NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
512287 | 2ldk | 17670 | cing | 1-original | 5 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 THR 1 H1 THR 1 -12.942 1.515 -6.796 2 H2 THR 1 H2 THR 1 -13.063 3.132 -7.294 3 H3 THR 1 H3 THR 1 -11.564 2.504 -6.828 4 HA THR 1 HA THR 1 -13.158 1.612 -9.157 5 HB THR 1 HB THR 1 -11.190 2.605 -10.508 6 HG1 THR 1 HG1 THR 1 -10.671 4.595 -8.773 7 HG21 THR 1 HG21 THR 1 -12.160 4.853 -10.588 8 HG22 THR 1 HG22 THR 1 -13.030 4.557 -9.080 9 HG23 THR 1 HG23 THR 1 -13.436 3.634 -10.530 10 H VAL 2 H VAL 2 -9.617 1.673 -8.486 11 HA VAL 2 HA VAL 2 -8.034 0.373 -9.433 12 HB VAL 2 HB VAL 2 -9.806 -1.933 -8.515 13 HG11 VAL 2 HG11 VAL 2 -6.888 -1.987 -9.399 14 HG12 VAL 2 HG12 VAL 2 -8.247 -2.724 -10.252 15 HG13 VAL 2 HG13 VAL 2 -7.759 -3.341 -8.675 16 HG21 VAL 2 HG21 VAL 2 -9.071 -0.486 -6.657 17 HG22 VAL 2 HG22 VAL 2 -7.391 -0.629 -7.185 18 HG23 VAL 2 HG23 VAL 2 -8.251 -2.048 -6.579 19 H VAL 3 H VAL 3 -8.152 1.021 -11.510 20 HA VAL 3 HA VAL 3 -10.160 0.040 -13.366 21 HB VAL 3 HB VAL 3 -8.969 1.574 -15.032 22 HG11 VAL 3 HG11 VAL 3 -9.928 2.853 -12.436 23 HG12 VAL 3 HG12 VAL 3 -10.956 2.336 -13.775 24 HG13 VAL 3 HG13 VAL 3 -9.816 3.663 -14.002 25 HG21 VAL 3 HG21 VAL 3 -6.717 1.593 -13.987 26 HG22 VAL 3 HG22 VAL 3 -7.382 2.407 -12.567 27 HG23 VAL 3 HG23 VAL 3 -7.358 3.237 -14.125 28 H SER 4 H SER 4 -6.888 -0.801 -12.536 29 HA SER 4 HA SER 4 -6.920 -3.057 -14.374 30 HB2 SER 4 HB2 SER 4 -5.908 -1.344 -15.834 31 HB3 SER 4 HB3 SER 4 -4.719 -0.952 -14.592 32 HG SER 4 HG SER 4 -3.560 -2.595 -15.215 33 H VAL 5 H VAL 5 -5.487 -4.729 -13.765 34 HA VAL 5 HA VAL 5 -3.633 -4.290 -11.490 35 HB VAL 5 HB VAL 5 -5.410 -6.770 -11.830 36 HG11 VAL 5 HG11 VAL 5 -3.311 -6.176 -9.698 37 HG12 VAL 5 HG12 VAL 5 -3.178 -7.393 -10.970 38 HG13 VAL 5 HG13 VAL 5 -4.394 -7.571 -9.706 39 HG21 VAL 5 HG21 VAL 5 -5.451 -4.651 -9.647 40 HG22 VAL 5 HG22 VAL 5 -6.435 -6.118 -9.669 41 HG23 VAL 5 HG23 VAL 5 -6.678 -4.873 -10.898 42 H ASP 6 H ASP 6 -1.623 -4.807 -12.094 43 HA ASP 6 HA ASP 6 -1.100 -6.763 -14.266 44 HB2 ASP 6 HB2 ASP 6 0.504 -4.261 -13.528 45 HB3 ASP 6 HB3 ASP 6 0.918 -5.405 -14.808 46 H LYS 7 H LYS 7 0.360 -8.381 -13.821 47 HA LYS 7 HA LYS 7 2.069 -8.217 -11.402 48 HB2 LYS 7 HB2 LYS 7 0.049 -9.578 -10.893 49 HB3 LYS 7 HB3 LYS 7 0.415 -10.636 -12.253 50 HG2 LYS 7 HG2 LYS 7 2.514 -11.341 -11.139 51 HG3 LYS 7 HG3 LYS 7 2.147 -10.270 -9.777 52 HD2 LYS 7 HD2 LYS 7 0.084 -11.566 -9.319 53 HD3 LYS 7 HD3 LYS 7 0.446 -12.626 -10.685 54 HE2 LYS 7 HE2 LYS 7 2.522 -13.360 -9.541 55 HE3 LYS 7 HE3 LYS 7 2.117 -12.327 -8.165 56 HZ1 LYS 7 HZ1 LYS 7 1.444 -14.596 -7.769 57 HZ2 LYS 7 HZ2 LYS 7 0.499 -14.602 -9.171 58 HZ3 LYS 7 HZ3 LYS 7 0.084 -13.602 -7.871 59 H ASP 8 H ASP 8 4.154 -8.533 -11.946 60 HA ASP 8 HA ASP 8 4.835 -10.353 -14.189 61 HB2 ASP 8 HB2 ASP 8 5.144 -7.845 -14.701 62 HB3 ASP 8 HB3 ASP 8 6.437 -7.850 -13.504 63 H VAL 9 H VAL 9 5.599 -12.114 -13.209 64 HA VAL 9 HA VAL 9 6.805 -12.128 -10.593 65 HB VAL 9 HB VAL 9 6.428 -14.406 -12.595 66 HG11 VAL 9 HG11 VAL 9 8.151 -14.997 -10.924 67 HG12 VAL 9 HG12 VAL 9 6.682 -15.936 -10.654 68 HG13 VAL 9 HG13 VAL 9 7.050 -14.559 -9.613 69 HG21 VAL 9 HG21 VAL 9 4.285 -13.361 -11.941 70 HG22 VAL 9 HG22 VAL 9 4.686 -13.571 -10.235 71 HG23 VAL 9 HG23 VAL 9 4.420 -14.984 -11.258 72 H GLU 10 H GLU 10 8.027 -12.133 -13.860 73 HA GLU 10 HA GLU 10 10.647 -13.184 -13.412 74 HB2 GLU 10 HB2 GLU 10 9.660 -11.284 -15.578 75 HB3 GLU 10 HB3 GLU 10 11.176 -12.187 -15.625 76 HG2 GLU 10 HG2 GLU 10 9.985 -14.285 -15.737 77 HG3 GLU 10 HG3 GLU 10 8.436 -13.481 -15.510 78 H ALA 11 H ALA 11 9.334 -9.900 -13.414 79 HA ALA 11 HA ALA 11 11.876 -8.703 -12.537 80 HB1 ALA 11 HB1 ALA 11 9.219 -7.393 -13.217 81 HB2 ALA 11 HB2 ALA 11 10.585 -7.583 -14.318 82 HB3 ALA 11 HB3 ALA 11 10.741 -6.550 -12.893 83 H LEU 12 H LEU 12 9.510 -10.322 -11.001 84 HA LEU 12 HA LEU 12 8.761 -10.573 -8.894 85 HB2 LEU 12 HB2 LEU 12 11.185 -8.872 -8.201 86 HB3 LEU 12 HB3 LEU 12 10.263 -9.817 -7.040 87 HG LEU 12 HG LEU 12 11.851 -10.961 -9.378 88 HD11 LEU 12 HD11 LEU 12 13.345 -11.892 -7.664 89 HD12 LEU 12 HD12 LEU 12 12.441 -11.048 -6.401 90 HD13 LEU 12 HD13 LEU 12 13.331 -10.127 -7.620 91 HD21 LEU 12 HD21 LEU 12 10.307 -12.390 -7.194 92 HD22 LEU 12 HD22 LEU 12 11.342 -13.161 -8.400 93 HD23 LEU 12 HD23 LEU 12 9.880 -12.320 -8.905 94 H SER 13 H SER 13 7.640 -8.313 -10.378 95 HA SER 13 HA SER 13 6.998 -6.399 -8.202 96 HB2 SER 13 HB2 SER 13 6.483 -4.774 -10.061 97 HB3 SER 13 HB3 SER 13 8.173 -5.253 -9.973 98 HG SER 13 HG SER 13 7.934 -6.482 -11.775 99 H PHE 14 H PHE 14 4.885 -5.742 -7.918 100 HA PHE 14 HA PHE 14 2.737 -6.930 -9.555 101 HB2 PHE 14 HB2 PHE 14 2.885 -8.344 -7.558 102 HB3 PHE 14 HB3 PHE 14 2.887 -6.933 -6.501 103 HD1 PHE 14 HD1 PHE 14 0.770 -8.511 -9.180 104 HD2 PHE 14 HD2 PHE 14 0.843 -6.307 -5.515 105 HE1 PHE 14 HE1 PHE 14 -1.681 -8.583 -9.085 106 HE2 PHE 14 HE2 PHE 14 -1.607 -6.385 -5.433 107 HZ PHE 14 HZ PHE 14 -2.870 -7.517 -7.213 108 H SER 15 H SER 15 1.887 -5.181 -10.483 109 HA SER 15 HA SER 15 1.736 -2.583 -9.082 110 HB2 SER 15 HB2 SER 15 2.930 -2.565 -11.222 111 HB3 SER 15 HB3 SER 15 1.548 -3.292 -12.035 112 HG SER 15 HG SER 15 0.770 -1.361 -12.263 113 H ILE 16 H ILE 16 -0.228 -1.691 -8.546 114 HA ILE 16 HA ILE 16 -2.690 -2.692 -9.890 115 HB ILE 16 HB ILE 16 -2.468 -1.651 -7.022 116 HG12 ILE 16 HG12 ILE 16 -3.186 -4.435 -8.057 117 HG13 ILE 16 HG13 ILE 16 -1.647 -3.994 -7.324 118 HG21 ILE 16 HG21 ILE 16 -4.946 -2.564 -8.555 119 HG22 ILE 16 HG22 ILE 16 -4.587 -0.909 -8.056 120 HG23 ILE 16 HG23 ILE 16 -4.902 -2.145 -6.840 121 HD11 ILE 16 HD11 ILE 16 -2.782 -3.534 -5.216 122 HD12 ILE 16 HD12 ILE 16 -3.067 -5.182 -5.770 123 HD13 ILE 16 HD13 ILE 16 -4.331 -3.966 -5.948 124 H VAL 17 H VAL 17 -3.615 -1.216 -11.121 125 HA VAL 17 HA VAL 17 -2.982 1.652 -10.823 126 HB VAL 17 HB VAL 17 -4.313 0.277 -13.209 127 HG11 VAL 17 HG11 VAL 17 -2.913 2.977 -12.985 128 HG12 VAL 17 HG12 VAL 17 -4.657 2.727 -13.095 129 HG13 VAL 17 HG13 VAL 17 -3.619 2.301 -14.458 130 HG21 VAL 17 HG21 VAL 17 -2.099 -0.747 -12.875 131 HG22 VAL 17 HG22 VAL 17 -1.348 0.851 -12.831 132 HG23 VAL 17 HG23 VAL 17 -2.098 0.271 -14.319 133 H ALA 18 H ALA 18 -4.576 3.026 -10.192 134 HA ALA 18 HA ALA 18 -7.426 2.314 -10.321 135 HB1 ALA 18 HB1 ALA 18 -6.009 3.204 -7.771 136 HB2 ALA 18 HB2 ALA 18 -6.660 1.593 -8.084 137 HB3 ALA 18 HB3 ALA 18 -7.753 2.972 -7.957 138 H GLU 19 H GLU 19 -8.799 4.266 -10.156 139 HA GLU 19 HA GLU 19 -7.339 6.787 -10.712 140 HB2 GLU 19 HB2 GLU 19 -7.928 5.423 -12.813 141 HB3 GLU 19 HB3 GLU 19 -9.619 5.761 -12.456 142 HG2 GLU 19 HG2 GLU 19 -9.164 8.176 -12.650 143 HG3 GLU 19 HG3 GLU 19 -7.469 7.819 -12.992 144 H PHE 20 H PHE 20 -8.286 8.541 -9.732 145 HA PHE 20 HA PHE 20 -10.933 8.184 -8.434 146 HB2 PHE 20 HB2 PHE 20 -8.420 9.298 -7.094 147 HB3 PHE 20 HB3 PHE 20 -10.011 9.156 -6.345 148 HD1 PHE 20 HD1 PHE 20 -11.036 6.734 -6.231 149 HD2 PHE 20 HD2 PHE 20 -6.871 7.521 -6.842 150 HE1 PHE 20 HE1 PHE 20 -10.491 4.453 -5.494 151 HE2 PHE 20 HE2 PHE 20 -6.340 5.241 -6.103 152 HZ PHE 20 HZ PHE 20 -8.145 3.704 -5.430 153 H ASP 21 H ASP 21 -12.201 10.004 -8.223 154 HA ASP 21 HA ASP 21 -11.570 12.331 -9.840 155 HB2 ASP 21 HB2 ASP 21 -13.836 11.194 -9.789 156 HB3 ASP 21 HB3 ASP 21 -14.051 11.785 -8.147 157 H ALA 22 H ALA 22 -9.833 13.229 -8.688 158 HA ALA 22 HA ALA 22 -10.322 15.155 -6.650 159 HB1 ALA 22 HB1 ALA 22 -8.895 12.615 -5.757 160 HB2 ALA 22 HB2 ALA 22 -10.472 13.168 -5.196 161 HB3 ALA 22 HB3 ALA 22 -9.026 14.099 -4.809 162 H ASP 23 H ASP 23 -8.242 16.315 -6.039 163 HA ASP 23 HA ASP 23 -6.356 16.285 -8.264 164 HB2 ASP 23 HB2 ASP 23 -5.204 18.155 -7.067 165 HB3 ASP 23 HB3 ASP 23 -6.900 18.473 -7.371 166 H VAL 24 H VAL 24 -3.950 16.465 -7.644 167 HA VAL 24 HA VAL 24 -3.150 13.866 -6.941 168 HB VAL 24 HB VAL 24 -1.449 16.373 -7.245 169 HG11 VAL 24 HG11 VAL 24 -0.169 14.569 -6.134 170 HG12 VAL 24 HG12 VAL 24 0.432 14.853 -7.767 171 HG13 VAL 24 HG13 VAL 24 -0.597 13.458 -7.438 172 HG21 VAL 24 HG21 VAL 24 -2.198 14.263 -9.302 173 HG22 VAL 24 HG22 VAL 24 -1.110 15.631 -9.571 174 HG23 VAL 24 HG23 VAL 24 -2.818 15.918 -9.233 175 H LYS 25 H LYS 25 -2.994 16.907 -5.087 176 HA LYS 25 HA LYS 25 -1.686 15.795 -2.796 177 HB2 LYS 25 HB2 LYS 25 -3.172 18.376 -3.305 178 HB3 LYS 25 HB3 LYS 25 -2.698 17.958 -1.665 179 HG2 LYS 25 HG2 LYS 25 -0.465 17.721 -3.585 180 HG3 LYS 25 HG3 LYS 25 -1.144 19.342 -3.520 181 HD2 LYS 25 HD2 LYS 25 0.755 19.067 -1.951 182 HD3 LYS 25 HD3 LYS 25 -0.741 19.467 -1.109 183 HE2 LYS 25 HE2 LYS 25 -1.008 17.083 -0.472 184 HE3 LYS 25 HE3 LYS 25 0.495 16.692 -1.312 185 HZ1 LYS 25 HZ1 LYS 25 0.311 18.622 0.932 186 HZ2 LYS 25 HZ2 LYS 25 1.712 18.003 0.222 187 HZ3 LYS 25 HZ3 LYS 25 0.709 16.989 1.122 188 H ARG 26 H ARG 26 -5.046 15.960 -3.769 189 HA ARG 26 HA ARG 26 -6.236 15.476 -1.195 190 HB2 ARG 26 HB2 ARG 26 -7.295 16.508 -3.334 191 HB3 ARG 26 HB3 ARG 26 -7.516 14.859 -3.889 192 HG2 ARG 26 HG2 ARG 26 -8.680 15.912 -1.289 193 HG3 ARG 26 HG3 ARG 26 -9.532 15.998 -2.828 194 HD2 ARG 26 HD2 ARG 26 -9.428 13.515 -2.975 195 HD3 ARG 26 HD3 ARG 26 -8.650 13.471 -1.395 196 HE ARG 26 HE ARG 26 -11.426 14.369 -1.916 197 HH11 ARG 26 HH11 ARG 26 -9.057 13.129 0.276 198 HH12 ARG 26 HH12 ARG 26 -10.221 12.769 1.493 199 HH21 ARG 26 HH21 ARG 26 -12.898 13.882 -0.347 200 HH22 ARG 26 HH22 ARG 26 -12.370 13.200 1.150 201 H VAL 27 H VAL 27 -5.311 13.407 -3.953 202 HA VAL 27 HA VAL 27 -6.051 10.918 -2.677 203 HB VAL 27 HB VAL 27 -4.138 11.227 -5.040 204 HG11 VAL 27 HG11 VAL 27 -4.167 8.966 -4.026 205 HG12 VAL 27 HG12 VAL 27 -4.890 8.934 -5.634 206 HG13 VAL 27 HG13 VAL 27 -5.924 8.894 -4.204 207 HG21 VAL 27 HG21 VAL 27 -7.179 11.035 -5.136 208 HG22 VAL 27 HG22 VAL 27 -6.105 10.970 -6.535 209 HG23 VAL 27 HG23 VAL 27 -6.212 12.447 -5.575 210 H TRP 28 H TRP 28 -3.079 12.852 -2.937 211 HA TRP 28 HA TRP 28 -1.250 11.083 -1.677 212 HB2 TRP 28 HB2 TRP 28 -0.575 13.112 -2.947 213 HB3 TRP 28 HB3 TRP 28 -1.281 14.134 -1.707 214 HD1 TRP 28 HD1 TRP 28 0.219 14.650 0.427 215 HE1 TRP 28 HE1 TRP 28 2.653 14.148 1.031 216 HE3 TRP 28 HE3 TRP 28 1.284 11.233 -3.231 217 HZ2 TRP 28 HZ2 TRP 28 4.761 12.546 0.086 218 HZ3 TRP 28 HZ3 TRP 28 3.548 10.276 -3.319 219 HH2 TRP 28 HH2 TRP 28 5.252 10.923 -1.693 220 H ALA 29 H ALA 29 -3.736 13.175 -0.374 221 HA ALA 29 HA ALA 29 -2.867 13.585 2.248 222 HB1 ALA 29 HB1 ALA 29 -4.736 14.794 1.216 223 HB2 ALA 29 HB2 ALA 29 -5.210 14.093 2.764 224 HB3 ALA 29 HB3 ALA 29 -5.720 13.329 1.254 225 H ILE 30 H ILE 30 -4.431 10.719 0.864 226 HA ILE 30 HA ILE 30 -5.056 9.420 3.344 227 HB ILE 30 HB ILE 30 -5.450 7.396 2.097 228 HG12 ILE 30 HG12 ILE 30 -3.910 8.683 -0.201 229 HG13 ILE 30 HG13 ILE 30 -3.413 7.283 0.730 230 HG21 ILE 30 HG21 ILE 30 -7.128 9.177 1.827 231 HG22 ILE 30 HG22 ILE 30 -7.038 8.163 0.387 232 HG23 ILE 30 HG23 ILE 30 -6.287 9.761 0.385 233 HD11 ILE 30 HD11 ILE 30 -5.329 6.036 -0.225 234 HD12 ILE 30 HD12 ILE 30 -4.156 6.593 -1.418 235 HD13 ILE 30 HD13 ILE 30 -5.689 7.443 -1.231 236 H TRP 31 H TRP 31 -2.125 9.683 1.432 237 HA TRP 31 HA TRP 31 -0.668 7.614 2.881 238 HB2 TRP 31 HB2 TRP 31 0.266 9.654 0.808 239 HB3 TRP 31 HB3 TRP 31 1.243 8.324 1.435 240 HD1 TRP 31 HD1 TRP 31 -1.160 9.097 -1.336 241 HE1 TRP 31 HE1 TRP 31 -1.776 6.936 -2.593 242 HE3 TRP 31 HE3 TRP 31 0.737 5.657 1.955 243 HZ2 TRP 31 HZ2 TRP 31 -1.492 4.152 -2.242 244 HZ3 TRP 31 HZ3 TRP 31 0.529 3.266 1.417 245 HH2 TRP 31 HH2 TRP 31 -0.569 2.527 -0.635 246 H GLU 32 H GLU 32 -0.865 11.130 2.808 247 HA GLU 32 HA GLU 32 1.460 11.626 4.418 248 HB2 GLU 32 HB2 GLU 32 0.576 13.189 2.650 249 HB3 GLU 32 HB3 GLU 32 -0.802 13.545 3.691 250 HG2 GLU 32 HG2 GLU 32 0.740 14.451 5.405 251 HG3 GLU 32 HG3 GLU 32 2.110 14.090 4.358 252 H ASP 33 H ASP 33 -2.058 11.715 5.011 253 HA ASP 33 HA ASP 33 -1.714 12.246 7.859 254 HB2 ASP 33 HB2 ASP 33 -4.201 11.820 6.160 255 HB3 ASP 33 HB3 ASP 33 -4.232 12.178 7.885 256 HA PRO 34 HA PRO 34 -1.349 7.759 8.810 257 HB2 PRO 34 HB2 PRO 34 -1.780 8.234 11.586 258 HB3 PRO 34 HB3 PRO 34 -0.224 8.139 10.765 259 HG2 PRO 34 HG2 PRO 34 -1.844 10.560 11.483 260 HG3 PRO 34 HG3 PRO 34 -0.082 10.334 11.542 261 HD2 PRO 34 HD2 PRO 34 -1.191 11.749 9.571 262 HD3 PRO 34 HD3 PRO 34 0.156 10.641 9.217 263 H ARG 35 H ARG 35 -3.874 9.811 10.313 264 HA ARG 35 HA ARG 35 -5.686 7.772 10.990 265 HB2 ARG 35 HB2 ARG 35 -5.663 10.202 11.809 266 HB3 ARG 35 HB3 ARG 35 -6.458 10.632 10.299 267 HG2 ARG 35 HG2 ARG 35 -8.137 10.428 12.033 268 HG3 ARG 35 HG3 ARG 35 -8.347 9.094 10.894 269 HD2 ARG 35 HD2 ARG 35 -8.574 8.281 13.200 270 HD3 ARG 35 HD3 ARG 35 -7.128 7.584 12.458 271 HE ARG 35 HE ARG 35 -6.876 9.990 14.138 272 HH11 ARG 35 HH11 ARG 35 -6.158 6.625 13.762 273 HH12 ARG 35 HH12 ARG 35 -5.028 6.632 15.062 274 HH21 ARG 35 HH21 ARG 35 -5.438 9.951 15.792 275 HH22 ARG 35 HH22 ARG 35 -4.618 8.482 16.178 276 H GLN 36 H GLN 36 -5.464 9.758 8.015 277 HA GLN 36 HA GLN 36 -7.734 8.555 6.698 278 HB2 GLN 36 HB2 GLN 36 -5.463 10.250 5.583 279 HB3 GLN 36 HB3 GLN 36 -6.873 9.741 4.653 280 HG2 GLN 36 HG2 GLN 36 -8.326 10.976 6.264 281 HG3 GLN 36 HG3 GLN 36 -6.874 11.554 7.084 282 HE21 GLN 36 HE21 GLN 36 -7.391 13.707 6.632 283 HE22 GLN 36 HE22 GLN 36 -7.252 14.385 5.054 284 H LEU 37 H LEU 37 -4.389 7.657 7.011 285 HA LEU 37 HA LEU 37 -4.262 5.878 4.753 286 HB2 LEU 37 HB2 LEU 37 -2.260 6.864 5.737 287 HB3 LEU 37 HB3 LEU 37 -2.592 6.094 7.279 288 HG LEU 37 HG LEU 37 -2.106 3.882 6.329 289 HD11 LEU 37 HD11 LEU 37 -1.510 5.269 3.699 290 HD12 LEU 37 HD12 LEU 37 -2.886 4.208 4.022 291 HD13 LEU 37 HD13 LEU 37 -1.245 3.558 4.074 292 HD21 LEU 37 HD21 LEU 37 0.065 5.900 5.698 293 HD22 LEU 37 HD22 LEU 37 0.290 4.162 5.943 294 HD23 LEU 37 HD23 LEU 37 -0.267 5.172 7.275 295 H GLU 38 H GLU 38 -4.610 5.317 8.282 296 HA GLU 38 HA GLU 38 -5.072 2.503 8.102 297 HB2 GLU 38 HB2 GLU 38 -5.695 2.653 10.481 298 HB3 GLU 38 HB3 GLU 38 -4.211 3.538 10.150 299 HG2 GLU 38 HG2 GLU 38 -5.481 5.657 10.157 300 HG3 GLU 38 HG3 GLU 38 -6.964 4.770 10.519 301 H ARG 39 H ARG 39 -7.109 5.207 7.594 302 HA ARG 39 HA ARG 39 -9.706 4.328 7.988 303 HB2 ARG 39 HB2 ARG 39 -9.085 6.612 7.368 304 HB3 ARG 39 HB3 ARG 39 -8.464 6.068 5.824 305 HG2 ARG 39 HG2 ARG 39 -10.521 7.197 5.430 306 HG3 ARG 39 HG3 ARG 39 -10.800 5.481 5.143 307 HD2 ARG 39 HD2 ARG 39 -11.485 6.823 7.771 308 HD3 ARG 39 HD3 ARG 39 -12.608 6.766 6.412 309 HE ARG 39 HE ARG 39 -11.961 4.174 6.710 310 HH11 ARG 39 HH11 ARG 39 -13.037 6.500 9.021 311 HH12 ARG 39 HH12 ARG 39 -13.840 5.314 9.985 312 HH21 ARG 39 HH21 ARG 39 -12.965 2.682 7.966 313 HH22 ARG 39 HH22 ARG 39 -13.791 3.173 9.400 314 H TRP 40 H TRP 40 -7.414 3.383 5.466 315 HA TRP 40 HA TRP 40 -9.404 1.514 4.303 316 HB2 TRP 40 HB2 TRP 40 -8.619 2.060 2.029 317 HB3 TRP 40 HB3 TRP 40 -9.252 3.496 2.830 318 HD1 TRP 40 HD1 TRP 40 -7.476 5.437 3.467 319 HE1 TRP 40 HE1 TRP 40 -5.089 5.916 2.641 320 HE3 TRP 40 HE3 TRP 40 -6.444 0.944 1.248 321 HZ2 TRP 40 HZ2 TRP 40 -3.058 4.594 1.200 322 HZ3 TRP 40 HZ3 TRP 40 -4.266 0.632 0.155 323 HH2 TRP 40 HH2 TRP 40 -2.612 2.421 0.138 324 H TRP 41 H TRP 41 -6.296 1.875 5.626 325 HA TRP 41 HA TRP 41 -4.700 0.268 3.919 326 HB2 TRP 41 HB2 TRP 41 -3.863 1.919 5.668 327 HB3 TRP 41 HB3 TRP 41 -4.214 0.712 6.901 328 HD1 TRP 41 HD1 TRP 41 -2.117 -0.706 7.522 329 HE1 TRP 41 HE1 TRP 41 0.090 -1.332 6.372 330 HE3 TRP 41 HE3 TRP 41 -2.927 1.436 2.959 331 HZ2 TRP 41 HZ2 TRP 41 1.314 -0.974 3.881 332 HZ3 TRP 41 HZ3 TRP 41 -1.198 1.228 1.242 333 HH2 TRP 41 HH2 TRP 41 0.893 0.042 1.685 334 H GLY 42 H GLY 42 -4.804 -1.859 3.571 335 HA2 GLY 42 HA2 GLY 42 -5.125 -4.150 3.984 336 HA3 GLY 42 HA3 GLY 42 -5.764 -3.783 5.579 337 HA PRO 43 HA PRO 43 -9.195 -4.598 2.262 338 HB2 PRO 43 HB2 PRO 43 -10.175 -6.973 3.240 339 HB3 PRO 43 HB3 PRO 43 -8.845 -6.898 2.073 340 HG2 PRO 43 HG2 PRO 43 -8.710 -7.175 5.083 341 HG3 PRO 43 HG3 PRO 43 -7.867 -8.125 3.838 342 HD2 PRO 43 HD2 PRO 43 -6.615 -6.115 5.120 343 HD3 PRO 43 HD3 PRO 43 -6.319 -6.406 3.390 344 HA PRO 44 HA PRO 44 -12.596 -2.885 4.754 345 HB2 PRO 44 HB2 PRO 44 -14.250 -5.223 3.747 346 HB3 PRO 44 HB3 PRO 44 -14.675 -3.505 3.831 347 HG2 PRO 44 HG2 PRO 44 -13.944 -4.558 1.503 348 HG3 PRO 44 HG3 PRO 44 -13.341 -2.952 1.968 349 HD2 PRO 44 HD2 PRO 44 -11.899 -5.596 1.971 350 HD3 PRO 44 HD3 PRO 44 -11.279 -3.974 1.590 351 H THR 45 H THR 45 -12.300 -6.442 4.929 352 HA THR 45 HA THR 45 -13.545 -6.736 7.509 353 HB THR 45 HB THR 45 -12.710 -9.112 7.392 354 HG1 THR 45 HG1 THR 45 -11.323 -9.717 5.858 355 HG21 THR 45 HG21 THR 45 -14.042 -8.147 4.829 356 HG22 THR 45 HG22 THR 45 -14.877 -8.546 6.333 357 HG23 THR 45 HG23 THR 45 -14.035 -9.807 5.431 358 H TRP 46 H TRP 46 -10.226 -6.127 6.494 359 HA TRP 46 HA TRP 46 -9.320 -6.279 9.330 360 HB2 TRP 46 HB2 TRP 46 -7.747 -7.010 6.823 361 HB3 TRP 46 HB3 TRP 46 -6.992 -6.765 8.392 362 HD1 TRP 46 HD1 TRP 46 -9.666 -9.132 6.796 363 HE1 TRP 46 HE1 TRP 46 -9.499 -11.405 7.981 364 HE3 TRP 46 HE3 TRP 46 -6.078 -7.992 10.249 365 HZ2 TRP 46 HZ2 TRP 46 -8.041 -12.572 10.085 366 HZ3 TRP 46 HZ3 TRP 46 -5.339 -9.745 11.806 367 HH2 TRP 46 HH2 TRP 46 -6.296 -11.994 11.726 368 HA PRO 47 HA PRO 47 -8.520 -1.866 7.920 369 HB2 PRO 47 HB2 PRO 47 -9.740 -0.600 10.003 370 HB3 PRO 47 HB3 PRO 47 -10.643 -1.155 8.585 371 HG2 PRO 47 HG2 PRO 47 -10.329 -2.503 11.274 372 HG3 PRO 47 HG3 PRO 47 -11.812 -2.249 10.327 373 HD2 PRO 47 HD2 PRO 47 -10.470 -4.619 10.306 374 HD3 PRO 47 HD3 PRO 47 -11.349 -4.021 8.882 375 H ALA 48 H ALA 48 -6.567 -0.996 8.484 376 HA ALA 48 HA ALA 48 -5.078 -2.038 10.736 377 HB1 ALA 48 HB1 ALA 48 -3.993 -1.660 8.565 378 HB2 ALA 48 HB2 ALA 48 -3.203 -0.737 9.846 379 HB3 ALA 48 HB3 ALA 48 -4.287 0.075 8.711 380 H THR 49 H THR 49 -3.778 -0.524 12.114 381 HA THR 49 HA THR 49 -4.904 2.122 12.686 382 HB THR 49 HB THR 49 -4.672 -0.052 14.826 383 HG1 THR 49 HG1 THR 49 -6.767 0.970 13.354 384 HG21 THR 49 HG21 THR 49 -3.927 2.113 15.749 385 HG22 THR 49 HG22 THR 49 -5.489 1.649 16.426 386 HG23 THR 49 HG23 THR 49 -5.407 2.882 15.163 387 H PHE 50 H PHE 50 -3.174 3.440 12.614 388 HA PHE 50 HA PHE 50 -0.462 2.394 12.962 389 HB2 PHE 50 HB2 PHE 50 -1.579 4.957 11.771 390 HB3 PHE 50 HB3 PHE 50 0.138 4.811 12.146 391 HD1 PHE 50 HD1 PHE 50 -2.602 3.106 10.228 392 HD2 PHE 50 HD2 PHE 50 1.603 3.811 10.585 393 HE1 PHE 50 HE1 PHE 50 -2.220 1.927 8.108 394 HE2 PHE 50 HE2 PHE 50 1.976 2.629 8.463 395 HZ PHE 50 HZ PHE 50 0.068 1.683 7.223 396 H GLU 51 H GLU 51 0.308 2.343 14.950 397 HA GLU 51 HA GLU 51 -0.307 4.112 17.097 398 HB2 GLU 51 HB2 GLU 51 2.056 2.228 16.712 399 HB3 GLU 51 HB3 GLU 51 1.616 3.002 18.234 400 HG2 GLU 51 HG2 GLU 51 -0.039 0.972 16.702 401 HG3 GLU 51 HG3 GLU 51 0.860 0.680 18.190 402 H THR 52 H THR 52 2.359 3.948 14.753 403 HA THR 52 HA THR 52 2.856 6.820 15.159 404 HB THR 52 HB THR 52 4.702 5.661 16.402 405 HG1 THR 52 HG1 THR 52 6.422 6.786 15.135 406 HG21 THR 52 HG21 THR 52 6.496 4.504 15.183 407 HG22 THR 52 HG22 THR 52 5.571 4.615 13.686 408 HG23 THR 52 HG23 THR 52 4.973 3.626 15.021 409 H HIS 53 H HIS 53 3.604 7.894 13.318 410 HA HIS 53 HA HIS 53 4.155 6.525 10.820 411 HB2 HIS 53 HB2 HIS 53 1.671 6.536 10.877 412 HB3 HIS 53 HB3 HIS 53 1.672 8.274 11.129 413 HD2 HIS 53 HD2 HIS 53 2.102 5.685 8.248 414 HE1 HIS 53 HE1 HIS 53 1.895 9.583 6.629 415 HE2 HIS 53 HE2 HIS 53 1.658 7.122 6.138 416 H GLU 54 H GLU 54 6.097 7.553 10.803 417 HA GLU 54 HA GLU 54 6.541 10.270 11.552 418 HB2 GLU 54 HB2 GLU 54 8.366 8.323 10.083 419 HB3 GLU 54 HB3 GLU 54 8.881 9.852 10.794 420 HG2 GLU 54 HG2 GLU 54 7.736 7.490 12.327 421 HG3 GLU 54 HG3 GLU 54 9.440 7.914 12.228 422 H PHE 55 H PHE 55 6.272 8.647 8.429 423 HA PHE 55 HA PHE 55 6.259 9.281 6.273 424 HB2 PHE 55 HB2 PHE 55 4.095 10.316 7.246 425 HB3 PHE 55 HB3 PHE 55 4.919 11.866 7.142 426 HD1 PHE 55 HD1 PHE 55 4.004 8.888 5.066 427 HD2 PHE 55 HD2 PHE 55 4.778 13.094 5.077 428 HE1 PHE 55 HE1 PHE 55 3.344 9.016 2.709 429 HE2 PHE 55 HE2 PHE 55 4.101 13.208 2.716 430 HZ PHE 55 HZ PHE 55 3.386 11.170 1.538 431 H THR 56 H THR 56 8.660 9.482 6.760 432 HA THR 56 HA THR 56 9.693 11.857 5.442 433 HB THR 56 HB THR 56 9.868 12.681 7.703 434 HG1 THR 56 HG1 THR 56 11.957 13.205 7.641 435 HG21 THR 56 HG21 THR 56 11.272 10.097 8.453 436 HG22 THR 56 HG22 THR 56 9.645 10.569 8.949 437 HG23 THR 56 HG23 THR 56 11.040 11.489 9.514 438 H VAL 57 H VAL 57 12.045 11.596 4.902 439 HA VAL 57 HA VAL 57 12.457 9.039 3.656 440 HB VAL 57 HB VAL 57 14.392 11.386 3.912 441 HG11 VAL 57 HG11 VAL 57 14.396 9.051 1.951 442 HG12 VAL 57 HG12 VAL 57 15.557 9.320 3.253 443 HG13 VAL 57 HG13 VAL 57 15.490 10.436 1.889 444 HG21 VAL 57 HG21 VAL 57 12.376 10.781 1.709 445 HG22 VAL 57 HG22 VAL 57 13.575 12.077 1.668 446 HG23 VAL 57 HG23 VAL 57 12.285 12.109 2.871 447 H GLY 58 H GLY 58 13.168 7.283 4.748 448 HA2 GLY 58 HA2 GLY 58 14.584 5.947 6.042 449 HA3 GLY 58 HA3 GLY 58 15.382 7.378 6.669 450 H GLY 59 H GLY 59 12.113 7.893 6.947 451 HA2 GLY 59 HA2 GLY 59 11.992 7.225 9.789 452 HA3 GLY 59 HA3 GLY 59 10.790 8.112 8.860 453 H LYS 60 H LYS 60 9.927 6.194 10.632 454 HA LYS 60 HA LYS 60 9.001 3.988 8.882 455 HB2 LYS 60 HB2 LYS 60 10.046 3.728 11.733 456 HB3 LYS 60 HB3 LYS 60 9.114 2.467 10.922 457 HG2 LYS 60 HG2 LYS 60 10.871 2.435 9.113 458 HG3 LYS 60 HG3 LYS 60 11.831 3.540 10.101 459 HD2 LYS 60 HD2 LYS 60 12.007 1.864 11.873 460 HD3 LYS 60 HD3 LYS 60 10.914 0.780 11.005 461 HE2 LYS 60 HE2 LYS 60 12.570 0.590 9.172 462 HE3 LYS 60 HE3 LYS 60 13.657 1.671 10.045 463 HZ1 LYS 60 HZ1 LYS 60 13.889 0.069 11.768 464 HZ2 LYS 60 HZ2 LYS 60 14.176 -0.704 10.290 465 HZ3 LYS 60 HZ3 LYS 60 12.706 -0.928 11.090 466 H ALA 61 H ALA 61 7.199 2.715 9.984 467 HA ALA 61 HA ALA 61 5.349 4.316 11.597 468 HB1 ALA 61 HB1 ALA 61 4.539 3.203 8.879 469 HB2 ALA 61 HB2 ALA 61 4.756 4.908 9.270 470 HB3 ALA 61 HB3 ALA 61 3.465 3.988 10.040 471 H ALA 62 H ALA 62 4.098 3.046 12.930 472 HA ALA 62 HA ALA 62 4.416 0.084 12.746 473 HB1 ALA 62 HB1 ALA 62 4.058 1.797 15.244 474 HB2 ALA 62 HB2 ALA 62 5.541 0.983 14.741 475 HB3 ALA 62 HB3 ALA 62 4.131 0.029 15.213 476 H TYR 63 H TYR 63 2.552 -1.058 12.517 477 HA TYR 63 HA TYR 63 -0.028 0.086 13.331 478 HB2 TYR 63 HB2 TYR 63 -1.076 -0.318 11.129 479 HB3 TYR 63 HB3 TYR 63 0.224 0.855 11.008 480 HD1 TYR 63 HD1 TYR 63 2.394 0.219 9.889 481 HD2 TYR 63 HD2 TYR 63 -0.963 -2.436 9.897 482 HE1 TYR 63 HE1 TYR 63 3.402 -1.064 8.059 483 HE2 TYR 63 HE2 TYR 63 0.055 -3.722 8.066 484 HH TYR 63 HH TYR 63 3.297 -3.350 7.122 485 H TYR 64 H TYR 64 -1.833 -1.496 12.931 486 HA TYR 64 HA TYR 64 -1.164 -4.282 12.518 487 HB2 TYR 64 HB2 TYR 64 -2.387 -4.998 14.667 488 HB3 TYR 64 HB3 TYR 64 -0.773 -4.335 14.868 489 HD1 TYR 64 HD1 TYR 64 -4.404 -3.446 15.169 490 HD2 TYR 64 HD2 TYR 64 -0.405 -2.449 16.306 491 HE1 TYR 64 HE1 TYR 64 -5.275 -1.855 16.812 492 HE2 TYR 64 HE2 TYR 64 -1.284 -0.859 17.954 493 HH TYR 64 HH TYR 64 -3.369 0.470 18.311 494 H MET 65 H MET 65 -2.821 -5.360 11.560 495 HA MET 65 HA MET 65 -5.286 -3.927 10.919 496 HB2 MET 65 HB2 MET 65 -4.244 -6.646 10.019 497 HB3 MET 65 HB3 MET 65 -5.736 -5.910 9.446 498 HG2 MET 65 HG2 MET 65 -4.479 -4.070 8.440 499 HG3 MET 65 HG3 MET 65 -2.966 -4.739 9.059 500 HE1 MET 65 HE1 MET 65 -3.447 -7.911 8.581 501 HE2 MET 65 HE2 MET 65 -1.932 -7.083 8.213 502 HE3 MET 65 HE3 MET 65 -2.703 -8.096 6.993 503 H THR 66 H THR 66 -6.993 -4.074 12.212 504 HA THR 66 HA THR 66 -7.290 -6.157 14.222 505 HB THR 66 HB THR 66 -9.211 -3.859 13.592 506 HG1 THR 66 HG1 THR 66 -7.719 -2.624 14.442 507 HG21 THR 66 HG21 THR 66 -9.960 -4.157 15.930 508 HG22 THR 66 HG22 THR 66 -8.819 -5.488 16.141 509 HG23 THR 66 HG23 THR 66 -10.182 -5.661 15.029 510 H GLY 67 H GLY 67 -8.084 -8.068 13.575 511 HA2 GLY 67 HA2 GLY 67 -9.467 -8.556 11.156 512 HA3 GLY 67 HA3 GLY 67 -9.203 -9.708 12.449 513 HA PRO 68 HA PRO 68 -13.831 -8.385 12.044 514 HB2 PRO 68 HB2 PRO 68 -14.813 -10.776 11.031 515 HB3 PRO 68 HB3 PRO 68 -14.325 -9.410 10.019 516 HG2 PRO 68 HG2 PRO 68 -12.753 -11.887 10.746 517 HG3 PRO 68 HG3 PRO 68 -12.922 -11.101 9.161 518 HD2 PRO 68 HD2 PRO 68 -10.722 -10.737 10.681 519 HD3 PRO 68 HD3 PRO 68 -11.383 -9.412 9.696 520 H ASP 69 H ASP 69 -12.181 -11.315 13.109 521 HA ASP 69 HA ASP 69 -14.088 -11.915 15.240 522 HB2 ASP 69 HB2 ASP 69 -11.392 -13.191 14.607 523 HB3 ASP 69 HB3 ASP 69 -12.626 -13.839 15.688 524 H GLY 70 H GLY 70 -11.697 -9.660 14.927 525 HA2 GLY 70 HA2 GLY 70 -10.859 -8.236 16.609 526 HA3 GLY 70 HA3 GLY 70 -11.108 -9.494 17.808 527 H THR 71 H THR 71 -9.676 -11.126 15.378 528 HA THR 71 HA THR 71 -7.205 -11.575 16.601 529 HB THR 71 HB THR 71 -7.837 -11.942 13.634 530 HG1 THR 71 HG1 THR 71 -8.026 -13.979 15.592 531 HG21 THR 71 HG21 THR 71 -5.783 -13.350 15.395 532 HG22 THR 71 HG22 THR 71 -5.415 -12.184 14.120 533 HG23 THR 71 HG23 THR 71 -6.132 -13.742 13.708 534 H LYS 72 H LYS 72 -5.515 -10.233 16.868 535 HA LYS 72 HA LYS 72 -5.247 -7.856 15.160 536 HB2 LYS 72 HB2 LYS 72 -5.210 -8.081 17.877 537 HB3 LYS 72 HB3 LYS 72 -3.486 -8.224 17.570 538 HG2 LYS 72 HG2 LYS 72 -3.965 -5.922 18.011 539 HG3 LYS 72 HG3 LYS 72 -3.603 -6.067 16.291 540 HD2 LYS 72 HD2 LYS 72 -5.483 -4.636 16.349 541 HD3 LYS 72 HD3 LYS 72 -6.169 -6.200 15.933 542 HE2 LYS 72 HE2 LYS 72 -6.152 -4.992 18.724 543 HE3 LYS 72 HE3 LYS 72 -7.516 -4.940 17.613 544 HZ1 LYS 72 HZ1 LYS 72 -7.525 -7.397 17.675 545 HZ2 LYS 72 HZ2 LYS 72 -7.843 -6.683 19.171 546 HZ3 LYS 72 HZ3 LYS 72 -6.324 -7.350 18.864 547 H ALA 73 H ALA 73 -4.028 -8.199 13.385 548 HA ALA 73 HA ALA 73 -1.539 -9.814 13.535 549 HB1 ALA 73 HB1 ALA 73 -3.078 -8.873 11.087 550 HB2 ALA 73 HB2 ALA 73 -3.135 -10.492 11.787 551 HB3 ALA 73 HB3 ALA 73 -1.634 -9.894 11.076 552 H ARG 74 H ARG 74 0.204 -8.564 14.044 553 HA ARG 74 HA ARG 74 0.298 -5.727 13.653 554 HB2 ARG 74 HB2 ARG 74 2.589 -7.606 14.374 555 HB3 ARG 74 HB3 ARG 74 2.638 -5.849 14.463 556 HG2 ARG 74 HG2 ARG 74 0.779 -5.990 16.200 557 HG3 ARG 74 HG3 ARG 74 1.021 -7.743 16.205 558 HD2 ARG 74 HD2 ARG 74 3.402 -7.385 16.839 559 HD3 ARG 74 HD3 ARG 74 3.114 -5.642 16.886 560 HE ARG 74 HE ARG 74 1.369 -7.184 18.606 561 HH11 ARG 74 HH11 ARG 74 4.458 -5.615 18.436 562 HH12 ARG 74 HH12 ARG 74 4.577 -5.438 20.146 563 HH21 ARG 74 HH21 ARG 74 1.565 -6.966 20.780 564 HH22 ARG 74 HH22 ARG 74 2.948 -6.190 21.466 565 H GLY 75 H GLY 75 1.614 -4.497 12.281 566 HA2 GLY 75 HA2 GLY 75 3.472 -5.829 10.426 567 HA3 GLY 75 HA3 GLY 75 2.228 -4.775 9.757 568 H TRP 76 H TRP 76 5.119 -4.469 9.627 569 HA TRP 76 HA TRP 76 5.391 -1.811 10.919 570 HB2 TRP 76 HB2 TRP 76 7.843 -2.138 10.929 571 HB3 TRP 76 HB3 TRP 76 7.034 -3.393 11.857 572 HD1 TRP 76 HD1 TRP 76 7.174 -5.933 10.896 573 HE1 TRP 76 HE1 TRP 76 8.696 -7.008 9.137 574 HE3 TRP 76 HE3 TRP 76 9.113 -1.694 8.732 575 HZ2 TRP 76 HZ2 TRP 76 10.491 -6.209 7.127 576 HZ3 TRP 76 HZ3 TRP 76 10.737 -1.943 6.894 577 HH2 TRP 76 HH2 TRP 76 11.414 -4.161 6.107 578 H TRP 77 H TRP 77 6.466 -0.195 9.681 579 HA TRP 77 HA TRP 77 6.516 -0.559 6.734 580 HB2 TRP 77 HB2 TRP 77 4.462 0.722 8.194 581 HB3 TRP 77 HB3 TRP 77 5.460 2.064 7.672 582 HD1 TRP 77 HD1 TRP 77 4.718 -1.032 5.438 583 HE1 TRP 77 HE1 TRP 77 3.316 -0.234 3.434 584 HE3 TRP 77 HE3 TRP 77 3.978 3.814 6.854 585 HZ2 TRP 77 HZ2 TRP 77 2.044 2.150 2.583 586 HZ3 TRP 77 HZ3 TRP 77 2.662 5.286 5.395 587 HH2 TRP 77 HH2 TRP 77 1.714 4.473 3.302 588 H GLN 78 H GLN 78 8.043 0.787 5.627 589 HA GLN 78 HA GLN 78 9.561 2.784 7.183 590 HB2 GLN 78 HB2 GLN 78 10.899 0.722 7.377 591 HB3 GLN 78 HB3 GLN 78 10.906 0.527 5.624 592 HG2 GLN 78 HG2 GLN 78 12.190 2.631 5.391 593 HG3 GLN 78 HG3 GLN 78 12.159 2.850 7.141 594 HE21 GLN 78 HE21 GLN 78 14.415 2.873 7.246 595 HE22 GLN 78 HE22 GLN 78 15.375 1.460 7.026 596 H PHE 79 H PHE 79 9.602 4.619 6.072 597 HA PHE 79 HA PHE 79 8.986 4.793 3.240 598 HB2 PHE 79 HB2 PHE 79 9.797 7.020 5.153 599 HB3 PHE 79 HB3 PHE 79 9.033 7.216 3.579 600 HD1 PHE 79 HD2 PHE 79 6.621 6.691 3.279 601 HD2 PHE 79 HD1 PHE 79 8.504 6.396 7.114 602 HE1 PHE 79 HE2 PHE 79 4.424 6.660 4.372 603 HE2 PHE 79 HE1 PHE 79 6.300 6.359 8.194 604 HZ PHE 79 HZ PHE 79 4.264 6.493 6.824 605 H THR 80 H THR 80 10.459 4.928 1.619 606 HA THR 80 HA THR 80 13.335 5.329 2.238 607 HB THR 80 HB THR 80 13.714 4.212 -0.016 608 HG1 THR 80 HG1 THR 80 11.159 3.122 0.025 609 HG21 THR 80 HG21 THR 80 13.899 2.898 2.066 610 HG22 THR 80 HG22 THR 80 13.200 1.925 0.769 611 HG23 THR 80 HG23 THR 80 12.160 2.582 2.033 612 H THR 81 H THR 81 10.760 6.403 0.020 613 HA THR 81 HA THR 81 12.358 8.765 -0.743 614 HB THR 81 HB THR 81 11.130 6.872 -2.807 615 HG1 THR 81 HG1 THR 81 13.672 7.167 -1.794 616 HG21 THR 81 HG21 THR 81 10.820 9.175 -3.572 617 HG22 THR 81 HG22 THR 81 12.107 8.415 -4.511 618 HG23 THR 81 HG23 THR 81 12.512 9.549 -3.219 619 H ILE 82 H ILE 82 11.043 10.341 -0.004 620 HA ILE 82 HA ILE 82 8.198 10.388 -0.863 621 HB ILE 82 HB ILE 82 9.311 11.726 1.647 622 HG12 ILE 82 HG12 ILE 82 7.723 9.141 1.339 623 HG13 ILE 82 HG13 ILE 82 9.331 9.319 2.026 624 HG21 ILE 82 HG21 ILE 82 7.381 12.916 0.650 625 HG22 ILE 82 HG22 ILE 82 6.937 12.178 2.187 626 HG23 ILE 82 HG23 ILE 82 6.434 11.422 0.674 627 HD11 ILE 82 HD11 ILE 82 8.334 10.599 3.891 628 HD12 ILE 82 HD12 ILE 82 7.736 8.949 3.756 629 HD13 ILE 82 HD13 ILE 82 6.738 10.289 3.203 630 H GLU 83 H GLU 83 8.307 11.617 -2.634 631 HA GLU 83 HA GLU 83 9.972 14.031 -2.786 632 HB2 GLU 83 HB2 GLU 83 8.212 12.714 -4.903 633 HB3 GLU 83 HB3 GLU 83 9.372 14.012 -5.178 634 HG2 GLU 83 HG2 GLU 83 10.094 11.237 -4.189 635 HG3 GLU 83 HG3 GLU 83 10.184 11.743 -5.867 636 H ALA 84 H ALA 84 6.555 13.093 -3.201 637 HA ALA 84 HA ALA 84 4.571 14.122 -3.053 638 HB1 ALA 84 HB1 ALA 84 5.323 14.797 -0.796 639 HB2 ALA 84 HB2 ALA 84 4.231 15.988 -1.506 640 HB3 ALA 84 HB3 ALA 84 5.970 16.298 -1.464 641 HA PRO 85 HA PRO 85 2.724 15.221 -3.190 642 HB2 PRO 85 HB2 PRO 85 0.695 16.025 -4.714 643 HB3 PRO 85 HB3 PRO 85 1.644 17.216 -3.809 644 HG2 PRO 85 HG2 PRO 85 1.808 16.496 -6.737 645 HG3 PRO 85 HG3 PRO 85 1.841 18.104 -5.982 646 HD2 PRO 85 HD2 PRO 85 4.110 16.633 -6.762 647 HD3 PRO 85 HD3 PRO 85 4.116 17.994 -5.618 648 H ASP 86 H ASP 86 4.208 14.061 -5.908 649 HA ASP 86 HA ASP 86 2.050 12.187 -6.685 650 HB2 ASP 86 HB2 ASP 86 3.344 11.981 -8.865 651 HB3 ASP 86 HB3 ASP 86 2.600 13.539 -8.553 652 H HIS 87 H HIS 87 5.639 12.170 -6.305 653 HA HIS 87 HA HIS 87 5.682 9.259 -6.522 654 HB2 HIS 87 HB2 HIS 87 7.337 10.643 -7.745 655 HB3 HIS 87 HB3 HIS 87 7.971 11.244 -6.226 656 HD1 HIS 87 HD1 HIS 87 10.193 10.228 -7.546 657 HD2 HIS 87 HD2 HIS 87 7.581 7.475 -5.852 658 HE1 HIS 87 HE1 HIS 87 11.496 8.095 -7.351 659 HE2 HIS 87 HE2 HIS 87 9.921 6.478 -6.265 660 H LEU 88 H LEU 88 5.540 7.968 -4.864 661 HA LEU 88 HA LEU 88 6.843 8.540 -2.272 662 HB2 LEU 88 HB2 LEU 88 4.424 8.837 -1.977 663 HB3 LEU 88 HB3 LEU 88 4.102 7.287 -2.725 664 HG LEU 88 HG LEU 88 5.219 6.158 -0.786 665 HD11 LEU 88 HD11 LEU 88 6.726 7.941 -0.070 666 HD12 LEU 88 HD12 LEU 88 5.708 7.409 1.265 667 HD13 LEU 88 HD13 LEU 88 5.353 8.929 0.437 668 HD21 LEU 88 HD21 LEU 88 2.787 6.423 -0.825 669 HD22 LEU 88 HD22 LEU 88 2.928 7.988 -0.018 670 HD23 LEU 88 HD23 LEU 88 3.411 6.511 0.822 671 H GLU 89 H GLU 89 7.975 6.793 -1.439 672 HA GLU 89 HA GLU 89 7.494 4.080 -2.427 673 HB2 GLU 89 HB2 GLU 89 10.247 5.391 -2.414 674 HB3 GLU 89 HB3 GLU 89 10.010 3.645 -2.474 675 HG2 GLU 89 HG2 GLU 89 8.687 3.979 -4.590 676 HG3 GLU 89 HG3 GLU 89 9.165 5.676 -4.554 677 H PHE 90 H PHE 90 7.843 2.519 -0.973 678 HA PHE 90 HA PHE 90 9.104 2.893 1.590 679 HB2 PHE 90 HB2 PHE 90 7.002 2.398 2.917 680 HB3 PHE 90 HB3 PHE 90 7.003 3.983 2.152 681 HD1 PHE 90 HD2 PHE 90 5.642 0.509 1.830 682 HD2 PHE 90 HD1 PHE 90 5.277 4.599 0.625 683 HE1 PHE 90 HE2 PHE 90 3.491 0.021 0.749 684 HE2 PHE 90 HE1 PHE 90 3.136 4.087 -0.445 685 HZ PHE 90 HZ PHE 90 2.238 1.799 -0.390 686 H ASP 91 H ASP 91 8.550 0.853 2.983 687 HA ASP 91 HA ASP 91 8.407 -1.562 1.276 688 HB2 ASP 91 HB2 ASP 91 10.153 -1.034 3.715 689 HB3 ASP 91 HB3 ASP 91 9.940 -2.627 2.990 690 H ASP 92 H ASP 92 6.431 -2.393 1.628 691 HA ASP 92 HA ASP 92 5.014 -2.466 4.094 692 HB2 ASP 92 HB2 ASP 92 4.733 -4.432 1.780 693 HB3 ASP 92 HB3 ASP 92 3.527 -4.065 3.011 694 H GLY 93 H GLY 93 5.729 -3.515 5.849 695 HA2 GLY 93 HA2 GLY 93 6.944 -6.217 5.574 696 HA3 GLY 93 HA3 GLY 93 7.380 -5.062 6.824 697 H PHE 94 H PHE 94 6.023 -7.848 6.694 698 HA PHE 94 HA PHE 94 3.689 -7.348 8.416 699 HB2 PHE 94 HB2 PHE 94 4.919 -9.943 7.362 700 HB3 PHE 94 HB3 PHE 94 3.489 -9.870 8.390 701 HD1 PHE 94 HD1 PHE 94 4.800 -9.220 4.991 702 HD2 PHE 94 HD2 PHE 94 1.332 -9.113 7.501 703 HE1 PHE 94 HE1 PHE 94 3.368 -8.944 3.014 704 HE2 PHE 94 HE2 PHE 94 -0.089 -8.841 5.516 705 HZ PHE 94 HZ PHE 94 0.924 -8.758 3.271 706 H ALA 95 H ALA 95 3.638 -7.990 10.609 707 HA ALA 95 HA ALA 95 6.205 -8.742 11.895 708 HB1 ALA 95 HB1 ALA 95 5.883 -6.309 12.141 709 HB2 ALA 95 HB2 ALA 95 5.758 -7.126 13.699 710 HB3 ALA 95 HB3 ALA 95 4.299 -6.581 12.867 711 H ASP 96 H ASP 96 6.018 -10.142 13.645 712 HA ASP 96 HA ASP 96 3.527 -11.647 13.847 713 HB2 ASP 96 HB2 ASP 96 4.781 -13.321 14.950 714 HB3 ASP 96 HB3 ASP 96 5.937 -12.619 13.827 715 H GLU 97 H GLU 97 3.440 -12.440 16.562 716 HA GLU 97 HA GLU 97 1.935 -10.376 17.763 717 HB2 GLU 97 HB2 GLU 97 1.787 -11.796 19.734 718 HB3 GLU 97 HB3 GLU 97 1.612 -12.777 18.284 719 HG2 GLU 97 HG2 GLU 97 3.826 -13.694 18.526 720 HG3 GLU 97 HG3 GLU 97 4.241 -12.525 19.776 721 H HIS 98 H HIS 98 5.369 -10.939 17.858 722 HA HIS 98 HA HIS 98 5.787 -9.198 20.190 723 HB2 HIS 98 HB2 HIS 98 7.834 -10.716 18.509 724 HB3 HIS 98 HB3 HIS 98 8.165 -9.865 20.016 725 HD1 HIS 98 HD1 HIS 98 6.572 -10.891 22.110 726 HD2 HIS 98 HD2 HIS 98 7.439 -13.356 18.893 727 HE1 HIS 98 HE1 HIS 98 6.161 -13.224 22.927 728 HE2 HIS 98 HE2 HIS 98 6.585 -14.689 20.937 729 H GLY 99 H GLY 99 5.964 -9.063 16.700 730 HA2 GLY 99 HA2 GLY 99 5.877 -6.946 15.564 731 HA3 GLY 99 HA3 GLY 99 6.854 -6.229 16.832 732 H ALA 100 H ALA 100 7.966 -9.296 15.793 733 HA ALA 100 HA ALA 100 10.301 -8.199 14.445 734 HB1 ALA 100 HB1 ALA 100 9.518 -11.092 14.970 735 HB2 ALA 100 HB2 ALA 100 10.544 -10.089 15.998 736 HB3 ALA 100 HB3 ALA 100 11.090 -10.530 14.382 737 HA PRO 101 HA PRO 101 8.785 -8.503 10.202 738 HB2 PRO 101 HB2 PRO 101 11.185 -9.239 8.928 739 HB3 PRO 101 HB3 PRO 101 10.693 -7.586 9.319 740 HG2 PRO 101 HG2 PRO 101 12.509 -9.439 10.848 741 HG3 PRO 101 HG3 PRO 101 12.693 -7.699 10.534 742 HD2 PRO 101 HD2 PRO 101 11.839 -8.577 12.924 743 HD3 PRO 101 HD3 PRO 101 11.140 -7.108 12.204 744 H VAL 102 H VAL 102 7.435 -10.161 9.864 745 HA VAL 102 HA VAL 102 7.824 -12.901 10.213 746 HB VAL 102 HB VAL 102 5.880 -11.418 8.388 747 HG11 VAL 102 HG11 VAL 102 5.775 -14.349 9.193 748 HG12 VAL 102 HG12 VAL 102 6.071 -13.727 7.568 749 HG13 VAL 102 HG13 VAL 102 4.503 -13.473 8.335 750 HG21 VAL 102 HG21 VAL 102 4.237 -11.809 10.184 751 HG22 VAL 102 HG22 VAL 102 5.626 -10.909 10.791 752 HG23 VAL 102 HG23 VAL 102 5.467 -12.629 11.150 753 H ASP 103 H ASP 103 9.620 -13.755 9.365 754 HA ASP 103 HA ASP 103 10.676 -13.309 6.744 755 HB2 ASP 103 HB2 ASP 103 12.231 -15.230 7.357 756 HB3 ASP 103 HB3 ASP 103 12.235 -13.867 8.467 757 H GLU 104 H GLU 104 8.276 -15.447 7.942 758 HA GLU 104 HA GLU 104 8.006 -17.387 5.961 759 HB2 GLU 104 HB2 GLU 104 6.601 -17.358 7.963 760 HB3 GLU 104 HB3 GLU 104 5.940 -15.800 7.530 761 HG2 GLU 104 HG2 GLU 104 4.211 -17.285 7.083 762 HG3 GLU 104 HG3 GLU 104 4.896 -16.951 5.496 763 H LEU 105 H LEU 105 6.951 -13.993 5.975 764 HA LEU 105 HA LEU 105 5.895 -14.172 3.214 765 HB2 LEU 105 HB2 LEU 105 5.340 -12.153 5.418 766 HB3 LEU 105 HB3 LEU 105 4.623 -12.108 3.812 767 HG LEU 105 HG LEU 105 4.174 -14.245 5.936 768 HD11 LEU 105 HD11 LEU 105 2.955 -12.185 6.386 769 HD12 LEU 105 HD12 LEU 105 1.847 -13.477 5.928 770 HD13 LEU 105 HD13 LEU 105 2.257 -12.213 4.764 771 HD21 LEU 105 HD21 LEU 105 3.076 -14.145 3.108 772 HD22 LEU 105 HD22 LEU 105 2.575 -15.282 4.365 773 HD23 LEU 105 HD23 LEU 105 4.224 -15.324 3.751 774 H GLY 106 H GLY 106 8.467 -12.773 5.031 775 HA2 GLY 106 HA2 GLY 106 10.321 -11.598 4.366 776 HA3 GLY 106 HA3 GLY 106 9.759 -11.722 2.708 777 H VAL 107 H VAL 107 10.581 -9.562 2.409 778 HA VAL 107 HA VAL 107 8.806 -7.381 3.395 779 HB VAL 107 HB VAL 107 11.768 -7.127 2.655 780 HG11 VAL 107 HG11 VAL 107 11.603 -4.827 3.591 781 HG12 VAL 107 HG12 VAL 107 9.876 -5.065 3.863 782 HG13 VAL 107 HG13 VAL 107 10.512 -5.046 2.218 783 HG21 VAL 107 HG21 VAL 107 12.207 -6.781 5.070 784 HG22 VAL 107 HG22 VAL 107 11.532 -8.383 4.762 785 HG23 VAL 107 HG23 VAL 107 10.508 -7.106 5.425 786 H THR 108 H THR 108 8.042 -5.925 1.831 787 HA THR 108 HA THR 108 8.926 -6.249 -0.975 788 HB THR 108 HB THR 108 6.942 -7.555 -0.961 789 HG1 THR 108 HG1 THR 108 5.883 -5.112 -1.884 790 HG21 THR 108 HG21 THR 108 5.454 -5.280 0.395 791 HG22 THR 108 HG22 THR 108 5.922 -6.802 1.159 792 HG23 THR 108 HG23 THR 108 4.749 -6.802 -0.159 793 H HIS 109 H HIS 109 9.315 -4.398 -1.991 794 HA HIS 109 HA HIS 109 8.870 -1.837 -0.645 795 HB2 HIS 109 HB2 HIS 109 11.128 -2.646 -1.565 796 HB3 HIS 109 HB3 HIS 109 10.473 -2.409 -3.174 797 HD1 HIS 109 HD1 HIS 109 12.416 -0.773 -0.693 798 HD2 HIS 109 HD2 HIS 109 9.649 0.532 -3.506 799 HE1 HIS 109 HE1 HIS 109 12.969 1.627 -1.122 800 HE2 HIS 109 HE2 HIS 109 11.449 2.310 -2.996 801 H ALA 110 H ALA 110 6.936 -0.837 -1.162 802 HA ALA 110 HA ALA 110 5.803 -1.150 -3.875 803 HB1 ALA 110 HB1 ALA 110 4.485 0.031 -1.426 804 HB2 ALA 110 HB2 ALA 110 4.304 -1.626 -1.989 805 HB3 ALA 110 HB3 ALA 110 3.714 -0.291 -2.979 806 H THR 111 H THR 111 5.599 0.479 -5.290 807 HA THR 111 HA THR 111 6.642 3.175 -4.601 808 HB THR 111 HB THR 111 6.613 1.793 -7.335 809 HG1 THR 111 HG1 THR 111 9.058 2.422 -6.221 810 HG21 THR 111 HG21 THR 111 7.905 4.413 -6.479 811 HG22 THR 111 HG22 THR 111 6.497 4.261 -7.532 812 HG23 THR 111 HG23 THR 111 8.067 3.660 -8.065 813 H VAL 112 H VAL 112 4.931 4.489 -4.295 814 HA VAL 112 HA VAL 112 2.406 4.206 -5.782 815 HB VAL 112 HB VAL 112 3.143 6.025 -3.439 816 HG11 VAL 112 HG11 VAL 112 1.326 7.027 -4.778 817 HG12 VAL 112 HG12 VAL 112 0.703 6.460 -3.228 818 HG13 VAL 112 HG13 VAL 112 0.410 5.518 -4.692 819 HG21 VAL 112 HG21 VAL 112 3.148 3.637 -2.817 820 HG22 VAL 112 HG22 VAL 112 1.515 3.455 -3.464 821 HG23 VAL 112 HG23 VAL 112 1.796 4.484 -2.058 822 H LYS 113 H LYS 113 2.101 5.393 -7.581 823 HA LYS 113 HA LYS 113 3.481 8.003 -7.920 824 HB2 LYS 113 HB2 LYS 113 2.947 5.908 -10.071 825 HB3 LYS 113 HB3 LYS 113 3.743 7.464 -10.317 826 HG2 LYS 113 HG2 LYS 113 5.589 6.737 -8.807 827 HG3 LYS 113 HG3 LYS 113 4.798 5.171 -8.612 828 HD2 LYS 113 HD2 LYS 113 5.904 6.330 -11.196 829 HD3 LYS 113 HD3 LYS 113 6.622 5.031 -10.238 830 HE2 LYS 113 HE2 LYS 113 4.670 3.601 -10.715 831 HE3 LYS 113 HE3 LYS 113 3.931 4.903 -11.646 832 HZ1 LYS 113 HZ1 LYS 113 6.494 3.565 -12.283 833 HZ2 LYS 113 HZ2 LYS 113 5.779 4.807 -13.180 834 HZ3 LYS 113 HZ3 LYS 113 5.018 3.304 -13.062 835 H LEU 114 H LEU 114 2.065 9.600 -8.000 836 HA LEU 114 HA LEU 114 -0.721 9.194 -8.879 837 HB2 LEU 114 HB2 LEU 114 0.618 11.493 -7.403 838 HB3 LEU 114 HB3 LEU 114 -1.085 11.451 -7.840 839 HG LEU 114 HG LEU 114 0.261 9.462 -5.958 840 HD11 LEU 114 HD11 LEU 114 -0.971 10.585 -4.157 841 HD12 LEU 114 HD12 LEU 114 -1.546 11.805 -5.299 842 HD13 LEU 114 HD13 LEU 114 0.176 11.673 -4.937 843 HD21 LEU 114 HD21 LEU 114 -2.021 8.729 -5.438 844 HD22 LEU 114 HD22 LEU 114 -1.656 8.503 -7.144 845 HD23 LEU 114 HD23 LEU 114 -2.672 9.854 -6.635 846 H GLU 115 H GLU 115 -1.536 10.106 -10.702 847 HA GLU 115 HA GLU 115 0.211 11.775 -12.413 848 HB2 GLU 115 HB2 GLU 115 -0.207 9.518 -13.316 849 HB3 GLU 115 HB3 GLU 115 -1.945 9.782 -13.220 850 HG2 GLU 115 HG2 GLU 115 -1.788 11.563 -14.906 851 HG3 GLU 115 HG3 GLU 115 -0.034 11.385 -14.957 852 HA PRO 116 HA PRO 116 -3.129 14.852 -11.698 853 HB2 PRO 116 HB2 PRO 116 -1.998 16.877 -13.208 854 HB3 PRO 116 HB3 PRO 116 -1.502 16.494 -11.555 855 HG2 PRO 116 HG2 PRO 116 -0.239 15.634 -14.160 856 HG3 PRO 116 HG3 PRO 116 0.549 16.269 -12.697 857 HD2 PRO 116 HD2 PRO 116 0.504 13.621 -13.216 858 HD3 PRO 116 HD3 PRO 116 0.356 14.228 -11.553 859 H LEU 117 H LEU 117 -4.875 13.995 -12.779 860 HA LEU 117 HA LEU 117 -5.129 14.235 -15.714 861 HB2 LEU 117 HB2 LEU 117 -7.153 13.184 -13.698 862 HB3 LEU 117 HB3 LEU 117 -7.230 13.005 -15.444 863 HG LEU 117 HG LEU 117 -5.169 11.693 -13.622 864 HD11 LEU 117 HD11 LEU 117 -7.566 10.477 -15.034 865 HD12 LEU 117 HD12 LEU 117 -7.395 10.741 -13.295 866 HD13 LEU 117 HD13 LEU 117 -6.340 9.594 -14.117 867 HD21 LEU 117 HD21 LEU 117 -5.613 11.337 -16.606 868 HD22 LEU 117 HD22 LEU 117 -4.487 10.412 -15.606 869 HD23 LEU 117 HD23 LEU 117 -4.235 12.140 -15.843 870 H GLU 118 H GLU 118 -4.821 16.699 -14.698 871 HA GLU 118 HA GLU 118 -5.590 18.802 -14.441 872 HB2 GLU 118 HB2 GLU 118 -7.961 17.662 -15.964 873 HB3 GLU 118 HB3 GLU 118 -7.894 19.353 -15.494 874 HG2 GLU 118 HG2 GLU 118 -7.221 19.148 -17.789 875 HG3 GLU 118 HG3 GLU 118 -5.838 19.633 -16.817 876 H ASN 119 H ASN 119 -8.775 17.309 -14.022 877 HA ASN 119 HA ASN 119 -9.048 18.576 -11.366 878 HB2 ASN 119 HB2 ASN 119 -11.487 18.306 -11.756 879 HB3 ASN 119 HB3 ASN 119 -10.702 19.206 -13.052 880 HD21 ASN 119 HD21 ASN 119 -10.508 18.247 -15.111 881 HD22 ASN 119 HD22 ASN 119 -11.435 16.859 -15.556 882 H ARG 120 H ARG 120 -8.653 15.484 -12.856 883 HA ARG 120 HA ARG 120 -9.264 14.093 -10.297 884 HB2 ARG 120 HB2 ARG 120 -9.095 12.875 -13.089 885 HB3 ARG 120 HB3 ARG 120 -9.475 12.017 -11.595 886 HG2 ARG 120 HG2 ARG 120 -11.522 13.515 -11.384 887 HG3 ARG 120 HG3 ARG 120 -11.172 14.089 -13.020 888 HD2 ARG 120 HD2 ARG 120 -11.810 11.245 -12.171 889 HD3 ARG 120 HD3 ARG 120 -12.839 12.322 -13.116 890 HE ARG 120 HE ARG 120 -10.895 12.218 -14.796 891 HH11 ARG 120 HH11 ARG 120 -11.894 9.539 -12.837 892 HH12 ARG 120 HH12 ARG 120 -11.303 8.375 -13.964 893 HH21 ARG 120 HH21 ARG 120 -10.153 10.706 -16.200 894 HH22 ARG 120 HH22 ARG 120 -10.316 9.023 -15.832 895 H THR 121 H THR 121 -7.848 11.897 -10.291 896 HA THR 121 HA THR 121 -5.124 12.208 -11.293 897 HB THR 121 HB THR 121 -5.675 12.094 -8.290 898 HG1 THR 121 HG1 THR 121 -5.752 14.189 -9.171 899 HG21 THR 121 HG21 THR 121 -3.750 10.643 -8.788 900 HG22 THR 121 HG22 THR 121 -3.199 12.122 -7.999 901 HG23 THR 121 HG23 THR 121 -3.005 11.927 -9.744 902 H ARG 122 H ARG 122 -4.094 10.268 -11.598 903 HA ARG 122 HA ARG 122 -5.530 7.771 -10.894 904 HB2 ARG 122 HB2 ARG 122 -5.254 8.257 -13.333 905 HB3 ARG 122 HB3 ARG 122 -3.507 8.305 -13.114 906 HG2 ARG 122 HG2 ARG 122 -3.587 5.912 -12.370 907 HG3 ARG 122 HG3 ARG 122 -5.317 5.894 -12.737 908 HD2 ARG 122 HD2 ARG 122 -3.039 6.350 -14.692 909 HD3 ARG 122 HD3 ARG 122 -4.068 4.924 -14.576 910 HE ARG 122 HE ARG 122 -5.904 6.766 -15.058 911 HH11 ARG 122 HH11 ARG 122 -2.833 6.385 -16.605 912 HH12 ARG 122 HH12 ARG 122 -3.401 7.027 -18.104 913 HH21 ARG 122 HH21 ARG 122 -6.589 7.608 -16.960 914 HH22 ARG 122 HH22 ARG 122 -5.501 7.722 -18.300 915 H MET 123 H MET 123 -4.507 6.360 -9.533 916 HA MET 123 HA MET 123 -1.688 6.836 -8.765 917 HB2 MET 123 HB2 MET 123 -3.395 6.983 -6.950 918 HB3 MET 123 HB3 MET 123 -3.854 5.313 -7.256 919 HG2 MET 123 HG2 MET 123 -1.716 4.508 -6.497 920 HG3 MET 123 HG3 MET 123 -1.051 6.142 -6.456 921 HE1 MET 123 HE1 MET 123 -4.655 5.162 -5.284 922 HE2 MET 123 HE2 MET 123 -4.381 4.778 -3.589 923 HE3 MET 123 HE3 MET 123 -3.725 3.728 -4.841 924 H THR 124 H THR 124 -0.186 5.200 -8.908 925 HA THR 124 HA THR 124 -1.040 2.450 -9.610 926 HB THR 124 HB THR 124 1.313 3.916 -10.909 927 HG1 THR 124 HG1 THR 124 -0.920 4.477 -11.613 928 HG21 THR 124 HG21 THR 124 1.475 1.928 -12.374 929 HG22 THR 124 HG22 THR 124 0.177 1.147 -11.468 930 HG23 THR 124 HG23 THR 124 1.723 1.483 -10.684 931 H ILE 125 H ILE 125 -0.380 1.165 -7.957 932 HA ILE 125 HA ILE 125 2.041 1.864 -6.375 933 HB ILE 125 HB ILE 125 -0.244 0.025 -5.516 934 HG12 ILE 125 HG12 ILE 125 0.134 2.967 -4.760 935 HG13 ILE 125 HG13 ILE 125 -1.091 2.367 -5.873 936 HG21 ILE 125 HG21 ILE 125 1.882 -0.370 -4.331 937 HG22 ILE 125 HG22 ILE 125 0.698 0.341 -3.236 938 HG23 ILE 125 HG23 ILE 125 1.989 1.342 -3.907 939 HD11 ILE 125 HD11 ILE 125 -2.122 1.097 -4.039 940 HD12 ILE 125 HD12 ILE 125 -2.039 2.823 -3.694 941 HD13 ILE 125 HD13 ILE 125 -0.897 1.721 -2.928 942 H ILE 126 H ILE 126 3.793 0.625 -6.929 943 HA ILE 126 HA ILE 126 3.387 -2.123 -7.977 944 HB ILE 126 HB ILE 126 5.901 -0.415 -8.375 945 HG12 ILE 126 HG12 ILE 126 5.001 -0.273 -10.848 946 HG13 ILE 126 HG13 ILE 126 3.427 -0.609 -10.143 947 HG21 ILE 126 HG21 ILE 126 6.427 -2.056 -10.151 948 HG22 ILE 126 HG22 ILE 126 4.962 -2.957 -9.757 949 HG23 ILE 126 HG23 ILE 126 6.266 -2.830 -8.573 950 HD11 ILE 126 HD11 ILE 126 3.607 1.422 -8.802 951 HD12 ILE 126 HD12 ILE 126 3.764 1.748 -10.527 952 HD13 ILE 126 HD13 ILE 126 5.197 1.742 -9.501 953 H SER 127 H SER 127 3.626 -3.509 -6.297 954 HA SER 127 HA SER 127 5.625 -3.141 -4.186 955 HB2 SER 127 HB2 SER 127 3.468 -5.273 -4.559 956 HB3 SER 127 HB3 SER 127 4.524 -5.139 -3.149 957 HG SER 127 HG SER 127 3.330 -3.557 -2.420 958 H THR 128 H THR 128 7.633 -3.858 -4.560 959 HA THR 128 HA THR 128 8.193 -6.128 -6.346 960 HB THR 128 HB THR 128 10.549 -5.274 -6.346 961 HG1 THR 128 HG1 THR 128 10.838 -4.156 -4.509 962 HG21 THR 128 HG21 THR 128 10.155 -3.232 -7.667 963 HG22 THR 128 HG22 THR 128 8.499 -3.146 -7.066 964 HG23 THR 128 HG23 THR 128 8.992 -4.486 -8.107 965 H PHE 129 H PHE 129 9.011 -7.987 -5.568 966 HA PHE 129 HA PHE 129 9.326 -8.317 -2.654 967 HB2 PHE 129 HB2 PHE 129 8.748 -10.442 -4.770 968 HB3 PHE 129 HB3 PHE 129 8.637 -10.631 -3.022 969 HD1 PHE 129 HD1 PHE 129 6.731 -9.646 -1.771 970 HD2 PHE 129 HD2 PHE 129 6.974 -9.293 -6.024 971 HE1 PHE 129 HE1 PHE 129 4.369 -8.969 -1.864 972 HE2 PHE 129 HE2 PHE 129 4.617 -8.628 -6.106 973 HZ PHE 129 HZ PHE 129 3.308 -8.455 -4.026 974 H GLU 130 H GLU 130 10.939 -10.001 -1.944 975 HA GLU 130 HA GLU 130 13.525 -9.410 -3.074 976 HB2 GLU 130 HB2 GLU 130 12.780 -11.377 -0.869 977 HB3 GLU 130 HB3 GLU 130 14.409 -10.803 -1.230 978 HG2 GLU 130 HG2 GLU 130 13.739 -8.506 -0.625 979 HG3 GLU 130 HG3 GLU 130 12.100 -9.070 -0.285 980 H SER 131 H SER 131 11.368 -12.219 -3.187 981 HA SER 131 HA SER 131 13.012 -13.475 -5.273 982 HB2 SER 131 HB2 SER 131 13.042 -15.681 -4.167 983 HB3 SER 131 HB3 SER 131 13.811 -14.486 -3.124 984 HG SER 131 HG SER 131 12.468 -15.485 -1.771 985 H GLU 132 H GLU 132 11.908 -15.300 -6.338 986 HA GLU 132 HA GLU 132 9.225 -14.807 -7.075 987 HB2 GLU 132 HB2 GLU 132 11.042 -17.207 -7.497 988 HB3 GLU 132 HB3 GLU 132 9.408 -17.153 -8.139 989 HG2 GLU 132 HG2 GLU 132 9.894 -15.508 -9.696 990 HG3 GLU 132 HG3 GLU 132 11.268 -14.906 -8.786 991 H GLU 133 H GLU 133 10.561 -17.547 -5.166 992 HA GLU 133 HA GLU 133 8.159 -18.785 -4.480 993 HB2 GLU 133 HB2 GLU 133 9.417 -19.834 -2.607 994 HB3 GLU 133 HB3 GLU 133 10.299 -19.875 -4.131 995 HG2 GLU 133 HG2 GLU 133 11.697 -17.980 -3.392 996 HG3 GLU 133 HG3 GLU 133 10.808 -17.903 -1.871 997 H GLN 134 H GLN 134 9.642 -15.923 -3.009 998 HA GLN 134 HA GLN 134 7.920 -15.678 -0.757 999 HB2 GLN 134 HB2 GLN 134 10.041 -14.368 -1.035 1000 HB3 GLN 134 HB3 GLN 134 9.272 -13.430 -2.313 1001 HG2 GLN 134 HG2 GLN 134 7.521 -12.736 -0.590 1002 HG3 GLN 134 HG3 GLN 134 8.542 -13.489 0.632 1003 HE21 GLN 134 HE21 GLN 134 7.739 -10.736 0.472 1004 HE22 GLN 134 HE22 GLN 134 9.185 -9.802 0.345 1005 H MET 135 H MET 135 7.743 -14.183 -4.050 1006 HA MET 135 HA MET 135 5.285 -12.810 -3.502 1007 HB2 MET 135 HB2 MET 135 5.302 -12.025 -5.747 1008 HB3 MET 135 HB3 MET 135 6.951 -12.009 -5.168 1009 HG2 MET 135 HG2 MET 135 7.441 -14.020 -6.478 1010 HG3 MET 135 HG3 MET 135 5.772 -14.059 -7.051 1011 HE1 MET 135 HE1 MET 135 5.658 -10.630 -9.100 1012 HE2 MET 135 HE2 MET 135 5.293 -10.792 -7.382 1013 HE3 MET 135 HE3 MET 135 4.691 -11.993 -8.530 1014 H GLN 136 H GLN 136 5.980 -15.973 -4.912 1015 HA GLN 136 HA GLN 136 3.351 -16.670 -5.665 1016 HB2 GLN 136 HB2 GLN 136 5.756 -18.307 -4.837 1017 HB3 GLN 136 HB3 GLN 136 4.193 -19.098 -4.961 1018 HG2 GLN 136 HG2 GLN 136 5.083 -19.520 -7.045 1019 HG3 GLN 136 HG3 GLN 136 4.122 -18.088 -7.370 1020 HE21 GLN 136 HE21 GLN 136 5.264 -16.083 -7.711 1021 HE22 GLN 136 HE22 GLN 136 6.911 -16.085 -8.174 1022 H LYS 137 H LYS 137 5.057 -16.949 -2.529 1023 HA LYS 137 HA LYS 137 2.919 -18.086 -1.056 1024 HB2 LYS 137 HB2 LYS 137 5.301 -18.151 -0.351 1025 HB3 LYS 137 HB3 LYS 137 5.261 -16.421 -0.047 1026 HG2 LYS 137 HG2 LYS 137 5.096 -17.872 2.000 1027 HG3 LYS 137 HG3 LYS 137 3.790 -16.692 1.831 1028 HD2 LYS 137 HD2 LYS 137 2.208 -18.357 1.209 1029 HD3 LYS 137 HD3 LYS 137 3.459 -19.550 0.847 1030 HE2 LYS 137 HE2 LYS 137 2.895 -18.491 3.633 1031 HE3 LYS 137 HE3 LYS 137 2.196 -19.973 2.977 1032 HZ1 LYS 137 HZ1 LYS 137 4.140 -20.458 4.288 1033 HZ2 LYS 137 HZ2 LYS 137 5.094 -19.429 3.353 1034 HZ3 LYS 137 HZ3 LYS 137 4.448 -20.835 2.671 1035 H MET 138 H MET 138 3.714 -14.716 -1.772 1036 HA MET 138 HA MET 138 1.818 -13.440 -0.078 1037 HB2 MET 138 HB2 MET 138 2.855 -12.527 -2.796 1038 HB3 MET 138 HB3 MET 138 2.078 -11.499 -1.599 1039 HG2 MET 138 HG2 MET 138 4.564 -12.935 -0.753 1040 HG3 MET 138 HG3 MET 138 4.737 -11.613 -1.895 1041 HE1 MET 138 HE1 MET 138 3.783 -12.644 1.771 1042 HE2 MET 138 HE2 MET 138 2.230 -11.990 1.244 1043 HE3 MET 138 HE3 MET 138 3.192 -11.124 2.441 1044 H ALA 139 H ALA 139 1.605 -14.719 -3.374 1045 HA ALA 139 HA ALA 139 -1.135 -14.079 -3.881 1046 HB1 ALA 139 HB1 ALA 139 0.475 -14.473 -5.682 1047 HB2 ALA 139 HB2 ALA 139 -0.880 -15.599 -5.810 1048 HB3 ALA 139 HB3 ALA 139 0.673 -16.155 -5.170 1049 H GLU 140 H GLU 140 0.476 -16.889 -2.396 1050 HA GLU 140 HA GLU 140 -1.792 -18.617 -2.237 1051 HB2 GLU 140 HB2 GLU 140 0.639 -18.552 -0.393 1052 HB3 GLU 140 HB3 GLU 140 -0.523 -19.872 -0.516 1053 HG2 GLU 140 HG2 GLU 140 1.439 -18.968 -2.637 1054 HG3 GLU 140 HG3 GLU 140 1.528 -20.438 -1.684 1055 H MET 141 H MET 141 -0.450 -16.197 -0.017 1056 HA MET 141 HA MET 141 -2.377 -16.406 2.072 1057 HB2 MET 141 HB2 MET 141 -0.517 -14.174 1.169 1058 HB3 MET 141 HB3 MET 141 -1.569 -13.993 2.568 1059 HG2 MET 141 HG2 MET 141 0.470 -16.215 2.324 1060 HG3 MET 141 HG3 MET 141 0.814 -14.652 3.065 1061 HE1 MET 141 HE1 MET 141 -0.216 -13.823 5.378 1062 HE2 MET 141 HE2 MET 141 -1.538 -14.657 6.196 1063 HE3 MET 141 HE3 MET 141 -1.813 -13.899 4.628 1064 H GLY 142 H GLY 142 -2.515 -14.986 -1.096 1065 HA2 GLY 142 HA2 GLY 142 -4.224 -13.920 -2.230 1066 HA3 GLY 142 HA3 GLY 142 -5.229 -14.036 -0.791 1067 H MET 143 H MET 143 -2.089 -12.646 -0.409 1068 HA MET 143 HA MET 143 -2.900 -10.195 0.648 1069 HB2 MET 143 HB2 MET 143 -0.651 -11.071 1.053 1070 HB3 MET 143 HB3 MET 143 -0.248 -10.955 -0.654 1071 HG2 MET 143 HG2 MET 143 -0.503 -8.456 -0.476 1072 HG3 MET 143 HG3 MET 143 -0.711 -8.653 1.266 1073 HE1 MET 143 HE1 MET 143 1.543 -6.814 -0.287 1074 HE2 MET 143 HE2 MET 143 2.942 -7.111 0.745 1075 HE3 MET 143 HE3 MET 143 1.359 -6.826 1.469 1076 H GLU 144 H GLU 144 -2.039 -11.048 -2.681 1077 HA GLU 144 HA GLU 144 -1.969 -8.446 -3.763 1078 HB2 GLU 144 HB2 GLU 144 -2.094 -9.528 -5.959 1079 HB3 GLU 144 HB3 GLU 144 -0.931 -10.317 -4.906 1080 HG2 GLU 144 HG2 GLU 144 -2.445 -12.181 -4.549 1081 HG3 GLU 144 HG3 GLU 144 -3.729 -11.359 -5.447 1082 H GLU 145 H GLU 145 -4.683 -10.717 -3.377 1083 HA GLU 145 HA GLU 145 -6.619 -9.126 -4.788 1084 HB2 GLU 145 HB2 GLU 145 -6.829 -11.588 -4.512 1085 HB3 GLU 145 HB3 GLU 145 -7.023 -11.381 -2.778 1086 HG2 GLU 145 HG2 GLU 145 -9.185 -11.784 -3.819 1087 HG3 GLU 145 HG3 GLU 145 -9.131 -10.150 -3.154 1088 H GLY 146 H GLY 146 -5.989 -9.743 -1.304 1089 HA2 GLY 146 HA2 GLY 146 -7.871 -7.987 -0.177 1090 HA3 GLY 146 HA3 GLY 146 -6.394 -8.529 0.599 1091 H MET 147 H MET 147 -4.667 -7.333 -1.447 1092 HA MET 147 HA MET 147 -4.308 -4.681 -0.466 1093 HB2 MET 147 HB2 MET 147 -2.450 -6.071 -1.375 1094 HB3 MET 147 HB3 MET 147 -3.175 -5.996 -2.974 1095 HG2 MET 147 HG2 MET 147 -2.852 -3.535 -2.972 1096 HG3 MET 147 HG3 MET 147 -2.037 -3.670 -1.410 1097 HE1 MET 147 HE1 MET 147 0.014 -2.332 -2.556 1098 HE2 MET 147 HE2 MET 147 -0.816 -2.323 -4.113 1099 HE3 MET 147 HE3 MET 147 0.850 -2.896 -4.004 1100 H ARG 148 H ARG 148 -5.601 -6.003 -3.525 1101 HA ARG 148 HA ARG 148 -6.331 -3.638 -4.842 1102 HB2 ARG 148 HB2 ARG 148 -6.424 -5.872 -5.924 1103 HB3 ARG 148 HB3 ARG 148 -7.752 -6.339 -4.865 1104 HG2 ARG 148 HG2 ARG 148 -9.045 -4.349 -5.903 1105 HG3 ARG 148 HG3 ARG 148 -7.777 -4.328 -7.131 1106 HD2 ARG 148 HD2 ARG 148 -9.632 -6.636 -6.480 1107 HD3 ARG 148 HD3 ARG 148 -9.721 -5.588 -7.898 1108 HE ARG 148 HE ARG 148 -7.202 -6.696 -7.963 1109 HH11 ARG 148 HH11 ARG 148 -10.401 -8.002 -7.927 1110 HH12 ARG 148 HH12 ARG 148 -9.962 -9.377 -8.873 1111 HH21 ARG 148 HH21 ARG 148 -6.662 -8.493 -9.153 1112 HH22 ARG 148 HH22 ARG 148 -7.884 -9.650 -9.554 1113 H GLU 149 H GLU 149 -8.201 -5.644 -2.565 1114 HA GLU 149 HA GLU 149 -10.628 -4.218 -2.515 1115 HB2 GLU 149 HB2 GLU 149 -9.350 -5.916 -0.327 1116 HB3 GLU 149 HB3 GLU 149 -11.048 -5.434 -0.371 1117 HG2 GLU 149 HG2 GLU 149 -11.392 -6.725 -2.421 1118 HG3 GLU 149 HG3 GLU 149 -9.680 -7.153 -2.464 1119 H ALA 150 H ALA 150 -7.666 -3.767 -0.603 1120 HA ALA 150 HA ALA 150 -8.510 -1.694 1.133 1121 HB1 ALA 150 HB1 ALA 150 -6.375 -2.912 1.408 1122 HB2 ALA 150 HB2 ALA 150 -6.109 -1.168 1.353 1123 HB3 ALA 150 HB3 ALA 150 -5.751 -2.164 -0.065 1124 H ILE 151 H ILE 151 -7.097 -1.605 -2.126 1125 HA ILE 151 HA ILE 151 -7.020 1.254 -2.368 1126 HB ILE 151 HB ILE 151 -6.717 -0.871 -4.529 1127 HG12 ILE 151 HG12 ILE 151 -4.522 0.568 -2.959 1128 HG13 ILE 151 HG13 ILE 151 -5.101 -1.046 -2.565 1129 HG21 ILE 151 HG21 ILE 151 -7.155 1.349 -5.509 1130 HG22 ILE 151 HG22 ILE 151 -5.487 0.866 -5.809 1131 HG23 ILE 151 HG23 ILE 151 -5.848 2.050 -4.550 1132 HD11 ILE 151 HD11 ILE 151 -3.041 -1.165 -3.790 1133 HD12 ILE 151 HD12 ILE 151 -3.725 -0.219 -5.111 1134 HD13 ILE 151 HD13 ILE 151 -4.351 -1.836 -4.766 1135 H GLU 152 H GLU 152 -9.438 -1.159 -3.084 1136 HA GLU 152 HA GLU 152 -11.181 0.577 -4.610 1137 HB2 GLU 152 HB2 GLU 152 -11.777 -2.046 -3.168 1138 HB3 GLU 152 HB3 GLU 152 -12.894 -1.202 -4.245 1139 HG2 GLU 152 HG2 GLU 152 -11.171 -1.442 -6.073 1140 HG3 GLU 152 HG3 GLU 152 -10.246 -2.471 -4.985 1141 H GLN 153 H GLN 153 -10.558 -0.041 -1.231 1142 HA GLN 153 HA GLN 153 -12.946 1.329 -0.279 1143 HB2 GLN 153 HB2 GLN 153 -11.982 -0.592 0.970 1144 HB3 GLN 153 HB3 GLN 153 -10.515 0.334 1.269 1145 HG2 GLN 153 HG2 GLN 153 -11.628 1.830 2.748 1146 HG3 GLN 153 HG3 GLN 153 -13.223 1.327 2.197 1147 HE21 GLN 153 HE21 GLN 153 -10.470 0.412 4.142 1148 HE22 GLN 153 HE22 GLN 153 -11.275 -0.801 5.056 1149 H ILE 154 H ILE 154 -9.730 2.232 -1.287 1150 HA ILE 154 HA ILE 154 -9.520 4.811 -0.124 1151 HB ILE 154 HB ILE 154 -8.643 3.940 -2.913 1152 HG12 ILE 154 HG12 ILE 154 -7.090 4.099 -0.302 1153 HG13 ILE 154 HG13 ILE 154 -7.609 2.621 -1.105 1154 HG21 ILE 154 HG21 ILE 154 -7.790 6.412 -1.341 1155 HG22 ILE 154 HG22 ILE 154 -8.775 6.401 -2.805 1156 HG23 ILE 154 HG23 ILE 154 -7.093 5.885 -2.876 1157 HD11 ILE 154 HD11 ILE 154 -6.140 3.171 -2.997 1158 HD12 ILE 154 HD12 ILE 154 -5.278 3.007 -1.470 1159 HD13 ILE 154 HD13 ILE 154 -5.595 4.608 -2.128 1160 H ASP 155 H ASP 155 -11.373 3.627 -2.894 1161 HA ASP 155 HA ASP 155 -12.342 6.076 -3.888 1162 HB2 ASP 155 HB2 ASP 155 -12.477 3.580 -4.821 1163 HB3 ASP 155 HB3 ASP 155 -14.011 3.539 -3.966 1164 H ALA 156 H ALA 156 -13.475 3.917 -1.307 1165 HA ALA 156 HA ALA 156 -15.791 5.371 -0.493 1166 HB1 ALA 156 HB1 ALA 156 -15.685 4.016 1.559 1167 HB2 ALA 156 HB2 ALA 156 -14.039 3.504 1.162 1168 HB3 ALA 156 HB3 ALA 156 -15.389 3.009 0.140 1169 H VAL 157 H VAL 157 -12.365 5.794 0.245 1170 HA VAL 157 HA VAL 157 -12.720 7.554 2.516 1171 HB VAL 157 HB VAL 157 -10.258 7.240 0.727 1172 HG11 VAL 157 HG11 VAL 157 -8.975 8.141 2.659 1173 HG12 VAL 157 HG12 VAL 157 -10.483 8.412 3.533 1174 HG13 VAL 157 HG13 VAL 157 -10.149 9.313 2.052 1175 HG21 VAL 157 HG21 VAL 157 -10.948 5.787 3.304 1176 HG22 VAL 157 HG22 VAL 157 -9.394 5.702 2.475 1177 HG23 VAL 157 HG23 VAL 157 -10.844 5.080 1.692 1178 H LEU 158 H LEU 158 -12.023 8.032 -0.956 1179 HA LEU 158 HA LEU 158 -11.739 10.915 -0.682 1180 HB2 LEU 158 HB2 LEU 158 -11.664 9.208 -3.201 1181 HB3 LEU 158 HB3 LEU 158 -11.163 10.892 -3.069 1182 HG LEU 158 HG LEU 158 -9.798 8.478 -1.806 1183 HD11 LEU 158 HD11 LEU 158 -9.324 8.718 -4.176 1184 HD12 LEU 158 HD12 LEU 158 -7.892 9.063 -3.213 1185 HD13 LEU 158 HD13 LEU 158 -8.807 10.391 -3.933 1186 HD21 LEU 158 HD21 LEU 158 -9.083 11.406 -1.465 1187 HD22 LEU 158 HD22 LEU 158 -8.090 10.043 -0.942 1188 HD23 LEU 158 HD23 LEU 158 -9.672 10.308 -0.216 1189 H SER 159 H SER 159 -14.155 8.655 -1.894 1190 HA SER 159 HA SER 159 -15.969 10.754 -2.816 1191 HB2 SER 159 HB2 SER 159 -15.933 8.490 -3.919 1192 HB3 SER 159 HB3 SER 159 -16.512 7.772 -2.429 1193 HG SER 159 HG SER 159 -17.964 9.878 -3.611 1194 H GLU 160 H GLU 160 -15.958 8.261 -0.286 1195 HA GLU 160 HA GLU 160 -17.238 7.794 1.492 1196 HB2 GLU 160 HB2 GLU 160 -15.711 9.784 2.196 1197 HB3 GLU 160 HB3 GLU 160 -17.197 10.721 2.236 1198 HG2 GLU 160 HG2 GLU 160 -18.122 8.938 3.808 1199 HG3 GLU 160 HG3 GLU 160 -16.491 8.286 3.892 1200 HA PRO 161 HA PRO 161 -21.056 8.968 -0.779 1201 HB2 PRO 161 HB2 PRO 161 -22.411 6.565 -0.449 1202 HB3 PRO 161 HB3 PRO 161 -21.205 6.857 -1.711 1203 HG2 PRO 161 HG2 PRO 161 -20.867 5.494 0.960 1204 HG3 PRO 161 HG3 PRO 161 -20.216 5.024 -0.623 1205 HD2 PRO 161 HD2 PRO 161 -18.702 6.291 1.240 1206 HD3 PRO 161 HD3 PRO 161 -18.457 6.567 -0.498 1207 H ALA 162 H ALA 162 -22.330 6.768 1.698 1208 HA ALA 162 HA ALA 162 -23.388 9.018 3.299 1209 HB1 ALA 162 HB1 ALA 162 -25.143 8.405 1.676 1210 HB2 ALA 162 HB2 ALA 162 -25.644 8.040 3.327 1211 HB3 ALA 162 HB3 ALA 162 -25.107 6.739 2.257 1212 H ASN 163 H ASN 163 -21.429 6.573 3.462 1213 HA ASN 163 HA ASN 163 -21.747 5.989 6.248 1214 HB2 ASN 163 HB2 ASN 163 -22.316 3.615 6.085 1215 HB3 ASN 163 HB3 ASN 163 -23.567 4.554 5.293 1216 HD21 ASN 163 HD21 ASN 163 -23.045 1.810 4.877 1217 HD22 ASN 163 HD22 ASN 163 -22.613 1.611 3.218 1218 H ALA 164 H ALA 164 -19.752 6.456 3.764 1219 HA ALA 164 HA ALA 164 -17.748 5.881 2.948 1220 HB1 ALA 164 HB1 ALA 164 -17.252 4.643 5.675 1221 HB2 ALA 164 HB2 ALA 164 -16.961 6.327 5.239 1222 HB3 ALA 164 HB3 ALA 164 -16.015 5.046 4.476 1223 H LEU 165 H LEU 165 -18.074 2.956 4.971 1224 HA LEU 165 HA LEU 165 -19.206 1.353 2.854 1225 HB2 LEU 165 HB2 LEU 165 -16.293 1.197 3.474 1226 HB3 LEU 165 HB3 LEU 165 -17.096 -0.361 3.412 1227 HG LEU 165 HG LEU 165 -16.993 1.682 1.151 1228 HD11 LEU 165 HD11 LEU 165 -15.581 0.038 -0.016 1229 HD12 LEU 165 HD12 LEU 165 -15.608 -1.018 1.400 1230 HD13 LEU 165 HD13 LEU 165 -14.836 0.568 1.491 1231 HD21 LEU 165 HD21 LEU 165 -19.120 0.466 1.094 1232 HD22 LEU 165 HD22 LEU 165 -18.272 -1.080 1.164 1233 HD23 LEU 165 HD23 LEU 165 -18.089 -0.032 -0.246 1234 H GLU 166 H GLU 166 -20.733 0.336 3.884 1235 HA GLU 166 HA GLU 166 -20.751 -0.488 6.635 1236 HB2 GLU 166 HB2 GLU 166 -22.965 -1.332 6.200 1237 HB3 GLU 166 HB3 GLU 166 -22.802 0.186 5.330 1238 HG2 GLU 166 HG2 GLU 166 -22.535 -2.560 4.037 1239 HG3 GLU 166 HG3 GLU 166 -24.029 -1.631 4.084 1240 H HIS 167 H HIS 167 -18.955 -1.803 4.266 1241 HA HIS 167 HA HIS 167 -17.814 -3.721 3.934 1242 HB2 HIS 167 HB2 HIS 167 -19.315 -4.839 6.347 1243 HB3 HIS 167 HB3 HIS 167 -17.969 -5.637 5.541 1244 HD1 HIS 167 HD1 HIS 167 -18.738 -2.594 7.650 1245 HD2 HIS 167 HD2 HIS 167 -15.475 -4.833 6.405 1246 HE1 HIS 167 HE1 HIS 167 -16.783 -1.691 8.930 1247 HE2 HIS 167 HE2 HIS 167 -14.820 -3.058 8.173 1248 H HIS 168 H HIS 168 -20.230 -3.138 2.503 1249 HA HIS 168 HA HIS 168 -21.799 -5.520 2.075 1250 HB2 HIS 168 HB2 HIS 168 -22.626 -3.217 1.623 1251 HB3 HIS 168 HB3 HIS 168 -21.477 -3.060 0.307 1252 HD1 HIS 168 HD1 HIS 168 -24.455 -5.210 1.263 1253 HD2 HIS 168 HD2 HIS 168 -22.526 -3.782 -2.117 1254 HE1 HIS 168 HE1 HIS 168 -25.880 -5.929 -0.665 1255 HE2 HIS 168 HE2 HIS 168 -24.775 -4.923 -2.687 1256 H HIS 169 H HIS 169 -18.632 -4.712 1.078 1257 HA HIS 169 HA HIS 169 -18.347 -5.920 -1.440 1258 HB2 HIS 169 HB2 HIS 169 -16.586 -4.541 -0.302 1259 HB3 HIS 169 HB3 HIS 169 -16.301 -5.848 0.832 1260 HD1 HIS 169 HD1 HIS 169 -15.093 -4.495 -2.286 1261 HD2 HIS 169 HD2 HIS 169 -15.217 -8.274 -0.570 1262 HE1 HIS 169 HE1 HIS 169 -13.390 -5.850 -3.526 1263 HE2 HIS 169 HE2 HIS 169 -13.310 -8.037 -2.293 1264 H HIS 170 H HIS 170 -19.544 -7.833 -1.604 1265 HA HIS 170 HA HIS 170 -18.528 -10.206 -0.131 1266 HB2 HIS 170 HB2 HIS 170 -20.864 -9.535 0.564 1267 HB3 HIS 170 HB3 HIS 170 -21.405 -9.778 -1.089 1268 HD1 HIS 170 HD1 HIS 170 -20.678 -11.584 2.061 1269 HD2 HIS 170 HD2 HIS 170 -21.469 -12.557 -1.905 1270 HE1 HIS 170 HE1 HIS 170 -21.206 -14.039 2.061 1271 HE2 HIS 170 HE2 HIS 170 -21.807 -14.571 -0.321 1272 H HIS 171 H HIS 171 -16.983 -10.283 -1.899 1273 HA HIS 171 HA HIS 171 -17.699 -12.222 -3.843 1274 HB2 HIS 171 HB2 HIS 171 -18.634 -10.300 -5.087 1275 HB3 HIS 171 HB3 HIS 171 -17.110 -9.433 -4.956 1276 HD1 HIS 171 HD1 HIS 171 -15.342 -9.924 -6.708 1277 HD2 HIS 171 HD2 HIS 171 -18.541 -12.570 -6.894 1278 HE1 HIS 171 HE1 HIS 171 -14.979 -11.265 -8.794 1279 HE2 HIS 171 HE2 HIS 171 -16.839 -12.950 -8.806 1280 H HIS 172 H HIS 172 -15.948 -13.423 -4.227 1281 HA HIS 172 HA HIS 172 -13.291 -12.210 -4.602 1282 HB2 HIS 172 HB2 HIS 172 -13.866 -14.513 -2.686 1283 HB3 HIS 172 HB3 HIS 172 -12.259 -14.194 -3.321 1284 HD1 HIS 172 HD1 HIS 172 -14.269 -13.493 -0.461 1285 HD2 HIS 172 HD2 HIS 172 -11.418 -11.376 -2.614 1286 HE1 HIS 172 HE1 HIS 172 -13.444 -11.712 1.095 1287 HE2 HIS 172 HE2 HIS 172 -11.797 -10.384 -0.262 Start of MODEL 2 1 H1 THR 1 H1 THR 1 -12.654 0.795 -8.089 2 H2 THR 1 H2 THR 1 -12.778 2.454 -8.401 3 H3 THR 1 H3 THR 1 -11.290 1.783 -7.952 4 HA THR 1 HA THR 1 -12.775 1.128 -10.421 5 HB THR 1 HB THR 1 -10.787 2.333 -11.559 6 HG1 THR 1 HG1 THR 1 -10.320 4.138 -9.683 7 HG21 THR 1 HG21 THR 1 -11.824 4.549 -11.379 8 HG22 THR 1 HG22 THR 1 -12.738 4.023 -9.962 9 HG23 THR 1 HG23 THR 1 -13.050 3.291 -11.540 10 H VAL 2 H VAL 2 -9.383 1.155 -9.190 11 HA VAL 2 HA VAL 2 -7.580 0.095 -10.059 12 HB VAL 2 HB VAL 2 -9.272 -2.321 -9.294 13 HG11 VAL 2 HG11 VAL 2 -7.434 -3.061 -10.766 14 HG12 VAL 2 HG12 VAL 2 -7.126 -3.574 -9.107 15 HG13 VAL 2 HG13 VAL 2 -6.264 -2.185 -9.775 16 HG21 VAL 2 HG21 VAL 2 -7.115 -0.841 -7.734 17 HG22 VAL 2 HG22 VAL 2 -7.996 -2.268 -7.178 18 HG23 VAL 2 HG23 VAL 2 -8.851 -0.749 -7.431 19 H VAL 3 H VAL 3 -7.897 0.982 -12.130 20 HA VAL 3 HA VAL 3 -9.512 -0.218 -14.156 21 HB VAL 3 HB VAL 3 -8.473 1.482 -15.696 22 HG11 VAL 3 HG11 VAL 3 -9.469 2.591 -13.037 23 HG12 VAL 3 HG12 VAL 3 -10.481 2.066 -14.387 24 HG13 VAL 3 HG13 VAL 3 -9.428 3.471 -14.569 25 HG21 VAL 3 HG21 VAL 3 -6.867 2.291 -13.232 26 HG22 VAL 3 HG22 VAL 3 -6.941 3.198 -14.745 27 HG23 VAL 3 HG23 VAL 3 -6.207 1.593 -14.715 28 H SER 4 H SER 4 -6.227 -0.803 -13.163 29 HA SER 4 HA SER 4 -6.051 -3.015 -15.054 30 HB2 SER 4 HB2 SER 4 -4.970 -1.170 -16.328 31 HB3 SER 4 HB3 SER 4 -3.864 -0.880 -14.985 32 HG SER 4 HG SER 4 -2.670 -2.460 -15.685 33 H VAL 5 H VAL 5 -4.854 -4.728 -14.244 34 HA VAL 5 HA VAL 5 -3.216 -4.329 -11.787 35 HB VAL 5 HB VAL 5 -4.679 -6.933 -12.495 36 HG11 VAL 5 HG11 VAL 5 -3.322 -6.059 -9.905 37 HG12 VAL 5 HG12 VAL 5 -2.684 -7.235 -11.058 38 HG13 VAL 5 HG13 VAL 5 -4.162 -7.590 -10.162 39 HG21 VAL 5 HG21 VAL 5 -5.566 -4.830 -10.487 40 HG22 VAL 5 HG22 VAL 5 -6.311 -6.415 -10.716 41 HG23 VAL 5 HG23 VAL 5 -6.373 -5.218 -12.010 42 H ASP 6 H ASP 6 -1.168 -4.261 -12.695 43 HA ASP 6 HA ASP 6 -0.422 -6.152 -14.837 44 HB2 ASP 6 HB2 ASP 6 1.165 -3.809 -13.682 45 HB3 ASP 6 HB3 ASP 6 1.548 -4.714 -15.146 46 H LYS 7 H LYS 7 0.383 -8.093 -14.108 47 HA LYS 7 HA LYS 7 2.077 -8.119 -11.659 48 HB2 LYS 7 HB2 LYS 7 -0.199 -9.081 -11.269 49 HB3 LYS 7 HB3 LYS 7 0.105 -10.275 -12.527 50 HG2 LYS 7 HG2 LYS 7 1.978 -11.203 -11.186 51 HG3 LYS 7 HG3 LYS 7 1.664 -10.000 -9.927 52 HD2 LYS 7 HD2 LYS 7 -0.612 -10.956 -9.619 53 HD3 LYS 7 HD3 LYS 7 -0.256 -12.172 -10.847 54 HE2 LYS 7 HE2 LYS 7 1.541 -13.086 -9.427 55 HE3 LYS 7 HE3 LYS 7 1.210 -11.857 -8.202 56 HZ1 LYS 7 HZ1 LYS 7 0.173 -14.004 -7.710 57 HZ2 LYS 7 HZ2 LYS 7 -0.738 -13.894 -9.132 58 HZ3 LYS 7 HZ3 LYS 7 -0.974 -12.771 -7.885 59 H ASP 8 H ASP 8 4.081 -8.670 -12.138 60 HA ASP 8 HA ASP 8 4.620 -10.731 -14.209 61 HB2 ASP 8 HB2 ASP 8 5.169 -8.367 -14.975 62 HB3 ASP 8 HB3 ASP 8 6.376 -8.289 -13.696 63 H VAL 9 H VAL 9 5.108 -12.432 -13.014 64 HA VAL 9 HA VAL 9 6.395 -12.414 -10.454 65 HB VAL 9 HB VAL 9 5.891 -14.796 -12.303 66 HG11 VAL 9 HG11 VAL 9 6.318 -14.743 -9.285 67 HG12 VAL 9 HG12 VAL 9 7.448 -15.376 -10.483 68 HG13 VAL 9 HG13 VAL 9 5.894 -16.173 -10.233 69 HG21 VAL 9 HG21 VAL 9 3.795 -13.566 -11.899 70 HG22 VAL 9 HG22 VAL 9 4.060 -13.654 -10.156 71 HG23 VAL 9 HG23 VAL 9 3.769 -15.130 -11.080 72 H GLU 10 H GLU 10 7.555 -12.544 -13.725 73 HA GLU 10 HA GLU 10 10.052 -13.858 -13.421 74 HB2 GLU 10 HB2 GLU 10 9.734 -11.573 -15.393 75 HB3 GLU 10 HB3 GLU 10 10.573 -13.110 -15.596 76 HG2 GLU 10 HG2 GLU 10 7.570 -12.656 -15.611 77 HG3 GLU 10 HG3 GLU 10 8.584 -12.956 -17.016 78 H ALA 11 H ALA 11 9.226 -10.410 -13.451 79 HA ALA 11 HA ALA 11 11.831 -9.528 -12.443 80 HB1 ALA 11 HB1 ALA 11 10.951 -7.251 -12.752 81 HB2 ALA 11 HB2 ALA 11 9.347 -7.905 -13.109 82 HB3 ALA 11 HB3 ALA 11 10.693 -8.220 -14.205 83 H LEU 12 H LEU 12 9.109 -10.753 -11.024 84 HA LEU 12 HA LEU 12 8.149 -10.817 -8.974 85 HB2 LEU 12 HB2 LEU 12 10.844 -9.694 -8.128 86 HB3 LEU 12 HB3 LEU 12 9.672 -10.413 -7.031 87 HG LEU 12 HG LEU 12 10.970 -11.930 -9.335 88 HD11 LEU 12 HD11 LEU 12 12.382 -13.027 -7.661 89 HD12 LEU 12 HD12 LEU 12 11.741 -11.964 -6.404 90 HD13 LEU 12 HD13 LEU 12 12.696 -11.293 -7.730 91 HD21 LEU 12 HD21 LEU 12 8.791 -12.829 -8.628 92 HD22 LEU 12 HD22 LEU 12 9.366 -12.930 -6.960 93 HD23 LEU 12 HD23 LEU 12 10.107 -13.928 -8.214 94 H SER 13 H SER 13 7.496 -8.543 -10.488 95 HA SER 13 HA SER 13 7.085 -6.448 -8.422 96 HB2 SER 13 HB2 SER 13 6.938 -4.817 -10.309 97 HB3 SER 13 HB3 SER 13 8.517 -5.580 -10.189 98 HG SER 13 HG SER 13 8.189 -5.942 -12.248 99 H PHE 14 H PHE 14 5.057 -5.970 -7.917 100 HA PHE 14 HA PHE 14 2.806 -6.883 -9.618 101 HB2 PHE 14 HB2 PHE 14 2.899 -8.297 -7.665 102 HB3 PHE 14 HB3 PHE 14 3.124 -6.921 -6.590 103 HD1 PHE 14 HD1 PHE 14 0.642 -8.059 -9.189 104 HD2 PHE 14 HD2 PHE 14 1.266 -6.336 -5.321 105 HE1 PHE 14 HE1 PHE 14 -1.791 -7.937 -8.836 106 HE2 PHE 14 HE2 PHE 14 -1.165 -6.216 -4.984 107 HZ PHE 14 HZ PHE 14 -2.688 -7.015 -6.736 108 H SER 15 H SER 15 1.947 -5.153 -10.512 109 HA SER 15 HA SER 15 1.920 -2.516 -9.198 110 HB2 SER 15 HB2 SER 15 3.211 -2.568 -11.279 111 HB3 SER 15 HB3 SER 15 1.845 -3.258 -12.151 112 HG SER 15 HG SER 15 1.736 -1.128 -12.575 113 H ILE 16 H ILE 16 0.044 -1.426 -8.914 114 HA ILE 16 HA ILE 16 -2.490 -2.434 -10.103 115 HB ILE 16 HB ILE 16 -2.119 -1.267 -7.299 116 HG12 ILE 16 HG12 ILE 16 -2.997 -4.074 -8.130 117 HG13 ILE 16 HG13 ILE 16 -1.400 -3.659 -7.517 118 HG21 ILE 16 HG21 ILE 16 -4.697 -2.138 -8.668 119 HG22 ILE 16 HG22 ILE 16 -4.245 -0.484 -8.255 120 HG23 ILE 16 HG23 ILE 16 -4.554 -1.655 -6.976 121 HD11 ILE 16 HD11 ILE 16 -3.993 -3.440 -5.984 122 HD12 ILE 16 HD12 ILE 16 -2.386 -3.035 -5.369 123 HD13 ILE 16 HD13 ILE 16 -2.768 -4.698 -5.810 124 H VAL 17 H VAL 17 -3.227 -0.952 -11.511 125 HA VAL 17 HA VAL 17 -2.697 1.932 -11.144 126 HB VAL 17 HB VAL 17 -3.812 0.553 -13.636 127 HG11 VAL 17 HG11 VAL 17 -2.585 3.326 -13.296 128 HG12 VAL 17 HG12 VAL 17 -4.305 2.978 -13.501 129 HG13 VAL 17 HG13 VAL 17 -3.176 2.634 -14.810 130 HG21 VAL 17 HG21 VAL 17 -1.562 -0.345 -13.191 131 HG22 VAL 17 HG22 VAL 17 -0.912 1.293 -13.090 132 HG23 VAL 17 HG23 VAL 17 -1.549 0.691 -14.621 133 H ALA 18 H ALA 18 -4.372 3.209 -10.489 134 HA ALA 18 HA ALA 18 -7.181 2.445 -10.891 135 HB1 ALA 18 HB1 ALA 18 -6.016 2.987 -8.129 136 HB2 ALA 18 HB2 ALA 18 -6.537 1.416 -8.740 137 HB3 ALA 18 HB3 ALA 18 -7.720 2.702 -8.502 138 H GLU 19 H GLU 19 -8.408 4.203 -11.351 139 HA GLU 19 HA GLU 19 -7.236 6.919 -11.059 140 HB2 GLU 19 HB2 GLU 19 -9.350 5.891 -12.997 141 HB3 GLU 19 HB3 GLU 19 -8.735 7.543 -12.942 142 HG2 GLU 19 HG2 GLU 19 -6.490 6.733 -13.546 143 HG3 GLU 19 HG3 GLU 19 -7.088 5.073 -13.581 144 H PHE 20 H PHE 20 -8.320 8.476 -9.914 145 HA PHE 20 HA PHE 20 -11.057 7.919 -8.912 146 HB2 PHE 20 HB2 PHE 20 -8.739 8.914 -7.187 147 HB3 PHE 20 HB3 PHE 20 -10.397 8.674 -6.645 148 HD1 PHE 20 HD1 PHE 20 -11.361 6.253 -6.822 149 HD2 PHE 20 HD2 PHE 20 -7.177 7.144 -6.973 150 HE1 PHE 20 HE1 PHE 20 -10.835 3.926 -6.225 151 HE2 PHE 20 HE2 PHE 20 -6.665 4.816 -6.376 152 HZ PHE 20 HZ PHE 20 -8.492 3.204 -6.007 153 H ASP 21 H ASP 21 -12.345 9.700 -8.539 154 HA ASP 21 HA ASP 21 -11.672 12.161 -9.901 155 HB2 ASP 21 HB2 ASP 21 -14.155 11.230 -8.407 156 HB3 ASP 21 HB3 ASP 21 -14.026 12.811 -9.174 157 H ALA 22 H ALA 22 -9.951 12.883 -8.696 158 HA ALA 22 HA ALA 22 -10.433 14.738 -6.587 159 HB1 ALA 22 HB1 ALA 22 -9.018 13.652 -4.845 160 HB2 ALA 22 HB2 ALA 22 -8.900 12.205 -5.851 161 HB3 ALA 22 HB3 ALA 22 -10.460 12.699 -5.193 162 H ASP 23 H ASP 23 -8.367 15.890 -5.992 163 HA ASP 23 HA ASP 23 -6.524 15.966 -8.272 164 HB2 ASP 23 HB2 ASP 23 -5.524 17.950 -7.160 165 HB3 ASP 23 HB3 ASP 23 -7.248 18.127 -7.413 166 H VAL 24 H VAL 24 -4.150 16.215 -7.750 167 HA VAL 24 HA VAL 24 -3.157 13.775 -6.875 168 HB VAL 24 HB VAL 24 -1.660 16.399 -7.249 169 HG11 VAL 24 HG11 VAL 24 0.359 15.009 -7.654 170 HG12 VAL 24 HG12 VAL 24 -0.557 13.557 -7.245 171 HG13 VAL 24 HG13 VAL 24 -0.254 14.786 -6.015 172 HG21 VAL 24 HG21 VAL 24 -2.912 15.729 -9.254 173 HG22 VAL 24 HG22 VAL 24 -2.153 14.133 -9.223 174 HG23 VAL 24 HG23 VAL 24 -1.176 15.574 -9.521 175 H LYS 25 H LYS 25 -3.214 16.883 -5.116 176 HA LYS 25 HA LYS 25 -1.799 15.984 -2.813 177 HB2 LYS 25 HB2 LYS 25 -3.408 18.436 -3.489 178 HB3 LYS 25 HB3 LYS 25 -3.107 18.119 -1.789 179 HG2 LYS 25 HG2 LYS 25 -0.701 18.002 -3.556 180 HG3 LYS 25 HG3 LYS 25 -1.450 19.586 -3.379 181 HD2 LYS 25 HD2 LYS 25 0.371 19.244 -1.732 182 HD3 LYS 25 HD3 LYS 25 -1.184 19.494 -0.946 183 HE2 LYS 25 HE2 LYS 25 -1.366 17.057 -0.541 184 HE3 LYS 25 HE3 LYS 25 0.189 16.807 -1.338 185 HZ1 LYS 25 HZ1 LYS 25 1.253 18.079 0.375 186 HZ2 LYS 25 HZ2 LYS 25 0.337 16.851 1.091 187 HZ3 LYS 25 HZ3 LYS 25 -0.227 18.445 1.100 188 H ARG 26 H ARG 26 -5.225 15.934 -3.674 189 HA ARG 26 HA ARG 26 -6.223 15.235 -1.068 190 HB2 ARG 26 HB2 ARG 26 -7.730 16.247 -2.667 191 HB3 ARG 26 HB3 ARG 26 -7.419 14.987 -3.853 192 HG2 ARG 26 HG2 ARG 26 -9.632 14.722 -2.845 193 HG3 ARG 26 HG3 ARG 26 -8.601 13.347 -2.462 194 HD2 ARG 26 HD2 ARG 26 -8.176 14.369 -0.205 195 HD3 ARG 26 HD3 ARG 26 -9.333 15.645 -0.610 196 HE ARG 26 HE ARG 26 -9.965 12.777 -0.249 197 HH11 ARG 26 HH11 ARG 26 -11.056 16.049 -0.357 198 HH12 ARG 26 HH12 ARG 26 -12.649 15.642 0.174 199 HH21 ARG 26 HH21 ARG 26 -12.015 12.288 0.426 200 HH22 ARG 26 HH22 ARG 26 -13.182 13.551 0.597 201 H VAL 27 H VAL 27 -5.315 13.317 -3.949 202 HA VAL 27 HA VAL 27 -5.862 10.746 -2.774 203 HB VAL 27 HB VAL 27 -3.954 11.238 -5.103 204 HG11 VAL 27 HG11 VAL 27 -3.933 8.937 -4.213 205 HG12 VAL 27 HG12 VAL 27 -4.647 8.967 -5.826 206 HG13 VAL 27 HG13 VAL 27 -5.687 8.828 -4.405 207 HG21 VAL 27 HG21 VAL 27 -6.984 10.990 -5.255 208 HG22 VAL 27 HG22 VAL 27 -5.892 10.988 -6.639 209 HG23 VAL 27 HG23 VAL 27 -6.033 12.427 -5.634 210 H TRP 28 H TRP 28 -3.031 12.850 -2.921 211 HA TRP 28 HA TRP 28 -1.111 11.097 -1.769 212 HB2 TRP 28 HB2 TRP 28 -0.512 13.148 -3.018 213 HB3 TRP 28 HB3 TRP 28 -1.221 14.139 -1.756 214 HD1 TRP 28 HD1 TRP 28 0.366 14.797 0.230 215 HE1 TRP 28 HE1 TRP 28 2.798 14.268 0.845 216 HE3 TRP 28 HE3 TRP 28 1.258 11.101 -3.174 217 HZ2 TRP 28 HZ2 TRP 28 4.842 12.514 -0.023 218 HZ3 TRP 28 HZ3 TRP 28 3.479 10.058 -3.231 219 HH2 TRP 28 HH2 TRP 28 5.238 10.753 -1.684 220 H ALA 29 H ALA 29 -3.520 13.265 -0.368 221 HA ALA 29 HA ALA 29 -2.608 13.507 2.267 222 HB1 ALA 29 HB1 ALA 29 -4.917 14.127 2.825 223 HB2 ALA 29 HB2 ALA 29 -5.476 13.456 1.289 224 HB3 ALA 29 HB3 ALA 29 -4.417 14.865 1.300 225 H ILE 30 H ILE 30 -4.218 10.785 0.742 226 HA ILE 30 HA ILE 30 -5.059 9.405 3.128 227 HB ILE 30 HB ILE 30 -5.700 7.587 1.750 228 HG12 ILE 30 HG12 ILE 30 -3.699 8.574 -0.332 229 HG13 ILE 30 HG13 ILE 30 -3.574 7.104 0.615 230 HG21 ILE 30 HG21 ILE 30 -6.915 8.614 -0.129 231 HG22 ILE 30 HG22 ILE 30 -5.894 10.051 -0.023 232 HG23 ILE 30 HG23 ILE 30 -6.986 9.644 1.304 233 HD11 ILE 30 HD11 ILE 30 -4.181 6.554 -1.608 234 HD12 ILE 30 HD12 ILE 30 -5.528 7.691 -1.591 235 HD13 ILE 30 HD13 ILE 30 -5.580 6.246 -0.573 236 H TRP 31 H TRP 31 -2.056 9.595 1.359 237 HA TRP 31 HA TRP 31 -0.734 7.442 2.855 238 HB2 TRP 31 HB2 TRP 31 0.342 9.420 0.778 239 HB3 TRP 31 HB3 TRP 31 1.248 8.067 1.453 240 HD1 TRP 31 HD1 TRP 31 -1.073 8.889 -1.383 241 HE1 TRP 31 HE1 TRP 31 -1.713 6.734 -2.639 242 HE3 TRP 31 HE3 TRP 31 0.731 5.446 1.942 243 HZ2 TRP 31 HZ2 TRP 31 -1.470 3.941 -2.267 244 HZ3 TRP 31 HZ3 TRP 31 0.502 3.058 1.420 245 HH2 TRP 31 HH2 TRP 31 -0.588 2.313 -0.633 246 H GLU 32 H GLU 32 -0.910 10.930 2.703 247 HA GLU 32 HA GLU 32 1.474 11.530 4.157 248 HB2 GLU 32 HB2 GLU 32 0.599 12.982 2.379 249 HB3 GLU 32 HB3 GLU 32 -0.893 13.234 3.277 250 HG2 GLU 32 HG2 GLU 32 0.281 14.513 4.974 251 HG3 GLU 32 HG3 GLU 32 1.837 14.138 4.233 252 H ASP 33 H ASP 33 -1.930 11.200 5.012 253 HA ASP 33 HA ASP 33 -1.376 12.069 7.789 254 HB2 ASP 33 HB2 ASP 33 -3.134 13.306 6.371 255 HB3 ASP 33 HB3 ASP 33 -4.126 11.860 6.504 256 HA PRO 34 HA PRO 34 -1.796 7.699 8.942 257 HB2 PRO 34 HB2 PRO 34 -2.135 8.092 11.679 258 HB3 PRO 34 HB3 PRO 34 -0.575 8.090 10.851 259 HG2 PRO 34 HG2 PRO 34 -2.307 10.438 11.624 260 HG3 PRO 34 HG3 PRO 34 -0.551 10.235 11.828 261 HD2 PRO 34 HD2 PRO 34 -1.524 11.703 9.812 262 HD3 PRO 34 HD3 PRO 34 -0.118 10.647 9.545 263 H ARG 35 H ARG 35 -4.249 10.102 10.008 264 HA ARG 35 HA ARG 35 -6.263 8.180 10.751 265 HB2 ARG 35 HB2 ARG 35 -6.313 11.151 10.215 266 HB3 ARG 35 HB3 ARG 35 -7.832 10.287 10.343 267 HG2 ARG 35 HG2 ARG 35 -7.283 11.365 12.449 268 HG3 ARG 35 HG3 ARG 35 -7.295 9.614 12.642 269 HD2 ARG 35 HD2 ARG 35 -4.694 11.078 12.156 270 HD3 ARG 35 HD3 ARG 35 -5.406 11.031 13.772 271 HE ARG 35 HE ARG 35 -5.164 8.423 12.573 272 HH11 ARG 35 HH11 ARG 35 -3.376 10.808 14.348 273 HH12 ARG 35 HH12 ARG 35 -2.286 9.637 15.000 274 HH21 ARG 35 HH21 ARG 35 -3.758 6.972 13.445 275 HH22 ARG 35 HH22 ARG 35 -2.503 7.513 14.511 276 H GLN 36 H GLN 36 -5.726 10.123 7.804 277 HA GLN 36 HA GLN 36 -7.936 9.048 6.320 278 HB2 GLN 36 HB2 GLN 36 -5.430 10.399 5.203 279 HB3 GLN 36 HB3 GLN 36 -7.004 10.250 4.417 280 HG2 GLN 36 HG2 GLN 36 -7.945 11.643 6.327 281 HG3 GLN 36 HG3 GLN 36 -6.284 11.944 6.823 282 HE21 GLN 36 HE21 GLN 36 -8.735 12.606 4.451 283 HE22 GLN 36 HE22 GLN 36 -7.909 13.900 3.661 284 H LEU 37 H LEU 37 -4.662 7.966 6.880 285 HA LEU 37 HA LEU 37 -4.531 6.017 4.760 286 HB2 LEU 37 HB2 LEU 37 -2.513 6.987 5.744 287 HB3 LEU 37 HB3 LEU 37 -2.929 6.338 7.320 288 HG LEU 37 HG LEU 37 -2.594 4.022 6.446 289 HD11 LEU 37 HD11 LEU 37 -1.620 5.339 3.892 290 HD12 LEU 37 HD12 LEU 37 -3.094 4.377 4.065 291 HD13 LEU 37 HD13 LEU 37 -1.513 3.616 4.289 292 HD21 LEU 37 HD21 LEU 37 -0.778 5.173 7.590 293 HD22 LEU 37 HD22 LEU 37 -0.224 5.869 6.062 294 HD23 LEU 37 HD23 LEU 37 -0.152 4.121 6.319 295 H GLU 38 H GLU 38 -5.095 5.777 8.301 296 HA GLU 38 HA GLU 38 -5.438 2.940 8.341 297 HB2 GLU 38 HB2 GLU 38 -6.106 3.194 10.664 298 HB3 GLU 38 HB3 GLU 38 -4.749 4.264 10.333 299 HG2 GLU 38 HG2 GLU 38 -6.346 6.172 10.134 300 HG3 GLU 38 HG3 GLU 38 -7.663 5.080 10.567 301 H ARG 39 H ARG 39 -7.563 5.509 7.495 302 HA ARG 39 HA ARG 39 -10.111 4.490 7.933 303 HB2 ARG 39 HB2 ARG 39 -9.520 6.790 7.034 304 HB3 ARG 39 HB3 ARG 39 -9.161 6.044 5.479 305 HG2 ARG 39 HG2 ARG 39 -11.599 5.136 5.596 306 HG3 ARG 39 HG3 ARG 39 -11.818 6.338 6.851 307 HD2 ARG 39 HD2 ARG 39 -10.853 7.012 4.076 308 HD3 ARG 39 HD3 ARG 39 -12.546 6.992 4.516 309 HE ARG 39 HE ARG 39 -10.807 8.767 6.056 310 HH11 ARG 39 HH11 ARG 39 -13.195 8.445 3.535 311 HH12 ARG 39 HH12 ARG 39 -13.444 10.150 3.434 312 HH21 ARG 39 HH21 ARG 39 -11.184 10.954 5.842 313 HH22 ARG 39 HH22 ARG 39 -12.355 11.520 4.696 314 H TRP 40 H TRP 40 -7.705 3.535 5.530 315 HA TRP 40 HA TRP 40 -9.585 1.604 4.306 316 HB2 TRP 40 HB2 TRP 40 -8.729 2.172 2.068 317 HB3 TRP 40 HB3 TRP 40 -9.455 3.578 2.846 318 HD1 TRP 40 HD1 TRP 40 -7.753 5.543 3.677 319 HE1 TRP 40 HE1 TRP 40 -5.391 6.174 2.867 320 HE3 TRP 40 HE3 TRP 40 -6.538 1.230 1.230 321 HZ2 TRP 40 HZ2 TRP 40 -3.299 5.008 1.377 322 HZ3 TRP 40 HZ3 TRP 40 -4.346 1.057 0.136 323 HH2 TRP 40 HH2 TRP 40 -2.769 2.913 0.204 324 H TRP 41 H TRP 41 -6.514 2.030 5.717 325 HA TRP 41 HA TRP 41 -4.903 0.382 4.047 326 HB2 TRP 41 HB2 TRP 41 -4.061 2.096 5.739 327 HB3 TRP 41 HB3 TRP 41 -4.398 0.919 7.010 328 HD1 TRP 41 HD1 TRP 41 -2.294 -0.501 7.641 329 HE1 TRP 41 HE1 TRP 41 -0.104 -1.162 6.479 330 HE3 TRP 41 HE3 TRP 41 -3.139 1.538 3.011 331 HZ2 TRP 41 HZ2 TRP 41 1.100 -0.870 3.971 332 HZ3 TRP 41 HZ3 TRP 41 -1.429 1.273 1.293 333 HH2 TRP 41 HH2 TRP 41 0.661 0.091 1.751 334 H GLY 42 H GLY 42 -5.256 -1.703 3.682 335 HA2 GLY 42 HA2 GLY 42 -5.395 -4.011 4.243 336 HA3 GLY 42 HA3 GLY 42 -6.048 -3.593 5.817 337 HA PRO 43 HA PRO 43 -9.511 -4.668 2.634 338 HB2 PRO 43 HB2 PRO 43 -10.295 -7.094 3.697 339 HB3 PRO 43 HB3 PRO 43 -9.081 -6.945 2.418 340 HG2 PRO 43 HG2 PRO 43 -8.680 -7.268 5.389 341 HG3 PRO 43 HG3 PRO 43 -7.855 -8.104 4.055 342 HD2 PRO 43 HD2 PRO 43 -6.706 -6.018 5.347 343 HD3 PRO 43 HD3 PRO 43 -6.459 -6.272 3.605 344 HA PRO 44 HA PRO 44 -12.786 -2.897 5.136 345 HB2 PRO 44 HB2 PRO 44 -14.493 -5.259 4.300 346 HB3 PRO 44 HB3 PRO 44 -14.893 -3.531 4.306 347 HG2 PRO 44 HG2 PRO 44 -14.228 -4.712 2.024 348 HG3 PRO 44 HG3 PRO 44 -13.595 -3.093 2.392 349 HD2 PRO 44 HD2 PRO 44 -12.189 -5.748 2.484 350 HD3 PRO 44 HD3 PRO 44 -11.557 -4.153 2.026 351 H THR 45 H THR 45 -12.416 -6.422 5.636 352 HA THR 45 HA THR 45 -13.671 -6.376 8.277 353 HB THR 45 HB THR 45 -13.091 -8.835 8.337 354 HG1 THR 45 HG1 THR 45 -12.445 -8.852 5.636 355 HG21 THR 45 HG21 THR 45 -14.542 -7.929 5.819 356 HG22 THR 45 HG22 THR 45 -15.272 -8.122 7.415 357 HG23 THR 45 HG23 THR 45 -14.651 -9.531 6.552 358 H TRP 46 H TRP 46 -10.464 -5.909 7.102 359 HA TRP 46 HA TRP 46 -9.305 -6.219 9.829 360 HB2 TRP 46 HB2 TRP 46 -7.937 -6.646 7.136 361 HB3 TRP 46 HB3 TRP 46 -7.091 -6.620 8.675 362 HD1 TRP 46 HD1 TRP 46 -9.931 -8.728 7.000 363 HE1 TRP 46 HE1 TRP 46 -9.667 -11.160 7.788 364 HE3 TRP 46 HE3 TRP 46 -5.966 -8.153 10.168 365 HZ2 TRP 46 HZ2 TRP 46 -8.009 -12.650 9.488 366 HZ3 TRP 46 HZ3 TRP 46 -5.091 -10.138 11.326 367 HH2 TRP 46 HH2 TRP 46 -6.087 -12.344 10.994 368 HA PRO 47 HA PRO 47 -8.617 -1.694 8.779 369 HB2 PRO 47 HB2 PRO 47 -9.595 -1.106 11.499 370 HB3 PRO 47 HB3 PRO 47 -10.234 -0.555 9.949 371 HG2 PRO 47 HG2 PRO 47 -11.566 -2.326 11.545 372 HG3 PRO 47 HG3 PRO 47 -11.716 -2.330 9.775 373 HD2 PRO 47 HD2 PRO 47 -10.002 -4.094 11.536 374 HD3 PRO 47 HD3 PRO 47 -11.037 -4.541 10.158 375 H ALA 48 H ALA 48 -6.542 -0.993 9.076 376 HA ALA 48 HA ALA 48 -4.823 -2.093 11.141 377 HB1 ALA 48 HB1 ALA 48 -3.999 -1.758 8.850 378 HB2 ALA 48 HB2 ALA 48 -3.033 -0.851 10.018 379 HB3 ALA 48 HB3 ALA 48 -4.223 -0.015 9.013 380 H THR 49 H THR 49 -4.525 -1.215 13.098 381 HA THR 49 HA THR 49 -5.310 1.548 13.730 382 HB THR 49 HB THR 49 -4.459 -0.703 15.615 383 HG1 THR 49 HG1 THR 49 -7.097 0.244 15.053 384 HG21 THR 49 HG21 THR 49 -4.144 1.534 16.630 385 HG22 THR 49 HG22 THR 49 -5.483 0.682 17.402 386 HG23 THR 49 HG23 THR 49 -5.812 1.960 16.229 387 H PHE 50 H PHE 50 -3.702 3.044 13.451 388 HA PHE 50 HA PHE 50 -0.905 2.228 13.390 389 HB2 PHE 50 HB2 PHE 50 -2.379 4.720 12.511 390 HB3 PHE 50 HB3 PHE 50 -0.632 4.784 12.740 391 HD1 PHE 50 HD1 PHE 50 -3.326 3.010 10.856 392 HD2 PHE 50 HD2 PHE 50 0.856 3.875 11.112 393 HE1 PHE 50 HE1 PHE 50 -2.969 1.966 8.660 394 HE2 PHE 50 HE2 PHE 50 1.201 2.833 8.914 395 HZ PHE 50 HZ PHE 50 -0.708 1.878 7.688 396 H GLU 51 H GLU 51 0.004 1.979 15.270 397 HA GLU 51 HA GLU 51 -0.277 3.513 17.642 398 HB2 GLU 51 HB2 GLU 51 2.070 1.834 16.649 399 HB3 GLU 51 HB3 GLU 51 1.798 2.322 18.324 400 HG2 GLU 51 HG2 GLU 51 -0.103 0.899 18.534 401 HG3 GLU 51 HG3 GLU 51 -0.214 0.637 16.797 402 H THR 52 H THR 52 1.956 3.708 14.882 403 HA THR 52 HA THR 52 2.322 6.566 15.322 404 HB THR 52 HB THR 52 4.239 5.580 16.594 405 HG1 THR 52 HG1 THR 52 5.895 6.711 15.066 406 HG21 THR 52 HG21 THR 52 6.096 4.490 15.419 407 HG22 THR 52 HG22 THR 52 5.189 4.532 13.906 408 HG23 THR 52 HG23 THR 52 4.622 3.534 15.247 409 H HIS 53 H HIS 53 3.268 7.647 13.460 410 HA HIS 53 HA HIS 53 3.772 6.211 10.988 411 HB2 HIS 53 HB2 HIS 53 1.316 6.357 10.951 412 HB3 HIS 53 HB3 HIS 53 1.379 8.085 11.260 413 HD2 HIS 53 HD2 HIS 53 2.072 5.576 8.301 414 HE1 HIS 53 HE1 HIS 53 1.597 9.501 6.797 415 HE2 HIS 53 HE2 HIS 53 1.649 7.047 6.209 416 H GLU 54 H GLU 54 5.805 7.135 10.995 417 HA GLU 54 HA GLU 54 6.166 10.048 11.065 418 HB2 GLU 54 HB2 GLU 54 8.297 7.916 10.564 419 HB3 GLU 54 HB3 GLU 54 8.563 9.610 10.987 420 HG2 GLU 54 HG2 GLU 54 7.589 9.190 13.207 421 HG3 GLU 54 HG3 GLU 54 7.320 7.507 12.769 422 H PHE 55 H PHE 55 5.111 10.696 9.094 423 HA PHE 55 HA PHE 55 5.859 9.559 6.564 424 HB2 PHE 55 HB2 PHE 55 3.592 10.643 7.167 425 HB3 PHE 55 HB3 PHE 55 4.394 12.198 6.962 426 HD1 PHE 55 HD1 PHE 55 3.798 8.967 5.198 427 HD2 PHE 55 HD2 PHE 55 4.445 13.164 4.774 428 HE1 PHE 55 HE1 PHE 55 3.398 8.777 2.777 429 HE2 PHE 55 HE2 PHE 55 4.030 12.974 2.350 430 HZ PHE 55 HZ PHE 55 3.508 10.779 1.356 431 H THR 56 H THR 56 8.201 9.886 7.179 432 HA THR 56 HA THR 56 9.227 12.233 5.709 433 HB THR 56 HB THR 56 9.548 12.808 8.078 434 HG1 THR 56 HG1 THR 56 11.940 12.901 8.022 435 HG21 THR 56 HG21 THR 56 10.979 11.450 9.571 436 HG22 THR 56 HG22 THR 56 11.114 10.214 8.321 437 HG23 THR 56 HG23 THR 56 9.548 10.544 9.065 438 H VAL 57 H VAL 57 11.501 11.871 4.945 439 HA VAL 57 HA VAL 57 11.805 9.344 3.634 440 HB VAL 57 HB VAL 57 13.770 11.675 3.890 441 HG11 VAL 57 HG11 VAL 57 14.940 9.606 3.229 442 HG12 VAL 57 HG12 VAL 57 14.890 10.744 1.882 443 HG13 VAL 57 HG13 VAL 57 13.792 9.361 1.911 444 HG21 VAL 57 HG21 VAL 57 11.648 12.368 2.829 445 HG22 VAL 57 HG22 VAL 57 11.778 11.047 1.664 446 HG23 VAL 57 HG23 VAL 57 12.956 12.362 1.642 447 H GLY 58 H GLY 58 12.516 7.524 4.606 448 HA2 GLY 58 HA2 GLY 58 14.013 6.135 5.770 449 HA3 GLY 58 HA3 GLY 58 14.751 7.540 6.521 450 H GLY 59 H GLY 59 11.492 7.975 6.862 451 HA2 GLY 59 HA2 GLY 59 11.510 7.239 9.687 452 HA3 GLY 59 HA3 GLY 59 10.272 8.154 8.842 453 H LYS 60 H LYS 60 9.548 6.180 10.669 454 HA LYS 60 HA LYS 60 8.595 3.941 8.972 455 HB2 LYS 60 HB2 LYS 60 9.683 3.691 11.806 456 HB3 LYS 60 HB3 LYS 60 8.959 2.384 10.867 457 HG2 LYS 60 HG2 LYS 60 10.810 2.713 9.167 458 HG3 LYS 60 HG3 LYS 60 11.562 3.838 10.300 459 HD2 LYS 60 HD2 LYS 60 12.610 1.657 10.526 460 HD3 LYS 60 HD3 LYS 60 11.688 2.004 11.991 461 HE2 LYS 60 HE2 LYS 60 9.860 0.543 11.177 462 HE3 LYS 60 HE3 LYS 60 10.777 0.203 9.705 463 HZ1 LYS 60 HZ1 LYS 60 10.986 -1.552 11.356 464 HZ2 LYS 60 HZ2 LYS 60 11.654 -0.461 12.464 465 HZ3 LYS 60 HZ3 LYS 60 12.484 -0.832 11.037 466 H ALA 61 H ALA 61 6.844 2.663 9.976 467 HA ALA 61 HA ALA 61 5.021 4.171 11.739 468 HB1 ALA 61 HB1 ALA 61 4.177 2.971 9.074 469 HB2 ALA 61 HB2 ALA 61 4.324 4.690 9.432 470 HB3 ALA 61 HB3 ALA 61 3.100 3.724 10.257 471 H ALA 62 H ALA 62 3.872 2.894 13.138 472 HA ALA 62 HA ALA 62 4.197 -0.062 12.966 473 HB1 ALA 62 HB1 ALA 62 3.940 1.669 15.462 474 HB2 ALA 62 HB2 ALA 62 5.395 0.835 14.911 475 HB3 ALA 62 HB3 ALA 62 3.993 -0.100 15.444 476 H TYR 63 H TYR 63 2.356 -1.264 12.995 477 HA TYR 63 HA TYR 63 -0.190 -0.241 13.914 478 HB2 TYR 63 HB2 TYR 63 -1.362 -0.449 11.731 479 HB3 TYR 63 HB3 TYR 63 -0.125 0.797 11.681 480 HD1 TYR 63 HD1 TYR 63 1.998 0.410 10.393 481 HD2 TYR 63 HD2 TYR 63 -1.204 -2.424 10.284 482 HE1 TYR 63 HE1 TYR 63 2.978 -0.625 8.399 483 HE2 TYR 63 HE2 TYR 63 -0.213 -3.458 8.286 484 HH TYR 63 HH TYR 63 2.961 -2.733 7.203 485 H TYR 64 H TYR 64 -1.969 -1.830 13.491 486 HA TYR 64 HA TYR 64 -1.254 -4.544 12.750 487 HB2 TYR 64 HB2 TYR 64 -2.188 -5.543 14.873 488 HB3 TYR 64 HB3 TYR 64 -0.688 -4.661 15.113 489 HD1 TYR 64 HD2 TYR 64 -0.744 -2.360 16.215 490 HD2 TYR 64 HD1 TYR 64 -4.216 -4.862 16.014 491 HE1 TYR 64 HE2 TYR 64 -1.817 -1.028 17.980 492 HE2 TYR 64 HE1 TYR 64 -5.283 -3.525 17.773 493 HH TYR 64 HH TYR 64 -4.070 -0.510 18.799 494 H MET 65 H MET 65 -2.964 -5.571 11.794 495 HA MET 65 HA MET 65 -5.424 -4.046 11.383 496 HB2 MET 65 HB2 MET 65 -4.441 -6.620 10.087 497 HB3 MET 65 HB3 MET 65 -5.908 -5.759 9.634 498 HG2 MET 65 HG2 MET 65 -4.542 -3.812 8.964 499 HG3 MET 65 HG3 MET 65 -3.078 -4.708 9.376 500 HE1 MET 65 HE1 MET 65 -3.228 -7.634 6.700 501 HE2 MET 65 HE2 MET 65 -3.931 -7.696 8.314 502 HE3 MET 65 HE3 MET 65 -2.336 -6.980 8.073 503 H THR 66 H THR 66 -6.989 -4.332 12.892 504 HA THR 66 HA THR 66 -7.239 -6.708 14.506 505 HB THR 66 HB THR 66 -9.197 -4.376 14.232 506 HG1 THR 66 HG1 THR 66 -7.458 -3.463 15.147 507 HG21 THR 66 HG21 THR 66 -8.983 -6.510 16.405 508 HG22 THR 66 HG22 THR 66 -10.288 -6.375 15.223 509 HG23 THR 66 HG23 THR 66 -10.068 -5.117 16.440 510 H GLY 67 H GLY 67 -7.977 -8.554 13.627 511 HA2 GLY 67 HA2 GLY 67 -9.495 -8.735 11.221 512 HA3 GLY 67 HA3 GLY 67 -9.054 -10.061 12.277 513 HA PRO 68 HA PRO 68 -13.773 -9.025 12.405 514 HB2 PRO 68 HB2 PRO 68 -14.679 -11.356 11.212 515 HB3 PRO 68 HB3 PRO 68 -14.315 -9.876 10.309 516 HG2 PRO 68 HG2 PRO 68 -12.560 -12.301 10.758 517 HG3 PRO 68 HG3 PRO 68 -12.894 -11.436 9.240 518 HD2 PRO 68 HD2 PRO 68 -10.622 -10.982 10.590 519 HD3 PRO 68 HD3 PRO 68 -11.482 -9.637 9.804 520 H ASP 69 H ASP 69 -11.852 -11.911 13.066 521 HA ASP 69 HA ASP 69 -13.640 -12.866 15.192 522 HB2 ASP 69 HB2 ASP 69 -10.978 -14.071 14.349 523 HB3 ASP 69 HB3 ASP 69 -12.307 -14.865 15.192 524 H GLY 70 H GLY 70 -11.336 -10.540 15.031 525 HA2 GLY 70 HA2 GLY 70 -10.508 -9.306 16.865 526 HA3 GLY 70 HA3 GLY 70 -10.579 -10.740 17.876 527 H THR 71 H THR 71 -9.189 -11.789 15.081 528 HA THR 71 HA THR 71 -6.568 -12.061 16.153 529 HB THR 71 HB THR 71 -7.483 -12.489 13.264 530 HG1 THR 71 HG1 THR 71 -7.722 -14.663 13.938 531 HG21 THR 71 HG21 THR 71 -5.027 -13.576 14.715 532 HG22 THR 71 HG22 THR 71 -5.012 -12.375 13.420 533 HG23 THR 71 HG23 THR 71 -5.539 -14.026 13.086 534 H LYS 72 H LYS 72 -5.376 -10.231 16.481 535 HA LYS 72 HA LYS 72 -5.278 -8.037 14.561 536 HB2 LYS 72 HB2 LYS 72 -3.818 -8.493 17.198 537 HB3 LYS 72 HB3 LYS 72 -3.707 -7.014 16.242 538 HG2 LYS 72 HG2 LYS 72 -6.041 -6.512 16.607 539 HG3 LYS 72 HG3 LYS 72 -6.325 -8.091 17.345 540 HD2 LYS 72 HD2 LYS 72 -4.845 -7.479 19.229 541 HD3 LYS 72 HD3 LYS 72 -4.544 -5.903 18.492 542 HE2 LYS 72 HE2 LYS 72 -6.872 -5.263 18.794 543 HE3 LYS 72 HE3 LYS 72 -7.289 -6.882 19.356 544 HZ1 LYS 72 HZ1 LYS 72 -5.476 -4.982 20.736 545 HZ2 LYS 72 HZ2 LYS 72 -5.854 -6.539 21.274 546 HZ3 LYS 72 HZ3 LYS 72 -7.060 -5.357 21.197 547 H ALA 73 H ALA 73 -4.022 -8.208 12.793 548 HA ALA 73 HA ALA 73 -1.589 -9.877 12.778 549 HB1 ALA 73 HB1 ALA 73 -3.040 -8.539 10.463 550 HB2 ALA 73 HB2 ALA 73 -3.172 -10.235 10.933 551 HB3 ALA 73 HB3 ALA 73 -1.637 -9.608 10.328 552 H ARG 74 H ARG 74 0.046 -8.725 13.674 553 HA ARG 74 HA ARG 74 0.335 -5.892 13.482 554 HB2 ARG 74 HB2 ARG 74 1.131 -6.991 15.451 555 HB3 ARG 74 HB3 ARG 74 2.152 -8.083 14.533 556 HG2 ARG 74 HG2 ARG 74 3.759 -6.398 14.089 557 HG3 ARG 74 HG3 ARG 74 2.647 -5.098 14.527 558 HD2 ARG 74 HD2 ARG 74 3.750 -7.143 16.488 559 HD3 ARG 74 HD3 ARG 74 4.435 -5.533 16.235 560 HE ARG 74 HE ARG 74 1.944 -6.190 17.586 561 HH11 ARG 74 HH11 ARG 74 3.995 -3.676 16.393 562 HH12 ARG 74 HH12 ARG 74 3.096 -2.430 17.174 563 HH21 ARG 74 HH21 ARG 74 0.842 -4.569 18.618 564 HH22 ARG 74 HH22 ARG 74 1.365 -2.926 18.439 565 H GLY 75 H GLY 75 1.447 -4.669 12.086 566 HA2 GLY 75 HA2 GLY 75 3.347 -5.911 10.177 567 HA3 GLY 75 HA3 GLY 75 2.099 -4.793 9.637 568 H TRP 76 H TRP 76 5.091 -4.694 9.621 569 HA TRP 76 HA TRP 76 5.507 -2.100 10.993 570 HB2 TRP 76 HB2 TRP 76 7.917 -2.438 10.637 571 HB3 TRP 76 HB3 TRP 76 7.240 -3.840 11.455 572 HD1 TRP 76 HD1 TRP 76 7.108 -6.151 10.022 573 HE1 TRP 76 HE1 TRP 76 8.387 -6.949 7.950 574 HE3 TRP 76 HE3 TRP 76 9.039 -1.661 8.477 575 HZ2 TRP 76 HZ2 TRP 76 9.995 -5.841 5.925 576 HZ3 TRP 76 HZ3 TRP 76 10.448 -1.628 6.452 577 HH2 TRP 76 HH2 TRP 76 10.915 -3.675 5.208 578 H TRP 77 H TRP 77 6.364 -0.347 9.726 579 HA TRP 77 HA TRP 77 6.323 -0.615 6.780 580 HB2 TRP 77 HB2 TRP 77 4.173 0.451 8.193 581 HB3 TRP 77 HB3 TRP 77 5.107 1.901 7.871 582 HD1 TRP 77 HD1 TRP 77 4.809 -0.951 5.273 583 HE1 TRP 77 HE1 TRP 77 3.473 -0.066 3.268 584 HE3 TRP 77 HE3 TRP 77 3.401 3.580 7.166 585 HZ2 TRP 77 HZ2 TRP 77 2.006 2.247 2.577 586 HZ3 TRP 77 HZ3 TRP 77 2.026 5.061 5.770 587 HH2 TRP 77 HH2 TRP 77 1.340 4.411 3.524 588 H GLN 78 H GLN 78 7.718 0.868 5.675 589 HA GLN 78 HA GLN 78 9.096 2.952 7.186 590 HB2 GLN 78 HB2 GLN 78 10.505 1.015 7.689 591 HB3 GLN 78 HB3 GLN 78 10.667 0.633 5.975 592 HG2 GLN 78 HG2 GLN 78 12.021 2.560 5.571 593 HG3 GLN 78 HG3 GLN 78 11.602 3.278 7.125 594 HE21 GLN 78 HE21 GLN 78 13.773 3.515 7.687 595 HE22 GLN 78 HE22 GLN 78 14.771 2.182 8.132 596 H PHE 79 H PHE 79 9.059 4.679 5.956 597 HA PHE 79 HA PHE 79 8.761 4.659 3.089 598 HB2 PHE 79 HB2 PHE 79 9.328 7.006 4.952 599 HB3 PHE 79 HB3 PHE 79 8.778 7.113 3.282 600 HD1 PHE 79 HD2 PHE 79 6.458 6.305 2.685 601 HD2 PHE 79 HD1 PHE 79 7.770 6.666 6.739 602 HE1 PHE 79 HE2 PHE 79 4.125 6.298 3.449 603 HE2 PHE 79 HE1 PHE 79 5.431 6.651 7.493 604 HZ PHE 79 HZ PHE 79 3.613 6.476 5.851 605 H THR 80 H THR 80 10.333 4.835 1.571 606 HA THR 80 HA THR 80 13.139 5.292 2.388 607 HB THR 80 HB THR 80 13.781 4.262 0.253 608 HG1 THR 80 HG1 THR 80 12.352 4.468 -1.296 609 HG21 THR 80 HG21 THR 80 12.894 1.968 0.592 610 HG22 THR 80 HG22 THR 80 11.673 2.604 1.697 611 HG23 THR 80 HG23 THR 80 13.385 2.707 2.122 612 H THR 81 H THR 81 10.676 6.435 0.058 613 HA THR 81 HA THR 81 12.341 8.796 -0.608 614 HB THR 81 HB THR 81 10.984 7.074 -2.744 615 HG1 THR 81 HG1 THR 81 13.083 6.460 -3.328 616 HG21 THR 81 HG21 THR 81 11.114 9.462 -3.386 617 HG22 THR 81 HG22 THR 81 12.206 8.479 -4.363 618 HG23 THR 81 HG23 THR 81 12.849 9.461 -3.045 619 H ILE 82 H ILE 82 10.987 10.318 0.319 620 HA ILE 82 HA ILE 82 8.200 10.510 -0.712 621 HB ILE 82 HB ILE 82 9.313 11.763 1.847 622 HG12 ILE 82 HG12 ILE 82 7.524 9.327 1.439 623 HG13 ILE 82 HG13 ILE 82 9.113 9.360 2.189 624 HG21 ILE 82 HG21 ILE 82 7.530 13.137 0.825 625 HG22 ILE 82 HG22 ILE 82 6.971 12.407 2.328 626 HG23 ILE 82 HG23 ILE 82 6.455 11.735 0.779 627 HD11 ILE 82 HD11 ILE 82 6.557 10.515 3.300 628 HD12 ILE 82 HD12 ILE 82 8.145 10.677 4.053 629 HD13 ILE 82 HD13 ILE 82 7.420 9.083 3.856 630 H GLU 83 H GLU 83 8.502 11.695 -2.551 631 HA GLU 83 HA GLU 83 10.112 14.158 -2.522 632 HB2 GLU 83 HB2 GLU 83 8.699 12.730 -4.822 633 HB3 GLU 83 HB3 GLU 83 9.718 14.163 -4.986 634 HG2 GLU 83 HG2 GLU 83 11.645 12.881 -4.107 635 HG3 GLU 83 HG3 GLU 83 10.630 11.447 -3.971 636 H ALA 84 H ALA 84 6.775 13.119 -3.250 637 HA ALA 84 HA ALA 84 4.751 14.039 -2.931 638 HB1 ALA 84 HB1 ALA 84 4.427 15.849 -1.304 639 HB2 ALA 84 HB2 ALA 84 6.157 16.201 -1.329 640 HB3 ALA 84 HB3 ALA 84 5.580 14.661 -0.695 641 HA PRO 85 HA PRO 85 2.844 15.027 -2.885 642 HB2 PRO 85 HB2 PRO 85 0.671 15.915 -4.126 643 HB3 PRO 85 HB3 PRO 85 1.668 17.056 -3.205 644 HG2 PRO 85 HG2 PRO 85 1.625 16.560 -6.190 645 HG3 PRO 85 HG3 PRO 85 1.602 18.112 -5.330 646 HD2 PRO 85 HD2 PRO 85 3.908 16.911 -6.362 647 HD3 PRO 85 HD3 PRO 85 3.910 18.111 -5.049 648 H ASP 86 H ASP 86 4.283 14.017 -5.545 649 HA ASP 86 HA ASP 86 2.122 12.277 -6.589 650 HB2 ASP 86 HB2 ASP 86 3.287 12.303 -8.746 651 HB3 ASP 86 HB3 ASP 86 2.962 13.946 -8.211 652 H HIS 87 H HIS 87 5.664 12.272 -5.934 653 HA HIS 87 HA HIS 87 5.782 9.378 -6.445 654 HB2 HIS 87 HB2 HIS 87 7.386 10.974 -7.549 655 HB3 HIS 87 HB3 HIS 87 8.069 11.337 -5.972 656 HD1 HIS 87 HD1 HIS 87 9.988 10.373 -7.978 657 HD2 HIS 87 HD2 HIS 87 7.866 7.683 -5.620 658 HE1 HIS 87 HE1 HIS 87 11.338 8.262 -7.987 659 HE2 HIS 87 HE2 HIS 87 10.157 6.749 -6.371 660 H LEU 88 H LEU 88 5.630 8.011 -4.852 661 HA LEU 88 HA LEU 88 6.893 8.473 -2.222 662 HB2 LEU 88 HB2 LEU 88 4.440 8.728 -1.998 663 HB3 LEU 88 HB3 LEU 88 4.186 7.168 -2.744 664 HG LEU 88 HG LEU 88 5.259 6.061 -0.797 665 HD11 LEU 88 HD11 LEU 88 6.801 7.825 -0.097 666 HD12 LEU 88 HD12 LEU 88 5.776 7.323 1.245 667 HD13 LEU 88 HD13 LEU 88 5.445 8.840 0.406 668 HD21 LEU 88 HD21 LEU 88 3.478 6.476 0.841 669 HD22 LEU 88 HD22 LEU 88 2.837 6.346 -0.795 670 HD23 LEU 88 HD23 LEU 88 2.999 7.932 -0.035 671 H GLU 89 H GLU 89 8.128 6.769 -1.552 672 HA GLU 89 HA GLU 89 7.628 4.054 -2.574 673 HB2 GLU 89 HB2 GLU 89 10.372 5.382 -2.406 674 HB3 GLU 89 HB3 GLU 89 10.137 3.648 -2.595 675 HG2 GLU 89 HG2 GLU 89 8.949 4.081 -4.743 676 HG3 GLU 89 HG3 GLU 89 9.293 5.801 -4.556 677 H PHE 90 H PHE 90 7.914 2.480 -1.097 678 HA PHE 90 HA PHE 90 9.170 2.839 1.469 679 HB2 PHE 90 HB2 PHE 90 7.092 2.374 2.815 680 HB3 PHE 90 HB3 PHE 90 7.065 3.941 2.022 681 HD1 PHE 90 HD2 PHE 90 5.673 0.481 1.879 682 HD2 PHE 90 HD1 PHE 90 5.334 4.501 0.466 683 HE1 PHE 90 HE2 PHE 90 3.479 -0.034 0.901 684 HE2 PHE 90 HE1 PHE 90 3.146 3.968 -0.504 685 HZ PHE 90 HZ PHE 90 2.216 1.703 -0.294 686 H ASP 91 H ASP 91 8.672 0.832 2.864 687 HA ASP 91 HA ASP 91 8.494 -1.597 1.189 688 HB2 ASP 91 HB2 ASP 91 9.942 -1.181 3.839 689 HB3 ASP 91 HB3 ASP 91 9.796 -2.729 3.000 690 H ASP 92 H ASP 92 6.650 -2.650 1.401 691 HA ASP 92 HA ASP 92 4.704 -2.196 3.441 692 HB2 ASP 92 HB2 ASP 92 4.762 -4.685 1.680 693 HB3 ASP 92 HB3 ASP 92 3.362 -3.853 2.347 694 H GLY 93 H GLY 93 6.352 -5.233 2.586 695 HA2 GLY 93 HA2 GLY 93 7.035 -7.059 3.767 696 HA3 GLY 93 HA3 GLY 93 7.438 -5.938 5.057 697 H PHE 94 H PHE 94 6.821 -8.043 6.208 698 HA PHE 94 HA PHE 94 4.192 -7.532 7.420 699 HB2 PHE 94 HB2 PHE 94 5.106 -10.247 6.385 700 HB3 PHE 94 HB3 PHE 94 3.961 -10.131 7.711 701 HD1 PHE 94 HD2 PHE 94 1.741 -8.978 7.331 702 HD2 PHE 94 HD1 PHE 94 4.353 -10.017 4.110 703 HE1 PHE 94 HE2 PHE 94 -0.136 -8.804 5.748 704 HE2 PHE 94 HE1 PHE 94 2.470 -9.834 2.534 705 HZ PHE 94 HZ PHE 94 0.229 -9.231 3.351 706 H ALA 95 H ALA 95 4.111 -8.024 9.623 707 HA ALA 95 HA ALA 95 6.614 -8.940 10.941 708 HB1 ALA 95 HB1 ALA 95 4.576 -6.950 12.009 709 HB2 ALA 95 HB2 ALA 95 6.173 -6.546 11.373 710 HB3 ALA 95 HB3 ALA 95 6.028 -7.508 12.845 711 H ASP 96 H ASP 96 6.259 -10.106 12.972 712 HA ASP 96 HA ASP 96 3.777 -11.705 13.005 713 HB2 ASP 96 HB2 ASP 96 4.990 -13.281 14.347 714 HB3 ASP 96 HB3 ASP 96 6.097 -12.775 13.073 715 H GLU 97 H GLU 97 3.562 -12.358 15.697 716 HA GLU 97 HA GLU 97 2.084 -10.249 16.808 717 HB2 GLU 97 HB2 GLU 97 1.958 -11.636 18.851 718 HB3 GLU 97 HB3 GLU 97 1.693 -12.586 17.393 719 HG2 GLU 97 HG2 GLU 97 4.039 -13.421 17.523 720 HG3 GLU 97 HG3 GLU 97 4.267 -12.493 19.009 721 H HIS 98 H HIS 98 5.503 -10.942 17.119 722 HA HIS 98 HA HIS 98 5.910 -9.156 19.403 723 HB2 HIS 98 HB2 HIS 98 7.963 -10.719 17.772 724 HB3 HIS 98 HB3 HIS 98 8.276 -9.881 19.293 725 HD1 HIS 98 HD1 HIS 98 6.592 -10.852 21.336 726 HD2 HIS 98 HD2 HIS 98 7.478 -13.357 18.147 727 HE1 HIS 98 HE1 HIS 98 6.017 -13.165 22.121 728 HE2 HIS 98 HE2 HIS 98 6.618 -14.671 20.201 729 H GLY 99 H GLY 99 6.095 -8.950 15.932 730 HA2 GLY 99 HA2 GLY 99 6.072 -6.817 14.852 731 HA3 GLY 99 HA3 GLY 99 7.029 -6.139 16.157 732 H ALA 100 H ALA 100 8.278 -9.138 15.214 733 HA ALA 100 HA ALA 100 10.557 -7.920 13.867 734 HB1 ALA 100 HB1 ALA 100 10.908 -9.736 15.484 735 HB2 ALA 100 HB2 ALA 100 11.495 -10.204 13.888 736 HB3 ALA 100 HB3 ALA 100 9.956 -10.835 14.484 737 HA PRO 101 HA PRO 101 8.996 -8.453 9.573 738 HB2 PRO 101 HB2 PRO 101 11.970 -8.910 9.170 739 HB3 PRO 101 HB3 PRO 101 10.839 -7.954 8.194 740 HG2 PRO 101 HG2 PRO 101 12.458 -6.712 9.889 741 HG3 PRO 101 HG3 PRO 101 10.759 -6.202 9.769 742 HD2 PRO 101 HD2 PRO 101 12.100 -7.844 11.912 743 HD3 PRO 101 HD3 PRO 101 10.829 -6.609 12.065 744 H VAL 102 H VAL 102 8.000 -10.317 9.097 745 HA VAL 102 HA VAL 102 8.712 -12.899 9.922 746 HB VAL 102 HB VAL 102 6.865 -12.074 7.634 747 HG11 VAL 102 HG11 VAL 102 7.496 -14.447 7.378 748 HG12 VAL 102 HG12 VAL 102 5.811 -14.320 7.883 749 HG13 VAL 102 HG13 VAL 102 7.053 -14.769 9.058 750 HG21 VAL 102 HG21 VAL 102 5.035 -12.382 9.275 751 HG22 VAL 102 HG22 VAL 102 6.172 -11.137 9.795 752 HG23 VAL 102 HG23 VAL 102 6.226 -12.740 10.534 753 H ASP 103 H ASP 103 9.833 -14.540 9.006 754 HA ASP 103 HA ASP 103 11.909 -13.845 7.139 755 HB2 ASP 103 HB2 ASP 103 12.333 -15.195 9.148 756 HB3 ASP 103 HB3 ASP 103 11.221 -16.438 8.586 757 H GLU 104 H GLU 104 9.034 -15.902 7.073 758 HA GLU 104 HA GLU 104 9.450 -17.037 4.473 759 HB2 GLU 104 HB2 GLU 104 8.127 -18.231 6.132 760 HB3 GLU 104 HB3 GLU 104 7.006 -16.881 6.281 761 HG2 GLU 104 HG2 GLU 104 6.183 -17.266 4.014 762 HG3 GLU 104 HG3 GLU 104 7.375 -18.548 3.778 763 H LEU 105 H LEU 105 7.255 -14.473 5.665 764 HA LEU 105 HA LEU 105 6.150 -13.820 3.089 765 HB2 LEU 105 HB2 LEU 105 6.010 -12.369 5.760 766 HB3 LEU 105 HB3 LEU 105 5.056 -11.939 4.347 767 HG LEU 105 HG LEU 105 4.878 -14.635 5.770 768 HD11 LEU 105 HD11 LEU 105 2.971 -12.286 5.983 769 HD12 LEU 105 HD12 LEU 105 4.044 -12.879 7.253 770 HD13 LEU 105 HD13 LEU 105 2.726 -13.894 6.673 771 HD21 LEU 105 HD21 LEU 105 3.120 -13.426 3.613 772 HD22 LEU 105 HD22 LEU 105 2.856 -14.975 4.422 773 HD23 LEU 105 HD23 LEU 105 4.272 -14.748 3.401 774 H GLY 106 H GLY 106 8.792 -12.576 5.046 775 HA2 GLY 106 HA2 GLY 106 10.667 -11.420 4.449 776 HA3 GLY 106 HA3 GLY 106 10.158 -11.564 2.779 777 H VAL 107 H VAL 107 11.286 -9.457 2.764 778 HA VAL 107 HA VAL 107 9.561 -7.148 3.461 779 HB VAL 107 HB VAL 107 12.499 -7.182 2.590 780 HG11 VAL 107 HG11 VAL 107 12.539 -4.788 3.258 781 HG12 VAL 107 HG12 VAL 107 10.811 -4.856 3.611 782 HG13 VAL 107 HG13 VAL 107 11.380 -5.071 1.955 783 HG21 VAL 107 HG21 VAL 107 13.057 -6.620 4.932 784 HG22 VAL 107 HG22 VAL 107 12.224 -8.173 4.840 785 HG23 VAL 107 HG23 VAL 107 11.351 -6.735 5.375 786 H THR 108 H THR 108 8.606 -6.007 1.822 787 HA THR 108 HA THR 108 9.562 -6.293 -0.966 788 HB THR 108 HB THR 108 7.613 -7.749 -0.841 789 HG1 THR 108 HG1 THR 108 6.210 -6.330 -2.325 790 HG21 THR 108 HG21 THR 108 6.435 -6.770 1.100 791 HG22 THR 108 HG22 THR 108 5.358 -6.916 -0.287 792 HG23 THR 108 HG23 THR 108 6.026 -5.340 0.146 793 H HIS 109 H HIS 109 8.939 -4.455 -2.367 794 HA HIS 109 HA HIS 109 8.849 -1.935 -0.772 795 HB2 HIS 109 HB2 HIS 109 11.127 -2.592 -1.580 796 HB3 HIS 109 HB3 HIS 109 10.547 -2.523 -3.233 797 HD1 HIS 109 HD1 HIS 109 11.714 -0.406 -0.428 798 HD2 HIS 109 HD2 HIS 109 10.108 0.151 -4.211 799 HE1 HIS 109 HE1 HIS 109 12.217 1.960 -1.047 800 HE2 HIS 109 HE2 HIS 109 11.397 2.220 -3.391 801 H ALA 110 H ALA 110 6.899 -0.991 -1.234 802 HA ALA 110 HA ALA 110 5.738 -1.147 -3.932 803 HB1 ALA 110 HB1 ALA 110 4.265 -1.567 -2.014 804 HB2 ALA 110 HB2 ALA 110 3.725 -0.177 -2.956 805 HB3 ALA 110 HB3 ALA 110 4.562 0.067 -1.424 806 H THR 111 H THR 111 5.517 0.545 -5.314 807 HA THR 111 HA THR 111 6.673 3.192 -4.583 808 HB THR 111 HB THR 111 6.701 1.832 -7.331 809 HG1 THR 111 HG1 THR 111 8.156 0.844 -5.841 810 HG21 THR 111 HG21 THR 111 8.250 3.649 -7.988 811 HG22 THR 111 HG22 THR 111 8.038 4.408 -6.409 812 HG23 THR 111 HG23 THR 111 6.674 4.286 -7.520 813 H VAL 112 H VAL 112 4.939 4.507 -4.286 814 HA VAL 112 HA VAL 112 2.485 4.287 -5.900 815 HB VAL 112 HB VAL 112 3.065 6.112 -3.517 816 HG11 VAL 112 HG11 VAL 112 1.233 6.959 -4.939 817 HG12 VAL 112 HG12 VAL 112 0.605 6.395 -3.390 818 HG13 VAL 112 HG13 VAL 112 0.409 5.399 -4.834 819 HG21 VAL 112 HG21 VAL 112 3.215 3.747 -2.840 820 HG22 VAL 112 HG22 VAL 112 1.619 3.437 -3.530 821 HG23 VAL 112 HG23 VAL 112 1.785 4.515 -2.142 822 H LYS 113 H LYS 113 2.467 5.441 -7.757 823 HA LYS 113 HA LYS 113 3.716 8.140 -7.830 824 HB2 LYS 113 HB2 LYS 113 3.430 6.202 -10.171 825 HB3 LYS 113 HB3 LYS 113 4.260 7.758 -10.179 826 HG2 LYS 113 HG2 LYS 113 5.926 6.850 -8.561 827 HG3 LYS 113 HG3 LYS 113 5.107 5.290 -8.616 828 HD2 LYS 113 HD2 LYS 113 6.491 6.661 -10.960 829 HD3 LYS 113 HD3 LYS 113 7.145 5.325 -10.007 830 HE2 LYS 113 HE2 LYS 113 6.320 4.374 -12.039 831 HE3 LYS 113 HE3 LYS 113 5.167 3.936 -10.786 832 HZ1 LYS 113 HZ1 LYS 113 4.185 4.675 -12.930 833 HZ2 LYS 113 HZ2 LYS 113 4.768 6.233 -12.621 834 HZ3 LYS 113 HZ3 LYS 113 3.637 5.531 -11.584 835 H LEU 114 H LEU 114 2.175 9.629 -7.833 836 HA LEU 114 HA LEU 114 -0.510 9.138 -8.906 837 HB2 LEU 114 HB2 LEU 114 0.622 11.539 -7.408 838 HB3 LEU 114 HB3 LEU 114 -1.074 11.290 -7.813 839 HG LEU 114 HG LEU 114 0.547 9.527 -5.925 840 HD11 LEU 114 HD11 LEU 114 0.154 11.727 -4.949 841 HD12 LEU 114 HD12 LEU 114 -0.825 10.514 -4.134 842 HD13 LEU 114 HD13 LEU 114 -1.572 11.611 -5.302 843 HD21 LEU 114 HD21 LEU 114 -1.610 8.507 -5.336 844 HD22 LEU 114 HD22 LEU 114 -1.212 8.251 -7.032 845 HD23 LEU 114 HD23 LEU 114 -2.414 9.467 -6.582 846 H GLU 115 H GLU 115 -1.192 9.915 -10.819 847 HA GLU 115 HA GLU 115 0.499 11.781 -12.365 848 HB2 GLU 115 HB2 GLU 115 0.151 9.593 -13.422 849 HB3 GLU 115 HB3 GLU 115 -1.594 9.776 -13.287 850 HG2 GLU 115 HG2 GLU 115 -1.558 11.645 -14.863 851 HG3 GLU 115 HG3 GLU 115 0.204 11.571 -14.944 852 HA PRO 116 HA PRO 116 -2.885 14.813 -11.652 853 HB2 PRO 116 HB2 PRO 116 -1.782 16.791 -13.269 854 HB3 PRO 116 HB3 PRO 116 -1.327 16.517 -11.583 855 HG2 PRO 116 HG2 PRO 116 0.034 15.552 -14.095 856 HG3 PRO 116 HG3 PRO 116 0.757 16.267 -12.638 857 HD2 PRO 116 HD2 PRO 116 0.805 13.612 -13.030 858 HD3 PRO 116 HD3 PRO 116 0.543 14.281 -11.403 859 H LEU 117 H LEU 117 -4.732 14.212 -12.678 860 HA LEU 117 HA LEU 117 -4.962 14.593 -15.627 861 HB2 LEU 117 HB2 LEU 117 -6.913 13.135 -13.791 862 HB3 LEU 117 HB3 LEU 117 -6.943 13.168 -15.547 863 HG LEU 117 HG LEU 117 -4.839 11.777 -13.830 864 HD11 LEU 117 HD11 LEU 117 -7.084 10.583 -15.490 865 HD12 LEU 117 HD12 LEU 117 -6.987 10.625 -13.728 866 HD13 LEU 117 HD13 LEU 117 -5.824 9.675 -14.646 867 HD21 LEU 117 HD21 LEU 117 -3.995 10.805 -15.928 868 HD22 LEU 117 HD22 LEU 117 -3.850 12.559 -15.924 869 HD23 LEU 117 HD23 LEU 117 -5.137 11.788 -16.853 870 H GLU 118 H GLU 118 -4.879 16.705 -13.606 871 HA GLU 118 HA GLU 118 -5.793 18.653 -12.968 872 HB2 GLU 118 HB2 GLU 118 -7.682 18.114 -15.291 873 HB3 GLU 118 HB3 GLU 118 -7.671 19.625 -14.392 874 HG2 GLU 118 HG2 GLU 118 -5.304 18.507 -15.944 875 HG3 GLU 118 HG3 GLU 118 -6.417 19.739 -16.543 876 H ASN 119 H ASN 119 -8.891 17.166 -13.894 877 HA ASN 119 HA ASN 119 -10.091 17.889 -11.347 878 HB2 ASN 119 HB2 ASN 119 -11.182 18.264 -13.585 879 HB3 ASN 119 HB3 ASN 119 -11.259 16.522 -13.814 880 HD21 ASN 119 HD21 ASN 119 -13.485 16.689 -14.039 881 HD22 ASN 119 HD22 ASN 119 -14.531 16.908 -12.680 882 H ARG 120 H ARG 120 -8.702 15.099 -12.835 883 HA ARG 120 HA ARG 120 -9.477 13.363 -10.550 884 HB2 ARG 120 HB2 ARG 120 -9.112 12.508 -13.462 885 HB3 ARG 120 HB3 ARG 120 -9.404 11.414 -12.110 886 HG2 ARG 120 HG2 ARG 120 -11.620 12.422 -11.743 887 HG3 ARG 120 HG3 ARG 120 -11.332 13.572 -13.050 888 HD2 ARG 120 HD2 ARG 120 -11.488 10.554 -13.359 889 HD3 ARG 120 HD3 ARG 120 -12.788 11.687 -13.746 890 HE ARG 120 HE ARG 120 -10.251 11.339 -15.203 891 HH11 ARG 120 HH11 ARG 120 -13.383 12.833 -15.094 892 HH12 ARG 120 HH12 ARG 120 -13.325 13.277 -16.761 893 HH21 ARG 120 HH21 ARG 120 -10.211 11.951 -17.319 894 HH22 ARG 120 HH22 ARG 120 -11.567 12.784 -18.002 895 H THR 121 H THR 121 -7.809 11.348 -10.584 896 HA THR 121 HA THR 121 -5.099 12.061 -11.463 897 HB THR 121 HB THR 121 -5.734 11.556 -8.513 898 HG1 THR 121 HG1 THR 121 -5.994 13.731 -9.241 899 HG21 THR 121 HG21 THR 121 -3.647 10.370 -9.087 900 HG22 THR 121 HG22 THR 121 -3.295 11.786 -8.094 901 HG23 THR 121 HG23 THR 121 -3.004 11.836 -9.837 902 H ARG 122 H ARG 122 -3.844 10.268 -11.932 903 HA ARG 122 HA ARG 122 -5.102 7.602 -11.704 904 HB2 ARG 122 HB2 ARG 122 -4.683 8.458 -14.003 905 HB3 ARG 122 HB3 ARG 122 -2.971 8.633 -13.628 906 HG2 ARG 122 HG2 ARG 122 -2.732 6.217 -13.387 907 HG3 ARG 122 HG3 ARG 122 -4.468 5.989 -13.626 908 HD2 ARG 122 HD2 ARG 122 -2.504 7.075 -15.685 909 HD3 ARG 122 HD3 ARG 122 -3.228 5.465 -15.673 910 HE ARG 122 HE ARG 122 -5.276 7.416 -15.676 911 HH11 ARG 122 HH11 ARG 122 -2.969 6.022 -17.855 912 HH12 ARG 122 HH12 ARG 122 -3.910 6.424 -19.245 913 HH21 ARG 122 HH21 ARG 122 -6.456 7.855 -17.445 914 HH22 ARG 122 HH22 ARG 122 -5.858 7.455 -19.022 915 H MET 123 H MET 123 -4.262 6.398 -10.083 916 HA MET 123 HA MET 123 -1.528 6.879 -9.076 917 HB2 MET 123 HB2 MET 123 -3.368 6.944 -7.419 918 HB3 MET 123 HB3 MET 123 -3.851 5.310 -7.864 919 HG2 MET 123 HG2 MET 123 -1.680 4.454 -7.033 920 HG3 MET 123 HG3 MET 123 -1.212 6.096 -6.591 921 HE1 MET 123 HE1 MET 123 -4.581 3.689 -4.561 922 HE2 MET 123 HE2 MET 123 -3.627 3.121 -5.926 923 HE3 MET 123 HE3 MET 123 -4.813 4.408 -6.153 924 H THR 124 H THR 124 0.062 5.302 -9.217 925 HA THR 124 HA THR 124 -0.718 2.522 -9.904 926 HB THR 124 HB THR 124 1.626 3.983 -11.202 927 HG1 THR 124 HG1 THR 124 -1.017 3.507 -12.002 928 HG21 THR 124 HG21 THR 124 1.832 1.948 -12.603 929 HG22 THR 124 HG22 THR 124 0.549 1.173 -11.674 930 HG23 THR 124 HG23 THR 124 2.084 1.567 -10.900 931 H ILE 125 H ILE 125 -0.029 1.212 -8.305 932 HA ILE 125 HA ILE 125 2.358 1.959 -6.698 933 HB ILE 125 HB ILE 125 0.098 0.121 -5.789 934 HG12 ILE 125 HG12 ILE 125 0.417 3.099 -5.154 935 HG13 ILE 125 HG13 ILE 125 -0.811 2.422 -6.218 936 HG21 ILE 125 HG21 ILE 125 2.238 -0.184 -4.606 937 HG22 ILE 125 HG22 ILE 125 1.047 0.540 -3.528 938 HG23 ILE 125 HG23 ILE 125 2.312 1.542 -4.245 939 HD11 ILE 125 HD11 ILE 125 -1.765 1.199 -4.299 940 HD12 ILE 125 HD12 ILE 125 -1.751 2.946 -4.062 941 HD13 ILE 125 HD13 ILE 125 -0.554 1.942 -3.249 942 H ILE 126 H ILE 126 4.111 0.722 -7.204 943 HA ILE 126 HA ILE 126 3.727 -2.054 -8.192 944 HB ILE 126 HB ILE 126 6.251 -0.358 -8.591 945 HG12 ILE 126 HG12 ILE 126 5.378 -0.243 -11.079 946 HG13 ILE 126 HG13 ILE 126 3.793 -0.550 -10.385 947 HG21 ILE 126 HG21 ILE 126 6.780 -2.029 -10.342 948 HG22 ILE 126 HG22 ILE 126 5.306 -2.915 -9.945 949 HG23 ILE 126 HG23 ILE 126 6.602 -2.778 -8.754 950 HD11 ILE 126 HD11 ILE 126 3.994 1.509 -9.064 951 HD12 ILE 126 HD12 ILE 126 4.139 1.799 -10.796 952 HD13 ILE 126 HD13 ILE 126 5.581 1.802 -9.782 953 H SER 127 H SER 127 4.071 -3.501 -6.574 954 HA SER 127 HA SER 127 5.974 -2.988 -4.389 955 HB2 SER 127 HB2 SER 127 3.614 -3.604 -3.826 956 HB3 SER 127 HB3 SER 127 3.840 -5.164 -4.618 957 HG SER 127 HG SER 127 4.798 -4.228 -2.171 958 H THR 128 H THR 128 7.937 -3.920 -4.462 959 HA THR 128 HA THR 128 8.487 -6.045 -6.445 960 HB THR 128 HB THR 128 10.857 -5.214 -6.387 961 HG1 THR 128 HG1 THR 128 11.254 -4.096 -4.613 962 HG21 THR 128 HG21 THR 128 10.473 -3.116 -7.633 963 HG22 THR 128 HG22 THR 128 8.807 -3.067 -7.052 964 HG23 THR 128 HG23 THR 128 9.326 -4.362 -8.134 965 H PHE 129 H PHE 129 8.726 -7.979 -5.627 966 HA PHE 129 HA PHE 129 9.438 -8.520 -2.843 967 HB2 PHE 129 HB2 PHE 129 8.603 -10.521 -4.994 968 HB3 PHE 129 HB3 PHE 129 8.527 -10.729 -3.244 969 HD1 PHE 129 HD1 PHE 129 6.792 -9.476 -1.916 970 HD2 PHE 129 HD2 PHE 129 6.831 -9.366 -6.189 971 HE1 PHE 129 HE1 PHE 129 4.495 -8.590 -1.926 972 HE2 PHE 129 HE2 PHE 129 4.536 -8.505 -6.179 973 HZ PHE 129 HZ PHE 129 3.371 -8.093 -4.055 974 H GLU 130 H GLU 130 11.037 -10.259 -2.339 975 HA GLU 130 HA GLU 130 13.469 -9.872 -3.898 976 HB2 GLU 130 HB2 GLU 130 12.970 -11.266 -1.242 977 HB3 GLU 130 HB3 GLU 130 14.562 -11.099 -1.982 978 HG2 GLU 130 HG2 GLU 130 12.770 -8.800 -1.114 979 HG3 GLU 130 HG3 GLU 130 14.159 -9.416 -0.219 980 H SER 131 H SER 131 11.310 -12.631 -3.179 981 HA SER 131 HA SER 131 12.855 -14.289 -5.105 982 HB2 SER 131 HB2 SER 131 11.751 -15.276 -2.438 983 HB3 SER 131 HB3 SER 131 12.587 -16.264 -3.639 984 HG SER 131 HG SER 131 14.396 -14.707 -3.304 985 H GLU 132 H GLU 132 11.662 -15.979 -6.146 986 HA GLU 132 HA GLU 132 9.072 -15.432 -7.031 987 HB2 GLU 132 HB2 GLU 132 10.611 -16.872 -8.312 988 HB3 GLU 132 HB3 GLU 132 10.544 -18.103 -7.054 989 HG2 GLU 132 HG2 GLU 132 8.084 -18.371 -7.519 990 HG3 GLU 132 HG3 GLU 132 8.255 -17.235 -8.857 991 H GLU 133 H GLU 133 10.105 -17.929 -4.667 992 HA GLU 133 HA GLU 133 7.557 -18.937 -4.021 993 HB2 GLU 133 HB2 GLU 133 8.617 -19.885 -2.001 994 HB3 GLU 133 HB3 GLU 133 9.602 -20.130 -3.438 995 HG2 GLU 133 HG2 GLU 133 11.101 -18.311 -2.772 996 HG3 GLU 133 HG3 GLU 133 10.088 -17.954 -1.376 997 H GLN 134 H GLN 134 9.193 -16.040 -2.854 998 HA GLN 134 HA GLN 134 7.452 -15.452 -0.639 999 HB2 GLN 134 HB2 GLN 134 9.749 -14.476 -0.883 1000 HB3 GLN 134 HB3 GLN 134 9.213 -13.582 -2.301 1001 HG2 GLN 134 HG2 GLN 134 7.517 -12.428 -0.777 1002 HG3 GLN 134 HG3 GLN 134 8.357 -13.174 0.582 1003 HE21 GLN 134 HE21 GLN 134 8.051 -10.361 0.111 1004 HE22 GLN 134 HE22 GLN 134 9.634 -9.696 -0.077 1005 H MET 135 H MET 135 7.746 -14.242 -3.956 1006 HA MET 135 HA MET 135 5.584 -12.518 -4.228 1007 HB2 MET 135 HB2 MET 135 7.349 -12.645 -5.857 1008 HB3 MET 135 HB3 MET 135 7.046 -14.343 -6.163 1009 HG2 MET 135 HG2 MET 135 6.360 -12.939 -8.023 1010 HG3 MET 135 HG3 MET 135 4.985 -13.799 -7.329 1011 HE1 MET 135 HE1 MET 135 3.846 -11.725 -9.099 1012 HE2 MET 135 HE2 MET 135 5.376 -10.848 -9.188 1013 HE3 MET 135 HE3 MET 135 3.919 -10.030 -8.621 1014 H GLN 136 H GLN 136 5.689 -16.032 -4.715 1015 HA GLN 136 HA GLN 136 2.978 -16.443 -5.487 1016 HB2 GLN 136 HB2 GLN 136 5.021 -18.344 -4.261 1017 HB3 GLN 136 HB3 GLN 136 3.463 -18.853 -4.910 1018 HG2 GLN 136 HG2 GLN 136 5.663 -17.513 -6.514 1019 HG3 GLN 136 HG3 GLN 136 5.350 -19.247 -6.476 1020 HE21 GLN 136 HE21 GLN 136 5.255 -17.275 -8.717 1021 HE22 GLN 136 HE22 GLN 136 3.687 -17.447 -9.410 1022 H LYS 137 H LYS 137 4.701 -16.724 -2.370 1023 HA LYS 137 HA LYS 137 2.621 -17.673 -0.742 1024 HB2 LYS 137 HB2 LYS 137 4.999 -17.683 -0.065 1025 HB3 LYS 137 HB3 LYS 137 4.992 -15.927 0.030 1026 HG2 LYS 137 HG2 LYS 137 4.849 -16.798 2.261 1027 HG3 LYS 137 HG3 LYS 137 3.292 -16.066 1.859 1028 HD2 LYS 137 HD2 LYS 137 2.437 -18.393 1.314 1029 HD3 LYS 137 HD3 LYS 137 3.964 -19.035 1.930 1030 HE2 LYS 137 HE2 LYS 137 3.392 -17.731 4.109 1031 HE3 LYS 137 HE3 LYS 137 1.763 -17.615 3.448 1032 HZ1 LYS 137 HZ1 LYS 137 3.271 -20.094 4.052 1033 HZ2 LYS 137 HZ2 LYS 137 1.761 -20.063 3.309 1034 HZ3 LYS 137 HZ3 LYS 137 1.936 -19.484 4.891 1035 H MET 138 H MET 138 3.458 -14.344 -1.636 1036 HA MET 138 HA MET 138 1.752 -12.857 0.016 1037 HB2 MET 138 HB2 MET 138 2.417 -12.336 -2.909 1038 HB3 MET 138 HB3 MET 138 1.765 -11.146 -1.788 1039 HG2 MET 138 HG2 MET 138 4.432 -12.488 -1.362 1040 HG3 MET 138 HG3 MET 138 4.241 -11.018 -2.299 1041 HE1 MET 138 HE1 MET 138 4.087 -11.397 2.264 1042 HE2 MET 138 HE2 MET 138 4.876 -12.496 1.134 1043 HE3 MET 138 HE3 MET 138 3.115 -12.476 1.260 1044 H ALA 139 H ALA 139 1.110 -14.220 -3.198 1045 HA ALA 139 HA ALA 139 -1.599 -13.474 -3.402 1046 HB1 ALA 139 HB1 ALA 139 -1.649 -15.019 -5.327 1047 HB2 ALA 139 HB2 ALA 139 -0.112 -15.724 -4.810 1048 HB3 ALA 139 HB3 ALA 139 -0.177 -14.041 -5.334 1049 H GLU 140 H GLU 140 -0.054 -16.358 -2.010 1050 HA GLU 140 HA GLU 140 -2.381 -17.941 -1.578 1051 HB2 GLU 140 HB2 GLU 140 0.160 -17.952 0.110 1052 HB3 GLU 140 HB3 GLU 140 -1.029 -19.249 -0.007 1053 HG2 GLU 140 HG2 GLU 140 0.938 -18.330 -2.117 1054 HG3 GLU 140 HG3 GLU 140 0.898 -19.877 -1.282 1055 H MET 141 H MET 141 -0.825 -15.436 0.385 1056 HA MET 141 HA MET 141 -2.474 -15.766 2.738 1057 HB2 MET 141 HB2 MET 141 -0.593 -13.533 1.862 1058 HB3 MET 141 HB3 MET 141 -1.380 -13.586 3.438 1059 HG2 MET 141 HG2 MET 141 0.510 -15.719 2.413 1060 HG3 MET 141 HG3 MET 141 0.985 -14.373 3.448 1061 HE1 MET 141 HE1 MET 141 -0.839 -15.168 6.806 1062 HE2 MET 141 HE2 MET 141 -1.350 -14.058 5.535 1063 HE3 MET 141 HE3 MET 141 0.350 -14.145 6.002 1064 H GLY 142 H GLY 142 -3.139 -14.417 -0.281 1065 HA2 GLY 142 HA2 GLY 142 -4.894 -13.157 -1.077 1066 HA3 GLY 142 HA3 GLY 142 -5.538 -13.063 0.556 1067 H MET 143 H MET 143 -2.280 -12.064 -0.294 1068 HA MET 143 HA MET 143 -2.625 -9.387 0.697 1069 HB2 MET 143 HB2 MET 143 -0.504 -10.628 0.975 1070 HB3 MET 143 HB3 MET 143 -0.285 -10.685 -0.768 1071 HG2 MET 143 HG2 MET 143 1.156 -9.005 0.291 1072 HG3 MET 143 HG3 MET 143 0.012 -8.259 -0.831 1073 HE1 MET 143 HE1 MET 143 0.521 -5.640 2.155 1074 HE2 MET 143 HE2 MET 143 0.804 -5.925 0.438 1075 HE3 MET 143 HE3 MET 143 1.739 -6.810 1.648 1076 H GLU 144 H GLU 144 -2.631 -10.876 -2.514 1077 HA GLU 144 HA GLU 144 -2.406 -8.530 -4.097 1078 HB2 GLU 144 HB2 GLU 144 -2.111 -10.706 -5.141 1079 HB3 GLU 144 HB3 GLU 144 -3.740 -11.205 -4.702 1080 HG2 GLU 144 HG2 GLU 144 -4.718 -9.604 -6.247 1081 HG3 GLU 144 HG3 GLU 144 -3.143 -8.912 -6.598 1082 H GLU 145 H GLU 145 -5.376 -10.419 -3.308 1083 HA GLU 145 HA GLU 145 -7.168 -8.338 -4.082 1084 HB2 GLU 145 HB2 GLU 145 -7.468 -11.064 -2.871 1085 HB3 GLU 145 HB3 GLU 145 -8.808 -9.959 -2.623 1086 HG2 GLU 145 HG2 GLU 145 -9.170 -11.404 -4.565 1087 HG3 GLU 145 HG3 GLU 145 -9.121 -9.704 -5.014 1088 H GLY 146 H GLY 146 -5.710 -9.164 -0.966 1089 HA2 GLY 146 HA2 GLY 146 -7.423 -7.666 0.736 1090 HA3 GLY 146 HA3 GLY 146 -5.753 -8.095 1.081 1091 H MET 147 H MET 147 -4.358 -6.778 -0.845 1092 HA MET 147 HA MET 147 -4.294 -4.026 -0.133 1093 HB2 MET 147 HB2 MET 147 -2.330 -5.313 -0.950 1094 HB3 MET 147 HB3 MET 147 -3.078 -5.467 -2.529 1095 HG2 MET 147 HG2 MET 147 -2.965 -2.999 -2.783 1096 HG3 MET 147 HG3 MET 147 -2.122 -2.910 -1.231 1097 HE1 MET 147 HE1 MET 147 -0.131 -1.581 -2.435 1098 HE2 MET 147 HE2 MET 147 -0.988 -1.697 -3.973 1099 HE3 MET 147 HE3 MET 147 0.706 -2.177 -3.869 1100 H ARG 148 H ARG 148 -5.698 -5.777 -2.842 1101 HA ARG 148 HA ARG 148 -6.394 -3.603 -4.531 1102 HB2 ARG 148 HB2 ARG 148 -6.085 -6.027 -5.149 1103 HB3 ARG 148 HB3 ARG 148 -7.614 -6.384 -4.360 1104 HG2 ARG 148 HG2 ARG 148 -8.836 -5.114 -6.034 1105 HG3 ARG 148 HG3 ARG 148 -7.324 -4.555 -6.768 1106 HD2 ARG 148 HD2 ARG 148 -6.722 -6.884 -7.329 1107 HD3 ARG 148 HD3 ARG 148 -8.210 -7.460 -6.569 1108 HE ARG 148 HE ARG 148 -8.917 -5.648 -8.581 1109 HH11 ARG 148 HH11 ARG 148 -7.441 -8.788 -8.321 1110 HH12 ARG 148 HH12 ARG 148 -8.033 -9.299 -9.867 1111 HH21 ARG 148 HH21 ARG 148 -9.652 -6.338 -10.537 1112 HH22 ARG 148 HH22 ARG 148 -9.287 -7.934 -11.093 1113 H GLU 149 H GLU 149 -8.184 -5.327 -1.972 1114 HA GLU 149 HA GLU 149 -10.707 -4.003 -2.200 1115 HB2 GLU 149 HB2 GLU 149 -9.362 -5.431 0.134 1116 HB3 GLU 149 HB3 GLU 149 -10.997 -4.779 0.234 1117 HG2 GLU 149 HG2 GLU 149 -11.762 -6.300 -1.491 1118 HG3 GLU 149 HG3 GLU 149 -10.124 -6.893 -1.756 1119 H ALA 150 H ALA 150 -7.773 -3.388 -0.308 1120 HA ALA 150 HA ALA 150 -8.585 -1.130 1.175 1121 HB1 ALA 150 HB1 ALA 150 -6.503 -2.386 1.639 1122 HB2 ALA 150 HB2 ALA 150 -6.179 -0.664 1.433 1123 HB3 ALA 150 HB3 ALA 150 -5.805 -1.796 0.126 1124 H ILE 151 H ILE 151 -7.233 -1.403 -2.105 1125 HA ILE 151 HA ILE 151 -7.135 1.441 -2.589 1126 HB ILE 151 HB ILE 151 -6.747 -0.923 -4.467 1127 HG12 ILE 151 HG12 ILE 151 -4.735 0.953 -3.122 1128 HG13 ILE 151 HG13 ILE 151 -5.057 -0.708 -2.640 1129 HG21 ILE 151 HG21 ILE 151 -7.439 1.027 -5.800 1130 HG22 ILE 151 HG22 ILE 151 -5.733 0.674 -6.076 1131 HG23 ILE 151 HG23 ILE 151 -6.198 2.018 -5.030 1132 HD11 ILE 151 HD11 ILE 151 -2.991 -0.555 -3.865 1133 HD12 ILE 151 HD12 ILE 151 -3.810 0.191 -5.233 1134 HD13 ILE 151 HD13 ILE 151 -4.165 -1.483 -4.798 1135 H GLU 152 H GLU 152 -9.530 -1.090 -3.217 1136 HA GLU 152 HA GLU 152 -11.340 0.668 -4.637 1137 HB2 GLU 152 HB2 GLU 152 -11.800 -2.017 -3.281 1138 HB3 GLU 152 HB3 GLU 152 -13.059 -1.141 -4.153 1139 HG2 GLU 152 HG2 GLU 152 -10.470 -2.216 -5.335 1140 HG3 GLU 152 HG3 GLU 152 -12.087 -2.892 -5.555 1141 H GLN 153 H GLN 153 -10.470 0.300 -1.353 1142 HA GLN 153 HA GLN 153 -12.854 1.688 -0.357 1143 HB2 GLN 153 HB2 GLN 153 -11.689 -0.292 0.841 1144 HB3 GLN 153 HB3 GLN 153 -10.439 0.860 1.298 1145 HG2 GLN 153 HG2 GLN 153 -11.925 2.105 2.671 1146 HG3 GLN 153 HG3 GLN 153 -13.355 1.376 1.938 1147 HE21 GLN 153 HE21 GLN 153 -10.853 0.955 4.300 1148 HE22 GLN 153 HE22 GLN 153 -11.478 -0.472 5.017 1149 H ILE 154 H ILE 154 -9.657 2.422 -1.514 1150 HA ILE 154 HA ILE 154 -9.318 5.053 -0.499 1151 HB ILE 154 HB ILE 154 -8.480 3.887 -3.189 1152 HG12 ILE 154 HG12 ILE 154 -6.881 4.462 -0.655 1153 HG13 ILE 154 HG13 ILE 154 -7.384 2.870 -1.211 1154 HG21 ILE 154 HG21 ILE 154 -8.653 6.321 -3.459 1155 HG22 ILE 154 HG22 ILE 154 -6.959 5.840 -3.450 1156 HG23 ILE 154 HG23 ILE 154 -7.672 6.578 -2.013 1157 HD11 ILE 154 HD11 ILE 154 -5.952 3.137 -3.193 1158 HD12 ILE 154 HD12 ILE 154 -5.057 3.249 -1.680 1159 HD13 ILE 154 HD13 ILE 154 -5.433 4.711 -2.585 1160 H ASP 155 H ASP 155 -11.285 3.782 -3.164 1161 HA ASP 155 HA ASP 155 -12.319 6.141 -4.228 1162 HB2 ASP 155 HB2 ASP 155 -12.706 3.909 -5.212 1163 HB3 ASP 155 HB3 ASP 155 -13.679 3.441 -3.819 1164 H ALA 156 H ALA 156 -13.349 4.302 -1.350 1165 HA ALA 156 HA ALA 156 -15.492 6.018 -0.589 1166 HB1 ALA 156 HB1 ALA 156 -13.867 4.146 1.173 1167 HB2 ALA 156 HB2 ALA 156 -15.291 3.699 0.229 1168 HB3 ALA 156 HB3 ALA 156 -15.444 4.845 1.564 1169 H VAL 157 H VAL 157 -12.025 6.273 -0.092 1170 HA VAL 157 HA VAL 157 -12.139 8.170 2.094 1171 HB VAL 157 HB VAL 157 -9.762 7.757 0.222 1172 HG11 VAL 157 HG11 VAL 157 -9.547 9.722 1.683 1173 HG12 VAL 157 HG12 VAL 157 -8.420 8.467 2.196 1174 HG13 VAL 157 HG13 VAL 157 -9.907 8.740 3.108 1175 HG21 VAL 157 HG21 VAL 157 -10.390 6.174 2.737 1176 HG22 VAL 157 HG22 VAL 157 -8.919 6.060 1.775 1177 HG23 VAL 157 HG23 VAL 157 -10.459 5.563 1.086 1178 H LEU 158 H LEU 158 -11.935 8.397 -1.419 1179 HA LEU 158 HA LEU 158 -11.531 11.316 -1.359 1180 HB2 LEU 158 HB2 LEU 158 -11.503 9.427 -3.741 1181 HB3 LEU 158 HB3 LEU 158 -10.949 11.099 -3.717 1182 HG LEU 158 HG LEU 158 -9.670 8.765 -2.224 1183 HD11 LEU 158 HD11 LEU 158 -9.220 8.660 -4.599 1184 HD12 LEU 158 HD12 LEU 158 -7.760 9.076 -3.708 1185 HD13 LEU 158 HD13 LEU 158 -8.636 10.327 -4.597 1186 HD21 LEU 158 HD21 LEU 158 -9.444 10.800 -0.900 1187 HD22 LEU 158 HD22 LEU 158 -8.790 11.667 -2.290 1188 HD23 LEU 158 HD23 LEU 158 -7.884 10.331 -1.574 1189 H SER 159 H SER 159 -13.825 8.955 -2.747 1190 HA SER 159 HA SER 159 -15.683 10.919 -3.768 1191 HB2 SER 159 HB2 SER 159 -15.475 8.494 -4.623 1192 HB3 SER 159 HB3 SER 159 -16.299 7.987 -3.166 1193 HG SER 159 HG SER 159 -17.714 8.306 -4.986 1194 H GLU 160 H GLU 160 -15.676 8.597 -1.088 1195 HA GLU 160 HA GLU 160 -16.541 8.471 0.966 1196 HB2 GLU 160 HB2 GLU 160 -17.035 11.470 0.780 1197 HB3 GLU 160 HB3 GLU 160 -16.972 10.508 2.254 1198 HG2 GLU 160 HG2 GLU 160 -14.613 9.998 1.852 1199 HG3 GLU 160 HG3 GLU 160 -14.658 10.892 0.336 1200 HA PRO 161 HA PRO 161 -20.802 7.417 0.466 1201 HB2 PRO 161 HB2 PRO 161 -21.224 7.925 3.395 1202 HB3 PRO 161 HB3 PRO 161 -21.508 6.450 2.457 1203 HG2 PRO 161 HG2 PRO 161 -19.401 6.629 4.094 1204 HG3 PRO 161 HG3 PRO 161 -19.252 5.821 2.518 1205 HD2 PRO 161 HD2 PRO 161 -18.357 8.589 3.320 1206 HD3 PRO 161 HD3 PRO 161 -17.519 7.378 2.321 1207 H ALA 162 H ALA 162 -21.000 9.799 3.094 1208 HA ALA 162 HA ALA 162 -21.960 11.977 1.504 1209 HB1 ALA 162 HB1 ALA 162 -24.034 10.619 1.521 1210 HB2 ALA 162 HB2 ALA 162 -24.249 12.132 2.403 1211 HB3 ALA 162 HB3 ALA 162 -24.014 10.620 3.287 1212 H ASN 163 H ASN 163 -20.058 11.172 3.726 1213 HA ASN 163 HA ASN 163 -20.265 13.443 5.438 1214 HB2 ASN 163 HB2 ASN 163 -20.647 12.190 7.583 1215 HB3 ASN 163 HB3 ASN 163 -22.046 12.225 6.534 1216 HD21 ASN 163 HD21 ASN 163 -21.370 10.357 8.703 1217 HD22 ASN 163 HD22 ASN 163 -21.408 8.783 7.998 1218 H ALA 164 H ALA 164 -18.958 10.079 5.715 1219 HA ALA 164 HA ALA 164 -17.091 9.257 6.683 1220 HB1 ALA 164 HB1 ALA 164 -14.976 9.954 5.667 1221 HB2 ALA 164 HB2 ALA 164 -15.735 11.420 5.036 1222 HB3 ALA 164 HB3 ALA 164 -16.244 9.837 4.444 1223 H LEU 165 H LEU 165 -17.521 9.725 8.860 1224 HA LEU 165 HA LEU 165 -17.065 12.249 10.100 1225 HB2 LEU 165 HB2 LEU 165 -17.348 9.511 11.406 1226 HB3 LEU 165 HB3 LEU 165 -17.443 11.056 12.241 1227 HG LEU 165 HG LEU 165 -19.427 9.995 10.184 1228 HD11 LEU 165 HD11 LEU 165 -21.020 9.958 12.059 1229 HD12 LEU 165 HD12 LEU 165 -19.740 10.462 13.167 1230 HD13 LEU 165 HD13 LEU 165 -19.642 8.899 12.353 1231 HD21 LEU 165 HD21 LEU 165 -19.478 12.656 11.658 1232 HD22 LEU 165 HD22 LEU 165 -20.783 12.002 10.662 1233 HD23 LEU 165 HD23 LEU 165 -19.240 12.416 9.923 1234 H GLU 166 H GLU 166 -14.956 12.863 9.614 1235 HA GLU 166 HA GLU 166 -12.773 11.675 11.219 1236 HB2 GLU 166 HB2 GLU 166 -12.783 10.778 8.825 1237 HB3 GLU 166 HB3 GLU 166 -12.518 12.423 8.263 1238 HG2 GLU 166 HG2 GLU 166 -10.361 12.428 9.561 1239 HG3 GLU 166 HG3 GLU 166 -10.632 10.720 9.923 1240 H HIS 167 H HIS 167 -14.506 14.077 11.424 1241 HA HIS 167 HA HIS 167 -12.746 16.350 10.702 1242 HB2 HIS 167 HB2 HIS 167 -15.728 16.343 11.347 1243 HB3 HIS 167 HB3 HIS 167 -14.787 17.720 10.770 1244 HD1 HIS 167 HD1 HIS 167 -16.932 15.109 9.542 1245 HD2 HIS 167 HD2 HIS 167 -13.600 17.112 8.073 1246 HE1 HIS 167 HE1 HIS 167 -16.904 14.649 7.083 1247 HE2 HIS 167 HE2 HIS 167 -14.885 15.858 6.215 1248 H HIS 168 H HIS 168 -11.607 17.212 12.320 1249 HA HIS 168 HA HIS 168 -12.784 17.690 14.958 1250 HB2 HIS 168 HB2 HIS 168 -11.712 15.433 15.138 1251 HB3 HIS 168 HB3 HIS 168 -10.170 16.136 14.657 1252 HD1 HIS 168 HD1 HIS 168 -12.628 16.094 17.515 1253 HD2 HIS 168 HD2 HIS 168 -8.761 17.391 16.733 1254 HE1 HIS 168 HE1 HIS 168 -11.693 16.770 19.732 1255 HE2 HIS 168 HE2 HIS 168 -9.277 17.275 19.266 1256 H HIS 169 H HIS 169 -9.902 18.040 12.858 1257 HA HIS 169 HA HIS 169 -9.585 20.818 13.763 1258 HB2 HIS 169 HB2 HIS 169 -8.092 19.363 15.201 1259 HB3 HIS 169 HB3 HIS 169 -7.218 18.894 13.747 1260 HD1 HIS 169 HD1 HIS 169 -5.630 20.652 12.694 1261 HD2 HIS 169 HD2 HIS 169 -7.584 21.991 16.108 1262 HE1 HIS 169 HE1 HIS 169 -4.513 22.813 13.303 1263 HE2 HIS 169 HE2 HIS 169 -5.570 23.483 15.481 1264 H HIS 170 H HIS 170 -10.032 21.721 11.826 1265 HA HIS 170 HA HIS 170 -8.762 20.868 9.351 1266 HB2 HIS 170 HB2 HIS 170 -10.047 22.734 8.303 1267 HB3 HIS 170 HB3 HIS 170 -11.075 21.649 9.227 1268 HD1 HIS 170 HD1 HIS 170 -12.184 22.611 11.387 1269 HD2 HIS 170 HD2 HIS 170 -9.960 25.388 9.239 1270 HE1 HIS 170 HE1 HIS 170 -12.803 24.846 12.339 1271 HE2 HIS 170 HE2 HIS 170 -11.283 26.467 11.185 1272 H HIS 171 H HIS 171 -6.807 21.545 8.694 1273 HA HIS 171 HA HIS 171 -5.857 24.253 9.168 1274 HB2 HIS 171 HB2 HIS 171 -5.137 22.929 11.214 1275 HB3 HIS 171 HB3 HIS 171 -4.162 21.910 10.163 1276 HD1 HIS 171 HD1 HIS 171 -1.937 22.903 9.295 1277 HD2 HIS 171 HD2 HIS 171 -4.133 25.547 11.632 1278 HE1 HIS 171 HE1 HIS 171 -0.381 24.803 9.800 1279 HE2 HIS 171 HE2 HIS 171 -1.709 26.367 11.255 1280 H HIS 172 H HIS 172 -5.418 24.786 7.117 1281 HA HIS 172 HA HIS 172 -3.602 23.088 5.490 1282 HB2 HIS 172 HB2 HIS 172 -6.129 24.484 4.486 1283 HB3 HIS 172 HB3 HIS 172 -4.924 23.734 3.445 1284 HD1 HIS 172 HD1 HIS 172 -7.929 22.981 5.398 1285 HD2 HIS 172 HD2 HIS 172 -4.779 20.844 3.741 1286 HE1 HIS 172 HE1 HIS 172 -8.643 20.580 5.474 1287 HE2 HIS 172 HE2 HIS 172 -6.645 19.299 4.652 Start of MODEL 3 1 H1 THR 1 H1 THR 1 -12.099 1.400 -5.742 2 H2 THR 1 H2 THR 1 -11.941 3.084 -5.879 3 H3 THR 1 H3 THR 1 -10.571 2.107 -5.962 4 HA THR 1 HA THR 1 -12.815 1.995 -7.865 5 HB THR 1 HB THR 1 -10.153 3.390 -8.326 6 HG1 THR 1 HG1 THR 1 -11.795 5.262 -8.386 7 HG21 THR 1 HG21 THR 1 -11.251 4.260 -10.365 8 HG22 THR 1 HG22 THR 1 -12.698 3.314 -10.001 9 HG23 THR 1 HG23 THR 1 -11.179 2.499 -10.395 10 H VAL 2 H VAL 2 -9.264 1.628 -8.095 11 HA VAL 2 HA VAL 2 -7.926 0.141 -9.131 12 HB VAL 2 HB VAL 2 -9.917 -1.972 -8.200 13 HG11 VAL 2 HG11 VAL 2 -7.029 -2.300 -9.125 14 HG12 VAL 2 HG12 VAL 2 -8.463 -2.855 -9.993 15 HG13 VAL 2 HG13 VAL 2 -8.037 -3.581 -8.443 16 HG21 VAL 2 HG21 VAL 2 -9.008 -0.662 -6.316 17 HG22 VAL 2 HG22 VAL 2 -7.364 -0.970 -6.877 18 HG23 VAL 2 HG23 VAL 2 -8.361 -2.306 -6.296 19 H VAL 3 H VAL 3 -8.061 0.814 -11.201 20 HA VAL 3 HA VAL 3 -10.154 -0.166 -13.019 21 HB VAL 3 HB VAL 3 -9.004 1.452 -14.684 22 HG11 VAL 3 HG11 VAL 3 -10.236 2.627 -12.157 23 HG12 VAL 3 HG12 VAL 3 -11.128 2.016 -13.551 24 HG13 VAL 3 HG13 VAL 3 -10.110 3.448 -13.715 25 HG21 VAL 3 HG21 VAL 3 -6.827 1.641 -13.494 26 HG22 VAL 3 HG22 VAL 3 -7.642 2.424 -12.134 27 HG23 VAL 3 HG23 VAL 3 -7.579 3.227 -13.707 28 H SER 4 H SER 4 -6.821 -0.802 -12.258 29 HA SER 4 HA SER 4 -6.717 -2.985 -14.188 30 HB2 SER 4 HB2 SER 4 -5.868 -1.113 -15.563 31 HB3 SER 4 HB3 SER 4 -4.690 -0.705 -14.319 32 HG SER 4 HG SER 4 -3.418 -2.094 -15.229 33 H VAL 5 H VAL 5 -5.312 -4.622 -13.532 34 HA VAL 5 HA VAL 5 -3.389 -4.112 -11.326 35 HB VAL 5 HB VAL 5 -5.061 -6.666 -11.585 36 HG11 VAL 5 HG11 VAL 5 -2.815 -7.116 -10.644 37 HG12 VAL 5 HG12 VAL 5 -4.053 -7.309 -9.400 38 HG13 VAL 5 HG13 VAL 5 -3.057 -5.852 -9.429 39 HG21 VAL 5 HG21 VAL 5 -5.292 -4.458 -9.505 40 HG22 VAL 5 HG22 VAL 5 -6.182 -5.984 -9.485 41 HG23 VAL 5 HG23 VAL 5 -6.467 -4.813 -10.775 42 H ASP 6 H ASP 6 -1.533 -4.136 -12.513 43 HA ASP 6 HA ASP 6 -0.950 -6.321 -14.405 44 HB2 ASP 6 HB2 ASP 6 0.595 -3.768 -13.752 45 HB3 ASP 6 HB3 ASP 6 1.072 -4.958 -14.971 46 H LYS 7 H LYS 7 0.495 -7.937 -13.913 47 HA LYS 7 HA LYS 7 2.077 -7.785 -11.410 48 HB2 LYS 7 HB2 LYS 7 -0.036 -8.953 -10.941 49 HB3 LYS 7 HB3 LYS 7 0.263 -10.072 -12.265 50 HG2 LYS 7 HG2 LYS 7 2.265 -10.933 -11.052 51 HG3 LYS 7 HG3 LYS 7 1.885 -9.846 -9.703 52 HD2 LYS 7 HD2 LYS 7 -0.291 -10.969 -9.398 53 HD3 LYS 7 HD3 LYS 7 0.037 -12.009 -10.786 54 HE2 LYS 7 HE2 LYS 7 2.004 -12.935 -9.543 55 HE3 LYS 7 HE3 LYS 7 1.509 -11.986 -8.137 56 HZ1 LYS 7 HZ1 LYS 7 0.703 -14.271 -8.060 57 HZ2 LYS 7 HZ2 LYS 7 -0.151 -14.037 -9.491 58 HZ3 LYS 7 HZ3 LYS 7 -0.572 -13.169 -8.100 59 H ASP 8 H ASP 8 4.118 -8.133 -11.878 60 HA ASP 8 HA ASP 8 4.966 -9.660 -14.255 61 HB2 ASP 8 HB2 ASP 8 6.599 -7.629 -12.668 62 HB3 ASP 8 HB3 ASP 8 6.952 -8.277 -14.270 63 H VAL 9 H VAL 9 5.137 -11.734 -13.456 64 HA VAL 9 HA VAL 9 6.186 -12.371 -10.842 65 HB VAL 9 HB VAL 9 5.473 -14.217 -13.170 66 HG11 VAL 9 HG11 VAL 9 5.832 -14.895 -10.224 67 HG12 VAL 9 HG12 VAL 9 6.901 -15.383 -11.540 68 HG13 VAL 9 HG13 VAL 9 5.253 -16.008 -11.465 69 HG21 VAL 9 HG21 VAL 9 3.535 -12.849 -12.505 70 HG22 VAL 9 HG22 VAL 9 3.745 -13.335 -10.820 71 HG23 VAL 9 HG23 VAL 9 3.289 -14.534 -12.034 72 H GLU 10 H GLU 10 7.441 -12.515 -14.152 73 HA GLU 10 HA GLU 10 9.976 -13.709 -13.435 74 HB2 GLU 10 HB2 GLU 10 10.548 -12.791 -15.902 75 HB3 GLU 10 HB3 GLU 10 9.642 -14.259 -15.623 76 HG2 GLU 10 HG2 GLU 10 8.631 -12.978 -17.392 77 HG3 GLU 10 HG3 GLU 10 7.534 -13.084 -16.030 78 H ALA 11 H ALA 11 8.789 -10.437 -13.905 79 HA ALA 11 HA ALA 11 11.453 -9.234 -13.584 80 HB1 ALA 11 HB1 ALA 11 8.779 -7.909 -14.133 81 HB2 ALA 11 HB2 ALA 11 9.944 -8.408 -15.359 82 HB3 ALA 11 HB3 ALA 11 10.367 -7.139 -14.207 83 H LEU 12 H LEU 12 9.166 -10.342 -11.494 84 HA LEU 12 HA LEU 12 8.629 -10.086 -9.313 85 HB2 LEU 12 HB2 LEU 12 11.425 -8.911 -9.182 86 HB3 LEU 12 HB3 LEU 12 10.518 -9.514 -7.802 87 HG LEU 12 HG LEU 12 11.586 -11.152 -10.134 88 HD11 LEU 12 HD11 LEU 12 12.335 -11.159 -7.192 89 HD12 LEU 12 HD12 LEU 12 13.312 -10.533 -8.527 90 HD13 LEU 12 HD13 LEU 12 12.965 -12.257 -8.425 91 HD21 LEU 12 HD21 LEU 12 9.889 -12.071 -7.791 92 HD22 LEU 12 HD22 LEU 12 10.685 -13.131 -8.960 93 HD23 LEU 12 HD23 LEU 12 9.411 -12.037 -9.491 94 H SER 13 H SER 13 7.503 -7.974 -10.755 95 HA SER 13 HA SER 13 7.339 -5.946 -8.595 96 HB2 SER 13 HB2 SER 13 7.039 -4.168 -10.344 97 HB3 SER 13 HB3 SER 13 8.639 -4.897 -10.362 98 HG SER 13 HG SER 13 6.494 -5.538 -12.114 99 H PHE 14 H PHE 14 5.292 -5.411 -7.995 100 HA PHE 14 HA PHE 14 3.002 -6.577 -9.499 101 HB2 PHE 14 HB2 PHE 14 3.404 -7.854 -7.480 102 HB3 PHE 14 HB3 PHE 14 3.551 -6.397 -6.507 103 HD1 PHE 14 HD1 PHE 14 0.915 -7.713 -8.903 104 HD2 PHE 14 HD2 PHE 14 1.821 -6.252 -4.975 105 HE1 PHE 14 HE1 PHE 14 -1.452 -7.914 -8.261 106 HE2 PHE 14 HE2 PHE 14 -0.542 -6.457 -4.357 107 HZ PHE 14 HZ PHE 14 -2.180 -7.284 -5.985 108 H SER 15 H SER 15 2.016 -4.925 -10.463 109 HA SER 15 HA SER 15 1.969 -2.212 -9.283 110 HB2 SER 15 HB2 SER 15 1.626 -3.087 -12.174 111 HB3 SER 15 HB3 SER 15 1.702 -1.417 -11.609 112 HG SER 15 HG SER 15 3.700 -2.910 -12.352 113 H ILE 16 H ILE 16 0.021 -1.653 -8.351 114 HA ILE 16 HA ILE 16 -2.516 -2.528 -9.631 115 HB ILE 16 HB ILE 16 -2.119 -1.441 -6.801 116 HG12 ILE 16 HG12 ILE 16 -2.700 -4.307 -7.693 117 HG13 ILE 16 HG13 ILE 16 -1.127 -3.729 -7.150 118 HG21 ILE 16 HG21 ILE 16 -4.362 -0.904 -7.702 119 HG22 ILE 16 HG22 ILE 16 -4.486 -2.118 -6.429 120 HG23 ILE 16 HG23 ILE 16 -4.617 -2.602 -8.121 121 HD11 ILE 16 HD11 ILE 16 -3.637 -3.836 -5.479 122 HD12 ILE 16 HD12 ILE 16 -2.049 -3.276 -4.941 123 HD13 ILE 16 HD13 ILE 16 -2.278 -4.957 -5.410 124 H VAL 17 H VAL 17 -3.437 -1.048 -10.874 125 HA VAL 17 HA VAL 17 -2.861 1.833 -10.587 126 HB VAL 17 HB VAL 17 -4.090 0.328 -12.951 127 HG11 VAL 17 HG11 VAL 17 -3.100 3.206 -12.782 128 HG12 VAL 17 HG12 VAL 17 -4.787 2.699 -12.895 129 HG13 VAL 17 HG13 VAL 17 -3.688 2.407 -14.243 130 HG21 VAL 17 HG21 VAL 17 -1.745 -0.362 -12.611 131 HG22 VAL 17 HG22 VAL 17 -1.233 1.329 -12.614 132 HG23 VAL 17 HG23 VAL 17 -1.902 0.610 -14.079 133 H ALA 18 H ALA 18 -4.436 3.116 -9.759 134 HA ALA 18 HA ALA 18 -7.295 2.451 -10.057 135 HB1 ALA 18 HB1 ALA 18 -5.983 2.996 -7.369 136 HB2 ALA 18 HB2 ALA 18 -6.572 1.428 -7.929 137 HB3 ALA 18 HB3 ALA 18 -7.709 2.750 -7.654 138 H GLU 19 H GLU 19 -8.481 4.245 -10.501 139 HA GLU 19 HA GLU 19 -7.186 6.911 -10.283 140 HB2 GLU 19 HB2 GLU 19 -9.236 5.875 -12.285 141 HB3 GLU 19 HB3 GLU 19 -8.615 7.528 -12.244 142 HG2 GLU 19 HG2 GLU 19 -6.362 6.746 -12.744 143 HG3 GLU 19 HG3 GLU 19 -6.885 5.065 -12.647 144 H PHE 20 H PHE 20 -8.168 8.475 -9.130 145 HA PHE 20 HA PHE 20 -10.859 7.951 -7.976 146 HB2 PHE 20 HB2 PHE 20 -8.507 9.269 -6.537 147 HB3 PHE 20 HB3 PHE 20 -10.067 8.840 -5.837 148 HD1 PHE 20 HD1 PHE 20 -10.723 6.274 -6.019 149 HD2 PHE 20 HD2 PHE 20 -6.716 7.761 -6.252 150 HE1 PHE 20 HE1 PHE 20 -9.857 4.048 -5.455 151 HE2 PHE 20 HE2 PHE 20 -5.862 5.532 -5.683 152 HZ PHE 20 HZ PHE 20 -7.428 3.673 -5.291 153 H ASP 21 H ASP 21 -12.268 9.638 -7.808 154 HA ASP 21 HA ASP 21 -11.897 11.960 -9.451 155 HB2 ASP 21 HB2 ASP 21 -14.116 11.304 -7.467 156 HB3 ASP 21 HB3 ASP 21 -14.182 12.563 -8.692 157 H ALA 22 H ALA 22 -10.142 13.089 -8.612 158 HA ALA 22 HA ALA 22 -10.412 14.910 -6.419 159 HB1 ALA 22 HB1 ALA 22 -8.661 13.842 -4.960 160 HB2 ALA 22 HB2 ALA 22 -8.718 12.416 -5.997 161 HB3 ALA 22 HB3 ALA 22 -10.142 12.892 -5.071 162 H ASP 23 H ASP 23 -8.150 15.993 -5.946 163 HA ASP 23 HA ASP 23 -6.444 15.977 -8.369 164 HB2 ASP 23 HB2 ASP 23 -5.296 17.949 -7.422 165 HB3 ASP 23 HB3 ASP 23 -7.020 18.224 -7.549 166 H VAL 24 H VAL 24 -3.995 16.246 -7.758 167 HA VAL 24 HA VAL 24 -3.130 13.724 -6.925 168 HB VAL 24 HB VAL 24 -1.517 16.281 -7.259 169 HG11 VAL 24 HG11 VAL 24 -0.214 14.601 -5.984 170 HG12 VAL 24 HG12 VAL 24 0.456 14.825 -7.600 171 HG13 VAL 24 HG13 VAL 24 -0.522 13.400 -7.243 172 HG21 VAL 24 HG21 VAL 24 -2.049 14.028 -9.235 173 HG22 VAL 24 HG22 VAL 24 -1.027 15.441 -9.521 174 HG23 VAL 24 HG23 VAL 24 -2.763 15.643 -9.286 175 H LYS 25 H LYS 25 -3.019 16.831 -5.143 176 HA LYS 25 HA LYS 25 -1.712 15.774 -2.827 177 HB2 LYS 25 HB2 LYS 25 -3.052 18.386 -3.503 178 HB3 LYS 25 HB3 LYS 25 -2.751 18.031 -1.811 179 HG2 LYS 25 HG2 LYS 25 -0.389 17.644 -3.582 180 HG3 LYS 25 HG3 LYS 25 -0.971 19.302 -3.475 181 HD2 LYS 25 HD2 LYS 25 0.807 18.835 -1.802 182 HD3 LYS 25 HD3 LYS 25 -0.716 19.281 -1.034 183 HE2 LYS 25 HE2 LYS 25 -1.163 16.877 -0.568 184 HE3 LYS 25 HE3 LYS 25 0.378 16.452 -1.310 185 HZ1 LYS 25 HZ1 LYS 25 1.511 17.684 0.389 186 HZ2 LYS 25 HZ2 LYS 25 0.487 16.549 1.102 187 HZ3 LYS 25 HZ3 LYS 25 0.050 18.180 1.073 188 H ARG 26 H ARG 26 -5.083 16.101 -3.763 189 HA ARG 26 HA ARG 26 -6.311 15.599 -1.247 190 HB2 ARG 26 HB2 ARG 26 -7.562 16.586 -3.087 191 HB3 ARG 26 HB3 ARG 26 -7.287 15.172 -4.092 192 HG2 ARG 26 HG2 ARG 26 -9.571 15.181 -3.306 193 HG3 ARG 26 HG3 ARG 26 -8.708 13.822 -2.591 194 HD2 ARG 26 HD2 ARG 26 -8.527 15.015 -0.470 195 HD3 ARG 26 HD3 ARG 26 -9.290 16.445 -1.179 196 HE ARG 26 HE ARG 26 -11.251 14.848 -1.602 197 HH11 ARG 26 HH11 ARG 26 -9.209 14.571 1.178 198 HH12 ARG 26 HH12 ARG 26 -10.456 13.868 2.137 199 HH21 ARG 26 HH21 ARG 26 -12.803 13.926 -0.359 200 HH22 ARG 26 HH22 ARG 26 -12.461 13.515 1.286 201 H VAL 27 H VAL 27 -5.413 13.425 -3.944 202 HA VAL 27 HA VAL 27 -6.128 10.982 -2.620 203 HB VAL 27 HB VAL 27 -4.154 11.323 -4.927 204 HG11 VAL 27 HG11 VAL 27 -3.990 9.100 -3.864 205 HG12 VAL 27 HG12 VAL 27 -4.713 8.959 -5.467 206 HG13 VAL 27 HG13 VAL 27 -5.735 8.872 -4.031 207 HG21 VAL 27 HG21 VAL 27 -6.059 10.843 -6.440 208 HG22 VAL 27 HG22 VAL 27 -6.314 12.335 -5.533 209 HG23 VAL 27 HG23 VAL 27 -7.161 10.859 -5.060 210 H TRP 28 H TRP 28 -3.099 12.830 -2.913 211 HA TRP 28 HA TRP 28 -1.260 10.990 -1.864 212 HB2 TRP 28 HB2 TRP 28 -0.603 13.034 -3.057 213 HB3 TRP 28 HB3 TRP 28 -1.229 14.029 -1.755 214 HD1 TRP 28 HD1 TRP 28 0.462 14.654 0.133 215 HE1 TRP 28 HE1 TRP 28 2.909 14.074 0.621 216 HE3 TRP 28 HE3 TRP 28 1.101 10.844 -3.224 217 HZ2 TRP 28 HZ2 TRP 28 4.852 12.265 -0.276 218 HZ3 TRP 28 HZ3 TRP 28 3.301 9.747 -3.349 219 HH2 TRP 28 HH2 TRP 28 5.136 10.447 -1.896 220 H ALA 29 H ALA 29 -3.546 13.047 -0.180 221 HA ALA 29 HA ALA 29 -2.474 13.134 2.407 222 HB1 ALA 29 HB1 ALA 29 -4.392 14.473 1.661 223 HB2 ALA 29 HB2 ALA 29 -4.761 13.601 3.153 224 HB3 ALA 29 HB3 ALA 29 -5.395 13.022 1.609 225 H ILE 30 H ILE 30 -4.155 10.475 0.784 226 HA ILE 30 HA ILE 30 -4.723 8.910 3.131 227 HB ILE 30 HB ILE 30 -5.368 7.123 1.684 228 HG12 ILE 30 HG12 ILE 30 -3.701 8.490 -0.466 229 HG13 ILE 30 HG13 ILE 30 -3.419 6.919 0.250 230 HG21 ILE 30 HG21 ILE 30 -6.880 9.077 1.677 231 HG22 ILE 30 HG22 ILE 30 -6.940 8.207 0.140 232 HG23 ILE 30 HG23 ILE 30 -6.041 9.722 0.258 233 HD11 ILE 30 HD11 ILE 30 -4.217 6.687 -1.974 234 HD12 ILE 30 HD12 ILE 30 -5.633 7.677 -1.628 235 HD13 ILE 30 HD13 ILE 30 -5.451 6.096 -0.859 236 H TRP 31 H TRP 31 -1.816 9.544 1.505 237 HA TRP 31 HA TRP 31 -0.419 7.233 2.702 238 HB2 TRP 31 HB2 TRP 31 0.509 9.264 0.612 239 HB3 TRP 31 HB3 TRP 31 1.466 7.904 1.206 240 HD1 TRP 31 HD1 TRP 31 -0.999 8.759 -1.485 241 HE1 TRP 31 HE1 TRP 31 -1.734 6.621 -2.713 242 HE3 TRP 31 HE3 TRP 31 0.918 5.253 1.728 243 HZ2 TRP 31 HZ2 TRP 31 -1.522 3.836 -2.376 244 HZ3 TRP 31 HZ3 TRP 31 0.613 2.871 1.194 245 HH2 TRP 31 HH2 TRP 31 -0.584 2.177 -0.817 246 H GLU 32 H GLU 32 -0.410 10.776 2.513 247 HA GLU 32 HA GLU 32 1.955 11.144 4.087 248 HB2 GLU 32 HB2 GLU 32 1.255 12.664 2.236 249 HB3 GLU 32 HB3 GLU 32 -0.133 13.180 3.188 250 HG2 GLU 32 HG2 GLU 32 1.303 14.235 4.826 251 HG3 GLU 32 HG3 GLU 32 2.743 13.550 4.078 252 H ASP 33 H ASP 33 -1.535 11.471 4.709 253 HA ASP 33 HA ASP 33 -1.060 12.021 7.556 254 HB2 ASP 33 HB2 ASP 33 -2.770 13.395 6.328 255 HB3 ASP 33 HB3 ASP 33 -3.697 11.934 6.035 256 HA PRO 34 HA PRO 34 -1.414 7.560 8.409 257 HB2 PRO 34 HB2 PRO 34 -1.696 7.787 11.175 258 HB3 PRO 34 HB3 PRO 34 -0.160 7.839 10.315 259 HG2 PRO 34 HG2 PRO 34 -1.872 10.131 11.260 260 HG3 PRO 34 HG3 PRO 34 -0.113 9.917 11.419 261 HD2 PRO 34 HD2 PRO 34 -1.114 11.505 9.512 262 HD3 PRO 34 HD3 PRO 34 0.277 10.455 9.153 263 H ARG 35 H ARG 35 -3.806 9.917 9.555 264 HA ARG 35 HA ARG 35 -5.737 7.978 10.454 265 HB2 ARG 35 HB2 ARG 35 -6.256 10.892 9.750 266 HB3 ARG 35 HB3 ARG 35 -7.249 9.855 10.770 267 HG2 ARG 35 HG2 ARG 35 -4.405 10.659 11.468 268 HG3 ARG 35 HG3 ARG 35 -5.825 11.572 11.973 269 HD2 ARG 35 HD2 ARG 35 -5.147 10.178 13.811 270 HD3 ARG 35 HD3 ARG 35 -6.644 9.526 13.164 271 HE ARG 35 HE ARG 35 -5.530 7.630 12.482 272 HH11 ARG 35 HH11 ARG 35 -3.163 9.904 13.600 273 HH12 ARG 35 HH12 ARG 35 -1.940 8.692 13.752 274 HH21 ARG 35 HH21 ARG 35 -3.934 6.122 12.687 275 HH22 ARG 35 HH22 ARG 35 -2.370 6.599 13.244 276 H GLN 36 H GLN 36 -5.402 9.994 7.507 277 HA GLN 36 HA GLN 36 -7.664 9.055 6.084 278 HB2 GLN 36 HB2 GLN 36 -4.994 9.907 4.882 279 HB3 GLN 36 HB3 GLN 36 -6.541 9.851 4.043 280 HG2 GLN 36 HG2 GLN 36 -5.793 11.716 6.303 281 HG3 GLN 36 HG3 GLN 36 -5.871 12.136 4.593 282 HE21 GLN 36 HE21 GLN 36 -7.279 13.228 6.889 283 HE22 GLN 36 HE22 GLN 36 -8.950 13.102 6.522 284 H LEU 37 H LEU 37 -4.397 7.788 6.415 285 HA LEU 37 HA LEU 37 -4.439 5.792 4.415 286 HB2 LEU 37 HB2 LEU 37 -2.386 6.652 5.365 287 HB3 LEU 37 HB3 LEU 37 -2.825 6.088 6.966 288 HG LEU 37 HG LEU 37 -2.520 3.742 6.250 289 HD11 LEU 37 HD11 LEU 37 -3.142 3.924 3.874 290 HD12 LEU 37 HD12 LEU 37 -1.574 3.133 4.080 291 HD13 LEU 37 HD13 LEU 37 -1.652 4.821 3.549 292 HD21 LEU 37 HD21 LEU 37 -0.151 5.510 5.592 293 HD22 LEU 37 HD22 LEU 37 -0.086 3.785 5.983 294 HD23 LEU 37 HD23 LEU 37 -0.629 4.943 7.197 295 H GLU 38 H GLU 38 -5.049 5.513 7.946 296 HA GLU 38 HA GLU 38 -5.519 2.691 7.914 297 HB2 GLU 38 HB2 GLU 38 -6.241 2.960 10.249 298 HB3 GLU 38 HB3 GLU 38 -4.753 3.850 9.937 299 HG2 GLU 38 HG2 GLU 38 -6.034 5.944 9.764 300 HG3 GLU 38 HG3 GLU 38 -7.530 5.064 10.073 301 H ARG 39 H ARG 39 -7.559 5.236 6.883 302 HA ARG 39 HA ARG 39 -10.138 4.272 7.523 303 HB2 ARG 39 HB2 ARG 39 -9.278 5.831 5.043 304 HB3 ARG 39 HB3 ARG 39 -10.940 5.628 5.594 305 HG2 ARG 39 HG2 ARG 39 -8.730 7.161 6.987 306 HG3 ARG 39 HG3 ARG 39 -10.144 7.833 6.171 307 HD2 ARG 39 HD2 ARG 39 -11.590 6.693 7.845 308 HD3 ARG 39 HD3 ARG 39 -10.142 6.143 8.696 309 HE ARG 39 HE ARG 39 -10.987 8.964 8.379 310 HH11 ARG 39 HH11 ARG 39 -9.151 6.613 10.157 311 HH12 ARG 39 HH12 ARG 39 -8.804 7.719 11.434 312 HH21 ARG 39 HH21 ARG 39 -10.505 10.333 9.987 313 HH22 ARG 39 HH22 ARG 39 -9.566 9.804 11.338 314 H TRP 40 H TRP 40 -7.894 3.433 4.957 315 HA TRP 40 HA TRP 40 -9.858 1.578 3.719 316 HB2 TRP 40 HB2 TRP 40 -8.818 2.127 1.535 317 HB3 TRP 40 HB3 TRP 40 -9.490 3.558 2.309 318 HD1 TRP 40 HD1 TRP 40 -7.704 5.396 3.265 319 HE1 TRP 40 HE1 TRP 40 -5.263 5.863 2.611 320 HE3 TRP 40 HE3 TRP 40 -6.637 1.039 0.810 321 HZ2 TRP 40 HZ2 TRP 40 -3.176 4.591 1.210 322 HZ3 TRP 40 HZ3 TRP 40 -4.403 0.739 -0.166 323 HH2 TRP 40 HH2 TRP 40 -2.711 2.480 0.037 324 H TRP 41 H TRP 41 -6.630 1.978 4.972 325 HA TRP 41 HA TRP 41 -5.028 0.334 3.431 326 HB2 TRP 41 HB2 TRP 41 -4.225 1.866 5.230 327 HB3 TRP 41 HB3 TRP 41 -4.790 0.728 6.449 328 HD1 TRP 41 HD1 TRP 41 -2.871 -0.795 7.342 329 HE1 TRP 41 HE1 TRP 41 -0.608 -1.609 6.439 330 HE3 TRP 41 HE3 TRP 41 -3.091 1.188 2.635 331 HZ2 TRP 41 HZ2 TRP 41 0.872 -1.450 4.057 332 HZ3 TRP 41 HZ3 TRP 41 -1.228 0.785 1.090 333 HH2 TRP 41 HH2 TRP 41 0.723 -0.512 1.787 334 H GLY 42 H GLY 42 -7.094 -0.648 6.125 335 HA2 GLY 42 HA2 GLY 42 -6.545 -3.501 5.653 336 HA3 GLY 42 HA3 GLY 42 -7.494 -2.818 6.961 337 HA PRO 43 HA PRO 43 -10.152 -4.085 3.020 338 HB2 PRO 43 HB2 PRO 43 -10.882 -6.672 3.689 339 HB3 PRO 43 HB3 PRO 43 -9.492 -6.289 2.664 340 HG2 PRO 43 HG2 PRO 43 -9.556 -6.878 5.625 341 HG3 PRO 43 HG3 PRO 43 -8.453 -7.523 4.388 342 HD2 PRO 43 HD2 PRO 43 -7.684 -5.510 6.004 343 HD3 PRO 43 HD3 PRO 43 -7.189 -5.530 4.296 344 HA PRO 44 HA PRO 44 -14.054 -2.961 4.997 345 HB2 PRO 44 HB2 PRO 44 -15.220 -5.442 3.694 346 HB3 PRO 44 HB3 PRO 44 -15.880 -3.798 3.761 347 HG2 PRO 44 HG2 PRO 44 -14.677 -4.602 1.545 348 HG3 PRO 44 HG3 PRO 44 -14.334 -2.974 2.173 349 HD2 PRO 44 HD2 PRO 44 -12.630 -5.457 2.295 350 HD3 PRO 44 HD3 PRO 44 -12.136 -3.761 2.073 351 H THR 45 H THR 45 -12.993 -6.294 5.474 352 HA THR 45 HA THR 45 -14.726 -6.741 7.806 353 HB THR 45 HB THR 45 -13.683 -9.055 7.788 354 HG1 THR 45 HG1 THR 45 -12.154 -9.534 6.331 355 HG21 THR 45 HG21 THR 45 -14.922 -8.171 5.152 356 HG22 THR 45 HG22 THR 45 -15.818 -8.645 6.599 357 HG23 THR 45 HG23 THR 45 -14.830 -9.832 5.741 358 H TRP 46 H TRP 46 -11.334 -6.054 7.105 359 HA TRP 46 HA TRP 46 -10.627 -6.188 9.998 360 HB2 TRP 46 HB2 TRP 46 -8.978 -6.957 7.558 361 HB3 TRP 46 HB3 TRP 46 -8.225 -6.617 9.109 362 HD1 TRP 46 HD1 TRP 46 -11.064 -9.028 7.860 363 HE1 TRP 46 HE1 TRP 46 -10.771 -11.254 9.108 364 HE3 TRP 46 HE3 TRP 46 -6.996 -7.847 10.713 365 HZ2 TRP 46 HZ2 TRP 46 -9.066 -12.371 11.015 366 HZ3 TRP 46 HZ3 TRP 46 -6.083 -9.566 12.215 367 HH2 TRP 46 HH2 TRP 46 -7.090 -11.787 12.362 368 HA PRO 47 HA PRO 47 -9.954 -1.714 8.741 369 HB2 PRO 47 HB2 PRO 47 -10.602 -0.651 11.203 370 HB3 PRO 47 HB3 PRO 47 -11.801 -1.018 9.957 371 HG2 PRO 47 HG2 PRO 47 -10.983 -2.686 12.343 372 HG3 PRO 47 HG3 PRO 47 -12.620 -2.307 11.761 373 HD2 PRO 47 HD2 PRO 47 -11.451 -4.677 11.199 374 HD3 PRO 47 HD3 PRO 47 -12.497 -3.867 10.008 375 H ALA 48 H ALA 48 -7.974 -0.768 8.846 376 HA ALA 48 HA ALA 48 -5.866 -1.876 10.502 377 HB1 ALA 48 HB1 ALA 48 -5.459 -1.296 8.133 378 HB2 ALA 48 HB2 ALA 48 -4.366 -0.421 9.210 379 HB3 ALA 48 HB3 ALA 48 -5.755 0.405 8.497 380 H THR 49 H THR 49 -4.528 -0.681 11.943 381 HA THR 49 HA THR 49 -5.495 1.909 13.004 382 HB THR 49 HB THR 49 -4.842 -0.536 14.732 383 HG1 THR 49 HG1 THR 49 -7.162 0.326 13.657 384 HG21 THR 49 HG21 THR 49 -4.094 1.540 15.838 385 HG22 THR 49 HG22 THR 49 -5.508 0.876 16.659 386 HG23 THR 49 HG23 THR 49 -5.685 2.264 15.582 387 H PHE 50 H PHE 50 -3.779 3.265 12.769 388 HA PHE 50 HA PHE 50 -1.016 2.228 12.864 389 HB2 PHE 50 HB2 PHE 50 -2.261 4.716 11.656 390 HB3 PHE 50 HB3 PHE 50 -0.532 4.686 12.000 391 HD1 PHE 50 HD1 PHE 50 -3.214 2.829 10.148 392 HD2 PHE 50 HD2 PHE 50 0.978 3.648 10.490 393 HE1 PHE 50 HE1 PHE 50 -2.793 1.586 8.069 394 HE2 PHE 50 HE2 PHE 50 1.385 2.401 8.415 395 HZ PHE 50 HZ PHE 50 -0.496 1.369 7.202 396 H GLU 51 H GLU 51 -0.041 2.257 14.744 397 HA GLU 51 HA GLU 51 -0.487 4.156 16.876 398 HB2 GLU 51 HB2 GLU 51 1.731 2.106 16.521 399 HB3 GLU 51 HB3 GLU 51 1.336 2.950 18.018 400 HG2 GLU 51 HG2 GLU 51 -0.408 0.939 16.572 401 HG3 GLU 51 HG3 GLU 51 0.504 0.658 18.051 402 H THR 52 H THR 52 2.021 3.561 14.483 403 HA THR 52 HA THR 52 3.167 6.242 14.993 404 HB THR 52 HB THR 52 4.795 3.717 14.416 405 HG1 THR 52 HG1 THR 52 5.514 4.242 16.692 406 HG21 THR 52 HG21 THR 52 5.655 6.511 15.227 407 HG22 THR 52 HG22 THR 52 5.863 5.798 13.626 408 HG23 THR 52 HG23 THR 52 6.731 5.123 15.005 409 H HIS 53 H HIS 53 3.749 7.366 13.138 410 HA HIS 53 HA HIS 53 4.188 6.111 10.570 411 HB2 HIS 53 HB2 HIS 53 1.709 6.109 10.707 412 HB3 HIS 53 HB3 HIS 53 1.711 7.837 11.010 413 HD2 HIS 53 HD2 HIS 53 1.831 5.344 8.072 414 HE1 HIS 53 HE1 HIS 53 1.932 9.280 6.535 415 HE2 HIS 53 HE2 HIS 53 1.443 6.862 6.005 416 H GLU 54 H GLU 54 6.165 7.198 10.550 417 HA GLU 54 HA GLU 54 6.530 9.948 11.282 418 HB2 GLU 54 HB2 GLU 54 8.379 8.141 9.664 419 HB3 GLU 54 HB3 GLU 54 8.835 9.667 10.416 420 HG2 GLU 54 HG2 GLU 54 8.020 7.116 11.838 421 HG3 GLU 54 HG3 GLU 54 9.644 7.790 11.728 422 H PHE 55 H PHE 55 6.278 8.256 8.203 423 HA PHE 55 HA PHE 55 6.345 8.795 6.041 424 HB2 PHE 55 HB2 PHE 55 4.125 9.867 6.840 425 HB3 PHE 55 HB3 PHE 55 4.950 11.414 6.694 426 HD1 PHE 55 HD1 PHE 55 4.017 8.357 4.784 427 HD2 PHE 55 HD2 PHE 55 5.114 12.476 4.527 428 HE1 PHE 55 HE1 PHE 55 3.534 8.333 2.380 429 HE2 PHE 55 HE2 PHE 55 4.613 12.446 2.118 430 HZ PHE 55 HZ PHE 55 3.825 10.372 1.049 431 H THR 56 H THR 56 8.693 8.975 6.434 432 HA THR 56 HA THR 56 9.804 11.238 5.060 433 HB THR 56 HB THR 56 9.765 12.276 7.282 434 HG1 THR 56 HG1 THR 56 11.647 13.072 6.775 435 HG21 THR 56 HG21 THR 56 9.724 10.247 8.697 436 HG22 THR 56 HG22 THR 56 11.007 11.350 9.200 437 HG23 THR 56 HG23 THR 56 11.405 9.910 8.261 438 H VAL 57 H VAL 57 12.193 10.947 4.683 439 HA VAL 57 HA VAL 57 12.731 8.286 3.811 440 HB VAL 57 HB VAL 57 14.588 10.701 4.000 441 HG11 VAL 57 HG11 VAL 57 16.017 9.538 2.332 442 HG12 VAL 57 HG12 VAL 57 14.977 8.118 2.434 443 HG13 VAL 57 HG13 VAL 57 15.911 8.627 3.841 444 HG21 VAL 57 HG21 VAL 57 12.621 11.121 2.554 445 HG22 VAL 57 HG22 VAL 57 12.975 9.663 1.625 446 HG23 VAL 57 HG23 VAL 57 14.097 11.026 1.589 447 H GLY 58 H GLY 58 13.441 6.625 5.028 448 HA2 GLY 58 HA2 GLY 58 14.902 5.471 6.474 449 HA3 GLY 58 HA3 GLY 58 15.366 6.979 7.236 450 H GLY 59 H GLY 59 12.272 7.518 7.309 451 HA2 GLY 59 HA2 GLY 59 11.924 6.588 10.047 452 HA3 GLY 59 HA3 GLY 59 10.867 7.675 9.157 453 H LYS 60 H LYS 60 9.907 5.560 10.785 454 HA LYS 60 HA LYS 60 8.905 3.566 8.824 455 HB2 LYS 60 HB2 LYS 60 9.824 3.076 11.689 456 HB3 LYS 60 HB3 LYS 60 8.978 1.882 10.702 457 HG2 LYS 60 HG2 LYS 60 10.848 2.005 9.035 458 HG3 LYS 60 HG3 LYS 60 11.706 3.093 10.132 459 HD2 LYS 60 HD2 LYS 60 11.792 1.306 11.841 460 HD3 LYS 60 HD3 LYS 60 10.890 0.225 10.772 461 HE2 LYS 60 HE2 LYS 60 12.743 0.274 9.144 462 HE3 LYS 60 HE3 LYS 60 13.637 1.394 10.174 463 HZ1 LYS 60 HZ1 LYS 60 14.424 -0.850 10.436 464 HZ2 LYS 60 HZ2 LYS 60 12.885 -1.391 10.868 465 HZ3 LYS 60 HZ3 LYS 60 13.716 -0.325 11.877 466 H ALA 61 H ALA 61 7.005 2.286 9.757 467 HA ALA 61 HA ALA 61 5.156 3.914 11.380 468 HB1 ALA 61 HB1 ALA 61 4.611 4.447 9.031 469 HB2 ALA 61 HB2 ALA 61 3.296 3.565 9.807 470 HB3 ALA 61 HB3 ALA 61 4.375 2.735 8.687 471 H ALA 62 H ALA 62 3.902 2.727 12.739 472 HA ALA 62 HA ALA 62 4.140 -0.237 12.707 473 HB1 ALA 62 HB1 ALA 62 3.831 1.611 15.109 474 HB2 ALA 62 HB2 ALA 62 5.314 0.784 14.623 475 HB3 ALA 62 HB3 ALA 62 3.921 -0.154 15.165 476 H TYR 63 H TYR 63 2.248 -1.358 12.564 477 HA TYR 63 HA TYR 63 -0.301 -0.158 13.344 478 HB2 TYR 63 HB2 TYR 63 -1.351 -0.492 11.123 479 HB3 TYR 63 HB3 TYR 63 -0.055 0.689 11.067 480 HD1 TYR 63 HD1 TYR 63 2.117 0.128 9.921 481 HD2 TYR 63 HD2 TYR 63 -1.205 -2.570 9.816 482 HE1 TYR 63 HE1 TYR 63 3.138 -1.058 8.032 483 HE2 TYR 63 HE2 TYR 63 -0.177 -3.758 7.927 484 HH TYR 63 HH TYR 63 3.061 -3.306 6.997 485 H TYR 64 H TYR 64 -2.133 -1.600 13.081 486 HA TYR 64 HA TYR 64 -1.722 -4.412 12.503 487 HB2 TYR 64 HB2 TYR 64 -2.791 -5.165 14.681 488 HB3 TYR 64 HB3 TYR 64 -1.167 -4.514 14.857 489 HD1 TYR 64 HD2 TYR 64 -0.820 -2.266 15.900 490 HD2 TYR 64 HD1 TYR 64 -4.713 -4.034 15.741 491 HE1 TYR 64 HE2 TYR 64 -1.613 -0.691 17.594 492 HE2 TYR 64 HE1 TYR 64 -5.502 -2.439 17.442 493 HH TYR 64 HH TYR 64 -3.660 0.313 18.362 494 H MET 65 H MET 65 -3.586 -5.365 11.725 495 HA MET 65 HA MET 65 -5.977 -3.695 11.380 496 HB2 MET 65 HB2 MET 65 -5.304 -6.461 10.282 497 HB3 MET 65 HB3 MET 65 -6.755 -5.543 9.887 498 HG2 MET 65 HG2 MET 65 -5.386 -3.799 8.841 499 HG3 MET 65 HG3 MET 65 -3.916 -4.678 9.261 500 HE1 MET 65 HE1 MET 65 -4.852 -7.737 8.684 501 HE2 MET 65 HE2 MET 65 -3.286 -7.084 8.200 502 HE3 MET 65 HE3 MET 65 -4.299 -7.912 7.020 503 H THR 66 H THR 66 -7.315 -3.684 13.098 504 HA THR 66 HA THR 66 -7.590 -5.850 14.978 505 HB THR 66 HB THR 66 -9.342 -3.367 14.641 506 HG1 THR 66 HG1 THR 66 -7.860 -2.325 15.763 507 HG21 THR 66 HG21 THR 66 -9.975 -3.741 17.011 508 HG22 THR 66 HG22 THR 66 -9.047 -5.240 17.024 509 HG23 THR 66 HG23 THR 66 -10.476 -5.100 15.997 510 H GLY 67 H GLY 67 -8.660 -7.667 14.478 511 HA2 GLY 67 HA2 GLY 67 -10.226 -7.968 12.116 512 HA3 GLY 67 HA3 GLY 67 -9.893 -9.199 13.319 513 HA PRO 68 HA PRO 68 -14.493 -7.760 13.379 514 HB2 PRO 68 HB2 PRO 68 -15.645 -10.038 12.350 515 HB3 PRO 68 HB3 PRO 68 -15.102 -8.695 11.337 516 HG2 PRO 68 HG2 PRO 68 -13.669 -11.280 11.982 517 HG3 PRO 68 HG3 PRO 68 -13.867 -10.484 10.403 518 HD2 PRO 68 HD2 PRO 68 -11.583 -10.264 11.843 519 HD3 PRO 68 HD3 PRO 68 -12.180 -8.918 10.850 520 H ASP 69 H ASP 69 -12.666 -10.479 14.459 521 HA ASP 69 HA ASP 69 -14.523 -11.106 16.679 522 HB2 ASP 69 HB2 ASP 69 -12.919 -13.158 16.898 523 HB3 ASP 69 HB3 ASP 69 -14.045 -13.115 15.546 524 H GLY 70 H GLY 70 -11.751 -9.281 16.053 525 HA2 GLY 70 HA2 GLY 70 -10.928 -7.839 17.825 526 HA3 GLY 70 HA3 GLY 70 -11.008 -9.194 18.934 527 H THR 71 H THR 71 -9.751 -10.570 16.232 528 HA THR 71 HA THR 71 -7.103 -10.759 17.299 529 HB THR 71 HB THR 71 -8.122 -11.629 14.552 530 HG1 THR 71 HG1 THR 71 -9.121 -12.695 16.327 531 HG21 THR 71 HG21 THR 71 -5.652 -11.454 14.512 532 HG22 THR 71 HG22 THR 71 -6.155 -13.145 14.490 533 HG23 THR 71 HG23 THR 71 -5.546 -12.426 15.982 534 H LYS 72 H LYS 72 -5.692 -9.122 17.254 535 HA LYS 72 HA LYS 72 -5.562 -7.123 15.144 536 HB2 LYS 72 HB2 LYS 72 -3.809 -7.580 17.599 537 HB3 LYS 72 HB3 LYS 72 -3.744 -6.161 16.551 538 HG2 LYS 72 HG2 LYS 72 -5.946 -5.461 17.218 539 HG3 LYS 72 HG3 LYS 72 -6.239 -6.986 18.066 540 HD2 LYS 72 HD2 LYS 72 -4.493 -6.418 19.714 541 HD3 LYS 72 HD3 LYS 72 -4.155 -4.906 18.863 542 HE2 LYS 72 HE2 LYS 72 -6.316 -4.012 19.437 543 HE3 LYS 72 HE3 LYS 72 -6.883 -5.574 20.021 544 HZ1 LYS 72 HZ1 LYS 72 -4.728 -3.949 21.254 545 HZ2 LYS 72 HZ2 LYS 72 -5.285 -5.440 21.824 546 HZ3 LYS 72 HZ3 LYS 72 -6.311 -4.095 21.830 547 H ALA 73 H ALA 73 -4.580 -7.631 13.272 548 HA ALA 73 HA ALA 73 -2.379 -9.579 13.111 549 HB1 ALA 73 HB1 ALA 73 -3.888 -8.145 10.892 550 HB2 ALA 73 HB2 ALA 73 -4.213 -9.778 11.476 551 HB3 ALA 73 HB3 ALA 73 -2.684 -9.421 10.671 552 H ARG 74 H ARG 74 -0.443 -8.673 13.668 553 HA ARG 74 HA ARG 74 0.111 -5.867 13.425 554 HB2 ARG 74 HB2 ARG 74 1.961 -8.161 14.213 555 HB3 ARG 74 HB3 ARG 74 2.432 -6.468 14.243 556 HG2 ARG 74 HG2 ARG 74 1.901 -6.882 16.472 557 HG3 ARG 74 HG3 ARG 74 0.421 -6.138 15.868 558 HD2 ARG 74 HD2 ARG 74 -0.533 -8.443 15.572 559 HD3 ARG 74 HD3 ARG 74 0.932 -9.099 16.310 560 HE ARG 74 HE ARG 74 -0.229 -7.155 17.997 561 HH11 ARG 74 HH11 ARG 74 -0.792 -10.408 16.972 562 HH12 ARG 74 HH12 ARG 74 -1.603 -10.829 18.433 563 HH21 ARG 74 HH21 ARG 74 -1.288 -7.707 19.824 564 HH22 ARG 74 HH22 ARG 74 -1.880 -9.314 20.036 565 H GLY 75 H GLY 75 1.315 -4.765 12.002 566 HA2 GLY 75 HA2 GLY 75 3.121 -6.136 10.120 567 HA3 GLY 75 HA3 GLY 75 1.896 -5.038 9.487 568 H TRP 76 H TRP 76 4.756 -4.761 9.238 569 HA TRP 76 HA TRP 76 5.145 -2.160 10.618 570 HB2 TRP 76 HB2 TRP 76 7.585 -2.545 10.566 571 HB3 TRP 76 HB3 TRP 76 6.767 -3.815 11.470 572 HD1 TRP 76 HD1 TRP 76 6.793 -6.295 10.410 573 HE1 TRP 76 HE1 TRP 76 8.262 -7.386 8.612 574 HE3 TRP 76 HE3 TRP 76 8.857 -2.080 8.369 575 HZ2 TRP 76 HZ2 TRP 76 10.059 -6.586 6.597 576 HZ3 TRP 76 HZ3 TRP 76 10.446 -2.329 6.502 577 HH2 TRP 76 HH2 TRP 76 11.034 -4.541 5.636 578 H TRP 77 H TRP 77 6.350 -0.586 9.424 579 HA TRP 77 HA TRP 77 6.441 -0.856 6.479 580 HB2 TRP 77 HB2 TRP 77 4.433 0.553 7.978 581 HB3 TRP 77 HB3 TRP 77 5.469 1.797 7.310 582 HD1 TRP 77 HD1 TRP 77 4.775 -1.332 5.176 583 HE1 TRP 77 HE1 TRP 77 3.239 -0.632 3.232 584 HE3 TRP 77 HE3 TRP 77 3.672 3.411 6.686 585 HZ2 TRP 77 HZ2 TRP 77 1.750 1.650 2.460 586 HZ3 TRP 77 HZ3 TRP 77 2.194 4.788 5.293 587 HH2 TRP 77 HH2 TRP 77 1.250 3.925 3.221 588 H GLN 78 H GLN 78 7.955 0.605 5.454 589 HA GLN 78 HA GLN 78 9.544 2.413 7.145 590 HB2 GLN 78 HB2 GLN 78 10.862 0.418 7.354 591 HB3 GLN 78 HB3 GLN 78 10.727 0.047 5.637 592 HG2 GLN 78 HG2 GLN 78 12.250 1.771 5.031 593 HG3 GLN 78 HG3 GLN 78 12.150 2.545 6.605 594 HE21 GLN 78 HE21 GLN 78 14.408 2.510 6.786 595 HE22 GLN 78 HE22 GLN 78 15.288 1.065 7.125 596 H PHE 79 H PHE 79 9.317 4.290 6.135 597 HA PHE 79 HA PHE 79 8.851 4.627 3.319 598 HB2 PHE 79 HB2 PHE 79 9.556 6.740 5.401 599 HB3 PHE 79 HB3 PHE 79 8.867 7.039 3.807 600 HD1 PHE 79 HD2 PHE 79 6.525 6.234 3.298 601 HD2 PHE 79 HD1 PHE 79 8.157 6.144 7.256 602 HE1 PHE 79 HE2 PHE 79 4.271 6.011 4.238 603 HE2 PHE 79 HE1 PHE 79 5.896 5.907 8.178 604 HZ PHE 79 HZ PHE 79 3.960 5.848 6.670 605 H THR 80 H THR 80 10.348 4.683 1.781 606 HA THR 80 HA THR 80 13.198 4.686 2.503 607 HB THR 80 HB THR 80 12.037 3.776 -0.152 608 HG1 THR 80 HG1 THR 80 12.384 1.858 1.853 609 HG21 THR 80 HG21 THR 80 13.903 2.197 -0.138 610 HG22 THR 80 HG22 THR 80 14.404 2.771 1.460 611 HG23 THR 80 HG23 THR 80 14.515 3.846 0.060 612 H THR 81 H THR 81 10.965 6.137 0.096 613 HA THR 81 HA THR 81 12.795 8.371 -0.430 614 HB THR 81 HB THR 81 11.901 6.486 -2.663 615 HG1 THR 81 HG1 THR 81 14.561 7.277 -2.118 616 HG21 THR 81 HG21 THR 81 11.717 8.790 -3.490 617 HG22 THR 81 HG22 THR 81 13.125 8.011 -4.217 618 HG23 THR 81 HG23 THR 81 13.337 9.161 -2.892 619 H ILE 82 H ILE 82 11.477 10.082 -0.126 620 HA ILE 82 HA ILE 82 8.730 10.079 -1.281 621 HB ILE 82 HB ILE 82 9.555 11.467 1.316 622 HG12 ILE 82 HG12 ILE 82 7.985 8.883 0.924 623 HG13 ILE 82 HG13 ILE 82 9.562 9.038 1.681 624 HG21 ILE 82 HG21 ILE 82 7.733 12.623 0.103 625 HG22 ILE 82 HG22 ILE 82 7.134 11.903 1.597 626 HG23 ILE 82 HG23 ILE 82 6.800 11.122 0.050 627 HD11 ILE 82 HD11 ILE 82 8.515 10.329 3.506 628 HD12 ILE 82 HD12 ILE 82 7.872 8.697 3.340 629 HD13 ILE 82 HD13 ILE 82 6.942 10.070 2.747 630 H GLU 83 H GLU 83 8.707 11.532 -2.937 631 HA GLU 83 HA GLU 83 10.296 14.022 -2.745 632 HB2 GLU 83 HB2 GLU 83 8.845 12.840 -5.143 633 HB3 GLU 83 HB3 GLU 83 9.788 14.330 -5.151 634 HG2 GLU 83 HG2 GLU 83 11.777 12.906 -4.399 635 HG3 GLU 83 HG3 GLU 83 10.784 11.498 -4.781 636 H ALA 84 H ALA 84 6.969 12.903 -3.219 637 HA ALA 84 HA ALA 84 4.937 13.801 -2.931 638 HB1 ALA 84 HB1 ALA 84 4.586 15.675 -1.377 639 HB2 ALA 84 HB2 ALA 84 6.313 16.049 -1.420 640 HB3 ALA 84 HB3 ALA 84 5.758 14.527 -0.722 641 HA PRO 85 HA PRO 85 3.040 14.656 -3.010 642 HB2 PRO 85 HB2 PRO 85 0.857 15.557 -4.200 643 HB3 PRO 85 HB3 PRO 85 1.876 16.696 -3.302 644 HG2 PRO 85 HG2 PRO 85 1.706 16.251 -6.284 645 HG3 PRO 85 HG3 PRO 85 1.829 17.780 -5.392 646 HD2 PRO 85 HD2 PRO 85 4.000 16.358 -6.554 647 HD3 PRO 85 HD3 PRO 85 4.136 17.683 -5.378 648 H ASP 86 H ASP 86 4.466 13.678 -5.662 649 HA ASP 86 HA ASP 86 2.332 11.880 -6.670 650 HB2 ASP 86 HB2 ASP 86 3.477 11.909 -8.835 651 HB3 ASP 86 HB3 ASP 86 3.090 13.545 -8.325 652 H HIS 87 H HIS 87 5.864 12.004 -6.045 653 HA HIS 87 HA HIS 87 6.122 9.109 -6.470 654 HB2 HIS 87 HB2 HIS 87 7.736 10.787 -7.473 655 HB3 HIS 87 HB3 HIS 87 8.299 11.158 -5.852 656 HD1 HIS 87 HD1 HIS 87 10.314 10.201 -7.862 657 HD2 HIS 87 HD2 HIS 87 8.244 7.550 -5.416 658 HE1 HIS 87 HE1 HIS 87 11.730 8.138 -7.759 659 HE2 HIS 87 HE2 HIS 87 10.546 6.644 -6.142 660 H LEU 88 H LEU 88 5.844 7.800 -4.842 661 HA LEU 88 HA LEU 88 7.092 8.275 -2.206 662 HB2 LEU 88 HB2 LEU 88 4.676 8.515 -1.915 663 HB3 LEU 88 HB3 LEU 88 4.373 7.023 -2.779 664 HG LEU 88 HG LEU 88 5.414 5.737 -0.925 665 HD11 LEU 88 HD11 LEU 88 5.685 8.399 0.497 666 HD12 LEU 88 HD12 LEU 88 7.004 7.377 -0.079 667 HD13 LEU 88 HD13 LEU 88 5.956 6.808 1.217 668 HD21 LEU 88 HD21 LEU 88 3.635 6.065 0.733 669 HD22 LEU 88 HD22 LEU 88 3.002 6.087 -0.912 670 HD23 LEU 88 HD23 LEU 88 3.202 7.602 -0.022 671 H GLU 89 H GLU 89 8.347 6.586 -1.546 672 HA GLU 89 HA GLU 89 7.937 3.875 -2.617 673 HB2 GLU 89 HB2 GLU 89 10.633 5.299 -2.408 674 HB3 GLU 89 HB3 GLU 89 10.463 3.559 -2.599 675 HG2 GLU 89 HG2 GLU 89 9.256 3.963 -4.747 676 HG3 GLU 89 HG3 GLU 89 9.597 5.682 -4.571 677 H PHE 90 H PHE 90 8.108 2.325 -1.114 678 HA PHE 90 HA PHE 90 9.445 2.682 1.422 679 HB2 PHE 90 HB2 PHE 90 7.413 2.210 2.815 680 HB3 PHE 90 HB3 PHE 90 7.337 3.762 1.996 681 HD1 PHE 90 HD2 PHE 90 6.015 0.272 1.949 682 HD2 PHE 90 HD1 PHE 90 5.565 4.251 0.447 683 HE1 PHE 90 HE2 PHE 90 3.828 -0.314 1.000 684 HE2 PHE 90 HE1 PHE 90 3.387 3.643 -0.492 685 HZ PHE 90 HZ PHE 90 2.515 1.363 -0.225 686 H ASP 91 H ASP 91 9.143 0.685 2.787 687 HA ASP 91 HA ASP 91 9.114 -1.750 1.133 688 HB2 ASP 91 HB2 ASP 91 10.352 -1.238 3.867 689 HB3 ASP 91 HB3 ASP 91 10.472 -2.740 2.949 690 H ASP 92 H ASP 92 7.202 -2.782 1.210 691 HA ASP 92 HA ASP 92 5.291 -2.699 3.334 692 HB2 ASP 92 HB2 ASP 92 5.484 -5.000 1.355 693 HB3 ASP 92 HB3 ASP 92 4.045 -4.318 2.100 694 H GLY 93 H GLY 93 4.950 -4.198 5.032 695 HA2 GLY 93 HA2 GLY 93 6.478 -6.663 5.209 696 HA3 GLY 93 HA3 GLY 93 6.983 -5.421 6.340 697 H PHE 94 H PHE 94 5.652 -8.115 6.590 698 HA PHE 94 HA PHE 94 3.390 -7.399 8.353 699 HB2 PHE 94 HB2 PHE 94 4.374 -10.117 7.368 700 HB3 PHE 94 HB3 PHE 94 3.010 -9.879 8.450 701 HD1 PHE 94 HD1 PHE 94 4.227 -9.204 4.979 702 HD2 PHE 94 HD2 PHE 94 0.835 -9.425 7.584 703 HE1 PHE 94 HE1 PHE 94 2.720 -9.079 3.039 704 HE2 PHE 94 HE2 PHE 94 -0.659 -9.291 5.639 705 HZ PHE 94 HZ PHE 94 0.279 -9.124 3.368 706 H ALA 95 H ALA 95 3.503 -7.841 10.545 707 HA ALA 95 HA ALA 95 6.115 -8.708 11.670 708 HB1 ALA 95 HB1 ALA 95 4.069 -6.806 12.890 709 HB2 ALA 95 HB2 ALA 95 5.602 -6.339 12.149 710 HB3 ALA 95 HB3 ALA 95 5.596 -7.303 13.629 711 H ASP 96 H ASP 96 6.083 -10.144 13.374 712 HA ASP 96 HA ASP 96 4.065 -12.133 13.495 713 HB2 ASP 96 HB2 ASP 96 6.459 -12.573 13.871 714 HB3 ASP 96 HB3 ASP 96 6.464 -11.530 15.288 715 H GLU 97 H GLU 97 3.083 -12.846 15.741 716 HA GLU 97 HA GLU 97 1.314 -10.917 16.741 717 HB2 GLU 97 HB2 GLU 97 0.686 -12.565 18.432 718 HB3 GLU 97 HB3 GLU 97 0.911 -13.346 16.872 719 HG2 GLU 97 HG2 GLU 97 3.120 -14.186 17.590 720 HG3 GLU 97 HG3 GLU 97 2.927 -13.380 19.147 721 H HIS 98 H HIS 98 4.558 -11.744 17.826 722 HA HIS 98 HA HIS 98 4.403 -10.098 20.250 723 HB2 HIS 98 HB2 HIS 98 6.837 -11.500 19.059 724 HB3 HIS 98 HB3 HIS 98 6.706 -10.826 20.683 725 HD1 HIS 98 HD1 HIS 98 4.642 -12.052 22.138 726 HD2 HIS 98 HD2 HIS 98 6.294 -14.142 18.957 727 HE1 HIS 98 HE1 HIS 98 4.009 -14.453 22.514 728 HE2 HIS 98 HE2 HIS 98 5.092 -15.709 20.633 729 H GLY 99 H GLY 99 4.924 -9.499 16.978 730 HA2 GLY 99 HA2 GLY 99 5.100 -7.304 16.109 731 HA3 GLY 99 HA3 GLY 99 5.972 -6.801 17.543 732 H ALA 100 H ALA 100 7.298 -9.714 16.422 733 HA ALA 100 HA ALA 100 9.691 -8.373 15.433 734 HB1 ALA 100 HB1 ALA 100 9.878 -10.304 16.946 735 HB2 ALA 100 HB2 ALA 100 10.693 -10.609 15.414 736 HB3 ALA 100 HB3 ALA 100 9.116 -11.339 15.735 737 HA PRO 101 HA PRO 101 8.381 -8.274 11.042 738 HB2 PRO 101 HB2 PRO 101 11.395 -8.415 10.701 739 HB3 PRO 101 HB3 PRO 101 10.219 -7.376 9.876 740 HG2 PRO 101 HG2 PRO 101 11.658 -6.371 11.854 741 HG3 PRO 101 HG3 PRO 101 9.925 -5.992 11.758 742 HD2 PRO 101 HD2 PRO 101 11.352 -7.913 13.594 743 HD3 PRO 101 HD3 PRO 101 9.974 -6.841 13.936 744 H VAL 102 H VAL 102 7.600 -10.000 9.989 745 HA VAL 102 HA VAL 102 8.579 -12.674 10.260 746 HB VAL 102 HB VAL 102 6.467 -11.592 8.333 747 HG11 VAL 102 HG11 VAL 102 7.285 -13.813 7.608 748 HG12 VAL 102 HG12 VAL 102 5.634 -13.930 8.215 749 HG13 VAL 102 HG13 VAL 102 6.981 -14.467 9.222 750 HG21 VAL 102 HG21 VAL 102 4.803 -12.349 10.006 751 HG22 VAL 102 HG22 VAL 102 5.876 -11.122 10.685 752 HG23 VAL 102 HG23 VAL 102 6.109 -12.823 11.096 753 H ASP 103 H ASP 103 10.456 -13.210 9.358 754 HA ASP 103 HA ASP 103 11.569 -12.043 6.977 755 HB2 ASP 103 HB2 ASP 103 13.494 -13.601 7.429 756 HB3 ASP 103 HB3 ASP 103 13.060 -12.599 8.809 757 H GLU 104 H GLU 104 9.679 -14.862 7.633 758 HA GLU 104 HA GLU 104 10.204 -16.470 5.376 759 HB2 GLU 104 HB2 GLU 104 8.913 -17.240 7.344 760 HB3 GLU 104 HB3 GLU 104 7.621 -16.101 6.963 761 HG2 GLU 104 HG2 GLU 104 7.261 -17.322 4.804 762 HG3 GLU 104 HG3 GLU 104 8.471 -18.498 5.311 763 H LEU 105 H LEU 105 7.861 -13.843 5.891 764 HA LEU 105 HA LEU 105 6.783 -13.868 3.210 765 HB2 LEU 105 HB2 LEU 105 6.490 -11.945 5.543 766 HB3 LEU 105 HB3 LEU 105 5.640 -11.734 4.017 767 HG LEU 105 HG LEU 105 5.339 -14.222 5.759 768 HD11 LEU 105 HD11 LEU 105 3.188 -13.357 6.500 769 HD12 LEU 105 HD12 LEU 105 3.469 -11.846 5.631 770 HD13 LEU 105 HD13 LEU 105 4.496 -12.286 6.997 771 HD21 LEU 105 HD21 LEU 105 4.816 -14.556 3.382 772 HD22 LEU 105 HD22 LEU 105 3.671 -13.212 3.433 773 HD23 LEU 105 HD23 LEU 105 3.367 -14.673 4.379 774 H GLY 106 H GLY 106 9.561 -12.491 4.672 775 HA2 GLY 106 HA2 GLY 106 11.350 -11.394 3.746 776 HA3 GLY 106 HA3 GLY 106 10.549 -11.483 2.187 777 H VAL 107 H VAL 107 11.692 -9.313 2.107 778 HA VAL 107 HA VAL 107 9.875 -7.150 3.032 779 HB VAL 107 HB VAL 107 12.876 -6.909 2.495 780 HG11 VAL 107 HG11 VAL 107 10.906 -4.843 3.570 781 HG12 VAL 107 HG12 VAL 107 11.677 -4.812 1.982 782 HG13 VAL 107 HG13 VAL 107 12.653 -4.612 3.440 783 HG21 VAL 107 HG21 VAL 107 13.136 -6.577 4.947 784 HG22 VAL 107 HG22 VAL 107 12.485 -8.176 4.575 785 HG23 VAL 107 HG23 VAL 107 11.414 -6.906 5.169 786 H THR 108 H THR 108 8.700 -6.508 1.346 787 HA THR 108 HA THR 108 9.856 -6.356 -1.387 788 HB THR 108 HB THR 108 7.936 -7.706 -1.589 789 HG1 THR 108 HG1 THR 108 6.698 -5.219 -2.123 790 HG21 THR 108 HG21 THR 108 6.353 -5.772 0.130 791 HG22 THR 108 HG22 THR 108 6.938 -7.357 0.637 792 HG23 THR 108 HG23 THR 108 5.722 -7.231 -0.636 793 H HIS 109 H HIS 109 9.260 -4.427 -2.682 794 HA HIS 109 HA HIS 109 9.208 -1.994 -0.974 795 HB2 HIS 109 HB2 HIS 109 11.488 -2.567 -1.776 796 HB3 HIS 109 HB3 HIS 109 10.920 -2.529 -3.437 797 HD1 HIS 109 HD1 HIS 109 11.204 -0.201 -0.472 798 HD2 HIS 109 HD2 HIS 109 11.217 -0.050 -4.612 799 HE1 HIS 109 HE1 HIS 109 11.664 2.164 -1.068 800 HE2 HIS 109 HE2 HIS 109 11.957 2.162 -3.539 801 H ALA 110 H ALA 110 7.159 -1.245 -1.353 802 HA ALA 110 HA ALA 110 5.948 -1.250 -4.001 803 HB1 ALA 110 HB1 ALA 110 4.906 -0.058 -1.425 804 HB2 ALA 110 HB2 ALA 110 4.562 -1.677 -2.027 805 HB3 ALA 110 HB3 ALA 110 3.991 -0.266 -2.918 806 H THR 111 H THR 111 5.726 0.425 -5.367 807 HA THR 111 HA THR 111 6.907 3.068 -4.670 808 HB THR 111 HB THR 111 6.706 1.913 -7.504 809 HG1 THR 111 HG1 THR 111 8.031 0.519 -6.228 810 HG21 THR 111 HG21 THR 111 8.509 4.062 -6.338 811 HG22 THR 111 HG22 THR 111 7.080 4.360 -7.324 812 HG23 THR 111 HG23 THR 111 8.476 3.534 -8.019 813 H VAL 112 H VAL 112 5.149 4.355 -4.247 814 HA VAL 112 HA VAL 112 2.634 4.107 -5.764 815 HB VAL 112 HB VAL 112 3.310 5.833 -3.340 816 HG11 VAL 112 HG11 VAL 112 1.487 6.838 -4.675 817 HG12 VAL 112 HG12 VAL 112 0.869 6.213 -3.146 818 HG13 VAL 112 HG13 VAL 112 0.602 5.309 -4.637 819 HG21 VAL 112 HG21 VAL 112 3.371 3.429 -2.794 820 HG22 VAL 112 HG22 VAL 112 1.761 3.217 -3.483 821 HG23 VAL 112 HG23 VAL 112 1.975 4.206 -2.037 822 H LYS 113 H LYS 113 2.392 5.327 -7.542 823 HA LYS 113 HA LYS 113 3.757 7.957 -7.767 824 HB2 LYS 113 HB2 LYS 113 3.463 5.792 -9.902 825 HB3 LYS 113 HB3 LYS 113 4.184 7.381 -10.164 826 HG2 LYS 113 HG2 LYS 113 6.086 6.876 -8.825 827 HG3 LYS 113 HG3 LYS 113 5.291 5.504 -8.057 828 HD2 LYS 113 HD2 LYS 113 6.977 4.698 -9.605 829 HD3 LYS 113 HD3 LYS 113 5.373 4.267 -10.189 830 HE2 LYS 113 HE2 LYS 113 5.443 6.111 -11.790 831 HE3 LYS 113 HE3 LYS 113 7.027 6.606 -11.195 832 HZ1 LYS 113 HZ1 LYS 113 7.241 5.325 -13.198 833 HZ2 LYS 113 HZ2 LYS 113 6.358 4.049 -12.537 834 HZ3 LYS 113 HZ3 LYS 113 7.876 4.436 -11.909 835 H LEU 114 H LEU 114 2.229 9.459 -7.771 836 HA LEU 114 HA LEU 114 -0.455 8.991 -8.823 837 HB2 LEU 114 HB2 LEU 114 0.764 11.326 -7.306 838 HB3 LEU 114 HB3 LEU 114 -0.899 11.300 -7.875 839 HG LEU 114 HG LEU 114 0.266 9.308 -5.879 840 HD11 LEU 114 HD11 LEU 114 -1.103 10.458 -4.193 841 HD12 LEU 114 HD12 LEU 114 -1.565 11.675 -5.386 842 HD13 LEU 114 HD13 LEU 114 0.119 11.524 -4.880 843 HD21 LEU 114 HD21 LEU 114 -2.598 9.717 -6.795 844 HD22 LEU 114 HD22 LEU 114 -2.058 8.599 -5.538 845 HD23 LEU 114 HD23 LEU 114 -1.557 8.351 -7.208 846 H GLU 115 H GLU 115 -1.320 9.916 -10.598 847 HA GLU 115 HA GLU 115 0.362 11.642 -12.317 848 HB2 GLU 115 HB2 GLU 115 -0.029 9.352 -13.210 849 HB3 GLU 115 HB3 GLU 115 -1.767 9.629 -13.135 850 HG2 GLU 115 HG2 GLU 115 -1.449 11.550 -14.738 851 HG3 GLU 115 HG3 GLU 115 0.240 11.070 -14.893 852 HA PRO 116 HA PRO 116 -3.078 14.598 -11.582 853 HB2 PRO 116 HB2 PRO 116 -2.112 16.566 -13.283 854 HB3 PRO 116 HB3 PRO 116 -1.582 16.353 -11.612 855 HG2 PRO 116 HG2 PRO 116 -0.278 15.381 -14.153 856 HG3 PRO 116 HG3 PRO 116 0.476 16.144 -12.736 857 HD2 PRO 116 HD2 PRO 116 0.585 13.476 -13.090 858 HD3 PRO 116 HD3 PRO 116 0.384 14.169 -11.463 859 H LEU 117 H LEU 117 -4.918 13.842 -12.504 860 HA LEU 117 HA LEU 117 -5.271 13.994 -15.462 861 HB2 LEU 117 HB2 LEU 117 -6.893 12.394 -13.442 862 HB3 LEU 117 HB3 LEU 117 -7.103 12.371 -15.182 863 HG LEU 117 HG LEU 117 -4.682 11.309 -13.670 864 HD11 LEU 117 HD11 LEU 117 -6.649 9.893 -13.348 865 HD12 LEU 117 HD12 LEU 117 -5.462 9.083 -14.365 866 HD13 LEU 117 HD13 LEU 117 -6.901 9.799 -15.095 867 HD21 LEU 117 HD21 LEU 117 -5.285 11.239 -16.644 868 HD22 LEU 117 HD22 LEU 117 -3.935 10.424 -15.841 869 HD23 LEU 117 HD23 LEU 117 -4.021 12.182 -15.846 870 H GLU 118 H GLU 118 -5.392 16.279 -13.746 871 HA GLU 118 HA GLU 118 -6.528 18.178 -13.342 872 HB2 GLU 118 HB2 GLU 118 -8.400 17.070 -15.477 873 HB3 GLU 118 HB3 GLU 118 -8.583 18.677 -14.792 874 HG2 GLU 118 HG2 GLU 118 -7.475 18.911 -16.893 875 HG3 GLU 118 HG3 GLU 118 -6.300 19.251 -15.629 876 H ASN 119 H ASN 119 -9.503 16.359 -13.934 877 HA ASN 119 HA ASN 119 -10.679 17.151 -11.410 878 HB2 ASN 119 HB2 ASN 119 -11.960 17.250 -13.502 879 HB3 ASN 119 HB3 ASN 119 -11.663 15.543 -13.800 880 HD21 ASN 119 HD21 ASN 119 -13.808 15.061 -13.943 881 HD22 ASN 119 HD22 ASN 119 -14.880 15.055 -12.584 882 H ARG 120 H ARG 120 -9.153 14.335 -12.792 883 HA ARG 120 HA ARG 120 -9.640 12.783 -10.309 884 HB2 ARG 120 HB2 ARG 120 -9.295 11.687 -13.143 885 HB3 ARG 120 HB3 ARG 120 -9.317 10.698 -11.686 886 HG2 ARG 120 HG2 ARG 120 -11.507 10.483 -12.437 887 HG3 ARG 120 HG3 ARG 120 -11.654 11.777 -11.250 888 HD2 ARG 120 HD2 ARG 120 -12.948 12.430 -13.142 889 HD3 ARG 120 HD3 ARG 120 -11.486 13.418 -13.171 890 HE ARG 120 HE ARG 120 -10.713 11.534 -14.814 891 HH11 ARG 120 HH11 ARG 120 -13.876 12.919 -14.681 892 HH12 ARG 120 HH12 ARG 120 -14.136 12.752 -16.376 893 HH21 ARG 120 HH21 ARG 120 -11.085 11.306 -16.983 894 HH22 ARG 120 HH22 ARG 120 -12.588 11.822 -17.657 895 H THR 121 H THR 121 -7.835 10.941 -10.211 896 HA THR 121 HA THR 121 -5.208 11.730 -11.233 897 HB THR 121 HB THR 121 -5.737 11.550 -8.223 898 HG1 THR 121 HG1 THR 121 -6.178 13.600 -9.167 899 HG21 THR 121 HG21 THR 121 -3.074 11.837 -9.672 900 HG22 THR 121 HG22 THR 121 -3.590 10.450 -8.706 901 HG23 THR 121 HG23 THR 121 -3.305 12.010 -7.930 902 H ARG 122 H ARG 122 -3.785 9.957 -11.388 903 HA ARG 122 HA ARG 122 -5.003 7.289 -10.997 904 HB2 ARG 122 HB2 ARG 122 -4.533 7.839 -13.326 905 HB3 ARG 122 HB3 ARG 122 -2.878 8.293 -12.935 906 HG2 ARG 122 HG2 ARG 122 -2.299 5.985 -12.445 907 HG3 ARG 122 HG3 ARG 122 -3.980 5.479 -12.643 908 HD2 ARG 122 HD2 ARG 122 -2.267 6.680 -14.852 909 HD3 ARG 122 HD3 ARG 122 -2.528 4.954 -14.609 910 HE ARG 122 HE ARG 122 -4.986 5.507 -14.923 911 HH11 ARG 122 HH11 ARG 122 -2.574 7.456 -16.479 912 HH12 ARG 122 HH12 ARG 122 -3.585 7.763 -17.846 913 HH21 ARG 122 HH21 ARG 122 -6.238 5.952 -16.667 914 HH22 ARG 122 HH22 ARG 122 -5.612 6.920 -17.955 915 H MET 123 H MET 123 -4.133 5.984 -9.494 916 HA MET 123 HA MET 123 -1.455 6.553 -8.363 917 HB2 MET 123 HB2 MET 123 -3.410 6.737 -6.788 918 HB3 MET 123 HB3 MET 123 -3.771 5.039 -7.068 919 HG2 MET 123 HG2 MET 123 -1.486 4.474 -6.171 920 HG3 MET 123 HG3 MET 123 -1.278 6.181 -5.781 921 HE1 MET 123 HE1 MET 123 -4.585 3.998 -5.478 922 HE2 MET 123 HE2 MET 123 -4.381 3.400 -3.831 923 HE3 MET 123 HE3 MET 123 -3.247 2.916 -5.085 924 H THR 124 H THR 124 0.016 5.193 -9.242 925 HA THR 124 HA THR 124 -0.666 2.330 -9.641 926 HB THR 124 HB THR 124 1.650 3.908 -10.868 927 HG1 THR 124 HG1 THR 124 0.371 3.678 -12.800 928 HG21 THR 124 HG21 THR 124 1.933 1.934 -12.336 929 HG22 THR 124 HG22 THR 124 0.657 1.090 -11.457 930 HG23 THR 124 HG23 THR 124 2.170 1.495 -10.642 931 H ILE 125 H ILE 125 -0.045 1.109 -7.939 932 HA ILE 125 HA ILE 125 2.350 1.810 -6.328 933 HB ILE 125 HB ILE 125 0.126 -0.179 -5.669 934 HG12 ILE 125 HG12 ILE 125 0.486 2.678 -4.660 935 HG13 ILE 125 HG13 ILE 125 -0.767 2.142 -5.776 936 HG21 ILE 125 HG21 ILE 125 2.259 -0.684 -4.525 937 HG22 ILE 125 HG22 ILE 125 1.048 -0.128 -3.369 938 HG23 ILE 125 HG23 ILE 125 2.326 0.968 -3.899 939 HD11 ILE 125 HD11 ILE 125 -1.691 0.709 -4.013 940 HD12 ILE 125 HD12 ILE 125 -1.646 2.406 -3.548 941 HD13 ILE 125 HD13 ILE 125 -0.448 1.287 -2.903 942 H ILE 126 H ILE 126 4.170 0.701 -6.916 943 HA ILE 126 HA ILE 126 3.918 -1.954 -8.224 944 HB ILE 126 HB ILE 126 6.220 0.042 -8.532 945 HG12 ILE 126 HG12 ILE 126 3.865 -0.375 -10.437 946 HG13 ILE 126 HG13 ILE 126 4.084 1.027 -9.399 947 HG21 ILE 126 HG21 ILE 126 6.829 -1.317 -10.508 948 HG22 ILE 126 HG22 ILE 126 5.489 -2.416 -10.176 949 HG23 ILE 126 HG23 ILE 126 6.832 -2.291 -9.037 950 HD11 ILE 126 HD11 ILE 126 4.695 1.542 -11.672 951 HD12 ILE 126 HD12 ILE 126 5.853 0.213 -11.704 952 HD13 ILE 126 HD13 ILE 126 6.130 1.601 -10.647 953 H SER 127 H SER 127 4.297 -3.432 -6.623 954 HA SER 127 HA SER 127 6.309 -3.020 -4.534 955 HB2 SER 127 HB2 SER 127 4.294 -5.278 -4.928 956 HB3 SER 127 HB3 SER 127 5.354 -5.095 -3.527 957 HG SER 127 HG SER 127 4.112 -3.547 -2.770 958 H THR 128 H THR 128 8.384 -3.547 -5.019 959 HA THR 128 HA THR 128 9.025 -5.632 -6.970 960 HB THR 128 HB THR 128 11.363 -4.728 -6.834 961 HG1 THR 128 HG1 THR 128 11.896 -3.281 -5.390 962 HG21 THR 128 HG21 THR 128 9.828 -3.804 -8.540 963 HG22 THR 128 HG22 THR 128 10.930 -2.561 -7.941 964 HG23 THR 128 HG23 THR 128 9.257 -2.597 -7.378 965 H PHE 129 H PHE 129 9.873 -7.561 -6.446 966 HA PHE 129 HA PHE 129 10.105 -8.278 -3.599 967 HB2 PHE 129 HB2 PHE 129 9.585 -10.059 -6.025 968 HB3 PHE 129 HB3 PHE 129 9.581 -10.584 -4.341 969 HD1 PHE 129 HD1 PHE 129 7.845 -9.606 -2.760 970 HD2 PHE 129 HD2 PHE 129 7.597 -9.126 -6.997 971 HE1 PHE 129 HE1 PHE 129 5.476 -9.025 -2.561 972 HE2 PHE 129 HE2 PHE 129 5.221 -8.547 -6.779 973 HZ PHE 129 HZ PHE 129 4.161 -8.487 -4.567 974 H GLU 130 H GLU 130 11.652 -9.833 -2.932 975 HA GLU 130 HA GLU 130 14.310 -9.489 -3.993 976 HB2 GLU 130 HB2 GLU 130 13.317 -11.287 -1.736 977 HB3 GLU 130 HB3 GLU 130 14.994 -10.827 -2.036 978 HG2 GLU 130 HG2 GLU 130 14.437 -8.475 -1.538 979 HG3 GLU 130 HG3 GLU 130 12.754 -8.924 -1.264 980 H SER 131 H SER 131 11.861 -12.050 -4.029 981 HA SER 131 HA SER 131 13.344 -13.608 -6.014 982 HB2 SER 131 HB2 SER 131 14.088 -14.573 -3.843 983 HB3 SER 131 HB3 SER 131 12.409 -14.826 -3.371 984 HG SER 131 HG SER 131 13.418 -16.719 -4.231 985 H GLU 132 H GLU 132 11.999 -15.083 -7.196 986 HA GLU 132 HA GLU 132 9.284 -14.432 -7.576 987 HB2 GLU 132 HB2 GLU 132 10.704 -15.583 -9.286 988 HB3 GLU 132 HB3 GLU 132 10.654 -17.054 -8.319 989 HG2 GLU 132 HG2 GLU 132 8.206 -17.170 -8.616 990 HG3 GLU 132 HG3 GLU 132 8.244 -15.682 -9.560 991 H GLU 133 H GLU 133 10.824 -16.711 -5.422 992 HA GLU 133 HA GLU 133 8.675 -18.276 -4.526 993 HB2 GLU 133 HB2 GLU 133 10.957 -17.213 -2.810 994 HB3 GLU 133 HB3 GLU 133 10.030 -18.690 -2.534 995 HG2 GLU 133 HG2 GLU 133 11.000 -19.681 -4.573 996 HG3 GLU 133 HG3 GLU 133 11.890 -18.184 -4.881 997 H GLN 134 H GLN 134 9.742 -15.042 -3.494 998 HA GLN 134 HA GLN 134 7.793 -14.678 -1.410 999 HB2 GLN 134 HB2 GLN 134 9.944 -13.472 -1.368 1000 HB3 GLN 134 HB3 GLN 134 9.544 -12.657 -2.877 1001 HG2 GLN 134 HG2 GLN 134 7.649 -11.514 -1.736 1002 HG3 GLN 134 HG3 GLN 134 8.101 -12.304 -0.225 1003 HE21 GLN 134 HE21 GLN 134 8.391 -10.250 0.734 1004 HE22 GLN 134 HE22 GLN 134 9.782 -9.291 0.404 1005 H MET 135 H MET 135 8.064 -13.595 -4.798 1006 HA MET 135 HA MET 135 5.718 -12.131 -5.126 1007 HB2 MET 135 HB2 MET 135 7.144 -12.091 -6.987 1008 HB3 MET 135 HB3 MET 135 7.411 -13.825 -6.961 1009 HG2 MET 135 HG2 MET 135 6.167 -13.146 -8.943 1010 HG3 MET 135 HG3 MET 135 5.206 -14.213 -7.924 1011 HE1 MET 135 HE1 MET 135 5.920 -10.278 -8.232 1012 HE2 MET 135 HE2 MET 135 4.325 -9.778 -8.793 1013 HE3 MET 135 HE3 MET 135 5.311 -10.845 -9.791 1014 H GLN 136 H GLN 136 6.118 -15.680 -5.444 1015 HA GLN 136 HA GLN 136 3.406 -16.347 -5.910 1016 HB2 GLN 136 HB2 GLN 136 5.588 -18.040 -4.628 1017 HB3 GLN 136 HB3 GLN 136 4.047 -18.655 -5.218 1018 HG2 GLN 136 HG2 GLN 136 6.226 -17.408 -6.921 1019 HG3 GLN 136 HG3 GLN 136 5.899 -19.130 -6.766 1020 HE21 GLN 136 HE21 GLN 136 4.931 -16.165 -8.259 1021 HE22 GLN 136 HE22 GLN 136 3.743 -16.833 -9.317 1022 H LYS 137 H LYS 137 5.331 -16.149 -2.928 1023 HA LYS 137 HA LYS 137 3.554 -17.245 -1.070 1024 HB2 LYS 137 HB2 LYS 137 5.964 -16.795 -0.646 1025 HB3 LYS 137 HB3 LYS 137 5.645 -15.066 -0.627 1026 HG2 LYS 137 HG2 LYS 137 5.886 -15.825 1.641 1027 HG3 LYS 137 HG3 LYS 137 4.192 -15.391 1.385 1028 HD2 LYS 137 HD2 LYS 137 3.618 -17.792 1.128 1029 HD3 LYS 137 HD3 LYS 137 5.314 -18.232 1.354 1030 HE2 LYS 137 HE2 LYS 137 5.206 -17.189 3.647 1031 HE3 LYS 137 HE3 LYS 137 3.479 -16.932 3.401 1032 HZ1 LYS 137 HZ1 LYS 137 3.170 -19.305 3.236 1033 HZ2 LYS 137 HZ2 LYS 137 3.976 -18.930 4.677 1034 HZ3 LYS 137 HZ3 LYS 137 4.832 -19.569 3.370 1035 H MET 138 H MET 138 3.917 -13.811 -2.041 1036 HA MET 138 HA MET 138 2.049 -12.633 -0.300 1037 HB2 MET 138 HB2 MET 138 2.885 -11.811 -3.105 1038 HB3 MET 138 HB3 MET 138 1.915 -10.797 -2.043 1039 HG2 MET 138 HG2 MET 138 4.698 -11.752 -1.338 1040 HG3 MET 138 HG3 MET 138 4.355 -10.235 -2.150 1041 HE1 MET 138 HE1 MET 138 3.842 -11.121 2.307 1042 HE2 MET 138 HE2 MET 138 4.955 -11.892 1.176 1043 HE3 MET 138 HE3 MET 138 3.229 -12.265 1.111 1044 H ALA 139 H ALA 139 1.569 -13.936 -3.573 1045 HA ALA 139 HA ALA 139 -1.187 -13.317 -3.796 1046 HB1 ALA 139 HB1 ALA 139 -1.156 -14.807 -5.757 1047 HB2 ALA 139 HB2 ALA 139 0.415 -15.447 -5.257 1048 HB3 ALA 139 HB3 ALA 139 0.265 -13.756 -5.745 1049 H GLU 140 H GLU 140 0.526 -16.215 -2.645 1050 HA GLU 140 HA GLU 140 -1.737 -17.891 -2.221 1051 HB2 GLU 140 HB2 GLU 140 1.011 -17.986 -0.899 1052 HB3 GLU 140 HB3 GLU 140 -0.185 -19.277 -0.837 1053 HG2 GLU 140 HG2 GLU 140 1.199 -18.261 -3.343 1054 HG3 GLU 140 HG3 GLU 140 1.612 -19.730 -2.469 1055 H MET 141 H MET 141 -0.148 -15.482 -0.175 1056 HA MET 141 HA MET 141 -1.590 -16.087 2.256 1057 HB2 MET 141 HB2 MET 141 0.065 -13.678 1.397 1058 HB3 MET 141 HB3 MET 141 -0.671 -13.811 2.992 1059 HG2 MET 141 HG2 MET 141 1.325 -15.804 1.895 1060 HG3 MET 141 HG3 MET 141 1.749 -14.425 2.907 1061 HE1 MET 141 HE1 MET 141 1.120 -14.210 5.496 1062 HE2 MET 141 HE2 MET 141 0.035 -15.328 6.320 1063 HE3 MET 141 HE3 MET 141 -0.586 -14.275 5.050 1064 H GLY 142 H GLY 142 -2.552 -14.569 -0.623 1065 HA2 GLY 142 HA2 GLY 142 -4.505 -13.466 -1.193 1066 HA3 GLY 142 HA3 GLY 142 -5.011 -13.522 0.487 1067 H MET 143 H MET 143 -1.892 -12.209 0.086 1068 HA MET 143 HA MET 143 -2.536 -9.573 0.926 1069 HB2 MET 143 HB2 MET 143 -0.342 -10.586 1.366 1070 HB3 MET 143 HB3 MET 143 -0.006 -10.699 -0.356 1071 HG2 MET 143 HG2 MET 143 1.230 -8.867 0.725 1072 HG3 MET 143 HG3 MET 143 0.129 -8.268 -0.521 1073 HE1 MET 143 HE1 MET 143 0.224 -5.471 2.332 1074 HE2 MET 143 HE2 MET 143 0.654 -5.827 0.661 1075 HE3 MET 143 HE3 MET 143 1.553 -6.582 1.984 1076 H GLU 144 H GLU 144 -2.101 -11.023 -2.247 1077 HA GLU 144 HA GLU 144 -1.975 -8.778 -3.918 1078 HB2 GLU 144 HB2 GLU 144 -1.565 -11.070 -4.719 1079 HB3 GLU 144 HB3 GLU 144 -3.239 -11.511 -4.400 1080 HG2 GLU 144 HG2 GLU 144 -3.942 -9.805 -6.125 1081 HG3 GLU 144 HG3 GLU 144 -2.241 -9.566 -6.507 1082 H GLU 145 H GLU 145 -4.886 -10.727 -3.094 1083 HA GLU 145 HA GLU 145 -6.692 -8.898 -4.375 1084 HB2 GLU 145 HB2 GLU 145 -8.461 -10.447 -3.697 1085 HB3 GLU 145 HB3 GLU 145 -7.107 -11.320 -4.401 1086 HG2 GLU 145 HG2 GLU 145 -6.362 -12.042 -2.194 1087 HG3 GLU 145 HG3 GLU 145 -7.613 -11.074 -1.417 1088 H GLY 146 H GLY 146 -5.743 -9.499 -1.029 1089 HA2 GLY 146 HA2 GLY 146 -7.835 -8.137 0.316 1090 HA3 GLY 146 HA3 GLY 146 -6.244 -8.498 0.970 1091 H MET 147 H MET 147 -4.524 -7.075 -0.541 1092 HA MET 147 HA MET 147 -4.851 -4.378 0.338 1093 HB2 MET 147 HB2 MET 147 -2.612 -5.635 -0.112 1094 HB3 MET 147 HB3 MET 147 -2.847 -5.206 -1.795 1095 HG2 MET 147 HG2 MET 147 -2.859 -2.814 -1.199 1096 HG3 MET 147 HG3 MET 147 -2.650 -3.233 0.499 1097 HE1 MET 147 HE1 MET 147 -0.970 -2.877 -2.999 1098 HE2 MET 147 HE2 MET 147 -0.913 -4.633 -2.819 1099 HE3 MET 147 HE3 MET 147 0.579 -3.692 -2.773 1100 H ARG 148 H ARG 148 -5.537 -6.020 -2.702 1101 HA ARG 148 HA ARG 148 -5.903 -3.796 -4.408 1102 HB2 ARG 148 HB2 ARG 148 -5.818 -6.270 -5.073 1103 HB3 ARG 148 HB3 ARG 148 -7.481 -6.403 -4.510 1104 HG2 ARG 148 HG2 ARG 148 -7.922 -4.431 -6.210 1105 HG3 ARG 148 HG3 ARG 148 -6.392 -4.948 -6.921 1106 HD2 ARG 148 HD2 ARG 148 -8.082 -6.087 -8.139 1107 HD3 ARG 148 HD3 ARG 148 -7.420 -7.304 -7.042 1108 HE ARG 148 HE ARG 148 -9.971 -5.858 -6.648 1109 HH11 ARG 148 HH11 ARG 148 -8.103 -8.725 -6.102 1110 HH12 ARG 148 HH12 ARG 148 -9.424 -9.554 -5.364 1111 HH21 ARG 148 HH21 ARG 148 -11.614 -6.951 -5.683 1112 HH22 ARG 148 HH22 ARG 148 -11.373 -8.563 -5.122 1113 H GLU 149 H GLU 149 -8.230 -5.573 -2.335 1114 HA GLU 149 HA GLU 149 -10.531 -3.960 -2.865 1115 HB2 GLU 149 HB2 GLU 149 -9.904 -5.836 -0.553 1116 HB3 GLU 149 HB3 GLU 149 -11.487 -5.100 -0.819 1117 HG2 GLU 149 HG2 GLU 149 -11.712 -6.253 -2.952 1118 HG3 GLU 149 HG3 GLU 149 -10.086 -6.928 -2.798 1119 H ALA 150 H ALA 150 -7.957 -3.745 -0.474 1120 HA ALA 150 HA ALA 150 -8.919 -1.646 1.154 1121 HB1 ALA 150 HB1 ALA 150 -6.534 -1.250 1.692 1122 HB2 ALA 150 HB2 ALA 150 -6.051 -2.266 0.329 1123 HB3 ALA 150 HB3 ALA 150 -6.908 -2.977 1.699 1124 H ILE 151 H ILE 151 -6.857 -1.552 -1.743 1125 HA ILE 151 HA ILE 151 -6.750 1.239 -2.164 1126 HB ILE 151 HB ILE 151 -6.323 -1.151 -3.993 1127 HG12 ILE 151 HG12 ILE 151 -4.261 0.738 -2.774 1128 HG13 ILE 151 HG13 ILE 151 -4.758 -0.773 -2.021 1129 HG21 ILE 151 HG21 ILE 151 -6.894 0.683 -5.480 1130 HG22 ILE 151 HG22 ILE 151 -5.166 0.349 -5.602 1131 HG23 ILE 151 HG23 ILE 151 -5.733 1.743 -4.678 1132 HD11 ILE 151 HD11 ILE 151 -2.660 -1.030 -3.183 1133 HD12 ILE 151 HD12 ILE 151 -3.390 -0.489 -4.692 1134 HD13 ILE 151 HD13 ILE 151 -3.905 -2.010 -3.958 1135 H GLU 152 H GLU 152 -9.143 -1.139 -3.031 1136 HA GLU 152 HA GLU 152 -10.599 0.418 -4.942 1137 HB2 GLU 152 HB2 GLU 152 -10.573 -2.203 -4.423 1138 HB3 GLU 152 HB3 GLU 152 -11.892 -1.802 -3.338 1139 HG2 GLU 152 HG2 GLU 152 -11.843 -1.200 -6.313 1140 HG3 GLU 152 HG3 GLU 152 -12.596 -2.614 -5.596 1141 H GLN 153 H GLN 153 -10.663 0.102 -1.424 1142 HA GLN 153 HA GLN 153 -13.208 1.372 -0.989 1143 HB2 GLN 153 HB2 GLN 153 -12.168 -0.282 0.587 1144 HB3 GLN 153 HB3 GLN 153 -10.935 0.907 0.987 1145 HG2 GLN 153 HG2 GLN 153 -12.631 2.386 1.955 1146 HG3 GLN 153 HG3 GLN 153 -13.915 1.276 1.479 1147 HE21 GLN 153 HE21 GLN 153 -12.421 -1.111 2.239 1148 HE22 GLN 153 HE22 GLN 153 -12.399 -1.144 3.960 1149 H ILE 154 H ILE 154 -10.024 2.610 -1.605 1150 HA ILE 154 HA ILE 154 -10.013 5.111 -0.327 1151 HB ILE 154 HB ILE 154 -8.922 4.512 -3.103 1152 HG12 ILE 154 HG12 ILE 154 -7.477 4.302 -0.431 1153 HG13 ILE 154 HG13 ILE 154 -8.083 2.928 -1.352 1154 HG21 ILE 154 HG21 ILE 154 -9.008 6.931 -2.648 1155 HG22 ILE 154 HG22 ILE 154 -7.338 6.374 -2.684 1156 HG23 ILE 154 HG23 ILE 154 -8.125 6.697 -1.138 1157 HD11 ILE 154 HD11 ILE 154 -5.682 3.265 -1.619 1158 HD12 ILE 154 HD12 ILE 154 -5.974 4.860 -2.307 1159 HD13 ILE 154 HD13 ILE 154 -6.540 3.417 -3.150 1160 H ASP 155 H ASP 155 -11.667 4.093 -3.282 1161 HA ASP 155 HA ASP 155 -12.622 6.520 -4.289 1162 HB2 ASP 155 HB2 ASP 155 -12.889 4.510 -5.583 1163 HB3 ASP 155 HB3 ASP 155 -13.743 3.688 -4.283 1164 H ALA 156 H ALA 156 -14.041 4.344 -1.848 1165 HA ALA 156 HA ALA 156 -16.304 5.950 -1.203 1166 HB1 ALA 156 HB1 ALA 156 -16.559 4.403 0.714 1167 HB2 ALA 156 HB2 ALA 156 -14.937 3.761 0.423 1168 HB3 ALA 156 HB3 ALA 156 -16.208 3.522 -0.777 1169 H VAL 157 H VAL 157 -12.978 5.972 -0.015 1170 HA VAL 157 HA VAL 157 -13.448 7.503 2.387 1171 HB VAL 157 HB VAL 157 -10.857 6.990 0.852 1172 HG11 VAL 157 HG11 VAL 157 -9.657 7.657 2.934 1173 HG12 VAL 157 HG12 VAL 157 -11.193 8.133 3.662 1174 HG13 VAL 157 HG13 VAL 157 -10.578 9.002 2.253 1175 HG21 VAL 157 HG21 VAL 157 -11.963 5.615 3.335 1176 HG22 VAL 157 HG22 VAL 157 -10.400 5.283 2.584 1177 HG23 VAL 157 HG23 VAL 157 -11.889 4.919 1.713 1178 H LEU 158 H LEU 158 -12.328 8.346 -0.910 1179 HA LEU 158 HA LEU 158 -11.938 11.164 -0.255 1180 HB2 LEU 158 HB2 LEU 158 -11.659 9.668 -2.891 1181 HB3 LEU 158 HB3 LEU 158 -11.281 11.372 -2.673 1182 HG LEU 158 HG LEU 158 -9.845 9.057 -1.301 1183 HD11 LEU 158 HD11 LEU 158 -8.893 10.865 -3.544 1184 HD12 LEU 158 HD12 LEU 158 -9.313 9.153 -3.675 1185 HD13 LEU 158 HD13 LEU 158 -7.926 9.644 -2.708 1186 HD21 LEU 158 HD21 LEU 158 -9.250 12.038 -1.171 1187 HD22 LEU 158 HD22 LEU 158 -8.251 10.753 -0.480 1188 HD23 LEU 158 HD23 LEU 158 -9.873 11.036 0.143 1189 H SER 159 H SER 159 -14.212 9.227 -2.202 1190 HA SER 159 HA SER 159 -15.760 11.527 -3.125 1191 HB2 SER 159 HB2 SER 159 -15.405 9.305 -4.415 1192 HB3 SER 159 HB3 SER 159 -16.591 8.601 -3.336 1193 HG SER 159 HG SER 159 -17.495 9.378 -5.313 1194 H GLU 160 H GLU 160 -15.577 10.267 -0.158 1195 HA GLU 160 HA GLU 160 -17.938 9.193 0.708 1196 HB2 GLU 160 HB2 GLU 160 -15.578 9.692 1.881 1197 HB3 GLU 160 HB3 GLU 160 -16.449 11.037 2.582 1198 HG2 GLU 160 HG2 GLU 160 -17.184 8.101 2.838 1199 HG3 GLU 160 HG3 GLU 160 -16.381 9.065 4.069 1200 HA PRO 161 HA PRO 161 -20.557 12.936 0.405 1201 HB2 PRO 161 HB2 PRO 161 -22.943 11.721 0.029 1202 HB3 PRO 161 HB3 PRO 161 -21.728 11.790 -1.256 1203 HG2 PRO 161 HG2 PRO 161 -22.388 9.511 0.608 1204 HG3 PRO 161 HG3 PRO 161 -22.045 9.467 -1.133 1205 HD2 PRO 161 HD2 PRO 161 -20.183 8.892 0.849 1206 HD3 PRO 161 HD3 PRO 161 -19.760 9.412 -0.795 1207 H ALA 162 H ALA 162 -21.197 10.184 2.550 1208 HA ALA 162 HA ALA 162 -21.822 11.528 4.906 1209 HB1 ALA 162 HB1 ALA 162 -23.784 12.450 3.699 1210 HB2 ALA 162 HB2 ALA 162 -24.279 11.430 5.051 1211 HB3 ALA 162 HB3 ALA 162 -24.361 10.810 3.399 1212 H ASN 163 H ASN 163 -22.087 8.652 2.947 1213 HA ASN 163 HA ASN 163 -22.048 6.861 5.215 1214 HB2 ASN 163 HB2 ASN 163 -24.277 5.840 4.773 1215 HB3 ASN 163 HB3 ASN 163 -24.403 7.515 5.259 1216 HD21 ASN 163 HD21 ASN 163 -24.773 5.289 2.592 1217 HD22 ASN 163 HD22 ASN 163 -25.652 6.364 1.570 1218 H ALA 164 H ALA 164 -20.376 7.156 2.877 1219 HA ALA 164 HA ALA 164 -20.974 5.313 0.784 1220 HB1 ALA 164 HB1 ALA 164 -18.297 6.503 1.583 1221 HB2 ALA 164 HB2 ALA 164 -19.462 7.216 0.467 1222 HB3 ALA 164 HB3 ALA 164 -18.659 5.704 0.049 1223 H LEU 165 H LEU 165 -18.534 5.081 3.390 1224 HA LEU 165 HA LEU 165 -17.321 3.444 4.313 1225 HB2 LEU 165 HB2 LEU 165 -19.884 1.890 3.896 1226 HB3 LEU 165 HB3 LEU 165 -18.518 1.222 4.779 1227 HG LEU 165 HG LEU 165 -20.150 3.678 5.567 1228 HD11 LEU 165 HD11 LEU 165 -21.336 1.587 5.986 1229 HD12 LEU 165 HD12 LEU 165 -20.852 2.336 7.505 1230 HD13 LEU 165 HD13 LEU 165 -19.954 0.947 6.882 1231 HD21 LEU 165 HD21 LEU 165 -17.820 4.043 6.198 1232 HD22 LEU 165 HD22 LEU 165 -17.750 2.466 6.987 1233 HD23 LEU 165 HD23 LEU 165 -18.793 3.736 7.637 1234 H GLU 166 H GLU 166 -18.984 1.279 1.943 1235 HA GLU 166 HA GLU 166 -16.654 1.132 0.270 1236 HB2 GLU 166 HB2 GLU 166 -16.481 -1.496 0.587 1237 HB3 GLU 166 HB3 GLU 166 -15.646 -0.403 1.673 1238 HG2 GLU 166 HG2 GLU 166 -16.531 -2.052 3.099 1239 HG3 GLU 166 HG3 GLU 166 -17.629 -0.688 3.277 1240 H HIS 167 H HIS 167 -19.666 -0.836 0.870 1241 HA HIS 167 HA HIS 167 -20.372 -0.668 -1.964 1242 HB2 HIS 167 HB2 HIS 167 -19.866 -3.383 -0.655 1243 HB3 HIS 167 HB3 HIS 167 -20.537 -3.136 -2.262 1244 HD1 HIS 167 HD1 HIS 167 -17.369 -3.380 -0.403 1245 HD2 HIS 167 HD2 HIS 167 -18.611 -2.235 -4.204 1246 HE1 HIS 167 HE1 HIS 167 -15.289 -3.353 -1.809 1247 HE2 HIS 167 HE2 HIS 167 -16.042 -2.501 -4.039 1248 H HIS 168 H HIS 168 -21.117 -2.516 1.019 1249 HA HIS 168 HA HIS 168 -22.994 -3.162 2.101 1250 HB2 HIS 168 HB2 HIS 168 -24.360 -0.849 0.652 1251 HB3 HIS 168 HB3 HIS 168 -25.029 -1.713 2.039 1252 HD1 HIS 168 HD1 HIS 168 -22.766 1.007 1.087 1253 HD2 HIS 168 HD2 HIS 168 -23.625 -1.164 4.511 1254 HE1 HIS 168 HE1 HIS 168 -21.826 2.355 2.981 1255 HE2 HIS 168 HE2 HIS 168 -22.557 1.124 5.044 1256 H HIS 169 H HIS 169 -22.388 -4.224 -0.665 1257 HA HIS 169 HA HIS 169 -25.101 -4.901 -1.671 1258 HB2 HIS 169 HB2 HIS 169 -23.477 -3.606 -3.181 1259 HB3 HIS 169 HB3 HIS 169 -22.508 -5.072 -3.260 1260 HD1 HIS 169 HD1 HIS 169 -23.567 -7.114 -4.558 1261 HD2 HIS 169 HD2 HIS 169 -25.767 -3.592 -4.760 1262 HE1 HIS 169 HE1 HIS 169 -25.271 -7.488 -6.360 1263 HE2 HIS 169 HE2 HIS 169 -26.666 -5.404 -6.377 1264 H HIS 170 H HIS 170 -25.434 -7.081 -2.563 1265 HA HIS 170 HA HIS 170 -23.725 -9.184 -1.356 1266 HB2 HIS 170 HB2 HIS 170 -26.758 -9.123 -1.563 1267 HB3 HIS 170 HB3 HIS 170 -25.836 -10.548 -1.093 1268 HD1 HIS 170 HD1 HIS 170 -24.493 -10.372 1.181 1269 HD2 HIS 170 HD2 HIS 170 -27.214 -7.307 0.496 1270 HE1 HIS 170 HE1 HIS 170 -24.809 -9.253 3.399 1271 HE2 HIS 170 HE2 HIS 170 -26.589 -7.529 2.999 1272 H HIS 171 H HIS 171 -22.900 -10.610 -2.727 1273 HA HIS 171 HA HIS 171 -24.350 -11.509 -5.117 1274 HB2 HIS 171 HB2 HIS 171 -22.903 -9.668 -5.948 1275 HB3 HIS 171 HB3 HIS 171 -21.487 -10.433 -5.236 1276 HD1 HIS 171 HD1 HIS 171 -20.376 -12.307 -6.570 1277 HD2 HIS 171 HD2 HIS 171 -23.925 -10.997 -8.290 1278 HE1 HIS 171 HE1 HIS 171 -20.438 -13.345 -8.847 1279 HE2 HIS 171 HE2 HIS 171 -22.504 -12.418 -9.923 1280 H HIS 172 H HIS 172 -24.237 -13.680 -5.247 1281 HA HIS 172 HA HIS 172 -23.893 -15.837 -4.711 1282 HB2 HIS 172 HB2 HIS 172 -21.806 -15.619 -5.962 1283 HB3 HIS 172 HB3 HIS 172 -20.974 -14.964 -4.555 1284 HD1 HIS 172 HD1 HIS 172 -23.003 -18.162 -5.133 1285 HD2 HIS 172 HD2 HIS 172 -19.343 -16.932 -3.592 1286 HE1 HIS 172 HE1 HIS 172 -21.898 -20.243 -4.295 1287 HE2 HIS 172 HE2 HIS 172 -19.616 -19.500 -3.542 Start of MODEL 4 1 H1 THR 1 H1 THR 1 -12.710 1.269 -7.037 2 H2 THR 1 H2 THR 1 -12.877 2.880 -7.535 3 H3 THR 1 H3 THR 1 -11.358 2.290 -7.083 4 HA THR 1 HA THR 1 -12.959 1.388 -9.405 5 HB THR 1 HB THR 1 -10.980 2.396 -10.740 6 HG1 THR 1 HG1 THR 1 -10.524 4.337 -8.873 7 HG21 THR 1 HG21 THR 1 -12.837 4.330 -9.303 8 HG22 THR 1 HG22 THR 1 -13.217 3.429 -10.774 9 HG23 THR 1 HG23 THR 1 -11.947 4.654 -10.796 10 H VAL 2 H VAL 2 -9.436 1.463 -8.655 11 HA VAL 2 HA VAL 2 -7.803 0.205 -9.576 12 HB VAL 2 HB VAL 2 -9.452 -2.139 -8.545 13 HG11 VAL 2 HG11 VAL 2 -7.684 -2.885 -10.100 14 HG12 VAL 2 HG12 VAL 2 -7.291 -3.363 -8.447 15 HG13 VAL 2 HG13 VAL 2 -6.473 -1.981 -9.183 16 HG21 VAL 2 HG21 VAL 2 -8.066 -1.993 -6.503 17 HG22 VAL 2 HG22 VAL 2 -8.977 -0.504 -6.758 18 HG23 VAL 2 HG23 VAL 2 -7.256 -0.559 -7.147 19 H VAL 3 H VAL 3 -8.233 0.882 -11.689 20 HA VAL 3 HA VAL 3 -10.151 -0.411 -13.390 21 HB VAL 3 HB VAL 3 -9.250 1.085 -15.194 22 HG11 VAL 3 HG11 VAL 3 -9.877 2.483 -12.558 23 HG12 VAL 3 HG12 VAL 3 -11.063 1.888 -13.724 24 HG13 VAL 3 HG13 VAL 3 -9.989 3.220 -14.159 25 HG21 VAL 3 HG21 VAL 3 -6.871 1.180 -14.489 26 HG22 VAL 3 HG22 VAL 3 -7.334 2.075 -13.037 27 HG23 VAL 3 HG23 VAL 3 -7.552 2.807 -14.630 28 H SER 4 H SER 4 -6.851 -1.113 -12.628 29 HA SER 4 HA SER 4 -6.940 -3.483 -14.287 30 HB2 SER 4 HB2 SER 4 -6.003 -1.814 -15.896 31 HB3 SER 4 HB3 SER 4 -4.706 -1.453 -14.757 32 HG SER 4 HG SER 4 -3.752 -3.313 -15.218 33 H VAL 5 H VAL 5 -5.840 -5.124 -13.354 34 HA VAL 5 HA VAL 5 -3.878 -4.584 -11.181 35 HB VAL 5 HB VAL 5 -5.496 -7.154 -11.597 36 HG11 VAL 5 HG11 VAL 5 -4.678 -7.782 -9.334 37 HG12 VAL 5 HG12 VAL 5 -3.722 -6.299 -9.265 38 HG13 VAL 5 HG13 VAL 5 -3.334 -7.543 -10.456 39 HG21 VAL 5 HG21 VAL 5 -5.972 -4.950 -9.556 40 HG22 VAL 5 HG22 VAL 5 -6.826 -6.494 -9.616 41 HG23 VAL 5 HG23 VAL 5 -7.011 -5.331 -10.932 42 H ASP 6 H ASP 6 -1.882 -4.735 -12.090 43 HA ASP 6 HA ASP 6 -1.303 -6.830 -14.121 44 HB2 ASP 6 HB2 ASP 6 0.337 -4.315 -13.518 45 HB3 ASP 6 HB3 ASP 6 0.525 -5.410 -14.888 46 H LYS 7 H LYS 7 0.103 -8.445 -13.566 47 HA LYS 7 HA LYS 7 2.046 -8.033 -11.364 48 HB2 LYS 7 HB2 LYS 7 0.072 -9.341 -10.527 49 HB3 LYS 7 HB3 LYS 7 0.390 -10.572 -11.746 50 HG2 LYS 7 HG2 LYS 7 2.498 -11.165 -10.697 51 HG3 LYS 7 HG3 LYS 7 2.384 -9.794 -9.586 52 HD2 LYS 7 HD2 LYS 7 0.386 -10.804 -8.531 53 HD3 LYS 7 HD3 LYS 7 0.475 -12.166 -9.654 54 HE2 LYS 7 HE2 LYS 7 2.631 -12.842 -8.697 55 HE3 LYS 7 HE3 LYS 7 2.626 -11.443 -7.625 56 HZ1 LYS 7 HZ1 LYS 7 0.735 -12.319 -6.487 57 HZ2 LYS 7 HZ2 LYS 7 1.912 -13.536 -6.563 58 HZ3 LYS 7 HZ3 LYS 7 0.575 -13.584 -7.595 59 H ASP 8 H ASP 8 3.896 -7.965 -12.496 60 HA ASP 8 HA ASP 8 4.357 -9.739 -14.804 61 HB2 ASP 8 HB2 ASP 8 5.993 -7.350 -13.835 62 HB3 ASP 8 HB3 ASP 8 6.213 -8.223 -15.353 63 H VAL 9 H VAL 9 4.969 -11.675 -14.019 64 HA VAL 9 HA VAL 9 6.614 -12.112 -11.722 65 HB VAL 9 HB VAL 9 6.180 -14.185 -13.919 66 HG11 VAL 9 HG11 VAL 9 6.230 -15.804 -12.041 67 HG12 VAL 9 HG12 VAL 9 6.465 -14.480 -10.897 68 HG13 VAL 9 HG13 VAL 9 7.713 -14.845 -12.093 69 HG21 VAL 9 HG21 VAL 9 3.984 -13.184 -13.483 70 HG22 VAL 9 HG22 VAL 9 4.183 -13.451 -11.748 71 HG23 VAL 9 HG23 VAL 9 4.051 -14.829 -12.842 72 H GLU 10 H GLU 10 7.243 -11.630 -15.081 73 HA GLU 10 HA GLU 10 9.906 -12.545 -15.396 74 HB2 GLU 10 HB2 GLU 10 8.622 -10.160 -16.817 75 HB3 GLU 10 HB3 GLU 10 10.006 -11.089 -17.373 76 HG2 GLU 10 HG2 GLU 10 8.204 -11.784 -18.722 77 HG3 GLU 10 HG3 GLU 10 8.438 -13.089 -17.560 78 H ALA 11 H ALA 11 8.525 -9.469 -14.368 79 HA ALA 11 HA ALA 11 11.128 -8.217 -13.819 80 HB1 ALA 11 HB1 ALA 11 8.303 -7.116 -13.557 81 HB2 ALA 11 HB2 ALA 11 9.363 -6.903 -14.951 82 HB3 ALA 11 HB3 ALA 11 9.795 -6.183 -13.399 83 H LEU 12 H LEU 12 9.186 -10.332 -12.148 84 HA LEU 12 HA LEU 12 8.516 -10.795 -10.025 85 HB2 LEU 12 HB2 LEU 12 11.134 -9.388 -9.377 86 HB3 LEU 12 HB3 LEU 12 10.216 -10.340 -8.217 87 HG LEU 12 HG LEU 12 11.512 -11.407 -10.762 88 HD11 LEU 12 HD11 LEU 12 13.049 -12.596 -9.240 89 HD12 LEU 12 HD12 LEU 12 12.306 -11.800 -7.851 90 HD13 LEU 12 HD13 LEU 12 13.179 -10.848 -9.057 91 HD21 LEU 12 HD21 LEU 12 10.883 -13.653 -9.916 92 HD22 LEU 12 HD22 LEU 12 9.476 -12.661 -10.281 93 HD23 LEU 12 HD23 LEU 12 9.972 -12.898 -8.603 94 H SER 13 H SER 13 7.479 -8.327 -11.121 95 HA SER 13 HA SER 13 7.199 -6.555 -8.760 96 HB2 SER 13 HB2 SER 13 6.980 -5.848 -11.721 97 HB3 SER 13 HB3 SER 13 6.751 -4.723 -10.382 98 HG SER 13 HG SER 13 9.147 -6.196 -10.685 99 H PHE 14 H PHE 14 5.141 -5.636 -8.379 100 HA PHE 14 HA PHE 14 2.803 -6.795 -9.786 101 HB2 PHE 14 HB2 PHE 14 3.110 -8.009 -7.677 102 HB3 PHE 14 HB3 PHE 14 3.218 -6.502 -6.772 103 HD1 PHE 14 HD1 PHE 14 0.793 -7.608 -9.409 104 HD2 PHE 14 HD2 PHE 14 1.354 -6.499 -5.320 105 HE1 PHE 14 HE1 PHE 14 -1.616 -7.705 -9.056 106 HE2 PHE 14 HE2 PHE 14 -1.075 -6.594 -4.978 107 HZ PHE 14 HZ PHE 14 -2.562 -7.191 -6.844 108 H SER 15 H SER 15 2.039 -5.058 -10.843 109 HA SER 15 HA SER 15 2.134 -2.364 -9.616 110 HB2 SER 15 HB2 SER 15 3.465 -2.602 -11.668 111 HB3 SER 15 HB3 SER 15 2.057 -3.198 -12.542 112 HG SER 15 HG SER 15 1.298 -1.219 -12.698 113 H ILE 16 H ILE 16 0.204 -1.708 -8.821 114 HA ILE 16 HA ILE 16 -2.317 -2.602 -10.095 115 HB ILE 16 HB ILE 16 -1.851 -1.342 -7.356 116 HG12 ILE 16 HG12 ILE 16 -2.630 -4.191 -8.123 117 HG13 ILE 16 HG13 ILE 16 -1.044 -3.693 -7.544 118 HG21 ILE 16 HG21 ILE 16 -4.467 -2.346 -8.555 119 HG22 ILE 16 HG22 ILE 16 -4.062 -0.661 -8.223 120 HG23 ILE 16 HG23 ILE 16 -4.247 -1.799 -6.890 121 HD11 ILE 16 HD11 ILE 16 -2.032 -3.091 -5.388 122 HD12 ILE 16 HD12 ILE 16 -2.321 -4.777 -5.806 123 HD13 ILE 16 HD13 ILE 16 -3.618 -3.598 -5.977 124 H VAL 17 H VAL 17 -3.293 -1.245 -11.414 125 HA VAL 17 HA VAL 17 -2.689 1.647 -11.396 126 HB VAL 17 HB VAL 17 -3.797 -0.153 -13.606 127 HG11 VAL 17 HG11 VAL 17 -3.114 2.812 -13.748 128 HG12 VAL 17 HG12 VAL 17 -4.735 2.121 -13.831 129 HG13 VAL 17 HG13 VAL 17 -3.576 1.799 -15.118 130 HG21 VAL 17 HG21 VAL 17 -1.402 -0.545 -13.164 131 HG22 VAL 17 HG22 VAL 17 -1.070 1.183 -13.336 132 HG23 VAL 17 HG23 VAL 17 -1.620 0.247 -14.729 133 H ALA 18 H ALA 18 -4.206 2.872 -10.471 134 HA ALA 18 HA ALA 18 -7.091 2.237 -10.727 135 HB1 ALA 18 HB1 ALA 18 -5.692 3.058 -8.147 136 HB2 ALA 18 HB2 ALA 18 -6.326 1.453 -8.517 137 HB3 ALA 18 HB3 ALA 18 -7.432 2.817 -8.351 138 H GLU 19 H GLU 19 -8.463 4.063 -10.824 139 HA GLU 19 HA GLU 19 -7.155 6.737 -11.017 140 HB2 GLU 19 HB2 GLU 19 -9.488 5.721 -12.709 141 HB3 GLU 19 HB3 GLU 19 -8.728 7.311 -12.825 142 HG2 GLU 19 HG2 GLU 19 -6.618 6.218 -13.520 143 HG3 GLU 19 HG3 GLU 19 -7.421 4.649 -13.457 144 H PHE 20 H PHE 20 -8.051 8.260 -9.736 145 HA PHE 20 HA PHE 20 -10.696 7.743 -8.479 146 HB2 PHE 20 HB2 PHE 20 -8.239 8.991 -7.151 147 HB3 PHE 20 HB3 PHE 20 -9.804 8.716 -6.387 148 HD1 PHE 20 HD1 PHE 20 -10.669 6.236 -6.362 149 HD2 PHE 20 HD2 PHE 20 -6.571 7.314 -6.952 150 HE1 PHE 20 HE1 PHE 20 -9.980 3.967 -5.729 151 HE2 PHE 20 HE2 PHE 20 -5.890 5.039 -6.309 152 HZ PHE 20 HZ PHE 20 -7.593 3.365 -5.701 153 H ASP 21 H ASP 21 -12.126 9.439 -8.471 154 HA ASP 21 HA ASP 21 -11.490 11.793 -10.041 155 HB2 ASP 21 HB2 ASP 21 -13.733 10.490 -10.070 156 HB3 ASP 21 HB3 ASP 21 -14.092 11.282 -8.540 157 H ALA 22 H ALA 22 -9.904 12.729 -8.788 158 HA ALA 22 HA ALA 22 -10.494 14.682 -6.844 159 HB1 ALA 22 HB1 ALA 22 -9.211 12.147 -5.725 160 HB2 ALA 22 HB2 ALA 22 -10.808 12.764 -5.308 161 HB3 ALA 22 HB3 ALA 22 -9.370 13.677 -4.856 162 H ASP 23 H ASP 23 -8.334 15.613 -5.955 163 HA ASP 23 HA ASP 23 -6.484 15.734 -8.231 164 HB2 ASP 23 HB2 ASP 23 -5.464 17.660 -7.019 165 HB3 ASP 23 HB3 ASP 23 -7.182 17.870 -7.299 166 H VAL 24 H VAL 24 -4.104 16.027 -7.636 167 HA VAL 24 HA VAL 24 -3.083 13.530 -6.875 168 HB VAL 24 HB VAL 24 -1.613 16.189 -7.151 169 HG11 VAL 24 HG11 VAL 24 -0.167 14.571 -5.985 170 HG12 VAL 24 HG12 VAL 24 0.423 14.819 -7.631 171 HG13 VAL 24 HG13 VAL 24 -0.480 13.357 -7.229 172 HG21 VAL 24 HG21 VAL 24 -2.875 15.586 -9.169 173 HG22 VAL 24 HG22 VAL 24 -2.082 14.005 -9.208 174 HG23 VAL 24 HG23 VAL 24 -1.135 15.475 -9.449 175 H LYS 25 H LYS 25 -3.174 16.595 -5.096 176 HA LYS 25 HA LYS 25 -1.699 15.717 -2.835 177 HB2 LYS 25 HB2 LYS 25 -2.796 18.205 -3.783 178 HB3 LYS 25 HB3 LYS 25 -3.434 17.969 -2.163 179 HG2 LYS 25 HG2 LYS 25 -0.500 17.903 -2.929 180 HG3 LYS 25 HG3 LYS 25 -1.336 19.257 -2.153 181 HD2 LYS 25 HD2 LYS 25 -1.707 17.981 -0.137 182 HD3 LYS 25 HD3 LYS 25 -1.185 16.476 -0.905 183 HE2 LYS 25 HE2 LYS 25 1.079 17.282 -1.053 184 HE3 LYS 25 HE3 LYS 25 0.608 18.870 -0.441 185 HZ1 LYS 25 HZ1 LYS 25 0.533 16.303 1.049 186 HZ2 LYS 25 HZ2 LYS 25 -0.081 17.761 1.631 187 HZ3 LYS 25 HZ3 LYS 25 1.568 17.610 1.315 188 H ARG 26 H ARG 26 -5.077 15.671 -3.645 189 HA ARG 26 HA ARG 26 -6.190 14.968 -1.116 190 HB2 ARG 26 HB2 ARG 26 -7.520 15.813 -3.073 191 HB3 ARG 26 HB3 ARG 26 -7.241 14.284 -3.895 192 HG2 ARG 26 HG2 ARG 26 -9.427 14.138 -3.001 193 HG3 ARG 26 HG3 ARG 26 -8.422 13.150 -1.948 194 HD2 ARG 26 HD2 ARG 26 -9.863 14.383 -0.510 195 HD3 ARG 26 HD3 ARG 26 -8.287 15.168 -0.386 196 HE ARG 26 HE ARG 26 -9.148 16.854 -1.988 197 HH11 ARG 26 HH11 ARG 26 -11.435 15.062 -0.110 198 HH12 ARG 26 HH12 ARG 26 -12.670 16.252 -0.285 199 HH21 ARG 26 HH21 ARG 26 -10.775 18.349 -2.209 200 HH22 ARG 26 HH22 ARG 26 -12.299 18.089 -1.442 201 H VAL 27 H VAL 27 -5.202 12.966 -3.916 202 HA VAL 27 HA VAL 27 -5.633 10.427 -2.658 203 HB VAL 27 HB VAL 27 -3.782 10.923 -5.036 204 HG11 VAL 27 HG11 VAL 27 -3.640 8.647 -4.070 205 HG12 VAL 27 HG12 VAL 27 -4.379 8.594 -5.671 206 HG13 VAL 27 HG13 VAL 27 -5.389 8.455 -4.230 207 HG21 VAL 27 HG21 VAL 27 -6.800 10.507 -5.114 208 HG22 VAL 27 HG22 VAL 27 -5.737 10.540 -6.521 209 HG23 VAL 27 HG23 VAL 27 -5.946 11.990 -5.540 210 H TRP 28 H TRP 28 -2.859 12.613 -2.847 211 HA TRP 28 HA TRP 28 -0.908 10.936 -1.630 212 HB2 TRP 28 HB2 TRP 28 -0.332 12.997 -2.877 213 HB3 TRP 28 HB3 TRP 28 -1.121 13.978 -1.654 214 HD1 TRP 28 HD1 TRP 28 0.387 14.725 0.388 215 HE1 TRP 28 HE1 TRP 28 2.806 14.252 1.108 216 HE3 TRP 28 HE3 TRP 28 1.511 10.996 -2.935 217 HZ2 TRP 28 HZ2 TRP 28 4.918 12.529 0.357 218 HZ3 TRP 28 HZ3 TRP 28 3.757 10.004 -2.874 219 HH2 TRP 28 HH2 TRP 28 5.429 10.759 -1.260 220 H ALA 29 H ALA 29 -3.437 13.019 -0.303 221 HA ALA 29 HA ALA 29 -2.570 13.235 2.368 222 HB1 ALA 29 HB1 ALA 29 -4.295 14.671 1.363 223 HB2 ALA 29 HB2 ALA 29 -4.863 13.937 2.866 224 HB3 ALA 29 HB3 ALA 29 -5.408 13.303 1.309 225 H ILE 30 H ILE 30 -4.219 10.556 0.766 226 HA ILE 30 HA ILE 30 -5.038 9.176 3.176 227 HB ILE 30 HB ILE 30 -5.663 7.324 1.808 228 HG12 ILE 30 HG12 ILE 30 -3.809 8.468 -0.320 229 HG13 ILE 30 HG13 ILE 30 -3.629 6.942 0.519 230 HG21 ILE 30 HG21 ILE 30 -7.082 9.309 1.538 231 HG22 ILE 30 HG22 ILE 30 -7.046 8.358 0.056 232 HG23 ILE 30 HG23 ILE 30 -6.099 9.844 0.169 233 HD11 ILE 30 HD11 ILE 30 -5.655 6.132 -0.643 234 HD12 ILE 30 HD12 ILE 30 -4.323 6.557 -1.717 235 HD13 ILE 30 HD13 ILE 30 -5.692 7.652 -1.542 236 H TRP 31 H TRP 31 -2.042 9.488 1.484 237 HA TRP 31 HA TRP 31 -0.759 7.239 2.896 238 HB2 TRP 31 HB2 TRP 31 0.332 9.200 0.818 239 HB3 TRP 31 HB3 TRP 31 1.237 7.855 1.504 240 HD1 TRP 31 HD1 TRP 31 -1.092 8.658 -1.336 241 HE1 TRP 31 HE1 TRP 31 -1.690 6.507 -2.614 242 HE3 TRP 31 HE3 TRP 31 0.741 5.200 1.973 243 HZ2 TRP 31 HZ2 TRP 31 -1.419 3.716 -2.278 244 HZ3 TRP 31 HZ3 TRP 31 0.532 2.809 1.416 245 HH2 TRP 31 HH2 TRP 31 -0.533 2.079 -0.654 246 H GLU 32 H GLU 32 -1.039 10.699 2.961 247 HA GLU 32 HA GLU 32 1.352 11.232 4.489 248 HB2 GLU 32 HB2 GLU 32 0.605 12.760 2.718 249 HB3 GLU 32 HB3 GLU 32 -0.919 13.034 3.554 250 HG2 GLU 32 HG2 GLU 32 0.176 14.236 5.324 251 HG3 GLU 32 HG3 GLU 32 1.773 13.765 4.738 252 H ASP 33 H ASP 33 -2.172 11.502 5.091 253 HA ASP 33 HA ASP 33 -1.763 12.152 7.904 254 HB2 ASP 33 HB2 ASP 33 -4.304 11.794 6.272 255 HB3 ASP 33 HB3 ASP 33 -4.254 12.336 7.951 256 HA PRO 34 HA PRO 34 -1.747 7.841 9.261 257 HB2 PRO 34 HB2 PRO 34 -2.722 9.023 11.856 258 HB3 PRO 34 HB3 PRO 34 -1.334 7.969 11.553 259 HG2 PRO 34 HG2 PRO 34 -0.976 10.567 12.042 260 HG3 PRO 34 HG3 PRO 34 0.013 9.739 10.823 261 HD2 PRO 34 HD2 PRO 34 -2.342 11.574 10.422 262 HD3 PRO 34 HD3 PRO 34 -0.820 11.471 9.505 263 H ARG 35 H ARG 35 -4.489 9.853 10.414 264 HA ARG 35 HA ARG 35 -6.381 7.800 10.791 265 HB2 ARG 35 HB2 ARG 35 -6.566 10.783 10.505 266 HB3 ARG 35 HB3 ARG 35 -8.056 9.870 10.364 267 HG2 ARG 35 HG2 ARG 35 -7.806 10.689 12.625 268 HG3 ARG 35 HG3 ARG 35 -7.724 8.928 12.614 269 HD2 ARG 35 HD2 ARG 35 -5.181 10.561 12.591 270 HD3 ARG 35 HD3 ARG 35 -6.060 10.316 14.099 271 HE ARG 35 HE ARG 35 -5.616 7.812 12.834 272 HH11 ARG 35 HH11 ARG 35 -3.835 10.251 14.542 273 HH12 ARG 35 HH12 ARG 35 -2.701 9.105 15.155 274 HH21 ARG 35 HH21 ARG 35 -4.142 6.414 13.655 275 HH22 ARG 35 HH22 ARG 35 -2.868 6.981 14.677 276 H GLN 36 H GLN 36 -5.840 9.871 7.912 277 HA GLN 36 HA GLN 36 -7.981 8.731 6.387 278 HB2 GLN 36 HB2 GLN 36 -5.568 10.312 5.419 279 HB3 GLN 36 HB3 GLN 36 -6.950 9.863 4.417 280 HG2 GLN 36 HG2 GLN 36 -8.390 11.154 6.124 281 HG3 GLN 36 HG3 GLN 36 -6.870 11.814 6.733 282 HE21 GLN 36 HE21 GLN 36 -5.646 13.183 5.327 283 HE22 GLN 36 HE22 GLN 36 -6.384 13.963 3.982 284 H LEU 37 H LEU 37 -4.670 7.742 6.927 285 HA LEU 37 HA LEU 37 -4.507 5.905 4.713 286 HB2 LEU 37 HB2 LEU 37 -2.510 6.889 5.725 287 HB3 LEU 37 HB3 LEU 37 -2.879 6.143 7.268 288 HG LEU 37 HG LEU 37 -2.356 3.919 6.389 289 HD11 LEU 37 HD11 LEU 37 -1.816 5.207 3.696 290 HD12 LEU 37 HD12 LEU 37 -3.179 4.148 4.078 291 HD13 LEU 37 HD13 LEU 37 -1.529 3.511 4.124 292 HD21 LEU 37 HD21 LEU 37 -0.492 5.270 7.236 293 HD22 LEU 37 HD22 LEU 37 -0.203 5.911 5.614 294 HD23 LEU 37 HD23 LEU 37 0.035 4.191 5.943 295 H GLU 38 H GLU 38 -5.013 5.459 8.237 296 HA GLU 38 HA GLU 38 -5.462 2.633 8.127 297 HB2 GLU 38 HB2 GLU 38 -6.114 2.852 10.486 298 HB3 GLU 38 HB3 GLU 38 -4.672 3.794 10.148 299 HG2 GLU 38 HG2 GLU 38 -6.204 5.827 9.924 300 HG3 GLU 38 HG3 GLU 38 -7.483 4.816 10.598 301 H ARG 39 H ARG 39 -7.472 5.239 7.270 302 HA ARG 39 HA ARG 39 -10.067 4.304 7.840 303 HB2 ARG 39 HB2 ARG 39 -9.479 6.628 7.164 304 HB3 ARG 39 HB3 ARG 39 -9.061 6.051 5.553 305 HG2 ARG 39 HG2 ARG 39 -11.385 5.440 5.125 306 HG3 ARG 39 HG3 ARG 39 -11.823 5.879 6.769 307 HD2 ARG 39 HD2 ARG 39 -10.881 7.735 4.572 308 HD3 ARG 39 HD3 ARG 39 -12.494 7.670 5.282 309 HE ARG 39 HE ARG 39 -10.763 8.211 7.357 310 HH11 ARG 39 HH11 ARG 39 -11.695 9.823 4.444 311 HH12 ARG 39 HH12 ARG 39 -11.340 11.386 5.078 312 HH21 ARG 39 HH21 ARG 39 -10.301 10.187 8.143 313 HH22 ARG 39 HH22 ARG 39 -10.548 11.586 7.157 314 H TRP 40 H TRP 40 -7.761 3.389 5.380 315 HA TRP 40 HA TRP 40 -9.680 1.480 4.179 316 HB2 TRP 40 HB2 TRP 40 -8.765 1.984 1.925 317 HB3 TRP 40 HB3 TRP 40 -9.519 3.401 2.651 318 HD1 TRP 40 HD1 TRP 40 -7.821 5.373 3.535 319 HE1 TRP 40 HE1 TRP 40 -5.442 5.993 2.766 320 HE3 TRP 40 HE3 TRP 40 -6.594 1.081 1.046 321 HZ2 TRP 40 HZ2 TRP 40 -3.344 4.846 1.281 322 HZ3 TRP 40 HZ3 TRP 40 -4.387 0.917 -0.029 323 HH2 TRP 40 HH2 TRP 40 -2.802 2.766 0.094 324 H TRP 41 H TRP 41 -6.580 1.998 5.540 325 HA TRP 41 HA TRP 41 -4.993 0.206 4.006 326 HB2 TRP 41 HB2 TRP 41 -4.157 2.058 5.568 327 HB3 TRP 41 HB3 TRP 41 -4.468 0.968 6.916 328 HD1 TRP 41 HD1 TRP 41 -2.330 -0.318 7.636 329 HE1 TRP 41 HE1 TRP 41 -0.151 -1.056 6.491 330 HE3 TRP 41 HE3 TRP 41 -3.276 1.302 2.861 331 HZ2 TRP 41 HZ2 TRP 41 1.009 -0.970 3.947 332 HZ3 TRP 41 HZ3 TRP 41 -1.588 0.919 1.142 333 HH2 TRP 41 HH2 TRP 41 0.523 -0.194 1.666 334 H GLY 42 H GLY 42 -5.624 -1.838 3.763 335 HA2 GLY 42 HA2 GLY 42 -5.685 -4.118 4.603 336 HA3 GLY 42 HA3 GLY 42 -6.401 -3.518 6.092 337 HA PRO 43 HA PRO 43 -9.783 -4.750 2.934 338 HB2 PRO 43 HB2 PRO 43 -10.606 -7.152 3.986 339 HB3 PRO 43 HB3 PRO 43 -9.305 -7.038 2.791 340 HG2 PRO 43 HG2 PRO 43 -9.121 -7.326 5.784 341 HG3 PRO 43 HG3 PRO 43 -8.177 -8.146 4.521 342 HD2 PRO 43 HD2 PRO 43 -7.233 -5.983 5.929 343 HD3 PRO 43 HD3 PRO 43 -6.716 -6.343 4.268 344 HA PRO 44 HA PRO 44 -13.144 -2.984 5.344 345 HB2 PRO 44 HB2 PRO 44 -14.778 -5.413 4.544 346 HB3 PRO 44 HB3 PRO 44 -15.227 -3.699 4.505 347 HG2 PRO 44 HG2 PRO 44 -14.515 -4.903 2.258 348 HG3 PRO 44 HG3 PRO 44 -13.908 -3.268 2.601 349 HD2 PRO 44 HD2 PRO 44 -12.462 -5.905 2.781 350 HD3 PRO 44 HD3 PRO 44 -11.852 -4.317 2.266 351 H THR 45 H THR 45 -12.535 -6.427 5.929 352 HA THR 45 HA THR 45 -13.902 -6.489 8.510 353 HB THR 45 HB THR 45 -13.132 -8.897 8.563 354 HG1 THR 45 HG1 THR 45 -11.845 -9.673 7.001 355 HG21 THR 45 HG21 THR 45 -14.531 -8.067 5.990 356 HG22 THR 45 HG22 THR 45 -15.318 -8.343 7.547 357 HG23 THR 45 HG23 THR 45 -14.549 -9.684 6.696 358 H TRP 46 H TRP 46 -10.657 -5.896 7.414 359 HA TRP 46 HA TRP 46 -9.586 -6.030 10.193 360 HB2 TRP 46 HB2 TRP 46 -8.078 -6.422 7.567 361 HB3 TRP 46 HB3 TRP 46 -7.310 -6.313 9.143 362 HD1 TRP 46 HD1 TRP 46 -9.990 -8.599 7.460 363 HE1 TRP 46 HE1 TRP 46 -9.582 -10.997 8.253 364 HE3 TRP 46 HE3 TRP 46 -6.047 -7.763 10.602 365 HZ2 TRP 46 HZ2 TRP 46 -7.846 -12.373 9.966 366 HZ3 TRP 46 HZ3 TRP 46 -5.052 -9.686 11.773 367 HH2 TRP 46 HH2 TRP 46 -5.927 -11.953 11.460 368 HA PRO 47 HA PRO 47 -9.205 -1.513 9.005 369 HB2 PRO 47 HB2 PRO 47 -10.115 -0.453 11.346 370 HB3 PRO 47 HB3 PRO 47 -11.220 -1.006 10.080 371 HG2 PRO 47 HG2 PRO 47 -10.361 -2.429 12.602 372 HG3 PRO 47 HG3 PRO 47 -11.990 -2.275 11.909 373 HD2 PRO 47 HD2 PRO 47 -10.429 -4.511 11.570 374 HD3 PRO 47 HD3 PRO 47 -11.638 -3.990 10.377 375 H ALA 48 H ALA 48 -7.239 -0.484 9.306 376 HA ALA 48 HA ALA 48 -5.334 -1.469 11.276 377 HB1 ALA 48 HB1 ALA 48 -4.597 -0.958 8.982 378 HB2 ALA 48 HB2 ALA 48 -3.726 0.027 10.162 379 HB3 ALA 48 HB3 ALA 48 -5.036 0.737 9.210 380 H THR 49 H THR 49 -4.164 -0.052 12.748 381 HA THR 49 HA THR 49 -5.289 2.598 13.389 382 HB THR 49 HB THR 49 -4.874 0.411 15.493 383 HG1 THR 49 HG1 THR 49 -7.184 1.731 14.478 384 HG21 THR 49 HG21 THR 49 -4.144 2.599 16.384 385 HG22 THR 49 HG22 THR 49 -5.657 2.093 17.142 386 HG23 THR 49 HG23 THR 49 -5.672 3.326 15.878 387 H PHE 50 H PHE 50 -3.568 3.937 13.221 388 HA PHE 50 HA PHE 50 -0.841 2.914 13.413 389 HB2 PHE 50 HB2 PHE 50 -2.046 5.481 12.324 390 HB3 PHE 50 HB3 PHE 50 -0.309 5.354 12.605 391 HD1 PHE 50 HD1 PHE 50 -3.119 3.582 10.853 392 HD2 PHE 50 HD2 PHE 50 1.078 4.416 10.934 393 HE1 PHE 50 HE1 PHE 50 -2.835 2.380 8.725 394 HE2 PHE 50 HE2 PHE 50 1.350 3.215 8.808 395 HZ PHE 50 HZ PHE 50 -0.601 2.195 7.703 396 H GLU 51 H GLU 51 -0.032 2.781 15.369 397 HA GLU 51 HA GLU 51 -0.412 4.495 17.590 398 HB2 GLU 51 HB2 GLU 51 1.934 2.661 16.912 399 HB3 GLU 51 HB3 GLU 51 1.601 3.341 18.506 400 HG2 GLU 51 HG2 GLU 51 -0.161 1.377 16.995 401 HG3 GLU 51 HG3 GLU 51 0.896 0.989 18.350 402 H THR 52 H THR 52 1.973 4.452 14.967 403 HA THR 52 HA THR 52 2.490 7.304 15.347 404 HB THR 52 HB THR 52 4.333 6.271 16.653 405 HG1 THR 52 HG1 THR 52 5.926 7.511 15.712 406 HG21 THR 52 HG21 THR 52 4.567 4.123 15.465 407 HG22 THR 52 HG22 THR 52 6.109 4.972 15.545 408 HG23 THR 52 HG23 THR 52 5.184 4.967 14.043 409 H HIS 53 H HIS 53 3.488 8.290 13.488 410 HA HIS 53 HA HIS 53 3.955 6.853 11.024 411 HB2 HIS 53 HB2 HIS 53 1.436 6.985 11.132 412 HB3 HIS 53 HB3 HIS 53 1.546 8.736 11.205 413 HD2 HIS 53 HD2 HIS 53 1.383 5.910 8.609 414 HE1 HIS 53 HE1 HIS 53 2.103 9.544 6.580 415 HE2 HIS 53 HE2 HIS 53 1.230 7.192 6.360 416 H GLU 54 H GLU 54 6.004 7.877 11.111 417 HA GLU 54 HA GLU 54 6.374 10.617 11.860 418 HB2 GLU 54 HB2 GLU 54 8.318 8.664 10.554 419 HB3 GLU 54 HB3 GLU 54 8.770 10.207 11.280 420 HG2 GLU 54 HG2 GLU 54 8.014 9.405 13.475 421 HG3 GLU 54 HG3 GLU 54 7.524 7.867 12.770 422 H PHE 55 H PHE 55 6.245 8.924 8.793 423 HA PHE 55 HA PHE 55 6.243 9.470 6.625 424 HB2 PHE 55 HB2 PHE 55 4.136 10.653 7.566 425 HB3 PHE 55 HB3 PHE 55 5.035 12.154 7.368 426 HD1 PHE 55 HD1 PHE 55 4.220 9.068 5.387 427 HD2 PHE 55 HD2 PHE 55 4.662 13.315 5.316 428 HE1 PHE 55 HE1 PHE 55 3.527 9.096 3.033 429 HE2 PHE 55 HE2 PHE 55 3.957 13.334 2.960 430 HZ PHE 55 HZ PHE 55 3.389 11.225 1.825 431 H THR 56 H THR 56 8.688 9.701 7.475 432 HA THR 56 HA THR 56 9.819 11.891 5.842 433 HB THR 56 HB THR 56 10.214 12.621 8.126 434 HG1 THR 56 HG1 THR 56 12.767 11.831 7.879 435 HG21 THR 56 HG21 THR 56 9.985 10.485 9.339 436 HG22 THR 56 HG22 THR 56 11.488 11.297 9.780 437 HG23 THR 56 HG23 THR 56 11.522 9.932 8.665 438 H VAL 57 H VAL 57 11.980 11.384 4.968 439 HA VAL 57 HA VAL 57 12.128 8.724 3.899 440 HB VAL 57 HB VAL 57 14.135 11.017 3.750 441 HG11 VAL 57 HG11 VAL 57 15.128 9.829 1.801 442 HG12 VAL 57 HG12 VAL 57 14.043 8.466 2.078 443 HG13 VAL 57 HG13 VAL 57 15.272 8.872 3.279 444 HG21 VAL 57 HG21 VAL 57 11.958 11.591 2.742 445 HG22 VAL 57 HG22 VAL 57 12.012 10.133 1.747 446 HG23 VAL 57 HG23 VAL 57 13.191 11.423 1.489 447 H GLY 58 H GLY 58 13.016 6.974 4.822 448 HA2 GLY 58 HA2 GLY 58 14.482 5.655 6.076 449 HA3 GLY 58 HA3 GLY 58 15.260 7.100 6.706 450 H GLY 59 H GLY 59 12.094 7.727 7.101 451 HA2 GLY 59 HA2 GLY 59 12.029 7.079 9.944 452 HA3 GLY 59 HA3 GLY 59 10.877 8.045 9.046 453 H LYS 60 H LYS 60 9.761 6.391 10.807 454 HA LYS 60 HA LYS 60 8.657 4.192 9.171 455 HB2 LYS 60 HB2 LYS 60 9.671 3.959 12.026 456 HB3 LYS 60 HB3 LYS 60 8.575 2.784 11.301 457 HG2 LYS 60 HG2 LYS 60 10.506 2.804 9.393 458 HG3 LYS 60 HG3 LYS 60 11.491 3.227 10.793 459 HD2 LYS 60 HD2 LYS 60 10.620 1.185 11.962 460 HD3 LYS 60 HD3 LYS 60 9.708 0.779 10.501 461 HE2 LYS 60 HE2 LYS 60 11.734 -0.521 10.540 462 HE3 LYS 60 HE3 LYS 60 11.849 0.667 9.253 463 HZ1 LYS 60 HZ1 LYS 60 13.888 0.530 10.470 464 HZ2 LYS 60 HZ2 LYS 60 13.102 0.872 11.926 465 HZ3 LYS 60 HZ3 LYS 60 13.188 2.043 10.711 466 H ALA 61 H ALA 61 6.794 3.137 10.176 467 HA ALA 61 HA ALA 61 5.000 4.801 11.801 468 HB1 ALA 61 HB1 ALA 61 4.187 3.529 9.153 469 HB2 ALA 61 HB2 ALA 61 4.362 5.256 9.458 470 HB3 ALA 61 HB3 ALA 61 3.099 4.342 10.283 471 H ALA 62 H ALA 62 3.802 3.569 13.236 472 HA ALA 62 HA ALA 62 4.039 0.600 13.112 473 HB1 ALA 62 HB1 ALA 62 3.851 2.368 15.584 474 HB2 ALA 62 HB2 ALA 62 5.277 1.484 15.034 475 HB3 ALA 62 HB3 ALA 62 3.853 0.597 15.588 476 H TYR 63 H TYR 63 2.192 -0.547 13.261 477 HA TYR 63 HA TYR 63 -0.341 0.572 14.070 478 HB2 TYR 63 HB2 TYR 63 -1.485 0.308 11.898 479 HB3 TYR 63 HB3 TYR 63 -0.209 1.508 11.798 480 HD1 TYR 63 HD1 TYR 63 1.957 0.925 10.612 481 HD2 TYR 63 HD2 TYR 63 -1.457 -1.645 10.457 482 HE1 TYR 63 HE1 TYR 63 2.883 -0.190 8.638 483 HE2 TYR 63 HE2 TYR 63 -0.520 -2.765 8.482 484 HH TYR 63 HH TYR 63 2.705 -2.314 7.461 485 H TYR 64 H TYR 64 -2.140 -1.032 13.502 486 HA TYR 64 HA TYR 64 -1.394 -3.777 12.991 487 HB2 TYR 64 HB2 TYR 64 -2.396 -4.656 15.123 488 HB3 TYR 64 HB3 TYR 64 -0.930 -3.722 15.383 489 HD1 TYR 64 HD2 TYR 64 -1.051 -1.428 16.423 490 HD2 TYR 64 HD1 TYR 64 -4.530 -3.887 16.027 491 HE1 TYR 64 HE2 TYR 64 -2.246 -0.027 18.048 492 HE2 TYR 64 HE1 TYR 64 -5.708 -2.490 17.646 493 HH TYR 64 HH TYR 64 -5.231 -0.966 19.451 494 H MET 65 H MET 65 -3.111 -4.923 12.127 495 HA MET 65 HA MET 65 -5.710 -3.554 11.859 496 HB2 MET 65 HB2 MET 65 -4.657 -6.030 10.420 497 HB3 MET 65 HB3 MET 65 -6.221 -5.275 10.133 498 HG2 MET 65 HG2 MET 65 -4.788 -4.577 8.373 499 HG3 MET 65 HG3 MET 65 -4.975 -3.189 9.442 500 HE1 MET 65 HE1 MET 65 -1.165 -5.784 9.117 501 HE2 MET 65 HE2 MET 65 -2.622 -6.013 8.141 502 HE3 MET 65 HE3 MET 65 -2.634 -6.408 9.864 503 H THR 66 H THR 66 -7.092 -3.999 13.496 504 HA THR 66 HA THR 66 -7.083 -6.485 14.967 505 HB THR 66 HB THR 66 -9.189 -4.270 14.995 506 HG1 THR 66 HG1 THR 66 -7.700 -3.227 16.073 507 HG21 THR 66 HG21 THR 66 -9.823 -5.194 17.214 508 HG22 THR 66 HG22 THR 66 -8.662 -6.506 17.003 509 HG23 THR 66 HG23 THR 66 -10.069 -6.391 15.940 510 H GLY 67 H GLY 67 -7.803 -8.323 14.063 511 HA2 GLY 67 HA2 GLY 67 -9.356 -8.522 11.716 512 HA3 GLY 67 HA3 GLY 67 -8.967 -9.838 12.809 513 HA PRO 68 HA PRO 68 -13.634 -8.464 12.598 514 HB2 PRO 68 HB2 PRO 68 -14.591 -10.946 11.677 515 HB3 PRO 68 HB3 PRO 68 -14.225 -9.556 10.646 516 HG2 PRO 68 HG2 PRO 68 -12.499 -11.951 11.292 517 HG3 PRO 68 HG3 PRO 68 -12.769 -11.153 9.726 518 HD2 PRO 68 HD2 PRO 68 -10.533 -10.696 11.109 519 HD3 PRO 68 HD3 PRO 68 -11.338 -9.360 10.256 520 H ASP 69 H ASP 69 -12.343 -11.657 13.575 521 HA ASP 69 HA ASP 69 -14.257 -11.899 15.790 522 HB2 ASP 69 HB2 ASP 69 -12.148 -13.841 14.769 523 HB3 ASP 69 HB3 ASP 69 -13.370 -14.200 15.992 524 H GLY 70 H GLY 70 -11.609 -10.151 15.595 525 HA2 GLY 70 HA2 GLY 70 -10.558 -9.135 17.460 526 HA3 GLY 70 HA3 GLY 70 -10.829 -10.589 18.410 527 H THR 71 H THR 71 -9.720 -11.948 15.724 528 HA THR 71 HA THR 71 -7.057 -12.431 16.526 529 HB THR 71 HB THR 71 -8.231 -12.737 13.717 530 HG1 THR 71 HG1 THR 71 -8.496 -14.977 14.502 531 HG21 THR 71 HG21 THR 71 -5.844 -14.138 14.996 532 HG22 THR 71 HG22 THR 71 -5.759 -12.921 13.719 533 HG23 THR 71 HG23 THR 71 -6.509 -14.486 13.397 534 H LYS 72 H LYS 72 -5.830 -10.614 16.840 535 HA LYS 72 HA LYS 72 -5.878 -8.408 14.899 536 HB2 LYS 72 HB2 LYS 72 -6.433 -8.091 17.300 537 HB3 LYS 72 HB3 LYS 72 -4.799 -8.585 17.726 538 HG2 LYS 72 HG2 LYS 72 -3.868 -6.623 16.675 539 HG3 LYS 72 HG3 LYS 72 -5.446 -6.179 16.016 540 HD2 LYS 72 HD2 LYS 72 -5.175 -4.786 17.921 541 HD3 LYS 72 HD3 LYS 72 -6.289 -6.045 18.437 542 HE2 LYS 72 HE2 LYS 72 -3.319 -5.975 19.036 543 HE3 LYS 72 HE3 LYS 72 -4.590 -5.493 20.132 544 HZ1 LYS 72 HZ1 LYS 72 -4.204 -8.238 19.101 545 HZ2 LYS 72 HZ2 LYS 72 -5.411 -7.745 20.174 546 HZ3 LYS 72 HZ3 LYS 72 -3.789 -7.694 20.643 547 H ALA 73 H ALA 73 -4.238 -8.129 13.503 548 HA ALA 73 HA ALA 73 -1.685 -9.605 13.839 549 HB1 ALA 73 HB1 ALA 73 -2.941 -10.149 11.783 550 HB2 ALA 73 HB2 ALA 73 -1.410 -9.361 11.393 551 HB3 ALA 73 HB3 ALA 73 -2.921 -8.450 11.306 552 H ARG 74 H ARG 74 0.221 -8.492 13.980 553 HA ARG 74 HA ARG 74 0.187 -5.614 14.327 554 HB2 ARG 74 HB2 ARG 74 1.606 -7.200 15.706 555 HB3 ARG 74 HB3 ARG 74 2.583 -7.500 14.283 556 HG2 ARG 74 HG2 ARG 74 3.914 -5.827 15.054 557 HG3 ARG 74 HG3 ARG 74 2.684 -4.737 14.426 558 HD2 ARG 74 HD2 ARG 74 3.016 -5.720 17.274 559 HD3 ARG 74 HD3 ARG 74 3.177 -4.067 16.679 560 HE ARG 74 HE ARG 74 0.678 -4.342 16.129 561 HH11 ARG 74 HH11 ARG 74 2.215 -5.692 18.921 562 HH12 ARG 74 HH12 ARG 74 0.750 -5.725 19.836 563 HH21 ARG 74 HH21 ARG 74 -1.174 -4.429 17.322 564 HH22 ARG 74 HH22 ARG 74 -1.134 -5.014 18.943 565 H GLY 75 H GLY 75 1.054 -4.064 12.919 566 HA2 GLY 75 HA2 GLY 75 2.506 -4.980 10.494 567 HA3 GLY 75 HA3 GLY 75 1.302 -3.702 10.450 568 H TRP 76 H TRP 76 4.405 -4.025 10.107 569 HA TRP 76 HA TRP 76 5.153 -1.491 11.473 570 HB2 TRP 76 HB2 TRP 76 7.508 -2.136 11.045 571 HB3 TRP 76 HB3 TRP 76 6.681 -3.412 11.934 572 HD1 TRP 76 HD1 TRP 76 6.113 -5.711 10.529 573 HE1 TRP 76 HE1 TRP 76 7.213 -6.726 8.443 574 HE3 TRP 76 HE3 TRP 76 8.739 -1.621 8.900 575 HZ2 TRP 76 HZ2 TRP 76 8.951 -5.930 6.402 576 HZ3 TRP 76 HZ3 TRP 76 10.119 -1.848 6.870 577 HH2 TRP 76 HH2 TRP 76 10.226 -3.966 5.646 578 H TRP 77 H TRP 77 6.268 0.135 10.094 579 HA TRP 77 HA TRP 77 6.188 -0.313 7.167 580 HB2 TRP 77 HB2 TRP 77 4.279 1.304 8.582 581 HB3 TRP 77 HB3 TRP 77 5.338 2.437 7.763 582 HD1 TRP 77 HD1 TRP 77 4.310 -0.925 6.141 583 HE1 TRP 77 HE1 TRP 77 2.867 -0.394 4.085 584 HE3 TRP 77 HE3 TRP 77 3.813 4.116 6.774 585 HZ2 TRP 77 HZ2 TRP 77 1.665 1.874 2.886 586 HZ3 TRP 77 HZ3 TRP 77 2.501 5.393 5.132 587 HH2 TRP 77 HH2 TRP 77 1.450 4.293 3.232 588 H GLN 78 H GLN 78 8.124 0.226 6.283 589 HA GLN 78 HA GLN 78 9.768 2.365 7.528 590 HB2 GLN 78 HB2 GLN 78 11.023 0.295 7.295 591 HB3 GLN 78 HB3 GLN 78 10.518 0.109 5.628 592 HG2 GLN 78 HG2 GLN 78 12.528 1.008 5.101 593 HG3 GLN 78 HG3 GLN 78 11.802 2.551 5.508 594 HE21 GLN 78 HE21 GLN 78 13.520 3.603 6.318 595 HE22 GLN 78 HE22 GLN 78 14.508 3.072 7.617 596 H PHE 79 H PHE 79 9.280 4.311 6.631 597 HA PHE 79 HA PHE 79 8.517 4.761 3.905 598 HB2 PHE 79 HB2 PHE 79 9.597 6.687 6.007 599 HB3 PHE 79 HB3 PHE 79 8.990 7.184 4.429 600 HD1 PHE 79 HD2 PHE 79 6.556 6.439 3.829 601 HD2 PHE 79 HD1 PHE 79 8.087 6.593 7.820 602 HE1 PHE 79 HE2 PHE 79 4.266 6.609 4.705 603 HE2 PHE 79 HE1 PHE 79 5.794 6.748 8.689 604 HZ PHE 79 HZ PHE 79 3.890 6.765 7.134 605 H THR 80 H THR 80 9.818 4.615 2.198 606 HA THR 80 HA THR 80 12.735 4.600 2.519 607 HB THR 80 HB THR 80 11.137 3.725 0.073 608 HG1 THR 80 HG1 THR 80 11.856 1.609 1.433 609 HG21 THR 80 HG21 THR 80 13.583 3.990 -0.267 610 HG22 THR 80 HG22 THR 80 13.096 2.296 -0.352 611 HG23 THR 80 HG23 THR 80 13.885 2.915 1.100 612 H THR 81 H THR 81 10.254 6.144 0.418 613 HA THR 81 HA THR 81 12.126 8.328 -0.271 614 HB THR 81 HB THR 81 10.632 6.701 -2.385 615 HG1 THR 81 HG1 THR 81 12.690 6.166 -3.122 616 HG21 THR 81 HG21 THR 81 10.614 9.089 -3.014 617 HG22 THR 81 HG22 THR 81 11.699 8.177 -4.063 618 HG23 THR 81 HG23 THR 81 12.363 9.174 -2.770 619 H ILE 82 H ILE 82 11.057 10.201 0.120 620 HA ILE 82 HA ILE 82 8.168 10.442 -0.502 621 HB ILE 82 HB ILE 82 9.488 11.584 2.014 622 HG12 ILE 82 HG12 ILE 82 7.561 9.243 1.679 623 HG13 ILE 82 HG13 ILE 82 9.213 9.161 2.269 624 HG21 ILE 82 HG21 ILE 82 6.570 11.690 1.127 625 HG22 ILE 82 HG22 ILE 82 7.695 13.050 1.147 626 HG23 ILE 82 HG23 ILE 82 7.199 12.297 2.661 627 HD11 ILE 82 HD11 ILE 82 7.661 8.894 4.061 628 HD12 ILE 82 HD12 ILE 82 6.853 10.405 3.655 629 HD13 ILE 82 HD13 ILE 82 8.513 10.424 4.263 630 H GLU 83 H GLU 83 8.488 11.615 -2.360 631 HA GLU 83 HA GLU 83 10.132 14.048 -2.354 632 HB2 GLU 83 HB2 GLU 83 8.613 12.672 -4.602 633 HB3 GLU 83 HB3 GLU 83 9.568 14.143 -4.790 634 HG2 GLU 83 HG2 GLU 83 11.580 12.837 -3.978 635 HG3 GLU 83 HG3 GLU 83 10.586 11.382 -4.045 636 H ALA 84 H ALA 84 6.757 13.085 -2.873 637 HA ALA 84 HA ALA 84 4.763 14.074 -2.603 638 HB1 ALA 84 HB1 ALA 84 4.479 15.959 -1.085 639 HB2 ALA 84 HB2 ALA 84 6.209 16.317 -1.163 640 HB3 ALA 84 HB3 ALA 84 5.651 14.816 -0.421 641 HA PRO 85 HA PRO 85 2.906 14.904 -2.757 642 HB2 PRO 85 HB2 PRO 85 0.756 15.751 -4.049 643 HB3 PRO 85 HB3 PRO 85 1.744 16.930 -3.165 644 HG2 PRO 85 HG2 PRO 85 1.692 16.340 -6.127 645 HG3 PRO 85 HG3 PRO 85 1.736 17.915 -5.312 646 HD2 PRO 85 HD2 PRO 85 3.985 16.524 -6.318 647 HD3 PRO 85 HD3 PRO 85 4.042 17.872 -5.162 648 H ASP 86 H ASP 86 4.434 13.791 -5.289 649 HA ASP 86 HA ASP 86 2.294 12.097 -6.450 650 HB2 ASP 86 HB2 ASP 86 3.616 12.023 -8.503 651 HB3 ASP 86 HB3 ASP 86 3.351 13.694 -8.029 652 H HIS 87 H HIS 87 5.720 11.965 -5.376 653 HA HIS 87 HA HIS 87 5.751 9.056 -5.901 654 HB2 HIS 87 HB2 HIS 87 7.403 10.546 -7.075 655 HB3 HIS 87 HB3 HIS 87 8.121 10.923 -5.516 656 HD1 HIS 87 HD1 HIS 87 10.105 9.858 -7.243 657 HD2 HIS 87 HD2 HIS 87 7.543 7.233 -5.290 658 HE1 HIS 87 HE1 HIS 87 11.318 7.675 -7.194 659 HE2 HIS 87 HE2 HIS 87 9.809 6.139 -5.913 660 H LEU 88 H LEU 88 5.070 8.035 -4.092 661 HA LEU 88 HA LEU 88 6.765 8.265 -1.663 662 HB2 LEU 88 HB2 LEU 88 4.360 8.515 -1.211 663 HB3 LEU 88 HB3 LEU 88 4.016 7.008 -2.024 664 HG LEU 88 HG LEU 88 5.357 5.807 -0.243 665 HD11 LEU 88 HD11 LEU 88 6.774 7.642 0.512 666 HD12 LEU 88 HD12 LEU 88 5.869 6.961 1.861 667 HD13 LEU 88 HD13 LEU 88 5.367 8.499 1.152 668 HD21 LEU 88 HD21 LEU 88 2.919 5.863 -0.106 669 HD22 LEU 88 HD22 LEU 88 2.983 7.393 0.773 670 HD23 LEU 88 HD23 LEU 88 3.640 5.925 1.501 671 H GLU 89 H GLU 89 7.894 6.435 -0.994 672 HA GLU 89 HA GLU 89 7.269 3.801 -2.136 673 HB2 GLU 89 HB2 GLU 89 10.110 4.919 -1.899 674 HB3 GLU 89 HB3 GLU 89 9.732 3.217 -2.169 675 HG2 GLU 89 HG2 GLU 89 8.615 3.824 -4.294 676 HG3 GLU 89 HG3 GLU 89 9.057 5.507 -4.029 677 H PHE 90 H PHE 90 7.567 2.131 -0.712 678 HA PHE 90 HA PHE 90 8.928 2.502 1.826 679 HB2 PHE 90 HB2 PHE 90 7.033 1.773 3.220 680 HB3 PHE 90 HB3 PHE 90 6.655 3.266 2.384 681 HD1 PHE 90 HD1 PHE 90 4.900 3.320 0.633 682 HD2 PHE 90 HD2 PHE 90 5.858 -0.330 2.670 683 HE1 PHE 90 HE1 PHE 90 2.823 2.302 -0.204 684 HE2 PHE 90 HE2 PHE 90 3.770 -1.333 1.830 685 HZ PHE 90 HZ PHE 90 2.255 -0.022 0.391 686 H ASP 91 H ASP 91 8.929 0.369 3.071 687 HA ASP 91 HA ASP 91 9.000 -1.947 1.211 688 HB2 ASP 91 HB2 ASP 91 10.797 -1.164 3.521 689 HB3 ASP 91 HB3 ASP 91 10.678 -2.851 3.025 690 H ASP 92 H ASP 92 7.228 -3.153 1.503 691 HA ASP 92 HA ASP 92 5.882 -4.763 2.375 692 HB2 ASP 92 HB2 ASP 92 8.314 -5.503 2.872 693 HB3 ASP 92 HB3 ASP 92 8.001 -5.046 4.537 694 H GLY 93 H GLY 93 5.244 -5.610 5.011 695 HA2 GLY 93 HA2 GLY 93 5.330 -3.734 7.028 696 HA3 GLY 93 HA3 GLY 93 3.790 -3.466 6.214 697 H PHE 94 H PHE 94 5.211 -6.665 6.486 698 HA PHE 94 HA PHE 94 2.887 -7.559 8.052 699 HB2 PHE 94 HB2 PHE 94 5.012 -9.111 6.520 700 HB3 PHE 94 HB3 PHE 94 3.699 -9.862 7.425 701 HD1 PHE 94 HD2 PHE 94 1.270 -9.244 6.761 702 HD2 PHE 94 HD1 PHE 94 4.657 -8.477 4.246 703 HE1 PHE 94 HE2 PHE 94 -0.213 -9.071 4.800 704 HE2 PHE 94 HE1 PHE 94 3.163 -8.301 2.297 705 HZ PHE 94 HZ PHE 94 0.728 -8.603 2.572 706 H ALA 95 H ALA 95 3.136 -7.513 10.212 707 HA ALA 95 HA ALA 95 5.541 -8.781 11.414 708 HB1 ALA 95 HB1 ALA 95 5.300 -7.307 13.375 709 HB2 ALA 95 HB2 ALA 95 3.945 -6.477 12.601 710 HB3 ALA 95 HB3 ALA 95 5.562 -6.365 11.907 711 H ASP 96 H ASP 96 5.011 -9.599 13.666 712 HA ASP 96 HA ASP 96 2.742 -11.419 13.375 713 HB2 ASP 96 HB2 ASP 96 3.893 -12.773 15.128 714 HB3 ASP 96 HB3 ASP 96 4.885 -12.460 13.712 715 H GLU 97 H GLU 97 3.980 -10.299 16.504 716 HA GLU 97 HA GLU 97 1.648 -8.778 17.258 717 HB2 GLU 97 HB2 GLU 97 1.180 -10.168 19.282 718 HB3 GLU 97 HB3 GLU 97 0.885 -11.062 17.799 719 HG2 GLU 97 HG2 GLU 97 2.932 -12.338 18.072 720 HG3 GLU 97 HG3 GLU 97 3.430 -11.344 19.436 721 H HIS 98 H HIS 98 4.789 -10.215 17.984 722 HA HIS 98 HA HIS 98 5.450 -8.515 20.212 723 HB2 HIS 98 HB2 HIS 98 7.309 -10.215 18.474 724 HB3 HIS 98 HB3 HIS 98 7.690 -9.543 20.059 725 HD1 HIS 98 HD1 HIS 98 5.831 -10.453 21.980 726 HD2 HIS 98 HD2 HIS 98 6.576 -12.833 18.667 727 HE1 HIS 98 HE1 HIS 98 5.010 -12.736 22.601 728 HE2 HIS 98 HE2 HIS 98 5.451 -14.161 20.577 729 H GLY 99 H GLY 99 5.864 -8.337 16.717 730 HA2 GLY 99 HA2 GLY 99 5.948 -6.077 15.754 731 HA3 GLY 99 HA3 GLY 99 7.135 -5.645 16.975 732 H ALA 100 H ALA 100 7.643 -8.785 15.731 733 HA ALA 100 HA ALA 100 10.108 -7.994 14.415 734 HB1 ALA 100 HB1 ALA 100 10.033 -9.979 15.868 735 HB2 ALA 100 HB2 ALA 100 10.510 -10.420 14.229 736 HB3 ALA 100 HB3 ALA 100 8.866 -10.746 14.789 737 HA PRO 101 HA PRO 101 8.353 -7.950 10.179 738 HB2 PRO 101 HB2 PRO 101 11.203 -8.394 9.322 739 HB3 PRO 101 HB3 PRO 101 10.082 -7.100 8.874 740 HG2 PRO 101 HG2 PRO 101 12.116 -6.618 10.547 741 HG3 PRO 101 HG3 PRO 101 10.529 -5.858 10.804 742 HD2 PRO 101 HD2 PRO 101 11.721 -8.264 12.202 743 HD3 PRO 101 HD3 PRO 101 10.857 -6.872 12.897 744 H VAL 102 H VAL 102 7.350 -9.727 9.403 745 HA VAL 102 HA VAL 102 8.114 -12.402 9.994 746 HB VAL 102 HB VAL 102 6.005 -11.390 8.027 747 HG11 VAL 102 HG11 VAL 102 6.306 -14.161 9.255 748 HG12 VAL 102 HG12 VAL 102 6.567 -13.746 7.557 749 HG13 VAL 102 HG13 VAL 102 4.952 -13.620 8.257 750 HG21 VAL 102 HG21 VAL 102 4.388 -11.762 9.859 751 HG22 VAL 102 HG22 VAL 102 5.614 -10.585 10.330 752 HG23 VAL 102 HG23 VAL 102 5.704 -12.239 10.935 753 H ASP 103 H ASP 103 9.958 -13.151 9.129 754 HA ASP 103 HA ASP 103 10.983 -12.555 6.524 755 HB2 ASP 103 HB2 ASP 103 12.738 -14.263 7.079 756 HB3 ASP 103 HB3 ASP 103 12.545 -13.027 8.316 757 H GLU 104 H GLU 104 8.911 -15.070 7.751 758 HA GLU 104 HA GLU 104 8.812 -16.899 5.633 759 HB2 GLU 104 HB2 GLU 104 7.584 -17.246 7.721 760 HB3 GLU 104 HB3 GLU 104 6.610 -15.819 7.440 761 HG2 GLU 104 HG2 GLU 104 5.228 -17.688 7.015 762 HG3 GLU 104 HG3 GLU 104 5.600 -16.968 5.453 763 H LEU 105 H LEU 105 7.316 -13.692 5.939 764 HA LEU 105 HA LEU 105 6.320 -13.745 3.151 765 HB2 LEU 105 HB2 LEU 105 5.780 -11.780 5.419 766 HB3 LEU 105 HB3 LEU 105 5.054 -11.698 3.815 767 HG LEU 105 HG LEU 105 4.636 -13.933 5.848 768 HD11 LEU 105 HD11 LEU 105 3.453 -11.903 6.494 769 HD12 LEU 105 HD12 LEU 105 2.318 -13.149 5.984 770 HD13 LEU 105 HD13 LEU 105 2.696 -11.806 4.901 771 HD21 LEU 105 HD21 LEU 105 3.422 -13.610 3.084 772 HD22 LEU 105 HD22 LEU 105 2.973 -14.841 4.270 773 HD23 LEU 105 HD23 LEU 105 4.592 -14.838 3.580 774 H GLY 106 H GLY 106 9.107 -13.081 4.553 775 HA2 GLY 106 HA2 GLY 106 10.984 -11.860 4.193 776 HA3 GLY 106 HA3 GLY 106 10.408 -11.756 2.538 777 H VAL 107 H VAL 107 11.219 -9.683 2.229 778 HA VAL 107 HA VAL 107 9.423 -7.542 3.192 779 HB VAL 107 HB VAL 107 12.471 -7.281 2.974 780 HG11 VAL 107 HG11 VAL 107 12.194 -4.867 3.507 781 HG12 VAL 107 HG12 VAL 107 10.442 -5.046 3.407 782 HG13 VAL 107 HG13 VAL 107 11.433 -5.275 1.966 783 HG21 VAL 107 HG21 VAL 107 12.372 -6.558 5.342 784 HG22 VAL 107 HG22 VAL 107 11.694 -8.176 5.145 785 HG23 VAL 107 HG23 VAL 107 10.621 -6.790 5.341 786 H THR 108 H THR 108 8.319 -6.989 1.405 787 HA THR 108 HA THR 108 9.626 -6.914 -1.255 788 HB THR 108 HB THR 108 7.457 -8.098 -1.158 789 HG1 THR 108 HG1 THR 108 6.750 -5.829 -2.610 790 HG21 THR 108 HG21 THR 108 6.244 -5.411 -0.376 791 HG22 THR 108 HG22 THR 108 6.354 -6.829 0.669 792 HG23 THR 108 HG23 THR 108 5.342 -6.875 -0.775 793 H HIS 109 H HIS 109 9.309 -4.975 -2.634 794 HA HIS 109 HA HIS 109 9.396 -2.478 -1.015 795 HB2 HIS 109 HB2 HIS 109 11.550 -3.223 -2.082 796 HB3 HIS 109 HB3 HIS 109 10.794 -3.060 -3.660 797 HD1 HIS 109 HD1 HIS 109 12.139 -1.070 -0.811 798 HD2 HIS 109 HD2 HIS 109 10.547 -0.383 -4.573 799 HE1 HIS 109 HE1 HIS 109 12.619 1.311 -1.322 800 HE2 HIS 109 HE2 HIS 109 11.830 1.651 -3.660 801 H ALA 110 H ALA 110 7.514 -1.372 -1.275 802 HA ALA 110 HA ALA 110 5.979 -1.544 -3.794 803 HB1 ALA 110 HB1 ALA 110 5.170 -0.387 -1.105 804 HB2 ALA 110 HB2 ALA 110 4.776 -2.003 -1.696 805 HB3 ALA 110 HB3 ALA 110 4.120 -0.582 -2.514 806 H THR 111 H THR 111 5.807 0.153 -5.186 807 HA THR 111 HA THR 111 6.966 2.803 -4.469 808 HB THR 111 HB THR 111 6.952 1.461 -7.225 809 HG1 THR 111 HG1 THR 111 9.195 1.971 -5.529 810 HG21 THR 111 HG21 THR 111 8.311 4.034 -6.326 811 HG22 THR 111 HG22 THR 111 6.898 3.944 -7.378 812 HG23 THR 111 HG23 THR 111 8.448 3.300 -7.924 813 H VAL 112 H VAL 112 5.250 4.120 -4.123 814 HA VAL 112 HA VAL 112 2.758 3.931 -5.673 815 HB VAL 112 HB VAL 112 3.414 5.714 -3.279 816 HG11 VAL 112 HG11 VAL 112 1.555 6.607 -4.644 817 HG12 VAL 112 HG12 VAL 112 0.957 6.023 -3.090 818 HG13 VAL 112 HG13 VAL 112 0.721 5.052 -4.544 819 HG21 VAL 112 HG21 VAL 112 3.549 3.338 -2.628 820 HG22 VAL 112 HG22 VAL 112 1.949 3.042 -3.313 821 HG23 VAL 112 HG23 VAL 112 2.122 4.094 -1.907 822 H LYS 113 H LYS 113 2.473 5.220 -7.423 823 HA LYS 113 HA LYS 113 3.906 7.813 -7.660 824 HB2 LYS 113 HB2 LYS 113 3.501 5.722 -9.844 825 HB3 LYS 113 HB3 LYS 113 4.245 7.304 -10.079 826 HG2 LYS 113 HG2 LYS 113 6.074 6.672 -8.531 827 HG3 LYS 113 HG3 LYS 113 5.331 5.085 -8.301 828 HD2 LYS 113 HD2 LYS 113 6.458 6.200 -10.902 829 HD3 LYS 113 HD3 LYS 113 7.197 4.955 -9.887 830 HE2 LYS 113 HE2 LYS 113 5.304 3.442 -10.359 831 HE3 LYS 113 HE3 LYS 113 4.541 4.691 -11.347 832 HZ1 LYS 113 HZ1 LYS 113 5.721 3.088 -12.687 833 HZ2 LYS 113 HZ2 LYS 113 7.169 3.433 -11.886 834 HZ3 LYS 113 HZ3 LYS 113 6.423 4.616 -12.837 835 H LEU 114 H LEU 114 2.462 9.421 -7.750 836 HA LEU 114 HA LEU 114 -0.248 9.024 -8.839 837 HB2 LEU 114 HB2 LEU 114 0.892 11.386 -7.296 838 HB3 LEU 114 HB3 LEU 114 -0.793 11.160 -7.749 839 HG LEU 114 HG LEU 114 0.747 9.372 -5.815 840 HD11 LEU 114 HD11 LEU 114 0.349 11.563 -4.834 841 HD12 LEU 114 HD12 LEU 114 -0.682 10.363 -4.065 842 HD13 LEU 114 HD13 LEU 114 -1.363 11.481 -5.255 843 HD21 LEU 114 HD21 LEU 114 -2.193 9.346 -6.571 844 HD22 LEU 114 HD22 LEU 114 -1.440 8.364 -5.311 845 HD23 LEU 114 HD23 LEU 114 -0.991 8.121 -6.996 846 H GLU 115 H GLU 115 -1.002 10.054 -10.630 847 HA GLU 115 HA GLU 115 0.735 11.943 -12.114 848 HB2 GLU 115 HB2 GLU 115 -1.061 9.769 -13.284 849 HB3 GLU 115 HB3 GLU 115 -0.128 10.936 -14.221 850 HG2 GLU 115 HG2 GLU 115 1.960 9.979 -13.333 851 HG3 GLU 115 HG3 GLU 115 1.033 8.821 -12.383 852 HA PRO 116 HA PRO 116 -2.948 14.585 -11.605 853 HB2 PRO 116 HB2 PRO 116 -1.595 16.410 -13.544 854 HB3 PRO 116 HB3 PRO 116 -2.090 16.714 -11.877 855 HG2 PRO 116 HG2 PRO 116 0.506 16.431 -12.558 856 HG3 PRO 116 HG3 PRO 116 -0.117 15.865 -10.995 857 HD2 PRO 116 HD2 PRO 116 0.515 14.269 -13.470 858 HD3 PRO 116 HD3 PRO 116 0.832 13.880 -11.766 859 H LEU 117 H LEU 117 -4.609 13.486 -12.688 860 HA LEU 117 HA LEU 117 -4.855 13.721 -15.628 861 HB2 LEU 117 HB2 LEU 117 -6.775 12.388 -13.670 862 HB3 LEU 117 HB3 LEU 117 -6.794 12.244 -15.419 863 HG LEU 117 HG LEU 117 -4.694 11.101 -13.534 864 HD11 LEU 117 HD11 LEU 117 -6.793 9.689 -15.223 865 HD12 LEU 117 HD12 LEU 117 -6.809 9.869 -13.466 866 HD13 LEU 117 HD13 LEU 117 -5.553 8.904 -14.237 867 HD21 LEU 117 HD21 LEU 117 -3.693 10.019 -15.513 868 HD22 LEU 117 HD22 LEU 117 -3.610 11.774 -15.622 869 HD23 LEU 117 HD23 LEU 117 -4.815 10.892 -16.566 870 H GLU 118 H GLU 118 -4.811 16.164 -14.683 871 HA GLU 118 HA GLU 118 -5.776 18.185 -14.416 872 HB2 GLU 118 HB2 GLU 118 -8.125 16.860 -15.836 873 HB3 GLU 118 HB3 GLU 118 -8.061 18.577 -15.473 874 HG2 GLU 118 HG2 GLU 118 -7.465 18.325 -17.748 875 HG3 GLU 118 HG3 GLU 118 -6.003 18.742 -16.864 876 H ASN 119 H ASN 119 -8.818 16.435 -14.004 877 HA ASN 119 HA ASN 119 -9.190 17.672 -11.357 878 HB2 ASN 119 HB2 ASN 119 -11.628 17.236 -11.815 879 HB3 ASN 119 HB3 ASN 119 -10.850 18.328 -12.961 880 HD21 ASN 119 HD21 ASN 119 -12.546 17.916 -14.422 881 HD22 ASN 119 HD22 ASN 119 -12.621 16.457 -15.342 882 H ARG 120 H ARG 120 -8.949 14.597 -12.998 883 HA ARG 120 HA ARG 120 -9.344 13.084 -10.495 884 HB2 ARG 120 HB2 ARG 120 -8.830 12.090 -13.343 885 HB3 ARG 120 HB3 ARG 120 -9.137 11.068 -11.938 886 HG2 ARG 120 HG2 ARG 120 -11.404 12.164 -11.739 887 HG3 ARG 120 HG3 ARG 120 -11.077 12.984 -13.269 888 HD2 ARG 120 HD2 ARG 120 -11.150 9.971 -12.863 889 HD3 ARG 120 HD3 ARG 120 -12.457 10.939 -13.549 890 HE ARG 120 HE ARG 120 -10.675 11.566 -15.288 891 HH11 ARG 120 HH11 ARG 120 -10.871 8.414 -13.866 892 HH12 ARG 120 HH12 ARG 120 -10.187 7.650 -15.256 893 HH21 ARG 120 HH21 ARG 120 -9.797 10.562 -17.020 894 HH22 ARG 120 HH22 ARG 120 -9.588 8.846 -17.012 895 H THR 121 H THR 121 -7.615 11.148 -10.398 896 HA THR 121 HA THR 121 -4.916 11.896 -11.274 897 HB THR 121 HB THR 121 -5.613 11.488 -8.325 898 HG1 THR 121 HG1 THR 121 -5.869 13.612 -9.114 899 HG21 THR 121 HG21 THR 121 -3.500 10.289 -8.765 900 HG22 THR 121 HG22 THR 121 -3.188 11.761 -7.840 901 HG23 THR 121 HG23 THR 121 -2.841 11.716 -9.572 902 H ARG 122 H ARG 122 -3.526 10.174 -11.479 903 HA ARG 122 HA ARG 122 -4.691 7.461 -11.457 904 HB2 ARG 122 HB2 ARG 122 -3.893 8.299 -13.638 905 HB3 ARG 122 HB3 ARG 122 -2.325 8.683 -12.945 906 HG2 ARG 122 HG2 ARG 122 -2.015 6.683 -14.166 907 HG3 ARG 122 HG3 ARG 122 -2.040 6.203 -12.470 908 HD2 ARG 122 HD2 ARG 122 -3.347 4.613 -13.735 909 HD3 ARG 122 HD3 ARG 122 -4.455 5.567 -12.747 910 HE ARG 122 HE ARG 122 -5.324 6.542 -14.656 911 HH11 ARG 122 HH11 ARG 122 -2.534 4.699 -15.595 912 HH12 ARG 122 HH12 ARG 122 -2.973 4.739 -17.265 913 HH21 ARG 122 HH21 ARG 122 -5.822 6.568 -16.782 914 HH22 ARG 122 HH22 ARG 122 -4.791 5.781 -17.926 915 H MET 123 H MET 123 -3.977 6.131 -9.812 916 HA MET 123 HA MET 123 -1.292 6.579 -8.644 917 HB2 MET 123 HB2 MET 123 -3.225 6.601 -7.047 918 HB3 MET 123 HB3 MET 123 -3.589 4.938 -7.490 919 HG2 MET 123 HG2 MET 123 -1.372 4.233 -6.633 920 HG3 MET 123 HG3 MET 123 -1.019 5.906 -6.201 921 HE1 MET 123 HE1 MET 123 -3.220 2.776 -5.508 922 HE2 MET 123 HE2 MET 123 -4.466 3.986 -5.822 923 HE3 MET 123 HE3 MET 123 -4.264 3.323 -4.201 924 H THR 124 H THR 124 0.268 5.100 -8.953 925 HA THR 124 HA THR 124 -0.425 2.343 -9.812 926 HB THR 124 HB THR 124 1.880 4.043 -10.886 927 HG1 THR 124 HG1 THR 124 -0.671 3.629 -11.739 928 HG21 THR 124 HG21 THR 124 2.381 2.122 -12.362 929 HG22 THR 124 HG22 THR 124 1.139 1.166 -11.552 930 HG23 THR 124 HG23 THR 124 2.579 1.680 -10.665 931 H ILE 125 H ILE 125 0.146 1.012 -8.181 932 HA ILE 125 HA ILE 125 2.503 1.645 -6.483 933 HB ILE 125 HB ILE 125 0.291 -0.354 -5.810 934 HG12 ILE 125 HG12 ILE 125 0.549 2.525 -4.806 935 HG13 ILE 125 HG13 ILE 125 -0.678 1.957 -5.937 936 HG21 ILE 125 HG21 ILE 125 1.237 -0.226 -3.516 937 HG22 ILE 125 HG22 ILE 125 2.468 0.906 -4.079 938 HG23 ILE 125 HG23 ILE 125 2.458 -0.754 -4.679 939 HD11 ILE 125 HD11 ILE 125 -1.567 0.465 -4.170 940 HD12 ILE 125 HD12 ILE 125 -1.608 2.170 -3.719 941 HD13 ILE 125 HD13 ILE 125 -0.365 1.114 -3.049 942 H ILE 126 H ILE 126 4.279 0.522 -7.083 943 HA ILE 126 HA ILE 126 4.016 -2.117 -8.397 944 HB ILE 126 HB ILE 126 6.363 -0.160 -8.480 945 HG12 ILE 126 HG12 ILE 126 4.266 -0.730 -10.630 946 HG13 ILE 126 HG13 ILE 126 4.299 0.715 -9.626 947 HG21 ILE 126 HG21 ILE 126 7.220 -1.588 -10.327 948 HG22 ILE 126 HG22 ILE 126 5.881 -2.711 -10.078 949 HG23 ILE 126 HG23 ILE 126 7.093 -2.489 -8.815 950 HD11 ILE 126 HD11 ILE 126 6.443 1.341 -10.627 951 HD12 ILE 126 HD12 ILE 126 5.163 1.154 -11.825 952 HD13 ILE 126 HD13 ILE 126 6.384 -0.106 -11.640 953 H SER 127 H SER 127 4.173 -3.633 -6.846 954 HA SER 127 HA SER 127 6.053 -3.446 -4.613 955 HB2 SER 127 HB2 SER 127 3.700 -4.159 -4.180 956 HB3 SER 127 HB3 SER 127 3.920 -5.543 -5.252 957 HG SER 127 HG SER 127 4.853 -6.559 -3.680 958 H THR 128 H THR 128 8.096 -3.964 -5.280 959 HA THR 128 HA THR 128 8.636 -6.126 -7.160 960 HB THR 128 HB THR 128 10.996 -5.322 -7.094 961 HG1 THR 128 HG1 THR 128 11.323 -4.451 -5.125 962 HG21 THR 128 HG21 THR 128 10.649 -3.117 -8.154 963 HG22 THR 128 HG22 THR 128 8.998 -3.073 -7.531 964 HG23 THR 128 HG23 THR 128 9.459 -4.289 -8.726 965 H PHE 129 H PHE 129 8.756 -8.076 -6.345 966 HA PHE 129 HA PHE 129 9.360 -8.698 -3.585 967 HB2 PHE 129 HB2 PHE 129 8.773 -10.579 -5.914 968 HB3 PHE 129 HB3 PHE 129 8.713 -10.981 -4.199 969 HD1 PHE 129 HD1 PHE 129 6.928 -9.901 -2.738 970 HD2 PHE 129 HD2 PHE 129 6.883 -9.575 -6.998 971 HE1 PHE 129 HE1 PHE 129 4.560 -9.251 -2.670 972 HE2 PHE 129 HE2 PHE 129 4.519 -8.937 -6.924 973 HZ PHE 129 HZ PHE 129 3.351 -8.763 -4.759 974 H GLU 130 H GLU 130 11.022 -10.156 -2.904 975 HA GLU 130 HA GLU 130 13.586 -9.643 -4.069 976 HB2 GLU 130 HB2 GLU 130 14.427 -11.077 -2.161 977 HB3 GLU 130 HB3 GLU 130 13.377 -9.753 -1.665 978 HG2 GLU 130 HG2 GLU 130 11.470 -11.403 -1.558 979 HG3 GLU 130 HG3 GLU 130 12.636 -12.693 -1.855 980 H SER 131 H SER 131 11.386 -12.386 -4.243 981 HA SER 131 HA SER 131 13.012 -13.675 -6.311 982 HB2 SER 131 HB2 SER 131 12.238 -15.120 -3.734 983 HB3 SER 131 HB3 SER 131 12.818 -15.943 -5.180 984 HG SER 131 HG SER 131 14.244 -14.804 -3.239 985 H GLU 132 H GLU 132 11.806 -15.518 -7.384 986 HA GLU 132 HA GLU 132 9.078 -14.928 -7.928 987 HB2 GLU 132 HB2 GLU 132 10.505 -16.137 -9.545 988 HB3 GLU 132 HB3 GLU 132 10.606 -17.517 -8.455 989 HG2 GLU 132 HG2 GLU 132 8.170 -17.876 -8.678 990 HG3 GLU 132 HG3 GLU 132 8.066 -16.483 -9.757 991 H GLU 133 H GLU 133 10.556 -17.497 -5.905 992 HA GLU 133 HA GLU 133 8.254 -18.766 -4.952 993 HB2 GLU 133 HB2 GLU 133 9.648 -19.514 -3.036 994 HB3 GLU 133 HB3 GLU 133 10.505 -19.663 -4.569 995 HG2 GLU 133 HG2 GLU 133 11.749 -17.580 -4.088 996 HG3 GLU 133 HG3 GLU 133 10.884 -17.410 -2.562 997 H GLN 134 H GLN 134 9.724 -15.720 -3.893 998 HA GLN 134 HA GLN 134 8.201 -15.196 -1.587 999 HB2 GLN 134 HB2 GLN 134 10.197 -13.879 -2.206 1000 HB3 GLN 134 HB3 GLN 134 9.378 -13.262 -3.628 1001 HG2 GLN 134 HG2 GLN 134 9.313 -11.497 -2.092 1002 HG3 GLN 134 HG3 GLN 134 7.696 -12.182 -2.037 1003 HE21 GLN 134 HE21 GLN 134 9.099 -10.539 -0.115 1004 HE22 GLN 134 HE22 GLN 134 9.078 -11.417 1.357 1005 H MET 135 H MET 135 7.621 -14.133 -4.997 1006 HA MET 135 HA MET 135 5.156 -12.818 -4.379 1007 HB2 MET 135 HB2 MET 135 4.943 -12.340 -6.710 1008 HB3 MET 135 HB3 MET 135 6.627 -12.172 -6.269 1009 HG2 MET 135 HG2 MET 135 7.016 -14.452 -7.282 1010 HG3 MET 135 HG3 MET 135 5.367 -14.369 -7.910 1011 HE1 MET 135 HE1 MET 135 5.369 -11.017 -8.371 1012 HE2 MET 135 HE2 MET 135 4.571 -12.134 -9.480 1013 HE3 MET 135 HE3 MET 135 5.752 -10.975 -10.092 1014 H GLN 136 H GLN 136 5.884 -16.100 -5.427 1015 HA GLN 136 HA GLN 136 3.251 -16.997 -6.012 1016 HB2 GLN 136 HB2 GLN 136 5.598 -18.553 -4.839 1017 HB3 GLN 136 HB3 GLN 136 4.137 -19.290 -5.483 1018 HG2 GLN 136 HG2 GLN 136 6.179 -17.699 -7.071 1019 HG3 GLN 136 HG3 GLN 136 6.039 -19.452 -7.038 1020 HE21 GLN 136 HE21 GLN 136 4.725 -16.504 -8.302 1021 HE22 GLN 136 HE22 GLN 136 3.634 -17.222 -9.428 1022 H LYS 137 H LYS 137 5.147 -17.000 -2.986 1023 HA LYS 137 HA LYS 137 3.270 -18.170 -1.242 1024 HB2 LYS 137 HB2 LYS 137 5.873 -17.638 -1.023 1025 HB3 LYS 137 HB3 LYS 137 5.328 -16.134 -0.302 1026 HG2 LYS 137 HG2 LYS 137 4.695 -18.924 0.722 1027 HG3 LYS 137 HG3 LYS 137 5.938 -17.851 1.365 1028 HD2 LYS 137 HD2 LYS 137 4.174 -16.231 2.015 1029 HD3 LYS 137 HD3 LYS 137 2.941 -17.335 1.397 1030 HE2 LYS 137 HE2 LYS 137 4.868 -17.937 3.658 1031 HE3 LYS 137 HE3 LYS 137 3.175 -17.481 3.845 1032 HZ1 LYS 137 HZ1 LYS 137 3.466 -19.864 4.016 1033 HZ2 LYS 137 HZ2 LYS 137 4.159 -19.927 2.479 1034 HZ3 LYS 137 HZ3 LYS 137 2.538 -19.484 2.659 1035 H MET 138 H MET 138 3.960 -14.770 -2.008 1036 HA MET 138 HA MET 138 2.185 -13.451 -0.296 1037 HB2 MET 138 HB2 MET 138 3.067 -12.658 -3.104 1038 HB3 MET 138 HB3 MET 138 2.287 -11.575 -1.960 1039 HG2 MET 138 HG2 MET 138 4.823 -12.894 -1.078 1040 HG3 MET 138 HG3 MET 138 4.936 -11.632 -2.294 1041 HE1 MET 138 HE1 MET 138 3.579 -10.978 2.081 1042 HE2 MET 138 HE2 MET 138 4.240 -12.489 1.449 1043 HE3 MET 138 HE3 MET 138 2.610 -11.980 1.002 1044 H ALA 139 H ALA 139 1.637 -14.722 -3.571 1045 HA ALA 139 HA ALA 139 -1.075 -13.954 -3.864 1046 HB1 ALA 139 HB1 ALA 139 0.350 -14.585 -5.757 1047 HB2 ALA 139 HB2 ALA 139 -1.136 -15.535 -5.728 1048 HB3 ALA 139 HB3 ALA 139 0.387 -16.257 -5.189 1049 H GLU 140 H GLU 140 0.382 -16.917 -2.489 1050 HA GLU 140 HA GLU 140 -2.008 -18.368 -1.992 1051 HB2 GLU 140 HB2 GLU 140 0.597 -18.417 -0.409 1052 HB3 GLU 140 HB3 GLU 140 -0.674 -19.632 -0.303 1053 HG2 GLU 140 HG2 GLU 140 1.079 -19.026 -2.699 1054 HG3 GLU 140 HG3 GLU 140 1.156 -20.448 -1.666 1055 H MET 141 H MET 141 -0.339 -15.885 -0.142 1056 HA MET 141 HA MET 141 -2.080 -15.869 2.153 1057 HB2 MET 141 HB2 MET 141 -0.092 -13.839 1.052 1058 HB3 MET 141 HB3 MET 141 -0.947 -13.623 2.577 1059 HG2 MET 141 HG2 MET 141 0.905 -15.939 1.964 1060 HG3 MET 141 HG3 MET 141 1.361 -14.483 2.850 1061 HE1 MET 141 HE1 MET 141 0.317 -13.817 5.265 1062 HE2 MET 141 HE2 MET 141 -0.957 -14.761 6.041 1063 HE3 MET 141 HE3 MET 141 -1.291 -13.894 4.542 1064 H GLY 142 H GLY 142 -2.397 -14.700 -1.053 1065 HA2 GLY 142 HA2 GLY 142 -4.158 -13.659 -2.107 1066 HA3 GLY 142 HA3 GLY 142 -4.958 -13.447 -0.553 1067 H MET 143 H MET 143 -1.826 -12.335 -1.896 1068 HA MET 143 HA MET 143 -2.013 -9.755 -0.655 1069 HB2 MET 143 HB2 MET 143 0.152 -10.949 -1.122 1070 HB3 MET 143 HB3 MET 143 -0.073 -10.629 -2.837 1071 HG2 MET 143 HG2 MET 143 0.004 -8.198 -2.380 1072 HG3 MET 143 HG3 MET 143 0.239 -8.537 -0.664 1073 HE1 MET 143 HE1 MET 143 2.488 -7.230 -0.358 1074 HE2 MET 143 HE2 MET 143 2.210 -6.608 -1.987 1075 HE3 MET 143 HE3 MET 143 3.788 -7.260 -1.549 1076 H GLU 144 H GLU 144 -2.640 -10.939 -3.949 1077 HA GLU 144 HA GLU 144 -2.814 -8.486 -5.296 1078 HB2 GLU 144 HB2 GLU 144 -4.189 -11.137 -5.843 1079 HB3 GLU 144 HB3 GLU 144 -4.430 -9.741 -6.884 1080 HG2 GLU 144 HG2 GLU 144 -2.786 -11.090 -7.920 1081 HG3 GLU 144 HG3 GLU 144 -1.952 -9.687 -7.272 1082 H GLU 145 H GLU 145 -5.450 -10.403 -3.871 1083 HA GLU 145 HA GLU 145 -7.432 -8.332 -3.995 1084 HB2 GLU 145 HB2 GLU 145 -7.328 -10.905 -2.370 1085 HB3 GLU 145 HB3 GLU 145 -8.753 -9.877 -2.522 1086 HG2 GLU 145 HG2 GLU 145 -7.369 -11.259 -4.845 1087 HG3 GLU 145 HG3 GLU 145 -8.775 -11.903 -4.001 1088 H GLY 146 H GLY 146 -5.074 -9.353 -1.590 1089 HA2 GLY 146 HA2 GLY 146 -6.101 -8.093 0.725 1090 HA3 GLY 146 HA3 GLY 146 -4.432 -8.579 0.467 1091 H MET 147 H MET 147 -4.041 -6.818 -1.857 1092 HA MET 147 HA MET 147 -3.938 -4.170 -0.634 1093 HB2 MET 147 HB2 MET 147 -3.108 -5.116 -3.412 1094 HB3 MET 147 HB3 MET 147 -2.896 -3.477 -2.811 1095 HG2 MET 147 HG2 MET 147 -1.439 -4.411 -0.983 1096 HG3 MET 147 HG3 MET 147 -1.566 -5.974 -1.772 1097 HE1 MET 147 HE1 MET 147 0.478 -2.295 -3.687 1098 HE2 MET 147 HE2 MET 147 -0.215 -2.298 -2.066 1099 HE3 MET 147 HE3 MET 147 -1.272 -2.400 -3.475 1100 H ARG 148 H ARG 148 -5.632 -5.771 -3.342 1101 HA ARG 148 HA ARG 148 -6.670 -3.532 -4.639 1102 HB2 ARG 148 HB2 ARG 148 -6.544 -5.714 -5.690 1103 HB3 ARG 148 HB3 ARG 148 -7.693 -6.387 -4.536 1104 HG2 ARG 148 HG2 ARG 148 -9.462 -4.895 -5.470 1105 HG3 ARG 148 HG3 ARG 148 -8.299 -4.303 -6.665 1106 HD2 ARG 148 HD2 ARG 148 -8.123 -6.494 -7.666 1107 HD3 ARG 148 HD3 ARG 148 -9.065 -7.222 -6.354 1108 HE ARG 148 HE ARG 148 -10.323 -5.161 -8.013 1109 HH11 ARG 148 HH11 ARG 148 -10.145 -8.501 -7.146 1110 HH12 ARG 148 HH12 ARG 148 -11.665 -8.872 -7.876 1111 HH21 ARG 148 HH21 ARG 148 -12.246 -5.650 -8.918 1112 HH22 ARG 148 HH22 ARG 148 -12.838 -7.269 -8.867 1113 H GLU 149 H GLU 149 -8.297 -5.531 -2.144 1114 HA GLU 149 HA GLU 149 -10.834 -4.309 -2.182 1115 HB2 GLU 149 HB2 GLU 149 -9.353 -5.638 0.119 1116 HB3 GLU 149 HB3 GLU 149 -11.057 -5.196 0.182 1117 HG2 GLU 149 HG2 GLU 149 -9.851 -7.151 -1.811 1118 HG3 GLU 149 HG3 GLU 149 -10.626 -7.615 -0.298 1119 H ALA 150 H ALA 150 -7.943 -3.506 -0.315 1120 HA ALA 150 HA ALA 150 -8.924 -1.275 1.142 1121 HB1 ALA 150 HB1 ALA 150 -6.861 -2.485 1.743 1122 HB2 ALA 150 HB2 ALA 150 -6.533 -0.766 1.519 1123 HB3 ALA 150 HB3 ALA 150 -6.083 -1.923 0.261 1124 H ILE 151 H ILE 151 -7.383 -1.577 -2.035 1125 HA ILE 151 HA ILE 151 -7.019 1.247 -2.449 1126 HB ILE 151 HB ILE 151 -6.659 -1.094 -4.364 1127 HG12 ILE 151 HG12 ILE 151 -4.574 0.484 -2.775 1128 HG13 ILE 151 HG13 ILE 151 -5.175 -1.104 -2.319 1129 HG21 ILE 151 HG21 ILE 151 -6.971 0.986 -5.651 1130 HG22 ILE 151 HG22 ILE 151 -5.299 0.436 -5.763 1131 HG23 ILE 151 HG23 ILE 151 -5.713 1.780 -4.698 1132 HD11 ILE 151 HD11 ILE 151 -3.017 -1.295 -3.347 1133 HD12 ILE 151 HD12 ILE 151 -3.573 -0.430 -4.780 1134 HD13 ILE 151 HD13 ILE 151 -4.226 -2.027 -4.403 1135 H GLU 152 H GLU 152 -9.563 -1.039 -3.311 1136 HA GLU 152 HA GLU 152 -11.009 0.851 -4.980 1137 HB2 GLU 152 HB2 GLU 152 -11.833 -1.800 -3.724 1138 HB3 GLU 152 HB3 GLU 152 -12.940 -0.804 -4.672 1139 HG2 GLU 152 HG2 GLU 152 -11.285 -0.946 -6.581 1140 HG3 GLU 152 HG3 GLU 152 -10.387 -2.124 -5.627 1141 H GLN 153 H GLN 153 -10.714 0.201 -1.584 1142 HA GLN 153 HA GLN 153 -13.143 1.570 -0.782 1143 HB2 GLN 153 HB2 GLN 153 -11.964 -0.356 0.463 1144 HB3 GLN 153 HB3 GLN 153 -10.785 0.836 0.997 1145 HG2 GLN 153 HG2 GLN 153 -12.499 2.067 2.207 1146 HG3 GLN 153 HG3 GLN 153 -13.766 1.033 1.545 1147 HE21 GLN 153 HE21 GLN 153 -11.226 1.266 3.885 1148 HE22 GLN 153 HE22 GLN 153 -11.581 -0.193 4.730 1149 H ILE 154 H ILE 154 -9.887 2.483 -1.595 1150 HA ILE 154 HA ILE 154 -9.600 5.019 -0.424 1151 HB ILE 154 HB ILE 154 -8.751 4.095 -3.201 1152 HG12 ILE 154 HG12 ILE 154 -7.158 4.324 -0.613 1153 HG13 ILE 154 HG13 ILE 154 -7.735 2.824 -1.331 1154 HG21 ILE 154 HG21 ILE 154 -8.823 6.550 -3.219 1155 HG22 ILE 154 HG22 ILE 154 -7.149 6.002 -3.236 1156 HG23 ILE 154 HG23 ILE 154 -7.858 6.617 -1.740 1157 HD11 ILE 154 HD11 ILE 154 -6.280 3.190 -3.262 1158 HD12 ILE 154 HD12 ILE 154 -5.377 3.166 -1.749 1159 HD13 ILE 154 HD13 ILE 154 -5.710 4.700 -2.546 1160 H ASP 155 H ASP 155 -11.491 4.031 -3.250 1161 HA ASP 155 HA ASP 155 -12.295 6.499 -4.259 1162 HB2 ASP 155 HB2 ASP 155 -12.933 3.759 -4.743 1163 HB3 ASP 155 HB3 ASP 155 -14.479 4.520 -4.416 1164 H ALA 156 H ALA 156 -13.611 4.595 -1.595 1165 HA ALA 156 HA ALA 156 -15.764 6.394 -0.930 1166 HB1 ALA 156 HB1 ALA 156 -15.857 3.970 -0.413 1167 HB2 ALA 156 HB2 ALA 156 -16.079 4.945 1.040 1168 HB3 ALA 156 HB3 ALA 156 -14.525 4.155 0.732 1169 H VAL 157 H VAL 157 -12.390 6.169 0.016 1170 HA VAL 157 HA VAL 157 -12.497 7.767 2.403 1171 HB VAL 157 HB VAL 157 -10.167 7.182 0.510 1172 HG11 VAL 157 HG11 VAL 157 -8.656 7.858 2.368 1173 HG12 VAL 157 HG12 VAL 157 -10.051 8.395 3.305 1174 HG13 VAL 157 HG13 VAL 157 -9.635 9.211 1.797 1175 HG21 VAL 157 HG21 VAL 157 -9.494 5.512 2.193 1176 HG22 VAL 157 HG22 VAL 157 -11.104 5.164 1.568 1177 HG23 VAL 157 HG23 VAL 157 -10.916 5.898 3.162 1178 H LEU 158 H LEU 158 -11.747 8.508 -0.989 1179 HA LEU 158 HA LEU 158 -11.257 11.340 -0.572 1180 HB2 LEU 158 HB2 LEU 158 -11.616 9.801 -3.179 1181 HB3 LEU 158 HB3 LEU 158 -10.905 11.402 -2.998 1182 HG LEU 158 HG LEU 158 -9.716 8.798 -1.950 1183 HD11 LEU 158 HD11 LEU 158 -9.539 8.948 -4.370 1184 HD12 LEU 158 HD12 LEU 158 -7.959 9.137 -3.618 1185 HD13 LEU 158 HD13 LEU 158 -8.808 10.553 -4.247 1186 HD21 LEU 158 HD21 LEU 158 -8.604 11.617 -1.801 1187 HD22 LEU 158 HD22 LEU 158 -7.726 10.148 -1.375 1188 HD23 LEU 158 HD23 LEU 158 -9.145 10.624 -0.446 1189 H SER 159 H SER 159 -13.771 9.355 -2.104 1190 HA SER 159 HA SER 159 -15.501 11.680 -2.676 1191 HB2 SER 159 HB2 SER 159 -14.865 9.664 -4.318 1192 HB3 SER 159 HB3 SER 159 -16.130 8.819 -3.468 1193 HG SER 159 HG SER 159 -17.330 9.753 -4.931 1194 H GLU 160 H GLU 160 -15.355 11.157 0.068 1195 HA GLU 160 HA GLU 160 -16.683 8.920 1.053 1196 HB2 GLU 160 HB2 GLU 160 -15.060 10.444 2.272 1197 HB3 GLU 160 HB3 GLU 160 -16.425 11.487 2.628 1198 HG2 GLU 160 HG2 GLU 160 -17.522 9.667 3.854 1199 HG3 GLU 160 HG3 GLU 160 -16.204 8.575 3.440 1200 HA PRO 161 HA PRO 161 -20.892 10.490 0.410 1201 HB2 PRO 161 HB2 PRO 161 -21.982 8.235 -0.514 1202 HB3 PRO 161 HB3 PRO 161 -20.724 9.051 -1.456 1203 HG2 PRO 161 HG2 PRO 161 -20.520 6.580 0.247 1204 HG3 PRO 161 HG3 PRO 161 -19.687 6.968 -1.271 1205 HD2 PRO 161 HD2 PRO 161 -18.666 7.308 1.399 1206 HD3 PRO 161 HD3 PRO 161 -17.911 7.841 -0.120 1207 H ALA 162 H ALA 162 -19.781 8.954 3.039 1208 HA ALA 162 HA ALA 162 -20.459 8.056 4.983 1209 HB1 ALA 162 HB1 ALA 162 -22.106 9.885 5.109 1210 HB2 ALA 162 HB2 ALA 162 -22.733 8.410 5.846 1211 HB3 ALA 162 HB3 ALA 162 -23.280 8.900 4.239 1212 H ASN 163 H ASN 163 -23.106 7.178 2.703 1213 HA ASN 163 HA ASN 163 -23.128 4.400 3.445 1214 HB2 ASN 163 HB2 ASN 163 -25.182 5.498 2.651 1215 HB3 ASN 163 HB3 ASN 163 -24.426 5.872 1.106 1216 HD21 ASN 163 HD21 ASN 163 -24.118 4.197 -0.392 1217 HD22 ASN 163 HD22 ASN 163 -24.935 2.685 -0.254 1218 H ALA 164 H ALA 164 -21.155 3.462 3.070 1219 HA ALA 164 HA ALA 164 -20.005 3.418 0.350 1220 HB1 ALA 164 HB1 ALA 164 -17.996 2.499 1.425 1221 HB2 ALA 164 HB2 ALA 164 -18.831 2.445 2.980 1222 HB3 ALA 164 HB3 ALA 164 -18.495 3.997 2.213 1223 H LEU 165 H LEU 165 -22.359 1.763 1.783 1224 HA LEU 165 HA LEU 165 -21.581 -0.917 0.768 1225 HB2 LEU 165 HB2 LEU 165 -23.232 -1.841 2.430 1226 HB3 LEU 165 HB3 LEU 165 -21.832 -1.064 3.138 1227 HG LEU 165 HG LEU 165 -23.403 1.027 3.423 1228 HD11 LEU 165 HD11 LEU 165 -25.785 0.528 3.777 1229 HD12 LEU 165 HD12 LEU 165 -25.539 -1.107 3.153 1230 HD13 LEU 165 HD13 LEU 165 -25.305 0.288 2.098 1231 HD21 LEU 165 HD21 LEU 165 -23.811 -1.420 5.171 1232 HD22 LEU 165 HD22 LEU 165 -24.161 0.252 5.623 1233 HD23 LEU 165 HD23 LEU 165 -22.501 -0.244 5.307 1234 H GLU 166 H GLU 166 -23.608 -2.280 0.184 1235 HA GLU 166 HA GLU 166 -25.835 -0.743 -0.920 1236 HB2 GLU 166 HB2 GLU 166 -25.599 -1.757 -3.188 1237 HB3 GLU 166 HB3 GLU 166 -24.260 -0.704 -2.771 1238 HG2 GLU 166 HG2 GLU 166 -23.170 -2.479 -3.805 1239 HG3 GLU 166 HG3 GLU 166 -23.015 -2.900 -2.104 1240 H HIS 167 H HIS 167 -27.376 -2.423 -2.114 1241 HA HIS 167 HA HIS 167 -28.085 -4.351 0.030 1242 HB2 HIS 167 HB2 HIS 167 -29.662 -2.523 -0.146 1243 HB3 HIS 167 HB3 HIS 167 -29.780 -2.702 -1.890 1244 HD1 HIS 167 HD1 HIS 167 -30.822 -4.505 1.300 1245 HD2 HIS 167 HD2 HIS 167 -31.802 -4.349 -2.731 1246 HE1 HIS 167 HE1 HIS 167 -32.875 -5.920 1.053 1247 HE2 HIS 167 HE2 HIS 167 -33.524 -5.702 -1.364 1248 H HIS 168 H HIS 168 -27.495 -4.158 -3.431 1249 HA HIS 168 HA HIS 168 -29.279 -6.284 -4.201 1250 HB2 HIS 168 HB2 HIS 168 -28.722 -4.377 -5.698 1251 HB3 HIS 168 HB3 HIS 168 -27.059 -4.949 -5.805 1252 HD1 HIS 168 HD1 HIS 168 -26.572 -6.797 -7.490 1253 HD2 HIS 168 HD2 HIS 168 -30.635 -6.050 -7.040 1254 HE1 HIS 168 HE1 HIS 168 -27.701 -8.139 -9.279 1255 HE2 HIS 168 HE2 HIS 168 -30.126 -7.494 -9.122 1256 H HIS 169 H HIS 169 -25.823 -6.092 -3.597 1257 HA HIS 169 HA HIS 169 -24.084 -7.506 -3.565 1258 HB2 HIS 169 HB2 HIS 169 -26.217 -9.665 -3.317 1259 HB3 HIS 169 HB3 HIS 169 -24.489 -9.967 -3.149 1260 HD1 HIS 169 HD1 HIS 169 -25.292 -6.764 -1.613 1261 HD2 HIS 169 HD2 HIS 169 -25.457 -10.752 -0.431 1262 HE1 HIS 169 HE1 HIS 169 -25.375 -6.710 0.886 1263 HE2 HIS 169 HE2 HIS 169 -25.472 -9.126 1.582 1264 H HIS 170 H HIS 170 -23.366 -9.862 -4.775 1265 HA HIS 170 HA HIS 170 -22.424 -10.615 -6.686 1266 HB2 HIS 170 HB2 HIS 170 -24.952 -9.569 -8.035 1267 HB3 HIS 170 HB3 HIS 170 -23.761 -10.608 -8.812 1268 HD1 HIS 170 HD1 HIS 170 -23.853 -13.101 -8.290 1269 HD2 HIS 170 HD2 HIS 170 -26.566 -10.875 -6.071 1270 HE1 HIS 170 HE1 HIS 170 -25.351 -14.781 -7.191 1271 HE2 HIS 170 HE2 HIS 170 -26.887 -13.420 -5.742 1272 H HIS 171 H HIS 171 -22.009 -9.750 -9.214 1273 HA HIS 171 HA HIS 171 -21.033 -8.298 -10.625 1274 HB2 HIS 171 HB2 HIS 171 -22.856 -6.687 -9.967 1275 HB3 HIS 171 HB3 HIS 171 -21.774 -6.012 -8.756 1276 HD1 HIS 171 HD1 HIS 171 -22.256 -6.248 -12.488 1277 HD2 HIS 171 HD2 HIS 171 -19.911 -4.174 -9.764 1278 HE1 HIS 171 HE1 HIS 171 -21.129 -4.446 -13.814 1279 HE2 HIS 171 HE2 HIS 171 -19.699 -3.213 -12.153 1280 H HIS 172 H HIS 172 -20.046 -8.090 -7.242 1281 HA HIS 172 HA HIS 172 -17.242 -8.096 -8.069 1282 HB2 HIS 172 HB2 HIS 172 -17.893 -5.660 -7.733 1283 HB3 HIS 172 HB3 HIS 172 -18.251 -6.032 -6.051 1284 HD1 HIS 172 HD1 HIS 172 -16.270 -6.260 -4.446 1285 HD2 HIS 172 HD2 HIS 172 -15.114 -5.696 -8.397 1286 HE1 HIS 172 HE1 HIS 172 -13.813 -5.788 -4.364 1287 HE2 HIS 172 HE2 HIS 172 -13.174 -5.294 -6.735 Start of MODEL 5 1 H1 THR 1 H1 THR 1 -11.564 1.111 -6.789 2 H2 THR 1 H2 THR 1 -12.539 2.490 -6.649 3 H3 THR 1 H3 THR 1 -10.859 2.645 -6.638 4 HA THR 1 HA THR 1 -12.471 1.649 -8.925 5 HB THR 1 HB THR 1 -11.008 4.278 -8.727 6 HG1 THR 1 HG1 THR 1 -12.654 4.876 -7.540 7 HG21 THR 1 HG21 THR 1 -12.339 4.933 -10.714 8 HG22 THR 1 HG22 THR 1 -13.071 3.326 -10.748 9 HG23 THR 1 HG23 THR 1 -11.341 3.514 -11.047 10 H VAL 2 H VAL 2 -10.979 -0.096 -8.870 11 HA VAL 2 HA VAL 2 -8.185 0.390 -9.667 12 HB VAL 2 HB VAL 2 -9.663 -2.151 -8.865 13 HG11 VAL 2 HG11 VAL 2 -7.879 -2.724 -10.469 14 HG12 VAL 2 HG12 VAL 2 -7.419 -3.267 -8.853 15 HG13 VAL 2 HG13 VAL 2 -6.705 -1.800 -9.527 16 HG21 VAL 2 HG21 VAL 2 -9.285 -0.637 -6.965 17 HG22 VAL 2 HG22 VAL 2 -7.564 -0.561 -7.346 18 HG23 VAL 2 HG23 VAL 2 -8.281 -2.082 -6.805 19 H VAL 3 H VAL 3 -8.013 0.731 -11.819 20 HA VAL 3 HA VAL 3 -9.843 -0.493 -13.735 21 HB VAL 3 HB VAL 3 -8.556 0.878 -15.455 22 HG11 VAL 3 HG11 VAL 3 -9.773 2.420 -13.122 23 HG12 VAL 3 HG12 VAL 3 -10.671 1.693 -14.458 24 HG13 VAL 3 HG13 VAL 3 -9.563 3.032 -14.766 25 HG21 VAL 3 HG21 VAL 3 -6.407 1.087 -14.221 26 HG22 VAL 3 HG22 VAL 3 -7.211 2.067 -12.989 27 HG23 VAL 3 HG23 VAL 3 -7.058 2.676 -14.642 28 H SER 4 H SER 4 -6.664 -1.218 -12.511 29 HA SER 4 HA SER 4 -6.500 -3.574 -14.221 30 HB2 SER 4 HB2 SER 4 -5.381 -1.885 -15.629 31 HB3 SER 4 HB3 SER 4 -4.304 -1.464 -14.300 32 HG SER 4 HG SER 4 -3.129 -3.169 -14.703 33 H VAL 5 H VAL 5 -5.423 -5.257 -13.277 34 HA VAL 5 HA VAL 5 -3.639 -4.793 -10.937 35 HB VAL 5 HB VAL 5 -5.509 -7.204 -11.270 36 HG11 VAL 5 HG11 VAL 5 -3.400 -7.815 -10.123 37 HG12 VAL 5 HG12 VAL 5 -4.754 -7.863 -8.993 38 HG13 VAL 5 HG13 VAL 5 -3.632 -6.500 -8.965 39 HG21 VAL 5 HG21 VAL 5 -5.715 -4.919 -9.273 40 HG22 VAL 5 HG22 VAL 5 -6.741 -6.356 -9.301 41 HG23 VAL 5 HG23 VAL 5 -6.799 -5.203 -10.636 42 H ASP 6 H ASP 6 -1.643 -5.160 -11.779 43 HA ASP 6 HA ASP 6 -1.122 -7.533 -13.486 44 HB2 ASP 6 HB2 ASP 6 0.571 -5.019 -13.059 45 HB3 ASP 6 HB3 ASP 6 0.999 -6.367 -14.114 46 H LYS 7 H LYS 7 0.245 -9.130 -12.708 47 HA LYS 7 HA LYS 7 2.101 -8.486 -10.500 48 HB2 LYS 7 HB2 LYS 7 0.131 -9.764 -9.565 49 HB3 LYS 7 HB3 LYS 7 0.519 -11.104 -10.646 50 HG2 LYS 7 HG2 LYS 7 2.739 -11.317 -9.567 51 HG3 LYS 7 HG3 LYS 7 2.339 -9.988 -8.489 52 HD2 LYS 7 HD2 LYS 7 2.065 -12.019 -7.251 53 HD3 LYS 7 HD3 LYS 7 0.447 -11.398 -7.571 54 HE2 LYS 7 HE2 LYS 7 1.704 -13.495 -9.364 55 HE3 LYS 7 HE3 LYS 7 0.886 -13.947 -7.874 56 HZ1 LYS 7 HZ1 LYS 7 -1.111 -12.826 -8.719 57 HZ2 LYS 7 HZ2 LYS 7 -0.610 -14.097 -9.720 58 HZ3 LYS 7 HZ3 LYS 7 -0.305 -12.500 -10.168 59 H ASP 8 H ASP 8 4.027 -8.557 -11.550 60 HA ASP 8 HA ASP 8 4.578 -10.491 -13.677 61 HB2 ASP 8 HB2 ASP 8 6.388 -8.330 -12.513 62 HB3 ASP 8 HB3 ASP 8 6.701 -9.270 -13.970 63 H VAL 9 H VAL 9 4.981 -12.502 -12.869 64 HA VAL 9 HA VAL 9 6.437 -13.015 -10.439 65 HB VAL 9 HB VAL 9 5.717 -14.940 -12.698 66 HG11 VAL 9 HG11 VAL 9 6.496 -15.538 -9.811 67 HG12 VAL 9 HG12 VAL 9 7.472 -15.892 -11.239 68 HG13 VAL 9 HG13 VAL 9 5.941 -16.732 -10.988 69 HG21 VAL 9 HG21 VAL 9 3.710 -13.838 -11.786 70 HG22 VAL 9 HG22 VAL 9 4.193 -14.267 -10.143 71 HG23 VAL 9 HG23 VAL 9 3.749 -15.533 -11.291 72 H GLU 10 H GLU 10 7.300 -12.672 -13.805 73 HA GLU 10 HA GLU 10 9.960 -13.728 -13.744 74 HB2 GLU 10 HB2 GLU 10 8.814 -11.598 -15.603 75 HB3 GLU 10 HB3 GLU 10 10.241 -12.588 -15.900 76 HG2 GLU 10 HG2 GLU 10 8.862 -14.586 -16.092 77 HG3 GLU 10 HG3 GLU 10 7.418 -13.665 -15.662 78 H ALA 11 H ALA 11 8.680 -10.394 -13.670 79 HA ALA 11 HA ALA 11 11.274 -9.206 -13.075 80 HB1 ALA 11 HB1 ALA 11 10.112 -7.059 -13.302 81 HB2 ALA 11 HB2 ALA 11 8.550 -7.881 -13.342 82 HB3 ALA 11 HB3 ALA 11 9.704 -8.118 -14.654 83 H LEU 12 H LEU 12 9.083 -10.725 -11.130 84 HA LEU 12 HA LEU 12 8.431 -10.734 -8.960 85 HB2 LEU 12 HB2 LEU 12 11.020 -9.200 -8.500 86 HB3 LEU 12 HB3 LEU 12 10.126 -10.101 -7.283 87 HG LEU 12 HG LEU 12 11.546 -11.302 -9.702 88 HD11 LEU 12 HD11 LEU 12 13.111 -12.262 -8.077 89 HD12 LEU 12 HD12 LEU 12 12.268 -11.457 -6.750 90 HD13 LEU 12 HD13 LEU 12 13.108 -10.500 -7.977 91 HD21 LEU 12 HD21 LEU 12 10.036 -12.708 -7.471 92 HD22 LEU 12 HD22 LEU 12 11.009 -13.503 -8.712 93 HD23 LEU 12 HD23 LEU 12 9.558 -12.614 -9.168 94 H SER 13 H SER 13 7.366 -8.601 -10.522 95 HA SER 13 HA SER 13 7.107 -6.308 -8.658 96 HB2 SER 13 HB2 SER 13 7.864 -5.672 -10.898 97 HB3 SER 13 HB3 SER 13 6.535 -6.555 -11.637 98 HG SER 13 HG SER 13 5.172 -4.998 -11.126 99 H PHE 14 H PHE 14 4.985 -5.397 -8.322 100 HA PHE 14 HA PHE 14 2.616 -6.829 -9.290 101 HB2 PHE 14 HB2 PHE 14 3.045 -7.950 -7.158 102 HB3 PHE 14 HB3 PHE 14 3.220 -6.410 -6.322 103 HD1 PHE 14 HD1 PHE 14 0.668 -7.936 -8.616 104 HD2 PHE 14 HD2 PHE 14 1.407 -5.983 -4.886 105 HE1 PHE 14 HE1 PHE 14 -1.727 -7.962 -8.131 106 HE2 PHE 14 HE2 PHE 14 -1.003 -6.011 -4.410 107 HZ PHE 14 HZ PHE 14 -2.565 -6.992 -6.035 108 H SER 15 H SER 15 1.683 -5.172 -10.364 109 HA SER 15 HA SER 15 1.744 -2.421 -9.241 110 HB2 SER 15 HB2 SER 15 3.074 -2.616 -11.286 111 HB3 SER 15 HB3 SER 15 1.724 -3.347 -12.148 112 HG SER 15 HG SER 15 0.628 -1.388 -12.035 113 H ILE 16 H ILE 16 -0.207 -1.901 -8.407 114 HA ILE 16 HA ILE 16 -2.704 -2.686 -9.789 115 HB ILE 16 HB ILE 16 -2.295 -1.454 -7.020 116 HG12 ILE 16 HG12 ILE 16 -3.168 -4.269 -7.816 117 HG13 ILE 16 HG13 ILE 16 -1.584 -3.836 -7.178 118 HG21 ILE 16 HG21 ILE 16 -4.897 -2.356 -8.332 119 HG22 ILE 16 HG22 ILE 16 -4.438 -0.690 -7.975 120 HG23 ILE 16 HG23 ILE 16 -4.724 -1.822 -6.656 121 HD11 ILE 16 HD11 ILE 16 -4.206 -3.615 -5.696 122 HD12 ILE 16 HD12 ILE 16 -2.614 -3.188 -5.058 123 HD13 ILE 16 HD13 ILE 16 -2.975 -4.858 -5.483 124 H VAL 17 H VAL 17 -3.352 -1.276 -11.256 125 HA VAL 17 HA VAL 17 -2.616 1.571 -11.121 126 HB VAL 17 HB VAL 17 -3.814 -0.042 -13.425 127 HG11 VAL 17 HG11 VAL 17 -2.632 2.763 -13.423 128 HG12 VAL 17 HG12 VAL 17 -4.342 2.360 -13.605 129 HG13 VAL 17 HG13 VAL 17 -3.188 1.883 -14.851 130 HG21 VAL 17 HG21 VAL 17 -1.542 -0.848 -12.877 131 HG22 VAL 17 HG22 VAL 17 -0.919 0.801 -12.993 132 HG23 VAL 17 HG23 VAL 17 -1.551 -0.005 -14.431 133 H ALA 18 H ALA 18 -4.115 3.005 -10.481 134 HA ALA 18 HA ALA 18 -7.016 2.417 -10.675 135 HB1 ALA 18 HB1 ALA 18 -5.584 3.365 -8.158 136 HB2 ALA 18 HB2 ALA 18 -6.245 1.750 -8.417 137 HB3 ALA 18 HB3 ALA 18 -7.329 3.140 -8.331 138 H GLU 19 H GLU 19 -8.379 4.327 -10.514 139 HA GLU 19 HA GLU 19 -7.049 6.978 -10.630 140 HB2 GLU 19 HB2 GLU 19 -9.199 5.918 -12.494 141 HB3 GLU 19 HB3 GLU 19 -9.034 7.645 -12.193 142 HG2 GLU 19 HG2 GLU 19 -6.604 7.405 -12.973 143 HG3 GLU 19 HG3 GLU 19 -7.063 5.796 -13.547 144 H PHE 20 H PHE 20 -8.109 8.633 -9.571 145 HA PHE 20 HA PHE 20 -10.759 8.133 -8.357 146 HB2 PHE 20 HB2 PHE 20 -8.376 9.264 -6.797 147 HB3 PHE 20 HB3 PHE 20 -10.002 9.000 -6.168 148 HD1 PHE 20 HD1 PHE 20 -10.909 6.533 -6.273 149 HD2 PHE 20 HD2 PHE 20 -6.756 7.543 -6.536 150 HE1 PHE 20 HE1 PHE 20 -10.305 4.219 -5.712 151 HE2 PHE 20 HE2 PHE 20 -6.164 5.227 -5.965 152 HZ PHE 20 HZ PHE 20 -7.935 3.564 -5.562 153 H ASP 21 H ASP 21 -12.098 9.872 -8.354 154 HA ASP 21 HA ASP 21 -11.407 12.144 -9.995 155 HB2 ASP 21 HB2 ASP 21 -13.959 11.553 -8.435 156 HB3 ASP 21 HB3 ASP 21 -13.772 12.811 -9.652 157 H ALA 22 H ALA 22 -9.779 13.105 -8.829 158 HA ALA 22 HA ALA 22 -10.379 15.198 -7.012 159 HB1 ALA 22 HB1 ALA 22 -9.124 14.359 -5.024 160 HB2 ALA 22 HB2 ALA 22 -8.935 12.790 -5.809 161 HB3 ALA 22 HB3 ALA 22 -10.540 13.358 -5.354 162 H ASP 23 H ASP 23 -8.154 16.155 -6.161 163 HA ASP 23 HA ASP 23 -6.233 16.066 -8.387 164 HB2 ASP 23 HB2 ASP 23 -5.159 18.028 -7.322 165 HB3 ASP 23 HB3 ASP 23 -6.866 18.309 -7.619 166 H VAL 24 H VAL 24 -3.864 16.344 -7.579 167 HA VAL 24 HA VAL 24 -3.074 13.785 -6.720 168 HB VAL 24 HB VAL 24 -1.425 16.321 -7.087 169 HG11 VAL 24 HG11 VAL 24 -0.131 14.664 -5.803 170 HG12 VAL 24 HG12 VAL 24 0.520 14.812 -7.436 171 HG13 VAL 24 HG13 VAL 24 -0.486 13.428 -7.010 172 HG21 VAL 24 HG21 VAL 24 -2.678 15.685 -9.107 173 HG22 VAL 24 HG22 VAL 24 -1.998 14.054 -9.031 174 HG23 VAL 24 HG23 VAL 24 -0.945 15.438 -9.336 175 H LYS 25 H LYS 25 -3.050 16.919 -5.016 176 HA LYS 25 HA LYS 25 -1.811 15.973 -2.622 177 HB2 LYS 25 HB2 LYS 25 -3.297 18.493 -3.381 178 HB3 LYS 25 HB3 LYS 25 -2.996 18.181 -1.679 179 HG2 LYS 25 HG2 LYS 25 -0.625 17.998 -3.505 180 HG3 LYS 25 HG3 LYS 25 -1.309 19.598 -3.242 181 HD2 LYS 25 HD2 LYS 25 0.517 19.195 -1.655 182 HD3 LYS 25 HD3 LYS 25 -1.012 19.334 -0.791 183 HE2 LYS 25 HE2 LYS 25 -1.104 16.840 -0.636 184 HE3 LYS 25 HE3 LYS 25 0.475 16.756 -1.418 185 HZ1 LYS 25 HZ1 LYS 25 1.384 18.032 0.441 186 HZ2 LYS 25 HZ2 LYS 25 0.684 16.580 0.962 187 HZ3 LYS 25 HZ3 LYS 25 -0.134 18.042 1.185 188 H ARG 26 H ARG 26 -5.138 16.073 -3.726 189 HA ARG 26 HA ARG 26 -6.483 15.692 -1.241 190 HB2 ARG 26 HB2 ARG 26 -7.300 16.387 -3.713 191 HB3 ARG 26 HB3 ARG 26 -7.646 14.673 -3.841 192 HG2 ARG 26 HG2 ARG 26 -8.783 16.516 -1.710 193 HG3 ARG 26 HG3 ARG 26 -9.605 16.098 -3.211 194 HD2 ARG 26 HD2 ARG 26 -9.585 13.698 -2.480 195 HD3 ARG 26 HD3 ARG 26 -8.877 14.212 -0.942 196 HE ARG 26 HE ARG 26 -11.406 15.444 -1.758 197 HH11 ARG 26 HH11 ARG 26 -9.864 13.162 0.352 198 HH12 ARG 26 HH12 ARG 26 -11.249 13.039 1.374 199 HH21 ARG 26 HH21 ARG 26 -13.127 15.264 -0.447 200 HH22 ARG 26 HH22 ARG 26 -13.087 14.204 0.913 201 H VAL 27 H VAL 27 -5.352 13.453 -3.775 202 HA VAL 27 HA VAL 27 -6.095 11.040 -2.355 203 HB VAL 27 HB VAL 27 -4.212 11.253 -4.748 204 HG11 VAL 27 HG11 VAL 27 -4.127 9.056 -3.622 205 HG12 VAL 27 HG12 VAL 27 -4.895 8.904 -5.204 206 HG13 VAL 27 HG13 VAL 27 -5.884 8.907 -3.741 207 HG21 VAL 27 HG21 VAL 27 -7.244 10.935 -4.786 208 HG22 VAL 27 HG22 VAL 27 -6.184 10.839 -6.196 209 HG23 VAL 27 HG23 VAL 27 -6.342 12.360 -5.317 210 H TRP 28 H TRP 28 -3.130 12.983 -2.662 211 HA TRP 28 HA TRP 28 -1.289 11.190 -1.462 212 HB2 TRP 28 HB2 TRP 28 -0.643 13.225 -2.733 213 HB3 TRP 28 HB3 TRP 28 -1.265 14.234 -1.444 214 HD1 TRP 28 HD1 TRP 28 0.426 14.837 0.479 215 HE1 TRP 28 HE1 TRP 28 2.879 14.257 0.955 216 HE3 TRP 28 HE3 TRP 28 1.071 11.057 -2.917 217 HZ2 TRP 28 HZ2 TRP 28 4.834 12.455 0.028 218 HZ3 TRP 28 HZ3 TRP 28 3.265 9.964 -3.059 219 HH2 TRP 28 HH2 TRP 28 5.109 10.649 -1.614 220 H ALA 29 H ALA 29 -3.621 13.427 -0.042 221 HA ALA 29 HA ALA 29 -2.663 13.619 2.584 222 HB1 ALA 29 HB1 ALA 29 -5.542 13.706 1.644 223 HB2 ALA 29 HB2 ALA 29 -4.417 15.066 1.658 224 HB3 ALA 29 HB3 ALA 29 -4.932 14.334 3.180 225 H ILE 30 H ILE 30 -4.532 11.003 1.085 226 HA ILE 30 HA ILE 30 -5.226 9.642 3.543 227 HB ILE 30 HB ILE 30 -6.122 7.868 2.238 228 HG12 ILE 30 HG12 ILE 30 -4.397 8.838 -0.076 229 HG13 ILE 30 HG13 ILE 30 -4.216 7.335 0.800 230 HG21 ILE 30 HG21 ILE 30 -7.398 9.964 2.056 231 HG22 ILE 30 HG22 ILE 30 -7.559 9.002 0.586 232 HG23 ILE 30 HG23 ILE 30 -6.490 10.408 0.604 233 HD11 ILE 30 HD11 ILE 30 -5.147 6.922 -1.348 234 HD12 ILE 30 HD12 ILE 30 -6.445 8.080 -1.072 235 HD13 ILE 30 HD13 ILE 30 -6.375 6.586 -0.128 236 H TRP 31 H TRP 31 -2.349 9.759 1.610 237 HA TRP 31 HA TRP 31 -1.119 7.418 2.929 238 HB2 TRP 31 HB2 TRP 31 -0.094 9.328 0.773 239 HB3 TRP 31 HB3 TRP 31 0.842 7.985 1.429 240 HD1 TRP 31 HD1 TRP 31 -1.778 8.746 -1.189 241 HE1 TRP 31 HE1 TRP 31 -2.460 6.565 -2.373 242 HE3 TRP 31 HE3 TRP 31 0.488 5.373 1.931 243 HZ2 TRP 31 HZ2 TRP 31 -2.078 3.794 -2.041 244 HZ3 TRP 31 HZ3 TRP 31 0.286 2.972 1.423 245 HH2 TRP 31 HH2 TRP 31 -0.977 2.196 -0.520 246 H GLU 32 H GLU 32 -1.123 10.880 2.965 247 HA GLU 32 HA GLU 32 1.358 11.370 4.286 248 HB2 GLU 32 HB2 GLU 32 0.251 12.967 2.745 249 HB3 GLU 32 HB3 GLU 32 -1.103 13.119 3.857 250 HG2 GLU 32 HG2 GLU 32 0.396 14.165 5.527 251 HG3 GLU 32 HG3 GLU 32 1.747 14.009 4.401 252 H ASP 33 H ASP 33 -2.021 11.148 5.348 253 HA ASP 33 HA ASP 33 -1.281 11.622 8.162 254 HB2 ASP 33 HB2 ASP 33 -3.123 12.961 7.082 255 HB3 ASP 33 HB3 ASP 33 -4.047 11.480 6.889 256 HA PRO 34 HA PRO 34 -1.486 7.142 9.026 257 HB2 PRO 34 HB2 PRO 34 -2.019 7.406 11.779 258 HB3 PRO 34 HB3 PRO 34 -0.416 7.417 11.042 259 HG2 PRO 34 HG2 PRO 34 -2.164 9.748 11.811 260 HG3 PRO 34 HG3 PRO 34 -0.417 9.531 12.064 261 HD2 PRO 34 HD2 PRO 34 -1.285 11.080 10.084 262 HD3 PRO 34 HD3 PRO 34 0.088 9.987 9.802 263 H ARG 35 H ARG 35 -4.047 9.299 10.331 264 HA ARG 35 HA ARG 35 -5.898 7.149 10.869 265 HB2 ARG 35 HB2 ARG 35 -6.292 10.160 10.912 266 HB3 ARG 35 HB3 ARG 35 -7.584 9.021 11.265 267 HG2 ARG 35 HG2 ARG 35 -6.749 9.775 13.364 268 HG3 ARG 35 HG3 ARG 35 -6.172 8.119 13.163 269 HD2 ARG 35 HD2 ARG 35 -4.439 9.663 14.091 270 HD3 ARG 35 HD3 ARG 35 -3.952 8.916 12.567 271 HE ARG 35 HE ARG 35 -4.206 10.978 11.470 272 HH11 ARG 35 HH11 ARG 35 -4.898 11.343 14.854 273 HH12 ARG 35 HH12 ARG 35 -4.832 13.069 14.761 274 HH21 ARG 35 HH21 ARG 35 -4.152 13.153 11.413 275 HH22 ARG 35 HH22 ARG 35 -4.403 14.071 12.855 276 H GLN 36 H GLN 36 -5.610 9.652 8.350 277 HA GLN 36 HA GLN 36 -7.849 8.858 6.776 278 HB2 GLN 36 HB2 GLN 36 -5.307 10.377 6.087 279 HB3 GLN 36 HB3 GLN 36 -6.588 10.100 4.907 280 HG2 GLN 36 HG2 GLN 36 -8.174 11.347 6.332 281 HG3 GLN 36 HG3 GLN 36 -6.895 11.607 7.522 282 HE21 GLN 36 HE21 GLN 36 -7.872 12.322 4.210 283 HE22 GLN 36 HE22 GLN 36 -6.952 13.773 4.062 284 H LEU 37 H LEU 37 -4.616 7.556 7.061 285 HA LEU 37 HA LEU 37 -4.699 5.928 4.681 286 HB2 LEU 37 HB2 LEU 37 -2.586 6.665 5.639 287 HB3 LEU 37 HB3 LEU 37 -2.935 5.844 7.149 288 HG LEU 37 HG LEU 37 -2.646 3.653 6.089 289 HD11 LEU 37 HD11 LEU 37 -2.070 5.095 3.479 290 HD12 LEU 37 HD12 LEU 37 -3.518 4.143 3.828 291 HD13 LEU 37 HD13 LEU 37 -1.936 3.351 3.775 292 HD21 LEU 37 HD21 LEU 37 -0.671 4.810 6.970 293 HD22 LEU 37 HD22 LEU 37 -0.370 5.524 5.383 294 HD23 LEU 37 HD23 LEU 37 -0.264 3.776 5.605 295 H GLU 38 H GLU 38 -5.055 5.179 8.189 296 HA GLU 38 HA GLU 38 -5.776 2.423 7.784 297 HB2 GLU 38 HB2 GLU 38 -6.172 2.355 10.192 298 HB3 GLU 38 HB3 GLU 38 -4.686 3.233 9.853 299 HG2 GLU 38 HG2 GLU 38 -5.995 5.375 10.094 300 HG3 GLU 38 HG3 GLU 38 -7.364 4.413 10.648 301 H ARG 39 H ARG 39 -7.525 5.300 7.494 302 HA ARG 39 HA ARG 39 -10.187 4.658 8.001 303 HB2 ARG 39 HB2 ARG 39 -9.361 6.901 7.454 304 HB3 ARG 39 HB3 ARG 39 -8.863 6.371 5.861 305 HG2 ARG 39 HG2 ARG 39 -10.818 7.733 5.659 306 HG3 ARG 39 HG3 ARG 39 -11.237 6.077 5.232 307 HD2 ARG 39 HD2 ARG 39 -11.742 7.095 8.027 308 HD3 ARG 39 HD3 ARG 39 -12.854 7.495 6.718 309 HE ARG 39 HE ARG 39 -12.197 4.698 7.409 310 HH11 ARG 39 HH11 ARG 39 -14.572 7.133 6.803 311 HH12 ARG 39 HH12 ARG 39 -15.884 6.014 6.859 312 HH21 ARG 39 HH21 ARG 39 -13.894 3.283 7.445 313 HH22 ARG 39 HH22 ARG 39 -15.505 3.858 7.208 314 H TRP 40 H TRP 40 -8.075 3.734 5.333 315 HA TRP 40 HA TRP 40 -10.192 2.004 4.190 316 HB2 TRP 40 HB2 TRP 40 -9.329 2.505 1.919 317 HB3 TRP 40 HB3 TRP 40 -9.923 3.951 2.723 318 HD1 TRP 40 HD1 TRP 40 -8.036 5.808 3.470 319 HE1 TRP 40 HE1 TRP 40 -5.647 6.214 2.624 320 HE3 TRP 40 HE3 TRP 40 -7.251 1.388 1.038 321 HZ2 TRP 40 HZ2 TRP 40 -3.702 4.873 1.090 322 HZ3 TRP 40 HZ3 TRP 40 -5.109 1.025 -0.106 323 HH2 TRP 40 HH2 TRP 40 -3.375 2.732 -0.075 324 H TRP 41 H TRP 41 -7.040 2.135 5.487 325 HA TRP 41 HA TRP 41 -5.641 0.316 3.799 326 HB2 TRP 41 HB2 TRP 41 -4.590 1.993 5.413 327 HB3 TRP 41 HB3 TRP 41 -4.971 0.883 6.724 328 HD1 TRP 41 HD1 TRP 41 -2.924 -0.625 7.339 329 HE1 TRP 41 HE1 TRP 41 -0.853 -1.506 6.104 330 HE3 TRP 41 HE3 TRP 41 -3.876 1.255 2.675 331 HZ2 TRP 41 HZ2 TRP 41 0.232 -1.412 3.513 332 HZ3 TRP 41 HZ3 TRP 41 -2.279 0.803 0.874 333 HH2 TRP 41 HH2 TRP 41 -0.258 -0.506 1.280 334 H GLY 42 H GLY 42 -5.932 -1.793 3.588 335 HA2 GLY 42 HA2 GLY 42 -6.262 -4.038 4.206 336 HA3 GLY 42 HA3 GLY 42 -6.862 -3.528 5.778 337 HA PRO 43 HA PRO 43 -10.423 -4.379 2.608 338 HB2 PRO 43 HB2 PRO 43 -11.185 -6.915 3.324 339 HB3 PRO 43 HB3 PRO 43 -9.921 -6.616 2.120 340 HG2 PRO 43 HG2 PRO 43 -9.622 -7.265 5.057 341 HG3 PRO 43 HG3 PRO 43 -8.769 -7.975 3.667 342 HD2 PRO 43 HD2 PRO 43 -7.643 -6.028 5.193 343 HD3 PRO 43 HD3 PRO 43 -7.328 -6.137 3.445 344 HA PRO 44 HA PRO 44 -13.716 -3.180 5.499 345 HB2 PRO 44 HB2 PRO 44 -15.367 -5.435 4.331 346 HB3 PRO 44 HB3 PRO 44 -15.812 -3.742 4.597 347 HG2 PRO 44 HG2 PRO 44 -15.194 -4.558 2.148 348 HG3 PRO 44 HG3 PRO 44 -14.582 -2.994 2.730 349 HD2 PRO 44 HD2 PRO 44 -13.122 -5.617 2.443 350 HD3 PRO 44 HD3 PRO 44 -12.547 -3.966 2.119 351 H THR 45 H THR 45 -12.770 -6.556 5.428 352 HA THR 45 HA THR 45 -14.031 -7.256 7.979 353 HB THR 45 HB THR 45 -12.949 -9.521 7.573 354 HG1 THR 45 HG1 THR 45 -12.380 -8.788 4.929 355 HG21 THR 45 HG21 THR 45 -14.638 -8.463 5.265 356 HG22 THR 45 HG22 THR 45 -15.264 -9.099 6.788 357 HG23 THR 45 HG23 THR 45 -14.402 -10.164 5.676 358 H TRP 46 H TRP 46 -10.855 -6.275 6.828 359 HA TRP 46 HA TRP 46 -9.714 -6.539 9.564 360 HB2 TRP 46 HB2 TRP 46 -8.318 -7.136 6.915 361 HB3 TRP 46 HB3 TRP 46 -7.457 -6.944 8.436 362 HD1 TRP 46 HD1 TRP 46 -10.249 -9.278 6.998 363 HE1 TRP 46 HE1 TRP 46 -9.930 -11.608 8.019 364 HE3 TRP 46 HE3 TRP 46 -6.274 -8.287 10.052 365 HZ2 TRP 46 HZ2 TRP 46 -8.217 -12.882 9.844 366 HZ3 TRP 46 HZ3 TRP 46 -5.336 -10.130 11.382 367 HH2 TRP 46 HH2 TRP 46 -6.280 -12.378 11.279 368 HA PRO 47 HA PRO 47 -9.118 -2.066 8.225 369 HB2 PRO 47 HB2 PRO 47 -10.223 -0.864 10.403 370 HB3 PRO 47 HB3 PRO 47 -11.209 -1.434 9.048 371 HG2 PRO 47 HG2 PRO 47 -10.676 -2.786 11.699 372 HG3 PRO 47 HG3 PRO 47 -12.222 -2.584 10.844 373 HD2 PRO 47 HD2 PRO 47 -10.770 -4.904 10.733 374 HD3 PRO 47 HD3 PRO 47 -11.800 -4.358 9.393 375 H ALA 48 H ALA 48 -7.210 -1.028 8.718 376 HA ALA 48 HA ALA 48 -5.474 -2.135 10.766 377 HB1 ALA 48 HB1 ALA 48 -4.625 -1.620 8.518 378 HB2 ALA 48 HB2 ALA 48 -3.738 -0.736 9.761 379 HB3 ALA 48 HB3 ALA 48 -4.951 0.095 8.781 380 H THR 49 H THR 49 -4.129 -0.699 12.143 381 HA THR 49 HA THR 49 -5.142 1.959 12.840 382 HB THR 49 HB THR 49 -4.825 -0.237 14.950 383 HG1 THR 49 HG1 THR 49 -7.036 1.177 13.875 384 HG21 THR 49 HG21 THR 49 -5.457 1.487 16.614 385 HG22 THR 49 HG22 THR 49 -5.442 2.720 15.350 386 HG23 THR 49 HG23 THR 49 -3.940 1.913 15.815 387 H PHE 50 H PHE 50 -3.417 3.281 12.842 388 HA PHE 50 HA PHE 50 -0.712 2.150 12.898 389 HB2 PHE 50 HB2 PHE 50 -1.852 4.785 11.914 390 HB3 PHE 50 HB3 PHE 50 -0.116 4.592 12.155 391 HD1 PHE 50 HD1 PHE 50 -3.022 2.993 10.392 392 HD2 PHE 50 HD2 PHE 50 1.209 3.650 10.435 393 HE1 PHE 50 HE1 PHE 50 -2.820 1.858 8.222 394 HE2 PHE 50 HE2 PHE 50 1.400 2.511 8.264 395 HZ PHE 50 HZ PHE 50 -0.611 1.612 7.158 396 H GLU 51 H GLU 51 0.029 1.869 14.880 397 HA GLU 51 HA GLU 51 -0.039 3.520 17.151 398 HB2 GLU 51 HB2 GLU 51 2.176 1.702 16.133 399 HB3 GLU 51 HB3 GLU 51 2.084 2.337 17.773 400 HG2 GLU 51 HG2 GLU 51 -0.058 0.559 16.563 401 HG3 GLU 51 HG3 GLU 51 1.337 -0.071 17.430 402 H THR 52 H THR 52 2.209 3.418 14.448 403 HA THR 52 HA THR 52 3.121 6.172 14.990 404 HB THR 52 HB THR 52 5.026 3.853 14.354 405 HG1 THR 52 HG1 THR 52 4.584 5.193 16.845 406 HG21 THR 52 HG21 THR 52 5.570 6.710 15.237 407 HG22 THR 52 HG22 THR 52 5.846 6.072 13.615 408 HG23 THR 52 HG23 THR 52 6.795 5.468 14.973 409 H HIS 53 H HIS 53 3.589 7.320 13.097 410 HA HIS 53 HA HIS 53 3.995 5.979 10.548 411 HB2 HIS 53 HB2 HIS 53 1.506 6.125 10.757 412 HB3 HIS 53 HB3 HIS 53 1.625 7.869 10.955 413 HD2 HIS 53 HD2 HIS 53 1.450 5.224 8.145 414 HE1 HIS 53 HE1 HIS 53 1.950 9.041 6.404 415 HE2 HIS 53 HE2 HIS 53 1.171 6.676 6.016 416 H GLU 54 H GLU 54 6.026 6.918 10.610 417 HA GLU 54 HA GLU 54 6.404 9.809 10.850 418 HB2 GLU 54 HB2 GLU 54 8.482 7.646 10.264 419 HB3 GLU 54 HB3 GLU 54 8.810 9.313 10.739 420 HG2 GLU 54 HG2 GLU 54 7.405 7.261 12.455 421 HG3 GLU 54 HG3 GLU 54 9.121 7.639 12.550 422 H PHE 55 H PHE 55 5.456 10.680 8.973 423 HA PHE 55 HA PHE 55 6.031 9.616 6.356 424 HB2 PHE 55 HB2 PHE 55 3.837 10.781 7.201 425 HB3 PHE 55 HB3 PHE 55 4.678 12.288 6.850 426 HD1 PHE 55 HD1 PHE 55 3.957 8.976 5.263 427 HD2 PHE 55 HD2 PHE 55 4.361 13.188 4.672 428 HE1 PHE 55 HE1 PHE 55 3.291 8.706 2.912 429 HE2 PHE 55 HE2 PHE 55 3.681 12.912 2.323 430 HZ PHE 55 HZ PHE 55 3.149 10.672 1.444 431 H THR 56 H THR 56 8.396 9.878 6.954 432 HA THR 56 HA THR 56 9.466 12.161 5.426 433 HB THR 56 HB THR 56 9.821 12.782 7.794 434 HG1 THR 56 HG1 THR 56 11.463 13.352 6.316 435 HG21 THR 56 HG21 THR 56 9.830 10.542 8.840 436 HG22 THR 56 HG22 THR 56 11.281 11.443 9.280 437 HG23 THR 56 HG23 THR 56 11.372 10.172 8.059 438 H VAL 57 H VAL 57 11.712 11.702 4.637 439 HA VAL 57 HA VAL 57 11.983 9.094 3.490 440 HB VAL 57 HB VAL 57 13.947 11.434 3.626 441 HG11 VAL 57 HG11 VAL 57 15.177 10.347 1.759 442 HG12 VAL 57 HG12 VAL 57 14.135 8.931 1.906 443 HG13 VAL 57 HG13 VAL 57 15.217 9.368 3.228 444 HG21 VAL 57 HG21 VAL 57 12.074 10.541 1.393 445 HG22 VAL 57 HG22 VAL 57 13.237 11.867 1.281 446 HG23 VAL 57 HG23 VAL 57 11.882 11.976 2.406 447 H GLY 58 H GLY 58 12.892 7.314 4.353 448 HA2 GLY 58 HA2 GLY 58 14.334 5.976 5.608 449 HA3 GLY 58 HA3 GLY 58 14.985 7.402 6.399 450 H GLY 59 H GLY 59 11.708 7.751 6.633 451 HA2 GLY 59 HA2 GLY 59 11.675 7.034 9.461 452 HA3 GLY 59 HA3 GLY 59 10.426 7.895 8.575 453 H LYS 60 H LYS 60 9.700 5.931 10.395 454 HA LYS 60 HA LYS 60 8.859 3.654 8.672 455 HB2 LYS 60 HB2 LYS 60 9.739 3.471 11.589 456 HB3 LYS 60 HB3 LYS 60 9.112 2.142 10.615 457 HG2 LYS 60 HG2 LYS 60 11.092 2.529 9.047 458 HG3 LYS 60 HG3 LYS 60 11.742 3.609 10.281 459 HD2 LYS 60 HD2 LYS 60 12.759 1.410 10.517 460 HD3 LYS 60 HD3 LYS 60 11.715 1.713 11.909 461 HE2 LYS 60 HE2 LYS 60 9.944 0.327 10.850 462 HE3 LYS 60 HE3 LYS 60 11.015 0.001 9.488 463 HZ1 LYS 60 HZ1 LYS 60 11.521 -0.754 12.308 464 HZ2 LYS 60 HZ2 LYS 60 12.545 -1.080 11.001 465 HZ3 LYS 60 HZ3 LYS 60 11.016 -1.793 11.081 466 H ALA 61 H ALA 61 7.012 2.418 9.514 467 HA ALA 61 HA ALA 61 5.115 3.962 11.177 468 HB1 ALA 61 HB1 ALA 61 4.370 2.721 8.501 469 HB2 ALA 61 HB2 ALA 61 4.562 4.442 8.819 470 HB3 ALA 61 HB3 ALA 61 3.271 3.543 9.615 471 H ALA 62 H ALA 62 4.101 2.753 12.654 472 HA ALA 62 HA ALA 62 4.325 -0.211 12.569 473 HB1 ALA 62 HB1 ALA 62 4.044 1.628 14.983 474 HB2 ALA 62 HB2 ALA 62 5.515 0.790 14.480 475 HB3 ALA 62 HB3 ALA 62 4.119 -0.138 15.037 476 H TYR 63 H TYR 63 2.425 -1.294 12.332 477 HA TYR 63 HA TYR 63 -0.101 -0.153 13.276 478 HB2 TYR 63 HB2 TYR 63 -1.239 -0.433 11.088 479 HB3 TYR 63 HB3 TYR 63 0.031 0.773 11.020 480 HD1 TYR 63 HD1 TYR 63 2.198 0.246 9.838 481 HD2 TYR 63 HD2 TYR 63 -1.146 -2.417 9.655 482 HE1 TYR 63 HE1 TYR 63 3.182 -0.856 7.885 483 HE2 TYR 63 HE2 TYR 63 -0.156 -3.521 7.693 484 HH TYR 63 HH TYR 63 3.100 -2.885 6.668 485 H TYR 64 H TYR 64 -1.960 -1.668 12.759 486 HA TYR 64 HA TYR 64 -1.374 -4.460 12.306 487 HB2 TYR 64 HB2 TYR 64 -2.370 -5.244 14.476 488 HB3 TYR 64 HB3 TYR 64 -0.843 -4.396 14.681 489 HD1 TYR 64 HD2 TYR 64 -0.805 -2.085 15.700 490 HD2 TYR 64 HD1 TYR 64 -4.435 -4.333 15.412 491 HE1 TYR 64 HE2 TYR 64 -1.866 -0.608 17.349 492 HE2 TYR 64 HE1 TYR 64 -5.481 -2.865 17.061 493 HH TYR 64 HH TYR 64 -4.029 0.101 18.080 494 H MET 65 H MET 65 -3.167 -5.548 11.527 495 HA MET 65 HA MET 65 -5.637 -4.012 11.092 496 HB2 MET 65 HB2 MET 65 -4.704 -6.671 9.935 497 HB3 MET 65 HB3 MET 65 -6.213 -5.865 9.512 498 HG2 MET 65 HG2 MET 65 -4.975 -3.984 8.563 499 HG3 MET 65 HG3 MET 65 -3.443 -4.724 9.036 500 HE1 MET 65 HE1 MET 65 -3.409 -7.937 6.730 501 HE2 MET 65 HE2 MET 65 -4.067 -7.851 8.364 502 HE3 MET 65 HE3 MET 65 -2.544 -7.046 7.981 503 H THR 66 H THR 66 -7.246 -4.242 12.515 504 HA THR 66 HA THR 66 -7.438 -6.481 14.351 505 HB THR 66 HB THR 66 -9.389 -4.156 13.976 506 HG1 THR 66 HG1 THR 66 -7.819 -3.045 14.863 507 HG21 THR 66 HG21 THR 66 -9.019 -6.063 16.328 508 HG22 THR 66 HG22 THR 66 -10.384 -6.077 15.208 509 HG23 THR 66 HG23 THR 66 -10.136 -4.694 16.277 510 H GLY 67 H GLY 67 -8.010 -8.330 13.304 511 HA2 GLY 67 HA2 GLY 67 -9.806 -8.626 11.150 512 HA3 GLY 67 HA3 GLY 67 -9.226 -9.909 12.196 513 HA PRO 68 HA PRO 68 -13.936 -8.886 12.455 514 HB2 PRO 68 HB2 PRO 68 -14.844 -11.470 11.894 515 HB3 PRO 68 HB3 PRO 68 -14.601 -10.207 10.679 516 HG2 PRO 68 HG2 PRO 68 -12.735 -12.446 11.484 517 HG3 PRO 68 HG3 PRO 68 -13.164 -11.881 9.853 518 HD2 PRO 68 HD2 PRO 68 -10.844 -11.158 10.978 519 HD3 PRO 68 HD3 PRO 68 -11.773 -9.988 10.012 520 H ASP 69 H ASP 69 -12.200 -11.733 13.748 521 HA ASP 69 HA ASP 69 -13.939 -11.858 16.128 522 HB2 ASP 69 HB2 ASP 69 -11.654 -13.678 15.251 523 HB3 ASP 69 HB3 ASP 69 -12.734 -13.968 16.615 524 H GLY 70 H GLY 70 -11.928 -9.654 15.618 525 HA2 GLY 70 HA2 GLY 70 -10.507 -8.341 16.878 526 HA3 GLY 70 HA3 GLY 70 -10.657 -9.483 18.207 527 H THR 71 H THR 71 -9.701 -10.773 15.155 528 HA THR 71 HA THR 71 -7.248 -11.824 16.192 529 HB THR 71 HB THR 71 -8.173 -11.876 13.278 530 HG1 THR 71 HG1 THR 71 -9.254 -13.803 13.840 531 HG21 THR 71 HG21 THR 71 -6.381 -13.770 14.865 532 HG22 THR 71 HG22 THR 71 -5.841 -12.635 13.623 533 HG23 THR 71 HG23 THR 71 -6.879 -13.991 13.186 534 H LYS 72 H LYS 72 -5.514 -10.494 16.473 535 HA LYS 72 HA LYS 72 -5.301 -8.018 14.913 536 HB2 LYS 72 HB2 LYS 72 -5.358 -8.074 17.433 537 HB3 LYS 72 HB3 LYS 72 -3.797 -8.887 17.414 538 HG2 LYS 72 HG2 LYS 72 -2.751 -6.916 16.407 539 HG3 LYS 72 HG3 LYS 72 -4.320 -6.123 16.278 540 HD2 LYS 72 HD2 LYS 72 -3.022 -6.950 18.910 541 HD3 LYS 72 HD3 LYS 72 -2.943 -5.324 18.224 542 HE2 LYS 72 HE2 LYS 72 -5.370 -5.085 18.410 543 HE3 LYS 72 HE3 LYS 72 -5.529 -6.752 18.953 544 HZ1 LYS 72 HZ1 LYS 72 -4.198 -4.540 20.401 545 HZ2 LYS 72 HZ2 LYS 72 -4.202 -6.148 20.914 546 HZ3 LYS 72 HZ3 LYS 72 -5.656 -5.292 20.814 547 H ALA 73 H ALA 73 -4.140 -8.203 13.062 548 HA ALA 73 HA ALA 73 -1.705 -9.890 12.932 549 HB1 ALA 73 HB1 ALA 73 -3.406 -10.316 11.201 550 HB2 ALA 73 HB2 ALA 73 -1.910 -9.713 10.486 551 HB3 ALA 73 HB3 ALA 73 -3.300 -8.637 10.665 552 H ARG 74 H ARG 74 0.062 -8.778 13.531 553 HA ARG 74 HA ARG 74 0.302 -5.915 13.381 554 HB2 ARG 74 HB2 ARG 74 1.241 -7.385 15.209 555 HB3 ARG 74 HB3 ARG 74 2.456 -7.964 14.077 556 HG2 ARG 74 HG2 ARG 74 3.428 -5.714 13.920 557 HG3 ARG 74 HG3 ARG 74 2.136 -5.056 14.926 558 HD2 ARG 74 HD2 ARG 74 2.908 -6.581 16.780 559 HD3 ARG 74 HD3 ARG 74 4.287 -7.016 15.772 560 HE ARG 74 HE ARG 74 5.033 -4.709 15.907 561 HH11 ARG 74 HH11 ARG 74 2.634 -5.620 18.228 562 HH12 ARG 74 HH12 ARG 74 3.048 -4.341 19.309 563 HH21 ARG 74 HH21 ARG 74 5.550 -3.096 17.321 564 HH22 ARG 74 HH22 ARG 74 4.690 -2.945 18.811 565 H GLY 75 H GLY 75 1.416 -4.660 11.914 566 HA2 GLY 75 HA2 GLY 75 3.191 -5.923 9.901 567 HA3 GLY 75 HA3 GLY 75 1.910 -4.826 9.399 568 H TRP 76 H TRP 76 4.804 -4.597 9.036 569 HA TRP 76 HA TRP 76 5.343 -2.023 10.428 570 HB2 TRP 76 HB2 TRP 76 7.743 -2.503 10.216 571 HB3 TRP 76 HB3 TRP 76 6.959 -3.870 11.004 572 HD1 TRP 76 HD1 TRP 76 6.599 -6.108 9.445 573 HE1 TRP 76 HE1 TRP 76 7.889 -6.988 7.422 574 HE3 TRP 76 HE3 TRP 76 9.195 -1.865 8.246 575 HZ2 TRP 76 HZ2 TRP 76 9.742 -6.036 5.562 576 HZ3 TRP 76 HZ3 TRP 76 10.723 -1.944 6.315 577 HH2 TRP 76 HH2 TRP 76 10.996 -3.992 5.005 578 H TRP 77 H TRP 77 6.238 -0.337 9.188 579 HA TRP 77 HA TRP 77 6.675 -0.696 6.278 580 HB2 TRP 77 HB2 TRP 77 5.103 1.411 7.737 581 HB3 TRP 77 HB3 TRP 77 6.064 1.959 6.377 582 HD1 TRP 77 HD1 TRP 77 4.577 -1.407 5.617 583 HE1 TRP 77 HE1 TRP 77 2.543 -1.084 4.077 584 HE3 TRP 77 HE3 TRP 77 4.054 3.637 6.042 585 HZ2 TRP 77 HZ2 TRP 77 0.947 1.064 3.147 586 HZ3 TRP 77 HZ3 TRP 77 2.265 4.762 4.784 587 HH2 TRP 77 HH2 TRP 77 0.740 3.495 3.367 588 H GLN 78 H GLN 78 8.378 0.603 5.362 589 HA GLN 78 HA GLN 78 9.567 2.677 7.051 590 HB2 GLN 78 HB2 GLN 78 11.077 0.737 7.380 591 HB3 GLN 78 HB3 GLN 78 11.334 0.628 5.637 592 HG2 GLN 78 HG2 GLN 78 12.504 2.716 5.574 593 HG3 GLN 78 HG3 GLN 78 11.971 3.153 7.198 594 HE21 GLN 78 HE21 GLN 78 14.014 3.481 8.000 595 HE22 GLN 78 HE22 GLN 78 15.150 2.205 8.249 596 H PHE 79 H PHE 79 9.036 4.389 5.908 597 HA PHE 79 HA PHE 79 8.755 4.650 3.116 598 HB2 PHE 79 HB2 PHE 79 9.354 6.826 5.168 599 HB3 PHE 79 HB3 PHE 79 8.723 7.087 3.547 600 HD1 PHE 79 HD2 PHE 79 6.371 6.567 3.016 601 HD2 PHE 79 HD1 PHE 79 7.911 5.998 6.962 602 HE1 PHE 79 HE2 PHE 79 4.085 6.460 3.900 603 HE2 PHE 79 HE1 PHE 79 5.620 5.887 7.837 604 HZ PHE 79 HZ PHE 79 3.709 6.124 6.309 605 H THR 80 H THR 80 10.275 4.846 1.552 606 HA THR 80 HA THR 80 13.097 5.410 2.263 607 HB THR 80 HB THR 80 13.740 4.244 0.224 608 HG1 THR 80 HG1 THR 80 12.198 4.643 -1.271 609 HG21 THR 80 HG21 THR 80 13.293 2.806 2.182 610 HG22 THR 80 HG22 THR 80 12.893 1.975 0.677 611 HG23 THR 80 HG23 THR 80 11.606 2.645 1.682 612 H THR 81 H THR 81 10.482 6.371 0.083 613 HA THR 81 HA THR 81 12.037 8.722 -0.833 614 HB THR 81 HB THR 81 10.383 6.956 -2.707 615 HG1 THR 81 HG1 THR 81 12.316 6.214 -3.498 616 HG21 THR 81 HG21 THR 81 10.399 9.320 -3.423 617 HG22 THR 81 HG22 THR 81 11.372 8.332 -4.515 618 HG23 THR 81 HG23 THR 81 12.161 9.351 -3.311 619 H ILE 82 H ILE 82 10.869 10.357 0.051 620 HA ILE 82 HA ILE 82 7.987 10.559 -0.634 621 HB ILE 82 HB ILE 82 9.258 11.625 1.941 622 HG12 ILE 82 HG12 ILE 82 7.428 9.241 1.431 623 HG13 ILE 82 HG13 ILE 82 9.033 9.222 2.145 624 HG21 ILE 82 HG21 ILE 82 6.957 12.282 2.584 625 HG22 ILE 82 HG22 ILE 82 6.349 11.725 1.025 626 HG23 ILE 82 HG23 ILE 82 7.453 13.099 1.101 627 HD11 ILE 82 HD11 ILE 82 6.510 10.293 3.376 628 HD12 ILE 82 HD12 ILE 82 8.114 10.411 4.103 629 HD13 ILE 82 HD13 ILE 82 7.389 8.833 3.817 630 H GLU 83 H GLU 83 8.485 11.667 -2.501 631 HA GLU 83 HA GLU 83 10.075 14.113 -2.440 632 HB2 GLU 83 HB2 GLU 83 8.562 12.754 -4.717 633 HB3 GLU 83 HB3 GLU 83 9.561 14.199 -4.895 634 HG2 GLU 83 HG2 GLU 83 11.517 12.870 -4.035 635 HG3 GLU 83 HG3 GLU 83 10.493 11.441 -4.055 636 H ALA 84 H ALA 84 6.706 13.159 -2.884 637 HA ALA 84 HA ALA 84 4.728 14.148 -2.615 638 HB1 ALA 84 HB1 ALA 84 4.474 16.047 -1.087 639 HB2 ALA 84 HB2 ALA 84 6.205 16.381 -1.183 640 HB3 ALA 84 HB3 ALA 84 5.637 14.886 -0.439 641 HA PRO 85 HA PRO 85 2.850 15.033 -2.729 642 HB2 PRO 85 HB2 PRO 85 0.698 15.842 -4.055 643 HB3 PRO 85 HB3 PRO 85 1.671 17.038 -3.179 644 HG2 PRO 85 HG2 PRO 85 1.643 16.419 -6.136 645 HG3 PRO 85 HG3 PRO 85 1.680 18.001 -5.331 646 HD2 PRO 85 HD2 PRO 85 3.937 16.614 -6.314 647 HD3 PRO 85 HD3 PRO 85 3.980 17.964 -5.157 648 H ASP 86 H ASP 86 4.372 13.910 -5.285 649 HA ASP 86 HA ASP 86 2.209 12.247 -6.443 650 HB2 ASP 86 HB2 ASP 86 3.480 12.264 -8.533 651 HB3 ASP 86 HB3 ASP 86 3.200 13.910 -7.981 652 H HIS 87 H HIS 87 5.726 12.069 -5.665 653 HA HIS 87 HA HIS 87 5.683 9.161 -6.149 654 HB2 HIS 87 HB2 HIS 87 7.375 10.649 -7.273 655 HB3 HIS 87 HB3 HIS 87 8.081 10.991 -5.699 656 HD1 HIS 87 HD1 HIS 87 10.149 9.954 -7.247 657 HD2 HIS 87 HD2 HIS 87 7.369 7.273 -5.703 658 HE1 HIS 87 HE1 HIS 87 11.271 7.726 -7.306 659 HE2 HIS 87 HE2 HIS 87 9.506 6.097 -6.584 660 H LEU 88 H LEU 88 5.349 7.893 -4.514 661 HA LEU 88 HA LEU 88 6.690 8.273 -1.908 662 HB2 LEU 88 HB2 LEU 88 4.251 8.587 -1.670 663 HB3 LEU 88 HB3 LEU 88 3.951 7.042 -2.436 664 HG LEU 88 HG LEU 88 5.041 5.888 -0.504 665 HD11 LEU 88 HD11 LEU 88 6.579 7.629 0.223 666 HD12 LEU 88 HD12 LEU 88 5.548 7.126 1.558 667 HD13 LEU 88 HD13 LEU 88 5.231 8.652 0.727 668 HD21 LEU 88 HD21 LEU 88 2.609 6.174 -0.509 669 HD22 LEU 88 HD22 LEU 88 2.771 7.736 0.298 670 HD23 LEU 88 HD23 LEU 88 3.249 6.256 1.132 671 H GLU 89 H GLU 89 7.865 6.523 -1.217 672 HA GLU 89 HA GLU 89 7.315 3.821 -2.240 673 HB2 GLU 89 HB2 GLU 89 10.092 5.097 -2.204 674 HB3 GLU 89 HB3 GLU 89 9.813 3.369 -2.390 675 HG2 GLU 89 HG2 GLU 89 8.513 3.872 -4.476 676 HG3 GLU 89 HG3 GLU 89 8.966 5.565 -4.301 677 H PHE 90 H PHE 90 7.838 2.179 -0.779 678 HA PHE 90 HA PHE 90 9.171 2.672 1.729 679 HB2 PHE 90 HB2 PHE 90 7.239 2.013 3.182 680 HB3 PHE 90 HB3 PHE 90 6.970 3.541 2.358 681 HD1 PHE 90 HD2 PHE 90 6.001 -0.058 2.421 682 HD2 PHE 90 HD1 PHE 90 5.120 3.820 0.826 683 HE1 PHE 90 HE2 PHE 90 3.841 -0.882 1.579 684 HE2 PHE 90 HE1 PHE 90 2.965 2.982 -0.005 685 HZ PHE 90 HZ PHE 90 2.324 0.633 0.365 686 H ASP 91 H ASP 91 9.003 0.612 3.146 687 HA ASP 91 HA ASP 91 8.964 -1.839 1.479 688 HB2 ASP 91 HB2 ASP 91 10.591 -1.301 3.996 689 HB3 ASP 91 HB3 ASP 91 10.589 -2.807 3.084 690 H ASP 92 H ASP 92 7.739 -3.508 2.154 691 HA ASP 92 HA ASP 92 6.608 -3.638 4.861 692 HB2 ASP 92 HB2 ASP 92 4.354 -4.132 3.945 693 HB3 ASP 92 HB3 ASP 92 4.897 -2.524 3.484 694 H GLY 93 H GLY 93 4.941 -5.991 4.135 695 HA2 GLY 93 HA2 GLY 93 5.576 -8.260 3.250 696 HA3 GLY 93 HA3 GLY 93 7.140 -8.001 4.011 697 H PHE 94 H PHE 94 4.935 -6.584 6.004 698 HA PHE 94 HA PHE 94 3.558 -7.064 7.750 699 HB2 PHE 94 HB2 PHE 94 3.757 -9.998 6.930 700 HB3 PHE 94 HB3 PHE 94 2.721 -9.391 8.217 701 HD1 PHE 94 HD2 PHE 94 0.905 -7.669 7.594 702 HD2 PHE 94 HD1 PHE 94 2.964 -10.046 4.690 703 HE1 PHE 94 HE2 PHE 94 -0.902 -7.264 5.979 704 HE2 PHE 94 HE1 PHE 94 1.150 -9.633 3.074 705 HZ PHE 94 HZ PHE 94 -0.783 -8.245 3.718 706 H ALA 95 H ALA 95 3.658 -7.994 9.999 707 HA ALA 95 HA ALA 95 6.490 -8.416 10.800 708 HB1 ALA 95 HB1 ALA 95 6.199 -6.841 12.642 709 HB2 ALA 95 HB2 ALA 95 4.531 -6.530 12.152 710 HB3 ALA 95 HB3 ALA 95 5.865 -6.050 11.100 711 H ASP 96 H ASP 96 6.841 -9.986 12.167 712 HA ASP 96 HA ASP 96 5.196 -11.684 13.575 713 HB2 ASP 96 HB2 ASP 96 7.483 -12.243 13.454 714 HB3 ASP 96 HB3 ASP 96 8.014 -10.637 13.916 715 H GLU 97 H GLU 97 4.808 -11.795 15.977 716 HA GLU 97 HA GLU 97 3.127 -9.862 16.961 717 HB2 GLU 97 HB2 GLU 97 3.263 -11.045 19.128 718 HB3 GLU 97 HB3 GLU 97 3.203 -12.178 17.782 719 HG2 GLU 97 HG2 GLU 97 5.643 -12.519 17.954 720 HG3 GLU 97 HG3 GLU 97 5.715 -11.374 19.284 721 H HIS 98 H HIS 98 6.634 -9.813 17.276 722 HA HIS 98 HA HIS 98 6.604 -7.763 19.387 723 HB2 HIS 98 HB2 HIS 98 9.010 -9.080 18.047 724 HB3 HIS 98 HB3 HIS 98 9.039 -8.087 19.503 725 HD1 HIS 98 HD1 HIS 98 7.599 -9.186 21.580 726 HD2 HIS 98 HD2 HIS 98 8.788 -11.765 18.551 727 HE1 HIS 98 HE1 HIS 98 7.400 -11.493 22.548 728 HE2 HIS 98 HE2 HIS 98 8.317 -13.016 20.770 729 H GLY 99 H GLY 99 6.759 -7.869 15.963 730 HA2 GLY 99 HA2 GLY 99 6.599 -5.847 14.670 731 HA3 GLY 99 HA3 GLY 99 7.663 -5.045 15.811 732 H ALA 100 H ALA 100 8.680 -8.191 14.993 733 HA ALA 100 HA ALA 100 10.921 -7.230 13.387 734 HB1 ALA 100 HB1 ALA 100 11.315 -8.935 15.124 735 HB2 ALA 100 HB2 ALA 100 11.720 -9.568 13.529 736 HB3 ALA 100 HB3 ALA 100 10.208 -10.046 14.311 737 HA PRO 101 HA PRO 101 8.885 -8.015 9.367 738 HB2 PRO 101 HB2 PRO 101 11.685 -8.753 8.485 739 HB3 PRO 101 HB3 PRO 101 10.525 -7.641 7.740 740 HG2 PRO 101 HG2 PRO 101 12.585 -6.669 9.114 741 HG3 PRO 101 HG3 PRO 101 10.979 -5.924 9.276 742 HD2 PRO 101 HD2 PRO 101 12.391 -7.811 11.169 743 HD3 PRO 101 HD3 PRO 101 11.433 -6.355 11.533 744 H VAL 102 H VAL 102 7.745 -9.855 8.942 745 HA VAL 102 HA VAL 102 8.414 -12.457 9.811 746 HB VAL 102 HB VAL 102 6.448 -11.623 7.616 747 HG11 VAL 102 HG11 VAL 102 5.363 -13.841 7.956 748 HG12 VAL 102 HG12 VAL 102 6.662 -14.307 9.059 749 HG13 VAL 102 HG13 VAL 102 7.013 -14.012 7.354 750 HG21 VAL 102 HG21 VAL 102 4.711 -11.875 9.361 751 HG22 VAL 102 HG22 VAL 102 5.904 -10.658 9.813 752 HG23 VAL 102 HG23 VAL 102 5.959 -12.258 10.553 753 H ASP 103 H ASP 103 10.160 -13.504 9.137 754 HA ASP 103 HA ASP 103 11.631 -12.928 6.782 755 HB2 ASP 103 HB2 ASP 103 12.574 -13.739 8.991 756 HB3 ASP 103 HB3 ASP 103 11.905 -15.327 8.649 757 H GLU 104 H GLU 104 9.279 -15.381 7.626 758 HA GLU 104 HA GLU 104 9.466 -17.161 5.474 759 HB2 GLU 104 HB2 GLU 104 8.110 -17.510 7.551 760 HB3 GLU 104 HB3 GLU 104 6.964 -16.293 6.995 761 HG2 GLU 104 HG2 GLU 104 6.480 -17.717 5.011 762 HG3 GLU 104 HG3 GLU 104 7.557 -18.948 5.662 763 H LEU 105 H LEU 105 7.609 -14.137 5.799 764 HA LEU 105 HA LEU 105 6.639 -14.214 3.032 765 HB2 LEU 105 HB2 LEU 105 6.170 -12.229 5.288 766 HB3 LEU 105 HB3 LEU 105 5.438 -12.100 3.693 767 HG LEU 105 HG LEU 105 4.960 -14.370 5.672 768 HD11 LEU 105 HD11 LEU 105 2.701 -13.460 5.925 769 HD12 LEU 105 HD12 LEU 105 3.107 -12.105 4.867 770 HD13 LEU 105 HD13 LEU 105 3.918 -12.285 6.426 771 HD21 LEU 105 HD21 LEU 105 4.809 -15.154 3.357 772 HD22 LEU 105 HD22 LEU 105 3.677 -13.855 2.968 773 HD23 LEU 105 HD23 LEU 105 3.213 -15.125 4.107 774 H GLY 106 H GLY 106 9.371 -13.033 4.670 775 HA2 GLY 106 HA2 GLY 106 11.236 -11.936 3.920 776 HA3 GLY 106 HA3 GLY 106 10.536 -11.931 2.313 777 H VAL 107 H VAL 107 11.718 -9.809 2.342 778 HA VAL 107 HA VAL 107 9.951 -7.601 3.266 779 HB VAL 107 HB VAL 107 12.962 -7.561 2.722 780 HG11 VAL 107 HG11 VAL 107 12.917 -5.155 3.384 781 HG12 VAL 107 HG12 VAL 107 11.155 -5.210 3.448 782 HG13 VAL 107 HG13 VAL 107 11.988 -5.442 1.910 783 HG21 VAL 107 HG21 VAL 107 13.160 -6.956 5.125 784 HG22 VAL 107 HG22 VAL 107 12.370 -8.522 4.918 785 HG23 VAL 107 HG23 VAL 107 11.405 -7.092 5.300 786 H THR 108 H THR 108 9.049 -6.352 1.720 787 HA THR 108 HA THR 108 10.020 -6.459 -1.082 788 HB THR 108 HB THR 108 8.030 -7.855 -1.021 789 HG1 THR 108 HG1 THR 108 6.668 -6.495 -2.451 790 HG21 THR 108 HG21 THR 108 6.532 -5.480 0.155 791 HG22 THR 108 HG22 THR 108 6.926 -6.975 1.009 792 HG23 THR 108 HG23 THR 108 5.813 -7.011 -0.359 793 H HIS 109 H HIS 109 9.407 -4.574 -2.366 794 HA HIS 109 HA HIS 109 9.315 -2.098 -0.718 795 HB2 HIS 109 HB2 HIS 109 11.537 -2.678 -1.780 796 HB3 HIS 109 HB3 HIS 109 10.782 -2.525 -3.358 797 HD1 HIS 109 HD1 HIS 109 12.464 -0.597 -0.761 798 HD2 HIS 109 HD2 HIS 109 9.908 0.240 -3.916 799 HE1 HIS 109 HE1 HIS 109 12.777 1.836 -1.252 800 HE2 HIS 109 HE2 HIS 109 11.392 2.252 -3.296 801 H ALA 110 H ALA 110 7.238 -1.357 -0.954 802 HA ALA 110 HA ALA 110 5.857 -1.536 -3.556 803 HB1 ALA 110 HB1 ALA 110 4.769 -0.660 -0.866 804 HB2 ALA 110 HB2 ALA 110 4.641 -2.276 -1.554 805 HB3 ALA 110 HB3 ALA 110 3.829 -0.919 -2.338 806 H THR 111 H THR 111 5.429 0.178 -4.825 807 HA THR 111 HA THR 111 6.515 2.849 -4.106 808 HB THR 111 HB THR 111 6.373 1.504 -6.856 809 HG1 THR 111 HG1 THR 111 8.839 2.242 -5.800 810 HG21 THR 111 HG21 THR 111 7.717 3.433 -7.668 811 HG22 THR 111 HG22 THR 111 7.553 4.207 -6.093 812 HG23 THR 111 HG23 THR 111 6.126 3.941 -7.094 813 H VAL 112 H VAL 112 4.766 4.118 -3.648 814 HA VAL 112 HA VAL 112 2.259 3.903 -5.169 815 HB VAL 112 HB VAL 112 2.976 5.702 -2.813 816 HG11 VAL 112 HG11 VAL 112 1.172 6.695 -4.179 817 HG12 VAL 112 HG12 VAL 112 0.541 6.135 -2.630 818 HG13 VAL 112 HG13 VAL 112 0.257 5.185 -4.089 819 HG21 VAL 112 HG21 VAL 112 2.988 3.312 -2.191 820 HG22 VAL 112 HG22 VAL 112 1.360 3.125 -2.853 821 HG23 VAL 112 HG23 VAL 112 1.626 4.153 -1.443 822 H LYS 113 H LYS 113 1.819 5.216 -6.827 823 HA LYS 113 HA LYS 113 3.425 7.668 -7.291 824 HB2 LYS 113 HB2 LYS 113 2.796 5.331 -9.115 825 HB3 LYS 113 HB3 LYS 113 3.070 6.922 -9.811 826 HG2 LYS 113 HG2 LYS 113 5.313 6.997 -9.117 827 HG3 LYS 113 HG3 LYS 113 5.090 5.725 -7.918 828 HD2 LYS 113 HD2 LYS 113 6.379 5.163 -10.110 829 HD3 LYS 113 HD3 LYS 113 5.187 4.021 -9.504 830 HE2 LYS 113 HE2 LYS 113 5.069 4.335 -11.980 831 HE3 LYS 113 HE3 LYS 113 3.564 4.753 -11.167 832 HZ1 LYS 113 HZ1 LYS 113 4.101 7.070 -11.368 833 HZ2 LYS 113 HZ2 LYS 113 4.209 6.344 -12.889 834 HZ3 LYS 113 HZ3 LYS 113 5.617 6.716 -12.030 835 H LEU 114 H LEU 114 2.304 9.447 -7.770 836 HA LEU 114 HA LEU 114 -0.551 9.244 -8.527 837 HB2 LEU 114 HB2 LEU 114 0.800 11.393 -6.851 838 HB3 LEU 114 HB3 LEU 114 -0.851 11.484 -7.441 839 HG LEU 114 HG LEU 114 0.185 9.379 -5.492 840 HD11 LEU 114 HD11 LEU 114 0.075 11.582 -4.444 841 HD12 LEU 114 HD12 LEU 114 -1.185 10.529 -3.808 842 HD13 LEU 114 HD13 LEU 114 -1.594 11.784 -4.984 843 HD21 LEU 114 HD21 LEU 114 -2.639 9.899 -6.481 844 HD22 LEU 114 HD22 LEU 114 -2.174 8.733 -5.239 845 HD23 LEU 114 HD23 LEU 114 -1.626 8.513 -6.899 846 H GLU 115 H GLU 115 -0.825 9.781 -10.572 847 HA GLU 115 HA GLU 115 1.007 11.635 -11.947 848 HB2 GLU 115 HB2 GLU 115 -0.924 9.517 -12.964 849 HB3 GLU 115 HB3 GLU 115 -0.174 10.686 -14.035 850 HG2 GLU 115 HG2 GLU 115 1.005 8.563 -14.140 851 HG3 GLU 115 HG3 GLU 115 2.048 9.819 -13.482 852 HA PRO 116 HA PRO 116 -2.398 14.660 -11.586 853 HB2 PRO 116 HB2 PRO 116 -0.681 16.399 -13.282 854 HB3 PRO 116 HB3 PRO 116 -1.271 16.668 -11.640 855 HG2 PRO 116 HG2 PRO 116 1.332 16.116 -12.151 856 HG3 PRO 116 HG3 PRO 116 0.528 15.565 -10.666 857 HD2 PRO 116 HD2 PRO 116 1.155 14.006 -13.171 858 HD3 PRO 116 HD3 PRO 116 1.304 13.516 -11.469 859 H LEU 117 H LEU 117 -3.988 13.706 -12.876 860 HA LEU 117 HA LEU 117 -3.874 13.951 -15.808 861 HB2 LEU 117 HB2 LEU 117 -6.121 12.809 -14.105 862 HB3 LEU 117 HB3 LEU 117 -5.874 12.583 -15.831 863 HG LEU 117 HG LEU 117 -4.083 11.468 -13.625 864 HD11 LEU 117 HD11 LEU 117 -6.015 10.005 -15.441 865 HD12 LEU 117 HD12 LEU 117 -6.234 10.316 -13.714 866 HD13 LEU 117 HD13 LEU 117 -4.925 9.270 -14.259 867 HD21 LEU 117 HD21 LEU 117 -3.916 11.017 -16.617 868 HD22 LEU 117 HD22 LEU 117 -2.937 10.212 -15.385 869 HD23 LEU 117 HD23 LEU 117 -2.777 11.948 -15.636 870 H GLU 118 H GLU 118 -3.762 16.375 -14.750 871 HA GLU 118 HA GLU 118 -4.536 18.465 -14.785 872 HB2 GLU 118 HB2 GLU 118 -5.426 17.494 -17.055 873 HB3 GLU 118 HB3 GLU 118 -7.007 17.555 -16.301 874 HG2 GLU 118 HG2 GLU 118 -5.185 19.949 -16.645 875 HG3 GLU 118 HG3 GLU 118 -6.439 19.494 -17.792 876 H ASN 119 H ASN 119 -7.821 17.055 -14.697 877 HA ASN 119 HA ASN 119 -8.335 18.338 -12.085 878 HB2 ASN 119 HB2 ASN 119 -10.749 17.944 -12.643 879 HB3 ASN 119 HB3 ASN 119 -9.911 18.932 -13.832 880 HD21 ASN 119 HD21 ASN 119 -9.437 18.024 -15.880 881 HD22 ASN 119 HD22 ASN 119 -10.286 16.643 -16.472 882 H ARG 120 H ARG 120 -8.074 15.184 -13.575 883 HA ARG 120 HA ARG 120 -8.878 13.792 -11.077 884 HB2 ARG 120 HB2 ARG 120 -8.541 12.861 -13.953 885 HB3 ARG 120 HB3 ARG 120 -8.651 11.706 -12.630 886 HG2 ARG 120 HG2 ARG 120 -10.891 12.267 -12.150 887 HG3 ARG 120 HG3 ARG 120 -10.787 13.808 -13.001 888 HD2 ARG 120 HD2 ARG 120 -12.156 12.212 -14.248 889 HD3 ARG 120 HD3 ARG 120 -10.709 12.644 -15.154 890 HE ARG 120 HE ARG 120 -9.887 10.361 -14.081 891 HH11 ARG 120 HH11 ARG 120 -12.992 11.062 -15.465 892 HH12 ARG 120 HH12 ARG 120 -13.176 9.470 -16.106 893 HH21 ARG 120 HH21 ARG 120 -10.160 8.336 -14.943 894 HH22 ARG 120 HH22 ARG 120 -11.604 7.947 -15.800 895 H THR 121 H THR 121 -7.457 11.648 -10.806 896 HA THR 121 HA THR 121 -4.586 12.092 -11.313 897 HB THR 121 HB THR 121 -5.714 11.723 -8.486 898 HG1 THR 121 HG1 THR 121 -5.839 13.876 -9.264 899 HG21 THR 121 HG21 THR 121 -3.579 10.500 -8.708 900 HG22 THR 121 HG22 THR 121 -3.363 11.941 -7.711 901 HG23 THR 121 HG23 THR 121 -2.810 11.937 -9.391 902 H ARG 122 H ARG 122 -3.380 10.221 -11.343 903 HA ARG 122 HA ARG 122 -4.769 7.609 -11.291 904 HB2 ARG 122 HB2 ARG 122 -3.556 8.265 -13.388 905 HB3 ARG 122 HB3 ARG 122 -2.076 8.448 -12.465 906 HG2 ARG 122 HG2 ARG 122 -1.692 6.344 -13.293 907 HG3 ARG 122 HG3 ARG 122 -2.557 5.891 -11.826 908 HD2 ARG 122 HD2 ARG 122 -3.539 4.605 -13.557 909 HD3 ARG 122 HD3 ARG 122 -4.693 5.908 -13.257 910 HE ARG 122 HE ARG 122 -2.804 6.544 -15.320 911 HH11 ARG 122 HH11 ARG 122 -5.803 4.923 -14.763 912 HH12 ARG 122 HH12 ARG 122 -6.291 5.048 -16.411 913 HH21 ARG 122 HH21 ARG 122 -3.412 6.635 -17.411 914 HH22 ARG 122 HH22 ARG 122 -4.933 5.984 -17.908 915 H MET 123 H MET 123 -4.296 6.225 -9.558 916 HA MET 123 HA MET 123 -1.737 6.631 -8.106 917 HB2 MET 123 HB2 MET 123 -3.873 6.884 -6.740 918 HB3 MET 123 HB3 MET 123 -4.162 5.168 -6.992 919 HG2 MET 123 HG2 MET 123 -1.841 4.772 -5.965 920 HG3 MET 123 HG3 MET 123 -1.877 6.469 -5.494 921 HE1 MET 123 HE1 MET 123 -4.785 3.766 -5.579 922 HE2 MET 123 HE2 MET 123 -4.660 3.172 -3.923 923 HE3 MET 123 HE3 MET 123 -3.323 2.936 -5.044 924 H THR 124 H THR 124 -0.250 5.208 -8.743 925 HA THR 124 HA THR 124 -1.019 2.409 -9.379 926 HB THR 124 HB THR 124 1.417 3.907 -10.465 927 HG1 THR 124 HG1 THR 124 -0.359 4.867 -11.399 928 HG21 THR 124 HG21 THR 124 1.547 2.048 -12.086 929 HG22 THR 124 HG22 THR 124 0.133 1.285 -11.356 930 HG23 THR 124 HG23 THR 124 1.635 1.420 -10.438 931 H ILE 125 H ILE 125 -0.411 1.062 -7.728 932 HA ILE 125 HA ILE 125 2.015 1.686 -6.130 933 HB ILE 125 HB ILE 125 -0.175 -0.298 -5.373 934 HG12 ILE 125 HG12 ILE 125 0.112 2.599 -4.426 935 HG13 ILE 125 HG13 ILE 125 -1.135 2.013 -5.524 936 HG21 ILE 125 HG21 ILE 125 2.009 -0.691 -4.278 937 HG22 ILE 125 HG22 ILE 125 0.822 -0.133 -3.101 938 HG23 ILE 125 HG23 ILE 125 2.046 0.982 -3.710 939 HD11 ILE 125 HD11 ILE 125 -2.010 2.283 -3.286 940 HD12 ILE 125 HD12 ILE 125 -0.778 1.202 -2.637 941 HD13 ILE 125 HD13 ILE 125 -2.016 0.576 -3.731 942 H ILE 126 H ILE 126 3.810 0.521 -6.644 943 HA ILE 126 HA ILE 126 3.536 -2.128 -7.949 944 HB ILE 126 HB ILE 126 5.921 -0.224 -8.219 945 HG12 ILE 126 HG12 ILE 126 4.982 -0.057 -10.705 946 HG13 ILE 126 HG13 ILE 126 3.443 -0.468 -9.961 947 HG21 ILE 126 HG21 ILE 126 6.590 -1.704 -10.077 948 HG22 ILE 126 HG22 ILE 126 5.211 -2.753 -9.744 949 HG23 ILE 126 HG23 ILE 126 6.496 -2.573 -8.545 950 HD11 ILE 126 HD11 ILE 126 3.596 1.518 -8.554 951 HD12 ILE 126 HD12 ILE 126 3.704 1.921 -10.268 952 HD13 ILE 126 HD13 ILE 126 5.160 1.914 -9.274 953 H SER 127 H SER 127 4.171 -3.793 -6.656 954 HA SER 127 HA SER 127 5.955 -3.286 -4.342 955 HB2 SER 127 HB2 SER 127 3.671 -4.131 -3.813 956 HB3 SER 127 HB3 SER 127 3.967 -5.569 -4.791 957 HG SER 127 HG SER 127 4.708 -5.024 -2.233 958 H THR 128 H THR 128 8.016 -3.758 -4.899 959 HA THR 128 HA THR 128 8.652 -5.964 -6.730 960 HB THR 128 HB THR 128 10.997 -4.998 -6.686 961 HG1 THR 128 HG1 THR 128 10.871 -3.858 -4.706 962 HG21 THR 128 HG21 THR 128 10.480 -3.052 -8.111 963 HG22 THR 128 HG22 THR 128 8.804 -3.078 -7.560 964 HG23 THR 128 HG23 THR 128 9.438 -4.420 -8.517 965 H PHE 129 H PHE 129 8.819 -7.824 -5.760 966 HA PHE 129 HA PHE 129 9.588 -8.239 -3.013 967 HB2 PHE 129 HB2 PHE 129 9.000 -10.314 -5.171 968 HB3 PHE 129 HB3 PHE 129 8.930 -10.547 -3.426 969 HD1 PHE 129 HD1 PHE 129 7.095 -9.371 -2.098 970 HD2 PHE 129 HD2 PHE 129 7.091 -9.452 -6.370 971 HE1 PHE 129 HE1 PHE 129 4.717 -8.746 -2.119 972 HE2 PHE 129 HE2 PHE 129 4.716 -8.838 -6.379 973 HZ PHE 129 HZ PHE 129 3.525 -8.475 -4.256 974 H GLU 130 H GLU 130 11.369 -9.590 -2.308 975 HA GLU 130 HA GLU 130 13.810 -9.208 -3.801 976 HB2 GLU 130 HB2 GLU 130 14.928 -10.263 -1.856 977 HB3 GLU 130 HB3 GLU 130 13.826 -8.984 -1.365 978 HG2 GLU 130 HG2 GLU 130 12.151 -10.651 -0.689 979 HG3 GLU 130 HG3 GLU 130 13.212 -11.955 -1.218 980 H SER 131 H SER 131 11.617 -11.947 -3.282 981 HA SER 131 HA SER 131 13.387 -13.723 -4.870 982 HB2 SER 131 HB2 SER 131 11.982 -14.522 -2.282 983 HB3 SER 131 HB3 SER 131 12.885 -15.619 -3.332 984 HG SER 131 HG SER 131 13.914 -14.471 -1.372 985 H GLU 132 H GLU 132 12.396 -15.418 -5.967 986 HA GLU 132 HA GLU 132 9.865 -14.967 -7.140 987 HB2 GLU 132 HB2 GLU 132 11.739 -16.141 -8.267 988 HB3 GLU 132 HB3 GLU 132 11.593 -17.475 -7.126 989 HG2 GLU 132 HG2 GLU 132 9.284 -17.908 -8.016 990 HG3 GLU 132 HG3 GLU 132 9.560 -16.648 -9.223 991 H GLU 133 H GLU 133 10.893 -17.624 -4.932 992 HA GLU 133 HA GLU 133 8.406 -18.795 -4.451 993 HB2 GLU 133 HB2 GLU 133 9.423 -19.700 -2.347 994 HB3 GLU 133 HB3 GLU 133 10.442 -19.907 -3.765 995 HG2 GLU 133 HG2 GLU 133 11.883 -18.072 -3.079 996 HG3 GLU 133 HG3 GLU 133 10.805 -17.675 -1.741 997 H GLN 134 H GLN 134 9.864 -15.960 -2.855 998 HA GLN 134 HA GLN 134 7.954 -15.529 -0.816 999 HB2 GLN 134 HB2 GLN 134 10.073 -14.318 -0.795 1000 HB3 GLN 134 HB3 GLN 134 9.710 -13.564 -2.343 1001 HG2 GLN 134 HG2 GLN 134 7.671 -12.495 -1.117 1002 HG3 GLN 134 HG3 GLN 134 8.493 -12.976 0.365 1003 HE21 GLN 134 HE21 GLN 134 8.680 -10.742 0.928 1004 HE22 GLN 134 HE22 GLN 134 9.845 -9.729 0.168 1005 H MET 135 H MET 135 8.146 -14.235 -4.143 1006 HA MET 135 HA MET 135 5.889 -12.519 -3.918 1007 HB2 MET 135 HB2 MET 135 6.396 -11.840 -6.068 1008 HB3 MET 135 HB3 MET 135 7.937 -12.505 -5.583 1009 HG2 MET 135 HG2 MET 135 7.707 -13.308 -7.747 1010 HG3 MET 135 HG3 MET 135 7.089 -14.668 -6.807 1011 HE1 MET 135 HE1 MET 135 4.419 -11.585 -8.979 1012 HE2 MET 135 HE2 MET 135 6.169 -11.454 -8.818 1013 HE3 MET 135 HE3 MET 135 5.133 -11.239 -7.406 1014 H GLN 136 H GLN 136 6.241 -15.850 -4.964 1015 HA GLN 136 HA GLN 136 3.571 -16.344 -5.843 1016 HB2 GLN 136 HB2 GLN 136 5.676 -18.210 -4.665 1017 HB3 GLN 136 HB3 GLN 136 4.172 -18.761 -5.401 1018 HG2 GLN 136 HG2 GLN 136 6.367 -17.227 -6.838 1019 HG3 GLN 136 HG3 GLN 136 6.128 -18.971 -6.909 1020 HE21 GLN 136 HE21 GLN 136 4.876 -15.870 -7.914 1021 HE22 GLN 136 HE22 GLN 136 3.799 -16.477 -9.118 1022 H LYS 137 H LYS 137 5.219 -16.762 -2.709 1023 HA LYS 137 HA LYS 137 3.084 -17.813 -1.193 1024 HB2 LYS 137 HB2 LYS 137 5.417 -17.975 -0.467 1025 HB3 LYS 137 HB3 LYS 137 5.536 -16.229 -0.329 1026 HG2 LYS 137 HG2 LYS 137 5.364 -17.281 1.868 1027 HG3 LYS 137 HG3 LYS 137 3.974 -16.238 1.555 1028 HD2 LYS 137 HD2 LYS 137 2.625 -18.257 0.968 1029 HD3 LYS 137 HD3 LYS 137 4.017 -19.281 1.344 1030 HE2 LYS 137 HE2 LYS 137 3.963 -18.483 3.686 1031 HE3 LYS 137 HE3 LYS 137 2.583 -17.449 3.305 1032 HZ1 LYS 137 HZ1 LYS 137 1.300 -19.416 2.782 1033 HZ2 LYS 137 HZ2 LYS 137 1.908 -19.501 4.355 1034 HZ3 LYS 137 HZ3 LYS 137 2.625 -20.408 3.123 1035 H MET 138 H MET 138 3.976 -14.466 -1.903 1036 HA MET 138 HA MET 138 2.227 -13.104 -0.147 1037 HB2 MET 138 HB2 MET 138 3.279 -12.306 -2.890 1038 HB3 MET 138 HB3 MET 138 2.451 -11.209 -1.797 1039 HG2 MET 138 HG2 MET 138 4.887 -12.595 -0.746 1040 HG3 MET 138 HG3 MET 138 5.116 -11.337 -1.951 1041 HE1 MET 138 HE1 MET 138 3.549 -10.645 2.349 1042 HE2 MET 138 HE2 MET 138 4.364 -12.109 1.798 1043 HE3 MET 138 HE3 MET 138 2.715 -11.766 1.271 1044 H ALA 139 H ALA 139 1.764 -14.184 -3.526 1045 HA ALA 139 HA ALA 139 -0.957 -13.405 -3.809 1046 HB1 ALA 139 HB1 ALA 139 0.564 -15.592 -5.263 1047 HB2 ALA 139 HB2 ALA 139 0.502 -13.890 -5.725 1048 HB3 ALA 139 HB3 ALA 139 -0.963 -14.870 -5.784 1049 H GLU 140 H GLU 140 0.542 -16.368 -2.545 1050 HA GLU 140 HA GLU 140 -1.804 -17.923 -2.164 1051 HB2 GLU 140 HB2 GLU 140 0.839 -17.970 -0.650 1052 HB3 GLU 140 HB3 GLU 140 -0.412 -19.199 -0.496 1053 HG2 GLU 140 HG2 GLU 140 1.036 -18.550 -3.085 1054 HG3 GLU 140 HG3 GLU 140 1.522 -19.830 -1.975 1055 H MET 141 H MET 141 -0.300 -15.402 -0.186 1056 HA MET 141 HA MET 141 -2.035 -15.686 2.106 1057 HB2 MET 141 HB2 MET 141 -0.210 -13.416 1.199 1058 HB3 MET 141 HB3 MET 141 -1.088 -13.402 2.725 1059 HG2 MET 141 HG2 MET 141 0.989 -15.459 1.933 1060 HG3 MET 141 HG3 MET 141 1.264 -14.081 3.000 1061 HE1 MET 141 HE1 MET 141 0.253 -13.863 5.456 1062 HE2 MET 141 HE2 MET 141 -0.924 -14.994 6.123 1063 HE3 MET 141 HE3 MET 141 -1.371 -13.953 4.771 1064 H GLY 142 H GLY 142 -2.618 -14.491 -1.017 1065 HA2 GLY 142 HA2 GLY 142 -4.390 -13.343 -1.950 1066 HA3 GLY 142 HA3 GLY 142 -5.147 -13.294 -0.365 1067 H MET 143 H MET 143 -1.917 -12.066 -0.949 1068 HA MET 143 HA MET 143 -2.250 -9.514 0.159 1069 HB2 MET 143 HB2 MET 143 -0.068 -10.708 -0.225 1070 HB3 MET 143 HB3 MET 143 -0.211 -10.377 -1.944 1071 HG2 MET 143 HG2 MET 143 1.358 -8.845 -0.921 1072 HG3 MET 143 HG3 MET 143 -0.066 -7.947 -1.457 1073 HE1 MET 143 HE1 MET 143 2.294 -7.156 0.815 1074 HE2 MET 143 HE2 MET 143 1.285 -6.253 1.944 1075 HE3 MET 143 HE3 MET 143 1.107 -5.997 0.209 1076 H GLU 144 H GLU 144 -2.641 -10.627 -3.147 1077 HA GLU 144 HA GLU 144 -2.806 -8.221 -4.558 1078 HB2 GLU 144 HB2 GLU 144 -4.232 -10.848 -5.159 1079 HB3 GLU 144 HB3 GLU 144 -3.982 -9.534 -6.307 1080 HG2 GLU 144 HG2 GLU 144 -1.517 -9.854 -6.083 1081 HG3 GLU 144 HG3 GLU 144 -1.816 -11.228 -5.018 1082 H GLU 145 H GLU 145 -5.477 -10.173 -3.207 1083 HA GLU 145 HA GLU 145 -7.529 -8.280 -3.900 1084 HB2 GLU 145 HB2 GLU 145 -7.895 -10.739 -3.808 1085 HB3 GLU 145 HB3 GLU 145 -7.671 -10.709 -2.061 1086 HG2 GLU 145 HG2 GLU 145 -9.679 -9.318 -1.810 1087 HG3 GLU 145 HG3 GLU 145 -9.869 -9.241 -3.561 1088 H GLY 146 H GLY 146 -5.656 -9.002 -0.985 1089 HA2 GLY 146 HA2 GLY 146 -7.095 -7.611 0.986 1090 HA3 GLY 146 HA3 GLY 146 -5.369 -7.925 1.018 1091 H MET 147 H MET 147 -4.437 -6.453 -1.120 1092 HA MET 147 HA MET 147 -4.604 -3.699 -0.344 1093 HB2 MET 147 HB2 MET 147 -3.480 -4.992 -2.859 1094 HB3 MET 147 HB3 MET 147 -3.340 -3.275 -2.503 1095 HG2 MET 147 HG2 MET 147 -2.046 -3.807 -0.479 1096 HG3 MET 147 HG3 MET 147 -2.185 -5.516 -0.863 1097 HE1 MET 147 HE1 MET 147 -0.692 -2.061 -2.026 1098 HE2 MET 147 HE2 MET 147 -1.622 -2.555 -3.443 1099 HE3 MET 147 HE3 MET 147 0.142 -2.522 -3.510 1100 H ARG 148 H ARG 148 -6.073 -5.609 -2.973 1101 HA ARG 148 HA ARG 148 -6.923 -3.523 -4.641 1102 HB2 ARG 148 HB2 ARG 148 -6.774 -5.897 -5.296 1103 HB3 ARG 148 HB3 ARG 148 -8.148 -6.280 -4.263 1104 HG2 ARG 148 HG2 ARG 148 -9.617 -4.903 -5.696 1105 HG3 ARG 148 HG3 ARG 148 -8.234 -4.487 -6.718 1106 HD2 ARG 148 HD2 ARG 148 -7.925 -6.885 -7.253 1107 HD3 ARG 148 HD3 ARG 148 -9.325 -7.282 -6.252 1108 HE ARG 148 HE ARG 148 -10.396 -5.579 -8.024 1109 HH11 ARG 148 HH11 ARG 148 -8.289 -8.271 -8.555 1110 HH12 ARG 148 HH12 ARG 148 -9.050 -8.713 -10.042 1111 HH21 ARG 148 HH21 ARG 148 -11.353 -6.159 -9.929 1112 HH22 ARG 148 HH22 ARG 148 -10.765 -7.523 -10.814 1113 H GLU 149 H GLU 149 -8.829 -5.260 -2.118 1114 HA GLU 149 HA GLU 149 -11.259 -3.817 -2.435 1115 HB2 GLU 149 HB2 GLU 149 -10.201 -5.313 -0.004 1116 HB3 GLU 149 HB3 GLU 149 -11.862 -4.747 -0.189 1117 HG2 GLU 149 HG2 GLU 149 -12.076 -6.204 -2.209 1118 HG3 GLU 149 HG3 GLU 149 -10.458 -6.835 -1.883 1119 H ALA 150 H ALA 150 -8.446 -3.250 -0.356 1120 HA ALA 150 HA ALA 150 -9.371 -1.027 1.125 1121 HB1 ALA 150 HB1 ALA 150 -7.318 -2.287 1.676 1122 HB2 ALA 150 HB2 ALA 150 -6.978 -0.562 1.520 1123 HB3 ALA 150 HB3 ALA 150 -6.538 -1.674 0.215 1124 H ILE 151 H ILE 151 -7.774 -1.239 -2.030 1125 HA ILE 151 HA ILE 151 -7.595 1.593 -2.528 1126 HB ILE 151 HB ILE 151 -7.137 -0.830 -4.330 1127 HG12 ILE 151 HG12 ILE 151 -5.035 0.936 -2.980 1128 HG13 ILE 151 HG13 ILE 151 -5.649 -0.535 -2.242 1129 HG21 ILE 151 HG21 ILE 151 -7.580 1.121 -5.737 1130 HG22 ILE 151 HG22 ILE 151 -5.871 0.693 -5.828 1131 HG23 ILE 151 HG23 ILE 151 -6.385 2.069 -4.849 1132 HD11 ILE 151 HD11 ILE 151 -3.529 -0.966 -3.269 1133 HD12 ILE 151 HD12 ILE 151 -4.094 -0.333 -4.817 1134 HD13 ILE 151 HD13 ILE 151 -4.782 -1.826 -4.166 1135 H GLU 152 H GLU 152 -9.957 -0.900 -3.204 1136 HA GLU 152 HA GLU 152 -11.689 0.592 -4.947 1137 HB2 GLU 152 HB2 GLU 152 -12.183 -1.776 -3.090 1138 HB3 GLU 152 HB3 GLU 152 -13.439 -1.101 -4.123 1139 HG2 GLU 152 HG2 GLU 152 -10.825 -2.182 -5.220 1140 HG3 GLU 152 HG3 GLU 152 -12.249 -3.191 -4.965 1141 H GLN 153 H GLN 153 -11.080 0.584 -1.528 1142 HA GLN 153 HA GLN 153 -13.613 1.859 -0.805 1143 HB2 GLN 153 HB2 GLN 153 -12.520 -0.019 0.517 1144 HB3 GLN 153 HB3 GLN 153 -11.273 1.121 1.005 1145 HG2 GLN 153 HG2 GLN 153 -12.872 2.446 2.240 1146 HG3 GLN 153 HG3 GLN 153 -14.228 1.536 1.576 1147 HE21 GLN 153 HE21 GLN 153 -11.607 1.478 3.869 1148 HE22 GLN 153 HE22 GLN 153 -12.115 0.075 4.728 1149 H ILE 154 H ILE 154 -10.566 2.924 -1.871 1150 HA ILE 154 HA ILE 154 -10.126 5.266 -0.338 1151 HB ILE 154 HB ILE 154 -9.320 4.593 -3.190 1152 HG12 ILE 154 HG12 ILE 154 -7.733 4.651 -0.587 1153 HG13 ILE 154 HG13 ILE 154 -8.305 3.197 -1.401 1154 HG21 ILE 154 HG21 ILE 154 -9.390 7.042 -3.043 1155 HG22 ILE 154 HG22 ILE 154 -7.715 6.500 -3.087 1156 HG23 ILE 154 HG23 ILE 154 -8.436 7.010 -1.559 1157 HD11 ILE 154 HD11 ILE 154 -5.952 3.545 -1.792 1158 HD12 ILE 154 HD12 ILE 154 -6.257 5.150 -2.450 1159 HD13 ILE 154 HD13 ILE 154 -6.839 3.719 -3.306 1160 H ASP 155 H ASP 155 -11.857 4.894 -3.478 1161 HA ASP 155 HA ASP 155 -12.696 7.606 -3.671 1162 HB2 ASP 155 HB2 ASP 155 -14.455 6.655 -5.306 1163 HB3 ASP 155 HB3 ASP 155 -12.763 6.420 -5.716 1164 H ALA 156 H ALA 156 -14.105 4.811 -2.031 1165 HA ALA 156 HA ALA 156 -16.512 6.032 -1.094 1166 HB1 ALA 156 HB1 ALA 156 -14.841 3.859 0.236 1167 HB2 ALA 156 HB2 ALA 156 -16.102 3.600 -0.972 1168 HB3 ALA 156 HB3 ALA 156 -16.523 4.258 0.608 1169 H VAL 157 H VAL 157 -13.180 6.280 0.035 1170 HA VAL 157 HA VAL 157 -13.759 7.680 2.507 1171 HB VAL 157 HB VAL 157 -11.158 7.412 0.919 1172 HG11 VAL 157 HG11 VAL 157 -9.967 8.226 2.953 1173 HG12 VAL 157 HG12 VAL 157 -11.519 8.602 3.703 1174 HG13 VAL 157 HG13 VAL 157 -11.006 9.469 2.252 1175 HG21 VAL 157 HG21 VAL 157 -12.061 6.000 3.455 1176 HG22 VAL 157 HG22 VAL 157 -10.491 5.809 2.671 1177 HG23 VAL 157 HG23 VAL 157 -11.956 5.282 1.846 1178 H LEU 158 H LEU 158 -12.783 8.640 -0.796 1179 HA LEU 158 HA LEU 158 -12.382 11.422 -0.189 1180 HB2 LEU 158 HB2 LEU 158 -12.728 10.113 -2.922 1181 HB3 LEU 158 HB3 LEU 158 -12.077 11.719 -2.616 1182 HG LEU 158 HG LEU 158 -10.777 9.052 -1.946 1183 HD11 LEU 158 HD11 LEU 158 -10.565 9.695 -4.285 1184 HD12 LEU 158 HD12 LEU 158 -9.006 9.761 -3.470 1185 HD13 LEU 158 HD13 LEU 158 -9.881 11.257 -3.820 1186 HD21 LEU 158 HD21 LEU 158 -9.767 11.815 -1.205 1187 HD22 LEU 158 HD22 LEU 158 -8.869 10.304 -1.027 1188 HD23 LEU 158 HD23 LEU 158 -10.340 10.568 -0.092 1189 H SER 159 H SER 159 -15.058 9.514 -1.412 1190 HA SER 159 HA SER 159 -16.760 11.868 -1.909 1191 HB2 SER 159 HB2 SER 159 -16.693 9.920 -3.533 1192 HB3 SER 159 HB3 SER 159 -17.423 8.912 -2.296 1193 HG SER 159 HG SER 159 -18.741 10.264 -4.001 1194 H GLU 160 H GLU 160 -16.905 8.786 -0.153 1195 HA GLU 160 HA GLU 160 -18.438 7.855 1.201 1196 HB2 GLU 160 HB2 GLU 160 -16.772 9.132 2.667 1197 HB3 GLU 160 HB3 GLU 160 -18.076 10.273 2.973 1198 HG2 GLU 160 HG2 GLU 160 -19.466 8.386 3.811 1199 HG3 GLU 160 HG3 GLU 160 -18.108 7.302 3.573 1200 HA PRO 161 HA PRO 161 -22.387 9.993 0.286 1201 HB2 PRO 161 HB2 PRO 161 -23.787 7.908 -0.656 1202 HB3 PRO 161 HB3 PRO 161 -22.462 8.600 -1.611 1203 HG2 PRO 161 HG2 PRO 161 -22.449 6.128 0.136 1204 HG3 PRO 161 HG3 PRO 161 -21.771 6.347 -1.491 1205 HD2 PRO 161 HD2 PRO 161 -20.289 6.527 0.865 1206 HD3 PRO 161 HD3 PRO 161 -19.816 7.277 -0.677 1207 H ALA 162 H ALA 162 -21.485 8.020 2.780 1208 HA ALA 162 HA ALA 162 -22.236 7.655 4.867 1209 HB1 ALA 162 HB1 ALA 162 -24.865 8.964 4.120 1210 HB2 ALA 162 HB2 ALA 162 -23.456 9.803 4.766 1211 HB3 ALA 162 HB3 ALA 162 -24.297 8.607 5.754 1212 H ASN 163 H ASN 163 -24.653 6.770 2.354 1213 HA ASN 163 HA ASN 163 -25.740 4.550 3.780 1214 HB2 ASN 163 HB2 ASN 163 -27.019 5.646 1.980 1215 HB3 ASN 163 HB3 ASN 163 -25.786 5.209 0.801 1216 HD21 ASN 163 HD21 ASN 163 -27.099 3.974 -0.505 1217 HD22 ASN 163 HD22 ASN 163 -27.833 2.495 -0.004 1218 H ALA 164 H ALA 164 -24.088 4.229 0.618 1219 HA ALA 164 HA ALA 164 -22.567 2.800 -0.249 1220 HB1 ALA 164 HB1 ALA 164 -20.472 2.537 0.994 1221 HB2 ALA 164 HB2 ALA 164 -21.278 3.028 2.486 1222 HB3 ALA 164 HB3 ALA 164 -21.093 4.183 1.166 1223 H LEU 165 H LEU 165 -24.901 1.464 1.196 1224 HA LEU 165 HA LEU 165 -24.000 -1.017 2.285 1225 HB2 LEU 165 HB2 LEU 165 -26.671 -0.207 1.096 1226 HB3 LEU 165 HB3 LEU 165 -26.384 -1.811 1.748 1227 HG LEU 165 HG LEU 165 -26.246 0.787 3.331 1228 HD11 LEU 165 HD11 LEU 165 -28.352 -1.404 3.367 1229 HD12 LEU 165 HD12 LEU 165 -28.546 0.228 2.721 1230 HD13 LEU 165 HD13 LEU 165 -28.292 -0.007 4.448 1231 HD21 LEU 165 HD21 LEU 165 -24.661 -0.854 4.229 1232 HD22 LEU 165 HD22 LEU 165 -25.928 -2.079 4.302 1233 HD23 LEU 165 HD23 LEU 165 -26.021 -0.646 5.330 1234 H GLU 166 H GLU 166 -22.429 -1.843 0.939 1235 HA GLU 166 HA GLU 166 -22.881 -2.422 -1.857 1236 HB2 GLU 166 HB2 GLU 166 -20.617 -1.842 -0.583 1237 HB3 GLU 166 HB3 GLU 166 -20.574 -3.562 -0.236 1238 HG2 GLU 166 HG2 GLU 166 -20.618 -2.304 -2.999 1239 HG3 GLU 166 HG3 GLU 166 -19.192 -2.947 -2.192 1240 H HIS 167 H HIS 167 -23.966 -4.164 -2.563 1241 HA HIS 167 HA HIS 167 -24.818 -6.290 -0.794 1242 HB2 HIS 167 HB2 HIS 167 -25.278 -5.949 -3.794 1243 HB3 HIS 167 HB3 HIS 167 -26.102 -7.109 -2.756 1244 HD1 HIS 167 HD1 HIS 167 -25.868 -3.400 -3.416 1245 HD2 HIS 167 HD2 HIS 167 -28.264 -6.090 -1.353 1246 HE1 HIS 167 HE1 HIS 167 -27.828 -2.067 -2.612 1247 HE2 HIS 167 HE2 HIS 167 -29.208 -3.683 -1.273 1248 H HIS 168 H HIS 168 -23.049 -7.380 -0.178 1249 HA HIS 168 HA HIS 168 -20.734 -8.123 -1.337 1250 HB2 HIS 168 HB2 HIS 168 -20.638 -9.978 0.322 1251 HB3 HIS 168 HB3 HIS 168 -21.245 -8.491 1.031 1252 HD1 HIS 168 HD1 HIS 168 -21.960 -12.004 0.909 1253 HD2 HIS 168 HD2 HIS 168 -24.276 -8.561 1.140 1254 HE1 HIS 168 HE1 HIS 168 -24.208 -12.758 1.726 1255 HE2 HIS 168 HE2 HIS 168 -25.633 -10.690 1.690 1256 H HIS 169 H HIS 169 -20.016 -9.402 -2.904 1257 HA HIS 169 HA HIS 169 -19.811 -10.882 -4.582 1258 HB2 HIS 169 HB2 HIS 169 -19.950 -12.559 -2.774 1259 HB3 HIS 169 HB3 HIS 169 -21.702 -12.580 -2.899 1260 HD1 HIS 169 HD1 HIS 169 -22.733 -13.859 -4.920 1261 HD2 HIS 169 HD2 HIS 169 -18.593 -14.137 -4.666 1262 HE1 HIS 169 HE1 HIS 169 -22.094 -15.754 -6.430 1263 HE2 HIS 169 HE2 HIS 169 -19.627 -16.048 -6.074 1264 H HIS 170 H HIS 170 -20.915 -9.243 -5.940 1265 HA HIS 170 HA HIS 170 -23.572 -9.847 -6.941 1266 HB2 HIS 170 HB2 HIS 170 -21.400 -7.906 -7.770 1267 HB3 HIS 170 HB3 HIS 170 -22.749 -8.217 -8.854 1268 HD1 HIS 170 HD1 HIS 170 -21.810 -6.237 -5.898 1269 HD2 HIS 170 HD2 HIS 170 -25.305 -7.437 -7.792 1270 HE1 HIS 170 HE1 HIS 170 -23.591 -4.698 -5.056 1271 HE2 HIS 170 HE2 HIS 170 -25.633 -5.305 -6.381 1272 H HIS 171 H HIS 171 -23.138 -12.129 -7.243 1273 HA HIS 171 HA HIS 171 -22.567 -14.047 -8.278 1274 HB2 HIS 171 HB2 HIS 171 -22.497 -12.285 -10.765 1275 HB3 HIS 171 HB3 HIS 171 -22.566 -14.046 -10.780 1276 HD1 HIS 171 HD1 HIS 171 -24.714 -11.186 -10.966 1277 HD2 HIS 171 HD2 HIS 171 -25.062 -14.985 -9.327 1278 HE1 HIS 171 HE1 HIS 171 -27.171 -11.544 -10.636 1279 HE2 HIS 171 HE2 HIS 171 -27.361 -13.906 -9.809 1280 H HIS 172 H HIS 172 -20.782 -14.880 -10.198 1281 HA HIS 172 HA HIS 172 -18.263 -13.507 -10.165 1282 HB2 HIS 172 HB2 HIS 172 -18.267 -14.457 -7.831 1283 HB3 HIS 172 HB3 HIS 172 -18.398 -16.076 -8.507 1284 HD1 HIS 172 HD1 HIS 172 -16.235 -17.226 -8.976 1285 HD2 HIS 172 HD2 HIS 172 -15.740 -13.128 -8.575 1286 HE1 HIS 172 HE1 HIS 172 -13.761 -16.850 -9.015 1287 HE2 HIS 172 HE2 HIS 172 -13.500 -14.355 -8.993 Start of MODEL 6 1 H1 THR 1 H1 THR 1 -11.392 0.345 -7.345 2 H2 THR 1 H2 THR 1 -12.181 1.728 -6.756 3 H3 THR 1 H3 THR 1 -10.497 1.696 -6.852 4 HA THR 1 HA THR 1 -12.299 1.474 -9.199 5 HB THR 1 HB THR 1 -10.695 3.942 -8.538 6 HG1 THR 1 HG1 THR 1 -12.809 4.756 -7.697 7 HG21 THR 1 HG21 THR 1 -12.369 5.076 -9.972 8 HG22 THR 1 HG22 THR 1 -13.258 3.560 -10.145 9 HG23 THR 1 HG23 THR 1 -11.641 3.716 -10.836 10 H VAL 2 H VAL 2 -10.367 -0.274 -8.896 11 HA VAL 2 HA VAL 2 -7.798 0.623 -9.918 12 HB VAL 2 HB VAL 2 -8.868 -2.075 -9.066 13 HG11 VAL 2 HG11 VAL 2 -6.028 -1.346 -9.894 14 HG12 VAL 2 HG12 VAL 2 -7.117 -2.437 -10.759 15 HG13 VAL 2 HG13 VAL 2 -6.507 -2.882 -9.164 16 HG21 VAL 2 HG21 VAL 2 -7.370 -1.808 -7.102 17 HG22 VAL 2 HG22 VAL 2 -8.595 -0.540 -7.187 18 HG23 VAL 2 HG23 VAL 2 -6.933 -0.193 -7.676 19 H VAL 3 H VAL 3 -7.933 1.154 -12.010 20 HA VAL 3 HA VAL 3 -9.654 -0.153 -13.913 21 HB VAL 3 HB VAL 3 -8.641 1.455 -15.569 22 HG11 VAL 3 HG11 VAL 3 -9.645 2.698 -12.969 23 HG12 VAL 3 HG12 VAL 3 -10.652 2.083 -14.284 24 HG13 VAL 3 HG13 VAL 3 -9.628 3.495 -14.547 25 HG21 VAL 3 HG21 VAL 3 -7.045 2.458 -13.167 26 HG22 VAL 3 HG22 VAL 3 -7.118 3.241 -14.750 27 HG23 VAL 3 HG23 VAL 3 -6.368 1.653 -14.588 28 H SER 4 H SER 4 -6.442 -0.818 -12.838 29 HA SER 4 HA SER 4 -6.352 -3.135 -14.581 30 HB2 SER 4 HB2 SER 4 -5.238 -1.523 -16.050 31 HB3 SER 4 HB3 SER 4 -4.153 -1.028 -14.752 32 HG SER 4 HG SER 4 -2.995 -2.473 -15.898 33 H VAL 5 H VAL 5 -5.471 -4.836 -13.489 34 HA VAL 5 HA VAL 5 -3.474 -4.356 -11.335 35 HB VAL 5 HB VAL 5 -5.292 -6.798 -11.693 36 HG11 VAL 5 HG11 VAL 5 -3.101 -7.482 -10.776 37 HG12 VAL 5 HG12 VAL 5 -4.343 -7.601 -9.529 38 HG13 VAL 5 HG13 VAL 5 -3.218 -6.243 -9.520 39 HG21 VAL 5 HG21 VAL 5 -5.328 -4.665 -9.534 40 HG22 VAL 5 HG22 VAL 5 -6.346 -6.108 -9.568 41 HG23 VAL 5 HG23 VAL 5 -6.528 -4.869 -10.813 42 H ASP 6 H ASP 6 -1.446 -4.966 -11.862 43 HA ASP 6 HA ASP 6 -1.004 -7.126 -13.851 44 HB2 ASP 6 HB2 ASP 6 -0.356 -4.653 -14.515 45 HB3 ASP 6 HB3 ASP 6 0.967 -4.853 -13.395 46 H LYS 7 H LYS 7 0.255 -8.773 -13.100 47 HA LYS 7 HA LYS 7 2.026 -8.322 -10.766 48 HB2 LYS 7 HB2 LYS 7 -0.070 -9.534 -10.073 49 HB3 LYS 7 HB3 LYS 7 0.308 -10.812 -11.230 50 HG2 LYS 7 HG2 LYS 7 2.435 -11.247 -10.005 51 HG3 LYS 7 HG3 LYS 7 1.973 -10.024 -8.815 52 HD2 LYS 7 HD2 LYS 7 0.003 -11.367 -8.179 53 HD3 LYS 7 HD3 LYS 7 0.402 -12.566 -9.416 54 HE2 LYS 7 HE2 LYS 7 2.569 -12.992 -8.225 55 HE3 LYS 7 HE3 LYS 7 2.052 -11.884 -6.956 56 HZ1 LYS 7 HZ1 LYS 7 0.241 -13.315 -6.441 57 HZ2 LYS 7 HZ2 LYS 7 1.664 -14.240 -6.462 58 HZ3 LYS 7 HZ3 LYS 7 0.579 -14.320 -7.750 59 H ASP 8 H ASP 8 3.968 -8.360 -11.775 60 HA ASP 8 HA ASP 8 4.527 -10.224 -13.978 61 HB2 ASP 8 HB2 ASP 8 5.007 -7.661 -14.021 62 HB3 ASP 8 HB3 ASP 8 6.338 -8.002 -12.928 63 H VAL 9 H VAL 9 4.840 -12.175 -12.921 64 HA VAL 9 HA VAL 9 6.363 -12.535 -10.530 65 HB VAL 9 HB VAL 9 5.611 -14.655 -12.593 66 HG11 VAL 9 HG11 VAL 9 6.283 -14.963 -9.636 67 HG12 VAL 9 HG12 VAL 9 7.302 -15.465 -10.985 68 HG13 VAL 9 HG13 VAL 9 5.755 -16.265 -10.708 69 HG21 VAL 9 HG21 VAL 9 3.579 -15.070 -11.224 70 HG22 VAL 9 HG22 VAL 9 3.592 -13.429 -11.875 71 HG23 VAL 9 HG23 VAL 9 4.002 -13.709 -10.180 72 H GLU 10 H GLU 10 7.205 -12.494 -13.924 73 HA GLU 10 HA GLU 10 9.765 -13.708 -13.864 74 HB2 GLU 10 HB2 GLU 10 8.835 -11.445 -15.691 75 HB3 GLU 10 HB3 GLU 10 10.156 -12.569 -16.005 76 HG2 GLU 10 HG2 GLU 10 7.207 -13.277 -15.843 77 HG3 GLU 10 HG3 GLU 10 8.150 -13.104 -17.320 78 H ALA 11 H ALA 11 8.777 -10.314 -13.588 79 HA ALA 11 HA ALA 11 11.463 -9.359 -12.887 80 HB1 ALA 11 HB1 ALA 11 8.842 -7.831 -13.118 81 HB2 ALA 11 HB2 ALA 11 10.044 -8.014 -14.396 82 HB3 ALA 11 HB3 ALA 11 10.450 -7.116 -12.936 83 H LEU 12 H LEU 12 9.141 -10.875 -11.139 84 HA LEU 12 HA LEU 12 8.393 -11.008 -9.011 85 HB2 LEU 12 HB2 LEU 12 11.049 -9.655 -8.396 86 HB3 LEU 12 HB3 LEU 12 10.056 -10.506 -7.220 87 HG LEU 12 HG LEU 12 11.397 -11.798 -9.638 88 HD11 LEU 12 HD11 LEU 12 12.915 -12.855 -8.016 89 HD12 LEU 12 HD12 LEU 12 12.168 -11.940 -6.703 90 HD13 LEU 12 HD13 LEU 12 13.053 -11.098 -7.977 91 HD21 LEU 12 HD21 LEU 12 9.328 -12.963 -9.033 92 HD22 LEU 12 HD22 LEU 12 9.857 -13.088 -7.355 93 HD23 LEU 12 HD23 LEU 12 10.734 -13.948 -8.625 94 H SER 13 H SER 13 7.564 -8.591 -10.463 95 HA SER 13 HA SER 13 7.222 -6.611 -8.274 96 HB2 SER 13 HB2 SER 13 7.000 -4.881 -10.051 97 HB3 SER 13 HB3 SER 13 8.561 -5.694 -10.131 98 HG SER 13 HG SER 13 7.654 -7.014 -11.822 99 H PHE 14 H PHE 14 5.193 -5.302 -8.465 100 HA PHE 14 HA PHE 14 2.869 -6.613 -9.704 101 HB2 PHE 14 HB2 PHE 14 3.042 -7.841 -7.621 102 HB3 PHE 14 HB3 PHE 14 3.342 -6.378 -6.693 103 HD1 PHE 14 HD1 PHE 14 0.671 -7.674 -9.019 104 HD2 PHE 14 HD2 PHE 14 1.571 -5.727 -5.317 105 HE1 PHE 14 HE1 PHE 14 -1.720 -7.536 -8.504 106 HE2 PHE 14 HE2 PHE 14 -0.826 -5.592 -4.817 107 HZ PHE 14 HZ PHE 14 -2.472 -6.490 -6.407 108 H SER 15 H SER 15 2.044 -4.893 -10.791 109 HA SER 15 HA SER 15 2.084 -2.199 -9.546 110 HB2 SER 15 HB2 SER 15 2.059 -1.292 -11.867 111 HB3 SER 15 HB3 SER 15 3.452 -2.322 -11.565 112 HG SER 15 HG SER 15 1.090 -3.030 -12.955 113 H ILE 16 H ILE 16 0.170 -1.531 -8.810 114 HA ILE 16 HA ILE 16 -2.375 -2.321 -10.091 115 HB ILE 16 HB ILE 16 -1.795 -1.033 -7.380 116 HG12 ILE 16 HG12 ILE 16 -2.904 -3.792 -8.065 117 HG13 ILE 16 HG13 ILE 16 -1.268 -3.459 -7.502 118 HG21 ILE 16 HG21 ILE 16 -4.514 -1.748 -8.544 119 HG22 ILE 16 HG22 ILE 16 -3.913 -0.119 -8.238 120 HG23 ILE 16 HG23 ILE 16 -4.224 -1.213 -6.890 121 HD11 ILE 16 HD11 ILE 16 -3.804 -3.008 -5.927 122 HD12 ILE 16 HD12 ILE 16 -2.162 -2.677 -5.367 123 HD13 ILE 16 HD13 ILE 16 -2.656 -4.330 -5.722 124 H VAL 17 H VAL 17 -3.136 -0.897 -11.551 125 HA VAL 17 HA VAL 17 -2.526 1.984 -11.372 126 HB VAL 17 HB VAL 17 -3.742 0.410 -13.696 127 HG11 VAL 17 HG11 VAL 17 -4.391 2.792 -13.723 128 HG12 VAL 17 HG12 VAL 17 -3.281 2.437 -15.047 129 HG13 VAL 17 HG13 VAL 17 -2.694 3.271 -13.606 130 HG21 VAL 17 HG21 VAL 17 -1.414 -0.315 -13.298 131 HG22 VAL 17 HG22 VAL 17 -0.866 1.364 -13.357 132 HG23 VAL 17 HG23 VAL 17 -1.533 0.604 -14.804 133 H ALA 18 H ALA 18 -4.076 3.177 -10.402 134 HA ALA 18 HA ALA 18 -6.950 2.510 -10.723 135 HB1 ALA 18 HB1 ALA 18 -5.599 3.239 -8.092 136 HB2 ALA 18 HB2 ALA 18 -6.191 1.638 -8.540 137 HB3 ALA 18 HB3 ALA 18 -7.330 2.968 -8.330 138 H GLU 19 H GLU 19 -8.348 4.326 -10.758 139 HA GLU 19 HA GLU 19 -7.052 7.015 -10.815 140 HB2 GLU 19 HB2 GLU 19 -9.273 6.006 -12.656 141 HB3 GLU 19 HB3 GLU 19 -8.577 7.628 -12.674 142 HG2 GLU 19 HG2 GLU 19 -6.388 6.676 -13.324 143 HG3 GLU 19 HG3 GLU 19 -7.088 5.060 -13.312 144 H PHE 20 H PHE 20 -8.012 8.527 -9.545 145 HA PHE 20 HA PHE 20 -10.695 7.987 -8.380 146 HB2 PHE 20 HB2 PHE 20 -8.292 9.167 -6.904 147 HB3 PHE 20 HB3 PHE 20 -9.888 8.862 -6.215 148 HD1 PHE 20 HD1 PHE 20 -10.742 6.377 -6.325 149 HD2 PHE 20 HD2 PHE 20 -6.628 7.503 -6.702 150 HE1 PHE 20 HE1 PHE 20 -10.059 4.091 -5.744 151 HE2 PHE 20 HE2 PHE 20 -5.957 5.215 -6.119 152 HZ PHE 20 HZ PHE 20 -7.670 3.513 -5.646 153 H ASP 21 H ASP 21 -12.041 9.750 -8.030 154 HA ASP 21 HA ASP 21 -11.518 12.125 -9.628 155 HB2 ASP 21 HB2 ASP 21 -13.722 10.896 -9.642 156 HB3 ASP 21 HB3 ASP 21 -13.970 11.377 -7.967 157 H ALA 22 H ALA 22 -9.843 13.088 -8.448 158 HA ALA 22 HA ALA 22 -10.467 15.008 -6.441 159 HB1 ALA 22 HB1 ALA 22 -9.077 14.114 -4.574 160 HB2 ALA 22 HB2 ALA 22 -8.796 12.629 -5.493 161 HB3 ALA 22 HB3 ALA 22 -10.422 13.027 -4.936 162 H ASP 23 H ASP 23 -8.212 15.968 -5.581 163 HA ASP 23 HA ASP 23 -6.438 16.245 -7.917 164 HB2 ASP 23 HB2 ASP 23 -5.399 18.126 -6.693 165 HB3 ASP 23 HB3 ASP 23 -7.130 18.341 -6.849 166 H VAL 24 H VAL 24 -4.085 16.408 -7.422 167 HA VAL 24 HA VAL 24 -3.088 13.916 -6.672 168 HB VAL 24 HB VAL 24 -1.551 16.535 -6.961 169 HG11 VAL 24 HG11 VAL 24 0.416 15.121 -7.523 170 HG12 VAL 24 HG12 VAL 24 -0.528 13.669 -7.190 171 HG13 VAL 24 HG13 VAL 24 -0.154 14.796 -5.884 172 HG21 VAL 24 HG21 VAL 24 -2.901 16.041 -8.946 173 HG22 VAL 24 HG22 VAL 24 -2.192 14.427 -9.053 174 HG23 VAL 24 HG23 VAL 24 -1.182 15.855 -9.299 175 H LYS 25 H LYS 25 -3.136 16.969 -4.840 176 HA LYS 25 HA LYS 25 -1.604 16.043 -2.621 177 HB2 LYS 25 HB2 LYS 25 -3.275 18.481 -3.174 178 HB3 LYS 25 HB3 LYS 25 -2.892 18.139 -1.498 179 HG2 LYS 25 HG2 LYS 25 -0.603 18.162 -3.448 180 HG3 LYS 25 HG3 LYS 25 -1.347 19.705 -3.035 181 HD2 LYS 25 HD2 LYS 25 0.522 19.380 -1.543 182 HD3 LYS 25 HD3 LYS 25 -0.952 19.188 -0.601 183 HE2 LYS 25 HE2 LYS 25 -0.666 16.677 -0.859 184 HE3 LYS 25 HE3 LYS 25 0.916 16.996 -1.569 185 HZ1 LYS 25 HZ1 LYS 25 1.521 18.133 0.492 186 HZ2 LYS 25 HZ2 LYS 25 1.121 16.514 0.755 187 HZ3 LYS 25 HZ3 LYS 25 0.021 17.733 1.157 188 H ARG 26 H ARG 26 -5.084 15.888 -3.326 189 HA ARG 26 HA ARG 26 -5.828 15.142 -0.626 190 HB2 ARG 26 HB2 ARG 26 -7.442 16.256 -2.180 191 HB3 ARG 26 HB3 ARG 26 -7.476 14.791 -3.164 192 HG2 ARG 26 HG2 ARG 26 -8.395 13.514 -1.278 193 HG3 ARG 26 HG3 ARG 26 -8.280 14.929 -0.233 194 HD2 ARG 26 HD2 ARG 26 -9.970 16.081 -1.602 195 HD3 ARG 26 HD3 ARG 26 -10.058 14.678 -2.678 196 HE ARG 26 HE ARG 26 -10.542 13.729 -0.125 197 HH11 ARG 26 HH11 ARG 26 -12.155 15.944 -2.241 198 HH12 ARG 26 HH12 ARG 26 -13.709 15.584 -1.581 199 HH21 ARG 26 HH21 ARG 26 -12.503 13.310 0.704 200 HH22 ARG 26 HH22 ARG 26 -13.904 14.111 0.086 201 H VAL 27 H VAL 27 -5.184 13.359 -3.648 202 HA VAL 27 HA VAL 27 -5.648 10.737 -2.557 203 HB VAL 27 HB VAL 27 -3.854 11.345 -4.948 204 HG11 VAL 27 HG11 VAL 27 -5.538 8.889 -4.286 205 HG12 VAL 27 HG12 VAL 27 -3.782 9.004 -4.137 206 HG13 VAL 27 HG13 VAL 27 -4.538 9.095 -5.729 207 HG21 VAL 27 HG21 VAL 27 -5.977 12.525 -5.332 208 HG22 VAL 27 HG22 VAL 27 -6.886 11.060 -4.978 209 HG23 VAL 27 HG23 VAL 27 -5.857 11.131 -6.406 210 H TRP 28 H TRP 28 -2.841 12.880 -2.717 211 HA TRP 28 HA TRP 28 -0.900 11.115 -1.602 212 HB2 TRP 28 HB2 TRP 28 -0.348 13.225 -2.822 213 HB3 TRP 28 HB3 TRP 28 -1.037 14.163 -1.508 214 HD1 TRP 28 HD1 TRP 28 0.597 14.753 0.482 215 HE1 TRP 28 HE1 TRP 28 3.051 14.244 1.001 216 HE3 TRP 28 HE3 TRP 28 1.457 11.235 -3.117 217 HZ2 TRP 28 HZ2 TRP 28 5.098 12.572 0.006 218 HZ3 TRP 28 HZ3 TRP 28 3.697 10.244 -3.279 219 HH2 TRP 28 HH2 TRP 28 5.482 10.900 -1.748 220 H ALA 29 H ALA 29 -3.381 13.195 -0.174 221 HA ALA 29 HA ALA 29 -2.454 13.403 2.470 222 HB1 ALA 29 HB1 ALA 29 -4.260 14.796 1.543 223 HB2 ALA 29 HB2 ALA 29 -4.754 14.026 3.053 224 HB3 ALA 29 HB3 ALA 29 -5.334 13.395 1.508 225 H ILE 30 H ILE 30 -4.240 10.752 0.930 226 HA ILE 30 HA ILE 30 -4.902 9.321 3.349 227 HB ILE 30 HB ILE 30 -5.601 7.484 1.949 228 HG12 ILE 30 HG12 ILE 30 -4.095 8.839 -0.328 229 HG13 ILE 30 HG13 ILE 30 -3.638 7.339 0.454 230 HG21 ILE 30 HG21 ILE 30 -7.085 9.453 1.945 231 HG22 ILE 30 HG22 ILE 30 -7.177 8.586 0.413 232 HG23 ILE 30 HG23 ILE 30 -6.254 10.089 0.519 233 HD11 ILE 30 HD11 ILE 30 -4.590 6.924 -1.701 234 HD12 ILE 30 HD12 ILE 30 -6.059 7.794 -1.269 235 HD13 ILE 30 HD13 ILE 30 -5.655 6.279 -0.452 236 H TRP 31 H TRP 31 -1.962 9.723 1.684 237 HA TRP 31 HA TRP 31 -0.675 7.357 2.924 238 HB2 TRP 31 HB2 TRP 31 0.352 9.335 0.827 239 HB3 TRP 31 HB3 TRP 31 1.258 7.953 1.444 240 HD1 TRP 31 HD1 TRP 31 -1.275 8.856 -1.205 241 HE1 TRP 31 HE1 TRP 31 -1.996 6.734 -2.469 242 HE3 TRP 31 HE3 TRP 31 0.825 5.332 1.848 243 HZ2 TRP 31 HZ2 TRP 31 -1.699 3.941 -2.217 244 HZ3 TRP 31 HZ3 TRP 31 0.577 2.960 1.261 245 HH2 TRP 31 HH2 TRP 31 -0.669 2.272 -0.725 246 H GLU 32 H GLU 32 -0.734 10.849 2.876 247 HA GLU 32 HA GLU 32 1.675 11.340 4.340 248 HB2 GLU 32 HB2 GLU 32 0.758 12.897 2.650 249 HB3 GLU 32 HB3 GLU 32 -0.682 13.141 3.631 250 HG2 GLU 32 HG2 GLU 32 0.686 14.216 5.380 251 HG3 GLU 32 HG3 GLU 32 2.137 13.943 4.415 252 H ASP 33 H ASP 33 -1.775 11.224 5.145 253 HA ASP 33 HA ASP 33 -1.245 11.850 7.978 254 HB2 ASP 33 HB2 ASP 33 -2.962 13.202 6.738 255 HB3 ASP 33 HB3 ASP 33 -3.912 11.738 6.498 256 HA PRO 34 HA PRO 34 -1.536 7.442 8.883 257 HB2 PRO 34 HB2 PRO 34 -2.133 8.257 11.700 258 HB3 PRO 34 HB3 PRO 34 -0.793 7.290 11.067 259 HG2 PRO 34 HG2 PRO 34 -0.415 9.814 11.924 260 HG3 PRO 34 HG3 PRO 34 0.484 9.167 10.535 261 HD2 PRO 34 HD2 PRO 34 -1.912 11.002 10.553 262 HD3 PRO 34 HD3 PRO 34 -0.447 11.065 9.545 263 H ARG 35 H ARG 35 -4.074 9.651 10.053 264 HA ARG 35 HA ARG 35 -5.990 7.598 10.718 265 HB2 ARG 35 HB2 ARG 35 -6.228 10.620 10.482 266 HB3 ARG 35 HB3 ARG 35 -7.632 9.609 10.808 267 HG2 ARG 35 HG2 ARG 35 -6.809 10.498 12.900 268 HG3 ARG 35 HG3 ARG 35 -6.533 8.758 12.863 269 HD2 ARG 35 HD2 ARG 35 -4.127 9.661 11.886 270 HD3 ARG 35 HD3 ARG 35 -4.576 11.000 12.939 271 HE ARG 35 HE ARG 35 -4.239 9.663 14.755 272 HH11 ARG 35 HH11 ARG 35 -4.279 7.597 11.989 273 HH12 ARG 35 HH12 ARG 35 -3.690 6.241 12.875 274 HH21 ARG 35 HH21 ARG 35 -3.436 7.928 15.824 275 HH22 ARG 35 HH22 ARG 35 -3.196 6.433 14.993 276 H GLN 36 H GLN 36 -5.635 9.914 8.022 277 HA GLN 36 HA GLN 36 -7.795 9.001 6.420 278 HB2 GLN 36 HB2 GLN 36 -5.219 10.428 5.633 279 HB3 GLN 36 HB3 GLN 36 -6.555 10.133 4.519 280 HG2 GLN 36 HG2 GLN 36 -8.041 11.479 6.016 281 HG3 GLN 36 HG3 GLN 36 -6.639 11.836 7.029 282 HE21 GLN 36 HE21 GLN 36 -8.108 12.370 3.888 283 HE22 GLN 36 HE22 GLN 36 -7.171 13.759 3.478 284 H LEU 37 H LEU 37 -4.581 7.751 6.912 285 HA LEU 37 HA LEU 37 -4.512 5.974 4.650 286 HB2 LEU 37 HB2 LEU 37 -2.482 6.846 5.644 287 HB3 LEU 37 HB3 LEU 37 -2.890 6.163 7.207 288 HG LEU 37 HG LEU 37 -2.489 3.892 6.370 289 HD11 LEU 37 HD11 LEU 37 -1.782 5.131 3.694 290 HD12 LEU 37 HD12 LEU 37 -3.214 4.150 4.035 291 HD13 LEU 37 HD13 LEU 37 -1.603 3.425 4.144 292 HD21 LEU 37 HD21 LEU 37 -0.611 5.148 7.297 293 HD22 LEU 37 HD22 LEU 37 -0.216 5.781 5.696 294 HD23 LEU 37 HD23 LEU 37 -0.071 4.050 6.027 295 H GLU 38 H GLU 38 -5.106 5.461 8.167 296 HA GLU 38 HA GLU 38 -5.188 2.610 7.969 297 HB2 GLU 38 HB2 GLU 38 -5.851 2.629 10.335 298 HB3 GLU 38 HB3 GLU 38 -4.506 3.722 10.041 299 HG2 GLU 38 HG2 GLU 38 -5.966 5.658 10.172 300 HG3 GLU 38 HG3 GLU 38 -7.394 4.627 10.276 301 H ARG 39 H ARG 39 -7.662 4.998 7.520 302 HA ARG 39 HA ARG 39 -9.955 3.462 8.222 303 HB2 ARG 39 HB2 ARG 39 -11.244 5.230 7.066 304 HB3 ARG 39 HB3 ARG 39 -10.031 5.898 8.152 305 HG2 ARG 39 HG2 ARG 39 -8.549 6.341 6.203 306 HG3 ARG 39 HG3 ARG 39 -9.809 5.724 5.125 307 HD2 ARG 39 HD2 ARG 39 -10.068 8.131 6.968 308 HD3 ARG 39 HD3 ARG 39 -9.802 8.196 5.223 309 HE ARG 39 HE ARG 39 -12.106 6.703 5.617 310 HH11 ARG 39 HH11 ARG 39 -11.150 9.980 6.255 311 HH12 ARG 39 HH12 ARG 39 -12.755 10.584 6.061 312 HH21 ARG 39 HH21 ARG 39 -14.118 7.501 5.410 313 HH22 ARG 39 HH22 ARG 39 -14.418 9.192 5.589 314 H TRP 40 H TRP 40 -7.991 3.477 5.319 315 HA TRP 40 HA TRP 40 -9.951 1.695 3.957 316 HB2 TRP 40 HB2 TRP 40 -9.008 2.416 1.798 317 HB3 TRP 40 HB3 TRP 40 -9.629 3.789 2.702 318 HD1 TRP 40 HD1 TRP 40 -7.835 5.645 3.497 319 HE1 TRP 40 HE1 TRP 40 -5.417 6.126 2.803 320 HE3 TRP 40 HE3 TRP 40 -6.786 1.269 1.079 321 HZ2 TRP 40 HZ2 TRP 40 -3.346 4.859 1.391 322 HZ3 TRP 40 HZ3 TRP 40 -4.563 0.984 0.071 323 HH2 TRP 40 HH2 TRP 40 -2.880 2.743 0.229 324 H TRP 41 H TRP 41 -6.695 2.049 5.121 325 HA TRP 41 HA TRP 41 -5.156 0.357 3.546 326 HB2 TRP 41 HB2 TRP 41 -4.355 1.904 5.377 327 HB3 TRP 41 HB3 TRP 41 -4.868 0.714 6.567 328 HD1 TRP 41 HD1 TRP 41 -2.916 -0.823 7.358 329 HE1 TRP 41 HE1 TRP 41 -0.628 -1.507 6.410 330 HE3 TRP 41 HE3 TRP 41 -3.206 1.406 2.772 331 HZ2 TRP 41 HZ2 TRP 41 0.851 -1.164 4.050 332 HZ3 TRP 41 HZ3 TRP 41 -1.335 1.160 1.218 333 HH2 TRP 41 HH2 TRP 41 0.670 -0.106 1.836 334 H GLY 42 H GLY 42 -7.222 -0.495 6.296 335 HA2 GLY 42 HA2 GLY 42 -6.775 -3.376 5.913 336 HA3 GLY 42 HA3 GLY 42 -7.649 -2.618 7.229 337 HA PRO 43 HA PRO 43 -10.578 -3.925 3.516 338 HB2 PRO 43 HB2 PRO 43 -11.096 -6.572 4.090 339 HB3 PRO 43 HB3 PRO 43 -9.816 -6.056 2.984 340 HG2 PRO 43 HG2 PRO 43 -9.615 -6.815 5.898 341 HG3 PRO 43 HG3 PRO 43 -8.583 -7.324 4.542 342 HD2 PRO 43 HD2 PRO 43 -7.813 -5.357 6.224 343 HD3 PRO 43 HD3 PRO 43 -7.422 -5.282 4.491 344 HA PRO 44 HA PRO 44 -14.286 -3.143 5.877 345 HB2 PRO 44 HB2 PRO 44 -15.603 -5.625 4.750 346 HB3 PRO 44 HB3 PRO 44 -16.204 -3.960 4.807 347 HG2 PRO 44 HG2 PRO 44 -15.253 -4.908 2.523 348 HG3 PRO 44 HG3 PRO 44 -14.815 -3.262 3.030 349 HD2 PRO 44 HD2 PRO 44 -13.172 -5.793 3.182 350 HD3 PRO 44 HD3 PRO 44 -12.671 -4.152 2.712 351 H THR 45 H THR 45 -13.262 -6.540 6.131 352 HA THR 45 HA THR 45 -14.629 -6.946 8.698 353 HB THR 45 HB THR 45 -13.645 -9.281 8.559 354 HG1 THR 45 HG1 THR 45 -12.486 -9.857 6.771 355 HG21 THR 45 HG21 THR 45 -15.205 -8.392 6.102 356 HG22 THR 45 HG22 THR 45 -15.911 -8.848 7.656 357 HG23 THR 45 HG23 THR 45 -15.058 -10.051 6.684 358 H TRP 46 H TRP 46 -11.470 -5.994 7.622 359 HA TRP 46 HA TRP 46 -10.340 -6.289 10.362 360 HB2 TRP 46 HB2 TRP 46 -8.888 -6.497 7.685 361 HB3 TRP 46 HB3 TRP 46 -8.076 -6.434 9.240 362 HD1 TRP 46 HD1 TRP 46 -10.614 -8.776 7.408 363 HE1 TRP 46 HE1 TRP 46 -10.129 -11.185 8.156 364 HE3 TRP 46 HE3 TRP 46 -6.879 -7.827 10.734 365 HZ2 TRP 46 HZ2 TRP 46 -8.367 -12.518 9.912 366 HZ3 TRP 46 HZ3 TRP 46 -5.830 -9.723 11.907 367 HH2 TRP 46 HH2 TRP 46 -6.554 -12.022 11.502 368 HA PRO 47 HA PRO 47 -10.285 -1.640 9.464 369 HB2 PRO 47 HB2 PRO 47 -10.676 -0.969 12.146 370 HB3 PRO 47 HB3 PRO 47 -11.976 -1.150 10.960 371 HG2 PRO 47 HG2 PRO 47 -10.953 -3.154 12.970 372 HG3 PRO 47 HG3 PRO 47 -12.633 -2.747 12.559 373 HD2 PRO 47 HD2 PRO 47 -11.491 -4.960 11.558 374 HD3 PRO 47 HD3 PRO 47 -12.575 -3.979 10.550 375 H ALA 48 H ALA 48 -8.246 -0.870 9.242 376 HA ALA 48 HA ALA 48 -6.015 -1.885 10.811 377 HB1 ALA 48 HB1 ALA 48 -5.778 -1.530 8.379 378 HB2 ALA 48 HB2 ALA 48 -4.603 -0.574 9.285 379 HB3 ALA 48 HB3 ALA 48 -6.037 0.201 8.601 380 H THR 49 H THR 49 -4.578 -0.602 12.068 381 HA THR 49 HA THR 49 -5.280 2.175 12.729 382 HB THR 49 HB THR 49 -5.022 0.000 14.862 383 HG1 THR 49 HG1 THR 49 -7.153 1.363 13.698 384 HG21 THR 49 HG21 THR 49 -3.907 2.061 15.650 385 HG22 THR 49 HG22 THR 49 -5.421 1.807 16.521 386 HG23 THR 49 HG23 THR 49 -5.334 3.009 15.230 387 H PHE 50 H PHE 50 -3.476 3.317 12.461 388 HA PHE 50 HA PHE 50 -0.800 2.152 12.774 389 HB2 PHE 50 HB2 PHE 50 -1.832 4.740 11.546 390 HB3 PHE 50 HB3 PHE 50 -0.123 4.554 11.928 391 HD1 PHE 50 HD1 PHE 50 -2.897 2.880 10.029 392 HD2 PHE 50 HD2 PHE 50 1.321 3.546 10.351 393 HE1 PHE 50 HE1 PHE 50 -2.540 1.688 7.913 394 HE2 PHE 50 HE2 PHE 50 1.667 2.347 8.232 395 HZ PHE 50 HZ PHE 50 -0.262 1.415 7.011 396 H GLU 51 H GLU 51 -0.060 2.098 14.808 397 HA GLU 51 HA GLU 51 -0.474 4.163 16.788 398 HB2 GLU 51 HB2 GLU 51 1.558 1.896 16.728 399 HB3 GLU 51 HB3 GLU 51 1.216 2.925 18.120 400 HG2 GLU 51 HG2 GLU 51 -1.118 2.058 18.151 401 HG3 GLU 51 HG3 GLU 51 -0.718 0.985 16.812 402 H THR 52 H THR 52 2.139 3.206 14.635 403 HA THR 52 HA THR 52 3.457 5.827 15.086 404 HB THR 52 HB THR 52 4.882 3.260 14.220 405 HG1 THR 52 HG1 THR 52 4.111 4.150 16.745 406 HG21 THR 52 HG21 THR 52 5.888 5.886 15.362 407 HG22 THR 52 HG22 THR 52 6.033 5.381 13.675 408 HG23 THR 52 HG23 THR 52 6.896 4.499 14.938 409 H HIS 53 H HIS 53 3.810 7.041 13.270 410 HA HIS 53 HA HIS 53 4.127 5.839 10.646 411 HB2 HIS 53 HB2 HIS 53 1.667 6.085 10.826 412 HB3 HIS 53 HB3 HIS 53 1.850 7.792 11.200 413 HD2 HIS 53 HD2 HIS 53 2.015 5.386 8.118 414 HE1 HIS 53 HE1 HIS 53 2.058 9.402 6.784 415 HE2 HIS 53 HE2 HIS 53 1.680 7.000 6.111 416 H GLU 54 H GLU 54 6.221 6.670 10.755 417 HA GLU 54 HA GLU 54 6.689 9.557 10.928 418 HB2 GLU 54 HB2 GLU 54 8.648 7.267 10.401 419 HB3 GLU 54 HB3 GLU 54 9.097 8.956 10.641 420 HG2 GLU 54 HG2 GLU 54 7.802 7.135 12.672 421 HG3 GLU 54 HG3 GLU 54 9.495 7.616 12.650 422 H PHE 55 H PHE 55 5.613 10.339 9.055 423 HA PHE 55 HA PHE 55 6.214 9.357 6.423 424 HB2 PHE 55 HB2 PHE 55 4.041 10.542 7.225 425 HB3 PHE 55 HB3 PHE 55 4.934 12.052 7.055 426 HD1 PHE 55 HD1 PHE 55 4.098 8.950 5.145 427 HD2 PHE 55 HD2 PHE 55 4.856 13.144 4.929 428 HE1 PHE 55 HE1 PHE 55 3.540 8.925 2.748 429 HE2 PHE 55 HE2 PHE 55 4.286 13.116 2.534 430 HZ PHE 55 HZ PHE 55 3.629 11.005 1.447 431 H THR 56 H THR 56 8.588 9.509 7.007 432 HA THR 56 HA THR 56 9.758 11.868 5.694 433 HB THR 56 HB THR 56 10.051 12.367 8.077 434 HG1 THR 56 HG1 THR 56 11.799 13.001 6.877 435 HG21 THR 56 HG21 THR 56 11.461 9.682 8.326 436 HG22 THR 56 HG22 THR 56 9.888 10.083 9.022 437 HG23 THR 56 HG23 THR 56 11.341 10.905 9.597 438 H VAL 57 H VAL 57 11.925 11.449 4.858 439 HA VAL 57 HA VAL 57 12.183 8.922 3.554 440 HB VAL 57 HB VAL 57 14.167 11.234 3.768 441 HG11 VAL 57 HG11 VAL 57 15.214 10.305 1.708 442 HG12 VAL 57 HG12 VAL 57 14.131 8.914 1.796 443 HG13 VAL 57 HG13 VAL 57 15.326 9.179 3.067 444 HG21 VAL 57 HG21 VAL 57 12.026 11.945 2.781 445 HG22 VAL 57 HG22 VAL 57 12.101 10.624 1.612 446 HG23 VAL 57 HG23 VAL 57 13.290 11.927 1.545 447 H GLY 58 H GLY 58 12.791 7.117 4.602 448 HA2 GLY 58 HA2 GLY 58 14.391 5.699 5.647 449 HA3 GLY 58 HA3 GLY 58 15.108 7.089 6.442 450 H GLY 59 H GLY 59 11.842 7.475 6.777 451 HA2 GLY 59 HA2 GLY 59 11.867 6.659 9.579 452 HA3 GLY 59 HA3 GLY 59 10.617 7.581 8.759 453 H LYS 60 H LYS 60 9.940 5.562 10.527 454 HA LYS 60 HA LYS 60 8.954 3.357 8.794 455 HB2 LYS 60 HB2 LYS 60 9.963 3.164 11.665 456 HB3 LYS 60 HB3 LYS 60 9.134 1.860 10.813 457 HG2 LYS 60 HG2 LYS 60 10.961 1.839 9.123 458 HG3 LYS 60 HG3 LYS 60 11.805 3.086 10.055 459 HD2 LYS 60 HD2 LYS 60 11.998 1.567 11.970 460 HD3 LYS 60 HD3 LYS 60 11.058 0.333 11.126 461 HE2 LYS 60 HE2 LYS 60 12.834 0.079 9.459 462 HE3 LYS 60 HE3 LYS 60 13.758 1.385 10.211 463 HZ1 LYS 60 HZ1 LYS 60 14.560 -0.792 10.866 464 HZ2 LYS 60 HZ2 LYS 60 13.053 -1.189 11.512 465 HZ3 LYS 60 HZ3 LYS 60 13.969 0.054 12.203 466 H ALA 61 H ALA 61 7.082 2.209 9.652 467 HA ALA 61 HA ALA 61 5.294 3.741 11.428 468 HB1 ALA 61 HB1 ALA 61 4.667 4.389 9.133 469 HB2 ALA 61 HB2 ALA 61 3.385 3.455 9.902 470 HB3 ALA 61 HB3 ALA 61 4.432 2.696 8.704 471 H ALA 62 H ALA 62 3.947 2.474 12.667 472 HA ALA 62 HA ALA 62 4.135 -0.482 12.429 473 HB1 ALA 62 HB1 ALA 62 4.036 1.160 14.991 474 HB2 ALA 62 HB2 ALA 62 5.435 0.278 14.372 475 HB3 ALA 62 HB3 ALA 62 3.999 -0.606 14.899 476 H TYR 63 H TYR 63 2.213 -1.484 12.251 477 HA TYR 63 HA TYR 63 -0.265 -0.226 13.199 478 HB2 TYR 63 HB2 TYR 63 -1.386 -0.517 11.006 479 HB3 TYR 63 HB3 TYR 63 -0.050 0.614 10.907 480 HD1 TYR 63 HD1 TYR 63 2.053 -0.018 9.688 481 HD2 TYR 63 HD2 TYR 63 -1.341 -2.623 9.726 482 HE1 TYR 63 HE1 TYR 63 2.982 -1.253 7.781 483 HE2 TYR 63 HE2 TYR 63 -0.412 -3.858 7.820 484 HH TYR 63 HH TYR 63 2.827 -3.400 6.708 485 H TYR 64 H TYR 64 -2.130 -1.644 13.058 486 HA TYR 64 HA TYR 64 -1.762 -4.459 12.458 487 HB2 TYR 64 HB2 TYR 64 -2.552 -5.275 14.660 488 HB3 TYR 64 HB3 TYR 64 -1.047 -4.383 14.828 489 HD1 TYR 64 HD2 TYR 64 -1.135 -1.959 15.733 490 HD2 TYR 64 HD1 TYR 64 -4.511 -4.604 15.891 491 HE1 TYR 64 HE2 TYR 64 -2.177 -0.548 17.449 492 HE2 TYR 64 HE1 TYR 64 -5.541 -3.181 17.606 493 HH TYR 64 HH TYR 64 -4.362 -0.058 18.363 494 H MET 65 H MET 65 -3.650 -5.399 11.780 495 HA MET 65 HA MET 65 -6.063 -3.714 11.572 496 HB2 MET 65 HB2 MET 65 -5.338 -6.330 10.184 497 HB3 MET 65 HB3 MET 65 -6.804 -5.399 9.893 498 HG2 MET 65 HG2 MET 65 -5.406 -3.514 9.101 499 HG3 MET 65 HG3 MET 65 -3.971 -4.517 9.295 500 HE1 MET 65 HE1 MET 65 -5.187 -7.403 8.305 501 HE2 MET 65 HE2 MET 65 -3.585 -6.792 7.883 502 HE3 MET 65 HE3 MET 65 -4.682 -7.343 6.617 503 H THR 66 H THR 66 -7.409 -3.949 13.302 504 HA THR 66 HA THR 66 -7.552 -6.317 14.940 505 HB THR 66 HB THR 66 -9.324 -3.831 14.863 506 HG1 THR 66 HG1 THR 66 -7.623 -3.044 15.823 507 HG21 THR 66 HG21 THR 66 -9.211 -6.036 16.962 508 HG22 THR 66 HG22 THR 66 -10.587 -5.668 15.918 509 HG23 THR 66 HG23 THR 66 -10.071 -4.506 17.142 510 H GLY 67 H GLY 67 -8.401 -8.143 14.076 511 HA2 GLY 67 HA2 GLY 67 -10.031 -8.241 11.766 512 HA3 GLY 67 HA3 GLY 67 -9.588 -9.600 12.774 513 HA PRO 68 HA PRO 68 -14.311 -8.932 12.830 514 HB2 PRO 68 HB2 PRO 68 -14.829 -11.671 12.476 515 HB3 PRO 68 HB3 PRO 68 -14.780 -10.471 11.180 516 HG2 PRO 68 HG2 PRO 68 -12.617 -12.363 12.098 517 HG3 PRO 68 HG3 PRO 68 -13.100 -11.934 10.442 518 HD2 PRO 68 HD2 PRO 68 -10.910 -10.851 11.549 519 HD3 PRO 68 HD3 PRO 68 -11.977 -9.867 10.516 520 H ASP 69 H ASP 69 -12.236 -11.389 14.363 521 HA ASP 69 HA ASP 69 -13.934 -11.483 16.777 522 HB2 ASP 69 HB2 ASP 69 -13.128 -13.608 15.665 523 HB3 ASP 69 HB3 ASP 69 -11.474 -13.154 16.061 524 H GLY 70 H GLY 70 -11.821 -9.312 15.785 525 HA2 GLY 70 HA2 GLY 70 -10.287 -7.877 16.720 526 HA3 GLY 70 HA3 GLY 70 -10.531 -8.670 18.272 527 H THR 71 H THR 71 -9.498 -10.137 15.225 528 HA THR 71 HA THR 71 -7.668 -11.872 16.491 529 HB THR 71 HB THR 71 -7.792 -11.295 13.503 530 HG1 THR 71 HG1 THR 71 -9.324 -13.313 13.908 531 HG21 THR 71 HG21 THR 71 -7.092 -13.841 15.029 532 HG22 THR 71 HG22 THR 71 -5.951 -12.817 14.151 533 HG23 THR 71 HG23 THR 71 -7.207 -13.693 13.273 534 H LYS 72 H LYS 72 -7.116 -8.834 14.753 535 HA LYS 72 HA LYS 72 -5.404 -7.387 14.581 536 HB2 LYS 72 HB2 LYS 72 -4.309 -8.872 16.991 537 HB3 LYS 72 HB3 LYS 72 -3.632 -7.368 16.369 538 HG2 LYS 72 HG2 LYS 72 -5.791 -6.231 16.818 539 HG3 LYS 72 HG3 LYS 72 -6.432 -7.741 17.484 540 HD2 LYS 72 HD2 LYS 72 -4.675 -7.710 19.240 541 HD3 LYS 72 HD3 LYS 72 -4.028 -6.208 18.569 542 HE2 LYS 72 HE2 LYS 72 -6.166 -5.070 19.086 543 HE3 LYS 72 HE3 LYS 72 -6.798 -6.570 19.770 544 HZ1 LYS 72 HZ1 LYS 72 -5.973 -5.060 21.459 545 HZ2 LYS 72 HZ2 LYS 72 -4.430 -5.085 20.773 546 HZ3 LYS 72 HZ3 LYS 72 -5.080 -6.495 21.447 547 H ALA 73 H ALA 73 -4.646 -7.952 12.537 548 HA ALA 73 HA ALA 73 -2.295 -9.723 12.302 549 HB1 ALA 73 HB1 ALA 73 -3.997 -9.900 10.531 550 HB2 ALA 73 HB2 ALA 73 -2.466 -9.317 9.873 551 HB3 ALA 73 HB3 ALA 73 -3.799 -8.189 10.145 552 H ARG 74 H ARG 74 -0.523 -8.702 13.128 553 HA ARG 74 HA ARG 74 -0.123 -5.842 12.913 554 HB2 ARG 74 HB2 ARG 74 0.487 -7.136 14.955 555 HB3 ARG 74 HB3 ARG 74 1.731 -7.983 14.041 556 HG2 ARG 74 HG2 ARG 74 2.991 -5.924 13.740 557 HG3 ARG 74 HG3 ARG 74 1.688 -4.968 14.448 558 HD2 ARG 74 HD2 ARG 74 3.394 -7.024 15.894 559 HD3 ARG 74 HD3 ARG 74 3.517 -5.269 16.041 560 HE ARG 74 HE ARG 74 1.006 -6.628 16.760 561 HH11 ARG 74 HH11 ARG 74 3.715 -4.724 17.781 562 HH12 ARG 74 HH12 ARG 74 3.041 -4.439 19.349 563 HH21 ARG 74 HH21 ARG 74 0.187 -6.247 18.757 564 HH22 ARG 74 HH22 ARG 74 1.066 -5.278 19.882 565 H GLY 75 H GLY 75 1.220 -4.771 11.565 566 HA2 GLY 75 HA2 GLY 75 3.131 -6.238 9.844 567 HA3 GLY 75 HA3 GLY 75 1.980 -5.104 9.138 568 H TRP 76 H TRP 76 4.868 -4.983 9.072 569 HA TRP 76 HA TRP 76 5.385 -2.454 10.534 570 HB2 TRP 76 HB2 TRP 76 7.789 -2.866 10.167 571 HB3 TRP 76 HB3 TRP 76 7.053 -4.232 10.994 572 HD1 TRP 76 HD1 TRP 76 6.775 -6.538 9.532 573 HE1 TRP 76 HE1 TRP 76 8.065 -7.399 7.488 574 HE3 TRP 76 HE3 TRP 76 9.021 -2.163 8.083 575 HZ2 TRP 76 HZ2 TRP 76 9.792 -6.375 5.518 576 HZ3 TRP 76 HZ3 TRP 76 10.489 -2.189 6.103 577 HH2 TRP 76 HH2 TRP 76 10.871 -4.256 4.852 578 H TRP 77 H TRP 77 6.462 -0.763 9.328 579 HA TRP 77 HA TRP 77 6.354 -0.847 6.374 580 HB2 TRP 77 HB2 TRP 77 4.344 0.376 7.965 581 HB3 TRP 77 HB3 TRP 77 5.358 1.724 7.491 582 HD1 TRP 77 HD1 TRP 77 4.639 -1.175 5.061 583 HE1 TRP 77 HE1 TRP 77 3.180 -0.286 3.146 584 HE3 TRP 77 HE3 TRP 77 3.684 3.488 6.880 585 HZ2 TRP 77 HZ2 TRP 77 1.786 2.084 2.500 586 HZ3 TRP 77 HZ3 TRP 77 2.274 5.004 5.561 587 HH2 TRP 77 HH2 TRP 77 1.343 4.316 3.416 588 H GLN 78 H GLN 78 7.880 0.597 5.358 589 HA GLN 78 HA GLN 78 9.328 2.531 7.015 590 HB2 GLN 78 HB2 GLN 78 10.671 0.472 7.281 591 HB3 GLN 78 HB3 GLN 78 10.831 0.330 5.530 592 HG2 GLN 78 HG2 GLN 78 12.045 2.516 5.494 593 HG3 GLN 78 HG3 GLN 78 11.925 2.589 7.251 594 HE21 GLN 78 HE21 GLN 78 14.162 2.607 7.531 595 HE22 GLN 78 HE22 GLN 78 15.159 1.234 7.220 596 H PHE 79 H PHE 79 9.093 4.345 5.897 597 HA PHE 79 HA PHE 79 8.886 4.589 3.054 598 HB2 PHE 79 HB2 PHE 79 9.500 6.713 5.153 599 HB3 PHE 79 HB3 PHE 79 9.061 7.039 3.478 600 HD1 PHE 79 HD2 PHE 79 6.752 6.641 2.683 601 HD2 PHE 79 HD1 PHE 79 7.820 6.047 6.780 602 HE1 PHE 79 HE2 PHE 79 4.381 6.674 3.315 603 HE2 PHE 79 HE1 PHE 79 5.446 6.075 7.401 604 HZ PHE 79 HZ PHE 79 3.730 6.396 5.670 605 H THR 80 H THR 80 10.453 4.780 1.561 606 HA THR 80 HA THR 80 13.289 5.067 2.383 607 HB THR 80 HB THR 80 13.814 3.972 0.185 608 HG1 THR 80 HG1 THR 80 11.181 3.109 -0.127 609 HG21 THR 80 HG21 THR 80 13.640 2.564 2.196 610 HG22 THR 80 HG22 THR 80 13.010 1.705 0.785 611 HG23 THR 80 HG23 THR 80 11.895 2.413 1.957 612 H THR 81 H THR 81 10.842 6.390 0.200 613 HA THR 81 HA THR 81 12.584 8.645 -0.524 614 HB THR 81 HB THR 81 11.340 6.805 -2.624 615 HG1 THR 81 HG1 THR 81 13.873 7.033 -1.550 616 HG21 THR 81 HG21 THR 81 12.885 9.390 -3.073 617 HG22 THR 81 HG22 THR 81 11.161 9.155 -3.375 618 HG23 THR 81 HG23 THR 81 12.351 8.274 -4.335 619 H ILE 82 H ILE 82 11.358 10.383 -0.065 620 HA ILE 82 HA ILE 82 8.483 10.415 -0.824 621 HB ILE 82 HB ILE 82 9.668 11.747 1.658 622 HG12 ILE 82 HG12 ILE 82 7.911 9.274 1.350 623 HG13 ILE 82 HG13 ILE 82 9.510 9.363 2.076 624 HG21 ILE 82 HG21 ILE 82 7.847 13.093 0.668 625 HG22 ILE 82 HG22 ILE 82 7.331 12.389 2.199 626 HG23 ILE 82 HG23 ILE 82 6.779 11.686 0.678 627 HD11 ILE 82 HD11 ILE 82 8.551 10.694 3.922 628 HD12 ILE 82 HD12 ILE 82 7.841 9.087 3.768 629 HD13 ILE 82 HD13 ILE 82 6.952 10.498 3.194 630 H GLU 83 H GLU 83 8.548 11.594 -2.629 631 HA GLU 83 HA GLU 83 10.268 13.960 -2.896 632 HB2 GLU 83 HB2 GLU 83 8.469 12.605 -4.954 633 HB3 GLU 83 HB3 GLU 83 9.654 13.871 -5.278 634 HG2 GLU 83 HG2 GLU 83 10.287 11.082 -4.254 635 HG3 GLU 83 HG3 GLU 83 10.483 11.633 -5.915 636 H ALA 84 H ALA 84 6.822 13.098 -3.264 637 HA ALA 84 HA ALA 84 4.879 14.162 -2.953 638 HB1 ALA 84 HB1 ALA 84 6.412 16.307 -1.453 639 HB2 ALA 84 HB2 ALA 84 5.835 14.795 -0.750 640 HB3 ALA 84 HB3 ALA 84 4.677 15.983 -1.352 641 HA PRO 85 HA PRO 85 3.051 15.232 -2.964 642 HB2 PRO 85 HB2 PRO 85 0.923 16.145 -4.269 643 HB3 PRO 85 HB3 PRO 85 1.969 17.282 -3.399 644 HG2 PRO 85 HG2 PRO 85 1.864 16.691 -6.358 645 HG3 PRO 85 HG3 PRO 85 2.013 18.262 -5.541 646 HD2 PRO 85 HD2 PRO 85 4.165 16.740 -6.570 647 HD3 PRO 85 HD3 PRO 85 4.313 18.077 -5.410 648 H ASP 86 H ASP 86 4.421 14.042 -5.629 649 HA ASP 86 HA ASP 86 2.166 12.328 -6.503 650 HB2 ASP 86 HB2 ASP 86 3.191 12.276 -8.729 651 HB3 ASP 86 HB3 ASP 86 2.909 13.934 -8.218 652 H HIS 87 H HIS 87 5.748 12.225 -6.138 653 HA HIS 87 HA HIS 87 5.771 9.309 -6.520 654 HB2 HIS 87 HB2 HIS 87 7.400 10.808 -7.698 655 HB3 HIS 87 HB3 HIS 87 8.080 11.275 -6.155 656 HD1 HIS 87 HD1 HIS 87 9.948 10.164 -8.168 657 HD2 HIS 87 HD2 HIS 87 7.962 7.677 -5.505 658 HE1 HIS 87 HE1 HIS 87 11.365 8.107 -8.004 659 HE2 HIS 87 HE2 HIS 87 10.183 6.655 -6.345 660 H LEU 88 H LEU 88 5.655 7.981 -4.865 661 HA LEU 88 HA LEU 88 6.984 8.523 -2.278 662 HB2 LEU 88 HB2 LEU 88 4.540 8.822 -2.018 663 HB3 LEU 88 HB3 LEU 88 4.248 7.239 -2.696 664 HG LEU 88 HG LEU 88 5.336 6.195 -0.715 665 HD11 LEU 88 HD11 LEU 88 6.913 7.962 -0.112 666 HD12 LEU 88 HD12 LEU 88 5.896 7.545 1.264 667 HD13 LEU 88 HD13 LEU 88 5.580 9.024 0.353 668 HD21 LEU 88 HD21 LEU 88 3.577 6.696 0.921 669 HD22 LEU 88 HD22 LEU 88 2.915 6.517 -0.703 670 HD23 LEU 88 HD23 LEU 88 3.110 8.129 -0.003 671 H GLU 89 H GLU 89 8.168 6.779 -1.517 672 HA GLU 89 HA GLU 89 7.685 4.074 -2.563 673 HB2 GLU 89 HB2 GLU 89 10.439 5.379 -2.371 674 HB3 GLU 89 HB3 GLU 89 10.186 3.647 -2.584 675 HG2 GLU 89 HG2 GLU 89 8.994 4.139 -4.725 676 HG3 GLU 89 HG3 GLU 89 9.403 5.844 -4.521 677 H PHE 90 H PHE 90 7.902 2.504 -1.113 678 HA PHE 90 HA PHE 90 9.259 2.748 1.415 679 HB2 PHE 90 HB2 PHE 90 7.183 2.231 2.792 680 HB3 PHE 90 HB3 PHE 90 7.210 3.854 2.117 681 HD1 PHE 90 HD2 PHE 90 5.733 0.444 1.661 682 HD2 PHE 90 HD1 PHE 90 5.449 4.606 0.702 683 HE1 PHE 90 HE2 PHE 90 3.532 0.082 0.635 684 HE2 PHE 90 HE1 PHE 90 3.253 4.218 -0.310 685 HZ PHE 90 HZ PHE 90 2.294 1.956 -0.350 686 H ASP 91 H ASP 91 8.747 0.672 2.730 687 HA ASP 91 HA ASP 91 8.337 -1.680 0.978 688 HB2 ASP 91 HB2 ASP 91 10.249 -1.354 3.332 689 HB3 ASP 91 HB3 ASP 91 9.909 -2.886 2.531 690 H ASP 92 H ASP 92 6.514 -2.738 1.541 691 HA ASP 92 HA ASP 92 5.118 -2.250 3.992 692 HB2 ASP 92 HB2 ASP 92 4.519 -4.494 2.027 693 HB3 ASP 92 HB3 ASP 92 3.410 -3.756 3.178 694 H GLY 93 H GLY 93 5.516 -5.612 2.950 695 HA2 GLY 93 HA2 GLY 93 6.229 -7.491 4.039 696 HA3 GLY 93 HA3 GLY 93 7.206 -6.473 5.083 697 H PHE 94 H PHE 94 5.663 -8.811 5.862 698 HA PHE 94 HA PHE 94 3.582 -7.649 7.631 699 HB2 PHE 94 HB2 PHE 94 4.083 -10.531 6.767 700 HB3 PHE 94 HB3 PHE 94 2.926 -10.089 8.019 701 HD1 PHE 94 HD2 PHE 94 0.920 -8.716 7.440 702 HD2 PHE 94 HD1 PHE 94 3.543 -10.254 4.431 703 HE1 PHE 94 HE2 PHE 94 -0.805 -8.326 5.735 704 HE2 PHE 94 HE1 PHE 94 1.811 -9.856 2.733 705 HZ PHE 94 HZ PHE 94 -0.363 -8.898 3.379 706 H ALA 95 H ALA 95 3.577 -8.172 9.851 707 HA ALA 95 HA ALA 95 6.225 -8.892 10.992 708 HB1 ALA 95 HB1 ALA 95 4.172 -6.944 12.115 709 HB2 ALA 95 HB2 ALA 95 5.664 -6.498 11.282 710 HB3 ALA 95 HB3 ALA 95 5.738 -7.341 12.830 711 H ASP 96 H ASP 96 6.211 -9.948 12.996 712 HA ASP 96 HA ASP 96 4.182 -11.908 13.516 713 HB2 ASP 96 HB2 ASP 96 6.486 -12.489 13.882 714 HB3 ASP 96 HB3 ASP 96 6.783 -11.044 14.836 715 H GLU 97 H GLU 97 3.325 -12.119 15.907 716 HA GLU 97 HA GLU 97 1.616 -10.027 16.599 717 HB2 GLU 97 HB2 GLU 97 1.157 -11.280 18.661 718 HB3 GLU 97 HB3 GLU 97 1.276 -12.378 17.291 719 HG2 GLU 97 HG2 GLU 97 3.534 -13.052 17.987 720 HG3 GLU 97 HG3 GLU 97 3.499 -11.884 19.300 721 H HIS 98 H HIS 98 4.973 -10.467 17.502 722 HA HIS 98 HA HIS 98 4.893 -8.283 19.488 723 HB2 HIS 98 HB2 HIS 98 7.263 -10.029 18.704 724 HB3 HIS 98 HB3 HIS 98 7.167 -8.946 20.090 725 HD1 HIS 98 HD1 HIS 98 5.098 -9.682 21.825 726 HD2 HIS 98 HD2 HIS 98 6.647 -12.594 19.303 727 HE1 HIS 98 HE1 HIS 98 4.382 -11.877 22.807 728 HE2 HIS 98 HE2 HIS 98 5.191 -13.595 21.175 729 H GLY 99 H GLY 99 5.549 -8.711 16.167 730 HA2 GLY 99 HA2 GLY 99 5.730 -6.721 14.804 731 HA3 GLY 99 HA3 GLY 99 6.799 -6.018 16.004 732 H ALA 100 H ALA 100 7.608 -9.276 15.511 733 HA ALA 100 HA ALA 100 10.125 -8.694 14.336 734 HB1 ALA 100 HB1 ALA 100 9.771 -10.643 15.789 735 HB2 ALA 100 HB2 ALA 100 10.452 -11.126 14.239 736 HB3 ALA 100 HB3 ALA 100 8.736 -11.387 14.567 737 HA PRO 101 HA PRO 101 8.679 -8.311 10.012 738 HB2 PRO 101 HB2 PRO 101 11.629 -8.446 9.415 739 HB3 PRO 101 HB3 PRO 101 10.435 -7.228 8.936 740 HG2 PRO 101 HG2 PRO 101 12.208 -6.684 10.860 741 HG3 PRO 101 HG3 PRO 101 10.526 -6.126 11.005 742 HD2 PRO 101 HD2 PRO 101 11.859 -8.496 12.331 743 HD3 PRO 101 HD3 PRO 101 10.754 -7.287 13.030 744 H VAL 102 H VAL 102 7.739 -10.224 9.440 745 HA VAL 102 HA VAL 102 8.882 -12.792 9.534 746 HB VAL 102 HB VAL 102 6.547 -11.891 7.781 747 HG11 VAL 102 HG11 VAL 102 7.255 -14.680 8.800 748 HG12 VAL 102 HG12 VAL 102 7.387 -14.121 7.130 749 HG13 VAL 102 HG13 VAL 102 5.801 -14.253 7.887 750 HG21 VAL 102 HG21 VAL 102 6.487 -12.941 10.644 751 HG22 VAL 102 HG22 VAL 102 5.071 -12.578 9.652 752 HG23 VAL 102 HG23 VAL 102 6.161 -11.279 10.144 753 H ASP 103 H ASP 103 10.719 -13.186 8.455 754 HA ASP 103 HA ASP 103 11.547 -11.955 6.029 755 HB2 ASP 103 HB2 ASP 103 13.472 -13.677 6.193 756 HB3 ASP 103 HB3 ASP 103 13.301 -12.525 7.511 757 H GLU 104 H GLU 104 9.953 -14.984 6.722 758 HA GLU 104 HA GLU 104 10.131 -16.297 4.252 759 HB2 GLU 104 HB2 GLU 104 9.222 -17.377 6.257 760 HB3 GLU 104 HB3 GLU 104 7.875 -16.240 6.303 761 HG2 GLU 104 HG2 GLU 104 7.099 -17.139 4.110 762 HG3 GLU 104 HG3 GLU 104 8.399 -18.329 4.173 763 H LEU 105 H LEU 105 7.623 -14.019 5.418 764 HA LEU 105 HA LEU 105 6.353 -13.680 2.839 765 HB2 LEU 105 HB2 LEU 105 6.064 -12.163 5.462 766 HB3 LEU 105 HB3 LEU 105 5.053 -11.887 4.046 767 HG LEU 105 HG LEU 105 5.218 -14.514 5.587 768 HD11 LEU 105 HD11 LEU 105 4.094 -12.805 6.918 769 HD12 LEU 105 HD12 LEU 105 2.951 -14.027 6.369 770 HD13 LEU 105 HD13 LEU 105 2.999 -12.449 5.578 771 HD21 LEU 105 HD21 LEU 105 3.407 -13.712 3.285 772 HD22 LEU 105 HD22 LEU 105 3.326 -15.230 4.186 773 HD23 LEU 105 HD23 LEU 105 4.744 -14.865 3.209 774 H GLY 106 H GLY 106 9.056 -12.297 4.431 775 HA2 GLY 106 HA2 GLY 106 10.789 -11.123 3.566 776 HA3 GLY 106 HA3 GLY 106 10.017 -11.250 2.001 777 H VAL 107 H VAL 107 10.992 -9.188 1.687 778 HA VAL 107 HA VAL 107 9.559 -6.874 2.874 779 HB VAL 107 HB VAL 107 12.386 -6.966 1.700 780 HG11 VAL 107 HG11 VAL 107 10.950 -4.720 3.159 781 HG12 VAL 107 HG12 VAL 107 11.329 -4.758 1.435 782 HG13 VAL 107 HG13 VAL 107 12.632 -4.685 2.623 783 HG21 VAL 107 HG21 VAL 107 13.204 -6.699 4.025 784 HG22 VAL 107 HG22 VAL 107 12.294 -8.200 3.836 785 HG23 VAL 107 HG23 VAL 107 11.545 -6.809 4.623 786 H THR 108 H THR 108 8.262 -5.843 1.446 787 HA THR 108 HA THR 108 8.719 -6.143 -1.475 788 HB THR 108 HB THR 108 6.721 -7.313 -1.134 789 HG1 THR 108 HG1 THR 108 5.522 -4.809 -1.611 790 HG21 THR 108 HG21 THR 108 5.704 -5.130 0.708 791 HG22 THR 108 HG22 THR 108 6.264 -6.726 1.207 792 HG23 THR 108 HG23 THR 108 4.806 -6.573 0.222 793 H HIS 109 H HIS 109 9.421 -4.324 -2.373 794 HA HIS 109 HA HIS 109 9.102 -1.735 -1.072 795 HB2 HIS 109 HB2 HIS 109 11.291 -2.657 -2.067 796 HB3 HIS 109 HB3 HIS 109 10.611 -2.325 -3.651 797 HD1 HIS 109 HD1 HIS 109 12.531 -0.821 -0.995 798 HD2 HIS 109 HD2 HIS 109 10.036 0.599 -3.982 799 HE1 HIS 109 HE1 HIS 109 13.191 1.570 -1.334 800 HE2 HIS 109 HE2 HIS 109 11.798 2.346 -3.269 801 H ALA 110 H ALA 110 7.109 -0.887 -1.435 802 HA ALA 110 HA ALA 110 5.801 -1.042 -4.064 803 HB1 ALA 110 HB1 ALA 110 3.816 -0.188 -2.906 804 HB2 ALA 110 HB2 ALA 110 4.754 0.013 -1.426 805 HB3 ALA 110 HB3 ALA 110 4.480 -1.600 -2.080 806 H THR 111 H THR 111 5.556 0.652 -5.422 807 HA THR 111 HA THR 111 6.689 3.305 -4.673 808 HB THR 111 HB THR 111 6.459 2.206 -7.533 809 HG1 THR 111 HG1 THR 111 7.861 0.828 -6.375 810 HG21 THR 111 HG21 THR 111 8.151 3.900 -8.062 811 HG22 THR 111 HG22 THR 111 8.205 4.410 -6.375 812 HG23 THR 111 HG23 THR 111 6.739 4.656 -7.323 813 H VAL 112 H VAL 112 4.927 4.593 -4.212 814 HA VAL 112 HA VAL 112 2.393 4.378 -5.699 815 HB VAL 112 HB VAL 112 3.148 6.102 -3.290 816 HG11 VAL 112 HG11 VAL 112 1.314 7.149 -4.563 817 HG12 VAL 112 HG12 VAL 112 0.712 6.509 -3.033 818 HG13 VAL 112 HG13 VAL 112 0.408 5.633 -4.532 819 HG21 VAL 112 HG21 VAL 112 3.176 3.694 -2.759 820 HG22 VAL 112 HG22 VAL 112 1.541 3.523 -3.402 821 HG23 VAL 112 HG23 VAL 112 1.820 4.499 -1.958 822 H LYS 113 H LYS 113 2.251 5.531 -7.550 823 HA LYS 113 HA LYS 113 3.658 8.139 -7.817 824 HB2 LYS 113 HB2 LYS 113 3.219 5.947 -9.897 825 HB3 LYS 113 HB3 LYS 113 3.974 7.508 -10.223 826 HG2 LYS 113 HG2 LYS 113 5.857 6.987 -8.799 827 HG3 LYS 113 HG3 LYS 113 5.060 5.543 -8.177 828 HD2 LYS 113 HD2 LYS 113 6.822 4.967 -9.786 829 HD3 LYS 113 HD3 LYS 113 5.235 4.474 -10.360 830 HE2 LYS 113 HE2 LYS 113 5.148 6.371 -11.873 831 HE3 LYS 113 HE3 LYS 113 6.673 6.992 -11.243 832 HZ1 LYS 113 HZ1 LYS 113 7.785 5.056 -12.107 833 HZ2 LYS 113 HZ2 LYS 113 6.931 5.821 -13.351 834 HZ3 LYS 113 HZ3 LYS 113 6.326 4.406 -12.650 835 H LEU 114 H LEU 114 2.230 9.744 -7.880 836 HA LEU 114 HA LEU 114 -0.531 9.352 -8.824 837 HB2 LEU 114 HB2 LEU 114 0.727 11.698 -7.356 838 HB3 LEU 114 HB3 LEU 114 -0.985 11.502 -7.705 839 HG LEU 114 HG LEU 114 0.649 9.691 -5.872 840 HD11 LEU 114 HD11 LEU 114 -1.419 11.801 -5.172 841 HD12 LEU 114 HD12 LEU 114 0.319 11.896 -4.880 842 HD13 LEU 114 HD13 LEU 114 -0.644 10.689 -4.037 843 HD21 LEU 114 HD21 LEU 114 -2.326 9.687 -6.443 844 HD22 LEU 114 HD22 LEU 114 -1.498 8.695 -5.238 845 HD23 LEU 114 HD23 LEU 114 -1.160 8.462 -6.951 846 H GLU 115 H GLU 115 -1.391 10.372 -10.589 847 HA GLU 115 HA GLU 115 0.309 12.258 -12.136 848 HB2 GLU 115 HB2 GLU 115 -1.711 10.236 -13.202 849 HB3 GLU 115 HB3 GLU 115 -0.831 11.409 -14.186 850 HG2 GLU 115 HG2 GLU 115 1.308 10.345 -13.433 851 HG3 GLU 115 HG3 GLU 115 0.358 9.104 -12.616 852 HA PRO 116 HA PRO 116 -3.205 15.081 -11.445 853 HB2 PRO 116 HB2 PRO 116 -2.244 17.227 -12.872 854 HB3 PRO 116 HB3 PRO 116 -1.672 16.807 -11.252 855 HG2 PRO 116 HG2 PRO 116 -0.402 16.238 -13.921 856 HG3 PRO 116 HG3 PRO 116 0.365 16.746 -12.404 857 HD2 PRO 116 HD2 PRO 116 0.363 14.146 -13.291 858 HD3 PRO 116 HD3 PRO 116 0.447 14.577 -11.573 859 H LEU 117 H LEU 117 -4.845 14.032 -12.570 860 HA LEU 117 HA LEU 117 -5.053 14.283 -15.510 861 HB2 LEU 117 HB2 LEU 117 -6.943 12.836 -13.620 862 HB3 LEU 117 HB3 LEU 117 -6.874 12.676 -15.368 863 HG LEU 117 HG LEU 117 -4.825 11.660 -13.356 864 HD11 LEU 117 HD11 LEU 117 -6.724 10.151 -15.183 865 HD12 LEU 117 HD12 LEU 117 -6.852 10.310 -13.429 866 HD13 LEU 117 HD13 LEU 117 -5.502 9.425 -14.133 867 HD21 LEU 117 HD21 LEU 117 -3.640 12.417 -15.359 868 HD22 LEU 117 HD22 LEU 117 -4.707 11.457 -16.386 869 HD23 LEU 117 HD23 LEU 117 -3.616 10.657 -15.251 870 H GLU 118 H GLU 118 -5.230 16.715 -14.230 871 HA GLU 118 HA GLU 118 -6.363 18.634 -13.980 872 HB2 GLU 118 HB2 GLU 118 -8.241 17.266 -15.934 873 HB3 GLU 118 HB3 GLU 118 -8.530 18.904 -15.374 874 HG2 GLU 118 HG2 GLU 118 -7.479 18.960 -17.544 875 HG3 GLU 118 HG3 GLU 118 -6.386 19.621 -16.337 876 H ASN 119 H ASN 119 -9.360 16.704 -14.169 877 HA ASN 119 HA ASN 119 -10.259 17.763 -11.597 878 HB2 ASN 119 HB2 ASN 119 -11.682 17.618 -13.746 879 HB3 ASN 119 HB3 ASN 119 -11.772 15.886 -13.460 880 HD21 ASN 119 HD21 ASN 119 -11.901 18.541 -11.086 881 HD22 ASN 119 HD22 ASN 119 -13.491 18.174 -10.529 882 H ARG 120 H ARG 120 -8.923 14.836 -12.902 883 HA ARG 120 HA ARG 120 -9.465 13.317 -10.398 884 HB2 ARG 120 HB2 ARG 120 -8.872 12.305 -13.215 885 HB3 ARG 120 HB3 ARG 120 -8.976 11.272 -11.789 886 HG2 ARG 120 HG2 ARG 120 -11.341 11.829 -11.510 887 HG3 ARG 120 HG3 ARG 120 -11.261 12.958 -12.872 888 HD2 ARG 120 HD2 ARG 120 -10.793 9.956 -13.010 889 HD3 ARG 120 HD3 ARG 120 -12.249 10.802 -13.543 890 HE ARG 120 HE ARG 120 -10.695 12.005 -15.135 891 HH11 ARG 120 HH11 ARG 120 -10.113 8.731 -14.191 892 HH12 ARG 120 HH12 ARG 120 -9.162 8.396 -15.591 893 HH21 ARG 120 HH21 ARG 120 -9.497 11.560 -16.892 894 HH22 ARG 120 HH22 ARG 120 -8.825 9.982 -17.119 895 H THR 121 H THR 121 -7.690 11.533 -10.131 896 HA THR 121 HA THR 121 -5.001 12.207 -11.058 897 HB THR 121 HB THR 121 -5.693 12.026 -8.085 898 HG1 THR 121 HG1 THR 121 -5.945 14.101 -8.990 899 HG21 THR 121 HG21 THR 121 -3.593 10.782 -8.471 900 HG22 THR 121 HG22 THR 121 -3.267 12.299 -7.633 901 HG23 THR 121 HG23 THR 121 -2.928 12.157 -9.359 902 H ARG 122 H ARG 122 -3.712 10.371 -11.317 903 HA ARG 122 HA ARG 122 -5.024 7.753 -10.866 904 HB2 ARG 122 HB2 ARG 122 -4.508 8.407 -13.221 905 HB3 ARG 122 HB3 ARG 122 -2.798 8.507 -12.810 906 HG2 ARG 122 HG2 ARG 122 -2.767 6.098 -12.306 907 HG3 ARG 122 HG3 ARG 122 -4.498 5.991 -12.661 908 HD2 ARG 122 HD2 ARG 122 -2.278 6.699 -14.613 909 HD3 ARG 122 HD3 ARG 122 -3.207 5.207 -14.565 910 HE ARG 122 HE ARG 122 -5.204 6.660 -15.077 911 HH11 ARG 122 HH11 ARG 122 -2.064 7.694 -16.082 912 HH12 ARG 122 HH12 ARG 122 -2.673 8.501 -17.484 913 HH21 ARG 122 HH21 ARG 122 -5.956 7.738 -16.827 914 HH22 ARG 122 HH22 ARG 122 -4.855 8.527 -17.900 915 H MET 123 H MET 123 -4.199 6.480 -9.321 916 HA MET 123 HA MET 123 -1.465 6.881 -8.283 917 HB2 MET 123 HB2 MET 123 -3.369 6.988 -6.655 918 HB3 MET 123 HB3 MET 123 -3.794 5.331 -7.059 919 HG2 MET 123 HG2 MET 123 -1.546 4.602 -6.240 920 HG3 MET 123 HG3 MET 123 -1.225 6.266 -5.756 921 HE1 MET 123 HE1 MET 123 -4.616 4.202 -5.483 922 HE2 MET 123 HE2 MET 123 -4.403 3.521 -3.872 923 HE3 MET 123 HE3 MET 123 -3.310 3.058 -5.171 924 H THR 124 H THR 124 -0.003 5.542 -9.208 925 HA THR 124 HA THR 124 -0.735 2.723 -9.795 926 HB THR 124 HB THR 124 1.560 4.335 -11.007 927 HG1 THR 124 HG1 THR 124 -0.065 5.054 -12.182 928 HG21 THR 124 HG21 THR 124 1.794 2.416 -12.568 929 HG22 THR 124 HG22 THR 124 0.538 1.543 -11.690 930 HG23 THR 124 HG23 THR 124 2.075 1.906 -10.900 931 H ILE 125 H ILE 125 -0.055 1.361 -8.220 932 HA ILE 125 HA ILE 125 2.357 2.002 -6.612 933 HB ILE 125 HB ILE 125 0.102 0.071 -5.909 934 HG12 ILE 125 HG12 ILE 125 0.574 2.925 -4.923 935 HG13 ILE 125 HG13 ILE 125 -0.758 2.390 -5.944 936 HG21 ILE 125 HG21 ILE 125 2.388 1.130 -4.191 937 HG22 ILE 125 HG22 ILE 125 2.254 -0.508 -4.836 938 HG23 ILE 125 HG23 ILE 125 1.093 0.062 -3.639 939 HD11 ILE 125 HD11 ILE 125 -1.565 0.975 -4.079 940 HD12 ILE 125 HD12 ILE 125 -1.519 2.691 -3.686 941 HD13 ILE 125 HD13 ILE 125 -0.269 1.616 -3.067 942 H ILE 126 H ILE 126 4.160 0.897 -7.253 943 HA ILE 126 HA ILE 126 3.880 -1.820 -8.416 944 HB ILE 126 HB ILE 126 6.354 -0.036 -8.690 945 HG12 ILE 126 HG12 ILE 126 5.458 0.241 -11.165 946 HG13 ILE 126 HG13 ILE 126 3.887 -0.139 -10.477 947 HG21 ILE 126 HG21 ILE 126 6.926 -1.561 -10.553 948 HG22 ILE 126 HG22 ILE 126 5.462 -2.497 -10.247 949 HG23 ILE 126 HG23 ILE 126 6.746 -2.440 -9.033 950 HD11 ILE 126 HD11 ILE 126 4.075 1.823 -9.017 951 HD12 ILE 126 HD12 ILE 126 4.199 2.242 -10.724 952 HD13 ILE 126 HD13 ILE 126 5.652 2.188 -9.723 953 H SER 127 H SER 127 4.144 -3.283 -6.814 954 HA SER 127 HA SER 127 5.984 -2.891 -4.565 955 HB2 SER 127 HB2 SER 127 3.745 -4.934 -4.968 956 HB3 SER 127 HB3 SER 127 4.656 -4.679 -3.477 957 HG SER 127 HG SER 127 3.332 -3.116 -3.021 958 H THR 128 H THR 128 7.996 -3.757 -4.842 959 HA THR 128 HA THR 128 8.409 -6.136 -6.551 960 HB THR 128 HB THR 128 10.832 -5.466 -6.521 961 HG1 THR 128 HG1 THR 128 11.478 -3.979 -5.166 962 HG21 THR 128 HG21 THR 128 10.596 -3.465 -7.951 963 HG22 THR 128 HG22 THR 128 8.939 -3.244 -7.384 964 HG23 THR 128 HG23 THR 128 9.360 -4.664 -8.345 965 H PHE 129 H PHE 129 8.864 -8.030 -5.699 966 HA PHE 129 HA PHE 129 9.348 -8.420 -2.845 967 HB2 PHE 129 HB2 PHE 129 8.708 -10.494 -4.998 968 HB3 PHE 129 HB3 PHE 129 8.628 -10.729 -3.252 969 HD1 PHE 129 HD1 PHE 129 6.862 -9.438 -1.921 970 HD2 PHE 129 HD2 PHE 129 6.819 -9.604 -6.191 971 HE1 PHE 129 HE1 PHE 129 4.518 -8.699 -1.933 972 HE2 PHE 129 HE2 PHE 129 4.474 -8.873 -6.191 973 HZ PHE 129 HZ PHE 129 3.322 -8.408 -4.066 974 H GLU 130 H GLU 130 11.049 -9.854 -2.085 975 HA GLU 130 HA GLU 130 13.578 -9.306 -3.279 976 HB2 GLU 130 HB2 GLU 130 12.890 -11.225 -1.021 977 HB3 GLU 130 HB3 GLU 130 14.517 -10.682 -1.432 978 HG2 GLU 130 HG2 GLU 130 13.837 -8.347 -0.889 979 HG3 GLU 130 HG3 GLU 130 12.247 -8.945 -0.404 980 H SER 131 H SER 131 11.600 -12.273 -3.157 981 HA SER 131 HA SER 131 13.190 -13.511 -5.288 982 HB2 SER 131 HB2 SER 131 12.828 -14.830 -2.558 983 HB3 SER 131 HB3 SER 131 13.430 -15.672 -3.990 984 HG SER 131 HG SER 131 15.024 -13.762 -3.955 985 H GLU 132 H GLU 132 12.215 -15.562 -6.049 986 HA GLU 132 HA GLU 132 9.509 -15.336 -6.731 987 HB2 GLU 132 HB2 GLU 132 11.166 -16.607 -8.073 988 HB3 GLU 132 HB3 GLU 132 11.274 -17.821 -6.800 989 HG2 GLU 132 HG2 GLU 132 8.822 -18.310 -7.157 990 HG3 GLU 132 HG3 GLU 132 8.855 -17.207 -8.531 991 H GLU 133 H GLU 133 11.069 -17.372 -4.242 992 HA GLU 133 HA GLU 133 8.850 -18.826 -3.333 993 HB2 GLU 133 HB2 GLU 133 10.144 -19.208 -1.265 994 HB3 GLU 133 HB3 GLU 133 11.154 -19.383 -2.697 995 HG2 GLU 133 HG2 GLU 133 12.070 -17.098 -2.303 996 HG3 GLU 133 HG3 GLU 133 11.090 -16.978 -0.842 997 H GLN 134 H GLN 134 9.850 -15.524 -2.528 998 HA GLN 134 HA GLN 134 7.958 -15.062 -0.410 999 HB2 GLN 134 HB2 GLN 134 9.983 -13.662 -0.677 1000 HB3 GLN 134 HB3 GLN 134 9.409 -13.094 -2.245 1001 HG2 GLN 134 HG2 GLN 134 7.449 -12.038 -1.099 1002 HG3 GLN 134 HG3 GLN 134 8.118 -12.551 0.450 1003 HE21 GLN 134 HE21 GLN 134 7.551 -9.852 -0.439 1004 HE22 GLN 134 HE22 GLN 134 9.050 -8.999 -0.386 1005 H MET 135 H MET 135 8.154 -14.199 -3.829 1006 HA MET 135 HA MET 135 5.756 -12.896 -4.294 1007 HB2 MET 135 HB2 MET 135 7.656 -12.965 -5.838 1008 HB3 MET 135 HB3 MET 135 7.424 -14.687 -6.101 1009 HG2 MET 135 HG2 MET 135 6.655 -13.343 -7.983 1010 HG3 MET 135 HG3 MET 135 5.335 -14.261 -7.249 1011 HE1 MET 135 HE1 MET 135 6.094 -11.002 -8.815 1012 HE2 MET 135 HE2 MET 135 4.538 -10.249 -8.464 1013 HE3 MET 135 HE3 MET 135 4.591 -11.853 -9.193 1014 H GLN 136 H GLN 136 6.375 -16.387 -4.203 1015 HA GLN 136 HA GLN 136 3.781 -17.255 -5.085 1016 HB2 GLN 136 HB2 GLN 136 5.891 -18.747 -3.469 1017 HB3 GLN 136 HB3 GLN 136 4.473 -19.486 -4.203 1018 HG2 GLN 136 HG2 GLN 136 6.839 -18.255 -5.631 1019 HG3 GLN 136 HG3 GLN 136 6.429 -19.962 -5.534 1020 HE21 GLN 136 HE21 GLN 136 5.823 -16.972 -7.136 1021 HE22 GLN 136 HE22 GLN 136 4.759 -17.585 -8.350 1022 H LYS 137 H LYS 137 5.349 -17.021 -1.856 1023 HA LYS 137 HA LYS 137 3.166 -18.077 -0.387 1024 HB2 LYS 137 HB2 LYS 137 5.535 -18.111 0.409 1025 HB3 LYS 137 HB3 LYS 137 5.456 -16.372 0.674 1026 HG2 LYS 137 HG2 LYS 137 5.163 -17.677 2.775 1027 HG3 LYS 137 HG3 LYS 137 3.774 -16.653 2.409 1028 HD2 LYS 137 HD2 LYS 137 2.581 -18.629 1.478 1029 HD3 LYS 137 HD3 LYS 137 3.958 -19.651 1.902 1030 HE2 LYS 137 HE2 LYS 137 2.398 -18.031 3.941 1031 HE3 LYS 137 HE3 LYS 137 1.994 -19.695 3.515 1032 HZ1 LYS 137 HZ1 LYS 137 4.236 -20.345 4.218 1033 HZ2 LYS 137 HZ2 LYS 137 3.346 -19.650 5.474 1034 HZ3 LYS 137 HZ3 LYS 137 4.543 -18.755 4.698 1035 H MET 138 H MET 138 3.983 -14.761 -1.260 1036 HA MET 138 HA MET 138 2.071 -13.288 0.149 1037 HB2 MET 138 HB2 MET 138 2.989 -12.956 -2.740 1038 HB3 MET 138 HB3 MET 138 2.083 -11.744 -1.849 1039 HG2 MET 138 HG2 MET 138 4.772 -12.690 -0.864 1040 HG3 MET 138 HG3 MET 138 4.636 -11.456 -2.108 1041 HE1 MET 138 HE1 MET 138 3.622 -10.925 2.351 1042 HE2 MET 138 HE2 MET 138 4.552 -12.247 1.651 1043 HE3 MET 138 HE3 MET 138 2.802 -12.186 1.433 1044 H ALA 139 H ALA 139 1.759 -14.969 -2.956 1045 HA ALA 139 HA ALA 139 -1.005 -14.413 -3.386 1046 HB1 ALA 139 HB1 ALA 139 0.566 -14.775 -5.207 1047 HB2 ALA 139 HB2 ALA 139 -0.770 -15.927 -5.303 1048 HB3 ALA 139 HB3 ALA 139 0.809 -16.455 -4.701 1049 H GLU 140 H GLU 140 0.668 -17.065 -1.767 1050 HA GLU 140 HA GLU 140 -1.513 -18.882 -1.558 1051 HB2 GLU 140 HB2 GLU 140 0.763 -18.509 0.438 1052 HB3 GLU 140 HB3 GLU 140 -0.277 -19.921 0.293 1053 HG2 GLU 140 HG2 GLU 140 1.819 -18.976 -1.681 1054 HG3 GLU 140 HG3 GLU 140 1.888 -20.411 -0.664 1055 H MET 141 H MET 141 -0.518 -16.096 0.379 1056 HA MET 141 HA MET 141 -2.669 -16.349 2.329 1057 HB2 MET 141 HB2 MET 141 -0.706 -14.082 1.794 1058 HB3 MET 141 HB3 MET 141 -1.814 -14.157 3.159 1059 HG2 MET 141 HG2 MET 141 -0.633 -16.226 3.939 1060 HG3 MET 141 HG3 MET 141 0.505 -16.023 2.610 1061 HE1 MET 141 HE1 MET 141 0.094 -12.851 5.973 1062 HE2 MET 141 HE2 MET 141 -0.989 -14.237 5.837 1063 HE3 MET 141 HE3 MET 141 -1.045 -12.948 4.632 1064 H GLY 142 H GLY 142 -2.195 -14.751 -0.755 1065 HA2 GLY 142 HA2 GLY 142 -3.804 -13.745 -2.123 1066 HA3 GLY 142 HA3 GLY 142 -4.935 -13.712 -0.775 1067 H MET 143 H MET 143 -1.633 -12.465 -1.096 1068 HA MET 143 HA MET 143 -2.173 -10.050 0.346 1069 HB2 MET 143 HB2 MET 143 -0.002 -11.343 0.399 1070 HB3 MET 143 HB3 MET 143 0.321 -10.815 -1.243 1071 HG2 MET 143 HG2 MET 143 -0.020 -8.897 1.076 1072 HG3 MET 143 HG3 MET 143 1.532 -9.571 0.589 1073 HE1 MET 143 HE1 MET 143 2.669 -7.237 0.225 1074 HE2 MET 143 HE2 MET 143 1.199 -6.465 0.826 1075 HE3 MET 143 HE3 MET 143 1.928 -5.915 -0.683 1076 H GLU 144 H GLU 144 -1.635 -10.861 -3.077 1077 HA GLU 144 HA GLU 144 -1.518 -8.260 -4.120 1078 HB2 GLU 144 HB2 GLU 144 -1.990 -9.174 -6.319 1079 HB3 GLU 144 HB3 GLU 144 -0.846 -10.198 -5.471 1080 HG2 GLU 144 HG2 GLU 144 -3.776 -10.909 -5.442 1081 HG3 GLU 144 HG3 GLU 144 -2.824 -11.233 -6.888 1082 H GLU 145 H GLU 145 -4.298 -10.385 -3.517 1083 HA GLU 145 HA GLU 145 -6.316 -8.594 -4.488 1084 HB2 GLU 145 HB2 GLU 145 -6.776 -11.005 -4.325 1085 HB3 GLU 145 HB3 GLU 145 -6.530 -10.968 -2.580 1086 HG2 GLU 145 HG2 GLU 145 -8.499 -9.492 -2.334 1087 HG3 GLU 145 HG3 GLU 145 -8.738 -9.511 -4.080 1088 H GLY 146 H GLY 146 -4.900 -9.262 -1.280 1089 HA2 GLY 146 HA2 GLY 146 -6.686 -7.993 0.430 1090 HA3 GLY 146 HA3 GLY 146 -4.974 -8.186 0.743 1091 H MET 147 H MET 147 -3.793 -6.540 -1.106 1092 HA MET 147 HA MET 147 -4.297 -3.910 -0.029 1093 HB2 MET 147 HB2 MET 147 -1.989 -4.819 -0.648 1094 HB3 MET 147 HB3 MET 147 -2.422 -4.578 -2.333 1095 HG2 MET 147 HG2 MET 147 -2.674 -2.163 -1.939 1096 HG3 MET 147 HG3 MET 147 -2.309 -2.395 -0.231 1097 HE1 MET 147 HE1 MET 147 -0.908 -2.390 -3.879 1098 HE2 MET 147 HE2 MET 147 -0.599 -4.061 -3.405 1099 HE3 MET 147 HE3 MET 147 0.750 -2.948 -3.646 1100 H ARG 148 H ARG 148 -5.197 -5.596 -3.000 1101 HA ARG 148 HA ARG 148 -5.916 -3.336 -4.586 1102 HB2 ARG 148 HB2 ARG 148 -5.564 -5.815 -5.327 1103 HB3 ARG 148 HB3 ARG 148 -7.228 -6.078 -4.836 1104 HG2 ARG 148 HG2 ARG 148 -6.413 -4.011 -6.910 1105 HG3 ARG 148 HG3 ARG 148 -6.809 -5.676 -7.321 1106 HD2 ARG 148 HD2 ARG 148 -8.689 -3.670 -6.022 1107 HD3 ARG 148 HD3 ARG 148 -8.701 -4.145 -7.723 1108 HE ARG 148 HE ARG 148 -9.136 -6.184 -5.635 1109 HH11 ARG 148 HH11 ARG 148 -10.476 -4.347 -8.261 1110 HH12 ARG 148 HH12 ARG 148 -11.860 -5.368 -8.395 1111 HH21 ARG 148 HH21 ARG 148 -10.929 -7.443 -5.815 1112 HH22 ARG 148 HH22 ARG 148 -12.111 -7.101 -7.026 1113 H GLU 149 H GLU 149 -7.772 -5.411 -2.348 1114 HA GLU 149 HA GLU 149 -10.321 -4.228 -2.628 1115 HB2 GLU 149 HB2 GLU 149 -9.193 -5.513 -0.097 1116 HB3 GLU 149 HB3 GLU 149 -10.899 -5.275 -0.477 1117 HG2 GLU 149 HG2 GLU 149 -8.949 -7.226 -1.722 1118 HG3 GLU 149 HG3 GLU 149 -10.427 -7.576 -0.834 1119 H ALA 150 H ALA 150 -7.623 -3.492 -0.450 1120 HA ALA 150 HA ALA 150 -8.662 -1.380 1.061 1121 HB1 ALA 150 HB1 ALA 150 -5.832 -1.718 -0.007 1122 HB2 ALA 150 HB2 ALA 150 -6.472 -2.452 1.467 1123 HB3 ALA 150 HB3 ALA 150 -6.310 -0.698 1.359 1124 H ILE 151 H ILE 151 -7.184 -1.338 -2.167 1125 HA ILE 151 HA ILE 151 -7.323 1.512 -2.535 1126 HB ILE 151 HB ILE 151 -6.686 -0.724 -4.502 1127 HG12 ILE 151 HG12 ILE 151 -4.816 1.181 -3.010 1128 HG13 ILE 151 HG13 ILE 151 -5.122 -0.484 -2.533 1129 HG21 ILE 151 HG21 ILE 151 -7.415 1.276 -5.735 1130 HG22 ILE 151 HG22 ILE 151 -5.684 1.020 -5.951 1131 HG23 ILE 151 HG23 ILE 151 -6.261 2.267 -4.843 1132 HD11 ILE 151 HD11 ILE 151 -3.794 0.432 -5.077 1133 HD12 ILE 151 HD12 ILE 151 -4.138 -1.247 -4.655 1134 HD13 ILE 151 HD13 ILE 151 -3.017 -0.303 -3.676 1135 H GLU 152 H GLU 152 -9.498 -1.147 -3.255 1136 HA GLU 152 HA GLU 152 -11.342 0.265 -4.915 1137 HB2 GLU 152 HB2 GLU 152 -11.699 -2.122 -3.057 1138 HB3 GLU 152 HB3 GLU 152 -13.007 -1.502 -4.064 1139 HG2 GLU 152 HG2 GLU 152 -10.358 -2.574 -5.108 1140 HG3 GLU 152 HG3 GLU 152 -11.872 -3.473 -5.057 1141 H GLN 153 H GLN 153 -10.791 0.218 -1.445 1142 HA GLN 153 HA GLN 153 -13.286 1.527 -0.703 1143 HB2 GLN 153 HB2 GLN 153 -10.760 1.025 0.918 1144 HB3 GLN 153 HB3 GLN 153 -12.313 1.552 1.574 1145 HG2 GLN 153 HG2 GLN 153 -13.344 -0.554 1.012 1146 HG3 GLN 153 HG3 GLN 153 -11.923 -1.071 0.107 1147 HE21 GLN 153 HE21 GLN 153 -11.916 0.512 3.276 1148 HE22 GLN 153 HE22 GLN 153 -11.241 -0.835 4.122 1149 H ILE 154 H ILE 154 -10.094 2.577 -1.656 1150 HA ILE 154 HA ILE 154 -9.964 5.150 -0.515 1151 HB ILE 154 HB ILE 154 -8.870 4.220 -3.203 1152 HG12 ILE 154 HG12 ILE 154 -7.543 4.387 -0.464 1153 HG13 ILE 154 HG13 ILE 154 -8.001 2.908 -1.303 1154 HG21 ILE 154 HG21 ILE 154 -8.960 6.678 -3.142 1155 HG22 ILE 154 HG22 ILE 154 -7.289 6.126 -3.063 1156 HG23 ILE 154 HG23 ILE 154 -8.102 6.690 -1.600 1157 HD11 ILE 154 HD11 ILE 154 -5.889 4.877 -2.169 1158 HD12 ILE 154 HD12 ILE 154 -6.365 3.434 -3.067 1159 HD13 ILE 154 HD13 ILE 154 -5.635 3.282 -1.471 1160 H ASP 155 H ASP 155 -11.810 3.985 -3.278 1161 HA ASP 155 HA ASP 155 -12.616 6.413 -4.455 1162 HB2 ASP 155 HB2 ASP 155 -12.972 4.076 -5.378 1163 HB3 ASP 155 HB3 ASP 155 -14.256 3.855 -4.193 1164 H ALA 156 H ALA 156 -14.128 4.454 -1.892 1165 HA ALA 156 HA ALA 156 -16.253 6.212 -1.196 1166 HB1 ALA 156 HB1 ALA 156 -14.886 4.071 0.502 1167 HB2 ALA 156 HB2 ALA 156 -16.226 3.803 -0.620 1168 HB3 ALA 156 HB3 ALA 156 -16.472 4.796 0.818 1169 H VAL 157 H VAL 157 -12.865 6.176 -0.239 1170 HA VAL 157 HA VAL 157 -13.157 7.958 2.027 1171 HB VAL 157 HB VAL 157 -10.670 7.154 0.444 1172 HG11 VAL 157 HG11 VAL 157 -9.341 8.041 2.352 1173 HG12 VAL 157 HG12 VAL 157 -10.819 8.668 3.086 1174 HG13 VAL 157 HG13 VAL 157 -10.253 9.321 1.545 1175 HG21 VAL 157 HG21 VAL 157 -11.701 6.168 3.137 1176 HG22 VAL 157 HG22 VAL 157 -10.181 5.685 2.380 1177 HG23 VAL 157 HG23 VAL 157 -11.716 5.257 1.622 1178 H LEU 158 H LEU 158 -12.091 8.399 -1.381 1179 HA LEU 158 HA LEU 158 -11.527 11.232 -0.979 1180 HB2 LEU 158 HB2 LEU 158 -11.284 9.485 -3.460 1181 HB3 LEU 158 HB3 LEU 158 -10.783 11.171 -3.373 1182 HG LEU 158 HG LEU 158 -9.573 8.853 -1.809 1183 HD11 LEU 158 HD11 LEU 158 -8.904 8.850 -4.145 1184 HD12 LEU 158 HD12 LEU 158 -7.547 9.294 -3.114 1185 HD13 LEU 158 HD13 LEU 158 -8.396 10.539 -4.037 1186 HD21 LEU 158 HD21 LEU 158 -8.813 11.790 -1.728 1187 HD22 LEU 158 HD22 LEU 158 -7.928 10.472 -0.952 1188 HD23 LEU 158 HD23 LEU 158 -9.563 10.863 -0.428 1189 H SER 159 H SER 159 -14.094 9.314 -2.388 1190 HA SER 159 HA SER 159 -15.452 11.661 -3.531 1191 HB2 SER 159 HB2 SER 159 -15.559 9.352 -4.627 1192 HB3 SER 159 HB3 SER 159 -16.530 8.813 -3.273 1193 HG SER 159 HG SER 159 -17.197 10.937 -5.044 1194 H GLU 160 H GLU 160 -16.018 9.161 -1.106 1195 HA GLU 160 HA GLU 160 -17.648 8.773 0.400 1196 HB2 GLU 160 HB2 GLU 160 -15.764 9.962 1.548 1197 HB3 GLU 160 HB3 GLU 160 -16.743 11.423 1.512 1198 HG2 GLU 160 HG2 GLU 160 -18.470 10.330 2.832 1199 HG3 GLU 160 HG3 GLU 160 -17.570 8.822 2.816 1200 HA PRO 161 HA PRO 161 -21.378 11.168 -0.702 1201 HB2 PRO 161 HB2 PRO 161 -22.863 9.129 -1.638 1202 HB3 PRO 161 HB3 PRO 161 -21.573 9.810 -2.647 1203 HG2 PRO 161 HG2 PRO 161 -21.509 7.333 -0.911 1204 HG3 PRO 161 HG3 PRO 161 -20.964 7.527 -2.591 1205 HD2 PRO 161 HD2 PRO 161 -19.264 7.669 -0.409 1206 HD3 PRO 161 HD3 PRO 161 -18.944 8.495 -1.953 1207 H ALA 162 H ALA 162 -23.751 9.532 -0.114 1208 HA ALA 162 HA ALA 162 -23.546 9.292 2.830 1209 HB1 ALA 162 HB1 ALA 162 -25.177 10.935 1.975 1210 HB2 ALA 162 HB2 ALA 162 -25.979 9.635 2.857 1211 HB3 ALA 162 HB3 ALA 162 -26.009 9.653 1.090 1212 H ASN 163 H ASN 163 -22.982 7.190 0.568 1213 HA ASN 163 HA ASN 163 -24.045 4.884 1.957 1214 HB2 ASN 163 HB2 ASN 163 -25.420 4.027 0.092 1215 HB3 ASN 163 HB3 ASN 163 -26.052 5.536 0.712 1216 HD21 ASN 163 HD21 ASN 163 -26.296 4.162 -1.938 1217 HD22 ASN 163 HD22 ASN 163 -25.855 5.366 -3.094 1218 H ALA 164 H ALA 164 -21.428 5.876 1.069 1219 HA ALA 164 HA ALA 164 -19.410 4.996 0.574 1220 HB1 ALA 164 HB1 ALA 164 -20.814 2.374 0.034 1221 HB2 ALA 164 HB2 ALA 164 -20.214 2.911 1.603 1222 HB3 ALA 164 HB3 ALA 164 -19.078 2.596 0.288 1223 H LEU 165 H LEU 165 -21.427 3.246 -1.829 1224 HA LEU 165 HA LEU 165 -21.390 3.063 -4.078 1225 HB2 LEU 165 HB2 LEU 165 -20.886 6.034 -3.801 1226 HB3 LEU 165 HB3 LEU 165 -21.153 5.274 -5.361 1227 HG LEU 165 HG LEU 165 -23.134 5.387 -3.059 1228 HD11 LEU 165 HD11 LEU 165 -23.193 6.754 -5.773 1229 HD12 LEU 165 HD12 LEU 165 -22.888 7.530 -4.215 1230 HD13 LEU 165 HD13 LEU 165 -24.463 6.816 -4.545 1231 HD21 LEU 165 HD21 LEU 165 -24.748 4.304 -4.588 1232 HD22 LEU 165 HD22 LEU 165 -23.380 3.253 -4.238 1233 HD23 LEU 165 HD23 LEU 165 -23.471 4.087 -5.792 1234 H GLU 166 H GLU 166 -18.976 2.177 -3.026 1235 HA GLU 166 HA GLU 166 -16.704 2.941 -4.502 1236 HB2 GLU 166 HB2 GLU 166 -15.762 0.771 -3.976 1237 HB3 GLU 166 HB3 GLU 166 -16.677 1.312 -2.579 1238 HG2 GLU 166 HG2 GLU 166 -17.550 -0.798 -4.592 1239 HG3 GLU 166 HG3 GLU 166 -16.970 -1.098 -2.956 1240 H HIS 167 H HIS 167 -16.000 2.469 -6.612 1241 HA HIS 167 HA HIS 167 -17.990 1.696 -8.537 1242 HB2 HIS 167 HB2 HIS 167 -16.139 3.430 -8.927 1243 HB3 HIS 167 HB3 HIS 167 -15.029 2.077 -9.133 1244 HD1 HIS 167 HD1 HIS 167 -18.010 3.727 -10.735 1245 HD2 HIS 167 HD2 HIS 167 -15.213 0.775 -11.632 1246 HE1 HIS 167 HE1 HIS 167 -18.395 3.144 -13.144 1247 HE2 HIS 167 HE2 HIS 167 -16.787 1.279 -13.631 1248 H HIS 168 H HIS 168 -18.476 -0.393 -7.724 1249 HA HIS 168 HA HIS 168 -16.617 -2.596 -7.928 1250 HB2 HIS 168 HB2 HIS 168 -18.644 -3.990 -7.302 1251 HB3 HIS 168 HB3 HIS 168 -18.268 -2.710 -6.157 1252 HD1 HIS 168 HD1 HIS 168 -19.937 -0.686 -6.051 1253 HD2 HIS 168 HD2 HIS 168 -21.170 -3.791 -8.522 1254 HE1 HIS 168 HE1 HIS 168 -22.330 -0.194 -6.603 1255 HE2 HIS 168 HE2 HIS 168 -23.085 -2.128 -8.016 1256 H HIS 169 H HIS 169 -16.076 -3.458 -9.829 1257 HA HIS 169 HA HIS 169 -18.039 -4.338 -11.757 1258 HB2 HIS 169 HB2 HIS 169 -17.737 -1.934 -12.414 1259 HB3 HIS 169 HB3 HIS 169 -16.013 -2.213 -12.631 1260 HD1 HIS 169 HD1 HIS 169 -15.320 -2.868 -14.953 1261 HD2 HIS 169 HD2 HIS 169 -19.374 -3.528 -14.300 1262 HE1 HIS 169 HE1 HIS 169 -16.250 -3.576 -17.167 1263 HE2 HIS 169 HE2 HIS 169 -18.718 -3.809 -16.787 1264 H HIS 170 H HIS 170 -17.320 -6.362 -12.140 1265 HA HIS 170 HA HIS 170 -14.614 -7.202 -11.671 1266 HB2 HIS 170 HB2 HIS 170 -17.007 -8.678 -12.842 1267 HB3 HIS 170 HB3 HIS 170 -15.456 -9.446 -12.517 1268 HD1 HIS 170 HD1 HIS 170 -18.639 -8.678 -10.940 1269 HD2 HIS 170 HD2 HIS 170 -14.747 -9.350 -9.648 1270 HE1 HIS 170 HE1 HIS 170 -18.826 -9.200 -8.495 1271 HE2 HIS 170 HE2 HIS 170 -16.490 -9.806 -7.794 1272 H HIS 171 H HIS 171 -12.949 -7.444 -13.041 1273 HA HIS 171 HA HIS 171 -13.305 -7.509 -15.949 1274 HB2 HIS 171 HB2 HIS 171 -11.494 -5.705 -16.214 1275 HB3 HIS 171 HB3 HIS 171 -13.074 -5.145 -15.692 1276 HD1 HIS 171 HD1 HIS 171 -13.274 -4.194 -13.306 1277 HD2 HIS 171 HD2 HIS 171 -9.419 -5.362 -14.309 1278 HE1 HIS 171 HE1 HIS 171 -11.805 -3.207 -11.543 1279 HE2 HIS 171 HE2 HIS 171 -9.473 -3.813 -12.235 1280 H HIS 172 H HIS 172 -11.311 -8.077 -17.100 1281 HA HIS 172 HA HIS 172 -10.102 -10.362 -15.732 1282 HB2 HIS 172 HB2 HIS 172 -9.999 -9.507 -18.658 1283 HB3 HIS 172 HB3 HIS 172 -9.404 -11.040 -18.022 1284 HD1 HIS 172 HD1 HIS 172 -11.082 -12.917 -17.849 1285 HD2 HIS 172 HD2 HIS 172 -12.901 -9.242 -18.510 1286 HE1 HIS 172 HE1 HIS 172 -13.498 -13.428 -18.281 1287 HE2 HIS 172 HE2 HIS 172 -14.610 -11.183 -18.463 Start of MODEL 7 1 H1 THR 1 H1 THR 1 -12.797 1.208 -7.441 2 H2 THR 1 H2 THR 1 -12.992 2.841 -7.819 3 H3 THR 1 H3 THR 1 -11.490 2.276 -7.300 4 HA THR 1 HA THR 1 -12.877 1.527 -9.797 5 HB THR 1 HB THR 1 -10.838 2.669 -10.895 6 HG1 THR 1 HG1 THR 1 -10.543 4.408 -8.775 7 HG21 THR 1 HG21 THR 1 -11.814 4.917 -10.801 8 HG22 THR 1 HG22 THR 1 -12.780 4.461 -9.395 9 HG23 THR 1 HG23 THR 1 -13.081 3.697 -10.960 10 H VAL 2 H VAL 2 -9.426 1.582 -8.785 11 HA VAL 2 HA VAL 2 -7.742 0.342 -9.638 12 HB VAL 2 HB VAL 2 -9.519 -1.992 -8.803 13 HG11 VAL 2 HG11 VAL 2 -7.721 -2.757 -10.302 14 HG12 VAL 2 HG12 VAL 2 -7.402 -3.291 -8.652 15 HG13 VAL 2 HG13 VAL 2 -6.517 -1.917 -9.321 16 HG21 VAL 2 HG21 VAL 2 -9.067 -0.422 -6.944 17 HG22 VAL 2 HG22 VAL 2 -7.332 -0.541 -7.255 18 HG23 VAL 2 HG23 VAL 2 -8.228 -1.955 -6.692 19 H VAL 3 H VAL 3 -8.017 1.139 -11.729 20 HA VAL 3 HA VAL 3 -9.900 0.041 -13.608 21 HB VAL 3 HB VAL 3 -8.925 1.689 -15.225 22 HG11 VAL 3 HG11 VAL 3 -9.570 2.863 -12.487 23 HG12 VAL 3 HG12 VAL 3 -10.751 2.394 -13.714 24 HG13 VAL 3 HG13 VAL 3 -9.643 3.733 -14.023 25 HG21 VAL 3 HG21 VAL 3 -6.564 1.651 -14.458 26 HG22 VAL 3 HG22 VAL 3 -7.039 2.426 -12.944 27 HG23 VAL 3 HG23 VAL 3 -7.197 3.300 -14.470 28 H SER 4 H SER 4 -6.624 -0.714 -12.821 29 HA SER 4 HA SER 4 -6.605 -2.959 -14.651 30 HB2 SER 4 HB2 SER 4 -5.735 -1.147 -16.133 31 HB3 SER 4 HB3 SER 4 -4.470 -0.790 -14.958 32 HG SER 4 HG SER 4 -4.539 -2.687 -16.880 33 H VAL 5 H VAL 5 -5.071 -4.548 -14.020 34 HA VAL 5 HA VAL 5 -3.318 -3.970 -11.694 35 HB VAL 5 HB VAL 5 -4.896 -6.578 -12.008 36 HG11 VAL 5 HG11 VAL 5 -2.738 -6.896 -10.845 37 HG12 VAL 5 HG12 VAL 5 -4.078 -7.079 -9.710 38 HG13 VAL 5 HG13 VAL 5 -3.133 -5.589 -9.722 39 HG21 VAL 5 HG21 VAL 5 -5.397 -4.313 -10.050 40 HG22 VAL 5 HG22 VAL 5 -6.237 -5.867 -10.070 41 HG23 VAL 5 HG23 VAL 5 -6.426 -4.742 -11.420 42 H ASP 6 H ASP 6 -1.377 -4.016 -12.721 43 HA ASP 6 HA ASP 6 -0.567 -6.114 -14.556 44 HB2 ASP 6 HB2 ASP 6 1.172 -4.023 -13.166 45 HB3 ASP 6 HB3 ASP 6 1.591 -4.956 -14.602 46 H LYS 7 H LYS 7 0.334 -8.036 -13.929 47 HA LYS 7 HA LYS 7 1.966 -8.146 -11.458 48 HB2 LYS 7 HB2 LYS 7 -0.220 -9.269 -11.037 49 HB3 LYS 7 HB3 LYS 7 0.061 -10.333 -12.413 50 HG2 LYS 7 HG2 LYS 7 2.103 -11.214 -11.246 51 HG3 LYS 7 HG3 LYS 7 1.686 -10.222 -9.843 52 HD2 LYS 7 HD2 LYS 7 -0.449 -11.461 -9.610 53 HD3 LYS 7 HD3 LYS 7 -0.043 -12.436 -11.028 54 HE2 LYS 7 HE2 LYS 7 1.975 -13.282 -9.810 55 HE3 LYS 7 HE3 LYS 7 1.462 -12.378 -8.383 56 HZ1 LYS 7 HZ1 LYS 7 -0.610 -13.674 -8.423 57 HZ2 LYS 7 HZ2 LYS 7 0.763 -14.637 -8.199 58 HZ3 LYS 7 HZ3 LYS 7 -0.002 -14.591 -9.706 59 H ASP 8 H ASP 8 3.996 -8.821 -11.883 60 HA ASP 8 HA ASP 8 4.483 -10.735 -14.088 61 HB2 ASP 8 HB2 ASP 8 5.198 -8.245 -14.553 62 HB3 ASP 8 HB3 ASP 8 6.514 -8.568 -13.433 63 H VAL 9 H VAL 9 5.038 -12.546 -13.114 64 HA VAL 9 HA VAL 9 6.136 -12.758 -10.471 65 HB VAL 9 HB VAL 9 5.661 -14.883 -12.609 66 HG11 VAL 9 HG11 VAL 9 7.313 -15.733 -10.998 67 HG12 VAL 9 HG12 VAL 9 5.772 -16.558 -10.767 68 HG13 VAL 9 HG13 VAL 9 6.265 -15.285 -9.649 69 HG21 VAL 9 HG21 VAL 9 3.952 -14.082 -10.218 70 HG22 VAL 9 HG22 VAL 9 3.603 -15.409 -11.329 71 HG23 VAL 9 HG23 VAL 9 3.589 -13.745 -11.915 72 H GLU 10 H GLU 10 7.460 -12.851 -13.725 73 HA GLU 10 HA GLU 10 9.993 -14.049 -13.056 74 HB2 GLU 10 HB2 GLU 10 9.263 -12.424 -15.529 75 HB3 GLU 10 HB3 GLU 10 10.608 -13.553 -15.369 76 HG2 GLU 10 HG2 GLU 10 7.646 -14.225 -15.409 77 HG3 GLU 10 HG3 GLU 10 8.832 -14.582 -16.662 78 H ALA 11 H ALA 11 8.864 -10.728 -13.592 79 HA ALA 11 HA ALA 11 11.441 -9.509 -12.942 80 HB1 ALA 11 HB1 ALA 11 8.747 -8.215 -13.532 81 HB2 ALA 11 HB2 ALA 11 10.021 -8.528 -14.713 82 HB3 ALA 11 HB3 ALA 11 10.298 -7.375 -13.407 83 H LEU 12 H LEU 12 8.965 -10.797 -11.122 84 HA LEU 12 HA LEU 12 8.249 -10.719 -8.987 85 HB2 LEU 12 HB2 LEU 12 10.967 -9.419 -8.595 86 HB3 LEU 12 HB3 LEU 12 9.944 -9.934 -7.260 87 HG LEU 12 HG LEU 12 11.087 -11.775 -9.402 88 HD11 LEU 12 HD11 LEU 12 12.519 -12.675 -7.618 89 HD12 LEU 12 HD12 LEU 12 11.901 -11.465 -6.490 90 HD13 LEU 12 HD13 LEU 12 12.844 -10.964 -7.897 91 HD21 LEU 12 HD21 LEU 12 8.906 -12.542 -8.586 92 HD22 LEU 12 HD22 LEU 12 9.472 -12.433 -6.917 93 HD23 LEU 12 HD23 LEU 12 10.197 -13.602 -8.023 94 H SER 13 H SER 13 7.356 -8.523 -10.630 95 HA SER 13 HA SER 13 6.997 -6.356 -8.630 96 HB2 SER 13 HB2 SER 13 8.053 -5.578 -10.724 97 HB3 SER 13 HB3 SER 13 6.717 -6.246 -11.650 98 HG SER 13 HG SER 13 6.822 -3.848 -10.854 99 H PHE 14 H PHE 14 4.920 -5.447 -8.401 100 HA PHE 14 HA PHE 14 2.607 -6.678 -9.718 101 HB2 PHE 14 HB2 PHE 14 2.982 -8.057 -7.693 102 HB3 PHE 14 HB3 PHE 14 2.996 -6.617 -6.680 103 HD1 PHE 14 HD1 PHE 14 0.720 -8.034 -9.327 104 HD2 PHE 14 HD2 PHE 14 1.065 -6.431 -5.376 105 HE1 PHE 14 HE1 PHE 14 -1.697 -8.297 -9.006 106 HE2 PHE 14 HE2 PHE 14 -1.354 -6.688 -5.071 107 HZ PHE 14 HZ PHE 14 -2.736 -7.625 -6.877 108 H SER 15 H SER 15 1.818 -4.850 -10.627 109 HA SER 15 HA SER 15 1.877 -2.279 -9.142 110 HB2 SER 15 HB2 SER 15 1.826 -2.694 -12.165 111 HB3 SER 15 HB3 SER 15 2.025 -1.162 -11.315 112 HG SER 15 HG SER 15 3.834 -3.233 -10.762 113 H ILE 16 H ILE 16 -0.099 -1.695 -8.388 114 HA ILE 16 HA ILE 16 -2.558 -2.523 -9.829 115 HB ILE 16 HB ILE 16 -2.221 -1.486 -6.974 116 HG12 ILE 16 HG12 ILE 16 -2.879 -4.303 -7.953 117 HG13 ILE 16 HG13 ILE 16 -1.301 -3.793 -7.362 118 HG21 ILE 16 HG21 ILE 16 -4.735 -2.518 -8.357 119 HG22 ILE 16 HG22 ILE 16 -4.427 -0.847 -7.877 120 HG23 ILE 16 HG23 ILE 16 -4.606 -2.097 -6.647 121 HD11 ILE 16 HD11 ILE 16 -3.846 -3.845 -5.743 122 HD12 ILE 16 HD12 ILE 16 -2.242 -3.381 -5.160 123 HD13 ILE 16 HD13 ILE 16 -2.545 -5.033 -5.691 124 H VAL 17 H VAL 17 -3.408 -1.033 -11.133 125 HA VAL 17 HA VAL 17 -2.834 1.838 -10.779 126 HB VAL 17 HB VAL 17 -3.992 0.457 -13.248 127 HG11 VAL 17 HG11 VAL 17 -2.743 3.218 -12.904 128 HG12 VAL 17 HG12 VAL 17 -4.462 2.882 -13.133 129 HG13 VAL 17 HG13 VAL 17 -3.316 2.535 -14.428 130 HG21 VAL 17 HG21 VAL 17 -1.752 -0.471 -12.818 131 HG22 VAL 17 HG22 VAL 17 -1.079 1.158 -12.714 132 HG23 VAL 17 HG23 VAL 17 -1.727 0.569 -14.246 133 H ALA 18 H ALA 18 -4.452 3.151 -10.158 134 HA ALA 18 HA ALA 18 -7.288 2.500 -10.609 135 HB1 ALA 18 HB1 ALA 18 -6.133 3.346 -7.917 136 HB2 ALA 18 HB2 ALA 18 -6.759 1.744 -8.314 137 HB3 ALA 18 HB3 ALA 18 -7.849 3.132 -8.282 138 H GLU 19 H GLU 19 -8.676 4.436 -10.496 139 HA GLU 19 HA GLU 19 -7.242 7.030 -10.725 140 HB2 GLU 19 HB2 GLU 19 -9.525 6.086 -12.524 141 HB3 GLU 19 HB3 GLU 19 -8.809 7.700 -12.541 142 HG2 GLU 19 HG2 GLU 19 -6.618 6.672 -13.176 143 HG3 GLU 19 HG3 GLU 19 -7.420 5.103 -13.260 144 H PHE 20 H PHE 20 -8.157 8.677 -9.631 145 HA PHE 20 HA PHE 20 -10.757 8.247 -8.275 146 HB2 PHE 20 HB2 PHE 20 -8.300 9.559 -7.008 147 HB3 PHE 20 HB3 PHE 20 -9.833 9.200 -6.213 148 HD1 PHE 20 HD1 PHE 20 -10.546 6.669 -6.139 149 HD2 PHE 20 HD2 PHE 20 -6.539 7.980 -6.864 150 HE1 PHE 20 HE1 PHE 20 -9.695 4.450 -5.518 151 HE2 PHE 20 HE2 PHE 20 -5.700 5.756 -6.228 152 HZ PHE 20 HZ PHE 20 -7.281 3.991 -5.566 153 H ASP 21 H ASP 21 -12.168 9.965 -8.391 154 HA ASP 21 HA ASP 21 -11.456 12.250 -10.036 155 HB2 ASP 21 HB2 ASP 21 -13.694 11.130 -10.216 156 HB3 ASP 21 HB3 ASP 21 -14.082 11.671 -8.584 157 H ALA 22 H ALA 22 -9.885 13.254 -8.823 158 HA ALA 22 HA ALA 22 -10.503 15.301 -6.987 159 HB1 ALA 22 HB1 ALA 22 -9.390 14.419 -4.941 160 HB2 ALA 22 HB2 ALA 22 -9.200 12.846 -5.723 161 HB3 ALA 22 HB3 ALA 22 -10.812 13.462 -5.359 162 H ASP 23 H ASP 23 -8.340 16.255 -6.079 163 HA ASP 23 HA ASP 23 -6.423 16.271 -8.294 164 HB2 ASP 23 HB2 ASP 23 -5.341 18.154 -7.058 165 HB3 ASP 23 HB3 ASP 23 -7.037 18.442 -7.398 166 H VAL 24 H VAL 24 -4.050 16.445 -7.632 167 HA VAL 24 HA VAL 24 -3.173 13.910 -6.886 168 HB VAL 24 HB VAL 24 -1.557 16.491 -6.999 169 HG11 VAL 24 HG11 VAL 24 -0.595 13.605 -7.217 170 HG12 VAL 24 HG12 VAL 24 -0.291 14.693 -5.860 171 HG13 VAL 24 HG13 VAL 24 0.409 15.042 -7.440 172 HG21 VAL 24 HG21 VAL 24 -2.073 14.439 -9.187 173 HG22 VAL 24 HG22 VAL 24 -1.031 15.860 -9.321 174 HG23 VAL 24 HG23 VAL 24 -2.771 16.061 -9.100 175 H LYS 25 H LYS 25 -3.106 16.932 -4.987 176 HA LYS 25 HA LYS 25 -1.832 15.876 -2.678 177 HB2 LYS 25 HB2 LYS 25 -3.379 18.396 -3.266 178 HB3 LYS 25 HB3 LYS 25 -3.043 18.004 -1.589 179 HG2 LYS 25 HG2 LYS 25 -0.695 17.965 -3.452 180 HG3 LYS 25 HG3 LYS 25 -1.414 19.536 -3.109 181 HD2 LYS 25 HD2 LYS 25 0.416 19.145 -1.549 182 HD3 LYS 25 HD3 LYS 25 -1.106 19.126 -0.661 183 HE2 LYS 25 HE2 LYS 25 -1.044 16.635 -0.670 184 HE3 LYS 25 HE3 LYS 25 0.512 16.688 -1.499 185 HZ1 LYS 25 HZ1 LYS 25 -0.073 17.782 1.192 186 HZ2 LYS 25 HZ2 LYS 25 1.418 17.865 0.407 187 HZ3 LYS 25 HZ3 LYS 25 0.786 16.367 0.861 188 H ARG 26 H ARG 26 -5.227 16.016 -3.642 189 HA ARG 26 HA ARG 26 -6.399 15.421 -1.108 190 HB2 ARG 26 HB2 ARG 26 -7.680 16.411 -2.980 191 HB3 ARG 26 HB3 ARG 26 -7.484 14.930 -3.909 192 HG2 ARG 26 HG2 ARG 26 -9.713 14.991 -2.971 193 HG3 ARG 26 HG3 ARG 26 -8.800 13.699 -2.189 194 HD2 ARG 26 HD2 ARG 26 -8.430 15.153 -0.227 195 HD3 ARG 26 HD3 ARG 26 -9.324 16.459 -1.014 196 HE ARG 26 HE ARG 26 -10.400 14.085 0.248 197 HH11 ARG 26 HH11 ARG 26 -11.131 16.724 -1.882 198 HH12 ARG 26 HH12 ARG 26 -12.835 16.561 -1.649 199 HH21 ARG 26 HH21 ARG 26 -12.577 13.928 0.526 200 HH22 ARG 26 HH22 ARG 26 -13.635 15.012 -0.305 201 H VAL 27 H VAL 27 -5.467 13.372 -3.882 202 HA VAL 27 HA VAL 27 -6.137 10.872 -2.611 203 HB VAL 27 HB VAL 27 -4.283 11.248 -5.005 204 HG11 VAL 27 HG11 VAL 27 -4.984 8.944 -5.608 205 HG12 VAL 27 HG12 VAL 27 -5.964 8.857 -4.143 206 HG13 VAL 27 HG13 VAL 27 -4.207 8.985 -4.022 207 HG21 VAL 27 HG21 VAL 27 -7.318 10.966 -5.035 208 HG22 VAL 27 HG22 VAL 27 -6.276 10.936 -6.460 209 HG23 VAL 27 HG23 VAL 27 -6.400 12.408 -5.491 210 H TRP 28 H TRP 28 -3.194 12.836 -2.874 211 HA TRP 28 HA TRP 28 -1.307 11.038 -1.783 212 HB2 TRP 28 HB2 TRP 28 -0.715 13.163 -2.935 213 HB3 TRP 28 HB3 TRP 28 -1.374 14.081 -1.589 214 HD1 TRP 28 HD1 TRP 28 0.308 14.684 0.292 215 HE1 TRP 28 HE1 TRP 28 2.742 14.093 0.822 216 HE3 TRP 28 HE3 TRP 28 0.982 10.955 -3.130 217 HZ2 TRP 28 HZ2 TRP 28 4.704 12.286 -0.101 218 HZ3 TRP 28 HZ3 TRP 28 3.175 9.852 -3.247 219 HH2 TRP 28 HH2 TRP 28 4.994 10.507 -1.758 220 H ALA 29 H ALA 29 -3.724 13.072 -0.250 221 HA ALA 29 HA ALA 29 -2.730 13.202 2.379 222 HB1 ALA 29 HB1 ALA 29 -4.525 14.641 1.516 223 HB2 ALA 29 HB2 ALA 29 -5.018 13.832 3.007 224 HB3 ALA 29 HB3 ALA 29 -5.616 13.253 1.447 225 H ILE 30 H ILE 30 -4.387 10.537 0.745 226 HA ILE 30 HA ILE 30 -5.136 9.068 3.117 227 HB ILE 30 HB ILE 30 -5.746 7.243 1.703 228 HG12 ILE 30 HG12 ILE 30 -3.937 8.469 -0.418 229 HG13 ILE 30 HG13 ILE 30 -3.677 6.963 0.433 230 HG21 ILE 30 HG21 ILE 30 -6.239 9.790 0.112 231 HG22 ILE 30 HG22 ILE 30 -7.216 9.202 1.462 232 HG23 ILE 30 HG23 ILE 30 -7.150 8.282 -0.041 233 HD11 ILE 30 HD11 ILE 30 -4.347 6.515 -1.787 234 HD12 ILE 30 HD12 ILE 30 -5.767 7.546 -1.634 235 HD13 ILE 30 HD13 ILE 30 -5.662 6.042 -0.711 236 H TRP 31 H TRP 31 -2.115 9.612 1.628 237 HA TRP 31 HA TRP 31 -0.823 7.291 2.946 238 HB2 TRP 31 HB2 TRP 31 0.250 9.198 0.806 239 HB3 TRP 31 HB3 TRP 31 1.139 7.839 1.495 240 HD1 TRP 31 HD1 TRP 31 -1.328 8.659 -1.238 241 HE1 TRP 31 HE1 TRP 31 -2.002 6.498 -2.464 242 HE3 TRP 31 HE3 TRP 31 0.737 5.225 1.951 243 HZ2 TRP 31 HZ2 TRP 31 -1.681 3.720 -2.139 244 HZ3 TRP 31 HZ3 TRP 31 0.526 2.835 1.410 245 HH2 TRP 31 HH2 TRP 31 -0.663 2.096 -0.593 246 H GLU 32 H GLU 32 -0.669 10.802 2.565 247 HA GLU 32 HA GLU 32 1.613 11.292 4.180 248 HB2 GLU 32 HB2 GLU 32 0.836 12.787 2.349 249 HB3 GLU 32 HB3 GLU 32 -0.614 13.173 3.269 250 HG2 GLU 32 HG2 GLU 32 0.716 14.315 4.968 251 HG3 GLU 32 HG3 GLU 32 2.212 13.811 4.182 252 H ASP 33 H ASP 33 -1.881 11.570 4.763 253 HA ASP 33 HA ASP 33 -1.510 12.209 7.588 254 HB2 ASP 33 HB2 ASP 33 -3.236 13.388 6.188 255 HB3 ASP 33 HB3 ASP 33 -4.087 11.860 5.986 256 HA PRO 34 HA PRO 34 -1.507 7.776 8.622 257 HB2 PRO 34 HB2 PRO 34 -1.882 8.084 11.369 258 HB3 PRO 34 HB3 PRO 34 -0.330 8.253 10.547 259 HG2 PRO 34 HG2 PRO 34 -2.282 10.404 11.354 260 HG3 PRO 34 HG3 PRO 34 -0.514 10.368 11.556 261 HD2 PRO 34 HD2 PRO 34 -1.619 11.768 9.562 262 HD3 PRO 34 HD3 PRO 34 -0.121 10.854 9.285 263 H ARG 35 H ARG 35 -4.092 9.960 9.689 264 HA ARG 35 HA ARG 35 -5.888 7.900 10.607 265 HB2 ARG 35 HB2 ARG 35 -6.032 9.929 11.762 266 HB3 ARG 35 HB3 ARG 35 -5.989 10.880 10.283 267 HG2 ARG 35 HG2 ARG 35 -8.310 10.100 9.757 268 HG3 ARG 35 HG3 ARG 35 -8.353 9.272 11.320 269 HD2 ARG 35 HD2 ARG 35 -9.380 11.666 11.163 270 HD3 ARG 35 HD3 ARG 35 -8.308 11.313 12.524 271 HE ARG 35 HE ARG 35 -6.638 12.589 11.562 272 HH11 ARG 35 HH11 ARG 35 -9.364 12.598 9.454 273 HH12 ARG 35 HH12 ARG 35 -8.708 13.854 8.474 274 HH21 ARG 35 HH21 ARG 35 -5.848 14.181 10.295 275 HH22 ARG 35 HH22 ARG 35 -6.776 14.764 8.964 276 H GLN 36 H GLN 36 -5.467 9.757 7.619 277 HA GLN 36 HA GLN 36 -7.802 8.598 6.333 278 HB2 GLN 36 HB2 GLN 36 -5.475 10.176 5.158 279 HB3 GLN 36 HB3 GLN 36 -6.904 9.666 4.259 280 HG2 GLN 36 HG2 GLN 36 -8.293 11.025 5.896 281 HG3 GLN 36 HG3 GLN 36 -6.775 11.663 6.537 282 HE21 GLN 36 HE21 GLN 36 -7.288 13.787 5.900 283 HE22 GLN 36 HE22 GLN 36 -7.280 14.283 4.248 284 H LEU 37 H LEU 37 -4.427 7.651 6.711 285 HA LEU 37 HA LEU 37 -4.435 5.678 4.598 286 HB2 LEU 37 HB2 LEU 37 -2.337 6.646 5.397 287 HB3 LEU 37 HB3 LEU 37 -2.611 5.996 7.007 288 HG LEU 37 HG LEU 37 -2.327 3.689 6.162 289 HD11 LEU 37 HD11 LEU 37 -1.603 3.176 3.890 290 HD12 LEU 37 HD12 LEU 37 -1.763 4.877 3.431 291 HD13 LEU 37 HD13 LEU 37 -3.198 3.946 3.876 292 HD21 LEU 37 HD21 LEU 37 -0.042 5.494 5.321 293 HD22 LEU 37 HD22 LEU 37 0.062 3.757 5.654 294 HD23 LEU 37 HD23 LEU 37 -0.349 4.881 6.951 295 H GLU 38 H GLU 38 -4.759 5.439 8.167 296 HA GLU 38 HA GLU 38 -5.247 2.629 8.272 297 HB2 GLU 38 HB2 GLU 38 -5.923 3.027 10.622 298 HB3 GLU 38 HB3 GLU 38 -4.436 3.864 10.227 299 HG2 GLU 38 HG2 GLU 38 -5.506 5.497 11.472 300 HG3 GLU 38 HG3 GLU 38 -6.018 5.952 9.854 301 H ARG 39 H ARG 39 -7.168 5.078 7.110 302 HA ARG 39 HA ARG 39 -9.793 4.393 7.858 303 HB2 ARG 39 HB2 ARG 39 -8.807 6.593 6.930 304 HB3 ARG 39 HB3 ARG 39 -8.904 5.860 5.337 305 HG2 ARG 39 HG2 ARG 39 -10.778 7.368 5.772 306 HG3 ARG 39 HG3 ARG 39 -11.343 5.709 5.544 307 HD2 ARG 39 HD2 ARG 39 -12.415 7.006 7.443 308 HD3 ARG 39 HD3 ARG 39 -11.770 5.426 7.856 309 HE ARG 39 HE ARG 39 -9.713 6.984 8.550 310 HH11 ARG 39 HH11 ARG 39 -13.059 7.460 9.276 311 HH12 ARG 39 HH12 ARG 39 -12.717 8.105 10.839 312 HH21 ARG 39 HH21 ARG 39 -9.335 7.743 10.555 313 HH22 ARG 39 HH22 ARG 39 -10.650 8.257 11.554 314 H TRP 40 H TRP 40 -7.654 3.119 5.412 315 HA TRP 40 HA TRP 40 -9.778 1.397 4.261 316 HB2 TRP 40 HB2 TRP 40 -8.970 1.914 1.960 317 HB3 TRP 40 HB3 TRP 40 -9.635 3.329 2.770 318 HD1 TRP 40 HD1 TRP 40 -7.865 5.263 3.531 319 HE1 TRP 40 HE1 TRP 40 -5.514 5.837 2.653 320 HE3 TRP 40 HE3 TRP 40 -6.847 0.945 0.991 321 HZ2 TRP 40 HZ2 TRP 40 -3.516 4.651 1.064 322 HZ3 TRP 40 HZ3 TRP 40 -4.702 0.743 -0.195 323 HH2 TRP 40 HH2 TRP 40 -3.073 2.560 -0.154 324 H TRP 41 H TRP 41 -6.569 1.672 5.433 325 HA TRP 41 HA TRP 41 -5.146 -0.057 3.705 326 HB2 TRP 41 HB2 TRP 41 -4.153 1.597 5.387 327 HB3 TRP 41 HB3 TRP 41 -4.458 0.399 6.642 328 HD1 TRP 41 HD1 TRP 41 -2.368 -1.130 7.095 329 HE1 TRP 41 HE1 TRP 41 -0.281 -1.821 5.775 330 HE3 TRP 41 HE3 TRP 41 -3.448 1.111 2.640 331 HZ2 TRP 41 HZ2 TRP 41 0.769 -1.447 3.202 332 HZ3 TRP 41 HZ3 TRP 41 -1.860 0.880 0.790 333 HH2 TRP 41 HH2 TRP 41 0.216 -0.381 1.055 334 H GLY 42 H GLY 42 -5.427 -2.160 3.385 335 HA2 GLY 42 HA2 GLY 42 -5.499 -4.454 3.996 336 HA3 GLY 42 HA3 GLY 42 -6.160 -4.016 5.567 337 HA PRO 43 HA PRO 43 -9.641 -5.524 2.603 338 HB2 PRO 43 HB2 PRO 43 -10.065 -7.424 4.908 339 HB3 PRO 43 HB3 PRO 43 -10.120 -7.740 3.168 340 HG2 PRO 43 HG2 PRO 43 -8.051 -8.568 4.648 341 HG3 PRO 43 HG3 PRO 43 -7.805 -7.955 2.997 342 HD2 PRO 43 HD2 PRO 43 -7.313 -6.554 5.630 343 HD3 PRO 43 HD3 PRO 43 -6.338 -6.538 4.144 344 HA PRO 44 HA PRO 44 -12.791 -3.247 5.039 345 HB2 PRO 44 HB2 PRO 44 -15.111 -4.568 4.234 346 HB3 PRO 44 HB3 PRO 44 -14.299 -3.318 3.285 347 HG2 PRO 44 HG2 PRO 44 -14.081 -6.320 3.053 348 HG3 PRO 44 HG3 PRO 44 -14.257 -5.113 1.758 349 HD2 PRO 44 HD2 PRO 44 -11.856 -6.189 2.312 350 HD3 PRO 44 HD3 PRO 44 -11.991 -4.472 1.876 351 H THR 45 H THR 45 -12.187 -6.608 5.441 352 HA THR 45 HA THR 45 -13.707 -6.867 7.945 353 HB THR 45 HB THR 45 -12.698 -9.246 7.884 354 HG1 THR 45 HG1 THR 45 -11.779 -9.881 5.924 355 HG21 THR 45 HG21 THR 45 -14.434 -8.425 5.522 356 HG22 THR 45 HG22 THR 45 -15.024 -8.805 7.142 357 HG23 THR 45 HG23 THR 45 -14.262 -10.061 6.164 358 H TRP 46 H TRP 46 -10.384 -6.395 6.840 359 HA TRP 46 HA TRP 46 -9.379 -6.451 9.644 360 HB2 TRP 46 HB2 TRP 46 -7.919 -7.294 7.101 361 HB3 TRP 46 HB3 TRP 46 -7.126 -7.091 8.658 362 HD1 TRP 46 HD1 TRP 46 -10.024 -9.255 7.186 363 HE1 TRP 46 HE1 TRP 46 -9.974 -11.532 8.345 364 HE3 TRP 46 HE3 TRP 46 -6.125 -8.452 10.389 365 HZ2 TRP 46 HZ2 TRP 46 -8.485 -12.854 10.326 366 HZ3 TRP 46 HZ3 TRP 46 -5.432 -10.288 11.881 367 HH2 TRP 46 HH2 TRP 46 -6.585 -12.446 11.847 368 HA PRO 47 HA PRO 47 -8.434 -2.152 8.091 369 HB2 PRO 47 HB2 PRO 47 -9.489 -0.742 10.154 370 HB3 PRO 47 HB3 PRO 47 -10.503 -1.365 8.845 371 HG2 PRO 47 HG2 PRO 47 -10.052 -2.509 11.600 372 HG3 PRO 47 HG3 PRO 47 -11.577 -2.329 10.707 373 HD2 PRO 47 HD2 PRO 47 -10.160 -4.693 10.831 374 HD3 PRO 47 HD3 PRO 47 -11.230 -4.267 9.481 375 H ALA 48 H ALA 48 -6.426 -1.364 8.478 376 HA ALA 48 HA ALA 48 -4.836 -2.272 10.725 377 HB1 ALA 48 HB1 ALA 48 -3.868 -2.138 8.482 378 HB2 ALA 48 HB2 ALA 48 -2.990 -1.102 9.611 379 HB3 ALA 48 HB3 ALA 48 -4.128 -0.394 8.459 380 H THR 49 H THR 49 -3.816 -0.945 12.268 381 HA THR 49 HA THR 49 -4.811 1.834 12.626 382 HB THR 49 HB THR 49 -4.428 -0.275 14.809 383 HG1 THR 49 HG1 THR 49 -6.655 0.822 13.486 384 HG21 THR 49 HG21 THR 49 -3.750 1.932 15.667 385 HG22 THR 49 HG22 THR 49 -5.290 1.448 16.378 386 HG23 THR 49 HG23 THR 49 -5.258 2.641 15.078 387 H PHE 50 H PHE 50 -3.117 3.196 12.416 388 HA PHE 50 HA PHE 50 -0.377 2.185 12.575 389 HB2 PHE 50 HB2 PHE 50 -1.627 4.676 11.378 390 HB3 PHE 50 HB3 PHE 50 0.118 4.564 11.599 391 HD1 PHE 50 HD1 PHE 50 -2.779 2.828 9.963 392 HD2 PHE 50 HD2 PHE 50 1.466 3.388 10.030 393 HE1 PHE 50 HE1 PHE 50 -2.566 1.519 7.894 394 HE2 PHE 50 HE2 PHE 50 1.667 2.079 7.962 395 HZ PHE 50 HZ PHE 50 -0.346 1.141 6.891 396 H GLU 51 H GLU 51 0.508 2.166 14.486 397 HA GLU 51 HA GLU 51 -0.073 3.869 16.683 398 HB2 GLU 51 HB2 GLU 51 2.274 1.973 16.257 399 HB3 GLU 51 HB3 GLU 51 1.750 2.631 17.806 400 HG2 GLU 51 HG2 GLU 51 0.151 0.741 16.037 401 HG3 GLU 51 HG3 GLU 51 1.023 0.295 17.500 402 H THR 52 H THR 52 2.657 3.805 14.347 403 HA THR 52 HA THR 52 3.467 6.490 15.241 404 HB THR 52 HB THR 52 4.844 5.013 16.604 405 HG1 THR 52 HG1 THR 52 6.206 6.437 14.556 406 HG21 THR 52 HG21 THR 52 4.931 2.987 15.232 407 HG22 THR 52 HG22 THR 52 6.556 3.512 15.672 408 HG23 THR 52 HG23 THR 52 5.941 3.821 14.048 409 H HIS 53 H HIS 53 2.190 6.329 12.982 410 HA HIS 53 HA HIS 53 3.731 5.879 10.645 411 HB2 HIS 53 HB2 HIS 53 1.277 5.907 10.642 412 HB3 HIS 53 HB3 HIS 53 1.272 7.613 11.071 413 HD2 HIS 53 HD2 HIS 53 1.923 5.327 7.963 414 HE1 HIS 53 HE1 HIS 53 1.676 9.364 6.724 415 HE2 HIS 53 HE2 HIS 53 1.560 6.958 5.977 416 H GLU 54 H GLU 54 5.750 6.884 10.923 417 HA GLU 54 HA GLU 54 6.006 9.797 11.092 418 HB2 GLU 54 HB2 GLU 54 8.182 7.687 10.665 419 HB3 GLU 54 HB3 GLU 54 8.441 9.385 11.066 420 HG2 GLU 54 HG2 GLU 54 7.086 7.352 12.834 421 HG3 GLU 54 HG3 GLU 54 8.773 7.841 12.968 422 H PHE 55 H PHE 55 5.034 10.476 9.083 423 HA PHE 55 HA PHE 55 5.920 9.431 6.555 424 HB2 PHE 55 HB2 PHE 55 3.609 10.479 7.123 425 HB3 PHE 55 HB3 PHE 55 4.398 12.041 6.929 426 HD1 PHE 55 HD1 PHE 55 3.692 8.832 5.199 427 HD2 PHE 55 HD2 PHE 55 4.691 12.954 4.712 428 HE1 PHE 55 HE1 PHE 55 3.349 8.624 2.772 429 HE2 PHE 55 HE2 PHE 55 4.334 12.744 2.281 430 HZ PHE 55 HZ PHE 55 3.666 10.575 1.317 431 H THR 56 H THR 56 8.231 9.796 7.230 432 HA THR 56 HA THR 56 9.253 12.188 5.829 433 HB THR 56 HB THR 56 9.501 12.873 8.130 434 HG1 THR 56 HG1 THR 56 11.898 12.788 8.325 435 HG21 THR 56 HG21 THR 56 10.851 10.212 8.690 436 HG22 THR 56 HG22 THR 56 9.246 10.689 9.250 437 HG23 THR 56 HG23 THR 56 10.678 11.536 9.843 438 H VAL 57 H VAL 57 11.562 11.904 5.162 439 HA VAL 57 HA VAL 57 11.937 9.331 3.908 440 HB VAL 57 HB VAL 57 13.829 11.726 3.996 441 HG11 VAL 57 HG11 VAL 57 14.846 10.738 1.943 442 HG12 VAL 57 HG12 VAL 57 13.784 9.336 2.100 443 HG13 VAL 57 HG13 VAL 57 15.003 9.661 3.335 444 HG21 VAL 57 HG21 VAL 57 11.654 12.371 3.035 445 HG22 VAL 57 HG22 VAL 57 11.725 11.016 1.905 446 HG23 VAL 57 HG23 VAL 57 12.891 12.336 1.774 447 H GLY 58 H GLY 58 12.916 7.628 4.811 448 HA2 GLY 58 HA2 GLY 58 14.391 6.346 6.084 449 HA3 GLY 58 HA3 GLY 58 15.045 7.797 6.816 450 H GLY 59 H GLY 59 11.756 8.076 6.997 451 HA2 GLY 59 HA2 GLY 59 11.597 7.322 9.810 452 HA3 GLY 59 HA3 GLY 59 10.363 8.141 8.861 453 H LYS 60 H LYS 60 9.655 6.085 10.584 454 HA LYS 60 HA LYS 60 8.884 3.890 8.738 455 HB2 LYS 60 HB2 LYS 60 9.939 3.578 11.589 456 HB3 LYS 60 HB3 LYS 60 9.196 2.279 10.652 457 HG2 LYS 60 HG2 LYS 60 10.989 2.575 8.919 458 HG3 LYS 60 HG3 LYS 60 11.767 3.751 9.987 459 HD2 LYS 60 HD2 LYS 60 12.110 2.026 11.685 460 HD3 LYS 60 HD3 LYS 60 11.216 0.851 10.717 461 HE2 LYS 60 HE2 LYS 60 12.941 0.985 8.957 462 HE3 LYS 60 HE3 LYS 60 13.839 2.163 9.922 463 HZ1 LYS 60 HZ1 LYS 60 14.746 -0.041 10.161 464 HZ2 LYS 60 HZ2 LYS 60 13.259 -0.644 10.696 465 HZ3 LYS 60 HZ3 LYS 60 14.105 0.477 11.635 466 H ALA 61 H ALA 61 7.133 2.459 9.779 467 HA ALA 61 HA ALA 61 5.205 3.947 11.449 468 HB1 ALA 61 HB1 ALA 61 4.628 4.560 9.118 469 HB2 ALA 61 HB2 ALA 61 3.356 3.584 9.850 470 HB3 ALA 61 HB3 ALA 61 4.472 2.854 8.693 471 H ALA 62 H ALA 62 4.263 2.610 12.904 472 HA ALA 62 HA ALA 62 4.431 -0.345 12.516 473 HB1 ALA 62 HB1 ALA 62 4.061 1.262 15.088 474 HB2 ALA 62 HB2 ALA 62 5.529 0.421 14.581 475 HB3 ALA 62 HB3 ALA 62 4.080 -0.505 14.980 476 H TYR 63 H TYR 63 2.506 -1.513 12.455 477 HA TYR 63 HA TYR 63 0.017 -0.291 13.351 478 HB2 TYR 63 HB2 TYR 63 -1.194 -0.475 11.266 479 HB3 TYR 63 HB3 TYR 63 0.242 0.485 10.975 480 HD1 TYR 63 HD2 TYR 63 -1.464 -2.701 10.226 481 HD2 TYR 63 HD1 TYR 63 2.036 -0.366 9.473 482 HE1 TYR 63 HE2 TYR 63 -0.946 -4.115 8.293 483 HE2 TYR 63 HE1 TYR 63 2.553 -1.782 7.532 484 HH TYR 63 HH TYR 63 2.076 -3.893 6.578 485 H TYR 64 H TYR 64 -1.865 -1.822 13.024 486 HA TYR 64 HA TYR 64 -1.262 -4.619 12.532 487 HB2 TYR 64 HB2 TYR 64 -2.325 -5.412 14.671 488 HB3 TYR 64 HB3 TYR 64 -0.810 -4.556 14.925 489 HD1 TYR 64 HD2 TYR 64 -0.793 -2.284 15.966 490 HD2 TYR 64 HD1 TYR 64 -4.446 -4.472 15.519 491 HE1 TYR 64 HE2 TYR 64 -1.887 -0.814 17.586 492 HE2 TYR 64 HE1 TYR 64 -5.535 -2.985 17.138 493 HH TYR 64 HH TYR 64 -4.883 -1.533 18.999 494 H MET 65 H MET 65 -2.956 -5.641 11.597 495 HA MET 65 HA MET 65 -5.436 -4.201 11.068 496 HB2 MET 65 HB2 MET 65 -4.434 -6.911 10.097 497 HB3 MET 65 HB3 MET 65 -5.932 -6.152 9.574 498 HG2 MET 65 HG2 MET 65 -4.653 -4.292 8.596 499 HG3 MET 65 HG3 MET 65 -3.145 -5.052 9.111 500 HE1 MET 65 HE1 MET 65 -3.764 -8.181 8.528 501 HE2 MET 65 HE2 MET 65 -2.245 -7.387 8.101 502 HE3 MET 65 HE3 MET 65 -3.126 -8.318 6.890 503 H THR 66 H THR 66 -6.958 -4.287 12.629 504 HA THR 66 HA THR 66 -7.265 -6.581 14.406 505 HB THR 66 HB THR 66 -8.847 -3.976 14.259 506 HG1 THR 66 HG1 THR 66 -7.330 -3.225 15.536 507 HG21 THR 66 HG21 THR 66 -8.912 -6.143 16.402 508 HG22 THR 66 HG22 THR 66 -10.231 -5.758 15.294 509 HG23 THR 66 HG23 THR 66 -9.720 -4.576 16.501 510 H GLY 67 H GLY 67 -8.023 -8.268 13.287 511 HA2 GLY 67 HA2 GLY 67 -9.922 -8.258 11.188 512 HA3 GLY 67 HA3 GLY 67 -9.355 -9.664 12.064 513 HA PRO 68 HA PRO 68 -13.956 -8.634 12.868 514 HB2 PRO 68 HB2 PRO 68 -15.088 -10.884 11.789 515 HB3 PRO 68 HB3 PRO 68 -14.669 -9.470 10.811 516 HG2 PRO 68 HG2 PRO 68 -13.098 -12.021 11.221 517 HG3 PRO 68 HG3 PRO 68 -13.457 -11.174 9.701 518 HD2 PRO 68 HD2 PRO 68 -11.071 -10.911 10.962 519 HD3 PRO 68 HD3 PRO 68 -11.801 -9.560 10.070 520 H ASP 69 H ASP 69 -11.865 -11.277 13.628 521 HA ASP 69 HA ASP 69 -13.554 -12.345 15.790 522 HB2 ASP 69 HB2 ASP 69 -10.798 -13.249 14.841 523 HB3 ASP 69 HB3 ASP 69 -11.887 -14.137 15.908 524 H GLY 70 H GLY 70 -11.672 -9.716 15.557 525 HA2 GLY 70 HA2 GLY 70 -10.586 -8.360 17.084 526 HA3 GLY 70 HA3 GLY 70 -10.877 -9.560 18.335 527 H THR 71 H THR 71 -9.320 -10.522 15.385 528 HA THR 71 HA THR 71 -6.909 -11.335 16.825 529 HB THR 71 HB THR 71 -7.730 -11.859 13.927 530 HG1 THR 71 HG1 THR 71 -8.235 -13.224 16.362 531 HG21 THR 71 HG21 THR 71 -6.108 -13.724 14.009 532 HG22 THR 71 HG22 THR 71 -5.636 -13.264 15.646 533 HG23 THR 71 HG23 THR 71 -5.291 -12.184 14.292 534 H LYS 72 H LYS 72 -5.043 -10.191 16.778 535 HA LYS 72 HA LYS 72 -4.769 -7.849 15.026 536 HB2 LYS 72 HB2 LYS 72 -3.488 -8.700 17.633 537 HB3 LYS 72 HB3 LYS 72 -2.651 -7.534 16.620 538 HG2 LYS 72 HG2 LYS 72 -3.934 -6.381 18.328 539 HG3 LYS 72 HG3 LYS 72 -4.575 -6.017 16.726 540 HD2 LYS 72 HD2 LYS 72 -6.410 -7.682 17.128 541 HD3 LYS 72 HD3 LYS 72 -5.785 -7.929 18.764 542 HE2 LYS 72 HE2 LYS 72 -6.770 -5.272 17.659 543 HE3 LYS 72 HE3 LYS 72 -7.705 -6.342 18.698 544 HZ1 LYS 72 HZ1 LYS 72 -6.048 -6.054 20.429 545 HZ2 LYS 72 HZ2 LYS 72 -6.683 -4.562 19.953 546 HZ3 LYS 72 HZ3 LYS 72 -5.147 -5.029 19.430 547 H ALA 73 H ALA 73 -3.852 -8.231 13.091 548 HA ALA 73 HA ALA 73 -1.418 -9.924 12.878 549 HB1 ALA 73 HB1 ALA 73 -3.260 -8.894 10.683 550 HB2 ALA 73 HB2 ALA 73 -3.242 -10.533 11.338 551 HB3 ALA 73 HB3 ALA 73 -1.845 -9.929 10.444 552 H ARG 74 H ARG 74 0.329 -8.656 13.326 553 HA ARG 74 HA ARG 74 0.269 -5.790 13.015 554 HB2 ARG 74 HB2 ARG 74 2.666 -7.489 13.826 555 HB3 ARG 74 HB3 ARG 74 2.423 -5.770 14.126 556 HG2 ARG 74 HG2 ARG 74 0.446 -6.422 15.607 557 HG3 ARG 74 HG3 ARG 74 0.970 -8.102 15.428 558 HD2 ARG 74 HD2 ARG 74 1.854 -7.242 17.506 559 HD3 ARG 74 HD3 ARG 74 3.200 -7.452 16.378 560 HE ARG 74 HE ARG 74 2.144 -4.806 16.280 561 HH11 ARG 74 HH11 ARG 74 4.227 -6.816 18.171 562 HH12 ARG 74 HH12 ARG 74 5.084 -5.476 18.839 563 HH21 ARG 74 HH21 ARG 74 3.251 -3.110 17.162 564 HH22 ARG 74 HH22 ARG 74 4.533 -3.401 18.282 565 H GLY 75 H GLY 75 1.758 -4.485 11.829 566 HA2 GLY 75 HA2 GLY 75 3.598 -5.748 9.907 567 HA3 GLY 75 HA3 GLY 75 2.381 -4.637 9.295 568 H TRP 76 H TRP 76 5.165 -4.285 8.982 569 HA TRP 76 HA TRP 76 5.618 -1.753 10.469 570 HB2 TRP 76 HB2 TRP 76 8.067 -2.215 10.414 571 HB3 TRP 76 HB3 TRP 76 7.207 -3.474 11.296 572 HD1 TRP 76 HD1 TRP 76 7.237 -5.954 10.258 573 HE1 TRP 76 HE1 TRP 76 8.567 -7.045 8.351 574 HE3 TRP 76 HE3 TRP 76 9.270 -1.746 8.113 575 HZ2 TRP 76 HZ2 TRP 76 10.257 -6.264 6.245 576 HZ3 TRP 76 HZ3 TRP 76 10.741 -2.016 6.156 577 HH2 TRP 76 HH2 TRP 76 11.231 -4.229 5.244 578 H TRP 77 H TRP 77 6.460 -0.050 9.253 579 HA TRP 77 HA TRP 77 6.955 -0.448 6.355 580 HB2 TRP 77 HB2 TRP 77 5.665 1.874 7.823 581 HB3 TRP 77 HB3 TRP 77 6.414 2.115 6.254 582 HD1 TRP 77 HD1 TRP 77 4.392 -1.103 6.701 583 HE1 TRP 77 HE1 TRP 77 2.236 -0.910 5.326 584 HE3 TRP 77 HE3 TRP 77 4.712 3.814 5.423 585 HZ2 TRP 77 HZ2 TRP 77 0.848 1.104 3.899 586 HZ3 TRP 77 HZ3 TRP 77 2.931 4.804 4.041 587 HH2 TRP 77 HH2 TRP 77 1.038 3.465 3.294 588 H GLN 78 H GLN 78 8.633 0.812 5.421 589 HA GLN 78 HA GLN 78 10.064 2.754 7.103 590 HB2 GLN 78 HB2 GLN 78 11.576 0.849 7.202 591 HB3 GLN 78 HB3 GLN 78 11.449 0.572 5.465 592 HG2 GLN 78 HG2 GLN 78 12.663 2.624 4.989 593 HG3 GLN 78 HG3 GLN 78 12.658 3.084 6.684 594 HE21 GLN 78 HE21 GLN 78 14.919 3.263 6.650 595 HE22 GLN 78 HE22 GLN 78 15.953 1.887 6.627 596 H PHE 79 H PHE 79 9.396 4.542 6.078 597 HA PHE 79 HA PHE 79 8.884 4.892 3.328 598 HB2 PHE 79 HB2 PHE 79 9.581 6.936 5.469 599 HB3 PHE 79 HB3 PHE 79 8.993 7.347 3.861 600 HD1 PHE 79 HD2 PHE 79 6.665 6.828 3.203 601 HD2 PHE 79 HD1 PHE 79 8.059 6.068 7.169 602 HE1 PHE 79 HE2 PHE 79 4.349 6.681 3.999 603 HE2 PHE 79 HE1 PHE 79 5.738 5.905 7.956 604 HZ PHE 79 HZ PHE 79 3.885 6.223 6.371 605 H THR 80 H THR 80 10.384 4.551 1.844 606 HA THR 80 HA THR 80 13.223 4.770 2.396 607 HB THR 80 HB THR 80 12.008 3.856 -0.235 608 HG1 THR 80 HG1 THR 80 12.328 1.914 1.730 609 HG21 THR 80 HG21 THR 80 13.844 2.247 -0.244 610 HG22 THR 80 HG22 THR 80 14.361 2.789 1.362 611 HG23 THR 80 HG23 THR 80 14.493 3.879 -0.024 612 H THR 81 H THR 81 10.817 6.304 0.285 613 HA THR 81 HA THR 81 12.560 8.563 -0.336 614 HB THR 81 HB THR 81 11.494 6.753 -2.558 615 HG1 THR 81 HG1 THR 81 13.954 7.085 -1.390 616 HG21 THR 81 HG21 THR 81 12.456 8.372 -4.174 617 HG22 THR 81 HG22 THR 81 12.824 9.471 -2.843 618 HG23 THR 81 HG23 THR 81 11.146 9.095 -3.235 619 H ILE 82 H ILE 82 11.205 10.183 0.276 620 HA ILE 82 HA ILE 82 8.422 10.241 -0.798 621 HB ILE 82 HB ILE 82 9.411 11.685 1.711 622 HG12 ILE 82 HG12 ILE 82 7.726 9.155 1.467 623 HG13 ILE 82 HG13 ILE 82 9.329 9.282 2.177 624 HG21 ILE 82 HG21 ILE 82 7.586 12.883 0.541 625 HG22 ILE 82 HG22 ILE 82 7.019 12.234 2.079 626 HG23 ILE 82 HG23 ILE 82 6.591 11.423 0.571 627 HD11 ILE 82 HD11 ILE 82 8.368 10.698 3.971 628 HD12 ILE 82 HD12 ILE 82 7.685 9.076 3.903 629 HD13 ILE 82 HD13 ILE 82 6.768 10.439 3.270 630 H GLU 83 H GLU 83 8.702 11.414 -2.665 631 HA GLU 83 HA GLU 83 10.228 13.916 -2.636 632 HB2 GLU 83 HB2 GLU 83 8.697 12.556 -4.887 633 HB3 GLU 83 HB3 GLU 83 9.562 14.084 -5.048 634 HG2 GLU 83 HG2 GLU 83 11.647 12.745 -4.233 635 HG3 GLU 83 HG3 GLU 83 10.694 11.313 -4.623 636 H ALA 84 H ALA 84 6.852 12.904 -3.247 637 HA ALA 84 HA ALA 84 4.834 13.850 -2.948 638 HB1 ALA 84 HB1 ALA 84 4.484 15.562 -1.233 639 HB2 ALA 84 HB2 ALA 84 6.213 15.925 -1.211 640 HB3 ALA 84 HB3 ALA 84 5.637 14.352 -0.657 641 HA PRO 85 HA PRO 85 2.936 15.126 -2.802 642 HB2 PRO 85 HB2 PRO 85 0.859 16.121 -4.133 643 HB3 PRO 85 HB3 PRO 85 1.946 17.215 -3.262 644 HG2 PRO 85 HG2 PRO 85 1.852 16.595 -6.216 645 HG3 PRO 85 HG3 PRO 85 2.040 18.169 -5.417 646 HD2 PRO 85 HD2 PRO 85 4.152 16.590 -6.403 647 HD3 PRO 85 HD3 PRO 85 4.325 17.913 -5.230 648 H ASP 86 H ASP 86 4.235 13.817 -5.479 649 HA ASP 86 HA ASP 86 1.936 12.008 -6.001 650 HB2 ASP 86 HB2 ASP 86 2.737 11.815 -8.374 651 HB3 ASP 86 HB3 ASP 86 2.122 13.398 -7.929 652 H HIS 87 H HIS 87 5.493 12.120 -5.764 653 HA HIS 87 HA HIS 87 5.684 9.211 -6.227 654 HB2 HIS 87 HB2 HIS 87 7.236 10.910 -7.335 655 HB3 HIS 87 HB3 HIS 87 7.967 11.183 -5.764 656 HD1 HIS 87 HD1 HIS 87 9.674 10.208 -8.062 657 HD2 HIS 87 HD2 HIS 87 7.863 7.622 -5.368 658 HE1 HIS 87 HE1 HIS 87 11.043 8.114 -8.129 659 HE2 HIS 87 HE2 HIS 87 10.039 6.655 -6.357 660 H LEU 88 H LEU 88 5.416 7.945 -4.541 661 HA LEU 88 HA LEU 88 6.820 8.416 -1.973 662 HB2 LEU 88 HB2 LEU 88 4.380 8.574 -1.632 663 HB3 LEU 88 HB3 LEU 88 4.136 7.037 -2.433 664 HG LEU 88 HG LEU 88 5.348 5.895 -0.563 665 HD11 LEU 88 HD11 LEU 88 5.393 8.626 0.751 666 HD12 LEU 88 HD12 LEU 88 6.792 7.721 0.169 667 HD13 LEU 88 HD13 LEU 88 5.844 7.097 1.516 668 HD21 LEU 88 HD21 LEU 88 3.581 6.098 1.121 669 HD22 LEU 88 HD22 LEU 88 2.904 6.031 -0.504 670 HD23 LEU 88 HD23 LEU 88 2.993 7.575 0.350 671 H GLU 89 H GLU 89 8.061 6.698 -1.264 672 HA GLU 89 HA GLU 89 7.666 3.996 -2.353 673 HB2 GLU 89 HB2 GLU 89 10.388 5.388 -2.187 674 HB3 GLU 89 HB3 GLU 89 10.159 3.668 -2.495 675 HG2 GLU 89 HG2 GLU 89 8.888 4.268 -4.567 676 HG3 GLU 89 HG3 GLU 89 9.297 5.956 -4.277 677 H PHE 90 H PHE 90 7.919 2.415 -0.831 678 HA PHE 90 HA PHE 90 9.414 2.835 1.609 679 HB2 PHE 90 HB2 PHE 90 7.556 2.373 3.167 680 HB3 PHE 90 HB3 PHE 90 7.285 3.851 2.259 681 HD1 PHE 90 HD2 PHE 90 6.172 0.341 2.731 682 HD2 PHE 90 HD1 PHE 90 5.397 4.040 0.711 683 HE1 PHE 90 HE2 PHE 90 3.946 -0.474 2.075 684 HE2 PHE 90 HE1 PHE 90 3.175 3.214 0.056 685 HZ PHE 90 HZ PHE 90 2.448 0.957 0.736 686 H ASP 91 H ASP 91 9.303 0.861 3.035 687 HA ASP 91 HA ASP 91 8.990 -1.642 1.477 688 HB2 ASP 91 HB2 ASP 91 10.979 -0.967 3.677 689 HB3 ASP 91 HB3 ASP 91 10.710 -2.602 3.078 690 H ASP 92 H ASP 92 7.994 -3.368 2.456 691 HA ASP 92 HA ASP 92 7.043 -3.285 5.212 692 HB2 ASP 92 HB2 ASP 92 5.283 -2.085 3.807 693 HB3 ASP 92 HB3 ASP 92 5.065 -3.562 2.881 694 H GLY 93 H GLY 93 7.050 -5.331 6.022 695 HA2 GLY 93 HA2 GLY 93 6.914 -7.680 4.205 696 HA3 GLY 93 HA3 GLY 93 8.278 -7.520 5.310 697 H PHE 94 H PHE 94 5.467 -6.204 6.578 698 HA PHE 94 HA PHE 94 4.091 -6.635 8.290 699 HB2 PHE 94 HB2 PHE 94 4.261 -9.515 7.321 700 HB3 PHE 94 HB3 PHE 94 3.149 -8.968 8.571 701 HD1 PHE 94 HD2 PHE 94 1.210 -7.554 8.006 702 HD2 PHE 94 HD1 PHE 94 3.888 -8.935 4.964 703 HE1 PHE 94 HE2 PHE 94 -0.432 -6.952 6.281 704 HE2 PHE 94 HE1 PHE 94 2.240 -8.320 3.243 705 HZ PHE 94 HZ PHE 94 0.077 -7.339 3.899 706 H ALA 95 H ALA 95 3.960 -7.373 10.452 707 HA ALA 95 HA ALA 95 6.463 -8.500 11.611 708 HB1 ALA 95 HB1 ALA 95 6.023 -7.092 13.586 709 HB2 ALA 95 HB2 ALA 95 4.593 -6.416 12.801 710 HB3 ALA 95 HB3 ALA 95 6.200 -6.105 12.136 711 H ASP 96 H ASP 96 6.160 -10.019 13.306 712 HA ASP 96 HA ASP 96 3.684 -11.545 13.102 713 HB2 ASP 96 HB2 ASP 96 4.849 -13.317 14.112 714 HB3 ASP 96 HB3 ASP 96 6.125 -12.472 13.248 715 H GLU 97 H GLU 97 3.240 -12.619 15.597 716 HA GLU 97 HA GLU 97 1.623 -10.693 16.882 717 HB2 GLU 97 HB2 GLU 97 1.237 -12.454 18.578 718 HB3 GLU 97 HB3 GLU 97 1.141 -13.091 16.939 719 HG2 GLU 97 HG2 GLU 97 3.492 -13.962 17.200 720 HG3 GLU 97 HG3 GLU 97 3.458 -13.425 18.878 721 H HIS 98 H HIS 98 4.997 -11.363 17.313 722 HA HIS 98 HA HIS 98 5.147 -9.930 19.888 723 HB2 HIS 98 HB2 HIS 98 7.368 -11.364 18.358 724 HB3 HIS 98 HB3 HIS 98 7.470 -10.733 19.998 725 HD1 HIS 98 HD1 HIS 98 5.506 -11.916 21.639 726 HD2 HIS 98 HD2 HIS 98 6.828 -14.007 18.313 727 HE1 HIS 98 HE1 HIS 98 4.844 -14.300 22.041 728 HE2 HIS 98 HE2 HIS 98 5.789 -15.571 20.096 729 H GLY 99 H GLY 99 5.702 -9.408 16.491 730 HA2 GLY 99 HA2 GLY 99 5.757 -7.169 15.641 731 HA3 GLY 99 HA3 GLY 99 6.599 -6.642 17.084 732 H ALA 100 H ALA 100 7.979 -9.507 16.007 733 HA ALA 100 HA ALA 100 10.281 -8.213 14.785 734 HB1 ALA 100 HB1 ALA 100 9.656 -11.170 15.176 735 HB2 ALA 100 HB2 ALA 100 10.598 -10.151 16.266 736 HB3 ALA 100 HB3 ALA 100 11.208 -10.503 14.649 737 HA PRO 101 HA PRO 101 8.693 -8.268 10.551 738 HB2 PRO 101 HB2 PRO 101 11.150 -8.580 9.197 739 HB3 PRO 101 HB3 PRO 101 10.450 -7.047 9.729 740 HG2 PRO 101 HG2 PRO 101 12.523 -8.759 11.079 741 HG3 PRO 101 HG3 PRO 101 12.458 -6.990 10.929 742 HD2 PRO 101 HD2 PRO 101 11.779 -8.195 13.230 743 HD3 PRO 101 HD3 PRO 101 10.869 -6.778 12.656 744 H VAL 102 H VAL 102 7.628 -9.934 9.717 745 HA VAL 102 HA VAL 102 8.174 -12.656 10.151 746 HB VAL 102 HB VAL 102 6.286 -11.419 8.098 747 HG11 VAL 102 HG11 VAL 102 5.049 -13.574 8.189 748 HG12 VAL 102 HG12 VAL 102 6.288 -14.240 9.259 749 HG13 VAL 102 HG13 VAL 102 6.698 -13.805 7.597 750 HG21 VAL 102 HG21 VAL 102 4.518 -11.718 9.794 751 HG22 VAL 102 HG22 VAL 102 5.791 -10.642 10.375 752 HG23 VAL 102 HG23 VAL 102 5.722 -12.309 10.947 753 H ASP 103 H ASP 103 9.917 -13.608 9.334 754 HA ASP 103 HA ASP 103 11.297 -12.874 6.957 755 HB2 ASP 103 HB2 ASP 103 12.309 -13.873 9.059 756 HB3 ASP 103 HB3 ASP 103 11.591 -15.417 8.611 757 H GLU 104 H GLU 104 8.845 -15.233 7.690 758 HA GLU 104 HA GLU 104 8.861 -16.881 5.422 759 HB2 GLU 104 HB2 GLU 104 7.573 -17.336 7.479 760 HB3 GLU 104 HB3 GLU 104 6.541 -15.947 7.162 761 HG2 GLU 104 HG2 GLU 104 5.687 -17.050 5.136 762 HG3 GLU 104 HG3 GLU 104 6.727 -18.440 5.454 763 H LEU 105 H LEU 105 7.485 -13.646 5.908 764 HA LEU 105 HA LEU 105 6.256 -13.594 3.228 765 HB2 LEU 105 HB2 LEU 105 6.124 -11.590 5.511 766 HB3 LEU 105 HB3 LEU 105 5.265 -11.430 3.982 767 HG LEU 105 HG LEU 105 4.814 -13.603 6.070 768 HD11 LEU 105 HD11 LEU 105 3.013 -11.310 5.245 769 HD12 LEU 105 HD12 LEU 105 3.892 -11.459 6.770 770 HD13 LEU 105 HD13 LEU 105 2.605 -12.598 6.383 771 HD21 LEU 105 HD21 LEU 105 4.502 -14.520 3.836 772 HD22 LEU 105 HD22 LEU 105 3.410 -13.197 3.415 773 HD23 LEU 105 HD23 LEU 105 2.952 -14.365 4.660 774 H GLY 106 H GLY 106 9.164 -12.605 4.755 775 HA2 GLY 106 HA2 GLY 106 11.068 -11.675 3.854 776 HA3 GLY 106 HA3 GLY 106 10.267 -11.637 2.290 777 H VAL 107 H VAL 107 11.018 -9.563 1.753 778 HA VAL 107 HA VAL 107 9.611 -7.295 3.058 779 HB VAL 107 HB VAL 107 12.502 -7.175 2.031 780 HG11 VAL 107 HG11 VAL 107 10.807 -5.002 3.338 781 HG12 VAL 107 HG12 VAL 107 11.306 -5.050 1.645 782 HG13 VAL 107 HG13 VAL 107 12.515 -4.843 2.915 783 HG21 VAL 107 HG21 VAL 107 13.178 -6.775 4.391 784 HG22 VAL 107 HG22 VAL 107 12.421 -8.358 4.193 785 HG23 VAL 107 HG23 VAL 107 11.506 -7.027 4.906 786 H THR 108 H THR 108 8.277 -6.404 1.534 787 HA THR 108 HA THR 108 9.121 -6.356 -1.313 788 HB THR 108 HB THR 108 6.954 -7.477 -1.035 789 HG1 THR 108 HG1 THR 108 7.245 -6.273 -2.927 790 HG21 THR 108 HG21 THR 108 5.917 -4.864 0.136 791 HG22 THR 108 HG22 THR 108 6.093 -6.390 1.003 792 HG23 THR 108 HG23 THR 108 4.922 -6.256 -0.310 793 H HIS 109 H HIS 109 9.260 -4.436 -2.410 794 HA HIS 109 HA HIS 109 9.092 -1.942 -0.840 795 HB2 HIS 109 HB2 HIS 109 11.284 -2.544 -1.935 796 HB3 HIS 109 HB3 HIS 109 10.499 -2.424 -3.508 797 HD1 HIS 109 HD1 HIS 109 11.041 -0.239 -0.458 798 HD2 HIS 109 HD2 HIS 109 10.752 0.125 -4.575 799 HE1 HIS 109 HE1 HIS 109 11.390 2.169 -0.955 800 HE2 HIS 109 HE2 HIS 109 11.432 2.322 -3.439 801 H ALA 110 H ALA 110 7.267 -0.812 -1.128 802 HA ALA 110 HA ALA 110 5.666 -1.097 -3.599 803 HB1 ALA 110 HB1 ALA 110 4.881 0.051 -0.899 804 HB2 ALA 110 HB2 ALA 110 4.521 -1.576 -1.480 805 HB3 ALA 110 HB3 ALA 110 3.807 -0.176 -2.284 806 H THR 111 H THR 111 5.673 0.512 -5.075 807 HA THR 111 HA THR 111 6.676 3.219 -4.360 808 HB THR 111 HB THR 111 6.571 2.021 -7.190 809 HG1 THR 111 HG1 THR 111 9.086 2.302 -6.333 810 HG21 THR 111 HG21 THR 111 8.067 4.430 -6.097 811 HG22 THR 111 HG22 THR 111 6.627 4.497 -7.111 812 HG23 THR 111 HG23 THR 111 8.130 3.838 -7.755 813 H VAL 112 H VAL 112 4.928 4.479 -3.981 814 HA VAL 112 HA VAL 112 2.399 4.138 -5.450 815 HB VAL 112 HB VAL 112 3.077 5.940 -3.082 816 HG11 VAL 112 HG11 VAL 112 0.365 5.266 -4.286 817 HG12 VAL 112 HG12 VAL 112 1.188 6.824 -4.407 818 HG13 VAL 112 HG13 VAL 112 0.637 6.237 -2.837 819 HG21 VAL 112 HG21 VAL 112 3.256 3.557 -2.465 820 HG22 VAL 112 HG22 VAL 112 1.636 3.257 -3.103 821 HG23 VAL 112 HG23 VAL 112 1.849 4.296 -1.692 822 H LYS 113 H LYS 113 2.143 5.317 -7.268 823 HA LYS 113 HA LYS 113 3.498 7.947 -7.571 824 HB2 LYS 113 HB2 LYS 113 3.151 5.681 -9.575 825 HB3 LYS 113 HB3 LYS 113 3.730 7.288 -10.012 826 HG2 LYS 113 HG2 LYS 113 5.766 7.020 -8.838 827 HG3 LYS 113 HG3 LYS 113 5.138 5.687 -7.865 828 HD2 LYS 113 HD2 LYS 113 6.751 4.909 -9.566 829 HD3 LYS 113 HD3 LYS 113 5.148 4.216 -9.788 830 HE2 LYS 113 HE2 LYS 113 4.702 5.881 -11.571 831 HE3 LYS 113 HE3 LYS 113 6.339 6.505 -11.372 832 HZ1 LYS 113 HZ1 LYS 113 7.185 4.335 -12.007 833 HZ2 LYS 113 HZ2 LYS 113 6.189 4.973 -13.214 834 HZ3 LYS 113 HZ3 LYS 113 5.609 3.757 -12.198 835 H LEU 114 H LEU 114 1.995 9.485 -7.596 836 HA LEU 114 HA LEU 114 -0.661 9.082 -8.769 837 HB2 LEU 114 HB2 LEU 114 0.545 11.480 -7.330 838 HB3 LEU 114 HB3 LEU 114 -1.124 11.359 -7.860 839 HG LEU 114 HG LEU 114 0.153 9.521 -5.789 840 HD11 LEU 114 HD11 LEU 114 -1.175 10.740 -4.122 841 HD12 LEU 114 HD12 LEU 114 -1.707 11.880 -5.364 842 HD13 LEU 114 HD13 LEU 114 -0.002 11.793 -4.913 843 HD21 LEU 114 HD21 LEU 114 -2.748 9.831 -6.625 844 HD22 LEU 114 HD22 LEU 114 -2.138 8.787 -5.338 845 HD23 LEU 114 HD23 LEU 114 -1.692 8.469 -7.011 846 H GLU 115 H GLU 115 -1.467 10.292 -10.503 847 HA GLU 115 HA GLU 115 0.430 11.931 -12.090 848 HB2 GLU 115 HB2 GLU 115 -1.579 9.878 -13.113 849 HB3 GLU 115 HB3 GLU 115 -0.729 11.028 -14.145 850 HG2 GLU 115 HG2 GLU 115 1.438 10.047 -13.409 851 HG3 GLU 115 HG3 GLU 115 0.550 8.846 -12.468 852 HA PRO 116 HA PRO 116 -2.992 14.897 -11.595 853 HB2 PRO 116 HB2 PRO 116 -1.882 16.975 -13.021 854 HB3 PRO 116 HB3 PRO 116 -1.408 16.569 -11.368 855 HG2 PRO 116 HG2 PRO 116 -0.040 15.873 -13.957 856 HG3 PRO 116 HG3 PRO 116 0.677 16.409 -12.423 857 HD2 PRO 116 HD2 PRO 116 0.643 13.785 -13.200 858 HD3 PRO 116 HD3 PRO 116 0.607 14.277 -11.495 859 H LEU 117 H LEU 117 -4.637 13.914 -12.766 860 HA LEU 117 HA LEU 117 -4.766 14.217 -15.710 861 HB2 LEU 117 HB2 LEU 117 -6.809 12.894 -13.880 862 HB3 LEU 117 HB3 LEU 117 -6.682 12.728 -15.625 863 HG LEU 117 HG LEU 117 -4.755 11.598 -13.554 864 HD11 LEU 117 HD11 LEU 117 -6.718 10.180 -15.385 865 HD12 LEU 117 HD12 LEU 117 -6.886 10.401 -13.641 866 HD13 LEU 117 HD13 LEU 117 -5.581 9.406 -14.277 867 HD21 LEU 117 HD21 LEU 117 -3.513 12.241 -15.569 868 HD22 LEU 117 HD22 LEU 117 -4.630 11.320 -16.579 869 HD23 LEU 117 HD23 LEU 117 -3.594 10.487 -15.415 870 H GLU 118 H GLU 118 -4.752 16.637 -14.619 871 HA GLU 118 HA GLU 118 -5.718 18.640 -14.252 872 HB2 GLU 118 HB2 GLU 118 -7.907 17.439 -15.989 873 HB3 GLU 118 HB3 GLU 118 -7.916 19.115 -15.466 874 HG2 GLU 118 HG2 GLU 118 -7.083 19.095 -17.684 875 HG3 GLU 118 HG3 GLU 118 -5.716 19.422 -16.622 876 H ASN 119 H ASN 119 -8.888 17.037 -14.215 877 HA ASN 119 HA ASN 119 -9.453 18.125 -11.555 878 HB2 ASN 119 HB2 ASN 119 -11.033 18.252 -13.590 879 HB3 ASN 119 HB3 ASN 119 -11.322 16.532 -13.368 880 HD21 ASN 119 HD21 ASN 119 -13.212 18.720 -13.228 881 HD22 ASN 119 HD22 ASN 119 -13.918 18.665 -11.655 882 H ARG 120 H ARG 120 -8.932 15.010 -13.155 883 HA ARG 120 HA ARG 120 -9.393 13.484 -10.660 884 HB2 ARG 120 HB2 ARG 120 -8.809 12.503 -13.489 885 HB3 ARG 120 HB3 ARG 120 -9.136 11.471 -12.095 886 HG2 ARG 120 HG2 ARG 120 -11.418 12.455 -11.932 887 HG3 ARG 120 HG3 ARG 120 -11.084 13.421 -13.376 888 HD2 ARG 120 HD2 ARG 120 -11.142 10.384 -13.209 889 HD3 ARG 120 HD3 ARG 120 -12.368 11.413 -13.952 890 HE ARG 120 HE ARG 120 -10.568 12.100 -15.556 891 HH11 ARG 120 HH11 ARG 120 -10.422 8.961 -14.079 892 HH12 ARG 120 HH12 ARG 120 -9.459 8.306 -15.356 893 HH21 ARG 120 HH21 ARG 120 -9.347 11.216 -17.153 894 HH22 ARG 120 HH22 ARG 120 -8.882 9.556 -17.076 895 H THR 121 H THR 121 -7.739 11.600 -10.385 896 HA THR 121 HA THR 121 -4.996 12.143 -11.246 897 HB THR 121 HB THR 121 -5.777 12.010 -8.294 898 HG1 THR 121 HG1 THR 121 -5.904 14.085 -9.256 899 HG21 THR 121 HG21 THR 121 -3.728 10.676 -8.602 900 HG22 THR 121 HG22 THR 121 -3.349 12.192 -7.785 901 HG23 THR 121 HG23 THR 121 -2.980 12.000 -9.500 902 H ARG 122 H ARG 122 -3.803 10.277 -11.509 903 HA ARG 122 HA ARG 122 -5.169 7.687 -11.038 904 HB2 ARG 122 HB2 ARG 122 -4.669 8.261 -13.400 905 HB3 ARG 122 HB3 ARG 122 -2.966 8.466 -13.003 906 HG2 ARG 122 HG2 ARG 122 -2.804 6.070 -12.439 907 HG3 ARG 122 HG3 ARG 122 -4.516 5.859 -12.824 908 HD2 ARG 122 HD2 ARG 122 -2.365 6.753 -14.782 909 HD3 ARG 122 HD3 ARG 122 -3.029 5.124 -14.663 910 HE ARG 122 HE ARG 122 -5.131 6.981 -15.085 911 HH11 ARG 122 HH11 ARG 122 -2.546 5.453 -16.821 912 HH12 ARG 122 HH12 ARG 122 -3.336 5.625 -18.347 913 HH21 ARG 122 HH21 ARG 122 -6.115 7.173 -17.037 914 HH22 ARG 122 HH22 ARG 122 -5.335 6.602 -18.472 915 H MET 123 H MET 123 -4.303 6.351 -9.506 916 HA MET 123 HA MET 123 -1.527 6.779 -8.547 917 HB2 MET 123 HB2 MET 123 -3.383 6.949 -6.850 918 HB3 MET 123 HB3 MET 123 -3.789 5.268 -7.165 919 HG2 MET 123 HG2 MET 123 -1.490 4.620 -6.409 920 HG3 MET 123 HG3 MET 123 -1.183 6.311 -6.017 921 HE1 MET 123 HE1 MET 123 -4.549 4.251 -5.485 922 HE2 MET 123 HE2 MET 123 -4.234 3.616 -3.871 923 HE3 MET 123 HE3 MET 123 -3.222 3.117 -5.221 924 H THR 124 H THR 124 -0.036 5.145 -8.779 925 HA THR 124 HA THR 124 -0.971 2.381 -9.296 926 HB THR 124 HB THR 124 1.387 3.706 -10.716 927 HG1 THR 124 HG1 THR 124 -0.750 4.243 -11.525 928 HG21 THR 124 HG21 THR 124 1.567 1.588 -11.985 929 HG22 THR 124 HG22 THR 124 0.279 0.880 -11.007 930 HG23 THR 124 HG23 THR 124 1.823 1.302 -10.263 931 H ILE 125 H ILE 125 -0.292 1.099 -7.690 932 HA ILE 125 HA ILE 125 2.125 1.783 -6.111 933 HB ILE 125 HB ILE 125 -0.041 -0.266 -5.441 934 HG12 ILE 125 HG12 ILE 125 0.225 2.588 -4.375 935 HG13 ILE 125 HG13 ILE 125 -0.983 2.061 -5.541 936 HG21 ILE 125 HG21 ILE 125 2.126 -0.689 -4.324 937 HG22 ILE 125 HG22 ILE 125 0.908 -0.192 -3.152 938 HG23 ILE 125 HG23 ILE 125 2.135 0.958 -3.689 939 HD11 ILE 125 HD11 ILE 125 -1.916 0.536 -3.836 940 HD12 ILE 125 HD12 ILE 125 -1.963 2.231 -3.355 941 HD13 ILE 125 HD13 ILE 125 -0.741 1.156 -2.673 942 H ILE 126 H ILE 126 3.945 0.748 -6.785 943 HA ILE 126 HA ILE 126 3.783 -1.871 -8.144 944 HB ILE 126 HB ILE 126 6.120 0.117 -8.063 945 HG12 ILE 126 HG12 ILE 126 5.483 0.239 -10.655 946 HG13 ILE 126 HG13 ILE 126 3.911 -0.302 -10.105 947 HG21 ILE 126 HG21 ILE 126 7.137 -1.283 -9.834 948 HG22 ILE 126 HG22 ILE 126 5.813 -2.438 -9.680 949 HG23 ILE 126 HG23 ILE 126 6.920 -2.180 -8.328 950 HD11 ILE 126 HD11 ILE 126 3.988 2.089 -10.391 951 HD12 ILE 126 HD12 ILE 126 5.318 2.215 -9.237 952 HD13 ILE 126 HD13 ILE 126 3.724 1.677 -8.697 953 H SER 127 H SER 127 4.085 -3.547 -6.787 954 HA SER 127 HA SER 127 5.739 -3.300 -4.351 955 HB2 SER 127 HB2 SER 127 3.568 -5.328 -5.074 956 HB3 SER 127 HB3 SER 127 4.468 -5.299 -3.552 957 HG SER 127 HG SER 127 2.581 -4.222 -3.186 958 H THR 128 H THR 128 7.786 -3.958 -4.761 959 HA THR 128 HA THR 128 8.319 -6.194 -6.610 960 HB THR 128 HB THR 128 10.716 -5.359 -6.554 961 HG1 THR 128 HG1 THR 128 10.247 -2.855 -5.759 962 HG21 THR 128 HG21 THR 128 10.315 -3.417 -8.027 963 HG22 THR 128 HG22 THR 128 8.639 -3.329 -7.485 964 HG23 THR 128 HG23 THR 128 9.194 -4.726 -8.413 965 H PHE 129 H PHE 129 9.004 -8.071 -5.877 966 HA PHE 129 HA PHE 129 9.383 -8.489 -2.988 967 HB2 PHE 129 HB2 PHE 129 8.753 -10.538 -5.171 968 HB3 PHE 129 HB3 PHE 129 8.634 -10.776 -3.425 969 HD1 PHE 129 HD1 PHE 129 6.873 -9.469 -2.124 970 HD2 PHE 129 HD2 PHE 129 6.903 -9.573 -6.407 971 HE1 PHE 129 HE1 PHE 129 4.552 -8.661 -2.171 972 HE2 PHE 129 HE2 PHE 129 4.583 -8.779 -6.428 973 HZ PHE 129 HZ PHE 129 3.406 -8.311 -4.321 974 H GLU 130 H GLU 130 11.123 -9.794 -2.192 975 HA GLU 130 HA GLU 130 13.619 -9.534 -3.584 976 HB2 GLU 130 HB2 GLU 130 12.961 -11.166 -1.092 977 HB3 GLU 130 HB3 GLU 130 14.583 -10.734 -1.638 978 HG2 GLU 130 HG2 GLU 130 14.119 -8.370 -1.250 979 HG3 GLU 130 HG3 GLU 130 12.453 -8.744 -0.806 980 H SER 131 H SER 131 11.321 -12.185 -3.212 981 HA SER 131 HA SER 131 12.977 -13.961 -4.903 982 HB2 SER 131 HB2 SER 131 11.655 -14.778 -2.276 983 HB3 SER 131 HB3 SER 131 12.470 -15.879 -3.384 984 HG SER 131 HG SER 131 13.595 -14.762 -1.421 985 H GLU 132 H GLU 132 11.814 -15.582 -6.034 986 HA GLU 132 HA GLU 132 9.186 -15.016 -6.925 987 HB2 GLU 132 HB2 GLU 132 11.044 -16.185 -8.214 988 HB3 GLU 132 HB3 GLU 132 10.724 -17.626 -7.266 989 HG2 GLU 132 HG2 GLU 132 8.580 -16.314 -8.955 990 HG3 GLU 132 HG3 GLU 132 9.719 -17.454 -9.650 991 H GLU 133 H GLU 133 10.462 -17.399 -4.614 992 HA GLU 133 HA GLU 133 8.070 -18.697 -3.886 993 HB2 GLU 133 HB2 GLU 133 9.256 -19.317 -1.797 994 HB3 GLU 133 HB3 GLU 133 10.289 -19.520 -3.209 995 HG2 GLU 133 HG2 GLU 133 11.307 -17.266 -2.671 996 HG3 GLU 133 HG3 GLU 133 10.397 -17.280 -1.166 997 H GLN 134 H GLN 134 9.421 -15.584 -2.828 998 HA GLN 134 HA GLN 134 7.545 -14.994 -0.759 999 HB2 GLN 134 HB2 GLN 134 9.747 -13.835 -0.978 1000 HB3 GLN 134 HB3 GLN 134 9.189 -13.061 -2.460 1001 HG2 GLN 134 HG2 GLN 134 7.354 -11.971 -1.097 1002 HG3 GLN 134 HG3 GLN 134 8.118 -12.635 0.347 1003 HE21 GLN 134 HE21 GLN 134 7.653 -9.860 -0.353 1004 HE22 GLN 134 HE22 GLN 134 9.199 -9.099 -0.359 1005 H MET 135 H MET 135 7.764 -14.031 -4.187 1006 HA MET 135 HA MET 135 5.459 -12.533 -4.563 1007 HB2 MET 135 HB2 MET 135 6.848 -12.560 -6.438 1008 HB3 MET 135 HB3 MET 135 7.181 -14.277 -6.305 1009 HG2 MET 135 HG2 MET 135 5.986 -13.806 -8.347 1010 HG3 MET 135 HG3 MET 135 4.991 -14.788 -7.278 1011 HE1 MET 135 HE1 MET 135 4.174 -10.387 -8.418 1012 HE2 MET 135 HE2 MET 135 5.283 -11.461 -9.272 1013 HE3 MET 135 HE3 MET 135 5.697 -10.861 -7.664 1014 H GLN 136 H GLN 136 5.771 -16.083 -4.624 1015 HA GLN 136 HA GLN 136 3.031 -16.673 -5.176 1016 HB2 GLN 136 HB2 GLN 136 5.189 -18.387 -3.879 1017 HB3 GLN 136 HB3 GLN 136 3.620 -18.993 -4.412 1018 HG2 GLN 136 HG2 GLN 136 5.731 -17.755 -6.202 1019 HG3 GLN 136 HG3 GLN 136 5.414 -19.480 -6.035 1020 HE21 GLN 136 HE21 GLN 136 5.230 -17.593 -8.370 1021 HE22 GLN 136 HE22 GLN 136 3.655 -17.857 -9.016 1022 H LYS 137 H LYS 137 4.885 -16.514 -2.135 1023 HA LYS 137 HA LYS 137 2.875 -17.431 -0.379 1024 HB2 LYS 137 HB2 LYS 137 5.259 -17.464 0.210 1025 HB3 LYS 137 HB3 LYS 137 5.321 -15.705 0.192 1026 HG2 LYS 137 HG2 LYS 137 5.264 -16.573 2.484 1027 HG3 LYS 137 HG3 LYS 137 3.832 -15.601 2.134 1028 HD2 LYS 137 HD2 LYS 137 2.553 -17.741 1.730 1029 HD3 LYS 137 HD3 LYS 137 3.984 -18.647 2.240 1030 HE2 LYS 137 HE2 LYS 137 3.861 -17.504 4.456 1031 HE3 LYS 137 HE3 LYS 137 2.391 -16.687 3.930 1032 HZ1 LYS 137 HZ1 LYS 137 1.343 -18.852 3.686 1033 HZ2 LYS 137 HZ2 LYS 137 1.888 -18.597 5.264 1034 HZ3 LYS 137 HZ3 LYS 137 2.750 -19.615 4.226 1035 H MET 138 H MET 138 3.649 -14.137 -1.457 1036 HA MET 138 HA MET 138 1.925 -12.697 0.296 1037 HB2 MET 138 HB2 MET 138 2.845 -11.982 -2.519 1038 HB3 MET 138 HB3 MET 138 2.134 -10.857 -1.370 1039 HG2 MET 138 HG2 MET 138 4.597 -12.282 -0.466 1040 HG3 MET 138 HG3 MET 138 4.792 -11.100 -1.750 1041 HE1 MET 138 HE1 MET 138 3.404 -10.077 2.552 1042 HE2 MET 138 HE2 MET 138 4.017 -11.658 2.066 1043 HE3 MET 138 HE3 MET 138 2.431 -11.116 1.510 1044 H ALA 139 H ALA 139 1.435 -14.120 -2.918 1045 HA ALA 139 HA ALA 139 -1.302 -13.461 -3.272 1046 HB1 ALA 139 HB1 ALA 139 0.152 -14.191 -5.121 1047 HB2 ALA 139 HB2 ALA 139 -1.284 -15.217 -5.006 1048 HB3 ALA 139 HB3 ALA 139 0.272 -15.801 -4.403 1049 H GLU 140 H GLU 140 0.300 -16.211 -1.643 1050 HA GLU 140 HA GLU 140 -2.036 -17.771 -1.100 1051 HB2 GLU 140 HB2 GLU 140 0.655 -17.747 0.339 1052 HB3 GLU 140 HB3 GLU 140 -0.594 -18.974 0.559 1053 HG2 GLU 140 HG2 GLU 140 -0.380 -19.575 -1.844 1054 HG3 GLU 140 HG3 GLU 140 0.917 -18.400 -2.006 1055 H MET 141 H MET 141 -0.517 -15.088 0.592 1056 HA MET 141 HA MET 141 -2.142 -15.230 2.983 1057 HB2 MET 141 HB2 MET 141 -0.381 -13.044 1.809 1058 HB3 MET 141 HB3 MET 141 -1.234 -12.864 3.339 1059 HG2 MET 141 HG2 MET 141 0.787 -15.043 2.777 1060 HG3 MET 141 HG3 MET 141 1.158 -13.514 3.575 1061 HE1 MET 141 HE1 MET 141 0.388 -12.878 6.037 1062 HE2 MET 141 HE2 MET 141 -0.822 -13.794 6.935 1063 HE3 MET 141 HE3 MET 141 -1.278 -12.943 5.461 1064 H GLY 142 H GLY 142 -2.776 -14.191 -0.214 1065 HA2 GLY 142 HA2 GLY 142 -4.585 -13.138 -1.172 1066 HA3 GLY 142 HA3 GLY 142 -5.346 -13.068 0.412 1067 H MET 143 H MET 143 -2.158 -11.735 0.107 1068 HA MET 143 HA MET 143 -2.951 -9.037 0.691 1069 HB2 MET 143 HB2 MET 143 -0.772 -9.982 1.431 1070 HB3 MET 143 HB3 MET 143 -0.252 -10.134 -0.241 1071 HG2 MET 143 HG2 MET 143 -0.412 -7.638 -0.454 1072 HG3 MET 143 HG3 MET 143 -0.774 -7.556 1.273 1073 HE1 MET 143 HE1 MET 143 1.305 -5.877 1.666 1074 HE2 MET 143 HE2 MET 143 1.654 -5.925 -0.064 1075 HE3 MET 143 HE3 MET 143 2.942 -6.224 1.103 1076 H GLU 144 H GLU 144 -2.086 -10.802 -2.207 1077 HA GLU 144 HA GLU 144 -1.736 -8.848 -4.140 1078 HB2 GLU 144 HB2 GLU 144 -1.335 -11.246 -4.465 1079 HB3 GLU 144 HB3 GLU 144 -3.049 -11.595 -4.313 1080 HG2 GLU 144 HG2 GLU 144 -3.462 -10.330 -6.410 1081 HG3 GLU 144 HG3 GLU 144 -1.726 -10.060 -6.569 1082 H GLU 145 H GLU 145 -4.778 -10.609 -3.528 1083 HA GLU 145 HA GLU 145 -6.447 -8.723 -4.960 1084 HB2 GLU 145 HB2 GLU 145 -7.162 -11.163 -3.275 1085 HB3 GLU 145 HB3 GLU 145 -8.255 -10.316 -4.370 1086 HG2 GLU 145 HG2 GLU 145 -6.835 -10.914 -6.282 1087 HG3 GLU 145 HG3 GLU 145 -5.697 -11.726 -5.211 1088 H GLY 146 H GLY 146 -5.543 -9.239 -1.618 1089 HA2 GLY 146 HA2 GLY 146 -7.675 -7.878 -0.308 1090 HA3 GLY 146 HA3 GLY 146 -6.094 -8.227 0.371 1091 H MET 147 H MET 147 -4.441 -6.763 -1.385 1092 HA MET 147 HA MET 147 -4.651 -4.052 -0.655 1093 HB2 MET 147 HB2 MET 147 -3.138 -5.431 -2.888 1094 HB3 MET 147 HB3 MET 147 -3.154 -3.676 -2.800 1095 HG2 MET 147 HG2 MET 147 -2.143 -3.762 -0.569 1096 HG3 MET 147 HG3 MET 147 -2.151 -5.516 -0.638 1097 HE1 MET 147 HE1 MET 147 -0.605 -2.227 -2.185 1098 HE2 MET 147 HE2 MET 147 -1.279 -3.004 -3.617 1099 HE3 MET 147 HE3 MET 147 0.469 -2.889 -3.415 1100 H ARG 148 H ARG 148 -5.697 -5.721 -3.653 1101 HA ARG 148 HA ARG 148 -6.618 -3.505 -5.094 1102 HB2 ARG 148 HB2 ARG 148 -6.350 -5.710 -6.125 1103 HB3 ARG 148 HB3 ARG 148 -7.625 -6.384 -5.110 1104 HG2 ARG 148 HG2 ARG 148 -9.296 -4.978 -6.224 1105 HG3 ARG 148 HG3 ARG 148 -8.037 -4.210 -7.191 1106 HD2 ARG 148 HD2 ARG 148 -7.592 -6.296 -8.360 1107 HD3 ARG 148 HD3 ARG 148 -8.712 -7.168 -7.301 1108 HE ARG 148 HE ARG 148 -10.380 -5.402 -8.285 1109 HH11 ARG 148 HH11 ARG 148 -7.970 -7.120 -10.067 1110 HH12 ARG 148 HH12 ARG 148 -8.882 -7.079 -11.532 1111 HH21 ARG 148 HH21 ARG 148 -11.504 -5.349 -10.183 1112 HH22 ARG 148 HH22 ARG 148 -10.840 -6.086 -11.597 1113 H GLU 149 H GLU 149 -8.414 -5.552 -2.742 1114 HA GLU 149 HA GLU 149 -10.935 -4.276 -2.835 1115 HB2 GLU 149 HB2 GLU 149 -9.530 -5.722 -0.554 1116 HB3 GLU 149 HB3 GLU 149 -11.220 -5.217 -0.488 1117 HG2 GLU 149 HG2 GLU 149 -11.770 -6.684 -2.355 1118 HG3 GLU 149 HG3 GLU 149 -10.067 -7.128 -2.538 1119 H ALA 150 H ALA 150 -8.124 -3.625 -0.740 1120 HA ALA 150 HA ALA 150 -9.164 -1.505 0.811 1121 HB1 ALA 150 HB1 ALA 150 -6.803 -1.010 1.342 1122 HB2 ALA 150 HB2 ALA 150 -6.278 -2.037 0.001 1123 HB3 ALA 150 HB3 ALA 150 -7.111 -2.749 1.386 1124 H ILE 151 H ILE 151 -7.541 -1.521 -2.324 1125 HA ILE 151 HA ILE 151 -7.257 1.341 -2.548 1126 HB ILE 151 HB ILE 151 -6.723 -0.896 -4.553 1127 HG12 ILE 151 HG12 ILE 151 -4.670 0.707 -2.955 1128 HG13 ILE 151 HG13 ILE 151 -5.342 -0.804 -2.363 1129 HG21 ILE 151 HG21 ILE 151 -7.083 1.206 -5.770 1130 HG22 ILE 151 HG22 ILE 151 -5.378 0.755 -5.830 1131 HG23 ILE 151 HG23 ILE 151 -5.915 2.031 -4.734 1132 HD11 ILE 151 HD11 ILE 151 -3.191 -1.203 -3.323 1133 HD12 ILE 151 HD12 ILE 151 -3.667 -0.437 -4.842 1134 HD13 ILE 151 HD13 ILE 151 -4.417 -1.958 -4.342 1135 H GLU 152 H GLU 152 -9.625 -1.040 -3.570 1136 HA GLU 152 HA GLU 152 -11.232 0.756 -5.159 1137 HB2 GLU 152 HB2 GLU 152 -11.879 -1.889 -3.791 1138 HB3 GLU 152 HB3 GLU 152 -13.050 -0.997 -4.765 1139 HG2 GLU 152 HG2 GLU 152 -11.589 -1.209 -6.734 1140 HG3 GLU 152 HG3 GLU 152 -10.404 -2.087 -5.769 1141 H GLN 153 H GLN 153 -10.793 0.248 -1.723 1142 HA GLN 153 HA GLN 153 -13.309 1.521 -0.960 1143 HB2 GLN 153 HB2 GLN 153 -12.284 -0.356 0.363 1144 HB3 GLN 153 HB3 GLN 153 -10.947 0.706 0.787 1145 HG2 GLN 153 HG2 GLN 153 -12.538 2.215 1.953 1146 HG3 GLN 153 HG3 GLN 153 -13.864 1.131 1.536 1147 HE21 GLN 153 HE21 GLN 153 -10.670 0.031 2.545 1148 HE22 GLN 153 HE22 GLN 153 -11.185 -0.624 4.051 1149 H ILE 154 H ILE 154 -10.112 2.546 -1.796 1150 HA ILE 154 HA ILE 154 -9.872 4.985 -0.379 1151 HB ILE 154 HB ILE 154 -8.939 4.334 -3.205 1152 HG12 ILE 154 HG12 ILE 154 -7.402 4.258 -0.577 1153 HG13 ILE 154 HG13 ILE 154 -8.013 2.844 -1.429 1154 HG21 ILE 154 HG21 ILE 154 -9.007 6.777 -2.895 1155 HG22 ILE 154 HG22 ILE 154 -7.336 6.221 -2.944 1156 HG23 ILE 154 HG23 ILE 154 -8.081 6.634 -1.398 1157 HD11 ILE 154 HD11 ILE 154 -5.646 3.157 -1.796 1158 HD12 ILE 154 HD12 ILE 154 -5.931 4.762 -2.462 1159 HD13 ILE 154 HD13 ILE 154 -6.535 3.335 -3.306 1160 H ASP 155 H ASP 155 -11.548 4.184 -3.422 1161 HA ASP 155 HA ASP 155 -12.543 6.671 -4.204 1162 HB2 ASP 155 HB2 ASP 155 -14.022 3.998 -4.334 1163 HB3 ASP 155 HB3 ASP 155 -14.350 5.421 -5.327 1164 H ALA 156 H ALA 156 -13.886 4.290 -1.930 1165 HA ALA 156 HA ALA 156 -16.184 5.733 -1.084 1166 HB1 ALA 156 HB1 ALA 156 -15.926 3.290 -0.786 1167 HB2 ALA 156 HB2 ALA 156 -16.275 4.071 0.755 1168 HB3 ALA 156 HB3 ALA 156 -14.624 3.548 0.380 1169 H VAL 157 H VAL 157 -12.818 5.838 0.024 1170 HA VAL 157 HA VAL 157 -13.308 7.282 2.485 1171 HB VAL 157 HB VAL 157 -10.755 6.837 0.849 1172 HG11 VAL 157 HG11 VAL 157 -9.453 7.614 2.823 1173 HG12 VAL 157 HG12 VAL 157 -10.954 8.094 3.617 1174 HG13 VAL 157 HG13 VAL 157 -10.439 8.910 2.138 1175 HG21 VAL 157 HG21 VAL 157 -11.685 5.558 3.450 1176 HG22 VAL 157 HG22 VAL 157 -10.157 5.231 2.630 1177 HG23 VAL 157 HG23 VAL 157 -11.680 4.787 1.862 1178 H LEU 158 H LEU 158 -12.507 8.199 -0.849 1179 HA LEU 158 HA LEU 158 -12.372 11.067 -0.233 1180 HB2 LEU 158 HB2 LEU 158 -12.047 9.587 -2.878 1181 HB3 LEU 158 HB3 LEU 158 -11.762 11.306 -2.637 1182 HG LEU 158 HG LEU 158 -10.156 9.061 -1.339 1183 HD11 LEU 158 HD11 LEU 158 -9.720 9.173 -3.740 1184 HD12 LEU 158 HD12 LEU 158 -8.318 9.716 -2.823 1185 HD13 LEU 158 HD13 LEU 158 -9.361 10.900 -3.620 1186 HD21 LEU 158 HD21 LEU 158 -9.696 12.066 -1.246 1187 HD22 LEU 158 HD22 LEU 158 -8.612 10.834 -0.588 1188 HD23 LEU 158 HD23 LEU 158 -10.222 11.043 0.098 1189 H SER 159 H SER 159 -14.878 8.941 -0.776 1190 HA SER 159 HA SER 159 -16.739 10.977 -1.810 1191 HB2 SER 159 HB2 SER 159 -15.730 9.582 -3.754 1192 HB3 SER 159 HB3 SER 159 -16.601 8.219 -3.096 1193 HG SER 159 HG SER 159 -17.520 10.010 -4.756 1194 H GLU 160 H GLU 160 -16.483 9.785 0.819 1195 HA GLU 160 HA GLU 160 -18.198 7.557 1.188 1196 HB2 GLU 160 HB2 GLU 160 -16.422 8.444 2.811 1197 HB3 GLU 160 HB3 GLU 160 -17.609 9.626 3.336 1198 HG2 GLU 160 HG2 GLU 160 -19.145 7.647 3.843 1199 HG3 GLU 160 HG3 GLU 160 -17.761 6.605 3.573 1200 HA PRO 161 HA PRO 161 -22.020 9.936 0.657 1201 HB2 PRO 161 HB2 PRO 161 -23.818 7.850 0.946 1202 HB3 PRO 161 HB3 PRO 161 -22.912 8.160 -0.544 1203 HG2 PRO 161 HG2 PRO 161 -22.340 6.168 1.646 1204 HG3 PRO 161 HG3 PRO 161 -22.213 5.962 -0.114 1205 HD2 PRO 161 HD2 PRO 161 -20.047 6.432 1.493 1206 HD3 PRO 161 HD3 PRO 161 -20.110 6.965 -0.200 1207 H ALA 162 H ALA 162 -21.417 7.770 3.316 1208 HA ALA 162 HA ALA 162 -22.249 9.295 5.475 1209 HB1 ALA 162 HB1 ALA 162 -24.548 9.124 4.556 1210 HB2 ALA 162 HB2 ALA 162 -24.421 8.296 6.111 1211 HB3 ALA 162 HB3 ALA 162 -24.433 7.364 4.609 1212 H ASN 163 H ASN 163 -22.022 6.122 4.058 1213 HA ASN 163 HA ASN 163 -20.940 4.938 6.529 1214 HB2 ASN 163 HB2 ASN 163 -22.551 3.077 6.371 1215 HB3 ASN 163 HB3 ASN 163 -23.398 4.597 6.554 1216 HD21 ASN 163 HD21 ASN 163 -24.326 2.040 5.405 1217 HD22 ASN 163 HD22 ASN 163 -24.887 2.419 3.815 1218 H ALA 164 H ALA 164 -20.833 5.180 3.139 1219 HA ALA 164 HA ALA 164 -20.019 4.032 1.376 1220 HB1 ALA 164 HB1 ALA 164 -17.992 2.656 1.660 1221 HB2 ALA 164 HB2 ALA 164 -18.239 2.641 3.408 1222 HB3 ALA 164 HB3 ALA 164 -17.872 4.156 2.585 1223 H LEU 165 H LEU 165 -21.975 3.067 0.881 1224 HA LEU 165 HA LEU 165 -23.201 0.950 2.234 1225 HB2 LEU 165 HB2 LEU 165 -24.644 0.775 0.078 1226 HB3 LEU 165 HB3 LEU 165 -24.677 2.250 1.024 1227 HG LEU 165 HG LEU 165 -23.016 3.245 -0.658 1228 HD11 LEU 165 HD11 LEU 165 -22.180 1.224 -1.714 1229 HD12 LEU 165 HD12 LEU 165 -22.904 2.294 -2.908 1230 HD13 LEU 165 HD13 LEU 165 -23.782 0.863 -2.361 1231 HD21 LEU 165 HD21 LEU 165 -25.773 2.528 -1.696 1232 HD22 LEU 165 HD22 LEU 165 -24.748 3.842 -2.283 1233 HD23 LEU 165 HD23 LEU 165 -25.372 3.883 -0.637 1234 H GLU 166 H GLU 166 -23.585 -1.208 1.767 1235 HA GLU 166 HA GLU 166 -21.257 -2.655 0.714 1236 HB2 GLU 166 HB2 GLU 166 -23.661 -3.583 2.344 1237 HB3 GLU 166 HB3 GLU 166 -22.237 -4.557 1.987 1238 HG2 GLU 166 HG2 GLU 166 -20.836 -3.185 3.369 1239 HG3 GLU 166 HG3 GLU 166 -22.090 -1.955 3.537 1240 H HIS 167 H HIS 167 -22.901 -1.574 -1.344 1241 HA HIS 167 HA HIS 167 -24.849 -3.450 -2.315 1242 HB2 HIS 167 HB2 HIS 167 -24.748 -0.927 -2.791 1243 HB3 HIS 167 HB3 HIS 167 -23.479 -1.279 -3.955 1244 HD1 HIS 167 HD1 HIS 167 -27.143 -1.958 -3.319 1245 HD2 HIS 167 HD2 HIS 167 -24.416 -2.096 -6.448 1246 HE1 HIS 167 HE1 HIS 167 -28.506 -2.407 -5.367 1247 HE2 HIS 167 HE2 HIS 167 -26.830 -2.632 -7.219 1248 H HIS 168 H HIS 168 -21.443 -3.508 -2.395 1249 HA HIS 168 HA HIS 168 -21.036 -5.096 -4.753 1250 HB2 HIS 168 HB2 HIS 168 -19.179 -3.832 -3.726 1251 HB3 HIS 168 HB3 HIS 168 -19.323 -4.772 -2.248 1252 HD1 HIS 168 HD1 HIS 168 -18.550 -5.377 -5.928 1253 HD2 HIS 168 HD2 HIS 168 -17.602 -6.894 -2.178 1254 HE1 HIS 168 HE1 HIS 168 -16.855 -7.174 -6.344 1255 HE2 HIS 168 HE2 HIS 168 -16.467 -8.209 -4.094 1256 H HIS 169 H HIS 169 -22.564 -6.737 -4.730 1257 HA HIS 169 HA HIS 169 -23.088 -8.363 -2.391 1258 HB2 HIS 169 HB2 HIS 169 -24.853 -7.553 -4.021 1259 HB3 HIS 169 HB3 HIS 169 -24.210 -8.684 -5.206 1260 HD1 HIS 169 HD1 HIS 169 -26.218 -8.513 -2.054 1261 HD2 HIS 169 HD2 HIS 169 -24.892 -11.409 -4.723 1262 HE1 HIS 169 HE1 HIS 169 -27.506 -10.587 -1.488 1263 HE2 HIS 169 HE2 HIS 169 -26.526 -12.370 -2.957 1264 H HIS 170 H HIS 170 -21.272 -8.747 -5.382 1265 HA HIS 170 HA HIS 170 -20.851 -11.588 -5.195 1266 HB2 HIS 170 HB2 HIS 170 -20.699 -10.412 -7.360 1267 HB3 HIS 170 HB3 HIS 170 -19.348 -9.450 -6.775 1268 HD1 HIS 170 HD1 HIS 170 -17.469 -10.253 -8.239 1269 HD2 HIS 170 HD2 HIS 170 -19.641 -13.413 -6.644 1270 HE1 HIS 170 HE1 HIS 170 -16.233 -12.325 -8.923 1271 HE2 HIS 170 HE2 HIS 170 -17.477 -14.207 -7.810 1272 H HIS 171 H HIS 171 -19.855 -12.355 -3.418 1273 HA HIS 171 HA HIS 171 -17.805 -10.866 -1.985 1274 HB2 HIS 171 HB2 HIS 171 -19.080 -13.583 -1.448 1275 HB3 HIS 171 HB3 HIS 171 -17.910 -12.807 -0.381 1276 HD1 HIS 171 HD1 HIS 171 -18.703 -10.545 0.768 1277 HD2 HIS 171 HD2 HIS 171 -21.689 -12.704 -1.139 1278 HE1 HIS 171 HE1 HIS 171 -20.859 -9.561 1.580 1279 HE2 HIS 171 HE2 HIS 171 -22.651 -10.837 0.371 1280 H HIS 172 H HIS 172 -15.967 -12.453 -1.049 1281 HA HIS 172 HA HIS 172 -14.689 -14.048 -3.141 1282 HB2 HIS 172 HB2 HIS 172 -14.110 -11.579 -3.546 1283 HB3 HIS 172 HB3 HIS 172 -13.247 -11.603 -2.011 1284 HD1 HIS 172 HD1 HIS 172 -13.223 -13.432 -5.344 1285 HD2 HIS 172 HD2 HIS 172 -10.623 -12.388 -2.270 1286 HE1 HIS 172 HE1 HIS 172 -10.963 -14.188 -6.097 1287 HE2 HIS 172 HE2 HIS 172 -9.447 -13.680 -4.164 Start of MODEL 8 1 H1 THR 1 H1 THR 1 -10.995 2.084 -7.090 2 H2 THR 1 H2 THR 1 -12.395 1.142 -7.073 3 H3 THR 1 H3 THR 1 -12.486 2.799 -7.424 4 HA THR 1 HA THR 1 -12.719 1.467 -9.416 5 HB THR 1 HB THR 1 -10.684 2.445 -10.725 6 HG1 THR 1 HG1 THR 1 -10.111 4.292 -8.838 7 HG21 THR 1 HG21 THR 1 -11.563 4.722 -10.660 8 HG22 THR 1 HG22 THR 1 -12.464 4.354 -9.186 9 HG23 THR 1 HG23 THR 1 -12.878 3.541 -10.698 10 H VAL 2 H VAL 2 -9.271 1.281 -8.478 11 HA VAL 2 HA VAL 2 -7.611 -0.095 -9.163 12 HB VAL 2 HB VAL 2 -9.606 -2.343 -8.633 13 HG11 VAL 2 HG11 VAL 2 -7.539 -3.129 -9.722 14 HG12 VAL 2 HG12 VAL 2 -7.611 -3.700 -8.055 15 HG13 VAL 2 HG13 VAL 2 -6.562 -2.343 -8.477 16 HG21 VAL 2 HG21 VAL 2 -7.798 -0.945 -6.624 17 HG22 VAL 2 HG22 VAL 2 -8.801 -2.359 -6.293 18 HG23 VAL 2 HG23 VAL 2 -9.557 -0.817 -6.697 19 H VAL 3 H VAL 3 -7.967 0.886 -11.326 20 HA VAL 3 HA VAL 3 -9.663 -0.328 -13.270 21 HB VAL 3 HB VAL 3 -8.672 1.268 -14.905 22 HG11 VAL 3 HG11 VAL 3 -9.394 2.542 -12.235 23 HG12 VAL 3 HG12 VAL 3 -10.538 2.012 -13.472 24 HG13 VAL 3 HG13 VAL 3 -9.436 3.350 -13.805 25 HG21 VAL 3 HG21 VAL 3 -6.329 1.292 -14.101 26 HG22 VAL 3 HG22 VAL 3 -6.838 2.107 -12.621 27 HG23 VAL 3 HG23 VAL 3 -6.977 2.934 -14.175 28 H SER 4 H SER 4 -6.387 -1.016 -12.328 29 HA SER 4 HA SER 4 -6.234 -3.190 -14.273 30 HB2 SER 4 HB2 SER 4 -5.180 -1.287 -15.483 31 HB3 SER 4 HB3 SER 4 -4.052 -1.061 -14.149 32 HG SER 4 HG SER 4 -2.879 -2.605 -14.930 33 H VAL 5 H VAL 5 -5.191 -4.953 -13.446 34 HA VAL 5 HA VAL 5 -3.438 -4.671 -11.056 35 HB VAL 5 HB VAL 5 -5.251 -7.059 -11.696 36 HG11 VAL 5 HG11 VAL 5 -4.531 -7.963 -9.489 37 HG12 VAL 5 HG12 VAL 5 -3.429 -6.602 -9.287 38 HG13 VAL 5 HG13 VAL 5 -3.152 -7.773 -10.577 39 HG21 VAL 5 HG21 VAL 5 -5.513 -5.006 -9.467 40 HG22 VAL 5 HG22 VAL 5 -6.535 -6.430 -9.679 41 HG23 VAL 5 HG23 VAL 5 -6.565 -5.136 -10.880 42 H ASP 6 H ASP 6 -1.407 -4.925 -11.803 43 HA ASP 6 HA ASP 6 -0.777 -7.043 -13.786 44 HB2 ASP 6 HB2 ASP 6 0.752 -4.480 -13.131 45 HB3 ASP 6 HB3 ASP 6 1.292 -5.710 -14.274 46 H LYS 7 H LYS 7 0.577 -8.673 -13.163 47 HA LYS 7 HA LYS 7 2.440 -8.260 -10.905 48 HB2 LYS 7 HB2 LYS 7 0.453 -9.602 -10.128 49 HB3 LYS 7 HB3 LYS 7 0.842 -10.829 -11.329 50 HG2 LYS 7 HG2 LYS 7 2.993 -11.267 -10.215 51 HG3 LYS 7 HG3 LYS 7 2.674 -9.975 -9.059 52 HD2 LYS 7 HD2 LYS 7 2.176 -11.974 -7.891 53 HD3 LYS 7 HD3 LYS 7 0.604 -11.316 -8.337 54 HE2 LYS 7 HE2 LYS 7 2.013 -13.497 -9.919 55 HE3 LYS 7 HE3 LYS 7 0.870 -13.827 -8.622 56 HZ1 LYS 7 HZ1 LYS 7 -0.825 -12.644 -9.891 57 HZ2 LYS 7 HZ2 LYS 7 -0.196 -13.945 -10.764 58 HZ3 LYS 7 HZ3 LYS 7 0.277 -12.370 -11.140 59 H ASP 8 H ASP 8 4.464 -8.951 -11.308 60 HA ASP 8 HA ASP 8 5.036 -10.640 -13.684 61 HB2 ASP 8 HB2 ASP 8 5.669 -8.109 -13.801 62 HB3 ASP 8 HB3 ASP 8 6.913 -8.483 -12.618 63 H VAL 9 H VAL 9 5.464 -12.587 -12.788 64 HA VAL 9 HA VAL 9 6.560 -12.937 -10.147 65 HB VAL 9 HB VAL 9 6.062 -15.034 -12.308 66 HG11 VAL 9 HG11 VAL 9 5.959 -16.664 -10.439 67 HG12 VAL 9 HG12 VAL 9 6.390 -15.387 -9.301 68 HG13 VAL 9 HG13 VAL 9 7.545 -15.893 -10.535 69 HG21 VAL 9 HG21 VAL 9 3.991 -13.785 -11.795 70 HG22 VAL 9 HG22 VAL 9 4.204 -14.119 -10.073 71 HG23 VAL 9 HG23 VAL 9 3.890 -15.443 -11.197 72 H GLU 10 H GLU 10 7.890 -12.953 -13.404 73 HA GLU 10 HA GLU 10 10.384 -14.258 -12.742 74 HB2 GLU 10 HB2 GLU 10 9.642 -12.587 -15.184 75 HB3 GLU 10 HB3 GLU 10 11.064 -13.628 -15.038 76 HG2 GLU 10 HG2 GLU 10 9.523 -15.576 -14.720 77 HG3 GLU 10 HG3 GLU 10 8.159 -14.508 -15.037 78 H ALA 11 H ALA 11 9.329 -10.909 -13.057 79 HA ALA 11 HA ALA 11 12.009 -9.851 -12.409 80 HB1 ALA 11 HB1 ALA 11 11.089 -7.663 -13.066 81 HB2 ALA 11 HB2 ALA 11 9.489 -8.388 -13.273 82 HB3 ALA 11 HB3 ALA 11 10.817 -8.868 -14.328 83 H LEU 12 H LEU 12 9.528 -10.984 -10.638 84 HA LEU 12 HA LEU 12 8.744 -10.793 -8.523 85 HB2 LEU 12 HB2 LEU 12 11.431 -9.479 -7.986 86 HB3 LEU 12 HB3 LEU 12 10.405 -10.265 -6.793 87 HG LEU 12 HG LEU 12 11.856 -11.646 -9.093 88 HD11 LEU 12 HD11 LEU 12 13.221 -12.696 -7.346 89 HD12 LEU 12 HD12 LEU 12 12.389 -11.750 -6.108 90 HD13 LEU 12 HD13 LEU 12 13.383 -10.940 -7.326 91 HD21 LEU 12 HD21 LEU 12 10.110 -12.866 -6.928 92 HD22 LEU 12 HD22 LEU 12 11.086 -13.768 -8.093 93 HD23 LEU 12 HD23 LEU 12 9.742 -12.778 -8.653 94 H SER 13 H SER 13 7.408 -8.991 -9.771 95 HA SER 13 HA SER 13 7.274 -6.638 -7.995 96 HB2 SER 13 HB2 SER 13 8.557 -5.956 -10.023 97 HB3 SER 13 HB3 SER 13 7.199 -6.431 -11.039 98 HG SER 13 HG SER 13 7.448 -4.265 -9.270 99 H PHE 14 H PHE 14 5.236 -5.477 -8.107 100 HA PHE 14 HA PHE 14 2.907 -6.781 -9.333 101 HB2 PHE 14 HB2 PHE 14 3.240 -7.909 -7.134 102 HB3 PHE 14 HB3 PHE 14 3.196 -6.351 -6.320 103 HD1 PHE 14 HD1 PHE 14 0.963 -7.876 -8.946 104 HD2 PHE 14 HD2 PHE 14 1.279 -6.324 -4.971 105 HE1 PHE 14 HE1 PHE 14 -1.450 -8.193 -8.627 106 HE2 PHE 14 HE2 PHE 14 -1.135 -6.636 -4.668 107 HZ PHE 14 HZ PHE 14 -2.501 -7.571 -6.490 108 H SER 15 H SER 15 2.128 -5.046 -10.450 109 HA SER 15 HA SER 15 2.163 -2.343 -9.228 110 HB2 SER 15 HB2 SER 15 3.565 -2.514 -11.236 111 HB3 SER 15 HB3 SER 15 2.193 -3.102 -12.176 112 HG SER 15 HG SER 15 2.900 -0.634 -11.877 113 H ILE 16 H ILE 16 0.201 -1.834 -8.425 114 HA ILE 16 HA ILE 16 -2.284 -2.590 -9.847 115 HB ILE 16 HB ILE 16 -1.908 -1.494 -7.025 116 HG12 ILE 16 HG12 ILE 16 -2.693 -4.317 -7.878 117 HG13 ILE 16 HG13 ILE 16 -1.075 -3.851 -7.357 118 HG21 ILE 16 HG21 ILE 16 -4.459 -2.465 -8.388 119 HG22 ILE 16 HG22 ILE 16 -4.089 -0.799 -7.938 120 HG23 ILE 16 HG23 ILE 16 -4.321 -2.018 -6.685 121 HD11 ILE 16 HD11 ILE 16 -3.559 -3.670 -5.652 122 HD12 ILE 16 HD12 ILE 16 -1.902 -3.309 -5.153 123 HD13 ILE 16 HD13 ILE 16 -2.353 -4.953 -5.593 124 H VAL 17 H VAL 17 -3.257 -1.082 -11.037 125 HA VAL 17 HA VAL 17 -2.651 1.789 -10.654 126 HB VAL 17 HB VAL 17 -3.768 0.503 -13.184 127 HG11 VAL 17 HG11 VAL 17 -2.411 3.192 -12.733 128 HG12 VAL 17 HG12 VAL 17 -4.141 2.936 -12.980 129 HG13 VAL 17 HG13 VAL 17 -3.002 2.583 -14.282 130 HG21 VAL 17 HG21 VAL 17 -1.577 -0.533 -12.758 131 HG22 VAL 17 HG22 VAL 17 -0.839 1.059 -12.571 132 HG23 VAL 17 HG23 VAL 17 -1.479 0.566 -14.139 133 H ALA 18 H ALA 18 -4.324 3.195 -10.313 134 HA ALA 18 HA ALA 18 -7.135 2.440 -10.684 135 HB1 ALA 18 HB1 ALA 18 -6.028 3.342 -7.996 136 HB2 ALA 18 HB2 ALA 18 -6.599 1.718 -8.385 137 HB3 ALA 18 HB3 ALA 18 -7.733 3.070 -8.368 138 H GLU 19 H GLU 19 -8.528 4.264 -10.948 139 HA GLU 19 HA GLU 19 -7.201 6.924 -11.163 140 HB2 GLU 19 HB2 GLU 19 -9.660 5.921 -12.665 141 HB3 GLU 19 HB3 GLU 19 -8.939 7.525 -12.823 142 HG2 GLU 19 HG2 GLU 19 -6.802 6.300 -13.571 143 HG3 GLU 19 HG3 GLU 19 -7.810 4.861 -13.722 144 H PHE 20 H PHE 20 -8.165 8.712 -10.186 145 HA PHE 20 HA PHE 20 -10.599 8.272 -8.556 146 HB2 PHE 20 HB2 PHE 20 -7.995 9.502 -7.539 147 HB3 PHE 20 HB3 PHE 20 -9.494 9.372 -6.621 148 HD1 PHE 20 HD1 PHE 20 -10.496 6.862 -6.551 149 HD2 PHE 20 HD2 PHE 20 -6.368 7.851 -7.114 150 HE1 PHE 20 HE1 PHE 20 -9.848 4.622 -5.790 151 HE2 PHE 20 HE2 PHE 20 -5.737 5.604 -6.346 152 HZ PHE 20 HZ PHE 20 -7.473 3.989 -5.690 153 H ASP 21 H ASP 21 -12.056 9.863 -8.756 154 HA ASP 21 HA ASP 21 -11.458 12.293 -10.223 155 HB2 ASP 21 HB2 ASP 21 -14.033 11.507 -8.789 156 HB3 ASP 21 HB3 ASP 21 -13.853 12.776 -9.996 157 H ALA 22 H ALA 22 -9.908 13.207 -8.882 158 HA ALA 22 HA ALA 22 -10.655 15.170 -6.985 159 HB1 ALA 22 HB1 ALA 22 -9.553 14.259 -4.942 160 HB2 ALA 22 HB2 ALA 22 -9.281 12.724 -5.774 161 HB3 ALA 22 HB3 ALA 22 -10.926 13.259 -5.424 162 H ASP 23 H ASP 23 -8.580 16.253 -6.064 163 HA ASP 23 HA ASP 23 -6.610 16.325 -8.226 164 HB2 ASP 23 HB2 ASP 23 -5.622 18.264 -7.072 165 HB3 ASP 23 HB3 ASP 23 -7.346 18.482 -7.307 166 H VAL 24 H VAL 24 -4.268 16.564 -7.540 167 HA VAL 24 HA VAL 24 -3.395 14.025 -6.773 168 HB VAL 24 HB VAL 24 -1.803 16.600 -7.075 169 HG11 VAL 24 HG11 VAL 24 0.147 15.132 -7.559 170 HG12 VAL 24 HG12 VAL 24 -0.834 13.713 -7.190 171 HG13 VAL 24 HG13 VAL 24 -0.456 14.876 -5.918 172 HG21 VAL 24 HG21 VAL 24 -2.408 14.420 -9.103 173 HG22 VAL 24 HG22 VAL 24 -1.395 15.840 -9.379 174 HG23 VAL 24 HG23 VAL 24 -3.122 16.038 -9.079 175 H LYS 25 H LYS 25 -3.381 17.086 -4.927 176 HA LYS 25 HA LYS 25 -2.025 16.018 -2.644 177 HB2 LYS 25 HB2 LYS 25 -3.584 18.561 -3.125 178 HB3 LYS 25 HB3 LYS 25 -3.078 18.144 -1.494 179 HG2 LYS 25 HG2 LYS 25 -0.904 18.035 -3.528 180 HG3 LYS 25 HG3 LYS 25 -1.588 19.634 -3.261 181 HD2 LYS 25 HD2 LYS 25 0.403 19.225 -1.832 182 HD3 LYS 25 HD3 LYS 25 -1.044 19.523 -0.872 183 HE2 LYS 25 HE2 LYS 25 -1.249 17.122 -0.400 184 HE3 LYS 25 HE3 LYS 25 0.135 16.774 -1.436 185 HZ1 LYS 25 HZ1 LYS 25 0.260 18.465 0.998 186 HZ2 LYS 25 HZ2 LYS 25 1.564 17.926 0.062 187 HZ3 LYS 25 HZ3 LYS 25 0.651 16.818 0.963 188 H ARG 26 H ARG 26 -5.430 16.168 -3.554 189 HA ARG 26 HA ARG 26 -6.557 15.535 -0.993 190 HB2 ARG 26 HB2 ARG 26 -7.632 16.442 -3.315 191 HB3 ARG 26 HB3 ARG 26 -8.006 14.741 -3.523 192 HG2 ARG 26 HG2 ARG 26 -8.896 16.490 -1.194 193 HG3 ARG 26 HG3 ARG 26 -9.893 16.033 -2.574 194 HD2 ARG 26 HD2 ARG 26 -9.670 13.642 -1.878 195 HD3 ARG 26 HD3 ARG 26 -8.772 14.172 -0.450 196 HE ARG 26 HE ARG 26 -11.376 15.392 -0.742 197 HH11 ARG 26 HH11 ARG 26 -9.663 12.711 0.643 198 HH12 ARG 26 HH12 ARG 26 -10.943 12.331 1.736 199 HH21 ARG 26 HH21 ARG 26 -12.994 14.868 0.652 200 HH22 ARG 26 HH22 ARG 26 -12.809 13.537 1.736 201 H VAL 27 H VAL 27 -5.582 13.595 -3.807 202 HA VAL 27 HA VAL 27 -6.211 11.024 -2.653 203 HB VAL 27 HB VAL 27 -4.390 11.595 -5.039 204 HG11 VAL 27 HG11 VAL 27 -4.154 9.290 -4.180 205 HG12 VAL 27 HG12 VAL 27 -4.955 9.280 -5.752 206 HG13 VAL 27 HG13 VAL 27 -5.903 9.056 -4.279 207 HG21 VAL 27 HG21 VAL 27 -7.397 11.100 -5.057 208 HG22 VAL 27 HG22 VAL 27 -6.370 11.258 -6.484 209 HG23 VAL 27 HG23 VAL 27 -6.601 12.637 -5.408 210 H TRP 28 H TRP 28 -3.320 13.075 -2.797 211 HA TRP 28 HA TRP 28 -1.406 11.209 -1.825 212 HB2 TRP 28 HB2 TRP 28 -0.796 13.295 -2.985 213 HB3 TRP 28 HB3 TRP 28 -1.444 14.241 -1.666 214 HD1 TRP 28 HD1 TRP 28 0.250 14.890 0.218 215 HE1 TRP 28 HE1 TRP 28 2.709 14.349 0.697 216 HE3 TRP 28 HE3 TRP 28 0.936 11.120 -3.176 217 HZ2 TRP 28 HZ2 TRP 28 4.681 12.574 -0.241 218 HZ3 TRP 28 HZ3 TRP 28 3.150 10.061 -3.326 219 HH2 TRP 28 HH2 TRP 28 4.982 10.776 -1.881 220 H ALA 29 H ALA 29 -3.732 13.271 -0.195 221 HA ALA 29 HA ALA 29 -2.677 13.334 2.410 222 HB1 ALA 29 HB1 ALA 29 -4.479 14.811 1.635 223 HB2 ALA 29 HB2 ALA 29 -4.945 13.965 3.114 224 HB3 ALA 29 HB3 ALA 29 -5.582 13.436 1.552 225 H ILE 30 H ILE 30 -4.411 10.755 0.749 226 HA ILE 30 HA ILE 30 -5.160 9.247 3.086 227 HB ILE 30 HB ILE 30 -5.837 7.478 1.646 228 HG12 ILE 30 HG12 ILE 30 -3.991 8.667 -0.467 229 HG13 ILE 30 HG13 ILE 30 -3.796 7.131 0.352 230 HG21 ILE 30 HG21 ILE 30 -7.229 9.496 1.455 231 HG22 ILE 30 HG22 ILE 30 -7.221 8.587 -0.057 232 HG23 ILE 30 HG23 ILE 30 -6.253 10.056 0.090 233 HD11 ILE 30 HD11 ILE 30 -4.498 6.751 -1.867 234 HD12 ILE 30 HD12 ILE 30 -5.861 7.855 -1.697 235 HD13 ILE 30 HD13 ILE 30 -5.836 6.333 -0.795 236 H TRP 31 H TRP 31 -2.208 9.582 1.296 237 HA TRP 31 HA TRP 31 -0.906 7.271 2.579 238 HB2 TRP 31 HB2 TRP 31 0.082 9.276 0.494 239 HB3 TRP 31 HB3 TRP 31 1.043 7.938 1.122 240 HD1 TRP 31 HD1 TRP 31 -1.429 8.719 -1.593 241 HE1 TRP 31 HE1 TRP 31 -2.080 6.552 -2.822 242 HE3 TRP 31 HE3 TRP 31 0.602 5.299 1.635 243 HZ2 TRP 31 HZ2 TRP 31 -1.757 3.774 -2.481 244 HZ3 TRP 31 HZ3 TRP 31 0.395 2.905 1.105 245 HH2 TRP 31 HH2 TRP 31 -0.768 2.153 -0.906 246 H GLU 32 H GLU 32 -0.963 10.767 2.609 247 HA GLU 32 HA GLU 32 1.508 11.129 4.032 248 HB2 GLU 32 HB2 GLU 32 0.751 12.698 2.302 249 HB3 GLU 32 HB3 GLU 32 -0.690 13.086 3.236 250 HG2 GLU 32 HG2 GLU 32 0.585 14.243 4.896 251 HG3 GLU 32 HG3 GLU 32 2.109 13.604 4.274 252 H ASP 33 H ASP 33 -1.947 11.560 4.812 253 HA ASP 33 HA ASP 33 -1.426 12.145 7.617 254 HB2 ASP 33 HB2 ASP 33 -3.251 13.273 6.301 255 HB3 ASP 33 HB3 ASP 33 -4.082 11.730 6.169 256 HA PRO 34 HA PRO 34 -1.177 7.715 8.676 257 HB2 PRO 34 HB2 PRO 34 -1.745 8.770 11.447 258 HB3 PRO 34 HB3 PRO 34 -0.451 7.698 10.888 259 HG2 PRO 34 HG2 PRO 34 0.074 10.255 11.430 260 HG3 PRO 34 HG3 PRO 34 0.824 9.467 10.026 261 HD2 PRO 34 HD2 PRO 34 -1.505 11.384 10.104 262 HD3 PRO 34 HD3 PRO 34 -0.156 11.293 8.947 263 H ARG 35 H ARG 35 -3.834 9.757 9.862 264 HA ARG 35 HA ARG 35 -5.537 7.568 10.683 265 HB2 ARG 35 HB2 ARG 35 -6.240 10.496 10.268 266 HB3 ARG 35 HB3 ARG 35 -7.220 9.312 11.127 267 HG2 ARG 35 HG2 ARG 35 -4.433 10.119 12.021 268 HG3 ARG 35 HG3 ARG 35 -5.894 10.951 12.554 269 HD2 ARG 35 HD2 ARG 35 -5.246 9.373 14.269 270 HD3 ARG 35 HD3 ARG 35 -6.722 8.793 13.510 271 HE ARG 35 HE ARG 35 -5.607 6.933 12.782 272 HH11 ARG 35 HH11 ARG 35 -3.179 9.207 13.784 273 HH12 ARG 35 HH12 ARG 35 -1.934 8.011 13.795 274 HH21 ARG 35 HH21 ARG 35 -3.971 5.455 12.805 275 HH22 ARG 35 HH22 ARG 35 -2.376 5.939 13.259 276 H GLN 36 H GLN 36 -5.307 9.693 7.817 277 HA GLN 36 HA GLN 36 -7.617 8.648 6.488 278 HB2 GLN 36 HB2 GLN 36 -5.207 10.133 5.370 279 HB3 GLN 36 HB3 GLN 36 -6.586 9.641 4.393 280 HG2 GLN 36 HG2 GLN 36 -8.012 11.015 6.061 281 HG3 GLN 36 HG3 GLN 36 -6.480 11.719 6.578 282 HE21 GLN 36 HE21 GLN 36 -7.019 13.786 5.812 283 HE22 GLN 36 HE22 GLN 36 -7.128 14.163 4.134 284 H LEU 37 H LEU 37 -4.203 7.615 6.571 285 HA LEU 37 HA LEU 37 -4.452 5.617 4.511 286 HB2 LEU 37 HB2 LEU 37 -2.265 6.492 5.210 287 HB3 LEU 37 HB3 LEU 37 -2.484 5.835 6.823 288 HG LEU 37 HG LEU 37 -2.346 3.530 5.932 289 HD11 LEU 37 HD11 LEU 37 -1.728 3.044 3.607 290 HD12 LEU 37 HD12 LEU 37 -1.864 4.763 3.201 291 HD13 LEU 37 HD13 LEU 37 -3.301 3.858 3.688 292 HD21 LEU 37 HD21 LEU 37 -0.294 4.638 6.651 293 HD22 LEU 37 HD22 LEU 37 -0.039 5.262 5.017 294 HD23 LEU 37 HD23 LEU 37 0.016 3.520 5.321 295 H GLU 38 H GLU 38 -4.492 5.457 8.054 296 HA GLU 38 HA GLU 38 -5.159 2.822 8.593 297 HB2 GLU 38 HB2 GLU 38 -4.569 4.419 10.324 298 HB3 GLU 38 HB3 GLU 38 -5.963 5.425 9.954 299 HG2 GLU 38 HG2 GLU 38 -7.453 3.623 10.808 300 HG3 GLU 38 HG3 GLU 38 -6.022 2.676 11.236 301 H ARG 39 H ARG 39 -7.197 5.369 7.370 302 HA ARG 39 HA ARG 39 -9.771 4.542 7.979 303 HB2 ARG 39 HB2 ARG 39 -9.004 6.762 7.012 304 HB3 ARG 39 HB3 ARG 39 -8.871 5.977 5.449 305 HG2 ARG 39 HG2 ARG 39 -10.950 6.941 5.234 306 HG3 ARG 39 HG3 ARG 39 -11.412 5.363 5.873 307 HD2 ARG 39 HD2 ARG 39 -11.116 7.921 7.481 308 HD3 ARG 39 HD3 ARG 39 -12.633 7.185 6.977 309 HE ARG 39 HE ARG 39 -10.733 5.925 8.864 310 HH11 ARG 39 HH11 ARG 39 -14.001 6.578 7.949 311 HH12 ARG 39 HH12 ARG 39 -14.647 5.740 9.315 312 HH21 ARG 39 HH21 ARG 39 -11.579 4.877 10.584 313 HH22 ARG 39 HH22 ARG 39 -13.294 4.794 10.788 314 H TRP 40 H TRP 40 -7.714 3.575 5.236 315 HA TRP 40 HA TRP 40 -9.858 1.788 4.206 316 HB2 TRP 40 HB2 TRP 40 -8.953 2.223 1.905 317 HB3 TRP 40 HB3 TRP 40 -9.642 3.644 2.679 318 HD1 TRP 40 HD1 TRP 40 -7.874 5.543 3.523 319 HE1 TRP 40 HE1 TRP 40 -5.550 6.174 2.658 320 HE3 TRP 40 HE3 TRP 40 -6.822 1.341 0.892 321 HZ2 TRP 40 HZ2 TRP 40 -3.548 5.063 1.023 322 HZ3 TRP 40 HZ3 TRP 40 -4.698 1.188 -0.318 323 HH2 TRP 40 HH2 TRP 40 -3.097 3.013 -0.249 324 H TRP 41 H TRP 41 -6.575 1.935 5.253 325 HA TRP 41 HA TRP 41 -5.281 0.203 3.476 326 HB2 TRP 41 HB2 TRP 41 -4.180 1.754 5.157 327 HB3 TRP 41 HB3 TRP 41 -4.520 0.559 6.407 328 HD1 TRP 41 HD1 TRP 41 -2.421 -0.916 6.874 329 HE1 TRP 41 HE1 TRP 41 -0.426 -1.762 5.492 330 HE3 TRP 41 HE3 TRP 41 -3.620 1.091 2.319 331 HZ2 TRP 41 HZ2 TRP 41 0.507 -1.608 2.860 332 HZ3 TRP 41 HZ3 TRP 41 -2.125 0.683 0.416 333 HH2 TRP 41 HH2 TRP 41 -0.098 -0.644 0.682 334 H GLY 42 H GLY 42 -7.265 -0.598 6.248 335 HA2 GLY 42 HA2 GLY 42 -6.743 -3.482 5.941 336 HA3 GLY 42 HA3 GLY 42 -7.675 -2.725 7.216 337 HA PRO 43 HA PRO 43 -10.460 -4.020 3.335 338 HB2 PRO 43 HB2 PRO 43 -10.832 -6.738 3.766 339 HB3 PRO 43 HB3 PRO 43 -9.626 -6.079 2.652 340 HG2 PRO 43 HG2 PRO 43 -9.271 -6.995 5.506 341 HG3 PRO 43 HG3 PRO 43 -8.259 -7.352 4.088 342 HD2 PRO 43 HD2 PRO 43 -7.531 -5.457 5.857 343 HD3 PRO 43 HD3 PRO 43 -7.246 -5.221 4.118 344 HA PRO 44 HA PRO 44 -14.115 -3.625 5.899 345 HB2 PRO 44 HB2 PRO 44 -15.984 -5.408 4.798 346 HB3 PRO 44 HB3 PRO 44 -15.609 -3.809 4.145 347 HG2 PRO 44 HG2 PRO 44 -14.506 -6.497 3.330 348 HG3 PRO 44 HG3 PRO 44 -15.083 -5.171 2.296 349 HD2 PRO 44 HD2 PRO 44 -12.465 -5.532 2.656 350 HD3 PRO 44 HD3 PRO 44 -13.126 -3.880 2.652 351 H THR 45 H THR 45 -12.857 -6.872 5.568 352 HA THR 45 HA THR 45 -14.235 -7.957 7.909 353 HB THR 45 HB THR 45 -12.894 -10.028 7.407 354 HG1 THR 45 HG1 THR 45 -11.309 -9.960 5.984 355 HG21 THR 45 HG21 THR 45 -14.371 -8.892 4.999 356 HG22 THR 45 HG22 THR 45 -15.114 -9.754 6.350 357 HG23 THR 45 HG23 THR 45 -13.999 -10.595 5.268 358 H TRP 46 H TRP 46 -11.060 -6.615 7.108 359 HA TRP 46 HA TRP 46 -10.089 -7.053 9.894 360 HB2 TRP 46 HB2 TRP 46 -8.552 -7.183 7.267 361 HB3 TRP 46 HB3 TRP 46 -7.737 -6.979 8.808 362 HD1 TRP 46 HD1 TRP 46 -10.080 -9.603 7.099 363 HE1 TRP 46 HE1 TRP 46 -9.423 -11.916 8.000 364 HE3 TRP 46 HE3 TRP 46 -6.473 -8.199 10.428 365 HZ2 TRP 46 HZ2 TRP 46 -7.617 -13.004 9.845 366 HZ3 TRP 46 HZ3 TRP 46 -5.313 -9.935 11.719 367 HH2 TRP 46 HH2 TRP 46 -5.867 -12.300 11.433 368 HA PRO 47 HA PRO 47 -10.215 -2.353 9.238 369 HB2 PRO 47 HB2 PRO 47 -10.735 -1.859 11.945 370 HB3 PRO 47 HB3 PRO 47 -11.975 -2.021 10.695 371 HG2 PRO 47 HG2 PRO 47 -10.937 -4.106 12.619 372 HG3 PRO 47 HG3 PRO 47 -12.619 -3.745 12.171 373 HD2 PRO 47 HD2 PRO 47 -11.357 -5.839 11.082 374 HD3 PRO 47 HD3 PRO 47 -12.420 -4.827 10.077 375 H ALA 48 H ALA 48 -8.261 -1.371 9.183 376 HA ALA 48 HA ALA 48 -5.976 -2.346 10.684 377 HB1 ALA 48 HB1 ALA 48 -5.744 -1.707 8.311 378 HB2 ALA 48 HB2 ALA 48 -4.668 -0.757 9.337 379 HB3 ALA 48 HB3 ALA 48 -6.157 -0.040 8.715 380 H THR 49 H THR 49 -4.629 -1.082 12.044 381 HA THR 49 HA THR 49 -5.514 1.553 12.999 382 HB THR 49 HB THR 49 -4.953 -0.756 14.934 383 HG1 THR 49 HG1 THR 49 -7.263 0.151 13.811 384 HG21 THR 49 HG21 THR 49 -5.546 0.851 16.720 385 HG22 THR 49 HG22 THR 49 -5.713 2.134 15.520 386 HG23 THR 49 HG23 THR 49 -4.132 1.406 15.821 387 H PHE 50 H PHE 50 -3.754 2.840 12.852 388 HA PHE 50 HA PHE 50 -1.056 1.692 12.733 389 HB2 PHE 50 HB2 PHE 50 -2.234 4.352 11.885 390 HB3 PHE 50 HB3 PHE 50 -0.493 4.206 12.114 391 HD1 PHE 50 HD1 PHE 50 -3.347 2.555 10.305 392 HD2 PHE 50 HD2 PHE 50 0.845 3.435 10.336 393 HE1 PHE 50 HE1 PHE 50 -3.114 1.554 8.072 394 HE2 PHE 50 HE2 PHE 50 1.065 2.429 8.106 395 HZ PHE 50 HZ PHE 50 -0.911 1.488 6.975 396 H GLU 51 H GLU 51 0.217 1.618 14.408 397 HA GLU 51 HA GLU 51 -0.023 3.213 16.810 398 HB2 GLU 51 HB2 GLU 51 2.161 1.318 15.844 399 HB3 GLU 51 HB3 GLU 51 2.081 2.013 17.463 400 HG2 GLU 51 HG2 GLU 51 -0.044 0.199 16.271 401 HG3 GLU 51 HG3 GLU 51 1.272 -0.353 17.302 402 H THR 52 H THR 52 2.180 3.042 14.058 403 HA THR 52 HA THR 52 3.147 5.779 14.619 404 HB THR 52 HB THR 52 5.024 3.504 13.793 405 HG1 THR 52 HG1 THR 52 4.418 4.530 16.388 406 HG21 THR 52 HG21 THR 52 5.559 6.281 14.914 407 HG22 THR 52 HG22 THR 52 5.804 5.791 13.235 408 HG23 THR 52 HG23 THR 52 6.793 5.082 14.514 409 H HIS 53 H HIS 53 3.576 6.983 12.786 410 HA HIS 53 HA HIS 53 4.093 5.816 10.203 411 HB2 HIS 53 HB2 HIS 53 1.612 5.711 10.261 412 HB3 HIS 53 HB3 HIS 53 1.531 7.424 10.636 413 HD2 HIS 53 HD2 HIS 53 1.913 5.067 7.593 414 HE1 HIS 53 HE1 HIS 53 1.831 9.065 6.236 415 HE2 HIS 53 HE2 HIS 53 1.512 6.652 5.586 416 H GLU 54 H GLU 54 6.007 6.943 10.220 417 HA GLU 54 HA GLU 54 6.343 9.637 11.120 418 HB2 GLU 54 HB2 GLU 54 8.185 7.884 9.432 419 HB3 GLU 54 HB3 GLU 54 8.655 9.420 10.159 420 HG2 GLU 54 HG2 GLU 54 7.830 6.913 11.662 421 HG3 GLU 54 HG3 GLU 54 9.478 7.505 11.461 422 H PHE 55 H PHE 55 6.190 8.160 7.903 423 HA PHE 55 HA PHE 55 6.181 8.887 5.787 424 HB2 PHE 55 HB2 PHE 55 3.922 9.756 6.744 425 HB3 PHE 55 HB3 PHE 55 4.652 11.354 6.680 426 HD1 PHE 55 HD1 PHE 55 3.806 8.382 4.599 427 HD2 PHE 55 HD2 PHE 55 4.691 12.568 4.583 428 HE1 PHE 55 HE1 PHE 55 3.219 8.498 2.224 429 HE2 PHE 55 HE2 PHE 55 4.087 12.669 2.199 430 HZ PHE 55 HZ PHE 55 3.351 10.632 1.026 431 H THR 56 H THR 56 8.524 9.197 6.166 432 HA THR 56 HA THR 56 9.427 11.706 5.066 433 HB THR 56 HB THR 56 9.408 12.309 7.476 434 HG1 THR 56 HG1 THR 56 11.304 13.302 7.341 435 HG21 THR 56 HG21 THR 56 9.739 10.080 8.485 436 HG22 THR 56 HG22 THR 56 10.944 11.225 9.079 437 HG23 THR 56 HG23 THR 56 11.390 10.035 7.854 438 H VAL 57 H VAL 57 11.847 11.616 4.611 439 HA VAL 57 HA VAL 57 12.529 9.131 3.359 440 HB VAL 57 HB VAL 57 14.174 11.661 3.814 441 HG11 VAL 57 HG11 VAL 57 14.829 9.295 2.014 442 HG12 VAL 57 HG12 VAL 57 15.719 9.787 3.456 443 HG13 VAL 57 HG13 VAL 57 15.705 10.828 2.032 444 HG21 VAL 57 HG21 VAL 57 12.185 12.033 2.401 445 HG22 VAL 57 HG22 VAL 57 12.669 10.709 1.338 446 HG23 VAL 57 HG23 VAL 57 13.658 12.169 1.436 447 H GLY 58 H GLY 58 13.170 7.386 4.480 448 HA2 GLY 58 HA2 GLY 58 14.627 6.081 5.776 449 HA3 GLY 58 HA3 GLY 58 15.222 7.518 6.588 450 H GLY 59 H GLY 59 11.914 7.782 6.638 451 HA2 GLY 59 HA2 GLY 59 11.695 6.945 9.431 452 HA3 GLY 59 HA3 GLY 59 10.489 7.813 8.494 453 H LYS 60 H LYS 60 9.758 5.697 10.187 454 HA LYS 60 HA LYS 60 8.955 3.559 8.277 455 HB2 LYS 60 HB2 LYS 60 9.724 3.192 11.207 456 HB3 LYS 60 HB3 LYS 60 9.160 1.919 10.124 457 HG2 LYS 60 HG2 LYS 60 11.164 2.336 8.671 458 HG3 LYS 60 HG3 LYS 60 11.735 3.505 9.855 459 HD2 LYS 60 HD2 LYS 60 12.952 1.496 10.267 460 HD3 LYS 60 HD3 LYS 60 11.761 1.612 11.560 461 HE2 LYS 60 HE2 LYS 60 11.291 -0.068 9.072 462 HE3 LYS 60 HE3 LYS 60 12.103 -0.705 10.499 463 HZ1 LYS 60 HZ1 LYS 60 9.336 0.320 10.333 464 HZ2 LYS 60 HZ2 LYS 60 10.106 -0.098 11.776 465 HZ3 LYS 60 HZ3 LYS 60 9.826 -1.275 10.598 466 H ALA 61 H ALA 61 7.054 2.200 9.181 467 HA ALA 61 HA ALA 61 5.075 3.791 10.687 468 HB1 ALA 61 HB1 ALA 61 4.494 2.659 7.919 469 HB2 ALA 61 HB2 ALA 61 4.710 4.364 8.310 470 HB3 ALA 61 HB3 ALA 61 3.337 3.481 8.973 471 H ALA 62 H ALA 62 4.013 2.532 12.124 472 HA ALA 62 HA ALA 62 4.135 -0.429 11.883 473 HB1 ALA 62 HB1 ALA 62 3.988 1.270 14.405 474 HB2 ALA 62 HB2 ALA 62 5.408 0.396 13.821 475 HB3 ALA 62 HB3 ALA 62 3.980 -0.498 14.359 476 H TYR 63 H TYR 63 2.231 -1.554 11.993 477 HA TYR 63 HA TYR 63 -0.208 -0.380 13.052 478 HB2 TYR 63 HB2 TYR 63 -1.542 -0.648 11.007 479 HB3 TYR 63 HB3 TYR 63 -0.217 0.469 10.730 480 HD1 TYR 63 HD1 TYR 63 1.697 -0.187 9.240 481 HD2 TYR 63 HD2 TYR 63 -1.670 -2.771 9.782 482 HE1 TYR 63 HE1 TYR 63 2.354 -1.467 7.246 483 HE2 TYR 63 HE2 TYR 63 -1.017 -4.049 7.795 484 HH TYR 63 HH TYR 63 0.287 -3.791 5.776 485 H TYR 64 H TYR 64 -2.085 -1.923 12.789 486 HA TYR 64 HA TYR 64 -1.542 -4.718 12.267 487 HB2 TYR 64 HB2 TYR 64 -2.339 -5.536 14.473 488 HB3 TYR 64 HB3 TYR 64 -0.871 -4.585 14.643 489 HD1 TYR 64 HD2 TYR 64 -1.017 -2.209 15.578 490 HD2 TYR 64 HD1 TYR 64 -4.383 -4.868 15.596 491 HE1 TYR 64 HE2 TYR 64 -2.137 -0.814 17.266 492 HE2 TYR 64 HE1 TYR 64 -5.492 -3.473 17.281 493 HH TYR 64 HH TYR 64 -4.369 -0.339 18.106 494 H MET 65 H MET 65 -3.400 -5.776 11.591 495 HA MET 65 HA MET 65 -5.940 -4.260 11.586 496 HB2 MET 65 HB2 MET 65 -5.120 -6.714 9.974 497 HB3 MET 65 HB3 MET 65 -6.697 -5.937 9.886 498 HG2 MET 65 HG2 MET 65 -5.456 -5.206 7.996 499 HG3 MET 65 HG3 MET 65 -5.512 -3.845 9.107 500 HE1 MET 65 HE1 MET 65 -3.171 -7.095 9.151 501 HE2 MET 65 HE2 MET 65 -1.779 -6.441 8.287 502 HE3 MET 65 HE3 MET 65 -3.327 -6.620 7.458 503 H THR 66 H THR 66 -7.481 -4.806 12.995 504 HA THR 66 HA THR 66 -7.385 -7.269 14.568 505 HB THR 66 HB THR 66 -9.400 -4.969 14.617 506 HG1 THR 66 HG1 THR 66 -8.046 -4.024 15.954 507 HG21 THR 66 HG21 THR 66 -9.001 -7.220 16.631 508 HG22 THR 66 HG22 THR 66 -10.384 -7.053 15.548 509 HG23 THR 66 HG23 THR 66 -10.109 -5.856 16.815 510 H GLY 67 H GLY 67 -8.333 -9.093 13.832 511 HA2 GLY 67 HA2 GLY 67 -9.727 -9.111 11.321 512 HA3 GLY 67 HA3 GLY 67 -9.257 -10.502 12.277 513 HA PRO 68 HA PRO 68 -13.991 -10.010 12.392 514 HB2 PRO 68 HB2 PRO 68 -14.594 -12.373 11.107 515 HB3 PRO 68 HB3 PRO 68 -14.380 -10.840 10.253 516 HG2 PRO 68 HG2 PRO 68 -12.396 -13.092 10.628 517 HG3 PRO 68 HG3 PRO 68 -12.771 -12.170 9.155 518 HD2 PRO 68 HD2 PRO 68 -10.590 -11.631 10.682 519 HD3 PRO 68 HD3 PRO 68 -11.463 -10.349 9.819 520 H ASP 69 H ASP 69 -11.584 -12.380 13.202 521 HA ASP 69 HA ASP 69 -13.252 -13.665 15.273 522 HB2 ASP 69 HB2 ASP 69 -11.839 -15.014 13.636 523 HB3 ASP 69 HB3 ASP 69 -10.406 -14.341 14.398 524 H GLY 70 H GLY 70 -11.238 -11.001 14.993 525 HA2 GLY 70 HA2 GLY 70 -10.549 -9.532 16.682 526 HA3 GLY 70 HA3 GLY 70 -10.683 -10.817 17.870 527 H THR 71 H THR 71 -8.977 -11.800 15.091 528 HA THR 71 HA THR 71 -6.488 -12.078 16.509 529 HB THR 71 HB THR 71 -7.137 -12.628 13.571 530 HG1 THR 71 HG1 THR 71 -7.391 -14.138 15.946 531 HG21 THR 71 HG21 THR 71 -5.142 -14.098 13.581 532 HG22 THR 71 HG22 THR 71 -4.760 -13.589 15.227 533 HG23 THR 71 HG23 THR 71 -4.688 -12.423 13.902 534 H LYS 72 H LYS 72 -4.886 -10.567 16.643 535 HA LYS 72 HA LYS 72 -4.805 -8.262 14.845 536 HB2 LYS 72 HB2 LYS 72 -3.393 -8.992 17.411 537 HB3 LYS 72 HB3 LYS 72 -2.666 -7.782 16.372 538 HG2 LYS 72 HG2 LYS 72 -3.921 -6.652 18.049 539 HG3 LYS 72 HG3 LYS 72 -4.751 -6.441 16.508 540 HD2 LYS 72 HD2 LYS 72 -6.399 -8.176 17.160 541 HD3 LYS 72 HD3 LYS 72 -5.552 -8.402 18.697 542 HE2 LYS 72 HE2 LYS 72 -6.847 -5.808 17.784 543 HE3 LYS 72 HE3 LYS 72 -7.547 -6.937 18.930 544 HZ1 LYS 72 HZ1 LYS 72 -5.010 -5.447 19.300 545 HZ2 LYS 72 HZ2 LYS 72 -5.667 -6.544 20.401 546 HZ3 LYS 72 HZ3 LYS 72 -6.483 -5.105 20.060 547 H ALA 73 H ALA 73 -3.831 -8.471 12.925 548 HA ALA 73 HA ALA 73 -1.322 -10.038 12.646 549 HB1 ALA 73 HB1 ALA 73 -3.104 -10.644 11.054 550 HB2 ALA 73 HB2 ALA 73 -1.722 -9.937 10.214 551 HB3 ALA 73 HB3 ALA 73 -3.180 -8.975 10.484 552 H ARG 74 H ARG 74 0.434 -8.765 13.035 553 HA ARG 74 HA ARG 74 0.311 -5.874 12.721 554 HB2 ARG 74 HB2 ARG 74 2.576 -7.656 13.719 555 HB3 ARG 74 HB3 ARG 74 2.683 -5.907 13.607 556 HG2 ARG 74 HG2 ARG 74 2.225 -6.299 15.870 557 HG3 ARG 74 HG3 ARG 74 0.663 -5.825 15.204 558 HD2 ARG 74 HD2 ARG 74 -0.031 -8.189 15.124 559 HD3 ARG 74 HD3 ARG 74 1.561 -8.682 15.723 560 HE ARG 74 HE ARG 74 0.556 -6.914 17.587 561 HH11 ARG 74 HH11 ARG 74 -0.474 -9.976 16.346 562 HH12 ARG 74 HH12 ARG 74 -1.190 -10.451 17.842 563 HH21 ARG 74 HH21 ARG 74 -0.356 -7.540 19.468 564 HH22 ARG 74 HH22 ARG 74 -1.125 -9.080 19.596 565 H GLY 75 H GLY 75 1.531 -4.620 11.367 566 HA2 GLY 75 HA2 GLY 75 3.409 -5.846 9.442 567 HA3 GLY 75 HA3 GLY 75 2.109 -4.806 8.859 568 H TRP 76 H TRP 76 4.907 -4.314 8.522 569 HA TRP 76 HA TRP 76 5.149 -1.691 9.848 570 HB2 TRP 76 HB2 TRP 76 7.557 -2.053 10.270 571 HB3 TRP 76 HB3 TRP 76 6.595 -3.261 11.111 572 HD1 TRP 76 HD1 TRP 76 6.877 -5.828 10.319 573 HE1 TRP 76 HE1 TRP 76 8.632 -7.019 8.881 574 HE3 TRP 76 HE3 TRP 76 9.142 -1.738 8.241 575 HZ2 TRP 76 HZ2 TRP 76 10.707 -6.330 7.100 576 HZ3 TRP 76 HZ3 TRP 76 11.006 -2.088 6.673 577 HH2 TRP 76 HH2 TRP 76 11.773 -4.341 6.115 578 H TRP 77 H TRP 77 6.385 -0.152 8.685 579 HA TRP 77 HA TRP 77 7.056 -0.752 5.861 580 HB2 TRP 77 HB2 TRP 77 5.608 1.611 7.070 581 HB3 TRP 77 HB3 TRP 77 6.535 1.833 5.596 582 HD1 TRP 77 HD1 TRP 77 4.963 -1.489 5.255 583 HE1 TRP 77 HE1 TRP 77 2.836 -1.296 3.821 584 HE3 TRP 77 HE3 TRP 77 4.369 3.567 5.393 585 HZ2 TRP 77 HZ2 TRP 77 1.141 0.765 2.885 586 HZ3 TRP 77 HZ3 TRP 77 2.481 4.580 4.192 587 HH2 TRP 77 HH2 TRP 77 0.894 3.196 2.966 588 H GLN 78 H GLN 78 8.630 0.777 4.915 589 HA GLN 78 HA GLN 78 9.969 2.670 6.656 590 HB2 GLN 78 HB2 GLN 78 11.367 0.618 6.913 591 HB3 GLN 78 HB3 GLN 78 11.623 0.580 5.167 592 HG2 GLN 78 HG2 GLN 78 12.857 2.666 5.234 593 HG3 GLN 78 HG3 GLN 78 12.443 2.919 6.931 594 HE21 GLN 78 HE21 GLN 78 14.617 3.073 7.511 595 HE22 GLN 78 HE22 GLN 78 15.660 1.704 7.569 596 H PHE 79 H PHE 79 9.527 4.439 5.527 597 HA PHE 79 HA PHE 79 9.294 4.670 2.693 598 HB2 PHE 79 HB2 PHE 79 9.718 6.906 4.725 599 HB3 PHE 79 HB3 PHE 79 9.081 7.084 3.096 600 HD1 PHE 79 HD2 PHE 79 6.768 6.335 2.568 601 HD2 PHE 79 HD1 PHE 79 8.308 6.134 6.554 602 HE1 PHE 79 HE2 PHE 79 4.488 6.096 3.446 603 HE2 PHE 79 HE1 PHE 79 6.023 5.891 7.423 604 HZ PHE 79 HZ PHE 79 4.113 5.875 5.871 605 H THR 80 H THR 80 10.868 5.052 1.187 606 HA THR 80 HA THR 80 13.633 5.662 2.071 607 HB THR 80 HB THR 80 14.423 4.696 -0.029 608 HG1 THR 80 HG1 THR 80 12.999 5.061 -1.607 609 HG21 THR 80 HG21 THR 80 13.980 3.059 1.758 610 HG22 THR 80 HG22 THR 80 13.630 2.353 0.174 611 HG23 THR 80 HG23 THR 80 12.309 2.895 1.210 612 H THR 81 H THR 81 11.147 6.645 -0.299 613 HA THR 81 HA THR 81 12.621 9.145 -0.887 614 HB THR 81 HB THR 81 11.653 7.190 -3.022 615 HG1 THR 81 HG1 THR 81 13.980 7.418 -3.598 616 HG21 THR 81 HG21 THR 81 12.559 8.818 -4.681 617 HG22 THR 81 HG22 THR 81 12.811 9.981 -3.381 618 HG23 THR 81 HG23 THR 81 11.174 9.468 -3.799 619 H ILE 82 H ILE 82 11.173 10.598 -0.173 620 HA ILE 82 HA ILE 82 8.431 10.598 -1.326 621 HB ILE 82 HB ILE 82 9.244 11.797 1.371 622 HG12 ILE 82 HG12 ILE 82 7.722 9.226 0.758 623 HG13 ILE 82 HG13 ILE 82 9.294 9.348 1.532 624 HG21 ILE 82 HG21 ILE 82 6.486 11.509 0.103 625 HG22 ILE 82 HG22 ILE 82 7.388 13.016 0.275 626 HG23 ILE 82 HG23 ILE 82 6.818 12.163 1.710 627 HD11 ILE 82 HD11 ILE 82 8.205 10.474 3.448 628 HD12 ILE 82 HD12 ILE 82 7.628 8.836 3.157 629 HD13 ILE 82 HD13 ILE 82 6.641 10.210 2.666 630 H GLU 83 H GLU 83 8.367 12.139 -2.875 631 HA GLU 83 HA GLU 83 9.906 14.653 -2.549 632 HB2 GLU 83 HB2 GLU 83 8.632 13.510 -5.071 633 HB3 GLU 83 HB3 GLU 83 9.591 14.987 -4.973 634 HG2 GLU 83 HG2 GLU 83 11.513 13.540 -4.131 635 HG3 GLU 83 HG3 GLU 83 10.539 12.137 -4.569 636 H ALA 84 H ALA 84 6.654 13.425 -3.195 637 HA ALA 84 HA ALA 84 4.583 14.226 -2.882 638 HB1 ALA 84 HB1 ALA 84 4.156 16.027 -1.278 639 HB2 ALA 84 HB2 ALA 84 5.858 16.497 -1.324 640 HB3 ALA 84 HB3 ALA 84 5.393 14.930 -0.660 641 HA PRO 85 HA PRO 85 2.658 14.985 -2.928 642 HB2 PRO 85 HB2 PRO 85 0.424 15.743 -4.175 643 HB3 PRO 85 HB3 PRO 85 1.314 16.900 -3.173 644 HG2 PRO 85 HG2 PRO 85 1.231 16.657 -6.170 645 HG3 PRO 85 HG3 PRO 85 1.286 18.122 -5.169 646 HD2 PRO 85 HD2 PRO 85 3.514 16.846 -6.416 647 HD3 PRO 85 HD3 PRO 85 3.591 18.134 -5.193 648 H ASP 86 H ASP 86 4.230 14.058 -5.447 649 HA ASP 86 HA ASP 86 2.215 12.269 -6.678 650 HB2 ASP 86 HB2 ASP 86 3.547 12.409 -8.754 651 HB3 ASP 86 HB3 ASP 86 2.994 13.991 -8.226 652 H HIS 87 H HIS 87 5.737 12.400 -5.929 653 HA HIS 87 HA HIS 87 5.984 9.519 -6.434 654 HB2 HIS 87 HB2 HIS 87 7.598 11.220 -7.400 655 HB3 HIS 87 HB3 HIS 87 8.188 11.524 -5.773 656 HD1 HIS 87 HD1 HIS 87 10.333 10.703 -7.510 657 HD2 HIS 87 HD2 HIS 87 7.885 7.806 -5.801 658 HE1 HIS 87 HE1 HIS 87 11.656 8.585 -7.593 659 HE2 HIS 87 HE2 HIS 87 10.201 6.870 -6.486 660 H LEU 88 H LEU 88 5.740 8.148 -4.850 661 HA LEU 88 HA LEU 88 6.875 8.598 -2.158 662 HB2 LEU 88 HB2 LEU 88 4.443 8.798 -1.991 663 HB3 LEU 88 HB3 LEU 88 4.210 7.309 -2.879 664 HG LEU 88 HG LEU 88 5.116 6.008 -0.987 665 HD11 LEU 88 HD11 LEU 88 5.415 8.653 0.464 666 HD12 LEU 88 HD12 LEU 88 6.728 7.612 -0.094 667 HD13 LEU 88 HD13 LEU 88 5.638 7.047 1.169 668 HD21 LEU 88 HD21 LEU 88 2.709 6.447 -1.040 669 HD22 LEU 88 HD22 LEU 88 2.941 7.937 -0.119 670 HD23 LEU 88 HD23 LEU 88 3.299 6.372 0.619 671 H GLU 89 H GLU 89 8.171 6.954 -1.484 672 HA GLU 89 HA GLU 89 7.888 4.244 -2.613 673 HB2 GLU 89 HB2 GLU 89 10.492 5.810 -2.334 674 HB3 GLU 89 HB3 GLU 89 10.448 4.058 -2.493 675 HG2 GLU 89 HG2 GLU 89 9.292 4.330 -4.690 676 HG3 GLU 89 HG3 GLU 89 9.485 6.075 -4.539 677 H PHE 90 H PHE 90 7.889 2.700 -1.109 678 HA PHE 90 HA PHE 90 9.241 2.923 1.445 679 HB2 PHE 90 HB2 PHE 90 7.200 2.384 2.808 680 HB3 PHE 90 HB3 PHE 90 7.134 3.982 2.078 681 HD1 PHE 90 HD2 PHE 90 5.845 0.477 1.713 682 HD2 PHE 90 HD1 PHE 90 5.304 4.596 0.683 683 HE1 PHE 90 HE2 PHE 90 3.651 -0.039 0.738 684 HE2 PHE 90 HE1 PHE 90 3.113 4.059 -0.280 685 HZ PHE 90 HZ PHE 90 2.284 1.744 -0.259 686 H ASP 91 H ASP 91 8.719 0.817 2.760 687 HA ASP 91 HA ASP 91 8.769 -1.518 0.921 688 HB2 ASP 91 HB2 ASP 91 10.242 -1.046 3.550 689 HB3 ASP 91 HB3 ASP 91 10.229 -2.583 2.684 690 H ASP 92 H ASP 92 6.759 -2.501 1.089 691 HA ASP 92 HA ASP 92 5.286 -2.784 3.532 692 HB2 ASP 92 HB2 ASP 92 5.103 -4.478 1.001 693 HB3 ASP 92 HB3 ASP 92 3.929 -4.468 2.313 694 H GLY 93 H GLY 93 6.255 -3.806 5.199 695 HA2 GLY 93 HA2 GLY 93 7.271 -6.580 4.807 696 HA3 GLY 93 HA3 GLY 93 7.863 -5.480 6.047 697 H PHE 94 H PHE 94 6.543 -8.153 6.293 698 HA PHE 94 HA PHE 94 4.177 -7.427 7.916 699 HB2 PHE 94 HB2 PHE 94 5.108 -10.064 6.716 700 HB3 PHE 94 HB3 PHE 94 3.879 -10.013 7.977 701 HD1 PHE 94 HD1 PHE 94 4.659 -8.874 4.510 702 HD2 PHE 94 HD2 PHE 94 1.623 -9.399 7.479 703 HE1 PHE 94 HE1 PHE 94 2.928 -8.346 2.844 704 HE2 PHE 94 HE2 PHE 94 -0.097 -8.878 5.807 705 HZ PHE 94 HZ PHE 94 0.550 -8.346 3.492 706 H ALA 95 H ALA 95 4.057 -7.855 10.057 707 HA ALA 95 HA ALA 95 6.577 -8.530 11.469 708 HB1 ALA 95 HB1 ALA 95 4.359 -6.637 12.339 709 HB2 ALA 95 HB2 ALA 95 5.932 -6.161 11.698 710 HB3 ALA 95 HB3 ALA 95 5.831 -6.997 13.248 711 H ASP 96 H ASP 96 6.465 -9.755 13.289 712 HA ASP 96 HA ASP 96 4.469 -11.788 13.545 713 HB2 ASP 96 HB2 ASP 96 6.819 -12.274 13.925 714 HB3 ASP 96 HB3 ASP 96 6.953 -10.997 15.123 715 H GLU 97 H GLU 97 3.577 -12.261 15.917 716 HA GLU 97 HA GLU 97 1.845 -10.260 16.801 717 HB2 GLU 97 HB2 GLU 97 1.375 -11.707 18.714 718 HB3 GLU 97 HB3 GLU 97 1.530 -12.673 17.250 719 HG2 GLU 97 HG2 GLU 97 3.797 -13.351 17.912 720 HG3 GLU 97 HG3 GLU 97 3.696 -12.337 19.346 721 H HIS 98 H HIS 98 5.187 -10.827 17.708 722 HA HIS 98 HA HIS 98 5.138 -8.784 19.839 723 HB2 HIS 98 HB2 HIS 98 7.487 -10.527 18.974 724 HB3 HIS 98 HB3 HIS 98 7.366 -9.571 20.450 725 HD1 HIS 98 HD1 HIS 98 5.239 -10.428 22.058 726 HD2 HIS 98 HD2 HIS 98 6.809 -13.122 19.314 727 HE1 HIS 98 HE1 HIS 98 4.501 -12.695 22.844 728 HE2 HIS 98 HE2 HIS 98 5.385 -14.297 21.127 729 H GLY 99 H GLY 99 5.444 -8.754 16.565 730 HA2 GLY 99 HA2 GLY 99 5.849 -6.856 15.252 731 HA3 GLY 99 HA3 GLY 99 6.776 -6.143 16.559 732 H ALA 100 H ALA 100 7.727 -9.361 15.899 733 HA ALA 100 HA ALA 100 10.313 -8.565 14.919 734 HB1 ALA 100 HB1 ALA 100 10.038 -10.489 16.429 735 HB2 ALA 100 HB2 ALA 100 10.832 -10.971 14.929 736 HB3 ALA 100 HB3 ALA 100 9.125 -11.352 15.188 737 HA PRO 101 HA PRO 101 9.254 -8.403 10.515 738 HB2 PRO 101 HB2 PRO 101 11.814 -8.622 9.439 739 HB3 PRO 101 HB3 PRO 101 11.131 -7.131 10.105 740 HG2 PRO 101 HG2 PRO 101 12.949 -9.142 11.440 741 HG3 PRO 101 HG3 PRO 101 13.046 -7.367 11.456 742 HD2 PRO 101 HD2 PRO 101 12.012 -8.705 13.552 743 HD3 PRO 101 HD3 PRO 101 11.303 -7.159 13.030 744 H VAL 102 H VAL 102 8.151 -10.164 9.868 745 HA VAL 102 HA VAL 102 9.036 -12.862 9.828 746 HB VAL 102 HB VAL 102 6.768 -11.563 8.241 747 HG11 VAL 102 HG11 VAL 102 7.350 -13.771 7.308 748 HG12 VAL 102 HG12 VAL 102 5.777 -13.832 8.107 749 HG13 VAL 102 HG13 VAL 102 7.201 -14.505 8.909 750 HG21 VAL 102 HG21 VAL 102 6.495 -11.188 10.665 751 HG22 VAL 102 HG22 VAL 102 6.670 -12.918 10.969 752 HG23 VAL 102 HG23 VAL 102 5.273 -12.319 10.071 753 H ASP 103 H ASP 103 10.886 -13.265 8.681 754 HA ASP 103 HA ASP 103 11.564 -12.073 6.156 755 HB2 ASP 103 HB2 ASP 103 13.534 -13.613 6.206 756 HB3 ASP 103 HB3 ASP 103 13.351 -12.671 7.680 757 H GLU 104 H GLU 104 9.788 -14.891 7.049 758 HA GLU 104 HA GLU 104 9.817 -16.405 4.683 759 HB2 GLU 104 HB2 GLU 104 8.800 -17.220 6.763 760 HB3 GLU 104 HB3 GLU 104 7.598 -15.932 6.715 761 HG2 GLU 104 HG2 GLU 104 6.875 -16.978 4.443 762 HG3 GLU 104 HG3 GLU 104 7.810 -18.379 4.959 763 H LEU 105 H LEU 105 7.442 -13.915 5.706 764 HA LEU 105 HA LEU 105 6.320 -13.584 3.056 765 HB2 LEU 105 HB2 LEU 105 5.898 -12.013 5.627 766 HB3 LEU 105 HB3 LEU 105 4.971 -11.774 4.149 767 HG LEU 105 HG LEU 105 5.014 -14.327 5.818 768 HD11 LEU 105 HD11 LEU 105 2.815 -12.262 5.516 769 HD12 LEU 105 HD12 LEU 105 3.804 -12.542 6.953 770 HD13 LEU 105 HD13 LEU 105 2.695 -13.791 6.394 771 HD21 LEU 105 HD21 LEU 105 3.404 -13.681 3.322 772 HD22 LEU 105 HD22 LEU 105 3.212 -15.124 4.325 773 HD23 LEU 105 HD23 LEU 105 4.716 -14.856 3.451 774 H GLY 106 H GLY 106 9.030 -12.330 4.715 775 HA2 GLY 106 HA2 GLY 106 10.809 -11.188 3.879 776 HA3 GLY 106 HA3 GLY 106 10.040 -11.262 2.306 777 H VAL 107 H VAL 107 11.075 -9.184 2.048 778 HA VAL 107 HA VAL 107 9.380 -6.930 2.978 779 HB VAL 107 HB VAL 107 12.362 -6.756 2.291 780 HG11 VAL 107 HG11 VAL 107 10.487 -4.675 3.483 781 HG12 VAL 107 HG12 VAL 107 11.128 -4.672 1.838 782 HG13 VAL 107 HG13 VAL 107 12.218 -4.458 3.208 783 HG21 VAL 107 HG21 VAL 107 12.779 -6.398 4.718 784 HG22 VAL 107 HG22 VAL 107 12.115 -8.001 4.398 785 HG23 VAL 107 HG23 VAL 107 11.077 -6.734 5.053 786 H THR 108 H THR 108 8.489 -5.755 1.306 787 HA THR 108 HA THR 108 9.523 -6.103 -1.439 788 HB THR 108 HB THR 108 7.756 -7.709 -1.345 789 HG1 THR 108 HG1 THR 108 6.141 -6.030 -2.651 790 HG21 THR 108 HG21 THR 108 5.869 -5.566 -0.310 791 HG22 THR 108 HG22 THR 108 6.492 -6.931 0.618 792 HG23 THR 108 HG23 THR 108 5.419 -7.219 -0.752 793 H HIS 109 H HIS 109 9.926 -4.201 -2.344 794 HA HIS 109 HA HIS 109 9.186 -1.761 -0.959 795 HB2 HIS 109 HB2 HIS 109 11.517 -2.179 -1.740 796 HB3 HIS 109 HB3 HIS 109 10.957 -2.139 -3.408 797 HD1 HIS 109 HD1 HIS 109 11.327 0.090 -0.398 798 HD2 HIS 109 HD2 HIS 109 10.718 0.456 -4.478 799 HE1 HIS 109 HE1 HIS 109 11.475 2.523 -0.882 800 HE2 HIS 109 HE2 HIS 109 11.331 2.689 -3.367 801 H ALA 110 H ALA 110 7.243 -0.878 -1.398 802 HA ALA 110 HA ALA 110 6.056 -0.944 -4.074 803 HB1 ALA 110 HB1 ALA 110 4.970 0.254 -1.517 804 HB2 ALA 110 HB2 ALA 110 4.604 -1.351 -2.147 805 HB3 ALA 110 HB3 ALA 110 4.091 0.082 -3.040 806 H THR 111 H THR 111 5.726 0.794 -5.377 807 HA THR 111 HA THR 111 6.812 3.453 -4.587 808 HB THR 111 HB THR 111 6.686 2.374 -7.457 809 HG1 THR 111 HG1 THR 111 8.186 1.166 -6.063 810 HG21 THR 111 HG21 THR 111 8.186 4.721 -6.236 811 HG22 THR 111 HG22 THR 111 6.768 4.828 -7.282 812 HG23 THR 111 HG23 THR 111 8.291 4.205 -7.921 813 H VAL 112 H VAL 112 4.998 4.635 -4.119 814 HA VAL 112 HA VAL 112 2.524 4.343 -5.693 815 HB VAL 112 HB VAL 112 3.085 6.054 -3.229 816 HG11 VAL 112 HG11 VAL 112 1.280 7.043 -4.610 817 HG12 VAL 112 HG12 VAL 112 0.627 6.383 -3.111 818 HG13 VAL 112 HG13 VAL 112 0.430 5.494 -4.623 819 HG21 VAL 112 HG21 VAL 112 1.753 4.369 -2.002 820 HG22 VAL 112 HG22 VAL 112 3.176 3.634 -2.743 821 HG23 VAL 112 HG23 VAL 112 1.585 3.419 -3.481 822 H LYS 113 H LYS 113 1.936 5.760 -7.215 823 HA LYS 113 HA LYS 113 3.463 8.262 -7.625 824 HB2 LYS 113 HB2 LYS 113 3.006 5.956 -9.555 825 HB3 LYS 113 HB3 LYS 113 3.415 7.571 -10.125 826 HG2 LYS 113 HG2 LYS 113 5.550 7.527 -9.036 827 HG3 LYS 113 HG3 LYS 113 5.143 6.063 -8.140 828 HD2 LYS 113 HD2 LYS 113 6.719 5.757 -10.118 829 HD3 LYS 113 HD3 LYS 113 5.307 4.701 -10.092 830 HE2 LYS 113 HE2 LYS 113 5.840 5.670 -12.358 831 HE3 LYS 113 HE3 LYS 113 4.209 6.010 -11.786 832 HZ1 LYS 113 HZ1 LYS 113 4.836 8.222 -11.232 833 HZ2 LYS 113 HZ2 LYS 113 5.375 7.931 -12.809 834 HZ3 LYS 113 HZ3 LYS 113 6.471 7.909 -11.525 835 H LEU 114 H LEU 114 2.197 9.963 -7.977 836 HA LEU 114 HA LEU 114 -0.613 9.584 -8.838 837 HB2 LEU 114 HB2 LEU 114 0.544 11.763 -7.058 838 HB3 LEU 114 HB3 LEU 114 -1.121 11.694 -7.615 839 HG LEU 114 HG LEU 114 0.206 9.686 -5.745 840 HD11 LEU 114 HD11 LEU 114 -1.362 10.565 -4.062 841 HD12 LEU 114 HD12 LEU 114 -1.913 11.786 -5.216 842 HD13 LEU 114 HD13 LEU 114 -0.244 11.798 -4.642 843 HD21 LEU 114 HD21 LEU 114 -1.438 8.562 -7.168 844 HD22 LEU 114 HD22 LEU 114 -2.657 9.769 -6.748 845 HD23 LEU 114 HD23 LEU 114 -2.027 8.680 -5.511 846 H GLU 115 H GLU 115 -0.967 10.266 -10.857 847 HA GLU 115 HA GLU 115 0.617 12.483 -12.014 848 HB2 GLU 115 HB2 GLU 115 -1.049 10.310 -13.354 849 HB3 GLU 115 HB3 GLU 115 -0.305 11.647 -14.221 850 HG2 GLU 115 HG2 GLU 115 1.091 9.734 -14.519 851 HG3 GLU 115 HG3 GLU 115 1.936 10.858 -13.455 852 HA PRO 116 HA PRO 116 -3.140 15.026 -11.606 853 HB2 PRO 116 HB2 PRO 116 -1.766 17.002 -13.354 854 HB3 PRO 116 HB3 PRO 116 -2.280 17.165 -11.672 855 HG2 PRO 116 HG2 PRO 116 0.335 16.976 -12.385 856 HG3 PRO 116 HG3 PRO 116 -0.279 16.351 -10.843 857 HD2 PRO 116 HD2 PRO 116 0.390 14.842 -13.362 858 HD3 PRO 116 HD3 PRO 116 0.702 14.406 -11.666 859 H LEU 117 H LEU 117 -4.626 13.856 -12.847 860 HA LEU 117 HA LEU 117 -4.638 14.095 -15.782 861 HB2 LEU 117 HB2 LEU 117 -6.757 12.809 -14.013 862 HB3 LEU 117 HB3 LEU 117 -6.519 12.569 -15.737 863 HG LEU 117 HG LEU 117 -4.678 11.609 -13.518 864 HD11 LEU 117 HD11 LEU 117 -6.511 10.018 -15.343 865 HD12 LEU 117 HD12 LEU 117 -6.743 10.316 -13.617 866 HD13 LEU 117 HD13 LEU 117 -5.380 9.345 -14.164 867 HD21 LEU 117 HD21 LEU 117 -3.389 10.433 -15.256 868 HD22 LEU 117 HD22 LEU 117 -3.346 12.178 -15.490 869 HD23 LEU 117 HD23 LEU 117 -4.384 11.181 -16.514 870 H GLU 118 H GLU 118 -4.674 16.521 -15.212 871 HA GLU 118 HA GLU 118 -5.631 18.567 -15.242 872 HB2 GLU 118 HB2 GLU 118 -8.075 17.039 -16.231 873 HB3 GLU 118 HB3 GLU 118 -8.001 18.793 -16.153 874 HG2 GLU 118 HG2 GLU 118 -7.602 18.095 -18.427 875 HG3 GLU 118 HG3 GLU 118 -6.123 18.784 -17.771 876 H ASN 119 H ASN 119 -8.629 16.950 -14.276 877 HA ASN 119 HA ASN 119 -8.634 18.367 -11.673 878 HB2 ASN 119 HB2 ASN 119 -10.533 18.952 -13.061 879 HB3 ASN 119 HB3 ASN 119 -10.880 17.266 -13.416 880 HD21 ASN 119 HD21 ASN 119 -11.990 16.044 -11.912 881 HD22 ASN 119 HD22 ASN 119 -12.763 16.731 -10.528 882 H ARG 120 H ARG 120 -8.899 15.209 -13.239 883 HA ARG 120 HA ARG 120 -9.288 13.712 -10.768 884 HB2 ARG 120 HB2 ARG 120 -8.533 12.642 -13.524 885 HB3 ARG 120 HB3 ARG 120 -9.232 11.739 -12.179 886 HG2 ARG 120 HG2 ARG 120 -11.347 12.976 -12.422 887 HG3 ARG 120 HG3 ARG 120 -10.647 13.937 -13.734 888 HD2 ARG 120 HD2 ARG 120 -11.221 10.954 -13.725 889 HD3 ARG 120 HD3 ARG 120 -11.997 12.188 -14.719 890 HE ARG 120 HE ARG 120 -9.753 12.483 -15.800 891 HH11 ARG 120 HH11 ARG 120 -10.513 9.429 -14.337 892 HH12 ARG 120 HH12 ARG 120 -9.418 8.561 -15.356 893 HH21 ARG 120 HH21 ARG 120 -8.333 11.348 -17.047 894 HH22 ARG 120 HH22 ARG 120 -8.201 9.630 -16.868 895 H THR 121 H THR 121 -7.663 11.687 -10.604 896 HA THR 121 HA THR 121 -4.865 12.340 -11.188 897 HB THR 121 HB THR 121 -5.868 11.885 -8.336 898 HG1 THR 121 HG1 THR 121 -6.026 14.039 -9.099 899 HG21 THR 121 HG21 THR 121 -3.737 10.677 -8.616 900 HG22 THR 121 HG22 THR 121 -3.499 12.116 -7.623 901 HG23 THR 121 HG23 THR 121 -2.993 12.119 -9.316 902 H ARG 122 H ARG 122 -3.552 10.554 -11.387 903 HA ARG 122 HA ARG 122 -4.827 7.883 -11.397 904 HB2 ARG 122 HB2 ARG 122 -3.890 8.728 -13.557 905 HB3 ARG 122 HB3 ARG 122 -2.315 8.904 -12.800 906 HG2 ARG 122 HG2 ARG 122 -2.203 6.888 -14.038 907 HG3 ARG 122 HG3 ARG 122 -2.376 6.391 -12.354 908 HD2 ARG 122 HD2 ARG 122 -3.812 5.002 -13.699 909 HD3 ARG 122 HD3 ARG 122 -4.840 6.087 -12.767 910 HE ARG 122 HE ARG 122 -5.435 7.207 -14.721 911 HH11 ARG 122 HH11 ARG 122 -3.020 4.826 -15.505 912 HH12 ARG 122 HH12 ARG 122 -3.437 4.828 -17.182 913 HH21 ARG 122 HH21 ARG 122 -5.928 7.168 -16.859 914 HH22 ARG 122 HH22 ARG 122 -5.054 6.133 -17.934 915 H MET 123 H MET 123 -4.194 6.493 -9.773 916 HA MET 123 HA MET 123 -1.571 6.879 -8.454 917 HB2 MET 123 HB2 MET 123 -3.633 6.860 -6.985 918 HB3 MET 123 HB3 MET 123 -3.893 5.184 -7.449 919 HG2 MET 123 HG2 MET 123 -1.580 4.677 -6.519 920 HG3 MET 123 HG3 MET 123 -1.556 6.324 -5.892 921 HE1 MET 123 HE1 MET 123 -4.597 3.790 -6.124 922 HE2 MET 123 HE2 MET 123 -4.460 3.018 -4.544 923 HE3 MET 123 HE3 MET 123 -3.182 2.807 -5.737 924 H THR 124 H THR 124 -0.000 5.399 -8.783 925 HA THR 124 HA THR 124 -0.682 2.650 -9.663 926 HB THR 124 HB THR 124 1.616 4.315 -10.809 927 HG1 THR 124 HG1 THR 124 -0.732 4.689 -11.509 928 HG21 THR 124 HG21 THR 124 1.922 2.431 -12.384 929 HG22 THR 124 HG22 THR 124 0.644 1.530 -11.565 930 HG23 THR 124 HG23 THR 124 2.150 1.898 -10.719 931 H ILE 125 H ILE 125 0.034 1.294 -8.092 932 HA ILE 125 HA ILE 125 2.388 2.001 -6.426 933 HB ILE 125 HB ILE 125 0.251 -0.091 -5.803 934 HG12 ILE 125 HG12 ILE 125 0.370 2.778 -4.750 935 HG13 ILE 125 HG13 ILE 125 -0.792 2.188 -5.936 936 HG21 ILE 125 HG21 ILE 125 2.396 -0.427 -4.623 937 HG22 ILE 125 HG22 ILE 125 1.135 0.050 -3.486 938 HG23 ILE 125 HG23 ILE 125 2.338 1.230 -4.012 939 HD11 ILE 125 HD11 ILE 125 -1.799 2.328 -3.743 940 HD12 ILE 125 HD12 ILE 125 -0.554 1.280 -3.066 941 HD13 ILE 125 HD13 ILE 125 -1.699 0.639 -4.247 942 H ILE 126 H ILE 126 4.245 0.948 -7.111 943 HA ILE 126 HA ILE 126 4.022 -1.760 -8.322 944 HB ILE 126 HB ILE 126 6.424 0.119 -8.634 945 HG12 ILE 126 HG12 ILE 126 5.403 0.399 -11.090 946 HG13 ILE 126 HG13 ILE 126 3.882 0.037 -10.291 947 HG21 ILE 126 HG21 ILE 126 6.888 -2.253 -9.066 948 HG22 ILE 126 HG22 ILE 126 6.997 -1.318 -10.558 949 HG23 ILE 126 HG23 ILE 126 5.574 -2.314 -10.247 950 HD11 ILE 126 HD11 ILE 126 4.224 2.420 -10.548 951 HD12 ILE 126 HD12 ILE 126 5.727 2.330 -9.631 952 HD13 ILE 126 HD13 ILE 126 4.187 1.980 -8.840 953 H SER 127 H SER 127 4.433 -3.261 -6.739 954 HA SER 127 HA SER 127 6.349 -2.683 -4.565 955 HB2 SER 127 HB2 SER 127 3.918 -3.177 -4.009 956 HB3 SER 127 HB3 SER 127 4.176 -4.826 -4.573 957 HG SER 127 HG SER 127 4.845 -3.664 -2.203 958 H THR 128 H THR 128 8.266 -3.678 -4.609 959 HA THR 128 HA THR 128 8.758 -5.891 -6.501 960 HB THR 128 HB THR 128 11.170 -5.099 -6.415 961 HG1 THR 128 HG1 THR 128 11.414 -3.913 -4.618 962 HG21 THR 128 HG21 THR 128 9.693 -4.373 -8.261 963 HG22 THR 128 HG22 THR 128 10.824 -3.092 -7.812 964 HG23 THR 128 HG23 THR 128 9.142 -3.006 -7.285 965 H PHE 129 H PHE 129 8.896 -7.823 -5.589 966 HA PHE 129 HA PHE 129 9.419 -8.277 -2.770 967 HB2 PHE 129 HB2 PHE 129 8.968 -10.323 -4.995 968 HB3 PHE 129 HB3 PHE 129 8.825 -10.607 -3.263 969 HD1 PHE 129 HD2 PHE 129 7.245 -8.998 -6.197 970 HD2 PHE 129 HD1 PHE 129 6.802 -9.931 -2.046 971 HE1 PHE 129 HE2 PHE 129 4.873 -8.410 -6.315 972 HE2 PHE 129 HE1 PHE 129 4.420 -9.334 -2.174 973 HZ PHE 129 HZ PHE 129 3.455 -8.561 -4.306 974 H GLU 130 H GLU 130 11.003 -9.878 -1.985 975 HA GLU 130 HA GLU 130 13.583 -9.640 -3.344 976 HB2 GLU 130 HB2 GLU 130 14.551 -10.490 -1.181 977 HB3 GLU 130 HB3 GLU 130 13.670 -8.980 -1.066 978 HG2 GLU 130 HG2 GLU 130 13.067 -10.133 0.876 979 HG3 GLU 130 HG3 GLU 130 11.690 -10.364 -0.194 980 H SER 131 H SER 131 11.184 -12.169 -2.888 981 HA SER 131 HA SER 131 12.775 -13.808 -4.729 982 HB2 SER 131 HB2 SER 131 12.678 -15.874 -3.458 983 HB3 SER 131 HB3 SER 131 13.387 -14.642 -2.415 984 HG SER 131 HG SER 131 11.458 -14.485 -1.309 985 H GLU 132 H GLU 132 11.585 -15.597 -5.693 986 HA GLU 132 HA GLU 132 8.946 -15.002 -6.521 987 HB2 GLU 132 HB2 GLU 132 10.460 -16.330 -7.918 988 HB3 GLU 132 HB3 GLU 132 10.495 -17.620 -6.718 989 HG2 GLU 132 HG2 GLU 132 8.069 -18.024 -7.095 990 HG3 GLU 132 HG3 GLU 132 8.050 -16.740 -8.299 991 H GLU 133 H GLU 133 10.118 -17.622 -4.363 992 HA GLU 133 HA GLU 133 7.642 -18.727 -3.664 993 HB2 GLU 133 HB2 GLU 133 8.851 -19.692 -1.687 994 HB3 GLU 133 HB3 GLU 133 9.689 -19.918 -3.221 995 HG2 GLU 133 HG2 GLU 133 11.129 -17.920 -2.642 996 HG3 GLU 133 HG3 GLU 133 10.377 -17.920 -1.043 997 H GLN 134 H GLN 134 9.189 -15.811 -2.391 998 HA GLN 134 HA GLN 134 7.473 -15.319 -0.187 999 HB2 GLN 134 HB2 GLN 134 9.591 -14.051 -0.689 1000 HB3 GLN 134 HB3 GLN 134 8.777 -13.283 -2.045 1001 HG2 GLN 134 HG2 GLN 134 7.040 -12.539 -0.168 1002 HG3 GLN 134 HG3 GLN 134 8.399 -12.843 0.910 1003 HE21 GLN 134 HE21 GLN 134 7.159 -10.316 0.504 1004 HE22 GLN 134 HE22 GLN 134 8.337 -9.263 -0.190 1005 H MET 135 H MET 135 7.356 -14.066 -3.565 1006 HA MET 135 HA MET 135 4.919 -12.632 -3.219 1007 HB2 MET 135 HB2 MET 135 5.034 -12.061 -5.541 1008 HB3 MET 135 HB3 MET 135 6.656 -12.013 -4.888 1009 HG2 MET 135 HG2 MET 135 7.124 -14.199 -5.948 1010 HG3 MET 135 HG3 MET 135 5.509 -14.180 -6.658 1011 HE1 MET 135 HE1 MET 135 5.375 -10.879 -7.209 1012 HE2 MET 135 HE2 MET 135 4.709 -12.088 -8.313 1013 HE3 MET 135 HE3 MET 135 5.843 -10.875 -8.909 1014 H GLN 136 H GLN 136 5.570 -15.898 -4.242 1015 HA GLN 136 HA GLN 136 3.068 -16.635 -5.296 1016 HB2 GLN 136 HB2 GLN 136 5.130 -18.263 -3.756 1017 HB3 GLN 136 HB3 GLN 136 3.703 -18.974 -4.500 1018 HG2 GLN 136 HG2 GLN 136 6.013 -17.617 -5.924 1019 HG3 GLN 136 HG3 GLN 136 5.614 -19.334 -5.935 1020 HE21 GLN 136 HE21 GLN 136 4.882 -16.226 -7.278 1021 HE22 GLN 136 HE22 GLN 136 3.776 -16.772 -8.483 1022 H LYS 137 H LYS 137 4.274 -16.830 -1.881 1023 HA LYS 137 HA LYS 137 1.761 -17.727 -0.853 1024 HB2 LYS 137 HB2 LYS 137 3.933 -18.200 0.315 1025 HB3 LYS 137 HB3 LYS 137 4.029 -16.496 0.766 1026 HG2 LYS 137 HG2 LYS 137 1.934 -16.691 2.039 1027 HG3 LYS 137 HG3 LYS 137 1.764 -18.371 1.529 1028 HD2 LYS 137 HD2 LYS 137 3.810 -18.949 2.803 1029 HD3 LYS 137 HD3 LYS 137 3.959 -17.262 3.316 1030 HE2 LYS 137 HE2 LYS 137 1.735 -17.423 4.425 1031 HE3 LYS 137 HE3 LYS 137 1.631 -19.120 3.951 1032 HZ1 LYS 137 HZ1 LYS 137 2.345 -18.954 6.194 1033 HZ2 LYS 137 HZ2 LYS 137 3.591 -17.899 5.788 1034 HZ3 LYS 137 HZ3 LYS 137 3.649 -19.505 5.273 1035 H MET 138 H MET 138 3.166 -14.504 -1.295 1036 HA MET 138 HA MET 138 1.327 -12.900 0.084 1037 HB2 MET 138 HB2 MET 138 2.575 -12.375 -2.649 1038 HB3 MET 138 HB3 MET 138 1.798 -11.153 -1.651 1039 HG2 MET 138 HG2 MET 138 4.137 -12.667 -0.528 1040 HG3 MET 138 HG3 MET 138 4.420 -11.394 -1.703 1041 HE1 MET 138 HE1 MET 138 2.013 -11.809 1.496 1042 HE2 MET 138 HE2 MET 138 2.937 -10.806 2.611 1043 HE3 MET 138 HE3 MET 138 3.648 -12.278 1.958 1044 H ALA 139 H ALA 139 1.056 -14.250 -3.208 1045 HA ALA 139 HA ALA 139 -1.573 -13.376 -3.785 1046 HB1 ALA 139 HB1 ALA 139 0.002 -14.160 -5.516 1047 HB2 ALA 139 HB2 ALA 139 -1.523 -15.047 -5.597 1048 HB3 ALA 139 HB3 ALA 139 -0.098 -15.801 -4.873 1049 H GLU 140 H GLU 140 -0.373 -16.439 -2.363 1050 HA GLU 140 HA GLU 140 -2.794 -17.871 -2.262 1051 HB2 GLU 140 HB2 GLU 140 -0.386 -18.134 -0.413 1052 HB3 GLU 140 HB3 GLU 140 -1.676 -19.321 -0.565 1053 HG2 GLU 140 HG2 GLU 140 0.359 -18.548 -2.671 1054 HG3 GLU 140 HG3 GLU 140 0.256 -20.074 -1.803 1055 H MET 141 H MET 141 -1.315 -15.803 0.225 1056 HA MET 141 HA MET 141 -3.326 -16.256 2.235 1057 HB2 MET 141 HB2 MET 141 -1.101 -14.191 2.026 1058 HB3 MET 141 HB3 MET 141 -2.130 -14.379 3.442 1059 HG2 MET 141 HG2 MET 141 -1.275 -16.637 3.801 1060 HG3 MET 141 HG3 MET 141 -0.311 -16.528 2.326 1061 HE1 MET 141 HE1 MET 141 0.503 -13.895 6.053 1062 HE2 MET 141 HE2 MET 141 -0.795 -15.085 5.989 1063 HE3 MET 141 HE3 MET 141 -0.881 -13.635 4.990 1064 H GLY 142 H GLY 142 -3.288 -14.316 -0.542 1065 HA2 GLY 142 HA2 GLY 142 -4.874 -12.855 -1.369 1066 HA3 GLY 142 HA3 GLY 142 -5.743 -12.957 0.154 1067 H MET 143 H MET 143 -2.344 -12.086 0.019 1068 HA MET 143 HA MET 143 -2.651 -9.475 1.129 1069 HB2 MET 143 HB2 MET 143 -0.602 -10.802 1.440 1070 HB3 MET 143 HB3 MET 143 -0.287 -10.786 -0.285 1071 HG2 MET 143 HG2 MET 143 -0.352 -8.233 1.318 1072 HG3 MET 143 HG3 MET 143 1.101 -9.230 1.211 1073 HE1 MET 143 HE1 MET 143 1.312 -6.227 0.347 1074 HE2 MET 143 HE2 MET 143 2.167 -6.385 -1.188 1075 HE3 MET 143 HE3 MET 143 2.615 -7.404 0.182 1076 H GLU 144 H GLU 144 -2.286 -10.678 -2.202 1077 HA GLU 144 HA GLU 144 -2.393 -8.357 -3.724 1078 HB2 GLU 144 HB2 GLU 144 -2.240 -10.455 -4.890 1079 HB3 GLU 144 HB3 GLU 144 -3.690 -11.084 -4.115 1080 HG2 GLU 144 HG2 GLU 144 -5.065 -9.460 -5.432 1081 HG3 GLU 144 HG3 GLU 144 -3.597 -8.891 -6.226 1082 H GLU 145 H GLU 145 -5.197 -10.233 -2.554 1083 HA GLU 145 HA GLU 145 -7.196 -8.325 -3.200 1084 HB2 GLU 145 HB2 GLU 145 -7.318 -10.645 -1.228 1085 HB3 GLU 145 HB3 GLU 145 -8.709 -9.790 -1.893 1086 HG2 GLU 145 HG2 GLU 145 -6.724 -11.432 -3.509 1087 HG3 GLU 145 HG3 GLU 145 -8.309 -11.991 -2.979 1088 H GLY 146 H GLY 146 -5.102 -8.652 -0.446 1089 HA2 GLY 146 HA2 GLY 146 -6.546 -7.163 1.501 1090 HA3 GLY 146 HA3 GLY 146 -4.815 -7.462 1.491 1091 H MET 147 H MET 147 -3.919 -6.226 -0.749 1092 HA MET 147 HA MET 147 -4.121 -3.410 -0.303 1093 HB2 MET 147 HB2 MET 147 -3.019 -4.963 -2.681 1094 HB3 MET 147 HB3 MET 147 -2.910 -3.213 -2.529 1095 HG2 MET 147 HG2 MET 147 -1.564 -3.489 -0.477 1096 HG3 MET 147 HG3 MET 147 -1.661 -5.231 -0.677 1097 HE1 MET 147 HE1 MET 147 0.574 -2.433 -3.605 1098 HE2 MET 147 HE2 MET 147 -0.205 -1.875 -2.125 1099 HE3 MET 147 HE3 MET 147 -1.186 -2.450 -3.475 1100 H ARG 148 H ARG 148 -5.671 -5.643 -2.570 1101 HA ARG 148 HA ARG 148 -6.592 -3.770 -4.474 1102 HB2 ARG 148 HB2 ARG 148 -6.278 -6.305 -4.690 1103 HB3 ARG 148 HB3 ARG 148 -7.836 -6.479 -3.887 1104 HG2 ARG 148 HG2 ARG 148 -8.936 -5.273 -5.730 1105 HG3 ARG 148 HG3 ARG 148 -7.370 -5.031 -6.516 1106 HD2 ARG 148 HD2 ARG 148 -7.102 -7.527 -6.611 1107 HD3 ARG 148 HD3 ARG 148 -8.746 -7.683 -5.984 1108 HE ARG 148 HE ARG 148 -8.952 -6.103 -8.234 1109 HH11 ARG 148 HH11 ARG 148 -7.844 -9.324 -7.552 1110 HH12 ARG 148 HH12 ARG 148 -8.223 -9.889 -9.144 1111 HH21 ARG 148 HH21 ARG 148 -9.424 -6.872 -10.246 1112 HH22 ARG 148 HH22 ARG 148 -9.109 -8.524 -10.636 1113 H GLU 149 H GLU 149 -8.360 -5.405 -1.805 1114 HA GLU 149 HA GLU 149 -10.812 -4.047 -1.967 1115 HB2 GLU 149 HB2 GLU 149 -9.373 -5.263 0.415 1116 HB3 GLU 149 HB3 GLU 149 -10.981 -4.561 0.554 1117 HG2 GLU 149 HG2 GLU 149 -10.229 -6.907 -1.220 1118 HG3 GLU 149 HG3 GLU 149 -11.037 -7.016 0.343 1119 H ALA 150 H ALA 150 -7.918 -3.254 -0.046 1120 HA ALA 150 HA ALA 150 -8.768 -0.923 1.216 1121 HB1 ALA 150 HB1 ALA 150 -6.676 -2.135 1.719 1122 HB2 ALA 150 HB2 ALA 150 -6.375 -0.417 1.457 1123 HB3 ALA 150 HB3 ALA 150 -5.985 -1.586 0.191 1124 H ILE 151 H ILE 151 -7.366 -1.305 -2.022 1125 HA ILE 151 HA ILE 151 -7.191 1.509 -2.610 1126 HB ILE 151 HB ILE 151 -6.747 -0.969 -4.325 1127 HG12 ILE 151 HG12 ILE 151 -4.654 0.964 -3.224 1128 HG13 ILE 151 HG13 ILE 151 -5.174 -0.458 -2.333 1129 HG21 ILE 151 HG21 ILE 151 -6.156 1.917 -5.065 1130 HG22 ILE 151 HG22 ILE 151 -7.350 0.867 -5.827 1131 HG23 ILE 151 HG23 ILE 151 -5.632 0.504 -5.986 1132 HD11 ILE 151 HD11 ILE 151 -3.771 -0.435 -5.002 1133 HD12 ILE 151 HD12 ILE 151 -4.358 -1.883 -4.174 1134 HD13 ILE 151 HD13 ILE 151 -3.095 -0.900 -3.437 1135 H GLU 152 H GLU 152 -9.599 -0.996 -3.137 1136 HA GLU 152 HA GLU 152 -11.422 0.531 -4.737 1137 HB2 GLU 152 HB2 GLU 152 -11.834 -1.781 -2.796 1138 HB3 GLU 152 HB3 GLU 152 -13.156 -1.077 -3.719 1139 HG2 GLU 152 HG2 GLU 152 -10.705 -2.122 -5.140 1140 HG3 GLU 152 HG3 GLU 152 -11.941 -3.239 -4.576 1141 H GLN 153 H GLN 153 -10.715 0.407 -1.279 1142 HA GLN 153 HA GLN 153 -13.082 1.861 -0.426 1143 HB2 GLN 153 HB2 GLN 153 -10.542 1.096 1.070 1144 HB3 GLN 153 HB3 GLN 153 -11.963 1.824 1.818 1145 HG2 GLN 153 HG2 GLN 153 -13.294 -0.125 1.386 1146 HG3 GLN 153 HG3 GLN 153 -12.054 -0.817 0.344 1147 HE21 GLN 153 HE21 GLN 153 -11.462 0.699 3.501 1148 HE22 GLN 153 HE22 GLN 153 -10.919 -0.747 4.266 1149 H ILE 154 H ILE 154 -9.998 2.809 -1.675 1150 HA ILE 154 HA ILE 154 -9.626 5.339 -0.474 1151 HB ILE 154 HB ILE 154 -8.996 4.498 -3.335 1152 HG12 ILE 154 HG12 ILE 154 -7.195 4.586 -0.872 1153 HG13 ILE 154 HG13 ILE 154 -7.856 3.121 -1.591 1154 HG21 ILE 154 HG21 ILE 154 -9.063 6.952 -3.185 1155 HG22 ILE 154 HG22 ILE 154 -7.397 6.411 -3.367 1156 HG23 ILE 154 HG23 ILE 154 -7.988 6.920 -1.784 1157 HD11 ILE 154 HD11 ILE 154 -5.532 3.443 -2.188 1158 HD12 ILE 154 HD12 ILE 154 -5.903 5.011 -2.902 1159 HD13 ILE 154 HD13 ILE 154 -6.554 3.536 -3.622 1160 H ASP 155 H ASP 155 -11.642 4.327 -3.213 1161 HA ASP 155 HA ASP 155 -12.669 6.772 -4.097 1162 HB2 ASP 155 HB2 ASP 155 -14.095 4.073 -3.953 1163 HB3 ASP 155 HB3 ASP 155 -14.551 5.423 -4.995 1164 H ALA 156 H ALA 156 -13.634 4.699 -1.394 1165 HA ALA 156 HA ALA 156 -15.889 6.245 -0.527 1166 HB1 ALA 156 HB1 ALA 156 -15.680 3.844 0.002 1167 HB2 ALA 156 HB2 ALA 156 -15.865 4.807 1.469 1168 HB3 ALA 156 HB3 ALA 156 -14.276 4.181 1.015 1169 H VAL 157 H VAL 157 -12.442 6.433 0.142 1170 HA VAL 157 HA VAL 157 -12.668 8.091 2.521 1171 HB VAL 157 HB VAL 157 -10.247 7.586 0.716 1172 HG11 VAL 157 HG11 VAL 157 -9.906 9.644 2.044 1173 HG12 VAL 157 HG12 VAL 157 -8.852 8.354 2.624 1174 HG13 VAL 157 HG13 VAL 157 -10.309 8.772 3.527 1175 HG21 VAL 157 HG21 VAL 157 -9.545 5.953 2.439 1176 HG22 VAL 157 HG22 VAL 157 -11.084 5.503 1.711 1177 HG23 VAL 157 HG23 VAL 157 -11.049 6.230 3.317 1178 H LEU 158 H LEU 158 -12.201 8.671 -0.938 1179 HA LEU 158 HA LEU 158 -11.743 11.523 -0.658 1180 HB2 LEU 158 HB2 LEU 158 -12.288 9.912 -3.180 1181 HB3 LEU 158 HB3 LEU 158 -11.630 11.544 -3.103 1182 HG LEU 158 HG LEU 158 -10.249 8.997 -2.157 1183 HD11 LEU 158 HD11 LEU 158 -9.589 10.812 -4.484 1184 HD12 LEU 158 HD12 LEU 158 -10.291 9.193 -4.575 1185 HD13 LEU 158 HD13 LEU 158 -8.656 9.407 -3.954 1186 HD21 LEU 158 HD21 LEU 158 -9.186 11.839 -2.062 1187 HD22 LEU 158 HD22 LEU 158 -8.273 10.376 -1.684 1188 HD23 LEU 158 HD23 LEU 158 -9.637 10.844 -0.676 1189 H SER 159 H SER 159 -14.409 9.450 -1.772 1190 HA SER 159 HA SER 159 -16.188 11.690 -2.382 1191 HB2 SER 159 HB2 SER 159 -16.078 9.550 -3.763 1192 HB3 SER 159 HB3 SER 159 -16.826 8.710 -2.420 1193 HG SER 159 HG SER 159 -18.021 10.101 -4.329 1194 H GLU 160 H GLU 160 -15.955 9.045 -0.082 1195 HA GLU 160 HA GLU 160 -17.174 8.202 1.575 1196 HB2 GLU 160 HB2 GLU 160 -16.299 10.504 2.505 1197 HB3 GLU 160 HB3 GLU 160 -17.997 10.923 2.517 1198 HG2 GLU 160 HG2 GLU 160 -18.420 8.862 3.904 1199 HG3 GLU 160 HG3 GLU 160 -16.679 8.633 3.993 1200 HA PRO 161 HA PRO 161 -21.441 8.337 -0.020 1201 HB2 PRO 161 HB2 PRO 161 -21.574 5.897 -1.111 1202 HB3 PRO 161 HB3 PRO 161 -20.705 7.185 -1.968 1203 HG2 PRO 161 HG2 PRO 161 -19.582 4.998 -0.202 1204 HG3 PRO 161 HG3 PRO 161 -19.038 5.501 -1.819 1205 HD2 PRO 161 HD2 PRO 161 -17.869 6.414 0.530 1206 HD3 PRO 161 HD3 PRO 161 -17.859 7.335 -0.989 1207 H ALA 162 H ALA 162 -23.222 7.121 0.851 1208 HA ALA 162 HA ALA 162 -22.752 5.816 3.439 1209 HB1 ALA 162 HB1 ALA 162 -25.323 6.741 2.121 1210 HB2 ALA 162 HB2 ALA 162 -24.377 7.657 3.293 1211 HB3 ALA 162 HB3 ALA 162 -25.165 6.156 3.783 1212 H ASN 163 H ASN 163 -21.894 4.246 1.342 1213 HA ASN 163 HA ASN 163 -23.505 1.850 1.612 1214 HB2 ASN 163 HB2 ASN 163 -23.698 1.526 -0.891 1215 HB3 ASN 163 HB3 ASN 163 -24.694 2.812 -0.240 1216 HD21 ASN 163 HD21 ASN 163 -21.807 2.107 -2.114 1217 HD22 ASN 163 HD22 ASN 163 -21.694 3.662 -2.857 1218 H ALA 164 H ALA 164 -20.907 2.504 2.485 1219 HA ALA 164 HA ALA 164 -18.857 1.315 0.888 1220 HB1 ALA 164 HB1 ALA 164 -17.532 1.318 2.968 1221 HB2 ALA 164 HB2 ALA 164 -18.981 1.691 3.906 1222 HB3 ALA 164 HB3 ALA 164 -18.359 2.859 2.738 1223 H LEU 165 H LEU 165 -19.461 -0.675 0.095 1224 HA LEU 165 HA LEU 165 -20.079 -2.895 1.965 1225 HB2 LEU 165 HB2 LEU 165 -21.676 -2.109 -0.514 1226 HB3 LEU 165 HB3 LEU 165 -21.884 -3.631 0.335 1227 HG LEU 165 HG LEU 165 -22.461 -0.879 1.511 1228 HD11 LEU 165 HD11 LEU 165 -24.394 -3.002 0.516 1229 HD12 LEU 165 HD12 LEU 165 -24.058 -1.447 -0.250 1230 HD13 LEU 165 HD13 LEU 165 -24.836 -1.496 1.329 1231 HD21 LEU 165 HD21 LEU 165 -22.954 -3.644 2.676 1232 HD22 LEU 165 HD22 LEU 165 -23.501 -2.119 3.380 1233 HD23 LEU 165 HD23 LEU 165 -21.778 -2.457 3.246 1234 H GLU 166 H GLU 166 -17.616 -2.279 0.445 1235 HA GLU 166 HA GLU 166 -17.351 -3.628 -1.989 1236 HB2 GLU 166 HB2 GLU 166 -15.325 -2.920 0.158 1237 HB3 GLU 166 HB3 GLU 166 -14.833 -3.780 -1.294 1238 HG2 GLU 166 HG2 GLU 166 -14.386 -1.427 -1.605 1239 HG3 GLU 166 HG3 GLU 166 -15.683 -1.906 -2.688 1240 H HIS 167 H HIS 167 -17.891 -5.656 -2.387 1241 HA HIS 167 HA HIS 167 -18.489 -7.796 -2.256 1242 HB2 HIS 167 HB2 HIS 167 -16.070 -8.004 -0.428 1243 HB3 HIS 167 HB3 HIS 167 -17.027 -9.409 -0.898 1244 HD1 HIS 167 HD1 HIS 167 -14.451 -7.058 -2.156 1245 HD2 HIS 167 HD2 HIS 167 -16.824 -10.113 -3.662 1246 HE1 HIS 167 HE1 HIS 167 -13.459 -7.642 -4.386 1247 HE2 HIS 167 HE2 HIS 167 -15.005 -9.365 -5.345 1248 H HIS 168 H HIS 168 -20.405 -8.262 -1.441 1249 HA HIS 168 HA HIS 168 -21.027 -7.892 1.418 1250 HB2 HIS 168 HB2 HIS 168 -23.138 -6.592 0.624 1251 HB3 HIS 168 HB3 HIS 168 -21.596 -5.741 0.564 1252 HD1 HIS 168 HD1 HIS 168 -21.547 -4.323 -1.475 1253 HD2 HIS 168 HD2 HIS 168 -23.415 -7.944 -2.243 1254 HE1 HIS 168 HE1 HIS 168 -22.165 -4.246 -3.894 1255 HE2 HIS 168 HE2 HIS 168 -23.433 -6.368 -4.293 1256 H HIS 169 H HIS 169 -23.098 -8.767 2.071 1257 HA HIS 169 HA HIS 169 -24.719 -10.308 2.299 1258 HB2 HIS 169 HB2 HIS 169 -24.802 -10.255 -0.742 1259 HB3 HIS 169 HB3 HIS 169 -25.992 -11.084 0.256 1260 HD1 HIS 169 HD1 HIS 169 -27.808 -9.653 1.347 1261 HD2 HIS 169 HD2 HIS 169 -24.947 -7.405 -0.644 1262 HE1 HIS 169 HE1 HIS 169 -28.761 -7.339 1.197 1263 HE2 HIS 169 HE2 HIS 169 -27.107 -6.057 -0.204 1264 H HIS 170 H HIS 170 -21.841 -11.217 1.986 1265 HA HIS 170 HA HIS 170 -22.178 -14.000 1.055 1266 HB2 HIS 170 HB2 HIS 170 -19.674 -12.489 1.913 1267 HB3 HIS 170 HB3 HIS 170 -19.697 -14.156 1.339 1268 HD1 HIS 170 HD1 HIS 170 -20.618 -14.446 -1.187 1269 HD2 HIS 170 HD2 HIS 170 -19.442 -10.619 -0.104 1270 HE1 HIS 170 HE1 HIS 170 -20.345 -13.206 -3.340 1271 HE2 HIS 170 HE2 HIS 170 -19.529 -10.931 -2.676 1272 H HIS 171 H HIS 171 -22.661 -15.575 2.449 1273 HA HIS 171 HA HIS 171 -22.958 -15.148 5.259 1274 HB2 HIS 171 HB2 HIS 171 -24.501 -16.584 3.955 1275 HB3 HIS 171 HB3 HIS 171 -23.191 -17.700 3.600 1276 HD1 HIS 171 HD1 HIS 171 -22.491 -19.332 5.450 1277 HD2 HIS 171 HD2 HIS 171 -25.577 -16.794 6.577 1278 HE1 HIS 171 HE1 HIS 171 -23.400 -20.295 7.582 1279 HE2 HIS 171 HE2 HIS 171 -25.116 -18.625 8.346 1280 H HIS 172 H HIS 172 -21.057 -14.880 6.383 1281 HA HIS 172 HA HIS 172 -19.410 -17.255 6.832 1282 HB2 HIS 172 HB2 HIS 172 -18.174 -15.919 5.090 1283 HB3 HIS 172 HB3 HIS 172 -18.136 -14.545 6.190 1284 HD1 HIS 172 HD1 HIS 172 -16.762 -18.059 5.825 1285 HD2 HIS 172 HD2 HIS 172 -16.029 -14.605 8.015 1286 HE1 HIS 172 HE1 HIS 172 -14.624 -18.489 7.051 1287 HE2 HIS 172 HE2 HIS 172 -14.135 -16.349 8.273 Start of MODEL 9 1 H1 THR 1 H1 THR 1 -10.823 3.477 -7.312 2 H2 THR 1 H2 THR 1 -12.206 4.054 -8.093 3 H3 THR 1 H3 THR 1 -10.701 4.163 -8.855 4 HA THR 1 HA THR 1 -11.965 1.592 -8.119 5 HB THR 1 HB THR 1 -11.885 2.810 -10.905 6 HG1 THR 1 HG1 THR 1 -14.204 2.695 -9.266 7 HG21 THR 1 HG21 THR 1 -13.604 1.105 -11.439 8 HG22 THR 1 HG22 THR 1 -13.495 0.479 -9.793 9 HG23 THR 1 HG23 THR 1 -12.106 0.356 -10.879 10 H VAL 2 H VAL 2 -10.577 -0.137 -8.523 11 HA VAL 2 HA VAL 2 -7.898 0.404 -9.526 12 HB VAL 2 HB VAL 2 -9.197 -2.236 -8.760 13 HG11 VAL 2 HG11 VAL 2 -6.251 -1.578 -9.252 14 HG12 VAL 2 HG12 VAL 2 -7.267 -2.587 -10.286 15 HG13 VAL 2 HG13 VAL 2 -6.864 -3.124 -8.654 16 HG21 VAL 2 HG21 VAL 2 -7.958 -2.014 -6.631 17 HG22 VAL 2 HG22 VAL 2 -9.040 -0.640 -6.866 18 HG23 VAL 2 HG23 VAL 2 -7.311 -0.456 -7.159 19 H VAL 3 H VAL 3 -8.086 1.026 -11.620 20 HA VAL 3 HA VAL 3 -9.876 -0.193 -13.509 21 HB VAL 3 HB VAL 3 -8.886 1.471 -15.143 22 HG11 VAL 3 HG11 VAL 3 -9.860 2.613 -12.484 23 HG12 VAL 3 HG12 VAL 3 -10.882 2.068 -13.818 24 HG13 VAL 3 HG13 VAL 3 -9.847 3.482 -14.023 25 HG21 VAL 3 HG21 VAL 3 -6.607 1.616 -14.178 26 HG22 VAL 3 HG22 VAL 3 -7.266 2.363 -12.719 27 HG23 VAL 3 HG23 VAL 3 -7.351 3.217 -14.263 28 H SER 4 H SER 4 -6.573 -0.801 -12.688 29 HA SER 4 HA SER 4 -6.525 -3.017 -14.589 30 HB2 SER 4 HB2 SER 4 -4.322 -0.905 -14.638 31 HB3 SER 4 HB3 SER 4 -4.329 -2.410 -15.533 32 HG SER 4 HG SER 4 -6.133 -1.657 -16.689 33 H VAL 5 H VAL 5 -5.339 -4.749 -13.809 34 HA VAL 5 HA VAL 5 -3.491 -4.352 -11.507 35 HB VAL 5 HB VAL 5 -5.264 -6.814 -11.943 36 HG11 VAL 5 HG11 VAL 5 -3.388 -6.146 -9.626 37 HG12 VAL 5 HG12 VAL 5 -3.105 -7.378 -10.858 38 HG13 VAL 5 HG13 VAL 5 -4.441 -7.559 -9.721 39 HG21 VAL 5 HG21 VAL 5 -5.530 -4.640 -9.832 40 HG22 VAL 5 HG22 VAL 5 -6.492 -6.121 -9.913 41 HG23 VAL 5 HG23 VAL 5 -6.630 -4.909 -11.190 42 H ASP 6 H ASP 6 -1.467 -4.847 -12.096 43 HA ASP 6 HA ASP 6 -0.948 -6.966 -14.114 44 HB2 ASP 6 HB2 ASP 6 0.533 -4.342 -13.638 45 HB3 ASP 6 HB3 ASP 6 1.156 -5.635 -14.660 46 H LYS 7 H LYS 7 0.178 -8.644 -13.362 47 HA LYS 7 HA LYS 7 1.969 -8.357 -11.010 48 HB2 LYS 7 HB2 LYS 7 -0.060 -9.533 -10.295 49 HB3 LYS 7 HB3 LYS 7 0.051 -10.649 -11.654 50 HG2 LYS 7 HG2 LYS 7 2.135 -11.594 -10.722 51 HG3 LYS 7 HG3 LYS 7 2.055 -10.459 -9.369 52 HD2 LYS 7 HD2 LYS 7 -0.032 -11.506 -8.590 53 HD3 LYS 7 HD3 LYS 7 -0.037 -12.588 -9.990 54 HE2 LYS 7 HE2 LYS 7 1.993 -13.686 -9.197 55 HE3 LYS 7 HE3 LYS 7 2.150 -12.532 -7.876 56 HZ1 LYS 7 HZ1 LYS 7 0.105 -13.365 -6.939 57 HZ2 LYS 7 HZ2 LYS 7 1.228 -14.624 -7.142 58 HZ3 LYS 7 HZ3 LYS 7 -0.064 -14.466 -8.213 59 H ASP 8 H ASP 8 3.967 -8.481 -11.887 60 HA ASP 8 HA ASP 8 4.629 -10.503 -13.931 61 HB2 ASP 8 HB2 ASP 8 6.277 -8.174 -12.826 62 HB3 ASP 8 HB3 ASP 8 6.788 -9.271 -14.112 63 H VAL 9 H VAL 9 4.808 -12.407 -12.853 64 HA VAL 9 HA VAL 9 6.157 -12.808 -10.350 65 HB VAL 9 HB VAL 9 5.692 -14.934 -12.500 66 HG11 VAL 9 HG11 VAL 9 5.899 -15.203 -9.472 67 HG12 VAL 9 HG12 VAL 9 7.130 -15.683 -10.644 68 HG13 VAL 9 HG13 VAL 9 5.578 -16.520 -10.605 69 HG21 VAL 9 HG21 VAL 9 3.497 -15.404 -11.455 70 HG22 VAL 9 HG22 VAL 9 3.565 -13.785 -12.154 71 HG23 VAL 9 HG23 VAL 9 3.697 -13.996 -10.404 72 H GLU 10 H GLU 10 7.144 -12.651 -13.676 73 HA GLU 10 HA GLU 10 9.733 -13.859 -13.479 74 HB2 GLU 10 HB2 GLU 10 8.667 -11.882 -15.555 75 HB3 GLU 10 HB3 GLU 10 10.126 -12.850 -15.717 76 HG2 GLU 10 HG2 GLU 10 8.458 -13.914 -17.038 77 HG3 GLU 10 HG3 GLU 10 8.691 -14.912 -15.608 78 H ALA 11 H ALA 11 8.611 -10.477 -13.595 79 HA ALA 11 HA ALA 11 11.242 -9.368 -12.974 80 HB1 ALA 11 HB1 ALA 11 10.154 -7.187 -13.246 81 HB2 ALA 11 HB2 ALA 11 8.566 -7.963 -13.301 82 HB3 ALA 11 HB3 ALA 11 9.734 -8.251 -14.591 83 H LEU 12 H LEU 12 9.014 -10.823 -11.058 84 HA LEU 12 HA LEU 12 8.442 -10.898 -8.871 85 HB2 LEU 12 HB2 LEU 12 11.111 -9.487 -8.485 86 HB3 LEU 12 HB3 LEU 12 10.220 -10.342 -7.233 87 HG LEU 12 HG LEU 12 11.507 -11.596 -9.695 88 HD11 LEU 12 HD11 LEU 12 12.230 -11.849 -6.757 89 HD12 LEU 12 HD12 LEU 12 13.140 -10.959 -7.982 90 HD13 LEU 12 HD13 LEU 12 12.997 -12.711 -8.096 91 HD21 LEU 12 HD21 LEU 12 9.434 -12.773 -9.158 92 HD22 LEU 12 HD22 LEU 12 9.934 -12.937 -7.473 93 HD23 LEU 12 HD23 LEU 12 10.830 -13.768 -8.747 94 H SER 13 H SER 13 7.421 -8.586 -10.289 95 HA SER 13 HA SER 13 7.112 -6.624 -8.084 96 HB2 SER 13 HB2 SER 13 6.952 -4.841 -9.866 97 HB3 SER 13 HB3 SER 13 8.541 -5.585 -9.742 98 HG SER 13 HG SER 13 6.592 -6.453 -11.626 99 H PHE 14 H PHE 14 5.090 -6.020 -7.621 100 HA PHE 14 HA PHE 14 2.842 -6.859 -9.369 101 HB2 PHE 14 HB2 PHE 14 2.878 -8.174 -7.310 102 HB3 PHE 14 HB3 PHE 14 3.014 -6.719 -6.325 103 HD1 PHE 14 HD1 PHE 14 0.737 -8.129 -8.976 104 HD2 PHE 14 HD2 PHE 14 1.048 -6.014 -5.274 105 HE1 PHE 14 HE1 PHE 14 -1.713 -8.026 -8.825 106 HE2 PHE 14 HE2 PHE 14 -1.394 -5.917 -5.134 107 HZ PHE 14 HZ PHE 14 -2.780 -6.913 -6.899 108 H SER 15 H SER 15 2.109 -5.101 -10.388 109 HA SER 15 HA SER 15 2.151 -2.434 -9.101 110 HB2 SER 15 HB2 SER 15 2.028 -1.541 -11.451 111 HB3 SER 15 HB3 SER 15 3.465 -2.513 -11.152 112 HG SER 15 HG SER 15 1.412 -4.028 -12.065 113 H ILE 16 H ILE 16 0.248 -1.648 -8.406 114 HA ILE 16 HA ILE 16 -2.318 -2.517 -9.602 115 HB ILE 16 HB ILE 16 -1.786 -1.067 -6.966 116 HG12 ILE 16 HG12 ILE 16 -2.636 -3.950 -7.480 117 HG13 ILE 16 HG13 ILE 16 -1.039 -3.437 -6.945 118 HG21 ILE 16 HG21 ILE 16 -4.429 -2.098 -8.073 119 HG22 ILE 16 HG22 ILE 16 -3.976 -0.404 -7.873 120 HG23 ILE 16 HG23 ILE 16 -4.190 -1.431 -6.455 121 HD11 ILE 16 HD11 ILE 16 -2.007 -2.627 -4.852 122 HD12 ILE 16 HD12 ILE 16 -2.333 -4.338 -5.119 123 HD13 ILE 16 HD13 ILE 16 -3.607 -3.150 -5.390 124 H VAL 17 H VAL 17 -3.289 -1.167 -10.962 125 HA VAL 17 HA VAL 17 -2.583 1.711 -11.066 126 HB VAL 17 HB VAL 17 -3.536 -0.224 -13.230 127 HG11 VAL 17 HG11 VAL 17 -3.027 2.755 -13.533 128 HG12 VAL 17 HG12 VAL 17 -4.596 1.954 -13.644 129 HG13 VAL 17 HG13 VAL 17 -3.353 1.630 -14.853 130 HG21 VAL 17 HG21 VAL 17 -0.910 1.288 -12.940 131 HG22 VAL 17 HG22 VAL 17 -1.343 0.234 -14.290 132 HG23 VAL 17 HG23 VAL 17 -1.145 -0.443 -12.672 133 H ALA 18 H ALA 18 -4.171 3.047 -10.346 134 HA ALA 18 HA ALA 18 -7.025 2.275 -10.534 135 HB1 ALA 18 HB1 ALA 18 -5.669 3.196 -7.967 136 HB2 ALA 18 HB2 ALA 18 -6.202 1.549 -8.322 137 HB3 ALA 18 HB3 ALA 18 -7.389 2.844 -8.168 138 H GLU 19 H GLU 19 -8.497 4.018 -10.666 139 HA GLU 19 HA GLU 19 -7.406 6.784 -10.702 140 HB2 GLU 19 HB2 GLU 19 -9.521 5.569 -12.531 141 HB3 GLU 19 HB3 GLU 19 -9.137 7.292 -12.468 142 HG2 GLU 19 HG2 GLU 19 -6.839 6.809 -13.194 143 HG3 GLU 19 HG3 GLU 19 -7.206 5.084 -13.228 144 H PHE 20 H PHE 20 -8.492 8.298 -9.558 145 HA PHE 20 HA PHE 20 -11.120 7.659 -8.313 146 HB2 PHE 20 HB2 PHE 20 -8.884 9.157 -6.860 147 HB3 PHE 20 HB3 PHE 20 -10.379 8.521 -6.177 148 HD1 PHE 20 HD1 PHE 20 -10.690 5.892 -6.401 149 HD2 PHE 20 HD2 PHE 20 -6.918 7.909 -6.572 150 HE1 PHE 20 HE1 PHE 20 -9.536 3.805 -5.828 151 HE2 PHE 20 HE2 PHE 20 -5.776 5.811 -5.989 152 HZ PHE 20 HZ PHE 20 -7.086 3.764 -5.625 153 H ASP 21 H ASP 21 -12.566 9.423 -8.161 154 HA ASP 21 HA ASP 21 -12.067 11.715 -9.848 155 HB2 ASP 21 HB2 ASP 21 -14.305 10.563 -9.661 156 HB3 ASP 21 HB3 ASP 21 -14.446 11.164 -8.013 157 H ALA 22 H ALA 22 -10.320 12.786 -8.858 158 HA ALA 22 HA ALA 22 -10.801 14.699 -6.775 159 HB1 ALA 22 HB1 ALA 22 -9.005 12.329 -6.095 160 HB2 ALA 22 HB2 ALA 22 -10.565 12.688 -5.355 161 HB3 ALA 22 HB3 ALA 22 -9.205 13.779 -5.107 162 H ASP 23 H ASP 23 -8.444 15.611 -6.047 163 HA ASP 23 HA ASP 23 -6.706 15.774 -8.443 164 HB2 ASP 23 HB2 ASP 23 -5.665 17.741 -7.364 165 HB3 ASP 23 HB3 ASP 23 -7.392 17.957 -7.573 166 H VAL 24 H VAL 24 -4.300 16.097 -7.797 167 HA VAL 24 HA VAL 24 -3.323 13.599 -7.010 168 HB VAL 24 HB VAL 24 -1.849 16.247 -7.301 169 HG11 VAL 24 HG11 VAL 24 -0.430 14.677 -6.031 170 HG12 VAL 24 HG12 VAL 24 0.218 14.908 -7.656 171 HG13 VAL 24 HG13 VAL 24 -0.674 13.436 -7.266 172 HG21 VAL 24 HG21 VAL 24 -2.223 13.980 -9.294 173 HG22 VAL 24 HG22 VAL 24 -1.284 15.453 -9.565 174 HG23 VAL 24 HG23 VAL 24 -3.032 15.550 -9.344 175 H LYS 25 H LYS 25 -3.366 16.671 -5.189 176 HA LYS 25 HA LYS 25 -1.887 15.639 -2.948 177 HB2 LYS 25 HB2 LYS 25 -3.550 18.185 -3.101 178 HB3 LYS 25 HB3 LYS 25 -2.372 17.783 -1.847 179 HG2 LYS 25 HG2 LYS 25 -0.655 17.649 -3.795 180 HG3 LYS 25 HG3 LYS 25 -1.877 18.485 -4.753 181 HD2 LYS 25 HD2 LYS 25 -0.318 20.120 -3.886 182 HD3 LYS 25 HD3 LYS 25 -1.856 20.344 -3.055 183 HE2 LYS 25 HE2 LYS 25 -1.006 19.234 -1.067 184 HE3 LYS 25 HE3 LYS 25 0.477 18.766 -1.902 185 HZ1 LYS 25 HZ1 LYS 25 1.009 21.131 -2.129 186 HZ2 LYS 25 HZ2 LYS 25 0.887 20.651 -0.514 187 HZ3 LYS 25 HZ3 LYS 25 -0.368 21.528 -1.230 188 H ARG 26 H ARG 26 -5.277 15.871 -3.753 189 HA ARG 26 HA ARG 26 -6.457 15.282 -1.250 190 HB2 ARG 26 HB2 ARG 26 -7.713 16.105 -3.222 191 HB3 ARG 26 HB3 ARG 26 -7.388 14.604 -4.068 192 HG2 ARG 26 HG2 ARG 26 -9.674 14.623 -3.281 193 HG3 ARG 26 HG3 ARG 26 -8.772 13.377 -2.424 194 HD2 ARG 26 HD2 ARG 26 -8.623 14.794 -0.441 195 HD3 ARG 26 HD3 ARG 26 -9.391 16.133 -1.305 196 HE ARG 26 HE ARG 26 -11.320 14.368 -1.535 197 HH11 ARG 26 HH11 ARG 26 -9.389 14.892 1.296 198 HH12 ARG 26 HH12 ARG 26 -10.662 14.456 2.374 199 HH21 ARG 26 HH21 ARG 26 -12.934 13.816 -0.131 200 HH22 ARG 26 HH22 ARG 26 -12.648 13.833 1.570 201 H VAL 27 H VAL 27 -5.216 13.158 -3.855 202 HA VAL 27 HA VAL 27 -5.787 10.678 -2.472 203 HB VAL 27 HB VAL 27 -3.823 11.014 -4.784 204 HG11 VAL 27 HG11 VAL 27 -3.747 8.810 -3.672 205 HG12 VAL 27 HG12 VAL 27 -4.396 8.661 -5.307 206 HG13 VAL 27 HG13 VAL 27 -5.486 8.609 -3.918 207 HG21 VAL 27 HG21 VAL 27 -5.946 12.066 -5.464 208 HG22 VAL 27 HG22 VAL 27 -6.828 10.603 -5.026 209 HG23 VAL 27 HG23 VAL 27 -5.671 10.568 -6.356 210 H TRP 28 H TRP 28 -2.962 12.828 -2.752 211 HA TRP 28 HA TRP 28 -1.012 11.130 -1.575 212 HB2 TRP 28 HB2 TRP 28 -0.435 13.146 -2.889 213 HB3 TRP 28 HB3 TRP 28 -1.124 14.174 -1.645 214 HD1 TRP 28 HD1 TRP 28 0.480 14.850 0.347 215 HE1 TRP 28 HE1 TRP 28 2.923 14.331 0.934 216 HE3 TRP 28 HE3 TRP 28 1.373 11.124 -3.049 217 HZ2 TRP 28 HZ2 TRP 28 4.962 12.592 0.082 218 HZ3 TRP 28 HZ3 TRP 28 3.606 10.093 -3.101 219 HH2 TRP 28 HH2 TRP 28 5.365 10.814 -1.564 220 H ALA 29 H ALA 29 -3.353 13.362 -0.175 221 HA ALA 29 HA ALA 29 -2.467 13.628 2.441 222 HB1 ALA 29 HB1 ALA 29 -4.322 14.909 1.455 223 HB2 ALA 29 HB2 ALA 29 -4.795 14.182 2.995 224 HB3 ALA 29 HB3 ALA 29 -5.336 13.463 1.473 225 H ILE 30 H ILE 30 -4.155 10.881 0.978 226 HA ILE 30 HA ILE 30 -4.848 9.578 3.466 227 HB ILE 30 HB ILE 30 -5.797 7.821 2.203 228 HG12 ILE 30 HG12 ILE 30 -3.968 8.655 -0.079 229 HG13 ILE 30 HG13 ILE 30 -3.960 7.134 0.788 230 HG21 ILE 30 HG21 ILE 30 -7.004 9.951 1.945 231 HG22 ILE 30 HG22 ILE 30 -7.189 8.943 0.510 232 HG23 ILE 30 HG23 ILE 30 -6.076 10.314 0.486 233 HD11 ILE 30 HD11 ILE 30 -6.021 8.098 -1.172 234 HD12 ILE 30 HD12 ILE 30 -6.156 6.613 -0.225 235 HD13 ILE 30 HD13 ILE 30 -4.842 6.805 -1.385 236 H TRP 31 H TRP 31 -2.008 9.641 1.474 237 HA TRP 31 HA TRP 31 -0.796 7.272 2.727 238 HB2 TRP 31 HB2 TRP 31 0.216 9.208 0.594 239 HB3 TRP 31 HB3 TRP 31 1.177 7.871 1.231 240 HD1 TRP 31 HD1 TRP 31 -1.517 8.608 -1.330 241 HE1 TRP 31 HE1 TRP 31 -2.193 6.419 -2.501 242 HE3 TRP 31 HE3 TRP 31 0.893 5.265 1.712 243 HZ2 TRP 31 HZ2 TRP 31 -1.759 3.653 -2.187 244 HZ3 TRP 31 HZ3 TRP 31 0.718 2.862 1.204 245 HH2 TRP 31 HH2 TRP 31 -0.589 2.070 -0.706 246 H GLU 32 H GLU 32 -0.609 10.771 2.821 247 HA GLU 32 HA GLU 32 1.864 10.924 4.284 248 HB2 GLU 32 HB2 GLU 32 1.119 12.665 2.657 249 HB3 GLU 32 HB3 GLU 32 -0.210 13.091 3.733 250 HG2 GLU 32 HG2 GLU 32 1.373 13.843 5.443 251 HG3 GLU 32 HG3 GLU 32 2.730 13.311 4.457 252 H ASP 33 H ASP 33 -1.590 11.187 5.129 253 HA ASP 33 HA ASP 33 -0.937 11.567 7.984 254 HB2 ASP 33 HB2 ASP 33 -2.606 13.102 6.818 255 HB3 ASP 33 HB3 ASP 33 -3.664 11.717 6.643 256 HA PRO 34 HA PRO 34 -1.668 7.109 8.540 257 HB2 PRO 34 HB2 PRO 34 -1.648 7.045 11.301 258 HB3 PRO 34 HB3 PRO 34 -0.194 7.134 10.304 259 HG2 PRO 34 HG2 PRO 34 -1.686 9.373 11.677 260 HG3 PRO 34 HG3 PRO 34 0.064 9.064 11.634 261 HD2 PRO 34 HD2 PRO 34 -1.063 10.907 10.019 262 HD3 PRO 34 HD3 PRO 34 0.287 9.898 9.450 263 H ARG 35 H ARG 35 -3.750 9.503 10.193 264 HA ARG 35 HA ARG 35 -5.834 7.651 10.924 265 HB2 ARG 35 HB2 ARG 35 -5.676 10.669 10.804 266 HB3 ARG 35 HB3 ARG 35 -7.229 9.897 11.049 267 HG2 ARG 35 HG2 ARG 35 -6.222 10.673 13.157 268 HG3 ARG 35 HG3 ARG 35 -6.492 8.932 13.152 269 HD2 ARG 35 HD2 ARG 35 -3.774 10.041 12.428 270 HD3 ARG 35 HD3 ARG 35 -4.258 9.918 14.124 271 HE ARG 35 HE ARG 35 -4.632 7.459 12.671 272 HH11 ARG 35 HH11 ARG 35 -2.206 9.321 14.291 273 HH12 ARG 35 HH12 ARG 35 -1.298 7.921 14.724 274 HH21 ARG 35 HH21 ARG 35 -3.452 5.710 13.250 275 HH22 ARG 35 HH22 ARG 35 -1.996 5.909 14.165 276 H GLN 36 H GLN 36 -5.300 9.797 8.134 277 HA GLN 36 HA GLN 36 -7.696 9.191 6.701 278 HB2 GLN 36 HB2 GLN 36 -4.974 10.021 5.598 279 HB3 GLN 36 HB3 GLN 36 -6.498 10.088 4.719 280 HG2 GLN 36 HG2 GLN 36 -6.004 11.669 7.249 281 HG3 GLN 36 HG3 GLN 36 -5.565 12.269 5.655 282 HE21 GLN 36 HE21 GLN 36 -6.927 14.024 5.979 283 HE22 GLN 36 HE22 GLN 36 -8.636 13.895 5.855 284 H LEU 37 H LEU 37 -4.482 7.736 6.818 285 HA LEU 37 HA LEU 37 -4.679 5.925 4.656 286 HB2 LEU 37 HB2 LEU 37 -2.561 6.661 5.607 287 HB3 LEU 37 HB3 LEU 37 -2.949 5.933 7.150 288 HG LEU 37 HG LEU 37 -2.667 3.673 6.206 289 HD11 LEU 37 HD11 LEU 37 -1.823 3.270 3.942 290 HD12 LEU 37 HD12 LEU 37 -1.962 4.999 3.569 291 HD13 LEU 37 HD13 LEU 37 -3.414 4.046 3.892 292 HD21 LEU 37 HD21 LEU 37 -0.327 5.481 5.525 293 HD22 LEU 37 HD22 LEU 37 -0.257 3.736 5.818 294 HD23 LEU 37 HD23 LEU 37 -0.708 4.829 7.126 295 H GLU 38 H GLU 38 -5.230 5.420 8.164 296 HA GLU 38 HA GLU 38 -5.505 2.590 8.002 297 HB2 GLU 38 HB2 GLU 38 -6.162 2.701 10.353 298 HB3 GLU 38 HB3 GLU 38 -4.791 3.755 10.037 299 HG2 GLU 38 HG2 GLU 38 -6.358 5.703 9.959 300 HG3 GLU 38 HG3 GLU 38 -7.676 4.618 10.420 301 H ARG 39 H ARG 39 -7.867 5.121 7.457 302 HA ARG 39 HA ARG 39 -10.191 3.593 8.177 303 HB2 ARG 39 HB2 ARG 39 -11.517 5.400 7.442 304 HB3 ARG 39 HB3 ARG 39 -10.059 6.148 8.067 305 HG2 ARG 39 HG2 ARG 39 -9.262 6.650 5.855 306 HG3 ARG 39 HG3 ARG 39 -10.524 5.669 5.110 307 HD2 ARG 39 HD2 ARG 39 -10.921 8.267 6.647 308 HD3 ARG 39 HD3 ARG 39 -11.105 8.029 4.904 309 HE ARG 39 HE ARG 39 -12.841 6.634 6.863 310 HH11 ARG 39 HH11 ARG 39 -12.623 8.714 4.089 311 HH12 ARG 39 HH12 ARG 39 -14.324 8.618 3.781 312 HH21 ARG 39 HH21 ARG 39 -14.987 6.600 6.465 313 HH22 ARG 39 HH22 ARG 39 -15.644 7.463 5.115 314 H TRP 40 H TRP 40 -8.230 3.747 5.310 315 HA TRP 40 HA TRP 40 -10.200 2.080 3.845 316 HB2 TRP 40 HB2 TRP 40 -9.212 2.827 1.746 317 HB3 TRP 40 HB3 TRP 40 -9.739 4.209 2.691 318 HD1 TRP 40 HD1 TRP 40 -7.820 5.897 3.584 319 HE1 TRP 40 HE1 TRP 40 -5.387 6.259 2.835 320 HE3 TRP 40 HE3 TRP 40 -7.096 1.598 0.888 321 HZ2 TRP 40 HZ2 TRP 40 -3.441 4.950 1.286 322 HZ3 TRP 40 HZ3 TRP 40 -4.926 1.238 -0.207 323 HH2 TRP 40 HH2 TRP 40 -3.134 2.882 -0.005 324 H TRP 41 H TRP 41 -6.960 2.200 5.143 325 HA TRP 41 HA TRP 41 -5.462 0.718 3.343 326 HB2 TRP 41 HB2 TRP 41 -4.495 2.015 5.227 327 HB3 TRP 41 HB3 TRP 41 -5.076 0.806 6.372 328 HD1 TRP 41 HD1 TRP 41 -3.142 -0.789 7.095 329 HE1 TRP 41 HE1 TRP 41 -1.001 -1.700 6.004 330 HE3 TRP 41 HE3 TRP 41 -3.565 1.385 2.482 331 HZ2 TRP 41 HZ2 TRP 41 0.316 -1.519 3.533 332 HZ3 TRP 41 HZ3 TRP 41 -1.835 0.947 0.801 333 HH2 TRP 41 HH2 TRP 41 0.073 -0.482 1.314 334 H GLY 42 H GLY 42 -7.413 -0.527 6.008 335 HA2 GLY 42 HA2 GLY 42 -6.906 -3.314 5.204 336 HA3 GLY 42 HA3 GLY 42 -7.743 -2.781 6.649 337 HA PRO 43 HA PRO 43 -10.850 -3.567 2.939 338 HB2 PRO 43 HB2 PRO 43 -11.392 -6.267 3.314 339 HB3 PRO 43 HB3 PRO 43 -10.246 -5.655 2.112 340 HG2 PRO 43 HG2 PRO 43 -9.705 -6.721 4.885 341 HG3 PRO 43 HG3 PRO 43 -8.844 -7.074 3.370 342 HD2 PRO 43 HD2 PRO 43 -7.838 -5.317 5.149 343 HD3 PRO 43 HD3 PRO 43 -7.679 -5.019 3.403 344 HA PRO 44 HA PRO 44 -14.238 -2.731 5.704 345 HB2 PRO 44 HB2 PRO 44 -15.718 -5.054 4.442 346 HB3 PRO 44 HB3 PRO 44 -16.305 -3.424 4.816 347 HG2 PRO 44 HG2 PRO 44 -15.603 -3.986 2.328 348 HG3 PRO 44 HG3 PRO 44 -15.090 -2.442 3.043 349 HD2 PRO 44 HD2 PRO 44 -13.470 -4.928 2.533 350 HD3 PRO 44 HD3 PRO 44 -12.983 -3.220 2.419 351 H THR 45 H THR 45 -13.395 -6.205 5.673 352 HA THR 45 HA THR 45 -14.591 -6.688 8.312 353 HB THR 45 HB THR 45 -13.803 -9.049 8.001 354 HG1 THR 45 HG1 THR 45 -12.425 -9.517 6.472 355 HG21 THR 45 HG21 THR 45 -15.364 -7.932 5.644 356 HG22 THR 45 HG22 THR 45 -16.048 -8.426 7.195 357 HG23 THR 45 HG23 THR 45 -15.314 -9.628 6.131 358 H TRP 46 H TRP 46 -11.409 -5.981 7.031 359 HA TRP 46 HA TRP 46 -10.118 -6.490 9.670 360 HB2 TRP 46 HB2 TRP 46 -8.881 -6.286 6.884 361 HB3 TRP 46 HB3 TRP 46 -7.945 -6.409 8.368 362 HD1 TRP 46 HD1 TRP 46 -10.627 -8.544 6.485 363 HE1 TRP 46 HE1 TRP 46 -10.050 -11.018 6.859 364 HE3 TRP 46 HE3 TRP 46 -6.560 -8.005 9.537 365 HZ2 TRP 46 HZ2 TRP 46 -8.148 -12.551 8.228 366 HZ3 TRP 46 HZ3 TRP 46 -5.406 -10.031 10.321 367 HH2 TRP 46 HH2 TRP 46 -6.177 -12.259 9.679 368 HA PRO 47 HA PRO 47 -10.079 -1.769 9.433 369 HB2 PRO 47 HB2 PRO 47 -10.409 -1.386 12.146 370 HB3 PRO 47 HB3 PRO 47 -11.758 -1.544 11.012 371 HG2 PRO 47 HG2 PRO 47 -10.510 -3.662 12.774 372 HG3 PRO 47 HG3 PRO 47 -12.233 -3.293 12.529 373 HD2 PRO 47 HD2 PRO 47 -11.065 -5.347 11.237 374 HD3 PRO 47 HD3 PRO 47 -12.293 -4.349 10.428 375 H ALA 48 H ALA 48 -8.028 -1.044 9.201 376 HA ALA 48 HA ALA 48 -5.766 -2.146 10.631 377 HB1 ALA 48 HB1 ALA 48 -5.582 -1.521 8.257 378 HB2 ALA 48 HB2 ALA 48 -4.413 -0.633 9.236 379 HB3 ALA 48 HB3 ALA 48 -5.881 0.170 8.667 380 H THR 49 H THR 49 -4.758 -1.315 12.393 381 HA THR 49 HA THR 49 -5.418 1.388 13.427 382 HB THR 49 HB THR 49 -4.492 -1.046 15.040 383 HG1 THR 49 HG1 THR 49 -7.029 -0.078 14.374 384 HG21 THR 49 HG21 THR 49 -5.074 0.298 17.032 385 HG22 THR 49 HG22 THR 49 -5.503 1.663 16.000 386 HG23 THR 49 HG23 THR 49 -3.827 1.113 16.084 387 H PHE 50 H PHE 50 -3.726 2.783 13.109 388 HA PHE 50 HA PHE 50 -0.984 1.749 12.807 389 HB2 PHE 50 HB2 PHE 50 -2.357 4.310 11.962 390 HB3 PHE 50 HB3 PHE 50 -0.601 4.289 12.114 391 HD1 PHE 50 HD1 PHE 50 -3.418 2.412 10.479 392 HD2 PHE 50 HD2 PHE 50 0.710 3.531 10.297 393 HE1 PHE 50 HE1 PHE 50 -3.224 1.350 8.275 394 HE2 PHE 50 HE2 PHE 50 0.893 2.460 8.093 395 HZ PHE 50 HZ PHE 50 -1.073 1.369 7.083 396 H GLU 51 H GLU 51 0.234 1.629 14.540 397 HA GLU 51 HA GLU 51 0.027 3.295 16.893 398 HB2 GLU 51 HB2 GLU 51 2.065 1.214 16.013 399 HB3 GLU 51 HB3 GLU 51 2.121 2.027 17.575 400 HG2 GLU 51 HG2 GLU 51 -0.177 0.278 16.617 401 HG3 GLU 51 HG3 GLU 51 1.138 -0.262 17.663 402 H THR 52 H THR 52 2.314 3.005 14.210 403 HA THR 52 HA THR 52 3.409 5.685 14.834 404 HB THR 52 HB THR 52 5.150 3.299 14.019 405 HG1 THR 52 HG1 THR 52 4.733 4.421 16.621 406 HG21 THR 52 HG21 THR 52 5.860 6.021 15.162 407 HG22 THR 52 HG22 THR 52 6.108 5.518 13.486 408 HG23 THR 52 HG23 THR 52 7.008 4.733 14.788 409 H HIS 53 H HIS 53 3.967 6.900 12.994 410 HA HIS 53 HA HIS 53 4.322 5.720 10.378 411 HB2 HIS 53 HB2 HIS 53 1.835 5.816 10.546 412 HB3 HIS 53 HB3 HIS 53 1.917 7.542 10.860 413 HD2 HIS 53 HD2 HIS 53 2.005 5.058 7.866 414 HE1 HIS 53 HE1 HIS 53 2.210 9.012 6.387 415 HE2 HIS 53 HE2 HIS 53 1.703 6.609 5.815 416 H GLU 54 H GLU 54 6.370 6.697 10.680 417 HA GLU 54 HA GLU 54 6.599 9.614 10.910 418 HB2 GLU 54 HB2 GLU 54 8.887 7.633 10.491 419 HB3 GLU 54 HB3 GLU 54 8.985 9.281 11.119 420 HG2 GLU 54 HG2 GLU 54 7.806 6.852 12.470 421 HG3 GLU 54 HG3 GLU 54 9.282 7.702 12.908 422 H PHE 55 H PHE 55 5.754 10.363 8.945 423 HA PHE 55 HA PHE 55 6.545 9.262 6.408 424 HB2 PHE 55 HB2 PHE 55 4.262 10.341 7.105 425 HB3 PHE 55 HB3 PHE 55 5.049 11.883 6.785 426 HD1 PHE 55 HD1 PHE 55 4.275 8.582 5.216 427 HD2 PHE 55 HD2 PHE 55 5.068 12.721 4.546 428 HE1 PHE 55 HE1 PHE 55 3.701 8.306 2.839 429 HE2 PHE 55 HE2 PHE 55 4.485 12.438 2.173 430 HZ PHE 55 HZ PHE 55 3.799 10.234 1.319 431 H THR 56 H THR 56 8.906 9.655 7.110 432 HA THR 56 HA THR 56 9.892 12.047 5.663 433 HB THR 56 HB THR 56 10.083 12.591 8.071 434 HG1 THR 56 HG1 THR 56 11.926 13.522 7.603 435 HG21 THR 56 HG21 THR 56 10.248 10.311 9.025 436 HG22 THR 56 HG22 THR 56 11.591 11.322 9.568 437 HG23 THR 56 HG23 THR 56 11.849 10.123 8.299 438 H VAL 57 H VAL 57 12.300 11.784 5.138 439 HA VAL 57 HA VAL 57 12.776 9.326 3.737 440 HB VAL 57 HB VAL 57 14.644 11.679 4.325 441 HG11 VAL 57 HG11 VAL 57 16.040 10.866 2.431 442 HG12 VAL 57 HG12 VAL 57 15.027 9.426 2.316 443 HG13 VAL 57 HG13 VAL 57 15.992 9.707 3.762 444 HG21 VAL 57 HG21 VAL 57 12.665 12.356 3.028 445 HG22 VAL 57 HG22 VAL 57 12.966 11.073 1.853 446 HG23 VAL 57 HG23 VAL 57 14.105 12.414 2.006 447 H GLY 58 H GLY 58 13.101 7.508 4.932 448 HA2 GLY 58 HA2 GLY 58 14.442 5.997 6.148 449 HA3 GLY 58 HA3 GLY 58 15.300 7.332 6.893 450 H GLY 59 H GLY 59 11.888 7.693 6.937 451 HA2 GLY 59 HA2 GLY 59 11.665 7.088 9.787 452 HA3 GLY 59 HA3 GLY 59 10.422 7.773 8.748 453 H LYS 60 H LYS 60 9.908 5.709 10.639 454 HA LYS 60 HA LYS 60 9.162 3.464 8.829 455 HB2 LYS 60 HB2 LYS 60 10.113 3.294 11.716 456 HB3 LYS 60 HB3 LYS 60 9.304 1.962 10.889 457 HG2 LYS 60 HG2 LYS 60 11.120 1.957 9.182 458 HG3 LYS 60 HG3 LYS 60 11.950 3.227 10.094 459 HD2 LYS 60 HD2 LYS 60 12.189 1.719 12.018 460 HD3 LYS 60 HD3 LYS 60 11.271 0.461 11.184 461 HE2 LYS 60 HE2 LYS 60 13.046 0.279 9.483 462 HE3 LYS 60 HE3 LYS 60 13.954 1.567 10.275 463 HZ1 LYS 60 HZ1 LYS 60 14.698 -0.715 10.810 464 HZ2 LYS 60 HZ2 LYS 60 13.230 -0.982 11.605 465 HZ3 LYS 60 HZ3 LYS 60 14.293 0.208 12.167 466 H ALA 61 H ALA 61 7.275 2.240 9.422 467 HA ALA 61 HA ALA 61 5.255 3.710 11.027 468 HB1 ALA 61 HB1 ALA 61 4.721 2.362 8.348 469 HB2 ALA 61 HB2 ALA 61 4.824 4.102 8.618 470 HB3 ALA 61 HB3 ALA 61 3.525 3.172 9.367 471 H ALA 62 H ALA 62 4.212 2.476 12.490 472 HA ALA 62 HA ALA 62 4.375 -0.492 12.344 473 HB1 ALA 62 HB1 ALA 62 4.098 1.268 14.814 474 HB2 ALA 62 HB2 ALA 62 5.558 0.413 14.310 475 HB3 ALA 62 HB3 ALA 62 4.129 -0.501 14.807 476 H TYR 63 H TYR 63 2.458 -1.581 12.254 477 HA TYR 63 HA TYR 63 -0.046 -0.435 13.171 478 HB2 TYR 63 HB2 TYR 63 -1.194 -0.609 10.964 479 HB3 TYR 63 HB3 TYR 63 0.054 0.620 10.983 480 HD1 TYR 63 HD1 TYR 63 2.198 0.261 9.716 481 HD2 TYR 63 HD2 TYR 63 -1.035 -2.530 9.448 482 HE1 TYR 63 HE1 TYR 63 3.181 -0.682 7.676 483 HE2 TYR 63 HE2 TYR 63 -0.050 -3.473 7.408 484 HH TYR 63 HH TYR 63 3.139 -2.778 6.405 485 H TYR 64 H TYR 64 -1.921 -1.934 12.612 486 HA TYR 64 HA TYR 64 -1.323 -4.643 11.849 487 HB2 TYR 64 HB2 TYR 64 -2.230 -5.697 13.945 488 HB3 TYR 64 HB3 TYR 64 -0.691 -4.884 14.168 489 HD1 TYR 64 HD1 TYR 64 -4.292 -4.799 14.985 490 HD2 TYR 64 HD2 TYR 64 -0.511 -2.891 15.622 491 HE1 TYR 64 HE1 TYR 64 -5.216 -3.626 16.922 492 HE2 TYR 64 HE2 TYR 64 -1.448 -1.708 17.564 493 HH TYR 64 HH TYR 64 -3.571 -1.034 18.467 494 H MET 65 H MET 65 -3.073 -5.591 10.896 495 HA MET 65 HA MET 65 -5.633 -4.159 10.820 496 HB2 MET 65 HB2 MET 65 -4.742 -6.667 9.329 497 HB3 MET 65 HB3 MET 65 -6.251 -5.801 9.065 498 HG2 MET 65 HG2 MET 65 -4.976 -3.833 8.288 499 HG3 MET 65 HG3 MET 65 -3.469 -4.721 8.529 500 HE1 MET 65 HE1 MET 65 -4.451 -7.710 7.513 501 HE2 MET 65 HE2 MET 65 -2.880 -6.997 7.140 502 HE3 MET 65 HE3 MET 65 -3.897 -7.621 5.842 503 H THR 66 H THR 66 -6.917 -4.564 12.554 504 HA THR 66 HA THR 66 -6.886 -7.021 14.053 505 HB THR 66 HB THR 66 -8.858 -4.692 14.191 506 HG1 THR 66 HG1 THR 66 -7.495 -3.854 15.692 507 HG21 THR 66 HG21 THR 66 -9.392 -5.514 16.450 508 HG22 THR 66 HG22 THR 66 -8.298 -6.878 16.232 509 HG23 THR 66 HG23 THR 66 -9.762 -6.760 15.252 510 H GLY 67 H GLY 67 -7.658 -8.830 13.117 511 HA2 GLY 67 HA2 GLY 67 -9.337 -8.977 10.873 512 HA3 GLY 67 HA3 GLY 67 -8.903 -10.320 11.908 513 HA PRO 68 HA PRO 68 -13.613 -8.962 11.906 514 HB2 PRO 68 HB2 PRO 68 -14.537 -11.483 10.991 515 HB3 PRO 68 HB3 PRO 68 -14.342 -10.032 10.001 516 HG2 PRO 68 HG2 PRO 68 -12.456 -12.354 10.363 517 HG3 PRO 68 HG3 PRO 68 -12.861 -11.460 8.881 518 HD2 PRO 68 HD2 PRO 68 -10.551 -11.010 10.143 519 HD3 PRO 68 HD3 PRO 68 -11.461 -9.650 9.447 520 H ASP 69 H ASP 69 -12.314 -12.194 12.694 521 HA ASP 69 HA ASP 69 -13.984 -12.592 15.013 522 HB2 ASP 69 HB2 ASP 69 -12.678 -14.645 15.335 523 HB3 ASP 69 HB3 ASP 69 -13.104 -14.480 13.634 524 H GLY 70 H GLY 70 -10.782 -11.292 14.403 525 HA2 GLY 70 HA2 GLY 70 -9.994 -9.722 16.237 526 HA3 GLY 70 HA3 GLY 70 -10.139 -11.116 17.301 527 H THR 71 H THR 71 -9.050 -11.960 14.126 528 HA THR 71 HA THR 71 -6.425 -12.684 15.016 529 HB THR 71 HB THR 71 -7.420 -12.492 12.127 530 HG1 THR 71 HG1 THR 71 -8.545 -13.975 13.605 531 HG21 THR 71 HG21 THR 71 -5.596 -14.086 11.605 532 HG22 THR 71 HG22 THR 71 -5.036 -14.009 13.278 533 HG23 THR 71 HG23 THR 71 -4.942 -12.578 12.249 534 H LYS 72 H LYS 72 -5.311 -10.933 15.767 535 HA LYS 72 HA LYS 72 -5.078 -8.417 14.397 536 HB2 LYS 72 HB2 LYS 72 -5.006 -8.686 16.880 537 HB3 LYS 72 HB3 LYS 72 -3.482 -9.557 16.734 538 HG2 LYS 72 HG2 LYS 72 -2.416 -7.537 15.810 539 HG3 LYS 72 HG3 LYS 72 -3.943 -6.669 15.936 540 HD2 LYS 72 HD2 LYS 72 -2.462 -7.879 18.306 541 HD3 LYS 72 HD3 LYS 72 -2.313 -6.193 17.803 542 HE2 LYS 72 HE2 LYS 72 -4.733 -5.853 18.224 543 HE3 LYS 72 HE3 LYS 72 -4.886 -7.543 18.704 544 HZ1 LYS 72 HZ1 LYS 72 -3.401 -7.134 20.541 545 HZ2 LYS 72 HZ2 LYS 72 -4.711 -6.067 20.600 546 HZ3 LYS 72 HZ3 LYS 72 -3.200 -5.524 20.068 547 H ALA 73 H ALA 73 -4.086 -8.528 12.416 548 HA ALA 73 HA ALA 73 -1.618 -10.115 12.034 549 HB1 ALA 73 HB1 ALA 73 -3.374 -8.735 9.970 550 HB2 ALA 73 HB2 ALA 73 -3.419 -10.449 10.389 551 HB3 ALA 73 HB3 ALA 73 -1.980 -9.765 9.628 552 H ARG 74 H ARG 74 0.138 -8.991 12.666 553 HA ARG 74 HA ARG 74 0.194 -6.088 12.666 554 HB2 ARG 74 HB2 ARG 74 1.049 -7.735 14.511 555 HB3 ARG 74 HB3 ARG 74 2.493 -7.880 13.519 556 HG2 ARG 74 HG2 ARG 74 2.988 -5.509 13.810 557 HG3 ARG 74 HG3 ARG 74 1.443 -5.243 14.617 558 HD2 ARG 74 HD2 ARG 74 2.205 -6.824 16.425 559 HD3 ARG 74 HD3 ARG 74 3.788 -6.858 15.651 560 HE ARG 74 HE ARG 74 3.745 -4.334 16.028 561 HH11 ARG 74 HH11 ARG 74 2.247 -6.570 18.206 562 HH12 ARG 74 HH12 ARG 74 2.403 -5.511 19.562 563 HH21 ARG 74 HH21 ARG 74 3.957 -3.016 17.775 564 HH22 ARG 74 HH22 ARG 74 3.368 -3.520 19.319 565 H GLY 75 H GLY 75 1.621 -4.757 11.500 566 HA2 GLY 75 HA2 GLY 75 3.495 -5.923 9.543 567 HA3 GLY 75 HA3 GLY 75 2.179 -4.920 8.934 568 H TRP 76 H TRP 76 4.794 -4.254 8.415 569 HA TRP 76 HA TRP 76 5.145 -1.704 9.860 570 HB2 TRP 76 HB2 TRP 76 7.601 -2.103 10.040 571 HB3 TRP 76 HB3 TRP 76 6.684 -3.311 10.936 572 HD1 TRP 76 HD1 TRP 76 6.622 -5.829 9.891 573 HE1 TRP 76 HE1 TRP 76 8.203 -7.047 8.289 574 HE3 TRP 76 HE3 TRP 76 9.213 -1.800 8.101 575 HZ2 TRP 76 HZ2 TRP 76 10.286 -6.406 6.507 576 HZ3 TRP 76 HZ3 TRP 76 11.001 -2.187 6.450 577 HH2 TRP 76 HH2 TRP 76 11.528 -4.444 5.672 578 H TRP 77 H TRP 77 6.296 -0.094 8.688 579 HA TRP 77 HA TRP 77 7.063 -0.607 5.865 580 HB2 TRP 77 HB2 TRP 77 5.744 1.870 7.047 581 HB3 TRP 77 HB3 TRP 77 6.563 1.891 5.495 582 HD1 TRP 77 HD1 TRP 77 4.777 -1.268 5.339 583 HE1 TRP 77 HE1 TRP 77 2.504 -0.982 4.170 584 HE3 TRP 77 HE3 TRP 77 4.392 3.799 5.572 585 HZ2 TRP 77 HZ2 TRP 77 0.791 1.152 3.429 586 HZ3 TRP 77 HZ3 TRP 77 2.422 4.898 4.597 587 HH2 TRP 77 HH2 TRP 77 0.653 3.592 3.545 588 H GLN 78 H GLN 78 8.878 0.724 5.091 589 HA GLN 78 HA GLN 78 10.105 2.616 6.972 590 HB2 GLN 78 HB2 GLN 78 11.455 0.572 7.288 591 HB3 GLN 78 HB3 GLN 78 11.738 0.463 5.551 592 HG2 GLN 78 HG2 GLN 78 12.949 2.640 5.630 593 HG3 GLN 78 HG3 GLN 78 12.686 2.707 7.372 594 HE21 GLN 78 HE21 GLN 78 14.935 2.825 7.679 595 HE22 GLN 78 HE22 GLN 78 15.955 1.452 7.506 596 H PHE 79 H PHE 79 9.850 4.460 5.888 597 HA PHE 79 HA PHE 79 9.577 4.722 3.078 598 HB2 PHE 79 HB2 PHE 79 10.034 6.867 5.186 599 HB3 PHE 79 HB3 PHE 79 9.499 7.159 3.536 600 HD1 PHE 79 HD2 PHE 79 7.221 6.367 2.801 601 HD2 PHE 79 HD1 PHE 79 8.467 6.183 6.887 602 HE1 PHE 79 HE2 PHE 79 4.878 6.161 3.512 603 HE2 PHE 79 HE1 PHE 79 6.124 5.970 7.589 604 HZ PHE 79 HZ PHE 79 4.331 5.966 5.907 605 H THR 80 H THR 80 11.016 5.237 1.504 606 HA THR 80 HA THR 80 13.839 5.817 2.229 607 HB THR 80 HB THR 80 14.480 4.880 0.036 608 HG1 THR 80 HG1 THR 80 13.048 4.364 -1.461 609 HG21 THR 80 HG21 THR 80 12.608 3.020 1.529 610 HG22 THR 80 HG22 THR 80 14.313 3.287 1.908 611 HG23 THR 80 HG23 THR 80 13.852 2.518 0.382 612 H THR 81 H THR 81 11.684 6.497 -0.585 613 HA THR 81 HA THR 81 12.875 9.219 -0.777 614 HB THR 81 HB THR 81 11.683 7.584 -3.063 615 HG1 THR 81 HG1 THR 81 13.666 6.934 -3.533 616 HG21 THR 81 HG21 THR 81 11.526 9.999 -3.480 617 HG22 THR 81 HG22 THR 81 12.764 9.288 -4.519 618 HG23 THR 81 HG23 THR 81 13.235 10.198 -3.079 619 H ILE 82 H ILE 82 11.426 10.526 0.237 620 HA ILE 82 HA ILE 82 8.631 10.607 -0.785 621 HB ILE 82 HB ILE 82 9.691 11.744 1.845 622 HG12 ILE 82 HG12 ILE 82 7.987 9.273 1.303 623 HG13 ILE 82 HG13 ILE 82 9.625 9.291 1.946 624 HG21 ILE 82 HG21 ILE 82 7.828 13.086 0.930 625 HG22 ILE 82 HG22 ILE 82 7.320 12.219 2.377 626 HG23 ILE 82 HG23 ILE 82 6.833 11.631 0.788 627 HD11 ILE 82 HD11 ILE 82 8.765 10.416 3.975 628 HD12 ILE 82 HD12 ILE 82 8.055 8.829 3.690 629 HD13 ILE 82 HD13 ILE 82 7.130 10.280 3.319 630 H GLU 83 H GLU 83 8.653 12.039 -2.458 631 HA GLU 83 HA GLU 83 10.132 14.592 -2.181 632 HB2 GLU 83 HB2 GLU 83 8.987 13.279 -4.676 633 HB3 GLU 83 HB3 GLU 83 9.826 14.830 -4.637 634 HG2 GLU 83 HG2 GLU 83 11.817 13.546 -3.647 635 HG3 GLU 83 HG3 GLU 83 10.965 12.076 -4.112 636 H ALA 84 H ALA 84 6.912 13.303 -2.894 637 HA ALA 84 HA ALA 84 4.823 14.129 -2.830 638 HB1 ALA 84 HB1 ALA 84 4.282 16.074 -1.425 639 HB2 ALA 84 HB2 ALA 84 5.992 16.514 -1.358 640 HB3 ALA 84 HB3 ALA 84 5.439 15.014 -0.613 641 HA PRO 85 HA PRO 85 2.876 15.156 -2.919 642 HB2 PRO 85 HB2 PRO 85 0.747 15.995 -4.251 643 HB3 PRO 85 HB3 PRO 85 1.781 17.194 -3.453 644 HG2 PRO 85 HG2 PRO 85 1.734 16.384 -6.372 645 HG3 PRO 85 HG3 PRO 85 1.755 18.018 -5.682 646 HD2 PRO 85 HD2 PRO 85 4.033 16.641 -6.550 647 HD3 PRO 85 HD3 PRO 85 4.057 17.986 -5.387 648 H ASP 86 H ASP 86 4.369 13.807 -5.322 649 HA ASP 86 HA ASP 86 2.233 11.937 -6.166 650 HB2 ASP 86 HB2 ASP 86 3.194 11.921 -8.436 651 HB3 ASP 86 HB3 ASP 86 2.655 13.527 -7.972 652 H HIS 87 H HIS 87 5.802 12.313 -5.887 653 HA HIS 87 HA HIS 87 6.227 9.446 -6.240 654 HB2 HIS 87 HB2 HIS 87 7.765 11.212 -7.207 655 HB3 HIS 87 HB3 HIS 87 8.306 11.578 -5.575 656 HD1 HIS 87 HD1 HIS 87 10.448 10.773 -7.432 657 HD2 HIS 87 HD2 HIS 87 8.280 7.898 -5.347 658 HE1 HIS 87 HE1 HIS 87 11.921 8.756 -7.358 659 HE2 HIS 87 HE2 HIS 87 10.620 7.052 -6.063 660 H LEU 88 H LEU 88 5.807 8.164 -4.596 661 HA LEU 88 HA LEU 88 7.085 8.625 -1.957 662 HB2 LEU 88 HB2 LEU 88 4.644 8.745 -1.718 663 HB3 LEU 88 HB3 LEU 88 4.443 7.228 -2.569 664 HG LEU 88 HG LEU 88 5.496 6.013 -0.684 665 HD11 LEU 88 HD11 LEU 88 7.043 7.716 0.127 666 HD12 LEU 88 HD12 LEU 88 6.014 7.143 1.436 667 HD13 LEU 88 HD13 LEU 88 5.694 8.710 0.689 668 HD21 LEU 88 HD21 LEU 88 3.067 6.306 -0.669 669 HD22 LEU 88 HD22 LEU 88 3.234 7.831 0.209 670 HD23 LEU 88 HD23 LEU 88 3.708 6.311 0.974 671 H GLU 89 H GLU 89 8.516 7.041 -1.389 672 HA GLU 89 HA GLU 89 8.145 4.292 -2.416 673 HB2 GLU 89 HB2 GLU 89 10.815 5.760 -2.178 674 HB3 GLU 89 HB3 GLU 89 10.653 4.021 -2.428 675 HG2 GLU 89 HG2 GLU 89 9.422 4.530 -4.565 676 HG3 GLU 89 HG3 GLU 89 9.832 6.229 -4.327 677 H PHE 90 H PHE 90 8.416 2.719 -0.923 678 HA PHE 90 HA PHE 90 9.878 3.091 1.536 679 HB2 PHE 90 HB2 PHE 90 7.962 2.455 3.040 680 HB3 PHE 90 HB3 PHE 90 7.776 4.039 2.307 681 HD1 PHE 90 HD2 PHE 90 6.501 0.551 2.331 682 HD2 PHE 90 HD1 PHE 90 5.945 4.501 0.775 683 HE1 PHE 90 HE2 PHE 90 4.240 -0.048 1.561 684 HE2 PHE 90 HE1 PHE 90 3.695 3.882 0.012 685 HZ PHE 90 HZ PHE 90 2.840 1.609 0.403 686 H ASP 91 H ASP 91 9.673 1.035 2.908 687 HA ASP 91 HA ASP 91 9.533 -1.372 1.195 688 HB2 ASP 91 HB2 ASP 91 11.207 -0.819 3.679 689 HB3 ASP 91 HB3 ASP 91 11.048 -2.412 2.934 690 H ASP 92 H ASP 92 7.473 -1.956 1.477 691 HA ASP 92 HA ASP 92 6.178 -2.073 4.055 692 HB2 ASP 92 HB2 ASP 92 4.260 -3.048 2.777 693 HB3 ASP 92 HB3 ASP 92 4.789 -1.489 2.174 694 H GLY 93 H GLY 93 5.366 -4.010 5.025 695 HA2 GLY 93 HA2 GLY 93 5.980 -6.647 4.205 696 HA3 GLY 93 HA3 GLY 93 7.223 -6.097 5.327 697 H PHE 94 H PHE 94 5.900 -8.212 6.115 698 HA PHE 94 HA PHE 94 3.776 -7.351 7.986 699 HB2 PHE 94 HB2 PHE 94 4.569 -10.113 6.974 700 HB3 PHE 94 HB3 PHE 94 3.436 -9.868 8.299 701 HD1 PHE 94 HD1 PHE 94 3.964 -9.364 4.660 702 HD2 PHE 94 HD2 PHE 94 1.163 -9.166 7.890 703 HE1 PHE 94 HE1 PHE 94 2.121 -9.114 3.058 704 HE2 PHE 94 HE2 PHE 94 -0.673 -8.914 6.276 705 HZ PHE 94 HZ PHE 94 -0.197 -8.885 3.858 706 H ALA 95 H ALA 95 4.006 -7.542 10.122 707 HA ALA 95 HA ALA 95 6.608 -8.380 11.272 708 HB1 ALA 95 HB1 ALA 95 4.507 -6.485 12.405 709 HB2 ALA 95 HB2 ALA 95 6.024 -6.004 11.639 710 HB3 ALA 95 HB3 ALA 95 6.052 -6.899 13.159 711 H ASP 96 H ASP 96 6.566 -9.588 13.203 712 HA ASP 96 HA ASP 96 4.531 -11.592 13.507 713 HB2 ASP 96 HB2 ASP 96 6.916 -12.034 13.954 714 HB3 ASP 96 HB3 ASP 96 6.947 -10.804 15.213 715 H GLU 97 H GLU 97 3.482 -11.942 15.792 716 HA GLU 97 HA GLU 97 1.783 -9.857 16.478 717 HB2 GLU 97 HB2 GLU 97 1.176 -11.161 18.480 718 HB3 GLU 97 HB3 GLU 97 1.299 -12.185 17.057 719 HG2 GLU 97 HG2 GLU 97 3.453 -13.048 17.802 720 HG3 GLU 97 HG3 GLU 97 3.475 -11.923 19.155 721 H HIS 98 H HIS 98 5.052 -10.351 17.575 722 HA HIS 98 HA HIS 98 4.817 -8.305 19.689 723 HB2 HIS 98 HB2 HIS 98 7.212 -10.048 18.965 724 HB3 HIS 98 HB3 HIS 98 7.047 -9.053 20.405 725 HD1 HIS 98 HD1 HIS 98 4.893 -9.839 21.979 726 HD2 HIS 98 HD2 HIS 98 6.479 -12.621 19.336 727 HE1 HIS 98 HE1 HIS 98 4.035 -12.067 22.748 728 HE2 HIS 98 HE2 HIS 98 4.866 -13.698 21.048 729 H GLY 99 H GLY 99 5.882 -8.575 16.408 730 HA2 GLY 99 HA2 GLY 99 6.143 -6.372 15.293 731 HA3 GLY 99 HA3 GLY 99 7.247 -5.924 16.575 732 H ALA 100 H ALA 100 7.972 -9.105 15.837 733 HA ALA 100 HA ALA 100 10.452 -8.414 14.560 734 HB1 ALA 100 HB1 ALA 100 10.286 -10.294 16.130 735 HB2 ALA 100 HB2 ALA 100 10.909 -10.827 14.570 736 HB3 ALA 100 HB3 ALA 100 9.229 -11.158 15.010 737 HA PRO 101 HA PRO 101 8.797 -8.299 10.304 738 HB2 PRO 101 HB2 PRO 101 11.269 -8.420 8.987 739 HB3 PRO 101 HB3 PRO 101 10.510 -6.945 9.593 740 HG2 PRO 101 HG2 PRO 101 12.630 -8.654 10.883 741 HG3 PRO 101 HG3 PRO 101 12.519 -6.885 10.804 742 HD2 PRO 101 HD2 PRO 101 11.846 -8.203 13.050 743 HD3 PRO 101 HD3 PRO 101 10.912 -6.779 12.526 744 H VAL 102 H VAL 102 7.770 -10.095 9.697 745 HA VAL 102 HA VAL 102 8.525 -12.746 10.116 746 HB VAL 102 HB VAL 102 6.469 -11.655 8.139 747 HG11 VAL 102 HG11 VAL 102 5.368 -13.879 8.275 748 HG12 VAL 102 HG12 VAL 102 6.696 -14.480 9.273 749 HG13 VAL 102 HG13 VAL 102 6.992 -14.011 7.597 750 HG21 VAL 102 HG21 VAL 102 4.814 -12.065 9.927 751 HG22 VAL 102 HG22 VAL 102 6.056 -10.930 10.461 752 HG23 VAL 102 HG23 VAL 102 6.105 -12.608 11.007 753 H ASP 103 H ASP 103 10.193 -13.752 9.232 754 HA ASP 103 HA ASP 103 11.525 -13.087 6.812 755 HB2 ASP 103 HB2 ASP 103 12.657 -14.090 8.775 756 HB3 ASP 103 HB3 ASP 103 11.720 -15.569 8.574 757 H GLU 104 H GLU 104 9.117 -15.495 7.647 758 HA GLU 104 HA GLU 104 9.003 -17.117 5.387 759 HB2 GLU 104 HB2 GLU 104 7.768 -17.551 7.478 760 HB3 GLU 104 HB3 GLU 104 6.764 -16.137 7.204 761 HG2 GLU 104 HG2 GLU 104 5.530 -18.155 6.702 762 HG3 GLU 104 HG3 GLU 104 5.765 -17.198 5.238 763 H LEU 105 H LEU 105 7.491 -13.935 5.933 764 HA LEU 105 HA LEU 105 6.335 -13.910 3.217 765 HB2 LEU 105 HB2 LEU 105 5.850 -12.094 5.605 766 HB3 LEU 105 HB3 LEU 105 5.041 -11.938 4.050 767 HG LEU 105 HG LEU 105 4.794 -14.291 5.975 768 HD11 LEU 105 HD11 LEU 105 2.454 -13.607 6.218 769 HD12 LEU 105 HD12 LEU 105 2.743 -12.207 5.179 770 HD13 LEU 105 HD13 LEU 105 3.559 -12.336 6.739 771 HD21 LEU 105 HD21 LEU 105 4.714 -15.112 3.681 772 HD22 LEU 105 HD22 LEU 105 3.488 -13.913 3.260 773 HD23 LEU 105 HD23 LEU 105 3.111 -15.199 4.410 774 H GLY 106 H GLY 106 9.049 -12.726 4.886 775 HA2 GLY 106 HA2 GLY 106 10.912 -11.671 4.088 776 HA3 GLY 106 HA3 GLY 106 10.187 -11.718 2.493 777 H VAL 107 H VAL 107 11.319 -9.652 2.267 778 HA VAL 107 HA VAL 107 9.743 -7.333 3.280 779 HB VAL 107 HB VAL 107 12.684 -7.302 2.432 780 HG11 VAL 107 HG11 VAL 107 11.000 -5.103 3.715 781 HG12 VAL 107 HG12 VAL 107 11.555 -5.133 2.040 782 HG13 VAL 107 HG13 VAL 107 12.726 -4.993 3.352 783 HG21 VAL 107 HG21 VAL 107 13.243 -6.990 4.827 784 HG22 VAL 107 HG22 VAL 107 12.435 -8.536 4.557 785 HG23 VAL 107 HG23 VAL 107 11.539 -7.183 5.252 786 H THR 108 H THR 108 9.004 -5.885 1.754 787 HA THR 108 HA THR 108 9.784 -6.167 -1.085 788 HB THR 108 HB THR 108 7.763 -7.305 -1.250 789 HG1 THR 108 HG1 THR 108 6.570 -4.767 -1.498 790 HG21 THR 108 HG21 THR 108 6.470 -5.434 0.760 791 HG22 THR 108 HG22 THR 108 6.989 -7.092 1.069 792 HG23 THR 108 HG23 THR 108 5.671 -6.778 -0.061 793 H HIS 109 H HIS 109 9.396 -4.236 -2.375 794 HA HIS 109 HA HIS 109 9.450 -1.736 -0.759 795 HB2 HIS 109 HB2 HIS 109 11.678 -2.486 -1.729 796 HB3 HIS 109 HB3 HIS 109 11.002 -2.271 -3.332 797 HD1 HIS 109 HD1 HIS 109 12.791 -0.497 -0.723 798 HD2 HIS 109 HD2 HIS 109 10.283 0.585 -3.846 799 HE1 HIS 109 HE1 HIS 109 13.252 1.926 -1.151 800 HE2 HIS 109 HE2 HIS 109 11.924 2.465 -3.211 801 H ALA 110 H ALA 110 7.530 -0.762 -1.117 802 HA ALA 110 HA ALA 110 6.167 -0.918 -3.715 803 HB1 ALA 110 HB1 ALA 110 5.208 0.275 -1.098 804 HB2 ALA 110 HB2 ALA 110 4.863 -1.354 -1.677 805 HB3 ALA 110 HB3 ALA 110 4.235 0.043 -2.556 806 H THR 111 H THR 111 6.131 0.717 -5.165 807 HA THR 111 HA THR 111 7.049 3.437 -4.371 808 HB THR 111 HB THR 111 6.967 2.376 -7.257 809 HG1 THR 111 HG1 THR 111 9.353 2.657 -5.730 810 HG21 THR 111 HG21 THR 111 8.425 4.743 -6.025 811 HG22 THR 111 HG22 THR 111 6.979 4.837 -7.029 812 HG23 THR 111 HG23 THR 111 8.492 4.250 -7.718 813 H VAL 112 H VAL 112 5.259 4.648 -3.963 814 HA VAL 112 HA VAL 112 2.743 4.245 -5.462 815 HB VAL 112 HB VAL 112 3.318 5.991 -3.016 816 HG11 VAL 112 HG11 VAL 112 1.435 6.893 -4.339 817 HG12 VAL 112 HG12 VAL 112 0.852 6.214 -2.819 818 HG13 VAL 112 HG13 VAL 112 0.645 5.311 -4.321 819 HG21 VAL 112 HG21 VAL 112 3.514 3.587 -2.477 820 HG22 VAL 112 HG22 VAL 112 1.918 3.286 -3.173 821 HG23 VAL 112 HG23 VAL 112 2.073 4.278 -1.721 822 H LYS 113 H LYS 113 2.435 5.483 -7.224 823 HA LYS 113 HA LYS 113 3.735 8.142 -7.461 824 HB2 LYS 113 HB2 LYS 113 3.499 5.946 -9.571 825 HB3 LYS 113 HB3 LYS 113 4.128 7.568 -9.876 826 HG2 LYS 113 HG2 LYS 113 6.011 7.190 -8.391 827 HG3 LYS 113 HG3 LYS 113 5.334 5.656 -7.847 828 HD2 LYS 113 HD2 LYS 113 7.175 5.285 -9.418 829 HD3 LYS 113 HD3 LYS 113 5.652 4.706 -10.088 830 HE2 LYS 113 HE2 LYS 113 5.475 6.699 -11.473 831 HE3 LYS 113 HE3 LYS 113 6.943 7.364 -10.761 832 HZ1 LYS 113 HZ1 LYS 113 7.368 6.379 -12.907 833 HZ2 LYS 113 HZ2 LYS 113 6.760 4.892 -12.383 834 HZ3 LYS 113 HZ3 LYS 113 8.172 5.513 -11.696 835 H LEU 114 H LEU 114 2.315 9.729 -7.803 836 HA LEU 114 HA LEU 114 -0.431 9.116 -8.704 837 HB2 LEU 114 HB2 LEU 114 0.644 11.568 -7.260 838 HB3 LEU 114 HB3 LEU 114 -1.042 11.276 -7.673 839 HG LEU 114 HG LEU 114 0.603 9.602 -5.718 840 HD11 LEU 114 HD11 LEU 114 -0.851 10.579 -3.979 841 HD12 LEU 114 HD12 LEU 114 -1.599 11.627 -5.189 842 HD13 LEU 114 HD13 LEU 114 0.112 11.806 -4.799 843 HD21 LEU 114 HD21 LEU 114 -2.339 9.421 -6.447 844 HD22 LEU 114 HD22 LEU 114 -1.534 8.512 -5.164 845 HD23 LEU 114 HD23 LEU 114 -1.083 8.244 -6.846 846 H GLU 115 H GLU 115 -0.941 9.591 -10.759 847 HA GLU 115 HA GLU 115 0.497 11.685 -12.249 848 HB2 GLU 115 HB2 GLU 115 -1.249 9.386 -13.215 849 HB3 GLU 115 HB3 GLU 115 -0.604 10.634 -14.269 850 HG2 GLU 115 HG2 GLU 115 0.830 8.779 -14.539 851 HG3 GLU 115 HG3 GLU 115 1.709 9.944 -13.546 852 HA PRO 116 HA PRO 116 -3.224 14.249 -11.687 853 HB2 PRO 116 HB2 PRO 116 -2.436 16.353 -13.286 854 HB3 PRO 116 HB3 PRO 116 -1.838 16.101 -11.642 855 HG2 PRO 116 HG2 PRO 116 -0.530 15.388 -14.263 856 HG3 PRO 116 HG3 PRO 116 0.191 16.121 -12.816 857 HD2 PRO 116 HD2 PRO 116 0.456 13.473 -13.382 858 HD3 PRO 116 HD3 PRO 116 0.382 14.068 -11.714 859 H LEU 117 H LEU 117 -5.023 13.493 -12.674 860 HA LEU 117 HA LEU 117 -5.224 13.475 -15.647 861 HB2 LEU 117 HB2 LEU 117 -7.125 12.194 -13.651 862 HB3 LEU 117 HB3 LEU 117 -7.126 11.973 -15.391 863 HG LEU 117 HG LEU 117 -5.064 10.922 -13.415 864 HD11 LEU 117 HD11 LEU 117 -7.054 9.437 -15.164 865 HD12 LEU 117 HD12 LEU 117 -7.178 9.679 -13.419 866 HD13 LEU 117 HD13 LEU 117 -5.864 8.708 -14.077 867 HD21 LEU 117 HD21 LEU 117 -3.980 9.809 -15.327 868 HD22 LEU 117 HD22 LEU 117 -3.907 11.564 -15.468 869 HD23 LEU 117 HD23 LEU 117 -5.067 10.651 -16.439 870 H GLU 118 H GLU 118 -5.356 15.910 -14.061 871 HA GLU 118 HA GLU 118 -6.488 17.854 -13.811 872 HB2 GLU 118 HB2 GLU 118 -8.271 16.651 -15.965 873 HB3 GLU 118 HB3 GLU 118 -8.432 18.305 -15.390 874 HG2 GLU 118 HG2 GLU 118 -6.159 18.817 -16.175 875 HG3 GLU 118 HG3 GLU 118 -5.956 17.150 -16.714 876 H ASN 119 H ASN 119 -9.475 16.108 -14.530 877 HA ASN 119 HA ASN 119 -10.785 16.953 -12.125 878 HB2 ASN 119 HB2 ASN 119 -11.981 16.888 -14.241 879 HB3 ASN 119 HB3 ASN 119 -11.585 15.194 -14.480 880 HD21 ASN 119 HD21 ASN 119 -12.753 13.645 -13.413 881 HD22 ASN 119 HD22 ASN 119 -14.213 13.976 -12.554 882 H ARG 120 H ARG 120 -9.468 13.899 -13.372 883 HA ARG 120 HA ARG 120 -9.974 12.563 -10.760 884 HB2 ARG 120 HB2 ARG 120 -9.166 11.283 -13.416 885 HB3 ARG 120 HB3 ARG 120 -9.533 10.432 -11.915 886 HG2 ARG 120 HG2 ARG 120 -11.881 11.394 -12.062 887 HG3 ARG 120 HG3 ARG 120 -11.461 11.982 -13.676 888 HD2 ARG 120 HD2 ARG 120 -11.517 9.090 -12.745 889 HD3 ARG 120 HD3 ARG 120 -12.659 9.856 -13.849 890 HE ARG 120 HE ARG 120 -9.922 8.982 -14.428 891 HH11 ARG 120 HH11 ARG 120 -12.742 10.574 -15.678 892 HH12 ARG 120 HH12 ARG 120 -12.292 10.274 -17.316 893 HH21 ARG 120 HH21 ARG 120 -9.383 8.631 -16.500 894 HH22 ARG 120 HH22 ARG 120 -10.397 9.198 -17.780 895 H THR 121 H THR 121 -8.084 10.813 -10.389 896 HA THR 121 HA THR 121 -5.431 11.681 -11.279 897 HB THR 121 HB THR 121 -6.128 11.489 -8.306 898 HG1 THR 121 HG1 THR 121 -6.535 13.517 -9.367 899 HG21 THR 121 HG21 THR 121 -3.912 10.434 -8.659 900 HG22 THR 121 HG22 THR 121 -3.738 11.988 -7.840 901 HG23 THR 121 HG23 THR 121 -3.370 11.852 -9.563 902 H ARG 122 H ARG 122 -3.910 10.043 -11.272 903 HA ARG 122 HA ARG 122 -4.946 7.282 -11.113 904 HB2 ARG 122 HB2 ARG 122 -4.156 8.030 -13.339 905 HB3 ARG 122 HB3 ARG 122 -2.615 8.517 -12.652 906 HG2 ARG 122 HG2 ARG 122 -2.180 6.473 -13.736 907 HG3 ARG 122 HG3 ARG 122 -2.254 6.068 -12.023 908 HD2 ARG 122 HD2 ARG 122 -3.438 4.360 -13.187 909 HD3 ARG 122 HD3 ARG 122 -4.664 5.363 -12.413 910 HE ARG 122 HE ARG 122 -5.396 6.051 -14.487 911 HH11 ARG 122 HH11 ARG 122 -2.392 4.407 -14.992 912 HH12 ARG 122 HH12 ARG 122 -2.695 4.176 -16.677 913 HH21 ARG 122 HH21 ARG 122 -5.740 5.740 -16.627 914 HH22 ARG 122 HH22 ARG 122 -4.546 4.949 -17.593 915 H MET 123 H MET 123 -4.046 5.934 -9.573 916 HA MET 123 HA MET 123 -1.459 6.639 -8.326 917 HB2 MET 123 HB2 MET 123 -3.396 6.682 -6.748 918 HB3 MET 123 HB3 MET 123 -3.730 4.998 -7.119 919 HG2 MET 123 HG2 MET 123 -1.515 4.368 -6.194 920 HG3 MET 123 HG3 MET 123 -1.211 6.063 -5.813 921 HE1 MET 123 HE1 MET 123 -4.442 3.465 -3.804 922 HE2 MET 123 HE2 MET 123 -3.340 2.898 -5.057 923 HE3 MET 123 HE3 MET 123 -4.618 4.048 -5.457 924 H THR 124 H THR 124 0.165 5.297 -8.827 925 HA THR 124 HA THR 124 -0.399 2.476 -9.580 926 HB THR 124 HB THR 124 1.982 4.147 -10.531 927 HG1 THR 124 HG1 THR 124 0.370 5.018 -11.676 928 HG21 THR 124 HG21 THR 124 0.924 1.436 -11.456 929 HG22 THR 124 HG22 THR 124 2.404 1.701 -10.531 930 HG23 THR 124 HG23 THR 124 2.277 2.310 -12.181 931 H ILE 125 H ILE 125 0.147 1.196 -7.890 932 HA ILE 125 HA ILE 125 2.486 1.840 -6.170 933 HB ILE 125 HB ILE 125 0.234 -0.156 -5.617 934 HG12 ILE 125 HG12 ILE 125 0.501 2.658 -4.454 935 HG13 ILE 125 HG13 ILE 125 -0.631 2.215 -5.731 936 HG21 ILE 125 HG21 ILE 125 2.321 -0.658 -4.394 937 HG22 ILE 125 HG22 ILE 125 1.058 -0.133 -3.282 938 HG23 ILE 125 HG23 ILE 125 2.347 0.984 -3.737 939 HD11 ILE 125 HD11 ILE 125 -1.751 0.665 -4.192 940 HD12 ILE 125 HD12 ILE 125 -1.737 2.318 -3.577 941 HD13 ILE 125 HD13 ILE 125 -0.622 1.125 -2.913 942 H ILE 126 H ILE 126 4.314 0.742 -6.861 943 HA ILE 126 HA ILE 126 4.015 -1.997 -7.975 944 HB ILE 126 HB ILE 126 6.532 -0.276 -8.251 945 HG12 ILE 126 HG12 ILE 126 5.655 0.004 -10.742 946 HG13 ILE 126 HG13 ILE 126 4.068 -0.279 -10.042 947 HG21 ILE 126 HG21 ILE 126 7.057 -1.832 -10.107 948 HG22 ILE 126 HG22 ILE 126 5.567 -2.722 -9.784 949 HG23 ILE 126 HG23 ILE 126 6.851 -2.684 -8.571 950 HD11 ILE 126 HD11 ILE 126 4.492 2.077 -10.300 951 HD12 ILE 126 HD12 ILE 126 5.970 1.957 -9.345 952 HD13 ILE 126 HD13 ILE 126 4.401 1.680 -8.583 953 H SER 127 H SER 127 4.158 -3.352 -6.222 954 HA SER 127 HA SER 127 6.184 -2.987 -4.128 955 HB2 SER 127 HB2 SER 127 3.977 -5.081 -4.433 956 HB3 SER 127 HB3 SER 127 5.053 -4.938 -3.039 957 HG SER 127 HG SER 127 3.776 -3.453 -2.304 958 H THR 128 H THR 128 8.194 -3.694 -4.595 959 HA THR 128 HA THR 128 8.652 -5.961 -6.417 960 HB THR 128 HB THR 128 11.031 -5.182 -6.437 961 HG1 THR 128 HG1 THR 128 11.169 -4.196 -4.405 962 HG21 THR 128 HG21 THR 128 10.687 -3.073 -7.671 963 HG22 THR 128 HG22 THR 128 9.041 -2.961 -7.045 964 HG23 THR 128 HG23 THR 128 9.480 -4.275 -8.143 965 H PHE 129 H PHE 129 8.915 -7.893 -5.554 966 HA PHE 129 HA PHE 129 9.568 -8.318 -2.737 967 HB2 PHE 129 HB2 PHE 129 8.769 -10.401 -4.819 968 HB3 PHE 129 HB3 PHE 129 8.687 -10.554 -3.068 969 HD1 PHE 129 HD1 PHE 129 6.965 -9.156 -1.791 970 HD2 PHE 129 HD2 PHE 129 6.940 -9.462 -6.056 971 HE1 PHE 129 HE1 PHE 129 4.632 -8.371 -1.843 972 HE2 PHE 129 HE2 PHE 129 4.616 -8.687 -6.099 973 HZ PHE 129 HZ PHE 129 3.460 -8.124 -3.998 974 H GLU 130 H GLU 130 11.178 -9.891 -2.064 975 HA GLU 130 HA GLU 130 13.672 -9.594 -3.459 976 HB2 GLU 130 HB2 GLU 130 12.939 -11.117 -0.930 977 HB3 GLU 130 HB3 GLU 130 14.591 -10.925 -1.515 978 HG2 GLU 130 HG2 GLU 130 12.749 -8.634 -0.748 979 HG3 GLU 130 HG3 GLU 130 13.972 -9.336 0.308 980 H SER 131 H SER 131 11.369 -12.274 -3.168 981 HA SER 131 HA SER 131 12.970 -13.875 -5.063 982 HB2 SER 131 HB2 SER 131 13.560 -14.684 -2.782 983 HB3 SER 131 HB3 SER 131 11.857 -14.994 -2.454 984 HG SER 131 HG SER 131 12.976 -16.881 -3.108 985 H GLU 132 H GLU 132 11.772 -15.580 -6.136 986 HA GLU 132 HA GLU 132 9.136 -14.922 -6.931 987 HB2 GLU 132 HB2 GLU 132 10.688 -16.258 -8.356 988 HB3 GLU 132 HB3 GLU 132 10.546 -17.612 -7.235 989 HG2 GLU 132 HG2 GLU 132 8.068 -17.666 -7.724 990 HG3 GLU 132 HG3 GLU 132 8.330 -16.423 -8.945 991 H GLU 133 H GLU 133 10.353 -17.446 -4.723 992 HA GLU 133 HA GLU 133 7.963 -18.691 -3.990 993 HB2 GLU 133 HB2 GLU 133 9.165 -19.548 -2.049 994 HB3 GLU 133 HB3 GLU 133 10.259 -19.512 -3.429 995 HG2 GLU 133 HG2 GLU 133 11.155 -17.309 -2.545 996 HG3 GLU 133 HG3 GLU 133 10.193 -17.571 -1.097 997 H GLN 134 H GLN 134 9.434 -15.710 -2.732 998 HA GLN 134 HA GLN 134 7.637 -15.199 -0.598 999 HB2 GLN 134 HB2 GLN 134 9.830 -14.044 -0.832 1000 HB3 GLN 134 HB3 GLN 134 9.246 -13.210 -2.271 1001 HG2 GLN 134 HG2 GLN 134 7.435 -12.178 -0.797 1002 HG3 GLN 134 HG3 GLN 134 8.288 -12.858 0.587 1003 HE21 GLN 134 HE21 GLN 134 7.737 -10.082 -0.029 1004 HE22 GLN 134 HE22 GLN 134 9.265 -9.287 -0.099 1005 H MET 135 H MET 135 7.721 -14.072 -3.999 1006 HA MET 135 HA MET 135 5.490 -12.317 -3.785 1007 HB2 MET 135 HB2 MET 135 6.030 -11.681 -5.921 1008 HB3 MET 135 HB3 MET 135 7.521 -12.503 -5.534 1009 HG2 MET 135 HG2 MET 135 7.100 -13.281 -7.666 1010 HG3 MET 135 HG3 MET 135 6.350 -14.556 -6.705 1011 HE1 MET 135 HE1 MET 135 4.887 -10.891 -7.259 1012 HE2 MET 135 HE2 MET 135 3.922 -11.149 -8.710 1013 HE3 MET 135 HE3 MET 135 5.679 -11.246 -8.797 1014 H GLN 136 H GLN 136 5.738 -15.708 -4.626 1015 HA GLN 136 HA GLN 136 3.003 -16.120 -5.399 1016 HB2 GLN 136 HB2 GLN 136 5.066 -18.091 -4.333 1017 HB3 GLN 136 HB3 GLN 136 3.533 -18.538 -5.076 1018 HG2 GLN 136 HG2 GLN 136 5.820 -17.096 -6.472 1019 HG3 GLN 136 HG3 GLN 136 5.448 -18.812 -6.611 1020 HE21 GLN 136 HE21 GLN 136 4.434 -15.585 -7.483 1021 HE22 GLN 136 HE22 GLN 136 3.330 -16.059 -8.719 1022 H LYS 137 H LYS 137 4.802 -16.371 -2.344 1023 HA LYS 137 HA LYS 137 2.707 -17.474 -0.765 1024 HB2 LYS 137 HB2 LYS 137 5.188 -17.606 -0.275 1025 HB3 LYS 137 HB3 LYS 137 5.140 -15.919 0.212 1026 HG2 LYS 137 HG2 LYS 137 5.113 -17.524 2.121 1027 HG3 LYS 137 HG3 LYS 137 3.721 -16.438 2.106 1028 HD2 LYS 137 HD2 LYS 137 2.277 -18.192 1.246 1029 HD3 LYS 137 HD3 LYS 137 3.649 -19.275 0.994 1030 HE2 LYS 137 HE2 LYS 137 2.834 -18.258 3.736 1031 HE3 LYS 137 HE3 LYS 137 2.208 -19.754 3.040 1032 HZ1 LYS 137 HZ1 LYS 137 4.493 -20.565 2.875 1033 HZ2 LYS 137 HZ2 LYS 137 4.082 -20.194 4.473 1034 HZ3 LYS 137 HZ3 LYS 137 5.061 -19.141 3.585 1035 H MET 138 H MET 138 3.604 -14.161 -1.551 1036 HA MET 138 HA MET 138 1.951 -12.735 0.260 1037 HB2 MET 138 HB2 MET 138 2.712 -11.970 -2.591 1038 HB3 MET 138 HB3 MET 138 2.146 -10.864 -1.347 1039 HG2 MET 138 HG2 MET 138 4.655 -12.431 -0.837 1040 HG3 MET 138 HG3 MET 138 4.713 -11.072 -1.946 1041 HE1 MET 138 HE1 MET 138 3.907 -10.727 2.600 1042 HE2 MET 138 HE2 MET 138 4.348 -12.226 1.780 1043 HE3 MET 138 HE3 MET 138 2.741 -11.533 1.552 1044 H ALA 139 H ALA 139 1.348 -13.966 -3.023 1045 HA ALA 139 HA ALA 139 -1.379 -13.307 -3.284 1046 HB1 ALA 139 HB1 ALA 139 0.033 -14.018 -5.171 1047 HB2 ALA 139 HB2 ALA 139 -1.421 -15.016 -5.060 1048 HB3 ALA 139 HB3 ALA 139 0.130 -15.648 -4.496 1049 H GLU 140 H GLU 140 0.196 -16.171 -1.868 1050 HA GLU 140 HA GLU 140 -2.102 -17.717 -1.321 1051 HB2 GLU 140 HB2 GLU 140 0.605 -17.659 0.065 1052 HB3 GLU 140 HB3 GLU 140 -0.632 -18.871 0.396 1053 HG2 GLU 140 HG2 GLU 140 0.689 -18.413 -2.304 1054 HG3 GLU 140 HG3 GLU 140 1.144 -19.668 -1.153 1055 H MET 141 H MET 141 -0.550 -15.143 0.563 1056 HA MET 141 HA MET 141 -2.274 -15.399 2.876 1057 HB2 MET 141 HB2 MET 141 -0.417 -13.142 2.011 1058 HB3 MET 141 HB3 MET 141 -1.212 -13.243 3.581 1059 HG2 MET 141 HG2 MET 141 0.819 -15.214 2.505 1060 HG3 MET 141 HG3 MET 141 1.134 -13.955 3.695 1061 HE1 MET 141 HE1 MET 141 0.177 -14.015 6.216 1062 HE2 MET 141 HE2 MET 141 -0.967 -15.237 6.773 1063 HE3 MET 141 HE3 MET 141 -1.457 -14.067 5.549 1064 H GLY 142 H GLY 142 -2.766 -14.107 -0.231 1065 HA2 GLY 142 HA2 GLY 142 -4.499 -12.916 -1.166 1066 HA3 GLY 142 HA3 GLY 142 -5.284 -12.879 0.406 1067 H MET 143 H MET 143 -2.038 -11.689 0.169 1068 HA MET 143 HA MET 143 -2.584 -9.108 1.187 1069 HB2 MET 143 HB2 MET 143 -0.408 -10.195 1.495 1070 HB3 MET 143 HB3 MET 143 -0.132 -10.228 -0.239 1071 HG2 MET 143 HG2 MET 143 -0.056 -7.721 -0.214 1072 HG3 MET 143 HG3 MET 143 -0.166 -7.782 1.550 1073 HE1 MET 143 HE1 MET 143 2.237 -6.296 0.006 1074 HE2 MET 143 HE2 MET 143 3.647 -6.870 0.899 1075 HE3 MET 143 HE3 MET 143 2.188 -6.394 1.768 1076 H GLU 144 H GLU 144 -1.888 -10.246 -2.091 1077 HA GLU 144 HA GLU 144 -1.533 -7.781 -3.395 1078 HB2 GLU 144 HB2 GLU 144 -2.430 -10.460 -4.524 1079 HB3 GLU 144 HB3 GLU 144 -1.826 -9.107 -5.478 1080 HG2 GLU 144 HG2 GLU 144 0.342 -9.263 -4.242 1081 HG3 GLU 144 HG3 GLU 144 -0.265 -10.701 -3.416 1082 H GLU 145 H GLU 145 -4.420 -9.922 -3.623 1083 HA GLU 145 HA GLU 145 -6.105 -7.876 -4.767 1084 HB2 GLU 145 HB2 GLU 145 -7.898 -9.568 -4.610 1085 HB3 GLU 145 HB3 GLU 145 -6.438 -10.232 -5.333 1086 HG2 GLU 145 HG2 GLU 145 -5.878 -11.393 -3.269 1087 HG3 GLU 145 HG3 GLU 145 -7.243 -10.649 -2.437 1088 H GLY 146 H GLY 146 -5.335 -8.837 -1.508 1089 HA2 GLY 146 HA2 GLY 146 -7.518 -7.721 -0.088 1090 HA3 GLY 146 HA3 GLY 146 -5.894 -7.958 0.543 1091 H MET 147 H MET 147 -4.419 -6.296 -1.153 1092 HA MET 147 HA MET 147 -4.789 -3.646 -0.283 1093 HB2 MET 147 HB2 MET 147 -3.325 -4.747 -2.710 1094 HB3 MET 147 HB3 MET 147 -3.310 -3.040 -2.304 1095 HG2 MET 147 HG2 MET 147 -2.239 -3.580 -0.141 1096 HG3 MET 147 HG3 MET 147 -2.231 -5.273 -0.602 1097 HE1 MET 147 HE1 MET 147 -0.798 -1.711 -1.393 1098 HE2 MET 147 HE2 MET 147 -1.498 -2.143 -2.954 1099 HE3 MET 147 HE3 MET 147 0.254 -2.036 -2.770 1100 H ARG 148 H ARG 148 -5.790 -5.259 -3.317 1101 HA ARG 148 HA ARG 148 -6.740 -3.073 -4.760 1102 HB2 ARG 148 HB2 ARG 148 -6.396 -5.225 -5.795 1103 HB3 ARG 148 HB3 ARG 148 -7.610 -5.987 -4.773 1104 HG2 ARG 148 HG2 ARG 148 -9.397 -4.792 -5.900 1105 HG3 ARG 148 HG3 ARG 148 -8.231 -3.838 -6.821 1106 HD2 ARG 148 HD2 ARG 148 -7.467 -5.850 -7.985 1107 HD3 ARG 148 HD3 ARG 148 -8.564 -6.848 -7.021 1108 HE ARG 148 HE ARG 148 -10.176 -4.977 -8.220 1109 HH11 ARG 148 HH11 ARG 148 -8.007 -7.392 -9.396 1110 HH12 ARG 148 HH12 ARG 148 -8.906 -7.646 -10.848 1111 HH21 ARG 148 HH21 ARG 148 -11.316 -5.330 -10.085 1112 HH22 ARG 148 HH22 ARG 148 -10.742 -6.482 -11.233 1113 H GLU 149 H GLU 149 -8.606 -5.185 -2.541 1114 HA GLU 149 HA GLU 149 -11.126 -3.949 -2.689 1115 HB2 GLU 149 HB2 GLU 149 -9.772 -5.310 -0.328 1116 HB3 GLU 149 HB3 GLU 149 -11.486 -4.898 -0.375 1117 HG2 GLU 149 HG2 GLU 149 -10.097 -6.806 -2.287 1118 HG3 GLU 149 HG3 GLU 149 -11.018 -7.287 -0.865 1119 H ALA 150 H ALA 150 -8.429 -3.301 -0.482 1120 HA ALA 150 HA ALA 150 -9.587 -1.195 1.004 1121 HB1 ALA 150 HB1 ALA 150 -7.713 -2.515 1.808 1122 HB2 ALA 150 HB2 ALA 150 -7.275 -0.806 1.774 1123 HB3 ALA 150 HB3 ALA 150 -6.681 -1.899 0.514 1124 H ILE 151 H ILE 151 -7.852 -1.235 -2.039 1125 HA ILE 151 HA ILE 151 -7.355 1.611 -2.180 1126 HB ILE 151 HB ILE 151 -6.950 -0.699 -4.120 1127 HG12 ILE 151 HG12 ILE 151 -4.895 1.085 -2.739 1128 HG13 ILE 151 HG13 ILE 151 -5.459 -0.435 -2.059 1129 HG21 ILE 151 HG21 ILE 151 -5.701 0.829 -5.616 1130 HG22 ILE 151 HG22 ILE 151 -6.225 2.204 -4.643 1131 HG23 ILE 151 HG23 ILE 151 -7.415 1.247 -5.527 1132 HD11 ILE 151 HD11 ILE 151 -3.338 -0.757 -3.097 1133 HD12 ILE 151 HD12 ILE 151 -3.915 -0.073 -4.618 1134 HD13 ILE 151 HD13 ILE 151 -4.560 -1.612 -4.035 1135 H GLU 152 H GLU 152 -9.967 -0.515 -3.121 1136 HA GLU 152 HA GLU 152 -11.324 1.555 -4.679 1137 HB2 GLU 152 HB2 GLU 152 -12.339 -1.178 -3.795 1138 HB3 GLU 152 HB3 GLU 152 -13.166 -0.078 -4.906 1139 HG2 GLU 152 HG2 GLU 152 -11.101 -0.193 -6.378 1140 HG3 GLU 152 HG3 GLU 152 -10.521 -1.488 -5.339 1141 H GLN 153 H GLN 153 -11.037 0.736 -1.358 1142 HA GLN 153 HA GLN 153 -13.394 2.034 -0.349 1143 HB2 GLN 153 HB2 GLN 153 -10.656 1.764 0.960 1144 HB3 GLN 153 HB3 GLN 153 -12.152 2.177 1.790 1145 HG2 GLN 153 HG2 GLN 153 -11.761 -0.462 0.362 1146 HG3 GLN 153 HG3 GLN 153 -11.262 -0.214 2.031 1147 HE21 GLN 153 HE21 GLN 153 -12.846 0.142 3.597 1148 HE22 GLN 153 HE22 GLN 153 -14.468 -0.356 3.349 1149 H ILE 154 H ILE 154 -10.294 3.140 -1.566 1150 HA ILE 154 HA ILE 154 -10.096 5.736 -0.506 1151 HB ILE 154 HB ILE 154 -9.159 4.754 -3.236 1152 HG12 ILE 154 HG12 ILE 154 -7.654 4.911 -0.588 1153 HG13 ILE 154 HG13 ILE 154 -8.253 3.430 -1.333 1154 HG21 ILE 154 HG21 ILE 154 -9.175 7.215 -3.181 1155 HG22 ILE 154 HG22 ILE 154 -7.517 6.618 -3.172 1156 HG23 ILE 154 HG23 ILE 154 -8.250 7.207 -1.676 1157 HD11 ILE 154 HD11 ILE 154 -6.727 3.784 -3.225 1158 HD12 ILE 154 HD12 ILE 154 -5.882 3.684 -1.681 1159 HD13 ILE 154 HD13 ILE 154 -6.121 5.250 -2.447 1160 H ASP 155 H ASP 155 -11.932 4.539 -3.315 1161 HA ASP 155 HA ASP 155 -12.853 6.868 -4.495 1162 HB2 ASP 155 HB2 ASP 155 -14.284 4.220 -4.005 1163 HB3 ASP 155 HB3 ASP 155 -14.946 5.497 -5.035 1164 H ALA 156 H ALA 156 -14.319 5.113 -1.729 1165 HA ALA 156 HA ALA 156 -16.323 6.997 -1.081 1166 HB1 ALA 156 HB1 ALA 156 -14.865 5.091 0.788 1167 HB2 ALA 156 HB2 ALA 156 -16.309 4.717 -0.151 1168 HB3 ALA 156 HB3 ALA 156 -16.392 5.918 1.138 1169 H VAL 157 H VAL 157 -12.972 6.680 0.102 1170 HA VAL 157 HA VAL 157 -13.003 8.531 2.204 1171 HB VAL 157 HB VAL 157 -10.652 7.749 0.417 1172 HG11 VAL 157 HG11 VAL 157 -10.077 9.807 1.636 1173 HG12 VAL 157 HG12 VAL 157 -9.176 8.445 2.302 1174 HG13 VAL 157 HG13 VAL 157 -10.583 9.075 3.163 1175 HG21 VAL 157 HG21 VAL 157 -11.682 5.803 1.516 1176 HG22 VAL 157 HG22 VAL 157 -11.558 6.596 3.088 1177 HG23 VAL 157 HG23 VAL 157 -10.095 6.129 2.217 1178 H LEU 158 H LEU 158 -12.253 9.104 -1.218 1179 HA LEU 158 HA LEU 158 -11.655 11.928 -0.800 1180 HB2 LEU 158 HB2 LEU 158 -11.799 10.419 -3.431 1181 HB3 LEU 158 HB3 LEU 158 -11.020 11.970 -3.131 1182 HG LEU 158 HG LEU 158 -10.113 9.236 -2.139 1183 HD11 LEU 158 HD11 LEU 158 -8.118 9.620 -3.457 1184 HD12 LEU 158 HD12 LEU 158 -8.734 11.187 -3.990 1185 HD13 LEU 158 HD13 LEU 158 -9.560 9.700 -4.468 1186 HD21 LEU 158 HD21 LEU 158 -8.907 11.932 -1.438 1187 HD22 LEU 158 HD22 LEU 158 -8.194 10.358 -1.075 1188 HD23 LEU 158 HD23 LEU 158 -9.723 10.819 -0.337 1189 H SER 159 H SER 159 -14.295 9.979 -2.141 1190 HA SER 159 HA SER 159 -15.748 12.148 -3.373 1191 HB2 SER 159 HB2 SER 159 -16.019 9.788 -4.116 1192 HB3 SER 159 HB3 SER 159 -16.722 9.372 -2.557 1193 HG SER 159 HG SER 159 -18.540 9.900 -3.447 1194 H GLU 160 H GLU 160 -15.598 10.832 -0.157 1195 HA GLU 160 HA GLU 160 -18.059 11.968 0.830 1196 HB2 GLU 160 HB2 GLU 160 -15.657 10.723 2.219 1197 HB3 GLU 160 HB3 GLU 160 -17.022 11.388 3.105 1198 HG2 GLU 160 HG2 GLU 160 -18.516 9.754 1.983 1199 HG3 GLU 160 HG3 GLU 160 -17.112 9.051 1.181 1200 HA PRO 161 HA PRO 161 -16.051 15.701 2.754 1201 HB2 PRO 161 HB2 PRO 161 -18.227 16.674 4.025 1202 HB3 PRO 161 HB3 PRO 161 -18.058 16.852 2.270 1203 HG2 PRO 161 HG2 PRO 161 -19.672 14.815 3.826 1204 HG3 PRO 161 HG3 PRO 161 -20.154 15.765 2.403 1205 HD2 PRO 161 HD2 PRO 161 -19.265 13.160 2.265 1206 HD3 PRO 161 HD3 PRO 161 -19.104 14.323 0.932 1207 H ALA 162 H ALA 162 -15.884 12.938 3.692 1208 HA ALA 162 HA ALA 162 -15.373 11.624 5.421 1209 HB1 ALA 162 HB1 ALA 162 -14.047 13.549 6.235 1210 HB2 ALA 162 HB2 ALA 162 -14.688 12.584 7.566 1211 HB3 ALA 162 HB3 ALA 162 -15.448 14.121 7.145 1212 H ASN 163 H ASN 163 -18.283 12.221 4.761 1213 HA ASN 163 HA ASN 163 -19.447 10.687 6.915 1214 HB2 ASN 163 HB2 ASN 163 -21.091 12.340 7.668 1215 HB3 ASN 163 HB3 ASN 163 -19.467 12.935 7.937 1216 HD21 ASN 163 HD21 ASN 163 -22.367 13.300 6.010 1217 HD22 ASN 163 HD22 ASN 163 -21.987 14.867 5.389 1218 H ALA 164 H ALA 164 -19.337 10.901 3.758 1219 HA ALA 164 HA ALA 164 -22.184 11.066 3.073 1220 HB1 ALA 164 HB1 ALA 164 -19.830 10.518 1.242 1221 HB2 ALA 164 HB2 ALA 164 -20.560 12.094 1.538 1222 HB3 ALA 164 HB3 ALA 164 -21.493 10.828 0.740 1223 H LEU 165 H LEU 165 -23.134 9.321 4.020 1224 HA LEU 165 HA LEU 165 -22.177 6.594 3.617 1225 HB2 LEU 165 HB2 LEU 165 -24.657 7.694 4.993 1226 HB3 LEU 165 HB3 LEU 165 -24.212 5.990 4.965 1227 HG LEU 165 HG LEU 165 -22.655 8.240 6.306 1228 HD11 LEU 165 HD11 LEU 165 -24.195 5.928 7.536 1229 HD12 LEU 165 HD12 LEU 165 -24.674 7.627 7.539 1230 HD13 LEU 165 HD13 LEU 165 -23.234 7.123 8.416 1231 HD21 LEU 165 HD21 LEU 165 -21.086 6.601 5.405 1232 HD22 LEU 165 HD22 LEU 165 -21.972 5.281 6.170 1233 HD23 LEU 165 HD23 LEU 165 -21.143 6.482 7.163 1234 H GLU 166 H GLU 166 -22.411 5.956 1.525 1235 HA GLU 166 HA GLU 166 -25.087 5.364 0.548 1236 HB2 GLU 166 HB2 GLU 166 -24.757 7.585 -0.450 1237 HB3 GLU 166 HB3 GLU 166 -23.180 7.117 -1.084 1238 HG2 GLU 166 HG2 GLU 166 -24.290 5.460 -2.570 1239 HG3 GLU 166 HG3 GLU 166 -25.856 5.947 -1.923 1240 H HIS 167 H HIS 167 -25.063 3.352 -0.346 1241 HA HIS 167 HA HIS 167 -22.570 2.007 -1.031 1242 HB2 HIS 167 HB2 HIS 167 -25.438 1.017 -1.382 1243 HB3 HIS 167 HB3 HIS 167 -23.976 0.040 -1.473 1244 HD1 HIS 167 HD1 HIS 167 -22.673 1.253 1.201 1245 HD2 HIS 167 HD2 HIS 167 -26.518 -0.278 0.794 1246 HE1 HIS 167 HE1 HIS 167 -23.360 0.541 3.507 1247 HE2 HIS 167 HE2 HIS 167 -25.607 -0.548 3.196 1248 H HIS 168 H HIS 168 -21.925 3.503 -2.729 1249 HA HIS 168 HA HIS 168 -23.584 3.844 -5.088 1250 HB2 HIS 168 HB2 HIS 168 -22.045 5.662 -4.153 1251 HB3 HIS 168 HB3 HIS 168 -20.680 4.731 -4.753 1252 HD1 HIS 168 HD1 HIS 168 -23.121 7.236 -5.754 1253 HD2 HIS 168 HD2 HIS 168 -20.720 4.475 -7.721 1254 HE1 HIS 168 HE1 HIS 168 -23.097 7.964 -8.150 1255 HE2 HIS 168 HE2 HIS 168 -21.604 6.316 -9.313 1256 H HIS 169 H HIS 169 -23.790 2.102 -6.363 1257 HA HIS 169 HA HIS 169 -21.408 0.563 -7.244 1258 HB2 HIS 169 HB2 HIS 169 -24.394 -0.069 -7.420 1259 HB3 HIS 169 HB3 HIS 169 -23.140 -1.049 -8.178 1260 HD1 HIS 169 HD1 HIS 169 -22.498 -3.004 -6.812 1261 HD2 HIS 169 HD2 HIS 169 -23.811 0.123 -4.422 1262 HE1 HIS 169 HE1 HIS 169 -22.384 -3.868 -4.468 1263 HE2 HIS 169 HE2 HIS 169 -22.956 -1.889 -3.040 1264 H HIS 170 H HIS 170 -20.501 1.705 -8.873 1265 HA HIS 170 HA HIS 170 -21.874 3.477 -10.629 1266 HB2 HIS 170 HB2 HIS 170 -19.569 3.903 -9.985 1267 HB3 HIS 170 HB3 HIS 170 -19.036 2.373 -10.670 1268 HD1 HIS 170 HD1 HIS 170 -20.640 5.612 -11.902 1269 HD2 HIS 170 HD2 HIS 170 -17.998 2.674 -13.183 1270 HE1 HIS 170 HE1 HIS 170 -19.854 6.360 -14.154 1271 HE2 HIS 170 HE2 HIS 170 -18.095 4.693 -14.798 1272 H HIS 171 H HIS 171 -21.060 0.071 -10.933 1273 HA HIS 171 HA HIS 171 -22.534 -0.079 -13.454 1274 HB2 HIS 171 HB2 HIS 171 -20.057 0.272 -14.000 1275 HB3 HIS 171 HB3 HIS 171 -19.755 -1.309 -13.298 1276 HD1 HIS 171 HD1 HIS 171 -19.228 -2.735 -15.271 1277 HD2 HIS 171 HD2 HIS 171 -22.550 -0.343 -15.961 1278 HE1 HIS 171 HE1 HIS 171 -20.064 -3.394 -17.543 1279 HE2 HIS 171 HE2 HIS 171 -22.146 -2.026 -17.881 1280 H HIS 172 H HIS 172 -20.548 -2.126 -11.202 1281 HA HIS 172 HA HIS 172 -22.958 -3.378 -10.218 1282 HB2 HIS 172 HB2 HIS 172 -22.611 -5.664 -10.803 1283 HB3 HIS 172 HB3 HIS 172 -22.432 -4.771 -12.300 1284 HD1 HIS 172 HD1 HIS 172 -20.055 -4.755 -13.393 1285 HD2 HIS 172 HD2 HIS 172 -20.325 -7.050 -9.935 1286 HE1 HIS 172 HE1 HIS 172 -17.994 -6.186 -13.365 1287 HE2 HIS 172 HE2 HIS 172 -18.102 -7.447 -11.197 Start of MODEL 10 1 H1 THR 1 H1 THR 1 -10.563 4.589 -8.765 2 H2 THR 1 H2 THR 1 -10.324 3.999 -7.197 3 H3 THR 1 H3 THR 1 -11.864 4.468 -7.698 4 HA THR 1 HA THR 1 -11.612 2.063 -7.639 5 HB THR 1 HB THR 1 -11.944 3.137 -10.456 6 HG1 THR 1 HG1 THR 1 -14.047 2.795 -8.574 7 HG21 THR 1 HG21 THR 1 -13.543 1.263 -10.755 8 HG22 THR 1 HG22 THR 1 -13.139 0.673 -9.142 9 HG23 THR 1 HG23 THR 1 -11.910 0.681 -10.413 10 H VAL 2 H VAL 2 -10.364 0.294 -8.053 11 HA VAL 2 HA VAL 2 -7.781 0.481 -9.280 12 HB VAL 2 HB VAL 2 -9.371 -2.026 -8.606 13 HG11 VAL 2 HG11 VAL 2 -7.456 -2.500 -10.088 14 HG12 VAL 2 HG12 VAL 2 -7.151 -3.149 -8.477 15 HG13 VAL 2 HG13 VAL 2 -6.364 -1.654 -8.985 16 HG21 VAL 2 HG21 VAL 2 -9.179 -0.613 -6.607 17 HG22 VAL 2 HG22 VAL 2 -7.430 -0.509 -6.823 18 HG23 VAL 2 HG23 VAL 2 -8.179 -2.061 -6.436 19 H VAL 3 H VAL 3 -7.765 0.941 -11.433 20 HA VAL 3 HA VAL 3 -9.863 -0.079 -13.222 21 HB VAL 3 HB VAL 3 -8.925 1.573 -14.868 22 HG11 VAL 3 HG11 VAL 3 -9.628 2.747 -12.141 23 HG12 VAL 3 HG12 VAL 3 -10.783 2.242 -13.380 24 HG13 VAL 3 HG13 VAL 3 -9.707 3.607 -13.685 25 HG21 VAL 3 HG21 VAL 3 -7.096 2.360 -12.570 26 HG22 VAL 3 HG22 VAL 3 -7.246 3.222 -14.107 27 HG23 VAL 3 HG23 VAL 3 -6.583 1.586 -14.073 28 H SER 4 H SER 4 -6.617 -0.878 -12.438 29 HA SER 4 HA SER 4 -6.589 -3.061 -14.331 30 HB2 SER 4 HB2 SER 4 -5.697 -1.322 -15.819 31 HB3 SER 4 HB3 SER 4 -4.506 -0.845 -14.612 32 HG SER 4 HG SER 4 -3.262 -2.417 -15.254 33 H VAL 5 H VAL 5 -5.410 -4.761 -13.528 34 HA VAL 5 HA VAL 5 -3.354 -4.280 -11.433 35 HB VAL 5 HB VAL 5 -5.168 -6.738 -11.615 36 HG11 VAL 5 HG11 VAL 5 -2.924 -7.327 -10.756 37 HG12 VAL 5 HG12 VAL 5 -4.121 -7.437 -9.466 38 HG13 VAL 5 HG13 VAL 5 -3.036 -6.047 -9.543 39 HG21 VAL 5 HG21 VAL 5 -5.179 -4.500 -9.555 40 HG22 VAL 5 HG22 VAL 5 -6.170 -5.959 -9.489 41 HG23 VAL 5 HG23 VAL 5 -6.416 -4.786 -10.784 42 H ASP 6 H ASP 6 -1.558 -4.344 -12.703 43 HA ASP 6 HA ASP 6 -0.996 -6.699 -14.379 44 HB2 ASP 6 HB2 ASP 6 0.578 -4.118 -13.922 45 HB3 ASP 6 HB3 ASP 6 1.079 -5.418 -15.006 46 H LYS 7 H LYS 7 0.374 -8.300 -13.727 47 HA LYS 7 HA LYS 7 2.004 -7.934 -11.282 48 HB2 LYS 7 HB2 LYS 7 -0.114 -9.157 -10.736 49 HB3 LYS 7 HB3 LYS 7 0.332 -10.418 -11.886 50 HG2 LYS 7 HG2 LYS 7 2.305 -10.985 -10.551 51 HG3 LYS 7 HG3 LYS 7 1.983 -9.636 -9.462 52 HD2 LYS 7 HD2 LYS 7 1.262 -11.654 -8.372 53 HD3 LYS 7 HD3 LYS 7 -0.174 -10.730 -8.813 54 HE2 LYS 7 HE2 LYS 7 -0.391 -12.216 -10.852 55 HE3 LYS 7 HE3 LYS 7 0.929 -13.190 -10.210 56 HZ1 LYS 7 HZ1 LYS 7 -0.366 -13.724 -8.305 57 HZ2 LYS 7 HZ2 LYS 7 -1.303 -14.034 -9.676 58 HZ3 LYS 7 HZ3 LYS 7 -1.591 -12.648 -8.754 59 H ASP 8 H ASP 8 4.051 -8.234 -11.776 60 HA ASP 8 HA ASP 8 4.877 -9.965 -14.020 61 HB2 ASP 8 HB2 ASP 8 6.626 -7.961 -12.529 62 HB3 ASP 8 HB3 ASP 8 6.885 -8.649 -14.129 63 H VAL 9 H VAL 9 4.735 -11.967 -12.916 64 HA VAL 9 HA VAL 9 6.023 -12.450 -10.379 65 HB VAL 9 HB VAL 9 5.059 -14.502 -12.418 66 HG11 VAL 9 HG11 VAL 9 5.410 -14.721 -9.411 67 HG12 VAL 9 HG12 VAL 9 6.433 -15.482 -10.633 68 HG13 VAL 9 HG13 VAL 9 4.746 -15.977 -10.458 69 HG21 VAL 9 HG21 VAL 9 3.238 -12.903 -11.941 70 HG22 VAL 9 HG22 VAL 9 3.437 -13.180 -10.208 71 HG23 VAL 9 HG23 VAL 9 2.883 -14.490 -11.252 72 H GLU 10 H GLU 10 6.833 -12.903 -13.771 73 HA GLU 10 HA GLU 10 9.272 -14.364 -13.458 74 HB2 GLU 10 HB2 GLU 10 8.548 -12.599 -15.831 75 HB3 GLU 10 HB3 GLU 10 9.547 -14.051 -15.827 76 HG2 GLU 10 HG2 GLU 10 6.536 -13.916 -15.429 77 HG3 GLU 10 HG3 GLU 10 7.375 -14.471 -16.874 78 H ALA 11 H ALA 11 8.540 -10.942 -14.050 79 HA ALA 11 HA ALA 11 11.327 -10.088 -13.799 80 HB1 ALA 11 HB1 ALA 11 10.486 -7.864 -14.414 81 HB2 ALA 11 HB2 ALA 11 8.822 -8.442 -14.276 82 HB3 ALA 11 HB3 ALA 11 9.882 -9.098 -15.523 83 H LEU 12 H LEU 12 9.170 -10.882 -11.485 84 HA LEU 12 HA LEU 12 8.668 -10.369 -9.341 85 HB2 LEU 12 HB2 LEU 12 11.580 -9.521 -9.404 86 HB3 LEU 12 HB3 LEU 12 10.661 -9.761 -7.925 87 HG LEU 12 HG LEU 12 11.246 -11.929 -9.987 88 HD11 LEU 12 HD11 LEU 12 12.458 -11.508 -7.236 89 HD12 LEU 12 HD12 LEU 12 13.276 -11.300 -8.786 90 HD13 LEU 12 HD13 LEU 12 12.734 -12.900 -8.289 91 HD21 LEU 12 HD21 LEU 12 10.292 -13.482 -8.330 92 HD22 LEU 12 HD22 LEU 12 9.101 -12.303 -8.870 93 HD23 LEU 12 HD23 LEU 12 9.863 -12.122 -7.288 94 H SER 13 H SER 13 7.582 -8.475 -10.822 95 HA SER 13 HA SER 13 7.576 -6.157 -8.992 96 HB2 SER 13 HB2 SER 13 8.569 -5.355 -11.050 97 HB3 SER 13 HB3 SER 13 7.344 -6.148 -12.026 98 HG SER 13 HG SER 13 6.000 -4.564 -11.666 99 H PHE 14 H PHE 14 5.455 -5.036 -8.938 100 HA PHE 14 HA PHE 14 3.084 -6.471 -9.903 101 HB2 PHE 14 HB2 PHE 14 3.599 -7.547 -7.737 102 HB3 PHE 14 HB3 PHE 14 3.641 -5.979 -6.942 103 HD1 PHE 14 HD1 PHE 14 1.114 -7.371 -9.357 104 HD2 PHE 14 HD2 PHE 14 1.910 -6.087 -5.352 105 HE1 PHE 14 HE1 PHE 14 -1.256 -7.657 -8.788 106 HE2 PHE 14 HE2 PHE 14 -0.465 -6.370 -4.798 107 HZ PHE 14 HZ PHE 14 -2.048 -7.154 -6.509 108 H SER 15 H SER 15 2.201 -4.795 -11.012 109 HA SER 15 HA SER 15 2.200 -2.065 -9.870 110 HB2 SER 15 HB2 SER 15 3.352 -2.192 -12.002 111 HB3 SER 15 HB3 SER 15 1.986 -2.993 -12.759 112 HG SER 15 HG SER 15 1.214 -1.087 -13.167 113 H ILE 16 H ILE 16 0.335 -1.609 -8.838 114 HA ILE 16 HA ILE 16 -2.271 -2.456 -9.952 115 HB ILE 16 HB ILE 16 -1.684 -1.190 -7.234 116 HG12 ILE 16 HG12 ILE 16 -2.313 -4.105 -7.873 117 HG13 ILE 16 HG13 ILE 16 -0.726 -3.489 -7.427 118 HG21 ILE 16 HG21 ILE 16 -4.270 -2.404 -8.291 119 HG22 ILE 16 HG22 ILE 16 -3.971 -0.689 -7.995 120 HG23 ILE 16 HG23 ILE 16 -4.012 -1.821 -6.643 121 HD11 ILE 16 HD11 ILE 16 -1.586 -2.863 -5.220 122 HD12 ILE 16 HD12 ILE 16 -1.809 -4.578 -5.550 123 HD13 ILE 16 HD13 ILE 16 -3.182 -3.481 -5.662 124 H VAL 17 H VAL 17 -3.069 -1.027 -11.353 125 HA VAL 17 HA VAL 17 -2.516 1.858 -11.159 126 HB VAL 17 HB VAL 17 -3.840 0.271 -13.414 127 HG11 VAL 17 HG11 VAL 17 -2.756 3.113 -13.414 128 HG12 VAL 17 HG12 VAL 17 -4.459 2.656 -13.451 129 HG13 VAL 17 HG13 VAL 17 -3.414 2.263 -14.815 130 HG21 VAL 17 HG21 VAL 17 -1.513 -0.480 -13.099 131 HG22 VAL 17 HG22 VAL 17 -0.948 1.188 -13.217 132 HG23 VAL 17 HG23 VAL 17 -1.688 0.408 -14.617 133 H ALA 18 H ALA 18 -4.080 3.162 -10.323 134 HA ALA 18 HA ALA 18 -6.929 2.374 -10.388 135 HB1 ALA 18 HB1 ALA 18 -5.457 3.227 -7.865 136 HB2 ALA 18 HB2 ALA 18 -6.000 1.589 -8.236 137 HB3 ALA 18 HB3 ALA 18 -7.184 2.876 -7.998 138 H GLU 19 H GLU 19 -8.187 4.063 -11.019 139 HA GLU 19 HA GLU 19 -7.121 6.828 -10.876 140 HB2 GLU 19 HB2 GLU 19 -9.257 5.669 -12.718 141 HB3 GLU 19 HB3 GLU 19 -8.728 7.354 -12.717 142 HG2 GLU 19 HG2 GLU 19 -6.460 6.636 -13.357 143 HG3 GLU 19 HG3 GLU 19 -6.981 4.955 -13.356 144 H PHE 20 H PHE 20 -8.071 8.272 -9.658 145 HA PHE 20 HA PHE 20 -10.763 7.810 -8.483 146 HB2 PHE 20 HB2 PHE 20 -8.481 9.300 -7.099 147 HB3 PHE 20 HB3 PHE 20 -9.998 8.756 -6.390 148 HD1 PHE 20 HD1 PHE 20 -10.390 6.199 -6.223 149 HD2 PHE 20 HD2 PHE 20 -6.552 7.939 -6.954 150 HE1 PHE 20 HE1 PHE 20 -9.299 4.121 -5.497 151 HE2 PHE 20 HE2 PHE 20 -5.474 5.854 -6.223 152 HZ PHE 20 HZ PHE 20 -6.847 3.948 -5.499 153 H ASP 21 H ASP 21 -12.184 9.560 -8.703 154 HA ASP 21 HA ASP 21 -11.345 11.841 -10.297 155 HB2 ASP 21 HB2 ASP 21 -13.563 10.818 -10.690 156 HB3 ASP 21 HB3 ASP 21 -14.054 11.232 -9.049 157 H ALA 22 H ALA 22 -9.851 12.797 -8.980 158 HA ALA 22 HA ALA 22 -10.684 14.838 -7.160 159 HB1 ALA 22 HB1 ALA 22 -9.431 14.046 -5.161 160 HB2 ALA 22 HB2 ALA 22 -9.078 12.521 -5.980 161 HB3 ALA 22 HB3 ALA 22 -10.742 12.936 -5.565 162 H ASP 23 H ASP 23 -8.516 15.870 -6.189 163 HA ASP 23 HA ASP 23 -6.611 16.083 -8.434 164 HB2 ASP 23 HB2 ASP 23 -5.682 18.029 -7.196 165 HB3 ASP 23 HB3 ASP 23 -7.391 18.206 -7.542 166 H VAL 24 H VAL 24 -4.290 16.287 -7.835 167 HA VAL 24 HA VAL 24 -3.325 13.845 -6.899 168 HB VAL 24 HB VAL 24 -1.793 16.451 -7.276 169 HG11 VAL 24 HG11 VAL 24 -0.746 13.585 -7.306 170 HG12 VAL 24 HG12 VAL 24 -0.427 14.793 -6.057 171 HG13 VAL 24 HG13 VAL 24 0.202 15.026 -7.689 172 HG21 VAL 24 HG21 VAL 24 -2.304 14.231 -9.288 173 HG22 VAL 24 HG22 VAL 24 -1.318 15.672 -9.557 174 HG23 VAL 24 HG23 VAL 24 -3.056 15.830 -9.293 175 H LYS 25 H LYS 25 -3.542 16.984 -5.241 176 HA LYS 25 HA LYS 25 -2.043 16.244 -2.918 177 HB2 LYS 25 HB2 LYS 25 -4.098 18.477 -3.246 178 HB3 LYS 25 HB3 LYS 25 -2.961 18.331 -1.907 179 HG2 LYS 25 HG2 LYS 25 -2.290 18.855 -4.821 180 HG3 LYS 25 HG3 LYS 25 -2.169 20.003 -3.480 181 HD2 LYS 25 HD2 LYS 25 -0.541 17.457 -3.813 182 HD3 LYS 25 HD3 LYS 25 0.033 19.093 -4.125 183 HE2 LYS 25 HE2 LYS 25 -0.895 18.110 -1.399 184 HE3 LYS 25 HE3 LYS 25 0.785 18.132 -1.934 185 HZ1 LYS 25 HZ1 LYS 25 0.629 20.522 -2.215 186 HZ2 LYS 25 HZ2 LYS 25 0.275 20.075 -0.625 187 HZ3 LYS 25 HZ3 LYS 25 -0.971 20.504 -1.678 188 H ARG 26 H ARG 26 -5.454 16.016 -3.779 189 HA ARG 26 HA ARG 26 -6.466 15.372 -1.175 190 HB2 ARG 26 HB2 ARG 26 -7.917 16.277 -2.963 191 HB3 ARG 26 HB3 ARG 26 -7.650 14.833 -3.926 192 HG2 ARG 26 HG2 ARG 26 -9.864 14.830 -2.840 193 HG3 ARG 26 HG3 ARG 26 -8.873 13.470 -2.310 194 HD2 ARG 26 HD2 ARG 26 -8.352 14.644 -0.218 195 HD3 ARG 26 HD3 ARG 26 -9.285 16.045 -0.747 196 HE ARG 26 HE ARG 26 -11.201 14.280 -0.838 197 HH11 ARG 26 HH11 ARG 26 -8.754 14.389 1.638 198 HH12 ARG 26 HH12 ARG 26 -9.815 13.744 2.841 199 HH21 ARG 26 HH21 ARG 26 -12.513 13.493 0.738 200 HH22 ARG 26 HH22 ARG 26 -11.907 13.232 2.332 201 H VAL 27 H VAL 27 -5.477 13.403 -3.992 202 HA VAL 27 HA VAL 27 -6.042 10.860 -2.790 203 HB VAL 27 HB VAL 27 -4.106 11.374 -5.096 204 HG11 VAL 27 HG11 VAL 27 -3.938 9.104 -4.135 205 HG12 VAL 27 HG12 VAL 27 -4.625 9.042 -5.758 206 HG13 VAL 27 HG13 VAL 27 -5.676 8.866 -4.350 207 HG21 VAL 27 HG21 VAL 27 -7.110 10.901 -5.266 208 HG22 VAL 27 HG22 VAL 27 -6.006 10.987 -6.638 209 HG23 VAL 27 HG23 VAL 27 -6.274 12.410 -5.634 210 H TRP 28 H TRP 28 -3.104 12.855 -3.043 211 HA TRP 28 HA TRP 28 -1.238 11.080 -1.881 212 HB2 TRP 28 HB2 TRP 28 -0.608 13.110 -3.153 213 HB3 TRP 28 HB3 TRP 28 -1.258 14.126 -1.880 214 HD1 TRP 28 HD1 TRP 28 0.366 14.713 0.113 215 HE1 TRP 28 HE1 TRP 28 2.816 14.146 0.641 216 HE3 TRP 28 HE3 TRP 28 1.151 11.056 -3.396 217 HZ2 TRP 28 HZ2 TRP 28 4.812 12.400 -0.298 218 HZ3 TRP 28 HZ3 TRP 28 3.367 9.995 -3.514 219 HH2 TRP 28 HH2 TRP 28 5.160 10.659 -1.990 220 H ALA 29 H ALA 29 -3.597 13.239 -0.423 221 HA ALA 29 HA ALA 29 -2.645 13.544 2.177 222 HB1 ALA 29 HB1 ALA 29 -4.954 14.069 2.799 223 HB2 ALA 29 HB2 ALA 29 -5.537 13.335 1.300 224 HB3 ALA 29 HB3 ALA 29 -4.544 14.793 1.241 225 H ILE 30 H ILE 30 -4.251 10.730 0.762 226 HA ILE 30 HA ILE 30 -4.948 9.387 3.187 227 HB ILE 30 HB ILE 30 -5.407 7.425 1.889 228 HG12 ILE 30 HG12 ILE 30 -3.685 8.675 -0.284 229 HG13 ILE 30 HG13 ILE 30 -3.376 7.188 0.590 230 HG21 ILE 30 HG21 ILE 30 -6.909 8.287 0.146 231 HG22 ILE 30 HG22 ILE 30 -6.098 9.853 0.203 232 HG23 ILE 30 HG23 ILE 30 -6.998 9.275 1.608 233 HD11 ILE 30 HD11 ILE 30 -4.052 6.668 -1.612 234 HD12 ILE 30 HD12 ILE 30 -5.490 7.678 -1.480 235 HD13 ILE 30 HD13 ILE 30 -5.356 6.199 -0.520 236 H TRP 31 H TRP 31 -2.002 9.490 1.269 237 HA TRP 31 HA TRP 31 -0.619 7.409 2.771 238 HB2 TRP 31 HB2 TRP 31 0.408 9.405 0.696 239 HB3 TRP 31 HB3 TRP 31 1.321 8.035 1.330 240 HD1 TRP 31 HD1 TRP 31 -1.042 8.924 -1.441 241 HE1 TRP 31 HE1 TRP 31 -1.711 6.801 -2.736 242 HE3 TRP 31 HE3 TRP 31 0.756 5.377 1.795 243 HZ2 TRP 31 HZ2 TRP 31 -1.496 4.006 -2.440 244 HZ3 TRP 31 HZ3 TRP 31 0.492 3.004 1.208 245 HH2 TRP 31 HH2 TRP 31 -0.618 2.330 -0.865 246 H GLU 32 H GLU 32 -0.780 10.907 2.623 247 HA GLU 32 HA GLU 32 1.559 11.554 4.066 248 HB2 GLU 32 HB2 GLU 32 0.224 13.008 2.427 249 HB3 GLU 32 HB3 GLU 32 -0.917 13.300 3.724 250 HG2 GLU 32 HG2 GLU 32 2.024 14.016 3.845 251 HG3 GLU 32 HG3 GLU 32 0.775 15.128 3.307 252 H ASP 33 H ASP 33 -1.878 11.466 5.054 253 HA ASP 33 HA ASP 33 -1.157 12.002 7.857 254 HB2 ASP 33 HB2 ASP 33 -2.983 13.332 6.630 255 HB3 ASP 33 HB3 ASP 33 -3.936 11.862 6.637 256 HA PRO 34 HA PRO 34 -1.623 7.589 8.896 257 HB2 PRO 34 HB2 PRO 34 -2.010 7.912 11.645 258 HB3 PRO 34 HB3 PRO 34 -0.444 7.885 10.839 259 HG2 PRO 34 HG2 PRO 34 -2.101 10.257 11.673 260 HG3 PRO 34 HG3 PRO 34 -0.351 10.002 11.845 261 HD2 PRO 34 HD2 PRO 34 -1.316 11.554 9.886 262 HD3 PRO 34 HD3 PRO 34 0.074 10.483 9.583 263 H ARG 35 H ARG 35 -4.051 9.913 10.203 264 HA ARG 35 HA ARG 35 -6.067 7.974 10.832 265 HB2 ARG 35 HB2 ARG 35 -6.107 10.976 10.532 266 HB3 ARG 35 HB3 ARG 35 -7.634 10.120 10.619 267 HG2 ARG 35 HG2 ARG 35 -7.012 11.017 12.797 268 HG3 ARG 35 HG3 ARG 35 -7.078 9.258 12.835 269 HD2 ARG 35 HD2 ARG 35 -4.439 10.668 12.420 270 HD3 ARG 35 HD3 ARG 35 -5.122 10.518 14.041 271 HE ARG 35 HE ARG 35 -5.033 7.996 12.686 272 HH11 ARG 35 HH11 ARG 35 -3.018 10.212 14.443 273 HH12 ARG 35 HH12 ARG 35 -1.951 8.961 14.970 274 HH21 ARG 35 HH21 ARG 35 -3.636 6.438 13.390 275 HH22 ARG 35 HH22 ARG 35 -2.286 6.868 14.378 276 H GLN 36 H GLN 36 -5.492 9.967 7.943 277 HA GLN 36 HA GLN 36 -7.678 9.121 6.348 278 HB2 GLN 36 HB2 GLN 36 -4.851 9.900 5.503 279 HB3 GLN 36 HB3 GLN 36 -6.220 9.768 4.408 280 HG2 GLN 36 HG2 GLN 36 -6.118 11.724 6.718 281 HG3 GLN 36 HG3 GLN 36 -5.547 12.105 5.096 282 HE21 GLN 36 HE21 GLN 36 -7.669 13.355 6.632 283 HE22 GLN 36 HE22 GLN 36 -9.085 13.233 5.667 284 H LEU 37 H LEU 37 -4.385 7.795 6.745 285 HA LEU 37 HA LEU 37 -4.494 5.805 4.727 286 HB2 LEU 37 HB2 LEU 37 -2.404 6.749 5.642 287 HB3 LEU 37 HB3 LEU 37 -2.735 6.011 7.198 288 HG LEU 37 HG LEU 37 -2.440 3.749 6.199 289 HD11 LEU 37 HD11 LEU 37 -1.507 3.448 3.952 290 HD12 LEU 37 HD12 LEU 37 -1.682 5.181 3.636 291 HD13 LEU 37 HD13 LEU 37 -3.115 4.181 3.888 292 HD21 LEU 37 HD21 LEU 37 -0.009 3.859 5.885 293 HD22 LEU 37 HD22 LEU 37 -0.534 4.845 7.249 294 HD23 LEU 37 HD23 LEU 37 -0.101 5.617 5.719 295 H GLU 38 H GLU 38 -4.869 5.513 8.280 296 HA GLU 38 HA GLU 38 -5.124 2.679 8.350 297 HB2 GLU 38 HB2 GLU 38 -5.685 2.966 10.713 298 HB3 GLU 38 HB3 GLU 38 -4.361 4.037 10.274 299 HG2 GLU 38 HG2 GLU 38 -6.057 5.901 10.067 300 HG3 GLU 38 HG3 GLU 38 -7.254 4.803 10.756 301 H ARG 39 H ARG 39 -7.379 5.137 7.607 302 HA ARG 39 HA ARG 39 -9.827 3.892 8.277 303 HB2 ARG 39 HB2 ARG 39 -9.880 6.222 7.989 304 HB3 ARG 39 HB3 ARG 39 -8.982 6.171 6.484 305 HG2 ARG 39 HG2 ARG 39 -10.864 5.608 5.210 306 HG3 ARG 39 HG3 ARG 39 -11.762 5.022 6.603 307 HD2 ARG 39 HD2 ARG 39 -12.561 7.239 5.684 308 HD3 ARG 39 HD3 ARG 39 -12.169 7.250 7.402 309 HE ARG 39 HE ARG 39 -10.255 8.233 5.379 310 HH11 ARG 39 HH11 ARG 39 -12.039 8.789 8.309 311 HH12 ARG 39 HH12 ARG 39 -11.354 10.358 8.539 312 HH21 ARG 39 HH21 ARG 39 -9.419 10.248 5.728 313 HH22 ARG 39 HH22 ARG 39 -9.927 11.166 7.099 314 H TRP 40 H TRP 40 -7.715 3.533 5.458 315 HA TRP 40 HA TRP 40 -9.695 1.694 4.210 316 HB2 TRP 40 HB2 TRP 40 -8.838 2.354 1.992 317 HB3 TRP 40 HB3 TRP 40 -9.474 3.741 2.869 318 HD1 TRP 40 HD1 TRP 40 -7.664 5.590 3.717 319 HE1 TRP 40 HE1 TRP 40 -5.298 6.147 2.884 320 HE3 TRP 40 HE3 TRP 40 -6.701 1.355 1.032 321 HZ2 TRP 40 HZ2 TRP 40 -3.309 4.985 1.277 322 HZ3 TRP 40 HZ3 TRP 40 -4.550 1.155 -0.140 323 HH2 TRP 40 HH2 TRP 40 -2.889 2.939 -0.013 324 H TRP 41 H TRP 41 -6.427 2.019 5.347 325 HA TRP 41 HA TRP 41 -4.916 0.543 3.540 326 HB2 TRP 41 HB2 TRP 41 -3.999 1.956 5.410 327 HB3 TRP 41 HB3 TRP 41 -4.403 0.673 6.545 328 HD1 TRP 41 HD1 TRP 41 -2.283 -0.751 7.125 329 HE1 TRP 41 HE1 TRP 41 -0.120 -1.415 5.900 330 HE3 TRP 41 HE3 TRP 41 -3.170 1.467 2.599 331 HZ2 TRP 41 HZ2 TRP 41 1.039 -1.053 3.364 332 HZ3 TRP 41 HZ3 TRP 41 -1.493 1.239 0.823 333 HH2 TRP 41 HH2 TRP 41 0.575 0.002 1.197 334 H GLY 42 H GLY 42 -6.734 -0.650 6.307 335 HA2 GLY 42 HA2 GLY 42 -6.188 -3.454 5.575 336 HA3 GLY 42 HA3 GLY 42 -6.962 -2.892 7.047 337 HA PRO 43 HA PRO 43 -10.205 -3.790 3.456 338 HB2 PRO 43 HB2 PRO 43 -10.677 -6.499 3.826 339 HB3 PRO 43 HB3 PRO 43 -9.554 -5.862 2.616 340 HG2 PRO 43 HG2 PRO 43 -8.961 -6.896 5.391 341 HG3 PRO 43 HG3 PRO 43 -8.123 -7.264 3.867 342 HD2 PRO 43 HD2 PRO 43 -7.101 -5.474 5.591 343 HD3 PRO 43 HD3 PRO 43 -6.998 -5.187 3.838 344 HA PRO 44 HA PRO 44 -13.589 -3.399 6.476 345 HB2 PRO 44 HB2 PRO 44 -15.059 -5.489 4.853 346 HB3 PRO 44 HB3 PRO 44 -15.629 -3.918 5.441 347 HG2 PRO 44 HG2 PRO 44 -14.935 -4.183 2.894 348 HG3 PRO 44 HG3 PRO 44 -14.448 -2.726 3.787 349 HD2 PRO 44 HD2 PRO 44 -12.788 -5.122 3.012 350 HD3 PRO 44 HD3 PRO 44 -12.341 -3.400 3.043 351 H THR 45 H THR 45 -12.387 -6.618 5.765 352 HA THR 45 HA THR 45 -13.481 -7.887 8.145 353 HB THR 45 HB THR 45 -12.120 -9.863 7.417 354 HG1 THR 45 HG1 THR 45 -10.668 -9.679 5.853 355 HG21 THR 45 HG21 THR 45 -13.757 -8.637 5.166 356 HG22 THR 45 HG22 THR 45 -14.407 -9.597 6.498 357 HG23 THR 45 HG23 THR 45 -13.322 -10.340 5.319 358 H TRP 46 H TRP 46 -10.289 -6.660 7.085 359 HA TRP 46 HA TRP 46 -9.234 -6.935 9.858 360 HB2 TRP 46 HB2 TRP 46 -7.799 -7.535 7.234 361 HB3 TRP 46 HB3 TRP 46 -6.940 -7.312 8.750 362 HD1 TRP 46 HD1 TRP 46 -9.627 -9.707 7.264 363 HE1 TRP 46 HE1 TRP 46 -9.322 -11.997 8.377 364 HE3 TRP 46 HE3 TRP 46 -5.869 -8.566 10.528 365 HZ2 TRP 46 HZ2 TRP 46 -7.728 -13.188 10.315 366 HZ3 TRP 46 HZ3 TRP 46 -4.993 -10.355 11.972 367 HH2 TRP 46 HH2 TRP 46 -5.899 -12.622 11.860 368 HA PRO 47 HA PRO 47 -8.760 -2.408 8.412 369 HB2 PRO 47 HB2 PRO 47 -9.708 -1.281 10.764 370 HB3 PRO 47 HB3 PRO 47 -10.729 -1.662 9.370 371 HG2 PRO 47 HG2 PRO 47 -10.247 -3.298 11.865 372 HG3 PRO 47 HG3 PRO 47 -11.788 -2.918 11.064 373 HD2 PRO 47 HD2 PRO 47 -10.608 -5.298 10.689 374 HD3 PRO 47 HD3 PRO 47 -11.419 -4.477 9.336 375 H ALA 48 H ALA 48 -6.730 -1.656 8.607 376 HA ALA 48 HA ALA 48 -4.989 -2.436 10.834 377 HB1 ALA 48 HB1 ALA 48 -4.155 -2.699 8.536 378 HB2 ALA 48 HB2 ALA 48 -3.165 -1.546 9.433 379 HB3 ALA 48 HB3 ALA 48 -4.347 -0.969 8.250 380 H THR 49 H THR 49 -4.586 -1.077 12.518 381 HA THR 49 HA THR 49 -5.189 1.831 12.280 382 HB THR 49 HB THR 49 -5.188 0.070 14.779 383 HG1 THR 49 HG1 THR 49 -7.371 1.505 13.637 384 HG21 THR 49 HG21 THR 49 -6.037 2.077 15.988 385 HG22 THR 49 HG22 THR 49 -5.787 3.053 14.538 386 HG23 THR 49 HG23 THR 49 -4.403 2.340 15.373 387 H PHE 50 H PHE 50 -3.524 3.238 12.488 388 HA PHE 50 HA PHE 50 -0.826 2.177 12.891 389 HB2 PHE 50 HB2 PHE 50 -1.914 4.719 11.642 390 HB3 PHE 50 HB3 PHE 50 -0.205 4.582 12.054 391 HD1 PHE 50 HD1 PHE 50 -2.911 2.933 10.054 392 HD2 PHE 50 HD2 PHE 50 1.297 3.447 10.608 393 HE1 PHE 50 HE1 PHE 50 -2.482 1.681 7.983 394 HE2 PHE 50 HE2 PHE 50 1.719 2.194 8.537 395 HZ PHE 50 HZ PHE 50 -0.165 1.307 7.224 396 H GLU 51 H GLU 51 -0.341 2.026 14.978 397 HA GLU 51 HA GLU 51 -0.722 3.910 17.062 398 HB2 GLU 51 HB2 GLU 51 1.488 1.845 16.694 399 HB3 GLU 51 HB3 GLU 51 1.082 2.640 18.215 400 HG2 GLU 51 HG2 GLU 51 -0.751 0.779 16.660 401 HG3 GLU 51 HG3 GLU 51 0.208 0.324 18.068 402 H THR 52 H THR 52 1.874 3.427 14.747 403 HA THR 52 HA THR 52 2.920 6.130 15.344 404 HB THR 52 HB THR 52 4.717 3.793 14.534 405 HG1 THR 52 HG1 THR 52 4.405 4.802 17.184 406 HG21 THR 52 HG21 THR 52 5.600 6.069 14.127 407 HG22 THR 52 HG22 THR 52 6.508 5.243 15.398 408 HG23 THR 52 HG23 THR 52 5.309 6.467 15.823 409 H HIS 53 H HIS 53 3.492 7.330 13.510 410 HA HIS 53 HA HIS 53 3.888 6.097 10.906 411 HB2 HIS 53 HB2 HIS 53 1.398 6.352 11.055 412 HB3 HIS 53 HB3 HIS 53 1.593 8.076 11.319 413 HD2 HIS 53 HD2 HIS 53 1.486 5.509 8.424 414 HE1 HIS 53 HE1 HIS 53 2.040 9.373 6.793 415 HE2 HIS 53 HE2 HIS 53 1.322 7.004 6.309 416 H GLU 54 H GLU 54 5.795 7.060 10.415 417 HA GLU 54 HA GLU 54 6.149 9.983 10.820 418 HB2 GLU 54 HB2 GLU 54 8.287 7.845 10.375 419 HB3 GLU 54 HB3 GLU 54 8.570 9.550 10.733 420 HG2 GLU 54 HG2 GLU 54 7.575 9.244 12.964 421 HG3 GLU 54 HG3 GLU 54 7.278 7.545 12.596 422 H PHE 55 H PHE 55 5.262 10.768 8.866 423 HA PHE 55 HA PHE 55 5.946 9.618 6.316 424 HB2 PHE 55 HB2 PHE 55 3.730 10.811 6.992 425 HB3 PHE 55 HB3 PHE 55 4.602 12.316 6.720 426 HD1 PHE 55 HD1 PHE 55 3.958 9.040 5.037 427 HD2 PHE 55 HD2 PHE 55 4.442 13.253 4.537 428 HE1 PHE 55 HE1 PHE 55 3.450 8.811 2.641 429 HE2 PHE 55 HE2 PHE 55 3.911 13.016 2.141 430 HZ PHE 55 HZ PHE 55 3.424 10.794 1.194 431 H THR 56 H THR 56 8.284 9.851 6.998 432 HA THR 56 HA THR 56 9.468 12.065 5.461 433 HB THR 56 HB THR 56 9.783 12.786 7.801 434 HG1 THR 56 HG1 THR 56 12.375 12.057 7.504 435 HG21 THR 56 HG21 THR 56 9.632 10.590 8.935 436 HG22 THR 56 HG22 THR 56 11.092 11.453 9.420 437 HG23 THR 56 HG23 THR 56 11.197 10.128 8.259 438 H VAL 57 H VAL 57 11.722 11.518 4.731 439 HA VAL 57 HA VAL 57 11.961 8.850 3.725 440 HB VAL 57 HB VAL 57 13.974 11.141 3.793 441 HG11 VAL 57 HG11 VAL 57 15.248 9.913 2.053 442 HG12 VAL 57 HG12 VAL 57 14.163 8.537 2.240 443 HG13 VAL 57 HG13 VAL 57 15.201 9.024 3.579 444 HG21 VAL 57 HG21 VAL 57 11.965 11.649 2.461 445 HG22 VAL 57 HG22 VAL 57 12.173 10.157 1.541 446 HG23 VAL 57 HG23 VAL 57 13.368 11.450 1.404 447 H GLY 58 H GLY 58 12.700 7.094 4.788 448 HA2 GLY 58 HA2 GLY 58 14.019 5.779 6.192 449 HA3 GLY 58 HA3 GLY 58 14.783 7.217 6.845 450 H GLY 59 H GLY 59 11.483 7.708 6.906 451 HA2 GLY 59 HA2 GLY 59 11.259 7.275 9.770 452 HA3 GLY 59 HA3 GLY 59 10.054 7.992 8.708 453 H LYS 60 H LYS 60 9.376 6.129 10.707 454 HA LYS 60 HA LYS 60 8.553 3.772 9.106 455 HB2 LYS 60 HB2 LYS 60 9.634 3.735 11.953 456 HB3 LYS 60 HB3 LYS 60 8.828 2.367 11.183 457 HG2 LYS 60 HG2 LYS 60 10.601 2.367 9.418 458 HG3 LYS 60 HG3 LYS 60 11.441 3.646 10.310 459 HD2 LYS 60 HD2 LYS 60 11.659 2.135 12.258 460 HD3 LYS 60 HD3 LYS 60 10.800 0.866 11.377 461 HE2 LYS 60 HE2 LYS 60 12.616 0.784 9.715 462 HE3 LYS 60 HE3 LYS 60 13.476 2.066 10.577 463 HZ1 LYS 60 HZ1 LYS 60 14.359 -0.091 11.147 464 HZ2 LYS 60 HZ2 LYS 60 12.837 -0.634 11.639 465 HZ3 LYS 60 HZ3 LYS 60 13.613 0.590 12.507 466 H ALA 61 H ALA 61 6.806 2.517 10.143 467 HA ALA 61 HA ALA 61 4.826 4.088 11.621 468 HB1 ALA 61 HB1 ALA 61 4.264 2.879 8.882 469 HB2 ALA 61 HB2 ALA 61 4.410 4.601 9.240 470 HB3 ALA 61 HB3 ALA 61 3.083 3.669 9.933 471 H ALA 62 H ALA 62 3.687 2.833 12.992 472 HA ALA 62 HA ALA 62 3.992 -0.120 12.906 473 HB1 ALA 62 HB1 ALA 62 3.439 1.700 15.290 474 HB2 ALA 62 HB2 ALA 62 4.976 0.921 14.915 475 HB3 ALA 62 HB3 ALA 62 3.576 -0.061 15.348 476 H TYR 63 H TYR 63 2.168 -1.076 12.156 477 HA TYR 63 HA TYR 63 -0.473 -0.029 13.028 478 HB2 TYR 63 HB2 TYR 63 -1.463 -0.807 10.907 479 HB3 TYR 63 HB3 TYR 63 -0.197 0.370 10.607 480 HD1 TYR 63 HD1 TYR 63 2.037 -0.412 9.683 481 HD2 TYR 63 HD2 TYR 63 -1.315 -3.055 9.994 482 HE1 TYR 63 HE1 TYR 63 3.123 -1.977 8.129 483 HE2 TYR 63 HE2 TYR 63 -0.230 -4.622 8.441 484 HH TYR 63 HH TYR 63 1.556 -4.488 6.599 485 H TYR 64 H TYR 64 -2.177 -1.689 13.123 486 HA TYR 64 HA TYR 64 -1.363 -4.497 13.027 487 HB2 TYR 64 HB2 TYR 64 -2.357 -5.062 15.219 488 HB3 TYR 64 HB3 TYR 64 -1.040 -3.916 15.419 489 HD1 TYR 64 HD2 TYR 64 -1.574 -1.480 15.931 490 HD2 TYR 64 HD1 TYR 64 -4.589 -4.512 15.940 491 HE1 TYR 64 HE2 TYR 64 -3.075 0.004 17.184 492 HE2 TYR 64 HE1 TYR 64 -6.086 -3.032 17.197 493 HH TYR 64 HH TYR 64 -5.423 0.332 17.632 494 H MET 65 H MET 65 -2.955 -5.790 12.308 495 HA MET 65 HA MET 65 -5.337 -4.477 11.207 496 HB2 MET 65 HB2 MET 65 -4.101 -7.194 10.556 497 HB3 MET 65 HB3 MET 65 -5.377 -6.381 9.650 498 HG2 MET 65 HG2 MET 65 -3.839 -4.629 8.962 499 HG3 MET 65 HG3 MET 65 -2.569 -5.288 9.992 500 HE1 MET 65 HE1 MET 65 -4.154 -7.416 6.207 501 HE2 MET 65 HE2 MET 65 -4.780 -5.878 6.804 502 HE3 MET 65 HE3 MET 65 -5.073 -7.363 7.712 503 H THR 66 H THR 66 -6.932 -4.537 12.741 504 HA THR 66 HA THR 66 -7.344 -6.727 14.566 505 HB THR 66 HB THR 66 -9.141 -4.341 13.931 506 HG1 THR 66 HG1 THR 66 -8.043 -3.325 15.463 507 HG21 THR 66 HG21 THR 66 -9.309 -6.318 16.244 508 HG22 THR 66 HG22 THR 66 -10.491 -6.142 14.943 509 HG23 THR 66 HG23 THR 66 -10.251 -4.831 16.101 510 H GLY 67 H GLY 67 -8.056 -8.628 13.834 511 HA2 GLY 67 HA2 GLY 67 -9.314 -9.106 11.370 512 HA3 GLY 67 HA3 GLY 67 -9.106 -10.263 12.667 513 HA PRO 68 HA PRO 68 -13.686 -9.103 11.850 514 HB2 PRO 68 HB2 PRO 68 -14.553 -11.544 10.924 515 HB3 PRO 68 HB3 PRO 68 -13.854 -10.312 9.866 516 HG2 PRO 68 HG2 PRO 68 -12.529 -12.743 11.078 517 HG3 PRO 68 HG3 PRO 68 -12.407 -12.112 9.423 518 HD2 PRO 68 HD2 PRO 68 -10.497 -11.673 11.323 519 HD3 PRO 68 HD3 PRO 68 -10.840 -10.504 10.026 520 H ASP 69 H ASP 69 -12.050 -11.657 13.542 521 HA ASP 69 HA ASP 69 -14.234 -11.908 15.545 522 HB2 ASP 69 HB2 ASP 69 -13.324 -14.111 16.074 523 HB3 ASP 69 HB3 ASP 69 -13.632 -14.014 14.343 524 H GLY 70 H GLY 70 -11.674 -10.077 15.129 525 HA2 GLY 70 HA2 GLY 70 -10.821 -8.740 16.982 526 HA3 GLY 70 HA3 GLY 70 -10.666 -10.205 17.936 527 H THR 71 H THR 71 -9.087 -11.788 17.230 528 HA THR 71 HA THR 71 -6.943 -12.398 17.007 529 HB THR 71 HB THR 71 -7.329 -11.293 14.196 530 HG1 THR 71 HG1 THR 71 -8.829 -12.823 14.333 531 HG21 THR 71 HG21 THR 71 -5.654 -13.005 13.533 532 HG22 THR 71 HG22 THR 71 -5.383 -13.407 15.229 533 HG23 THR 71 HG23 THR 71 -4.939 -11.811 14.619 534 H LYS 72 H LYS 72 -6.683 -9.336 15.165 535 HA LYS 72 HA LYS 72 -5.154 -7.720 15.017 536 HB2 LYS 72 HB2 LYS 72 -4.349 -8.540 17.827 537 HB3 LYS 72 HB3 LYS 72 -3.467 -7.308 16.943 538 HG2 LYS 72 HG2 LYS 72 -4.948 -6.122 18.331 539 HG3 LYS 72 HG3 LYS 72 -5.661 -6.047 16.720 540 HD2 LYS 72 HD2 LYS 72 -7.256 -7.825 17.331 541 HD3 LYS 72 HD3 LYS 72 -6.518 -7.950 18.933 542 HE2 LYS 72 HE2 LYS 72 -7.192 -5.611 19.404 543 HE3 LYS 72 HE3 LYS 72 -7.946 -5.517 17.808 544 HZ1 LYS 72 HZ1 LYS 72 -9.414 -7.331 18.473 545 HZ2 LYS 72 HZ2 LYS 72 -9.576 -5.990 19.481 546 HZ3 LYS 72 HZ3 LYS 72 -8.715 -7.343 20.012 547 H ALA 73 H ALA 73 -3.915 -8.200 13.348 548 HA ALA 73 HA ALA 73 -1.521 -9.922 13.663 549 HB1 ALA 73 HB1 ALA 73 -2.871 -8.919 11.114 550 HB2 ALA 73 HB2 ALA 73 -2.986 -10.552 11.776 551 HB3 ALA 73 HB3 ALA 73 -1.435 -9.952 11.187 552 H ARG 74 H ARG 74 0.037 -8.577 14.505 553 HA ARG 74 HA ARG 74 0.241 -5.794 14.107 554 HB2 ARG 74 HB2 ARG 74 2.383 -7.778 14.971 555 HB3 ARG 74 HB3 ARG 74 2.589 -6.029 15.016 556 HG2 ARG 74 HG2 ARG 74 0.687 -5.881 16.636 557 HG3 ARG 74 HG3 ARG 74 0.583 -7.645 16.639 558 HD2 ARG 74 HD2 ARG 74 2.849 -7.808 17.552 559 HD3 ARG 74 HD3 ARG 74 3.052 -6.054 17.451 560 HE ARG 74 HE ARG 74 0.796 -6.734 19.049 561 HH11 ARG 74 HH11 ARG 74 4.249 -6.636 19.199 562 HH12 ARG 74 HH12 ARG 74 4.271 -6.426 20.907 563 HH21 ARG 74 HH21 ARG 74 0.845 -6.468 21.218 564 HH22 ARG 74 HH22 ARG 74 2.355 -6.331 22.047 565 H GLY 75 H GLY 75 1.743 -4.542 12.894 566 HA2 GLY 75 HA2 GLY 75 3.456 -5.867 10.920 567 HA3 GLY 75 HA3 GLY 75 2.202 -4.789 10.324 568 H TRP 76 H TRP 76 5.131 -4.688 10.199 569 HA TRP 76 HA TRP 76 5.573 -1.971 11.288 570 HB2 TRP 76 HB2 TRP 76 7.985 -2.365 10.986 571 HB3 TRP 76 HB3 TRP 76 7.298 -3.656 11.969 572 HD1 TRP 76 HD1 TRP 76 7.242 -6.138 10.893 573 HE1 TRP 76 HE1 TRP 76 8.428 -7.157 8.853 574 HE3 TRP 76 HE3 TRP 76 8.946 -1.836 8.653 575 HZ2 TRP 76 HZ2 TRP 76 9.897 -6.286 6.620 576 HZ3 TRP 76 HZ3 TRP 76 10.239 -2.027 6.564 577 HH2 TRP 76 HH2 TRP 76 10.707 -4.210 5.576 578 H TRP 77 H TRP 77 6.327 -0.383 9.826 579 HA TRP 77 HA TRP 77 6.288 -0.934 6.924 580 HB2 TRP 77 HB2 TRP 77 4.053 0.011 8.201 581 HB3 TRP 77 HB3 TRP 77 4.874 1.538 7.943 582 HD1 TRP 77 HD1 TRP 77 4.533 -1.440 5.441 583 HE1 TRP 77 HE1 TRP 77 3.300 -0.577 3.357 584 HE3 TRP 77 HE3 TRP 77 3.583 3.339 6.980 585 HZ2 TRP 77 HZ2 TRP 77 2.074 1.819 2.489 586 HZ3 TRP 77 HZ3 TRP 77 2.380 4.849 5.461 587 HH2 TRP 77 HH2 TRP 77 1.639 4.107 3.259 588 H GLN 78 H GLN 78 7.820 0.351 5.783 589 HA GLN 78 HA GLN 78 9.186 2.530 7.277 590 HB2 GLN 78 HB2 GLN 78 10.576 0.522 7.549 591 HB3 GLN 78 HB3 GLN 78 10.625 0.275 5.809 592 HG2 GLN 78 HG2 GLN 78 11.922 2.311 5.499 593 HG3 GLN 78 HG3 GLN 78 11.758 2.731 7.197 594 HE21 GLN 78 HE21 GLN 78 13.986 2.800 7.544 595 HE22 GLN 78 HE22 GLN 78 14.988 1.394 7.534 596 H PHE 79 H PHE 79 9.107 4.325 6.168 597 HA PHE 79 HA PHE 79 8.591 4.525 3.344 598 HB2 PHE 79 HB2 PHE 79 9.352 6.702 5.346 599 HB3 PHE 79 HB3 PHE 79 8.724 6.973 3.725 600 HD1 PHE 79 HD1 PHE 79 7.863 5.751 7.116 601 HD2 PHE 79 HD2 PHE 79 6.354 6.812 3.261 602 HE1 PHE 79 HE1 PHE 79 5.580 5.759 8.016 603 HE2 PHE 79 HE2 PHE 79 4.075 6.823 4.172 604 HZ PHE 79 HZ PHE 79 3.688 6.302 6.544 605 H THR 80 H THR 80 10.083 4.506 1.775 606 HA THR 80 HA THR 80 12.949 4.729 2.362 607 HB THR 80 HB THR 80 12.556 4.149 -0.438 608 HG1 THR 80 HG1 THR 80 11.044 2.251 0.956 609 HG21 THR 80 HG21 THR 80 13.394 1.910 0.096 610 HG22 THR 80 HG22 THR 80 13.156 2.218 1.827 611 HG23 THR 80 HG23 THR 80 14.356 3.150 0.919 612 H THR 81 H THR 81 10.529 6.227 0.182 613 HA THR 81 HA THR 81 12.289 8.559 -0.289 614 HB THR 81 HB THR 81 11.102 6.893 -2.563 615 HG1 THR 81 HG1 THR 81 13.131 6.292 -3.028 616 HG21 THR 81 HG21 THR 81 12.219 8.454 -4.114 617 HG22 THR 81 HG22 THR 81 12.728 9.455 -2.754 618 HG23 THR 81 HG23 THR 81 11.011 9.294 -3.141 619 H ILE 82 H ILE 82 11.055 10.362 -0.005 620 HA ILE 82 HA ILE 82 8.217 10.364 -0.870 621 HB ILE 82 HB ILE 82 9.213 11.741 1.670 622 HG12 ILE 82 HG12 ILE 82 7.637 9.151 1.354 623 HG13 ILE 82 HG13 ILE 82 9.231 9.334 2.067 624 HG21 ILE 82 HG21 ILE 82 7.330 12.905 0.578 625 HG22 ILE 82 HG22 ILE 82 6.823 12.188 2.105 626 HG23 ILE 82 HG23 ILE 82 6.386 11.410 0.582 627 HD11 ILE 82 HD11 ILE 82 7.609 8.977 3.778 628 HD12 ILE 82 HD12 ILE 82 6.619 10.315 3.197 629 HD13 ILE 82 HD13 ILE 82 8.206 10.629 3.905 630 H GLU 83 H GLU 83 8.510 11.533 -2.716 631 HA GLU 83 HA GLU 83 10.066 14.004 -2.742 632 HB2 GLU 83 HB2 GLU 83 8.554 12.584 -4.971 633 HB3 GLU 83 HB3 GLU 83 9.447 14.090 -5.181 634 HG2 GLU 83 HG2 GLU 83 11.509 12.790 -4.323 635 HG3 GLU 83 HG3 GLU 83 10.545 11.335 -4.562 636 H ALA 84 H ALA 84 6.701 13.007 -3.225 637 HA ALA 84 HA ALA 84 4.707 14.007 -3.112 638 HB1 ALA 84 HB1 ALA 84 4.337 15.939 -1.650 639 HB2 ALA 84 HB2 ALA 84 6.075 16.259 -1.600 640 HB3 ALA 84 HB3 ALA 84 5.427 14.782 -0.882 641 HA PRO 85 HA PRO 85 2.868 14.852 -3.386 642 HB2 PRO 85 HB2 PRO 85 0.809 15.676 -4.840 643 HB3 PRO 85 HB3 PRO 85 1.723 16.848 -3.881 644 HG2 PRO 85 HG2 PRO 85 1.863 16.312 -6.843 645 HG3 PRO 85 HG3 PRO 85 1.879 17.869 -5.988 646 HD2 PRO 85 HD2 PRO 85 4.165 16.450 -6.879 647 HD3 PRO 85 HD3 PRO 85 4.165 17.797 -5.721 648 H ASP 86 H ASP 86 4.474 13.890 -6.029 649 HA ASP 86 HA ASP 86 2.442 12.021 -7.093 650 HB2 ASP 86 HB2 ASP 86 3.913 11.878 -9.090 651 HB3 ASP 86 HB3 ASP 86 3.385 13.520 -8.753 652 H HIS 87 H HIS 87 5.913 12.015 -6.119 653 HA HIS 87 HA HIS 87 5.979 9.099 -6.456 654 HB2 HIS 87 HB2 HIS 87 7.655 10.633 -7.574 655 HB3 HIS 87 HB3 HIS 87 8.308 10.992 -5.986 656 HD1 HIS 87 HD1 HIS 87 10.209 9.910 -7.956 657 HD2 HIS 87 HD2 HIS 87 7.961 7.385 -5.543 658 HE1 HIS 87 HE1 HIS 87 11.513 7.784 -7.824 659 HE2 HIS 87 HE2 HIS 87 10.221 6.335 -6.240 660 H LEU 88 H LEU 88 5.735 7.842 -4.800 661 HA LEU 88 HA LEU 88 6.976 8.357 -2.177 662 HB2 LEU 88 HB2 LEU 88 4.525 8.637 -1.946 663 HB3 LEU 88 HB3 LEU 88 4.250 7.095 -2.726 664 HG LEU 88 HG LEU 88 5.363 5.955 -0.777 665 HD11 LEU 88 HD11 LEU 88 6.772 7.774 0.028 666 HD12 LEU 88 HD12 LEU 88 5.727 7.173 1.312 667 HD13 LEU 88 HD13 LEU 88 5.344 8.697 0.506 668 HD21 LEU 88 HD21 LEU 88 3.496 6.193 0.781 669 HD22 LEU 88 HD22 LEU 88 2.932 6.103 -0.886 670 HD23 LEU 88 HD23 LEU 88 2.969 7.660 -0.053 671 H GLU 89 H GLU 89 8.037 6.562 -1.352 672 HA GLU 89 HA GLU 89 7.613 3.891 -2.497 673 HB2 GLU 89 HB2 GLU 89 10.345 5.201 -2.055 674 HB3 GLU 89 HB3 GLU 89 10.124 3.473 -2.324 675 HG2 GLU 89 HG2 GLU 89 9.188 3.921 -4.543 676 HG3 GLU 89 HG3 GLU 89 9.338 5.652 -4.278 677 H PHE 90 H PHE 90 7.644 2.312 -0.983 678 HA PHE 90 HA PHE 90 8.803 2.675 1.650 679 HB2 PHE 90 HB2 PHE 90 6.712 2.081 2.871 680 HB3 PHE 90 HB3 PHE 90 6.589 3.625 2.044 681 HD1 PHE 90 HD2 PHE 90 5.544 0.040 1.879 682 HD2 PHE 90 HD1 PHE 90 4.878 4.006 0.407 683 HE1 PHE 90 HE2 PHE 90 3.451 -0.692 0.810 684 HE2 PHE 90 HE1 PHE 90 2.801 3.254 -0.646 685 HZ PHE 90 HZ PHE 90 2.080 0.913 -0.456 686 H ASP 91 H ASP 91 8.309 0.596 2.979 687 HA ASP 91 HA ASP 91 8.444 -1.804 1.262 688 HB2 ASP 91 HB2 ASP 91 10.207 -1.084 3.638 689 HB3 ASP 91 HB3 ASP 91 10.154 -2.689 2.911 690 H ASP 92 H ASP 92 6.871 -3.160 1.722 691 HA ASP 92 HA ASP 92 5.534 -3.315 4.320 692 HB2 ASP 92 HB2 ASP 92 5.111 -5.088 1.872 693 HB3 ASP 92 HB3 ASP 92 4.001 -4.853 3.220 694 H GLY 93 H GLY 93 5.246 -5.592 5.284 695 HA2 GLY 93 HA2 GLY 93 6.992 -7.730 4.733 696 HA3 GLY 93 HA3 GLY 93 7.766 -6.725 5.945 697 H PHE 94 H PHE 94 5.159 -5.997 7.161 698 HA PHE 94 HA PHE 94 3.695 -6.609 8.775 699 HB2 PHE 94 HB2 PHE 94 3.947 -9.420 7.624 700 HB3 PHE 94 HB3 PHE 94 2.782 -8.955 8.853 701 HD1 PHE 94 HD1 PHE 94 3.692 -8.621 5.276 702 HD2 PHE 94 HD2 PHE 94 0.766 -7.721 8.267 703 HE1 PHE 94 HE1 PHE 94 2.068 -8.052 3.522 704 HE2 PHE 94 HE2 PHE 94 -0.849 -7.153 6.503 705 HZ PHE 94 HZ PHE 94 -0.205 -7.329 4.131 706 H ALA 95 H ALA 95 3.485 -7.831 10.853 707 HA ALA 95 HA ALA 95 6.066 -8.832 11.925 708 HB1 ALA 95 HB1 ALA 95 4.302 -6.761 13.283 709 HB2 ALA 95 HB2 ALA 95 5.850 -6.436 12.502 710 HB3 ALA 95 HB3 ALA 95 5.788 -7.460 13.934 711 H ASP 96 H ASP 96 5.824 -10.069 13.942 712 HA ASP 96 HA ASP 96 3.413 -11.751 13.867 713 HB2 ASP 96 HB2 ASP 96 4.689 -13.427 14.894 714 HB3 ASP 96 HB3 ASP 96 5.905 -12.575 13.956 715 H GLU 97 H GLU 97 3.191 -12.670 16.502 716 HA GLU 97 HA GLU 97 1.542 -10.776 17.751 717 HB2 GLU 97 HB2 GLU 97 1.452 -12.338 19.654 718 HB3 GLU 97 HB3 GLU 97 1.330 -13.196 18.119 719 HG2 GLU 97 HG2 GLU 97 3.760 -13.787 18.302 720 HG3 GLU 97 HG3 GLU 97 3.798 -13.012 19.882 721 H HIS 98 H HIS 98 5.003 -11.198 18.047 722 HA HIS 98 HA HIS 98 5.218 -9.515 20.456 723 HB2 HIS 98 HB2 HIS 98 7.414 -10.919 18.870 724 HB3 HIS 98 HB3 HIS 98 7.611 -10.127 20.433 725 HD1 HIS 98 HD1 HIS 98 5.862 -11.244 22.343 726 HD2 HIS 98 HD2 HIS 98 7.025 -13.583 19.113 727 HE1 HIS 98 HE1 HIS 98 5.410 -13.613 23.028 728 HE2 HIS 98 HE2 HIS 98 6.223 -15.017 21.108 729 H GLY 99 H GLY 99 5.448 -9.189 17.027 730 HA2 GLY 99 HA2 GLY 99 5.413 -7.056 15.967 731 HA3 GLY 99 HA3 GLY 99 6.311 -6.371 17.313 732 H ALA 100 H ALA 100 7.583 -9.357 16.260 733 HA ALA 100 HA ALA 100 9.941 -8.124 15.057 734 HB1 ALA 100 HB1 ALA 100 10.204 -9.998 16.620 735 HB2 ALA 100 HB2 ALA 100 10.836 -10.431 15.032 736 HB3 ALA 100 HB3 ALA 100 9.266 -11.051 15.556 737 HA PRO 101 HA PRO 101 8.590 -8.316 10.791 738 HB2 PRO 101 HB2 PRO 101 10.972 -8.848 9.449 739 HB3 PRO 101 HB3 PRO 101 10.525 -7.265 10.100 740 HG2 PRO 101 HG2 PRO 101 12.277 -9.390 11.332 741 HG3 PRO 101 HG3 PRO 101 12.554 -7.638 11.229 742 HD2 PRO 101 HD2 PRO 101 11.657 -8.760 13.504 743 HD3 PRO 101 HD3 PRO 101 11.054 -7.170 12.983 744 H VAL 102 H VAL 102 7.520 -9.850 9.658 745 HA VAL 102 HA VAL 102 7.905 -12.654 10.152 746 HB VAL 102 HB VAL 102 6.042 -11.303 8.146 747 HG11 VAL 102 HG11 VAL 102 6.369 -13.688 7.620 748 HG12 VAL 102 HG12 VAL 102 4.737 -13.401 8.222 749 HG13 VAL 102 HG13 VAL 102 5.951 -14.127 9.279 750 HG21 VAL 102 HG21 VAL 102 4.279 -11.558 9.849 751 HG22 VAL 102 HG22 VAL 102 5.592 -10.537 10.438 752 HG23 VAL 102 HG23 VAL 102 5.463 -12.208 10.988 753 H ASP 103 H ASP 103 9.787 -13.412 9.357 754 HA ASP 103 HA ASP 103 11.018 -12.806 6.866 755 HB2 ASP 103 HB2 ASP 103 12.491 -14.772 7.389 756 HB3 ASP 103 HB3 ASP 103 12.360 -13.624 8.713 757 H GLU 104 H GLU 104 8.642 -15.154 7.805 758 HA GLU 104 HA GLU 104 8.464 -16.880 5.651 759 HB2 GLU 104 HB2 GLU 104 7.080 -17.133 7.638 760 HB3 GLU 104 HB3 GLU 104 6.316 -15.576 7.361 761 HG2 GLU 104 HG2 GLU 104 5.386 -16.575 5.203 762 HG3 GLU 104 HG3 GLU 104 5.919 -18.135 5.815 763 H LEU 105 H LEU 105 7.119 -13.578 5.946 764 HA LEU 105 HA LEU 105 6.062 -13.584 3.212 765 HB2 LEU 105 HB2 LEU 105 5.938 -11.451 5.381 766 HB3 LEU 105 HB3 LEU 105 5.075 -11.400 3.848 767 HG LEU 105 HG LEU 105 4.608 -13.353 6.133 768 HD11 LEU 105 HD11 LEU 105 2.380 -12.358 6.267 769 HD12 LEU 105 HD12 LEU 105 2.798 -11.212 4.990 770 HD13 LEU 105 HD13 LEU 105 3.642 -11.158 6.540 771 HD21 LEU 105 HD21 LEU 105 3.288 -13.313 3.409 772 HD22 LEU 105 HD22 LEU 105 2.791 -14.309 4.781 773 HD23 LEU 105 HD23 LEU 105 4.369 -14.557 4.044 774 H GLY 106 H GLY 106 8.762 -12.325 5.013 775 HA2 GLY 106 HA2 GLY 106 10.709 -11.307 4.355 776 HA3 GLY 106 HA3 GLY 106 10.209 -11.513 2.687 777 H VAL 107 H VAL 107 11.254 -9.349 2.426 778 HA VAL 107 HA VAL 107 9.462 -7.097 3.225 779 HB VAL 107 HB VAL 107 12.458 -6.896 2.655 780 HG11 VAL 107 HG11 VAL 107 10.523 -4.852 3.814 781 HG12 VAL 107 HG12 VAL 107 11.228 -4.810 2.197 782 HG13 VAL 107 HG13 VAL 107 12.262 -4.616 3.612 783 HG21 VAL 107 HG21 VAL 107 12.793 -6.600 5.100 784 HG22 VAL 107 HG22 VAL 107 12.151 -8.198 4.715 785 HG23 VAL 107 HG23 VAL 107 11.084 -6.955 5.369 786 H THR 108 H THR 108 8.320 -6.439 1.459 787 HA THR 108 HA THR 108 9.591 -6.439 -1.237 788 HB THR 108 HB THR 108 7.571 -7.760 -1.348 789 HG1 THR 108 HG1 THR 108 6.263 -6.338 -2.776 790 HG21 THR 108 HG21 THR 108 6.401 -6.920 0.676 791 HG22 THR 108 HG22 THR 108 5.335 -6.909 -0.730 792 HG23 THR 108 HG23 THR 108 6.050 -5.401 -0.154 793 H HIS 109 H HIS 109 9.401 -4.586 -2.568 794 HA HIS 109 HA HIS 109 9.268 -2.060 -1.027 795 HB2 HIS 109 HB2 HIS 109 11.500 -2.742 -1.927 796 HB3 HIS 109 HB3 HIS 109 10.842 -2.704 -3.557 797 HD1 HIS 109 HD1 HIS 109 11.528 -0.421 -0.644 798 HD2 HIS 109 HD2 HIS 109 10.890 -0.165 -4.719 799 HE1 HIS 109 HE1 HIS 109 11.907 1.953 -1.258 800 HE2 HIS 109 HE2 HIS 109 11.312 2.114 -3.658 801 H ALA 110 H ALA 110 7.264 -1.166 -1.397 802 HA ALA 110 HA ALA 110 6.007 -1.329 -4.066 803 HB1 ALA 110 HB1 ALA 110 4.652 -2.033 -2.148 804 HB2 ALA 110 HB2 ALA 110 3.941 -0.623 -2.938 805 HB3 ALA 110 HB3 ALA 110 4.828 -0.434 -1.425 806 H THR 111 H THR 111 5.630 0.443 -5.357 807 HA THR 111 HA THR 111 6.770 3.064 -4.498 808 HB THR 111 HB THR 111 6.821 1.934 -7.348 809 HG1 THR 111 HG1 THR 111 8.178 0.659 -6.060 810 HG21 THR 111 HG21 THR 111 8.259 4.298 -6.095 811 HG22 THR 111 HG22 THR 111 6.975 4.374 -7.303 812 HG23 THR 111 HG23 THR 111 8.549 3.689 -7.722 813 H VAL 112 H VAL 112 5.050 4.413 -4.216 814 HA VAL 112 HA VAL 112 2.583 4.193 -5.806 815 HB VAL 112 HB VAL 112 3.262 5.969 -3.415 816 HG11 VAL 112 HG11 VAL 112 1.496 7.012 -4.779 817 HG12 VAL 112 HG12 VAL 112 0.827 6.418 -3.256 818 HG13 VAL 112 HG13 VAL 112 0.568 5.510 -4.745 819 HG21 VAL 112 HG21 VAL 112 1.629 3.412 -3.522 820 HG22 VAL 112 HG22 VAL 112 1.870 4.422 -2.094 821 HG23 VAL 112 HG23 VAL 112 3.241 3.582 -2.821 822 H LYS 113 H LYS 113 2.293 5.453 -7.567 823 HA LYS 113 HA LYS 113 3.733 8.037 -7.820 824 HB2 LYS 113 HB2 LYS 113 3.580 5.739 -9.810 825 HB3 LYS 113 HB3 LYS 113 4.040 7.368 -10.296 826 HG2 LYS 113 HG2 LYS 113 6.039 7.319 -9.016 827 HG3 LYS 113 HG3 LYS 113 5.515 5.921 -8.081 828 HD2 LYS 113 HD2 LYS 113 7.307 5.417 -9.769 829 HD3 LYS 113 HD3 LYS 113 5.850 4.440 -9.954 830 HE2 LYS 113 HE2 LYS 113 6.780 5.244 -12.120 831 HE3 LYS 113 HE3 LYS 113 5.131 5.786 -11.831 832 HZ1 LYS 113 HZ1 LYS 113 6.595 7.526 -12.730 833 HZ2 LYS 113 HZ2 LYS 113 7.546 7.439 -11.337 834 HZ3 LYS 113 HZ3 LYS 113 5.939 7.948 -11.229 835 H LEU 114 H LEU 114 2.263 9.591 -7.918 836 HA LEU 114 HA LEU 114 -0.411 9.153 -9.023 837 HB2 LEU 114 HB2 LEU 114 0.770 11.519 -7.516 838 HB3 LEU 114 HB3 LEU 114 -0.888 11.443 -8.096 839 HG LEU 114 HG LEU 114 0.306 9.516 -6.055 840 HD11 LEU 114 HD11 LEU 114 -1.124 10.653 -4.403 841 HD12 LEU 114 HD12 LEU 114 -1.592 11.846 -5.619 842 HD13 LEU 114 HD13 LEU 114 0.085 11.740 -5.080 843 HD21 LEU 114 HD21 LEU 114 -2.555 9.842 -6.996 844 HD22 LEU 114 HD22 LEU 114 -1.988 8.747 -5.732 845 HD23 LEU 114 HD23 LEU 114 -1.475 8.504 -7.398 846 H GLU 115 H GLU 115 -1.270 10.175 -10.748 847 HA GLU 115 HA GLU 115 0.416 11.940 -12.424 848 HB2 GLU 115 HB2 GLU 115 -1.588 9.804 -13.258 849 HB3 GLU 115 HB3 GLU 115 -0.897 10.978 -14.378 850 HG2 GLU 115 HG2 GLU 115 1.345 10.107 -13.968 851 HG3 GLU 115 HG3 GLU 115 0.714 8.971 -12.772 852 HA PRO 116 HA PRO 116 -3.110 14.786 -11.718 853 HB2 PRO 116 HB2 PRO 116 -2.094 16.929 -13.103 854 HB3 PRO 116 HB3 PRO 116 -1.562 16.495 -11.476 855 HG2 PRO 116 HG2 PRO 116 -0.243 15.911 -14.119 856 HG3 PRO 116 HG3 PRO 116 0.498 16.443 -12.594 857 HD2 PRO 116 HD2 PRO 116 0.529 13.838 -13.431 858 HD3 PRO 116 HD3 PRO 116 0.529 14.284 -11.715 859 H LEU 117 H LEU 117 -4.736 13.755 -12.896 860 HA LEU 117 HA LEU 117 -4.842 13.987 -15.847 861 HB2 LEU 117 HB2 LEU 117 -6.764 12.499 -14.023 862 HB3 LEU 117 HB3 LEU 117 -6.644 12.360 -15.768 863 HG LEU 117 HG LEU 117 -4.630 11.342 -13.723 864 HD11 LEU 117 HD11 LEU 117 -6.647 9.989 -13.826 865 HD12 LEU 117 HD12 LEU 117 -5.297 9.108 -14.533 866 HD13 LEU 117 HD13 LEU 117 -6.512 9.845 -15.581 867 HD21 LEU 117 HD21 LEU 117 -4.475 11.164 -16.756 868 HD22 LEU 117 HD22 LEU 117 -3.395 10.355 -15.614 869 HD23 LEU 117 HD23 LEU 117 -3.420 12.113 -15.702 870 H GLU 118 H GLU 118 -5.137 16.385 -14.512 871 HA GLU 118 HA GLU 118 -6.290 18.289 -14.394 872 HB2 GLU 118 HB2 GLU 118 -6.979 17.416 -16.765 873 HB3 GLU 118 HB3 GLU 118 -8.540 17.082 -16.042 874 HG2 GLU 118 HG2 GLU 118 -7.235 19.815 -16.116 875 HG3 GLU 118 HG3 GLU 118 -8.395 19.237 -17.302 876 H ASN 119 H ASN 119 -9.344 16.447 -14.540 877 HA ASN 119 HA ASN 119 -10.119 17.415 -11.888 878 HB2 ASN 119 HB2 ASN 119 -12.362 16.553 -12.454 879 HB3 ASN 119 HB3 ASN 119 -11.740 17.573 -13.744 880 HD21 ASN 119 HD21 ASN 119 -13.808 15.453 -13.793 881 HD22 ASN 119 HD22 ASN 119 -13.299 14.351 -15.015 882 H ARG 120 H ARG 120 -9.035 14.479 -13.382 883 HA ARG 120 HA ARG 120 -9.543 12.884 -10.933 884 HB2 ARG 120 HB2 ARG 120 -8.691 11.907 -13.691 885 HB3 ARG 120 HB3 ARG 120 -9.145 10.903 -12.315 886 HG2 ARG 120 HG2 ARG 120 -11.461 11.866 -12.442 887 HG3 ARG 120 HG3 ARG 120 -10.979 12.740 -13.904 888 HD2 ARG 120 HD2 ARG 120 -11.079 9.724 -13.519 889 HD3 ARG 120 HD3 ARG 120 -12.155 10.698 -14.523 890 HE ARG 120 HE ARG 120 -9.935 11.255 -15.761 891 HH11 ARG 120 HH11 ARG 120 -10.747 8.147 -14.457 892 HH12 ARG 120 HH12 ARG 120 -9.755 7.301 -15.587 893 HH21 ARG 120 HH21 ARG 120 -8.668 10.132 -17.191 894 HH22 ARG 120 HH22 ARG 120 -8.596 8.406 -17.114 895 H THR 121 H THR 121 -7.744 11.226 -10.514 896 HA THR 121 HA THR 121 -5.031 11.930 -11.358 897 HB THR 121 HB THR 121 -5.822 11.874 -8.402 898 HG1 THR 121 HG1 THR 121 -6.085 13.899 -9.528 899 HG21 THR 121 HG21 THR 121 -3.028 12.025 -9.607 900 HG22 THR 121 HG22 THR 121 -3.682 10.678 -8.668 901 HG23 THR 121 HG23 THR 121 -3.418 12.244 -7.898 902 H ARG 122 H ARG 122 -3.699 10.120 -11.437 903 HA ARG 122 HA ARG 122 -4.983 7.513 -10.896 904 HB2 ARG 122 HB2 ARG 122 -4.687 8.053 -13.268 905 HB3 ARG 122 HB3 ARG 122 -2.964 8.298 -13.025 906 HG2 ARG 122 HG2 ARG 122 -2.565 5.984 -12.692 907 HG3 ARG 122 HG3 ARG 122 -4.280 5.635 -12.446 908 HD2 ARG 122 HD2 ARG 122 -3.432 4.906 -14.668 909 HD3 ARG 122 HD3 ARG 122 -4.763 6.058 -14.784 910 HE ARG 122 HE ARG 122 -1.974 6.963 -15.021 911 HH11 ARG 122 HH11 ARG 122 -5.123 6.731 -16.446 912 HH12 ARG 122 HH12 ARG 122 -4.646 7.612 -17.853 913 HH21 ARG 122 HH21 ARG 122 -1.417 8.098 -16.789 914 HH22 ARG 122 HH22 ARG 122 -2.575 8.384 -18.043 915 H MET 123 H MET 123 -4.081 6.322 -9.398 916 HA MET 123 HA MET 123 -1.340 6.733 -8.441 917 HB2 MET 123 HB2 MET 123 -3.250 6.862 -6.801 918 HB3 MET 123 HB3 MET 123 -3.635 5.185 -7.158 919 HG2 MET 123 HG2 MET 123 -1.334 4.562 -6.348 920 HG3 MET 123 HG3 MET 123 -1.119 6.243 -5.860 921 HE1 MET 123 HE1 MET 123 -3.029 2.920 -5.317 922 HE2 MET 123 HE2 MET 123 -4.386 3.997 -5.660 923 HE3 MET 123 HE3 MET 123 -4.176 3.323 -4.043 924 H THR 124 H THR 124 0.059 5.407 -9.475 925 HA THR 124 HA THR 124 -0.658 2.560 -9.941 926 HB THR 124 HB THR 124 1.589 4.173 -11.245 927 HG1 THR 124 HG1 THR 124 0.201 4.671 -12.764 928 HG21 THR 124 HG21 THR 124 1.762 2.277 -12.819 929 HG22 THR 124 HG22 THR 124 0.541 1.394 -11.904 930 HG23 THR 124 HG23 THR 124 2.102 1.756 -11.166 931 H ILE 125 H ILE 125 0.097 1.267 -8.333 932 HA ILE 125 HA ILE 125 2.542 2.006 -6.834 933 HB ILE 125 HB ILE 125 0.439 -0.050 -6.022 934 HG12 ILE 125 HG12 ILE 125 0.698 2.853 -5.103 935 HG13 ILE 125 HG13 ILE 125 -0.589 2.214 -6.121 936 HG21 ILE 125 HG21 ILE 125 1.480 0.116 -3.777 937 HG22 ILE 125 HG22 ILE 125 2.674 1.249 -4.412 938 HG23 ILE 125 HG23 ILE 125 2.648 -0.420 -4.989 939 HD11 ILE 125 HD11 ILE 125 -1.326 0.785 -4.244 940 HD12 ILE 125 HD12 ILE 125 -1.368 2.503 -3.857 941 HD13 ILE 125 HD13 ILE 125 -0.064 1.495 -3.230 942 H ILE 126 H ILE 126 4.356 0.969 -7.518 943 HA ILE 126 HA ILE 126 4.160 -1.698 -8.769 944 HB ILE 126 HB ILE 126 6.445 0.305 -9.056 945 HG12 ILE 126 HG12 ILE 126 5.407 0.359 -11.559 946 HG13 ILE 126 HG13 ILE 126 3.926 -0.018 -10.699 947 HG21 ILE 126 HG21 ILE 126 7.191 -1.122 -10.924 948 HG22 ILE 126 HG22 ILE 126 5.876 -2.249 -10.586 949 HG23 ILE 126 HG23 ILE 126 7.155 -2.003 -9.394 950 HD11 ILE 126 HD11 ILE 126 4.193 2.022 -9.357 951 HD12 ILE 126 HD12 ILE 126 4.134 2.360 -11.086 952 HD13 ILE 126 HD13 ILE 126 5.678 2.395 -10.238 953 H SER 127 H SER 127 4.689 -3.290 -7.379 954 HA SER 127 HA SER 127 6.508 -2.838 -5.107 955 HB2 SER 127 HB2 SER 127 4.521 -5.106 -5.575 956 HB3 SER 127 HB3 SER 127 5.457 -4.834 -4.103 957 HG SER 127 HG SER 127 3.826 -3.651 -3.522 958 H THR 128 H THR 128 8.582 -3.457 -5.480 959 HA THR 128 HA THR 128 9.223 -5.587 -7.375 960 HB THR 128 HB THR 128 11.606 -4.817 -7.051 961 HG1 THR 128 HG1 THR 128 11.574 -3.889 -5.041 962 HG21 THR 128 HG21 THR 128 11.362 -2.676 -8.277 963 HG22 THR 128 HG22 THR 128 9.650 -2.626 -7.858 964 HG23 THR 128 HG23 THR 128 10.258 -3.899 -8.922 965 H PHE 129 H PHE 129 9.746 -7.563 -6.761 966 HA PHE 129 HA PHE 129 10.193 -8.242 -3.934 967 HB2 PHE 129 HB2 PHE 129 9.322 -10.059 -6.216 968 HB3 PHE 129 HB3 PHE 129 9.427 -10.512 -4.522 969 HD1 PHE 129 HD2 PHE 129 7.568 -8.415 -6.967 970 HD2 PHE 129 HD1 PHE 129 7.627 -9.997 -2.996 971 HE1 PHE 129 HE2 PHE 129 5.262 -7.664 -6.624 972 HE2 PHE 129 HE1 PHE 129 5.314 -9.235 -2.675 973 HZ PHE 129 HZ PHE 129 4.129 -8.064 -4.479 974 H GLU 130 H GLU 130 11.644 -10.118 -3.519 975 HA GLU 130 HA GLU 130 14.157 -9.847 -5.063 976 HB2 GLU 130 HB2 GLU 130 15.277 -10.592 -3.003 977 HB3 GLU 130 HB3 GLU 130 14.227 -9.215 -2.687 978 HG2 GLU 130 HG2 GLU 130 12.470 -10.944 -1.909 979 HG3 GLU 130 HG3 GLU 130 13.787 -12.117 -1.919 980 H SER 131 H SER 131 11.764 -12.245 -4.021 981 HA SER 131 HA SER 131 13.203 -14.369 -5.509 982 HB2 SER 131 HB2 SER 131 11.853 -14.759 -2.793 983 HB3 SER 131 HB3 SER 131 12.673 -16.000 -3.742 984 HG SER 131 HG SER 131 13.879 -14.911 -1.966 985 H GLU 132 H GLU 132 11.920 -15.653 -6.765 986 HA GLU 132 HA GLU 132 9.257 -14.987 -7.425 987 HB2 GLU 132 HB2 GLU 132 10.812 -16.063 -8.987 988 HB3 GLU 132 HB3 GLU 132 10.878 -17.505 -7.990 989 HG2 GLU 132 HG2 GLU 132 8.210 -16.670 -9.110 990 HG3 GLU 132 HG3 GLU 132 9.392 -17.369 -10.211 991 H GLU 133 H GLU 133 10.547 -17.594 -5.358 992 HA GLU 133 HA GLU 133 8.090 -18.849 -4.703 993 HB2 GLU 133 HB2 GLU 133 9.338 -19.887 -2.824 994 HB3 GLU 133 HB3 GLU 133 10.227 -19.965 -4.341 995 HG2 GLU 133 HG2 GLU 133 11.603 -18.020 -3.616 996 HG3 GLU 133 HG3 GLU 133 10.750 -18.016 -2.073 997 H GLN 134 H GLN 134 9.708 -16.025 -3.316 998 HA GLN 134 HA GLN 134 7.980 -15.772 -1.013 999 HB2 GLN 134 HB2 GLN 134 10.369 -14.887 -1.154 1000 HB3 GLN 134 HB3 GLN 134 9.761 -13.614 -2.209 1001 HG2 GLN 134 HG2 GLN 134 8.195 -12.939 -0.330 1002 HG3 GLN 134 HG3 GLN 134 9.030 -14.104 0.697 1003 HE21 GLN 134 HE21 GLN 134 9.162 -10.991 -0.764 1004 HE22 GLN 134 HE22 GLN 134 10.632 -10.475 -0.031 1005 H MET 135 H MET 135 8.168 -14.449 -4.242 1006 HA MET 135 HA MET 135 6.142 -12.497 -4.214 1007 HB2 MET 135 HB2 MET 135 7.761 -12.604 -6.004 1008 HB3 MET 135 HB3 MET 135 7.313 -14.251 -6.402 1009 HG2 MET 135 HG2 MET 135 6.543 -12.587 -8.046 1010 HG3 MET 135 HG3 MET 135 5.218 -13.517 -7.335 1011 HE1 MET 135 HE1 MET 135 3.901 -9.769 -7.994 1012 HE2 MET 135 HE2 MET 135 3.769 -11.440 -8.546 1013 HE3 MET 135 HE3 MET 135 5.227 -10.506 -8.897 1014 H GLN 136 H GLN 136 6.016 -16.002 -4.911 1015 HA GLN 136 HA GLN 136 3.235 -16.256 -5.387 1016 HB2 GLN 136 HB2 GLN 136 5.161 -18.286 -4.181 1017 HB3 GLN 136 HB3 GLN 136 3.534 -18.663 -4.741 1018 HG2 GLN 136 HG2 GLN 136 5.824 -17.676 -6.454 1019 HG3 GLN 136 HG3 GLN 136 5.235 -19.332 -6.374 1020 HE21 GLN 136 HE21 GLN 136 5.451 -17.622 -8.695 1021 HE22 GLN 136 HE22 GLN 136 3.860 -17.447 -9.344 1022 H LYS 137 H LYS 137 5.127 -16.338 -2.373 1023 HA LYS 137 HA LYS 137 3.159 -17.300 -0.607 1024 HB2 LYS 137 HB2 LYS 137 5.829 -16.700 -0.342 1025 HB3 LYS 137 HB3 LYS 137 5.141 -15.350 0.544 1026 HG2 LYS 137 HG2 LYS 137 4.684 -18.291 1.121 1027 HG3 LYS 137 HG3 LYS 137 5.724 -17.210 2.041 1028 HD2 LYS 137 HD2 LYS 137 3.821 -15.983 2.868 1029 HD3 LYS 137 HD3 LYS 137 2.722 -16.796 1.755 1030 HE2 LYS 137 HE2 LYS 137 3.036 -18.908 2.938 1031 HE3 LYS 137 HE3 LYS 137 4.224 -18.163 4.010 1032 HZ1 LYS 137 HZ1 LYS 137 1.404 -17.281 3.809 1033 HZ2 LYS 137 HZ2 LYS 137 2.551 -16.788 4.951 1034 HZ3 LYS 137 HZ3 LYS 137 1.973 -18.374 4.962 1035 H MET 138 H MET 138 3.944 -13.984 -1.565 1036 HA MET 138 HA MET 138 2.186 -12.489 0.028 1037 HB2 MET 138 HB2 MET 138 2.951 -11.975 -2.877 1038 HB3 MET 138 HB3 MET 138 2.342 -10.772 -1.748 1039 HG2 MET 138 HG2 MET 138 4.879 -12.218 -1.056 1040 HG3 MET 138 HG3 MET 138 4.924 -10.972 -2.293 1041 HE1 MET 138 HE1 MET 138 4.126 -10.260 2.199 1042 HE2 MET 138 HE2 MET 138 4.816 -11.732 1.515 1043 HE3 MET 138 HE3 MET 138 3.105 -11.361 1.272 1044 H ALA 139 H ALA 139 1.613 -14.004 -3.144 1045 HA ALA 139 HA ALA 139 -1.140 -13.286 -3.396 1046 HB1 ALA 139 HB1 ALA 139 0.443 -15.452 -4.824 1047 HB2 ALA 139 HB2 ALA 139 0.301 -13.768 -5.335 1048 HB3 ALA 139 HB3 ALA 139 -1.124 -14.813 -5.336 1049 H GLU 140 H GLU 140 0.503 -16.069 -1.948 1050 HA GLU 140 HA GLU 140 -1.746 -17.792 -1.598 1051 HB2 GLU 140 HB2 GLU 140 0.852 -17.607 -0.005 1052 HB3 GLU 140 HB3 GLU 140 -0.326 -18.907 0.169 1053 HG2 GLU 140 HG2 GLU 140 1.263 -18.261 -2.334 1054 HG3 GLU 140 HG3 GLU 140 1.582 -19.584 -1.219 1055 H MET 141 H MET 141 -0.418 -15.162 0.303 1056 HA MET 141 HA MET 141 -2.079 -15.444 2.630 1057 HB2 MET 141 HB2 MET 141 -0.489 -13.096 1.523 1058 HB3 MET 141 HB3 MET 141 -1.241 -13.111 3.115 1059 HG2 MET 141 HG2 MET 141 0.830 -15.134 2.250 1060 HG3 MET 141 HG3 MET 141 1.235 -13.628 3.062 1061 HE1 MET 141 HE1 MET 141 0.528 -13.049 5.564 1062 HE2 MET 141 HE2 MET 141 -0.453 -14.116 6.572 1063 HE3 MET 141 HE3 MET 141 -1.173 -13.316 5.174 1064 H GLY 142 H GLY 142 -2.810 -14.427 -0.522 1065 HA2 GLY 142 HA2 GLY 142 -4.560 -13.307 -1.490 1066 HA3 GLY 142 HA3 GLY 142 -5.364 -13.290 0.076 1067 H MET 143 H MET 143 -2.155 -11.963 -0.188 1068 HA MET 143 HA MET 143 -2.883 -9.400 0.797 1069 HB2 MET 143 HB2 MET 143 -0.659 -10.407 1.206 1070 HB3 MET 143 HB3 MET 143 -0.280 -10.315 -0.505 1071 HG2 MET 143 HG2 MET 143 -0.377 -7.837 -0.369 1072 HG3 MET 143 HG3 MET 143 -0.688 -7.966 1.366 1073 HE1 MET 143 HE1 MET 143 3.067 -6.673 1.100 1074 HE2 MET 143 HE2 MET 143 1.457 -6.304 1.719 1075 HE3 MET 143 HE3 MET 143 1.759 -6.289 -0.020 1076 H GLU 144 H GLU 144 -2.239 -10.616 -2.471 1077 HA GLU 144 HA GLU 144 -2.253 -8.281 -4.001 1078 HB2 GLU 144 HB2 GLU 144 -1.821 -10.462 -5.027 1079 HB3 GLU 144 HB3 GLU 144 -3.433 -11.028 -4.607 1080 HG2 GLU 144 HG2 GLU 144 -4.365 -9.246 -6.158 1081 HG3 GLU 144 HG3 GLU 144 -2.713 -8.921 -6.672 1082 H GLU 145 H GLU 145 -5.085 -10.352 -3.242 1083 HA GLU 145 HA GLU 145 -7.057 -8.640 -4.330 1084 HB2 GLU 145 HB2 GLU 145 -7.356 -10.873 -2.277 1085 HB3 GLU 145 HB3 GLU 145 -8.681 -10.138 -3.177 1086 HG2 GLU 145 HG2 GLU 145 -7.698 -10.960 -5.294 1087 HG3 GLU 145 HG3 GLU 145 -6.381 -11.710 -4.389 1088 H GLY 146 H GLY 146 -6.086 -9.216 -0.954 1089 HA2 GLY 146 HA2 GLY 146 -7.874 -7.527 0.369 1090 HA3 GLY 146 HA3 GLY 146 -6.302 -8.017 0.978 1091 H MET 147 H MET 147 -4.686 -6.761 -1.036 1092 HA MET 147 HA MET 147 -4.544 -4.059 -0.138 1093 HB2 MET 147 HB2 MET 147 -2.579 -5.372 -0.939 1094 HB3 MET 147 HB3 MET 147 -3.224 -5.331 -2.573 1095 HG2 MET 147 HG2 MET 147 -2.971 -2.890 -2.617 1096 HG3 MET 147 HG3 MET 147 -2.358 -2.919 -0.959 1097 HE1 MET 147 HE1 MET 147 -0.182 -1.555 -1.754 1098 HE2 MET 147 HE2 MET 147 -0.780 -1.539 -3.416 1099 HE3 MET 147 HE3 MET 147 0.865 -2.079 -3.075 1100 H ARG 148 H ARG 148 -5.853 -5.573 -3.094 1101 HA ARG 148 HA ARG 148 -6.643 -3.228 -4.473 1102 HB2 ARG 148 HB2 ARG 148 -7.790 -6.046 -4.511 1103 HB3 ARG 148 HB3 ARG 148 -8.328 -4.777 -5.612 1104 HG2 ARG 148 HG2 ARG 148 -6.247 -4.688 -6.712 1105 HG3 ARG 148 HG3 ARG 148 -5.430 -5.593 -5.437 1106 HD2 ARG 148 HD2 ARG 148 -5.738 -7.035 -7.356 1107 HD3 ARG 148 HD3 ARG 148 -6.762 -7.607 -6.044 1108 HE ARG 148 HE ARG 148 -8.275 -5.890 -7.682 1109 HH11 ARG 148 HH11 ARG 148 -6.837 -9.052 -7.860 1110 HH12 ARG 148 HH12 ARG 148 -7.979 -9.616 -9.022 1111 HH21 ARG 148 HH21 ARG 148 -9.707 -6.628 -9.164 1112 HH22 ARG 148 HH22 ARG 148 -9.592 -8.244 -9.765 1113 H GLU 149 H GLU 149 -8.402 -5.259 -2.107 1114 HA GLU 149 HA GLU 149 -10.868 -3.905 -2.065 1115 HB2 GLU 149 HB2 GLU 149 -9.557 -5.194 0.362 1116 HB3 GLU 149 HB3 GLU 149 -11.280 -4.917 0.118 1117 HG2 GLU 149 HG2 GLU 149 -9.489 -6.924 -1.258 1118 HG3 GLU 149 HG3 GLU 149 -10.845 -7.245 -0.192 1119 H ALA 150 H ALA 150 -7.909 -3.337 -0.209 1120 HA ALA 150 HA ALA 150 -8.709 -1.155 1.378 1121 HB1 ALA 150 HB1 ALA 150 -6.618 -2.417 1.732 1122 HB2 ALA 150 HB2 ALA 150 -6.297 -0.687 1.588 1123 HB3 ALA 150 HB3 ALA 150 -5.963 -1.765 0.228 1124 H ILE 151 H ILE 151 -7.083 -1.190 -1.797 1125 HA ILE 151 HA ILE 151 -7.046 1.619 -2.218 1126 HB ILE 151 HB ILE 151 -6.689 -0.703 -4.153 1127 HG12 ILE 151 HG12 ILE 151 -4.613 1.113 -2.839 1128 HG13 ILE 151 HG13 ILE 151 -5.004 -0.515 -2.298 1129 HG21 ILE 151 HG21 ILE 151 -6.098 2.233 -4.674 1130 HG22 ILE 151 HG22 ILE 151 -7.339 1.260 -5.467 1131 HG23 ILE 151 HG23 ILE 151 -5.635 0.894 -5.730 1132 HD11 ILE 151 HD11 ILE 151 -4.192 -1.400 -4.451 1133 HD12 ILE 151 HD12 ILE 151 -2.956 -0.516 -3.558 1134 HD13 ILE 151 HD13 ILE 151 -3.753 0.239 -4.939 1135 H GLU 152 H GLU 152 -9.455 -0.790 -2.819 1136 HA GLU 152 HA GLU 152 -11.174 0.689 -4.570 1137 HB2 GLU 152 HB2 GLU 152 -11.415 -1.824 -2.902 1138 HB3 GLU 152 HB3 GLU 152 -12.886 -1.106 -3.552 1139 HG2 GLU 152 HG2 GLU 152 -10.507 -1.890 -5.259 1140 HG3 GLU 152 HG3 GLU 152 -11.848 -2.981 -4.913 1141 H GLN 153 H GLN 153 -10.694 0.656 -1.076 1142 HA GLN 153 HA GLN 153 -13.120 2.237 -0.570 1143 HB2 GLN 153 HB2 GLN 153 -10.952 1.402 1.394 1144 HB3 GLN 153 HB3 GLN 153 -12.478 2.189 1.795 1145 HG2 GLN 153 HG2 GLN 153 -13.564 0.069 0.678 1146 HG3 GLN 153 HG3 GLN 153 -11.973 -0.658 0.931 1147 HE21 GLN 153 HE21 GLN 153 -11.144 -0.605 3.160 1148 HE22 GLN 153 HE22 GLN 153 -12.263 -0.703 4.464 1149 H ILE 154 H ILE 154 -9.965 2.987 -1.596 1150 HA ILE 154 HA ILE 154 -9.483 5.449 -0.272 1151 HB ILE 154 HB ILE 154 -8.783 4.631 -3.121 1152 HG12 ILE 154 HG12 ILE 154 -7.090 4.679 -0.587 1153 HG13 ILE 154 HG13 ILE 154 -7.760 3.235 -1.336 1154 HG21 ILE 154 HG21 ILE 154 -8.766 7.088 -2.990 1155 HG22 ILE 154 HG22 ILE 154 -7.120 6.474 -3.118 1156 HG23 ILE 154 HG23 ILE 154 -7.732 7.024 -1.557 1157 HD11 ILE 154 HD11 ILE 154 -5.404 3.493 -1.824 1158 HD12 ILE 154 HD12 ILE 154 -5.700 5.063 -2.563 1159 HD13 ILE 154 HD13 ILE 154 -6.357 3.601 -3.300 1160 H ASP 155 H ASP 155 -11.499 4.662 -3.106 1161 HA ASP 155 HA ASP 155 -12.514 7.160 -3.803 1162 HB2 ASP 155 HB2 ASP 155 -13.980 4.486 -3.693 1163 HB3 ASP 155 HB3 ASP 155 -14.540 5.905 -4.575 1164 H ALA 156 H ALA 156 -13.561 4.972 -1.167 1165 HA ALA 156 HA ALA 156 -15.682 6.616 -0.183 1166 HB1 ALA 156 HB1 ALA 156 -15.587 4.208 0.326 1167 HB2 ALA 156 HB2 ALA 156 -15.656 5.158 1.812 1168 HB3 ALA 156 HB3 ALA 156 -14.123 4.440 1.291 1169 H VAL 157 H VAL 157 -12.210 6.628 0.446 1170 HA VAL 157 HA VAL 157 -12.315 8.297 2.816 1171 HB VAL 157 HB VAL 157 -9.948 7.730 0.970 1172 HG11 VAL 157 HG11 VAL 157 -9.531 9.729 2.363 1173 HG12 VAL 157 HG12 VAL 157 -8.519 8.387 2.896 1174 HG13 VAL 157 HG13 VAL 157 -9.959 8.824 3.819 1175 HG21 VAL 157 HG21 VAL 157 -9.304 6.014 2.632 1176 HG22 VAL 157 HG22 VAL 157 -10.866 5.654 1.899 1177 HG23 VAL 157 HG23 VAL 157 -10.790 6.325 3.529 1178 H LEU 158 H LEU 158 -11.691 8.879 -0.645 1179 HA LEU 158 HA LEU 158 -11.105 11.690 -0.354 1180 HB2 LEU 158 HB2 LEU 158 -11.710 10.128 -2.894 1181 HB3 LEU 158 HB3 LEU 158 -10.961 11.719 -2.805 1182 HG LEU 158 HG LEU 158 -9.749 9.073 -1.923 1183 HD11 LEU 158 HD11 LEU 158 -9.715 9.423 -4.329 1184 HD12 LEU 158 HD12 LEU 158 -8.089 9.494 -3.657 1185 HD13 LEU 158 HD13 LEU 158 -8.919 10.985 -4.117 1186 HD21 LEU 158 HD21 LEU 158 -9.099 10.764 -0.309 1187 HD22 LEU 158 HD22 LEU 158 -8.577 11.849 -1.601 1188 HD23 LEU 158 HD23 LEU 158 -7.724 10.328 -1.319 1189 H SER 159 H SER 159 -13.896 9.789 -1.360 1190 HA SER 159 HA SER 159 -15.491 12.125 -2.126 1191 HB2 SER 159 HB2 SER 159 -15.556 9.956 -3.453 1192 HB3 SER 159 HB3 SER 159 -16.304 9.188 -2.069 1193 HG SER 159 HG SER 159 -17.368 11.290 -3.649 1194 H GLU 160 H GLU 160 -15.601 9.398 0.150 1195 HA GLU 160 HA GLU 160 -16.790 8.848 1.961 1196 HB2 GLU 160 HB2 GLU 160 -16.995 11.858 2.380 1197 HB3 GLU 160 HB3 GLU 160 -17.392 10.643 3.589 1198 HG2 GLU 160 HG2 GLU 160 -15.042 9.825 3.520 1199 HG3 GLU 160 HG3 GLU 160 -14.654 11.091 2.357 1200 HA PRO 161 HA PRO 161 -20.990 8.409 0.713 1201 HB2 PRO 161 HB2 PRO 161 -22.354 7.700 2.943 1202 HB3 PRO 161 HB3 PRO 161 -21.027 6.707 2.321 1203 HG2 PRO 161 HG2 PRO 161 -20.961 8.775 4.537 1204 HG3 PRO 161 HG3 PRO 161 -20.345 7.106 4.561 1205 HD2 PRO 161 HD2 PRO 161 -18.715 9.228 4.078 1206 HD3 PRO 161 HD3 PRO 161 -18.449 7.648 3.309 1207 H ALA 162 H ALA 162 -20.463 11.286 1.109 1208 HA ALA 162 HA ALA 162 -21.406 13.333 1.325 1209 HB1 ALA 162 HB1 ALA 162 -24.010 11.822 0.911 1210 HB2 ALA 162 HB2 ALA 162 -22.945 12.406 -0.369 1211 HB3 ALA 162 HB3 ALA 162 -23.775 13.557 0.681 1212 H ASN 163 H ASN 163 -21.099 11.598 3.734 1213 HA ASN 163 HA ASN 163 -22.522 13.217 5.697 1214 HB2 ASN 163 HB2 ASN 163 -24.004 11.177 5.073 1215 HB3 ASN 163 HB3 ASN 163 -22.762 10.166 5.804 1216 HD21 ASN 163 HD21 ASN 163 -24.014 9.422 7.501 1217 HD22 ASN 163 HD22 ASN 163 -24.637 10.436 8.750 1218 H ALA 164 H ALA 164 -21.554 10.668 7.542 1219 HA ALA 164 HA ALA 164 -19.868 10.433 9.039 1220 HB1 ALA 164 HB1 ALA 164 -17.589 10.171 8.132 1221 HB2 ALA 164 HB2 ALA 164 -18.080 10.951 6.624 1222 HB3 ALA 164 HB3 ALA 164 -18.773 9.394 7.079 1223 H LEU 165 H LEU 165 -21.045 13.012 8.882 1224 HA LEU 165 HA LEU 165 -19.101 15.106 8.757 1225 HB2 LEU 165 HB2 LEU 165 -21.164 16.491 9.706 1226 HB3 LEU 165 HB3 LEU 165 -21.078 15.962 8.043 1227 HG LEU 165 HG LEU 165 -22.602 14.039 8.611 1228 HD11 LEU 165 HD11 LEU 165 -23.963 14.092 10.644 1229 HD12 LEU 165 HD12 LEU 165 -22.992 15.426 11.276 1230 HD13 LEU 165 HD13 LEU 165 -22.258 13.842 11.016 1231 HD21 LEU 165 HD21 LEU 165 -23.444 16.070 7.536 1232 HD22 LEU 165 HD22 LEU 165 -23.740 16.804 9.115 1233 HD23 LEU 165 HD23 LEU 165 -24.651 15.377 8.617 1234 H GLU 166 H GLU 166 -17.539 14.519 10.275 1235 HA GLU 166 HA GLU 166 -18.134 14.667 13.122 1236 HB2 GLU 166 HB2 GLU 166 -15.443 14.504 11.694 1237 HB3 GLU 166 HB3 GLU 166 -15.710 14.318 13.429 1238 HG2 GLU 166 HG2 GLU 166 -17.138 12.320 12.948 1239 HG3 GLU 166 HG3 GLU 166 -16.732 12.474 11.242 1240 H HIS 167 H HIS 167 -19.150 16.763 12.845 1241 HA HIS 167 HA HIS 167 -17.678 19.144 12.223 1242 HB2 HIS 167 HB2 HIS 167 -20.187 18.838 11.964 1243 HB3 HIS 167 HB3 HIS 167 -20.334 18.867 13.716 1244 HD1 HIS 167 HD1 HIS 167 -20.348 21.152 14.841 1245 HD2 HIS 167 HD2 HIS 167 -19.515 21.342 10.774 1246 HE1 HIS 167 HE1 HIS 167 -20.447 23.584 14.251 1247 HE2 HIS 167 HE2 HIS 167 -19.797 23.690 11.824 1248 H HIS 168 H HIS 168 -18.952 17.712 15.211 1249 HA HIS 168 HA HIS 168 -18.424 17.805 17.392 1250 HB2 HIS 168 HB2 HIS 168 -16.693 16.308 16.437 1251 HB3 HIS 168 HB3 HIS 168 -15.606 17.680 16.268 1252 HD1 HIS 168 HD1 HIS 168 -14.545 18.622 18.443 1253 HD2 HIS 168 HD2 HIS 168 -16.909 15.260 19.041 1254 HE1 HIS 168 HE1 HIS 168 -14.039 17.867 20.777 1255 HE2 HIS 168 HE2 HIS 168 -15.309 15.714 21.030 1256 H HIS 169 H HIS 169 -19.275 19.969 17.612 1257 HA HIS 169 HA HIS 169 -17.409 21.807 18.893 1258 HB2 HIS 169 HB2 HIS 169 -18.762 22.422 16.268 1259 HB3 HIS 169 HB3 HIS 169 -18.779 23.709 17.467 1260 HD1 HIS 169 HD1 HIS 169 -16.243 21.516 15.636 1261 HD2 HIS 169 HD2 HIS 169 -16.507 25.198 17.537 1262 HE1 HIS 169 HE1 HIS 169 -14.029 22.623 15.248 1263 HE2 HIS 169 HE2 HIS 169 -14.165 24.788 16.527 1264 H HIS 170 H HIS 170 -18.358 22.940 20.542 1265 HA HIS 170 HA HIS 170 -21.137 22.370 21.257 1266 HB2 HIS 170 HB2 HIS 170 -20.617 23.478 23.385 1267 HB3 HIS 170 HB3 HIS 170 -19.363 22.309 22.997 1268 HD1 HIS 170 HD1 HIS 170 -17.059 23.358 22.099 1269 HD2 HIS 170 HD2 HIS 170 -19.709 26.045 23.831 1270 HE1 HIS 170 HE1 HIS 170 -15.702 25.403 22.587 1271 HE2 HIS 170 HE2 HIS 170 -17.349 27.061 23.516 1272 H HIS 171 H HIS 171 -22.536 24.247 22.053 1273 HA HIS 171 HA HIS 171 -22.893 26.117 19.890 1274 HB2 HIS 171 HB2 HIS 171 -24.342 25.942 22.564 1275 HB3 HIS 171 HB3 HIS 171 -24.848 26.937 21.203 1276 HD1 HIS 171 HD1 HIS 171 -25.329 25.433 18.921 1277 HD2 HIS 171 HD2 HIS 171 -25.542 23.509 22.599 1278 HE1 HIS 171 HE1 HIS 171 -26.672 23.350 18.510 1279 HE2 HIS 171 HE2 HIS 171 -26.694 22.160 20.726 1280 H HIS 172 H HIS 172 -22.354 28.237 19.731 1281 HA HIS 172 HA HIS 172 -20.942 29.585 21.970 1282 HB2 HIS 172 HB2 HIS 172 -19.688 29.369 19.827 1283 HB3 HIS 172 HB3 HIS 172 -20.968 30.222 18.978 1284 HD1 HIS 172 HD1 HIS 172 -21.117 32.802 19.334 1285 HD2 HIS 172 HD2 HIS 172 -17.892 31.018 21.246 1286 HE1 HIS 172 HE1 HIS 172 -19.610 34.688 20.002 1287 HE2 HIS 172 HE2 HIS 172 -17.780 33.601 21.331 Start of MODEL 11 1 H1 THR 1 H1 THR 1 -12.300 4.135 -7.985 2 H2 THR 1 H2 THR 1 -10.824 4.430 -8.753 3 H3 THR 1 H3 THR 1 -10.866 3.562 -7.305 4 HA THR 1 HA THR 1 -11.999 1.744 -8.323 5 HB THR 1 HB THR 1 -11.782 3.235 -10.953 6 HG1 THR 1 HG1 THR 1 -14.159 3.415 -10.656 7 HG21 THR 1 HG21 THR 1 -13.410 1.553 -11.771 8 HG22 THR 1 HG22 THR 1 -13.378 0.760 -10.195 9 HG23 THR 1 HG23 THR 1 -11.924 0.791 -11.198 10 H VAL 2 H VAL 2 -10.517 0.139 -8.567 11 HA VAL 2 HA VAL 2 -7.873 0.632 -9.656 12 HB VAL 2 HB VAL 2 -9.202 -1.975 -8.816 13 HG11 VAL 2 HG11 VAL 2 -6.888 -2.917 -8.798 14 HG12 VAL 2 HG12 VAL 2 -6.276 -1.406 -9.473 15 HG13 VAL 2 HG13 VAL 2 -7.378 -2.409 -10.418 16 HG21 VAL 2 HG21 VAL 2 -7.838 -1.768 -6.752 17 HG22 VAL 2 HG22 VAL 2 -8.936 -0.398 -6.934 18 HG23 VAL 2 HG23 VAL 2 -7.221 -0.211 -7.313 19 H VAL 3 H VAL 3 -7.886 1.069 -11.782 20 HA VAL 3 HA VAL 3 -9.850 -0.088 -13.600 21 HB VAL 3 HB VAL 3 -8.904 1.531 -15.266 22 HG11 VAL 3 HG11 VAL 3 -9.648 2.757 -12.571 23 HG12 VAL 3 HG12 VAL 3 -10.783 2.206 -13.806 24 HG13 VAL 3 HG13 VAL 3 -9.726 3.580 -14.136 25 HG21 VAL 3 HG21 VAL 3 -6.561 1.597 -14.452 26 HG22 VAL 3 HG22 VAL 3 -7.090 2.396 -12.968 27 HG23 VAL 3 HG23 VAL 3 -7.243 3.225 -14.522 28 H SER 4 H SER 4 -6.557 -0.765 -12.763 29 HA SER 4 HA SER 4 -6.541 -3.030 -14.587 30 HB2 SER 4 HB2 SER 4 -5.516 -1.308 -16.040 31 HB3 SER 4 HB3 SER 4 -4.342 -0.916 -14.785 32 HG SER 4 HG SER 4 -3.189 -2.581 -15.366 33 H VAL 5 H VAL 5 -5.369 -4.726 -13.782 34 HA VAL 5 HA VAL 5 -3.596 -4.300 -11.426 35 HB VAL 5 HB VAL 5 -5.325 -6.779 -11.932 36 HG11 VAL 5 HG11 VAL 5 -3.613 -6.031 -9.516 37 HG12 VAL 5 HG12 VAL 5 -3.256 -7.305 -10.686 38 HG13 VAL 5 HG13 VAL 5 -4.660 -7.450 -9.628 39 HG21 VAL 5 HG21 VAL 5 -5.765 -4.555 -9.911 40 HG22 VAL 5 HG22 VAL 5 -6.702 -6.048 -10.018 41 HG23 VAL 5 HG23 VAL 5 -6.755 -4.877 -11.337 42 H ASP 6 H ASP 6 -1.639 -4.370 -12.450 43 HA ASP 6 HA ASP 6 -0.974 -6.552 -14.311 44 HB2 ASP 6 HB2 ASP 6 0.666 -4.132 -13.445 45 HB3 ASP 6 HB3 ASP 6 1.089 -5.248 -14.740 46 H LYS 7 H LYS 7 0.023 -8.346 -13.537 47 HA LYS 7 HA LYS 7 1.809 -8.202 -11.169 48 HB2 LYS 7 HB2 LYS 7 -0.399 -9.051 -10.419 49 HB3 LYS 7 HB3 LYS 7 -0.361 -10.297 -11.663 50 HG2 LYS 7 HG2 LYS 7 1.664 -11.286 -10.534 51 HG3 LYS 7 HG3 LYS 7 1.482 -10.084 -9.246 52 HD2 LYS 7 HD2 LYS 7 -0.722 -11.001 -8.666 53 HD3 LYS 7 HD3 LYS 7 -0.641 -12.131 -10.021 54 HE2 LYS 7 HE2 LYS 7 1.394 -13.164 -8.923 55 HE3 LYS 7 HE3 LYS 7 1.083 -12.138 -7.518 56 HZ1 LYS 7 HZ1 LYS 7 -0.884 -14.049 -8.643 57 HZ2 LYS 7 HZ2 LYS 7 -0.997 -13.200 -7.180 58 HZ3 LYS 7 HZ3 LYS 7 0.163 -14.413 -7.367 59 H ASP 8 H ASP 8 3.732 -8.547 -12.205 60 HA ASP 8 HA ASP 8 3.966 -10.793 -14.133 61 HB2 ASP 8 HB2 ASP 8 4.759 -8.344 -14.686 62 HB3 ASP 8 HB3 ASP 8 6.145 -8.718 -13.668 63 H VAL 9 H VAL 9 4.574 -12.630 -13.228 64 HA VAL 9 HA VAL 9 5.787 -12.792 -10.611 65 HB VAL 9 HB VAL 9 5.074 -15.042 -12.550 66 HG11 VAL 9 HG11 VAL 9 6.627 -15.806 -10.802 67 HG12 VAL 9 HG12 VAL 9 5.024 -16.494 -10.536 68 HG13 VAL 9 HG13 VAL 9 5.576 -15.139 -9.548 69 HG21 VAL 9 HG21 VAL 9 3.078 -13.681 -12.031 70 HG22 VAL 9 HG22 VAL 9 3.390 -13.857 -10.302 71 HG23 VAL 9 HG23 VAL 9 2.961 -15.271 -11.267 72 H GLU 10 H GLU 10 6.920 -13.139 -13.928 73 HA GLU 10 HA GLU 10 9.414 -14.453 -13.331 74 HB2 GLU 10 HB2 GLU 10 8.760 -12.741 -15.770 75 HB3 GLU 10 HB3 GLU 10 10.031 -13.957 -15.637 76 HG2 GLU 10 HG2 GLU 10 7.034 -14.438 -15.673 77 HG3 GLU 10 HG3 GLU 10 8.175 -14.809 -16.960 78 H ALA 11 H ALA 11 8.479 -11.087 -13.937 79 HA ALA 11 HA ALA 11 11.115 -9.989 -13.380 80 HB1 ALA 11 HB1 ALA 11 8.469 -8.573 -13.904 81 HB2 ALA 11 HB2 ALA 11 9.674 -8.992 -15.123 82 HB3 ALA 11 HB3 ALA 11 10.065 -7.812 -13.871 83 H LEU 12 H LEU 12 8.743 -11.138 -11.366 84 HA LEU 12 HA LEU 12 8.132 -10.927 -9.187 85 HB2 LEU 12 HB2 LEU 12 10.888 -9.679 -8.911 86 HB3 LEU 12 HB3 LEU 12 9.943 -10.372 -7.600 87 HG LEU 12 HG LEU 12 11.040 -11.951 -9.972 88 HD11 LEU 12 HD11 LEU 12 12.650 -12.900 -8.382 89 HD12 LEU 12 HD12 LEU 12 12.060 -11.817 -7.117 90 HD13 LEU 12 HD13 LEU 12 12.859 -11.157 -8.548 91 HD21 LEU 12 HD21 LEU 12 8.994 -12.954 -9.062 92 HD22 LEU 12 HD22 LEU 12 9.678 -12.924 -7.433 93 HD23 LEU 12 HD23 LEU 12 10.399 -13.951 -8.678 94 H SER 13 H SER 13 7.215 -8.762 -10.808 95 HA SER 13 HA SER 13 7.081 -6.534 -8.844 96 HB2 SER 13 HB2 SER 13 6.573 -5.037 -10.799 97 HB3 SER 13 HB3 SER 13 8.180 -5.747 -10.870 98 HG SER 13 HG SER 13 7.453 -6.130 -12.854 99 H PHE 14 H PHE 14 5.102 -5.660 -8.363 100 HA PHE 14 HA PHE 14 2.673 -6.664 -9.721 101 HB2 PHE 14 HB2 PHE 14 2.851 -7.964 -7.670 102 HB3 PHE 14 HB3 PHE 14 3.193 -6.522 -6.715 103 HD1 PHE 14 HD1 PHE 14 0.524 -7.637 -9.133 104 HD2 PHE 14 HD2 PHE 14 1.426 -5.864 -5.345 105 HE1 PHE 14 HE1 PHE 14 -1.876 -7.385 -8.671 106 HE2 PHE 14 HE2 PHE 14 -0.972 -5.617 -4.897 107 HZ PHE 14 HZ PHE 14 -2.622 -6.375 -6.552 108 H SER 15 H SER 15 2.015 -4.838 -10.741 109 HA SER 15 HA SER 15 2.074 -2.231 -9.333 110 HB2 SER 15 HB2 SER 15 2.163 -1.201 -11.628 111 HB3 SER 15 HB3 SER 15 3.560 -2.199 -11.243 112 HG SER 15 HG SER 15 1.693 -3.712 -12.402 113 H ILE 16 H ILE 16 0.147 -1.477 -8.721 114 HA ILE 16 HA ILE 16 -2.349 -2.288 -10.093 115 HB ILE 16 HB ILE 16 -1.873 -1.007 -7.361 116 HG12 ILE 16 HG12 ILE 16 -2.987 -3.756 -8.069 117 HG13 ILE 16 HG13 ILE 16 -1.342 -3.443 -7.516 118 HG21 ILE 16 HG21 ILE 16 -4.553 -1.715 -8.624 119 HG22 ILE 16 HG22 ILE 16 -3.966 -0.090 -8.262 120 HG23 ILE 16 HG23 ILE 16 -4.321 -1.209 -6.948 121 HD11 ILE 16 HD11 ILE 16 -3.856 -2.933 -5.925 122 HD12 ILE 16 HD12 ILE 16 -2.194 -2.663 -5.380 123 HD13 ILE 16 HD13 ILE 16 -2.753 -4.294 -5.738 124 H VAL 17 H VAL 17 -3.157 -0.865 -11.529 125 HA VAL 17 HA VAL 17 -2.578 2.024 -11.306 126 HB VAL 17 HB VAL 17 -3.874 0.513 -13.631 127 HG11 VAL 17 HG11 VAL 17 -2.769 3.356 -13.492 128 HG12 VAL 17 HG12 VAL 17 -4.477 2.912 -13.578 129 HG13 VAL 17 HG13 VAL 17 -3.410 2.573 -14.941 130 HG21 VAL 17 HG21 VAL 17 -1.560 -0.268 -13.329 131 HG22 VAL 17 HG22 VAL 17 -0.975 1.398 -13.322 132 HG23 VAL 17 HG23 VAL 17 -1.687 0.719 -14.789 133 H ALA 18 H ALA 18 -4.133 3.244 -10.372 134 HA ALA 18 HA ALA 18 -6.973 2.441 -10.490 135 HB1 ALA 18 HB1 ALA 18 -5.486 3.110 -7.918 136 HB2 ALA 18 HB2 ALA 18 -6.039 1.505 -8.408 137 HB3 ALA 18 HB3 ALA 18 -7.216 2.773 -8.061 138 H GLU 19 H GLU 19 -8.238 4.135 -11.003 139 HA GLU 19 HA GLU 19 -7.183 6.895 -10.812 140 HB2 GLU 19 HB2 GLU 19 -9.465 5.807 -12.514 141 HB3 GLU 19 HB3 GLU 19 -8.846 7.460 -12.552 142 HG2 GLU 19 HG2 GLU 19 -6.670 6.608 -13.374 143 HG3 GLU 19 HG3 GLU 19 -7.311 4.964 -13.359 144 H PHE 20 H PHE 20 -8.245 8.452 -9.669 145 HA PHE 20 HA PHE 20 -10.855 7.874 -8.392 146 HB2 PHE 20 HB2 PHE 20 -8.373 8.921 -6.944 147 HB3 PHE 20 HB3 PHE 20 -9.982 8.806 -6.236 148 HD1 PHE 20 HD1 PHE 20 -11.036 6.514 -5.938 149 HD2 PHE 20 HD2 PHE 20 -6.917 7.016 -6.981 150 HE1 PHE 20 HE1 PHE 20 -10.571 4.203 -5.243 151 HE2 PHE 20 HE2 PHE 20 -6.468 4.705 -6.288 152 HZ PHE 20 HZ PHE 20 -8.293 3.298 -5.422 153 H ASP 21 H ASP 21 -12.186 9.633 -8.147 154 HA ASP 21 HA ASP 21 -11.587 11.978 -9.746 155 HB2 ASP 21 HB2 ASP 21 -14.096 11.210 -8.196 156 HB3 ASP 21 HB3 ASP 21 -13.968 12.565 -9.320 157 H ALA 22 H ALA 22 -9.952 12.915 -8.545 158 HA ALA 22 HA ALA 22 -10.597 15.080 -6.855 159 HB1 ALA 22 HB1 ALA 22 -9.414 14.411 -4.770 160 HB2 ALA 22 HB2 ALA 22 -9.176 12.786 -5.426 161 HB3 ALA 22 HB3 ALA 22 -10.804 13.365 -5.074 162 H ASP 23 H ASP 23 -8.381 16.117 -6.008 163 HA ASP 23 HA ASP 23 -6.540 16.027 -8.296 164 HB2 ASP 23 HB2 ASP 23 -5.479 18.038 -7.259 165 HB3 ASP 23 HB3 ASP 23 -7.194 18.246 -7.556 166 H VAL 24 H VAL 24 -4.164 16.226 -7.793 167 HA VAL 24 HA VAL 24 -3.197 13.829 -6.785 168 HB VAL 24 HB VAL 24 -1.668 16.417 -7.283 169 HG11 VAL 24 HG11 VAL 24 -0.280 14.836 -5.979 170 HG12 VAL 24 HG12 VAL 24 0.336 14.998 -7.623 171 HG13 VAL 24 HG13 VAL 24 -0.591 13.567 -7.167 172 HG21 VAL 24 HG21 VAL 24 -2.169 14.076 -9.163 173 HG22 VAL 24 HG22 VAL 24 -1.201 15.511 -9.518 174 HG23 VAL 24 HG23 VAL 24 -2.938 15.665 -9.258 175 H LYS 25 H LYS 25 -3.410 16.979 -5.152 176 HA LYS 25 HA LYS 25 -1.778 16.317 -2.877 177 HB2 LYS 25 HB2 LYS 25 -3.951 18.455 -3.106 178 HB3 LYS 25 HB3 LYS 25 -2.686 18.385 -1.876 179 HG2 LYS 25 HG2 LYS 25 -2.202 18.754 -4.850 180 HG3 LYS 25 HG3 LYS 25 -2.277 20.072 -3.676 181 HD2 LYS 25 HD2 LYS 25 -0.272 17.789 -3.448 182 HD3 LYS 25 HD3 LYS 25 0.057 19.246 -4.381 183 HE2 LYS 25 HE2 LYS 25 1.072 19.517 -2.230 184 HE3 LYS 25 HE3 LYS 25 -0.319 20.589 -2.291 185 HZ1 LYS 25 HZ1 LYS 25 -0.249 17.950 -0.930 186 HZ2 LYS 25 HZ2 LYS 25 -1.552 19.024 -0.950 187 HZ3 LYS 25 HZ3 LYS 25 -0.118 19.454 -0.178 188 H ARG 26 H ARG 26 -5.238 16.259 -3.554 189 HA ARG 26 HA ARG 26 -6.203 15.664 -0.936 190 HB2 ARG 26 HB2 ARG 26 -7.383 16.551 -3.200 191 HB3 ARG 26 HB3 ARG 26 -7.765 14.849 -3.396 192 HG2 ARG 26 HG2 ARG 26 -8.552 16.571 -1.011 193 HG3 ARG 26 HG3 ARG 26 -9.600 16.179 -2.373 194 HD2 ARG 26 HD2 ARG 26 -9.357 13.744 -1.748 195 HD3 ARG 26 HD3 ARG 26 -8.484 14.259 -0.301 196 HE ARG 26 HE ARG 26 -11.084 15.474 -0.611 197 HH11 ARG 26 HH11 ARG 26 -9.399 12.778 0.784 198 HH12 ARG 26 HH12 ARG 26 -10.732 12.346 1.798 199 HH21 ARG 26 HH21 ARG 26 -12.744 14.895 0.688 200 HH22 ARG 26 HH22 ARG 26 -12.588 13.541 1.755 201 H VAL 27 H VAL 27 -5.337 13.636 -3.730 202 HA VAL 27 HA VAL 27 -5.974 11.119 -2.446 203 HB VAL 27 HB VAL 27 -4.244 11.496 -4.936 204 HG11 VAL 27 HG11 VAL 27 -4.977 9.186 -5.506 205 HG12 VAL 27 HG12 VAL 27 -5.870 9.093 -3.986 206 HG13 VAL 27 HG13 VAL 27 -4.110 9.223 -3.966 207 HG21 VAL 27 HG21 VAL 27 -7.271 11.176 -4.803 208 HG22 VAL 27 HG22 VAL 27 -6.303 11.173 -6.281 209 HG23 VAL 27 HG23 VAL 27 -6.405 12.633 -5.295 210 H TRP 28 H TRP 28 -3.040 13.107 -2.792 211 HA TRP 28 HA TRP 28 -1.156 11.286 -1.680 212 HB2 TRP 28 HB2 TRP 28 -0.520 13.350 -2.911 213 HB3 TRP 28 HB3 TRP 28 -1.161 14.335 -1.610 214 HD1 TRP 28 HD1 TRP 28 0.519 14.931 0.330 215 HE1 TRP 28 HE1 TRP 28 2.953 14.309 0.864 216 HE3 TRP 28 HE3 TRP 28 1.197 11.216 -3.125 217 HZ2 TRP 28 HZ2 TRP 28 4.907 12.492 -0.065 218 HZ3 TRP 28 HZ3 TRP 28 3.378 10.093 -3.245 219 HH2 TRP 28 HH2 TRP 28 5.199 10.721 -1.742 220 H ALA 29 H ALA 29 -3.509 13.440 -0.202 221 HA ALA 29 HA ALA 29 -2.538 13.603 2.430 222 HB1 ALA 29 HB1 ALA 29 -4.291 15.070 1.522 223 HB2 ALA 29 HB2 ALA 29 -4.807 14.319 3.035 224 HB3 ALA 29 HB3 ALA 29 -5.420 13.715 1.492 225 H ILE 30 H ILE 30 -4.364 10.995 0.872 226 HA ILE 30 HA ILE 30 -5.166 9.620 3.276 227 HB ILE 30 HB ILE 30 -5.885 7.803 1.902 228 HG12 ILE 30 HG12 ILE 30 -3.989 8.867 -0.232 229 HG13 ILE 30 HG13 ILE 30 -3.867 7.342 0.617 230 HG21 ILE 30 HG21 ILE 30 -7.214 9.855 1.632 231 HG22 ILE 30 HG22 ILE 30 -7.223 8.903 0.147 232 HG23 ILE 30 HG23 ILE 30 -6.208 10.344 0.263 233 HD11 ILE 30 HD11 ILE 30 -4.573 6.958 -1.608 234 HD12 ILE 30 HD12 ILE 30 -5.889 8.118 -1.456 235 HD13 ILE 30 HD13 ILE 30 -5.931 6.610 -0.536 236 H TRP 31 H TRP 31 -2.185 9.796 1.516 237 HA TRP 31 HA TRP 31 -1.007 7.447 2.833 238 HB2 TRP 31 HB2 TRP 31 0.100 9.377 0.739 239 HB3 TRP 31 HB3 TRP 31 1.011 8.028 1.415 240 HD1 TRP 31 HD1 TRP 31 -1.418 8.806 -1.356 241 HE1 TRP 31 HE1 TRP 31 -2.104 6.627 -2.549 242 HE3 TRP 31 HE3 TRP 31 0.520 5.403 1.953 243 HZ2 TRP 31 HZ2 TRP 31 -1.852 3.845 -2.146 244 HZ3 TRP 31 HZ3 TRP 31 0.265 3.003 1.468 245 HH2 TRP 31 HH2 TRP 31 -0.908 2.236 -0.531 246 H GLU 32 H GLU 32 -0.733 10.964 2.774 247 HA GLU 32 HA GLU 32 1.623 11.115 4.404 248 HB2 GLU 32 HB2 GLU 32 1.052 12.810 2.665 249 HB3 GLU 32 HB3 GLU 32 -0.337 13.321 3.623 250 HG2 GLU 32 HG2 GLU 32 1.106 14.134 5.395 251 HG3 GLU 32 HG3 GLU 32 2.529 13.452 4.616 252 H ASP 33 H ASP 33 -1.851 11.498 5.027 253 HA ASP 33 HA ASP 33 -1.397 12.101 7.861 254 HB2 ASP 33 HB2 ASP 33 -3.936 11.994 6.195 255 HB3 ASP 33 HB3 ASP 33 -3.900 12.371 7.916 256 HA PRO 34 HA PRO 34 -1.607 7.641 8.929 257 HB2 PRO 34 HB2 PRO 34 -2.054 8.315 11.687 258 HB3 PRO 34 HB3 PRO 34 -0.528 7.869 10.925 259 HG2 PRO 34 HG2 PRO 34 -1.643 10.586 11.506 260 HG3 PRO 34 HG3 PRO 34 0.044 10.039 11.532 261 HD2 PRO 34 HD2 PRO 34 -0.862 11.557 9.532 262 HD3 PRO 34 HD3 PRO 34 0.270 10.224 9.198 263 H ARG 35 H ARG 35 -3.965 9.978 10.370 264 HA ARG 35 HA ARG 35 -5.987 8.034 10.894 265 HB2 ARG 35 HB2 ARG 35 -5.879 11.029 10.961 266 HB3 ARG 35 HB3 ARG 35 -7.475 10.308 10.855 267 HG2 ARG 35 HG2 ARG 35 -6.907 10.780 13.175 268 HG3 ARG 35 HG3 ARG 35 -7.082 9.044 12.924 269 HD2 ARG 35 HD2 ARG 35 -5.189 9.458 14.373 270 HD3 ARG 35 HD3 ARG 35 -4.597 8.844 12.827 271 HE ARG 35 HE ARG 35 -4.554 11.643 12.722 272 HH11 ARG 35 HH11 ARG 35 -2.860 9.076 14.318 273 HH12 ARG 35 HH12 ARG 35 -1.467 10.052 14.618 274 HH21 ARG 35 HH21 ARG 35 -2.727 12.851 13.112 275 HH22 ARG 35 HH22 ARG 35 -1.394 12.142 13.946 276 H GLN 36 H GLN 36 -5.246 9.849 7.959 277 HA GLN 36 HA GLN 36 -7.762 9.124 6.667 278 HB2 GLN 36 HB2 GLN 36 -5.286 10.456 5.496 279 HB3 GLN 36 HB3 GLN 36 -6.806 10.199 4.637 280 HG2 GLN 36 HG2 GLN 36 -7.922 11.643 6.416 281 HG3 GLN 36 HG3 GLN 36 -6.305 12.030 7.007 282 HE21 GLN 36 HE21 GLN 36 -6.438 14.226 6.499 283 HE22 GLN 36 HE22 GLN 36 -6.475 14.817 4.879 284 H LEU 37 H LEU 37 -4.528 7.821 6.943 285 HA LEU 37 HA LEU 37 -4.687 5.985 4.720 286 HB2 LEU 37 HB2 LEU 37 -2.533 6.775 5.523 287 HB3 LEU 37 HB3 LEU 37 -2.838 6.136 7.127 288 HG LEU 37 HG LEU 37 -2.672 3.814 6.248 289 HD11 LEU 37 HD11 LEU 37 -1.973 5.057 3.570 290 HD12 LEU 37 HD12 LEU 37 -3.440 4.145 3.937 291 HD13 LEU 37 HD13 LEU 37 -1.867 3.337 3.981 292 HD21 LEU 37 HD21 LEU 37 -0.672 4.904 7.124 293 HD22 LEU 37 HD22 LEU 37 -0.292 5.541 5.520 294 HD23 LEU 37 HD23 LEU 37 -0.269 3.796 5.810 295 H GLU 38 H GLU 38 -5.005 5.601 8.270 296 HA GLU 38 HA GLU 38 -5.234 2.788 8.283 297 HB2 GLU 38 HB2 GLU 38 -5.968 3.031 10.632 298 HB3 GLU 38 HB3 GLU 38 -4.555 4.007 10.265 299 HG2 GLU 38 HG2 GLU 38 -5.942 6.028 10.163 300 HG3 GLU 38 HG3 GLU 38 -7.393 5.068 10.462 301 H ARG 39 H ARG 39 -7.700 5.253 7.826 302 HA ARG 39 HA ARG 39 -9.982 3.671 8.478 303 HB2 ARG 39 HB2 ARG 39 -11.302 5.493 7.459 304 HB3 ARG 39 HB3 ARG 39 -10.071 6.106 8.556 305 HG2 ARG 39 HG2 ARG 39 -8.650 6.709 6.616 306 HG3 ARG 39 HG3 ARG 39 -9.907 6.114 5.523 307 HD2 ARG 39 HD2 ARG 39 -10.221 8.412 7.500 308 HD3 ARG 39 HD3 ARG 39 -9.974 8.578 5.762 309 HE ARG 39 HE ARG 39 -12.148 7.494 5.428 310 HH11 ARG 39 HH11 ARG 39 -11.627 8.800 8.614 311 HH12 ARG 39 HH12 ARG 39 -13.318 8.937 8.925 312 HH21 ARG 39 HH21 ARG 39 -14.274 7.702 5.885 313 HH22 ARG 39 HH22 ARG 39 -14.787 8.323 7.414 314 H TRP 40 H TRP 40 -7.974 3.590 5.672 315 HA TRP 40 HA TRP 40 -9.974 1.857 4.326 316 HB2 TRP 40 HB2 TRP 40 -9.167 2.558 2.131 317 HB3 TRP 40 HB3 TRP 40 -9.740 3.946 3.040 318 HD1 TRP 40 HD1 TRP 40 -7.874 5.782 3.781 319 HE1 TRP 40 HE1 TRP 40 -5.531 6.291 2.846 320 HE3 TRP 40 HE3 TRP 40 -7.077 1.474 1.183 321 HZ2 TRP 40 HZ2 TRP 40 -3.612 5.040 1.195 322 HZ3 TRP 40 HZ3 TRP 40 -4.980 1.194 -0.061 323 HH2 TRP 40 HH2 TRP 40 -3.283 2.944 -0.049 324 H TRP 41 H TRP 41 -6.873 2.002 5.716 325 HA TRP 41 HA TRP 41 -5.461 0.274 3.933 326 HB2 TRP 41 HB2 TRP 41 -4.435 1.908 5.635 327 HB3 TRP 41 HB3 TRP 41 -4.756 0.696 6.873 328 HD1 TRP 41 HD1 TRP 41 -2.630 -0.739 7.348 329 HE1 TRP 41 HE1 TRP 41 -0.594 -1.534 5.992 330 HE3 TRP 41 HE3 TRP 41 -3.800 1.293 2.777 331 HZ2 TRP 41 HZ2 TRP 41 0.376 -1.328 3.376 332 HZ3 TRP 41 HZ3 TRP 41 -2.267 0.929 0.910 333 HH2 TRP 41 HH2 TRP 41 -0.212 -0.356 1.195 334 H GLY 42 H GLY 42 -5.912 -1.787 3.595 335 HA2 GLY 42 HA2 GLY 42 -6.211 -4.071 4.134 336 HA3 GLY 42 HA3 GLY 42 -6.802 -3.626 5.725 337 HA PRO 43 HA PRO 43 -10.440 -4.482 2.611 338 HB2 PRO 43 HB2 PRO 43 -11.184 -6.976 3.550 339 HB3 PRO 43 HB3 PRO 43 -10.050 -6.743 2.210 340 HG2 PRO 43 HG2 PRO 43 -9.464 -7.247 5.132 341 HG3 PRO 43 HG3 PRO 43 -8.746 -8.027 3.703 342 HD2 PRO 43 HD2 PRO 43 -7.455 -6.051 5.006 343 HD3 PRO 43 HD3 PRO 43 -7.366 -6.175 3.235 344 HA PRO 44 HA PRO 44 -13.498 -3.021 5.545 345 HB2 PRO 44 HB2 PRO 44 -15.795 -4.559 5.136 346 HB3 PRO 44 HB3 PRO 44 -15.277 -3.236 4.081 347 HG2 PRO 44 HG2 PRO 44 -14.793 -6.203 3.781 348 HG3 PRO 44 HG3 PRO 44 -15.343 -5.038 2.556 349 HD2 PRO 44 HD2 PRO 44 -12.792 -5.816 2.603 350 HD3 PRO 44 HD3 PRO 44 -13.177 -4.103 2.300 351 H THR 45 H THR 45 -12.988 -6.494 5.663 352 HA THR 45 HA THR 45 -14.024 -6.866 8.361 353 HB THR 45 HB THR 45 -13.128 -9.232 8.053 354 HG1 THR 45 HG1 THR 45 -11.924 -9.661 6.354 355 HG21 THR 45 HG21 THR 45 -14.982 -8.225 5.858 356 HG22 THR 45 HG22 THR 45 -15.475 -8.703 7.485 357 HG23 THR 45 HG23 THR 45 -14.812 -9.905 6.377 358 H TRP 46 H TRP 46 -10.933 -6.055 6.948 359 HA TRP 46 HA TRP 46 -9.591 -6.365 9.593 360 HB2 TRP 46 HB2 TRP 46 -8.351 -6.852 6.846 361 HB3 TRP 46 HB3 TRP 46 -7.441 -6.799 8.348 362 HD1 TRP 46 HD1 TRP 46 -10.162 -8.986 6.628 363 HE1 TRP 46 HE1 TRP 46 -9.931 -11.382 7.521 364 HE3 TRP 46 HE3 TRP 46 -6.495 -8.204 10.094 365 HZ2 TRP 46 HZ2 TRP 46 -8.391 -12.775 9.431 366 HZ3 TRP 46 HZ3 TRP 46 -5.689 -10.123 11.410 367 HH2 TRP 46 HH2 TRP 46 -6.614 -12.363 11.086 368 HA PRO 47 HA PRO 47 -9.008 -1.879 8.210 369 HB2 PRO 47 HB2 PRO 47 -10.102 -0.648 10.386 370 HB3 PRO 47 HB3 PRO 47 -11.080 -1.167 9.006 371 HG2 PRO 47 HG2 PRO 47 -10.644 -2.567 11.650 372 HG3 PRO 47 HG3 PRO 47 -12.168 -2.291 10.776 373 HD2 PRO 47 HD2 PRO 47 -10.836 -4.667 10.653 374 HD3 PRO 47 HD3 PRO 47 -11.778 -4.045 9.284 375 H ALA 48 H ALA 48 -6.981 -1.106 8.621 376 HA ALA 48 HA ALA 48 -5.398 -2.105 10.846 377 HB1 ALA 48 HB1 ALA 48 -4.422 -1.938 8.600 378 HB2 ALA 48 HB2 ALA 48 -3.517 -0.967 9.764 379 HB3 ALA 48 HB3 ALA 48 -4.627 -0.185 8.633 380 H THR 49 H THR 49 -4.228 -0.747 12.348 381 HA THR 49 HA THR 49 -5.253 2.008 12.782 382 HB THR 49 HB THR 49 -4.953 -0.112 14.972 383 HG1 THR 49 HG1 THR 49 -7.108 0.784 13.468 384 HG21 THR 49 HG21 THR 49 -4.388 2.147 15.816 385 HG22 THR 49 HG22 THR 49 -5.916 1.574 16.491 386 HG23 THR 49 HG23 THR 49 -5.920 2.766 15.189 387 H PHE 50 H PHE 50 -3.554 3.388 12.812 388 HA PHE 50 HA PHE 50 -0.823 2.326 13.065 389 HB2 PHE 50 HB2 PHE 50 -1.953 4.885 11.878 390 HB3 PHE 50 HB3 PHE 50 -0.226 4.702 12.177 391 HD1 PHE 50 HD1 PHE 50 -3.089 3.034 10.412 392 HD2 PHE 50 HD2 PHE 50 1.142 3.658 10.549 393 HE1 PHE 50 HE1 PHE 50 -2.842 1.832 8.281 394 HE2 PHE 50 HE2 PHE 50 1.381 2.451 8.417 395 HZ PHE 50 HZ PHE 50 -0.608 1.539 7.283 396 H GLU 51 H GLU 51 -0.068 2.273 15.081 397 HA GLU 51 HA GLU 51 -0.619 4.161 17.161 398 HB2 GLU 51 HB2 GLU 51 1.649 2.138 16.923 399 HB3 GLU 51 HB3 GLU 51 1.151 2.957 18.404 400 HG2 GLU 51 HG2 GLU 51 -0.509 0.985 16.796 401 HG3 GLU 51 HG3 GLU 51 0.315 0.648 18.318 402 H THR 52 H THR 52 1.977 3.775 14.795 403 HA THR 52 HA THR 52 2.622 6.619 15.099 404 HB THR 52 HB THR 52 4.401 5.387 16.398 405 HG1 THR 52 HG1 THR 52 6.133 6.381 14.782 406 HG21 THR 52 HG21 THR 52 4.615 3.338 15.025 407 HG22 THR 52 HG22 THR 52 6.166 4.164 15.196 408 HG23 THR 52 HG23 THR 52 5.255 4.301 13.690 409 H HIS 53 H HIS 53 3.527 7.547 13.192 410 HA HIS 53 HA HIS 53 3.862 6.006 10.762 411 HB2 HIS 53 HB2 HIS 53 1.406 6.219 10.855 412 HB3 HIS 53 HB3 HIS 53 1.531 7.957 11.069 413 HD2 HIS 53 HD2 HIS 53 1.543 5.303 8.232 414 HE1 HIS 53 HE1 HIS 53 1.831 9.158 6.527 415 HE2 HIS 53 HE2 HIS 53 1.234 6.747 6.103 416 H GLU 54 H GLU 54 5.941 6.877 10.862 417 HA GLU 54 HA GLU 54 6.377 9.765 10.750 418 HB2 GLU 54 HB2 GLU 54 8.472 7.570 10.428 419 HB3 GLU 54 HB3 GLU 54 8.749 9.269 10.817 420 HG2 GLU 54 HG2 GLU 54 7.457 7.178 12.577 421 HG3 GLU 54 HG3 GLU 54 9.072 7.858 12.764 422 H PHE 55 H PHE 55 5.280 10.218 8.762 423 HA PHE 55 HA PHE 55 6.028 8.979 6.290 424 HB2 PHE 55 HB2 PHE 55 3.765 10.056 6.888 425 HB3 PHE 55 HB3 PHE 55 4.536 11.615 6.631 426 HD1 PHE 55 HD1 PHE 55 3.677 8.402 4.983 427 HD2 PHE 55 HD2 PHE 55 4.771 12.481 4.393 428 HE1 PHE 55 HE1 PHE 55 3.163 8.189 2.585 429 HE2 PHE 55 HE2 PHE 55 4.248 12.268 1.999 430 HZ PHE 55 HZ PHE 55 3.442 10.122 1.093 431 H THR 56 H THR 56 8.396 9.384 6.882 432 HA THR 56 HA THR 56 9.344 11.659 5.260 433 HB THR 56 HB THR 56 9.554 12.398 7.627 434 HG1 THR 56 HG1 THR 56 11.101 13.195 6.232 435 HG21 THR 56 HG21 THR 56 11.170 11.306 9.158 436 HG22 THR 56 HG22 THR 56 11.416 10.010 7.984 437 HG23 THR 56 HG23 THR 56 9.839 10.219 8.750 438 H VAL 57 H VAL 57 11.748 11.361 4.744 439 HA VAL 57 HA VAL 57 12.218 8.838 3.508 440 HB VAL 57 HB VAL 57 14.132 11.162 4.048 441 HG11 VAL 57 HG11 VAL 57 14.457 8.832 2.117 442 HG12 VAL 57 HG12 VAL 57 15.415 9.123 3.570 443 HG13 VAL 57 HG13 VAL 57 15.525 10.237 2.207 444 HG21 VAL 57 HG21 VAL 57 12.181 11.851 2.702 445 HG22 VAL 57 HG22 VAL 57 12.469 10.526 1.571 446 HG23 VAL 57 HG23 VAL 57 13.639 11.842 1.702 447 H GLY 58 H GLY 58 12.710 7.007 4.609 448 HA2 GLY 58 HA2 GLY 58 13.953 5.540 5.924 449 HA3 GLY 58 HA3 GLY 58 14.851 6.886 6.595 450 H GLY 59 H GLY 59 11.539 7.503 6.817 451 HA2 GLY 59 HA2 GLY 59 11.446 6.970 9.683 452 HA3 GLY 59 HA3 GLY 59 10.221 7.785 8.722 453 H LYS 60 H LYS 60 9.553 5.845 10.677 454 HA LYS 60 HA LYS 60 8.603 3.568 9.021 455 HB2 LYS 60 HB2 LYS 60 9.697 3.463 11.859 456 HB3 LYS 60 HB3 LYS 60 8.768 2.150 11.131 457 HG2 LYS 60 HG2 LYS 60 10.516 2.068 9.291 458 HG3 LYS 60 HG3 LYS 60 11.481 3.191 10.263 459 HD2 LYS 60 HD2 LYS 60 11.594 1.577 12.092 460 HD3 LYS 60 HD3 LYS 60 10.489 0.485 11.253 461 HE2 LYS 60 HE2 LYS 60 12.207 0.222 9.448 462 HE3 LYS 60 HE3 LYS 60 13.314 1.212 10.403 463 HZ1 LYS 60 HZ1 LYS 60 13.663 -1.177 10.690 464 HZ2 LYS 60 HZ2 LYS 60 12.103 -1.340 11.321 465 HZ3 LYS 60 HZ3 LYS 60 13.258 -0.414 12.144 466 H ALA 61 H ALA 61 6.748 2.433 9.811 467 HA ALA 61 HA ALA 61 4.889 3.975 11.521 468 HB1 ALA 61 HB1 ALA 61 4.134 2.761 8.834 469 HB2 ALA 61 HB2 ALA 61 4.307 4.481 9.174 470 HB3 ALA 61 HB3 ALA 61 3.031 3.554 9.962 471 H ALA 62 H ALA 62 3.752 2.738 12.932 472 HA ALA 62 HA ALA 62 4.000 -0.229 12.783 473 HB1 ALA 62 HB1 ALA 62 3.794 1.529 15.263 474 HB2 ALA 62 HB2 ALA 62 5.239 0.686 14.700 475 HB3 ALA 62 HB3 ALA 62 3.841 -0.239 15.256 476 H TYR 63 H TYR 63 2.088 -1.202 12.360 477 HA TYR 63 HA TYR 63 -0.416 -0.058 13.429 478 HB2 TYR 63 HB2 TYR 63 -1.582 -0.305 11.297 479 HB3 TYR 63 HB3 TYR 63 -0.204 0.765 11.104 480 HD1 TYR 63 HD1 TYR 63 1.883 -0.100 9.909 481 HD2 TYR 63 HD2 TYR 63 -1.777 -2.314 9.964 482 HE1 TYR 63 HE1 TYR 63 2.645 -1.408 7.973 483 HE2 TYR 63 HE2 TYR 63 -1.020 -3.626 8.029 484 HH TYR 63 HH TYR 63 2.224 -3.494 6.852 485 H TYR 64 H TYR 64 -2.292 -1.581 13.017 486 HA TYR 64 HA TYR 64 -1.657 -4.389 12.636 487 HB2 TYR 64 HB2 TYR 64 -2.822 -5.061 14.800 488 HB3 TYR 64 HB3 TYR 64 -1.248 -4.304 15.005 489 HD1 TYR 64 HD1 TYR 64 -4.892 -3.855 15.517 490 HD2 TYR 64 HD2 TYR 64 -1.035 -2.092 16.062 491 HE1 TYR 64 HE1 TYR 64 -5.851 -2.237 17.078 492 HE2 TYR 64 HE2 TYR 64 -2.007 -0.477 17.620 493 HH TYR 64 HH TYR 64 -4.120 0.537 18.139 494 H MET 65 H MET 65 -3.285 -5.479 11.766 495 HA MET 65 HA MET 65 -5.694 -4.047 10.944 496 HB2 MET 65 HB2 MET 65 -4.598 -6.770 10.092 497 HB3 MET 65 HB3 MET 65 -5.912 -5.887 9.312 498 HG2 MET 65 HG2 MET 65 -4.421 -4.198 8.515 499 HG3 MET 65 HG3 MET 65 -3.104 -4.775 9.533 500 HE1 MET 65 HE1 MET 65 -4.679 -7.051 5.836 501 HE2 MET 65 HE2 MET 65 -5.339 -5.517 6.403 502 HE3 MET 65 HE3 MET 65 -5.573 -6.986 7.353 503 H THR 66 H THR 66 -7.239 -4.137 12.523 504 HA THR 66 HA THR 66 -7.614 -6.360 14.308 505 HB THR 66 HB THR 66 -9.427 -3.950 13.814 506 HG1 THR 66 HG1 THR 66 -8.246 -2.941 15.340 507 HG21 THR 66 HG21 THR 66 -10.355 -4.414 16.058 508 HG22 THR 66 HG22 THR 66 -9.355 -5.861 16.185 509 HG23 THR 66 HG23 THR 66 -10.639 -5.782 14.977 510 H GLY 67 H GLY 67 -8.335 -8.248 13.475 511 HA2 GLY 67 HA2 GLY 67 -9.837 -8.517 11.073 512 HA3 GLY 67 HA3 GLY 67 -9.398 -9.802 12.178 513 HA PRO 68 HA PRO 68 -14.126 -8.947 12.103 514 HB2 PRO 68 HB2 PRO 68 -14.847 -11.544 11.352 515 HB3 PRO 68 HB3 PRO 68 -14.636 -10.198 10.222 516 HG2 PRO 68 HG2 PRO 68 -12.697 -12.387 10.964 517 HG3 PRO 68 HG3 PRO 68 -13.058 -11.709 9.362 518 HD2 PRO 68 HD2 PRO 68 -10.839 -10.992 10.708 519 HD3 PRO 68 HD3 PRO 68 -11.730 -9.809 9.724 520 H ASP 69 H ASP 69 -12.280 -11.768 13.271 521 HA ASP 69 HA ASP 69 -14.044 -12.243 15.545 522 HB2 ASP 69 HB2 ASP 69 -11.336 -13.491 14.901 523 HB3 ASP 69 HB3 ASP 69 -12.506 -14.087 16.076 524 H GLY 70 H GLY 70 -12.191 -9.717 15.129 525 HA2 GLY 70 HA2 GLY 70 -10.985 -8.271 16.443 526 HA3 GLY 70 HA3 GLY 70 -11.209 -9.354 17.812 527 H THR 71 H THR 71 -9.884 -10.729 14.931 528 HA THR 71 HA THR 71 -7.484 -11.572 16.231 529 HB THR 71 HB THR 71 -8.134 -11.733 13.248 530 HG1 THR 71 HG1 THR 71 -8.761 -13.524 15.392 531 HG21 THR 71 HG21 THR 71 -6.257 -13.416 14.970 532 HG22 THR 71 HG22 THR 71 -5.755 -12.232 13.761 533 HG23 THR 71 HG23 THR 71 -6.610 -13.692 13.262 534 H LYS 72 H LYS 72 -6.113 -9.954 16.763 535 HA LYS 72 HA LYS 72 -5.710 -7.609 15.120 536 HB2 LYS 72 HB2 LYS 72 -5.922 -7.596 17.622 537 HB3 LYS 72 HB3 LYS 72 -4.371 -8.421 17.731 538 HG2 LYS 72 HG2 LYS 72 -3.219 -6.501 16.807 539 HG3 LYS 72 HG3 LYS 72 -4.745 -5.709 16.434 540 HD2 LYS 72 HD2 LYS 72 -3.839 -6.395 19.259 541 HD3 LYS 72 HD3 LYS 72 -3.575 -4.824 18.493 542 HE2 LYS 72 HE2 LYS 72 -6.009 -4.499 18.282 543 HE3 LYS 72 HE3 LYS 72 -6.299 -6.090 18.983 544 HZ1 LYS 72 HZ1 LYS 72 -6.580 -4.327 20.597 545 HZ2 LYS 72 HZ2 LYS 72 -4.986 -3.817 20.357 546 HZ3 LYS 72 HZ3 LYS 72 -5.293 -5.335 21.033 547 H ALA 73 H ALA 73 -4.514 -7.951 13.307 548 HA ALA 73 HA ALA 73 -2.147 -9.719 13.335 549 HB1 ALA 73 HB1 ALA 73 -3.809 -10.121 11.568 550 HB2 ALA 73 HB2 ALA 73 -2.271 -9.609 10.874 551 HB3 ALA 73 HB3 ALA 73 -3.616 -8.467 10.980 552 H ARG 74 H ARG 74 -0.402 -8.608 14.065 553 HA ARG 74 HA ARG 74 -0.076 -5.776 13.723 554 HB2 ARG 74 HB2 ARG 74 0.612 -7.037 15.768 555 HB3 ARG 74 HB3 ARG 74 1.890 -7.817 14.844 556 HG2 ARG 74 HG2 ARG 74 3.071 -5.741 14.573 557 HG3 ARG 74 HG3 ARG 74 1.708 -4.809 15.206 558 HD2 ARG 74 HD2 ARG 74 3.420 -6.779 16.773 559 HD3 ARG 74 HD3 ARG 74 3.492 -5.018 16.887 560 HE ARG 74 HE ARG 74 0.864 -5.746 17.453 561 HH11 ARG 74 HH11 ARG 74 3.975 -6.117 18.926 562 HH12 ARG 74 HH12 ARG 74 3.309 -6.379 20.498 563 HH21 ARG 74 HH21 ARG 74 0.048 -6.053 19.470 564 HH22 ARG 74 HH22 ARG 74 1.106 -6.342 20.804 565 H GLY 75 H GLY 75 1.053 -4.690 12.205 566 HA2 GLY 75 HA2 GLY 75 2.909 -6.117 10.371 567 HA3 GLY 75 HA3 GLY 75 1.684 -5.001 9.777 568 H TRP 76 H TRP 76 4.625 -4.875 9.501 569 HA TRP 76 HA TRP 76 5.187 -2.308 10.893 570 HB2 TRP 76 HB2 TRP 76 7.585 -2.769 10.633 571 HB3 TRP 76 HB3 TRP 76 6.811 -4.112 11.464 572 HD1 TRP 76 HD1 TRP 76 6.741 -6.475 10.176 573 HE1 TRP 76 HE1 TRP 76 8.026 -7.386 8.155 574 HE3 TRP 76 HE3 TRP 76 8.670 -2.082 8.379 575 HZ2 TRP 76 HZ2 TRP 76 9.636 -6.397 6.070 576 HZ3 TRP 76 HZ3 TRP 76 10.083 -2.152 6.362 577 HH2 TRP 76 HH2 TRP 76 10.560 -4.269 5.236 578 H TRP 77 H TRP 77 6.217 -0.647 9.673 579 HA TRP 77 HA TRP 77 6.280 -0.868 6.725 580 HB2 TRP 77 HB2 TRP 77 4.308 0.600 8.295 581 HB3 TRP 77 HB3 TRP 77 5.276 1.765 7.410 582 HD1 TRP 77 HD1 TRP 77 4.367 -1.625 5.793 583 HE1 TRP 77 HE1 TRP 77 2.764 -1.157 3.837 584 HE3 TRP 77 HE3 TRP 77 3.551 3.336 6.606 585 HZ2 TRP 77 HZ2 TRP 77 1.338 1.059 2.783 586 HZ3 TRP 77 HZ3 TRP 77 2.058 4.560 5.092 587 HH2 TRP 77 HH2 TRP 77 0.970 3.443 3.222 588 H GLN 78 H GLN 78 7.748 0.564 5.677 589 HA GLN 78 HA GLN 78 9.279 2.508 7.246 590 HB2 GLN 78 HB2 GLN 78 10.554 0.409 7.552 591 HB3 GLN 78 HB3 GLN 78 10.654 0.195 5.805 592 HG2 GLN 78 HG2 GLN 78 12.026 2.220 5.602 593 HG3 GLN 78 HG3 GLN 78 11.861 2.532 7.331 594 HE21 GLN 78 HE21 GLN 78 14.070 2.463 7.707 595 HE22 GLN 78 HE22 GLN 78 15.005 1.022 7.603 596 H PHE 79 H PHE 79 9.099 4.289 6.050 597 HA PHE 79 HA PHE 79 8.722 4.324 3.203 598 HB2 PHE 79 HB2 PHE 79 9.225 6.633 5.117 599 HB3 PHE 79 HB3 PHE 79 8.654 6.775 3.458 600 HD1 PHE 79 HD2 PHE 79 6.350 6.043 2.859 601 HD2 PHE 79 HD1 PHE 79 7.723 6.020 6.908 602 HE1 PHE 79 HE2 PHE 79 4.028 5.911 3.656 603 HE2 PHE 79 HE1 PHE 79 5.398 5.885 7.695 604 HZ PHE 79 HZ PHE 79 3.554 5.838 6.072 605 H THR 80 H THR 80 10.170 4.886 1.605 606 HA THR 80 HA THR 80 12.966 5.541 2.355 607 HB THR 80 HB THR 80 13.598 4.589 0.077 608 HG1 THR 80 HG1 THR 80 11.238 3.100 0.036 609 HG21 THR 80 HG21 THR 80 12.286 2.664 2.027 610 HG22 THR 80 HG22 THR 80 13.949 3.252 2.111 611 HG23 THR 80 HG23 THR 80 13.444 2.220 0.771 612 H THR 81 H THR 81 11.308 5.920 -0.829 613 HA THR 81 HA THR 81 12.502 8.623 -0.990 614 HB THR 81 HB THR 81 11.289 6.973 -3.248 615 HG1 THR 81 HG1 THR 81 13.090 5.904 -3.153 616 HG21 THR 81 HG21 THR 81 11.299 9.359 -3.803 617 HG22 THR 81 HG22 THR 81 12.559 8.540 -4.732 618 HG23 THR 81 HG23 THR 81 12.990 9.494 -3.309 619 H ILE 82 H ILE 82 11.073 9.971 0.040 620 HA ILE 82 HA ILE 82 8.323 10.219 -1.069 621 HB ILE 82 HB ILE 82 9.401 11.327 1.570 622 HG12 ILE 82 HG12 ILE 82 7.638 8.905 0.995 623 HG13 ILE 82 HG13 ILE 82 9.233 8.898 1.734 624 HG21 ILE 82 HG21 ILE 82 7.613 12.744 0.614 625 HG22 ILE 82 HG22 ILE 82 7.047 11.919 2.064 626 HG23 ILE 82 HG23 ILE 82 6.552 11.336 0.473 627 HD11 ILE 82 HD11 ILE 82 8.276 10.068 3.694 628 HD12 ILE 82 HD12 ILE 82 7.549 8.494 3.384 629 HD13 ILE 82 HD13 ILE 82 6.682 9.960 2.941 630 H GLU 83 H GLU 83 8.712 11.489 -2.856 631 HA GLU 83 HA GLU 83 10.302 13.943 -2.654 632 HB2 GLU 83 HB2 GLU 83 8.824 12.752 -5.042 633 HB3 GLU 83 HB3 GLU 83 9.825 14.205 -5.082 634 HG2 GLU 83 HG2 GLU 83 11.746 12.696 -4.239 635 HG3 GLU 83 HG3 GLU 83 10.699 11.337 -4.661 636 H ALA 84 H ALA 84 6.931 12.982 -3.254 637 HA ALA 84 HA ALA 84 4.933 13.978 -3.085 638 HB1 ALA 84 HB1 ALA 84 4.574 15.832 -1.522 639 HB2 ALA 84 HB2 ALA 84 6.311 16.161 -1.488 640 HB3 ALA 84 HB3 ALA 84 5.688 14.649 -0.829 641 HA PRO 85 HA PRO 85 3.054 15.086 -3.173 642 HB2 PRO 85 HB2 PRO 85 1.004 15.981 -4.597 643 HB3 PRO 85 HB3 PRO 85 2.019 17.139 -3.720 644 HG2 PRO 85 HG2 PRO 85 2.071 16.426 -6.657 645 HG3 PRO 85 HG3 PRO 85 2.141 18.031 -5.905 646 HD2 PRO 85 HD2 PRO 85 4.378 16.541 -6.745 647 HD3 PRO 85 HD3 PRO 85 4.429 17.894 -5.591 648 H ASP 86 H ASP 86 4.489 13.983 -5.893 649 HA ASP 86 HA ASP 86 2.326 12.165 -6.767 650 HB2 ASP 86 HB2 ASP 86 3.622 11.969 -8.884 651 HB3 ASP 86 HB3 ASP 86 3.151 13.626 -8.531 652 H HIS 87 H HIS 87 5.858 12.119 -6.110 653 HA HIS 87 HA HIS 87 5.923 9.214 -6.426 654 HB2 HIS 87 HB2 HIS 87 7.632 10.785 -7.462 655 HB3 HIS 87 HB3 HIS 87 8.262 11.079 -5.847 656 HD1 HIS 87 HD1 HIS 87 10.150 9.960 -7.888 657 HD2 HIS 87 HD2 HIS 87 7.866 7.499 -5.449 658 HE1 HIS 87 HE1 HIS 87 11.372 7.785 -7.805 659 HE2 HIS 87 HE2 HIS 87 9.886 6.267 -6.475 660 H LEU 88 H LEU 88 5.427 8.018 -4.741 661 HA LEU 88 HA LEU 88 6.759 8.435 -2.125 662 HB2 LEU 88 HB2 LEU 88 4.353 8.639 -1.827 663 HB3 LEU 88 HB3 LEU 88 4.051 7.192 -2.766 664 HG LEU 88 HG LEU 88 5.040 5.804 -0.958 665 HD11 LEU 88 HD11 LEU 88 6.650 7.380 -0.022 666 HD12 LEU 88 HD12 LEU 88 5.582 6.757 1.233 667 HD13 LEU 88 HD13 LEU 88 5.337 8.388 0.597 668 HD21 LEU 88 HD21 LEU 88 3.253 6.074 0.699 669 HD22 LEU 88 HD22 LEU 88 2.629 6.207 -0.943 670 HD23 LEU 88 HD23 LEU 88 2.859 7.661 0.032 671 H GLU 89 H GLU 89 8.072 6.777 -1.490 672 HA GLU 89 HA GLU 89 7.604 4.042 -2.523 673 HB2 GLU 89 HB2 GLU 89 10.312 5.399 -2.144 674 HB3 GLU 89 HB3 GLU 89 10.123 3.654 -2.283 675 HG2 GLU 89 HG2 GLU 89 9.205 3.932 -4.544 676 HG3 GLU 89 HG3 GLU 89 9.388 5.680 -4.411 677 H PHE 90 H PHE 90 7.711 2.472 -1.015 678 HA PHE 90 HA PHE 90 9.003 2.829 1.548 679 HB2 PHE 90 HB2 PHE 90 7.015 2.200 2.905 680 HB3 PHE 90 HB3 PHE 90 6.772 3.731 2.078 681 HD1 PHE 90 HD2 PHE 90 5.787 0.139 2.126 682 HD2 PHE 90 HD1 PHE 90 4.972 4.007 0.486 683 HE1 PHE 90 HE2 PHE 90 3.650 -0.682 1.235 684 HE2 PHE 90 HE1 PHE 90 2.833 3.174 -0.389 685 HZ PHE 90 HZ PHE 90 2.171 0.832 -0.024 686 H ASP 91 H ASP 91 8.730 0.723 2.837 687 HA ASP 91 HA ASP 91 8.731 -1.651 1.088 688 HB2 ASP 91 HB2 ASP 91 10.391 -1.039 3.574 689 HB3 ASP 91 HB3 ASP 91 10.299 -2.633 2.822 690 H ASP 92 H ASP 92 6.695 -2.384 1.364 691 HA ASP 92 HA ASP 92 5.307 -2.479 3.874 692 HB2 ASP 92 HB2 ASP 92 4.121 -2.323 1.683 693 HB3 ASP 92 HB3 ASP 92 4.713 -3.923 1.251 694 H GLY 93 H GLY 93 4.953 -4.275 5.200 695 HA2 GLY 93 HA2 GLY 93 5.846 -6.921 4.596 696 HA3 GLY 93 HA3 GLY 93 6.972 -6.105 5.675 697 H PHE 94 H PHE 94 5.299 -8.418 6.132 698 HA PHE 94 HA PHE 94 3.300 -7.586 8.110 699 HB2 PHE 94 HB2 PHE 94 4.129 -10.353 7.117 700 HB3 PHE 94 HB3 PHE 94 2.836 -10.049 8.272 701 HD1 PHE 94 HD1 PHE 94 3.897 -9.439 4.740 702 HD2 PHE 94 HD2 PHE 94 0.641 -9.470 7.516 703 HE1 PHE 94 HE1 PHE 94 2.305 -9.153 2.885 704 HE2 PHE 94 HE2 PHE 94 -0.941 -9.181 5.656 705 HZ PHE 94 HZ PHE 94 -0.112 -9.021 3.342 706 H ALA 95 H ALA 95 3.571 -7.833 10.305 707 HA ALA 95 HA ALA 95 6.246 -8.638 11.305 708 HB1 ALA 95 HB1 ALA 95 5.583 -6.297 11.778 709 HB2 ALA 95 HB2 ALA 95 5.777 -7.238 13.260 710 HB3 ALA 95 HB3 ALA 95 4.159 -6.877 12.649 711 H ASP 96 H ASP 96 6.291 -9.624 13.423 712 HA ASP 96 HA ASP 96 4.415 -11.794 13.808 713 HB2 ASP 96 HB2 ASP 96 6.812 -12.141 14.111 714 HB3 ASP 96 HB3 ASP 96 6.908 -10.835 15.287 715 H GLU 97 H GLU 97 3.517 -12.161 16.100 716 HA GLU 97 HA GLU 97 1.774 -10.130 16.929 717 HB2 GLU 97 HB2 GLU 97 1.234 -11.597 18.821 718 HB3 GLU 97 HB3 GLU 97 1.399 -12.530 17.336 719 HG2 GLU 97 HG2 GLU 97 3.669 -13.238 18.034 720 HG3 GLU 97 HG3 GLU 97 3.499 -12.308 19.518 721 H HIS 98 H HIS 98 5.108 -10.541 17.760 722 HA HIS 98 HA HIS 98 4.946 -8.608 20.001 723 HB2 HIS 98 HB2 HIS 98 7.353 -10.258 19.106 724 HB3 HIS 98 HB3 HIS 98 7.216 -9.315 20.591 725 HD1 HIS 98 HD1 HIS 98 5.089 -10.247 22.197 726 HD2 HIS 98 HD2 HIS 98 6.776 -12.869 19.455 727 HE1 HIS 98 HE1 HIS 98 4.405 -12.544 22.953 728 HE2 HIS 98 HE2 HIS 98 5.332 -14.093 21.219 729 H GLY 99 H GLY 99 5.699 -8.746 16.663 730 HA2 GLY 99 HA2 GLY 99 5.828 -6.625 15.495 731 HA3 GLY 99 HA3 GLY 99 6.866 -6.009 16.765 732 H ALA 100 H ALA 100 7.812 -9.171 15.968 733 HA ALA 100 HA ALA 100 10.244 -8.279 14.689 734 HB1 ALA 100 HB1 ALA 100 10.253 -10.156 16.277 735 HB2 ALA 100 HB2 ALA 100 10.881 -10.655 14.707 736 HB3 ALA 100 HB3 ALA 100 9.239 -11.105 15.183 737 HA PRO 101 HA PRO 101 8.613 -8.345 10.427 738 HB2 PRO 101 HB2 PRO 101 11.076 -8.434 9.103 739 HB3 PRO 101 HB3 PRO 101 10.309 -6.965 9.718 740 HG2 PRO 101 HG2 PRO 101 12.436 -8.678 11.014 741 HG3 PRO 101 HG3 PRO 101 12.351 -6.906 10.889 742 HD2 PRO 101 HD2 PRO 101 11.662 -8.128 13.172 743 HD3 PRO 101 HD3 PRO 101 10.718 -6.736 12.588 744 H VAL 102 H VAL 102 7.669 -10.134 9.636 745 HA VAL 102 HA VAL 102 8.598 -12.798 9.941 746 HB VAL 102 HB VAL 102 6.419 -11.712 8.094 747 HG11 VAL 102 HG11 VAL 102 7.108 -13.966 7.339 748 HG12 VAL 102 HG12 VAL 102 5.499 -14.021 8.061 749 HG13 VAL 102 HG13 VAL 102 6.895 -14.597 8.977 750 HG21 VAL 102 HG21 VAL 102 4.848 -12.405 9.877 751 HG22 VAL 102 HG22 VAL 102 6.004 -11.211 10.472 752 HG23 VAL 102 HG23 VAL 102 6.209 -12.915 10.883 753 H ASP 103 H ASP 103 10.341 -13.560 8.958 754 HA ASP 103 HA ASP 103 11.530 -12.496 6.587 755 HB2 ASP 103 HB2 ASP 103 12.775 -13.486 8.545 756 HB3 ASP 103 HB3 ASP 103 12.173 -15.076 8.084 757 H GLU 104 H GLU 104 9.460 -15.224 7.273 758 HA GLU 104 HA GLU 104 9.645 -16.746 4.929 759 HB2 GLU 104 HB2 GLU 104 8.536 -17.463 7.021 760 HB3 GLU 104 HB3 GLU 104 7.264 -16.270 6.773 761 HG2 GLU 104 HG2 GLU 104 6.512 -17.459 4.769 762 HG3 GLU 104 HG3 GLU 104 7.818 -18.627 4.946 763 H LEU 105 H LEU 105 7.516 -13.993 5.695 764 HA LEU 105 HA LEU 105 6.364 -13.862 3.018 765 HB2 LEU 105 HB2 LEU 105 5.993 -12.182 5.520 766 HB3 LEU 105 HB3 LEU 105 5.151 -11.854 4.010 767 HG LEU 105 HG LEU 105 4.914 -14.471 5.567 768 HD11 LEU 105 HD11 LEU 105 3.908 -12.668 6.866 769 HD12 LEU 105 HD12 LEU 105 2.670 -13.742 6.219 770 HD13 LEU 105 HD13 LEU 105 2.948 -12.166 5.470 771 HD21 LEU 105 HD21 LEU 105 3.317 -13.441 3.196 772 HD22 LEU 105 HD22 LEU 105 3.045 -14.961 4.060 773 HD23 LEU 105 HD23 LEU 105 4.534 -14.722 3.152 774 H GLY 106 H GLY 106 9.046 -12.458 4.708 775 HA2 GLY 106 HA2 GLY 106 10.856 -11.323 3.870 776 HA3 GLY 106 HA3 GLY 106 10.135 -11.435 2.276 777 H VAL 107 H VAL 107 11.011 -9.316 1.922 778 HA VAL 107 HA VAL 107 9.399 -7.069 3.020 779 HB VAL 107 HB VAL 107 12.335 -6.933 2.145 780 HG11 VAL 107 HG11 VAL 107 10.591 -4.814 3.466 781 HG12 VAL 107 HG12 VAL 107 11.127 -4.809 1.785 782 HG13 VAL 107 HG13 VAL 107 12.307 -4.638 3.087 783 HG21 VAL 107 HG21 VAL 107 12.913 -6.615 4.540 784 HG22 VAL 107 HG22 VAL 107 12.167 -8.190 4.264 785 HG23 VAL 107 HG23 VAL 107 11.225 -6.883 4.984 786 H THR 108 H THR 108 8.320 -5.915 1.433 787 HA THR 108 HA THR 108 9.233 -6.173 -1.388 788 HB THR 108 HB THR 108 7.197 -7.460 -1.210 789 HG1 THR 108 HG1 THR 108 7.347 -6.348 -3.124 790 HG21 THR 108 HG21 THR 108 6.162 -6.435 0.794 791 HG22 THR 108 HG22 THR 108 5.022 -6.504 -0.550 792 HG23 THR 108 HG23 THR 108 5.801 -4.976 -0.134 793 H HIS 109 H HIS 109 9.702 -4.341 -2.406 794 HA HIS 109 HA HIS 109 9.335 -1.782 -1.032 795 HB2 HIS 109 HB2 HIS 109 11.543 -2.669 -2.120 796 HB3 HIS 109 HB3 HIS 109 10.833 -2.184 -3.649 797 HD1 HIS 109 HD1 HIS 109 12.755 -0.932 -0.838 798 HD2 HIS 109 HD2 HIS 109 10.319 0.749 -3.746 799 HE1 HIS 109 HE1 HIS 109 13.385 1.481 -0.923 800 HE2 HIS 109 HE2 HIS 109 12.051 2.420 -2.814 801 H ALA 110 H ALA 110 7.322 -0.981 -1.366 802 HA ALA 110 HA ALA 110 5.982 -1.174 -3.988 803 HB1 ALA 110 HB1 ALA 110 4.879 -0.271 -1.307 804 HB2 ALA 110 HB2 ALA 110 4.725 -1.888 -1.997 805 HB3 ALA 110 HB3 ALA 110 3.947 -0.516 -2.789 806 H THR 111 H THR 111 5.699 0.561 -5.317 807 HA THR 111 HA THR 111 6.664 3.237 -4.428 808 HB THR 111 HB THR 111 6.677 2.201 -7.321 809 HG1 THR 111 HG1 THR 111 8.162 0.987 -6.015 810 HG21 THR 111 HG21 THR 111 8.214 4.076 -7.733 811 HG22 THR 111 HG22 THR 111 8.084 4.577 -6.047 812 HG23 THR 111 HG23 THR 111 6.674 4.659 -7.100 813 H VAL 112 H VAL 112 4.872 4.455 -4.042 814 HA VAL 112 HA VAL 112 2.398 4.160 -5.612 815 HB VAL 112 HB VAL 112 2.978 5.891 -3.164 816 HG11 VAL 112 HG11 VAL 112 1.124 6.815 -4.512 817 HG12 VAL 112 HG12 VAL 112 0.527 6.162 -2.987 818 HG13 VAL 112 HG13 VAL 112 0.309 5.246 -4.479 819 HG21 VAL 112 HG21 VAL 112 3.138 3.487 -2.628 820 HG22 VAL 112 HG22 VAL 112 1.539 3.216 -3.325 821 HG23 VAL 112 HG23 VAL 112 1.710 4.205 -1.875 822 H LYS 113 H LYS 113 2.327 5.331 -7.471 823 HA LYS 113 HA LYS 113 3.625 8.003 -7.600 824 HB2 LYS 113 HB2 LYS 113 3.328 5.861 -9.752 825 HB3 LYS 113 HB3 LYS 113 4.013 7.465 -10.026 826 HG2 LYS 113 HG2 LYS 113 5.907 7.004 -8.625 827 HG3 LYS 113 HG3 LYS 113 5.159 5.548 -7.973 828 HD2 LYS 113 HD2 LYS 113 6.935 4.984 -9.567 829 HD3 LYS 113 HD3 LYS 113 5.363 4.437 -10.146 830 HE2 LYS 113 HE2 LYS 113 5.237 6.345 -11.663 831 HE3 LYS 113 HE3 LYS 113 6.775 6.960 -11.059 832 HZ1 LYS 113 HZ1 LYS 113 6.981 5.759 -13.160 833 HZ2 LYS 113 HZ2 LYS 113 6.400 4.350 -12.424 834 HZ3 LYS 113 HZ3 LYS 113 7.870 5.024 -11.923 835 H LEU 114 H LEU 114 2.098 9.514 -7.551 836 HA LEU 114 HA LEU 114 -0.576 9.142 -8.667 837 HB2 LEU 114 HB2 LEU 114 0.686 11.480 -7.175 838 HB3 LEU 114 HB3 LEU 114 -1.003 11.397 -7.660 839 HG LEU 114 HG LEU 114 0.321 9.466 -5.704 840 HD11 LEU 114 HD11 LEU 114 0.188 11.728 -4.759 841 HD12 LEU 114 HD12 LEU 114 -0.947 10.647 -3.956 842 HD13 LEU 114 HD13 LEU 114 -1.533 11.813 -5.149 843 HD21 LEU 114 HD21 LEU 114 -2.604 9.817 -6.450 844 HD22 LEU 114 HD22 LEU 114 -1.978 8.751 -5.188 845 HD23 LEU 114 HD23 LEU 114 -1.571 8.448 -6.873 846 H GLU 115 H GLU 115 -1.291 10.022 -10.553 847 HA GLU 115 HA GLU 115 0.496 11.837 -12.072 848 HB2 GLU 115 HB2 GLU 115 0.391 9.574 -13.039 849 HB3 GLU 115 HB3 GLU 115 -1.364 9.683 -13.140 850 HG2 GLU 115 HG2 GLU 115 -1.225 11.419 -14.822 851 HG3 GLU 115 HG3 GLU 115 0.526 11.546 -14.614 852 HA PRO 116 HA PRO 116 -3.038 14.685 -11.652 853 HB2 PRO 116 HB2 PRO 116 -2.036 16.685 -13.279 854 HB3 PRO 116 HB3 PRO 116 -1.518 16.429 -11.607 855 HG2 PRO 116 HG2 PRO 116 -0.214 15.480 -14.164 856 HG3 PRO 116 HG3 PRO 116 0.535 16.269 -12.758 857 HD2 PRO 116 HD2 PRO 116 0.690 13.612 -13.065 858 HD3 PRO 116 HD3 PRO 116 0.447 14.321 -11.450 859 H LEU 117 H LEU 117 -4.777 13.728 -12.675 860 HA LEU 117 HA LEU 117 -5.073 13.958 -15.626 861 HB2 LEU 117 HB2 LEU 117 -6.978 12.599 -13.679 862 HB3 LEU 117 HB3 LEU 117 -6.977 12.461 -15.430 863 HG LEU 117 HG LEU 117 -4.920 11.288 -13.515 864 HD11 LEU 117 HD11 LEU 117 -5.794 9.115 -14.254 865 HD12 LEU 117 HD12 LEU 117 -6.998 9.922 -15.262 866 HD13 LEU 117 HD13 LEU 117 -7.056 10.092 -13.504 867 HD21 LEU 117 HD21 LEU 117 -4.990 11.085 -16.548 868 HD22 LEU 117 HD22 LEU 117 -3.886 10.221 -15.473 869 HD23 LEU 117 HD23 LEU 117 -3.803 11.976 -15.589 870 H GLU 118 H GLU 118 -5.113 16.284 -13.907 871 HA GLU 118 HA GLU 118 -6.129 18.270 -13.658 872 HB2 GLU 118 HB2 GLU 118 -6.721 17.951 -16.066 873 HB3 GLU 118 HB3 GLU 118 -8.236 17.217 -15.579 874 HG2 GLU 118 HG2 GLU 118 -8.817 19.383 -14.413 875 HG3 GLU 118 HG3 GLU 118 -7.380 20.091 -15.153 876 H ASN 119 H ASN 119 -9.243 16.557 -14.092 877 HA ASN 119 HA ASN 119 -10.180 17.452 -11.474 878 HB2 ASN 119 HB2 ASN 119 -11.611 15.848 -13.640 879 HB3 ASN 119 HB3 ASN 119 -12.374 16.563 -12.220 880 HD21 ASN 119 HD21 ASN 119 -12.809 17.041 -15.123 881 HD22 ASN 119 HD22 ASN 119 -12.605 18.743 -15.329 882 H ARG 120 H ARG 120 -8.689 14.667 -12.794 883 HA ARG 120 HA ARG 120 -9.377 13.059 -10.378 884 HB2 ARG 120 HB2 ARG 120 -8.815 11.923 -13.157 885 HB3 ARG 120 HB3 ARG 120 -9.242 11.012 -11.707 886 HG2 ARG 120 HG2 ARG 120 -11.477 12.171 -11.721 887 HG3 ARG 120 HG3 ARG 120 -11.029 12.911 -13.264 888 HD2 ARG 120 HD2 ARG 120 -11.399 9.958 -12.663 889 HD3 ARG 120 HD3 ARG 120 -12.391 10.966 -13.716 890 HE ARG 120 HE ARG 120 -10.142 11.184 -15.019 891 HH11 ARG 120 HH11 ARG 120 -11.362 8.295 -13.554 892 HH12 ARG 120 HH12 ARG 120 -10.487 7.272 -14.636 893 HH21 ARG 120 HH21 ARG 120 -9.046 9.853 -16.364 894 HH22 ARG 120 HH22 ARG 120 -9.196 8.139 -16.205 895 H THR 121 H THR 121 -7.674 11.173 -10.203 896 HA THR 121 HA THR 121 -4.973 11.896 -11.120 897 HB THR 121 HB THR 121 -5.603 11.331 -8.177 898 HG1 THR 121 HG1 THR 121 -6.068 13.482 -8.816 899 HG21 THR 121 HG21 THR 121 -3.419 10.358 -8.820 900 HG22 THR 121 HG22 THR 121 -3.197 11.761 -7.772 901 HG23 THR 121 HG23 THR 121 -2.925 11.909 -9.512 902 H ARG 122 H ARG 122 -3.698 10.131 -11.562 903 HA ARG 122 HA ARG 122 -4.910 7.447 -11.343 904 HB2 ARG 122 HB2 ARG 122 -4.449 8.361 -13.625 905 HB3 ARG 122 HB3 ARG 122 -2.744 8.487 -13.222 906 HG2 ARG 122 HG2 ARG 122 -2.560 6.065 -13.041 907 HG3 ARG 122 HG3 ARG 122 -4.303 5.882 -13.290 908 HD2 ARG 122 HD2 ARG 122 -2.326 7.016 -15.312 909 HD3 ARG 122 HD3 ARG 122 -3.022 5.397 -15.345 910 HE ARG 122 HE ARG 122 -5.256 6.699 -15.465 911 HH11 ARG 122 HH11 ARG 122 -2.343 7.783 -17.000 912 HH12 ARG 122 HH12 ARG 122 -3.201 8.528 -18.302 913 HH21 ARG 122 HH21 ARG 122 -6.304 7.667 -17.123 914 HH22 ARG 122 HH22 ARG 122 -5.411 8.463 -18.373 915 H MET 123 H MET 123 -4.085 6.308 -9.698 916 HA MET 123 HA MET 123 -1.387 6.794 -8.649 917 HB2 MET 123 HB2 MET 123 -3.296 6.943 -7.055 918 HB3 MET 123 HB3 MET 123 -3.726 5.277 -7.413 919 HG2 MET 123 HG2 MET 123 -1.512 4.551 -6.514 920 HG3 MET 123 HG3 MET 123 -1.168 6.230 -6.097 921 HE1 MET 123 HE1 MET 123 -4.644 4.337 -5.821 922 HE2 MET 123 HE2 MET 123 -4.503 3.684 -4.189 923 HE3 MET 123 HE3 MET 123 -3.416 3.122 -5.456 924 H THR 124 H THR 124 0.159 5.397 -9.288 925 HA THR 124 HA THR 124 -0.556 2.582 -9.908 926 HB THR 124 HB THR 124 1.820 4.135 -11.038 927 HG1 THR 124 HG1 THR 124 0.576 4.635 -12.707 928 HG21 THR 124 HG21 THR 124 2.011 2.226 -12.609 929 HG22 THR 124 HG22 THR 124 0.678 1.411 -11.790 930 HG23 THR 124 HG23 THR 124 2.201 1.682 -10.939 931 H ILE 125 H ILE 125 0.042 1.275 -8.249 932 HA ILE 125 HA ILE 125 2.403 1.951 -6.587 933 HB ILE 125 HB ILE 125 0.107 0.058 -5.900 934 HG12 ILE 125 HG12 ILE 125 0.563 2.952 -5.020 935 HG13 ILE 125 HG13 ILE 125 -0.729 2.384 -6.073 936 HG21 ILE 125 HG21 ILE 125 2.200 -0.495 -4.710 937 HG22 ILE 125 HG22 ILE 125 1.004 0.149 -3.587 938 HG23 ILE 125 HG23 ILE 125 2.334 1.171 -4.136 939 HD11 ILE 125 HD11 ILE 125 -1.571 2.818 -3.862 940 HD12 ILE 125 HD12 ILE 125 -0.377 1.739 -3.144 941 HD13 ILE 125 HD13 ILE 125 -1.647 1.087 -4.181 942 H ILE 126 H ILE 126 4.213 0.837 -7.175 943 HA ILE 126 HA ILE 126 3.956 -1.861 -8.371 944 HB ILE 126 HB ILE 126 6.436 -0.066 -8.561 945 HG12 ILE 126 HG12 ILE 126 5.618 0.226 -11.055 946 HG13 ILE 126 HG13 ILE 126 4.030 -0.181 -10.427 947 HG21 ILE 126 HG21 ILE 126 7.057 -1.574 -10.434 948 HG22 ILE 126 HG22 ILE 126 5.607 -2.535 -10.138 949 HG23 ILE 126 HG23 ILE 126 6.875 -2.451 -8.911 950 HD11 ILE 126 HD11 ILE 126 4.148 1.765 -8.935 951 HD12 ILE 126 HD12 ILE 126 4.301 2.196 -10.636 952 HD13 ILE 126 HD13 ILE 126 5.732 2.167 -9.605 953 H SER 127 H SER 127 4.244 -3.375 -6.827 954 HA SER 127 HA SER 127 6.116 -3.059 -4.597 955 HB2 SER 127 HB2 SER 127 3.976 -5.188 -5.086 956 HB3 SER 127 HB3 SER 127 4.941 -5.014 -3.617 957 HG SER 127 HG SER 127 3.232 -3.867 -3.069 958 H THR 128 H THR 128 8.156 -3.692 -5.139 959 HA THR 128 HA THR 128 8.661 -5.960 -6.935 960 HB THR 128 HB THR 128 11.048 -5.270 -6.787 961 HG1 THR 128 HG1 THR 128 11.300 -4.412 -4.784 962 HG21 THR 128 HG21 THR 128 10.863 -3.048 -7.872 963 HG22 THR 128 HG22 THR 128 9.190 -2.916 -7.328 964 HG23 THR 128 HG23 THR 128 9.642 -4.160 -8.498 965 H PHE 129 H PHE 129 9.541 -7.911 -6.296 966 HA PHE 129 HA PHE 129 9.769 -8.448 -3.376 967 HB2 PHE 129 HB2 PHE 129 9.012 -10.430 -5.576 968 HB3 PHE 129 HB3 PHE 129 8.994 -10.732 -3.842 969 HD1 PHE 129 HD1 PHE 129 7.236 -9.635 -2.401 970 HD2 PHE 129 HD2 PHE 129 7.168 -9.293 -6.659 971 HE1 PHE 129 HE1 PHE 129 4.907 -8.843 -2.309 972 HE2 PHE 129 HE2 PHE 129 4.844 -8.501 -6.555 973 HZ PHE 129 HZ PHE 129 3.713 -8.270 -4.383 974 H GLU 130 H GLU 130 11.342 -10.090 -2.709 975 HA GLU 130 HA GLU 130 13.922 -9.683 -3.877 976 HB2 GLU 130 HB2 GLU 130 13.036 -11.607 -1.683 977 HB3 GLU 130 HB3 GLU 130 14.716 -11.255 -2.092 978 HG2 GLU 130 HG2 GLU 130 12.685 -9.252 -1.028 979 HG3 GLU 130 HG3 GLU 130 13.960 -10.027 -0.088 980 H SER 131 H SER 131 11.818 -12.561 -3.684 981 HA SER 131 HA SER 131 13.209 -13.871 -5.916 982 HB2 SER 131 HB2 SER 131 12.939 -15.195 -3.171 983 HB3 SER 131 HB3 SER 131 13.539 -15.986 -4.627 984 HG SER 131 HG SER 131 14.951 -14.726 -2.872 985 H GLU 132 H GLU 132 12.082 -15.947 -6.517 986 HA GLU 132 HA GLU 132 9.292 -15.677 -6.841 987 HB2 GLU 132 HB2 GLU 132 10.958 -18.220 -7.129 988 HB3 GLU 132 HB3 GLU 132 9.306 -18.022 -7.693 989 HG2 GLU 132 HG2 GLU 132 10.635 -17.811 -9.616 990 HG3 GLU 132 HG3 GLU 132 10.146 -16.167 -9.213 991 H GLU 133 H GLU 133 11.191 -17.549 -4.470 992 HA GLU 133 HA GLU 133 9.090 -18.934 -3.229 993 HB2 GLU 133 HB2 GLU 133 10.564 -19.230 -1.308 994 HB3 GLU 133 HB3 GLU 133 11.458 -19.442 -2.808 995 HG2 GLU 133 HG2 GLU 133 12.383 -17.140 -2.562 996 HG3 GLU 133 HG3 GLU 133 11.523 -16.975 -1.033 997 H GLN 134 H GLN 134 10.063 -15.546 -2.841 998 HA GLN 134 HA GLN 134 8.254 -15.015 -0.629 999 HB2 GLN 134 HB2 GLN 134 10.311 -13.640 -0.960 1000 HB3 GLN 134 HB3 GLN 134 9.658 -13.039 -2.483 1001 HG2 GLN 134 HG2 GLN 134 7.712 -12.082 -1.175 1002 HG3 GLN 134 HG3 GLN 134 8.544 -12.558 0.303 1003 HE21 GLN 134 HE21 GLN 134 7.742 -9.910 -0.539 1004 HE22 GLN 134 HE22 GLN 134 9.183 -8.963 -0.599 1005 H MET 135 H MET 135 8.349 -14.261 -4.104 1006 HA MET 135 HA MET 135 6.048 -12.724 -4.403 1007 HB2 MET 135 HB2 MET 135 7.790 -12.814 -6.078 1008 HB3 MET 135 HB3 MET 135 7.535 -14.530 -6.341 1009 HG2 MET 135 HG2 MET 135 6.662 -13.153 -8.170 1010 HG3 MET 135 HG3 MET 135 5.397 -14.103 -7.387 1011 HE1 MET 135 HE1 MET 135 3.776 -10.544 -8.513 1012 HE2 MET 135 HE2 MET 135 3.800 -12.266 -8.896 1013 HE3 MET 135 HE3 MET 135 5.186 -11.251 -9.302 1014 H GLN 136 H GLN 136 6.381 -16.210 -5.118 1015 HA GLN 136 HA GLN 136 3.738 -16.961 -5.500 1016 HB2 GLN 136 HB2 GLN 136 6.218 -18.361 -4.543 1017 HB3 GLN 136 HB3 GLN 136 4.697 -19.195 -4.291 1018 HG2 GLN 136 HG2 GLN 136 5.885 -19.889 -6.357 1019 HG3 GLN 136 HG3 GLN 136 4.247 -19.311 -6.632 1020 HE21 GLN 136 HE21 GLN 136 4.789 -19.039 -8.824 1021 HE22 GLN 136 HE22 GLN 136 5.736 -17.724 -9.377 1022 H LYS 137 H LYS 137 5.542 -16.827 -2.401 1023 HA LYS 137 HA LYS 137 3.530 -17.858 -0.714 1024 HB2 LYS 137 HB2 LYS 137 5.923 -17.758 -0.102 1025 HB3 LYS 137 HB3 LYS 137 5.850 -16.004 -0.024 1026 HG2 LYS 137 HG2 LYS 137 5.829 -17.001 2.215 1027 HG3 LYS 137 HG3 LYS 137 4.331 -16.118 1.895 1028 HD2 LYS 137 HD2 LYS 137 3.230 -18.315 1.330 1029 HD3 LYS 137 HD3 LYS 137 4.717 -19.141 1.815 1030 HE2 LYS 137 HE2 LYS 137 4.456 -18.241 4.104 1031 HE3 LYS 137 HE3 LYS 137 2.989 -17.393 3.606 1032 HZ1 LYS 137 HZ1 LYS 137 2.428 -19.415 4.711 1033 HZ2 LYS 137 HZ2 LYS 137 3.401 -20.326 3.677 1034 HZ3 LYS 137 HZ3 LYS 137 2.016 -19.566 3.078 1035 H MET 138 H MET 138 4.195 -14.511 -1.688 1036 HA MET 138 HA MET 138 2.385 -13.140 0.001 1037 HB2 MET 138 HB2 MET 138 3.271 -12.447 -2.828 1038 HB3 MET 138 HB3 MET 138 2.473 -11.335 -1.724 1039 HG2 MET 138 HG2 MET 138 5.046 -12.559 -0.809 1040 HG3 MET 138 HG3 MET 138 5.119 -11.348 -2.081 1041 HE1 MET 138 HE1 MET 138 4.515 -12.043 1.710 1042 HE2 MET 138 HE2 MET 138 2.856 -11.640 1.263 1043 HE3 MET 138 HE3 MET 138 3.787 -10.539 2.275 1044 H ALA 139 H ALA 139 1.997 -14.494 -3.259 1045 HA ALA 139 HA ALA 139 -0.740 -13.865 -3.655 1046 HB1 ALA 139 HB1 ALA 139 0.779 -14.384 -5.493 1047 HB2 ALA 139 HB2 ALA 139 -0.611 -15.470 -5.520 1048 HB3 ALA 139 HB3 ALA 139 0.952 -16.047 -4.920 1049 H GLU 140 H GLU 140 0.849 -16.654 -2.132 1050 HA GLU 140 HA GLU 140 -1.460 -18.318 -1.857 1051 HB2 GLU 140 HB2 GLU 140 1.095 -18.287 -0.192 1052 HB3 GLU 140 HB3 GLU 140 -0.117 -19.568 -0.168 1053 HG2 GLU 140 HG2 GLU 140 1.741 -18.812 -2.437 1054 HG3 GLU 140 HG3 GLU 140 1.746 -20.299 -1.496 1055 H MET 141 H MET 141 -0.329 -15.565 -0.037 1056 HA MET 141 HA MET 141 -2.133 -16.006 2.230 1057 HB2 MET 141 HB2 MET 141 -0.303 -13.678 1.508 1058 HB3 MET 141 HB3 MET 141 -1.250 -13.773 2.992 1059 HG2 MET 141 HG2 MET 141 0.904 -15.749 2.187 1060 HG3 MET 141 HG3 MET 141 1.125 -14.404 3.307 1061 HE1 MET 141 HE1 MET 141 -1.100 -15.475 6.354 1062 HE2 MET 141 HE2 MET 141 -1.545 -14.391 5.039 1063 HE3 MET 141 HE3 MET 141 0.068 -14.298 5.752 1064 H GLY 142 H GLY 142 -2.442 -14.698 -0.916 1065 HA2 GLY 142 HA2 GLY 142 -4.099 -13.473 -1.959 1066 HA3 GLY 142 HA3 GLY 142 -5.017 -13.493 -0.456 1067 H MET 143 H MET 143 -1.727 -12.300 -0.851 1068 HA MET 143 HA MET 143 -2.239 -9.836 0.507 1069 HB2 MET 143 HB2 MET 143 -0.089 -11.101 0.662 1070 HB3 MET 143 HB3 MET 143 0.248 -10.729 -1.020 1071 HG2 MET 143 HG2 MET 143 -0.064 -8.593 1.103 1072 HG3 MET 143 HG3 MET 143 1.480 -9.353 0.708 1073 HE1 MET 143 HE1 MET 143 1.082 -6.198 0.609 1074 HE2 MET 143 HE2 MET 143 1.869 -5.801 -0.918 1075 HE3 MET 143 HE3 MET 143 2.597 -6.988 0.168 1076 H GLU 144 H GLU 144 -1.707 -10.706 -2.914 1077 HA GLU 144 HA GLU 144 -1.437 -8.076 -3.915 1078 HB2 GLU 144 HB2 GLU 144 -1.548 -8.975 -6.110 1079 HB3 GLU 144 HB3 GLU 144 -0.764 -10.207 -5.140 1080 HG2 GLU 144 HG2 GLU 144 -3.724 -10.336 -5.781 1081 HG3 GLU 144 HG3 GLU 144 -2.510 -10.927 -6.913 1082 H GLU 145 H GLU 145 -4.227 -10.175 -3.443 1083 HA GLU 145 HA GLU 145 -6.211 -8.415 -4.539 1084 HB2 GLU 145 HB2 GLU 145 -6.380 -10.886 -2.779 1085 HB3 GLU 145 HB3 GLU 145 -7.805 -10.022 -3.351 1086 HG2 GLU 145 HG2 GLU 145 -5.707 -11.256 -5.169 1087 HG3 GLU 145 HG3 GLU 145 -7.216 -12.045 -4.699 1088 H GLY 146 H GLY 146 -5.077 -9.149 -1.244 1089 HA2 GLY 146 HA2 GLY 146 -7.044 -7.812 0.255 1090 HA3 GLY 146 HA3 GLY 146 -5.415 -8.173 0.799 1091 H MET 147 H MET 147 -3.942 -6.607 -1.020 1092 HA MET 147 HA MET 147 -4.175 -3.986 0.141 1093 HB2 MET 147 HB2 MET 147 -1.993 -5.152 -0.635 1094 HB3 MET 147 HB3 MET 147 -2.440 -4.669 -2.262 1095 HG2 MET 147 HG2 MET 147 -2.458 -2.287 -1.514 1096 HG3 MET 147 HG3 MET 147 -1.919 -2.812 0.079 1097 HE1 MET 147 HE1 MET 147 -0.988 -2.316 -3.676 1098 HE2 MET 147 HE2 MET 147 -0.819 -4.067 -3.531 1099 HE3 MET 147 HE3 MET 147 0.609 -3.062 -3.779 1100 H ARG 148 H ARG 148 -5.122 -5.441 -2.956 1101 HA ARG 148 HA ARG 148 -5.766 -3.049 -4.364 1102 HB2 ARG 148 HB2 ARG 148 -5.452 -5.188 -5.531 1103 HB3 ARG 148 HB3 ARG 148 -6.848 -5.876 -4.700 1104 HG2 ARG 148 HG2 ARG 148 -8.289 -4.140 -5.839 1105 HG3 ARG 148 HG3 ARG 148 -6.870 -3.639 -6.764 1106 HD2 ARG 148 HD2 ARG 148 -8.295 -5.163 -8.061 1107 HD3 ARG 148 HD3 ARG 148 -6.718 -5.885 -7.750 1108 HE ARG 148 HE ARG 148 -7.722 -7.522 -6.526 1109 HH11 ARG 148 HH11 ARG 148 -10.099 -5.038 -6.992 1110 HH12 ARG 148 HH12 ARG 148 -11.370 -6.010 -6.336 1111 HH21 ARG 148 HH21 ARG 148 -9.373 -8.718 -5.701 1112 HH22 ARG 148 HH22 ARG 148 -10.967 -8.057 -5.625 1113 H GLU 149 H GLU 149 -7.713 -5.237 -2.337 1114 HA GLU 149 HA GLU 149 -10.239 -3.956 -2.640 1115 HB2 GLU 149 HB2 GLU 149 -9.175 -5.795 -0.455 1116 HB3 GLU 149 HB3 GLU 149 -10.871 -5.325 -0.620 1117 HG2 GLU 149 HG2 GLU 149 -11.029 -6.447 -2.768 1118 HG3 GLU 149 HG3 GLU 149 -9.299 -6.798 -2.761 1119 H ALA 150 H ALA 150 -7.578 -3.530 -0.343 1120 HA ALA 150 HA ALA 150 -8.622 -1.531 1.334 1121 HB1 ALA 150 HB1 ALA 150 -6.438 -2.622 1.705 1122 HB2 ALA 150 HB2 ALA 150 -6.266 -0.866 1.688 1123 HB3 ALA 150 HB3 ALA 150 -5.778 -1.818 0.277 1124 H ILE 151 H ILE 151 -6.932 -1.236 -1.791 1125 HA ILE 151 HA ILE 151 -7.015 1.579 -2.056 1126 HB ILE 151 HB ILE 151 -6.679 -0.639 -4.115 1127 HG12 ILE 151 HG12 ILE 151 -4.603 1.225 -2.866 1128 HG13 ILE 151 HG13 ILE 151 -4.908 -0.422 -2.329 1129 HG21 ILE 151 HG21 ILE 151 -7.473 1.346 -5.315 1130 HG22 ILE 151 HG22 ILE 151 -5.773 1.051 -5.681 1131 HG23 ILE 151 HG23 ILE 151 -6.223 2.333 -4.553 1132 HD11 ILE 151 HD11 ILE 151 -2.936 -0.323 -3.707 1133 HD12 ILE 151 HD12 ILE 151 -3.846 0.408 -5.025 1134 HD13 ILE 151 HD13 ILE 151 -4.186 -1.252 -4.531 1135 H GLU 152 H GLU 152 -9.381 -0.900 -2.925 1136 HA GLU 152 HA GLU 152 -11.126 0.726 -4.467 1137 HB2 GLU 152 HB2 GLU 152 -11.675 -1.783 -2.838 1138 HB3 GLU 152 HB3 GLU 152 -12.860 -1.035 -3.909 1139 HG2 GLU 152 HG2 GLU 152 -10.142 -1.996 -4.879 1140 HG3 GLU 152 HG3 GLU 152 -11.566 -3.035 -4.835 1141 H GLN 153 H GLN 153 -10.584 0.588 -1.037 1142 HA GLN 153 HA GLN 153 -13.081 1.918 -0.286 1143 HB2 GLN 153 HB2 GLN 153 -10.625 1.320 1.405 1144 HB3 GLN 153 HB3 GLN 153 -12.206 1.824 2.004 1145 HG2 GLN 153 HG2 GLN 153 -13.165 -0.307 1.126 1146 HG3 GLN 153 HG3 GLN 153 -11.550 -0.804 0.631 1147 HE21 GLN 153 HE21 GLN 153 -10.361 0.408 3.079 1148 HE22 GLN 153 HE22 GLN 153 -10.691 -0.732 4.324 1149 H ILE 154 H ILE 154 -10.050 2.970 -1.482 1150 HA ILE 154 HA ILE 154 -9.773 5.507 -0.240 1151 HB ILE 154 HB ILE 154 -9.043 4.661 -3.072 1152 HG12 ILE 154 HG12 ILE 154 -7.290 4.893 -0.584 1153 HG13 ILE 154 HG13 ILE 154 -7.902 3.381 -1.249 1154 HG21 ILE 154 HG21 ILE 154 -8.146 7.151 -1.572 1155 HG22 ILE 154 HG22 ILE 154 -9.207 7.111 -2.982 1156 HG23 ILE 154 HG23 ILE 154 -7.522 6.617 -3.136 1157 HD11 ILE 154 HD11 ILE 154 -6.606 3.773 -3.295 1158 HD12 ILE 154 HD12 ILE 154 -5.594 3.726 -1.851 1159 HD13 ILE 154 HD13 ILE 154 -5.981 5.272 -2.601 1160 H ASP 155 H ASP 155 -11.878 4.375 -2.851 1161 HA ASP 155 HA ASP 155 -13.066 6.726 -3.736 1162 HB2 ASP 155 HB2 ASP 155 -13.474 4.434 -4.660 1163 HB3 ASP 155 HB3 ASP 155 -14.398 4.027 -3.224 1164 H ALA 156 H ALA 156 -13.872 4.767 -0.837 1165 HA ALA 156 HA ALA 156 -15.962 6.419 0.172 1166 HB1 ALA 156 HB1 ALA 156 -14.158 4.490 1.686 1167 HB2 ALA 156 HB2 ALA 156 -15.697 4.097 0.908 1168 HB3 ALA 156 HB3 ALA 156 -15.667 5.199 2.292 1169 H VAL 157 H VAL 157 -12.456 6.590 0.538 1170 HA VAL 157 HA VAL 157 -12.498 8.403 2.801 1171 HB VAL 157 HB VAL 157 -10.180 7.628 0.978 1172 HG11 VAL 157 HG11 VAL 157 -8.702 8.409 2.821 1173 HG12 VAL 157 HG12 VAL 157 -10.114 8.990 3.709 1174 HG13 VAL 157 HG13 VAL 157 -9.671 9.734 2.171 1175 HG21 VAL 157 HG21 VAL 157 -11.024 6.513 3.679 1176 HG22 VAL 157 HG22 VAL 157 -9.567 6.068 2.794 1177 HG23 VAL 157 HG23 VAL 157 -11.150 5.684 2.123 1178 H LEU 158 H LEU 158 -12.208 8.771 -0.707 1179 HA LEU 158 HA LEU 158 -11.716 11.642 -0.542 1180 HB2 LEU 158 HB2 LEU 158 -12.263 9.960 -3.015 1181 HB3 LEU 158 HB3 LEU 158 -11.629 11.604 -2.979 1182 HG LEU 158 HG LEU 158 -10.215 9.067 -2.066 1183 HD11 LEU 158 HD11 LEU 158 -10.209 9.416 -4.471 1184 HD12 LEU 158 HD12 LEU 158 -8.593 9.596 -3.797 1185 HD13 LEU 158 HD13 LEU 158 -9.519 11.029 -4.261 1186 HD21 LEU 158 HD21 LEU 158 -8.278 10.447 -1.461 1187 HD22 LEU 158 HD22 LEU 158 -9.680 10.839 -0.469 1188 HD23 LEU 158 HD23 LEU 158 -9.206 11.916 -1.786 1189 H SER 159 H SER 159 -14.449 9.509 -1.228 1190 HA SER 159 HA SER 159 -16.232 11.711 -1.976 1191 HB2 SER 159 HB2 SER 159 -16.414 9.509 -3.119 1192 HB3 SER 159 HB3 SER 159 -16.841 8.749 -1.592 1193 HG SER 159 HG SER 159 -18.463 9.894 -3.320 1194 H GLU 160 H GLU 160 -16.091 9.187 0.578 1195 HA GLU 160 HA GLU 160 -16.903 9.017 2.706 1196 HB2 GLU 160 HB2 GLU 160 -16.706 12.053 2.585 1197 HB3 GLU 160 HB3 GLU 160 -16.905 11.121 4.056 1198 HG2 GLU 160 HG2 GLU 160 -14.704 10.178 3.857 1199 HG3 GLU 160 HG3 GLU 160 -14.502 10.879 2.247 1200 HA PRO 161 HA PRO 161 -21.336 10.706 2.830 1201 HB2 PRO 161 HB2 PRO 161 -21.684 11.468 5.440 1202 HB3 PRO 161 HB3 PRO 161 -21.788 9.783 4.918 1203 HG2 PRO 161 HG2 PRO 161 -19.451 11.247 6.162 1204 HG3 PRO 161 HG3 PRO 161 -20.112 9.652 6.586 1205 HD2 PRO 161 HD2 PRO 161 -17.926 9.901 5.028 1206 HD3 PRO 161 HD3 PRO 161 -19.114 8.609 4.738 1207 H ALA 162 H ALA 162 -18.843 12.361 2.251 1208 HA ALA 162 HA ALA 162 -18.231 14.426 1.674 1209 HB1 ALA 162 HB1 ALA 162 -20.577 14.806 1.005 1210 HB2 ALA 162 HB2 ALA 162 -19.809 16.282 1.589 1211 HB3 ALA 162 HB3 ALA 162 -20.938 15.403 2.627 1212 H ASN 163 H ASN 163 -18.722 13.592 4.853 1213 HA ASN 163 HA ASN 163 -17.120 15.652 6.000 1214 HB2 ASN 163 HB2 ASN 163 -18.969 16.646 7.430 1215 HB3 ASN 163 HB3 ASN 163 -19.062 17.058 5.737 1216 HD21 ASN 163 HD21 ASN 163 -20.483 15.073 8.268 1217 HD22 ASN 163 HD22 ASN 163 -21.965 14.765 7.449 1218 H ALA 164 H ALA 164 -16.721 12.999 6.126 1219 HA ALA 164 HA ALA 164 -17.984 11.522 8.179 1220 HB1 ALA 164 HB1 ALA 164 -15.173 11.196 7.075 1221 HB2 ALA 164 HB2 ALA 164 -16.641 10.491 6.395 1222 HB3 ALA 164 HB3 ALA 164 -16.077 9.983 7.990 1223 H LEU 165 H LEU 165 -18.143 12.397 10.161 1224 HA LEU 165 HA LEU 165 -16.084 14.092 11.336 1225 HB2 LEU 165 HB2 LEU 165 -17.946 14.469 13.092 1226 HB3 LEU 165 HB3 LEU 165 -18.211 15.054 11.464 1227 HG LEU 165 HG LEU 165 -19.608 12.917 11.067 1228 HD11 LEU 165 HD11 LEU 165 -19.582 12.768 14.090 1229 HD12 LEU 165 HD12 LEU 165 -18.892 11.583 12.979 1230 HD13 LEU 165 HD13 LEU 165 -20.634 11.842 13.013 1231 HD21 LEU 165 HD21 LEU 165 -20.649 14.963 13.050 1232 HD22 LEU 165 HD22 LEU 165 -21.638 13.898 12.046 1233 HD23 LEU 165 HD23 LEU 165 -20.628 15.129 11.292 1234 H GLU 166 H GLU 166 -15.277 11.422 11.190 1235 HA GLU 166 HA GLU 166 -15.592 10.068 13.736 1236 HB2 GLU 166 HB2 GLU 166 -13.913 9.429 11.272 1237 HB3 GLU 166 HB3 GLU 166 -14.124 8.354 12.654 1238 HG2 GLU 166 HG2 GLU 166 -16.479 8.090 12.174 1239 HG3 GLU 166 HG3 GLU 166 -16.418 9.327 10.922 1240 H HIS 167 H HIS 167 -14.590 12.320 14.562 1241 HA HIS 167 HA HIS 167 -11.788 11.763 15.258 1242 HB2 HIS 167 HB2 HIS 167 -11.079 14.067 14.918 1243 HB3 HIS 167 HB3 HIS 167 -11.749 13.456 13.417 1244 HD1 HIS 167 HD1 HIS 167 -12.049 16.191 15.835 1245 HD2 HIS 167 HD2 HIS 167 -14.390 14.589 12.794 1246 HE1 HIS 167 HE1 HIS 167 -13.798 17.921 15.352 1247 HE2 HIS 167 HE2 HIS 167 -15.250 16.901 13.580 1248 H HIS 168 H HIS 168 -12.077 11.252 17.356 1249 HA HIS 168 HA HIS 168 -13.635 13.004 19.136 1250 HB2 HIS 168 HB2 HIS 168 -12.285 10.312 19.576 1251 HB3 HIS 168 HB3 HIS 168 -13.060 11.224 20.872 1252 HD1 HIS 168 HD1 HIS 168 -15.668 11.442 20.775 1253 HD2 HIS 168 HD2 HIS 168 -14.048 9.003 17.824 1254 HE1 HIS 168 HE1 HIS 168 -17.613 10.206 19.782 1255 HE2 HIS 168 HE2 HIS 168 -16.623 8.816 17.936 1256 H HIS 169 H HIS 169 -12.482 13.292 21.412 1257 HA HIS 169 HA HIS 169 -10.792 15.447 21.020 1258 HB2 HIS 169 HB2 HIS 169 -11.317 13.800 23.514 1259 HB3 HIS 169 HB3 HIS 169 -10.348 15.269 23.546 1260 HD1 HIS 169 HD1 HIS 169 -13.802 14.118 23.757 1261 HD2 HIS 169 HD2 HIS 169 -11.869 17.651 22.721 1262 HE1 HIS 169 HE1 HIS 169 -15.552 15.907 23.905 1263 HE2 HIS 169 HE2 HIS 169 -14.373 18.032 23.259 1264 H HIS 170 H HIS 170 -9.694 12.286 22.422 1265 HA HIS 170 HA HIS 170 -7.647 11.291 22.626 1266 HB2 HIS 170 HB2 HIS 170 -7.139 12.756 19.998 1267 HB3 HIS 170 HB3 HIS 170 -6.098 11.490 20.636 1268 HD1 HIS 170 HD1 HIS 170 -8.805 11.971 18.347 1269 HD2 HIS 170 HD2 HIS 170 -7.665 8.915 20.921 1270 HE1 HIS 170 HE1 HIS 170 -9.940 9.908 17.480 1271 HE2 HIS 170 HE2 HIS 170 -9.070 8.046 18.926 1272 H HIS 171 H HIS 171 -4.965 12.195 21.990 1273 HA HIS 171 HA HIS 171 -4.488 14.369 23.870 1274 HB2 HIS 171 HB2 HIS 171 -2.580 12.864 22.021 1275 HB3 HIS 171 HB3 HIS 171 -2.065 14.088 23.179 1276 HD1 HIS 171 HD1 HIS 171 -2.821 10.508 22.897 1277 HD2 HIS 171 HD2 HIS 171 -2.545 13.310 25.956 1278 HE1 HIS 171 HE1 HIS 171 -2.649 9.175 25.014 1279 HE2 HIS 171 HE2 HIS 171 -2.297 10.883 26.821 1280 H HIS 172 H HIS 172 -4.974 14.065 20.439 1281 HA HIS 172 HA HIS 172 -4.915 16.995 20.141 1282 HB2 HIS 172 HB2 HIS 172 -2.716 16.112 19.282 1283 HB3 HIS 172 HB3 HIS 172 -3.587 15.104 18.132 1284 HD1 HIS 172 HD1 HIS 172 -4.370 16.209 15.976 1285 HD2 HIS 172 HD2 HIS 172 -2.821 18.934 18.707 1286 HE1 HIS 172 HE1 HIS 172 -4.127 18.360 14.713 1287 HE2 HIS 172 HE2 HIS 172 -3.319 20.022 16.415 Start of MODEL 12 1 H1 THR 1 H1 THR 1 -10.523 2.987 -6.524 2 H2 THR 1 H2 THR 1 -11.262 1.472 -6.672 3 H3 THR 1 H3 THR 1 -12.207 2.848 -6.398 4 HA THR 1 HA THR 1 -12.331 2.100 -8.706 5 HB THR 1 HB THR 1 -10.823 4.702 -8.654 6 HG1 THR 1 HG1 THR 1 -12.927 5.646 -8.009 7 HG21 THR 1 HG21 THR 1 -12.529 5.434 -10.300 8 HG22 THR 1 HG22 THR 1 -13.333 3.867 -10.170 9 HG23 THR 1 HG23 THR 1 -11.709 3.972 -10.854 10 H VAL 2 H VAL 2 -10.830 0.347 -8.848 11 HA VAL 2 HA VAL 2 -8.101 0.874 -9.802 12 HB VAL 2 HB VAL 2 -9.620 -1.640 -9.052 13 HG11 VAL 2 HG11 VAL 2 -7.495 -2.926 -9.405 14 HG12 VAL 2 HG12 VAL 2 -6.762 -1.485 -10.110 15 HG13 VAL 2 HG13 VAL 2 -8.124 -2.264 -10.917 16 HG21 VAL 2 HG21 VAL 2 -7.958 -1.811 -7.221 17 HG22 VAL 2 HG22 VAL 2 -8.852 -0.290 -7.149 18 HG23 VAL 2 HG23 VAL 2 -7.202 -0.315 -7.778 19 H VAL 3 H VAL 3 -7.766 1.144 -11.931 20 HA VAL 3 HA VAL 3 -9.729 0.196 -13.920 21 HB VAL 3 HB VAL 3 -8.501 1.750 -15.512 22 HG11 VAL 3 HG11 VAL 3 -9.644 3.046 -13.000 23 HG12 VAL 3 HG12 VAL 3 -10.581 2.471 -14.383 24 HG13 VAL 3 HG13 VAL 3 -9.472 3.832 -14.574 25 HG21 VAL 3 HG21 VAL 3 -6.314 1.831 -14.342 26 HG22 VAL 3 HG22 VAL 3 -7.074 2.657 -12.975 27 HG23 VAL 3 HG23 VAL 3 -6.974 3.459 -14.549 28 H SER 4 H SER 4 -6.618 -0.695 -12.733 29 HA SER 4 HA SER 4 -6.544 -2.946 -14.562 30 HB2 SER 4 HB2 SER 4 -5.295 -1.297 -15.917 31 HB3 SER 4 HB3 SER 4 -4.206 -0.984 -14.567 32 HG SER 4 HG SER 4 -3.114 -2.716 -15.063 33 H VAL 5 H VAL 5 -5.695 -4.714 -13.589 34 HA VAL 5 HA VAL 5 -3.869 -4.435 -11.255 35 HB VAL 5 HB VAL 5 -5.740 -6.783 -11.869 36 HG11 VAL 5 HG11 VAL 5 -3.908 -6.332 -9.468 37 HG12 VAL 5 HG12 VAL 5 -3.669 -7.535 -10.738 38 HG13 VAL 5 HG13 VAL 5 -5.050 -7.666 -9.653 39 HG21 VAL 5 HG21 VAL 5 -5.959 -4.687 -9.677 40 HG22 VAL 5 HG22 VAL 5 -7.008 -6.096 -9.858 41 HG23 VAL 5 HG23 VAL 5 -7.013 -4.827 -11.086 42 H ASP 6 H ASP 6 -1.838 -4.890 -11.863 43 HA ASP 6 HA ASP 6 -1.278 -6.931 -13.950 44 HB2 ASP 6 HB2 ASP 6 0.444 -4.577 -13.060 45 HB3 ASP 6 HB3 ASP 6 0.852 -5.721 -14.332 46 H LYS 7 H LYS 7 -0.236 -8.748 -13.263 47 HA LYS 7 HA LYS 7 1.347 -8.710 -10.755 48 HB2 LYS 7 HB2 LYS 7 -0.943 -9.615 -10.295 49 HB3 LYS 7 HB3 LYS 7 -0.693 -10.855 -11.521 50 HG2 LYS 7 HG2 LYS 7 1.225 -11.743 -10.166 51 HG3 LYS 7 HG3 LYS 7 0.857 -10.545 -8.920 52 HD2 LYS 7 HD2 LYS 7 -1.379 -11.564 -8.610 53 HD3 LYS 7 HD3 LYS 7 -1.019 -12.742 -9.875 54 HE2 LYS 7 HE2 LYS 7 0.861 -13.610 -8.478 55 HE3 LYS 7 HE3 LYS 7 0.396 -12.483 -7.200 56 HZ1 LYS 7 HZ1 LYS 7 -1.424 -14.528 -8.321 57 HZ2 LYS 7 HZ2 LYS 7 -1.661 -13.593 -6.930 58 HZ3 LYS 7 HZ3 LYS 7 -0.465 -14.784 -6.960 59 H ASP 8 H ASP 8 3.343 -8.953 -11.685 60 HA ASP 8 HA ASP 8 3.839 -11.292 -13.428 61 HB2 ASP 8 HB2 ASP 8 4.547 -8.882 -14.136 62 HB3 ASP 8 HB3 ASP 8 5.813 -9.030 -12.924 63 H VAL 9 H VAL 9 4.518 -13.013 -12.372 64 HA VAL 9 HA VAL 9 5.549 -12.946 -9.662 65 HB VAL 9 HB VAL 9 5.050 -15.322 -11.517 66 HG11 VAL 9 HG11 VAL 9 5.474 -15.281 -8.503 67 HG12 VAL 9 HG12 VAL 9 6.608 -15.921 -9.695 68 HG13 VAL 9 HG13 VAL 9 5.044 -16.703 -9.455 69 HG21 VAL 9 HG21 VAL 9 2.976 -14.041 -11.095 70 HG22 VAL 9 HG22 VAL 9 3.253 -14.145 -9.356 71 HG23 VAL 9 HG23 VAL 9 2.915 -15.610 -10.281 72 H GLU 10 H GLU 10 6.865 -13.399 -12.887 73 HA GLU 10 HA GLU 10 9.386 -14.580 -12.045 74 HB2 GLU 10 HB2 GLU 10 8.543 -13.418 -14.739 75 HB3 GLU 10 HB3 GLU 10 10.039 -14.308 -14.440 76 HG2 GLU 10 HG2 GLU 10 8.679 -16.277 -13.769 77 HG3 GLU 10 HG3 GLU 10 7.217 -15.396 -14.200 78 H ALA 11 H ALA 11 8.335 -11.398 -13.255 79 HA ALA 11 HA ALA 11 10.908 -10.125 -12.780 80 HB1 ALA 11 HB1 ALA 11 9.818 -8.112 -13.672 81 HB2 ALA 11 HB2 ALA 11 8.247 -8.925 -13.628 82 HB3 ALA 11 HB3 ALA 11 9.508 -9.503 -14.716 83 H LEU 12 H LEU 12 8.475 -11.048 -10.749 84 HA LEU 12 HA LEU 12 7.917 -10.654 -8.595 85 HB2 LEU 12 HB2 LEU 12 10.605 -9.228 -8.534 86 HB3 LEU 12 HB3 LEU 12 9.718 -9.781 -7.119 87 HG LEU 12 HG LEU 12 10.833 -11.611 -9.289 88 HD11 LEU 12 HD11 LEU 12 12.496 -12.309 -7.630 89 HD12 LEU 12 HD12 LEU 12 11.893 -11.100 -6.493 90 HD13 LEU 12 HD13 LEU 12 12.650 -10.594 -8.007 91 HD21 LEU 12 HD21 LEU 12 10.264 -13.442 -7.738 92 HD22 LEU 12 HD22 LEU 12 8.834 -12.540 -8.232 93 HD23 LEU 12 HD23 LEU 12 9.528 -12.278 -6.631 94 H SER 13 H SER 13 7.011 -8.626 -10.546 95 HA SER 13 HA SER 13 6.716 -6.277 -8.748 96 HB2 SER 13 HB2 SER 13 6.453 -4.880 -10.767 97 HB3 SER 13 HB3 SER 13 8.015 -5.688 -10.756 98 HG SER 13 HG SER 13 7.383 -6.975 -12.390 99 H PHE 14 H PHE 14 4.728 -6.013 -8.013 100 HA PHE 14 HA PHE 14 2.381 -6.878 -9.618 101 HB2 PHE 14 HB2 PHE 14 2.540 -8.203 -7.578 102 HB3 PHE 14 HB3 PHE 14 2.797 -6.767 -6.591 103 HD1 PHE 14 HD1 PHE 14 0.260 -8.041 -9.062 104 HD2 PHE 14 HD2 PHE 14 0.945 -6.074 -5.328 105 HE1 PHE 14 HE1 PHE 14 -2.158 -7.859 -8.715 106 HE2 PHE 14 HE2 PHE 14 -1.478 -5.897 -4.991 107 HZ PHE 14 HZ PHE 14 -3.029 -6.786 -6.684 108 H SER 15 H SER 15 1.672 -5.067 -10.625 109 HA SER 15 HA SER 15 1.752 -2.459 -9.214 110 HB2 SER 15 HB2 SER 15 1.975 -1.436 -11.488 111 HB3 SER 15 HB3 SER 15 3.319 -2.494 -11.070 112 HG SER 15 HG SER 15 1.113 -3.122 -12.739 113 H ILE 16 H ILE 16 -0.204 -1.724 -8.655 114 HA ILE 16 HA ILE 16 -2.607 -2.436 -10.238 115 HB ILE 16 HB ILE 16 -2.396 -1.238 -7.434 116 HG12 ILE 16 HG12 ILE 16 -3.281 -4.044 -8.245 117 HG13 ILE 16 HG13 ILE 16 -1.675 -3.656 -7.632 118 HG21 ILE 16 HG21 ILE 16 -4.877 -2.139 -8.958 119 HG22 ILE 16 HG22 ILE 16 -4.456 -0.475 -8.551 120 HG23 ILE 16 HG23 ILE 16 -4.850 -1.620 -7.269 121 HD11 ILE 16 HD11 ILE 16 -4.258 -3.286 -6.117 122 HD12 ILE 16 HD12 ILE 16 -2.627 -2.972 -5.512 123 HD13 ILE 16 HD13 ILE 16 -3.115 -4.613 -5.922 124 H VAL 17 H VAL 17 -3.223 -0.935 -11.676 125 HA VAL 17 HA VAL 17 -2.553 1.907 -11.321 126 HB VAL 17 HB VAL 17 -3.876 0.598 -13.744 127 HG11 VAL 17 HG11 VAL 17 -2.458 3.283 -13.456 128 HG12 VAL 17 HG12 VAL 17 -4.204 3.050 -13.600 129 HG13 VAL 17 HG13 VAL 17 -3.144 2.638 -14.951 130 HG21 VAL 17 HG21 VAL 17 -1.676 -0.454 -13.406 131 HG22 VAL 17 HG22 VAL 17 -0.911 1.133 -13.305 132 HG23 VAL 17 HG23 VAL 17 -1.636 0.601 -14.822 133 H ALA 18 H ALA 18 -4.043 3.265 -10.597 134 HA ALA 18 HA ALA 18 -6.939 2.690 -10.764 135 HB1 ALA 18 HB1 ALA 18 -5.448 3.615 -8.265 136 HB2 ALA 18 HB2 ALA 18 -6.162 2.021 -8.518 137 HB3 ALA 18 HB3 ALA 18 -7.203 3.441 -8.414 138 H GLU 19 H GLU 19 -8.265 4.627 -10.720 139 HA GLU 19 HA GLU 19 -6.870 7.245 -10.864 140 HB2 GLU 19 HB2 GLU 19 -8.909 6.196 -12.885 141 HB3 GLU 19 HB3 GLU 19 -8.424 7.889 -12.779 142 HG2 GLU 19 HG2 GLU 19 -6.119 7.288 -13.346 143 HG3 GLU 19 HG3 GLU 19 -6.546 5.580 -13.377 144 H PHE 20 H PHE 20 -7.830 8.738 -9.614 145 HA PHE 20 HA PHE 20 -10.571 8.250 -8.566 146 HB2 PHE 20 HB2 PHE 20 -8.198 9.485 -7.081 147 HB3 PHE 20 HB3 PHE 20 -9.809 9.221 -6.414 148 HD1 PHE 20 HD1 PHE 20 -10.677 6.750 -6.377 149 HD2 PHE 20 HD2 PHE 20 -6.544 7.783 -6.815 150 HE1 PHE 20 HE1 PHE 20 -10.027 4.485 -5.677 151 HE2 PHE 20 HE2 PHE 20 -5.907 5.508 -6.111 152 HZ PHE 20 HZ PHE 20 -7.649 3.862 -5.548 153 H ASP 21 H ASP 21 -12.005 9.911 -8.648 154 HA ASP 21 HA ASP 21 -11.411 12.262 -10.215 155 HB2 ASP 21 HB2 ASP 21 -13.935 11.480 -8.690 156 HB3 ASP 21 HB3 ASP 21 -13.809 12.820 -9.825 157 H ALA 22 H ALA 22 -9.859 13.359 -9.049 158 HA ALA 22 HA ALA 22 -10.579 15.185 -6.974 159 HB1 ALA 22 HB1 ALA 22 -9.164 14.215 -5.176 160 HB2 ALA 22 HB2 ALA 22 -8.872 12.790 -6.174 161 HB3 ALA 22 HB3 ALA 22 -10.500 13.145 -5.594 162 H ASP 23 H ASP 23 -8.328 16.109 -5.988 163 HA ASP 23 HA ASP 23 -6.430 16.426 -8.227 164 HB2 ASP 23 HB2 ASP 23 -5.415 18.231 -6.873 165 HB3 ASP 23 HB3 ASP 23 -7.132 18.498 -7.118 166 H VAL 24 H VAL 24 -4.068 16.545 -7.494 167 HA VAL 24 HA VAL 24 -3.198 13.975 -6.834 168 HB VAL 24 HB VAL 24 -1.666 16.597 -6.921 169 HG11 VAL 24 HG11 VAL 24 -0.333 14.976 -5.653 170 HG12 VAL 24 HG12 VAL 24 0.389 15.235 -7.244 171 HG13 VAL 24 HG13 VAL 24 -0.548 13.772 -6.929 172 HG21 VAL 24 HG21 VAL 24 -1.998 14.429 -9.027 173 HG22 VAL 24 HG22 VAL 24 -0.997 15.875 -9.191 174 HG23 VAL 24 HG23 VAL 24 -2.750 16.028 -9.048 175 H LYS 25 H LYS 25 -3.216 16.920 -4.812 176 HA LYS 25 HA LYS 25 -1.886 15.754 -2.567 177 HB2 LYS 25 HB2 LYS 25 -3.682 18.214 -2.633 178 HB3 LYS 25 HB3 LYS 25 -2.606 17.759 -1.310 179 HG2 LYS 25 HG2 LYS 25 -0.694 17.940 -3.013 180 HG3 LYS 25 HG3 LYS 25 -1.862 18.718 -4.084 181 HD2 LYS 25 HD2 LYS 25 -0.594 20.427 -2.913 182 HD3 LYS 25 HD3 LYS 25 -2.257 20.456 -2.321 183 HE2 LYS 25 HE2 LYS 25 -1.588 19.226 -0.306 184 HE3 LYS 25 HE3 LYS 25 0.058 19.058 -0.919 185 HZ1 LYS 25 HZ1 LYS 25 -1.268 21.630 -0.279 186 HZ2 LYS 25 HZ2 LYS 25 0.332 21.427 -0.785 187 HZ3 LYS 25 HZ3 LYS 25 -0.163 20.830 0.716 188 H ARG 26 H ARG 26 -5.233 15.898 -3.562 189 HA ARG 26 HA ARG 26 -6.539 15.214 -1.136 190 HB2 ARG 26 HB2 ARG 26 -7.705 16.142 -3.101 191 HB3 ARG 26 HB3 ARG 26 -7.331 14.699 -4.027 192 HG2 ARG 26 HG2 ARG 26 -9.646 14.659 -3.335 193 HG3 ARG 26 HG3 ARG 26 -8.767 13.358 -2.528 194 HD2 ARG 26 HD2 ARG 26 -8.730 14.592 -0.454 195 HD3 ARG 26 HD3 ARG 26 -9.369 16.040 -1.247 196 HE ARG 26 HE ARG 26 -11.199 13.955 -1.629 197 HH11 ARG 26 HH11 ARG 26 -9.999 15.873 0.978 198 HH12 ARG 26 HH12 ARG 26 -11.486 15.792 1.851 199 HH21 ARG 26 HH21 ARG 26 -13.076 13.893 -0.511 200 HH22 ARG 26 HH22 ARG 26 -13.198 14.684 1.016 201 H VAL 27 H VAL 27 -5.447 13.201 -3.879 202 HA VAL 27 HA VAL 27 -6.035 10.679 -2.623 203 HB VAL 27 HB VAL 27 -4.146 11.113 -4.977 204 HG11 VAL 27 HG11 VAL 27 -4.056 8.841 -4.017 205 HG12 VAL 27 HG12 VAL 27 -4.804 8.800 -5.613 206 HG13 VAL 27 HG13 VAL 27 -5.810 8.689 -4.167 207 HG21 VAL 27 HG21 VAL 27 -6.098 10.782 -6.480 208 HG22 VAL 27 HG22 VAL 27 -6.272 12.244 -5.505 209 HG23 VAL 27 HG23 VAL 27 -7.176 10.786 -5.081 210 H TRP 28 H TRP 28 -3.192 12.775 -2.758 211 HA TRP 28 HA TRP 28 -1.281 11.033 -1.585 212 HB2 TRP 28 HB2 TRP 28 -0.719 13.157 -2.765 213 HB3 TRP 28 HB3 TRP 28 -1.432 14.076 -1.446 214 HD1 TRP 28 HD1 TRP 28 0.172 14.660 0.561 215 HE1 TRP 28 HE1 TRP 28 2.617 14.107 1.125 216 HE3 TRP 28 HE3 TRP 28 1.057 11.093 -3.004 217 HZ2 TRP 28 HZ2 TRP 28 4.649 12.404 0.180 218 HZ3 TRP 28 HZ3 TRP 28 3.284 10.062 -3.109 219 HH2 TRP 28 HH2 TRP 28 5.043 10.707 -1.544 220 H ALA 29 H ALA 29 -3.816 13.036 -0.177 221 HA ALA 29 HA ALA 29 -2.937 13.311 2.461 222 HB1 ALA 29 HB1 ALA 29 -5.276 13.798 3.011 223 HB2 ALA 29 HB2 ALA 29 -5.792 13.105 1.469 224 HB3 ALA 29 HB3 ALA 29 -4.808 14.570 1.493 225 H ILE 30 H ILE 30 -4.517 10.559 0.935 226 HA ILE 30 HA ILE 30 -5.172 9.106 3.334 227 HB ILE 30 HB ILE 30 -5.775 7.259 1.926 228 HG12 ILE 30 HG12 ILE 30 -4.071 8.586 -0.218 229 HG13 ILE 30 HG13 ILE 30 -3.797 7.027 0.534 230 HG21 ILE 30 HG21 ILE 30 -7.296 8.291 0.289 231 HG22 ILE 30 HG22 ILE 30 -6.416 9.816 0.409 232 HG23 ILE 30 HG23 ILE 30 -7.299 9.194 1.807 233 HD11 ILE 30 HD11 ILE 30 -5.839 6.196 -0.594 234 HD12 ILE 30 HD12 ILE 30 -4.554 6.719 -1.683 235 HD13 ILE 30 HD13 ILE 30 -5.955 7.754 -1.421 236 H TRP 31 H TRP 31 -2.214 9.607 1.680 237 HA TRP 31 HA TRP 31 -0.866 7.278 2.894 238 HB2 TRP 31 HB2 TRP 31 0.119 9.361 0.885 239 HB3 TRP 31 HB3 TRP 31 1.084 8.010 1.491 240 HD1 TRP 31 HD1 TRP 31 -1.357 8.851 -1.238 241 HE1 TRP 31 HE1 TRP 31 -1.973 6.718 -2.536 242 HE3 TRP 31 HE3 TRP 31 0.648 5.351 1.920 243 HZ2 TRP 31 HZ2 TRP 31 -1.642 3.930 -2.270 244 HZ3 TRP 31 HZ3 TRP 31 0.463 2.971 1.322 245 HH2 TRP 31 HH2 TRP 31 -0.662 2.273 -0.732 246 H GLU 32 H GLU 32 -0.827 10.816 2.866 247 HA GLU 32 HA GLU 32 1.454 11.189 4.511 248 HB2 GLU 32 HB2 GLU 32 0.547 12.875 2.908 249 HB3 GLU 32 HB3 GLU 32 -0.862 13.096 3.931 250 HG2 GLU 32 HG2 GLU 32 1.956 13.662 4.892 251 HG3 GLU 32 HG3 GLU 32 1.006 14.864 4.033 252 H ASP 33 H ASP 33 -2.057 11.343 5.229 253 HA ASP 33 HA ASP 33 -1.552 11.819 8.057 254 HB2 ASP 33 HB2 ASP 33 -3.405 12.994 6.756 255 HB3 ASP 33 HB3 ASP 33 -4.221 11.448 6.644 256 HA PRO 34 HA PRO 34 -1.439 7.355 9.127 257 HB2 PRO 34 HB2 PRO 34 -2.174 8.487 11.832 258 HB3 PRO 34 HB3 PRO 34 -0.895 7.341 11.397 259 HG2 PRO 34 HG2 PRO 34 -0.303 9.896 11.923 260 HG3 PRO 34 HG3 PRO 34 0.539 9.020 10.630 261 HD2 PRO 34 HD2 PRO 34 -1.623 11.090 10.416 262 HD3 PRO 34 HD3 PRO 34 -0.223 10.806 9.361 263 H ARG 35 H ARG 35 -4.097 9.456 10.312 264 HA ARG 35 HA ARG 35 -5.935 7.327 10.928 265 HB2 ARG 35 HB2 ARG 35 -6.567 10.265 10.455 266 HB3 ARG 35 HB3 ARG 35 -7.606 9.099 11.266 267 HG2 ARG 35 HG2 ARG 35 -4.881 9.924 12.325 268 HG3 ARG 35 HG3 ARG 35 -6.374 10.759 12.745 269 HD2 ARG 35 HD2 ARG 35 -5.961 9.277 14.548 270 HD3 ARG 35 HD3 ARG 35 -7.234 8.506 13.610 271 HE ARG 35 HE ARG 35 -5.793 6.802 13.055 272 HH11 ARG 35 HH11 ARG 35 -3.962 9.261 14.688 273 HH12 ARG 35 HH12 ARG 35 -2.591 8.229 14.885 274 HH21 ARG 35 HH21 ARG 35 -4.023 5.558 13.317 275 HH22 ARG 35 HH22 ARG 35 -2.622 6.178 14.122 276 H GLN 36 H GLN 36 -5.407 9.416 8.109 277 HA GLN 36 HA GLN 36 -7.684 8.569 6.592 278 HB2 GLN 36 HB2 GLN 36 -5.101 9.899 5.694 279 HB3 GLN 36 HB3 GLN 36 -6.499 9.646 4.653 280 HG2 GLN 36 HG2 GLN 36 -6.663 11.248 7.208 281 HG3 GLN 36 HG3 GLN 36 -6.170 11.965 5.679 282 HE21 GLN 36 HE21 GLN 36 -7.895 13.372 5.754 283 HE22 GLN 36 HE22 GLN 36 -9.505 12.875 5.431 284 H LEU 37 H LEU 37 -4.411 7.319 6.952 285 HA LEU 37 HA LEU 37 -4.477 5.593 4.640 286 HB2 LEU 37 HB2 LEU 37 -2.368 6.444 5.506 287 HB3 LEU 37 HB3 LEU 37 -2.646 5.687 7.063 288 HG LEU 37 HG LEU 37 -2.311 3.452 6.089 289 HD11 LEU 37 HD11 LEU 37 -1.579 3.092 3.774 290 HD12 LEU 37 HD12 LEU 37 -1.821 4.812 3.419 291 HD13 LEU 37 HD13 LEU 37 -3.205 3.791 3.823 292 HD21 LEU 37 HD21 LEU 37 0.066 3.616 5.551 293 HD22 LEU 37 HD22 LEU 37 -0.350 4.669 6.904 294 HD23 LEU 37 HD23 LEU 37 -0.091 5.360 5.298 295 H GLU 38 H GLU 38 -4.851 5.040 8.149 296 HA GLU 38 HA GLU 38 -4.980 2.224 8.094 297 HB2 GLU 38 HB2 GLU 38 -5.775 2.381 10.402 298 HB3 GLU 38 HB3 GLU 38 -4.479 3.535 10.120 299 HG2 GLU 38 HG2 GLU 38 -6.119 5.361 9.945 300 HG3 GLU 38 HG3 GLU 38 -7.438 4.214 10.178 301 H ARG 39 H ARG 39 -7.494 4.580 7.519 302 HA ARG 39 HA ARG 39 -9.749 2.917 8.167 303 HB2 ARG 39 HB2 ARG 39 -11.094 4.797 7.441 304 HB3 ARG 39 HB3 ARG 39 -9.743 5.375 8.404 305 HG2 ARG 39 HG2 ARG 39 -8.575 5.898 6.179 306 HG3 ARG 39 HG3 ARG 39 -10.143 5.623 5.415 307 HD2 ARG 39 HD2 ARG 39 -9.445 7.736 7.489 308 HD3 ARG 39 HD3 ARG 39 -9.855 8.001 5.794 309 HE ARG 39 HE ARG 39 -11.908 6.765 7.452 310 HH11 ARG 39 HH11 ARG 39 -10.762 9.703 6.022 311 HH12 ARG 39 HH12 ARG 39 -12.241 10.541 6.327 312 HH21 ARG 39 HH21 ARG 39 -13.758 7.874 7.862 313 HH22 ARG 39 HH22 ARG 39 -13.923 9.514 7.330 314 H TRP 40 H TRP 40 -7.742 2.915 5.452 315 HA TRP 40 HA TRP 40 -9.709 1.254 4.000 316 HB2 TRP 40 HB2 TRP 40 -8.925 2.086 1.831 317 HB3 TRP 40 HB3 TRP 40 -9.556 3.406 2.805 318 HD1 TRP 40 HD1 TRP 40 -7.749 5.231 3.704 319 HE1 TRP 40 HE1 TRP 40 -5.411 5.867 2.861 320 HE3 TRP 40 HE3 TRP 40 -6.810 1.172 0.782 321 HZ2 TRP 40 HZ2 TRP 40 -3.437 4.808 1.141 322 HZ3 TRP 40 HZ3 TRP 40 -4.689 1.052 -0.448 323 HH2 TRP 40 HH2 TRP 40 -3.040 2.834 -0.267 324 H TRP 41 H TRP 41 -6.581 1.528 5.346 325 HA TRP 41 HA TRP 41 -5.083 -0.023 3.495 326 HB2 TRP 41 HB2 TRP 41 -4.114 1.566 5.226 327 HB3 TRP 41 HB3 TRP 41 -4.427 0.337 6.449 328 HD1 TRP 41 HD1 TRP 41 -2.287 -1.093 6.936 329 HE1 TRP 41 HE1 TRP 41 -0.209 -1.810 5.596 330 HE3 TRP 41 HE3 TRP 41 -3.432 1.038 2.425 331 HZ2 TRP 41 HZ2 TRP 41 0.805 -1.494 3.002 332 HZ3 TRP 41 HZ3 TRP 41 -1.854 0.780 0.563 333 HH2 TRP 41 HH2 TRP 41 0.226 -0.465 0.844 334 H GLY 42 H GLY 42 -5.062 -2.141 3.141 335 HA2 GLY 42 HA2 GLY 42 -5.340 -4.443 3.473 336 HA3 GLY 42 HA3 GLY 42 -5.978 -4.139 5.083 337 HA PRO 43 HA PRO 43 -9.543 -4.940 2.038 338 HB2 PRO 43 HB2 PRO 43 -10.389 -7.382 2.888 339 HB3 PRO 43 HB3 PRO 43 -9.047 -7.218 1.747 340 HG2 PRO 43 HG2 PRO 43 -8.958 -7.680 4.729 341 HG3 PRO 43 HG3 PRO 43 -8.013 -8.475 3.449 342 HD2 PRO 43 HD2 PRO 43 -7.031 -6.399 4.971 343 HD3 PRO 43 HD3 PRO 43 -6.489 -6.719 3.310 344 HA PRO 44 HA PRO 44 -12.811 -3.397 4.785 345 HB2 PRO 44 HB2 PRO 44 -14.554 -5.608 3.666 346 HB3 PRO 44 HB3 PRO 44 -14.915 -3.885 3.861 347 HG2 PRO 44 HG2 PRO 44 -14.279 -4.843 1.463 348 HG3 PRO 44 HG3 PRO 44 -13.638 -3.272 1.989 349 HD2 PRO 44 HD2 PRO 44 -12.236 -5.929 1.806 350 HD3 PRO 44 HD3 PRO 44 -11.606 -4.296 1.498 351 H THR 45 H THR 45 -12.299 -6.903 4.766 352 HA THR 45 HA THR 45 -13.518 -7.501 7.296 353 HB THR 45 HB THR 45 -12.210 -9.680 7.107 354 HG1 THR 45 HG1 THR 45 -10.993 -10.009 5.248 355 HG21 THR 45 HG21 THR 45 -14.475 -9.550 6.144 356 HG22 THR 45 HG22 THR 45 -13.422 -10.545 5.136 357 HG23 THR 45 HG23 THR 45 -13.810 -8.896 4.643 358 H TRP 46 H TRP 46 -10.181 -6.741 6.287 359 HA TRP 46 HA TRP 46 -9.315 -6.608 9.135 360 HB2 TRP 46 HB2 TRP 46 -7.709 -7.497 6.698 361 HB3 TRP 46 HB3 TRP 46 -6.986 -7.167 8.266 362 HD1 TRP 46 HD1 TRP 46 -9.572 -9.636 6.704 363 HE1 TRP 46 HE1 TRP 46 -9.485 -11.822 8.046 364 HE3 TRP 46 HE3 TRP 46 -6.190 -8.275 10.289 365 HZ2 TRP 46 HZ2 TRP 46 -8.164 -12.856 10.281 366 HZ3 TRP 46 HZ3 TRP 46 -5.552 -9.938 11.986 367 HH2 TRP 46 HH2 TRP 46 -6.514 -12.186 11.985 368 HA PRO 47 HA PRO 47 -8.445 -2.327 7.472 369 HB2 PRO 47 HB2 PRO 47 -9.785 -0.877 9.321 370 HB3 PRO 47 HB3 PRO 47 -10.614 -1.602 7.937 371 HG2 PRO 47 HG2 PRO 47 -10.466 -2.586 10.786 372 HG3 PRO 47 HG3 PRO 47 -11.867 -2.528 9.697 373 HD2 PRO 47 HD2 PRO 47 -10.359 -4.809 10.137 374 HD3 PRO 47 HD3 PRO 47 -11.302 -4.519 8.660 375 H ALA 48 H ALA 48 -6.680 -1.141 8.156 376 HA ALA 48 HA ALA 48 -5.102 -2.199 10.337 377 HB1 ALA 48 HB1 ALA 48 -4.489 0.090 8.444 378 HB2 ALA 48 HB2 ALA 48 -4.081 -1.605 8.174 379 HB3 ALA 48 HB3 ALA 48 -3.333 -0.721 9.508 380 H THR 49 H THR 49 -3.941 -0.731 11.850 381 HA THR 49 HA THR 49 -5.149 1.855 12.519 382 HB THR 49 HB THR 49 -4.826 -0.326 14.649 383 HG1 THR 49 HG1 THR 49 -6.974 0.442 13.092 384 HG21 THR 49 HG21 THR 49 -4.350 1.937 15.541 385 HG22 THR 49 HG22 THR 49 -5.867 1.309 16.188 386 HG23 THR 49 HG23 THR 49 -5.890 2.518 14.901 387 H PHE 50 H PHE 50 -3.432 3.210 12.530 388 HA PHE 50 HA PHE 50 -0.709 2.152 12.819 389 HB2 PHE 50 HB2 PHE 50 -1.851 4.707 11.642 390 HB3 PHE 50 HB3 PHE 50 -0.131 4.583 12.003 391 HD1 PHE 50 HD1 PHE 50 -2.868 2.830 10.113 392 HD2 PHE 50 HD2 PHE 50 1.331 3.599 10.422 393 HE1 PHE 50 HE1 PHE 50 -2.488 1.615 8.007 394 HE2 PHE 50 HE2 PHE 50 1.701 2.380 8.320 395 HZ PHE 50 HZ PHE 50 -0.203 1.385 7.113 396 H GLU 51 H GLU 51 -0.013 2.028 14.864 397 HA GLU 51 HA GLU 51 -0.411 3.919 16.962 398 HB2 GLU 51 HB2 GLU 51 1.848 1.926 16.543 399 HB3 GLU 51 HB3 GLU 51 1.507 2.764 18.057 400 HG2 GLU 51 HG2 GLU 51 -0.357 0.804 16.677 401 HG3 GLU 51 HG3 GLU 51 0.704 0.416 18.027 402 H THR 52 H THR 52 2.122 3.435 14.605 403 HA THR 52 HA THR 52 3.094 6.194 15.029 404 HB THR 52 HB THR 52 4.871 3.730 14.629 405 HG1 THR 52 HG1 THR 52 4.967 3.666 16.746 406 HG21 THR 52 HG21 THR 52 5.822 5.771 13.604 407 HG22 THR 52 HG22 THR 52 6.743 5.289 15.030 408 HG23 THR 52 HG23 THR 52 5.602 6.632 15.128 409 H HIS 53 H HIS 53 3.570 7.269 13.166 410 HA HIS 53 HA HIS 53 4.141 5.998 10.647 411 HB2 HIS 53 HB2 HIS 53 1.668 5.810 10.700 412 HB3 HIS 53 HB3 HIS 53 1.518 7.534 10.996 413 HD2 HIS 53 HD2 HIS 53 1.781 5.065 8.082 414 HE1 HIS 53 HE1 HIS 53 1.901 8.988 6.523 415 HE2 HIS 53 HE2 HIS 53 1.464 6.563 5.996 416 H GLU 54 H GLU 54 6.025 7.186 10.680 417 HA GLU 54 HA GLU 54 6.238 9.920 11.492 418 HB2 GLU 54 HB2 GLU 54 8.199 8.108 10.019 419 HB3 GLU 54 HB3 GLU 54 8.602 9.724 10.599 420 HG2 GLU 54 HG2 GLU 54 8.143 9.011 12.907 421 HG3 GLU 54 HG3 GLU 54 7.744 7.390 12.342 422 H PHE 55 H PHE 55 6.304 8.329 8.329 423 HA PHE 55 HA PHE 55 6.216 8.978 6.193 424 HB2 PHE 55 HB2 PHE 55 3.974 9.899 7.153 425 HB3 PHE 55 HB3 PHE 55 4.713 11.488 7.014 426 HD1 PHE 55 HD1 PHE 55 3.881 8.433 5.036 427 HD2 PHE 55 HD2 PHE 55 4.617 12.641 4.891 428 HE1 PHE 55 HE1 PHE 55 3.217 8.465 2.675 429 HE2 PHE 55 HE2 PHE 55 3.936 12.660 2.523 430 HZ PHE 55 HZ PHE 55 3.235 10.571 1.422 431 H THR 56 H THR 56 8.611 9.338 6.812 432 HA THR 56 HA THR 56 9.431 11.748 5.334 433 HB THR 56 HB THR 56 9.821 12.377 7.688 434 HG1 THR 56 HG1 THR 56 11.448 13.326 6.708 435 HG21 THR 56 HG21 THR 56 11.614 9.928 7.878 436 HG22 THR 56 HG22 THR 56 10.066 10.131 8.700 437 HG23 THR 56 HG23 THR 56 11.433 11.169 9.119 438 H VAL 57 H VAL 57 11.740 11.529 4.530 439 HA VAL 57 HA VAL 57 12.118 8.985 3.244 440 HB VAL 57 HB VAL 57 13.941 11.436 3.367 441 HG11 VAL 57 HG11 VAL 57 15.282 9.459 2.778 442 HG12 VAL 57 HG12 VAL 57 15.089 10.496 1.363 443 HG13 VAL 57 HG13 VAL 57 14.128 9.024 1.515 444 HG21 VAL 57 HG21 VAL 57 13.049 11.951 1.105 445 HG22 VAL 57 HG22 VAL 57 11.761 11.915 2.312 446 HG23 VAL 57 HG23 VAL 57 11.975 10.551 1.210 447 H GLY 58 H GLY 58 12.893 7.232 4.260 448 HA2 GLY 58 HA2 GLY 58 14.416 5.896 5.442 449 HA3 GLY 58 HA3 GLY 58 15.188 7.328 6.096 450 H GLY 59 H GLY 59 11.877 7.650 6.454 451 HA2 GLY 59 HA2 GLY 59 11.892 7.071 9.303 452 HA3 GLY 59 HA3 GLY 59 10.584 7.783 8.372 453 H LYS 60 H LYS 60 9.820 6.011 10.204 454 HA LYS 60 HA LYS 60 9.066 3.595 8.658 455 HB2 LYS 60 HB2 LYS 60 10.009 3.681 11.560 456 HB3 LYS 60 HB3 LYS 60 9.214 2.286 10.825 457 HG2 LYS 60 HG2 LYS 60 11.072 2.191 9.135 458 HG3 LYS 60 HG3 LYS 60 11.892 3.476 10.032 459 HD2 LYS 60 HD2 LYS 60 12.053 2.043 12.006 460 HD3 LYS 60 HD3 LYS 60 11.109 0.782 11.207 461 HE2 LYS 60 HE2 LYS 60 12.909 0.467 9.556 462 HE3 LYS 60 HE3 LYS 60 13.852 1.752 10.322 463 HZ1 LYS 60 HZ1 LYS 60 13.049 -0.811 11.599 464 HZ2 LYS 60 HZ2 LYS 60 13.942 0.419 12.340 465 HZ3 LYS 60 HZ3 LYS 60 14.592 -0.419 11.030 466 H ALA 61 H ALA 61 7.267 2.355 9.763 467 HA ALA 61 HA ALA 61 5.344 3.954 11.307 468 HB1 ALA 61 HB1 ALA 61 4.565 2.628 8.678 469 HB2 ALA 61 HB2 ALA 61 4.720 4.364 8.943 470 HB3 ALA 61 HB3 ALA 61 3.472 3.454 9.794 471 H ALA 62 H ALA 62 4.066 2.719 12.657 472 HA ALA 62 HA ALA 62 4.349 -0.241 12.641 473 HB1 ALA 62 HB1 ALA 62 4.056 1.610 15.043 474 HB2 ALA 62 HB2 ALA 62 5.516 0.737 14.570 475 HB3 ALA 62 HB3 ALA 62 4.091 -0.159 15.109 476 H TYR 63 H TYR 63 2.448 -1.361 12.486 477 HA TYR 63 HA TYR 63 -0.071 -0.225 13.394 478 HB2 TYR 63 HB2 TYR 63 -1.236 -0.329 11.264 479 HB3 TYR 63 HB3 TYR 63 0.162 0.720 11.102 480 HD1 TYR 63 HD1 TYR 63 2.190 -0.110 9.808 481 HD2 TYR 63 HD2 TYR 63 -1.481 -2.299 9.873 482 HE1 TYR 63 HE1 TYR 63 2.880 -1.339 7.800 483 HE2 TYR 63 HE2 TYR 63 -0.783 -3.529 7.867 484 HH TYR 63 HH TYR 63 2.410 -3.363 6.585 485 H TYR 64 H TYR 64 -1.937 -1.707 12.810 486 HA TYR 64 HA TYR 64 -1.376 -4.520 12.387 487 HB2 TYR 64 HB2 TYR 64 -2.519 -5.231 14.522 488 HB3 TYR 64 HB3 TYR 64 -0.984 -4.420 14.795 489 HD1 TYR 64 HD2 TYR 64 -0.940 -2.061 15.709 490 HD2 TYR 64 HD1 TYR 64 -4.608 -4.246 15.339 491 HE1 TYR 64 HE2 TYR 64 -2.058 -0.472 17.209 492 HE2 TYR 64 HE1 TYR 64 -5.713 -2.645 16.830 493 HH TYR 64 HH TYR 64 -5.125 -1.055 18.575 494 H MET 65 H MET 65 -3.110 -5.480 11.345 495 HA MET 65 HA MET 65 -5.556 -3.956 10.906 496 HB2 MET 65 HB2 MET 65 -4.587 -6.618 9.799 497 HB3 MET 65 HB3 MET 65 -6.183 -5.966 9.446 498 HG2 MET 65 HG2 MET 65 -4.792 -5.425 7.597 499 HG3 MET 65 HG3 MET 65 -5.047 -3.928 8.488 500 HE1 MET 65 HE1 MET 65 -1.089 -6.282 8.217 501 HE2 MET 65 HE2 MET 65 -2.512 -6.564 7.213 502 HE3 MET 65 HE3 MET 65 -2.531 -7.012 8.920 503 H THR 66 H THR 66 -7.080 -4.008 12.467 504 HA THR 66 HA THR 66 -7.508 -6.318 14.193 505 HB THR 66 HB THR 66 -9.142 -3.740 14.005 506 HG1 THR 66 HG1 THR 66 -7.624 -2.860 15.186 507 HG21 THR 66 HG21 THR 66 -9.019 -5.827 16.223 508 HG22 THR 66 HG22 THR 66 -10.383 -5.575 15.128 509 HG23 THR 66 HG23 THR 66 -9.930 -4.315 16.277 510 H GLY 67 H GLY 67 -8.467 -8.023 13.272 511 HA2 GLY 67 HA2 GLY 67 -9.994 -7.832 10.828 512 HA3 GLY 67 HA3 GLY 67 -9.456 -9.293 11.628 513 HA PRO 68 HA PRO 68 -14.140 -8.945 11.831 514 HB2 PRO 68 HB2 PRO 68 -14.139 -11.805 11.033 515 HB3 PRO 68 HB3 PRO 68 -14.893 -10.422 10.231 516 HG2 PRO 68 HG2 PRO 68 -12.725 -11.704 9.196 517 HG3 PRO 68 HG3 PRO 68 -13.011 -9.968 8.953 518 HD2 PRO 68 HD2 PRO 68 -11.163 -11.338 10.903 519 HD3 PRO 68 HD3 PRO 68 -10.870 -9.909 9.881 520 H ASP 69 H ASP 69 -12.025 -11.516 13.013 521 HA ASP 69 HA ASP 69 -13.772 -12.257 15.220 522 HB2 ASP 69 HB2 ASP 69 -12.272 -13.864 13.888 523 HB3 ASP 69 HB3 ASP 69 -10.895 -13.144 14.713 524 H GLY 70 H GLY 70 -11.898 -9.598 14.726 525 HA2 GLY 70 HA2 GLY 70 -11.099 -7.966 16.165 526 HA3 GLY 70 HA3 GLY 70 -11.349 -9.048 17.528 527 H THR 71 H THR 71 -9.633 -10.692 15.173 528 HA THR 71 HA THR 71 -7.247 -10.869 16.723 529 HB THR 71 HB THR 71 -7.706 -11.825 13.849 530 HG1 THR 71 HG1 THR 71 -8.353 -13.774 14.844 531 HG21 THR 71 HG21 THR 71 -5.963 -13.516 14.367 532 HG22 THR 71 HG22 THR 71 -5.713 -12.788 15.955 533 HG23 THR 71 HG23 THR 71 -5.309 -11.880 14.494 534 H LYS 72 H LYS 72 -5.362 -9.692 16.587 535 HA LYS 72 HA LYS 72 -5.140 -7.531 14.614 536 HB2 LYS 72 HB2 LYS 72 -3.456 -8.210 17.062 537 HB3 LYS 72 HB3 LYS 72 -3.168 -6.821 16.012 538 HG2 LYS 72 HG2 LYS 72 -5.371 -5.900 16.608 539 HG3 LYS 72 HG3 LYS 72 -5.684 -7.300 17.641 540 HD2 LYS 72 HD2 LYS 72 -3.763 -6.691 19.071 541 HD3 LYS 72 HD3 LYS 72 -3.409 -5.308 18.028 542 HE2 LYS 72 HE2 LYS 72 -5.573 -4.289 18.636 543 HE3 LYS 72 HE3 LYS 72 -5.955 -5.686 19.646 544 HZ1 LYS 72 HZ1 LYS 72 -5.124 -3.870 20.963 545 HZ2 LYS 72 HZ2 LYS 72 -3.703 -3.807 20.056 546 HZ3 LYS 72 HZ3 LYS 72 -4.031 -5.158 21.013 547 H ALA 73 H ALA 73 -4.181 -8.010 12.696 548 HA ALA 73 HA ALA 73 -1.823 -9.792 12.568 549 HB1 ALA 73 HB1 ALA 73 -3.532 -10.110 10.824 550 HB2 ALA 73 HB2 ALA 73 -2.019 -9.547 10.114 551 HB3 ALA 73 HB3 ALA 73 -3.366 -8.425 10.324 552 H ARG 74 H ARG 74 -0.088 -8.677 13.354 553 HA ARG 74 HA ARG 74 0.171 -5.815 13.093 554 HB2 ARG 74 HB2 ARG 74 0.793 -6.959 15.168 555 HB3 ARG 74 HB3 ARG 74 2.009 -7.908 14.329 556 HG2 ARG 74 HG2 ARG 74 3.535 -6.175 14.265 557 HG3 ARG 74 HG3 ARG 74 2.292 -4.922 14.217 558 HD2 ARG 74 HD2 ARG 74 2.949 -6.580 16.686 559 HD3 ARG 74 HD3 ARG 74 3.623 -4.985 16.351 560 HE ARG 74 HE ARG 74 1.348 -4.084 16.456 561 HH11 ARG 74 HH11 ARG 74 1.822 -7.152 17.978 562 HH12 ARG 74 HH12 ARG 74 0.463 -6.955 19.021 563 HH21 ARG 74 HH21 ARG 74 -0.399 -3.887 17.790 564 HH22 ARG 74 HH22 ARG 74 -0.777 -5.142 18.913 565 H GLY 75 H GLY 75 1.504 -4.660 11.775 566 HA2 GLY 75 HA2 GLY 75 3.476 -6.013 10.037 567 HA3 GLY 75 HA3 GLY 75 2.198 -5.050 9.301 568 H TRP 76 H TRP 76 4.998 -4.568 9.043 569 HA TRP 76 HA TRP 76 5.334 -1.958 10.429 570 HB2 TRP 76 HB2 TRP 76 7.790 -2.374 10.434 571 HB3 TRP 76 HB3 TRP 76 6.935 -3.622 11.334 572 HD1 TRP 76 HD1 TRP 76 6.896 -6.106 10.255 573 HE1 TRP 76 HE1 TRP 76 8.323 -7.229 8.449 574 HE3 TRP 76 HE3 TRP 76 9.151 -1.948 8.290 575 HZ2 TRP 76 HZ2 TRP 76 10.159 -6.476 6.458 576 HZ3 TRP 76 HZ3 TRP 76 10.736 -2.237 6.428 577 HH2 TRP 76 HH2 TRP 76 11.231 -4.459 5.535 578 H TRP 77 H TRP 77 6.267 -0.278 9.208 579 HA TRP 77 HA TRP 77 6.859 -0.717 6.333 580 HB2 TRP 77 HB2 TRP 77 5.460 1.566 7.736 581 HB3 TRP 77 HB3 TRP 77 6.351 1.894 6.262 582 HD1 TRP 77 HD1 TRP 77 4.466 -1.400 6.137 583 HE1 TRP 77 HE1 TRP 77 2.389 -1.100 4.649 584 HE3 TRP 77 HE3 TRP 77 4.575 3.664 5.659 585 HZ2 TRP 77 HZ2 TRP 77 0.993 1.060 3.424 586 HZ3 TRP 77 HZ3 TRP 77 2.855 4.777 4.302 587 HH2 TRP 77 HH2 TRP 77 1.098 3.494 3.208 588 H GLN 78 H GLN 78 8.622 0.458 5.435 589 HA GLN 78 HA GLN 78 9.926 2.508 7.085 590 HB2 GLN 78 HB2 GLN 78 11.384 0.527 7.346 591 HB3 GLN 78 HB3 GLN 78 11.510 0.360 5.597 592 HG2 GLN 78 HG2 GLN 78 12.655 2.541 5.456 593 HG3 GLN 78 HG3 GLN 78 12.490 2.756 7.198 594 HE21 GLN 78 HE21 GLN 78 14.716 2.932 7.484 595 HE22 GLN 78 HE22 GLN 78 15.787 1.588 7.336 596 H PHE 79 H PHE 79 9.423 4.267 5.943 597 HA PHE 79 HA PHE 79 8.983 4.457 3.155 598 HB2 PHE 79 HB2 PHE 79 9.745 6.701 5.071 599 HB3 PHE 79 HB3 PHE 79 8.996 6.896 3.492 600 HD1 PHE 79 HD2 PHE 79 6.607 6.329 3.154 601 HD2 PHE 79 HD1 PHE 79 8.432 6.043 7.010 602 HE1 PHE 79 HE2 PHE 79 4.393 6.272 4.208 603 HE2 PHE 79 HE1 PHE 79 6.214 5.984 8.057 604 HZ PHE 79 HZ PHE 79 4.193 6.102 6.659 605 H THR 80 H THR 80 10.408 4.659 1.485 606 HA THR 80 HA THR 80 13.298 4.919 2.059 607 HB THR 80 HB THR 80 13.670 3.889 -0.156 608 HG1 THR 80 HG1 THR 80 10.947 3.356 -0.503 609 HG21 THR 80 HG21 THR 80 13.338 2.315 1.709 610 HG22 THR 80 HG22 THR 80 12.629 1.660 0.226 611 HG23 THR 80 HG23 THR 80 11.589 2.371 1.464 612 H THR 81 H THR 81 10.811 6.209 -0.179 613 HA THR 81 HA THR 81 12.430 8.634 -0.685 614 HB THR 81 HB THR 81 11.297 6.848 -2.895 615 HG1 THR 81 HG1 THR 81 13.375 6.509 -3.449 616 HG21 THR 81 HG21 THR 81 10.856 9.186 -3.531 617 HG22 THR 81 HG22 THR 81 12.161 8.524 -4.517 618 HG23 THR 81 HG23 THR 81 12.536 9.615 -3.183 619 H ILE 82 H ILE 82 11.148 10.338 -0.280 620 HA ILE 82 HA ILE 82 8.283 10.290 -1.024 621 HB ILE 82 HB ILE 82 9.340 11.547 1.561 622 HG12 ILE 82 HG12 ILE 82 7.769 8.971 1.118 623 HG13 ILE 82 HG13 ILE 82 9.348 9.137 1.873 624 HG21 ILE 82 HG21 ILE 82 7.438 12.793 0.584 625 HG22 ILE 82 HG22 ILE 82 6.955 11.989 2.074 626 HG23 ILE 82 HG23 ILE 82 6.480 11.309 0.516 627 HD11 ILE 82 HD11 ILE 82 8.264 10.324 3.758 628 HD12 ILE 82 HD12 ILE 82 7.682 8.678 3.526 629 HD13 ILE 82 HD13 ILE 82 6.699 10.036 2.991 630 H GLU 83 H GLU 83 8.353 11.606 -2.728 631 HA GLU 83 HA GLU 83 9.969 14.041 -2.804 632 HB2 GLU 83 HB2 GLU 83 8.109 12.843 -4.910 633 HB3 GLU 83 HB3 GLU 83 9.243 14.171 -5.160 634 HG2 GLU 83 HG2 GLU 83 10.014 11.327 -4.413 635 HG3 GLU 83 HG3 GLU 83 10.083 12.004 -6.033 636 H ALA 84 H ALA 84 6.534 13.134 -3.108 637 HA ALA 84 HA ALA 84 4.572 14.122 -2.654 638 HB1 ALA 84 HB1 ALA 84 4.383 15.711 -0.818 639 HB2 ALA 84 HB2 ALA 84 6.112 16.073 -0.918 640 HB3 ALA 84 HB3 ALA 84 5.578 14.471 -0.409 641 HA PRO 85 HA PRO 85 2.681 15.149 -2.533 642 HB2 PRO 85 HB2 PRO 85 0.549 16.046 -3.852 643 HB3 PRO 85 HB3 PRO 85 1.481 17.151 -2.831 644 HG2 PRO 85 HG2 PRO 85 1.579 16.815 -5.831 645 HG3 PRO 85 HG3 PRO 85 1.515 18.317 -4.886 646 HD2 PRO 85 HD2 PRO 85 3.862 17.184 -5.891 647 HD3 PRO 85 HD3 PRO 85 3.801 18.314 -4.520 648 H ASP 86 H ASP 86 4.174 14.307 -5.274 649 HA ASP 86 HA ASP 86 2.034 12.644 -6.447 650 HB2 ASP 86 HB2 ASP 86 3.396 12.671 -8.517 651 HB3 ASP 86 HB3 ASP 86 2.956 14.283 -7.976 652 H HIS 87 H HIS 87 5.551 12.378 -5.653 653 HA HIS 87 HA HIS 87 5.405 9.481 -6.223 654 HB2 HIS 87 HB2 HIS 87 7.077 10.996 -7.402 655 HB3 HIS 87 HB3 HIS 87 7.897 11.181 -5.868 656 HD1 HIS 87 HD1 HIS 87 9.404 10.077 -8.238 657 HD2 HIS 87 HD2 HIS 87 7.444 7.633 -5.512 658 HE1 HIS 87 HE1 HIS 87 10.525 7.840 -8.419 659 HE2 HIS 87 HE2 HIS 87 9.448 6.455 -6.638 660 H LEU 88 H LEU 88 5.487 8.044 -4.703 661 HA LEU 88 HA LEU 88 6.754 8.465 -2.077 662 HB2 LEU 88 HB2 LEU 88 4.320 8.668 -1.753 663 HB3 LEU 88 HB3 LEU 88 4.044 7.174 -2.622 664 HG LEU 88 HG LEU 88 5.193 5.919 -0.786 665 HD11 LEU 88 HD11 LEU 88 6.663 7.668 0.079 666 HD12 LEU 88 HD12 LEU 88 5.659 7.000 1.365 667 HD13 LEU 88 HD13 LEU 88 5.266 8.576 0.671 668 HD21 LEU 88 HD21 LEU 88 3.391 6.100 0.864 669 HD22 LEU 88 HD22 LEU 88 2.757 6.115 -0.780 670 HD23 LEU 88 HD23 LEU 88 2.862 7.622 0.138 671 H GLU 89 H GLU 89 7.881 6.695 -1.372 672 HA GLU 89 HA GLU 89 7.524 4.030 -2.529 673 HB2 GLU 89 HB2 GLU 89 10.218 5.479 -2.411 674 HB3 GLU 89 HB3 GLU 89 10.055 3.743 -2.632 675 HG2 GLU 89 HG2 GLU 89 8.907 4.103 -4.764 676 HG3 GLU 89 HG3 GLU 89 9.005 5.845 -4.540 677 H PHE 90 H PHE 90 7.894 2.430 -1.018 678 HA PHE 90 HA PHE 90 9.267 2.902 1.487 679 HB2 PHE 90 HB2 PHE 90 7.320 2.363 2.956 680 HB3 PHE 90 HB3 PHE 90 7.105 3.879 2.097 681 HD1 PHE 90 HD2 PHE 90 5.949 0.348 2.332 682 HD2 PHE 90 HD1 PHE 90 5.286 4.167 0.515 683 HE1 PHE 90 HE2 PHE 90 3.737 -0.397 1.549 684 HE2 PHE 90 HE1 PHE 90 3.078 3.412 -0.257 685 HZ PHE 90 HZ PHE 90 2.302 1.131 0.254 686 H ASP 91 H ASP 91 9.000 0.893 2.934 687 HA ASP 91 HA ASP 91 8.972 -1.588 1.316 688 HB2 ASP 91 HB2 ASP 91 10.498 -0.981 3.884 689 HB3 ASP 91 HB3 ASP 91 10.496 -2.533 3.051 690 H ASP 92 H ASP 92 6.847 -2.177 1.596 691 HA ASP 92 HA ASP 92 5.532 -2.320 4.152 692 HB2 ASP 92 HB2 ASP 92 4.264 -2.088 2.020 693 HB3 ASP 92 HB3 ASP 92 4.846 -3.664 1.492 694 H GLY 93 H GLY 93 5.261 -4.148 5.457 695 HA2 GLY 93 HA2 GLY 93 6.195 -6.779 4.712 696 HA3 GLY 93 HA3 GLY 93 7.251 -5.974 5.870 697 H PHE 94 H PHE 94 5.801 -8.370 6.326 698 HA PHE 94 HA PHE 94 3.708 -7.644 8.261 699 HB2 PHE 94 HB2 PHE 94 4.684 -10.355 7.272 700 HB3 PHE 94 HB3 PHE 94 3.441 -10.146 8.502 701 HD1 PHE 94 HD2 PHE 94 1.264 -9.035 7.894 702 HD2 PHE 94 HD1 PHE 94 4.149 -10.136 4.936 703 HE1 PHE 94 HE2 PHE 94 -0.462 -8.872 6.150 704 HE2 PHE 94 HE1 PHE 94 2.416 -9.964 3.197 705 HZ PHE 94 HZ PHE 94 0.113 -9.339 3.799 706 H ALA 95 H ALA 95 3.864 -8.088 10.428 707 HA ALA 95 HA ALA 95 6.541 -8.705 11.547 708 HB1 ALA 95 HB1 ALA 95 6.088 -7.068 13.332 709 HB2 ALA 95 HB2 ALA 95 4.530 -6.669 12.600 710 HB3 ALA 95 HB3 ALA 95 6.029 -6.291 11.748 711 H ASP 96 H ASP 96 6.596 -9.963 13.326 712 HA ASP 96 HA ASP 96 4.560 -11.740 14.101 713 HB2 ASP 96 HB2 ASP 96 6.669 -12.576 14.567 714 HB3 ASP 96 HB3 ASP 96 7.340 -11.001 14.946 715 H GLU 97 H GLU 97 3.657 -11.862 16.408 716 HA GLU 97 HA GLU 97 1.986 -9.704 16.994 717 HB2 GLU 97 HB2 GLU 97 1.405 -10.926 19.057 718 HB3 GLU 97 HB3 GLU 97 1.494 -12.013 17.673 719 HG2 GLU 97 HG2 GLU 97 3.670 -12.834 18.389 720 HG3 GLU 97 HG3 GLU 97 3.729 -11.654 19.694 721 H HIS 98 H HIS 98 5.283 -10.184 18.097 722 HA HIS 98 HA HIS 98 5.077 -8.030 20.115 723 HB2 HIS 98 HB2 HIS 98 7.545 -9.700 19.470 724 HB3 HIS 98 HB3 HIS 98 7.242 -8.751 20.918 725 HD1 HIS 98 HD1 HIS 98 5.179 -9.754 22.454 726 HD2 HIS 98 HD2 HIS 98 6.918 -12.325 19.694 727 HE1 HIS 98 HE1 HIS 98 4.504 -12.063 23.180 728 HE2 HIS 98 HE2 HIS 98 5.448 -13.584 21.413 729 H GLY 99 H GLY 99 5.846 -8.385 16.843 730 HA2 GLY 99 HA2 GLY 99 5.952 -6.382 15.517 731 HA3 GLY 99 HA3 GLY 99 6.938 -5.629 16.755 732 H ALA 100 H ALA 100 7.869 -8.859 16.024 733 HA ALA 100 HA ALA 100 10.391 -7.976 14.884 734 HB1 ALA 100 HB1 ALA 100 10.322 -9.782 16.554 735 HB2 ALA 100 HB2 ALA 100 11.043 -10.336 15.044 736 HB3 ALA 100 HB3 ALA 100 9.382 -10.789 15.444 737 HA PRO 101 HA PRO 101 8.893 -8.126 10.517 738 HB2 PRO 101 HB2 PRO 101 11.898 -8.360 10.124 739 HB3 PRO 101 HB3 PRO 101 10.721 -7.353 9.256 740 HG2 PRO 101 HG2 PRO 101 12.244 -6.239 11.115 741 HG3 PRO 101 HG3 PRO 101 10.517 -5.821 11.033 742 HD2 PRO 101 HD2 PRO 101 11.941 -7.645 12.970 743 HD3 PRO 101 HD3 PRO 101 10.617 -6.495 13.269 744 H VAL 102 H VAL 102 7.965 -10.055 9.995 745 HA VAL 102 HA VAL 102 9.029 -12.629 10.465 746 HB VAL 102 HB VAL 102 6.827 -11.840 8.495 747 HG11 VAL 102 HG11 VAL 102 7.646 -14.122 8.020 748 HG12 VAL 102 HG12 VAL 102 6.028 -14.185 8.718 749 HG13 VAL 102 HG13 VAL 102 7.433 -14.575 9.716 750 HG21 VAL 102 HG21 VAL 102 6.600 -12.714 11.405 751 HG22 VAL 102 HG22 VAL 102 5.245 -12.392 10.320 752 HG23 VAL 102 HG23 VAL 102 6.328 -11.080 10.791 753 H ASP 103 H ASP 103 10.709 -13.508 9.509 754 HA ASP 103 HA ASP 103 12.000 -12.517 7.181 755 HB2 ASP 103 HB2 ASP 103 12.501 -15.171 8.596 756 HB3 ASP 103 HB3 ASP 103 13.630 -14.292 7.568 757 H GLU 104 H GLU 104 9.885 -15.250 7.808 758 HA GLU 104 HA GLU 104 10.124 -16.685 5.394 759 HB2 GLU 104 HB2 GLU 104 9.105 -17.541 7.502 760 HB3 GLU 104 HB3 GLU 104 7.744 -16.447 7.286 761 HG2 GLU 104 HG2 GLU 104 7.089 -17.624 5.250 762 HG3 GLU 104 HG3 GLU 104 8.485 -18.686 5.389 763 H LEU 105 H LEU 105 7.907 -14.053 6.324 764 HA LEU 105 HA LEU 105 6.599 -13.929 3.718 765 HB2 LEU 105 HB2 LEU 105 6.317 -12.277 6.253 766 HB3 LEU 105 HB3 LEU 105 5.366 -11.983 4.801 767 HG LEU 105 HG LEU 105 5.333 -14.622 6.340 768 HD11 LEU 105 HD11 LEU 105 3.284 -12.392 6.459 769 HD12 LEU 105 HD12 LEU 105 4.387 -12.866 7.753 770 HD13 LEU 105 HD13 LEU 105 3.140 -13.985 7.210 771 HD21 LEU 105 HD21 LEU 105 4.753 -14.839 3.961 772 HD22 LEU 105 HD22 LEU 105 3.509 -13.599 4.137 773 HD23 LEU 105 HD23 LEU 105 3.351 -15.140 4.987 774 H GLY 106 H GLY 106 9.303 -12.452 5.293 775 HA2 GLY 106 HA2 GLY 106 11.028 -11.211 4.460 776 HA3 GLY 106 HA3 GLY 106 10.340 -11.442 2.865 777 H VAL 107 H VAL 107 11.168 -9.331 2.429 778 HA VAL 107 HA VAL 107 9.538 -7.029 3.387 779 HB VAL 107 HB VAL 107 12.373 -6.971 2.225 780 HG11 VAL 107 HG11 VAL 107 12.422 -4.604 2.988 781 HG12 VAL 107 HG12 VAL 107 10.746 -4.746 3.521 782 HG13 VAL 107 HG13 VAL 107 11.138 -4.879 1.807 783 HG21 VAL 107 HG21 VAL 107 13.177 -6.464 4.519 784 HG22 VAL 107 HG22 VAL 107 12.423 -8.059 4.430 785 HG23 VAL 107 HG23 VAL 107 11.542 -6.705 5.138 786 H THR 108 H THR 108 8.502 -5.795 1.771 787 HA THR 108 HA THR 108 9.268 -6.225 -1.054 788 HB THR 108 HB THR 108 7.300 -7.599 -0.808 789 HG1 THR 108 HG1 THR 108 6.188 -5.340 -2.046 790 HG21 THR 108 HG21 THR 108 6.250 -6.583 1.191 791 HG22 THR 108 HG22 THR 108 5.093 -6.738 -0.131 792 HG23 THR 108 HG23 THR 108 5.800 -5.163 0.239 793 H HIS 109 H HIS 109 9.428 -4.435 -2.250 794 HA HIS 109 HA HIS 109 9.143 -1.842 -0.902 795 HB2 HIS 109 HB2 HIS 109 11.334 -2.508 -1.886 796 HB3 HIS 109 HB3 HIS 109 10.594 -2.593 -3.474 797 HD1 HIS 109 HD1 HIS 109 12.173 -0.261 -1.122 798 HD2 HIS 109 HD2 HIS 109 9.793 0.020 -4.510 799 HE1 HIS 109 HE1 HIS 109 12.425 2.097 -1.943 800 HE2 HIS 109 HE2 HIS 109 10.870 2.275 -3.901 801 H ALA 110 H ALA 110 7.198 -0.871 -1.231 802 HA ALA 110 HA ALA 110 5.765 -1.161 -3.805 803 HB1 ALA 110 HB1 ALA 110 4.523 -1.722 -1.762 804 HB2 ALA 110 HB2 ALA 110 3.794 -0.348 -2.593 805 HB3 ALA 110 HB3 ALA 110 4.771 -0.085 -1.146 806 H THR 111 H THR 111 5.644 0.492 -5.239 807 HA THR 111 HA THR 111 6.663 3.190 -4.501 808 HB THR 111 HB THR 111 6.623 1.887 -7.280 809 HG1 THR 111 HG1 THR 111 8.553 1.144 -6.817 810 HG21 THR 111 HG21 THR 111 7.885 4.500 -6.365 811 HG22 THR 111 HG22 THR 111 6.491 4.340 -7.433 812 HG23 THR 111 HG23 THR 111 8.075 3.774 -7.960 813 H VAL 112 H VAL 112 4.923 4.471 -4.142 814 HA VAL 112 HA VAL 112 2.437 4.225 -5.715 815 HB VAL 112 HB VAL 112 2.966 5.986 -3.277 816 HG11 VAL 112 HG11 VAL 112 1.059 6.737 -4.657 817 HG12 VAL 112 HG12 VAL 112 0.501 6.112 -3.105 818 HG13 VAL 112 HG13 VAL 112 0.339 5.126 -4.560 819 HG21 VAL 112 HG21 VAL 112 1.817 4.274 -1.914 820 HG22 VAL 112 HG22 VAL 112 3.289 3.628 -2.644 821 HG23 VAL 112 HG23 VAL 112 1.713 3.215 -3.322 822 H LYS 113 H LYS 113 2.255 5.550 -7.471 823 HA LYS 113 HA LYS 113 3.563 8.219 -7.454 824 HB2 LYS 113 HB2 LYS 113 3.078 6.412 -9.863 825 HB3 LYS 113 HB3 LYS 113 3.910 7.970 -9.876 826 HG2 LYS 113 HG2 LYS 113 5.724 7.044 -8.496 827 HG3 LYS 113 HG3 LYS 113 4.877 5.500 -8.380 828 HD2 LYS 113 HD2 LYS 113 6.050 6.750 -10.892 829 HD3 LYS 113 HD3 LYS 113 6.674 5.344 -10.018 830 HE2 LYS 113 HE2 LYS 113 4.641 4.079 -10.592 831 HE3 LYS 113 HE3 LYS 113 3.986 5.479 -11.426 832 HZ1 LYS 113 HZ1 LYS 113 4.934 3.934 -12.968 833 HZ2 LYS 113 HZ2 LYS 113 6.423 3.985 -12.175 834 HZ3 LYS 113 HZ3 LYS 113 5.841 5.360 -12.968 835 H LEU 114 H LEU 114 2.408 9.966 -8.228 836 HA LEU 114 HA LEU 114 -0.464 9.590 -8.876 837 HB2 LEU 114 HB2 LEU 114 0.819 11.709 -7.106 838 HB3 LEU 114 HB3 LEU 114 -0.831 11.821 -7.700 839 HG LEU 114 HG LEU 114 0.195 9.580 -5.905 840 HD11 LEU 114 HD11 LEU 114 -1.492 11.996 -5.178 841 HD12 LEU 114 HD12 LEU 114 0.178 11.700 -4.687 842 HD13 LEU 114 HD13 LEU 114 -1.105 10.642 -4.110 843 HD21 LEU 114 HD21 LEU 114 -1.664 8.893 -7.336 844 HD22 LEU 114 HD22 LEU 114 -2.619 10.278 -6.800 845 HD23 LEU 114 HD23 LEU 114 -2.180 9.008 -5.655 846 H GLU 115 H GLU 115 -1.025 10.435 -10.788 847 HA GLU 115 HA GLU 115 0.737 12.429 -12.097 848 HB2 GLU 115 HB2 GLU 115 0.484 10.196 -13.206 849 HB3 GLU 115 HB3 GLU 115 -1.239 10.507 -13.395 850 HG2 GLU 115 HG2 GLU 115 -0.732 12.445 -14.835 851 HG3 GLU 115 HG3 GLU 115 0.995 12.169 -14.606 852 HA PRO 116 HA PRO 116 -2.803 15.292 -11.485 853 HB2 PRO 116 HB2 PRO 116 -1.704 17.408 -12.902 854 HB3 PRO 116 HB3 PRO 116 -1.313 17.042 -11.218 855 HG2 PRO 116 HG2 PRO 116 0.195 16.290 -13.722 856 HG3 PRO 116 HG3 PRO 116 0.827 16.943 -12.194 857 HD2 PRO 116 HD2 PRO 116 0.996 14.315 -12.732 858 HD3 PRO 116 HD3 PRO 116 0.639 14.880 -11.085 859 H LEU 117 H LEU 117 -4.504 14.563 -12.648 860 HA LEU 117 HA LEU 117 -4.559 14.919 -15.600 861 HB2 LEU 117 HB2 LEU 117 -6.624 13.483 -13.882 862 HB3 LEU 117 HB3 LEU 117 -6.485 13.437 -15.632 863 HG LEU 117 HG LEU 117 -4.511 12.181 -13.671 864 HD11 LEU 117 HD11 LEU 117 -6.656 10.993 -13.678 865 HD12 LEU 117 HD12 LEU 117 -5.388 10.015 -14.413 866 HD13 LEU 117 HD13 LEU 117 -6.580 10.825 -15.436 867 HD21 LEU 117 HD21 LEU 117 -4.581 11.992 -16.701 868 HD22 LEU 117 HD22 LEU 117 -3.480 11.120 -15.628 869 HD23 LEU 117 HD23 LEU 117 -3.391 12.875 -15.740 870 H GLU 118 H GLU 118 -4.774 17.111 -13.572 871 HA GLU 118 HA GLU 118 -5.889 19.009 -13.096 872 HB2 GLU 118 HB2 GLU 118 -7.215 18.217 -15.660 873 HB3 GLU 118 HB3 GLU 118 -8.126 19.352 -14.684 874 HG2 GLU 118 HG2 GLU 118 -6.788 20.463 -16.383 875 HG3 GLU 118 HG3 GLU 118 -6.341 20.935 -14.746 876 H ASN 119 H ASN 119 -8.832 17.313 -14.089 877 HA ASN 119 HA ASN 119 -10.143 17.947 -11.572 878 HB2 ASN 119 HB2 ASN 119 -11.034 16.683 -14.187 879 HB3 ASN 119 HB3 ASN 119 -12.127 16.906 -12.821 880 HD21 ASN 119 HD21 ASN 119 -13.467 18.296 -14.004 881 HD22 ASN 119 HD22 ASN 119 -12.991 19.897 -14.438 882 H ARG 120 H ARG 120 -8.584 15.212 -13.053 883 HA ARG 120 HA ARG 120 -9.298 13.523 -10.706 884 HB2 ARG 120 HB2 ARG 120 -8.679 12.535 -13.527 885 HB3 ARG 120 HB3 ARG 120 -9.082 11.533 -12.131 886 HG2 ARG 120 HG2 ARG 120 -11.349 12.542 -12.072 887 HG3 ARG 120 HG3 ARG 120 -10.937 13.528 -13.481 888 HD2 ARG 120 HD2 ARG 120 -11.138 10.504 -13.357 889 HD3 ARG 120 HD3 ARG 120 -12.234 11.605 -14.192 890 HE ARG 120 HE ARG 120 -10.407 12.125 -15.718 891 HH11 ARG 120 HH11 ARG 120 -10.011 9.235 -13.854 892 HH12 ARG 120 HH12 ARG 120 -8.928 8.531 -15.004 893 HH21 ARG 120 HH21 ARG 120 -9.029 11.200 -17.148 894 HH22 ARG 120 HH22 ARG 120 -8.377 9.626 -16.834 895 H THR 121 H THR 121 -7.559 11.652 -10.565 896 HA THR 121 HA THR 121 -4.842 12.422 -11.371 897 HB THR 121 HB THR 121 -5.597 12.021 -8.433 898 HG1 THR 121 HG1 THR 121 -5.863 14.162 -9.377 899 HG21 THR 121 HG21 THR 121 -2.817 12.324 -9.647 900 HG22 THR 121 HG22 THR 121 -3.452 10.879 -8.855 901 HG23 THR 121 HG23 THR 121 -3.186 12.348 -7.918 902 H ARG 122 H ARG 122 -3.465 10.627 -11.593 903 HA ARG 122 HA ARG 122 -4.801 7.989 -11.486 904 HB2 ARG 122 HB2 ARG 122 -4.080 8.836 -13.710 905 HB3 ARG 122 HB3 ARG 122 -2.416 8.924 -13.142 906 HG2 ARG 122 HG2 ARG 122 -2.281 6.526 -12.931 907 HG3 ARG 122 HG3 ARG 122 -4.010 6.343 -13.255 908 HD2 ARG 122 HD2 ARG 122 -1.952 7.422 -15.218 909 HD3 ARG 122 HD3 ARG 122 -2.611 5.787 -15.222 910 HE ARG 122 HE ARG 122 -4.809 7.420 -15.375 911 HH11 ARG 122 HH11 ARG 122 -1.966 7.107 -17.323 912 HH12 ARG 122 HH12 ARG 122 -2.810 7.498 -18.776 913 HH21 ARG 122 HH21 ARG 122 -5.850 7.904 -17.227 914 HH22 ARG 122 HH22 ARG 122 -4.981 7.947 -18.722 915 H MET 123 H MET 123 -4.202 6.699 -9.879 916 HA MET 123 HA MET 123 -1.635 7.063 -8.459 917 HB2 MET 123 HB2 MET 123 -3.847 7.411 -7.227 918 HB3 MET 123 HB3 MET 123 -4.180 5.703 -7.456 919 HG2 MET 123 HG2 MET 123 -1.774 6.769 -5.956 920 HG3 MET 123 HG3 MET 123 -3.293 6.317 -5.191 921 HE1 MET 123 HE1 MET 123 -4.187 3.814 -5.046 922 HE2 MET 123 HE2 MET 123 -3.365 2.441 -5.783 923 HE3 MET 123 HE3 MET 123 -4.124 3.665 -6.803 924 H THR 124 H THR 124 -0.125 5.513 -8.971 925 HA THR 124 HA THR 124 -1.016 2.716 -9.462 926 HB THR 124 HB THR 124 1.278 4.147 -10.876 927 HG1 THR 124 HG1 THR 124 -0.909 4.666 -11.604 928 HG21 THR 124 HG21 THR 124 1.456 2.076 -12.248 929 HG22 THR 124 HG22 THR 124 0.240 1.301 -11.233 930 HG23 THR 124 HG23 THR 124 1.805 1.751 -10.548 931 H ILE 125 H ILE 125 -0.241 1.335 -7.951 932 HA ILE 125 HA ILE 125 2.290 1.967 -6.527 933 HB ILE 125 HB ILE 125 0.207 -0.053 -5.600 934 HG12 ILE 125 HG12 ILE 125 0.423 2.857 -4.698 935 HG13 ILE 125 HG13 ILE 125 -0.843 2.226 -5.746 936 HG21 ILE 125 HG21 ILE 125 2.469 -0.318 -4.646 937 HG22 ILE 125 HG22 ILE 125 1.341 0.220 -3.403 938 HG23 ILE 125 HG23 ILE 125 2.469 1.370 -4.125 939 HD11 ILE 125 HD11 ILE 125 -1.554 0.728 -3.890 940 HD12 ILE 125 HD12 ILE 125 -1.695 2.447 -3.529 941 HD13 ILE 125 HD13 ILE 125 -0.356 1.515 -2.856 942 H ILE 126 H ILE 126 4.027 0.788 -7.231 943 HA ILE 126 HA ILE 126 3.603 -1.927 -8.350 944 HB ILE 126 HB ILE 126 6.185 -0.290 -8.604 945 HG12 ILE 126 HG12 ILE 126 5.373 0.038 -11.084 946 HG13 ILE 126 HG13 ILE 126 3.763 -0.269 -10.453 947 HG21 ILE 126 HG21 ILE 126 6.700 -1.854 -10.445 948 HG22 ILE 126 HG22 ILE 126 5.179 -2.704 -10.156 949 HG23 ILE 126 HG23 ILE 126 6.444 -2.708 -8.922 950 HD11 ILE 126 HD11 ILE 126 4.210 2.091 -10.695 951 HD12 ILE 126 HD12 ILE 126 5.604 1.967 -9.623 952 HD13 ILE 126 HD13 ILE 126 3.980 1.682 -8.994 953 H SER 127 H SER 127 3.922 -3.477 -6.862 954 HA SER 127 HA SER 127 5.684 -3.090 -4.540 955 HB2 SER 127 HB2 SER 127 3.303 -3.818 -4.189 956 HB3 SER 127 HB3 SER 127 3.639 -5.295 -5.092 957 HG SER 127 HG SER 127 4.550 -6.095 -3.381 958 H THR 128 H THR 128 7.751 -3.689 -4.986 959 HA THR 128 HA THR 128 8.374 -5.930 -6.767 960 HB THR 128 HB THR 128 10.726 -5.008 -6.720 961 HG1 THR 128 HG1 THR 128 10.863 -3.834 -4.873 962 HG21 THR 128 HG21 THR 128 10.260 -3.033 -8.136 963 HG22 THR 128 HG22 THR 128 8.582 -3.025 -7.591 964 HG23 THR 128 HG23 THR 128 9.191 -4.373 -8.555 965 H PHE 129 H PHE 129 8.725 -7.824 -5.866 966 HA PHE 129 HA PHE 129 9.343 -8.166 -3.037 967 HB2 PHE 129 HB2 PHE 129 8.688 -10.258 -5.168 968 HB3 PHE 129 HB3 PHE 129 8.712 -10.517 -3.423 969 HD1 PHE 129 HD1 PHE 129 6.887 -9.628 -1.996 970 HD2 PHE 129 HD2 PHE 129 6.797 -9.072 -6.239 971 HE1 PHE 129 HE1 PHE 129 4.524 -8.955 -1.866 972 HE2 PHE 129 HE2 PHE 129 4.434 -8.408 -6.091 973 HZ PHE 129 HZ PHE 129 3.298 -8.336 -3.912 974 H GLU 130 H GLU 130 10.972 -9.767 -2.356 975 HA GLU 130 HA GLU 130 13.532 -9.285 -3.593 976 HB2 GLU 130 HB2 GLU 130 12.832 -11.056 -1.215 977 HB3 GLU 130 HB3 GLU 130 14.448 -10.499 -1.650 978 HG2 GLU 130 HG2 GLU 130 13.749 -8.170 -1.223 979 HG3 GLU 130 HG3 GLU 130 12.137 -8.736 -0.792 980 H SER 131 H SER 131 11.394 -12.129 -3.288 981 HA SER 131 HA SER 131 12.977 -13.637 -5.255 982 HB2 SER 131 HB2 SER 131 13.959 -14.300 -3.077 983 HB3 SER 131 HB3 SER 131 12.363 -14.737 -2.472 984 HG SER 131 HG SER 131 13.638 -16.528 -3.266 985 H GLU 132 H GLU 132 11.863 -15.459 -6.165 986 HA GLU 132 HA GLU 132 9.090 -15.069 -6.613 987 HB2 GLU 132 HB2 GLU 132 10.627 -16.072 -8.314 988 HB3 GLU 132 HB3 GLU 132 10.763 -17.519 -7.315 989 HG2 GLU 132 HG2 GLU 132 8.328 -17.924 -7.577 990 HG3 GLU 132 HG3 GLU 132 8.205 -16.480 -8.580 991 H GLU 133 H GLU 133 10.847 -17.326 -4.488 992 HA GLU 133 HA GLU 133 8.704 -18.939 -3.617 993 HB2 GLU 133 HB2 GLU 133 10.083 -19.481 -1.663 994 HB3 GLU 133 HB3 GLU 133 11.102 -19.400 -3.092 995 HG2 GLU 133 HG2 GLU 133 11.806 -17.095 -2.420 996 HG3 GLU 133 HG3 GLU 133 10.850 -17.263 -0.953 997 H GLN 134 H GLN 134 9.676 -15.695 -2.687 998 HA GLN 134 HA GLN 134 7.884 -15.409 -0.439 999 HB2 GLN 134 HB2 GLN 134 9.952 -14.112 -0.481 1000 HB3 GLN 134 HB3 GLN 134 9.537 -13.411 -2.041 1001 HG2 GLN 134 HG2 GLN 134 7.581 -12.268 -0.932 1002 HG3 GLN 134 HG3 GLN 134 8.177 -12.869 0.618 1003 HE21 GLN 134 HE21 GLN 134 8.415 -10.692 1.308 1004 HE22 GLN 134 HE22 GLN 134 9.740 -9.727 0.781 1005 H MET 135 H MET 135 7.980 -14.364 -3.818 1006 HA MET 135 HA MET 135 5.664 -12.775 -3.928 1007 HB2 MET 135 HB2 MET 135 7.379 -12.668 -5.625 1008 HB3 MET 135 HB3 MET 135 7.163 -14.357 -6.045 1009 HG2 MET 135 HG2 MET 135 6.243 -12.782 -7.705 1010 HG3 MET 135 HG3 MET 135 5.047 -13.911 -7.069 1011 HE1 MET 135 HE1 MET 135 3.073 -10.478 -7.738 1012 HE2 MET 135 HE2 MET 135 3.244 -12.152 -8.264 1013 HE3 MET 135 HE3 MET 135 4.503 -10.973 -8.640 1014 H GLN 136 H GLN 136 6.056 -16.268 -4.605 1015 HA GLN 136 HA GLN 136 3.347 -16.943 -5.105 1016 HB2 GLN 136 HB2 GLN 136 5.602 -18.585 -3.873 1017 HB3 GLN 136 HB3 GLN 136 4.039 -19.264 -4.322 1018 HG2 GLN 136 HG2 GLN 136 5.961 -17.948 -6.264 1019 HG3 GLN 136 HG3 GLN 136 5.865 -19.684 -5.977 1020 HE21 GLN 136 HE21 GLN 136 5.455 -18.295 -8.473 1021 HE22 GLN 136 HE22 GLN 136 3.841 -18.635 -8.981 1022 H LYS 137 H LYS 137 5.255 -17.012 -2.090 1023 HA LYS 137 HA LYS 137 3.373 -17.901 -0.226 1024 HB2 LYS 137 HB2 LYS 137 5.793 -17.717 0.202 1025 HB3 LYS 137 HB3 LYS 137 5.696 -15.966 0.131 1026 HG2 LYS 137 HG2 LYS 137 5.896 -16.612 2.423 1027 HG3 LYS 137 HG3 LYS 137 4.259 -15.998 2.177 1028 HD2 LYS 137 HD2 LYS 137 3.381 -18.302 2.112 1029 HD3 LYS 137 HD3 LYS 137 5.018 -18.954 2.267 1030 HE2 LYS 137 HE2 LYS 137 5.209 -17.824 4.493 1031 HE3 LYS 137 HE3 LYS 137 3.537 -17.288 4.336 1032 HZ1 LYS 137 HZ1 LYS 137 2.800 -19.537 4.385 1033 HZ2 LYS 137 HZ2 LYS 137 3.850 -19.297 5.697 1034 HZ3 LYS 137 HZ3 LYS 137 4.382 -20.125 4.326 1035 H MET 138 H MET 138 3.945 -14.613 -1.397 1036 HA MET 138 HA MET 138 2.238 -13.153 0.332 1037 HB2 MET 138 HB2 MET 138 3.136 -12.585 -2.519 1038 HB3 MET 138 HB3 MET 138 2.304 -11.417 -1.503 1039 HG2 MET 138 HG2 MET 138 4.936 -12.615 -0.658 1040 HG3 MET 138 HG3 MET 138 4.859 -11.244 -1.750 1041 HE1 MET 138 HE1 MET 138 4.008 -11.187 2.756 1042 HE2 MET 138 HE2 MET 138 4.946 -12.393 1.879 1043 HE3 MET 138 HE3 MET 138 3.187 -12.363 1.727 1044 H ALA 139 H ALA 139 1.739 -14.522 -2.911 1045 HA ALA 139 HA ALA 139 -0.954 -13.793 -3.273 1046 HB1 ALA 139 HB1 ALA 139 0.559 -16.140 -4.467 1047 HB2 ALA 139 HB2 ALA 139 0.534 -14.490 -5.098 1048 HB3 ALA 139 HB3 ALA 139 -0.945 -15.450 -5.092 1049 H GLU 140 H GLU 140 0.484 -16.628 -1.709 1050 HA GLU 140 HA GLU 140 -1.898 -18.109 -1.206 1051 HB2 GLU 140 HB2 GLU 140 0.680 -18.080 0.425 1052 HB3 GLU 140 HB3 GLU 140 -0.562 -19.330 0.471 1053 HG2 GLU 140 HG2 GLU 140 1.252 -18.669 -1.870 1054 HG3 GLU 140 HG3 GLU 140 1.399 -20.061 -0.808 1055 H MET 141 H MET 141 -0.317 -15.447 0.492 1056 HA MET 141 HA MET 141 -2.073 -15.446 2.805 1057 HB2 MET 141 HB2 MET 141 -0.008 -13.454 1.781 1058 HB3 MET 141 HB3 MET 141 -0.907 -13.231 3.279 1059 HG2 MET 141 HG2 MET 141 0.958 -15.545 2.693 1060 HG3 MET 141 HG3 MET 141 1.357 -14.125 3.662 1061 HE1 MET 141 HE1 MET 141 0.147 -13.555 6.027 1062 HE2 MET 141 HE2 MET 141 -1.103 -14.580 6.732 1063 HE3 MET 141 HE3 MET 141 -1.439 -13.671 5.261 1064 H GLY 142 H GLY 142 -2.640 -14.541 -0.375 1065 HA2 GLY 142 HA2 GLY 142 -4.367 -13.398 -1.380 1066 HA3 GLY 142 HA3 GLY 142 -5.025 -13.054 0.215 1067 H MET 143 H MET 143 -1.815 -12.188 -1.009 1068 HA MET 143 HA MET 143 -1.868 -9.501 -0.163 1069 HB2 MET 143 HB2 MET 143 0.251 -10.635 -0.544 1070 HB3 MET 143 HB3 MET 143 -0.122 -10.876 -2.243 1071 HG2 MET 143 HG2 MET 143 1.526 -9.101 -1.964 1072 HG3 MET 143 HG3 MET 143 0.033 -8.447 -2.629 1073 HE1 MET 143 HE1 MET 143 1.513 -7.766 1.701 1074 HE2 MET 143 HE2 MET 143 2.461 -8.563 0.445 1075 HE3 MET 143 HE3 MET 143 1.045 -9.366 1.127 1076 H GLU 144 H GLU 144 -2.384 -10.888 -3.432 1077 HA GLU 144 HA GLU 144 -2.434 -8.400 -4.760 1078 HB2 GLU 144 HB2 GLU 144 -3.162 -9.551 -6.770 1079 HB3 GLU 144 HB3 GLU 144 -1.919 -10.497 -5.969 1080 HG2 GLU 144 HG2 GLU 144 -4.893 -11.099 -5.813 1081 HG3 GLU 144 HG3 GLU 144 -3.790 -11.832 -6.977 1082 H GLU 145 H GLU 145 -5.135 -10.449 -3.624 1083 HA GLU 145 HA GLU 145 -7.182 -8.686 -4.640 1084 HB2 GLU 145 HB2 GLU 145 -7.418 -10.942 -2.608 1085 HB3 GLU 145 HB3 GLU 145 -8.763 -10.127 -3.403 1086 HG2 GLU 145 HG2 GLU 145 -7.818 -10.950 -5.609 1087 HG3 GLU 145 HG3 GLU 145 -6.694 -11.938 -4.671 1088 H GLY 146 H GLY 146 -5.939 -9.403 -1.340 1089 HA2 GLY 146 HA2 GLY 146 -7.606 -7.720 0.151 1090 HA3 GLY 146 HA3 GLY 146 -5.992 -8.211 0.627 1091 H MET 147 H MET 147 -4.552 -6.947 -1.470 1092 HA MET 147 HA MET 147 -4.316 -4.242 -0.555 1093 HB2 MET 147 HB2 MET 147 -2.380 -5.543 -1.356 1094 HB3 MET 147 HB3 MET 147 -3.086 -5.633 -2.962 1095 HG2 MET 147 HG2 MET 147 -2.891 -3.176 -3.159 1096 HG3 MET 147 HG3 MET 147 -2.118 -3.131 -1.572 1097 HE1 MET 147 HE1 MET 147 -0.935 -1.974 -4.383 1098 HE2 MET 147 HE2 MET 147 0.765 -2.401 -4.189 1099 HE3 MET 147 HE3 MET 147 -0.145 -1.757 -2.821 1100 H ARG 148 H ARG 148 -5.654 -5.722 -3.525 1101 HA ARG 148 HA ARG 148 -6.294 -3.359 -4.937 1102 HB2 ARG 148 HB2 ARG 148 -6.319 -5.514 -6.078 1103 HB3 ARG 148 HB3 ARG 148 -7.603 -6.107 -5.023 1104 HG2 ARG 148 HG2 ARG 148 -9.093 -4.282 -5.969 1105 HG3 ARG 148 HG3 ARG 148 -7.818 -3.938 -7.139 1106 HD2 ARG 148 HD2 ARG 148 -8.071 -6.090 -8.163 1107 HD3 ARG 148 HD3 ARG 148 -9.098 -6.668 -6.844 1108 HE ARG 148 HE ARG 148 -10.640 -4.758 -7.635 1109 HH11 ARG 148 HH11 ARG 148 -8.834 -6.798 -9.769 1110 HH12 ARG 148 HH12 ARG 148 -9.927 -6.542 -11.082 1111 HH21 ARG 148 HH21 ARG 148 -11.997 -4.464 -9.281 1112 HH22 ARG 148 HH22 ARG 148 -11.718 -5.237 -10.801 1113 H GLU 149 H GLU 149 -8.281 -5.324 -2.716 1114 HA GLU 149 HA GLU 149 -10.715 -3.919 -2.802 1115 HB2 GLU 149 HB2 GLU 149 -9.457 -5.550 -0.557 1116 HB3 GLU 149 HB3 GLU 149 -11.138 -5.009 -0.561 1117 HG2 GLU 149 HG2 GLU 149 -11.654 -6.372 -2.476 1118 HG3 GLU 149 HG3 GLU 149 -9.951 -6.782 -2.713 1119 H ALA 150 H ALA 150 -7.843 -3.448 -0.777 1120 HA ALA 150 HA ALA 150 -8.642 -1.308 0.856 1121 HB1 ALA 150 HB1 ALA 150 -5.893 -1.802 -0.364 1122 HB2 ALA 150 HB2 ALA 150 -6.504 -2.538 1.122 1123 HB3 ALA 150 HB3 ALA 150 -6.239 -0.795 1.048 1124 H ILE 151 H ILE 151 -7.150 -1.244 -2.382 1125 HA ILE 151 HA ILE 151 -7.106 1.595 -2.678 1126 HB ILE 151 HB ILE 151 -6.786 -0.627 -4.734 1127 HG12 ILE 151 HG12 ILE 151 -4.685 1.045 -3.266 1128 HG13 ILE 151 HG13 ILE 151 -5.100 -0.619 -2.873 1129 HG21 ILE 151 HG21 ILE 151 -6.115 2.321 -5.040 1130 HG22 ILE 151 HG22 ILE 151 -7.394 1.452 -5.889 1131 HG23 ILE 151 HG23 ILE 151 -5.706 1.051 -6.197 1132 HD11 ILE 151 HD11 ILE 151 -3.815 0.359 -5.418 1133 HD12 ILE 151 HD12 ILE 151 -4.275 -1.313 -5.090 1134 HD13 ILE 151 HD13 ILE 151 -3.041 -0.527 -4.107 1135 H GLU 152 H GLU 152 -9.526 -0.822 -3.403 1136 HA GLU 152 HA GLU 152 -11.257 0.986 -4.901 1137 HB2 GLU 152 HB2 GLU 152 -11.741 -1.814 -3.797 1138 HB3 GLU 152 HB3 GLU 152 -12.880 -0.925 -4.814 1139 HG2 GLU 152 HG2 GLU 152 -11.243 -0.882 -6.637 1140 HG3 GLU 152 HG3 GLU 152 -10.070 -1.724 -5.630 1141 H GLN 153 H GLN 153 -10.612 0.368 -1.588 1142 HA GLN 153 HA GLN 153 -13.162 1.452 -0.618 1143 HB2 GLN 153 HB2 GLN 153 -11.987 -0.516 0.478 1144 HB3 GLN 153 HB3 GLN 153 -10.741 0.602 1.020 1145 HG2 GLN 153 HG2 GLN 153 -12.294 1.776 2.439 1146 HG3 GLN 153 HG3 GLN 153 -13.676 0.942 1.728 1147 HE21 GLN 153 HE21 GLN 153 -11.029 0.663 3.965 1148 HE22 GLN 153 HE22 GLN 153 -11.521 -0.822 4.682 1149 H ILE 154 H ILE 154 -9.994 2.607 -1.460 1150 HA ILE 154 HA ILE 154 -9.775 5.057 -0.119 1151 HB ILE 154 HB ILE 154 -9.192 4.478 -3.058 1152 HG12 ILE 154 HG12 ILE 154 -7.301 4.525 -0.665 1153 HG13 ILE 154 HG13 ILE 154 -7.918 3.068 -1.434 1154 HG21 ILE 154 HG21 ILE 154 -9.388 6.911 -2.744 1155 HG22 ILE 154 HG22 ILE 154 -7.708 6.468 -3.042 1156 HG23 ILE 154 HG23 ILE 154 -8.241 6.851 -1.403 1157 HD11 ILE 154 HD11 ILE 154 -5.638 3.547 -2.110 1158 HD12 ILE 154 HD12 ILE 154 -6.123 5.127 -2.724 1159 HD13 ILE 154 HD13 ILE 154 -6.726 3.656 -3.494 1160 H ASP 155 H ASP 155 -11.912 4.120 -2.740 1161 HA ASP 155 HA ASP 155 -13.087 6.452 -3.600 1162 HB2 ASP 155 HB2 ASP 155 -13.463 4.113 -4.465 1163 HB3 ASP 155 HB3 ASP 155 -14.469 3.787 -3.060 1164 H ALA 156 H ALA 156 -14.016 4.484 -0.760 1165 HA ALA 156 HA ALA 156 -16.126 6.124 0.209 1166 HB1 ALA 156 HB1 ALA 156 -15.848 3.762 0.864 1167 HB2 ALA 156 HB2 ALA 156 -15.934 4.806 2.282 1168 HB3 ALA 156 HB3 ALA 156 -14.373 4.168 1.745 1169 H VAL 157 H VAL 157 -12.630 6.133 0.830 1170 HA VAL 157 HA VAL 157 -12.613 7.831 3.137 1171 HB VAL 157 HB VAL 157 -10.365 7.282 1.143 1172 HG11 VAL 157 HG11 VAL 157 -10.183 8.338 3.998 1173 HG12 VAL 157 HG12 VAL 157 -9.828 9.250 2.528 1174 HG13 VAL 157 HG13 VAL 157 -8.809 7.885 2.985 1175 HG21 VAL 157 HG21 VAL 157 -11.041 5.837 3.733 1176 HG22 VAL 157 HG22 VAL 157 -9.630 5.528 2.721 1177 HG23 VAL 157 HG23 VAL 157 -11.246 5.194 2.099 1178 H LEU 158 H LEU 158 -12.238 8.486 -0.330 1179 HA LEU 158 HA LEU 158 -11.875 11.344 -0.008 1180 HB2 LEU 158 HB2 LEU 158 -12.430 9.734 -2.529 1181 HB3 LEU 158 HB3 LEU 158 -11.888 11.408 -2.472 1182 HG LEU 158 HG LEU 158 -10.282 8.963 -1.611 1183 HD11 LEU 158 HD11 LEU 158 -10.454 9.176 -4.035 1184 HD12 LEU 158 HD12 LEU 158 -8.813 9.506 -3.493 1185 HD13 LEU 158 HD13 LEU 158 -9.871 10.842 -3.957 1186 HD21 LEU 158 HD21 LEU 158 -9.740 10.832 -0.136 1187 HD22 LEU 158 HD22 LEU 158 -9.463 11.888 -1.521 1188 HD23 LEU 158 HD23 LEU 158 -8.393 10.515 -1.230 1189 H SER 159 H SER 159 -14.634 9.245 -0.232 1190 HA SER 159 HA SER 159 -16.410 11.379 -1.275 1191 HB2 SER 159 HB2 SER 159 -16.438 9.185 -2.450 1192 HB3 SER 159 HB3 SER 159 -16.978 8.398 -0.971 1193 HG SER 159 HG SER 159 -18.512 9.306 -2.787 1194 H GLU 160 H GLU 160 -15.638 9.868 1.746 1195 HA GLU 160 HA GLU 160 -18.138 10.077 3.073 1196 HB2 GLU 160 HB2 GLU 160 -16.773 9.992 5.202 1197 HB3 GLU 160 HB3 GLU 160 -16.467 8.693 4.077 1198 HG2 GLU 160 HG2 GLU 160 -14.331 9.202 4.834 1199 HG3 GLU 160 HG3 GLU 160 -14.414 10.090 3.320 1200 HA PRO 161 HA PRO 161 -18.848 14.322 3.597 1201 HB2 PRO 161 HB2 PRO 161 -20.151 14.612 5.945 1202 HB3 PRO 161 HB3 PRO 161 -20.815 13.635 4.626 1203 HG2 PRO 161 HG2 PRO 161 -19.241 12.716 7.051 1204 HG3 PRO 161 HG3 PRO 161 -20.783 12.080 6.425 1205 HD2 PRO 161 HD2 PRO 161 -18.402 10.906 5.848 1206 HD3 PRO 161 HD3 PRO 161 -19.740 10.916 4.680 1207 H ALA 162 H ALA 162 -16.080 13.542 4.879 1208 HA ALA 162 HA ALA 162 -14.280 14.710 5.556 1209 HB1 ALA 162 HB1 ALA 162 -14.265 17.148 5.684 1210 HB2 ALA 162 HB2 ALA 162 -16.031 17.178 5.678 1211 HB3 ALA 162 HB3 ALA 162 -15.156 16.607 4.259 1212 H ASN 163 H ASN 163 -16.927 16.120 7.504 1213 HA ASN 163 HA ASN 163 -15.676 16.232 9.992 1214 HB2 ASN 163 HB2 ASN 163 -17.776 17.406 9.433 1215 HB3 ASN 163 HB3 ASN 163 -18.634 15.880 9.326 1216 HD21 ASN 163 HD21 ASN 163 -19.094 14.747 11.271 1217 HD22 ASN 163 HD22 ASN 163 -19.079 15.545 12.799 1218 H ALA 164 H ALA 164 -16.908 13.444 8.321 1219 HA ALA 164 HA ALA 164 -17.682 11.697 10.328 1220 HB1 ALA 164 HB1 ALA 164 -16.249 10.975 7.754 1221 HB2 ALA 164 HB2 ALA 164 -17.985 11.233 7.931 1222 HB3 ALA 164 HB3 ALA 164 -17.211 9.877 8.750 1223 H LEU 165 H LEU 165 -14.444 11.486 8.761 1224 HA LEU 165 HA LEU 165 -12.414 10.728 9.466 1225 HB2 LEU 165 HB2 LEU 165 -13.329 11.995 12.074 1226 HB3 LEU 165 HB3 LEU 165 -11.680 11.471 11.767 1227 HG LEU 165 HG LEU 165 -13.141 13.704 10.292 1228 HD11 LEU 165 HD11 LEU 165 -12.558 14.331 12.580 1229 HD12 LEU 165 HD12 LEU 165 -11.568 15.214 11.424 1230 HD13 LEU 165 HD13 LEU 165 -10.879 13.852 12.314 1231 HD21 LEU 165 HD21 LEU 165 -10.981 14.188 9.204 1232 HD22 LEU 165 HD22 LEU 165 -11.567 12.584 8.780 1233 HD23 LEU 165 HD23 LEU 165 -10.267 12.760 9.962 1234 H GLU 166 H GLU 166 -11.496 9.682 11.981 1235 HA GLU 166 HA GLU 166 -13.023 7.142 12.251 1236 HB2 GLU 166 HB2 GLU 166 -10.028 7.651 12.536 1237 HB3 GLU 166 HB3 GLU 166 -10.815 6.104 12.828 1238 HG2 GLU 166 HG2 GLU 166 -10.644 7.571 10.179 1239 HG3 GLU 166 HG3 GLU 166 -9.747 6.121 10.635 1240 H HIS 167 H HIS 167 -13.661 9.456 13.830 1241 HA HIS 167 HA HIS 167 -12.381 9.157 16.437 1242 HB2 HIS 167 HB2 HIS 167 -13.528 11.135 17.119 1243 HB3 HIS 167 HB3 HIS 167 -13.027 11.420 15.463 1244 HD1 HIS 167 HD1 HIS 167 -15.049 11.164 13.633 1245 HD2 HIS 167 HD2 HIS 167 -16.187 11.537 17.611 1246 HE1 HIS 167 HE1 HIS 167 -17.470 11.818 13.583 1247 HE2 HIS 167 HE2 HIS 167 -18.091 12.176 15.987 1248 H HIS 168 H HIS 168 -13.150 8.037 18.142 1249 HA HIS 168 HA HIS 168 -15.912 7.558 18.686 1250 HB2 HIS 168 HB2 HIS 168 -15.878 5.047 18.508 1251 HB3 HIS 168 HB3 HIS 168 -15.780 5.863 16.952 1252 HD1 HIS 168 HD1 HIS 168 -13.710 3.839 19.349 1253 HD2 HIS 168 HD2 HIS 168 -13.465 5.343 15.488 1254 HE1 HIS 168 HE1 HIS 168 -11.705 2.727 18.326 1255 HE2 HIS 168 HE2 HIS 168 -11.712 3.494 15.930 1256 H HIS 169 H HIS 169 -13.330 8.455 19.944 1257 HA HIS 169 HA HIS 169 -13.188 6.647 22.289 1258 HB2 HIS 169 HB2 HIS 169 -11.034 7.231 21.138 1259 HB3 HIS 169 HB3 HIS 169 -11.312 8.929 21.509 1260 HD1 HIS 169 HD1 HIS 169 -10.604 5.626 23.223 1261 HD2 HIS 169 HD2 HIS 169 -10.467 9.701 24.042 1262 HE1 HIS 169 HE1 HIS 169 -9.502 5.824 25.468 1263 HE2 HIS 169 HE2 HIS 169 -9.284 8.298 25.867 1264 H HIS 170 H HIS 170 -13.840 7.325 24.305 1265 HA HIS 170 HA HIS 170 -15.393 9.719 24.641 1266 HB2 HIS 170 HB2 HIS 170 -14.325 7.744 26.709 1267 HB3 HIS 170 HB3 HIS 170 -15.437 9.056 27.083 1268 HD1 HIS 170 HD1 HIS 170 -15.489 5.579 26.444 1269 HD2 HIS 170 HD2 HIS 170 -17.911 8.753 25.303 1270 HE1 HIS 170 HE1 HIS 170 -17.687 4.545 25.815 1271 HE2 HIS 170 HE2 HIS 170 -19.052 6.463 24.933 1272 H HIS 171 H HIS 171 -14.294 11.613 24.390 1273 HA HIS 171 HA HIS 171 -12.255 12.312 26.427 1274 HB2 HIS 171 HB2 HIS 171 -11.203 11.919 24.129 1275 HB3 HIS 171 HB3 HIS 171 -12.146 13.278 23.529 1276 HD1 HIS 171 HD1 HIS 171 -9.605 12.623 26.301 1277 HD2 HIS 171 HD2 HIS 171 -10.759 15.627 23.676 1278 HE1 HIS 171 HE1 HIS 171 -8.000 14.510 26.699 1279 HE2 HIS 171 HE2 HIS 171 -8.809 16.369 25.209 1280 H HIS 172 H HIS 172 -15.068 12.619 26.504 1281 HA HIS 172 HA HIS 172 -15.874 15.297 25.751 1282 HB2 HIS 172 HB2 HIS 172 -17.372 13.199 25.832 1283 HB3 HIS 172 HB3 HIS 172 -17.366 13.361 27.580 1284 HD1 HIS 172 HD1 HIS 172 -19.078 14.501 24.572 1285 HD2 HIS 172 HD2 HIS 172 -18.673 15.846 28.489 1286 HE1 HIS 172 HE1 HIS 172 -20.928 16.161 24.906 1287 HE2 HIS 172 HE2 HIS 172 -20.546 17.096 27.208 Start of MODEL 13 1 H1 THR 1 H1 THR 1 -10.730 4.620 -9.182 2 H2 THR 1 H2 THR 1 -10.658 3.686 -7.777 3 H3 THR 1 H3 THR 1 -12.146 4.290 -8.311 4 HA THR 1 HA THR 1 -11.899 1.932 -8.796 5 HB THR 1 HB THR 1 -11.809 3.544 -11.353 6 HG1 THR 1 HG1 THR 1 -14.082 3.824 -11.001 7 HG21 THR 1 HG21 THR 1 -13.422 1.863 -12.199 8 HG22 THR 1 HG22 THR 1 -13.294 0.977 -10.679 9 HG23 THR 1 HG23 THR 1 -11.886 1.118 -11.739 10 H VAL 2 H VAL 2 -10.536 0.292 -9.225 11 HA VAL 2 HA VAL 2 -7.851 0.733 -10.223 12 HB VAL 2 HB VAL 2 -9.349 -1.822 -9.540 13 HG11 VAL 2 HG11 VAL 2 -7.111 -2.953 -9.567 14 HG12 VAL 2 HG12 VAL 2 -6.384 -1.470 -10.190 15 HG13 VAL 2 HG13 VAL 2 -7.563 -2.351 -11.164 16 HG21 VAL 2 HG21 VAL 2 -8.942 -0.356 -7.594 17 HG22 VAL 2 HG22 VAL 2 -7.219 -0.312 -7.976 18 HG23 VAL 2 HG23 VAL 2 -7.971 -1.831 -7.477 19 H VAL 3 H VAL 3 -7.844 1.350 -12.304 20 HA VAL 3 HA VAL 3 -9.625 0.299 -14.318 21 HB VAL 3 HB VAL 3 -8.294 1.823 -15.878 22 HG11 VAL 3 HG11 VAL 3 -9.465 3.120 -13.374 23 HG12 VAL 3 HG12 VAL 3 -10.384 2.586 -14.784 24 HG13 VAL 3 HG13 VAL 3 -9.233 3.914 -14.937 25 HG21 VAL 3 HG21 VAL 3 -6.917 2.645 -13.282 26 HG22 VAL 3 HG22 VAL 3 -6.743 3.470 -14.841 27 HG23 VAL 3 HG23 VAL 3 -6.143 1.820 -14.641 28 H SER 4 H SER 4 -6.420 -0.559 -13.229 29 HA SER 4 HA SER 4 -6.316 -2.791 -15.095 30 HB2 SER 4 HB2 SER 4 -5.255 -1.015 -16.447 31 HB3 SER 4 HB3 SER 4 -4.123 -0.674 -15.140 32 HG SER 4 HG SER 4 -2.922 -2.194 -15.920 33 H VAL 5 H VAL 5 -4.987 -4.480 -14.399 34 HA VAL 5 HA VAL 5 -3.202 -4.092 -12.058 35 HB VAL 5 HB VAL 5 -4.984 -6.562 -12.475 36 HG11 VAL 5 HG11 VAL 5 -3.004 -5.943 -10.230 37 HG12 VAL 5 HG12 VAL 5 -2.804 -7.181 -11.476 38 HG13 VAL 5 HG13 VAL 5 -4.091 -7.336 -10.277 39 HG21 VAL 5 HG21 VAL 5 -5.145 -4.421 -10.322 40 HG22 VAL 5 HG22 VAL 5 -6.117 -5.896 -10.375 41 HG23 VAL 5 HG23 VAL 5 -6.305 -4.668 -11.631 42 H ASP 6 H ASP 6 -1.243 -4.276 -13.002 43 HA ASP 6 HA ASP 6 -0.690 -6.380 -15.004 44 HB2 ASP 6 HB2 ASP 6 0.915 -3.909 -14.217 45 HB3 ASP 6 HB3 ASP 6 1.357 -5.023 -15.495 46 H LYS 7 H LYS 7 0.311 -8.195 -14.270 47 HA LYS 7 HA LYS 7 2.037 -8.070 -11.843 48 HB2 LYS 7 HB2 LYS 7 -0.053 -9.305 -11.394 49 HB3 LYS 7 HB3 LYS 7 0.239 -10.346 -12.784 50 HG2 LYS 7 HG2 LYS 7 2.289 -11.226 -11.660 51 HG3 LYS 7 HG3 LYS 7 1.923 -10.219 -10.253 52 HD2 LYS 7 HD2 LYS 7 -0.155 -11.456 -9.864 53 HD3 LYS 7 HD3 LYS 7 0.083 -12.387 -11.348 54 HE2 LYS 7 HE2 LYS 7 2.146 -13.378 -10.366 55 HE3 LYS 7 HE3 LYS 7 1.855 -12.480 -8.875 56 HZ1 LYS 7 HZ1 LYS 7 -0.185 -13.682 -8.556 57 HZ2 LYS 7 HZ2 LYS 7 1.082 -14.788 -8.778 58 HZ3 LYS 7 HZ3 LYS 7 -0.003 -14.481 -10.037 59 H ASP 8 H ASP 8 4.113 -8.269 -12.458 60 HA ASP 8 HA ASP 8 4.851 -10.142 -14.645 61 HB2 ASP 8 HB2 ASP 8 5.301 -7.551 -14.879 62 HB3 ASP 8 HB3 ASP 8 6.626 -7.830 -13.759 63 H VAL 9 H VAL 9 5.601 -11.980 -13.744 64 HA VAL 9 HA VAL 9 6.678 -12.036 -11.036 65 HB VAL 9 HB VAL 9 6.306 -14.461 -12.845 66 HG11 VAL 9 HG11 VAL 9 6.211 -14.134 -9.818 67 HG12 VAL 9 HG12 VAL 9 7.528 -14.864 -10.743 68 HG13 VAL 9 HG13 VAL 9 5.946 -15.646 -10.693 69 HG21 VAL 9 HG21 VAL 9 4.005 -14.701 -11.946 70 HG22 VAL 9 HG22 VAL 9 4.178 -13.224 -12.899 71 HG23 VAL 9 HG23 VAL 9 4.160 -13.138 -11.135 72 H GLU 10 H GLU 10 7.924 -12.132 -14.275 73 HA GLU 10 HA GLU 10 10.499 -13.306 -13.736 74 HB2 GLU 10 HB2 GLU 10 9.589 -11.476 -16.003 75 HB3 GLU 10 HB3 GLU 10 11.124 -12.348 -15.963 76 HG2 GLU 10 HG2 GLU 10 9.953 -14.478 -15.988 77 HG3 GLU 10 HG3 GLU 10 8.395 -13.663 -15.936 78 H ALA 11 H ALA 11 9.339 -9.973 -14.069 79 HA ALA 11 HA ALA 11 11.849 -8.760 -13.233 80 HB1 ALA 11 HB1 ALA 11 10.674 -6.634 -13.593 81 HB2 ALA 11 HB2 ALA 11 9.145 -7.500 -13.804 82 HB3 ALA 11 HB3 ALA 11 10.450 -7.715 -14.972 83 H LEU 12 H LEU 12 9.384 -10.231 -11.581 84 HA LEU 12 HA LEU 12 8.606 -10.345 -9.466 85 HB2 LEU 12 HB2 LEU 12 11.164 -8.849 -8.777 86 HB3 LEU 12 HB3 LEU 12 10.168 -9.748 -7.638 87 HG LEU 12 HG LEU 12 11.688 -10.971 -9.982 88 HD11 LEU 12 HD11 LEU 12 13.222 -10.181 -8.249 89 HD12 LEU 12 HD12 LEU 12 13.177 -11.941 -8.291 90 HD13 LEU 12 HD13 LEU 12 12.322 -11.068 -7.013 91 HD21 LEU 12 HD21 LEU 12 11.082 -13.142 -8.983 92 HD22 LEU 12 HD22 LEU 12 9.657 -12.231 -9.471 93 HD23 LEU 12 HD23 LEU 12 10.106 -12.315 -7.766 94 H SER 13 H SER 13 7.693 -8.065 -11.018 95 HA SER 13 HA SER 13 7.204 -6.040 -8.903 96 HB2 SER 13 HB2 SER 13 7.003 -4.373 -10.752 97 HB3 SER 13 HB3 SER 13 8.610 -5.075 -10.633 98 HG SER 13 HG SER 13 8.332 -5.467 -12.685 99 H PHE 14 H PHE 14 5.163 -5.761 -8.328 100 HA PHE 14 HA PHE 14 2.937 -6.660 -10.079 101 HB2 PHE 14 HB2 PHE 14 3.112 -8.105 -8.138 102 HB3 PHE 14 HB3 PHE 14 3.262 -6.732 -7.050 103 HD1 PHE 14 HD1 PHE 14 0.799 -7.878 -9.679 104 HD2 PHE 14 HD2 PHE 14 1.395 -6.402 -5.704 105 HE1 PHE 14 HE1 PHE 14 -1.620 -7.975 -9.267 106 HE2 PHE 14 HE2 PHE 14 -1.026 -6.499 -5.308 107 HZ PHE 14 HZ PHE 14 -2.533 -7.299 -7.075 108 H SER 15 H SER 15 2.187 -4.858 -10.994 109 HA SER 15 HA SER 15 2.064 -2.298 -9.522 110 HB2 SER 15 HB2 SER 15 1.971 -1.288 -11.851 111 HB3 SER 15 HB3 SER 15 3.453 -2.162 -11.495 112 HG SER 15 HG SER 15 1.421 -3.639 -12.647 113 H ILE 16 H ILE 16 0.094 -1.734 -8.788 114 HA ILE 16 HA ILE 16 -2.363 -2.518 -10.248 115 HB ILE 16 HB ILE 16 -2.076 -1.366 -7.428 116 HG12 ILE 16 HG12 ILE 16 -2.731 -4.230 -8.270 117 HG13 ILE 16 HG13 ILE 16 -1.163 -3.699 -7.670 118 HG21 ILE 16 HG21 ILE 16 -4.549 -2.464 -8.836 119 HG22 ILE 16 HG22 ILE 16 -4.246 -0.769 -8.449 120 HG23 ILE 16 HG23 ILE 16 -4.476 -1.941 -7.150 121 HD11 ILE 16 HD11 ILE 16 -3.747 -3.642 -6.113 122 HD12 ILE 16 HD12 ILE 16 -2.157 -3.155 -5.516 123 HD13 ILE 16 HD13 ILE 16 -2.458 -4.833 -5.959 124 H VAL 17 H VAL 17 -3.082 -1.026 -11.630 125 HA VAL 17 HA VAL 17 -2.421 1.827 -11.304 126 HB VAL 17 HB VAL 17 -3.622 0.423 -13.737 127 HG11 VAL 17 HG11 VAL 17 -2.348 3.182 -13.477 128 HG12 VAL 17 HG12 VAL 17 -4.069 2.850 -13.699 129 HG13 VAL 17 HG13 VAL 17 -2.922 2.452 -14.979 130 HG21 VAL 17 HG21 VAL 17 -1.383 -0.507 -13.266 131 HG22 VAL 17 HG22 VAL 17 -0.698 1.120 -13.242 132 HG23 VAL 17 HG23 VAL 17 -1.362 0.467 -14.741 133 H ALA 18 H ALA 18 -3.914 2.904 -10.198 134 HA ALA 18 HA ALA 18 -6.811 2.450 -10.668 135 HB1 ALA 18 HB1 ALA 18 -5.453 3.387 -8.105 136 HB2 ALA 18 HB2 ALA 18 -6.127 1.781 -8.393 137 HB3 ALA 18 HB3 ALA 18 -7.194 3.184 -8.344 138 H GLU 19 H GLU 19 -8.148 4.357 -10.613 139 HA GLU 19 HA GLU 19 -6.864 7.004 -10.756 140 HB2 GLU 19 HB2 GLU 19 -8.885 5.870 -12.744 141 HB3 GLU 19 HB3 GLU 19 -8.530 7.593 -12.612 142 HG2 GLU 19 HG2 GLU 19 -6.163 7.134 -13.192 143 HG3 GLU 19 HG3 GLU 19 -6.548 5.418 -13.356 144 H PHE 20 H PHE 20 -7.927 8.550 -9.665 145 HA PHE 20 HA PHE 20 -10.651 8.070 -8.600 146 HB2 PHE 20 HB2 PHE 20 -8.311 9.230 -7.002 147 HB3 PHE 20 HB3 PHE 20 -9.951 8.986 -6.409 148 HD1 PHE 20 HD1 PHE 20 -10.853 6.552 -6.335 149 HD2 PHE 20 HD2 PHE 20 -6.700 7.502 -6.763 150 HE1 PHE 20 HE1 PHE 20 -10.249 4.281 -5.607 151 HE2 PHE 20 HE2 PHE 20 -6.113 5.234 -6.037 152 HZ PHE 20 HZ PHE 20 -7.881 3.621 -5.462 153 H ASP 21 H ASP 21 -11.961 9.855 -8.582 154 HA ASP 21 HA ASP 21 -11.159 12.101 -10.220 155 HB2 ASP 21 HB2 ASP 21 -13.572 12.800 -9.943 156 HB3 ASP 21 HB3 ASP 21 -13.339 11.211 -10.650 157 H ALA 22 H ALA 22 -9.605 13.135 -9.027 158 HA ALA 22 HA ALA 22 -10.360 15.130 -7.092 159 HB1 ALA 22 HB1 ALA 22 -8.952 14.298 -5.228 160 HB2 ALA 22 HB2 ALA 22 -8.599 12.829 -6.140 161 HB3 ALA 22 HB3 ALA 22 -10.245 13.155 -5.596 162 H ASP 23 H ASP 23 -8.048 16.088 -6.152 163 HA ASP 23 HA ASP 23 -6.191 16.297 -8.442 164 HB2 ASP 23 HB2 ASP 23 -5.113 18.146 -7.196 165 HB3 ASP 23 HB3 ASP 23 -6.825 18.436 -7.415 166 H VAL 24 H VAL 24 -3.798 16.508 -7.647 167 HA VAL 24 HA VAL 24 -2.980 13.884 -7.056 168 HB VAL 24 HB VAL 24 -1.333 16.443 -7.144 169 HG11 VAL 24 HG11 VAL 24 0.618 14.977 -7.634 170 HG12 VAL 24 HG12 VAL 24 -0.391 13.552 -7.388 171 HG13 VAL 24 HG13 VAL 24 -0.055 14.635 -6.035 172 HG21 VAL 24 HG21 VAL 24 -2.580 16.035 -9.226 173 HG22 VAL 24 HG22 VAL 24 -1.904 14.404 -9.328 174 HG23 VAL 24 HG23 VAL 24 -0.847 15.811 -9.479 175 H LYS 25 H LYS 25 -2.842 16.843 -5.051 176 HA LYS 25 HA LYS 25 -1.619 15.611 -2.786 177 HB2 LYS 25 HB2 LYS 25 -3.059 18.244 -3.172 178 HB3 LYS 25 HB3 LYS 25 -2.570 17.727 -1.564 179 HG2 LYS 25 HG2 LYS 25 -0.320 17.507 -3.419 180 HG3 LYS 25 HG3 LYS 25 -1.005 19.126 -3.472 181 HD2 LYS 25 HD2 LYS 25 0.817 19.006 -1.822 182 HD3 LYS 25 HD3 LYS 25 -0.717 19.351 -1.027 183 HE2 LYS 25 HE2 LYS 25 -0.879 16.931 -0.391 184 HE3 LYS 25 HE3 LYS 25 0.714 16.666 -1.104 185 HZ1 LYS 25 HZ1 LYS 25 0.126 18.510 1.149 186 HZ2 LYS 25 HZ2 LYS 25 1.649 18.194 0.496 187 HZ3 LYS 25 HZ3 LYS 25 0.807 16.968 1.299 188 H ARG 26 H ARG 26 -4.953 15.844 -3.829 189 HA ARG 26 HA ARG 26 -6.217 15.237 -1.331 190 HB2 ARG 26 HB2 ARG 26 -7.379 16.282 -3.294 191 HB3 ARG 26 HB3 ARG 26 -7.259 14.753 -4.154 192 HG2 ARG 26 HG2 ARG 26 -9.498 15.018 -3.253 193 HG3 ARG 26 HG3 ARG 26 -8.692 13.678 -2.432 194 HD2 ARG 26 HD2 ARG 26 -8.241 15.105 -0.495 195 HD3 ARG 26 HD3 ARG 26 -8.949 16.497 -1.325 196 HE ARG 26 HE ARG 26 -10.896 14.512 -1.265 197 HH11 ARG 26 HH11 ARG 26 -9.176 16.397 1.087 198 HH12 ARG 26 HH12 ARG 26 -10.500 16.390 2.200 199 HH21 ARG 26 HH21 ARG 26 -12.559 14.529 0.165 200 HH22 ARG 26 HH22 ARG 26 -12.396 15.347 1.680 201 H VAL 27 H VAL 27 -5.236 13.218 -4.122 202 HA VAL 27 HA VAL 27 -5.916 10.702 -2.871 203 HB VAL 27 HB VAL 27 -4.073 11.159 -5.261 204 HG11 VAL 27 HG11 VAL 27 -3.855 8.887 -4.319 205 HG12 VAL 27 HG12 VAL 27 -4.651 8.826 -5.894 206 HG13 VAL 27 HG13 VAL 27 -5.605 8.664 -4.416 207 HG21 VAL 27 HG21 VAL 27 -7.085 10.703 -5.258 208 HG22 VAL 27 HG22 VAL 27 -6.060 10.746 -6.696 209 HG23 VAL 27 HG23 VAL 27 -6.258 12.198 -5.710 210 H TRP 28 H TRP 28 -2.982 12.684 -3.081 211 HA TRP 28 HA TRP 28 -1.134 10.910 -1.853 212 HB2 TRP 28 HB2 TRP 28 -0.481 12.969 -3.089 213 HB3 TRP 28 HB3 TRP 28 -1.197 13.959 -1.830 214 HD1 TRP 28 HD1 TRP 28 0.366 14.627 0.148 215 HE1 TRP 28 HE1 TRP 28 2.790 14.093 0.799 216 HE3 TRP 28 HE3 TRP 28 1.298 10.858 -3.190 217 HZ2 TRP 28 HZ2 TRP 28 4.834 12.325 0.006 218 HZ3 TRP 28 HZ3 TRP 28 3.521 9.806 -3.182 219 HH2 TRP 28 HH2 TRP 28 5.254 10.525 -1.615 220 H ALA 29 H ALA 29 -3.640 12.972 -0.529 221 HA ALA 29 HA ALA 29 -2.800 13.272 2.126 222 HB1 ALA 29 HB1 ALA 29 -5.143 13.813 2.608 223 HB2 ALA 29 HB2 ALA 29 -5.630 13.122 1.057 224 HB3 ALA 29 HB3 ALA 29 -4.609 14.563 1.101 225 H ILE 30 H ILE 30 -4.350 10.474 0.595 226 HA ILE 30 HA ILE 30 -5.100 9.112 3.026 227 HB ILE 30 HB ILE 30 -5.573 7.169 1.674 228 HG12 ILE 30 HG12 ILE 30 -3.869 8.484 -0.479 229 HG13 ILE 30 HG13 ILE 30 -3.508 7.002 0.382 230 HG21 ILE 30 HG21 ILE 30 -7.061 8.088 -0.061 231 HG22 ILE 30 HG22 ILE 30 -6.235 9.647 0.040 232 HG23 ILE 30 HG23 ILE 30 -7.158 9.043 1.421 233 HD11 ILE 30 HD11 ILE 30 -4.179 6.487 -1.825 234 HD12 ILE 30 HD12 ILE 30 -5.650 7.443 -1.673 235 HD13 ILE 30 HD13 ILE 30 -5.459 5.961 -0.731 236 H TRP 31 H TRP 31 -2.093 9.568 1.426 237 HA TRP 31 HA TRP 31 -0.732 7.335 2.787 238 HB2 TRP 31 HB2 TRP 31 0.301 9.355 0.736 239 HB3 TRP 31 HB3 TRP 31 1.219 7.991 1.374 240 HD1 TRP 31 HD1 TRP 31 -1.102 8.869 -1.436 241 HE1 TRP 31 HE1 TRP 31 -1.762 6.744 -2.730 242 HE3 TRP 31 HE3 TRP 31 0.671 5.337 1.823 243 HZ2 TRP 31 HZ2 TRP 31 -1.546 3.945 -2.421 244 HZ3 TRP 31 HZ3 TRP 31 0.416 2.961 1.246 245 HH2 TRP 31 HH2 TRP 31 -0.674 2.276 -0.831 246 H GLU 32 H GLU 32 -0.678 10.865 2.546 247 HA GLU 32 HA GLU 32 1.590 11.265 4.253 248 HB2 GLU 32 HB2 GLU 32 1.018 12.721 2.313 249 HB3 GLU 32 HB3 GLU 32 -0.442 13.251 3.140 250 HG2 GLU 32 HG2 GLU 32 0.941 14.295 4.897 251 HG3 GLU 32 HG3 GLU 32 2.403 13.743 4.080 252 H ASP 33 H ASP 33 -1.931 11.482 4.655 253 HA ASP 33 HA ASP 33 -1.681 12.308 7.463 254 HB2 ASP 33 HB2 ASP 33 -3.357 13.435 5.972 255 HB3 ASP 33 HB3 ASP 33 -4.202 11.902 5.803 256 HA PRO 34 HA PRO 34 -1.700 7.923 8.639 257 HB2 PRO 34 HB2 PRO 34 -2.269 9.011 11.379 258 HB3 PRO 34 HB3 PRO 34 -0.963 7.950 10.837 259 HG2 PRO 34 HG2 PRO 34 -0.473 10.515 11.408 260 HG3 PRO 34 HG3 PRO 34 0.328 9.734 10.026 261 HD2 PRO 34 HD2 PRO 34 -2.053 11.595 10.032 262 HD3 PRO 34 HD3 PRO 34 -0.639 11.576 8.949 263 H ARG 35 H ARG 35 -4.255 10.154 9.715 264 HA ARG 35 HA ARG 35 -6.140 8.198 10.640 265 HB2 ARG 35 HB2 ARG 35 -6.080 10.594 11.355 266 HB3 ARG 35 HB3 ARG 35 -6.591 11.071 9.742 267 HG2 ARG 35 HG2 ARG 35 -8.733 9.779 10.135 268 HG3 ARG 35 HG3 ARG 35 -8.207 9.545 11.808 269 HD2 ARG 35 HD2 ARG 35 -8.809 12.181 10.413 270 HD3 ARG 35 HD3 ARG 35 -9.710 11.443 11.738 271 HE ARG 35 HE ARG 35 -7.732 11.830 13.157 272 HH11 ARG 35 HH11 ARG 35 -7.990 13.767 10.292 273 HH12 ARG 35 HH12 ARG 35 -6.989 15.022 10.921 274 HH21 ARG 35 HH21 ARG 35 -6.453 13.456 13.934 275 HH22 ARG 35 HH22 ARG 35 -6.135 14.847 12.963 276 H GLN 36 H GLN 36 -5.711 9.956 7.582 277 HA GLN 36 HA GLN 36 -7.967 8.787 6.232 278 HB2 GLN 36 HB2 GLN 36 -5.569 10.362 5.221 279 HB3 GLN 36 HB3 GLN 36 -6.840 9.762 4.153 280 HG2 GLN 36 HG2 GLN 36 -8.514 11.090 5.398 281 HG3 GLN 36 HG3 GLN 36 -7.234 11.694 6.456 282 HE21 GLN 36 HE21 GLN 36 -8.449 11.702 3.175 283 HE22 GLN 36 HE22 GLN 36 -7.660 13.148 2.676 284 H LEU 37 H LEU 37 -4.678 7.770 6.753 285 HA LEU 37 HA LEU 37 -4.555 5.804 4.657 286 HB2 LEU 37 HB2 LEU 37 -2.531 6.770 5.629 287 HB3 LEU 37 HB3 LEU 37 -2.956 6.153 7.216 288 HG LEU 37 HG LEU 37 -2.661 3.806 6.339 289 HD11 LEU 37 HD11 LEU 37 -1.483 3.414 4.223 290 HD12 LEU 37 HD12 LEU 37 -1.562 5.143 3.846 291 HD13 LEU 37 HD13 LEU 37 -3.049 4.193 3.947 292 HD21 LEU 37 HD21 LEU 37 -0.215 3.856 6.328 293 HD22 LEU 37 HD22 LEU 37 -0.876 4.905 7.579 294 HD23 LEU 37 HD23 LEU 37 -0.240 5.607 6.088 295 H GLU 38 H GLU 38 -5.200 5.603 8.184 296 HA GLU 38 HA GLU 38 -5.253 2.769 8.298 297 HB2 GLU 38 HB2 GLU 38 -6.070 3.105 10.619 298 HB3 GLU 38 HB3 GLU 38 -4.660 4.069 10.234 299 HG2 GLU 38 HG2 GLU 38 -5.910 5.586 11.439 300 HG3 GLU 38 HG3 GLU 38 -6.390 5.989 9.798 301 H ARG 39 H ARG 39 -7.732 4.966 7.340 302 HA ARG 39 HA ARG 39 -10.003 3.278 8.003 303 HB2 ARG 39 HB2 ARG 39 -11.371 5.043 7.032 304 HB3 ARG 39 HB3 ARG 39 -10.148 5.743 8.085 305 HG2 ARG 39 HG2 ARG 39 -8.794 6.286 6.024 306 HG3 ARG 39 HG3 ARG 39 -10.167 5.740 5.049 307 HD2 ARG 39 HD2 ARG 39 -10.108 8.067 7.010 308 HD3 ARG 39 HD3 ARG 39 -10.253 8.161 5.253 309 HE ARG 39 HE ARG 39 -12.456 6.879 5.658 310 HH11 ARG 39 HH11 ARG 39 -11.225 9.294 7.828 311 HH12 ARG 39 HH12 ARG 39 -12.796 9.699 8.413 312 HH21 ARG 39 HH21 ARG 39 -14.431 7.411 6.467 313 HH22 ARG 39 HH22 ARG 39 -14.572 8.656 7.657 314 H TRP 40 H TRP 40 -7.784 2.930 5.585 315 HA TRP 40 HA TRP 40 -9.643 1.239 4.052 316 HB2 TRP 40 HB2 TRP 40 -8.827 2.002 1.878 317 HB3 TRP 40 HB3 TRP 40 -9.468 3.375 2.773 318 HD1 TRP 40 HD1 TRP 40 -7.707 5.279 3.514 319 HE1 TRP 40 HE1 TRP 40 -5.312 5.818 2.741 320 HE3 TRP 40 HE3 TRP 40 -6.629 0.916 1.082 321 HZ2 TRP 40 HZ2 TRP 40 -3.251 4.578 1.268 322 HZ3 TRP 40 HZ3 TRP 40 -4.430 0.668 0.008 323 HH2 TRP 40 HH2 TRP 40 -2.781 2.462 0.104 324 H TRP 41 H TRP 41 -6.435 1.890 5.243 325 HA TRP 41 HA TRP 41 -4.774 0.296 3.686 326 HB2 TRP 41 HB2 TRP 41 -4.034 1.936 5.451 327 HB3 TRP 41 HB3 TRP 41 -4.479 0.767 6.692 328 HD1 TRP 41 HD1 TRP 41 -2.432 -0.635 7.521 329 HE1 TRP 41 HE1 TRP 41 -0.156 -1.313 6.530 330 HE3 TRP 41 HE3 TRP 41 -2.936 1.376 2.845 331 HZ2 TRP 41 HZ2 TRP 41 1.227 -1.037 4.089 332 HZ3 TRP 41 HZ3 TRP 41 -1.109 1.110 1.238 333 HH2 TRP 41 HH2 TRP 41 0.939 -0.074 1.844 334 H GLY 42 H GLY 42 -6.596 -0.630 6.580 335 HA2 GLY 42 HA2 GLY 42 -6.199 -3.497 6.028 336 HA3 GLY 42 HA3 GLY 42 -6.914 -2.802 7.474 337 HA PRO 43 HA PRO 43 -10.214 -3.905 3.980 338 HB2 PRO 43 HB2 PRO 43 -10.890 -6.487 4.761 339 HB3 PRO 43 HB3 PRO 43 -9.722 -6.117 3.484 340 HG2 PRO 43 HG2 PRO 43 -9.221 -6.768 6.387 341 HG3 PRO 43 HG3 PRO 43 -8.394 -7.402 4.946 342 HD2 PRO 43 HD2 PRO 43 -7.275 -5.456 6.423 343 HD3 PRO 43 HD3 PRO 43 -7.132 -5.424 4.647 344 HA PRO 44 HA PRO 44 -13.583 -2.707 6.652 345 HB2 PRO 44 HB2 PRO 44 -15.724 -4.377 5.914 346 HB3 PRO 44 HB3 PRO 44 -15.225 -2.919 5.051 347 HG2 PRO 44 HG2 PRO 44 -14.490 -5.795 4.500 348 HG3 PRO 44 HG3 PRO 44 -14.987 -4.534 3.349 349 HD2 PRO 44 HD2 PRO 44 -12.411 -5.156 3.580 350 HD3 PRO 44 HD3 PRO 44 -12.880 -3.443 3.451 351 H THR 45 H THR 45 -12.807 -6.138 6.747 352 HA THR 45 HA THR 45 -14.096 -6.579 9.356 353 HB THR 45 HB THR 45 -13.244 -8.938 9.092 354 HG1 THR 45 HG1 THR 45 -12.575 -9.182 6.659 355 HG21 THR 45 HG21 THR 45 -14.802 -7.911 6.684 356 HG22 THR 45 HG22 THR 45 -15.504 -8.351 8.246 357 HG23 THR 45 HG23 THR 45 -14.736 -9.584 7.244 358 H TRP 46 H TRP 46 -10.879 -5.974 8.055 359 HA TRP 46 HA TRP 46 -9.669 -6.235 10.768 360 HB2 TRP 46 HB2 TRP 46 -8.399 -6.791 8.049 361 HB3 TRP 46 HB3 TRP 46 -7.478 -6.669 9.538 362 HD1 TRP 46 HD1 TRP 46 -10.322 -8.911 8.075 363 HE1 TRP 46 HE1 TRP 46 -10.031 -11.269 9.055 364 HE3 TRP 46 HE3 TRP 46 -6.324 -8.034 11.117 365 HZ2 TRP 46 HZ2 TRP 46 -8.331 -12.594 10.857 366 HZ3 TRP 46 HZ3 TRP 46 -5.410 -9.909 12.429 367 HH2 TRP 46 HH2 TRP 46 -6.389 -12.144 12.299 368 HA PRO 47 HA PRO 47 -9.269 -1.698 9.339 369 HB2 PRO 47 HB2 PRO 47 -9.850 -0.605 11.826 370 HB3 PRO 47 HB3 PRO 47 -11.064 -0.938 10.583 371 HG2 PRO 47 HG2 PRO 47 -10.265 -2.637 12.953 372 HG3 PRO 47 HG3 PRO 47 -11.897 -2.219 12.385 373 HD2 PRO 47 HD2 PRO 47 -10.827 -4.609 11.799 374 HD3 PRO 47 HD3 PRO 47 -11.794 -3.741 10.584 375 H ALA 48 H ALA 48 -7.231 -0.947 9.265 376 HA ALA 48 HA ALA 48 -5.115 -1.966 10.916 377 HB1 ALA 48 HB1 ALA 48 -5.060 0.284 8.876 378 HB2 ALA 48 HB2 ALA 48 -4.775 -1.424 8.537 379 HB3 ALA 48 HB3 ALA 48 -3.649 -0.532 9.563 380 H THR 49 H THR 49 -4.511 -1.195 12.859 381 HA THR 49 HA THR 49 -5.310 1.514 13.755 382 HB THR 49 HB THR 49 -4.544 -0.916 15.453 383 HG1 THR 49 HG1 THR 49 -6.989 0.007 14.434 384 HG21 THR 49 HG21 THR 49 -5.758 1.754 16.275 385 HG22 THR 49 HG22 THR 49 -4.114 1.218 16.632 386 HG23 THR 49 HG23 THR 49 -5.484 0.369 17.346 387 H PHE 50 H PHE 50 -3.639 2.909 13.362 388 HA PHE 50 HA PHE 50 -0.847 2.044 13.540 389 HB2 PHE 50 HB2 PHE 50 -2.187 4.552 12.483 390 HB3 PHE 50 HB3 PHE 50 -0.451 4.521 12.772 391 HD1 PHE 50 HD1 PHE 50 -3.159 2.725 10.899 392 HD2 PHE 50 HD2 PHE 50 1.019 3.630 11.138 393 HE1 PHE 50 HE1 PHE 50 -2.797 1.652 8.718 394 HE2 PHE 50 HE2 PHE 50 1.370 2.548 8.956 395 HZ PHE 50 HZ PHE 50 -0.535 1.561 7.747 396 H GLU 51 H GLU 51 0.165 2.082 15.415 397 HA GLU 51 HA GLU 51 -0.389 3.829 17.631 398 HB2 GLU 51 HB2 GLU 51 2.021 2.049 17.056 399 HB3 GLU 51 HB3 GLU 51 1.664 2.803 18.611 400 HG2 GLU 51 HG2 GLU 51 -0.006 0.687 17.206 401 HG3 GLU 51 HG3 GLU 51 1.037 0.436 18.606 402 H THR 52 H THR 52 1.975 3.787 14.979 403 HA THR 52 HA THR 52 2.403 6.661 15.289 404 HB THR 52 HB THR 52 4.280 5.664 16.608 405 HG1 THR 52 HG1 THR 52 5.937 6.852 15.504 406 HG21 THR 52 HG21 THR 52 4.651 3.564 15.374 407 HG22 THR 52 HG22 THR 52 6.140 4.508 15.477 408 HG23 THR 52 HG23 THR 52 5.216 4.477 13.973 409 H HIS 53 H HIS 53 3.203 7.664 13.385 410 HA HIS 53 HA HIS 53 3.827 6.164 10.987 411 HB2 HIS 53 HB2 HIS 53 1.360 6.116 10.909 412 HB3 HIS 53 HB3 HIS 53 1.286 7.858 11.131 413 HD2 HIS 53 HD2 HIS 53 2.040 5.245 8.318 414 HE1 HIS 53 HE1 HIS 53 1.663 9.093 6.609 415 HE2 HIS 53 HE2 HIS 53 1.652 6.611 6.151 416 H GLU 54 H GLU 54 5.768 7.238 10.988 417 HA GLU 54 HA GLU 54 6.211 9.957 11.671 418 HB2 GLU 54 HB2 GLU 54 7.968 8.006 10.117 419 HB3 GLU 54 HB3 GLU 54 8.521 9.549 10.761 420 HG2 GLU 54 HG2 GLU 54 7.409 7.325 12.497 421 HG3 GLU 54 HG3 GLU 54 9.120 7.476 12.109 422 H PHE 55 H PHE 55 5.919 8.314 8.561 423 HA PHE 55 HA PHE 55 6.084 8.877 6.402 424 HB2 PHE 55 HB2 PHE 55 3.825 9.906 7.165 425 HB3 PHE 55 HB3 PHE 55 4.630 11.466 7.021 426 HD1 PHE 55 HD1 PHE 55 3.751 8.380 5.107 427 HD2 PHE 55 HD2 PHE 55 4.827 12.509 4.848 428 HE1 PHE 55 HE1 PHE 55 3.289 8.350 2.698 429 HE2 PHE 55 HE2 PHE 55 4.350 12.466 2.434 430 HZ PHE 55 HZ PHE 55 3.581 10.387 1.361 431 H THR 56 H THR 56 8.409 9.087 6.785 432 HA THR 56 HA THR 56 9.459 11.557 5.660 433 HB THR 56 HB THR 56 9.577 12.116 8.044 434 HG1 THR 56 HG1 THR 56 11.526 12.912 7.798 435 HG21 THR 56 HG21 THR 56 9.587 9.855 9.024 436 HG22 THR 56 HG22 THR 56 10.938 10.812 9.634 437 HG23 THR 56 HG23 THR 56 11.217 9.584 8.398 438 H VAL 57 H VAL 57 11.823 11.351 5.147 439 HA VAL 57 HA VAL 57 12.375 8.931 3.736 440 HB VAL 57 HB VAL 57 14.272 11.237 4.397 441 HG11 VAL 57 HG11 VAL 57 15.594 10.508 2.436 442 HG12 VAL 57 HG12 VAL 57 14.499 9.145 2.193 443 HG13 VAL 57 HG13 VAL 57 15.499 9.222 3.644 444 HG21 VAL 57 HG21 VAL 57 13.666 12.157 2.173 445 HG22 VAL 57 HG22 VAL 57 12.258 12.049 3.233 446 HG23 VAL 57 HG23 VAL 57 12.492 10.854 1.954 447 H GLY 58 H GLY 58 12.857 7.067 4.798 448 HA2 GLY 58 HA2 GLY 58 14.156 5.574 6.035 449 HA3 GLY 58 HA3 GLY 58 15.044 6.917 6.732 450 H GLY 59 H GLY 59 11.669 7.337 6.964 451 HA2 GLY 59 HA2 GLY 59 11.660 6.742 9.845 452 HA3 GLY 59 HA3 GLY 59 10.443 7.631 8.949 453 H LYS 60 H LYS 60 9.635 5.765 10.787 454 HA LYS 60 HA LYS 60 8.620 3.527 9.131 455 HB2 LYS 60 HB2 LYS 60 9.581 3.422 12.014 456 HB3 LYS 60 HB3 LYS 60 8.580 2.162 11.293 457 HG2 LYS 60 HG2 LYS 60 10.391 1.914 9.512 458 HG3 LYS 60 HG3 LYS 60 11.403 2.955 10.523 459 HD2 LYS 60 HD2 LYS 60 11.290 1.334 12.356 460 HD3 LYS 60 HD3 LYS 60 10.150 0.338 11.449 461 HE2 LYS 60 HE2 LYS 60 12.338 -0.682 11.328 462 HE3 LYS 60 HE3 LYS 60 11.936 -0.049 9.733 463 HZ1 LYS 60 HZ1 LYS 60 14.219 0.439 10.330 464 HZ2 LYS 60 HZ2 LYS 60 13.716 1.256 11.719 465 HZ3 LYS 60 HZ3 LYS 60 13.332 1.874 10.199 466 H ALA 61 H ALA 61 6.756 2.404 10.183 467 HA ALA 61 HA ALA 61 4.918 4.068 11.745 468 HB1 ALA 61 HB1 ALA 61 4.313 4.518 9.391 469 HB2 ALA 61 HB2 ALA 61 3.040 3.610 10.207 470 HB3 ALA 61 HB3 ALA 61 4.134 2.787 9.093 471 H ALA 62 H ALA 62 3.954 2.846 13.285 472 HA ALA 62 HA ALA 62 4.316 -0.107 13.223 473 HB1 ALA 62 HB1 ALA 62 4.005 1.727 15.639 474 HB2 ALA 62 HB2 ALA 62 5.508 0.977 15.091 475 HB3 ALA 62 HB3 ALA 62 4.190 -0.032 15.691 476 H TYR 63 H TYR 63 2.479 -1.288 13.044 477 HA TYR 63 HA TYR 63 -0.086 -0.248 13.989 478 HB2 TYR 63 HB2 TYR 63 -1.217 -0.447 11.824 479 HB3 TYR 63 HB3 TYR 63 0.107 0.696 11.705 480 HD1 TYR 63 HD1 TYR 63 2.293 -0.067 10.569 481 HD2 TYR 63 HD2 TYR 63 -1.325 -2.341 10.329 482 HE1 TYR 63 HE1 TYR 63 3.171 -1.265 8.619 483 HE2 TYR 63 HE2 TYR 63 -0.437 -3.542 8.375 484 HH TYR 63 HH TYR 63 2.830 -3.438 7.470 485 H TYR 64 H TYR 64 -1.865 -1.778 13.592 486 HA TYR 64 HA TYR 64 -1.302 -4.526 12.925 487 HB2 TYR 64 HB2 TYR 64 -2.241 -5.421 15.127 488 HB3 TYR 64 HB3 TYR 64 -0.638 -4.706 15.239 489 HD1 TYR 64 HD1 TYR 64 -4.205 -4.259 16.155 490 HD2 TYR 64 HD2 TYR 64 -0.265 -2.641 16.523 491 HE1 TYR 64 HE1 TYR 64 -4.982 -2.785 17.956 492 HE2 TYR 64 HE2 TYR 64 -1.043 -1.169 18.324 493 HH TYR 64 HH TYR 64 -3.140 -0.160 19.098 494 H MET 65 H MET 65 -3.132 -5.495 12.084 495 HA MET 65 HA MET 65 -5.503 -3.822 11.758 496 HB2 MET 65 HB2 MET 65 -4.802 -6.547 10.589 497 HB3 MET 65 HB3 MET 65 -6.265 -5.644 10.213 498 HG2 MET 65 HG2 MET 65 -4.846 -3.797 9.339 499 HG3 MET 65 HG3 MET 65 -3.425 -4.809 9.590 500 HE1 MET 65 HE1 MET 65 -4.102 -7.727 7.025 501 HE2 MET 65 HE2 MET 65 -4.555 -7.720 8.728 502 HE3 MET 65 HE3 MET 65 -2.984 -7.087 8.229 503 H THR 66 H THR 66 -6.911 -3.826 13.422 504 HA THR 66 HA THR 66 -7.216 -6.005 15.272 505 HB THR 66 HB THR 66 -8.979 -3.527 14.972 506 HG1 THR 66 HG1 THR 66 -7.036 -2.703 15.513 507 HG21 THR 66 HG21 THR 66 -8.614 -5.426 17.331 508 HG22 THR 66 HG22 THR 66 -10.066 -5.284 16.337 509 HG23 THR 66 HG23 THR 66 -9.558 -3.935 17.358 510 H GLY 67 H GLY 67 -7.968 -7.818 14.304 511 HA2 GLY 67 HA2 GLY 67 -9.880 -7.918 12.186 512 HA3 GLY 67 HA3 GLY 67 -9.179 -9.284 13.026 513 HA PRO 68 HA PRO 68 -13.806 -8.667 13.999 514 HB2 PRO 68 HB2 PRO 68 -14.877 -10.785 12.682 515 HB3 PRO 68 HB3 PRO 68 -14.476 -9.278 11.847 516 HG2 PRO 68 HG2 PRO 68 -12.880 -11.844 11.988 517 HG3 PRO 68 HG3 PRO 68 -13.247 -10.838 10.569 518 HD2 PRO 68 HD2 PRO 68 -10.866 -10.689 11.917 519 HD3 PRO 68 HD3 PRO 68 -11.577 -9.299 11.070 520 H ASP 69 H ASP 69 -11.594 -11.325 14.299 521 HA ASP 69 HA ASP 69 -13.044 -12.765 16.363 522 HB2 ASP 69 HB2 ASP 69 -10.121 -13.002 15.513 523 HB3 ASP 69 HB3 ASP 69 -11.037 -14.177 16.458 524 H GLY 70 H GLY 70 -11.198 -9.937 16.289 525 HA2 GLY 70 HA2 GLY 70 -10.354 -8.634 18.054 526 HA3 GLY 70 HA3 GLY 70 -10.381 -10.036 19.113 527 H THR 71 H THR 71 -9.072 -11.290 16.442 528 HA THR 71 HA THR 71 -6.368 -11.351 17.281 529 HB THR 71 HB THR 71 -7.447 -11.990 14.484 530 HG1 THR 71 HG1 THR 71 -7.748 -14.072 15.261 531 HG21 THR 71 HG21 THR 71 -5.492 -13.512 14.327 532 HG22 THR 71 HG22 THR 71 -4.926 -12.959 15.904 533 HG23 THR 71 HG23 THR 71 -4.975 -11.837 14.541 534 H LYS 72 H LYS 72 -4.980 -9.683 17.171 535 HA LYS 72 HA LYS 72 -5.234 -7.545 15.181 536 HB2 LYS 72 HB2 LYS 72 -3.369 -7.905 17.567 537 HB3 LYS 72 HB3 LYS 72 -3.416 -6.468 16.541 538 HG2 LYS 72 HG2 LYS 72 -5.657 -5.932 17.273 539 HG3 LYS 72 HG3 LYS 72 -5.806 -7.470 18.129 540 HD2 LYS 72 HD2 LYS 72 -4.047 -6.784 19.714 541 HD3 LYS 72 HD3 LYS 72 -3.824 -5.262 18.842 542 HE2 LYS 72 HE2 LYS 72 -6.113 -4.572 19.438 543 HE3 LYS 72 HE3 LYS 72 -6.385 -6.119 20.243 544 HZ1 LYS 72 HZ1 LYS 72 -4.537 -5.542 21.757 545 HZ2 LYS 72 HZ2 LYS 72 -5.853 -4.490 21.868 546 HZ3 LYS 72 HZ3 LYS 72 -4.463 -4.010 21.042 547 H ALA 73 H ALA 73 -4.287 -7.891 13.223 548 HA ALA 73 HA ALA 73 -2.025 -9.707 12.876 549 HB1 ALA 73 HB1 ALA 73 -3.762 -9.648 11.137 550 HB2 ALA 73 HB2 ALA 73 -2.203 -9.156 10.474 551 HB3 ALA 73 HB3 ALA 73 -3.431 -7.939 10.836 552 H ARG 74 H ARG 74 -0.203 -8.897 13.738 553 HA ARG 74 HA ARG 74 0.401 -6.115 13.952 554 HB2 ARG 74 HB2 ARG 74 1.081 -8.304 15.411 555 HB3 ARG 74 HB3 ARG 74 2.535 -8.200 14.434 556 HG2 ARG 74 HG2 ARG 74 1.506 -5.842 16.042 557 HG3 ARG 74 HG3 ARG 74 2.530 -7.086 16.762 558 HD2 ARG 74 HD2 ARG 74 4.331 -6.561 15.230 559 HD3 ARG 74 HD3 ARG 74 3.306 -5.410 14.347 560 HE ARG 74 HE ARG 74 3.823 -4.949 17.201 561 HH11 ARG 74 HH11 ARG 74 4.364 -3.931 13.929 562 HH12 ARG 74 HH12 ARG 74 5.169 -2.483 14.411 563 HH21 ARG 74 HH21 ARG 74 4.798 -3.096 17.788 564 HH22 ARG 74 HH22 ARG 74 5.403 -2.005 16.593 565 H GLY 75 H GLY 75 1.671 -4.823 12.627 566 HA2 GLY 75 HA2 GLY 75 3.460 -6.061 10.630 567 HA3 GLY 75 HA3 GLY 75 2.201 -4.964 10.077 568 H TRP 76 H TRP 76 5.060 -4.718 9.754 569 HA TRP 76 HA TRP 76 5.500 -2.089 11.066 570 HB2 TRP 76 HB2 TRP 76 7.927 -2.421 10.760 571 HB3 TRP 76 HB3 TRP 76 7.251 -3.754 11.690 572 HD1 TRP 76 HD1 TRP 76 7.144 -6.179 10.460 573 HE1 TRP 76 HE1 TRP 76 8.461 -7.149 8.486 574 HE3 TRP 76 HE3 TRP 76 9.087 -1.836 8.530 575 HZ2 TRP 76 HZ2 TRP 76 10.106 -6.232 6.400 576 HZ3 TRP 76 HZ3 TRP 76 10.531 -1.984 6.532 577 HH2 TRP 76 HH2 TRP 76 11.031 -4.138 5.492 578 H TRP 77 H TRP 77 6.020 -0.356 9.727 579 HA TRP 77 HA TRP 77 6.172 -0.814 6.792 580 HB2 TRP 77 HB2 TRP 77 3.949 0.195 8.030 581 HB3 TRP 77 HB3 TRP 77 4.854 1.688 7.867 582 HD1 TRP 77 HD1 TRP 77 4.762 -1.055 5.126 583 HE1 TRP 77 HE1 TRP 77 3.580 -0.084 3.064 584 HE3 TRP 77 HE3 TRP 77 3.254 3.423 7.081 585 HZ2 TRP 77 HZ2 TRP 77 2.193 2.270 2.358 586 HZ3 TRP 77 HZ3 TRP 77 1.994 4.969 5.640 587 HH2 TRP 77 HH2 TRP 77 1.474 4.404 3.326 588 H GLN 78 H GLN 78 7.769 0.474 5.722 589 HA GLN 78 HA GLN 78 9.046 2.657 7.231 590 HB2 GLN 78 HB2 GLN 78 10.405 0.662 7.786 591 HB3 GLN 78 HB3 GLN 78 10.692 0.359 6.069 592 HG2 GLN 78 HG2 GLN 78 11.952 2.438 5.864 593 HG3 GLN 78 HG3 GLN 78 11.539 2.903 7.510 594 HE21 GLN 78 HE21 GLN 78 13.718 3.108 8.099 595 HE22 GLN 78 HE22 GLN 78 14.761 1.741 8.295 596 H PHE 79 H PHE 79 9.349 4.358 6.024 597 HA PHE 79 HA PHE 79 8.978 4.323 3.132 598 HB2 PHE 79 HB2 PHE 79 9.563 6.751 4.879 599 HB3 PHE 79 HB3 PHE 79 8.784 6.719 3.302 600 HD1 PHE 79 HD2 PHE 79 6.413 6.015 3.092 601 HD2 PHE 79 HD1 PHE 79 8.330 6.250 6.911 602 HE1 PHE 79 HE2 PHE 79 4.230 5.934 4.208 603 HE2 PHE 79 HE1 PHE 79 6.140 6.161 8.018 604 HZ PHE 79 HZ PHE 79 4.093 6.004 6.667 605 H THR 80 H THR 80 10.610 4.650 1.646 606 HA THR 80 HA THR 80 13.354 5.265 2.604 607 HB THR 80 HB THR 80 14.167 4.261 0.497 608 HG1 THR 80 HG1 THR 80 12.828 4.070 -1.115 609 HG21 THR 80 HG21 THR 80 13.902 2.714 2.395 610 HG22 THR 80 HG22 THR 80 13.498 1.891 0.881 611 HG23 THR 80 HG23 THR 80 12.210 2.437 1.957 612 H THR 81 H THR 81 11.138 5.943 -0.136 613 HA THR 81 HA THR 81 12.532 8.530 -0.635 614 HB THR 81 HB THR 81 11.097 6.790 -2.691 615 HG1 THR 81 HG1 THR 81 13.160 6.345 -3.475 616 HG21 THR 81 HG21 THR 81 10.938 9.186 -3.271 617 HG22 THR 81 HG22 THR 81 12.022 8.340 -4.379 618 HG23 THR 81 HG23 THR 81 12.689 9.351 -3.093 619 H ILE 82 H ILE 82 11.286 10.190 0.071 620 HA ILE 82 HA ILE 82 8.433 10.273 -0.767 621 HB ILE 82 HB ILE 82 9.529 11.505 1.809 622 HG12 ILE 82 HG12 ILE 82 7.859 9.004 1.342 623 HG13 ILE 82 HG13 ILE 82 9.403 9.125 2.171 624 HG21 ILE 82 HG21 ILE 82 7.169 12.078 2.303 625 HG22 ILE 82 HG22 ILE 82 6.676 11.431 0.739 626 HG23 ILE 82 HG23 ILE 82 7.717 12.855 0.816 627 HD11 ILE 82 HD11 ILE 82 8.265 10.360 3.991 628 HD12 ILE 82 HD12 ILE 82 7.653 8.727 3.745 629 HD13 ILE 82 HD13 ILE 82 6.730 10.105 3.155 630 H GLU 83 H GLU 83 8.706 11.489 -2.583 631 HA GLU 83 HA GLU 83 10.292 13.957 -2.548 632 HB2 GLU 83 HB2 GLU 83 8.740 12.637 -4.815 633 HB3 GLU 83 HB3 GLU 83 9.776 14.054 -4.980 634 HG2 GLU 83 HG2 GLU 83 11.711 12.677 -4.222 635 HG3 GLU 83 HG3 GLU 83 10.658 11.264 -4.179 636 H ALA 84 H ALA 84 6.936 12.918 -2.986 637 HA ALA 84 HA ALA 84 4.923 13.877 -2.860 638 HB1 ALA 84 HB1 ALA 84 4.536 15.753 -1.331 639 HB2 ALA 84 HB2 ALA 84 6.263 16.133 -1.325 640 HB3 ALA 84 HB3 ALA 84 5.690 14.621 -0.621 641 HA PRO 85 HA PRO 85 3.044 14.891 -2.970 642 HB2 PRO 85 HB2 PRO 85 0.950 15.791 -4.344 643 HB3 PRO 85 HB3 PRO 85 1.951 16.932 -3.431 644 HG2 PRO 85 HG2 PRO 85 1.922 16.390 -6.398 645 HG3 PRO 85 HG3 PRO 85 2.087 17.939 -5.549 646 HD2 PRO 85 HD2 PRO 85 4.217 16.351 -6.562 647 HD3 PRO 85 HD3 PRO 85 4.376 17.727 -5.447 648 H ASP 86 H ASP 86 4.548 13.664 -5.483 649 HA ASP 86 HA ASP 86 2.349 11.964 -6.529 650 HB2 ASP 86 HB2 ASP 86 3.550 11.898 -8.673 651 HB3 ASP 86 HB3 ASP 86 3.204 13.557 -8.201 652 H HIS 87 H HIS 87 5.897 11.894 -5.913 653 HA HIS 87 HA HIS 87 5.957 8.982 -6.328 654 HB2 HIS 87 HB2 HIS 87 7.612 10.478 -7.470 655 HB3 HIS 87 HB3 HIS 87 8.260 10.941 -5.906 656 HD1 HIS 87 HD1 HIS 87 10.400 9.961 -7.463 657 HD2 HIS 87 HD2 HIS 87 7.856 7.199 -5.675 658 HE1 HIS 87 HE1 HIS 87 11.689 7.813 -7.386 659 HE2 HIS 87 HE2 HIS 87 10.178 6.199 -6.208 660 H LEU 88 H LEU 88 5.865 7.633 -4.710 661 HA LEU 88 HA LEU 88 7.073 8.181 -2.071 662 HB2 LEU 88 HB2 LEU 88 4.630 8.519 -1.902 663 HB3 LEU 88 HB3 LEU 88 4.335 6.947 -2.610 664 HG LEU 88 HG LEU 88 5.309 5.860 -0.604 665 HD11 LEU 88 HD11 LEU 88 6.906 7.566 0.087 666 HD12 LEU 88 HD12 LEU 88 5.827 7.152 1.416 667 HD13 LEU 88 HD13 LEU 88 5.586 8.658 0.524 668 HD21 LEU 88 HD21 LEU 88 2.897 6.249 -0.682 669 HD22 LEU 88 HD22 LEU 88 3.109 7.843 0.053 670 HD23 LEU 88 HD23 LEU 88 3.499 6.386 0.971 671 H GLU 89 H GLU 89 8.195 6.426 -1.267 672 HA GLU 89 HA GLU 89 7.803 3.742 -2.417 673 HB2 GLU 89 HB2 GLU 89 10.487 5.147 -2.075 674 HB3 GLU 89 HB3 GLU 89 10.339 3.401 -2.232 675 HG2 GLU 89 HG2 GLU 89 9.343 3.684 -4.470 676 HG3 GLU 89 HG3 GLU 89 9.490 5.434 -4.316 677 H PHE 90 H PHE 90 7.853 2.167 -0.945 678 HA PHE 90 HA PHE 90 8.981 2.423 1.697 679 HB2 PHE 90 HB2 PHE 90 6.774 1.977 2.876 680 HB3 PHE 90 HB3 PHE 90 6.910 3.588 2.181 681 HD1 PHE 90 HD2 PHE 90 5.434 0.194 1.559 682 HD2 PHE 90 HD1 PHE 90 5.286 4.368 0.650 683 HE1 PHE 90 HE2 PHE 90 3.328 -0.126 0.334 684 HE2 PHE 90 HE1 PHE 90 3.188 4.023 -0.565 685 HZ PHE 90 HZ PHE 90 2.204 1.780 -0.727 686 H ASP 91 H ASP 91 8.267 0.413 3.018 687 HA ASP 91 HA ASP 91 8.158 -1.971 1.261 688 HB2 ASP 91 HB2 ASP 91 9.669 -1.559 3.872 689 HB3 ASP 91 HB3 ASP 91 9.517 -3.112 3.045 690 H ASP 92 H ASP 92 6.192 -2.876 1.425 691 HA ASP 92 HA ASP 92 4.456 -2.700 3.703 692 HB2 ASP 92 HB2 ASP 92 4.284 -4.674 1.385 693 HB3 ASP 92 HB3 ASP 92 2.977 -4.211 2.474 694 H GLY 93 H GLY 93 5.513 -3.500 5.494 695 HA2 GLY 93 HA2 GLY 93 6.576 -6.255 5.455 696 HA3 GLY 93 HA3 GLY 93 6.952 -5.006 6.625 697 H PHE 94 H PHE 94 5.658 -7.854 6.578 698 HA PHE 94 HA PHE 94 3.490 -7.323 8.514 699 HB2 PHE 94 HB2 PHE 94 4.467 -9.937 7.265 700 HB3 PHE 94 HB3 PHE 94 3.141 -9.810 8.420 701 HD1 PHE 94 HD1 PHE 94 4.192 -9.138 4.944 702 HD2 PHE 94 HD2 PHE 94 0.964 -8.920 7.745 703 HE1 PHE 94 HE1 PHE 94 2.613 -8.737 3.103 704 HE2 PHE 94 HE2 PHE 94 -0.608 -8.519 5.896 705 HZ PHE 94 HZ PHE 94 0.214 -8.426 3.575 706 H ALA 95 H ALA 95 3.683 -8.089 10.666 707 HA ALA 95 HA ALA 95 6.402 -8.851 11.553 708 HB1 ALA 95 HB1 ALA 95 6.229 -7.299 13.446 709 HB2 ALA 95 HB2 ALA 95 4.655 -6.741 12.867 710 HB3 ALA 95 HB3 ALA 95 6.107 -6.433 11.910 711 H ASP 96 H ASP 96 6.485 -10.398 12.995 712 HA ASP 96 HA ASP 96 4.543 -11.963 14.133 713 HB2 ASP 96 HB2 ASP 96 6.747 -12.744 14.302 714 HB3 ASP 96 HB3 ASP 96 7.384 -11.187 14.805 715 H GLU 97 H GLU 97 3.784 -12.065 16.389 716 HA GLU 97 HA GLU 97 2.220 -9.866 17.104 717 HB2 GLU 97 HB2 GLU 97 1.619 -11.197 19.110 718 HB3 GLU 97 HB3 GLU 97 1.632 -12.170 17.643 719 HG2 GLU 97 HG2 GLU 97 3.877 -13.052 18.268 720 HG3 GLU 97 HG3 GLU 97 3.810 -12.119 19.763 721 H HIS 98 H HIS 98 5.524 -10.459 18.008 722 HA HIS 98 HA HIS 98 5.436 -8.595 20.290 723 HB2 HIS 98 HB2 HIS 98 7.830 -10.165 19.229 724 HB3 HIS 98 HB3 HIS 98 7.720 -9.332 20.777 725 HD1 HIS 98 HD1 HIS 98 5.716 -10.403 22.406 726 HD2 HIS 98 HD2 HIS 98 7.257 -12.818 19.397 727 HE1 HIS 98 HE1 HIS 98 5.073 -12.752 23.030 728 HE2 HIS 98 HE2 HIS 98 5.961 -14.187 21.163 729 H GLY 99 H GLY 99 6.261 -8.586 16.923 730 HA2 GLY 99 HA2 GLY 99 6.328 -6.261 15.990 731 HA3 GLY 99 HA3 GLY 99 7.575 -5.913 17.172 732 H ALA 100 H ALA 100 8.150 -9.012 16.105 733 HA ALA 100 HA ALA 100 10.555 -8.199 14.727 734 HB1 ALA 100 HB1 ALA 100 10.557 -10.117 16.261 735 HB2 ALA 100 HB2 ALA 100 11.048 -10.619 14.645 736 HB3 ALA 100 HB3 ALA 100 9.417 -10.980 15.221 737 HA PRO 101 HA PRO 101 8.794 -8.252 10.499 738 HB2 PRO 101 HB2 PRO 101 11.208 -8.581 9.123 739 HB3 PRO 101 HB3 PRO 101 10.569 -7.036 9.693 740 HG2 PRO 101 HG2 PRO 101 12.598 -8.844 11.001 741 HG3 PRO 101 HG3 PRO 101 12.634 -7.077 10.818 742 HD2 PRO 101 HD2 PRO 101 11.932 -8.180 13.154 743 HD3 PRO 101 HD3 PRO 101 11.078 -6.737 12.559 744 H VAL 102 H VAL 102 7.828 -9.939 9.461 745 HA VAL 102 HA VAL 102 8.520 -12.675 10.078 746 HB VAL 102 HB VAL 102 6.345 -11.586 8.229 747 HG11 VAL 102 HG11 VAL 102 6.867 -13.933 7.654 748 HG12 VAL 102 HG12 VAL 102 5.282 -13.815 8.422 749 HG13 VAL 102 HG13 VAL 102 6.667 -14.405 9.346 750 HG21 VAL 102 HG21 VAL 102 6.156 -12.551 11.107 751 HG22 VAL 102 HG22 VAL 102 4.800 -12.020 10.104 752 HG23 VAL 102 HG23 VAL 102 6.057 -10.871 10.572 753 H ASP 103 H ASP 103 10.236 -13.553 9.098 754 HA ASP 103 HA ASP 103 11.211 -12.839 6.494 755 HB2 ASP 103 HB2 ASP 103 12.691 -13.558 8.374 756 HB3 ASP 103 HB3 ASP 103 12.008 -15.179 8.282 757 H GLU 104 H GLU 104 9.087 -15.341 7.705 758 HA GLU 104 HA GLU 104 8.921 -17.149 5.582 759 HB2 GLU 104 HB2 GLU 104 7.771 -17.483 7.729 760 HB3 GLU 104 HB3 GLU 104 6.753 -16.084 7.445 761 HG2 GLU 104 HG2 GLU 104 5.442 -18.050 7.089 762 HG3 GLU 104 HG3 GLU 104 5.694 -17.263 5.534 763 H LEU 105 H LEU 105 7.261 -14.020 6.013 764 HA LEU 105 HA LEU 105 5.971 -14.145 3.384 765 HB2 LEU 105 HB2 LEU 105 5.841 -12.065 5.599 766 HB3 LEU 105 HB3 LEU 105 4.886 -12.014 4.120 767 HG LEU 105 HG LEU 105 4.704 -14.132 6.305 768 HD11 LEU 105 HD11 LEU 105 2.717 -11.999 5.483 769 HD12 LEU 105 HD12 LEU 105 3.664 -12.045 6.974 770 HD13 LEU 105 HD13 LEU 105 2.436 -13.273 6.676 771 HD21 LEU 105 HD21 LEU 105 3.189 -13.943 3.687 772 HD22 LEU 105 HD22 LEU 105 2.810 -15.059 5.005 773 HD23 LEU 105 HD23 LEU 105 4.348 -15.192 4.157 774 H GLY 106 H GLY 106 8.802 -12.751 4.809 775 HA2 GLY 106 HA2 GLY 106 10.593 -11.703 3.824 776 HA3 GLY 106 HA3 GLY 106 9.787 -11.847 2.274 777 H VAL 107 H VAL 107 10.775 -9.704 1.929 778 HA VAL 107 HA VAL 107 9.106 -7.473 2.978 779 HB VAL 107 HB VAL 107 12.060 -7.314 2.188 780 HG11 VAL 107 HG11 VAL 107 11.970 -4.990 3.044 781 HG12 VAL 107 HG12 VAL 107 10.245 -5.170 3.368 782 HG13 VAL 107 HG13 VAL 107 10.837 -5.215 1.706 783 HG21 VAL 107 HG21 VAL 107 12.530 -6.904 4.589 784 HG22 VAL 107 HG22 VAL 107 11.796 -8.492 4.348 785 HG23 VAL 107 HG23 VAL 107 10.822 -7.156 4.967 786 H THR 108 H THR 108 8.098 -6.262 1.434 787 HA THR 108 HA THR 108 8.988 -6.422 -1.397 788 HB THR 108 HB THR 108 6.982 -7.737 -1.321 789 HG1 THR 108 HG1 THR 108 5.784 -5.407 -2.244 790 HG21 THR 108 HG21 THR 108 4.812 -6.927 -0.488 791 HG22 THR 108 HG22 THR 108 5.564 -5.426 0.058 792 HG23 THR 108 HG23 THR 108 6.005 -6.963 0.813 793 H HIS 109 H HIS 109 9.142 -4.514 -2.477 794 HA HIS 109 HA HIS 109 8.821 -2.043 -0.897 795 HB2 HIS 109 HB2 HIS 109 11.131 -2.807 -1.692 796 HB3 HIS 109 HB3 HIS 109 10.604 -2.476 -3.335 797 HD1 HIS 109 HD1 HIS 109 11.461 -0.782 -0.117 798 HD2 HIS 109 HD2 HIS 109 10.568 0.291 -4.017 799 HE1 HIS 109 HE1 HIS 109 12.019 1.629 -0.305 800 HE2 HIS 109 HE2 HIS 109 11.729 2.180 -2.718 801 H ALA 110 H ALA 110 6.904 -1.079 -1.436 802 HA ALA 110 HA ALA 110 5.895 -1.191 -4.205 803 HB1 ALA 110 HB1 ALA 110 4.346 -1.814 -2.409 804 HB2 ALA 110 HB2 ALA 110 3.773 -0.405 -3.297 805 HB3 ALA 110 HB3 ALA 110 4.501 -0.207 -1.704 806 H THR 111 H THR 111 5.692 0.542 -5.512 807 HA THR 111 HA THR 111 6.705 3.181 -4.592 808 HB THR 111 HB THR 111 6.706 2.186 -7.494 809 HG1 THR 111 HG1 THR 111 8.186 0.850 -6.631 810 HG21 THR 111 HG21 THR 111 6.866 4.642 -7.195 811 HG22 THR 111 HG22 THR 111 8.374 3.975 -7.823 812 HG23 THR 111 HG23 THR 111 8.252 4.423 -6.122 813 H VAL 112 H VAL 112 4.943 4.461 -4.232 814 HA VAL 112 HA VAL 112 2.509 4.293 -5.870 815 HB VAL 112 HB VAL 112 3.154 6.045 -3.449 816 HG11 VAL 112 HG11 VAL 112 1.418 7.095 -4.863 817 HG12 VAL 112 HG12 VAL 112 0.713 6.506 -3.355 818 HG13 VAL 112 HG13 VAL 112 0.486 5.595 -4.849 819 HG21 VAL 112 HG21 VAL 112 1.713 4.489 -2.177 820 HG22 VAL 112 HG22 VAL 112 3.093 3.642 -2.884 821 HG23 VAL 112 HG23 VAL 112 1.495 3.502 -3.623 822 H LYS 113 H LYS 113 2.302 5.527 -7.633 823 HA LYS 113 HA LYS 113 3.798 8.075 -7.917 824 HB2 LYS 113 HB2 LYS 113 3.394 5.857 -9.980 825 HB3 LYS 113 HB3 LYS 113 4.115 7.428 -10.335 826 HG2 LYS 113 HG2 LYS 113 6.043 6.972 -8.999 827 HG3 LYS 113 HG3 LYS 113 5.271 5.594 -8.216 828 HD2 LYS 113 HD2 LYS 113 6.963 4.853 -9.829 829 HD3 LYS 113 HD3 LYS 113 5.352 4.329 -10.302 830 HE2 LYS 113 HE2 LYS 113 5.233 6.173 -11.930 831 HE3 LYS 113 HE3 LYS 113 6.855 6.692 -11.474 832 HZ1 LYS 113 HZ1 LYS 113 6.140 4.070 -12.671 833 HZ2 LYS 113 HZ2 LYS 113 7.699 4.571 -12.255 834 HZ3 LYS 113 HZ3 LYS 113 6.859 5.366 -13.486 835 H LEU 114 H LEU 114 2.382 9.676 -8.030 836 HA LEU 114 HA LEU 114 -0.355 9.257 -9.022 837 HB2 LEU 114 HB2 LEU 114 0.854 11.572 -7.466 838 HB3 LEU 114 HB3 LEU 114 -0.832 11.453 -7.951 839 HG LEU 114 HG LEU 114 0.581 9.552 -6.025 840 HD11 LEU 114 HD11 LEU 114 -0.864 10.540 -4.298 841 HD12 LEU 114 HD12 LEU 114 -1.479 11.708 -5.471 842 HD13 LEU 114 HD13 LEU 114 0.222 11.730 -5.008 843 HD21 LEU 114 HD21 LEU 114 -2.331 9.640 -6.876 844 HD22 LEU 114 HD22 LEU 114 -1.646 8.600 -5.622 845 HD23 LEU 114 HD23 LEU 114 -1.151 8.395 -7.298 846 H GLU 115 H GLU 115 -0.989 9.949 -10.952 847 HA GLU 115 HA GLU 115 0.616 11.881 -12.489 848 HB2 GLU 115 HB2 GLU 115 -1.453 9.831 -13.347 849 HB3 GLU 115 HB3 GLU 115 -0.842 11.071 -14.432 850 HG2 GLU 115 HG2 GLU 115 0.405 9.134 -14.925 851 HG3 GLU 115 HG3 GLU 115 1.476 10.201 -14.025 852 HA PRO 116 HA PRO 116 -2.733 14.859 -11.684 853 HB2 PRO 116 HB2 PRO 116 -1.672 16.958 -13.092 854 HB3 PRO 116 HB3 PRO 116 -1.129 16.503 -11.476 855 HG2 PRO 116 HG2 PRO 116 0.120 15.864 -14.141 856 HG3 PRO 116 HG3 PRO 116 0.907 16.366 -12.632 857 HD2 PRO 116 HD2 PRO 116 0.827 13.761 -13.455 858 HD3 PRO 116 HD3 PRO 116 0.852 14.213 -11.741 859 H LEU 117 H LEU 117 -4.485 14.049 -12.768 860 HA LEU 117 HA LEU 117 -4.718 14.476 -15.701 861 HB2 LEU 117 HB2 LEU 117 -6.589 12.845 -13.949 862 HB3 LEU 117 HB3 LEU 117 -6.472 12.820 -15.702 863 HG LEU 117 HG LEU 117 -4.412 11.710 -13.744 864 HD11 LEU 117 HD11 LEU 117 -6.418 10.328 -13.865 865 HD12 LEU 117 HD12 LEU 117 -5.049 9.506 -14.607 866 HD13 LEU 117 HD13 LEU 117 -6.288 10.245 -15.625 867 HD21 LEU 117 HD21 LEU 117 -3.217 10.819 -15.707 868 HD22 LEU 117 HD22 LEU 117 -3.268 12.579 -15.725 869 HD23 LEU 117 HD23 LEU 117 -4.340 11.657 -16.783 870 H GLU 118 H GLU 118 -4.914 16.542 -13.620 871 HA GLU 118 HA GLU 118 -5.946 18.491 -13.253 872 HB2 GLU 118 HB2 GLU 118 -6.299 18.546 -15.680 873 HB3 GLU 118 HB3 GLU 118 -7.808 17.672 -15.502 874 HG2 GLU 118 HG2 GLU 118 -8.788 19.541 -14.267 875 HG3 GLU 118 HG3 GLU 118 -7.260 20.419 -14.349 876 H ASN 119 H ASN 119 -9.015 16.889 -14.147 877 HA ASN 119 HA ASN 119 -10.153 17.450 -11.520 878 HB2 ASN 119 HB2 ASN 119 -11.370 16.147 -13.996 879 HB3 ASN 119 HB3 ASN 119 -12.266 16.608 -12.549 880 HD21 ASN 119 HD21 ASN 119 -12.609 17.496 -15.296 881 HD22 ASN 119 HD22 ASN 119 -12.446 19.213 -15.270 882 H ARG 120 H ARG 120 -8.457 14.914 -12.981 883 HA ARG 120 HA ARG 120 -9.285 12.986 -10.866 884 HB2 ARG 120 HB2 ARG 120 -8.368 12.295 -13.694 885 HB3 ARG 120 HB3 ARG 120 -8.808 11.143 -12.434 886 HG2 ARG 120 HG2 ARG 120 -11.142 11.866 -12.536 887 HG3 ARG 120 HG3 ARG 120 -10.727 13.132 -13.701 888 HD2 ARG 120 HD2 ARG 120 -10.509 10.130 -14.136 889 HD3 ARG 120 HD3 ARG 120 -11.703 11.212 -14.860 890 HE ARG 120 HE ARG 120 -9.312 12.264 -15.629 891 HH11 ARG 120 HH11 ARG 120 -10.751 9.144 -16.044 892 HH12 ARG 120 HH12 ARG 120 -9.856 8.827 -17.485 893 HH21 ARG 120 HH21 ARG 120 -8.199 11.839 -17.455 894 HH22 ARG 120 HH22 ARG 120 -8.445 10.339 -18.284 895 H THR 121 H THR 121 -7.500 11.319 -10.511 896 HA THR 121 HA THR 121 -4.787 12.025 -11.336 897 HB THR 121 HB THR 121 -5.535 11.877 -8.371 898 HG1 THR 121 HG1 THR 121 -5.795 13.941 -9.443 899 HG21 THR 121 HG21 THR 121 -2.763 12.060 -9.625 900 HG22 THR 121 HG22 THR 121 -3.400 10.683 -8.722 901 HG23 THR 121 HG23 THR 121 -3.116 12.218 -7.901 902 H ARG 122 H ARG 122 -3.450 10.210 -11.438 903 HA ARG 122 HA ARG 122 -4.823 7.608 -11.120 904 HB2 ARG 122 HB2 ARG 122 -4.196 8.198 -13.414 905 HB3 ARG 122 HB3 ARG 122 -2.526 8.462 -12.923 906 HG2 ARG 122 HG2 ARG 122 -2.254 6.086 -12.425 907 HG3 ARG 122 HG3 ARG 122 -3.960 5.785 -12.799 908 HD2 ARG 122 HD2 ARG 122 -1.859 6.797 -14.752 909 HD3 ARG 122 HD3 ARG 122 -2.469 5.147 -14.662 910 HE ARG 122 HE ARG 122 -4.723 6.171 -15.188 911 HH11 ARG 122 HH11 ARG 122 -1.793 7.591 -16.375 912 HH12 ARG 122 HH12 ARG 122 -2.578 8.316 -17.732 913 HH21 ARG 122 HH21 ARG 122 -5.700 7.107 -16.902 914 HH22 ARG 122 HH22 ARG 122 -4.779 8.032 -18.035 915 H MET 123 H MET 123 -4.152 6.352 -9.474 916 HA MET 123 HA MET 123 -1.482 6.751 -8.272 917 HB2 MET 123 HB2 MET 123 -3.507 6.899 -6.783 918 HB3 MET 123 HB3 MET 123 -3.876 5.220 -7.154 919 HG2 MET 123 HG2 MET 123 -1.692 4.551 -6.156 920 HG3 MET 123 HG3 MET 123 -1.398 6.239 -5.737 921 HE1 MET 123 HE1 MET 123 -4.666 3.570 -3.890 922 HE2 MET 123 HE2 MET 123 -3.505 3.049 -5.107 923 HE3 MET 123 HE3 MET 123 -4.799 4.168 -5.542 924 H THR 124 H THR 124 -0.054 5.473 -9.357 925 HA THR 124 HA THR 124 -0.727 2.636 -9.914 926 HB THR 124 HB THR 124 1.623 4.263 -11.009 927 HG1 THR 124 HG1 THR 124 -0.132 5.132 -11.991 928 HG21 THR 124 HG21 THR 124 1.828 2.416 -12.652 929 HG22 THR 124 HG22 THR 124 0.506 1.554 -11.862 930 HG23 THR 124 HG23 THR 124 2.028 1.812 -11.006 931 H ILE 125 H ILE 125 -0.060 1.278 -8.315 932 HA ILE 125 HA ILE 125 2.324 1.958 -6.679 933 HB ILE 125 HB ILE 125 0.102 -0.006 -5.948 934 HG12 ILE 125 HG12 ILE 125 0.363 2.910 -5.053 935 HG13 ILE 125 HG13 ILE 125 -0.854 2.297 -6.169 936 HG21 ILE 125 HG21 ILE 125 2.235 -0.384 -4.773 937 HG22 ILE 125 HG22 ILE 125 1.016 0.214 -3.651 938 HG23 ILE 125 HG23 ILE 125 2.269 1.304 -4.248 939 HD11 ILE 125 HD11 ILE 125 -1.804 0.920 -4.375 940 HD12 ILE 125 HD12 ILE 125 -1.768 2.629 -3.945 941 HD13 ILE 125 HD13 ILE 125 -0.576 1.527 -3.260 942 H ILE 126 H ILE 126 4.119 0.821 -7.307 943 HA ILE 126 HA ILE 126 3.815 -1.876 -8.513 944 HB ILE 126 HB ILE 126 6.300 -0.110 -8.787 945 HG12 ILE 126 HG12 ILE 126 5.389 0.242 -11.239 946 HG13 ILE 126 HG13 ILE 126 3.816 -0.138 -10.552 947 HG21 ILE 126 HG21 ILE 126 6.814 -1.594 -10.701 948 HG22 ILE 126 HG22 ILE 126 5.343 -2.518 -10.383 949 HG23 ILE 126 HG23 ILE 126 6.651 -2.505 -9.195 950 HD11 ILE 126 HD11 ILE 126 4.156 2.240 -10.745 951 HD12 ILE 126 HD12 ILE 126 5.609 2.147 -9.751 952 HD13 ILE 126 HD13 ILE 126 4.031 1.780 -9.047 953 H SER 127 H SER 127 4.113 -3.390 -6.929 954 HA SER 127 HA SER 127 6.061 -2.998 -4.762 955 HB2 SER 127 HB2 SER 127 4.960 -5.006 -3.741 956 HB3 SER 127 HB3 SER 127 3.820 -3.707 -4.089 957 HG SER 127 HG SER 127 3.259 -5.965 -4.723 958 H THR 128 H THR 128 8.090 -3.587 -5.265 959 HA THR 128 HA THR 128 8.709 -5.875 -6.974 960 HB THR 128 HB THR 128 11.098 -5.163 -6.658 961 HG1 THR 128 HG1 THR 128 11.013 -4.218 -4.622 962 HG21 THR 128 HG21 THR 128 10.956 -3.032 -7.906 963 HG22 THR 128 HG22 THR 128 9.243 -2.897 -7.500 964 HG23 THR 128 HG23 THR 128 9.804 -4.209 -8.545 965 H PHE 129 H PHE 129 9.315 -7.833 -6.243 966 HA PHE 129 HA PHE 129 9.515 -8.326 -3.331 967 HB2 PHE 129 HB2 PHE 129 8.986 -10.301 -5.605 968 HB3 PHE 129 HB3 PHE 129 8.891 -10.646 -3.879 969 HD1 PHE 129 HD1 PHE 129 6.987 -9.821 -2.533 970 HD2 PHE 129 HD2 PHE 129 7.187 -9.049 -6.737 971 HE1 PHE 129 HE1 PHE 129 4.615 -9.171 -2.536 972 HE2 PHE 129 HE2 PHE 129 4.820 -8.409 -6.725 973 HZ PHE 129 HZ PHE 129 3.530 -8.462 -4.633 974 H GLU 130 H GLU 130 11.080 -10.055 -2.647 975 HA GLU 130 HA GLU 130 13.706 -9.593 -3.705 976 HB2 GLU 130 HB2 GLU 130 12.766 -11.605 -1.620 977 HB3 GLU 130 HB3 GLU 130 14.455 -11.255 -1.992 978 HG2 GLU 130 HG2 GLU 130 12.425 -9.322 -0.816 979 HG3 GLU 130 HG3 GLU 130 13.772 -10.077 0.037 980 H SER 131 H SER 131 11.435 -12.325 -3.908 981 HA SER 131 HA SER 131 12.580 -13.199 -6.400 982 HB2 SER 131 HB2 SER 131 14.146 -14.332 -4.868 983 HB3 SER 131 HB3 SER 131 12.800 -15.084 -4.015 984 HG SER 131 HG SER 131 14.039 -15.852 -6.299 985 H GLU 132 H GLU 132 11.408 -15.066 -7.319 986 HA GLU 132 HA GLU 132 8.696 -14.704 -7.508 987 HB2 GLU 132 HB2 GLU 132 9.928 -15.788 -9.275 988 HB3 GLU 132 HB3 GLU 132 10.418 -17.108 -8.216 989 HG2 GLU 132 HG2 GLU 132 8.070 -17.888 -8.096 990 HG3 GLU 132 HG3 GLU 132 7.582 -16.556 -9.143 991 H GLU 133 H GLU 133 10.378 -17.199 -5.543 992 HA GLU 133 HA GLU 133 8.054 -18.582 -4.701 993 HB2 GLU 133 HB2 GLU 133 9.604 -19.433 -2.799 994 HB3 GLU 133 HB3 GLU 133 10.010 -19.823 -4.460 995 HG2 GLU 133 HG2 GLU 133 12.059 -19.289 -3.373 996 HG3 GLU 133 HG3 GLU 133 11.682 -17.935 -4.435 997 H GLN 134 H GLN 134 9.599 -15.704 -3.336 998 HA GLN 134 HA GLN 134 7.922 -15.523 -0.996 999 HB2 GLN 134 HB2 GLN 134 10.133 -14.332 -1.199 1000 HB3 GLN 134 HB3 GLN 134 9.445 -13.299 -2.449 1001 HG2 GLN 134 HG2 GLN 134 7.639 -12.825 -0.493 1002 HG3 GLN 134 HG3 GLN 134 9.005 -13.278 0.520 1003 HE21 GLN 134 HE21 GLN 134 7.663 -10.729 0.341 1004 HE22 GLN 134 HE22 GLN 134 8.861 -9.579 -0.134 1005 H MET 135 H MET 135 7.927 -14.195 -4.250 1006 HA MET 135 HA MET 135 5.685 -12.507 -4.148 1007 HB2 MET 135 HB2 MET 135 7.364 -12.347 -5.898 1008 HB3 MET 135 HB3 MET 135 7.027 -13.978 -6.453 1009 HG2 MET 135 HG2 MET 135 4.981 -13.357 -7.391 1010 HG3 MET 135 HG3 MET 135 4.947 -11.817 -6.529 1011 HE1 MET 135 HE1 MET 135 4.658 -10.054 -8.383 1012 HE2 MET 135 HE2 MET 135 4.171 -11.427 -9.380 1013 HE3 MET 135 HE3 MET 135 5.318 -10.242 -10.008 1014 H GLN 136 H GLN 136 5.920 -16.009 -4.678 1015 HA GLN 136 HA GLN 136 3.142 -16.421 -5.358 1016 HB2 GLN 136 HB2 GLN 136 5.049 -18.474 -4.155 1017 HB3 GLN 136 HB3 GLN 136 3.552 -18.800 -5.021 1018 HG2 GLN 136 HG2 GLN 136 6.197 -17.858 -6.132 1019 HG3 GLN 136 HG3 GLN 136 5.347 -19.353 -6.481 1020 HE21 GLN 136 HE21 GLN 136 5.624 -15.977 -7.219 1021 HE22 GLN 136 HE22 GLN 136 4.556 -15.965 -8.576 1022 H LYS 137 H LYS 137 5.107 -16.715 -2.404 1023 HA LYS 137 HA LYS 137 3.219 -17.570 -0.538 1024 HB2 LYS 137 HB2 LYS 137 5.599 -17.530 -0.046 1025 HB3 LYS 137 HB3 LYS 137 5.659 -15.788 -0.219 1026 HG2 LYS 137 HG2 LYS 137 5.787 -16.093 2.086 1027 HG3 LYS 137 HG3 LYS 137 4.091 -15.700 1.847 1028 HD2 LYS 137 HD2 LYS 137 5.118 -18.557 2.117 1029 HD3 LYS 137 HD3 LYS 137 4.610 -17.586 3.497 1030 HE2 LYS 137 HE2 LYS 137 2.334 -17.407 2.470 1031 HE3 LYS 137 HE3 LYS 137 2.871 -18.468 1.169 1032 HZ1 LYS 137 HZ1 LYS 137 2.695 -19.146 4.041 1033 HZ2 LYS 137 HZ2 LYS 137 3.338 -20.158 2.851 1034 HZ3 LYS 137 HZ3 LYS 137 1.709 -19.720 2.795 1035 H MET 138 H MET 138 3.910 -14.248 -1.602 1036 HA MET 138 HA MET 138 2.223 -12.852 0.199 1037 HB2 MET 138 HB2 MET 138 3.079 -12.085 -2.619 1038 HB3 MET 138 HB3 MET 138 2.398 -10.981 -1.433 1039 HG2 MET 138 HG2 MET 138 4.890 -12.441 -0.644 1040 HG3 MET 138 HG3 MET 138 5.040 -11.191 -1.867 1041 HE1 MET 138 HE1 MET 138 3.811 -10.438 2.533 1042 HE2 MET 138 HE2 MET 138 4.402 -11.981 1.917 1043 HE3 MET 138 HE3 MET 138 2.792 -11.410 1.471 1044 H ALA 139 H ALA 139 1.627 -14.106 -3.094 1045 HA ALA 139 HA ALA 139 -1.107 -13.384 -3.322 1046 HB1 ALA 139 HB1 ALA 139 0.393 -15.647 -4.690 1047 HB2 ALA 139 HB2 ALA 139 0.290 -13.978 -5.258 1048 HB3 ALA 139 HB3 ALA 139 -1.163 -14.980 -5.204 1049 H GLU 140 H GLU 140 0.460 -16.239 -1.900 1050 HA GLU 140 HA GLU 140 -1.800 -17.885 -1.446 1051 HB2 GLU 140 HB2 GLU 140 0.804 -17.649 0.116 1052 HB3 GLU 140 HB3 GLU 140 -0.383 -18.918 0.397 1053 HG2 GLU 140 HG2 GLU 140 1.071 -18.476 -2.231 1054 HG3 GLU 140 HG3 GLU 140 1.590 -19.603 -0.986 1055 H MET 141 H MET 141 -0.494 -15.163 0.367 1056 HA MET 141 HA MET 141 -2.199 -15.472 2.696 1057 HB2 MET 141 HB2 MET 141 -0.396 -13.213 1.745 1058 HB3 MET 141 HB3 MET 141 -1.227 -13.211 3.297 1059 HG2 MET 141 HG2 MET 141 0.785 -15.297 2.439 1060 HG3 MET 141 HG3 MET 141 1.162 -13.883 3.422 1061 HE1 MET 141 HE1 MET 141 -0.736 -14.624 6.760 1062 HE2 MET 141 HE2 MET 141 -1.263 -13.597 5.427 1063 HE3 MET 141 HE3 MET 141 0.425 -13.571 5.948 1064 H GLY 142 H GLY 142 -3.002 -14.557 -0.394 1065 HA2 GLY 142 HA2 GLY 142 -4.801 -13.465 -1.316 1066 HA3 GLY 142 HA3 GLY 142 -5.464 -13.289 0.300 1067 H MET 143 H MET 143 -2.304 -12.038 -0.162 1068 HA MET 143 HA MET 143 -3.026 -9.359 0.498 1069 HB2 MET 143 HB2 MET 143 -0.898 -10.402 1.200 1070 HB3 MET 143 HB3 MET 143 -0.387 -10.541 -0.473 1071 HG2 MET 143 HG2 MET 143 -0.374 -8.046 -0.619 1072 HG3 MET 143 HG3 MET 143 -0.750 -7.983 1.108 1073 HE1 MET 143 HE1 MET 143 3.076 -6.982 1.027 1074 HE2 MET 143 HE2 MET 143 1.467 -6.498 1.560 1075 HE3 MET 143 HE3 MET 143 1.853 -6.535 -0.161 1076 H GLU 144 H GLU 144 -2.148 -10.993 -2.513 1077 HA GLU 144 HA GLU 144 -1.737 -8.814 -4.227 1078 HB2 GLU 144 HB2 GLU 144 -1.079 -11.065 -4.813 1079 HB3 GLU 144 HB3 GLU 144 -2.741 -11.632 -4.755 1080 HG2 GLU 144 HG2 GLU 144 -3.248 -10.178 -6.725 1081 HG3 GLU 144 HG3 GLU 144 -1.539 -9.752 -6.805 1082 H GLU 145 H GLU 145 -4.742 -10.747 -3.850 1083 HA GLU 145 HA GLU 145 -6.352 -8.998 -5.473 1084 HB2 GLU 145 HB2 GLU 145 -6.771 -11.422 -5.351 1085 HB3 GLU 145 HB3 GLU 145 -7.133 -11.295 -3.633 1086 HG2 GLU 145 HG2 GLU 145 -9.112 -9.929 -4.135 1087 HG3 GLU 145 HG3 GLU 145 -8.727 -9.986 -5.855 1088 H GLY 146 H GLY 146 -6.097 -9.652 -1.977 1089 HA2 GLY 146 HA2 GLY 146 -8.167 -7.999 -1.038 1090 HA3 GLY 146 HA3 GLY 146 -6.774 -8.517 -0.103 1091 H MET 147 H MET 147 -4.903 -7.143 -2.031 1092 HA MET 147 HA MET 147 -4.714 -4.581 -0.836 1093 HB2 MET 147 HB2 MET 147 -2.794 -5.842 -1.825 1094 HB3 MET 147 HB3 MET 147 -3.444 -5.546 -3.429 1095 HG2 MET 147 HG2 MET 147 -3.116 -3.133 -3.121 1096 HG3 MET 147 HG3 MET 147 -2.486 -3.422 -1.495 1097 HE1 MET 147 HE1 MET 147 0.689 -2.369 -3.594 1098 HE2 MET 147 HE2 MET 147 -0.320 -1.983 -2.200 1099 HE3 MET 147 HE3 MET 147 -0.957 -1.781 -3.834 1100 H ARG 148 H ARG 148 -5.976 -5.628 -4.048 1101 HA ARG 148 HA ARG 148 -6.711 -3.040 -4.972 1102 HB2 ARG 148 HB2 ARG 148 -7.820 -5.763 -5.728 1103 HB3 ARG 148 HB3 ARG 148 -8.403 -4.275 -6.456 1104 HG2 ARG 148 HG2 ARG 148 -6.841 -4.639 -8.029 1105 HG3 ARG 148 HG3 ARG 148 -5.709 -3.984 -6.849 1106 HD2 ARG 148 HD2 ARG 148 -4.785 -6.019 -7.726 1107 HD3 ARG 148 HD3 ARG 148 -5.283 -6.347 -6.064 1108 HE ARG 148 HE ARG 148 -7.451 -7.079 -7.542 1109 HH11 ARG 148 HH11 ARG 148 -4.127 -8.061 -7.591 1110 HH12 ARG 148 HH12 ARG 148 -4.494 -9.603 -8.280 1111 HH21 ARG 148 HH21 ARG 148 -7.879 -9.051 -8.395 1112 HH22 ARG 148 HH22 ARG 148 -6.590 -10.158 -8.718 1113 H GLU 149 H GLU 149 -8.438 -5.374 -2.941 1114 HA GLU 149 HA GLU 149 -10.956 -4.063 -2.854 1115 HB2 GLU 149 HB2 GLU 149 -9.613 -5.820 -0.754 1116 HB3 GLU 149 HB3 GLU 149 -11.310 -5.332 -0.718 1117 HG2 GLU 149 HG2 GLU 149 -11.666 -6.510 -2.883 1118 HG3 GLU 149 HG3 GLU 149 -9.982 -7.046 -2.846 1119 H ALA 150 H ALA 150 -8.030 -3.644 -0.869 1120 HA ALA 150 HA ALA 150 -8.981 -1.615 0.880 1121 HB1 ALA 150 HB1 ALA 150 -6.896 -2.866 1.291 1122 HB2 ALA 150 HB2 ALA 150 -6.595 -1.126 1.286 1123 HB3 ALA 150 HB3 ALA 150 -6.149 -2.104 -0.119 1124 H ILE 151 H ILE 151 -7.408 -1.472 -2.298 1125 HA ILE 151 HA ILE 151 -7.233 1.365 -2.502 1126 HB ILE 151 HB ILE 151 -7.008 -0.819 -4.608 1127 HG12 ILE 151 HG12 ILE 151 -4.844 0.832 -3.213 1128 HG13 ILE 151 HG13 ILE 151 -5.271 -0.821 -2.793 1129 HG21 ILE 151 HG21 ILE 151 -7.629 1.259 -5.750 1130 HG22 ILE 151 HG22 ILE 151 -5.947 0.858 -6.095 1131 HG23 ILE 151 HG23 ILE 151 -6.329 2.127 -4.927 1132 HD11 ILE 151 HD11 ILE 151 -4.527 -1.554 -5.029 1133 HD12 ILE 151 HD12 ILE 151 -3.248 -0.776 -4.097 1134 HD13 ILE 151 HD13 ILE 151 -4.051 0.108 -5.394 1135 H GLU 152 H GLU 152 -9.744 -0.928 -3.388 1136 HA GLU 152 HA GLU 152 -11.360 0.998 -4.834 1137 HB2 GLU 152 HB2 GLU 152 -11.917 -1.832 -3.868 1138 HB3 GLU 152 HB3 GLU 152 -13.107 -0.867 -4.741 1139 HG2 GLU 152 HG2 GLU 152 -10.383 -1.700 -5.809 1140 HG3 GLU 152 HG3 GLU 152 -11.916 -2.484 -6.188 1141 H GLN 153 H GLN 153 -10.883 0.183 -1.528 1142 HA GLN 153 HA GLN 153 -13.353 1.414 -0.601 1143 HB2 GLN 153 HB2 GLN 153 -12.138 -0.492 0.608 1144 HB3 GLN 153 HB3 GLN 153 -10.925 0.690 1.089 1145 HG2 GLN 153 HG2 GLN 153 -12.593 1.964 2.329 1146 HG3 GLN 153 HG3 GLN 153 -13.884 0.920 1.741 1147 HE21 GLN 153 HE21 GLN 153 -11.301 1.242 4.015 1148 HE22 GLN 153 HE22 GLN 153 -11.653 -0.177 4.930 1149 H ILE 154 H ILE 154 -10.145 2.460 -1.516 1150 HA ILE 154 HA ILE 154 -10.070 5.024 -0.250 1151 HB ILE 154 HB ILE 154 -8.947 4.242 -2.979 1152 HG12 ILE 154 HG12 ILE 154 -7.529 4.314 -0.284 1153 HG13 ILE 154 HG13 ILE 154 -8.107 2.849 -1.072 1154 HG21 ILE 154 HG21 ILE 154 -9.091 6.694 -2.762 1155 HG22 ILE 154 HG22 ILE 154 -7.407 6.177 -2.715 1156 HG23 ILE 154 HG23 ILE 154 -8.229 6.631 -1.220 1157 HD11 ILE 154 HD11 ILE 154 -6.573 3.219 -2.919 1158 HD12 ILE 154 HD12 ILE 154 -5.727 3.166 -1.375 1159 HD13 ILE 154 HD13 ILE 154 -6.011 4.711 -2.165 1160 H ASP 155 H ASP 155 -11.543 3.847 -3.262 1161 HA ASP 155 HA ASP 155 -12.496 6.307 -4.291 1162 HB2 ASP 155 HB2 ASP 155 -12.277 4.001 -5.477 1163 HB3 ASP 155 HB3 ASP 155 -13.803 3.583 -4.713 1164 H ALA 156 H ALA 156 -13.818 3.947 -1.994 1165 HA ALA 156 HA ALA 156 -16.293 5.245 -1.432 1166 HB1 ALA 156 HB1 ALA 156 -15.860 2.894 -0.803 1167 HB2 ALA 156 HB2 ALA 156 -16.360 3.849 0.595 1168 HB3 ALA 156 HB3 ALA 156 -14.657 3.424 0.375 1169 H VAL 157 H VAL 157 -13.020 5.606 -0.044 1170 HA VAL 157 HA VAL 157 -13.673 7.183 2.224 1171 HB VAL 157 HB VAL 157 -11.060 6.848 0.688 1172 HG11 VAL 157 HG11 VAL 157 -11.439 8.431 3.264 1173 HG12 VAL 157 HG12 VAL 157 -10.941 9.087 1.702 1174 HG13 VAL 157 HG13 VAL 157 -9.880 7.978 2.571 1175 HG21 VAL 157 HG21 VAL 157 -10.356 5.541 2.660 1176 HG22 VAL 157 HG22 VAL 157 -11.841 4.879 1.980 1177 HG23 VAL 157 HG23 VAL 157 -11.908 5.861 3.442 1178 H LEU 158 H LEU 158 -12.902 8.113 -1.120 1179 HA LEU 158 HA LEU 158 -12.998 10.975 -0.590 1180 HB2 LEU 158 HB2 LEU 158 -12.925 9.414 -3.203 1181 HB3 LEU 158 HB3 LEU 158 -12.841 11.168 -3.097 1182 HG LEU 158 HG LEU 158 -10.767 9.219 -1.997 1183 HD11 LEU 158 HD11 LEU 158 -10.590 11.079 -4.387 1184 HD12 LEU 158 HD12 LEU 158 -10.699 9.314 -4.428 1185 HD13 LEU 158 HD13 LEU 158 -9.277 10.090 -3.736 1186 HD21 LEU 158 HD21 LEU 158 -10.857 11.193 -0.573 1187 HD22 LEU 158 HD22 LEU 158 -10.737 12.260 -1.975 1188 HD23 LEU 158 HD23 LEU 158 -9.377 11.220 -1.536 1189 H SER 159 H SER 159 -15.280 8.477 -1.344 1190 HA SER 159 HA SER 159 -17.394 10.323 -2.222 1191 HB2 SER 159 HB2 SER 159 -17.120 8.185 -3.428 1192 HB3 SER 159 HB3 SER 159 -17.388 7.286 -1.935 1193 HG SER 159 HG SER 159 -19.257 8.984 -3.255 1194 H GLU 160 H GLU 160 -16.305 9.024 0.770 1195 HA GLU 160 HA GLU 160 -18.709 8.622 2.191 1196 HB2 GLU 160 HB2 GLU 160 -15.914 9.389 3.118 1197 HB3 GLU 160 HB3 GLU 160 -17.239 9.230 4.266 1198 HG2 GLU 160 HG2 GLU 160 -17.562 6.876 3.523 1199 HG3 GLU 160 HG3 GLU 160 -16.182 7.046 2.452 1200 HA PRO 161 HA PRO 161 -20.217 12.800 2.075 1201 HB2 PRO 161 HB2 PRO 161 -22.610 12.458 3.225 1202 HB3 PRO 161 HB3 PRO 161 -22.195 11.559 1.754 1203 HG2 PRO 161 HG2 PRO 161 -22.126 10.624 4.633 1204 HG3 PRO 161 HG3 PRO 161 -22.776 9.790 3.207 1205 HD2 PRO 161 HD2 PRO 161 -20.243 9.332 4.269 1206 HD3 PRO 161 HD3 PRO 161 -20.702 8.988 2.585 1207 H ALA 162 H ALA 162 -18.342 12.327 4.331 1208 HA ALA 162 HA ALA 162 -17.503 13.353 6.139 1209 HB1 ALA 162 HB1 ALA 162 -19.841 15.275 6.024 1210 HB2 ALA 162 HB2 ALA 162 -18.311 15.466 5.171 1211 HB3 ALA 162 HB3 ALA 162 -18.341 15.503 6.935 1212 H ASN 163 H ASN 163 -21.060 13.105 6.553 1213 HA ASN 163 HA ASN 163 -21.186 12.851 9.317 1214 HB2 ASN 163 HB2 ASN 163 -23.150 13.294 7.838 1215 HB3 ASN 163 HB3 ASN 163 -23.070 11.642 7.238 1216 HD21 ASN 163 HD21 ASN 163 -25.066 11.006 7.959 1217 HD22 ASN 163 HD22 ASN 163 -25.511 10.912 9.625 1218 H ALA 164 H ALA 164 -21.907 10.034 7.189 1219 HA ALA 164 HA ALA 164 -21.604 7.800 7.375 1220 HB1 ALA 164 HB1 ALA 164 -18.986 8.553 8.710 1221 HB2 ALA 164 HB2 ALA 164 -19.256 8.452 6.970 1222 HB3 ALA 164 HB3 ALA 164 -19.361 6.997 7.965 1223 H LEU 165 H LEU 165 -22.641 9.396 9.917 1224 HA LEU 165 HA LEU 165 -22.180 7.479 12.071 1225 HB2 LEU 165 HB2 LEU 165 -23.881 10.002 11.996 1226 HB3 LEU 165 HB3 LEU 165 -23.603 9.016 13.428 1227 HG LEU 165 HG LEU 165 -21.480 10.593 11.909 1228 HD11 LEU 165 HD11 LEU 165 -22.691 11.114 14.643 1229 HD12 LEU 165 HD12 LEU 165 -22.969 12.056 13.176 1230 HD13 LEU 165 HD13 LEU 165 -21.365 12.018 13.902 1231 HD21 LEU 165 HD21 LEU 165 -19.937 9.954 13.730 1232 HD22 LEU 165 HD22 LEU 165 -20.504 8.548 12.835 1233 HD23 LEU 165 HD23 LEU 165 -21.180 8.910 14.426 1234 H GLU 166 H GLU 166 -23.136 5.632 11.313 1235 HA GLU 166 HA GLU 166 -26.074 5.501 11.261 1236 HB2 GLU 166 HB2 GLU 166 -25.856 3.964 9.192 1237 HB3 GLU 166 HB3 GLU 166 -25.656 5.693 8.937 1238 HG2 GLU 166 HG2 GLU 166 -23.210 5.428 8.865 1239 HG3 GLU 166 HG3 GLU 166 -23.375 3.699 9.173 1240 H HIS 167 H HIS 167 -26.316 4.301 13.084 1241 HA HIS 167 HA HIS 167 -24.507 2.283 13.960 1242 HB2 HIS 167 HB2 HIS 167 -26.065 1.864 15.785 1243 HB3 HIS 167 HB3 HIS 167 -25.951 3.596 15.524 1244 HD1 HIS 167 HD1 HIS 167 -28.354 0.859 15.780 1245 HD2 HIS 167 HD2 HIS 167 -28.348 4.700 14.196 1246 HE1 HIS 167 HE1 HIS 167 -30.759 1.415 15.369 1247 HE2 HIS 167 HE2 HIS 167 -30.742 3.781 14.536 1248 H HIS 168 H HIS 168 -24.290 0.231 13.268 1249 HA HIS 168 HA HIS 168 -26.408 -1.003 11.607 1250 HB2 HIS 168 HB2 HIS 168 -23.484 -1.801 11.928 1251 HB3 HIS 168 HB3 HIS 168 -24.629 -2.502 10.788 1252 HD1 HIS 168 HD1 HIS 168 -22.088 0.049 11.042 1253 HD2 HIS 168 HD2 HIS 168 -25.532 -0.492 8.783 1254 HE1 HIS 168 HE1 HIS 168 -21.850 1.599 9.085 1255 HE2 HIS 168 HE2 HIS 168 -23.893 1.185 7.681 1256 H HIS 169 H HIS 169 -27.322 -1.084 14.045 1257 HA HIS 169 HA HIS 169 -26.838 -3.827 15.065 1258 HB2 HIS 169 HB2 HIS 169 -25.664 -2.034 16.472 1259 HB3 HIS 169 HB3 HIS 169 -27.250 -1.431 16.915 1260 HD1 HIS 169 HD1 HIS 169 -28.649 -2.881 18.570 1261 HD2 HIS 169 HD2 HIS 169 -24.911 -4.453 17.684 1262 HE1 HIS 169 HE1 HIS 169 -28.287 -4.720 20.235 1263 HE2 HIS 169 HE2 HIS 169 -26.091 -5.744 19.586 1264 H HIS 170 H HIS 170 -28.656 -4.963 15.250 1265 HA HIS 170 HA HIS 170 -30.785 -5.658 15.521 1266 HB2 HIS 170 HB2 HIS 170 -30.358 -4.535 17.756 1267 HB3 HIS 170 HB3 HIS 170 -31.190 -3.114 17.144 1268 HD1 HIS 170 HD1 HIS 170 -31.776 -6.251 18.876 1269 HD2 HIS 170 HD2 HIS 170 -34.059 -3.658 16.577 1270 HE1 HIS 170 HE1 HIS 170 -34.155 -6.806 19.413 1271 HE2 HIS 170 HE2 HIS 170 -35.498 -5.060 18.204 1272 H HIS 171 H HIS 171 -31.238 -5.416 13.252 1273 HA HIS 171 HA HIS 171 -32.381 -4.828 11.405 1274 HB2 HIS 171 HB2 HIS 171 -34.241 -3.601 13.466 1275 HB3 HIS 171 HB3 HIS 171 -34.614 -3.560 11.746 1276 HD1 HIS 171 HD1 HIS 171 -34.394 -5.907 14.663 1277 HD2 HIS 171 HD2 HIS 171 -35.426 -6.006 10.644 1278 HE1 HIS 171 HE1 HIS 171 -35.529 -8.115 14.320 1279 HE2 HIS 171 HE2 HIS 171 -35.944 -8.230 11.845 1280 H HIS 172 H HIS 172 -31.398 -3.560 9.992 1281 HA HIS 172 HA HIS 172 -31.459 -0.652 10.143 1282 HB2 HIS 172 HB2 HIS 172 -28.904 -0.490 9.952 1283 HB3 HIS 172 HB3 HIS 172 -29.506 -0.996 11.527 1284 HD1 HIS 172 HD1 HIS 172 -27.535 -2.232 8.606 1285 HD2 HIS 172 HD2 HIS 172 -28.946 -3.684 12.231 1286 HE1 HIS 172 HE1 HIS 172 -26.301 -4.371 8.990 1287 HE2 HIS 172 HE2 HIS 172 -27.321 -5.329 11.067 Start of MODEL 14 1 H1 THR 1 H1 THR 1 -11.316 1.054 -6.276 2 H2 THR 1 H2 THR 1 -12.366 2.370 -6.058 3 H3 THR 1 H3 THR 1 -10.693 2.624 -6.135 4 HA THR 1 HA THR 1 -12.357 1.551 -8.345 5 HB THR 1 HB THR 1 -11.089 4.282 -8.309 6 HG1 THR 1 HG1 THR 1 -13.204 5.077 -7.729 7 HG21 THR 1 HG21 THR 1 -12.777 4.788 -10.067 8 HG22 THR 1 HG22 THR 1 -13.383 3.134 -9.946 9 HG23 THR 1 HG23 THR 1 -11.746 3.431 -10.535 10 H VAL 2 H VAL 2 -10.841 -0.061 -8.608 11 HA VAL 2 HA VAL 2 -8.126 0.589 -9.526 12 HB VAL 2 HB VAL 2 -9.574 -2.036 -9.007 13 HG11 VAL 2 HG11 VAL 2 -7.974 -2.400 -10.854 14 HG12 VAL 2 HG12 VAL 2 -7.381 -3.179 -9.389 15 HG13 VAL 2 HG13 VAL 2 -6.683 -1.645 -9.910 16 HG21 VAL 2 HG21 VAL 2 -8.954 -0.848 -6.947 17 HG22 VAL 2 HG22 VAL 2 -7.281 -0.728 -7.497 18 HG23 VAL 2 HG23 VAL 2 -7.973 -2.309 -7.125 19 H VAL 3 H VAL 3 -7.761 0.851 -11.658 20 HA VAL 3 HA VAL 3 -9.820 0.055 -13.635 21 HB VAL 3 HB VAL 3 -8.617 1.697 -15.166 22 HG11 VAL 3 HG11 VAL 3 -10.697 2.340 -13.976 23 HG12 VAL 3 HG12 VAL 3 -9.602 3.718 -14.109 24 HG13 VAL 3 HG13 VAL 3 -9.749 2.854 -12.576 25 HG21 VAL 3 HG21 VAL 3 -7.179 2.485 -12.595 26 HG22 VAL 3 HG22 VAL 3 -7.090 3.357 -14.132 27 HG23 VAL 3 HG23 VAL 3 -6.422 1.728 -14.003 28 H SER 4 H SER 4 -6.674 -0.849 -12.580 29 HA SER 4 HA SER 4 -6.520 -2.978 -14.522 30 HB2 SER 4 HB2 SER 4 -5.504 -1.183 -15.876 31 HB3 SER 4 HB3 SER 4 -4.380 -0.803 -14.576 32 HG SER 4 HG SER 4 -3.142 -2.367 -15.225 33 H VAL 5 H VAL 5 -5.271 -4.701 -13.777 34 HA VAL 5 HA VAL 5 -3.402 -4.290 -11.502 35 HB VAL 5 HB VAL 5 -5.297 -6.671 -11.856 36 HG11 VAL 5 HG11 VAL 5 -3.077 -6.317 -9.784 37 HG12 VAL 5 HG12 VAL 5 -3.089 -7.504 -11.093 38 HG13 VAL 5 HG13 VAL 5 -4.270 -7.618 -9.788 39 HG21 VAL 5 HG21 VAL 5 -6.186 -6.015 -9.631 40 HG22 VAL 5 HG22 VAL 5 -6.383 -4.716 -10.810 41 HG23 VAL 5 HG23 VAL 5 -5.094 -4.625 -9.607 42 H ASP 6 H ASP 6 -1.415 -4.754 -12.115 43 HA ASP 6 HA ASP 6 -0.839 -6.784 -14.203 44 HB2 ASP 6 HB2 ASP 6 0.646 -4.183 -13.595 45 HB3 ASP 6 HB3 ASP 6 1.135 -5.367 -14.802 46 H LYS 7 H LYS 7 0.581 -8.406 -13.573 47 HA LYS 7 HA LYS 7 2.296 -7.982 -11.191 48 HB2 LYS 7 HB2 LYS 7 0.220 -9.219 -10.523 49 HB3 LYS 7 HB3 LYS 7 0.632 -10.499 -11.662 50 HG2 LYS 7 HG2 LYS 7 2.666 -11.018 -10.397 51 HG3 LYS 7 HG3 LYS 7 2.376 -9.650 -9.322 52 HD2 LYS 7 HD2 LYS 7 1.723 -11.699 -8.197 53 HD3 LYS 7 HD3 LYS 7 0.280 -10.740 -8.529 54 HE2 LYS 7 HE2 LYS 7 -0.088 -12.194 -10.576 55 HE3 LYS 7 HE3 LYS 7 1.228 -13.217 -10.012 56 HZ1 LYS 7 HZ1 LYS 7 -1.015 -13.990 -9.387 57 HZ2 LYS 7 HZ2 LYS 7 -1.201 -12.614 -8.421 58 HZ3 LYS 7 HZ3 LYS 7 0.001 -13.745 -8.060 59 H ASP 8 H ASP 8 4.259 -8.012 -12.082 60 HA ASP 8 HA ASP 8 5.033 -9.967 -14.127 61 HB2 ASP 8 HB2 ASP 8 6.608 -7.620 -12.966 62 HB3 ASP 8 HB3 ASP 8 7.049 -8.581 -14.377 63 H VAL 9 H VAL 9 5.143 -11.850 -12.936 64 HA VAL 9 HA VAL 9 6.339 -12.071 -10.330 65 HB VAL 9 HB VAL 9 5.590 -14.334 -12.246 66 HG11 VAL 9 HG11 VAL 9 6.935 -15.101 -10.321 67 HG12 VAL 9 HG12 VAL 9 5.273 -15.679 -10.189 68 HG13 VAL 9 HG13 VAL 9 5.808 -14.314 -9.211 69 HG21 VAL 9 HG21 VAL 9 3.654 -12.847 -11.988 70 HG22 VAL 9 HG22 VAL 9 3.819 -12.892 -10.229 71 HG23 VAL 9 HG23 VAL 9 3.370 -14.356 -11.110 72 H GLU 10 H GLU 10 7.480 -12.524 -13.614 73 HA GLU 10 HA GLU 10 9.972 -13.841 -12.994 74 HB2 GLU 10 HB2 GLU 10 10.527 -13.420 -15.359 75 HB3 GLU 10 HB3 GLU 10 8.891 -14.048 -15.195 76 HG2 GLU 10 HG2 GLU 10 8.036 -11.675 -15.399 77 HG3 GLU 10 HG3 GLU 10 9.688 -11.179 -15.772 78 H ALA 11 H ALA 11 8.872 -10.525 -13.178 79 HA ALA 11 HA ALA 11 11.583 -9.390 -12.882 80 HB1 ALA 11 HB1 ALA 11 10.518 -7.224 -13.301 81 HB2 ALA 11 HB2 ALA 11 8.917 -7.971 -13.260 82 HB3 ALA 11 HB3 ALA 11 10.047 -8.379 -14.550 83 H LEU 12 H LEU 12 9.251 -10.599 -10.873 84 HA LEU 12 HA LEU 12 8.594 -10.434 -8.722 85 HB2 LEU 12 HB2 LEU 12 11.325 -9.153 -8.339 86 HB3 LEU 12 HB3 LEU 12 10.336 -9.849 -7.063 87 HG LEU 12 HG LEU 12 11.610 -11.380 -9.372 88 HD11 LEU 12 HD11 LEU 12 12.995 -12.438 -7.636 89 HD12 LEU 12 HD12 LEU 12 12.271 -11.401 -6.404 90 HD13 LEU 12 HD13 LEU 12 13.255 -10.695 -7.691 91 HD21 LEU 12 HD21 LEU 12 10.776 -13.417 -8.248 92 HD22 LEU 12 HD22 LEU 12 9.462 -12.382 -8.797 93 HD23 LEU 12 HD23 LEU 12 9.899 -12.416 -7.087 94 H SER 13 H SER 13 7.736 -8.235 -10.376 95 HA SER 13 HA SER 13 7.364 -6.108 -8.335 96 HB2 SER 13 HB2 SER 13 7.115 -4.508 -10.267 97 HB3 SER 13 HB3 SER 13 8.719 -5.215 -10.153 98 HG SER 13 HG SER 13 6.868 -5.417 -12.148 99 H PHE 14 H PHE 14 5.292 -5.644 -7.797 100 HA PHE 14 HA PHE 14 3.044 -6.726 -9.416 101 HB2 PHE 14 HB2 PHE 14 3.277 -7.942 -7.297 102 HB3 PHE 14 HB3 PHE 14 3.319 -6.438 -6.384 103 HD1 PHE 14 HD1 PHE 14 0.990 -7.714 -9.070 104 HD2 PHE 14 HD2 PHE 14 1.398 -6.355 -5.031 105 HE1 PHE 14 HE1 PHE 14 -1.439 -7.898 -8.758 106 HE2 PHE 14 HE2 PHE 14 -1.033 -6.541 -4.735 107 HZ PHE 14 HZ PHE 14 -2.450 -7.309 -6.588 108 H SER 15 H SER 15 2.243 -5.026 -10.493 109 HA SER 15 HA SER 15 2.156 -2.328 -9.262 110 HB2 SER 15 HB2 SER 15 2.209 -1.502 -11.651 111 HB3 SER 15 HB3 SER 15 3.644 -2.403 -11.177 112 HG SER 15 HG SER 15 1.708 -4.005 -12.241 113 H ILE 16 H ILE 16 0.108 -1.897 -8.533 114 HA ILE 16 HA ILE 16 -2.243 -2.651 -10.181 115 HB ILE 16 HB ILE 16 -2.163 -1.551 -7.329 116 HG12 ILE 16 HG12 ILE 16 -2.784 -4.385 -8.277 117 HG13 ILE 16 HG13 ILE 16 -1.271 -3.890 -7.524 118 HG21 ILE 16 HG21 ILE 16 -4.543 -2.574 -8.943 119 HG22 ILE 16 HG22 ILE 16 -4.251 -0.898 -8.478 120 HG23 ILE 16 HG23 ILE 16 -4.591 -2.106 -7.241 121 HD11 ILE 16 HD11 ILE 16 -2.731 -5.027 -5.955 122 HD12 ILE 16 HD12 ILE 16 -3.992 -3.826 -6.220 123 HD13 ILE 16 HD13 ILE 16 -2.465 -3.354 -5.467 124 H VAL 17 H VAL 17 -3.142 -1.138 -11.420 125 HA VAL 17 HA VAL 17 -2.463 1.711 -11.092 126 HB VAL 17 HB VAL 17 -3.721 0.301 -13.488 127 HG11 VAL 17 HG11 VAL 17 -2.528 3.094 -13.259 128 HG12 VAL 17 HG12 VAL 17 -4.244 2.714 -13.418 129 HG13 VAL 17 HG13 VAL 17 -3.136 2.358 -14.743 130 HG21 VAL 17 HG21 VAL 17 -1.446 -0.566 -13.116 131 HG22 VAL 17 HG22 VAL 17 -0.809 1.081 -13.074 132 HG23 VAL 17 HG23 VAL 17 -1.495 0.440 -14.568 133 H ALA 18 H ALA 18 -3.955 2.940 -10.175 134 HA ALA 18 HA ALA 18 -6.852 2.310 -10.364 135 HB1 ALA 18 HB1 ALA 18 -5.352 3.355 -7.921 136 HB2 ALA 18 HB2 ALA 18 -5.997 1.723 -8.120 137 HB3 ALA 18 HB3 ALA 18 -7.098 3.097 -8.031 138 H GLU 19 H GLU 19 -8.243 4.157 -10.519 139 HA GLU 19 HA GLU 19 -6.975 6.833 -10.688 140 HB2 GLU 19 HB2 GLU 19 -8.840 5.591 -12.752 141 HB3 GLU 19 HB3 GLU 19 -8.533 7.324 -12.660 142 HG2 GLU 19 HG2 GLU 19 -6.134 6.931 -13.069 143 HG3 GLU 19 HG3 GLU 19 -6.426 5.193 -13.137 144 H PHE 20 H PHE 20 -8.018 8.350 -9.607 145 HA PHE 20 HA PHE 20 -10.798 7.922 -8.648 146 HB2 PHE 20 HB2 PHE 20 -8.488 9.139 -7.046 147 HB3 PHE 20 HB3 PHE 20 -10.143 8.928 -6.472 148 HD1 PHE 20 HD1 PHE 20 -11.067 6.532 -6.290 149 HD2 PHE 20 HD2 PHE 20 -6.898 7.371 -6.789 150 HE1 PHE 20 HE1 PHE 20 -10.510 4.268 -5.514 151 HE2 PHE 20 HE2 PHE 20 -6.359 5.105 -6.013 152 HZ PHE 20 HZ PHE 20 -8.161 3.555 -5.381 153 H ASP 21 H ASP 21 -12.145 9.660 -8.828 154 HA ASP 21 HA ASP 21 -11.258 11.907 -10.417 155 HB2 ASP 21 HB2 ASP 21 -13.676 12.614 -10.296 156 HB3 ASP 21 HB3 ASP 21 -13.414 11.015 -10.969 157 H ALA 22 H ALA 22 -9.776 12.897 -9.113 158 HA ALA 22 HA ALA 22 -10.632 14.990 -7.353 159 HB1 ALA 22 HB1 ALA 22 -9.391 14.243 -5.326 160 HB2 ALA 22 HB2 ALA 22 -9.018 12.708 -6.120 161 HB3 ALA 22 HB3 ALA 22 -10.688 13.112 -5.726 162 H ASP 23 H ASP 23 -8.284 15.738 -6.201 163 HA ASP 23 HA ASP 23 -6.361 15.991 -8.438 164 HB2 ASP 23 HB2 ASP 23 -5.446 17.927 -7.129 165 HB3 ASP 23 HB3 ASP 23 -7.107 18.138 -7.646 166 H VAL 24 H VAL 24 -4.106 16.002 -7.919 167 HA VAL 24 HA VAL 24 -3.142 13.672 -6.783 168 HB VAL 24 HB VAL 24 -1.617 16.261 -7.301 169 HG11 VAL 24 HG11 VAL 24 0.416 14.831 -7.536 170 HG12 VAL 24 HG12 VAL 24 -0.522 13.430 -7.013 171 HG13 VAL 24 HG13 VAL 24 -0.249 14.773 -5.900 172 HG21 VAL 24 HG21 VAL 24 -2.048 13.866 -9.110 173 HG22 VAL 24 HG22 VAL 24 -1.049 15.275 -9.480 174 HG23 VAL 24 HG23 VAL 24 -2.793 15.457 -9.290 175 H LYS 25 H LYS 25 -3.466 16.852 -5.317 176 HA LYS 25 HA LYS 25 -1.868 16.424 -2.982 177 HB2 LYS 25 HB2 LYS 25 -4.193 18.390 -3.268 178 HB3 LYS 25 HB3 LYS 25 -2.808 18.525 -2.190 179 HG2 LYS 25 HG2 LYS 25 -2.700 18.683 -5.222 180 HG3 LYS 25 HG3 LYS 25 -2.693 20.072 -4.129 181 HD2 LYS 25 HD2 LYS 25 -0.534 19.312 -3.178 182 HD3 LYS 25 HD3 LYS 25 -0.559 17.896 -4.239 183 HE2 LYS 25 HE2 LYS 25 0.918 19.642 -5.140 184 HE3 LYS 25 HE3 LYS 25 -0.452 19.370 -6.217 185 HZ1 LYS 25 HZ1 LYS 25 -1.501 21.336 -5.352 186 HZ2 LYS 25 HZ2 LYS 25 0.049 21.723 -5.905 187 HZ3 LYS 25 HZ3 LYS 25 -0.247 21.580 -4.248 188 H ARG 26 H ARG 26 -5.292 16.013 -3.750 189 HA ARG 26 HA ARG 26 -6.265 15.435 -1.129 190 HB2 ARG 26 HB2 ARG 26 -7.678 16.243 -3.054 191 HB3 ARG 26 HB3 ARG 26 -7.492 14.666 -3.810 192 HG2 ARG 26 HG2 ARG 26 -9.646 14.736 -2.731 193 HG3 ARG 26 HG3 ARG 26 -8.615 13.627 -1.820 194 HD2 ARG 26 HD2 ARG 26 -8.138 15.535 -0.221 195 HD3 ARG 26 HD3 ARG 26 -9.359 16.482 -1.076 196 HE ARG 26 HE ARG 26 -9.786 14.177 0.673 197 HH11 ARG 26 HH11 ARG 26 -11.278 16.485 -1.445 198 HH12 ARG 26 HH12 ARG 26 -12.833 16.270 -0.724 199 HH21 ARG 26 HH21 ARG 26 -11.755 13.944 1.562 200 HH22 ARG 26 HH22 ARG 26 -13.098 14.849 0.962 201 H VAL 27 H VAL 27 -5.305 13.384 -3.873 202 HA VAL 27 HA VAL 27 -5.822 10.872 -2.557 203 HB VAL 27 HB VAL 27 -4.129 11.313 -5.060 204 HG11 VAL 27 HG11 VAL 27 -3.904 9.042 -4.118 205 HG12 VAL 27 HG12 VAL 27 -4.803 8.984 -5.635 206 HG13 VAL 27 HG13 VAL 27 -5.663 8.855 -4.097 207 HG21 VAL 27 HG21 VAL 27 -7.148 10.911 -4.885 208 HG22 VAL 27 HG22 VAL 27 -6.205 10.934 -6.378 209 HG23 VAL 27 HG23 VAL 27 -6.324 12.391 -5.390 210 H TRP 28 H TRP 28 -2.980 12.957 -2.890 211 HA TRP 28 HA TRP 28 -1.040 11.254 -1.716 212 HB2 TRP 28 HB2 TRP 28 -0.479 13.354 -2.917 213 HB3 TRP 28 HB3 TRP 28 -1.217 14.293 -1.632 214 HD1 TRP 28 HD1 TRP 28 0.418 15.053 0.281 215 HE1 TRP 28 HE1 TRP 28 2.842 14.490 0.925 216 HE3 TRP 28 HE3 TRP 28 1.252 11.165 -2.955 217 HZ2 TRP 28 HZ2 TRP 28 4.850 12.647 0.146 218 HZ3 TRP 28 HZ3 TRP 28 3.452 10.072 -2.946 219 HH2 TRP 28 HH2 TRP 28 5.213 10.800 -1.421 220 H ALA 29 H ALA 29 -3.472 13.402 -0.324 221 HA ALA 29 HA ALA 29 -2.631 13.535 2.340 222 HB1 ALA 29 HB1 ALA 29 -4.932 14.202 2.855 223 HB2 ALA 29 HB2 ALA 29 -5.477 13.588 1.292 224 HB3 ALA 29 HB3 ALA 29 -4.382 14.969 1.363 225 H ILE 30 H ILE 30 -4.442 10.939 0.702 226 HA ILE 30 HA ILE 30 -5.247 9.553 3.103 227 HB ILE 30 HB ILE 30 -6.093 7.793 1.717 228 HG12 ILE 30 HG12 ILE 30 -4.373 8.899 -0.539 229 HG13 ILE 30 HG13 ILE 30 -4.112 7.385 0.300 230 HG21 ILE 30 HG21 ILE 30 -7.493 8.996 0.077 231 HG22 ILE 30 HG22 ILE 30 -6.439 10.407 0.202 232 HG23 ILE 30 HG23 ILE 30 -7.385 9.883 1.599 233 HD11 ILE 30 HD11 ILE 30 -6.224 6.548 -0.650 234 HD12 ILE 30 HD12 ILE 30 -5.020 6.985 -1.863 235 HD13 ILE 30 HD13 ILE 30 -6.379 8.062 -1.549 236 H TRP 31 H TRP 31 -2.228 9.766 1.544 237 HA TRP 31 HA TRP 31 -1.159 7.322 2.835 238 HB2 TRP 31 HB2 TRP 31 0.038 9.208 0.752 239 HB3 TRP 31 HB3 TRP 31 0.922 7.867 1.481 240 HD1 TRP 31 HD1 TRP 31 -1.547 8.618 -1.303 241 HE1 TRP 31 HE1 TRP 31 -2.119 6.431 -2.533 242 HE3 TRP 31 HE3 TRP 31 0.587 5.272 1.934 243 HZ2 TRP 31 HZ2 TRP 31 -1.712 3.660 -2.184 244 HZ3 TRP 31 HZ3 TRP 31 0.452 2.871 1.415 245 HH2 TRP 31 HH2 TRP 31 -0.686 2.076 -0.595 246 H GLU 32 H GLU 32 -0.870 10.819 2.712 247 HA GLU 32 HA GLU 32 1.467 11.100 4.319 248 HB2 GLU 32 HB2 GLU 32 0.834 12.761 2.635 249 HB3 GLU 32 HB3 GLU 32 -0.676 13.098 3.483 250 HG2 GLU 32 HG2 GLU 32 0.645 13.969 5.409 251 HG3 GLU 32 HG3 GLU 32 2.128 13.689 4.492 252 H ASP 33 H ASP 33 -1.995 11.698 4.948 253 HA ASP 33 HA ASP 33 -1.614 12.302 7.751 254 HB2 ASP 33 HB2 ASP 33 -3.360 13.382 6.267 255 HB3 ASP 33 HB3 ASP 33 -4.200 11.842 6.193 256 HA PRO 34 HA PRO 34 -1.532 7.896 8.904 257 HB2 PRO 34 HB2 PRO 34 -2.173 8.970 11.644 258 HB3 PRO 34 HB3 PRO 34 -0.854 7.907 11.129 259 HG2 PRO 34 HG2 PRO 34 -0.368 10.471 11.692 260 HG3 PRO 34 HG3 PRO 34 0.441 9.684 10.319 261 HD2 PRO 34 HD2 PRO 34 -1.921 11.566 10.302 262 HD3 PRO 34 HD3 PRO 34 -0.509 11.518 9.222 263 H ARG 35 H ARG 35 -4.169 10.048 9.932 264 HA ARG 35 HA ARG 35 -5.979 7.945 10.725 265 HB2 ARG 35 HB2 ARG 35 -6.445 10.918 10.292 266 HB3 ARG 35 HB3 ARG 35 -7.715 9.815 10.800 267 HG2 ARG 35 HG2 ARG 35 -6.906 10.998 12.732 268 HG3 ARG 35 HG3 ARG 35 -6.412 9.312 12.869 269 HD2 ARG 35 HD2 ARG 35 -4.630 10.896 13.575 270 HD3 ARG 35 HD3 ARG 35 -4.130 9.889 12.214 271 HE ARG 35 HE ARG 35 -4.912 12.003 10.867 272 HH11 ARG 35 HH11 ARG 35 -3.153 12.079 13.838 273 HH12 ARG 35 HH12 ARG 35 -2.339 13.538 13.412 274 HH21 ARG 35 HH21 ARG 35 -3.839 13.821 10.367 275 HH22 ARG 35 HH22 ARG 35 -2.720 14.510 11.483 276 H GLN 36 H GLN 36 -5.620 10.045 7.867 277 HA GLN 36 HA GLN 36 -7.863 8.972 6.424 278 HB2 GLN 36 HB2 GLN 36 -5.471 10.640 5.558 279 HB3 GLN 36 HB3 GLN 36 -6.717 10.126 4.422 280 HG2 GLN 36 HG2 GLN 36 -8.421 11.347 5.693 281 HG3 GLN 36 HG3 GLN 36 -7.219 11.811 6.898 282 HE21 GLN 36 HE21 GLN 36 -8.932 13.453 5.106 283 HE22 GLN 36 HE22 GLN 36 -7.842 14.491 4.264 284 H LEU 37 H LEU 37 -4.534 7.913 6.799 285 HA LEU 37 HA LEU 37 -4.566 6.041 4.598 286 HB2 LEU 37 HB2 LEU 37 -2.447 6.902 5.413 287 HB3 LEU 37 HB3 LEU 37 -2.762 6.283 7.026 288 HG LEU 37 HG LEU 37 -2.553 3.949 6.189 289 HD11 LEU 37 HD11 LEU 37 -1.736 3.426 3.945 290 HD12 LEU 37 HD12 LEU 37 -1.817 5.139 3.497 291 HD13 LEU 37 HD13 LEU 37 -3.301 4.251 3.861 292 HD21 LEU 37 HD21 LEU 37 -0.578 5.083 7.078 293 HD22 LEU 37 HD22 LEU 37 -0.174 5.681 5.465 294 HD23 LEU 37 HD23 LEU 37 -0.143 3.943 5.803 295 H GLU 38 H GLU 38 -4.893 5.669 8.168 296 HA GLU 38 HA GLU 38 -5.400 2.856 8.109 297 HB2 GLU 38 HB2 GLU 38 -5.911 3.061 10.477 298 HB3 GLU 38 HB3 GLU 38 -4.536 4.074 10.101 299 HG2 GLU 38 HG2 GLU 38 -5.659 5.527 11.460 300 HG3 GLU 38 HG3 GLU 38 -6.404 5.974 9.932 301 H ARG 39 H ARG 39 -7.357 5.545 7.423 302 HA ARG 39 HA ARG 39 -9.969 4.777 7.911 303 HB2 ARG 39 HB2 ARG 39 -9.225 7.012 7.170 304 HB3 ARG 39 HB3 ARG 39 -8.797 6.371 5.594 305 HG2 ARG 39 HG2 ARG 39 -10.841 7.553 5.337 306 HG3 ARG 39 HG3 ARG 39 -11.241 5.838 5.240 307 HD2 ARG 39 HD2 ARG 39 -11.544 7.494 7.764 308 HD3 ARG 39 HD3 ARG 39 -12.835 7.265 6.591 309 HE ARG 39 HE ARG 39 -11.675 5.212 8.355 310 HH11 ARG 39 HH11 ARG 39 -14.203 6.110 6.170 311 HH12 ARG 39 HH12 ARG 39 -15.112 4.680 6.497 312 HH21 ARG 39 HH21 ARG 39 -12.837 3.401 8.721 313 HH22 ARG 39 HH22 ARG 39 -14.365 3.175 7.944 314 H TRP 40 H TRP 40 -7.819 3.784 5.270 315 HA TRP 40 HA TRP 40 -9.918 1.969 4.201 316 HB2 TRP 40 HB2 TRP 40 -9.052 2.412 1.912 317 HB3 TRP 40 HB3 TRP 40 -9.695 3.859 2.679 318 HD1 TRP 40 HD1 TRP 40 -7.882 5.764 3.414 319 HE1 TRP 40 HE1 TRP 40 -5.516 6.270 2.557 320 HE3 TRP 40 HE3 TRP 40 -6.938 1.372 1.012 321 HZ2 TRP 40 HZ2 TRP 40 -3.523 4.993 1.022 322 HZ3 TRP 40 HZ3 TRP 40 -4.788 1.085 -0.139 323 HH2 TRP 40 HH2 TRP 40 -3.122 2.858 -0.129 324 H TRP 41 H TRP 41 -6.809 2.118 5.530 325 HA TRP 41 HA TRP 41 -5.370 0.339 3.838 326 HB2 TRP 41 HB2 TRP 41 -4.381 2.001 5.520 327 HB3 TRP 41 HB3 TRP 41 -4.747 0.829 6.782 328 HD1 TRP 41 HD1 TRP 41 -2.664 -0.638 7.353 329 HE1 TRP 41 HE1 TRP 41 -0.587 -1.456 6.089 330 HE3 TRP 41 HE3 TRP 41 -3.645 1.340 2.720 331 HZ2 TRP 41 HZ2 TRP 41 0.490 -1.287 3.517 332 HZ3 TRP 41 HZ3 TRP 41 -2.045 0.940 0.918 333 HH2 TRP 41 HH2 TRP 41 -0.009 -0.350 1.300 334 H GLY 42 H GLY 42 -6.064 -1.663 3.457 335 HA2 GLY 42 HA2 GLY 42 -6.185 -3.979 4.099 336 HA3 GLY 42 HA3 GLY 42 -6.808 -3.499 5.672 337 HA PRO 43 HA PRO 43 -10.381 -4.471 2.627 338 HB2 PRO 43 HB2 PRO 43 -11.125 -6.963 3.481 339 HB3 PRO 43 HB3 PRO 43 -9.857 -6.737 2.265 340 HG2 PRO 43 HG2 PRO 43 -9.575 -7.216 5.236 341 HG3 PRO 43 HG3 PRO 43 -8.699 -7.992 3.898 342 HD2 PRO 43 HD2 PRO 43 -7.628 -5.929 5.342 343 HD3 PRO 43 HD3 PRO 43 -7.251 -6.169 3.622 344 HA PRO 44 HA PRO 44 -13.627 -3.071 5.441 345 HB2 PRO 44 HB2 PRO 44 -15.289 -5.408 4.451 346 HB3 PRO 44 HB3 PRO 44 -15.741 -3.703 4.618 347 HG2 PRO 44 HG2 PRO 44 -15.148 -4.653 2.217 348 HG3 PRO 44 HG3 PRO 44 -14.522 -3.061 2.703 349 HD2 PRO 44 HD2 PRO 44 -13.075 -5.703 2.551 350 HD3 PRO 44 HD3 PRO 44 -12.496 -4.077 2.131 351 H THR 45 H THR 45 -12.788 -6.502 5.620 352 HA THR 45 HA THR 45 -13.986 -6.879 8.273 353 HB THR 45 HB THR 45 -13.125 -9.252 8.055 354 HG1 THR 45 HG1 THR 45 -11.808 -9.739 6.460 355 HG21 THR 45 HG21 THR 45 -14.715 -9.950 6.305 356 HG22 THR 45 HG22 THR 45 -14.813 -8.291 5.712 357 HG23 THR 45 HG23 THR 45 -15.426 -8.689 7.319 358 H TRP 46 H TRP 46 -10.813 -6.204 6.937 359 HA TRP 46 HA TRP 46 -9.596 -6.383 9.651 360 HB2 TRP 46 HB2 TRP 46 -8.268 -7.062 6.983 361 HB3 TRP 46 HB3 TRP 46 -7.390 -6.896 8.497 362 HD1 TRP 46 HD1 TRP 46 -10.226 -9.147 7.028 363 HE1 TRP 46 HE1 TRP 46 -10.020 -11.466 8.104 364 HE3 TRP 46 HE3 TRP 46 -6.316 -8.255 10.188 365 HZ2 TRP 46 HZ2 TRP 46 -8.433 -12.770 10.000 366 HZ3 TRP 46 HZ3 TRP 46 -5.497 -10.104 11.593 367 HH2 TRP 46 HH2 TRP 46 -6.528 -12.321 11.501 368 HA PRO 47 HA PRO 47 -8.920 -1.963 8.162 369 HB2 PRO 47 HB2 PRO 47 -10.012 -0.671 10.300 370 HB3 PRO 47 HB3 PRO 47 -10.996 -1.223 8.935 371 HG2 PRO 47 HG2 PRO 47 -10.568 -2.551 11.616 372 HG3 PRO 47 HG3 PRO 47 -12.090 -2.302 10.731 373 HD2 PRO 47 HD2 PRO 47 -10.740 -4.680 10.684 374 HD3 PRO 47 HD3 PRO 47 -11.704 -4.110 9.306 375 H ALA 48 H ALA 48 -6.918 -1.135 8.596 376 HA ALA 48 HA ALA 48 -5.356 -2.148 10.830 377 HB1 ALA 48 HB1 ALA 48 -4.558 -0.222 8.626 378 HB2 ALA 48 HB2 ALA 48 -4.353 -1.973 8.593 379 HB3 ALA 48 HB3 ALA 48 -3.465 -1.007 9.772 380 H THR 49 H THR 49 -4.700 -1.035 12.595 381 HA THR 49 HA THR 49 -5.368 1.839 12.925 382 HB THR 49 HB THR 49 -5.089 -0.333 15.061 383 HG1 THR 49 HG1 THR 49 -7.208 0.606 13.651 384 HG21 THR 49 HG21 THR 49 -5.767 1.400 16.697 385 HG22 THR 49 HG22 THR 49 -5.703 2.625 15.430 386 HG23 THR 49 HG23 THR 49 -4.224 1.805 15.940 387 H PHE 50 H PHE 50 -3.613 3.130 12.868 388 HA PHE 50 HA PHE 50 -0.935 1.978 12.941 389 HB2 PHE 50 HB2 PHE 50 -2.041 4.645 12.034 390 HB3 PHE 50 HB3 PHE 50 -0.315 4.483 12.349 391 HD1 PHE 50 HD1 PHE 50 -3.094 2.870 10.400 392 HD2 PHE 50 HD2 PHE 50 1.105 3.660 10.649 393 HE1 PHE 50 HE1 PHE 50 -2.768 1.858 8.186 394 HE2 PHE 50 HE2 PHE 50 1.422 2.644 8.436 395 HZ PHE 50 HZ PHE 50 -0.513 1.742 7.202 396 H GLU 51 H GLU 51 0.126 1.770 14.729 397 HA GLU 51 HA GLU 51 -0.157 3.263 17.151 398 HB2 GLU 51 HB2 GLU 51 2.166 1.540 16.193 399 HB3 GLU 51 HB3 GLU 51 1.848 2.008 17.864 400 HG2 GLU 51 HG2 GLU 51 -0.138 0.631 17.942 401 HG3 GLU 51 HG3 GLU 51 -0.048 0.317 16.211 402 H THR 52 H THR 52 2.088 3.356 14.426 403 HA THR 52 HA THR 52 2.878 6.106 15.118 404 HB THR 52 HB THR 52 4.942 3.937 14.469 405 HG1 THR 52 HG1 THR 52 4.894 5.164 16.983 406 HG21 THR 52 HG21 THR 52 5.646 6.219 13.821 407 HG22 THR 52 HG22 THR 52 6.590 5.629 15.191 408 HG23 THR 52 HG23 THR 52 5.285 6.787 15.454 409 H HIS 53 H HIS 53 3.455 7.349 13.285 410 HA HIS 53 HA HIS 53 3.994 6.147 10.699 411 HB2 HIS 53 HB2 HIS 53 1.497 6.136 10.779 412 HB3 HIS 53 HB3 HIS 53 1.488 7.867 11.086 413 HD2 HIS 53 HD2 HIS 53 1.771 5.373 8.131 414 HE1 HIS 53 HE1 HIS 53 1.843 9.314 6.620 415 HE2 HIS 53 HE2 HIS 53 1.448 6.891 6.064 416 H GLU 54 H GLU 54 5.920 7.271 10.504 417 HA GLU 54 HA GLU 54 6.199 10.020 11.393 418 HB2 GLU 54 HB2 GLU 54 8.169 8.155 10.014 419 HB3 GLU 54 HB3 GLU 54 8.563 9.774 10.590 420 HG2 GLU 54 HG2 GLU 54 7.864 9.005 12.906 421 HG3 GLU 54 HG3 GLU 54 7.782 7.367 12.257 422 H PHE 55 H PHE 55 6.224 8.349 8.275 423 HA PHE 55 HA PHE 55 6.189 8.956 6.117 424 HB2 PHE 55 HB2 PHE 55 3.967 9.955 7.063 425 HB3 PHE 55 HB3 PHE 55 4.742 11.519 6.859 426 HD1 PHE 55 HD1 PHE 55 3.721 8.432 5.028 427 HD2 PHE 55 HD2 PHE 55 4.787 12.559 4.667 428 HE1 PHE 55 HE1 PHE 55 3.067 8.393 2.661 429 HE2 PHE 55 HE2 PHE 55 4.119 12.508 2.299 430 HZ PHE 55 HZ PHE 55 3.262 10.426 1.298 431 H THR 56 H THR 56 8.598 9.346 6.919 432 HA THR 56 HA THR 56 9.536 11.776 5.544 433 HB THR 56 HB THR 56 9.691 12.393 7.908 434 HG1 THR 56 HG1 THR 56 11.501 13.296 7.294 435 HG21 THR 56 HG21 THR 56 9.753 10.153 8.950 436 HG22 THR 56 HG22 THR 56 11.093 11.151 9.520 437 HG23 THR 56 HG23 THR 56 11.381 9.897 8.311 438 H VAL 57 H VAL 57 11.932 11.610 5.029 439 HA VAL 57 HA VAL 57 12.386 9.160 3.579 440 HB VAL 57 HB VAL 57 14.125 11.649 3.948 441 HG11 VAL 57 HG11 VAL 57 15.570 9.742 3.339 442 HG12 VAL 57 HG12 VAL 57 15.459 10.888 2.003 443 HG13 VAL 57 HG13 VAL 57 14.536 9.386 1.955 444 HG21 VAL 57 HG21 VAL 57 13.362 12.247 1.646 445 HG22 VAL 57 HG22 VAL 57 12.013 12.128 2.779 446 HG23 VAL 57 HG23 VAL 57 12.320 10.818 1.635 447 H GLY 58 H GLY 58 12.960 7.366 4.698 448 HA2 GLY 58 HA2 GLY 58 14.597 6.019 5.789 449 HA3 GLY 58 HA3 GLY 58 15.230 7.438 6.606 450 H GLY 59 H GLY 59 11.955 7.706 6.861 451 HA2 GLY 59 HA2 GLY 59 11.936 6.923 9.675 452 HA3 GLY 59 HA3 GLY 59 10.684 7.797 8.814 453 H LYS 60 H LYS 60 9.840 5.911 10.537 454 HA LYS 60 HA LYS 60 8.992 3.621 8.846 455 HB2 LYS 60 HB2 LYS 60 9.777 3.579 11.792 456 HB3 LYS 60 HB3 LYS 60 8.933 2.254 10.988 457 HG2 LYS 60 HG2 LYS 60 10.869 2.115 9.367 458 HG3 LYS 60 HG3 LYS 60 11.729 3.276 10.384 459 HD2 LYS 60 HD2 LYS 60 11.723 1.710 12.258 460 HD3 LYS 60 HD3 LYS 60 10.673 0.595 11.379 461 HE2 LYS 60 HE2 LYS 60 12.935 -0.267 11.312 462 HE3 LYS 60 HE3 LYS 60 12.509 0.280 9.692 463 HZ1 LYS 60 HZ1 LYS 60 14.704 1.008 10.174 464 HZ2 LYS 60 HZ2 LYS 60 14.241 1.670 11.661 465 HZ3 LYS 60 HZ3 LYS 60 13.709 2.376 10.220 466 H ALA 61 H ALA 61 7.075 2.459 9.772 467 HA ALA 61 HA ALA 61 5.190 4.052 11.349 468 HB1 ALA 61 HB1 ALA 61 4.423 2.958 8.606 469 HB2 ALA 61 HB2 ALA 61 4.666 4.659 8.999 470 HB3 ALA 61 HB3 ALA 61 3.342 3.766 9.748 471 H ALA 62 H ALA 62 3.895 2.793 12.630 472 HA ALA 62 HA ALA 62 4.154 -0.169 12.478 473 HB1 ALA 62 HB1 ALA 62 3.865 -0.168 14.945 474 HB2 ALA 62 HB2 ALA 62 3.804 1.600 14.939 475 HB3 ALA 62 HB3 ALA 62 5.283 0.766 14.459 476 H TYR 63 H TYR 63 2.244 -1.359 12.526 477 HA TYR 63 HA TYR 63 -0.272 -0.197 13.385 478 HB2 TYR 63 HB2 TYR 63 -1.474 -0.441 11.253 479 HB3 TYR 63 HB3 TYR 63 -0.149 0.694 11.085 480 HD1 TYR 63 HD1 TYR 63 1.882 0.066 9.744 481 HD2 TYR 63 HD2 TYR 63 -1.519 -2.521 9.953 482 HE1 TYR 63 HE1 TYR 63 2.685 -1.150 7.770 483 HE2 TYR 63 HE2 TYR 63 -0.711 -3.741 7.980 484 HH TYR 63 HH TYR 63 2.444 -3.281 6.676 485 H TYR 64 H TYR 64 -2.139 -1.733 12.949 486 HA TYR 64 HA TYR 64 -1.494 -4.535 12.495 487 HB2 TYR 64 HB2 TYR 64 -2.691 -5.266 14.617 488 HB3 TYR 64 HB3 TYR 64 -1.132 -4.505 14.878 489 HD1 TYR 64 HD2 TYR 64 -1.015 -2.151 15.808 490 HD2 TYR 64 HD1 TYR 64 -4.734 -4.257 15.516 491 HE1 TYR 64 HE2 TYR 64 -2.040 -0.573 17.380 492 HE2 TYR 64 HE1 TYR 64 -5.751 -2.667 17.088 493 HH TYR 64 HH TYR 64 -4.188 0.260 18.032 494 H MET 65 H MET 65 -3.141 -5.552 11.440 495 HA MET 65 HA MET 65 -5.601 -4.086 10.846 496 HB2 MET 65 HB2 MET 65 -4.543 -6.761 9.835 497 HB3 MET 65 HB3 MET 65 -6.053 -6.030 9.304 498 HG2 MET 65 HG2 MET 65 -4.812 -4.105 8.405 499 HG3 MET 65 HG3 MET 65 -3.293 -4.834 8.928 500 HE1 MET 65 HE1 MET 65 -2.281 -7.074 7.856 501 HE2 MET 65 HE2 MET 65 -3.100 -8.008 6.608 502 HE3 MET 65 HE3 MET 65 -3.768 -7.948 8.238 503 H THR 66 H THR 66 -7.156 -4.185 12.362 504 HA THR 66 HA THR 66 -7.430 -6.404 14.215 505 HB THR 66 HB THR 66 -9.196 -3.931 13.912 506 HG1 THR 66 HG1 THR 66 -7.159 -3.241 14.461 507 HG21 THR 66 HG21 THR 66 -8.899 -5.873 16.248 508 HG22 THR 66 HG22 THR 66 -10.308 -5.757 15.192 509 HG23 THR 66 HG23 THR 66 -9.887 -4.407 16.249 510 H GLY 67 H GLY 67 -8.203 -8.219 13.267 511 HA2 GLY 67 HA2 GLY 67 -10.050 -8.332 11.100 512 HA3 GLY 67 HA3 GLY 67 -9.453 -9.685 12.037 513 HA PRO 68 HA PRO 68 -14.093 -8.876 12.834 514 HB2 PRO 68 HB2 PRO 68 -15.065 -11.279 11.917 515 HB3 PRO 68 HB3 PRO 68 -14.812 -9.884 10.861 516 HG2 PRO 68 HG2 PRO 68 -13.009 -12.271 11.303 517 HG3 PRO 68 HG3 PRO 68 -13.492 -11.508 9.770 518 HD2 PRO 68 HD2 PRO 68 -11.091 -10.997 10.931 519 HD3 PRO 68 HD3 PRO 68 -11.969 -9.747 10.024 520 H ASP 69 H ASP 69 -11.909 -11.529 13.509 521 HA ASP 69 HA ASP 69 -13.370 -12.555 15.809 522 HB2 ASP 69 HB2 ASP 69 -10.529 -13.195 14.902 523 HB3 ASP 69 HB3 ASP 69 -11.545 -14.160 15.976 524 H GLY 70 H GLY 70 -11.703 -9.772 15.410 525 HA2 GLY 70 HA2 GLY 70 -10.701 -8.286 16.870 526 HA3 GLY 70 HA3 GLY 70 -10.757 -9.500 18.138 527 H THR 71 H THR 71 -9.393 -10.872 15.411 528 HA THR 71 HA THR 71 -6.825 -11.200 16.583 529 HB THR 71 HB THR 71 -7.666 -11.798 13.700 530 HG1 THR 71 HG1 THR 71 -7.513 -13.966 15.292 531 HG21 THR 71 HG21 THR 71 -5.362 -12.926 15.359 532 HG22 THR 71 HG22 THR 71 -5.202 -11.842 13.974 533 HG23 THR 71 HG23 THR 71 -5.831 -13.473 13.748 534 H LYS 72 H LYS 72 -5.439 -9.520 16.757 535 HA LYS 72 HA LYS 72 -5.232 -7.398 14.780 536 HB2 LYS 72 HB2 LYS 72 -3.665 -7.934 17.343 537 HB3 LYS 72 HB3 LYS 72 -3.486 -6.492 16.343 538 HG2 LYS 72 HG2 LYS 72 -5.794 -5.838 16.802 539 HG3 LYS 72 HG3 LYS 72 -6.062 -7.323 17.722 540 HD2 LYS 72 HD2 LYS 72 -4.419 -6.613 19.405 541 HD3 LYS 72 HD3 LYS 72 -4.037 -5.167 18.463 542 HE2 LYS 72 HE2 LYS 72 -6.329 -4.325 18.810 543 HE3 LYS 72 HE3 LYS 72 -6.745 -5.787 19.706 544 HZ1 LYS 72 HZ1 LYS 72 -5.142 -5.193 21.381 545 HZ2 LYS 72 HZ2 LYS 72 -6.225 -3.918 21.153 546 HZ3 LYS 72 HZ3 LYS 72 -4.665 -3.828 20.510 547 H ALA 73 H ALA 73 -4.194 -7.876 12.919 548 HA ALA 73 HA ALA 73 -1.902 -9.714 12.823 549 HB1 ALA 73 HB1 ALA 73 -3.359 -8.277 10.568 550 HB2 ALA 73 HB2 ALA 73 -3.624 -9.944 11.081 551 HB3 ALA 73 HB3 ALA 73 -2.079 -9.480 10.369 552 H ARG 74 H ARG 74 -0.123 -8.709 13.612 553 HA ARG 74 HA ARG 74 0.346 -5.893 13.465 554 HB2 ARG 74 HB2 ARG 74 1.061 -7.278 15.370 555 HB3 ARG 74 HB3 ARG 74 2.192 -8.155 14.347 556 HG2 ARG 74 HG2 ARG 74 3.654 -6.265 14.160 557 HG3 ARG 74 HG3 ARG 74 2.411 -5.153 14.735 558 HD2 ARG 74 HD2 ARG 74 2.513 -6.191 16.980 559 HD3 ARG 74 HD3 ARG 74 3.764 -7.292 16.411 560 HE ARG 74 HE ARG 74 5.286 -5.479 16.307 561 HH11 ARG 74 HH11 ARG 74 2.261 -4.387 17.610 562 HH12 ARG 74 HH12 ARG 74 3.001 -3.074 18.452 563 HH21 ARG 74 HH21 ARG 74 6.179 -3.826 17.420 564 HH22 ARG 74 HH22 ARG 74 5.179 -2.767 18.354 565 H GLY 75 H GLY 75 1.341 -4.747 11.911 566 HA2 GLY 75 HA2 GLY 75 3.229 -6.032 10.015 567 HA3 GLY 75 HA3 GLY 75 1.892 -5.047 9.428 568 H TRP 76 H TRP 76 4.688 -4.576 8.990 569 HA TRP 76 HA TRP 76 5.157 -2.037 10.458 570 HB2 TRP 76 HB2 TRP 76 7.593 -2.516 10.302 571 HB3 TRP 76 HB3 TRP 76 6.754 -3.795 11.179 572 HD1 TRP 76 HD1 TRP 76 6.617 -6.222 9.967 573 HE1 TRP 76 HE1 TRP 76 7.896 -7.250 7.997 574 HE3 TRP 76 HE3 TRP 76 8.795 -1.981 8.111 575 HZ2 TRP 76 HZ2 TRP 76 9.604 -6.390 5.927 576 HZ3 TRP 76 HZ3 TRP 76 10.245 -2.159 6.134 577 HH2 TRP 76 HH2 TRP 76 10.649 -4.317 5.067 578 H TRP 77 H TRP 77 6.161 -0.367 9.303 579 HA TRP 77 HA TRP 77 6.597 -0.608 6.380 580 HB2 TRP 77 HB2 TRP 77 5.081 1.463 7.952 581 HB3 TRP 77 HB3 TRP 77 6.028 2.040 6.594 582 HD1 TRP 77 HD1 TRP 77 4.331 -1.293 5.921 583 HE1 TRP 77 HE1 TRP 77 2.347 -0.884 4.338 584 HE3 TRP 77 HE3 TRP 77 4.199 3.789 6.121 585 HZ2 TRP 77 HZ2 TRP 77 0.926 1.347 3.300 586 HZ3 TRP 77 HZ3 TRP 77 2.517 4.994 4.801 587 HH2 TRP 77 HH2 TRP 77 0.910 3.792 3.423 588 H GLN 78 H GLN 78 8.349 0.631 5.519 589 HA GLN 78 HA GLN 78 9.624 2.641 7.204 590 HB2 GLN 78 HB2 GLN 78 11.023 0.666 7.663 591 HB3 GLN 78 HB3 GLN 78 11.296 0.424 5.937 592 HG2 GLN 78 HG2 GLN 78 12.505 2.554 5.792 593 HG3 GLN 78 HG3 GLN 78 12.143 2.912 7.480 594 HE21 GLN 78 HE21 GLN 78 14.364 3.134 7.907 595 HE22 GLN 78 HE22 GLN 78 15.413 1.766 8.020 596 H PHE 79 H PHE 79 9.476 4.410 6.030 597 HA PHE 79 HA PHE 79 9.147 4.527 3.202 598 HB2 PHE 79 HB2 PHE 79 9.770 6.794 5.139 599 HB3 PHE 79 HB3 PHE 79 9.108 6.961 3.516 600 HD1 PHE 79 HD2 PHE 79 6.750 6.268 3.047 601 HD2 PHE 79 HD1 PHE 79 8.348 6.227 7.020 602 HE1 PHE 79 HE2 PHE 79 4.476 6.192 3.971 603 HE2 PHE 79 HE1 PHE 79 6.069 6.145 7.933 604 HZ PHE 79 HZ PHE 79 4.134 6.132 6.412 605 H THR 80 H THR 80 10.642 4.841 1.618 606 HA THR 80 HA THR 80 13.465 5.371 2.334 607 HB THR 80 HB THR 80 14.066 4.452 0.114 608 HG1 THR 80 HG1 THR 80 12.611 4.300 -1.387 609 HG21 THR 80 HG21 THR 80 13.881 2.814 1.925 610 HG22 THR 80 HG22 THR 80 13.313 2.101 0.404 611 HG23 THR 80 HG23 THR 80 12.149 2.642 1.619 612 H THR 81 H THR 81 11.414 6.154 -0.528 613 HA THR 81 HA THR 81 12.743 8.816 -0.703 614 HB THR 81 HB THR 81 11.617 7.129 -2.980 615 HG1 THR 81 HG1 THR 81 13.578 6.389 -3.266 616 HG21 THR 81 HG21 THR 81 12.693 8.762 -4.497 617 HG22 THR 81 HG22 THR 81 13.162 9.746 -3.110 618 HG23 THR 81 HG23 THR 81 11.454 9.538 -3.507 619 H ILE 82 H ILE 82 11.311 10.263 0.151 620 HA ILE 82 HA ILE 82 8.561 10.376 -0.978 621 HB ILE 82 HB ILE 82 9.510 11.560 1.674 622 HG12 ILE 82 HG12 ILE 82 7.874 9.051 1.086 623 HG13 ILE 82 HG13 ILE 82 9.445 9.126 1.875 624 HG21 ILE 82 HG21 ILE 82 7.691 12.882 0.643 625 HG22 ILE 82 HG22 ILE 82 7.112 12.044 2.082 626 HG23 ILE 82 HG23 ILE 82 6.704 11.424 0.481 627 HD11 ILE 82 HD11 ILE 82 6.816 10.101 2.987 628 HD12 ILE 82 HD12 ILE 82 8.381 10.275 3.788 629 HD13 ILE 82 HD13 ILE 82 7.720 8.672 3.478 630 H GLU 83 H GLU 83 8.689 11.752 -2.675 631 HA GLU 83 HA GLU 83 10.261 14.242 -2.518 632 HB2 GLU 83 HB2 GLU 83 8.832 12.928 -4.867 633 HB3 GLU 83 HB3 GLU 83 9.723 14.446 -4.960 634 HG2 GLU 83 HG2 GLU 83 11.793 13.256 -4.280 635 HG3 GLU 83 HG3 GLU 83 10.898 11.739 -4.248 636 H ALA 84 H ALA 84 6.929 13.139 -3.032 637 HA ALA 84 HA ALA 84 4.887 14.059 -2.831 638 HB1 ALA 84 HB1 ALA 84 4.499 15.942 -1.317 639 HB2 ALA 84 HB2 ALA 84 6.225 16.328 -1.326 640 HB3 ALA 84 HB3 ALA 84 5.665 14.815 -0.612 641 HA PRO 85 HA PRO 85 2.973 14.993 -2.936 642 HB2 PRO 85 HB2 PRO 85 0.849 15.809 -4.293 643 HB3 PRO 85 HB3 PRO 85 1.823 17.009 -3.421 644 HG2 PRO 85 HG2 PRO 85 1.843 16.340 -6.373 645 HG3 PRO 85 HG3 PRO 85 1.854 17.938 -5.599 646 HD2 PRO 85 HD2 PRO 85 4.141 16.569 -6.506 647 HD3 PRO 85 HD3 PRO 85 4.150 17.912 -5.344 648 H ASP 86 H ASP 86 4.483 13.959 -5.564 649 HA ASP 86 HA ASP 86 2.403 12.117 -6.584 650 HB2 ASP 86 HB2 ASP 86 3.714 12.083 -8.683 651 HB3 ASP 86 HB3 ASP 86 3.216 13.712 -8.249 652 H HIS 87 H HIS 87 5.904 12.212 -5.775 653 HA HIS 87 HA HIS 87 6.118 9.310 -6.177 654 HB2 HIS 87 HB2 HIS 87 7.781 10.985 -7.143 655 HB3 HIS 87 HB3 HIS 87 8.358 11.261 -5.506 656 HD1 HIS 87 HD1 HIS 87 10.357 10.294 -7.495 657 HD2 HIS 87 HD2 HIS 87 8.076 7.634 -5.247 658 HE1 HIS 87 HE1 HIS 87 11.648 8.150 -7.489 659 HE2 HIS 87 HE2 HIS 87 10.196 6.530 -6.246 660 H LEU 88 H LEU 88 5.697 8.046 -4.546 661 HA LEU 88 HA LEU 88 6.898 8.494 -1.879 662 HB2 LEU 88 HB2 LEU 88 4.479 8.741 -1.661 663 HB3 LEU 88 HB3 LEU 88 4.189 7.268 -2.562 664 HG LEU 88 HG LEU 88 5.175 5.947 -0.686 665 HD11 LEU 88 HD11 LEU 88 5.344 8.591 0.788 666 HD12 LEU 88 HD12 LEU 88 6.709 7.606 0.251 667 HD13 LEU 88 HD13 LEU 88 5.616 6.993 1.491 668 HD21 LEU 88 HD21 LEU 88 2.907 7.777 0.149 669 HD22 LEU 88 HD22 LEU 88 3.316 6.227 0.890 670 HD23 LEU 88 HD23 LEU 88 2.757 6.281 -0.779 671 H GLU 89 H GLU 89 8.252 6.857 -1.301 672 HA GLU 89 HA GLU 89 7.799 4.122 -2.333 673 HB2 GLU 89 HB2 GLU 89 10.525 5.478 -2.056 674 HB3 GLU 89 HB3 GLU 89 10.282 3.758 -2.351 675 HG2 GLU 89 HG2 GLU 89 9.072 4.409 -4.475 676 HG3 GLU 89 HG3 GLU 89 9.631 6.055 -4.198 677 H PHE 90 H PHE 90 8.030 2.539 -0.836 678 HA PHE 90 HA PHE 90 9.389 2.878 1.685 679 HB2 PHE 90 HB2 PHE 90 7.406 2.414 3.132 680 HB3 PHE 90 HB3 PHE 90 7.267 3.955 2.303 681 HD1 PHE 90 HD2 PHE 90 5.907 0.519 2.551 682 HD2 PHE 90 HD1 PHE 90 5.520 4.321 0.622 683 HE1 PHE 90 HE2 PHE 90 3.677 -0.111 1.733 684 HE2 PHE 90 HE1 PHE 90 3.294 3.678 -0.187 685 HZ PHE 90 HZ PHE 90 2.370 1.462 0.361 686 H ASP 91 H ASP 91 8.978 0.826 3.062 687 HA ASP 91 HA ASP 91 8.753 -1.571 1.331 688 HB2 ASP 91 HB2 ASP 91 10.458 -1.062 3.803 689 HB3 ASP 91 HB3 ASP 91 10.183 -2.678 3.147 690 H ASP 92 H ASP 92 6.728 -2.235 1.583 691 HA ASP 92 HA ASP 92 5.347 -2.315 4.126 692 HB2 ASP 92 HB2 ASP 92 4.124 -1.933 1.991 693 HB3 ASP 92 HB3 ASP 92 4.630 -3.515 1.406 694 H GLY 93 H GLY 93 4.809 -4.251 5.245 695 HA2 GLY 93 HA2 GLY 93 5.508 -6.860 4.436 696 HA3 GLY 93 HA3 GLY 93 6.787 -6.234 5.472 697 H PHE 94 H PHE 94 5.240 -8.460 6.069 698 HA PHE 94 HA PHE 94 3.394 -7.681 8.222 699 HB2 PHE 94 HB2 PHE 94 4.158 -10.433 7.130 700 HB3 PHE 94 HB3 PHE 94 2.991 -10.158 8.422 701 HD1 PHE 94 HD2 PHE 94 0.800 -9.071 7.934 702 HD2 PHE 94 HD1 PHE 94 3.548 -10.021 4.790 703 HE1 PHE 94 HE2 PHE 94 -1.000 -8.812 6.276 704 HE2 PHE 94 HE1 PHE 94 1.739 -9.758 3.143 705 HZ PHE 94 HZ PHE 94 -0.533 -9.160 3.882 706 H ALA 95 H ALA 95 3.772 -8.282 10.391 707 HA ALA 95 HA ALA 95 6.577 -8.898 11.138 708 HB1 ALA 95 HB1 ALA 95 4.515 -7.303 12.694 709 HB2 ALA 95 HB2 ALA 95 5.867 -6.629 11.780 710 HB3 ALA 95 HB3 ALA 95 6.176 -7.634 13.199 711 H ASP 96 H ASP 96 6.908 -10.221 12.989 712 HA ASP 96 HA ASP 96 5.499 -12.659 12.778 713 HB2 ASP 96 HB2 ASP 96 7.130 -13.506 14.382 714 HB3 ASP 96 HB3 ASP 96 7.942 -12.422 13.259 715 H GLU 97 H GLU 97 5.465 -10.158 15.260 716 HA GLU 97 HA GLU 97 3.076 -10.297 16.429 717 HB2 GLU 97 HB2 GLU 97 3.089 -11.744 18.399 718 HB3 GLU 97 HB3 GLU 97 3.405 -12.721 16.972 719 HG2 GLU 97 HG2 GLU 97 5.852 -12.670 17.541 720 HG3 GLU 97 HG3 GLU 97 5.445 -11.816 19.024 721 H HIS 98 H HIS 98 6.536 -10.036 16.999 722 HA HIS 98 HA HIS 98 6.192 -8.180 19.271 723 HB2 HIS 98 HB2 HIS 98 8.751 -9.282 18.039 724 HB3 HIS 98 HB3 HIS 98 8.648 -8.332 19.519 725 HD1 HIS 98 HD1 HIS 98 7.156 -9.581 21.480 726 HD2 HIS 98 HD2 HIS 98 8.636 -11.948 18.418 727 HE1 HIS 98 HE1 HIS 98 7.070 -11.932 22.353 728 HE2 HIS 98 HE2 HIS 98 8.022 -13.343 20.508 729 H GLY 99 H GLY 99 6.790 -8.051 15.843 730 HA2 GLY 99 HA2 GLY 99 6.740 -5.849 14.739 731 HA3 GLY 99 HA3 GLY 99 7.806 -5.248 15.997 732 H ALA 100 H ALA 100 8.691 -8.373 15.044 733 HA ALA 100 HA ALA 100 10.956 -7.411 13.430 734 HB1 ALA 100 HB1 ALA 100 11.454 -9.001 15.232 735 HB2 ALA 100 HB2 ALA 100 11.816 -9.723 13.664 736 HB3 ALA 100 HB3 ALA 100 10.345 -10.182 14.528 737 HA PRO 101 HA PRO 101 8.812 -8.362 9.555 738 HB2 PRO 101 HB2 PRO 101 11.072 -8.952 7.982 739 HB3 PRO 101 HB3 PRO 101 10.434 -7.329 8.289 740 HG2 PRO 101 HG2 PRO 101 12.685 -8.775 9.675 741 HG3 PRO 101 HG3 PRO 101 12.601 -7.077 9.159 742 HD2 PRO 101 HD2 PRO 101 12.229 -7.740 11.733 743 HD3 PRO 101 HD3 PRO 101 11.247 -6.458 10.989 744 H VAL 102 H VAL 102 7.823 -10.204 8.905 745 HA VAL 102 HA VAL 102 8.489 -12.807 9.758 746 HB VAL 102 HB VAL 102 6.646 -11.865 7.520 747 HG11 VAL 102 HG11 VAL 102 5.638 -14.154 7.536 748 HG12 VAL 102 HG12 VAL 102 6.897 -14.697 8.647 749 HG13 VAL 102 HG13 VAL 102 7.322 -14.195 7.008 750 HG21 VAL 102 HG21 VAL 102 4.832 -12.383 9.117 751 HG22 VAL 102 HG22 VAL 102 5.948 -11.188 9.778 752 HG23 VAL 102 HG23 VAL 102 6.028 -12.863 10.327 753 H ASP 103 H ASP 103 9.608 -14.453 8.815 754 HA ASP 103 HA ASP 103 11.829 -13.636 7.152 755 HB2 ASP 103 HB2 ASP 103 12.036 -15.014 9.216 756 HB3 ASP 103 HB3 ASP 103 11.139 -16.307 8.441 757 H GLU 104 H GLU 104 9.259 -16.070 6.948 758 HA GLU 104 HA GLU 104 9.846 -17.091 4.368 759 HB2 GLU 104 HB2 GLU 104 8.435 -18.337 5.945 760 HB3 GLU 104 HB3 GLU 104 7.258 -17.025 5.973 761 HG2 GLU 104 HG2 GLU 104 6.917 -17.450 3.472 762 HG3 GLU 104 HG3 GLU 104 7.858 -18.926 3.695 763 H LEU 105 H LEU 105 7.283 -14.799 5.392 764 HA LEU 105 HA LEU 105 6.395 -14.167 2.751 765 HB2 LEU 105 HB2 LEU 105 5.909 -12.690 5.371 766 HB3 LEU 105 HB3 LEU 105 5.045 -12.393 3.870 767 HG LEU 105 HG LEU 105 4.930 -14.940 5.543 768 HD11 LEU 105 HD11 LEU 105 2.569 -14.349 5.905 769 HD12 LEU 105 HD12 LEU 105 2.799 -12.845 5.005 770 HD13 LEU 105 HD13 LEU 105 3.655 -13.106 6.527 771 HD21 LEU 105 HD21 LEU 105 3.528 -14.346 2.912 772 HD22 LEU 105 HD22 LEU 105 3.239 -15.759 3.934 773 HD23 LEU 105 HD23 LEU 105 4.811 -15.532 3.171 774 H GLY 106 H GLY 106 8.968 -12.909 4.741 775 HA2 GLY 106 HA2 GLY 106 10.790 -11.678 4.133 776 HA3 GLY 106 HA3 GLY 106 10.222 -11.762 2.475 777 H VAL 107 H VAL 107 11.019 -9.656 2.157 778 HA VAL 107 HA VAL 107 9.412 -7.408 3.267 779 HB VAL 107 HB VAL 107 12.287 -7.368 2.206 780 HG11 VAL 107 HG11 VAL 107 11.138 -5.238 1.696 781 HG12 VAL 107 HG12 VAL 107 12.357 -4.992 2.948 782 HG13 VAL 107 HG13 VAL 107 10.650 -5.084 3.386 783 HG21 VAL 107 HG21 VAL 107 12.962 -6.870 4.542 784 HG22 VAL 107 HG22 VAL 107 12.144 -8.432 4.434 785 HG23 VAL 107 HG23 VAL 107 11.279 -7.024 5.059 786 H THR 108 H THR 108 8.350 -6.107 1.773 787 HA THR 108 HA THR 108 9.061 -6.347 -1.092 788 HB THR 108 HB THR 108 7.079 -7.712 -0.850 789 HG1 THR 108 HG1 THR 108 6.756 -6.840 -2.738 790 HG21 THR 108 HG21 THR 108 6.070 -6.762 1.196 791 HG22 THR 108 HG22 THR 108 4.896 -6.844 -0.118 792 HG23 THR 108 HG23 THR 108 5.633 -5.298 0.307 793 H HIS 109 H HIS 109 9.700 -4.472 -1.828 794 HA HIS 109 HA HIS 109 9.194 -1.973 -0.465 795 HB2 HIS 109 HB2 HIS 109 11.424 -2.526 -1.392 796 HB3 HIS 109 HB3 HIS 109 10.749 -2.584 -3.009 797 HD1 HIS 109 HD1 HIS 109 11.903 -0.226 -0.385 798 HD2 HIS 109 HD2 HIS 109 10.252 -0.022 -4.170 799 HE1 HIS 109 HE1 HIS 109 12.212 2.137 -1.137 800 HE2 HIS 109 HE2 HIS 109 11.070 2.272 -3.352 801 H ALA 110 H ALA 110 7.151 -1.195 -0.737 802 HA ALA 110 HA ALA 110 5.757 -1.343 -3.322 803 HB1 ALA 110 HB1 ALA 110 4.527 -2.023 -1.307 804 HB2 ALA 110 HB2 ALA 110 3.770 -0.618 -2.058 805 HB3 ALA 110 HB3 ALA 110 4.757 -0.421 -0.607 806 H THR 111 H THR 111 5.561 0.351 -4.657 807 HA THR 111 HA THR 111 6.617 3.013 -3.851 808 HB THR 111 HB THR 111 6.922 1.582 -6.544 809 HG1 THR 111 HG1 THR 111 8.758 0.929 -5.737 810 HG21 THR 111 HG21 THR 111 7.920 4.320 -5.690 811 HG22 THR 111 HG22 THR 111 6.706 3.992 -6.924 812 HG23 THR 111 HG23 THR 111 8.378 3.491 -7.177 813 H VAL 112 H VAL 112 4.984 4.442 -3.797 814 HA VAL 112 HA VAL 112 2.579 4.115 -5.490 815 HB VAL 112 HB VAL 112 3.029 5.951 -3.090 816 HG11 VAL 112 HG11 VAL 112 1.277 6.819 -4.605 817 HG12 VAL 112 HG12 VAL 112 0.560 6.239 -3.100 818 HG13 VAL 112 HG13 VAL 112 0.449 5.257 -4.563 819 HG21 VAL 112 HG21 VAL 112 3.130 3.585 -2.407 820 HG22 VAL 112 HG22 VAL 112 1.586 3.273 -3.203 821 HG23 VAL 112 HG23 VAL 112 1.653 4.344 -1.803 822 H LYS 113 H LYS 113 2.468 5.316 -7.313 823 HA LYS 113 HA LYS 113 3.793 7.972 -7.447 824 HB2 LYS 113 HB2 LYS 113 3.544 5.862 -9.635 825 HB3 LYS 113 HB3 LYS 113 4.156 7.488 -9.897 826 HG2 LYS 113 HG2 LYS 113 6.230 6.958 -9.141 827 HG3 LYS 113 HG3 LYS 113 5.594 6.143 -7.719 828 HD2 LYS 113 HD2 LYS 113 6.796 4.482 -8.896 829 HD3 LYS 113 HD3 LYS 113 5.102 4.139 -9.216 830 HE2 LYS 113 HE2 LYS 113 6.959 5.603 -11.121 831 HE3 LYS 113 HE3 LYS 113 6.592 3.889 -11.214 832 HZ1 LYS 113 HZ1 LYS 113 4.627 6.083 -11.503 833 HZ2 LYS 113 HZ2 LYS 113 4.286 4.434 -11.621 834 HZ3 LYS 113 HZ3 LYS 113 5.283 5.175 -12.762 835 H LEU 114 H LEU 114 2.258 9.471 -7.420 836 HA LEU 114 HA LEU 114 -0.387 9.085 -8.609 837 HB2 LEU 114 HB2 LEU 114 0.810 11.427 -7.076 838 HB3 LEU 114 HB3 LEU 114 -0.870 11.300 -7.586 839 HG LEU 114 HG LEU 114 0.491 9.422 -5.603 840 HD11 LEU 114 HD11 LEU 114 -0.897 10.514 -3.894 841 HD12 LEU 114 HD12 LEU 114 -1.485 11.667 -5.096 842 HD13 LEU 114 HD13 LEU 114 0.221 11.648 -4.647 843 HD21 LEU 114 HD21 LEU 114 -2.419 9.607 -6.442 844 HD22 LEU 114 HD22 LEU 114 -1.775 8.577 -5.159 845 HD23 LEU 114 HD23 LEU 114 -1.295 8.300 -6.832 846 H GLU 115 H GLU 115 -1.119 10.119 -10.423 847 HA GLU 115 HA GLU 115 0.751 11.855 -11.930 848 HB2 GLU 115 HB2 GLU 115 -1.108 9.702 -13.025 849 HB3 GLU 115 HB3 GLU 115 -0.125 10.790 -14.011 850 HG2 GLU 115 HG2 GLU 115 1.922 9.878 -13.022 851 HG3 GLU 115 HG3 GLU 115 0.975 8.815 -11.983 852 HA PRO 116 HA PRO 116 -2.734 14.738 -11.572 853 HB2 PRO 116 HB2 PRO 116 -1.609 16.805 -13.007 854 HB3 PRO 116 HB3 PRO 116 -1.227 16.458 -11.322 855 HG2 PRO 116 HG2 PRO 116 0.320 15.766 -13.800 856 HG3 PRO 116 HG3 PRO 116 0.919 16.300 -12.219 857 HD2 PRO 116 HD2 PRO 116 0.972 13.688 -13.029 858 HD3 PRO 116 HD3 PRO 116 0.838 14.160 -11.322 859 H LEU 117 H LEU 117 -4.476 14.085 -12.709 860 HA LEU 117 HA LEU 117 -4.536 14.416 -15.665 861 HB2 LEU 117 HB2 LEU 117 -6.519 12.805 -14.025 862 HB3 LEU 117 HB3 LEU 117 -6.261 12.742 -15.761 863 HG LEU 117 HG LEU 117 -4.373 11.666 -13.620 864 HD11 LEU 117 HD11 LEU 117 -6.378 10.287 -13.862 865 HD12 LEU 117 HD12 LEU 117 -4.958 9.439 -14.467 866 HD13 LEU 117 HD13 LEU 117 -6.107 10.155 -15.602 867 HD21 LEU 117 HD21 LEU 117 -3.046 10.712 -15.462 868 HD22 LEU 117 HD22 LEU 117 -3.071 12.471 -15.520 869 HD23 LEU 117 HD23 LEU 117 -4.071 11.541 -16.638 870 H GLU 118 H GLU 118 -4.924 16.467 -13.515 871 HA GLU 118 HA GLU 118 -6.078 18.348 -13.123 872 HB2 GLU 118 HB2 GLU 118 -6.357 18.473 -15.598 873 HB3 GLU 118 HB3 GLU 118 -7.859 17.577 -15.465 874 HG2 GLU 118 HG2 GLU 118 -8.786 19.398 -14.047 875 HG3 GLU 118 HG3 GLU 118 -7.307 20.317 -14.301 876 H ASN 119 H ASN 119 -8.991 16.600 -14.243 877 HA ASN 119 HA ASN 119 -10.298 17.027 -11.659 878 HB2 ASN 119 HB2 ASN 119 -11.368 15.903 -14.291 879 HB3 ASN 119 HB3 ASN 119 -12.347 16.303 -12.879 880 HD21 ASN 119 HD21 ASN 119 -12.296 17.392 -15.674 881 HD22 ASN 119 HD22 ASN 119 -12.137 19.096 -15.472 882 H ARG 120 H ARG 120 -8.432 14.632 -13.079 883 HA ARG 120 HA ARG 120 -9.325 12.623 -11.073 884 HB2 ARG 120 HB2 ARG 120 -8.372 12.090 -13.923 885 HB3 ARG 120 HB3 ARG 120 -8.530 10.838 -12.695 886 HG2 ARG 120 HG2 ARG 120 -10.936 11.111 -12.629 887 HG3 ARG 120 HG3 ARG 120 -10.850 12.525 -13.690 888 HD2 ARG 120 HD2 ARG 120 -10.058 9.688 -14.451 889 HD3 ARG 120 HD3 ARG 120 -11.556 10.501 -14.916 890 HE ARG 120 HE ARG 120 -9.909 12.208 -15.970 891 HH11 ARG 120 HH11 ARG 120 -9.428 8.792 -15.997 892 HH12 ARG 120 HH12 ARG 120 -8.486 8.849 -17.440 893 HH21 ARG 120 HH21 ARG 120 -8.703 12.242 -17.785 894 HH22 ARG 120 HH22 ARG 120 -8.082 10.768 -18.437 895 H THR 121 H THR 121 -7.531 11.032 -10.621 896 HA THR 121 HA THR 121 -4.779 11.847 -11.266 897 HB THR 121 HB THR 121 -5.726 11.455 -8.377 898 HG1 THR 121 HG1 THR 121 -6.032 13.574 -9.355 899 HG21 THR 121 HG21 THR 121 -3.496 10.406 -8.684 900 HG22 THR 121 HG22 THR 121 -3.373 11.869 -7.705 901 HG23 THR 121 HG23 THR 121 -2.886 11.901 -9.403 902 H ARG 122 H ARG 122 -3.428 10.037 -11.466 903 HA ARG 122 HA ARG 122 -4.711 7.388 -11.164 904 HB2 ARG 122 HB2 ARG 122 -4.063 7.958 -13.463 905 HB3 ARG 122 HB3 ARG 122 -2.412 8.293 -12.948 906 HG2 ARG 122 HG2 ARG 122 -2.061 5.948 -12.385 907 HG3 ARG 122 HG3 ARG 122 -3.744 5.568 -12.765 908 HD2 ARG 122 HD2 ARG 122 -1.768 6.672 -14.793 909 HD3 ARG 122 HD3 ARG 122 -2.057 4.951 -14.543 910 HE ARG 122 HE ARG 122 -4.540 6.104 -15.017 911 HH11 ARG 122 HH11 ARG 122 -1.588 5.750 -16.799 912 HH12 ARG 122 HH12 ARG 122 -2.409 5.632 -18.315 913 HH21 ARG 122 HH21 ARG 122 -5.544 5.952 -16.975 914 HH22 ARG 122 HH22 ARG 122 -4.606 5.746 -18.410 915 H MET 123 H MET 123 -4.101 6.314 -9.404 916 HA MET 123 HA MET 123 -1.464 6.698 -8.148 917 HB2 MET 123 HB2 MET 123 -3.511 6.854 -6.715 918 HB3 MET 123 HB3 MET 123 -3.922 5.195 -7.129 919 HG2 MET 123 HG2 MET 123 -1.750 4.470 -6.077 920 HG3 MET 123 HG3 MET 123 -1.512 6.137 -5.553 921 HE1 MET 123 HE1 MET 123 -4.866 3.352 -4.055 922 HE2 MET 123 HE2 MET 123 -3.613 2.883 -5.202 923 HE3 MET 123 HE3 MET 123 -4.876 4.016 -5.688 924 H THR 124 H THR 124 0.054 5.345 -9.036 925 HA THR 124 HA THR 124 -0.675 2.508 -9.565 926 HB THR 124 HB THR 124 1.708 4.015 -10.741 927 HG1 THR 124 HG1 THR 124 -0.301 4.842 -11.535 928 HG21 THR 124 HG21 THR 124 0.461 1.332 -11.494 929 HG22 THR 124 HG22 THR 124 2.003 1.546 -10.659 930 HG23 THR 124 HG23 THR 124 1.819 2.109 -12.320 931 H ILE 125 H ILE 125 -0.040 1.186 -7.958 932 HA ILE 125 HA ILE 125 2.314 1.857 -6.281 933 HB ILE 125 HB ILE 125 0.082 -0.112 -5.609 934 HG12 ILE 125 HG12 ILE 125 0.320 2.775 -4.629 935 HG13 ILE 125 HG13 ILE 125 -0.809 2.251 -5.875 936 HG21 ILE 125 HG21 ILE 125 2.193 -0.497 -4.386 937 HG22 ILE 125 HG22 ILE 125 0.951 0.100 -3.284 938 HG23 ILE 125 HG23 ILE 125 2.215 1.189 -3.857 939 HD11 ILE 125 HD11 ILE 125 -1.928 0.804 -4.242 940 HD12 ILE 125 HD12 ILE 125 -1.905 2.490 -3.724 941 HD13 ILE 125 HD13 ILE 125 -0.791 1.333 -3.000 942 H ILE 126 H ILE 126 4.132 0.683 -6.757 943 HA ILE 126 HA ILE 126 3.869 -2.019 -7.949 944 HB ILE 126 HB ILE 126 6.300 -0.179 -8.282 945 HG12 ILE 126 HG12 ILE 126 5.424 -0.004 -10.760 946 HG13 ILE 126 HG13 ILE 126 3.860 -0.445 -10.091 947 HG21 ILE 126 HG21 ILE 126 6.914 -1.749 -10.096 948 HG22 ILE 126 HG22 ILE 126 5.491 -2.727 -9.733 949 HG23 ILE 126 HG23 ILE 126 6.781 -2.567 -8.536 950 HD11 ILE 126 HD11 ILE 126 5.484 1.980 -9.356 951 HD12 ILE 126 HD12 ILE 126 3.901 1.554 -8.699 952 HD13 ILE 126 HD13 ILE 126 4.072 1.935 -10.411 953 H SER 127 H SER 127 4.276 -3.504 -6.414 954 HA SER 127 HA SER 127 6.143 -3.032 -4.195 955 HB2 SER 127 HB2 SER 127 4.158 -5.300 -4.702 956 HB3 SER 127 HB3 SER 127 5.109 -5.079 -3.232 957 HG SER 127 HG SER 127 3.547 -3.855 -2.586 958 H THR 128 H THR 128 8.232 -3.772 -4.368 959 HA THR 128 HA THR 128 8.882 -5.864 -6.356 960 HB THR 128 HB THR 128 11.219 -5.001 -6.268 961 HG1 THR 128 HG1 THR 128 11.737 -3.241 -5.049 962 HG21 THR 128 HG21 THR 128 10.826 -2.852 -7.423 963 HG22 THR 128 HG22 THR 128 9.163 -2.824 -6.825 964 HG23 THR 128 HG23 THR 128 9.672 -4.074 -7.965 965 H PHE 129 H PHE 129 9.764 -7.781 -5.739 966 HA PHE 129 HA PHE 129 9.753 -8.364 -2.837 967 HB2 PHE 129 HB2 PHE 129 9.198 -10.184 -5.223 968 HB3 PHE 129 HB3 PHE 129 9.148 -10.690 -3.536 969 HD1 PHE 129 HD2 PHE 129 7.476 -8.572 -6.083 970 HD2 PHE 129 HD1 PHE 129 7.216 -10.207 -2.145 971 HE1 PHE 129 HE2 PHE 129 5.132 -7.879 -5.949 972 HE2 PHE 129 HE1 PHE 129 4.865 -9.496 -2.023 973 HZ PHE 129 HZ PHE 129 3.820 -8.334 -3.920 974 H GLU 130 H GLU 130 11.152 -9.954 -1.996 975 HA GLU 130 HA GLU 130 13.893 -9.828 -2.670 976 HB2 GLU 130 HB2 GLU 130 12.418 -11.805 -0.876 977 HB3 GLU 130 HB3 GLU 130 14.157 -11.526 -0.864 978 HG2 GLU 130 HG2 GLU 130 12.044 -9.464 -0.135 979 HG3 GLU 130 HG3 GLU 130 12.969 -10.423 1.019 980 H SER 131 H SER 131 11.450 -12.380 -3.223 981 HA SER 131 HA SER 131 13.122 -13.754 -5.193 982 HB2 SER 131 HB2 SER 131 13.055 -15.936 -4.037 983 HB3 SER 131 HB3 SER 131 13.853 -14.740 -3.016 984 HG SER 131 HG SER 131 12.392 -15.888 -1.774 985 H GLU 132 H GLU 132 11.957 -15.631 -6.196 986 HA GLU 132 HA GLU 132 9.303 -14.850 -6.952 987 HB2 GLU 132 HB2 GLU 132 10.947 -15.895 -8.536 988 HB3 GLU 132 HB3 GLU 132 10.750 -17.431 -7.693 989 HG2 GLU 132 HG2 GLU 132 8.329 -17.416 -8.290 990 HG3 GLU 132 HG3 GLU 132 8.571 -15.904 -9.162 991 H GLU 133 H GLU 133 10.587 -17.468 -4.910 992 HA GLU 133 HA GLU 133 8.184 -18.910 -4.481 993 HB2 GLU 133 HB2 GLU 133 9.325 -19.854 -2.485 994 HB3 GLU 133 HB3 GLU 133 10.376 -19.858 -3.899 995 HG2 GLU 133 HG2 GLU 133 11.552 -17.866 -3.053 996 HG3 GLU 133 HG3 GLU 133 10.485 -17.812 -1.651 997 H GLN 134 H GLN 134 9.502 -16.024 -2.937 998 HA GLN 134 HA GLN 134 7.526 -15.749 -0.859 999 HB2 GLN 134 HB2 GLN 134 9.652 -14.615 -0.575 1000 HB3 GLN 134 HB3 GLN 134 9.499 -13.815 -2.137 1001 HG2 GLN 134 HG2 GLN 134 7.368 -12.685 -1.056 1002 HG3 GLN 134 HG3 GLN 134 8.112 -13.168 0.468 1003 HE21 GLN 134 HE21 GLN 134 8.289 -10.880 0.929 1004 HE22 GLN 134 HE22 GLN 134 9.548 -9.946 0.233 1005 H MET 135 H MET 135 8.080 -14.193 -3.999 1006 HA MET 135 HA MET 135 5.933 -12.466 -4.246 1007 HB2 MET 135 HB2 MET 135 7.810 -12.445 -5.763 1008 HB3 MET 135 HB3 MET 135 7.481 -14.082 -6.299 1009 HG2 MET 135 HG2 MET 135 6.928 -12.404 -7.985 1010 HG3 MET 135 HG3 MET 135 5.518 -13.342 -7.498 1011 HE1 MET 135 HE1 MET 135 4.624 -9.385 -8.307 1012 HE2 MET 135 HE2 MET 135 4.650 -10.973 -9.074 1013 HE3 MET 135 HE3 MET 135 6.159 -10.093 -8.808 1014 H GLN 136 H GLN 136 6.013 -15.937 -5.047 1015 HA GLN 136 HA GLN 136 3.280 -16.155 -5.878 1016 HB2 GLN 136 HB2 GLN 136 5.363 -18.192 -5.027 1017 HB3 GLN 136 HB3 GLN 136 3.709 -18.675 -5.394 1018 HG2 GLN 136 HG2 GLN 136 5.589 -17.276 -7.319 1019 HG3 GLN 136 HG3 GLN 136 5.230 -19.003 -7.312 1020 HE21 GLN 136 HE21 GLN 136 4.800 -17.106 -9.481 1021 HE22 GLN 136 HE22 GLN 136 3.108 -17.113 -9.827 1022 H LYS 137 H LYS 137 4.954 -16.858 -2.758 1023 HA LYS 137 HA LYS 137 2.705 -17.918 -1.410 1024 HB2 LYS 137 HB2 LYS 137 5.018 -18.308 -0.627 1025 HB3 LYS 137 HB3 LYS 137 5.182 -16.611 -0.201 1026 HG2 LYS 137 HG2 LYS 137 4.771 -18.125 1.762 1027 HG3 LYS 137 HG3 LYS 137 3.589 -16.820 1.601 1028 HD2 LYS 137 HD2 LYS 137 2.025 -18.439 0.493 1029 HD3 LYS 137 HD3 LYS 137 3.185 -19.733 0.801 1030 HE2 LYS 137 HE2 LYS 137 1.936 -18.036 2.986 1031 HE3 LYS 137 HE3 LYS 137 1.264 -19.570 2.439 1032 HZ1 LYS 137 HZ1 LYS 137 3.321 -20.651 3.098 1033 HZ2 LYS 137 HZ2 LYS 137 2.613 -19.849 4.405 1034 HZ3 LYS 137 HZ3 LYS 137 3.943 -19.180 3.621 1035 H MET 138 H MET 138 3.740 -14.570 -1.780 1036 HA MET 138 HA MET 138 2.027 -13.294 0.078 1037 HB2 MET 138 HB2 MET 138 3.043 -12.295 -2.617 1038 HB3 MET 138 HB3 MET 138 2.332 -11.279 -1.371 1039 HG2 MET 138 HG2 MET 138 4.721 -12.881 -0.571 1040 HG3 MET 138 HG3 MET 138 4.990 -11.561 -1.699 1041 HE1 MET 138 HE1 MET 138 3.482 -11.029 2.647 1042 HE2 MET 138 HE2 MET 138 4.017 -12.562 1.961 1043 HE3 MET 138 HE3 MET 138 2.485 -11.855 1.448 1044 H ALA 139 H ALA 139 1.570 -14.149 -3.350 1045 HA ALA 139 HA ALA 139 -1.133 -13.318 -3.635 1046 HB1 ALA 139 HB1 ALA 139 0.396 -15.448 -5.174 1047 HB2 ALA 139 HB2 ALA 139 0.370 -13.721 -5.544 1048 HB3 ALA 139 HB3 ALA 139 -1.110 -14.674 -5.685 1049 H GLU 140 H GLU 140 0.328 -16.372 -2.525 1050 HA GLU 140 HA GLU 140 -2.106 -17.892 -2.378 1051 HB2 GLU 140 HB2 GLU 140 0.500 -18.412 -0.884 1052 HB3 GLU 140 HB3 GLU 140 -0.799 -19.570 -1.154 1053 HG2 GLU 140 HG2 GLU 140 1.141 -18.436 -3.179 1054 HG3 GLU 140 HG3 GLU 140 0.970 -20.107 -2.665 1055 H MET 141 H MET 141 -0.588 -15.607 -0.218 1056 HA MET 141 HA MET 141 -2.174 -16.223 2.126 1057 HB2 MET 141 HB2 MET 141 -0.511 -13.789 1.350 1058 HB3 MET 141 HB3 MET 141 -1.361 -13.914 2.886 1059 HG2 MET 141 HG2 MET 141 0.802 -15.823 1.963 1060 HG3 MET 141 HG3 MET 141 1.053 -14.458 3.052 1061 HE1 MET 141 HE1 MET 141 0.030 -14.337 5.548 1062 HE2 MET 141 HE2 MET 141 -1.052 -15.567 6.203 1063 HE3 MET 141 HE3 MET 141 -1.588 -14.541 4.873 1064 H GLY 142 H GLY 142 -3.005 -14.893 -0.854 1065 HA2 GLY 142 HA2 GLY 142 -4.881 -13.810 -1.642 1066 HA3 GLY 142 HA3 GLY 142 -5.567 -13.907 -0.026 1067 H MET 143 H MET 143 -2.461 -12.428 -0.616 1068 HA MET 143 HA MET 143 -3.103 -10.016 0.735 1069 HB2 MET 143 HB2 MET 143 -0.831 -11.053 0.646 1070 HB3 MET 143 HB3 MET 143 -0.714 -10.633 -1.052 1071 HG2 MET 143 HG2 MET 143 -0.788 -8.236 -0.450 1072 HG3 MET 143 HG3 MET 143 -0.879 -8.683 1.258 1073 HE1 MET 143 HE1 MET 143 1.288 -7.199 1.836 1074 HE2 MET 143 HE2 MET 143 1.383 -6.694 0.149 1075 HE3 MET 143 HE3 MET 143 2.814 -7.329 0.961 1076 H GLU 144 H GLU 144 -3.007 -10.867 -2.702 1077 HA GLU 144 HA GLU 144 -3.094 -8.294 -3.866 1078 HB2 GLU 144 HB2 GLU 144 -4.327 -10.862 -4.945 1079 HB3 GLU 144 HB3 GLU 144 -3.996 -9.409 -5.885 1080 HG2 GLU 144 HG2 GLU 144 -1.579 -9.709 -5.492 1081 HG3 GLU 144 HG3 GLU 144 -1.912 -11.173 -4.562 1082 H GLU 145 H GLU 145 -5.703 -10.386 -2.664 1083 HA GLU 145 HA GLU 145 -7.913 -8.832 -3.563 1084 HB2 GLU 145 HB2 GLU 145 -8.150 -11.193 -2.920 1085 HB3 GLU 145 HB3 GLU 145 -7.710 -10.817 -1.256 1086 HG2 GLU 145 HG2 GLU 145 -9.767 -9.410 -1.068 1087 HG3 GLU 145 HG3 GLU 145 -10.194 -9.855 -2.717 1088 H GLY 146 H GLY 146 -6.487 -9.140 -0.243 1089 HA2 GLY 146 HA2 GLY 146 -7.979 -7.145 1.049 1090 HA3 GLY 146 HA3 GLY 146 -6.382 -7.681 1.541 1091 H MET 147 H MET 147 -4.999 -6.858 -0.807 1092 HA MET 147 HA MET 147 -4.417 -4.115 -0.348 1093 HB2 MET 147 HB2 MET 147 -2.781 -5.739 -1.248 1094 HB3 MET 147 HB3 MET 147 -3.741 -5.917 -2.710 1095 HG2 MET 147 HG2 MET 147 -1.811 -4.519 -3.132 1096 HG3 MET 147 HG3 MET 147 -3.290 -3.567 -3.282 1097 HE1 MET 147 HE1 MET 147 -0.257 -2.437 -2.953 1098 HE2 MET 147 HE2 MET 147 -0.554 -1.071 -1.875 1099 HE3 MET 147 HE3 MET 147 -1.659 -1.396 -3.211 1100 H ARG 148 H ARG 148 -6.181 -5.769 -2.983 1101 HA ARG 148 HA ARG 148 -6.774 -3.486 -4.554 1102 HB2 ARG 148 HB2 ARG 148 -6.864 -5.764 -5.474 1103 HB3 ARG 148 HB3 ARG 148 -8.197 -6.175 -4.401 1104 HG2 ARG 148 HG2 ARG 148 -9.626 -4.501 -5.576 1105 HG3 ARG 148 HG3 ARG 148 -8.286 -4.157 -6.674 1106 HD2 ARG 148 HD2 ARG 148 -9.649 -6.857 -6.355 1107 HD3 ARG 148 HD3 ARG 148 -9.964 -5.708 -7.650 1108 HE ARG 148 HE ARG 148 -7.809 -6.137 -8.545 1109 HH11 ARG 148 HH11 ARG 148 -8.522 -8.280 -5.911 1110 HH12 ARG 148 HH12 ARG 148 -7.378 -9.464 -6.436 1111 HH21 ARG 148 HH21 ARG 148 -6.346 -7.671 -9.169 1112 HH22 ARG 148 HH22 ARG 148 -6.168 -9.119 -8.251 1113 H GLU 149 H GLU 149 -8.676 -5.179 -2.058 1114 HA GLU 149 HA GLU 149 -11.055 -3.639 -2.335 1115 HB2 GLU 149 HB2 GLU 149 -10.151 -5.362 0.012 1116 HB3 GLU 149 HB3 GLU 149 -11.779 -4.712 -0.202 1117 HG2 GLU 149 HG2 GLU 149 -10.387 -6.804 -1.908 1118 HG3 GLU 149 HG3 GLU 149 -11.789 -7.028 -0.868 1119 H ALA 150 H ALA 150 -8.167 -3.272 -0.340 1120 HA ALA 150 HA ALA 150 -8.964 -1.072 1.244 1121 HB1 ALA 150 HB1 ALA 150 -6.851 -2.289 1.591 1122 HB2 ALA 150 HB2 ALA 150 -6.548 -0.563 1.381 1123 HB3 ALA 150 HB3 ALA 150 -6.235 -1.683 0.050 1124 H ILE 151 H ILE 151 -7.508 -1.213 -2.001 1125 HA ILE 151 HA ILE 151 -7.536 1.586 -2.553 1126 HB ILE 151 HB ILE 151 -7.348 -0.772 -4.474 1127 HG12 ILE 151 HG12 ILE 151 -5.095 0.896 -3.249 1128 HG13 ILE 151 HG13 ILE 151 -5.549 -0.712 -2.701 1129 HG21 ILE 151 HG21 ILE 151 -7.956 1.268 -5.689 1130 HG22 ILE 151 HG22 ILE 151 -6.292 0.818 -6.063 1131 HG23 ILE 151 HG23 ILE 151 -6.617 2.143 -4.940 1132 HD11 ILE 151 HD11 ILE 151 -3.577 -0.801 -4.093 1133 HD12 ILE 151 HD12 ILE 151 -4.430 -0.002 -5.412 1134 HD13 ILE 151 HD13 ILE 151 -4.915 -1.622 -4.901 1135 H GLU 152 H GLU 152 -9.920 -0.942 -2.980 1136 HA GLU 152 HA GLU 152 -11.781 0.492 -4.622 1137 HB2 GLU 152 HB2 GLU 152 -12.138 -1.888 -2.749 1138 HB3 GLU 152 HB3 GLU 152 -13.431 -1.258 -3.768 1139 HG2 GLU 152 HG2 GLU 152 -10.786 -2.354 -4.800 1140 HG3 GLU 152 HG3 GLU 152 -12.294 -3.262 -4.726 1141 H GLN 153 H GLN 153 -11.177 0.246 -1.173 1142 HA GLN 153 HA GLN 153 -13.619 1.550 -0.339 1143 HB2 GLN 153 HB2 GLN 153 -12.343 -0.236 0.964 1144 HB3 GLN 153 HB3 GLN 153 -11.135 0.988 1.334 1145 HG2 GLN 153 HG2 GLN 153 -12.707 2.261 2.640 1146 HG3 GLN 153 HG3 GLN 153 -14.064 1.294 2.067 1147 HE21 GLN 153 HE21 GLN 153 -11.343 1.377 4.233 1148 HE22 GLN 153 HE22 GLN 153 -11.762 -0.028 5.139 1149 H ILE 154 H ILE 154 -10.482 2.633 -1.397 1150 HA ILE 154 HA ILE 154 -10.293 5.193 -0.236 1151 HB ILE 154 HB ILE 154 -9.461 4.371 -3.048 1152 HG12 ILE 154 HG12 ILE 154 -7.823 4.543 -0.483 1153 HG13 ILE 154 HG13 ILE 154 -8.348 3.053 -1.260 1154 HG21 ILE 154 HG21 ILE 154 -9.632 6.827 -2.915 1155 HG22 ILE 154 HG22 ILE 154 -7.941 6.344 -3.023 1156 HG23 ILE 154 HG23 ILE 154 -8.618 6.839 -1.470 1157 HD11 ILE 154 HD11 ILE 154 -6.429 5.076 -2.409 1158 HD12 ILE 154 HD12 ILE 154 -6.946 3.584 -3.198 1159 HD13 ILE 154 HD13 ILE 154 -6.017 3.516 -1.702 1160 H ASP 155 H ASP 155 -12.272 4.072 -2.970 1161 HA ASP 155 HA ASP 155 -13.229 6.550 -3.885 1162 HB2 ASP 155 HB2 ASP 155 -13.545 4.406 -5.107 1163 HB3 ASP 155 HB3 ASP 155 -14.653 3.849 -3.853 1164 H ALA 156 H ALA 156 -14.426 4.397 -1.302 1165 HA ALA 156 HA ALA 156 -16.607 6.016 -0.407 1166 HB1 ALA 156 HB1 ALA 156 -16.396 3.613 0.142 1167 HB2 ALA 156 HB2 ALA 156 -16.580 4.593 1.597 1168 HB3 ALA 156 HB3 ALA 156 -14.990 3.957 1.153 1169 H VAL 157 H VAL 157 -13.156 6.137 0.275 1170 HA VAL 157 HA VAL 157 -13.244 7.756 2.653 1171 HB VAL 157 HB VAL 157 -10.973 7.274 0.666 1172 HG11 VAL 157 HG11 VAL 157 -10.778 8.528 3.437 1173 HG12 VAL 157 HG12 VAL 157 -10.498 9.357 1.905 1174 HG13 VAL 157 HG13 VAL 157 -9.407 8.070 2.421 1175 HG21 VAL 157 HG21 VAL 157 -11.564 5.979 3.350 1176 HG22 VAL 157 HG22 VAL 157 -10.113 5.699 2.386 1177 HG23 VAL 157 HG23 VAL 157 -11.690 5.216 1.765 1178 H LEU 158 H LEU 158 -12.739 8.500 -0.798 1179 HA LEU 158 HA LEU 158 -12.508 11.370 -0.382 1180 HB2 LEU 158 HB2 LEU 158 -12.764 9.777 -2.968 1181 HB3 LEU 158 HB3 LEU 158 -12.338 11.480 -2.853 1182 HG LEU 158 HG LEU 158 -10.656 9.141 -1.855 1183 HD11 LEU 158 HD11 LEU 158 -9.057 9.777 -3.598 1184 HD12 LEU 158 HD12 LEU 158 -10.163 11.022 -4.183 1185 HD13 LEU 158 HD13 LEU 158 -10.614 9.318 -4.285 1186 HD21 LEU 158 HD21 LEU 158 -10.043 12.113 -1.722 1187 HD22 LEU 158 HD22 LEU 158 -8.910 10.816 -1.334 1188 HD23 LEU 158 HD23 LEU 158 -10.357 11.038 -0.358 1189 H SER 159 H SER 159 -14.944 9.098 -1.575 1190 HA SER 159 HA SER 159 -17.020 11.186 -1.780 1191 HB2 SER 159 HB2 SER 159 -16.780 9.372 -3.566 1192 HB3 SER 159 HB3 SER 159 -17.257 8.195 -2.364 1193 HG SER 159 HG SER 159 -19.129 8.679 -3.304 1194 H GLU 160 H GLU 160 -16.467 11.338 0.696 1195 HA GLU 160 HA GLU 160 -18.308 9.570 2.205 1196 HB2 GLU 160 HB2 GLU 160 -15.638 9.426 2.527 1197 HB3 GLU 160 HB3 GLU 160 -15.936 10.778 3.599 1198 HG2 GLU 160 HG2 GLU 160 -17.648 9.289 4.762 1199 HG3 GLU 160 HG3 GLU 160 -17.016 7.965 3.803 1200 HA PRO 161 HA PRO 161 -19.802 13.736 3.469 1201 HB2 PRO 161 HB2 PRO 161 -22.186 13.796 2.219 1202 HB3 PRO 161 HB3 PRO 161 -20.707 14.221 1.342 1203 HG2 PRO 161 HG2 PRO 161 -22.244 11.634 1.314 1204 HG3 PRO 161 HG3 PRO 161 -21.530 12.514 -0.049 1205 HD2 PRO 161 HD2 PRO 161 -20.308 10.349 1.255 1206 HD3 PRO 161 HD3 PRO 161 -19.456 11.572 0.291 1207 H ALA 162 H ALA 162 -22.798 13.406 3.795 1208 HA ALA 162 HA ALA 162 -22.712 11.996 6.328 1209 HB1 ALA 162 HB1 ALA 162 -23.729 14.234 6.144 1210 HB2 ALA 162 HB2 ALA 162 -24.894 13.043 6.726 1211 HB3 ALA 162 HB3 ALA 162 -24.952 13.587 5.046 1212 H ASN 163 H ASN 163 -22.617 10.293 3.912 1213 HA ASN 163 HA ASN 163 -24.516 8.326 4.865 1214 HB2 ASN 163 HB2 ASN 163 -25.497 7.808 2.664 1215 HB3 ASN 163 HB3 ASN 163 -25.916 9.426 3.177 1216 HD21 ASN 163 HD21 ASN 163 -25.846 8.217 0.472 1217 HD22 ASN 163 HD22 ASN 163 -24.837 9.264 -0.461 1218 H ALA 164 H ALA 164 -22.046 9.030 2.351 1219 HA ALA 164 HA ALA 164 -20.432 7.801 1.329 1220 HB1 ALA 164 HB1 ALA 164 -20.208 6.428 4.036 1221 HB2 ALA 164 HB2 ALA 164 -19.431 7.948 3.589 1222 HB3 ALA 164 HB3 ALA 164 -18.972 6.452 2.774 1223 H LEU 165 H LEU 165 -21.877 6.816 -0.172 1224 HA LEU 165 HA LEU 165 -23.419 4.476 0.531 1225 HB2 LEU 165 HB2 LEU 165 -24.286 4.633 -1.819 1226 HB3 LEU 165 HB3 LEU 165 -24.496 6.073 -0.845 1227 HG LEU 165 HG LEU 165 -22.284 6.887 -2.092 1228 HD11 LEU 165 HD11 LEU 165 -21.783 4.811 -3.277 1229 HD12 LEU 165 HD12 LEU 165 -22.096 6.122 -4.408 1230 HD13 LEU 165 HD13 LEU 165 -23.331 4.893 -4.124 1231 HD21 LEU 165 HD21 LEU 165 -24.991 6.895 -3.469 1232 HD22 LEU 165 HD22 LEU 165 -23.647 7.989 -3.814 1233 HD23 LEU 165 HD23 LEU 165 -24.436 8.038 -2.240 1234 H GLU 166 H GLU 166 -23.236 2.389 -0.140 1235 HA GLU 166 HA GLU 166 -21.005 1.547 -1.898 1236 HB2 GLU 166 HB2 GLU 166 -21.816 0.241 0.745 1237 HB3 GLU 166 HB3 GLU 166 -20.728 -0.496 -0.427 1238 HG2 GLU 166 HG2 GLU 166 -19.134 1.373 -0.112 1239 HG3 GLU 166 HG3 GLU 166 -20.216 2.088 1.086 1240 H HIS 167 H HIS 167 -23.917 0.304 -0.190 1241 HA HIS 167 HA HIS 167 -25.500 -1.225 -0.673 1242 HB2 HIS 167 HB2 HIS 167 -25.213 0.124 -3.374 1243 HB3 HIS 167 HB3 HIS 167 -26.380 -1.169 -3.137 1244 HD1 HIS 167 HD1 HIS 167 -25.836 2.421 -2.532 1245 HD2 HIS 167 HD2 HIS 167 -28.522 -0.500 -1.313 1246 HE1 HIS 167 HE1 HIS 167 -27.801 3.670 -1.590 1247 HE2 HIS 167 HE2 HIS 167 -29.358 1.882 -0.754 1248 H HIS 168 H HIS 168 -23.092 -2.401 -0.400 1249 HA HIS 168 HA HIS 168 -22.451 -4.237 -2.527 1250 HB2 HIS 168 HB2 HIS 168 -21.498 -3.905 0.316 1251 HB3 HIS 168 HB3 HIS 168 -21.137 -5.404 -0.525 1252 HD1 HIS 168 HD1 HIS 168 -19.680 -2.226 0.111 1253 HD2 HIS 168 HD2 HIS 168 -19.784 -4.787 -3.156 1254 HE1 HIS 168 HE1 HIS 168 -17.712 -1.584 -1.300 1255 HE2 HIS 168 HE2 HIS 168 -17.883 -3.046 -3.341 1256 H HIS 169 H HIS 169 -24.622 -5.088 -2.902 1257 HA HIS 169 HA HIS 169 -25.464 -7.271 -1.107 1258 HB2 HIS 169 HB2 HIS 169 -27.210 -5.789 -2.133 1259 HB3 HIS 169 HB3 HIS 169 -26.703 -6.317 -3.733 1260 HD1 HIS 169 HD1 HIS 169 -27.805 -8.404 -4.625 1261 HD2 HIS 169 HD2 HIS 169 -28.397 -7.937 -0.536 1262 HE1 HIS 169 HE1 HIS 169 -29.412 -10.214 -3.967 1263 HE2 HIS 169 HE2 HIS 169 -29.691 -9.964 -1.482 1264 H HIS 170 H HIS 170 -23.501 -6.729 -3.878 1265 HA HIS 170 HA HIS 170 -23.015 -9.613 -4.199 1266 HB2 HIS 170 HB2 HIS 170 -24.555 -9.065 -6.026 1267 HB3 HIS 170 HB3 HIS 170 -23.554 -7.704 -6.521 1268 HD1 HIS 170 HD1 HIS 170 -22.222 -8.261 -8.546 1269 HD2 HIS 170 HD2 HIS 170 -22.787 -11.609 -6.152 1270 HE1 HIS 170 HE1 HIS 170 -21.027 -10.131 -9.721 1271 HE2 HIS 170 HE2 HIS 170 -21.338 -12.127 -8.236 1272 H HIS 171 H HIS 171 -20.920 -10.121 -4.366 1273 HA HIS 171 HA HIS 171 -18.958 -8.341 -5.573 1274 HB2 HIS 171 HB2 HIS 171 -18.882 -7.606 -3.203 1275 HB3 HIS 171 HB3 HIS 171 -18.636 -9.266 -2.672 1276 HD1 HIS 171 HD1 HIS 171 -16.265 -10.007 -2.451 1277 HD2 HIS 171 HD2 HIS 171 -16.597 -6.572 -4.760 1278 HE1 HIS 171 HE1 HIS 171 -13.912 -9.273 -2.900 1279 HE2 HIS 171 HE2 HIS 171 -14.162 -7.066 -4.073 1280 H HIS 172 H HIS 172 -18.828 -11.239 -3.424 1281 HA HIS 172 HA HIS 172 -17.921 -13.289 -3.590 1282 HB2 HIS 172 HB2 HIS 172 -19.787 -13.566 -5.212 1283 HB3 HIS 172 HB3 HIS 172 -18.731 -13.066 -6.523 1284 HD1 HIS 172 HD1 HIS 172 -18.982 -15.858 -3.950 1285 HD2 HIS 172 HD2 HIS 172 -17.438 -15.149 -7.733 1286 HE1 HIS 172 HE1 HIS 172 -18.159 -18.081 -4.755 1287 HE2 HIS 172 HE2 HIS 172 -17.048 -17.578 -6.949 Start of MODEL 15 1 H1 THR 1 H1 THR 1 -12.147 0.322 -7.869 2 H2 THR 1 H2 THR 1 -13.139 1.614 -7.423 3 H3 THR 1 H3 THR 1 -11.492 1.654 -7.056 4 HA THR 1 HA THR 1 -12.667 1.653 -9.770 5 HB THR 1 HB THR 1 -11.124 3.964 -8.598 6 HG1 THR 1 HG1 THR 1 -13.335 4.830 -8.076 7 HG21 THR 1 HG21 THR 1 -12.472 5.285 -10.202 8 HG22 THR 1 HG22 THR 1 -13.381 3.838 -10.647 9 HG23 THR 1 HG23 THR 1 -11.660 3.947 -11.029 10 H VAL 2 H VAL 2 -10.706 -0.182 -8.905 11 HA VAL 2 HA VAL 2 -8.080 0.749 -9.753 12 HB VAL 2 HB VAL 2 -9.142 -1.940 -8.874 13 HG11 VAL 2 HG11 VAL 2 -7.357 -2.387 -10.532 14 HG12 VAL 2 HG12 VAL 2 -6.787 -2.787 -8.912 15 HG13 VAL 2 HG13 VAL 2 -6.268 -1.285 -9.682 16 HG21 VAL 2 HG21 VAL 2 -7.697 -1.604 -6.901 17 HG22 VAL 2 HG22 VAL 2 -8.852 -0.281 -7.078 18 HG23 VAL 2 HG23 VAL 2 -7.167 -0.050 -7.550 19 H VAL 3 H VAL 3 -7.762 1.067 -11.844 20 HA VAL 3 HA VAL 3 -9.508 -0.067 -13.859 21 HB VAL 3 HB VAL 3 -8.224 1.473 -15.437 22 HG11 VAL 3 HG11 VAL 3 -9.483 2.772 -12.980 23 HG12 VAL 3 HG12 VAL 3 -10.361 2.157 -14.384 24 HG13 VAL 3 HG13 VAL 3 -9.274 3.535 -14.560 25 HG21 VAL 3 HG21 VAL 3 -6.913 2.447 -12.856 26 HG22 VAL 3 HG22 VAL 3 -6.755 3.207 -14.445 27 HG23 VAL 3 HG23 VAL 3 -6.085 1.599 -14.170 28 H SER 4 H SER 4 -6.398 -0.959 -12.636 29 HA SER 4 HA SER 4 -6.344 -3.254 -14.380 30 HB2 SER 4 HB2 SER 4 -5.210 -1.617 -15.869 31 HB3 SER 4 HB3 SER 4 -4.032 -1.273 -14.606 32 HG SER 4 HG SER 4 -3.076 -3.165 -14.937 33 H VAL 5 H VAL 5 -5.254 -4.965 -13.453 34 HA VAL 5 HA VAL 5 -3.332 -4.462 -11.237 35 HB VAL 5 HB VAL 5 -5.333 -6.772 -11.438 36 HG11 VAL 5 HG11 VAL 5 -3.187 -7.670 -10.601 37 HG12 VAL 5 HG12 VAL 5 -4.370 -7.614 -9.293 38 HG13 VAL 5 HG13 VAL 5 -3.105 -6.388 -9.387 39 HG21 VAL 5 HG21 VAL 5 -5.024 -4.603 -9.328 40 HG22 VAL 5 HG22 VAL 5 -6.200 -5.918 -9.287 41 HG23 VAL 5 HG23 VAL 5 -6.301 -4.684 -10.544 42 H ASP 6 H ASP 6 -1.441 -4.698 -12.254 43 HA ASP 6 HA ASP 6 -0.894 -6.937 -14.081 44 HB2 ASP 6 HB2 ASP 6 0.857 -4.524 -13.398 45 HB3 ASP 6 HB3 ASP 6 1.124 -5.681 -14.704 46 H LYS 7 H LYS 7 0.530 -8.591 -13.498 47 HA LYS 7 HA LYS 7 2.328 -8.175 -11.191 48 HB2 LYS 7 HB2 LYS 7 0.305 -9.541 -10.500 49 HB3 LYS 7 HB3 LYS 7 0.832 -10.798 -11.622 50 HG2 LYS 7 HG2 LYS 7 2.838 -11.206 -10.366 51 HG3 LYS 7 HG3 LYS 7 2.609 -9.740 -9.400 52 HD2 LYS 7 HD2 LYS 7 0.474 -10.805 -8.503 53 HD3 LYS 7 HD3 LYS 7 0.979 -12.304 -9.294 54 HE2 LYS 7 HE2 LYS 7 3.002 -12.379 -7.932 55 HE3 LYS 7 HE3 LYS 7 2.617 -10.815 -7.210 56 HZ1 LYS 7 HZ1 LYS 7 0.530 -11.891 -6.395 57 HZ2 LYS 7 HZ2 LYS 7 1.957 -12.448 -5.688 58 HZ3 LYS 7 HZ3 LYS 7 1.183 -13.373 -6.875 59 H ASP 8 H ASP 8 4.242 -8.108 -12.159 60 HA ASP 8 HA ASP 8 4.952 -9.845 -14.409 61 HB2 ASP 8 HB2 ASP 8 6.732 -7.788 -13.022 62 HB3 ASP 8 HB3 ASP 8 6.901 -8.447 -14.650 63 H VAL 9 H VAL 9 5.106 -11.890 -13.471 64 HA VAL 9 HA VAL 9 6.432 -12.378 -10.962 65 HB VAL 9 HB VAL 9 5.578 -14.429 -13.062 66 HG11 VAL 9 HG11 VAL 9 7.071 -15.370 -11.331 67 HG12 VAL 9 HG12 VAL 9 5.432 -16.000 -11.148 68 HG13 VAL 9 HG13 VAL 9 6.016 -14.734 -10.063 69 HG21 VAL 9 HG21 VAL 9 3.442 -14.606 -11.811 70 HG22 VAL 9 HG22 VAL 9 3.663 -12.986 -12.476 71 HG23 VAL 9 HG23 VAL 9 3.947 -13.280 -10.758 72 H GLU 10 H GLU 10 7.402 -12.521 -14.338 73 HA GLU 10 HA GLU 10 9.977 -13.727 -13.952 74 HB2 GLU 10 HB2 GLU 10 10.424 -12.959 -16.276 75 HB3 GLU 10 HB3 GLU 10 8.873 -13.778 -16.129 76 HG2 GLU 10 HG2 GLU 10 7.760 -11.515 -16.024 77 HG3 GLU 10 HG3 GLU 10 9.329 -10.789 -16.368 78 H ALA 11 H ALA 11 8.774 -10.408 -13.914 79 HA ALA 11 HA ALA 11 11.464 -9.260 -13.505 80 HB1 ALA 11 HB1 ALA 11 8.814 -7.839 -13.927 81 HB2 ALA 11 HB2 ALA 11 9.998 -8.194 -15.184 82 HB3 ALA 11 HB3 ALA 11 10.408 -7.081 -13.878 83 H LEU 12 H LEU 12 9.304 -10.662 -11.564 84 HA LEU 12 HA LEU 12 8.776 -10.730 -9.381 85 HB2 LEU 12 HB2 LEU 12 11.395 -9.244 -9.017 86 HB3 LEU 12 HB3 LEU 12 10.582 -10.225 -7.807 87 HG LEU 12 HG LEU 12 11.833 -11.241 -10.395 88 HD11 LEU 12 HD11 LEU 12 13.501 -10.616 -8.720 89 HD12 LEU 12 HD12 LEU 12 13.449 -12.363 -8.926 90 HD13 LEU 12 HD13 LEU 12 12.698 -11.622 -7.509 91 HD21 LEU 12 HD21 LEU 12 11.329 -13.513 -9.550 92 HD22 LEU 12 HD22 LEU 12 9.871 -12.582 -9.881 93 HD23 LEU 12 HD23 LEU 12 10.411 -12.805 -8.216 94 H SER 13 H SER 13 7.734 -8.346 -10.781 95 HA SER 13 HA SER 13 7.354 -6.522 -8.466 96 HB2 SER 13 HB2 SER 13 6.893 -4.718 -10.172 97 HB3 SER 13 HB3 SER 13 8.545 -5.326 -10.204 98 HG SER 13 HG SER 13 6.446 -5.868 -12.032 99 H PHE 14 H PHE 14 5.267 -5.464 -8.342 100 HA PHE 14 HA PHE 14 2.990 -6.752 -9.707 101 HB2 PHE 14 HB2 PHE 14 3.226 -8.047 -7.666 102 HB3 PHE 14 HB3 PHE 14 3.405 -6.596 -6.684 103 HD1 PHE 14 HD1 PHE 14 0.940 -8.166 -9.054 104 HD2 PHE 14 HD2 PHE 14 1.515 -5.869 -5.497 105 HE1 PHE 14 HE1 PHE 14 -1.483 -8.162 -8.665 106 HE2 PHE 14 HE2 PHE 14 -0.908 -5.866 -5.119 107 HZ PHE 14 HZ PHE 14 -2.411 -7.010 -6.698 108 H SER 15 H SER 15 2.038 -5.047 -10.658 109 HA SER 15 HA SER 15 2.071 -2.380 -9.373 110 HB2 SER 15 HB2 SER 15 3.266 -2.418 -11.481 111 HB3 SER 15 HB3 SER 15 1.912 -3.185 -12.298 112 HG SER 15 HG SER 15 1.079 -1.291 -12.594 113 H ILE 16 H ILE 16 0.169 -1.785 -8.478 114 HA ILE 16 HA ILE 16 -2.403 -2.609 -9.693 115 HB ILE 16 HB ILE 16 -1.860 -1.284 -6.990 116 HG12 ILE 16 HG12 ILE 16 -2.732 -4.137 -7.623 117 HG13 ILE 16 HG13 ILE 16 -1.113 -3.661 -7.119 118 HG21 ILE 16 HG21 ILE 16 -4.506 -2.283 -8.134 119 HG22 ILE 16 HG22 ILE 16 -4.065 -0.595 -7.866 120 HG23 ILE 16 HG23 ILE 16 -4.264 -1.681 -6.491 121 HD11 ILE 16 HD11 ILE 16 -3.621 -3.399 -5.461 122 HD12 ILE 16 HD12 ILE 16 -1.987 -2.946 -4.961 123 HD13 ILE 16 HD13 ILE 16 -2.372 -4.631 -5.295 124 H VAL 17 H VAL 17 -3.019 -1.229 -11.227 125 HA VAL 17 HA VAL 17 -2.421 1.645 -11.071 126 HB VAL 17 HB VAL 17 -3.646 0.091 -13.402 127 HG11 VAL 17 HG11 VAL 17 -2.360 2.853 -13.319 128 HG12 VAL 17 HG12 VAL 17 -4.090 2.530 -13.457 129 HG13 VAL 17 HG13 VAL 17 -2.998 2.057 -14.759 130 HG21 VAL 17 HG21 VAL 17 -1.404 -0.820 -12.938 131 HG22 VAL 17 HG22 VAL 17 -0.718 0.806 -12.972 132 HG23 VAL 17 HG23 VAL 17 -1.394 0.106 -14.443 133 H ALA 18 H ALA 18 -3.979 2.918 -10.281 134 HA ALA 18 HA ALA 18 -6.840 2.173 -10.440 135 HB1 ALA 18 HB1 ALA 18 -5.391 3.250 -7.985 136 HB2 ALA 18 HB2 ALA 18 -5.995 1.604 -8.194 137 HB3 ALA 18 HB3 ALA 18 -7.129 2.953 -8.110 138 H GLU 19 H GLU 19 -8.277 4.052 -10.260 139 HA GLU 19 HA GLU 19 -7.012 6.655 -10.899 140 HB2 GLU 19 HB2 GLU 19 -7.896 5.137 -12.930 141 HB3 GLU 19 HB3 GLU 19 -9.467 5.758 -12.445 142 HG2 GLU 19 HG2 GLU 19 -7.074 7.444 -13.250 143 HG3 GLU 19 HG3 GLU 19 -8.415 7.021 -14.308 144 H PHE 20 H PHE 20 -8.057 8.400 -9.961 145 HA PHE 20 HA PHE 20 -10.581 7.941 -8.481 146 HB2 PHE 20 HB2 PHE 20 -8.085 9.227 -7.264 147 HB3 PHE 20 HB3 PHE 20 -9.641 9.020 -6.460 148 HD1 PHE 20 HD1 PHE 20 -10.525 6.540 -6.279 149 HD2 PHE 20 HD2 PHE 20 -6.424 7.571 -6.961 150 HE1 PHE 20 HE1 PHE 20 -9.832 4.307 -5.526 151 HE2 PHE 20 HE2 PHE 20 -5.744 5.337 -6.200 152 HZ PHE 20 HZ PHE 20 -7.443 3.702 -5.492 153 H ASP 21 H ASP 21 -12.003 9.584 -8.726 154 HA ASP 21 HA ASP 21 -11.331 11.894 -10.328 155 HB2 ASP 21 HB2 ASP 21 -13.515 10.602 -10.491 156 HB3 ASP 21 HB3 ASP 21 -13.969 11.265 -8.928 157 H ALA 22 H ALA 22 -9.821 12.927 -9.029 158 HA ALA 22 HA ALA 22 -10.627 15.073 -7.402 159 HB1 ALA 22 HB1 ALA 22 -9.677 14.401 -5.205 160 HB2 ALA 22 HB2 ALA 22 -9.363 12.779 -5.830 161 HB3 ALA 22 HB3 ALA 22 -11.020 13.353 -5.660 162 H ASP 23 H ASP 23 -8.484 16.101 -6.347 163 HA ASP 23 HA ASP 23 -6.540 16.100 -8.531 164 HB2 ASP 23 HB2 ASP 23 -5.502 18.030 -7.381 165 HB3 ASP 23 HB3 ASP 23 -7.214 18.278 -7.655 166 H VAL 24 H VAL 24 -4.167 16.450 -7.715 167 HA VAL 24 HA VAL 24 -3.259 13.883 -7.009 168 HB VAL 24 HB VAL 24 -1.672 16.480 -7.154 169 HG11 VAL 24 HG11 VAL 24 0.286 15.035 -7.645 170 HG12 VAL 24 HG12 VAL 24 -0.713 13.598 -7.417 171 HG13 VAL 24 HG13 VAL 24 -0.381 14.668 -6.051 172 HG21 VAL 24 HG21 VAL 24 -2.230 14.428 -9.326 173 HG22 VAL 24 HG22 VAL 24 -1.193 15.849 -9.486 174 HG23 VAL 24 HG23 VAL 24 -2.926 16.051 -9.229 175 H LYS 25 H LYS 25 -3.339 16.928 -5.138 176 HA LYS 25 HA LYS 25 -2.056 15.882 -2.802 177 HB2 LYS 25 HB2 LYS 25 -3.587 18.412 -3.407 178 HB3 LYS 25 HB3 LYS 25 -3.249 18.014 -1.730 179 HG2 LYS 25 HG2 LYS 25 -0.874 17.879 -3.526 180 HG3 LYS 25 HG3 LYS 25 -1.583 19.481 -3.356 181 HD2 LYS 25 HD2 LYS 25 0.238 19.103 -1.717 182 HD3 LYS 25 HD3 LYS 25 -1.305 19.395 -0.919 183 HE2 LYS 25 HE2 LYS 25 -1.540 16.940 -0.540 184 HE3 LYS 25 HE3 LYS 25 0.036 16.687 -1.290 185 HZ1 LYS 25 HZ1 LYS 25 1.020 18.042 0.449 186 HZ2 LYS 25 HZ2 LYS 25 0.203 16.714 1.101 187 HZ3 LYS 25 HZ3 LYS 25 -0.493 18.254 1.171 188 H ARG 26 H ARG 26 -5.381 15.938 -3.899 189 HA ARG 26 HA ARG 26 -6.701 15.272 -1.468 190 HB2 ARG 26 HB2 ARG 26 -7.415 15.502 -4.313 191 HB3 ARG 26 HB3 ARG 26 -8.214 14.115 -3.602 192 HG2 ARG 26 HG2 ARG 26 -8.378 16.944 -2.515 193 HG3 ARG 26 HG3 ARG 26 -9.590 16.179 -3.550 194 HD2 ARG 26 HD2 ARG 26 -10.013 14.476 -1.827 195 HD3 ARG 26 HD3 ARG 26 -8.758 15.181 -0.798 196 HE ARG 26 HE ARG 26 -10.563 17.212 -1.350 197 HH11 ARG 26 HH11 ARG 26 -10.699 14.149 0.286 198 HH12 ARG 26 HH12 ARG 26 -11.944 14.678 1.358 199 HH21 ARG 26 HH21 ARG 26 -12.121 17.841 0.030 200 HH22 ARG 26 HH22 ARG 26 -12.727 16.751 1.225 201 H VAL 27 H VAL 27 -5.505 13.235 -4.140 202 HA VAL 27 HA VAL 27 -6.076 10.733 -2.830 203 HB VAL 27 HB VAL 27 -4.201 11.169 -5.200 204 HG11 VAL 27 HG11 VAL 27 -4.003 8.925 -4.185 205 HG12 VAL 27 HG12 VAL 27 -4.766 8.812 -5.774 206 HG13 VAL 27 HG13 VAL 27 -5.750 8.695 -4.312 207 HG21 VAL 27 HG21 VAL 27 -7.213 10.695 -5.261 208 HG22 VAL 27 HG22 VAL 27 -6.152 10.733 -6.672 209 HG23 VAL 27 HG23 VAL 27 -6.391 12.194 -5.709 210 H TRP 28 H TRP 28 -3.234 12.851 -3.024 211 HA TRP 28 HA TRP 28 -1.330 11.114 -1.814 212 HB2 TRP 28 HB2 TRP 28 -0.697 13.145 -3.081 213 HB3 TRP 28 HB3 TRP 28 -1.411 14.158 -1.837 214 HD1 TRP 28 HD1 TRP 28 0.162 14.825 0.166 215 HE1 TRP 28 HE1 TRP 28 2.575 14.268 0.828 216 HE3 TRP 28 HE3 TRP 28 1.065 11.055 -3.175 217 HZ2 TRP 28 HZ2 TRP 28 4.603 12.479 0.031 218 HZ3 TRP 28 HZ3 TRP 28 3.277 9.979 -3.164 219 HH2 TRP 28 HH2 TRP 28 5.009 10.679 -1.589 220 H ALA 29 H ALA 29 -3.765 13.274 -0.443 221 HA ALA 29 HA ALA 29 -2.842 13.601 2.171 222 HB1 ALA 29 HB1 ALA 29 -4.723 14.861 1.207 223 HB2 ALA 29 HB2 ALA 29 -5.161 14.144 2.758 224 HB3 ALA 29 HB3 ALA 29 -5.726 13.411 1.251 225 H ILE 30 H ILE 30 -4.387 10.778 0.740 226 HA ILE 30 HA ILE 30 -5.118 9.448 3.173 227 HB ILE 30 HB ILE 30 -5.565 7.485 1.871 228 HG12 ILE 30 HG12 ILE 30 -3.798 8.700 -0.292 229 HG13 ILE 30 HG13 ILE 30 -3.468 7.253 0.639 230 HG21 ILE 30 HG21 ILE 30 -7.001 8.332 0.061 231 HG22 ILE 30 HG22 ILE 30 -6.179 9.895 0.125 232 HG23 ILE 30 HG23 ILE 30 -7.136 9.344 1.504 233 HD11 ILE 30 HD11 ILE 30 -4.079 6.655 -1.563 234 HD12 ILE 30 HD12 ILE 30 -5.553 7.616 -1.488 235 HD13 ILE 30 HD13 ILE 30 -5.390 6.170 -0.486 236 H TRP 31 H TRP 31 -2.135 9.636 1.319 237 HA TRP 31 HA TRP 31 -0.759 7.531 2.808 238 HB2 TRP 31 HB2 TRP 31 0.239 9.495 0.685 239 HB3 TRP 31 HB3 TRP 31 1.202 8.186 1.371 240 HD1 TRP 31 HD1 TRP 31 -1.139 8.866 -1.471 241 HE1 TRP 31 HE1 TRP 31 -1.769 6.663 -2.647 242 HE3 TRP 31 HE3 TRP 31 0.686 5.539 1.973 243 HZ2 TRP 31 HZ2 TRP 31 -1.509 3.886 -2.186 244 HZ3 TRP 31 HZ3 TRP 31 0.471 3.132 1.524 245 HH2 TRP 31 HH2 TRP 31 -0.616 2.317 -0.505 246 H GLU 32 H GLU 32 -0.865 11.032 2.653 247 HA GLU 32 HA GLU 32 1.476 11.566 4.192 248 HB2 GLU 32 HB2 GLU 32 0.542 13.063 2.433 249 HB3 GLU 32 HB3 GLU 32 -0.867 13.373 3.442 250 HG2 GLU 32 HG2 GLU 32 0.512 14.505 5.098 251 HG3 GLU 32 HG3 GLU 32 1.981 14.071 4.223 252 H ASP 33 H ASP 33 -2.020 11.672 4.896 253 HA ASP 33 HA ASP 33 -1.605 12.215 7.736 254 HB2 ASP 33 HB2 ASP 33 -4.093 11.856 6.032 255 HB3 ASP 33 HB3 ASP 33 -4.169 12.133 7.763 256 HA PRO 34 HA PRO 34 -1.390 7.721 8.760 257 HB2 PRO 34 HB2 PRO 34 -1.824 8.209 11.522 258 HB3 PRO 34 HB3 PRO 34 -0.258 8.118 10.718 259 HG2 PRO 34 HG2 PRO 34 -1.907 10.540 11.391 260 HG3 PRO 34 HG3 PRO 34 -0.149 10.313 11.524 261 HD2 PRO 34 HD2 PRO 34 -1.150 11.717 9.493 262 HD3 PRO 34 HD3 PRO 34 0.181 10.577 9.190 263 H ARG 35 H ARG 35 -3.914 9.919 9.991 264 HA ARG 35 HA ARG 35 -5.773 7.854 10.735 265 HB2 ARG 35 HB2 ARG 35 -6.299 10.817 10.295 266 HB3 ARG 35 HB3 ARG 35 -7.350 9.692 11.151 267 HG2 ARG 35 HG2 ARG 35 -4.571 10.550 12.037 268 HG3 ARG 35 HG3 ARG 35 -6.092 11.163 12.683 269 HD2 ARG 35 HD2 ARG 35 -5.437 9.596 14.294 270 HD3 ARG 35 HD3 ARG 35 -6.572 8.675 13.317 271 HE ARG 35 HE ARG 35 -4.733 7.481 12.353 272 HH11 ARG 35 HH11 ARG 35 -3.750 9.522 14.998 273 HH12 ARG 35 HH12 ARG 35 -2.323 8.595 15.291 274 HH21 ARG 35 HH21 ARG 35 -2.898 6.347 12.779 275 HH22 ARG 35 HH22 ARG 35 -1.854 6.837 14.066 276 H GLN 36 H GLN 36 -5.386 9.918 7.848 277 HA GLN 36 HA GLN 36 -7.725 8.962 6.466 278 HB2 GLN 36 HB2 GLN 36 -5.240 10.344 5.379 279 HB3 GLN 36 HB3 GLN 36 -6.703 10.037 4.447 280 HG2 GLN 36 HG2 GLN 36 -6.637 11.750 6.944 281 HG3 GLN 36 HG3 GLN 36 -6.400 12.386 5.320 282 HE21 GLN 36 HE21 GLN 36 -8.182 13.722 5.508 283 HE22 GLN 36 HE22 GLN 36 -9.798 13.130 5.463 284 H LEU 37 H LEU 37 -4.477 7.782 6.873 285 HA LEU 37 HA LEU 37 -4.413 5.982 4.644 286 HB2 LEU 37 HB2 LEU 37 -2.382 6.806 5.714 287 HB3 LEU 37 HB3 LEU 37 -2.843 6.071 7.241 288 HG LEU 37 HG LEU 37 -2.511 3.818 6.293 289 HD11 LEU 37 HD11 LEU 37 -1.630 5.177 3.727 290 HD12 LEU 37 HD12 LEU 37 -3.114 4.241 3.942 291 HD13 LEU 37 HD13 LEU 37 -1.544 3.444 4.084 292 HD21 LEU 37 HD21 LEU 37 -0.080 3.899 6.063 293 HD22 LEU 37 HD22 LEU 37 -0.634 4.941 7.372 294 HD23 LEU 37 HD23 LEU 37 -0.144 5.650 5.829 295 H GLU 38 H GLU 38 -4.980 5.463 8.158 296 HA GLU 38 HA GLU 38 -5.793 2.704 7.822 297 HB2 GLU 38 HB2 GLU 38 -6.255 2.756 10.246 298 HB3 GLU 38 HB3 GLU 38 -4.680 3.441 9.865 299 HG2 GLU 38 HG2 GLU 38 -5.724 5.739 10.034 300 HG3 GLU 38 HG3 GLU 38 -7.193 4.959 10.627 301 H ARG 39 H ARG 39 -7.386 5.549 7.167 302 HA ARG 39 HA ARG 39 -10.112 4.911 7.680 303 HB2 ARG 39 HB2 ARG 39 -9.415 7.183 7.234 304 HB3 ARG 39 HB3 ARG 39 -8.660 6.725 5.725 305 HG2 ARG 39 HG2 ARG 39 -10.589 7.968 5.179 306 HG3 ARG 39 HG3 ARG 39 -10.947 6.291 4.781 307 HD2 ARG 39 HD2 ARG 39 -11.808 7.479 7.416 308 HD3 ARG 39 HD3 ARG 39 -12.754 7.742 5.954 309 HE ARG 39 HE ARG 39 -12.148 5.019 6.952 310 HH11 ARG 39 HH11 ARG 39 -14.489 7.343 5.878 311 HH12 ARG 39 HH12 ARG 39 -15.789 6.214 5.965 312 HH21 ARG 39 HH21 ARG 39 -13.836 3.605 7.017 313 HH22 ARG 39 HH22 ARG 39 -15.422 4.126 6.582 314 H TRP 40 H TRP 40 -7.811 3.715 5.350 315 HA TRP 40 HA TRP 40 -9.907 2.062 4.074 316 HB2 TRP 40 HB2 TRP 40 -8.900 2.412 1.832 317 HB3 TRP 40 HB3 TRP 40 -9.504 3.915 2.525 318 HD1 TRP 40 HD1 TRP 40 -7.629 5.703 3.396 319 HE1 TRP 40 HE1 TRP 40 -5.201 6.078 2.644 320 HE3 TRP 40 HE3 TRP 40 -6.814 1.284 0.987 321 HZ2 TRP 40 HZ2 TRP 40 -3.216 4.711 1.178 322 HZ3 TRP 40 HZ3 TRP 40 -4.641 0.889 -0.083 323 HH2 TRP 40 HH2 TRP 40 -2.877 2.571 0.016 324 H TRP 41 H TRP 41 -6.703 2.239 5.356 325 HA TRP 41 HA TRP 41 -5.314 0.282 3.864 326 HB2 TRP 41 HB2 TRP 41 -4.357 2.021 5.501 327 HB3 TRP 41 HB3 TRP 41 -4.794 0.926 6.806 328 HD1 TRP 41 HD1 TRP 41 -2.847 -0.662 7.508 329 HE1 TRP 41 HE1 TRP 41 -0.650 -1.456 6.451 330 HE3 TRP 41 HE3 TRP 41 -3.387 1.393 2.862 331 HZ2 TRP 41 HZ2 TRP 41 0.677 -1.248 3.982 332 HZ3 TRP 41 HZ3 TRP 41 -1.633 1.025 1.208 333 HH2 TRP 41 HH2 TRP 41 0.377 -0.272 1.743 334 H GLY 42 H GLY 42 -5.923 -1.799 3.651 335 HA2 GLY 42 HA2 GLY 42 -6.174 -4.029 4.428 336 HA3 GLY 42 HA3 GLY 42 -6.747 -3.431 5.978 337 HA PRO 43 HA PRO 43 -10.396 -4.506 3.055 338 HB2 PRO 43 HB2 PRO 43 -11.085 -7.003 3.885 339 HB3 PRO 43 HB3 PRO 43 -9.805 -6.747 2.686 340 HG2 PRO 43 HG2 PRO 43 -9.559 -7.269 5.647 341 HG3 PRO 43 HG3 PRO 43 -8.637 -7.990 4.310 342 HD2 PRO 43 HD2 PRO 43 -7.693 -5.900 5.842 343 HD3 PRO 43 HD3 PRO 43 -7.193 -6.164 4.159 344 HA PRO 44 HA PRO 44 -13.462 -3.196 6.103 345 HB2 PRO 44 HB2 PRO 44 -15.781 -4.538 5.357 346 HB3 PRO 44 HB3 PRO 44 -15.132 -3.136 4.492 347 HG2 PRO 44 HG2 PRO 44 -14.747 -6.074 3.890 348 HG3 PRO 44 HG3 PRO 44 -15.196 -4.765 2.772 349 HD2 PRO 44 HD2 PRO 44 -12.668 -5.626 2.864 350 HD3 PRO 44 HD3 PRO 44 -12.993 -3.883 2.729 351 H THR 45 H THR 45 -12.738 -6.565 5.882 352 HA THR 45 HA THR 45 -14.084 -7.355 8.361 353 HB THR 45 HB THR 45 -13.096 -9.616 7.844 354 HG1 THR 45 HG1 THR 45 -11.719 -9.858 6.201 355 HG21 THR 45 HG21 THR 45 -14.449 -10.067 5.825 356 HG22 THR 45 HG22 THR 45 -14.580 -8.335 5.516 357 HG23 THR 45 HG23 THR 45 -15.332 -9.033 6.952 358 H TRP 46 H TRP 46 -10.837 -6.526 7.243 359 HA TRP 46 HA TRP 46 -9.752 -6.826 9.997 360 HB2 TRP 46 HB2 TRP 46 -8.334 -7.424 7.363 361 HB3 TRP 46 HB3 TRP 46 -7.500 -7.290 8.903 362 HD1 TRP 46 HD1 TRP 46 -10.336 -9.509 7.374 363 HE1 TRP 46 HE1 TRP 46 -10.092 -11.872 8.347 364 HE3 TRP 46 HE3 TRP 46 -6.375 -8.706 10.494 365 HZ2 TRP 46 HZ2 TRP 46 -8.439 -13.236 10.156 366 HZ3 TRP 46 HZ3 TRP 46 -5.504 -10.600 11.805 367 HH2 TRP 46 HH2 TRP 46 -6.514 -12.824 11.638 368 HA PRO 47 HA PRO 47 -9.195 -2.358 8.637 369 HB2 PRO 47 HB2 PRO 47 -10.110 -1.175 10.925 370 HB3 PRO 47 HB3 PRO 47 -11.197 -1.719 9.639 371 HG2 PRO 47 HG2 PRO 47 -10.464 -3.120 12.218 372 HG3 PRO 47 HG3 PRO 47 -12.072 -2.899 11.492 373 HD2 PRO 47 HD2 PRO 47 -10.668 -5.222 11.225 374 HD3 PRO 47 HD3 PRO 47 -11.759 -4.627 9.955 375 H ALA 48 H ALA 48 -7.181 -1.464 8.849 376 HA ALA 48 HA ALA 48 -5.385 -2.330 10.985 377 HB1 ALA 48 HB1 ALA 48 -4.562 -2.248 8.675 378 HB2 ALA 48 HB2 ALA 48 -3.633 -1.174 9.723 379 HB3 ALA 48 HB3 ALA 48 -4.845 -0.507 8.626 380 H THR 49 H THR 49 -4.294 -0.931 12.419 381 HA THR 49 HA THR 49 -5.219 1.876 12.673 382 HB THR 49 HB THR 49 -4.945 -0.078 15.011 383 HG1 THR 49 HG1 THR 49 -7.136 0.823 13.503 384 HG21 THR 49 HG21 THR 49 -5.881 1.762 16.391 385 HG22 THR 49 HG22 THR 49 -5.843 2.834 14.987 386 HG23 THR 49 HG23 THR 49 -4.334 2.221 15.675 387 H PHE 50 H PHE 50 -3.484 3.229 12.695 388 HA PHE 50 HA PHE 50 -0.783 2.120 12.993 389 HB2 PHE 50 HB2 PHE 50 -1.845 4.724 11.847 390 HB3 PHE 50 HB3 PHE 50 -0.128 4.511 12.181 391 HD1 PHE 50 HD1 PHE 50 -2.978 3.012 10.264 392 HD2 PHE 50 HD2 PHE 50 1.272 3.395 10.628 393 HE1 PHE 50 HE1 PHE 50 -2.682 1.831 8.130 394 HE2 PHE 50 HE2 PHE 50 1.557 2.209 8.496 395 HZ PHE 50 HZ PHE 50 -0.417 1.424 7.246 396 H GLU 51 H GLU 51 -0.128 1.977 15.035 397 HA GLU 51 HA GLU 51 -0.496 3.938 17.094 398 HB2 GLU 51 HB2 GLU 51 1.662 1.798 16.875 399 HB3 GLU 51 HB3 GLU 51 1.166 2.632 18.348 400 HG2 GLU 51 HG2 GLU 51 -0.465 0.645 16.725 401 HG3 GLU 51 HG3 GLU 51 0.232 0.389 18.322 402 H THR 52 H THR 52 1.983 3.262 14.716 403 HA THR 52 HA THR 52 3.184 5.925 15.208 404 HB THR 52 HB THR 52 4.806 3.501 14.290 405 HG1 THR 52 HG1 THR 52 4.075 4.283 16.913 406 HG21 THR 52 HG21 THR 52 5.586 6.097 15.656 407 HG22 THR 52 HG22 THR 52 5.804 5.743 13.941 408 HG23 THR 52 HG23 THR 52 6.702 4.822 15.149 409 H HIS 53 H HIS 53 3.489 7.127 13.341 410 HA HIS 53 HA HIS 53 3.916 5.870 10.767 411 HB2 HIS 53 HB2 HIS 53 1.445 5.949 10.837 412 HB3 HIS 53 HB3 HIS 53 1.491 7.671 11.189 413 HD2 HIS 53 HD2 HIS 53 2.101 5.250 8.148 414 HE1 HIS 53 HE1 HIS 53 1.671 9.215 6.745 415 HE2 HIS 53 HE2 HIS 53 1.676 6.777 6.100 416 H GLU 54 H GLU 54 5.920 6.817 10.883 417 HA GLU 54 HA GLU 54 6.221 9.730 11.086 418 HB2 GLU 54 HB2 GLU 54 8.459 7.720 10.575 419 HB3 GLU 54 HB3 GLU 54 8.590 9.338 11.263 420 HG2 GLU 54 HG2 GLU 54 7.382 6.894 12.584 421 HG3 GLU 54 HG3 GLU 54 8.943 7.619 12.944 422 H PHE 55 H PHE 55 5.303 10.462 9.126 423 HA PHE 55 HA PHE 55 5.947 9.298 6.581 424 HB2 PHE 55 HB2 PHE 55 3.735 10.427 7.238 425 HB3 PHE 55 HB3 PHE 55 4.566 11.972 7.071 426 HD1 PHE 55 HD1 PHE 55 3.913 8.809 5.190 427 HD2 PHE 55 HD2 PHE 55 4.529 13.025 4.923 428 HE1 PHE 55 HE1 PHE 55 3.445 8.720 2.774 429 HE2 PHE 55 HE2 PHE 55 4.044 12.935 2.505 430 HZ PHE 55 HZ PHE 55 3.504 10.778 1.436 431 H THR 56 H THR 56 8.338 9.607 7.206 432 HA THR 56 HA THR 56 9.400 11.902 5.681 433 HB THR 56 HB THR 56 9.681 12.554 8.041 434 HG1 THR 56 HG1 THR 56 11.750 13.160 7.792 435 HG21 THR 56 HG21 THR 56 9.707 10.323 9.108 436 HG22 THR 56 HG22 THR 56 11.112 11.279 9.588 437 HG23 THR 56 HG23 THR 56 11.290 10.000 8.386 438 H VAL 57 H VAL 57 11.698 11.533 5.038 439 HA VAL 57 HA VAL 57 12.031 8.991 3.767 440 HB VAL 57 HB VAL 57 13.996 11.312 4.038 441 HG11 VAL 57 HG11 VAL 57 15.164 9.246 3.397 442 HG12 VAL 57 HG12 VAL 57 15.117 10.367 2.036 443 HG13 VAL 57 HG13 VAL 57 14.019 8.987 2.078 444 HG21 VAL 57 HG21 VAL 57 13.206 12.009 1.791 445 HG22 VAL 57 HG22 VAL 57 11.887 12.021 2.965 446 HG23 VAL 57 HG23 VAL 57 12.018 10.701 1.800 447 H GLY 58 H GLY 58 12.690 7.196 4.806 448 HA2 GLY 58 HA2 GLY 58 14.206 5.830 5.996 449 HA3 GLY 58 HA3 GLY 58 14.876 7.242 6.790 450 H GLY 59 H GLY 59 11.617 7.665 7.007 451 HA2 GLY 59 HA2 GLY 59 11.535 6.901 9.821 452 HA3 GLY 59 HA3 GLY 59 10.313 7.803 8.935 453 H LYS 60 H LYS 60 9.659 5.732 10.749 454 HA LYS 60 HA LYS 60 8.750 3.525 8.977 455 HB2 LYS 60 HB2 LYS 60 9.774 3.297 11.839 456 HB3 LYS 60 HB3 LYS 60 8.981 1.988 10.960 457 HG2 LYS 60 HG2 LYS 60 10.795 2.145 9.226 458 HG3 LYS 60 HG3 LYS 60 11.617 3.315 10.267 459 HD2 LYS 60 HD2 LYS 60 11.823 1.622 12.040 460 HD3 LYS 60 HD3 LYS 60 10.922 0.455 11.062 461 HE2 LYS 60 HE2 LYS 60 12.718 0.505 9.364 462 HE3 LYS 60 HE3 LYS 60 13.620 1.662 10.346 463 HZ1 LYS 60 HZ1 LYS 60 13.740 -0.030 12.092 464 HZ2 LYS 60 HZ2 LYS 60 14.463 -0.539 10.654 465 HZ3 LYS 60 HZ3 LYS 60 12.940 -1.129 11.084 466 H ALA 61 H ALA 61 6.972 2.198 10.015 467 HA ALA 61 HA ALA 61 5.069 3.748 11.627 468 HB1 ALA 61 HB1 ALA 61 4.330 2.609 8.900 469 HB2 ALA 61 HB2 ALA 61 4.512 4.317 9.288 470 HB3 ALA 61 HB3 ALA 61 3.222 3.379 10.039 471 H ALA 62 H ALA 62 3.732 2.502 12.865 472 HA ALA 62 HA ALA 62 3.999 -0.458 12.763 473 HB1 ALA 62 HB1 ALA 62 5.118 0.459 14.753 474 HB2 ALA 62 HB2 ALA 62 3.683 -0.457 15.222 475 HB3 ALA 62 HB3 ALA 62 3.642 1.310 15.218 476 H TYR 63 H TYR 63 2.129 -1.448 12.275 477 HA TYR 63 HA TYR 63 -0.441 -0.320 13.180 478 HB2 TYR 63 HB2 TYR 63 -1.491 -0.684 10.979 479 HB3 TYR 63 HB3 TYR 63 -0.174 0.467 10.862 480 HD1 TYR 63 HD1 TYR 63 1.992 -0.210 9.738 481 HD2 TYR 63 HD2 TYR 63 -1.426 -2.783 9.732 482 HE1 TYR 63 HE1 TYR 63 2.975 -1.509 7.899 483 HE2 TYR 63 HE2 TYR 63 -0.443 -4.085 7.894 484 HH TYR 63 HH TYR 63 2.815 -3.776 6.942 485 H TYR 64 H TYR 64 -2.244 -1.870 12.931 486 HA TYR 64 HA TYR 64 -1.596 -4.685 12.549 487 HB2 TYR 64 HB2 TYR 64 -2.585 -5.386 14.730 488 HB3 TYR 64 HB3 TYR 64 -1.138 -4.419 14.950 489 HD1 TYR 64 HD2 TYR 64 -1.514 -1.835 15.455 490 HD2 TYR 64 HD1 TYR 64 -4.545 -4.819 15.953 491 HE1 TYR 64 HE2 TYR 64 -2.741 -0.353 16.982 492 HE2 TYR 64 HE1 TYR 64 -5.765 -3.328 17.472 493 HH TYR 64 HH TYR 64 -5.281 -1.423 18.961 494 H MET 65 H MET 65 -3.253 -5.711 11.545 495 HA MET 65 HA MET 65 -5.820 -4.345 11.174 496 HB2 MET 65 HB2 MET 65 -4.735 -6.910 9.932 497 HB3 MET 65 HB3 MET 65 -6.302 -6.201 9.554 498 HG2 MET 65 HG2 MET 65 -4.871 -5.563 7.791 499 HG3 MET 65 HG3 MET 65 -5.034 -4.126 8.791 500 HE1 MET 65 HE1 MET 65 -2.720 -6.929 7.459 501 HE2 MET 65 HE2 MET 65 -2.726 -7.394 9.164 502 HE3 MET 65 HE3 MET 65 -1.256 -6.751 8.430 503 H THR 66 H THR 66 -7.131 -4.595 12.927 504 HA THR 66 HA THR 66 -7.152 -6.990 14.545 505 HB THR 66 HB THR 66 -9.089 -4.636 14.604 506 HG1 THR 66 HG1 THR 66 -7.622 -3.653 15.773 507 HG21 THR 66 HG21 THR 66 -8.572 -6.807 16.679 508 HG22 THR 66 HG22 THR 66 -10.053 -6.610 15.734 509 HG23 THR 66 HG23 THR 66 -9.592 -5.386 16.921 510 H GLY 67 H GLY 67 -7.946 -8.792 13.661 511 HA2 GLY 67 HA2 GLY 67 -9.843 -9.012 11.593 512 HA3 GLY 67 HA3 GLY 67 -9.302 -10.316 12.632 513 HA PRO 68 HA PRO 68 -13.977 -9.206 13.105 514 HB2 PRO 68 HB2 PRO 68 -14.869 -11.831 12.687 515 HB3 PRO 68 HB3 PRO 68 -14.743 -10.604 11.421 516 HG2 PRO 68 HG2 PRO 68 -12.764 -12.766 12.167 517 HG3 PRO 68 HG3 PRO 68 -13.324 -12.277 10.552 518 HD2 PRO 68 HD2 PRO 68 -10.952 -11.445 11.447 519 HD3 PRO 68 HD3 PRO 68 -12.001 -10.318 10.552 520 H ASP 69 H ASP 69 -12.052 -11.914 14.351 521 HA ASP 69 HA ASP 69 -13.672 -12.237 16.759 522 HB2 ASP 69 HB2 ASP 69 -11.081 -13.603 15.909 523 HB3 ASP 69 HB3 ASP 69 -12.136 -14.109 17.231 524 H GLY 70 H GLY 70 -11.830 -9.760 16.151 525 HA2 GLY 70 HA2 GLY 70 -10.389 -8.348 17.256 526 HA3 GLY 70 HA3 GLY 70 -10.671 -9.290 18.720 527 H THR 71 H THR 71 -9.385 -10.365 15.609 528 HA THR 71 HA THR 71 -7.582 -12.171 16.830 529 HB THR 71 HB THR 71 -7.639 -11.351 13.893 530 HG1 THR 71 HG1 THR 71 -9.048 -13.562 14.984 531 HG21 THR 71 HG21 THR 71 -6.755 -13.951 15.218 532 HG22 THR 71 HG22 THR 71 -5.682 -12.754 14.486 533 HG23 THR 71 HG23 THR 71 -6.827 -13.647 13.483 534 H LYS 72 H LYS 72 -7.012 -9.107 15.117 535 HA LYS 72 HA LYS 72 -5.265 -7.706 14.856 536 HB2 LYS 72 HB2 LYS 72 -4.304 -8.962 17.450 537 HB3 LYS 72 HB3 LYS 72 -3.566 -7.541 16.710 538 HG2 LYS 72 HG2 LYS 72 -5.688 -6.305 16.963 539 HG3 LYS 72 HG3 LYS 72 -6.428 -7.728 17.715 540 HD2 LYS 72 HD2 LYS 72 -4.849 -7.615 19.581 541 HD3 LYS 72 HD3 LYS 72 -3.966 -6.297 18.803 542 HE2 LYS 72 HE2 LYS 72 -5.971 -4.852 19.019 543 HE3 LYS 72 HE3 LYS 72 -6.818 -6.165 19.842 544 HZ1 LYS 72 HZ1 LYS 72 -5.231 -6.073 21.618 545 HZ2 LYS 72 HZ2 LYS 72 -5.856 -4.525 21.365 546 HZ3 LYS 72 HZ3 LYS 72 -4.308 -4.909 20.812 547 H ALA 73 H ALA 73 -4.225 -8.264 13.012 548 HA ALA 73 HA ALA 73 -1.854 -10.042 13.166 549 HB1 ALA 73 HB1 ALA 73 -3.367 -9.075 10.705 550 HB2 ALA 73 HB2 ALA 73 -3.466 -10.688 11.414 551 HB3 ALA 73 HB3 ALA 73 -1.951 -10.134 10.699 552 H ARG 74 H ARG 74 -0.187 -8.720 13.847 553 HA ARG 74 HA ARG 74 -0.007 -5.939 13.219 554 HB2 ARG 74 HB2 ARG 74 1.904 -7.870 14.551 555 HB3 ARG 74 HB3 ARG 74 2.454 -6.258 14.109 556 HG2 ARG 74 HG2 ARG 74 0.529 -5.329 15.490 557 HG3 ARG 74 HG3 ARG 74 0.257 -6.972 16.079 558 HD2 ARG 74 HD2 ARG 74 2.405 -7.038 17.148 559 HD3 ARG 74 HD3 ARG 74 2.937 -5.563 16.332 560 HE ARG 74 HE ARG 74 0.671 -4.938 17.849 561 HH11 ARG 74 HH11 ARG 74 3.934 -5.921 18.465 562 HH12 ARG 74 HH12 ARG 74 4.017 -5.052 19.951 563 HH21 ARG 74 HH21 ARG 74 0.823 -3.821 19.726 564 HH22 ARG 74 HH22 ARG 74 2.272 -3.880 20.660 565 H GLY 75 H GLY 75 1.440 -4.821 11.941 566 HA2 GLY 75 HA2 GLY 75 3.306 -6.257 10.176 567 HA3 GLY 75 HA3 GLY 75 2.109 -5.185 9.450 568 H TRP 76 H TRP 76 5.027 -4.998 9.449 569 HA TRP 76 HA TRP 76 5.423 -2.385 10.799 570 HB2 TRP 76 HB2 TRP 76 7.854 -2.768 10.592 571 HB3 TRP 76 HB3 TRP 76 7.096 -4.103 11.456 572 HD1 TRP 76 HD1 TRP 76 7.056 -6.512 10.221 573 HE1 TRP 76 HE1 TRP 76 8.368 -7.445 8.221 574 HE3 TRP 76 HE3 TRP 76 9.004 -2.133 8.381 575 HZ2 TRP 76 HZ2 TRP 76 10.000 -6.481 6.145 576 HZ3 TRP 76 HZ3 TRP 76 10.437 -2.223 6.381 577 HH2 TRP 76 HH2 TRP 76 10.933 -4.360 5.286 578 H TRP 77 H TRP 77 6.322 -0.684 9.579 579 HA TRP 77 HA TRP 77 6.363 -0.928 6.624 580 HB2 TRP 77 HB2 TRP 77 4.245 0.189 8.108 581 HB3 TRP 77 HB3 TRP 77 5.187 1.604 7.679 582 HD1 TRP 77 HD1 TRP 77 4.650 -1.381 5.257 583 HE1 TRP 77 HE1 TRP 77 3.233 -0.544 3.286 584 HE3 TRP 77 HE3 TRP 77 3.582 3.314 6.952 585 HZ2 TRP 77 HZ2 TRP 77 1.818 1.793 2.553 586 HZ3 TRP 77 HZ3 TRP 77 2.192 4.782 5.563 587 HH2 TRP 77 HH2 TRP 77 1.328 4.040 3.410 588 H GLN 78 H GLN 78 7.797 0.588 5.565 589 HA GLN 78 HA GLN 78 9.247 2.548 7.192 590 HB2 GLN 78 HB2 GLN 78 10.617 0.541 7.508 591 HB3 GLN 78 HB3 GLN 78 10.716 0.290 5.765 592 HG2 GLN 78 HG2 GLN 78 12.017 2.352 5.505 593 HG3 GLN 78 HG3 GLN 78 11.828 2.719 7.220 594 HE21 GLN 78 HE21 GLN 78 14.077 2.794 7.506 595 HE22 GLN 78 HE22 GLN 78 15.054 1.372 7.525 596 H PHE 79 H PHE 79 9.040 4.363 6.051 597 HA PHE 79 HA PHE 79 8.863 4.548 3.189 598 HB2 PHE 79 HB2 PHE 79 9.374 6.727 5.265 599 HB3 PHE 79 HB3 PHE 79 8.969 7.010 3.574 600 HD1 PHE 79 HD2 PHE 79 6.704 6.289 2.706 601 HD2 PHE 79 HD1 PHE 79 7.654 6.310 6.879 602 HE1 PHE 79 HE2 PHE 79 4.313 6.264 3.259 603 HE2 PHE 79 HE1 PHE 79 5.257 6.282 7.419 604 HZ PHE 79 HZ PHE 79 3.591 6.264 5.612 605 H THR 80 H THR 80 10.469 4.816 1.723 606 HA THR 80 HA THR 80 13.284 5.129 2.620 607 HB THR 80 HB THR 80 13.925 4.030 0.532 608 HG1 THR 80 HG1 THR 80 12.615 4.262 -1.102 609 HG21 THR 80 HG21 THR 80 13.314 2.471 2.328 610 HG22 THR 80 HG22 THR 80 12.808 1.816 0.763 611 HG23 THR 80 HG23 THR 80 11.617 2.545 1.842 612 H THR 81 H THR 81 10.836 6.436 0.441 613 HA THR 81 HA THR 81 12.493 8.750 -0.272 614 HB THR 81 HB THR 81 11.364 6.858 -2.396 615 HG1 THR 81 HG1 THR 81 13.831 7.102 -1.255 616 HG21 THR 81 HG21 THR 81 11.086 9.187 -3.147 617 HG22 THR 81 HG22 THR 81 12.357 8.383 -4.073 618 HG23 THR 81 HG23 THR 81 12.782 9.518 -2.789 619 H ILE 82 H ILE 82 11.190 10.466 0.048 620 HA ILE 82 HA ILE 82 8.353 10.357 -0.819 621 HB ILE 82 HB ILE 82 9.306 11.791 1.714 622 HG12 ILE 82 HG12 ILE 82 7.782 9.168 1.398 623 HG13 ILE 82 HG13 ILE 82 9.348 9.395 2.157 624 HG21 ILE 82 HG21 ILE 82 7.414 12.932 0.609 625 HG22 ILE 82 HG22 ILE 82 6.890 12.195 2.122 626 HG23 ILE 82 HG23 ILE 82 6.494 11.421 0.586 627 HD11 ILE 82 HD11 ILE 82 8.248 10.667 3.962 628 HD12 ILE 82 HD12 ILE 82 7.660 9.013 3.813 629 HD13 ILE 82 HD13 ILE 82 6.687 10.347 3.201 630 H GLU 83 H GLU 83 8.424 11.597 -2.596 631 HA GLU 83 HA GLU 83 10.043 14.054 -2.717 632 HB2 GLU 83 HB2 GLU 83 8.415 12.676 -4.899 633 HB3 GLU 83 HB3 GLU 83 9.544 14.011 -5.129 634 HG2 GLU 83 HG2 GLU 83 10.287 11.231 -4.151 635 HG3 GLU 83 HG3 GLU 83 10.489 11.814 -5.797 636 H ALA 84 H ALA 84 6.692 13.017 -3.355 637 HA ALA 84 HA ALA 84 4.668 13.928 -3.090 638 HB1 ALA 84 HB1 ALA 84 4.266 15.707 -1.470 639 HB2 ALA 84 HB2 ALA 84 5.986 16.111 -1.448 640 HB3 ALA 84 HB3 ALA 84 5.439 14.554 -0.827 641 HA PRO 85 HA PRO 85 2.777 15.024 -3.016 642 HB2 PRO 85 HB2 PRO 85 0.638 15.901 -4.336 643 HB3 PRO 85 HB3 PRO 85 1.632 17.046 -3.418 644 HG2 PRO 85 HG2 PRO 85 1.618 16.514 -6.395 645 HG3 PRO 85 HG3 PRO 85 1.669 18.072 -5.546 646 HD2 PRO 85 HD2 PRO 85 3.918 16.727 -6.555 647 HD3 PRO 85 HD3 PRO 85 3.968 17.985 -5.300 648 H ASP 86 H ASP 86 4.239 13.890 -5.590 649 HA ASP 86 HA ASP 86 2.092 12.103 -6.577 650 HB2 ASP 86 HB2 ASP 86 3.264 12.070 -8.742 651 HB3 ASP 86 HB3 ASP 86 2.840 13.710 -8.277 652 H HIS 87 H HIS 87 5.651 12.164 -6.019 653 HA HIS 87 HA HIS 87 5.804 9.257 -6.389 654 HB2 HIS 87 HB2 HIS 87 7.401 10.783 -7.545 655 HB3 HIS 87 HB3 HIS 87 8.022 11.306 -5.993 656 HD1 HIS 87 HD1 HIS 87 10.133 10.349 -7.684 657 HD2 HIS 87 HD2 HIS 87 7.881 7.611 -5.524 658 HE1 HIS 87 HE1 HIS 87 11.552 8.294 -7.531 659 HE2 HIS 87 HE2 HIS 87 10.215 6.704 -6.139 660 H LEU 88 H LEU 88 5.812 7.884 -4.797 661 HA LEU 88 HA LEU 88 6.964 8.454 -2.143 662 HB2 LEU 88 HB2 LEU 88 4.507 8.724 -1.981 663 HB3 LEU 88 HB3 LEU 88 4.264 7.143 -2.690 664 HG LEU 88 HG LEU 88 5.281 6.087 -0.677 665 HD11 LEU 88 HD11 LEU 88 5.725 7.414 1.343 666 HD12 LEU 88 HD12 LEU 88 5.430 8.902 0.441 667 HD13 LEU 88 HD13 LEU 88 6.798 7.869 0.019 668 HD21 LEU 88 HD21 LEU 88 3.442 6.532 0.880 669 HD22 LEU 88 HD22 LEU 88 2.855 6.380 -0.774 670 HD23 LEU 88 HD23 LEU 88 2.999 7.978 -0.032 671 H GLU 89 H GLU 89 8.083 6.698 -1.297 672 HA GLU 89 HA GLU 89 7.753 4.005 -2.433 673 HB2 GLU 89 HB2 GLU 89 10.409 5.469 -2.113 674 HB3 GLU 89 HB3 GLU 89 10.299 3.719 -2.263 675 HG2 GLU 89 HG2 GLU 89 9.271 3.976 -4.490 676 HG3 GLU 89 HG3 GLU 89 9.396 5.730 -4.341 677 H PHE 90 H PHE 90 7.878 2.415 -0.955 678 HA PHE 90 HA PHE 90 9.123 2.668 1.632 679 HB2 PHE 90 HB2 PHE 90 7.004 2.161 2.935 680 HB3 PHE 90 HB3 PHE 90 7.053 3.779 2.246 681 HD1 PHE 90 HD2 PHE 90 5.609 0.356 1.736 682 HD2 PHE 90 HD1 PHE 90 5.327 4.522 0.796 683 HE1 PHE 90 HE2 PHE 90 3.436 -0.013 0.645 684 HE2 PHE 90 HE1 PHE 90 3.165 4.127 -0.284 685 HZ PHE 90 HZ PHE 90 2.217 1.863 -0.364 686 H ASP 91 H ASP 91 8.549 0.611 2.973 687 HA ASP 91 HA ASP 91 8.380 -1.761 1.204 688 HB2 ASP 91 HB2 ASP 91 10.021 -1.345 3.735 689 HB3 ASP 91 HB3 ASP 91 9.801 -2.914 2.960 690 H ASP 92 H ASP 92 6.433 -2.667 1.455 691 HA ASP 92 HA ASP 92 4.961 -2.751 3.935 692 HB2 ASP 92 HB2 ASP 92 4.586 -4.497 1.464 693 HB3 ASP 92 HB3 ASP 92 3.412 -4.225 2.747 694 H GLY 93 H GLY 93 5.150 -4.241 5.520 695 HA2 GLY 93 HA2 GLY 93 6.156 -6.942 4.965 696 HA3 GLY 93 HA3 GLY 93 7.064 -5.968 6.116 697 H PHE 94 H PHE 94 5.602 -8.457 6.528 698 HA PHE 94 HA PHE 94 3.475 -7.681 8.415 699 HB2 PHE 94 HB2 PHE 94 4.371 -10.389 7.347 700 HB3 PHE 94 HB3 PHE 94 3.205 -10.224 8.657 701 HD1 PHE 94 HD1 PHE 94 3.755 -9.751 5.034 702 HD2 PHE 94 HD2 PHE 94 0.936 -9.413 8.237 703 HE1 PHE 94 HE1 PHE 94 1.924 -9.496 3.411 704 HE2 PHE 94 HE2 PHE 94 -0.885 -9.162 6.601 705 HZ PHE 94 HZ PHE 94 -0.394 -9.204 4.187 706 H ALA 95 H ALA 95 3.558 -8.278 10.580 707 HA ALA 95 HA ALA 95 6.177 -9.042 11.717 708 HB1 ALA 95 HB1 ALA 95 4.472 -6.693 12.633 709 HB2 ALA 95 HB2 ALA 95 6.005 -6.584 11.765 710 HB3 ALA 95 HB3 ALA 95 5.963 -7.255 13.394 711 H ASP 96 H ASP 96 6.038 -10.313 13.505 712 HA ASP 96 HA ASP 96 3.595 -11.619 14.215 713 HB2 ASP 96 HB2 ASP 96 6.368 -11.629 15.456 714 HB3 ASP 96 HB3 ASP 96 5.057 -12.659 16.022 715 H GLU 97 H GLU 97 3.374 -11.860 16.891 716 HA GLU 97 HA GLU 97 1.739 -9.681 17.485 717 HB2 GLU 97 HB2 GLU 97 1.348 -10.724 19.646 718 HB3 GLU 97 HB3 GLU 97 1.408 -11.953 18.390 719 HG2 GLU 97 HG2 GLU 97 3.599 -12.677 19.087 720 HG3 GLU 97 HG3 GLU 97 3.778 -11.309 20.176 721 H HIS 98 H HIS 98 5.135 -10.057 18.337 722 HA HIS 98 HA HIS 98 5.055 -7.773 20.207 723 HB2 HIS 98 HB2 HIS 98 7.476 -9.469 19.440 724 HB3 HIS 98 HB3 HIS 98 7.358 -8.342 20.787 725 HD1 HIS 98 HD1 HIS 98 5.526 -9.091 22.680 726 HD2 HIS 98 HD2 HIS 98 6.844 -12.041 20.069 727 HE1 HIS 98 HE1 HIS 98 4.895 -11.274 23.755 728 HE2 HIS 98 HE2 HIS 98 5.872 -13.031 22.257 729 H GLY 99 H GLY 99 5.628 -8.365 16.900 730 HA2 GLY 99 HA2 GLY 99 5.744 -6.499 15.389 731 HA3 GLY 99 HA3 GLY 99 6.797 -5.664 16.515 732 H ALA 100 H ALA 100 7.494 -9.038 15.953 733 HA ALA 100 HA ALA 100 10.066 -8.437 14.784 734 HB1 ALA 100 HB1 ALA 100 9.786 -10.295 16.377 735 HB2 ALA 100 HB2 ALA 100 10.456 -10.855 14.846 736 HB3 ALA 100 HB3 ALA 100 8.752 -11.142 15.222 737 HA PRO 101 HA PRO 101 8.656 -8.491 10.404 738 HB2 PRO 101 HB2 PRO 101 11.638 -8.857 10.013 739 HB3 PRO 101 HB3 PRO 101 10.520 -7.746 9.200 740 HG2 PRO 101 HG2 PRO 101 12.135 -6.810 11.084 741 HG3 PRO 101 HG3 PRO 101 10.442 -6.269 11.038 742 HD2 PRO 101 HD2 PRO 101 11.731 -8.318 12.855 743 HD3 PRO 101 HD3 PRO 101 10.559 -7.038 13.254 744 H VAL 102 H VAL 102 7.708 -10.304 9.719 745 HA VAL 102 HA VAL 102 8.571 -12.967 10.221 746 HB VAL 102 HB VAL 102 6.486 -12.013 8.199 747 HG11 VAL 102 HG11 VAL 102 7.140 -14.396 7.891 748 HG12 VAL 102 HG12 VAL 102 5.473 -14.246 8.453 749 HG13 VAL 102 HG13 VAL 102 6.745 -14.716 9.586 750 HG21 VAL 102 HG21 VAL 102 6.069 -12.741 11.126 751 HG22 VAL 102 HG22 VAL 102 4.796 -12.329 9.974 752 HG23 VAL 102 HG23 VAL 102 5.987 -11.114 10.447 753 H ASP 103 H ASP 103 10.356 -13.803 9.274 754 HA ASP 103 HA ASP 103 11.526 -12.793 6.857 755 HB2 ASP 103 HB2 ASP 103 13.228 -14.666 7.216 756 HB3 ASP 103 HB3 ASP 103 13.062 -13.513 8.536 757 H GLU 104 H GLU 104 9.514 -15.554 7.587 758 HA GLU 104 HA GLU 104 9.735 -17.078 5.249 759 HB2 GLU 104 HB2 GLU 104 8.516 -17.860 7.242 760 HB3 GLU 104 HB3 GLU 104 7.321 -16.580 7.047 761 HG2 GLU 104 HG2 GLU 104 6.623 -17.596 4.891 762 HG3 GLU 104 HG3 GLU 104 7.784 -18.897 5.151 763 H LEU 105 H LEU 105 7.794 -14.195 5.936 764 HA LEU 105 HA LEU 105 6.563 -14.131 3.285 765 HB2 LEU 105 HB2 LEU 105 6.282 -12.282 5.683 766 HB3 LEU 105 HB3 LEU 105 5.345 -12.149 4.199 767 HG LEU 105 HG LEU 105 5.255 -14.461 6.187 768 HD11 LEU 105 HD11 LEU 105 2.935 -13.785 6.582 769 HD12 LEU 105 HD12 LEU 105 3.143 -12.405 5.500 770 HD13 LEU 105 HD13 LEU 105 4.070 -12.502 6.998 771 HD21 LEU 105 HD21 LEU 105 3.459 -15.412 4.791 772 HD22 LEU 105 HD22 LEU 105 4.994 -15.344 3.932 773 HD23 LEU 105 HD23 LEU 105 3.736 -14.156 3.580 774 H GLY 106 H GLY 106 9.261 -12.714 4.934 775 HA2 GLY 106 HA2 GLY 106 11.060 -11.556 4.115 776 HA3 GLY 106 HA3 GLY 106 10.384 -11.734 2.505 777 H VAL 107 H VAL 107 11.129 -9.605 2.027 778 HA VAL 107 HA VAL 107 9.447 -7.388 3.083 779 HB VAL 107 HB VAL 107 12.334 -7.178 2.083 780 HG11 VAL 107 HG11 VAL 107 12.246 -4.828 2.894 781 HG12 VAL 107 HG12 VAL 107 10.547 -5.044 3.321 782 HG13 VAL 107 HG13 VAL 107 11.048 -5.122 1.630 783 HG21 VAL 107 HG21 VAL 107 12.964 -6.680 4.436 784 HG22 VAL 107 HG22 VAL 107 12.284 -8.302 4.275 785 HG23 VAL 107 HG23 VAL 107 11.302 -6.996 4.940 786 H THR 108 H THR 108 8.374 -6.179 1.536 787 HA THR 108 HA THR 108 9.195 -6.410 -1.305 788 HB THR 108 HB THR 108 7.192 -7.777 -1.106 789 HG1 THR 108 HG1 THR 108 7.118 -6.791 -3.025 790 HG21 THR 108 HG21 THR 108 5.007 -6.874 -0.424 791 HG22 THR 108 HG22 THR 108 5.755 -5.333 -0.002 792 HG23 THR 108 HG23 THR 108 6.160 -6.788 0.911 793 H HIS 109 H HIS 109 9.327 -4.517 -2.423 794 HA HIS 109 HA HIS 109 8.951 -2.033 -0.868 795 HB2 HIS 109 HB2 HIS 109 11.257 -2.603 -1.690 796 HB3 HIS 109 HB3 HIS 109 10.670 -2.483 -3.345 797 HD1 HIS 109 HD1 HIS 109 11.209 -0.368 -0.284 798 HD2 HIS 109 HD2 HIS 109 10.538 0.146 -4.336 799 HE1 HIS 109 HE1 HIS 109 11.437 2.070 -0.709 800 HE2 HIS 109 HE2 HIS 109 11.188 2.333 -3.173 801 H ALA 110 H ALA 110 7.090 -1.004 -1.337 802 HA ALA 110 HA ALA 110 5.893 -1.146 -4.027 803 HB1 ALA 110 HB1 ALA 110 4.444 -1.685 -2.136 804 HB2 ALA 110 HB2 ALA 110 3.874 -0.243 -2.972 805 HB3 ALA 110 HB3 ALA 110 4.728 -0.092 -1.438 806 H THR 111 H THR 111 5.837 0.546 -5.397 807 HA THR 111 HA THR 111 6.814 3.215 -4.512 808 HB THR 111 HB THR 111 6.792 2.156 -7.396 809 HG1 THR 111 HG1 THR 111 8.826 1.451 -7.095 810 HG21 THR 111 HG21 THR 111 8.392 3.987 -7.813 811 HG22 THR 111 HG22 THR 111 8.248 4.505 -6.134 812 HG23 THR 111 HG23 THR 111 6.855 4.615 -7.210 813 H VAL 112 H VAL 112 5.041 4.471 -4.123 814 HA VAL 112 HA VAL 112 2.560 4.209 -5.687 815 HB VAL 112 HB VAL 112 3.197 5.942 -3.254 816 HG11 VAL 112 HG11 VAL 112 1.408 6.984 -4.599 817 HG12 VAL 112 HG12 VAL 112 0.749 6.337 -3.096 818 HG13 VAL 112 HG13 VAL 112 0.513 5.463 -4.610 819 HG21 VAL 112 HG21 VAL 112 3.209 3.530 -2.732 820 HG22 VAL 112 HG22 VAL 112 1.601 3.361 -3.443 821 HG23 VAL 112 HG23 VAL 112 1.822 4.331 -1.985 822 H LYS 113 H LYS 113 2.093 5.551 -7.337 823 HA LYS 113 HA LYS 113 3.576 8.094 -7.693 824 HB2 LYS 113 HB2 LYS 113 3.200 5.836 -9.708 825 HB3 LYS 113 HB3 LYS 113 3.788 7.439 -10.145 826 HG2 LYS 113 HG2 LYS 113 5.833 7.153 -8.992 827 HG3 LYS 113 HG3 LYS 113 5.202 5.836 -8.005 828 HD2 LYS 113 HD2 LYS 113 6.809 5.031 -9.694 829 HD3 LYS 113 HD3 LYS 113 5.204 4.336 -9.918 830 HE2 LYS 113 HE2 LYS 113 4.762 5.883 -11.755 831 HE3 LYS 113 HE3 LYS 113 6.318 6.673 -11.495 832 HZ1 LYS 113 HZ1 LYS 113 5.969 3.831 -12.244 833 HZ2 LYS 113 HZ2 LYS 113 7.433 4.661 -12.111 834 HZ3 LYS 113 HZ3 LYS 113 6.336 5.074 -13.327 835 H LEU 114 H LEU 114 2.249 9.761 -8.075 836 HA LEU 114 HA LEU 114 -0.536 9.290 -8.982 837 HB2 LEU 114 HB2 LEU 114 0.621 11.620 -7.399 838 HB3 LEU 114 HB3 LEU 114 -1.053 11.484 -7.919 839 HG LEU 114 HG LEU 114 0.321 9.582 -5.970 840 HD11 LEU 114 HD11 LEU 114 -1.132 10.602 -4.256 841 HD12 LEU 114 HD12 LEU 114 -1.720 11.770 -5.445 842 HD13 LEU 114 HD13 LEU 114 -0.025 11.779 -4.959 843 HD21 LEU 114 HD21 LEU 114 -1.924 8.670 -5.588 844 HD22 LEU 114 HD22 LEU 114 -1.418 8.461 -7.262 845 HD23 LEU 114 HD23 LEU 114 -2.577 9.726 -6.843 846 H GLU 115 H GLU 115 -1.325 10.283 -10.772 847 HA GLU 115 HA GLU 115 0.400 12.224 -12.227 848 HB2 GLU 115 HB2 GLU 115 -1.402 10.057 -13.381 849 HB3 GLU 115 HB3 GLU 115 -0.592 11.300 -14.339 850 HG2 GLU 115 HG2 GLU 115 1.591 10.461 -13.626 851 HG3 GLU 115 HG3 GLU 115 0.820 9.228 -12.626 852 HA PRO 116 HA PRO 116 -3.273 14.885 -11.782 853 HB2 PRO 116 HB2 PRO 116 -2.279 17.024 -13.236 854 HB3 PRO 116 HB3 PRO 116 -1.884 16.721 -11.540 855 HG2 PRO 116 HG2 PRO 116 -0.285 16.084 -14.008 856 HG3 PRO 116 HG3 PRO 116 0.273 16.703 -12.439 857 HD2 PRO 116 HD2 PRO 116 0.519 14.079 -13.166 858 HD3 PRO 116 HD3 PRO 116 0.314 14.579 -11.479 859 H LEU 117 H LEU 117 -4.795 13.802 -12.979 860 HA LEU 117 HA LEU 117 -4.840 14.011 -15.930 861 HB2 LEU 117 HB2 LEU 117 -6.833 12.634 -14.087 862 HB3 LEU 117 HB3 LEU 117 -6.721 12.455 -15.834 863 HG LEU 117 HG LEU 117 -4.727 11.437 -13.764 864 HD11 LEU 117 HD11 LEU 117 -6.758 10.081 -13.910 865 HD12 LEU 117 HD12 LEU 117 -5.370 9.205 -14.549 866 HD13 LEU 117 HD13 LEU 117 -6.548 9.916 -15.658 867 HD21 LEU 117 HD21 LEU 117 -3.491 10.414 -15.650 868 HD22 LEU 117 HD22 LEU 117 -3.473 12.174 -15.717 869 HD23 LEU 117 HD23 LEU 117 -4.541 11.263 -16.792 870 H GLU 118 H GLU 118 -4.935 16.454 -15.012 871 HA GLU 118 HA GLU 118 -5.956 18.458 -14.921 872 HB2 GLU 118 HB2 GLU 118 -8.274 16.996 -16.251 873 HB3 GLU 118 HB3 GLU 118 -8.202 18.746 -16.050 874 HG2 GLU 118 HG2 GLU 118 -6.306 18.914 -17.507 875 HG3 GLU 118 HG3 GLU 118 -6.117 17.164 -17.542 876 H ASN 119 H ASN 119 -8.889 16.555 -14.393 877 HA ASN 119 HA ASN 119 -9.365 17.947 -11.826 878 HB2 ASN 119 HB2 ASN 119 -11.722 17.554 -12.263 879 HB3 ASN 119 HB3 ASN 119 -10.978 18.220 -13.722 880 HD21 ASN 119 HD21 ASN 119 -13.404 16.482 -13.224 881 HD22 ASN 119 HD22 ASN 119 -13.223 15.186 -14.350 882 H ARG 120 H ARG 120 -8.630 14.910 -13.211 883 HA ARG 120 HA ARG 120 -9.306 13.379 -10.763 884 HB2 ARG 120 HB2 ARG 120 -8.810 12.445 -13.624 885 HB3 ARG 120 HB3 ARG 120 -9.189 11.400 -12.258 886 HG2 ARG 120 HG2 ARG 120 -11.405 12.372 -12.051 887 HG3 ARG 120 HG3 ARG 120 -11.043 13.556 -13.313 888 HD2 ARG 120 HD2 ARG 120 -11.123 10.548 -13.702 889 HD3 ARG 120 HD3 ARG 120 -12.429 11.659 -14.119 890 HE ARG 120 HE ARG 120 -10.749 12.723 -15.665 891 HH11 ARG 120 HH11 ARG 120 -10.367 9.385 -14.854 892 HH12 ARG 120 HH12 ARG 120 -9.695 8.994 -16.396 893 HH21 ARG 120 HH21 ARG 120 -9.887 12.213 -17.594 894 HH22 ARG 120 HH22 ARG 120 -9.409 10.588 -17.930 895 H THR 121 H THR 121 -7.671 11.339 -10.663 896 HA THR 121 HA THR 121 -4.916 11.941 -11.384 897 HB THR 121 HB THR 121 -5.722 11.853 -8.434 898 HG1 THR 121 HG1 THR 121 -5.887 13.914 -9.401 899 HG21 THR 121 HG21 THR 121 -3.644 10.563 -8.712 900 HG22 THR 121 HG22 THR 121 -3.300 12.104 -7.922 901 HG23 THR 121 HG23 THR 121 -2.926 11.886 -9.636 902 H ARG 122 H ARG 122 -3.693 10.110 -11.582 903 HA ARG 122 HA ARG 122 -5.024 7.508 -11.125 904 HB2 ARG 122 HB2 ARG 122 -4.408 8.158 -13.471 905 HB3 ARG 122 HB3 ARG 122 -2.719 8.251 -12.984 906 HG2 ARG 122 HG2 ARG 122 -2.805 5.811 -12.415 907 HG3 ARG 122 HG3 ARG 122 -4.457 5.760 -13.040 908 HD2 ARG 122 HD2 ARG 122 -1.941 6.445 -14.607 909 HD3 ARG 122 HD3 ARG 122 -2.881 4.961 -14.725 910 HE ARG 122 HE ARG 122 -4.746 6.384 -15.572 911 HH11 ARG 122 HH11 ARG 122 -1.509 7.559 -15.921 912 HH12 ARG 122 HH12 ARG 122 -1.892 8.485 -17.328 913 HH21 ARG 122 HH21 ARG 122 -5.211 7.597 -17.348 914 HH22 ARG 122 HH22 ARG 122 -3.964 8.508 -18.124 915 H MET 123 H MET 123 -4.195 6.186 -9.562 916 HA MET 123 HA MET 123 -1.486 6.699 -8.468 917 HB2 MET 123 HB2 MET 123 -3.418 6.887 -6.867 918 HB3 MET 123 HB3 MET 123 -3.772 5.184 -7.134 919 HG2 MET 123 HG2 MET 123 -1.446 4.653 -6.297 920 HG3 MET 123 HG3 MET 123 -1.268 6.359 -5.891 921 HE1 MET 123 HE1 MET 123 -4.214 3.443 -3.917 922 HE2 MET 123 HE2 MET 123 -3.073 3.027 -5.191 923 HE3 MET 123 HE3 MET 123 -4.469 4.045 -5.552 924 H THR 124 H THR 124 0.004 5.310 -9.228 925 HA THR 124 HA THR 124 -0.711 2.460 -9.691 926 HB THR 124 HB THR 124 1.583 4.042 -10.952 927 HG1 THR 124 HG1 THR 124 0.069 3.374 -12.867 928 HG21 THR 124 HG21 THR 124 1.861 2.074 -12.419 929 HG22 THR 124 HG22 THR 124 0.591 1.226 -11.537 930 HG23 THR 124 HG23 THR 124 2.107 1.626 -10.729 931 H ILE 125 H ILE 125 -0.007 1.151 -8.076 932 HA ILE 125 HA ILE 125 2.392 1.865 -6.473 933 HB ILE 125 HB ILE 125 0.192 -0.121 -5.731 934 HG12 ILE 125 HG12 ILE 125 0.488 2.789 -4.837 935 HG13 ILE 125 HG13 ILE 125 -0.802 2.143 -5.847 936 HG21 ILE 125 HG21 ILE 125 2.353 -0.540 -4.621 937 HG22 ILE 125 HG22 ILE 125 1.157 0.019 -3.453 938 HG23 ILE 125 HG23 ILE 125 2.398 1.130 -4.042 939 HD11 ILE 125 HD11 ILE 125 -1.551 0.748 -3.942 940 HD12 ILE 125 HD12 ILE 125 -1.589 2.476 -3.590 941 HD13 ILE 125 HD13 ILE 125 -0.290 1.476 -2.944 942 H ILE 126 H ILE 126 4.212 0.730 -7.093 943 HA ILE 126 HA ILE 126 3.891 -1.984 -8.256 944 HB ILE 126 HB ILE 126 6.361 -0.217 -8.597 945 HG12 ILE 126 HG12 ILE 126 5.379 0.011 -11.062 946 HG13 ILE 126 HG13 ILE 126 3.836 -0.306 -10.285 947 HG21 ILE 126 HG21 ILE 126 6.893 -1.757 -10.458 948 HG22 ILE 126 HG22 ILE 126 5.439 -2.692 -10.106 949 HG23 ILE 126 HG23 ILE 126 6.748 -2.618 -8.924 950 HD11 ILE 126 HD11 ILE 126 4.149 1.671 -8.875 951 HD12 ILE 126 HD12 ILE 126 4.206 2.060 -10.594 952 HD13 ILE 126 HD13 ILE 126 5.700 1.980 -9.662 953 H SER 127 H SER 127 4.121 -3.399 -6.602 954 HA SER 127 HA SER 127 6.127 -3.116 -4.502 955 HB2 SER 127 HB2 SER 127 3.997 -5.260 -4.917 956 HB3 SER 127 HB3 SER 127 5.001 -5.066 -3.477 957 HG SER 127 HG SER 127 3.557 -3.702 -2.808 958 H THR 128 H THR 128 8.141 -3.801 -4.948 959 HA THR 128 HA THR 128 8.745 -5.994 -6.792 960 HB THR 128 HB THR 128 11.110 -5.322 -6.471 961 HG1 THR 128 HG1 THR 128 11.333 -4.626 -4.431 962 HG21 THR 128 HG21 THR 128 11.027 -3.029 -7.381 963 HG22 THR 128 HG22 THR 128 9.336 -2.890 -6.900 964 HG23 THR 128 HG23 THR 128 9.804 -4.045 -8.150 965 H PHE 129 H PHE 129 9.759 -7.936 -6.152 966 HA PHE 129 HA PHE 129 9.787 -8.558 -3.240 967 HB2 PHE 129 HB2 PHE 129 9.089 -10.460 -5.531 968 HB3 PHE 129 HB3 PHE 129 9.082 -10.858 -3.817 969 HD1 PHE 129 HD2 PHE 129 7.293 -9.088 -6.512 970 HD2 PHE 129 HD1 PHE 129 7.228 -10.125 -2.363 971 HE1 PHE 129 HE2 PHE 129 4.928 -8.462 -6.397 972 HE2 PHE 129 HE1 PHE 129 4.850 -9.494 -2.251 973 HZ PHE 129 HZ PHE 129 3.697 -8.657 -4.266 974 H GLU 130 H GLU 130 11.260 -10.399 -2.675 975 HA GLU 130 HA GLU 130 13.910 -10.037 -3.666 976 HB2 GLU 130 HB2 GLU 130 12.855 -12.313 -1.926 977 HB3 GLU 130 HB3 GLU 130 14.539 -11.819 -2.093 978 HG2 GLU 130 HG2 GLU 130 12.297 -10.245 -0.783 979 HG3 GLU 130 HG3 GLU 130 13.635 -11.048 0.029 980 H SER 131 H SER 131 11.532 -12.672 -4.043 981 HA SER 131 HA SER 131 12.698 -13.543 -6.559 982 HB2 SER 131 HB2 SER 131 12.621 -15.463 -4.189 983 HB3 SER 131 HB3 SER 131 12.961 -15.939 -5.846 984 HG SER 131 HG SER 131 14.641 -14.003 -5.311 985 H GLU 132 H GLU 132 11.448 -15.442 -7.457 986 HA GLU 132 HA GLU 132 8.737 -14.882 -7.763 987 HB2 GLU 132 HB2 GLU 132 9.998 -16.138 -9.433 988 HB3 GLU 132 HB3 GLU 132 10.263 -17.467 -8.308 989 HG2 GLU 132 HG2 GLU 132 7.844 -17.969 -8.319 990 HG3 GLU 132 HG3 GLU 132 7.561 -16.613 -9.405 991 H GLU 133 H GLU 133 10.255 -17.370 -5.699 992 HA GLU 133 HA GLU 133 7.946 -18.663 -4.792 993 HB2 GLU 133 HB2 GLU 133 9.435 -19.355 -2.792 994 HB3 GLU 133 HB3 GLU 133 9.945 -19.820 -4.405 995 HG2 GLU 133 HG2 GLU 133 11.923 -19.147 -3.284 996 HG3 GLU 133 HG3 GLU 133 11.532 -17.840 -4.391 997 H GLN 134 H GLN 134 9.347 -15.619 -3.649 998 HA GLN 134 HA GLN 134 7.745 -15.389 -1.288 999 HB2 GLN 134 HB2 GLN 134 9.849 -14.068 -1.656 1000 HB3 GLN 134 HB3 GLN 134 9.014 -13.121 -2.889 1001 HG2 GLN 134 HG2 GLN 134 7.319 -12.489 -1.056 1002 HG3 GLN 134 HG3 GLN 134 8.437 -13.214 0.095 1003 HE21 GLN 134 HE21 GLN 134 7.529 -10.484 -0.012 1004 HE22 GLN 134 HE22 GLN 134 8.935 -9.503 -0.208 1005 H MET 135 H MET 135 7.443 -13.948 -4.584 1006 HA MET 135 HA MET 135 5.091 -12.463 -3.984 1007 HB2 MET 135 HB2 MET 135 4.958 -11.935 -6.328 1008 HB3 MET 135 HB3 MET 135 6.629 -11.875 -5.816 1009 HG2 MET 135 HG2 MET 135 6.906 -14.174 -6.839 1010 HG3 MET 135 HG3 MET 135 5.305 -13.953 -7.553 1011 HE1 MET 135 HE1 MET 135 5.682 -10.566 -7.863 1012 HE2 MET 135 HE2 MET 135 4.768 -11.570 -8.990 1013 HE3 MET 135 HE3 MET 135 6.068 -10.533 -9.582 1014 H GLN 136 H GLN 136 5.534 -15.752 -5.164 1015 HA GLN 136 HA GLN 136 2.782 -16.344 -5.664 1016 HB2 GLN 136 HB2 GLN 136 5.081 -18.178 -4.865 1017 HB3 GLN 136 HB3 GLN 136 3.504 -18.740 -5.414 1018 HG2 GLN 136 HG2 GLN 136 5.455 -17.093 -7.056 1019 HG3 GLN 136 HG3 GLN 136 5.226 -18.835 -7.193 1020 HE21 GLN 136 HE21 GLN 136 4.866 -16.724 -9.212 1021 HE22 GLN 136 HE22 GLN 136 3.237 -16.872 -9.763 1022 H LYS 137 H LYS 137 4.845 -16.515 -2.766 1023 HA LYS 137 HA LYS 137 3.043 -17.856 -1.019 1024 HB2 LYS 137 HB2 LYS 137 5.426 -17.833 -0.553 1025 HB3 LYS 137 HB3 LYS 137 5.472 -16.080 -0.525 1026 HG2 LYS 137 HG2 LYS 137 5.683 -16.958 1.724 1027 HG3 LYS 137 HG3 LYS 137 4.162 -16.075 1.576 1028 HD2 LYS 137 HD2 LYS 137 2.927 -18.199 1.385 1029 HD3 LYS 137 HD3 LYS 137 4.441 -19.111 1.446 1030 HE2 LYS 137 HE2 LYS 137 4.841 -18.258 3.738 1031 HE3 LYS 137 HE3 LYS 137 3.326 -17.358 3.666 1032 HZ1 LYS 137 HZ1 LYS 137 3.032 -19.386 4.858 1033 HZ2 LYS 137 HZ2 LYS 137 3.636 -20.304 3.572 1034 HZ3 LYS 137 HZ3 LYS 137 2.168 -19.478 3.409 1035 H MET 138 H MET 138 3.716 -14.398 -1.571 1036 HA MET 138 HA MET 138 2.006 -13.393 0.472 1037 HB2 MET 138 HB2 MET 138 2.879 -11.877 -2.018 1038 HB3 MET 138 HB3 MET 138 2.376 -11.199 -0.471 1039 HG2 MET 138 HG2 MET 138 4.968 -12.563 -1.177 1040 HG3 MET 138 HG3 MET 138 4.720 -10.956 -0.503 1041 HE1 MET 138 HE1 MET 138 3.881 -10.573 2.034 1042 HE2 MET 138 HE2 MET 138 3.674 -11.884 3.197 1043 HE3 MET 138 HE3 MET 138 2.562 -11.729 1.838 1044 H ALA 139 H ALA 139 1.551 -14.017 -2.979 1045 HA ALA 139 HA ALA 139 -1.107 -13.186 -3.312 1046 HB1 ALA 139 HB1 ALA 139 0.310 -15.517 -4.642 1047 HB2 ALA 139 HB2 ALA 139 0.401 -13.831 -5.155 1048 HB3 ALA 139 HB3 ALA 139 -1.135 -14.697 -5.246 1049 H GLU 140 H GLU 140 0.197 -16.278 -2.104 1050 HA GLU 140 HA GLU 140 -2.313 -17.582 -1.692 1051 HB2 GLU 140 HB2 GLU 140 0.399 -18.136 -0.427 1052 HB3 GLU 140 HB3 GLU 140 -0.999 -19.196 -0.297 1053 HG2 GLU 140 HG2 GLU 140 0.550 -18.518 -2.812 1054 HG3 GLU 140 HG3 GLU 140 0.533 -20.058 -1.966 1055 H MET 141 H MET 141 -0.364 -15.436 0.329 1056 HA MET 141 HA MET 141 -1.863 -15.756 2.765 1057 HB2 MET 141 HB2 MET 141 -0.089 -13.474 1.802 1058 HB3 MET 141 HB3 MET 141 -0.724 -13.615 3.439 1059 HG2 MET 141 HG2 MET 141 1.158 -15.587 2.126 1060 HG3 MET 141 HG3 MET 141 1.622 -14.335 3.276 1061 HE1 MET 141 HE1 MET 141 1.044 -14.413 5.891 1062 HE2 MET 141 HE2 MET 141 -0.057 -15.596 6.593 1063 HE3 MET 141 HE3 MET 141 -0.669 -14.392 5.462 1064 H GLY 142 H GLY 142 -2.482 -14.059 -0.172 1065 HA2 GLY 142 HA2 GLY 142 -4.369 -12.895 -0.845 1066 HA3 GLY 142 HA3 GLY 142 -4.974 -12.920 0.804 1067 H MET 143 H MET 143 -1.749 -11.784 0.182 1068 HA MET 143 HA MET 143 -2.217 -9.213 1.348 1069 HB2 MET 143 HB2 MET 143 -0.076 -10.422 1.602 1070 HB3 MET 143 HB3 MET 143 0.216 -10.308 -0.129 1071 HG2 MET 143 HG2 MET 143 0.347 -7.850 0.064 1072 HG3 MET 143 HG3 MET 143 0.065 -7.978 1.803 1073 HE1 MET 143 HE1 MET 143 2.215 -6.671 2.486 1074 HE2 MET 143 HE2 MET 143 2.527 -6.346 0.780 1075 HE3 MET 143 HE3 MET 143 3.814 -6.974 1.809 1076 H GLU 144 H GLU 144 -1.399 -10.285 -1.949 1077 HA GLU 144 HA GLU 144 -1.241 -7.872 -3.293 1078 HB2 GLU 144 HB2 GLU 144 -1.860 -10.701 -4.136 1079 HB3 GLU 144 HB3 GLU 144 -2.094 -9.425 -5.320 1080 HG2 GLU 144 HG2 GLU 144 0.080 -10.289 -5.706 1081 HG3 GLU 144 HG3 GLU 144 0.294 -8.719 -4.952 1082 H GLU 145 H GLU 145 -4.181 -9.951 -3.187 1083 HA GLU 145 HA GLU 145 -5.899 -7.874 -4.217 1084 HB2 GLU 145 HB2 GLU 145 -6.518 -10.598 -3.026 1085 HB3 GLU 145 HB3 GLU 145 -7.759 -9.511 -3.651 1086 HG2 GLU 145 HG2 GLU 145 -6.751 -9.588 -5.881 1087 HG3 GLU 145 HG3 GLU 145 -5.441 -10.607 -5.281 1088 H GLY 146 H GLY 146 -4.877 -8.783 -1.018 1089 HA2 GLY 146 HA2 GLY 146 -6.825 -7.512 0.573 1090 HA3 GLY 146 HA3 GLY 146 -5.140 -7.740 1.011 1091 H MET 147 H MET 147 -3.940 -6.202 -1.062 1092 HA MET 147 HA MET 147 -4.292 -3.476 -0.281 1093 HB2 MET 147 HB2 MET 147 -2.915 -4.674 -2.718 1094 HB3 MET 147 HB3 MET 147 -2.862 -2.965 -2.303 1095 HG2 MET 147 HG2 MET 147 -1.731 -3.533 -0.182 1096 HG3 MET 147 HG3 MET 147 -1.760 -5.226 -0.652 1097 HE1 MET 147 HE1 MET 147 -1.088 -2.093 -3.002 1098 HE2 MET 147 HE2 MET 147 0.670 -2.005 -2.904 1099 HE3 MET 147 HE3 MET 147 -0.309 -1.673 -1.475 1100 H ARG 148 H ARG 148 -5.333 -5.347 -3.156 1101 HA ARG 148 HA ARG 148 -6.309 -3.327 -4.807 1102 HB2 ARG 148 HB2 ARG 148 -5.947 -5.672 -5.492 1103 HB3 ARG 148 HB3 ARG 148 -7.293 -6.188 -4.481 1104 HG2 ARG 148 HG2 ARG 148 -8.835 -4.825 -5.947 1105 HG3 ARG 148 HG3 ARG 148 -7.459 -4.515 -7.016 1106 HD2 ARG 148 HD2 ARG 148 -7.197 -6.964 -7.352 1107 HD3 ARG 148 HD3 ARG 148 -8.585 -7.252 -6.296 1108 HE ARG 148 HE ARG 148 -8.665 -5.993 -8.971 1109 HH11 ARG 148 HH11 ARG 148 -10.424 -7.446 -6.370 1110 HH12 ARG 148 HH12 ARG 148 -11.785 -7.813 -7.364 1111 HH21 ARG 148 HH21 ARG 148 -10.410 -6.476 -10.210 1112 HH22 ARG 148 HH22 ARG 148 -11.776 -7.271 -9.515 1113 H GLU 149 H GLU 149 -8.163 -5.235 -2.397 1114 HA GLU 149 HA GLU 149 -10.706 -4.045 -2.671 1115 HB2 GLU 149 HB2 GLU 149 -9.410 -5.248 -0.191 1116 HB3 GLU 149 HB3 GLU 149 -11.133 -4.903 -0.359 1117 HG2 GLU 149 HG2 GLU 149 -11.296 -6.550 -2.171 1118 HG3 GLU 149 HG3 GLU 149 -9.565 -6.888 -2.032 1119 H ALA 150 H ALA 150 -8.068 -3.302 -0.405 1120 HA ALA 150 HA ALA 150 -9.193 -1.132 0.993 1121 HB1 ALA 150 HB1 ALA 150 -6.869 -0.640 1.680 1122 HB2 ALA 150 HB2 ALA 150 -6.261 -1.717 0.415 1123 HB3 ALA 150 HB3 ALA 150 -7.202 -2.373 1.757 1124 H ILE 151 H ILE 151 -7.455 -1.256 -2.066 1125 HA ILE 151 HA ILE 151 -7.027 1.573 -2.335 1126 HB ILE 151 HB ILE 151 -6.601 -0.774 -4.225 1127 HG12 ILE 151 HG12 ILE 151 -4.563 1.014 -2.819 1128 HG13 ILE 151 HG13 ILE 151 -5.127 -0.514 -2.158 1129 HG21 ILE 151 HG21 ILE 151 -7.047 1.179 -5.634 1130 HG22 ILE 151 HG22 ILE 151 -5.340 0.751 -5.715 1131 HG23 ILE 151 HG23 ILE 151 -5.856 2.126 -4.738 1132 HD11 ILE 151 HD11 ILE 151 -2.980 -0.801 -3.170 1133 HD12 ILE 151 HD12 ILE 151 -3.551 -0.129 -4.699 1134 HD13 ILE 151 HD13 ILE 151 -4.180 -1.678 -4.119 1135 H GLU 152 H GLU 152 -9.541 -0.682 -3.424 1136 HA GLU 152 HA GLU 152 -10.959 1.362 -4.931 1137 HB2 GLU 152 HB2 GLU 152 -11.985 -1.326 -3.920 1138 HB3 GLU 152 HB3 GLU 152 -12.804 -0.265 -5.072 1139 HG2 GLU 152 HG2 GLU 152 -10.617 -0.506 -6.481 1140 HG3 GLU 152 HG3 GLU 152 -10.296 -1.902 -5.459 1141 H GLN 153 H GLN 153 -10.603 0.611 -1.624 1142 HA GLN 153 HA GLN 153 -13.055 1.923 -0.720 1143 HB2 GLN 153 HB2 GLN 153 -12.155 -0.106 0.409 1144 HB3 GLN 153 HB3 GLN 153 -10.697 0.770 0.837 1145 HG2 GLN 153 HG2 GLN 153 -11.864 2.148 2.403 1146 HG3 GLN 153 HG3 GLN 153 -13.438 1.635 1.798 1147 HE21 GLN 153 HE21 GLN 153 -10.618 0.596 3.628 1148 HE22 GLN 153 HE22 GLN 153 -11.395 -0.699 4.450 1149 H ILE 154 H ILE 154 -10.032 2.968 -1.815 1150 HA ILE 154 HA ILE 154 -9.671 5.366 -0.300 1151 HB ILE 154 HB ILE 154 -8.848 4.706 -3.155 1152 HG12 ILE 154 HG12 ILE 154 -7.213 4.661 -0.580 1153 HG13 ILE 154 HG13 ILE 154 -7.879 3.236 -1.372 1154 HG21 ILE 154 HG21 ILE 154 -8.902 7.152 -2.881 1155 HG22 ILE 154 HG22 ILE 154 -7.234 6.590 -2.995 1156 HG23 ILE 154 HG23 ILE 154 -7.912 7.031 -1.424 1157 HD11 ILE 154 HD11 ILE 154 -6.462 3.628 -3.301 1158 HD12 ILE 154 HD12 ILE 154 -5.514 3.521 -1.817 1159 HD13 ILE 154 HD13 ILE 154 -5.822 5.093 -2.551 1160 H ASP 155 H ASP 155 -11.651 4.549 -3.116 1161 HA ASP 155 HA ASP 155 -12.683 7.093 -3.740 1162 HB2 ASP 155 HB2 ASP 155 -12.976 5.136 -5.203 1163 HB3 ASP 155 HB3 ASP 155 -13.947 4.326 -3.976 1164 H ALA 156 H ALA 156 -13.624 4.715 -1.282 1165 HA ALA 156 HA ALA 156 -15.852 6.090 -0.156 1166 HB1 ALA 156 HB1 ALA 156 -13.959 4.129 1.198 1167 HB2 ALA 156 HB2 ALA 156 -15.393 3.696 0.264 1168 HB3 ALA 156 HB3 ALA 156 -15.565 4.595 1.772 1169 H VAL 157 H VAL 157 -12.383 6.531 0.274 1170 HA VAL 157 HA VAL 157 -12.521 8.139 2.672 1171 HB VAL 157 HB VAL 157 -10.294 8.077 0.581 1172 HG11 VAL 157 HG11 VAL 157 -10.206 8.980 3.492 1173 HG12 VAL 157 HG12 VAL 157 -10.088 10.026 2.074 1174 HG13 VAL 157 HG13 VAL 157 -8.812 8.855 2.416 1175 HG21 VAL 157 HG21 VAL 157 -10.596 6.364 3.071 1176 HG22 VAL 157 HG22 VAL 157 -9.170 6.420 2.033 1177 HG23 VAL 157 HG23 VAL 157 -10.698 5.810 1.398 1178 H LEU 158 H LEU 158 -12.262 8.865 -0.812 1179 HA LEU 158 HA LEU 158 -12.010 11.725 -0.461 1180 HB2 LEU 158 HB2 LEU 158 -12.460 10.102 -3.000 1181 HB3 LEU 158 HB3 LEU 158 -11.969 11.792 -2.934 1182 HG LEU 158 HG LEU 158 -10.322 9.398 -2.013 1183 HD11 LEU 158 HD11 LEU 158 -10.386 9.597 -4.434 1184 HD12 LEU 158 HD12 LEU 158 -8.784 9.997 -3.822 1185 HD13 LEU 158 HD13 LEU 158 -9.877 11.286 -4.340 1186 HD21 LEU 158 HD21 LEU 158 -9.610 12.344 -1.877 1187 HD22 LEU 158 HD22 LEU 158 -8.509 11.002 -1.544 1188 HD23 LEU 158 HD23 LEU 158 -9.914 11.263 -0.512 1189 H SER 159 H SER 159 -14.581 9.514 -1.493 1190 HA SER 159 HA SER 159 -16.545 11.613 -1.947 1191 HB2 SER 159 HB2 SER 159 -16.545 9.437 -3.222 1192 HB3 SER 159 HB3 SER 159 -16.953 8.594 -1.736 1193 HG SER 159 HG SER 159 -18.777 9.114 -3.106 1194 H GLU 160 H GLU 160 -16.168 8.913 0.348 1195 HA GLU 160 HA GLU 160 -17.441 8.180 2.061 1196 HB2 GLU 160 HB2 GLU 160 -15.651 10.084 2.830 1197 HB3 GLU 160 HB3 GLU 160 -17.107 10.727 3.565 1198 HG2 GLU 160 HG2 GLU 160 -15.993 7.932 3.988 1199 HG3 GLU 160 HG3 GLU 160 -15.777 9.281 5.087 1200 HA PRO 161 HA PRO 161 -21.516 10.141 1.247 1201 HB2 PRO 161 HB2 PRO 161 -22.894 7.913 0.615 1202 HB3 PRO 161 HB3 PRO 161 -21.760 8.641 -0.533 1203 HG2 PRO 161 HG2 PRO 161 -21.326 6.283 1.314 1204 HG3 PRO 161 HG3 PRO 161 -20.915 6.439 -0.409 1205 HD2 PRO 161 HD2 PRO 161 -19.089 6.841 1.625 1206 HD3 PRO 161 HD3 PRO 161 -18.964 7.629 0.037 1207 H ALA 162 H ALA 162 -20.379 7.915 3.606 1208 HA ALA 162 HA ALA 162 -21.001 7.227 5.659 1209 HB1 ALA 162 HB1 ALA 162 -22.813 9.658 5.643 1210 HB2 ALA 162 HB2 ALA 162 -21.100 9.659 6.072 1211 HB3 ALA 162 HB3 ALA 162 -22.257 8.782 7.074 1212 H ASN 163 H ASN 163 -22.703 6.358 3.290 1213 HA ASN 163 HA ASN 163 -24.719 4.942 4.921 1214 HB2 ASN 163 HB2 ASN 163 -26.433 5.242 3.253 1215 HB3 ASN 163 HB3 ASN 163 -25.817 6.823 3.681 1216 HD21 ASN 163 HD21 ASN 163 -25.969 4.391 1.180 1217 HD22 ASN 163 HD22 ASN 163 -25.426 5.408 -0.110 1218 H ALA 164 H ALA 164 -22.010 4.464 3.378 1219 HA ALA 164 HA ALA 164 -22.619 2.339 1.513 1220 HB1 ALA 164 HB1 ALA 164 -19.955 3.157 2.728 1221 HB2 ALA 164 HB2 ALA 164 -20.628 3.780 1.220 1222 HB3 ALA 164 HB3 ALA 164 -20.182 2.078 1.349 1223 H LEU 165 H LEU 165 -23.961 1.103 3.012 1224 HA LEU 165 HA LEU 165 -22.850 -0.071 5.396 1225 HB2 LEU 165 HB2 LEU 165 -25.143 -1.448 5.222 1226 HB3 LEU 165 HB3 LEU 165 -25.081 0.212 5.778 1227 HG LEU 165 HG LEU 165 -25.729 0.919 3.403 1228 HD11 LEU 165 HD11 LEU 165 -25.182 -1.105 2.164 1229 HD12 LEU 165 HD12 LEU 165 -26.879 -0.682 1.963 1230 HD13 LEU 165 HD13 LEU 165 -26.422 -2.005 3.040 1231 HD21 LEU 165 HD21 LEU 165 -27.314 0.962 5.269 1232 HD22 LEU 165 HD22 LEU 165 -27.752 -0.720 4.961 1233 HD23 LEU 165 HD23 LEU 165 -28.121 0.525 3.763 1234 H GLU 166 H GLU 166 -21.525 -1.730 5.466 1235 HA GLU 166 HA GLU 166 -21.032 -3.463 3.205 1236 HB2 GLU 166 HB2 GLU 166 -19.152 -2.680 4.549 1237 HB3 GLU 166 HB3 GLU 166 -19.834 -3.381 6.007 1238 HG2 GLU 166 HG2 GLU 166 -17.940 -4.696 5.133 1239 HG3 GLU 166 HG3 GLU 166 -19.432 -5.631 5.179 1240 H HIS 167 H HIS 167 -21.548 -5.552 2.963 1241 HA HIS 167 HA HIS 167 -23.553 -6.793 4.717 1242 HB2 HIS 167 HB2 HIS 167 -23.619 -8.495 2.698 1243 HB3 HIS 167 HB3 HIS 167 -24.349 -6.905 2.515 1244 HD1 HIS 167 HD1 HIS 167 -21.130 -8.718 1.610 1245 HD2 HIS 167 HD2 HIS 167 -23.367 -5.418 0.448 1246 HE1 HIS 167 HE1 HIS 167 -20.010 -7.841 -0.445 1247 HE2 HIS 167 HE2 HIS 167 -21.225 -5.710 -0.962 1248 H HIS 168 H HIS 168 -22.171 -7.360 6.424 1249 HA HIS 168 HA HIS 168 -19.916 -9.135 6.082 1250 HB2 HIS 168 HB2 HIS 168 -21.386 -8.168 8.569 1251 HB3 HIS 168 HB3 HIS 168 -19.997 -9.249 8.630 1252 HD1 HIS 168 HD1 HIS 168 -17.770 -8.220 7.421 1253 HD2 HIS 168 HD2 HIS 168 -20.693 -5.526 8.610 1254 HE1 HIS 168 HE1 HIS 168 -16.609 -6.006 7.560 1255 HE2 HIS 168 HE2 HIS 168 -18.353 -4.431 8.454 1256 H HIS 169 H HIS 169 -19.767 -11.252 7.121 1257 HA HIS 169 HA HIS 169 -22.183 -12.879 6.597 1258 HB2 HIS 169 HB2 HIS 169 -19.241 -13.703 6.670 1259 HB3 HIS 169 HB3 HIS 169 -20.591 -14.763 6.260 1260 HD1 HIS 169 HD1 HIS 169 -18.099 -12.822 4.655 1261 HD2 HIS 169 HD2 HIS 169 -22.118 -13.512 3.922 1262 HE1 HIS 169 HE1 HIS 169 -18.462 -12.120 2.280 1263 HE2 HIS 169 HE2 HIS 169 -20.862 -12.699 1.814 1264 H HIS 170 H HIS 170 -23.294 -13.413 8.338 1265 HA HIS 170 HA HIS 170 -22.142 -13.479 11.014 1266 HB2 HIS 170 HB2 HIS 170 -24.344 -12.343 10.481 1267 HB3 HIS 170 HB3 HIS 170 -25.040 -13.924 10.150 1268 HD1 HIS 170 HD1 HIS 170 -24.316 -11.570 12.870 1269 HD2 HIS 170 HD2 HIS 170 -25.235 -15.609 12.534 1270 HE1 HIS 170 HE1 HIS 170 -24.998 -12.295 15.167 1271 HE2 HIS 170 HE2 HIS 170 -25.385 -14.766 14.979 1272 H HIS 171 H HIS 171 -21.395 -15.310 11.902 1273 HA HIS 171 HA HIS 171 -22.652 -17.878 11.697 1274 HB2 HIS 171 HB2 HIS 171 -20.865 -19.099 10.515 1275 HB3 HIS 171 HB3 HIS 171 -21.525 -17.845 9.478 1276 HD1 HIS 171 HD1 HIS 171 -18.386 -19.086 10.878 1277 HD2 HIS 171 HD2 HIS 171 -19.754 -15.545 9.189 1278 HE1 HIS 171 HE1 HIS 171 -16.328 -17.800 10.257 1279 HE2 HIS 171 HE2 HIS 171 -17.169 -15.624 9.336 1280 H HIS 172 H HIS 172 -20.564 -19.566 12.436 1281 HA HIS 172 HA HIS 172 -20.162 -19.096 15.176 1282 HB2 HIS 172 HB2 HIS 172 -20.070 -21.323 13.942 1283 HB3 HIS 172 HB3 HIS 172 -18.462 -20.888 13.392 1284 HD1 HIS 172 HD1 HIS 172 -19.892 -23.016 15.722 1285 HD2 HIS 172 HD2 HIS 172 -16.856 -20.199 16.059 1286 HE1 HIS 172 HE1 HIS 172 -18.582 -23.687 17.751 1287 HE2 HIS 172 HE2 HIS 172 -16.842 -21.896 18.004 Start of MODEL 16 1 H1 THR 1 H1 THR 1 -12.387 1.237 -7.029 2 H2 THR 1 H2 THR 1 -12.609 2.881 -7.356 3 H3 THR 1 H3 THR 1 -11.058 2.279 -7.075 4 HA THR 1 HA THR 1 -12.803 1.546 -9.350 5 HB THR 1 HB THR 1 -10.902 2.714 -10.709 6 HG1 THR 1 HG1 THR 1 -10.496 4.570 -8.754 7 HG21 THR 1 HG21 THR 1 -11.997 4.904 -10.572 8 HG22 THR 1 HG22 THR 1 -12.831 4.414 -9.093 9 HG23 THR 1 HG23 THR 1 -13.185 3.601 -10.624 10 H VAL 2 H VAL 2 -9.266 1.639 -8.695 11 HA VAL 2 HA VAL 2 -7.628 0.479 -9.714 12 HB VAL 2 HB VAL 2 -9.349 -1.906 -8.925 13 HG11 VAL 2 HG11 VAL 2 -6.427 -1.865 -9.797 14 HG12 VAL 2 HG12 VAL 2 -7.767 -2.595 -10.685 15 HG13 VAL 2 HG13 VAL 2 -7.274 -3.264 -9.130 16 HG21 VAL 2 HG21 VAL 2 -8.643 -0.501 -7.018 17 HG22 VAL 2 HG22 VAL 2 -6.960 -0.607 -7.541 18 HG23 VAL 2 HG23 VAL 2 -7.806 -2.053 -6.986 19 H VAL 3 H VAL 3 -7.800 1.309 -11.725 20 HA VAL 3 HA VAL 3 -9.641 0.288 -13.711 21 HB VAL 3 HB VAL 3 -8.501 1.986 -15.244 22 HG11 VAL 3 HG11 VAL 3 -9.657 3.044 -12.629 23 HG12 VAL 3 HG12 VAL 3 -10.590 2.525 -14.035 24 HG13 VAL 3 HG13 VAL 3 -9.547 3.943 -14.146 25 HG21 VAL 3 HG21 VAL 3 -6.301 2.111 -14.107 26 HG22 VAL 3 HG22 VAL 3 -7.080 2.797 -12.675 27 HG23 VAL 3 HG23 VAL 3 -7.059 3.708 -14.189 28 H SER 4 H SER 4 -6.427 -0.525 -12.726 29 HA SER 4 HA SER 4 -6.309 -2.631 -14.733 30 HB2 SER 4 HB2 SER 4 -5.126 -0.845 -15.935 31 HB3 SER 4 HB3 SER 4 -4.095 -0.543 -14.541 32 HG SER 4 HG SER 4 -2.882 -2.190 -15.072 33 H VAL 5 H VAL 5 -5.083 -4.412 -14.079 34 HA VAL 5 HA VAL 5 -3.479 -4.247 -11.577 35 HB VAL 5 HB VAL 5 -5.140 -6.680 -12.442 36 HG11 VAL 5 HG11 VAL 5 -3.504 -6.220 -9.904 37 HG12 VAL 5 HG12 VAL 5 -3.087 -7.325 -11.217 38 HG13 VAL 5 HG13 VAL 5 -4.514 -7.632 -10.227 39 HG21 VAL 5 HG21 VAL 5 -5.675 -4.757 -10.147 40 HG22 VAL 5 HG22 VAL 5 -6.584 -6.232 -10.492 41 HG23 VAL 5 HG23 VAL 5 -6.624 -4.883 -11.632 42 H ASP 6 H ASP 6 -1.403 -4.980 -11.829 43 HA ASP 6 HA ASP 6 -0.672 -6.581 -14.233 44 HB2 ASP 6 HB2 ASP 6 0.784 -4.197 -13.013 45 HB3 ASP 6 HB3 ASP 6 1.484 -5.243 -14.247 46 H LYS 7 H LYS 7 0.382 -8.418 -13.767 47 HA LYS 7 HA LYS 7 1.853 -8.777 -11.213 48 HB2 LYS 7 HB2 LYS 7 -0.372 -9.787 -10.979 49 HB3 LYS 7 HB3 LYS 7 -0.202 -10.627 -12.509 50 HG2 LYS 7 HG2 LYS 7 0.071 -12.224 -10.762 51 HG3 LYS 7 HG3 LYS 7 1.648 -11.988 -11.504 52 HD2 LYS 7 HD2 LYS 7 2.399 -10.661 -9.620 53 HD3 LYS 7 HD3 LYS 7 0.768 -10.615 -8.932 54 HE2 LYS 7 HE2 LYS 7 2.503 -13.092 -9.258 55 HE3 LYS 7 HE3 LYS 7 2.182 -12.249 -7.749 56 HZ1 LYS 7 HZ1 LYS 7 -0.151 -12.835 -7.942 57 HZ2 LYS 7 HZ2 LYS 7 0.807 -14.240 -8.028 58 HZ3 LYS 7 HZ3 LYS 7 0.129 -13.597 -9.426 59 H ASP 8 H ASP 8 3.935 -9.460 -11.619 60 HA ASP 8 HA ASP 8 4.483 -11.262 -13.896 61 HB2 ASP 8 HB2 ASP 8 4.960 -8.727 -14.420 62 HB3 ASP 8 HB3 ASP 8 6.359 -8.919 -13.371 63 H VAL 9 H VAL 9 5.340 -13.018 -13.002 64 HA VAL 9 HA VAL 9 6.569 -13.063 -10.383 65 HB VAL 9 HB VAL 9 6.214 -15.325 -12.407 66 HG11 VAL 9 HG11 VAL 9 7.888 -15.926 -10.691 67 HG12 VAL 9 HG12 VAL 9 6.414 -16.871 -10.480 68 HG13 VAL 9 HG13 VAL 9 6.745 -15.507 -9.411 69 HG21 VAL 9 HG21 VAL 9 4.041 -14.333 -11.834 70 HG22 VAL 9 HG22 VAL 9 4.392 -14.498 -10.112 71 HG23 VAL 9 HG23 VAL 9 4.184 -15.938 -11.111 72 H GLU 10 H GLU 10 7.744 -13.039 -13.687 73 HA GLU 10 HA GLU 10 10.400 -14.072 -13.149 74 HB2 GLU 10 HB2 GLU 10 9.315 -12.559 -15.568 75 HB3 GLU 10 HB3 GLU 10 10.867 -13.399 -15.501 76 HG2 GLU 10 HG2 GLU 10 9.704 -15.531 -15.168 77 HG3 GLU 10 HG3 GLU 10 8.148 -14.713 -15.203 78 H ALA 11 H ALA 11 8.958 -10.865 -13.577 79 HA ALA 11 HA ALA 11 11.473 -9.436 -13.162 80 HB1 ALA 11 HB1 ALA 11 8.656 -8.386 -13.617 81 HB2 ALA 11 HB2 ALA 11 9.868 -8.657 -14.871 82 HB3 ALA 11 HB3 ALA 11 10.140 -7.424 -13.637 83 H LEU 12 H LEU 12 9.267 -10.865 -11.141 84 HA LEU 12 HA LEU 12 8.689 -10.787 -8.959 85 HB2 LEU 12 HB2 LEU 12 11.300 -9.246 -8.703 86 HB3 LEU 12 HB3 LEU 12 10.419 -9.952 -7.355 87 HG LEU 12 HG LEU 12 11.721 -11.505 -9.636 88 HD11 LEU 12 HD11 LEU 12 13.368 -10.573 -8.074 89 HD12 LEU 12 HD12 LEU 12 13.273 -12.326 -7.917 90 HD13 LEU 12 HD13 LEU 12 12.508 -11.290 -6.708 91 HD21 LEU 12 HD21 LEU 12 11.115 -13.526 -8.341 92 HD22 LEU 12 HD22 LEU 12 9.696 -12.641 -8.886 93 HD23 LEU 12 HD23 LEU 12 10.212 -12.522 -7.201 94 H SER 13 H SER 13 7.466 -8.731 -10.520 95 HA SER 13 HA SER 13 7.028 -6.650 -8.450 96 HB2 SER 13 HB2 SER 13 6.797 -4.947 -10.258 97 HB3 SER 13 HB3 SER 13 8.412 -5.642 -10.190 98 HG SER 13 HG SER 13 8.010 -5.844 -12.276 99 H PHE 14 H PHE 14 4.996 -5.731 -8.362 100 HA PHE 14 HA PHE 14 2.776 -6.832 -9.940 101 HB2 PHE 14 HB2 PHE 14 2.931 -8.403 -8.095 102 HB3 PHE 14 HB3 PHE 14 3.138 -7.112 -6.919 103 HD1 PHE 14 HD1 PHE 14 0.634 -8.205 -9.504 104 HD2 PHE 14 HD2 PHE 14 1.284 -6.628 -5.584 105 HE1 PHE 14 HE1 PHE 14 -1.776 -8.238 -9.093 106 HE2 PHE 14 HE2 PHE 14 -1.138 -6.660 -5.181 107 HZ PHE 14 HZ PHE 14 -2.669 -7.467 -6.927 108 H SER 15 H SER 15 1.971 -4.907 -10.736 109 HA SER 15 HA SER 15 1.901 -2.528 -8.963 110 HB2 SER 15 HB2 SER 15 2.132 -1.147 -11.037 111 HB3 SER 15 HB3 SER 15 3.517 -2.195 -10.740 112 HG SER 15 HG SER 15 2.995 -3.391 -12.432 113 H ILE 16 H ILE 16 -0.048 -1.798 -8.430 114 HA ILE 16 HA ILE 16 -2.429 -2.519 -10.043 115 HB ILE 16 HB ILE 16 -2.284 -1.551 -7.148 116 HG12 ILE 16 HG12 ILE 16 -2.833 -4.379 -8.163 117 HG13 ILE 16 HG13 ILE 16 -1.275 -3.845 -7.537 118 HG21 ILE 16 HG21 ILE 16 -4.432 -0.968 -8.208 119 HG22 ILE 16 HG22 ILE 16 -4.667 -2.236 -7.006 120 HG23 ILE 16 HG23 ILE 16 -4.653 -2.646 -8.722 121 HD11 ILE 16 HD11 ILE 16 -2.534 -5.091 -5.885 122 HD12 ILE 16 HD12 ILE 16 -3.857 -3.932 -5.977 123 HD13 ILE 16 HD13 ILE 16 -2.276 -3.431 -5.362 124 H VAL 17 H VAL 17 -3.294 -0.952 -11.252 125 HA VAL 17 HA VAL 17 -2.701 1.895 -10.733 126 HB VAL 17 HB VAL 17 -3.858 0.670 -13.283 127 HG11 VAL 17 HG11 VAL 17 -2.589 3.399 -12.804 128 HG12 VAL 17 HG12 VAL 17 -4.310 3.087 -13.049 129 HG13 VAL 17 HG13 VAL 17 -3.165 2.792 -14.359 130 HG21 VAL 17 HG21 VAL 17 -1.628 -0.297 -12.896 131 HG22 VAL 17 HG22 VAL 17 -0.943 1.319 -12.701 132 HG23 VAL 17 HG23 VAL 17 -1.591 0.820 -14.266 133 H ALA 18 H ALA 18 -4.353 3.286 -10.236 134 HA ALA 18 HA ALA 18 -7.180 2.524 -10.550 135 HB1 ALA 18 HB1 ALA 18 -5.977 3.560 -7.944 136 HB2 ALA 18 HB2 ALA 18 -6.561 1.920 -8.234 137 HB3 ALA 18 HB3 ALA 18 -7.696 3.271 -8.250 138 H GLU 19 H GLU 19 -8.638 4.511 -10.286 139 HA GLU 19 HA GLU 19 -7.260 7.081 -10.705 140 HB2 GLU 19 HB2 GLU 19 -7.781 5.836 -12.950 141 HB3 GLU 19 HB3 GLU 19 -9.462 6.266 -12.641 142 HG2 GLU 19 HG2 GLU 19 -8.757 8.671 -12.533 143 HG3 GLU 19 HG3 GLU 19 -7.125 8.171 -12.962 144 H PHE 20 H PHE 20 -8.323 8.776 -9.777 145 HA PHE 20 HA PHE 20 -11.029 8.336 -8.630 146 HB2 PHE 20 HB2 PHE 20 -8.729 9.663 -7.108 147 HB3 PHE 20 HB3 PHE 20 -10.304 9.197 -6.473 148 HD1 PHE 20 HD1 PHE 20 -10.870 6.647 -6.445 149 HD2 PHE 20 HD2 PHE 20 -6.897 8.174 -6.910 150 HE1 PHE 20 HE1 PHE 20 -9.943 4.469 -5.782 151 HE2 PHE 20 HE2 PHE 20 -5.986 5.992 -6.243 152 HZ PHE 20 HZ PHE 20 -7.507 4.138 -5.682 153 H ASP 21 H ASP 21 -12.369 10.125 -8.604 154 HA ASP 21 HA ASP 21 -11.637 12.452 -10.188 155 HB2 ASP 21 HB2 ASP 21 -14.194 12.004 -8.576 156 HB3 ASP 21 HB3 ASP 21 -13.960 13.109 -9.928 157 H ALA 22 H ALA 22 -9.963 13.356 -8.922 158 HA ALA 22 HA ALA 22 -10.559 15.208 -6.833 159 HB1 ALA 22 HB1 ALA 22 -9.134 12.650 -5.976 160 HB2 ALA 22 HB2 ALA 22 -10.748 13.153 -5.468 161 HB3 ALA 22 HB3 ALA 22 -9.343 14.095 -4.977 162 H ASP 23 H ASP 23 -8.452 16.203 -5.948 163 HA ASP 23 HA ASP 23 -6.480 16.385 -8.109 164 HB2 ASP 23 HB2 ASP 23 -5.454 18.207 -6.761 165 HB3 ASP 23 HB3 ASP 23 -7.153 18.485 -7.076 166 H VAL 24 H VAL 24 -4.099 16.564 -7.302 167 HA VAL 24 HA VAL 24 -3.309 13.925 -6.641 168 HB VAL 24 HB VAL 24 -1.649 16.469 -6.866 169 HG11 VAL 24 HG11 VAL 24 -0.365 14.737 -5.671 170 HG12 VAL 24 HG12 VAL 24 0.294 14.977 -7.290 171 HG13 VAL 24 HG13 VAL 24 -0.717 13.568 -6.948 172 HG21 VAL 24 HG21 VAL 24 -2.888 15.961 -8.919 173 HG22 VAL 24 HG22 VAL 24 -2.231 14.320 -8.936 174 HG23 VAL 24 HG23 VAL 24 -1.158 15.705 -9.157 175 H LYS 25 H LYS 25 -3.284 16.968 -4.788 176 HA LYS 25 HA LYS 25 -1.860 16.066 -2.495 177 HB2 LYS 25 HB2 LYS 25 -4.015 18.228 -2.604 178 HB3 LYS 25 HB3 LYS 25 -2.801 18.032 -1.340 179 HG2 LYS 25 HG2 LYS 25 -2.183 18.688 -4.238 180 HG3 LYS 25 HG3 LYS 25 -2.341 19.886 -2.946 181 HD2 LYS 25 HD2 LYS 25 -0.440 18.782 -1.745 182 HD3 LYS 25 HD3 LYS 25 -0.260 17.662 -3.102 183 HE2 LYS 25 HE2 LYS 25 0.279 19.517 -4.597 184 HE3 LYS 25 HE3 LYS 25 -0.012 20.684 -3.305 185 HZ1 LYS 25 HZ1 LYS 25 2.112 18.616 -3.313 186 HZ2 LYS 25 HZ2 LYS 25 1.831 19.737 -2.082 187 HZ3 LYS 25 HZ3 LYS 25 2.329 20.268 -3.605 188 H ARG 26 H ARG 26 -5.240 15.930 -3.426 189 HA ARG 26 HA ARG 26 -6.423 15.148 -0.956 190 HB2 ARG 26 HB2 ARG 26 -7.711 16.125 -2.816 191 HB3 ARG 26 HB3 ARG 26 -7.343 14.743 -3.828 192 HG2 ARG 26 HG2 ARG 26 -9.641 14.633 -3.064 193 HG3 ARG 26 HG3 ARG 26 -8.722 13.298 -2.379 194 HD2 ARG 26 HD2 ARG 26 -9.248 15.851 -0.821 195 HD3 ARG 26 HD3 ARG 26 -10.392 14.507 -0.838 196 HE ARG 26 HE ARG 26 -7.963 13.409 -0.149 197 HH11 ARG 26 HH11 ARG 26 -10.082 15.739 1.256 198 HH12 ARG 26 HH12 ARG 26 -9.499 15.445 2.851 199 HH21 ARG 26 HH21 ARG 26 -7.264 13.046 1.884 200 HH22 ARG 26 HH22 ARG 26 -7.943 13.927 3.203 201 H VAL 27 H VAL 27 -5.330 13.233 -3.780 202 HA VAL 27 HA VAL 27 -5.896 10.671 -2.582 203 HB VAL 27 HB VAL 27 -4.000 11.121 -4.927 204 HG11 VAL 27 HG11 VAL 27 -4.022 8.823 -4.012 205 HG12 VAL 27 HG12 VAL 27 -4.728 8.859 -5.628 206 HG13 VAL 27 HG13 VAL 27 -5.777 8.747 -4.211 207 HG21 VAL 27 HG21 VAL 27 -5.951 10.902 -6.452 208 HG22 VAL 27 HG22 VAL 27 -6.063 12.349 -5.450 209 HG23 VAL 27 HG23 VAL 27 -7.039 10.933 -5.060 210 H TRP 28 H TRP 28 -3.064 12.774 -2.723 211 HA TRP 28 HA TRP 28 -1.104 11.000 -1.679 212 HB2 TRP 28 HB2 TRP 28 -0.589 13.106 -2.905 213 HB3 TRP 28 HB3 TRP 28 -1.222 14.044 -1.565 214 HD1 TRP 28 HD1 TRP 28 0.507 14.693 0.304 215 HE1 TRP 28 HE1 TRP 28 2.972 14.143 0.751 216 HE3 TRP 28 HE3 TRP 28 1.176 11.007 -3.197 217 HZ2 TRP 28 HZ2 TRP 28 4.950 12.401 -0.260 218 HZ3 TRP 28 HZ3 TRP 28 3.395 9.964 -3.397 219 HH2 TRP 28 HH2 TRP 28 5.243 10.649 -1.954 220 H ALA 29 H ALA 29 -3.497 13.071 -0.139 221 HA ALA 29 HA ALA 29 -2.477 13.240 2.472 222 HB1 ALA 29 HB1 ALA 29 -4.291 14.655 1.615 223 HB2 ALA 29 HB2 ALA 29 -4.755 13.872 3.128 224 HB3 ALA 29 HB3 ALA 29 -5.377 13.264 1.590 225 H ILE 30 H ILE 30 -4.217 10.591 0.927 226 HA ILE 30 HA ILE 30 -4.916 9.147 3.339 227 HB ILE 30 HB ILE 30 -5.682 7.375 1.954 228 HG12 ILE 30 HG12 ILE 30 -3.872 8.466 -0.240 229 HG13 ILE 30 HG13 ILE 30 -3.702 6.937 0.598 230 HG21 ILE 30 HG21 ILE 30 -7.025 9.430 1.736 231 HG22 ILE 30 HG22 ILE 30 -7.079 8.479 0.253 232 HG23 ILE 30 HG23 ILE 30 -6.065 9.922 0.336 233 HD11 ILE 30 HD11 ILE 30 -5.810 6.191 -0.474 234 HD12 ILE 30 HD12 ILE 30 -4.490 6.542 -1.592 235 HD13 ILE 30 HD13 ILE 30 -5.807 7.698 -1.401 236 H TRP 31 H TRP 31 -2.039 9.435 1.397 237 HA TRP 31 HA TRP 31 -0.703 7.113 2.603 238 HB2 TRP 31 HB2 TRP 31 0.229 9.143 0.514 239 HB3 TRP 31 HB3 TRP 31 1.179 7.760 1.060 240 HD1 TRP 31 HD1 TRP 31 -1.405 8.671 -1.504 241 HE1 TRP 31 HE1 TRP 31 -2.253 6.548 -2.690 242 HE3 TRP 31 HE3 TRP 31 0.662 5.131 1.564 243 HZ2 TRP 31 HZ2 TRP 31 -2.061 3.753 -2.371 244 HZ3 TRP 31 HZ3 TRP 31 0.303 2.761 1.045 245 HH2 TRP 31 HH2 TRP 31 -1.046 2.076 -0.872 246 H GLU 32 H GLU 32 -0.733 10.591 2.762 247 HA GLU 32 HA GLU 32 1.755 10.919 4.161 248 HB2 GLU 32 HB2 GLU 32 0.886 12.594 2.570 249 HB3 GLU 32 HB3 GLU 32 -0.505 12.889 3.606 250 HG2 GLU 32 HG2 GLU 32 0.834 13.939 5.277 251 HG3 GLU 32 HG3 GLU 32 2.330 13.347 4.559 252 H ASP 33 H ASP 33 -1.660 10.824 5.079 253 HA ASP 33 HA ASP 33 -0.968 11.256 7.922 254 HB2 ASP 33 HB2 ASP 33 -3.624 11.484 6.469 255 HB3 ASP 33 HB3 ASP 33 -3.410 11.719 8.203 256 HA PRO 34 HA PRO 34 -1.525 6.790 8.662 257 HB2 PRO 34 HB2 PRO 34 -1.856 7.106 11.452 258 HB3 PRO 34 HB3 PRO 34 -0.329 6.860 10.609 259 HG2 PRO 34 HG2 PRO 34 -1.607 9.434 11.514 260 HG3 PRO 34 HG3 PRO 34 0.099 8.943 11.591 261 HD2 PRO 34 HD2 PRO 34 -0.715 10.638 9.704 262 HD3 PRO 34 HD3 PRO 34 0.452 9.358 9.292 263 H ARG 35 H ARG 35 -3.690 9.175 10.273 264 HA ARG 35 HA ARG 35 -5.841 7.453 10.864 265 HB2 ARG 35 HB2 ARG 35 -5.568 10.431 10.545 266 HB3 ARG 35 HB3 ARG 35 -7.191 9.777 10.568 267 HG2 ARG 35 HG2 ARG 35 -6.640 10.543 12.769 268 HG3 ARG 35 HG3 ARG 35 -6.759 8.785 12.803 269 HD2 ARG 35 HD2 ARG 35 -4.097 10.217 12.557 270 HD3 ARG 35 HD3 ARG 35 -4.845 9.897 14.123 271 HE ARG 35 HE ARG 35 -4.623 7.518 12.538 272 HH11 ARG 35 HH11 ARG 35 -2.823 9.578 14.654 273 HH12 ARG 35 HH12 ARG 35 -1.661 8.350 15.004 274 HH21 ARG 35 HH21 ARG 35 -3.130 6.004 12.999 275 HH22 ARG 35 HH22 ARG 35 -1.830 6.362 14.080 276 H GLN 36 H GLN 36 -5.249 9.417 7.941 277 HA GLN 36 HA GLN 36 -7.698 8.627 6.627 278 HB2 GLN 36 HB2 GLN 36 -5.263 10.007 5.416 279 HB3 GLN 36 HB3 GLN 36 -6.873 9.901 4.701 280 HG2 GLN 36 HG2 GLN 36 -7.716 11.184 6.754 281 HG3 GLN 36 HG3 GLN 36 -6.026 11.472 7.158 282 HE21 GLN 36 HE21 GLN 36 -4.779 12.804 5.729 283 HE22 GLN 36 HE22 GLN 36 -5.548 13.916 4.666 284 H LEU 37 H LEU 37 -4.485 7.306 6.828 285 HA LEU 37 HA LEU 37 -4.585 5.620 4.491 286 HB2 LEU 37 HB2 LEU 37 -2.457 6.325 5.438 287 HB3 LEU 37 HB3 LEU 37 -2.845 5.592 6.985 288 HG LEU 37 HG LEU 37 -2.630 3.333 6.008 289 HD11 LEU 37 HD11 LEU 37 -1.878 4.673 3.391 290 HD12 LEU 37 HD12 LEU 37 -3.372 3.781 3.701 291 HD13 LEU 37 HD13 LEU 37 -1.819 2.934 3.738 292 HD21 LEU 37 HD21 LEU 37 -0.238 5.085 5.372 293 HD22 LEU 37 HD22 LEU 37 -0.218 3.336 5.639 294 HD23 LEU 37 HD23 LEU 37 -0.647 4.423 6.959 295 H GLU 38 H GLU 38 -4.973 4.982 8.000 296 HA GLU 38 HA GLU 38 -5.659 2.212 7.676 297 HB2 GLU 38 HB2 GLU 38 -6.059 2.235 10.094 298 HB3 GLU 38 HB3 GLU 38 -4.562 3.061 9.693 299 HG2 GLU 38 HG2 GLU 38 -5.770 5.249 9.900 300 HG3 GLU 38 HG3 GLU 38 -7.188 4.361 10.457 301 H ARG 39 H ARG 39 -7.463 4.988 7.116 302 HA ARG 39 HA ARG 39 -10.089 4.241 7.843 303 HB2 ARG 39 HB2 ARG 39 -9.439 6.546 7.227 304 HB3 ARG 39 HB3 ARG 39 -9.060 6.022 5.589 305 HG2 ARG 39 HG2 ARG 39 -11.423 5.516 5.175 306 HG3 ARG 39 HG3 ARG 39 -11.818 5.948 6.830 307 HD2 ARG 39 HD2 ARG 39 -10.747 7.827 4.705 308 HD3 ARG 39 HD3 ARG 39 -12.415 7.756 5.281 309 HE ARG 39 HE ARG 39 -10.531 8.285 7.380 310 HH11 ARG 39 HH11 ARG 39 -12.389 9.811 4.889 311 HH12 ARG 39 HH12 ARG 39 -12.333 11.354 5.656 312 HH21 ARG 39 HH21 ARG 39 -10.472 10.259 8.330 313 HH22 ARG 39 HH22 ARG 39 -11.244 11.608 7.575 314 H TRP 40 H TRP 40 -8.008 3.303 5.204 315 HA TRP 40 HA TRP 40 -10.117 1.607 3.990 316 HB2 TRP 40 HB2 TRP 40 -9.187 2.162 1.754 317 HB3 TRP 40 HB3 TRP 40 -9.802 3.590 2.581 318 HD1 TRP 40 HD1 TRP 40 -7.925 5.396 3.477 319 HE1 TRP 40 HE1 TRP 40 -5.534 5.857 2.647 320 HE3 TRP 40 HE3 TRP 40 -7.103 1.095 0.852 321 HZ2 TRP 40 HZ2 TRP 40 -3.568 4.586 1.072 322 HZ3 TRP 40 HZ3 TRP 40 -4.955 0.787 -0.294 323 HH2 TRP 40 HH2 TRP 40 -3.226 2.499 -0.180 324 H TRP 41 H TRP 41 -6.962 1.772 5.292 325 HA TRP 41 HA TRP 41 -5.608 -0.166 3.683 326 HB2 TRP 41 HB2 TRP 41 -4.525 1.629 5.168 327 HB3 TRP 41 HB3 TRP 41 -4.875 0.597 6.554 328 HD1 TRP 41 HD1 TRP 41 -2.887 -1.004 7.170 329 HE1 TRP 41 HE1 TRP 41 -0.832 -1.933 5.924 330 HE3 TRP 41 HE3 TRP 41 -3.787 0.921 2.509 331 HZ2 TRP 41 HZ2 TRP 41 0.252 -1.841 3.339 332 HZ3 TRP 41 HZ3 TRP 41 -2.209 0.443 0.714 333 HH2 TRP 41 HH2 TRP 41 -0.214 -0.912 1.113 334 H GLY 42 H GLY 42 -6.714 -2.072 3.531 335 HA2 GLY 42 HA2 GLY 42 -6.598 -4.355 4.439 336 HA3 GLY 42 HA3 GLY 42 -7.127 -3.713 5.987 337 HA PRO 43 HA PRO 43 -10.809 -5.059 3.103 338 HB2 PRO 43 HB2 PRO 43 -11.378 -7.536 4.176 339 HB3 PRO 43 HB3 PRO 43 -10.268 -7.307 2.815 340 HG2 PRO 43 HG2 PRO 43 -9.636 -7.627 5.752 341 HG3 PRO 43 HG3 PRO 43 -8.873 -8.420 4.356 342 HD2 PRO 43 HD2 PRO 43 -7.733 -6.285 5.574 343 HD3 PRO 43 HD3 PRO 43 -7.594 -6.521 3.817 344 HA PRO 44 HA PRO 44 -13.965 -3.613 5.941 345 HB2 PRO 44 HB2 PRO 44 -16.033 -5.537 5.705 346 HB3 PRO 44 HB3 PRO 44 -15.787 -4.147 4.642 347 HG2 PRO 44 HG2 PRO 44 -14.863 -6.999 4.292 348 HG3 PRO 44 HG3 PRO 44 -15.593 -5.909 3.093 349 HD2 PRO 44 HD2 PRO 44 -12.977 -6.308 3.048 350 HD3 PRO 44 HD3 PRO 44 -13.587 -4.646 2.852 351 H THR 45 H THR 45 -13.072 -7.009 6.428 352 HA THR 45 HA THR 45 -14.095 -7.077 9.185 353 HB THR 45 HB THR 45 -13.327 -9.473 9.160 354 HG1 THR 45 HG1 THR 45 -12.166 -10.215 7.537 355 HG21 THR 45 HG21 THR 45 -15.106 -8.692 6.815 356 HG22 THR 45 HG22 THR 45 -15.642 -8.950 8.478 357 HG23 THR 45 HG23 THR 45 -15.004 -10.300 7.538 358 H TRP 46 H TRP 46 -11.100 -6.335 7.630 359 HA TRP 46 HA TRP 46 -9.616 -6.526 10.207 360 HB2 TRP 46 HB2 TRP 46 -8.508 -7.023 7.405 361 HB3 TRP 46 HB3 TRP 46 -7.520 -6.903 8.851 362 HD1 TRP 46 HD1 TRP 46 -10.256 -9.233 7.340 363 HE1 TRP 46 HE1 TRP 46 -9.874 -11.600 8.270 364 HE3 TRP 46 HE3 TRP 46 -6.408 -8.252 10.555 365 HZ2 TRP 46 HZ2 TRP 46 -8.167 -12.895 10.085 366 HZ3 TRP 46 HZ3 TRP 46 -5.452 -10.117 11.841 367 HH2 TRP 46 HH2 TRP 46 -6.308 -12.392 11.613 368 HA PRO 47 HA PRO 47 -9.262 -2.020 8.857 369 HB2 PRO 47 HB2 PRO 47 -10.020 -0.904 11.237 370 HB3 PRO 47 HB3 PRO 47 -11.192 -1.377 9.997 371 HG2 PRO 47 HG2 PRO 47 -10.328 -2.901 12.465 372 HG3 PRO 47 HG3 PRO 47 -11.975 -2.605 11.865 373 HD2 PRO 47 HD2 PRO 47 -10.688 -4.950 11.401 374 HD3 PRO 47 HD3 PRO 47 -11.807 -4.254 10.212 375 H ALA 48 H ALA 48 -7.191 -1.245 8.957 376 HA ALA 48 HA ALA 48 -5.236 -2.198 10.831 377 HB1 ALA 48 HB1 ALA 48 -4.651 -1.589 8.516 378 HB2 ALA 48 HB2 ALA 48 -3.678 -0.692 9.687 379 HB3 ALA 48 HB3 ALA 48 -5.025 0.101 8.863 380 H THR 49 H THR 49 -4.028 -0.953 12.371 381 HA THR 49 HA THR 49 -5.231 1.572 13.364 382 HB THR 49 HB THR 49 -4.361 -0.689 15.234 383 HG1 THR 49 HG1 THR 49 -6.181 -1.508 14.396 384 HG21 THR 49 HG21 THR 49 -5.576 0.601 16.959 385 HG22 THR 49 HG22 THR 49 -5.986 1.835 15.765 386 HG23 THR 49 HG23 THR 49 -4.300 1.586 16.235 387 H PHE 50 H PHE 50 -3.534 2.968 12.904 388 HA PHE 50 HA PHE 50 -0.775 2.021 13.034 389 HB2 PHE 50 HB2 PHE 50 -2.059 4.535 11.938 390 HB3 PHE 50 HB3 PHE 50 -0.317 4.472 12.195 391 HD1 PHE 50 HD1 PHE 50 -3.095 2.605 10.493 392 HD2 PHE 50 HD2 PHE 50 1.078 3.552 10.512 393 HE1 PHE 50 HE1 PHE 50 -2.814 1.423 8.356 394 HE2 PHE 50 HE2 PHE 50 1.350 2.367 8.375 395 HZ PHE 50 HZ PHE 50 -0.594 1.300 7.298 396 H GLU 51 H GLU 51 0.133 1.932 14.958 397 HA GLU 51 HA GLU 51 -0.158 3.834 17.088 398 HB2 GLU 51 HB2 GLU 51 2.058 1.798 16.597 399 HB3 GLU 51 HB3 GLU 51 1.753 2.638 18.119 400 HG2 GLU 51 HG2 GLU 51 -0.052 0.606 16.768 401 HG3 GLU 51 HG3 GLU 51 0.908 0.353 18.223 402 H THR 52 H THR 52 2.130 3.364 14.460 403 HA THR 52 HA THR 52 3.118 6.119 14.821 404 HB THR 52 HB THR 52 5.020 3.807 14.176 405 HG1 THR 52 HG1 THR 52 4.291 4.933 16.687 406 HG21 THR 52 HG21 THR 52 5.510 6.634 15.175 407 HG22 THR 52 HG22 THR 52 5.771 6.076 13.519 408 HG23 THR 52 HG23 THR 52 6.756 5.427 14.832 409 H HIS 53 H HIS 53 3.624 7.165 12.892 410 HA HIS 53 HA HIS 53 4.105 5.735 10.423 411 HB2 HIS 53 HB2 HIS 53 1.641 5.826 10.426 412 HB3 HIS 53 HB3 HIS 53 1.679 7.564 10.669 413 HD2 HIS 53 HD2 HIS 53 1.753 4.983 7.813 414 HE1 HIS 53 HE1 HIS 53 2.283 8.843 6.164 415 HE2 HIS 53 HE2 HIS 53 1.630 6.454 5.680 416 H GLU 54 H GLU 54 6.095 6.679 10.501 417 HA GLU 54 HA GLU 54 6.469 9.571 10.705 418 HB2 GLU 54 HB2 GLU 54 8.576 7.393 10.323 419 HB3 GLU 54 HB3 GLU 54 8.856 9.068 10.819 420 HG2 GLU 54 HG2 GLU 54 7.668 8.656 12.914 421 HG3 GLU 54 HG3 GLU 54 7.309 7.010 12.406 422 H PHE 55 H PHE 55 5.586 10.311 8.743 423 HA PHE 55 HA PHE 55 6.293 9.181 6.200 424 HB2 PHE 55 HB2 PHE 55 4.077 10.358 6.894 425 HB3 PHE 55 HB3 PHE 55 4.941 11.873 6.644 426 HD1 PHE 55 HD1 PHE 55 4.197 8.641 4.919 427 HD2 PHE 55 HD2 PHE 55 4.873 12.830 4.462 428 HE1 PHE 55 HE1 PHE 55 3.655 8.465 2.527 429 HE2 PHE 55 HE2 PHE 55 4.314 12.650 2.070 430 HZ PHE 55 HZ PHE 55 3.707 10.467 1.104 431 H THR 56 H THR 56 8.667 9.480 6.947 432 HA THR 56 HA THR 56 9.779 11.819 5.520 433 HB THR 56 HB THR 56 9.965 12.342 7.932 434 HG1 THR 56 HG1 THR 56 11.674 13.211 6.968 435 HG21 THR 56 HG21 THR 56 10.006 10.051 8.872 436 HG22 THR 56 HG22 THR 56 11.382 10.992 9.448 437 HG23 THR 56 HG23 THR 56 11.610 9.786 8.179 438 H VAL 57 H VAL 57 12.064 11.448 4.835 439 HA VAL 57 HA VAL 57 12.513 8.897 3.615 440 HB VAL 57 HB VAL 57 14.268 11.376 3.931 441 HG11 VAL 57 HG11 VAL 57 15.781 10.439 2.195 442 HG12 VAL 57 HG12 VAL 57 14.901 8.912 2.267 443 HG13 VAL 57 HG13 VAL 57 15.797 9.477 3.674 444 HG21 VAL 57 HG21 VAL 57 12.269 11.671 2.516 445 HG22 VAL 57 HG22 VAL 57 12.737 10.279 1.536 446 HG23 VAL 57 HG23 VAL 57 13.733 11.736 1.530 447 H GLY 58 H GLY 58 13.038 7.138 4.792 448 HA2 GLY 58 HA2 GLY 58 14.513 5.772 6.026 449 HA3 GLY 58 HA3 GLY 58 15.204 7.189 6.791 450 H GLY 59 H GLY 59 11.783 7.292 6.843 451 HA2 GLY 59 HA2 GLY 59 11.669 6.694 9.709 452 HA3 GLY 59 HA3 GLY 59 10.399 7.397 8.724 453 H LYS 60 H LYS 60 9.902 5.395 10.631 454 HA LYS 60 HA LYS 60 9.087 3.063 8.964 455 HB2 LYS 60 HB2 LYS 60 10.053 3.251 11.791 456 HB3 LYS 60 HB3 LYS 60 8.666 2.209 11.574 457 HG2 LYS 60 HG2 LYS 60 10.461 0.742 11.422 458 HG3 LYS 60 HG3 LYS 60 10.021 1.019 9.743 459 HD2 LYS 60 HD2 LYS 60 11.926 2.479 9.425 460 HD3 LYS 60 HD3 LYS 60 12.289 2.466 11.159 461 HE2 LYS 60 HE2 LYS 60 12.644 -0.051 10.960 462 HE3 LYS 60 HE3 LYS 60 12.522 0.143 9.209 463 HZ1 LYS 60 HZ1 LYS 60 14.810 0.111 9.927 464 HZ2 LYS 60 HZ2 LYS 60 14.538 1.415 10.976 465 HZ3 LYS 60 HZ3 LYS 60 14.426 1.637 9.307 466 H ALA 61 H ALA 61 6.993 2.033 9.713 467 HA ALA 61 HA ALA 61 5.101 3.815 11.119 468 HB1 ALA 61 HB1 ALA 61 4.397 2.419 8.506 469 HB2 ALA 61 HB2 ALA 61 4.686 4.147 8.693 470 HB3 ALA 61 HB3 ALA 61 3.310 3.395 9.499 471 H ALA 62 H ALA 62 4.002 2.713 12.672 472 HA ALA 62 HA ALA 62 4.191 -0.253 12.774 473 HB1 ALA 62 HB1 ALA 62 3.836 1.740 15.050 474 HB2 ALA 62 HB2 ALA 62 5.318 0.870 14.653 475 HB3 ALA 62 HB3 ALA 62 3.903 -0.019 15.227 476 H TYR 63 H TYR 63 2.283 -1.415 12.731 477 HA TYR 63 HA TYR 63 -0.196 -0.291 13.709 478 HB2 TYR 63 HB2 TYR 63 -1.501 -0.457 11.668 479 HB3 TYR 63 HB3 TYR 63 -0.147 0.622 11.405 480 HD1 TYR 63 HD1 TYR 63 1.820 -0.176 9.986 481 HD2 TYR 63 HD2 TYR 63 -1.814 -2.417 10.285 482 HE1 TYR 63 HE1 TYR 63 2.376 -1.366 7.908 483 HE2 TYR 63 HE2 TYR 63 -1.248 -3.613 8.215 484 HH TYR 63 HH TYR 63 1.843 -3.389 6.709 485 H TYR 64 H TYR 64 -2.083 -1.826 13.341 486 HA TYR 64 HA TYR 64 -1.491 -4.595 12.719 487 HB2 TYR 64 HB2 TYR 64 -2.519 -5.451 14.889 488 HB3 TYR 64 HB3 TYR 64 -0.929 -4.724 15.058 489 HD1 TYR 64 HD2 TYR 64 -0.642 -2.557 16.236 490 HD2 TYR 64 HD1 TYR 64 -4.507 -4.372 15.901 491 HE1 TYR 64 HE2 TYR 64 -1.507 -1.056 17.974 492 HE2 TYR 64 HE1 TYR 64 -5.365 -2.869 17.641 493 HH TYR 64 HH TYR 64 -3.669 -0.113 18.689 494 H MET 65 H MET 65 -3.246 -5.603 11.826 495 HA MET 65 HA MET 65 -5.722 -4.084 11.454 496 HB2 MET 65 HB2 MET 65 -4.816 -6.735 10.249 497 HB3 MET 65 HB3 MET 65 -6.300 -5.889 9.825 498 HG2 MET 65 HG2 MET 65 -4.964 -3.996 8.975 499 HG3 MET 65 HG3 MET 65 -3.483 -4.872 9.366 500 HE1 MET 65 HE1 MET 65 -2.798 -7.199 8.175 501 HE2 MET 65 HE2 MET 65 -3.734 -7.937 6.877 502 HE3 MET 65 HE3 MET 65 -4.376 -7.916 8.517 503 H THR 66 H THR 66 -7.148 -4.266 13.122 504 HA THR 66 HA THR 66 -7.304 -6.578 14.847 505 HB THR 66 HB THR 66 -9.142 -4.143 14.725 506 HG1 THR 66 HG1 THR 66 -7.725 -3.653 16.674 507 HG21 THR 66 HG21 THR 66 -10.165 -6.034 15.977 508 HG22 THR 66 HG22 THR 66 -9.720 -4.718 17.069 509 HG23 THR 66 HG23 THR 66 -8.709 -6.161 16.968 510 H GLY 67 H GLY 67 -8.209 -8.404 14.090 511 HA2 GLY 67 HA2 GLY 67 -9.770 -8.512 11.701 512 HA3 GLY 67 HA3 GLY 67 -9.278 -9.867 12.691 513 HA PRO 68 HA PRO 68 -13.986 -9.295 12.741 514 HB2 PRO 68 HB2 PRO 68 -14.642 -11.879 12.038 515 HB3 PRO 68 HB3 PRO 68 -14.304 -10.607 10.853 516 HG2 PRO 68 HG2 PRO 68 -12.451 -12.745 11.921 517 HG3 PRO 68 HG3 PRO 68 -12.718 -12.248 10.234 518 HD2 PRO 68 HD2 PRO 68 -10.581 -11.362 11.627 519 HD3 PRO 68 HD3 PRO 68 -11.417 -10.306 10.466 520 H ASP 69 H ASP 69 -11.827 -11.613 14.233 521 HA ASP 69 HA ASP 69 -13.693 -12.110 16.478 522 HB2 ASP 69 HB2 ASP 69 -12.593 -14.045 15.214 523 HB3 ASP 69 HB3 ASP 69 -11.050 -13.509 15.866 524 H GLY 70 H GLY 70 -11.704 -9.728 15.752 525 HA2 GLY 70 HA2 GLY 70 -10.595 -8.154 17.050 526 HA3 GLY 70 HA3 GLY 70 -10.647 -9.241 18.430 527 H THR 71 H THR 71 -9.465 -10.842 15.701 528 HA THR 71 HA THR 71 -6.911 -11.329 16.835 529 HB THR 71 HB THR 71 -7.791 -11.888 13.960 530 HG1 THR 71 HG1 THR 71 -8.012 -14.061 15.413 531 HG21 THR 71 HG21 THR 71 -5.694 -13.275 15.694 532 HG22 THR 71 HG22 THR 71 -5.356 -12.224 14.312 533 HG23 THR 71 HG23 THR 71 -6.179 -13.765 14.068 534 H LYS 72 H LYS 72 -5.512 -9.617 17.009 535 HA LYS 72 HA LYS 72 -5.241 -7.548 15.013 536 HB2 LYS 72 HB2 LYS 72 -3.668 -8.105 17.561 537 HB3 LYS 72 HB3 LYS 72 -3.509 -6.646 16.582 538 HG2 LYS 72 HG2 LYS 72 -5.770 -5.963 17.096 539 HG3 LYS 72 HG3 LYS 72 -6.118 -7.510 17.878 540 HD2 LYS 72 HD2 LYS 72 -4.483 -6.985 19.657 541 HD3 LYS 72 HD3 LYS 72 -4.098 -5.449 18.869 542 HE2 LYS 72 HE2 LYS 72 -6.343 -4.615 19.292 543 HE3 LYS 72 HE3 LYS 72 -6.862 -6.184 19.904 544 HZ1 LYS 72 HZ1 LYS 72 -5.215 -5.917 21.708 545 HZ2 LYS 72 HZ2 LYS 72 -6.433 -4.745 21.731 546 HZ3 LYS 72 HZ3 LYS 72 -4.893 -4.353 21.156 547 H ALA 73 H ALA 73 -4.264 -8.096 13.126 548 HA ALA 73 HA ALA 73 -1.884 -9.828 13.033 549 HB1 ALA 73 HB1 ALA 73 -3.604 -10.197 11.316 550 HB2 ALA 73 HB2 ALA 73 -2.092 -9.665 10.579 551 HB3 ALA 73 HB3 ALA 73 -3.434 -8.530 10.757 552 H ARG 74 H ARG 74 -0.114 -8.748 13.702 553 HA ARG 74 HA ARG 74 0.238 -5.937 13.601 554 HB2 ARG 74 HB2 ARG 74 1.289 -7.719 15.218 555 HB3 ARG 74 HB3 ARG 74 2.518 -7.909 13.984 556 HG2 ARG 74 HG2 ARG 74 3.465 -6.393 15.525 557 HG3 ARG 74 HG3 ARG 74 2.909 -5.364 14.198 558 HD2 ARG 74 HD2 ARG 74 0.832 -4.874 15.517 559 HD3 ARG 74 HD3 ARG 74 1.491 -5.846 16.842 560 HE ARG 74 HE ARG 74 3.237 -3.713 16.033 561 HH11 ARG 74 HH11 ARG 74 0.502 -4.440 18.035 562 HH12 ARG 74 HH12 ARG 74 0.821 -3.134 19.114 563 HH21 ARG 74 HH21 ARG 74 3.594 -2.045 17.404 564 HH22 ARG 74 HH22 ARG 74 2.549 -1.781 18.754 565 H GLY 75 H GLY 75 1.388 -4.632 12.164 566 HA2 GLY 75 HA2 GLY 75 3.131 -5.814 10.099 567 HA3 GLY 75 HA3 GLY 75 1.784 -4.800 9.584 568 H TRP 76 H TRP 76 4.448 -4.207 8.971 569 HA TRP 76 HA TRP 76 4.785 -1.584 10.275 570 HB2 TRP 76 HB2 TRP 76 7.234 -1.918 10.464 571 HB3 TRP 76 HB3 TRP 76 6.378 -3.149 11.390 572 HD1 TRP 76 HD1 TRP 76 6.367 -5.683 10.331 573 HE1 TRP 76 HE1 TRP 76 7.985 -6.846 8.727 574 HE3 TRP 76 HE3 TRP 76 8.880 -1.577 8.575 575 HZ2 TRP 76 HZ2 TRP 76 10.045 -6.147 6.965 576 HZ3 TRP 76 HZ3 TRP 76 10.681 -1.918 6.928 577 HH2 TRP 76 HH2 TRP 76 11.255 -4.164 6.141 578 H TRP 77 H TRP 77 5.885 -0.018 8.952 579 HA TRP 77 HA TRP 77 6.495 -0.731 6.137 580 HB2 TRP 77 HB2 TRP 77 5.272 1.826 7.228 581 HB3 TRP 77 HB3 TRP 77 6.045 1.765 5.655 582 HD1 TRP 77 HD1 TRP 77 3.937 -1.317 6.211 583 HE1 TRP 77 HE1 TRP 77 1.745 -1.072 4.886 584 HE3 TRP 77 HE3 TRP 77 4.292 3.616 5.024 585 HZ2 TRP 77 HZ2 TRP 77 0.347 1.002 3.520 586 HZ3 TRP 77 HZ3 TRP 77 2.509 4.667 3.703 587 HH2 TRP 77 HH2 TRP 77 0.577 3.380 2.968 588 H GLN 78 H GLN 78 8.269 0.554 5.163 589 HA GLN 78 HA GLN 78 9.644 2.478 6.897 590 HB2 GLN 78 HB2 GLN 78 10.970 0.455 7.241 591 HB3 GLN 78 HB3 GLN 78 11.146 0.227 5.501 592 HG2 GLN 78 HG2 GLN 78 12.515 2.208 5.299 593 HG3 GLN 78 HG3 GLN 78 12.171 2.686 6.962 594 HE21 GLN 78 HE21 GLN 78 14.364 2.786 7.436 595 HE22 GLN 78 HE22 GLN 78 15.318 1.369 7.656 596 H PHE 79 H PHE 79 9.478 4.285 5.809 597 HA PHE 79 HA PHE 79 9.211 4.500 2.960 598 HB2 PHE 79 HB2 PHE 79 9.690 6.687 5.031 599 HB3 PHE 79 HB3 PHE 79 9.124 6.926 3.382 600 HD1 PHE 79 HD1 PHE 79 8.186 5.799 6.761 601 HD2 PHE 79 HD2 PHE 79 6.805 6.399 2.758 602 HE1 PHE 79 HE1 PHE 79 5.860 5.619 7.534 603 HE2 PHE 79 HE2 PHE 79 4.485 6.223 3.539 604 HZ PHE 79 HZ PHE 79 4.012 5.838 5.925 605 H THR 80 H THR 80 10.820 4.699 1.470 606 HA THR 80 HA THR 80 13.587 5.314 2.336 607 HB THR 80 HB THR 80 14.329 4.385 0.171 608 HG1 THR 80 HG1 THR 80 12.974 4.107 -1.421 609 HG21 THR 80 HG21 THR 80 13.645 2.012 0.463 610 HG22 THR 80 HG22 THR 80 12.393 2.522 1.599 611 HG23 THR 80 HG23 THR 80 14.098 2.764 2.000 612 H THR 81 H THR 81 11.497 6.050 -0.500 613 HA THR 81 HA THR 81 12.852 8.692 -0.781 614 HB THR 81 HB THR 81 11.816 6.878 -3.005 615 HG1 THR 81 HG1 THR 81 14.368 7.380 -1.929 616 HG21 THR 81 HG21 THR 81 11.532 9.219 -3.680 617 HG22 THR 81 HG22 THR 81 12.885 8.504 -4.563 618 HG23 THR 81 HG23 THR 81 13.195 9.582 -3.199 619 H ILE 82 H ILE 82 11.410 10.079 0.095 620 HA ILE 82 HA ILE 82 8.678 10.229 -1.067 621 HB ILE 82 HB ILE 82 9.626 11.460 1.567 622 HG12 ILE 82 HG12 ILE 82 7.926 8.975 1.079 623 HG13 ILE 82 HG13 ILE 82 9.533 9.015 1.795 624 HG21 ILE 82 HG21 ILE 82 7.240 11.984 1.957 625 HG22 ILE 82 HG22 ILE 82 6.817 11.303 0.386 626 HG23 ILE 82 HG23 ILE 82 7.815 12.756 0.477 627 HD11 ILE 82 HD11 ILE 82 7.870 8.667 3.486 628 HD12 ILE 82 HD12 ILE 82 6.990 10.111 2.996 629 HD13 ILE 82 HD13 ILE 82 8.596 10.255 3.719 630 H GLU 83 H GLU 83 8.908 11.579 -2.800 631 HA GLU 83 HA GLU 83 10.434 14.088 -2.538 632 HB2 GLU 83 HB2 GLU 83 9.081 12.899 -4.992 633 HB3 GLU 83 HB3 GLU 83 10.070 14.358 -4.964 634 HG2 GLU 83 HG2 GLU 83 11.988 12.917 -4.164 635 HG3 GLU 83 HG3 GLU 83 10.976 11.508 -4.485 636 H ALA 84 H ALA 84 7.149 12.978 -3.380 637 HA ALA 84 HA ALA 84 5.084 13.842 -3.190 638 HB1 ALA 84 HB1 ALA 84 4.571 15.602 -1.572 639 HB2 ALA 84 HB2 ALA 84 6.281 16.050 -1.485 640 HB3 ALA 84 HB3 ALA 84 5.750 14.477 -0.889 641 HA PRO 85 HA PRO 85 3.139 15.018 -3.211 642 HB2 PRO 85 HB2 PRO 85 1.091 15.883 -4.672 643 HB3 PRO 85 HB3 PRO 85 2.092 17.047 -3.787 644 HG2 PRO 85 HG2 PRO 85 2.140 16.352 -6.725 645 HG3 PRO 85 HG3 PRO 85 2.268 17.947 -5.953 646 HD2 PRO 85 HD2 PRO 85 4.445 16.355 -6.818 647 HD3 PRO 85 HD3 PRO 85 4.552 17.752 -5.722 648 H ASP 86 H ASP 86 4.586 13.770 -5.874 649 HA ASP 86 HA ASP 86 2.371 11.912 -6.559 650 HB2 ASP 86 HB2 ASP 86 3.471 11.680 -8.810 651 HB3 ASP 86 HB3 ASP 86 2.814 13.274 -8.472 652 H HIS 87 H HIS 87 5.933 12.024 -6.132 653 HA HIS 87 HA HIS 87 6.131 9.119 -6.432 654 HB2 HIS 87 HB2 HIS 87 7.798 10.699 -7.470 655 HB3 HIS 87 HB3 HIS 87 8.359 11.125 -5.861 656 HD1 HIS 87 HD1 HIS 87 10.480 10.096 -7.597 657 HD2 HIS 87 HD2 HIS 87 8.081 7.457 -5.463 658 HE1 HIS 87 HE1 HIS 87 11.784 7.970 -7.459 659 HE2 HIS 87 HE2 HIS 87 10.266 6.358 -6.297 660 H LEU 88 H LEU 88 5.620 7.926 -4.734 661 HA LEU 88 HA LEU 88 6.919 8.392 -2.108 662 HB2 LEU 88 HB2 LEU 88 4.470 8.582 -1.908 663 HB3 LEU 88 HB3 LEU 88 4.250 7.044 -2.714 664 HG LEU 88 HG LEU 88 5.242 5.859 -0.784 665 HD11 LEU 88 HD11 LEU 88 6.831 7.557 -0.018 666 HD12 LEU 88 HD12 LEU 88 5.793 7.024 1.301 667 HD13 LEU 88 HD13 LEU 88 5.500 8.585 0.525 668 HD21 LEU 88 HD21 LEU 88 3.468 6.266 0.863 669 HD22 LEU 88 HD22 LEU 88 2.830 6.210 -0.778 670 HD23 LEU 88 HD23 LEU 88 3.032 7.766 0.037 671 H GLU 89 H GLU 89 8.304 6.784 -1.502 672 HA GLU 89 HA GLU 89 7.861 4.023 -2.476 673 HB2 GLU 89 HB2 GLU 89 10.536 5.471 -2.241 674 HB3 GLU 89 HB3 GLU 89 10.404 3.716 -2.335 675 HG2 GLU 89 HG2 GLU 89 9.227 3.994 -4.534 676 HG3 GLU 89 HG3 GLU 89 9.572 5.722 -4.446 677 H PHE 90 H PHE 90 7.723 2.579 -0.904 678 HA PHE 90 HA PHE 90 9.124 2.879 1.633 679 HB2 PHE 90 HB2 PHE 90 7.111 2.489 3.019 680 HB3 PHE 90 HB3 PHE 90 6.976 3.991 2.119 681 HD1 PHE 90 HD2 PHE 90 5.658 0.543 2.462 682 HD2 PHE 90 HD1 PHE 90 5.270 4.264 0.388 683 HE1 PHE 90 HE2 PHE 90 3.461 -0.152 1.611 684 HE2 PHE 90 HE1 PHE 90 3.075 3.558 -0.453 685 HZ PHE 90 HZ PHE 90 2.168 1.353 0.152 686 H ASP 91 H ASP 91 8.677 0.872 3.012 687 HA ASP 91 HA ASP 91 8.537 -1.555 1.314 688 HB2 ASP 91 HB2 ASP 91 10.155 -0.998 3.837 689 HB3 ASP 91 HB3 ASP 91 9.946 -2.614 3.158 690 H ASP 92 H ASP 92 6.395 -2.055 1.519 691 HA ASP 92 HA ASP 92 4.999 -2.180 4.012 692 HB2 ASP 92 HB2 ASP 92 3.772 -1.962 1.867 693 HB3 ASP 92 HB3 ASP 92 4.377 -3.534 1.350 694 H GLY 93 H GLY 93 5.198 -3.708 5.521 695 HA2 GLY 93 HA2 GLY 93 6.202 -6.411 4.874 696 HA3 GLY 93 HA3 GLY 93 7.026 -5.444 6.094 697 H PHE 94 H PHE 94 5.647 -7.993 6.352 698 HA PHE 94 HA PHE 94 3.425 -7.402 8.194 699 HB2 PHE 94 HB2 PHE 94 4.557 -10.026 7.115 700 HB3 PHE 94 HB3 PHE 94 3.274 -9.945 8.318 701 HD1 PHE 94 HD1 PHE 94 4.123 -9.021 4.788 702 HD2 PHE 94 HD2 PHE 94 0.997 -9.586 7.665 703 HE1 PHE 94 HE1 PHE 94 2.435 -8.843 3.003 704 HE2 PHE 94 HE2 PHE 94 -0.675 -9.401 5.875 705 HZ PHE 94 HZ PHE 94 0.039 -9.034 3.545 706 H ALA 95 H ALA 95 3.507 -7.987 10.387 707 HA ALA 95 HA ALA 95 6.197 -8.432 11.547 708 HB1 ALA 95 HB1 ALA 95 5.652 -6.839 13.329 709 HB2 ALA 95 HB2 ALA 95 4.079 -6.524 12.591 710 HB3 ALA 95 HB3 ALA 95 5.558 -6.062 11.750 711 H ASP 96 H ASP 96 6.304 -9.635 13.450 712 HA ASP 96 HA ASP 96 4.276 -11.616 13.868 713 HB2 ASP 96 HB2 ASP 96 6.782 -11.015 15.506 714 HB3 ASP 96 HB3 ASP 96 5.796 -12.476 15.636 715 H GLU 97 H GLU 97 5.695 -9.976 16.693 716 HA GLU 97 HA GLU 97 3.029 -8.942 17.495 717 HB2 GLU 97 HB2 GLU 97 3.502 -9.627 19.828 718 HB3 GLU 97 HB3 GLU 97 3.466 -11.003 18.738 719 HG2 GLU 97 HG2 GLU 97 5.919 -11.115 18.744 720 HG3 GLU 97 HG3 GLU 97 6.003 -9.680 19.755 721 H HIS 98 H HIS 98 6.567 -8.581 17.909 722 HA HIS 98 HA HIS 98 6.319 -6.113 19.438 723 HB2 HIS 98 HB2 HIS 98 8.856 -7.389 18.311 724 HB3 HIS 98 HB3 HIS 98 8.778 -6.156 19.565 725 HD1 HIS 98 HD1 HIS 98 7.171 -7.173 21.733 726 HD2 HIS 98 HD2 HIS 98 9.398 -9.792 19.399 727 HE1 HIS 98 HE1 HIS 98 7.481 -9.226 23.136 728 HE2 HIS 98 HE2 HIS 98 8.702 -10.846 21.658 729 H GLY 99 H GLY 99 5.906 -6.599 16.204 730 HA2 GLY 99 HA2 GLY 99 6.034 -5.059 14.419 731 HA3 GLY 99 HA3 GLY 99 7.169 -4.082 15.336 732 H ALA 100 H ALA 100 8.014 -7.337 15.470 733 HA ALA 100 HA ALA 100 10.418 -7.035 13.943 734 HB1 ALA 100 HB1 ALA 100 9.200 -9.515 15.218 735 HB2 ALA 100 HB2 ALA 100 10.345 -8.406 15.981 736 HB3 ALA 100 HB3 ALA 100 10.849 -9.378 14.598 737 HA PRO 101 HA PRO 101 8.679 -8.140 9.946 738 HB2 PRO 101 HB2 PRO 101 10.973 -8.800 8.562 739 HB3 PRO 101 HB3 PRO 101 10.511 -7.141 8.962 740 HG2 PRO 101 HG2 PRO 101 12.434 -8.969 10.399 741 HG3 PRO 101 HG3 PRO 101 12.638 -7.258 9.961 742 HD2 PRO 101 HD2 PRO 101 11.936 -8.001 12.467 743 HD3 PRO 101 HD3 PRO 101 11.302 -6.510 11.732 744 H VAL 102 H VAL 102 7.482 -9.924 9.690 745 HA VAL 102 HA VAL 102 8.101 -12.596 10.273 746 HB VAL 102 HB VAL 102 6.078 -11.503 8.262 747 HG11 VAL 102 HG11 VAL 102 4.897 -13.678 8.481 748 HG12 VAL 102 HG12 VAL 102 6.222 -14.297 9.473 749 HG13 VAL 102 HG13 VAL 102 6.505 -13.882 7.779 750 HG21 VAL 102 HG21 VAL 102 4.422 -11.795 10.060 751 HG22 VAL 102 HG22 VAL 102 5.714 -10.707 10.570 752 HG23 VAL 102 HG23 VAL 102 5.688 -12.374 11.150 753 H ASP 103 H ASP 103 9.755 -13.671 9.415 754 HA ASP 103 HA ASP 103 11.020 -13.188 6.909 755 HB2 ASP 103 HB2 ASP 103 12.173 -14.134 8.897 756 HB3 ASP 103 HB3 ASP 103 11.189 -15.586 8.784 757 H GLU 104 H GLU 104 8.551 -15.402 7.989 758 HA GLU 104 HA GLU 104 8.321 -17.239 5.916 759 HB2 GLU 104 HB2 GLU 104 7.153 -17.305 8.138 760 HB3 GLU 104 HB3 GLU 104 6.105 -16.006 7.609 761 HG2 GLU 104 HG2 GLU 104 4.842 -17.973 7.421 762 HG3 GLU 104 HG3 GLU 104 5.278 -17.524 5.776 763 H LEU 105 H LEU 105 7.172 -13.873 6.048 764 HA LEU 105 HA LEU 105 5.924 -14.105 3.359 765 HB2 LEU 105 HB2 LEU 105 5.343 -12.203 5.653 766 HB3 LEU 105 HB3 LEU 105 4.685 -11.972 4.036 767 HG LEU 105 HG LEU 105 4.142 -14.368 5.850 768 HD11 LEU 105 HD11 LEU 105 2.287 -12.109 5.035 769 HD12 LEU 105 HD12 LEU 105 3.006 -12.344 6.631 770 HD13 LEU 105 HD13 LEU 105 1.854 -13.521 6.007 771 HD21 LEU 105 HD21 LEU 105 4.139 -15.049 3.504 772 HD22 LEU 105 HD22 LEU 105 3.028 -13.738 3.092 773 HD23 LEU 105 HD23 LEU 105 2.495 -15.058 4.141 774 H GLY 106 H GLY 106 8.660 -12.838 4.887 775 HA2 GLY 106 HA2 GLY 106 10.443 -11.642 4.066 776 HA3 GLY 106 HA3 GLY 106 9.673 -11.682 2.491 777 H VAL 107 H VAL 107 10.550 -9.504 2.219 778 HA VAL 107 HA VAL 107 8.818 -7.367 3.359 779 HB VAL 107 HB VAL 107 11.826 -7.104 2.850 780 HG11 VAL 107 HG11 VAL 107 9.862 -5.064 3.981 781 HG12 VAL 107 HG12 VAL 107 10.651 -4.988 2.402 782 HG13 VAL 107 HG13 VAL 107 11.613 -4.844 3.875 783 HG21 VAL 107 HG21 VAL 107 12.081 -6.862 5.305 784 HG22 VAL 107 HG22 VAL 107 11.424 -8.442 4.872 785 HG23 VAL 107 HG23 VAL 107 10.358 -7.191 5.514 786 H THR 108 H THR 108 7.799 -6.244 1.732 787 HA THR 108 HA THR 108 8.992 -6.252 -0.999 788 HB THR 108 HB THR 108 6.870 -7.425 -1.065 789 HG1 THR 108 HG1 THR 108 5.857 -6.109 -2.657 790 HG21 THR 108 HG21 THR 108 5.560 -4.922 0.079 791 HG22 THR 108 HG22 THR 108 5.726 -6.474 0.904 792 HG23 THR 108 HG23 THR 108 4.709 -6.346 -0.531 793 H HIS 109 H HIS 109 8.933 -4.366 -2.230 794 HA HIS 109 HA HIS 109 8.799 -1.847 -0.691 795 HB2 HIS 109 HB2 HIS 109 11.031 -2.607 -1.660 796 HB3 HIS 109 HB3 HIS 109 10.344 -2.392 -3.262 797 HD1 HIS 109 HD1 HIS 109 11.438 -0.470 -0.251 798 HD2 HIS 109 HD2 HIS 109 10.251 0.287 -4.131 799 HE1 HIS 109 HE1 HIS 109 11.858 1.947 -0.624 800 HE2 HIS 109 HE2 HIS 109 11.384 2.313 -3.043 801 H ALA 110 H ALA 110 6.893 -0.861 -1.076 802 HA ALA 110 HA ALA 110 5.541 -1.110 -3.692 803 HB1 ALA 110 HB1 ALA 110 4.468 -0.088 -1.045 804 HB2 ALA 110 HB2 ALA 110 4.235 -1.707 -1.700 805 HB3 ALA 110 HB3 ALA 110 3.531 -0.315 -2.525 806 H THR 111 H THR 111 5.434 0.574 -5.094 807 HA THR 111 HA THR 111 6.495 3.233 -4.273 808 HB THR 111 HB THR 111 6.501 2.104 -7.130 809 HG1 THR 111 HG1 THR 111 7.876 0.818 -5.861 810 HG21 THR 111 HG21 THR 111 7.999 4.439 -5.879 811 HG22 THR 111 HG22 THR 111 6.653 4.550 -7.014 812 HG23 THR 111 HG23 THR 111 8.188 3.862 -7.536 813 H VAL 112 H VAL 112 4.781 4.586 -3.998 814 HA VAL 112 HA VAL 112 2.316 4.304 -5.589 815 HB VAL 112 HB VAL 112 2.930 6.131 -3.219 816 HG11 VAL 112 HG11 VAL 112 1.153 7.078 -4.654 817 HG12 VAL 112 HG12 VAL 112 0.486 6.525 -3.118 818 HG13 VAL 112 HG13 VAL 112 0.263 5.553 -4.573 819 HG21 VAL 112 HG21 VAL 112 2.959 3.745 -2.576 820 HG22 VAL 112 HG22 VAL 112 1.361 3.523 -3.295 821 HG23 VAL 112 HG23 VAL 112 1.556 4.569 -1.886 822 H LYS 113 H LYS 113 2.156 5.455 -7.428 823 HA LYS 113 HA LYS 113 3.593 8.043 -7.714 824 HB2 LYS 113 HB2 LYS 113 3.249 5.809 -9.770 825 HB3 LYS 113 HB3 LYS 113 3.996 7.373 -10.100 826 HG2 LYS 113 HG2 LYS 113 5.855 6.902 -8.651 827 HG3 LYS 113 HG3 LYS 113 5.050 5.498 -7.959 828 HD2 LYS 113 HD2 LYS 113 6.841 4.833 -9.507 829 HD3 LYS 113 HD3 LYS 113 5.262 4.291 -10.070 830 HE2 LYS 113 HE2 LYS 113 5.176 6.121 -11.669 831 HE3 LYS 113 HE3 LYS 113 6.710 6.751 -11.078 832 HZ1 LYS 113 HZ1 LYS 113 6.314 4.116 -12.370 833 HZ2 LYS 113 HZ2 LYS 113 7.790 4.753 -11.844 834 HZ3 LYS 113 HZ3 LYS 113 6.957 5.490 -13.115 835 H LEU 114 H LEU 114 2.112 9.602 -7.764 836 HA LEU 114 HA LEU 114 -0.575 9.209 -8.893 837 HB2 LEU 114 HB2 LEU 114 0.609 11.581 -7.384 838 HB3 LEU 114 HB3 LEU 114 -1.078 11.407 -7.853 839 HG LEU 114 HG LEU 114 0.377 9.595 -5.876 840 HD11 LEU 114 HD11 LEU 114 -1.673 11.774 -5.336 841 HD12 LEU 114 HD12 LEU 114 0.047 11.842 -4.947 842 HD13 LEU 114 HD13 LEU 114 -0.987 10.668 -4.139 843 HD21 LEU 114 HD21 LEU 114 -2.556 9.680 -6.647 844 HD22 LEU 114 HD22 LEU 114 -1.848 8.686 -5.369 845 HD23 LEU 114 HD23 LEU 114 -1.401 8.406 -7.048 846 H GLU 115 H GLU 115 -1.442 10.493 -10.558 847 HA GLU 115 HA GLU 115 0.407 12.234 -12.095 848 HB2 GLU 115 HB2 GLU 115 0.141 10.100 -13.268 849 HB3 GLU 115 HB3 GLU 115 -1.610 10.233 -13.184 850 HG2 GLU 115 HG2 GLU 115 -0.859 10.793 -15.427 851 HG3 GLU 115 HG3 GLU 115 -1.531 12.228 -14.641 852 HA PRO 116 HA PRO 116 -3.063 15.132 -11.357 853 HB2 PRO 116 HB2 PRO 116 -1.906 17.303 -12.623 854 HB3 PRO 116 HB3 PRO 116 -1.541 16.821 -10.962 855 HG2 PRO 116 HG2 PRO 116 -0.004 16.242 -13.490 856 HG3 PRO 116 HG3 PRO 116 0.610 16.735 -11.897 857 HD2 PRO 116 HD2 PRO 116 0.692 14.151 -12.727 858 HD3 PRO 116 HD3 PRO 116 0.433 14.570 -11.024 859 H LEU 117 H LEU 117 -4.617 14.150 -12.647 860 HA LEU 117 HA LEU 117 -4.735 14.747 -15.541 861 HB2 LEU 117 HB2 LEU 117 -6.749 13.218 -13.850 862 HB3 LEU 117 HB3 LEU 117 -6.658 13.256 -15.604 863 HG LEU 117 HG LEU 117 -4.657 11.917 -13.731 864 HD11 LEU 117 HD11 LEU 117 -6.716 10.710 -15.610 865 HD12 LEU 117 HD12 LEU 117 -6.771 10.709 -13.844 866 HD13 LEU 117 HD13 LEU 117 -5.510 9.812 -14.683 867 HD21 LEU 117 HD21 LEU 117 -4.690 11.971 -16.770 868 HD22 LEU 117 HD22 LEU 117 -3.603 11.013 -15.760 869 HD23 LEU 117 HD23 LEU 117 -3.514 12.769 -15.721 870 H GLU 118 H GLU 118 -4.819 16.980 -13.878 871 HA GLU 118 HA GLU 118 -5.803 18.962 -13.584 872 HB2 GLU 118 HB2 GLU 118 -6.432 18.574 -16.011 873 HB3 GLU 118 HB3 GLU 118 -7.999 18.013 -15.456 874 HG2 GLU 118 HG2 GLU 118 -8.396 20.229 -14.407 875 HG3 GLU 118 HG3 GLU 118 -6.852 20.790 -15.056 876 H ASN 119 H ASN 119 -9.003 17.394 -13.982 877 HA ASN 119 HA ASN 119 -9.828 18.287 -11.315 878 HB2 ASN 119 HB2 ASN 119 -11.350 16.923 -13.576 879 HB3 ASN 119 HB3 ASN 119 -12.084 17.369 -12.042 880 HD21 ASN 119 HD21 ASN 119 -9.734 19.398 -13.758 881 HD22 ASN 119 HD22 ASN 119 -10.855 20.625 -14.174 882 H ARG 120 H ARG 120 -8.675 15.427 -12.832 883 HA ARG 120 HA ARG 120 -9.333 13.778 -10.446 884 HB2 ARG 120 HB2 ARG 120 -9.074 11.799 -12.242 885 HB3 ARG 120 HB3 ARG 120 -10.616 12.610 -11.977 886 HG2 ARG 120 HG2 ARG 120 -10.230 14.015 -13.957 887 HG3 ARG 120 HG3 ARG 120 -8.664 13.247 -14.208 888 HD2 ARG 120 HD2 ARG 120 -9.689 11.130 -14.719 889 HD3 ARG 120 HD3 ARG 120 -11.278 11.707 -14.198 890 HE ARG 120 HE ARG 120 -10.749 13.421 -16.158 891 HH11 ARG 120 HH11 ARG 120 -10.404 9.978 -16.158 892 HH12 ARG 120 HH12 ARG 120 -10.797 9.837 -17.833 893 HH21 ARG 120 HH21 ARG 120 -11.259 13.228 -18.278 894 HH22 ARG 120 HH22 ARG 120 -11.257 11.677 -19.034 895 H THR 121 H THR 121 -7.806 11.758 -10.422 896 HA THR 121 HA THR 121 -5.062 12.305 -11.304 897 HB THR 121 HB THR 121 -5.790 12.019 -8.345 898 HG1 THR 121 HG1 THR 121 -5.932 14.143 -9.118 899 HG21 THR 121 HG21 THR 121 -3.760 10.690 -8.761 900 HG22 THR 121 HG22 THR 121 -3.340 12.166 -7.888 901 HG23 THR 121 HG23 THR 121 -3.022 12.045 -9.622 902 H ARG 122 H ARG 122 -3.953 10.438 -11.738 903 HA ARG 122 HA ARG 122 -5.285 7.852 -11.195 904 HB2 ARG 122 HB2 ARG 122 -4.944 8.507 -13.593 905 HB3 ARG 122 HB3 ARG 122 -3.206 8.561 -13.310 906 HG2 ARG 122 HG2 ARG 122 -3.216 6.153 -12.796 907 HG3 ARG 122 HG3 ARG 122 -4.961 6.094 -13.054 908 HD2 ARG 122 HD2 ARG 122 -2.890 6.847 -15.152 909 HD3 ARG 122 HD3 ARG 122 -3.684 5.278 -15.015 910 HE ARG 122 HE ARG 122 -5.752 7.057 -15.216 911 HH11 ARG 122 HH11 ARG 122 -3.003 6.415 -17.231 912 HH12 ARG 122 HH12 ARG 122 -3.854 6.815 -18.677 913 HH21 ARG 122 HH21 ARG 122 -6.793 7.565 -17.061 914 HH22 ARG 122 HH22 ARG 122 -5.988 7.454 -18.584 915 H MET 123 H MET 123 -4.249 6.393 -9.906 916 HA MET 123 HA MET 123 -1.493 6.944 -8.970 917 HB2 MET 123 HB2 MET 123 -3.254 6.959 -7.223 918 HB3 MET 123 HB3 MET 123 -3.709 5.316 -7.657 919 HG2 MET 123 HG2 MET 123 -1.538 4.483 -6.898 920 HG3 MET 123 HG3 MET 123 -0.995 6.130 -6.575 921 HE1 MET 123 HE1 MET 123 -4.629 4.743 -5.819 922 HE2 MET 123 HE2 MET 123 -4.373 4.068 -4.212 923 HE3 MET 123 HE3 MET 123 -3.571 3.348 -5.603 924 H THR 124 H THR 124 0.078 5.338 -9.100 925 HA THR 124 HA THR 124 -0.703 2.582 -9.858 926 HB THR 124 HB THR 124 1.704 4.061 -11.033 927 HG1 THR 124 HG1 THR 124 -0.365 4.617 -11.975 928 HG21 THR 124 HG21 THR 124 2.041 2.029 -12.404 929 HG22 THR 124 HG22 THR 124 0.702 1.235 -11.573 930 HG23 THR 124 HG23 THR 124 2.173 1.648 -10.685 931 H ILE 125 H ILE 125 -0.124 1.318 -8.149 932 HA ILE 125 HA ILE 125 2.235 2.034 -6.498 933 HB ILE 125 HB ILE 125 0.055 0.036 -5.748 934 HG12 ILE 125 HG12 ILE 125 0.186 2.966 -4.886 935 HG13 ILE 125 HG13 ILE 125 -0.932 2.342 -6.096 936 HG21 ILE 125 HG21 ILE 125 2.179 -0.209 -4.514 937 HG22 ILE 125 HG22 ILE 125 0.914 0.386 -3.440 938 HG23 ILE 125 HG23 ILE 125 2.135 1.501 -4.063 939 HD11 ILE 125 HD11 ILE 125 -0.844 1.531 -3.189 940 HD12 ILE 125 HD12 ILE 125 -1.975 0.921 -4.399 941 HD13 ILE 125 HD13 ILE 125 -2.008 2.620 -3.939 942 H ILE 126 H ILE 126 4.059 0.899 -7.059 943 HA ILE 126 HA ILE 126 3.795 -1.773 -8.292 944 HB ILE 126 HB ILE 126 6.338 -0.055 -8.197 945 HG12 ILE 126 HG12 ILE 126 5.844 0.293 -10.731 946 HG13 ILE 126 HG13 ILE 126 4.196 -0.186 -10.367 947 HG21 ILE 126 HG21 ILE 126 7.146 -1.571 -9.982 948 HG22 ILE 126 HG22 ILE 126 5.649 -2.500 -9.879 949 HG23 ILE 126 HG23 ILE 126 6.759 -2.461 -8.505 950 HD11 ILE 126 HD11 ILE 126 3.976 1.735 -8.882 951 HD12 ILE 126 HD12 ILE 126 4.443 2.211 -10.515 952 HD13 ILE 126 HD13 ILE 126 5.647 2.195 -9.227 953 H SER 127 H SER 127 3.861 -3.343 -6.826 954 HA SER 127 HA SER 127 5.441 -3.211 -4.361 955 HB2 SER 127 HB2 SER 127 3.062 -3.914 -4.240 956 HB3 SER 127 HB3 SER 127 3.385 -5.253 -5.337 957 HG SER 127 HG SER 127 3.354 -5.672 -2.980 958 H THR 128 H THR 128 7.555 -3.796 -4.677 959 HA THR 128 HA THR 128 8.257 -5.930 -6.607 960 HB THR 128 HB THR 128 10.554 -4.964 -6.587 961 HG1 THR 128 HG1 THR 128 10.539 -4.016 -4.505 962 HG21 THR 128 HG21 THR 128 8.949 -4.151 -8.289 963 HG22 THR 128 HG22 THR 128 10.059 -2.870 -7.801 964 HG23 THR 128 HG23 THR 128 8.407 -2.885 -7.178 965 H PHE 129 H PHE 129 9.329 -7.735 -5.945 966 HA PHE 129 HA PHE 129 9.523 -8.211 -3.033 967 HB2 PHE 129 HB2 PHE 129 9.163 -10.269 -5.265 968 HB3 PHE 129 HB3 PHE 129 8.996 -10.547 -3.527 969 HD1 PHE 129 HD1 PHE 129 7.170 -9.103 -2.303 970 HD2 PHE 129 HD2 PHE 129 7.206 -9.758 -6.524 971 HE1 PHE 129 HE1 PHE 129 4.803 -8.473 -2.428 972 HE2 PHE 129 HE2 PHE 129 4.827 -9.137 -6.631 973 HZ PHE 129 HZ PHE 129 3.632 -8.473 -4.591 974 H GLU 130 H GLU 130 11.343 -9.305 -2.166 975 HA GLU 130 HA GLU 130 13.842 -8.713 -3.433 976 HB2 GLU 130 HB2 GLU 130 14.873 -9.668 -1.417 977 HB3 GLU 130 HB3 GLU 130 13.541 -8.599 -0.991 978 HG2 GLU 130 HG2 GLU 130 12.087 -10.651 -0.718 979 HG3 GLU 130 HG3 GLU 130 13.524 -11.638 -0.951 980 H SER 131 H SER 131 11.899 -11.628 -3.176 981 HA SER 131 HA SER 131 13.577 -13.086 -5.067 982 HB2 SER 131 HB2 SER 131 13.024 -14.190 -2.274 983 HB3 SER 131 HB3 SER 131 13.704 -15.133 -3.602 984 HG SER 131 HG SER 131 14.836 -12.906 -2.267 985 H GLU 132 H GLU 132 12.538 -15.207 -5.656 986 HA GLU 132 HA GLU 132 9.904 -14.690 -6.557 987 HB2 GLU 132 HB2 GLU 132 11.592 -15.980 -7.829 988 HB3 GLU 132 HB3 GLU 132 11.460 -17.298 -6.667 989 HG2 GLU 132 HG2 GLU 132 9.092 -17.618 -7.306 990 HG3 GLU 132 HG3 GLU 132 9.224 -16.282 -8.451 991 H GLU 133 H GLU 133 11.091 -16.867 -3.974 992 HA GLU 133 HA GLU 133 8.665 -18.196 -3.431 993 HB2 GLU 133 HB2 GLU 133 9.734 -18.563 -1.071 994 HB3 GLU 133 HB3 GLU 133 10.497 -19.266 -2.483 995 HG2 GLU 133 HG2 GLU 133 12.254 -18.420 -1.126 996 HG3 GLU 133 HG3 GLU 133 12.116 -17.330 -2.498 997 H GLN 134 H GLN 134 9.708 -15.009 -2.386 998 HA GLN 134 HA GLN 134 7.581 -14.507 -0.513 999 HB2 GLN 134 HB2 GLN 134 9.779 -13.235 -0.634 1000 HB3 GLN 134 HB3 GLN 134 9.203 -12.478 -2.120 1001 HG2 GLN 134 HG2 GLN 134 7.157 -11.745 -0.641 1002 HG3 GLN 134 HG3 GLN 134 8.227 -12.106 0.712 1003 HE21 GLN 134 HE21 GLN 134 7.094 -9.616 0.017 1004 HE22 GLN 134 HE22 GLN 134 8.396 -8.535 -0.302 1005 H MET 135 H MET 135 8.161 -13.675 -3.918 1006 HA MET 135 HA MET 135 5.765 -12.411 -4.603 1007 HB2 MET 135 HB2 MET 135 7.295 -12.211 -6.317 1008 HB3 MET 135 HB3 MET 135 7.977 -13.805 -6.051 1009 HG2 MET 135 HG2 MET 135 7.002 -13.648 -8.261 1010 HG3 MET 135 HG3 MET 135 6.129 -14.825 -7.288 1011 HE1 MET 135 HE1 MET 135 5.967 -11.525 -9.314 1012 HE2 MET 135 HE2 MET 135 5.844 -10.800 -7.710 1013 HE3 MET 135 HE3 MET 135 4.447 -10.794 -8.789 1014 H GLN 136 H GLN 136 6.467 -15.881 -4.315 1015 HA GLN 136 HA GLN 136 3.949 -16.863 -5.234 1016 HB2 GLN 136 HB2 GLN 136 5.870 -18.159 -3.250 1017 HB3 GLN 136 HB3 GLN 136 4.553 -18.975 -4.093 1018 HG2 GLN 136 HG2 GLN 136 7.077 -17.833 -5.322 1019 HG3 GLN 136 HG3 GLN 136 6.675 -19.534 -5.114 1020 HE21 GLN 136 HE21 GLN 136 6.132 -16.672 -7.000 1021 HE22 GLN 136 HE22 GLN 136 5.256 -17.426 -8.284 1022 H LYS 137 H LYS 137 5.225 -16.118 -1.959 1023 HA LYS 137 HA LYS 137 3.112 -17.014 -0.381 1024 HB2 LYS 137 HB2 LYS 137 5.310 -15.006 0.031 1025 HB3 LYS 137 HB3 LYS 137 4.001 -14.989 1.202 1026 HG2 LYS 137 HG2 LYS 137 5.828 -17.314 0.573 1027 HG3 LYS 137 HG3 LYS 137 5.795 -16.337 2.043 1028 HD2 LYS 137 HD2 LYS 137 3.302 -17.177 2.233 1029 HD3 LYS 137 HD3 LYS 137 3.817 -18.428 1.093 1030 HE2 LYS 137 HE2 LYS 137 4.842 -17.907 3.898 1031 HE3 LYS 137 HE3 LYS 137 4.037 -19.352 3.286 1032 HZ1 LYS 137 HZ1 LYS 137 6.367 -19.783 3.513 1033 HZ2 LYS 137 HZ2 LYS 137 6.775 -18.412 2.617 1034 HZ3 LYS 137 HZ3 LYS 137 6.018 -19.718 1.861 1035 H MET 138 H MET 138 3.451 -13.841 -1.932 1036 HA MET 138 HA MET 138 1.239 -12.556 -0.694 1037 HB2 MET 138 HB2 MET 138 2.441 -12.046 -3.440 1038 HB3 MET 138 HB3 MET 138 1.364 -10.947 -2.577 1039 HG2 MET 138 HG2 MET 138 4.106 -11.793 -1.603 1040 HG3 MET 138 HG3 MET 138 3.747 -10.301 -2.451 1041 HE1 MET 138 HE1 MET 138 3.087 -11.138 1.987 1042 HE2 MET 138 HE2 MET 138 4.356 -11.771 0.940 1043 HE3 MET 138 HE3 MET 138 2.703 -12.379 0.789 1044 H ALA 139 H ALA 139 1.472 -14.597 -3.547 1045 HA ALA 139 HA ALA 139 -1.280 -14.314 -4.329 1046 HB1 ALA 139 HB1 ALA 139 0.493 -14.750 -5.976 1047 HB2 ALA 139 HB2 ALA 139 -0.730 -16.027 -6.018 1048 HB3 ALA 139 HB3 ALA 139 0.821 -16.314 -5.222 1049 H GLU 140 H GLU 140 0.573 -16.658 -2.409 1050 HA GLU 140 HA GLU 140 -1.444 -18.677 -2.174 1051 HB2 GLU 140 HB2 GLU 140 0.917 -18.145 -0.310 1052 HB3 GLU 140 HB3 GLU 140 -0.038 -19.628 -0.367 1053 HG2 GLU 140 HG2 GLU 140 1.821 -18.567 -2.515 1054 HG3 GLU 140 HG3 GLU 140 2.093 -19.961 -1.479 1055 H MET 141 H MET 141 -0.506 -15.972 -0.098 1056 HA MET 141 HA MET 141 -2.477 -16.489 1.973 1057 HB2 MET 141 HB2 MET 141 -0.589 -14.151 1.467 1058 HB3 MET 141 HB3 MET 141 -1.606 -14.297 2.897 1059 HG2 MET 141 HG2 MET 141 0.423 -16.415 2.165 1060 HG3 MET 141 HG3 MET 141 0.848 -14.997 3.120 1061 HE1 MET 141 HE1 MET 141 0.042 -14.570 5.619 1062 HE2 MET 141 HE2 MET 141 -1.245 -15.502 6.389 1063 HE3 MET 141 HE3 MET 141 -1.610 -14.476 5.002 1064 H GLY 142 H GLY 142 -2.766 -15.134 -1.105 1065 HA2 GLY 142 HA2 GLY 142 -4.463 -13.982 -2.152 1066 HA3 GLY 142 HA3 GLY 142 -5.388 -14.075 -0.665 1067 H MET 143 H MET 143 -2.262 -12.641 -0.494 1068 HA MET 143 HA MET 143 -3.182 -10.092 0.384 1069 HB2 MET 143 HB2 MET 143 -1.074 -11.217 1.129 1070 HB3 MET 143 HB3 MET 143 -0.395 -10.991 -0.474 1071 HG2 MET 143 HG2 MET 143 -1.231 -8.665 1.267 1072 HG3 MET 143 HG3 MET 143 0.373 -9.394 1.354 1073 HE1 MET 143 HE1 MET 143 1.284 -6.121 -0.527 1074 HE2 MET 143 HE2 MET 143 1.657 -7.194 0.824 1075 HE3 MET 143 HE3 MET 143 0.141 -6.289 0.806 1076 H GLU 144 H GLU 144 -2.086 -11.366 -2.697 1077 HA GLU 144 HA GLU 144 -1.673 -9.159 -4.303 1078 HB2 GLU 144 HB2 GLU 144 -1.229 -11.300 -5.214 1079 HB3 GLU 144 HB3 GLU 144 -2.825 -11.918 -4.823 1080 HG2 GLU 144 HG2 GLU 144 -3.798 -10.529 -6.628 1081 HG3 GLU 144 HG3 GLU 144 -2.192 -9.918 -7.011 1082 H GLU 145 H GLU 145 -4.841 -10.870 -4.043 1083 HA GLU 145 HA GLU 145 -6.283 -8.722 -5.308 1084 HB2 GLU 145 HB2 GLU 145 -8.313 -10.097 -4.838 1085 HB3 GLU 145 HB3 GLU 145 -7.043 -10.980 -5.676 1086 HG2 GLU 145 HG2 GLU 145 -6.387 -12.082 -3.574 1087 HG3 GLU 145 HG3 GLU 145 -7.634 -11.182 -2.706 1088 H GLY 146 H GLY 146 -5.808 -9.795 -1.956 1089 HA2 GLY 146 HA2 GLY 146 -7.755 -8.309 -0.610 1090 HA3 GLY 146 HA3 GLY 146 -6.216 -8.799 0.079 1091 H MET 147 H MET 147 -4.564 -7.299 -1.717 1092 HA MET 147 HA MET 147 -4.474 -4.714 -0.539 1093 HB2 MET 147 HB2 MET 147 -2.485 -5.887 -1.415 1094 HB3 MET 147 HB3 MET 147 -3.130 -5.801 -3.048 1095 HG2 MET 147 HG2 MET 147 -2.977 -3.339 -2.959 1096 HG3 MET 147 HG3 MET 147 -2.282 -3.456 -1.339 1097 HE1 MET 147 HE1 MET 147 0.705 -2.379 -3.704 1098 HE2 MET 147 HE2 MET 147 -0.318 -1.895 -2.349 1099 HE3 MET 147 HE3 MET 147 -0.992 -1.983 -3.977 1100 H ARG 148 H ARG 148 -5.607 -5.870 -3.716 1101 HA ARG 148 HA ARG 148 -6.242 -3.429 -4.959 1102 HB2 ARG 148 HB2 ARG 148 -6.098 -5.544 -6.197 1103 HB3 ARG 148 HB3 ARG 148 -7.472 -6.193 -5.304 1104 HG2 ARG 148 HG2 ARG 148 -8.873 -4.314 -6.343 1105 HG3 ARG 148 HG3 ARG 148 -7.491 -3.983 -7.391 1106 HD2 ARG 148 HD2 ARG 148 -9.165 -5.416 -8.501 1107 HD3 ARG 148 HD3 ARG 148 -7.624 -6.264 -8.302 1108 HE ARG 148 HE ARG 148 -9.326 -6.773 -6.097 1109 HH11 ARG 148 HH11 ARG 148 -9.027 -7.674 -9.424 1110 HH12 ARG 148 HH12 ARG 148 -9.735 -9.225 -9.164 1111 HH21 ARG 148 HH21 ARG 148 -10.221 -8.709 -5.791 1112 HH22 ARG 148 HH22 ARG 148 -10.423 -9.799 -7.119 1113 H GLU 149 H GLU 149 -8.206 -5.523 -2.838 1114 HA GLU 149 HA GLU 149 -10.718 -4.275 -3.063 1115 HB2 GLU 149 HB2 GLU 149 -9.722 -5.414 -0.421 1116 HB3 GLU 149 HB3 GLU 149 -11.367 -5.404 -1.048 1117 HG2 GLU 149 HG2 GLU 149 -9.048 -7.136 -1.956 1118 HG3 GLU 149 HG3 GLU 149 -10.465 -7.656 -1.058 1119 H ALA 150 H ALA 150 -8.012 -3.623 -0.868 1120 HA ALA 150 HA ALA 150 -9.058 -1.504 0.664 1121 HB1 ALA 150 HB1 ALA 150 -7.020 -2.769 1.270 1122 HB2 ALA 150 HB2 ALA 150 -6.712 -1.030 1.253 1123 HB3 ALA 150 HB3 ALA 150 -6.159 -2.040 -0.090 1124 H ILE 151 H ILE 151 -7.300 -1.485 -2.423 1125 HA ILE 151 HA ILE 151 -6.976 1.351 -2.608 1126 HB ILE 151 HB ILE 151 -6.745 -0.793 -4.766 1127 HG12 ILE 151 HG12 ILE 151 -4.570 0.518 -3.057 1128 HG13 ILE 151 HG13 ILE 151 -5.218 -1.097 -2.789 1129 HG21 ILE 151 HG21 ILE 151 -7.002 1.425 -5.807 1130 HG22 ILE 151 HG22 ILE 151 -5.359 0.828 -6.028 1131 HG23 ILE 151 HG23 ILE 151 -5.690 2.063 -4.811 1132 HD11 ILE 151 HD11 ILE 151 -3.081 -1.207 -3.879 1133 HD12 ILE 151 HD12 ILE 151 -3.651 -0.178 -5.191 1134 HD13 ILE 151 HD13 ILE 151 -4.334 -1.792 -4.974 1135 H GLU 152 H GLU 152 -9.620 -0.771 -3.404 1136 HA GLU 152 HA GLU 152 -11.090 1.292 -4.886 1137 HB2 GLU 152 HB2 GLU 152 -11.923 -1.511 -4.047 1138 HB3 GLU 152 HB3 GLU 152 -12.895 -0.412 -5.035 1139 HG2 GLU 152 HG2 GLU 152 -10.953 -0.344 -6.670 1140 HG3 GLU 152 HG3 GLU 152 -10.223 -1.655 -5.739 1141 H GLN 153 H GLN 153 -10.683 0.364 -1.608 1142 HA GLN 153 HA GLN 153 -13.094 1.646 -0.600 1143 HB2 GLN 153 HB2 GLN 153 -10.556 0.648 0.746 1144 HB3 GLN 153 HB3 GLN 153 -11.853 1.437 1.637 1145 HG2 GLN 153 HG2 GLN 153 -13.388 -0.351 1.154 1146 HG3 GLN 153 HG3 GLN 153 -12.278 -1.070 -0.011 1147 HE21 GLN 153 HE21 GLN 153 -12.769 -0.453 3.434 1148 HE22 GLN 153 HE22 GLN 153 -11.734 -1.716 3.988 1149 H ILE 154 H ILE 154 -10.094 2.760 -1.823 1150 HA ILE 154 HA ILE 154 -9.742 5.198 -0.405 1151 HB ILE 154 HB ILE 154 -9.004 4.508 -3.282 1152 HG12 ILE 154 HG12 ILE 154 -7.318 4.448 -0.739 1153 HG13 ILE 154 HG13 ILE 154 -7.958 3.035 -1.570 1154 HG21 ILE 154 HG21 ILE 154 -9.049 6.954 -3.022 1155 HG22 ILE 154 HG22 ILE 154 -7.385 6.395 -3.170 1156 HG23 ILE 154 HG23 ILE 154 -8.022 6.847 -1.587 1157 HD11 ILE 154 HD11 ILE 154 -6.562 3.551 -3.510 1158 HD12 ILE 154 HD12 ILE 154 -5.615 3.346 -2.037 1159 HD13 ILE 154 HD13 ILE 154 -5.918 4.964 -2.667 1160 H ASP 155 H ASP 155 -11.756 4.332 -3.188 1161 HA ASP 155 HA ASP 155 -12.755 6.833 -3.966 1162 HB2 ASP 155 HB2 ASP 155 -14.249 4.167 -3.922 1163 HB3 ASP 155 HB3 ASP 155 -14.663 5.570 -4.910 1164 H ALA 156 H ALA 156 -13.718 4.669 -1.345 1165 HA ALA 156 HA ALA 156 -15.952 6.182 -0.357 1166 HB1 ALA 156 HB1 ALA 156 -14.267 4.074 1.055 1167 HB2 ALA 156 HB2 ALA 156 -15.699 3.764 0.075 1168 HB3 ALA 156 HB3 ALA 156 -15.848 4.666 1.583 1169 H VAL 157 H VAL 157 -12.488 6.382 0.191 1170 HA VAL 157 HA VAL 157 -12.578 7.996 2.587 1171 HB VAL 157 HB VAL 157 -10.317 7.666 0.555 1172 HG11 VAL 157 HG11 VAL 157 -8.804 8.445 2.380 1173 HG12 VAL 157 HG12 VAL 157 -10.212 8.800 3.383 1174 HG13 VAL 157 HG13 VAL 157 -9.948 9.697 1.887 1175 HG21 VAL 157 HG21 VAL 157 -10.794 6.201 3.175 1176 HG22 VAL 157 HG22 VAL 157 -9.381 6.023 2.136 1177 HG23 VAL 157 HG23 VAL 157 -10.967 5.517 1.556 1178 H LEU 158 H LEU 158 -12.041 8.729 -0.878 1179 HA LEU 158 HA LEU 158 -11.634 11.562 -0.412 1180 HB2 LEU 158 HB2 LEU 158 -11.903 10.118 -3.077 1181 HB3 LEU 158 HB3 LEU 158 -11.210 11.713 -2.807 1182 HG LEU 158 HG LEU 158 -10.026 9.037 -1.954 1183 HD11 LEU 158 HD11 LEU 158 -9.724 9.524 -4.320 1184 HD12 LEU 158 HD12 LEU 158 -8.189 9.593 -3.460 1185 HD13 LEU 158 HD13 LEU 158 -9.000 11.090 -3.933 1186 HD21 LEU 158 HD21 LEU 158 -8.091 10.297 -1.081 1187 HD22 LEU 158 HD22 LEU 158 -9.566 10.642 -0.186 1188 HD23 LEU 158 HD23 LEU 158 -8.953 11.813 -1.355 1189 H SER 159 H SER 159 -14.251 9.522 -1.630 1190 HA SER 159 HA SER 159 -16.032 11.756 -2.250 1191 HB2 SER 159 HB2 SER 159 -16.157 9.591 -3.521 1192 HB3 SER 159 HB3 SER 159 -16.634 8.770 -2.052 1193 HG SER 159 HG SER 159 -18.088 10.782 -3.427 1194 H GLU 160 H GLU 160 -15.951 9.066 0.053 1195 HA GLU 160 HA GLU 160 -17.200 8.443 1.797 1196 HB2 GLU 160 HB2 GLU 160 -15.466 10.165 2.651 1197 HB3 GLU 160 HB3 GLU 160 -16.841 11.232 2.889 1198 HG2 GLU 160 HG2 GLU 160 -17.876 9.572 4.378 1199 HG3 GLU 160 HG3 GLU 160 -16.518 8.485 4.122 1200 HA PRO 161 HA PRO 161 -21.127 10.300 0.233 1201 HB2 PRO 161 HB2 PRO 161 -22.494 7.955 -0.188 1202 HB3 PRO 161 HB3 PRO 161 -21.337 8.621 -1.351 1203 HG2 PRO 161 HG2 PRO 161 -20.935 6.435 0.690 1204 HG3 PRO 161 HG3 PRO 161 -20.366 6.511 -0.992 1205 HD2 PRO 161 HD2 PRO 161 -18.761 7.087 1.167 1206 HD3 PRO 161 HD3 PRO 161 -18.518 7.814 -0.436 1207 H ALA 162 H ALA 162 -22.377 7.389 1.783 1208 HA ALA 162 HA ALA 162 -22.742 8.529 4.411 1209 HB1 ALA 162 HB1 ALA 162 -24.522 9.717 3.151 1210 HB2 ALA 162 HB2 ALA 162 -25.199 8.638 4.373 1211 HB3 ALA 162 HB3 ALA 162 -25.204 8.161 2.672 1212 H ASN 163 H ASN 163 -21.789 6.046 2.950 1213 HA ASN 163 HA ASN 163 -22.898 4.059 4.720 1214 HB2 ASN 163 HB2 ASN 163 -23.695 2.549 2.923 1215 HB3 ASN 163 HB3 ASN 163 -24.643 4.015 3.039 1216 HD21 ASN 163 HD21 ASN 163 -24.340 2.152 0.791 1217 HD22 ASN 163 HD22 ASN 163 -23.800 3.107 -0.541 1218 H ALA 164 H ALA 164 -20.997 4.405 1.680 1219 HA ALA 164 HA ALA 164 -18.913 3.820 1.057 1220 HB1 ALA 164 HB1 ALA 164 -17.167 3.234 2.652 1221 HB2 ALA 164 HB2 ALA 164 -18.373 2.963 3.913 1222 HB3 ALA 164 HB3 ALA 164 -18.126 4.585 3.265 1223 H LEU 165 H LEU 165 -20.647 1.336 2.922 1224 HA LEU 165 HA LEU 165 -19.306 -0.919 1.722 1225 HB2 LEU 165 HB2 LEU 165 -21.909 -0.818 3.307 1226 HB3 LEU 165 HB3 LEU 165 -20.980 -2.266 2.938 1227 HG LEU 165 HG LEU 165 -20.076 0.019 4.739 1228 HD11 LEU 165 HD11 LEU 165 -20.898 -2.810 5.467 1229 HD12 LEU 165 HD12 LEU 165 -21.827 -1.339 5.770 1230 HD13 LEU 165 HD13 LEU 165 -20.282 -1.582 6.580 1231 HD21 LEU 165 HD21 LEU 165 -18.147 -0.957 3.587 1232 HD22 LEU 165 HD22 LEU 165 -18.631 -2.578 4.091 1233 HD23 LEU 165 HD23 LEU 165 -18.128 -1.389 5.296 1234 H GLU 166 H GLU 166 -20.961 -2.711 0.849 1235 HA GLU 166 HA GLU 166 -21.918 -3.508 -1.032 1236 HB2 GLU 166 HB2 GLU 166 -23.517 -0.905 -0.994 1237 HB3 GLU 166 HB3 GLU 166 -23.863 -2.273 -2.048 1238 HG2 GLU 166 HG2 GLU 166 -23.970 -2.316 0.984 1239 HG3 GLU 166 HG3 GLU 166 -25.365 -2.157 -0.077 1240 H HIS 167 H HIS 167 -22.543 -2.618 -3.505 1241 HA HIS 167 HA HIS 167 -21.738 -1.988 -5.532 1242 HB2 HIS 167 HB2 HIS 167 -20.245 0.210 -4.039 1243 HB3 HIS 167 HB3 HIS 167 -20.656 0.207 -5.751 1244 HD1 HIS 167 HD1 HIS 167 -22.060 0.874 -2.366 1245 HD2 HIS 167 HD2 HIS 167 -23.397 0.808 -6.306 1246 HE1 HIS 167 HE1 HIS 167 -24.320 1.955 -2.324 1247 HE2 HIS 167 HE2 HIS 167 -25.075 1.981 -4.726 1248 H HIS 168 H HIS 168 -20.117 -3.803 -3.705 1249 HA HIS 168 HA HIS 168 -17.343 -3.516 -4.222 1250 HB2 HIS 168 HB2 HIS 168 -18.201 -4.900 -2.366 1251 HB3 HIS 168 HB3 HIS 168 -18.955 -6.015 -3.503 1252 HD1 HIS 168 HD1 HIS 168 -17.399 -7.700 -4.720 1253 HD2 HIS 168 HD2 HIS 168 -15.413 -5.208 -2.045 1254 HE1 HIS 168 HE1 HIS 168 -15.101 -8.669 -4.480 1255 HE2 HIS 168 HE2 HIS 168 -14.007 -7.272 -2.705 1256 H HIS 169 H HIS 169 -16.092 -4.197 -5.899 1257 HA HIS 169 HA HIS 169 -17.077 -4.469 -8.458 1258 HB2 HIS 169 HB2 HIS 169 -14.705 -5.191 -9.065 1259 HB3 HIS 169 HB3 HIS 169 -14.862 -3.678 -8.189 1260 HD1 HIS 169 HD1 HIS 169 -14.231 -3.778 -5.582 1261 HD2 HIS 169 HD2 HIS 169 -12.974 -7.007 -7.876 1262 HE1 HIS 169 HE1 HIS 169 -12.525 -4.961 -4.186 1263 HE2 HIS 169 HE2 HIS 169 -11.882 -6.973 -5.528 1264 H HIS 170 H HIS 170 -18.672 -6.035 -8.633 1265 HA HIS 170 HA HIS 170 -17.800 -8.856 -8.767 1266 HB2 HIS 170 HB2 HIS 170 -20.279 -9.324 -9.148 1267 HB3 HIS 170 HB3 HIS 170 -19.863 -8.682 -7.567 1268 HD1 HIS 170 HD1 HIS 170 -20.725 -6.300 -6.983 1269 HD2 HIS 170 HD2 HIS 170 -21.955 -7.672 -10.708 1270 HE1 HIS 170 HE1 HIS 170 -22.563 -4.758 -7.694 1271 HE2 HIS 170 HE2 HIS 170 -23.412 -5.712 -9.856 1272 H HIS 171 H HIS 171 -16.952 -9.462 -10.620 1273 HA HIS 171 HA HIS 171 -16.386 -9.755 -12.761 1274 HB2 HIS 171 HB2 HIS 171 -19.051 -8.472 -13.498 1275 HB3 HIS 171 HB3 HIS 171 -17.995 -9.337 -14.612 1276 HD1 HIS 171 HD1 HIS 171 -20.857 -9.860 -12.514 1277 HD2 HIS 171 HD2 HIS 171 -17.622 -12.188 -13.682 1278 HE1 HIS 171 HE1 HIS 171 -21.545 -12.232 -12.071 1279 HE2 HIS 171 HE2 HIS 171 -19.632 -13.615 -12.920 1280 H HIS 172 H HIS 172 -15.016 -8.759 -14.162 1281 HA HIS 172 HA HIS 172 -13.598 -7.221 -15.014 1282 HB2 HIS 172 HB2 HIS 172 -15.574 -6.497 -16.288 1283 HB3 HIS 172 HB3 HIS 172 -16.086 -5.458 -14.968 1284 HD1 HIS 172 HD1 HIS 172 -15.028 -3.142 -14.813 1285 HD2 HIS 172 HD2 HIS 172 -13.373 -5.490 -17.822 1286 HE1 HIS 172 HE1 HIS 172 -13.647 -1.576 -16.206 1287 HE2 HIS 172 HE2 HIS 172 -12.748 -2.992 -18.078 Start of MODEL 17 1 H1 THR 1 H1 THR 1 -11.711 2.438 -7.039 2 H2 THR 1 H2 THR 1 -13.183 1.621 -7.183 3 H3 THR 1 H3 THR 1 -13.137 3.307 -7.336 4 HA THR 1 HA THR 1 -13.393 2.153 -9.458 5 HB THR 1 HB THR 1 -10.731 3.627 -9.291 6 HG1 THR 1 HG1 THR 1 -12.241 5.485 -9.704 7 HG21 THR 1 HG21 THR 1 -11.314 4.436 -11.547 8 HG22 THR 1 HG22 THR 1 -12.815 3.508 -11.513 9 HG23 THR 1 HG23 THR 1 -11.259 2.672 -11.529 10 H VAL 2 H VAL 2 -9.842 1.982 -9.000 11 HA VAL 2 HA VAL 2 -8.282 0.560 -9.784 12 HB VAL 2 HB VAL 2 -10.217 -1.670 -9.013 13 HG11 VAL 2 HG11 VAL 2 -8.384 -2.500 -10.446 14 HG12 VAL 2 HG12 VAL 2 -8.175 -3.075 -8.792 15 HG13 VAL 2 HG13 VAL 2 -7.187 -1.739 -9.390 16 HG21 VAL 2 HG21 VAL 2 -8.998 -1.718 -6.846 17 HG22 VAL 2 HG22 VAL 2 -9.806 -0.171 -7.103 18 HG23 VAL 2 HG23 VAL 2 -8.062 -0.305 -7.343 19 H VAL 3 H VAL 3 -7.853 0.648 -11.907 20 HA VAL 3 HA VAL 3 -9.804 -0.438 -13.869 21 HB VAL 3 HB VAL 3 -8.764 1.228 -15.512 22 HG11 VAL 3 HG11 VAL 3 -10.214 2.373 -13.089 23 HG12 VAL 3 HG12 VAL 3 -10.977 1.611 -14.485 24 HG13 VAL 3 HG13 VAL 3 -10.110 3.134 -14.679 25 HG21 VAL 3 HG21 VAL 3 -7.612 2.455 -12.965 26 HG22 VAL 3 HG22 VAL 3 -7.570 3.187 -14.574 27 HG23 VAL 3 HG23 VAL 3 -6.668 1.702 -14.258 28 H SER 4 H SER 4 -6.534 -0.786 -12.758 29 HA SER 4 HA SER 4 -6.099 -2.916 -14.716 30 HB2 SER 4 HB2 SER 4 -5.082 -0.967 -15.841 31 HB3 SER 4 HB3 SER 4 -4.118 -0.616 -14.406 32 HG SER 4 HG SER 4 -2.694 -1.919 -15.248 33 H VAL 5 H VAL 5 -4.752 -4.530 -13.986 34 HA VAL 5 HA VAL 5 -3.183 -4.188 -11.504 35 HB VAL 5 HB VAL 5 -5.004 -6.600 -12.053 36 HG11 VAL 5 HG11 VAL 5 -3.142 -6.085 -9.690 37 HG12 VAL 5 HG12 VAL 5 -2.904 -7.301 -10.947 38 HG13 VAL 5 HG13 VAL 5 -4.265 -7.442 -9.835 39 HG21 VAL 5 HG21 VAL 5 -5.213 -4.486 -9.870 40 HG22 VAL 5 HG22 VAL 5 -6.240 -5.915 -10.019 41 HG23 VAL 5 HG23 VAL 5 -6.298 -4.655 -11.253 42 H ASP 6 H ASP 6 -1.174 -4.345 -12.365 43 HA ASP 6 HA ASP 6 -0.442 -6.392 -14.335 44 HB2 ASP 6 HB2 ASP 6 1.223 -4.180 -13.038 45 HB3 ASP 6 HB3 ASP 6 1.757 -5.219 -14.363 46 H LYS 7 H LYS 7 0.689 -8.246 -13.830 47 HA LYS 7 HA LYS 7 2.063 -8.463 -11.213 48 HB2 LYS 7 HB2 LYS 7 -0.176 -9.548 -11.043 49 HB3 LYS 7 HB3 LYS 7 0.240 -10.603 -12.390 50 HG2 LYS 7 HG2 LYS 7 2.080 -11.586 -11.032 51 HG3 LYS 7 HG3 LYS 7 1.622 -10.540 -9.678 52 HD2 LYS 7 HD2 LYS 7 -0.606 -11.614 -9.601 53 HD3 LYS 7 HD3 LYS 7 -0.166 -12.636 -10.974 54 HE2 LYS 7 HE2 LYS 7 1.644 -13.648 -9.601 55 HE3 LYS 7 HE3 LYS 7 1.123 -12.667 -8.225 56 HZ1 LYS 7 HZ1 LYS 7 -1.013 -13.751 -8.302 57 HZ2 LYS 7 HZ2 LYS 7 0.215 -14.907 -8.161 58 HZ3 LYS 7 HZ3 LYS 7 -0.548 -14.660 -9.649 59 H ASP 8 H ASP 8 4.146 -8.555 -11.876 60 HA ASP 8 HA ASP 8 4.993 -10.562 -13.877 61 HB2 ASP 8 HB2 ASP 8 6.512 -8.163 -12.764 62 HB3 ASP 8 HB3 ASP 8 7.157 -9.314 -13.929 63 H VAL 9 H VAL 9 5.027 -12.393 -12.610 64 HA VAL 9 HA VAL 9 6.381 -12.685 -10.105 65 HB VAL 9 HB VAL 9 5.637 -14.778 -12.205 66 HG11 VAL 9 HG11 VAL 9 6.451 -15.217 -9.301 67 HG12 VAL 9 HG12 VAL 9 7.378 -15.693 -10.723 68 HG13 VAL 9 HG13 VAL 9 5.830 -16.465 -10.385 69 HG21 VAL 9 HG21 VAL 9 3.683 -13.555 -11.328 70 HG22 VAL 9 HG22 VAL 9 4.174 -13.925 -9.673 71 HG23 VAL 9 HG23 VAL 9 3.675 -15.226 -10.758 72 H GLU 10 H GLU 10 7.404 -12.707 -13.439 73 HA GLU 10 HA GLU 10 10.025 -13.836 -13.175 74 HB2 GLU 10 HB2 GLU 10 8.924 -11.865 -15.233 75 HB3 GLU 10 HB3 GLU 10 10.419 -12.785 -15.406 76 HG2 GLU 10 HG2 GLU 10 9.202 -14.862 -15.558 77 HG3 GLU 10 HG3 GLU 10 7.686 -14.071 -15.135 78 H ALA 11 H ALA 11 8.842 -10.460 -13.373 79 HA ALA 11 HA ALA 11 11.463 -9.337 -12.690 80 HB1 ALA 11 HB1 ALA 11 10.456 -7.168 -13.212 81 HB2 ALA 11 HB2 ALA 11 8.857 -7.909 -13.329 82 HB3 ALA 11 HB3 ALA 11 10.109 -8.324 -14.500 83 H LEU 12 H LEU 12 9.098 -10.616 -10.836 84 HA LEU 12 HA LEU 12 8.491 -10.595 -8.668 85 HB2 LEU 12 HB2 LEU 12 11.038 -8.991 -8.248 86 HB3 LEU 12 HB3 LEU 12 10.159 -9.873 -7.007 87 HG LEU 12 HG LEU 12 11.603 -11.111 -9.390 88 HD11 LEU 12 HD11 LEU 12 13.130 -12.055 -7.714 89 HD12 LEU 12 HD12 LEU 12 12.278 -11.192 -6.430 90 HD13 LEU 12 HD13 LEU 12 13.149 -10.292 -7.675 91 HD21 LEU 12 HD21 LEU 12 9.608 -12.405 -8.863 92 HD22 LEU 12 HD22 LEU 12 10.053 -12.460 -7.156 93 HD23 LEU 12 HD23 LEU 12 11.049 -13.286 -8.355 94 H SER 13 H SER 13 7.530 -8.321 -10.325 95 HA SER 13 HA SER 13 6.951 -6.330 -8.196 96 HB2 SER 13 HB2 SER 13 6.652 -4.667 -10.046 97 HB3 SER 13 HB3 SER 13 8.293 -5.287 -9.938 98 HG SER 13 HG SER 13 6.289 -6.038 -11.814 99 H PHE 14 H PHE 14 4.874 -6.118 -7.660 100 HA PHE 14 HA PHE 14 2.719 -6.981 -9.501 101 HB2 PHE 14 HB2 PHE 14 2.764 -8.477 -7.586 102 HB3 PHE 14 HB3 PHE 14 2.898 -7.132 -6.454 103 HD1 PHE 14 HD1 PHE 14 0.582 -8.543 -9.062 104 HD2 PHE 14 HD2 PHE 14 0.947 -6.308 -5.430 105 HE1 PHE 14 HE1 PHE 14 -1.867 -8.469 -8.845 106 HE2 PHE 14 HE2 PHE 14 -1.497 -6.239 -5.234 107 HZ PHE 14 HZ PHE 14 -2.906 -7.313 -6.931 108 H SER 15 H SER 15 1.952 -5.132 -10.395 109 HA SER 15 HA SER 15 1.727 -2.672 -8.760 110 HB2 SER 15 HB2 SER 15 3.236 -2.466 -10.702 111 HB3 SER 15 HB3 SER 15 1.920 -2.916 -11.791 112 HG SER 15 HG SER 15 1.977 -0.641 -10.072 113 H ILE 16 H ILE 16 -0.143 -1.389 -8.836 114 HA ILE 16 HA ILE 16 -2.521 -2.377 -10.313 115 HB ILE 16 HB ILE 16 -2.553 -1.454 -7.390 116 HG12 ILE 16 HG12 ILE 16 -3.268 -4.218 -8.480 117 HG13 ILE 16 HG13 ILE 16 -1.697 -3.825 -7.790 118 HG21 ILE 16 HG21 ILE 16 -4.876 -2.328 -9.164 119 HG22 ILE 16 HG22 ILE 16 -4.576 -0.691 -8.573 120 HG23 ILE 16 HG23 ILE 16 -4.990 -1.974 -7.436 121 HD11 ILE 16 HD11 ILE 16 -4.324 -3.689 -6.321 122 HD12 ILE 16 HD12 ILE 16 -2.718 -3.370 -5.650 123 HD13 ILE 16 HD13 ILE 16 -3.133 -4.984 -6.219 124 H VAL 17 H VAL 17 -3.415 -0.771 -11.476 125 HA VAL 17 HA VAL 17 -2.839 2.069 -10.874 126 HB VAL 17 HB VAL 17 -3.871 0.842 -13.478 127 HG11 VAL 17 HG11 VAL 17 -2.860 3.662 -12.923 128 HG12 VAL 17 HG12 VAL 17 -4.541 3.203 -13.208 129 HG13 VAL 17 HG13 VAL 17 -3.351 3.033 -14.499 130 HG21 VAL 17 HG21 VAL 17 -1.569 0.074 -13.054 131 HG22 VAL 17 HG22 VAL 17 -1.036 1.744 -12.829 132 HG23 VAL 17 HG23 VAL 17 -1.612 1.206 -14.410 133 H ALA 18 H ALA 18 -4.505 3.352 -10.239 134 HA ALA 18 HA ALA 18 -7.312 2.662 -10.803 135 HB1 ALA 18 HB1 ALA 18 -6.268 3.177 -7.990 136 HB2 ALA 18 HB2 ALA 18 -6.792 1.615 -8.625 137 HB3 ALA 18 HB3 ALA 18 -7.957 2.925 -8.443 138 H GLU 19 H GLU 19 -8.436 4.452 -11.370 139 HA GLU 19 HA GLU 19 -7.272 7.145 -10.922 140 HB2 GLU 19 HB2 GLU 19 -9.348 6.244 -12.972 141 HB3 GLU 19 HB3 GLU 19 -8.598 7.838 -12.882 142 HG2 GLU 19 HG2 GLU 19 -6.403 6.828 -13.396 143 HG3 GLU 19 HG3 GLU 19 -7.154 5.235 -13.478 144 H PHE 20 H PHE 20 -8.330 8.553 -9.585 145 HA PHE 20 HA PHE 20 -11.137 7.975 -8.775 146 HB2 PHE 20 HB2 PHE 20 -8.874 8.941 -6.959 147 HB3 PHE 20 HB3 PHE 20 -10.552 8.741 -6.469 148 HD1 PHE 20 HD1 PHE 20 -11.580 6.379 -6.594 149 HD2 PHE 20 HD2 PHE 20 -7.364 7.092 -6.821 150 HE1 PHE 20 HE1 PHE 20 -11.145 4.038 -5.989 151 HE2 PHE 20 HE2 PHE 20 -6.939 4.745 -6.215 152 HZ PHE 20 HZ PHE 20 -8.830 3.217 -5.802 153 H ASP 21 H ASP 21 -12.458 9.707 -8.291 154 HA ASP 21 HA ASP 21 -11.857 12.206 -9.626 155 HB2 ASP 21 HB2 ASP 21 -14.254 12.775 -8.953 156 HB3 ASP 21 HB3 ASP 21 -14.065 11.378 -9.999 157 H ALA 22 H ALA 22 -10.152 12.939 -8.377 158 HA ALA 22 HA ALA 22 -10.679 14.766 -6.254 159 HB1 ALA 22 HB1 ALA 22 -9.337 13.658 -4.470 160 HB2 ALA 22 HB2 ALA 22 -9.184 12.219 -5.481 161 HB3 ALA 22 HB3 ALA 22 -10.767 12.710 -4.879 162 H ASP 23 H ASP 23 -8.559 15.854 -5.555 163 HA ASP 23 HA ASP 23 -6.759 16.006 -7.879 164 HB2 ASP 23 HB2 ASP 23 -5.821 18.035 -6.797 165 HB3 ASP 23 HB3 ASP 23 -7.557 18.148 -7.033 166 H VAL 24 H VAL 24 -4.405 16.408 -7.350 167 HA VAL 24 HA VAL 24 -3.279 13.998 -6.517 168 HB VAL 24 HB VAL 24 -1.886 16.682 -6.907 169 HG11 VAL 24 HG11 VAL 24 -0.364 15.074 -5.810 170 HG12 VAL 24 HG12 VAL 24 0.144 15.347 -7.479 171 HG13 VAL 24 HG13 VAL 24 -0.714 13.866 -7.050 172 HG21 VAL 24 HG21 VAL 24 -2.434 14.475 -8.930 173 HG22 VAL 24 HG22 VAL 24 -1.504 15.948 -9.230 174 HG23 VAL 24 HG23 VAL 24 -3.225 16.055 -8.865 175 H LYS 25 H LYS 25 -3.588 17.051 -4.719 176 HA LYS 25 HA LYS 25 -1.934 16.327 -2.483 177 HB2 LYS 25 HB2 LYS 25 -4.196 18.375 -2.599 178 HB3 LYS 25 HB3 LYS 25 -2.960 18.274 -1.343 179 HG2 LYS 25 HG2 LYS 25 -2.395 18.859 -4.267 180 HG3 LYS 25 HG3 LYS 25 -2.601 20.093 -3.019 181 HD2 LYS 25 HD2 LYS 25 -0.636 19.169 -1.800 182 HD3 LYS 25 HD3 LYS 25 -0.426 17.954 -3.068 183 HE2 LYS 25 HE2 LYS 25 0.006 19.716 -4.712 184 HE3 LYS 25 HE3 LYS 25 -0.295 20.958 -3.497 185 HZ1 LYS 25 HZ1 LYS 25 1.633 20.294 -2.309 186 HZ2 LYS 25 HZ2 LYS 25 2.071 20.503 -3.930 187 HZ3 LYS 25 HZ3 LYS 25 1.868 18.948 -3.303 188 H ARG 26 H ARG 26 -5.377 16.099 -3.210 189 HA ARG 26 HA ARG 26 -6.356 15.255 -0.674 190 HB2 ARG 26 HB2 ARG 26 -7.827 16.224 -2.383 191 HB3 ARG 26 HB3 ARG 26 -7.474 14.903 -3.485 192 HG2 ARG 26 HG2 ARG 26 -9.687 14.600 -2.565 193 HG3 ARG 26 HG3 ARG 26 -8.631 13.327 -1.958 194 HD2 ARG 26 HD2 ARG 26 -8.376 14.619 0.174 195 HD3 ARG 26 HD3 ARG 26 -9.535 15.799 -0.446 196 HE ARG 26 HE ARG 26 -11.223 14.050 -0.437 197 HH11 ARG 26 HH11 ARG 26 -8.375 13.335 1.405 198 HH12 ARG 26 HH12 ARG 26 -9.195 12.195 2.410 199 HH21 ARG 26 HH21 ARG 26 -12.220 12.567 0.841 200 HH22 ARG 26 HH22 ARG 26 -11.336 11.749 2.082 201 H VAL 27 H VAL 27 -5.273 13.431 -3.542 202 HA VAL 27 HA VAL 27 -5.802 10.814 -2.433 203 HB VAL 27 HB VAL 27 -4.053 11.475 -4.845 204 HG11 VAL 27 HG11 VAL 27 -3.775 9.155 -4.038 205 HG12 VAL 27 HG12 VAL 27 -4.596 9.175 -5.597 206 HG13 VAL 27 HG13 VAL 27 -5.522 8.900 -4.120 207 HG21 VAL 27 HG21 VAL 27 -6.063 11.112 -6.251 208 HG22 VAL 27 HG22 VAL 27 -6.270 12.491 -5.172 209 HG23 VAL 27 HG23 VAL 27 -7.054 10.956 -4.797 210 H TRP 28 H TRP 28 -2.965 12.937 -2.645 211 HA TRP 28 HA TRP 28 -1.000 11.141 -1.646 212 HB2 TRP 28 HB2 TRP 28 -0.474 13.280 -2.799 213 HB3 TRP 28 HB3 TRP 28 -1.121 14.178 -1.440 214 HD1 TRP 28 HD1 TRP 28 0.580 14.742 0.499 215 HE1 TRP 28 HE1 TRP 28 3.046 14.187 0.943 216 HE3 TRP 28 HE3 TRP 28 1.313 11.237 -3.172 217 HZ2 TRP 28 HZ2 TRP 28 5.047 12.509 -0.127 218 HZ3 TRP 28 HZ3 TRP 28 3.542 10.216 -3.395 219 HH2 TRP 28 HH2 TRP 28 5.369 10.842 -1.899 220 H ALA 29 H ALA 29 -3.412 13.140 -0.055 221 HA ALA 29 HA ALA 29 -2.419 13.177 2.578 222 HB1 ALA 29 HB1 ALA 29 -4.682 13.852 3.219 223 HB2 ALA 29 HB2 ALA 29 -5.296 13.329 1.647 224 HB3 ALA 29 HB3 ALA 29 -4.169 14.682 1.747 225 H ILE 30 H ILE 30 -4.205 10.608 0.898 226 HA ILE 30 HA ILE 30 -4.935 9.141 3.299 227 HB ILE 30 HB ILE 30 -5.775 7.397 1.895 228 HG12 ILE 30 HG12 ILE 30 -4.142 8.605 -0.381 229 HG13 ILE 30 HG13 ILE 30 -3.856 7.059 0.394 230 HG21 ILE 30 HG21 ILE 30 -7.111 9.465 1.880 231 HG22 ILE 30 HG22 ILE 30 -7.265 8.608 0.347 232 HG23 ILE 30 HG23 ILE 30 -6.236 10.038 0.455 233 HD11 ILE 30 HD11 ILE 30 -4.825 6.738 -1.761 234 HD12 ILE 30 HD12 ILE 30 -6.179 7.794 -1.369 235 HD13 ILE 30 HD13 ILE 30 -5.992 6.248 -0.534 236 H TRP 31 H TRP 31 -1.989 9.592 1.766 237 HA TRP 31 HA TRP 31 -0.780 7.105 2.829 238 HB2 TRP 31 HB2 TRP 31 0.243 9.142 0.791 239 HB3 TRP 31 HB3 TRP 31 1.183 7.767 1.373 240 HD1 TRP 31 HD1 TRP 31 -1.418 8.660 -1.221 241 HE1 TRP 31 HE1 TRP 31 -2.114 6.532 -2.494 242 HE3 TRP 31 HE3 TRP 31 0.811 5.159 1.764 243 HZ2 TRP 31 HZ2 TRP 31 -1.749 3.750 -2.264 244 HZ3 TRP 31 HZ3 TRP 31 0.603 2.786 1.169 245 HH2 TRP 31 HH2 TRP 31 -0.661 2.089 -0.799 246 H GLU 32 H GLU 32 -0.549 10.624 2.827 247 HA GLU 32 HA GLU 32 1.813 10.772 4.461 248 HB2 GLU 32 HB2 GLU 32 1.363 12.398 2.687 249 HB3 GLU 32 HB3 GLU 32 -0.131 12.901 3.475 250 HG2 GLU 32 HG2 GLU 32 1.070 13.935 5.277 251 HG3 GLU 32 HG3 GLU 32 2.591 13.199 4.774 252 H ASP 33 H ASP 33 -1.648 11.120 4.994 253 HA ASP 33 HA ASP 33 -1.288 11.791 7.837 254 HB2 ASP 33 HB2 ASP 33 -2.848 13.132 6.426 255 HB3 ASP 33 HB3 ASP 33 -3.808 11.690 6.125 256 HA PRO 34 HA PRO 34 -1.638 7.313 8.731 257 HB2 PRO 34 HB2 PRO 34 -1.956 7.648 11.512 258 HB3 PRO 34 HB3 PRO 34 -0.411 7.528 10.663 259 HG2 PRO 34 HG2 PRO 34 -1.919 9.988 11.531 260 HG3 PRO 34 HG3 PRO 34 -0.176 9.647 11.639 261 HD2 PRO 34 HD2 PRO 34 -1.114 11.243 9.715 262 HD3 PRO 34 HD3 PRO 34 0.175 10.076 9.344 263 H ARG 35 H ARG 35 -3.955 9.704 10.047 264 HA ARG 35 HA ARG 35 -5.950 7.899 10.924 265 HB2 ARG 35 HB2 ARG 35 -5.667 10.487 11.371 266 HB3 ARG 35 HB3 ARG 35 -6.633 10.685 9.922 267 HG2 ARG 35 HG2 ARG 35 -8.418 10.629 11.339 268 HG3 ARG 35 HG3 ARG 35 -8.181 8.884 11.340 269 HD2 ARG 35 HD2 ARG 35 -7.367 10.906 13.434 270 HD3 ARG 35 HD3 ARG 35 -8.321 9.437 13.642 271 HE ARG 35 HE ARG 35 -5.429 9.696 13.606 272 HH11 ARG 35 HH11 ARG 35 -8.046 7.437 13.457 273 HH12 ARG 35 HH12 ARG 35 -7.018 6.096 13.798 274 HH21 ARG 35 HH21 ARG 35 -4.171 7.963 14.050 275 HH22 ARG 35 HH22 ARG 35 -4.865 6.382 14.120 276 H GLN 36 H GLN 36 -5.403 9.507 7.821 277 HA GLN 36 HA GLN 36 -7.758 8.400 6.537 278 HB2 GLN 36 HB2 GLN 36 -5.410 9.985 5.436 279 HB3 GLN 36 HB3 GLN 36 -6.786 9.460 4.461 280 HG2 GLN 36 HG2 GLN 36 -8.299 10.790 5.914 281 HG3 GLN 36 HG3 GLN 36 -6.905 11.341 6.845 282 HE21 GLN 36 HE21 GLN 36 -5.504 12.867 5.908 283 HE22 GLN 36 HE22 GLN 36 -5.932 13.756 4.495 284 H LEU 37 H LEU 37 -4.397 7.410 6.902 285 HA LEU 37 HA LEU 37 -4.344 5.628 4.626 286 HB2 LEU 37 HB2 LEU 37 -2.256 6.551 5.419 287 HB3 LEU 37 HB3 LEU 37 -2.514 5.911 7.033 288 HG LEU 37 HG LEU 37 -2.180 3.599 6.201 289 HD11 LEU 37 HD11 LEU 37 -3.013 3.845 3.893 290 HD12 LEU 37 HD12 LEU 37 -1.405 3.104 3.942 291 HD13 LEU 37 HD13 LEU 37 -1.583 4.806 3.482 292 HD21 LEU 37 HD21 LEU 37 -0.240 4.835 7.025 293 HD22 LEU 37 HD22 LEU 37 0.074 5.462 5.403 294 HD23 LEU 37 HD23 LEU 37 0.219 3.727 5.727 295 H GLU 38 H GLU 38 -4.578 5.059 8.171 296 HA GLU 38 HA GLU 38 -4.876 2.234 8.036 297 HB2 GLU 38 HB2 GLU 38 -5.513 2.358 10.392 298 HB3 GLU 38 HB3 GLU 38 -4.156 3.428 10.076 299 HG2 GLU 38 HG2 GLU 38 -5.724 5.363 10.034 300 HG3 GLU 38 HG3 GLU 38 -7.053 4.269 10.434 301 H ARG 39 H ARG 39 -7.065 4.785 7.507 302 HA ARG 39 HA ARG 39 -9.585 3.768 8.098 303 HB2 ARG 39 HB2 ARG 39 -9.077 6.110 7.663 304 HB3 ARG 39 HB3 ARG 39 -8.615 5.750 6.010 305 HG2 ARG 39 HG2 ARG 39 -10.845 5.422 5.318 306 HG3 ARG 39 HG3 ARG 39 -11.420 5.234 6.971 307 HD2 ARG 39 HD2 ARG 39 -10.419 7.805 5.695 308 HD3 ARG 39 HD3 ARG 39 -12.101 7.415 6.093 309 HE ARG 39 HE ARG 39 -10.029 7.578 8.201 310 HH11 ARG 39 HH11 ARG 39 -13.029 8.741 6.931 311 HH12 ARG 39 HH12 ARG 39 -13.397 9.624 8.370 312 HH21 ARG 39 HH21 ARG 39 -10.544 8.690 10.016 313 HH22 ARG 39 HH22 ARG 39 -12.005 9.609 10.077 314 H TRP 40 H TRP 40 -7.504 3.115 5.338 315 HA TRP 40 HA TRP 40 -9.562 1.310 4.180 316 HB2 TRP 40 HB2 TRP 40 -8.762 1.928 1.912 317 HB3 TRP 40 HB3 TRP 40 -9.431 3.307 2.775 318 HD1 TRP 40 HD1 TRP 40 -7.698 5.276 3.482 319 HE1 TRP 40 HE1 TRP 40 -5.337 5.860 2.644 320 HE3 TRP 40 HE3 TRP 40 -6.576 0.913 1.100 321 HZ2 TRP 40 HZ2 TRP 40 -3.282 4.640 1.152 322 HZ3 TRP 40 HZ3 TRP 40 -4.401 0.687 -0.015 323 HH2 TRP 40 HH2 TRP 40 -2.799 2.512 0.016 324 H TRP 41 H TRP 41 -6.468 1.477 5.516 325 HA TRP 41 HA TRP 41 -4.962 -0.130 3.708 326 HB2 TRP 41 HB2 TRP 41 -4.025 1.467 5.471 327 HB3 TRP 41 HB3 TRP 41 -4.365 0.230 6.679 328 HD1 TRP 41 HD1 TRP 41 -2.257 -1.209 7.201 329 HE1 TRP 41 HE1 TRP 41 -0.129 -1.900 5.926 330 HE3 TRP 41 HE3 TRP 41 -3.243 0.969 2.675 331 HZ2 TRP 41 HZ2 TRP 41 0.970 -1.543 3.377 332 HZ3 TRP 41 HZ3 TRP 41 -1.610 0.727 0.870 333 HH2 TRP 41 HH2 TRP 41 0.466 -0.515 1.206 334 H GLY 42 H GLY 42 -5.928 -2.014 3.185 335 HA2 GLY 42 HA2 GLY 42 -5.884 -4.437 3.781 336 HA3 GLY 42 HA3 GLY 42 -6.665 -3.989 5.290 337 HA PRO 43 HA PRO 43 -9.946 -4.934 1.980 338 HB2 PRO 43 HB2 PRO 43 -11.010 -7.227 3.034 339 HB3 PRO 43 HB3 PRO 43 -9.592 -7.256 1.970 340 HG2 PRO 43 HG2 PRO 43 -9.709 -7.367 4.985 341 HG3 PRO 43 HG3 PRO 43 -8.747 -8.363 3.869 342 HD2 PRO 43 HD2 PRO 43 -7.696 -6.213 5.195 343 HD3 PRO 43 HD3 PRO 43 -7.128 -6.703 3.582 344 HA PRO 44 HA PRO 44 -13.363 -2.917 4.155 345 HB2 PRO 44 HB2 PRO 44 -15.065 -5.188 3.095 346 HB3 PRO 44 HB3 PRO 44 -15.390 -3.445 3.086 347 HG2 PRO 44 HG2 PRO 44 -14.523 -4.601 0.869 348 HG3 PRO 44 HG3 PRO 44 -13.835 -3.036 1.358 349 HD2 PRO 44 HD2 PRO 44 -12.630 -5.791 1.576 350 HD3 PRO 44 HD3 PRO 44 -11.847 -4.245 1.177 351 H THR 45 H THR 45 -12.801 -6.309 4.870 352 HA THR 45 HA THR 45 -14.505 -6.306 7.265 353 HB THR 45 HB THR 45 -13.754 -8.731 7.461 354 HG1 THR 45 HG1 THR 45 -12.466 -9.578 5.898 355 HG21 THR 45 HG21 THR 45 -14.985 -7.959 4.782 356 HG22 THR 45 HG22 THR 45 -15.872 -8.173 6.295 357 HG23 THR 45 HG23 THR 45 -15.072 -9.553 5.539 358 H TRP 46 H TRP 46 -11.135 -5.830 6.493 359 HA TRP 46 HA TRP 46 -10.343 -6.030 9.360 360 HB2 TRP 46 HB2 TRP 46 -8.670 -6.507 6.856 361 HB3 TRP 46 HB3 TRP 46 -7.976 -6.354 8.465 362 HD1 TRP 46 HD1 TRP 46 -10.669 -8.641 6.774 363 HE1 TRP 46 HE1 TRP 46 -10.375 -11.009 7.713 364 HE3 TRP 46 HE3 TRP 46 -6.815 -7.757 10.012 365 HZ2 TRP 46 HZ2 TRP 46 -8.730 -12.346 9.556 366 HZ3 TRP 46 HZ3 TRP 46 -5.918 -9.643 11.318 367 HH2 TRP 46 HH2 TRP 46 -6.853 -11.895 11.094 368 HA PRO 47 HA PRO 47 -9.470 -1.533 8.558 369 HB2 PRO 47 HB2 PRO 47 -10.242 -0.621 11.005 370 HB3 PRO 47 HB3 PRO 47 -11.408 -0.934 9.712 371 HG2 PRO 47 HG2 PRO 47 -10.668 -2.690 12.058 372 HG3 PRO 47 HG3 PRO 47 -12.283 -2.291 11.433 373 HD2 PRO 47 HD2 PRO 47 -10.998 -4.633 10.818 374 HD3 PRO 47 HD3 PRO 47 -12.141 -3.849 9.709 375 H ALA 48 H ALA 48 -7.414 -0.788 8.859 376 HA ALA 48 HA ALA 48 -5.609 -2.032 10.799 377 HB1 ALA 48 HB1 ALA 48 -5.047 0.074 8.683 378 HB2 ALA 48 HB2 ALA 48 -4.837 -1.667 8.492 379 HB3 ALA 48 HB3 ALA 48 -3.833 -0.782 9.642 380 H THR 49 H THR 49 -4.017 -0.510 11.948 381 HA THR 49 HA THR 49 -5.048 2.106 12.758 382 HB THR 49 HB THR 49 -4.501 -0.033 14.878 383 HG1 THR 49 HG1 THR 49 -6.880 0.852 13.661 384 HG21 THR 49 HG21 THR 49 -3.962 2.276 15.628 385 HG22 THR 49 HG22 THR 49 -5.367 1.634 16.478 386 HG23 THR 49 HG23 THR 49 -5.588 2.798 15.171 387 H PHE 50 H PHE 50 -3.279 3.371 12.439 388 HA PHE 50 HA PHE 50 -0.558 2.298 12.720 389 HB2 PHE 50 HB2 PHE 50 -1.714 4.737 11.334 390 HB3 PHE 50 HB3 PHE 50 0.005 4.681 11.712 391 HD1 PHE 50 HD1 PHE 50 -2.674 2.752 9.925 392 HD2 PHE 50 HD2 PHE 50 1.510 3.569 10.249 393 HE1 PHE 50 HE1 PHE 50 -2.256 1.414 7.903 394 HE2 PHE 50 HE2 PHE 50 1.923 2.231 8.225 395 HZ PHE 50 HZ PHE 50 0.044 1.151 7.049 396 H GLU 51 H GLU 51 0.095 2.310 14.778 397 HA GLU 51 HA GLU 51 -0.373 4.306 16.752 398 HB2 GLU 51 HB2 GLU 51 1.861 2.244 16.595 399 HB3 GLU 51 HB3 GLU 51 1.410 3.152 18.039 400 HG2 GLU 51 HG2 GLU 51 -0.233 1.049 16.600 401 HG3 GLU 51 HG3 GLU 51 0.510 0.915 18.191 402 H THR 52 H THR 52 2.231 3.696 14.520 403 HA THR 52 HA THR 52 3.341 6.393 15.030 404 HB THR 52 HB THR 52 4.987 3.894 14.387 405 HG1 THR 52 HG1 THR 52 4.279 5.110 16.843 406 HG21 THR 52 HG21 THR 52 5.796 6.682 15.260 407 HG22 THR 52 HG22 THR 52 6.025 6.004 13.646 408 HG23 THR 52 HG23 THR 52 6.902 5.328 15.021 409 H HIS 53 H HIS 53 3.780 7.550 13.166 410 HA HIS 53 HA HIS 53 4.164 6.221 10.608 411 HB2 HIS 53 HB2 HIS 53 1.672 6.499 10.828 412 HB3 HIS 53 HB3 HIS 53 1.896 8.240 10.962 413 HD2 HIS 53 HD2 HIS 53 1.746 5.456 8.266 414 HE1 HIS 53 HE1 HIS 53 2.320 9.191 6.374 415 HE2 HIS 53 HE2 HIS 53 1.545 6.815 6.067 416 H GLU 54 H GLU 54 6.277 7.083 10.846 417 HA GLU 54 HA GLU 54 6.733 9.975 10.822 418 HB2 GLU 54 HB2 GLU 54 8.731 7.702 10.407 419 HB3 GLU 54 HB3 GLU 54 9.127 9.396 10.714 420 HG2 GLU 54 HG2 GLU 54 8.211 9.221 12.965 421 HG3 GLU 54 HG3 GLU 54 7.695 7.568 12.645 422 H PHE 55 H PHE 55 5.715 10.611 8.833 423 HA PHE 55 HA PHE 55 6.412 9.372 6.332 424 HB2 PHE 55 HB2 PHE 55 4.181 10.565 6.964 425 HB3 PHE 55 HB3 PHE 55 5.034 12.072 6.646 426 HD1 PHE 55 HD1 PHE 55 4.079 8.823 5.124 427 HD2 PHE 55 HD2 PHE 55 5.223 12.864 4.383 428 HE1 PHE 55 HE1 PHE 55 3.560 8.524 2.739 429 HE2 PHE 55 HE2 PHE 55 4.690 12.567 1.996 430 HZ PHE 55 HZ PHE 55 3.858 10.397 1.174 431 H THR 56 H THR 56 8.779 9.662 6.961 432 HA THR 56 HA THR 56 9.871 11.984 5.503 433 HB THR 56 HB THR 56 10.150 12.504 7.916 434 HG1 THR 56 HG1 THR 56 11.984 13.364 7.312 435 HG21 THR 56 HG21 THR 56 10.233 10.212 8.853 436 HG22 THR 56 HG22 THR 56 11.644 11.145 9.349 437 HG23 THR 56 HG23 THR 56 11.795 9.944 8.067 438 H VAL 57 H VAL 57 12.108 11.600 4.753 439 HA VAL 57 HA VAL 57 12.481 9.085 3.465 440 HB VAL 57 HB VAL 57 14.398 11.432 3.883 441 HG11 VAL 57 HG11 VAL 57 15.713 9.422 3.366 442 HG12 VAL 57 HG12 VAL 57 15.735 10.536 2.001 443 HG13 VAL 57 HG13 VAL 57 14.708 9.103 1.953 444 HG21 VAL 57 HG21 VAL 57 12.370 12.040 2.622 445 HG22 VAL 57 HG22 VAL 57 12.652 10.716 1.490 446 HG23 VAL 57 HG23 VAL 57 13.784 12.069 1.566 447 H GLY 58 H GLY 58 12.914 7.269 4.596 448 HA2 GLY 58 HA2 GLY 58 14.415 5.786 5.665 449 HA3 GLY 58 HA3 GLY 58 15.229 7.141 6.427 450 H GLY 59 H GLY 59 11.999 7.732 6.867 451 HA2 GLY 59 HA2 GLY 59 12.057 6.903 9.667 452 HA3 GLY 59 HA3 GLY 59 10.813 7.864 8.881 453 H LYS 60 H LYS 60 9.935 5.959 10.615 454 HA LYS 60 HA LYS 60 8.978 3.743 8.887 455 HB2 LYS 60 HB2 LYS 60 10.103 3.475 11.709 456 HB3 LYS 60 HB3 LYS 60 9.174 2.207 10.905 457 HG2 LYS 60 HG2 LYS 60 10.899 2.227 9.060 458 HG3 LYS 60 HG3 LYS 60 11.865 3.323 10.057 459 HD2 LYS 60 HD2 LYS 60 12.064 1.621 11.802 460 HD3 LYS 60 HD3 LYS 60 10.970 0.542 10.926 461 HE2 LYS 60 HE2 LYS 60 12.622 0.442 9.059 462 HE3 LYS 60 HE3 LYS 60 13.725 1.447 10.002 463 HZ1 LYS 60 HZ1 LYS 60 14.326 -0.832 10.216 464 HZ2 LYS 60 HZ2 LYS 60 12.764 -1.275 10.684 465 HZ3 LYS 60 HZ3 LYS 60 13.714 -0.313 11.704 466 H ALA 61 H ALA 61 7.146 2.554 9.750 467 HA ALA 61 HA ALA 61 5.301 4.124 11.448 468 HB1 ALA 61 HB1 ALA 61 4.729 4.610 9.088 469 HB2 ALA 61 HB2 ALA 61 3.439 3.725 9.901 470 HB3 ALA 61 HB3 ALA 61 4.512 2.886 8.782 471 H ALA 62 H ALA 62 4.203 2.895 12.910 472 HA ALA 62 HA ALA 62 4.438 -0.074 12.792 473 HB1 ALA 62 HB1 ALA 62 4.094 1.728 15.226 474 HB2 ALA 62 HB2 ALA 62 5.557 0.853 14.770 475 HB3 ALA 62 HB3 ALA 62 4.113 -0.041 15.262 476 H TYR 63 H TYR 63 2.544 -1.218 12.631 477 HA TYR 63 HA TYR 63 0.036 -0.039 13.543 478 HB2 TYR 63 HB2 TYR 63 -1.152 -0.171 11.469 479 HB3 TYR 63 HB3 TYR 63 0.322 0.722 11.144 480 HD1 TYR 63 HD1 TYR 63 2.170 -0.378 9.804 481 HD2 TYR 63 HD2 TYR 63 -1.629 -2.263 10.343 482 HE1 TYR 63 HE1 TYR 63 2.627 -1.863 7.900 483 HE2 TYR 63 HE2 TYR 63 -1.166 -3.749 8.449 484 HH TYR 63 HH TYR 63 1.958 -3.839 6.876 485 H TYR 64 H TYR 64 -1.821 -1.520 13.157 486 HA TYR 64 HA TYR 64 -1.283 -4.350 12.761 487 HB2 TYR 64 HB2 TYR 64 -2.421 -5.009 14.893 488 HB3 TYR 64 HB3 TYR 64 -0.911 -4.152 15.178 489 HD1 TYR 64 HD1 TYR 64 -4.600 -3.912 15.406 490 HD2 TYR 64 HD2 TYR 64 -0.896 -1.933 16.270 491 HE1 TYR 64 HE1 TYR 64 -5.778 -2.361 16.874 492 HE2 TYR 64 HE2 TYR 64 -2.101 -0.382 17.756 493 HH TYR 64 HH TYR 64 -5.332 -0.920 18.761 494 H MET 65 H MET 65 -3.248 -5.550 12.388 495 HA MET 65 HA MET 65 -5.516 -3.881 11.447 496 HB2 MET 65 HB2 MET 65 -4.445 -6.514 10.331 497 HB3 MET 65 HB3 MET 65 -5.842 -5.637 9.709 498 HG2 MET 65 HG2 MET 65 -4.433 -3.799 8.997 499 HG3 MET 65 HG3 MET 65 -3.025 -4.521 9.775 500 HE1 MET 65 HE1 MET 65 -5.120 -6.427 6.121 501 HE2 MET 65 HE2 MET 65 -5.709 -4.970 6.924 502 HE3 MET 65 HE3 MET 65 -5.769 -6.525 7.757 503 H THR 66 H THR 66 -7.011 -4.079 13.081 504 HA THR 66 HA THR 66 -7.443 -6.545 14.542 505 HB THR 66 HB THR 66 -8.995 -3.916 14.590 506 HG1 THR 66 HG1 THR 66 -7.754 -3.438 16.325 507 HG21 THR 66 HG21 THR 66 -9.239 -6.290 16.482 508 HG22 THR 66 HG22 THR 66 -10.470 -5.773 15.325 509 HG23 THR 66 HG23 THR 66 -10.034 -4.726 16.678 510 H GLY 67 H GLY 67 -8.590 -8.192 13.768 511 HA2 GLY 67 HA2 GLY 67 -9.998 -8.053 11.271 512 HA3 GLY 67 HA3 GLY 67 -9.738 -9.478 12.253 513 HA PRO 68 HA PRO 68 -14.332 -8.096 12.278 514 HB2 PRO 68 HB2 PRO 68 -15.360 -10.379 11.097 515 HB3 PRO 68 HB3 PRO 68 -14.854 -8.953 10.179 516 HG2 PRO 68 HG2 PRO 68 -13.319 -11.504 10.721 517 HG3 PRO 68 HG3 PRO 68 -13.504 -10.619 9.190 518 HD2 PRO 68 HD2 PRO 68 -11.276 -10.385 10.693 519 HD3 PRO 68 HD3 PRO 68 -11.927 -8.994 9.798 520 H ASP 69 H ASP 69 -12.620 -11.049 13.133 521 HA ASP 69 HA ASP 69 -14.525 -11.737 15.282 522 HB2 ASP 69 HB2 ASP 69 -13.373 -13.871 15.396 523 HB3 ASP 69 HB3 ASP 69 -13.747 -13.524 13.711 524 H GLY 70 H GLY 70 -11.882 -9.769 14.935 525 HA2 GLY 70 HA2 GLY 70 -10.911 -8.521 16.689 526 HA3 GLY 70 HA3 GLY 70 -11.199 -9.846 17.802 527 H THR 71 H THR 71 -9.795 -11.008 14.891 528 HA THR 71 HA THR 71 -7.282 -11.604 16.144 529 HB THR 71 HB THR 71 -8.010 -11.835 13.188 530 HG1 THR 71 HG1 THR 71 -9.105 -13.484 13.895 531 HG21 THR 71 HG21 THR 71 -5.675 -13.092 14.703 532 HG22 THR 71 HG22 THR 71 -5.545 -11.820 13.484 533 HG23 THR 71 HG23 THR 71 -6.115 -13.425 13.028 534 H LYS 72 H LYS 72 -5.983 -9.961 16.672 535 HA LYS 72 HA LYS 72 -5.602 -7.588 15.048 536 HB2 LYS 72 HB2 LYS 72 -5.793 -7.648 17.556 537 HB3 LYS 72 HB3 LYS 72 -4.251 -8.491 17.624 538 HG2 LYS 72 HG2 LYS 72 -3.102 -6.538 16.732 539 HG3 LYS 72 HG3 LYS 72 -4.636 -5.713 16.479 540 HD2 LYS 72 HD2 LYS 72 -3.811 -6.639 19.253 541 HD3 LYS 72 HD3 LYS 72 -3.218 -5.113 18.596 542 HE2 LYS 72 HE2 LYS 72 -5.240 -4.871 20.052 543 HE3 LYS 72 HE3 LYS 72 -5.458 -4.222 18.439 544 HZ1 LYS 72 HZ1 LYS 72 -6.785 -6.080 17.856 545 HZ2 LYS 72 HZ2 LYS 72 -7.370 -5.469 19.321 546 HZ3 LYS 72 HZ3 LYS 72 -6.436 -6.877 19.307 547 H ALA 73 H ALA 73 -4.304 -7.778 13.267 548 HA ALA 73 HA ALA 73 -2.018 -9.655 13.207 549 HB1 ALA 73 HB1 ALA 73 -3.467 -8.270 10.919 550 HB2 ALA 73 HB2 ALA 73 -3.734 -9.929 11.460 551 HB3 ALA 73 HB3 ALA 73 -2.182 -9.472 10.757 552 H ARG 74 H ARG 74 -0.177 -8.662 13.881 553 HA ARG 74 HA ARG 74 0.264 -5.821 13.722 554 HB2 ARG 74 HB2 ARG 74 1.017 -7.595 15.545 555 HB3 ARG 74 HB3 ARG 74 2.418 -7.812 14.512 556 HG2 ARG 74 HG2 ARG 74 1.575 -5.152 15.726 557 HG3 ARG 74 HG3 ARG 74 2.742 -6.250 16.459 558 HD2 ARG 74 HD2 ARG 74 4.167 -5.992 14.399 559 HD3 ARG 74 HD3 ARG 74 3.028 -4.764 13.824 560 HE ARG 74 HE ARG 74 4.059 -4.239 16.463 561 HH11 ARG 74 HH11 ARG 74 4.634 -3.703 13.084 562 HH12 ARG 74 HH12 ARG 74 5.803 -2.467 13.386 563 HH21 ARG 74 HH21 ARG 74 5.552 -2.660 16.798 564 HH22 ARG 74 HH22 ARG 74 6.306 -1.876 15.452 565 H GLY 75 H GLY 75 1.308 -4.696 12.146 566 HA2 GLY 75 HA2 GLY 75 3.245 -6.039 10.333 567 HA3 GLY 75 HA3 GLY 75 1.966 -5.020 9.683 568 H TRP 76 H TRP 76 4.636 -4.470 9.145 569 HA TRP 76 HA TRP 76 5.119 -1.920 10.590 570 HB2 TRP 76 HB2 TRP 76 7.570 -2.373 10.453 571 HB3 TRP 76 HB3 TRP 76 6.741 -3.607 11.396 572 HD1 TRP 76 HD1 TRP 76 6.643 -6.104 10.344 573 HE1 TRP 76 HE1 TRP 76 7.926 -7.235 8.436 574 HE3 TRP 76 HE3 TRP 76 8.760 -1.959 8.194 575 HZ2 TRP 76 HZ2 TRP 76 9.614 -6.497 6.311 576 HZ3 TRP 76 HZ3 TRP 76 10.209 -2.263 6.229 577 HH2 TRP 76 HH2 TRP 76 10.629 -4.488 5.310 578 H TRP 77 H TRP 77 6.105 -0.258 9.363 579 HA TRP 77 HA TRP 77 6.522 -0.611 6.443 580 HB2 TRP 77 HB2 TRP 77 5.214 1.623 7.999 581 HB3 TRP 77 HB3 TRP 77 6.076 2.038 6.528 582 HD1 TRP 77 HD1 TRP 77 3.886 -1.144 6.648 583 HE1 TRP 77 HE1 TRP 77 1.892 -0.779 5.073 584 HE3 TRP 77 HE3 TRP 77 4.662 3.757 5.542 585 HZ2 TRP 77 HZ2 TRP 77 0.787 1.368 3.560 586 HZ3 TRP 77 HZ3 TRP 77 3.109 4.902 4.020 587 HH2 TRP 77 HH2 TRP 77 1.211 3.725 3.049 588 H GLN 78 H GLN 78 8.248 0.626 5.482 589 HA GLN 78 HA GLN 78 9.742 2.542 7.127 590 HB2 GLN 78 HB2 GLN 78 11.113 0.485 7.312 591 HB3 GLN 78 HB3 GLN 78 11.157 0.333 5.557 592 HG2 GLN 78 HG2 GLN 78 12.406 2.456 5.387 593 HG3 GLN 78 HG3 GLN 78 12.325 2.657 7.136 594 HE21 GLN 78 HE21 GLN 78 14.561 2.713 7.347 595 HE22 GLN 78 HE22 GLN 78 15.565 1.327 7.117 596 H PHE 79 H PHE 79 9.565 4.391 6.001 597 HA PHE 79 HA PHE 79 9.093 4.540 3.166 598 HB2 PHE 79 HB2 PHE 79 9.769 6.781 5.120 599 HB3 PHE 79 HB3 PHE 79 9.099 6.977 3.505 600 HD1 PHE 79 HD1 PHE 79 8.357 5.897 6.964 601 HD2 PHE 79 HD2 PHE 79 6.724 6.637 3.085 602 HE1 PHE 79 HE1 PHE 79 6.091 5.857 7.911 603 HE2 PHE 79 HE2 PHE 79 4.466 6.600 4.042 604 HZ PHE 79 HZ PHE 79 4.145 6.216 6.451 605 H THR 80 H THR 80 10.580 4.883 1.544 606 HA THR 80 HA THR 80 13.422 5.386 2.263 607 HB THR 80 HB THR 80 14.020 4.389 0.066 608 HG1 THR 80 HG1 THR 80 12.541 4.109 -1.398 609 HG21 THR 80 HG21 THR 80 12.208 2.608 1.733 610 HG22 THR 80 HG22 THR 80 13.944 2.845 1.958 611 HG23 THR 80 HG23 THR 80 13.341 2.031 0.506 612 H THR 81 H THR 81 11.307 6.031 -0.580 613 HA THR 81 HA THR 81 12.679 8.646 -0.959 614 HB THR 81 HB THR 81 11.283 6.946 -3.076 615 HG1 THR 81 HG1 THR 81 13.317 6.403 -3.765 616 HG21 THR 81 HG21 THR 81 11.168 9.323 -3.666 617 HG22 THR 81 HG22 THR 81 12.341 8.509 -4.703 618 HG23 THR 81 HG23 THR 81 12.898 9.506 -3.356 619 H ILE 82 H ILE 82 11.408 10.178 -0.038 620 HA ILE 82 HA ILE 82 8.577 10.403 -0.933 621 HB ILE 82 HB ILE 82 9.800 11.496 1.647 622 HG12 ILE 82 HG12 ILE 82 7.838 9.203 1.184 623 HG13 ILE 82 HG13 ILE 82 9.481 9.065 1.800 624 HG21 ILE 82 HG21 ILE 82 7.500 12.223 2.221 625 HG22 ILE 82 HG22 ILE 82 6.923 11.674 0.646 626 HG23 ILE 82 HG23 ILE 82 8.069 13.013 0.750 627 HD11 ILE 82 HD11 ILE 82 7.132 10.338 3.195 628 HD12 ILE 82 HD12 ILE 82 8.783 10.293 3.820 629 HD13 ILE 82 HD13 ILE 82 7.892 8.794 3.571 630 H GLU 83 H GLU 83 8.539 11.842 -2.557 631 HA GLU 83 HA GLU 83 10.269 14.255 -2.442 632 HB2 GLU 83 HB2 GLU 83 8.992 12.934 -4.875 633 HB3 GLU 83 HB3 GLU 83 9.997 14.384 -4.901 634 HG2 GLU 83 HG2 GLU 83 11.866 13.011 -3.918 635 HG3 GLU 83 HG3 GLU 83 10.859 11.579 -4.129 636 H ALA 84 H ALA 84 6.951 13.186 -3.179 637 HA ALA 84 HA ALA 84 4.924 14.132 -3.035 638 HB1 ALA 84 HB1 ALA 84 4.503 15.966 -1.466 639 HB2 ALA 84 HB2 ALA 84 6.232 16.332 -1.402 640 HB3 ALA 84 HB3 ALA 84 5.631 14.800 -0.767 641 HA PRO 85 HA PRO 85 3.018 15.221 -3.099 642 HB2 PRO 85 HB2 PRO 85 0.956 16.085 -4.545 643 HB3 PRO 85 HB3 PRO 85 1.943 17.250 -3.645 644 HG2 PRO 85 HG2 PRO 85 1.975 16.614 -6.588 645 HG3 PRO 85 HG3 PRO 85 2.123 18.188 -5.786 646 HD2 PRO 85 HD2 PRO 85 4.274 16.570 -6.704 647 HD3 PRO 85 HD3 PRO 85 4.413 17.977 -5.625 648 H ASP 86 H ASP 86 4.549 13.977 -5.604 649 HA ASP 86 HA ASP 86 2.377 12.213 -6.584 650 HB2 ASP 86 HB2 ASP 86 3.500 12.190 -8.759 651 HB3 ASP 86 HB3 ASP 86 3.127 13.836 -8.272 652 H HIS 87 H HIS 87 5.962 12.235 -6.052 653 HA HIS 87 HA HIS 87 6.041 9.330 -6.418 654 HB2 HIS 87 HB2 HIS 87 7.719 10.810 -7.530 655 HB3 HIS 87 HB3 HIS 87 8.351 11.263 -5.954 656 HD1 HIS 87 HD1 HIS 87 10.527 10.257 -7.404 657 HD2 HIS 87 HD2 HIS 87 7.859 7.504 -5.811 658 HE1 HIS 87 HE1 HIS 87 11.776 8.094 -7.320 659 HE2 HIS 87 HE2 HIS 87 10.193 6.489 -6.225 660 H LEU 88 H LEU 88 5.783 8.005 -4.808 661 HA LEU 88 HA LEU 88 7.041 8.440 -2.168 662 HB2 LEU 88 HB2 LEU 88 4.619 8.746 -1.898 663 HB3 LEU 88 HB3 LEU 88 4.294 7.250 -2.754 664 HG LEU 88 HG LEU 88 5.312 5.958 -0.881 665 HD11 LEU 88 HD11 LEU 88 6.908 7.609 -0.038 666 HD12 LEU 88 HD12 LEU 88 5.858 7.031 1.253 667 HD13 LEU 88 HD13 LEU 88 5.582 8.624 0.540 668 HD21 LEU 88 HD21 LEU 88 3.522 6.290 0.756 669 HD22 LEU 88 HD22 LEU 88 2.896 6.337 -0.891 670 HD23 LEU 88 HD23 LEU 88 3.109 7.841 0.013 671 H GLU 89 H GLU 89 8.233 6.709 -1.481 672 HA GLU 89 HA GLU 89 7.704 3.998 -2.511 673 HB2 GLU 89 HB2 GLU 89 10.466 5.287 -2.293 674 HB3 GLU 89 HB3 GLU 89 10.214 3.552 -2.452 675 HG2 GLU 89 HG2 GLU 89 9.106 3.943 -4.638 676 HG3 GLU 89 HG3 GLU 89 9.447 5.668 -4.482 677 H PHE 90 H PHE 90 7.786 2.443 -0.948 678 HA PHE 90 HA PHE 90 9.134 2.840 1.586 679 HB2 PHE 90 HB2 PHE 90 7.147 2.503 3.015 680 HB3 PHE 90 HB3 PHE 90 6.977 3.967 2.059 681 HD1 PHE 90 HD2 PHE 90 5.708 0.518 2.569 682 HD2 PHE 90 HD1 PHE 90 5.237 4.147 0.349 683 HE1 PHE 90 HE2 PHE 90 3.507 -0.241 1.782 684 HE2 PHE 90 HE1 PHE 90 3.039 3.376 -0.425 685 HZ PHE 90 HZ PHE 90 2.173 1.186 0.283 686 H ASP 91 H ASP 91 8.643 0.865 3.050 687 HA ASP 91 HA ASP 91 8.497 -1.628 1.451 688 HB2 ASP 91 HB2 ASP 91 10.227 -1.005 3.890 689 HB3 ASP 91 HB3 ASP 91 10.048 -2.613 3.179 690 H ASP 92 H ASP 92 6.397 -2.201 1.859 691 HA ASP 92 HA ASP 92 5.288 -2.285 4.542 692 HB2 ASP 92 HB2 ASP 92 3.820 -1.864 2.594 693 HB3 ASP 92 HB3 ASP 92 4.266 -3.422 1.901 694 H GLY 93 H GLY 93 4.764 -4.250 5.662 695 HA2 GLY 93 HA2 GLY 93 5.430 -6.851 4.770 696 HA3 GLY 93 HA3 GLY 93 6.743 -6.235 5.768 697 H PHE 94 H PHE 94 5.294 -8.491 6.442 698 HA PHE 94 HA PHE 94 3.465 -7.756 8.625 699 HB2 PHE 94 HB2 PHE 94 4.329 -10.480 7.546 700 HB3 PHE 94 HB3 PHE 94 3.197 -10.251 8.878 701 HD1 PHE 94 HD2 PHE 94 0.940 -9.291 8.463 702 HD2 PHE 94 HD1 PHE 94 3.630 -10.115 5.238 703 HE1 PHE 94 HE2 PHE 94 -0.927 -9.154 6.867 704 HE2 PHE 94 HE1 PHE 94 1.757 -9.972 3.652 705 HZ PHE 94 HZ PHE 94 -0.521 -9.497 4.458 706 H ALA 95 H ALA 95 3.880 -8.254 10.777 707 HA ALA 95 HA ALA 95 6.664 -8.950 11.542 708 HB1 ALA 95 HB1 ALA 95 4.796 -6.996 12.925 709 HB2 ALA 95 HB2 ALA 95 6.197 -6.564 11.941 710 HB3 ALA 95 HB3 ALA 95 6.421 -7.433 13.460 711 H ASP 96 H ASP 96 6.884 -10.016 13.592 712 HA ASP 96 HA ASP 96 5.159 -12.220 13.954 713 HB2 ASP 96 HB2 ASP 96 6.622 -12.807 15.850 714 HB3 ASP 96 HB3 ASP 96 7.581 -12.255 14.487 715 H GLU 97 H GLU 97 5.604 -9.330 15.880 716 HA GLU 97 HA GLU 97 3.127 -8.681 16.756 717 HB2 GLU 97 HB2 GLU 97 2.865 -9.546 19.069 718 HB3 GLU 97 HB3 GLU 97 2.860 -10.854 17.898 719 HG2 GLU 97 HG2 GLU 97 5.217 -11.363 18.462 720 HG3 GLU 97 HG3 GLU 97 5.199 -10.076 19.658 721 H HIS 98 H HIS 98 6.533 -8.976 17.604 722 HA HIS 98 HA HIS 98 6.474 -6.566 19.302 723 HB2 HIS 98 HB2 HIS 98 8.843 -8.371 18.665 724 HB3 HIS 98 HB3 HIS 98 8.784 -7.123 19.904 725 HD1 HIS 98 HD1 HIS 98 6.849 -7.666 21.848 726 HD2 HIS 98 HD2 HIS 98 8.248 -10.835 19.563 727 HE1 HIS 98 HE1 HIS 98 6.218 -9.738 23.107 728 HE2 HIS 98 HE2 HIS 98 6.881 -11.630 21.601 729 H GLY 99 H GLY 99 6.961 -7.282 16.019 730 HA2 GLY 99 HA2 GLY 99 7.152 -5.377 14.498 731 HA3 GLY 99 HA3 GLY 99 8.367 -4.690 15.559 732 H ALA 100 H ALA 100 9.001 -7.955 15.408 733 HA ALA 100 HA ALA 100 11.245 -7.687 13.615 734 HB1 ALA 100 HB1 ALA 100 10.131 -10.163 14.980 735 HB2 ALA 100 HB2 ALA 100 11.395 -9.110 15.614 736 HB3 ALA 100 HB3 ALA 100 11.688 -10.053 14.151 737 HA PRO 101 HA PRO 101 8.781 -8.520 9.847 738 HB2 PRO 101 HB2 PRO 101 11.551 -9.076 8.759 739 HB3 PRO 101 HB3 PRO 101 10.258 -8.066 8.089 740 HG2 PRO 101 HG2 PRO 101 12.327 -6.916 9.293 741 HG3 PRO 101 HG3 PRO 101 10.683 -6.298 9.577 742 HD2 PRO 101 HD2 PRO 101 12.386 -8.046 11.360 743 HD3 PRO 101 HD3 PRO 101 11.343 -6.671 11.790 744 H VAL 102 H VAL 102 7.701 -10.417 9.630 745 HA VAL 102 HA VAL 102 8.683 -13.031 10.105 746 HB VAL 102 HB VAL 102 6.336 -12.158 8.343 747 HG11 VAL 102 HG11 VAL 102 6.933 -14.921 9.510 748 HG12 VAL 102 HG12 VAL 102 6.997 -14.481 7.801 749 HG13 VAL 102 HG13 VAL 102 5.454 -14.471 8.653 750 HG21 VAL 102 HG21 VAL 102 4.920 -12.649 10.321 751 HG22 VAL 102 HG22 VAL 102 6.098 -11.383 10.669 752 HG23 VAL 102 HG23 VAL 102 6.365 -13.022 11.265 753 H ASP 103 H ASP 103 10.357 -13.867 9.021 754 HA ASP 103 HA ASP 103 11.403 -12.770 6.613 755 HB2 ASP 103 HB2 ASP 103 12.766 -13.713 8.491 756 HB3 ASP 103 HB3 ASP 103 12.182 -15.322 8.090 757 H GLU 104 H GLU 104 9.412 -15.546 7.301 758 HA GLU 104 HA GLU 104 9.491 -16.975 4.888 759 HB2 GLU 104 HB2 GLU 104 8.447 -17.850 6.926 760 HB3 GLU 104 HB3 GLU 104 7.244 -16.563 6.905 761 HG2 GLU 104 HG2 GLU 104 6.313 -17.484 4.807 762 HG3 GLU 104 HG3 GLU 104 7.504 -18.781 4.857 763 H LEU 105 H LEU 105 7.335 -14.325 5.907 764 HA LEU 105 HA LEU 105 6.048 -14.102 3.303 765 HB2 LEU 105 HB2 LEU 105 5.769 -12.346 5.777 766 HB3 LEU 105 HB3 LEU 105 4.707 -12.336 4.371 767 HG LEU 105 HG LEU 105 5.014 -14.589 6.402 768 HD11 LEU 105 HD11 LEU 105 2.623 -12.828 5.798 769 HD12 LEU 105 HD12 LEU 105 3.660 -12.733 7.224 770 HD13 LEU 105 HD13 LEU 105 2.672 -14.166 6.951 771 HD21 LEU 105 HD21 LEU 105 3.315 -14.561 3.889 772 HD22 LEU 105 HD22 LEU 105 3.254 -15.791 5.155 773 HD23 LEU 105 HD23 LEU 105 4.719 -15.584 4.203 774 H GLY 106 H GLY 106 8.811 -12.774 4.862 775 HA2 GLY 106 HA2 GLY 106 10.540 -11.537 4.043 776 HA3 GLY 106 HA3 GLY 106 9.784 -11.641 2.465 777 H VAL 107 H VAL 107 10.545 -9.519 2.062 778 HA VAL 107 HA VAL 107 8.980 -7.302 3.287 779 HB VAL 107 HB VAL 107 11.765 -7.150 2.012 780 HG11 VAL 107 HG11 VAL 107 11.811 -4.801 2.846 781 HG12 VAL 107 HG12 VAL 107 10.151 -4.978 3.414 782 HG13 VAL 107 HG13 VAL 107 10.503 -5.056 1.687 783 HG21 VAL 107 HG21 VAL 107 12.619 -6.691 4.305 784 HG22 VAL 107 HG22 VAL 107 11.883 -8.292 4.193 785 HG23 VAL 107 HG23 VAL 107 11.002 -6.967 4.956 786 H THR 108 H THR 108 7.879 -5.936 1.843 787 HA THR 108 HA THR 108 8.391 -6.260 -1.054 788 HB THR 108 HB THR 108 6.354 -7.467 -0.742 789 HG1 THR 108 HG1 THR 108 6.426 -6.113 -2.570 790 HG21 THR 108 HG21 THR 108 5.575 -6.570 1.425 791 HG22 THR 108 HG22 THR 108 4.289 -6.502 0.220 792 HG23 THR 108 HG23 THR 108 5.165 -5.033 0.656 793 H HIS 109 H HIS 109 9.041 -4.452 -1.947 794 HA HIS 109 HA HIS 109 8.739 -1.873 -0.621 795 HB2 HIS 109 HB2 HIS 109 10.950 -2.695 -1.541 796 HB3 HIS 109 HB3 HIS 109 10.286 -2.551 -3.158 797 HD1 HIS 109 HD1 HIS 109 11.660 -0.566 -0.348 798 HD2 HIS 109 HD2 HIS 109 9.996 0.175 -4.064 799 HE1 HIS 109 HE1 HIS 109 12.173 1.812 -0.862 800 HE2 HIS 109 HE2 HIS 109 11.353 2.166 -3.187 801 H ALA 110 H ALA 110 6.806 -0.915 -1.020 802 HA ALA 110 HA ALA 110 5.505 -1.109 -3.660 803 HB1 ALA 110 HB1 ALA 110 4.146 -1.665 -1.696 804 HB2 ALA 110 HB2 ALA 110 3.499 -0.251 -2.531 805 HB3 ALA 110 HB3 ALA 110 4.413 -0.051 -1.034 806 H THR 111 H THR 111 5.544 0.533 -5.076 807 HA THR 111 HA THR 111 6.578 3.198 -4.267 808 HB THR 111 HB THR 111 6.664 1.889 -7.041 809 HG1 THR 111 HG1 THR 111 8.681 1.312 -6.556 810 HG21 THR 111 HG21 THR 111 7.860 4.514 -6.074 811 HG22 THR 111 HG22 THR 111 6.542 4.336 -7.234 812 HG23 THR 111 HG23 THR 111 8.162 3.774 -7.648 813 H VAL 112 H VAL 112 4.894 4.557 -4.009 814 HA VAL 112 HA VAL 112 2.440 4.319 -5.633 815 HB VAL 112 HB VAL 112 2.963 6.029 -3.157 816 HG11 VAL 112 HG11 VAL 112 1.147 6.944 -4.558 817 HG12 VAL 112 HG12 VAL 112 0.498 6.281 -3.058 818 HG13 VAL 112 HG13 VAL 112 0.338 5.373 -4.562 819 HG21 VAL 112 HG21 VAL 112 3.119 3.626 -2.615 820 HG22 VAL 112 HG22 VAL 112 1.540 3.343 -3.356 821 HG23 VAL 112 HG23 VAL 112 1.668 4.339 -1.903 822 H LYS 113 H LYS 113 2.217 5.636 -7.360 823 HA LYS 113 HA LYS 113 3.533 8.298 -7.399 824 HB2 LYS 113 HB2 LYS 113 3.343 6.319 -9.711 825 HB3 LYS 113 HB3 LYS 113 4.044 7.936 -9.799 826 HG2 LYS 113 HG2 LYS 113 5.793 7.270 -8.173 827 HG3 LYS 113 HG3 LYS 113 5.091 5.653 -8.077 828 HD2 LYS 113 HD2 LYS 113 6.435 6.942 -10.482 829 HD3 LYS 113 HD3 LYS 113 7.025 5.578 -9.521 830 HE2 LYS 113 HE2 LYS 113 5.099 4.221 -10.311 831 HE3 LYS 113 HE3 LYS 113 4.558 5.581 -11.295 832 HZ1 LYS 113 HZ1 LYS 113 6.632 5.463 -12.521 833 HZ2 LYS 113 HZ2 LYS 113 5.794 3.998 -12.595 834 HZ3 LYS 113 HZ3 LYS 113 7.134 4.152 -11.578 835 H LEU 114 H LEU 114 2.338 9.986 -8.218 836 HA LEU 114 HA LEU 114 -0.518 9.443 -8.830 837 HB2 LEU 114 HB2 LEU 114 0.670 11.834 -7.362 838 HB3 LEU 114 HB3 LEU 114 -1.030 11.630 -7.763 839 HG LEU 114 HG LEU 114 0.568 9.898 -5.823 840 HD11 LEU 114 HD11 LEU 114 0.039 12.108 -4.907 841 HD12 LEU 114 HD12 LEU 114 -0.878 10.853 -4.087 842 HD13 LEU 114 HD13 LEU 114 -1.669 11.882 -5.286 843 HD21 LEU 114 HD21 LEU 114 -2.358 9.699 -6.603 844 HD22 LEU 114 HD22 LEU 114 -1.579 8.806 -5.292 845 HD23 LEU 114 HD23 LEU 114 -1.088 8.523 -6.961 846 H GLU 115 H GLU 115 -1.305 10.203 -10.690 847 HA GLU 115 HA GLU 115 0.226 12.084 -12.354 848 HB2 GLU 115 HB2 GLU 115 -1.896 10.024 -13.058 849 HB3 GLU 115 HB3 GLU 115 -1.343 11.240 -14.199 850 HG2 GLU 115 HG2 GLU 115 -0.140 9.295 -14.751 851 HG3 GLU 115 HG3 GLU 115 0.997 10.336 -13.899 852 HA PRO 116 HA PRO 116 -3.145 15.028 -11.364 853 HB2 PRO 116 HB2 PRO 116 -2.101 17.182 -12.692 854 HB3 PRO 116 HB3 PRO 116 -1.501 16.645 -11.117 855 HG2 PRO 116 HG2 PRO 116 -0.358 16.134 -13.859 856 HG3 PRO 116 HG3 PRO 116 0.485 16.563 -12.357 857 HD2 PRO 116 HD2 PRO 116 0.346 13.998 -13.298 858 HD3 PRO 116 HD3 PRO 116 0.479 14.377 -11.576 859 H LEU 117 H LEU 117 -4.838 14.093 -12.522 860 HA LEU 117 HA LEU 117 -5.013 14.345 -15.448 861 HB2 LEU 117 HB2 LEU 117 -7.091 13.190 -13.548 862 HB3 LEU 117 HB3 LEU 117 -6.983 12.938 -15.282 863 HG LEU 117 HG LEU 117 -5.051 11.842 -13.199 864 HD11 LEU 117 HD11 LEU 117 -7.237 10.748 -13.112 865 HD12 LEU 117 HD12 LEU 117 -6.011 9.651 -13.740 866 HD13 LEU 117 HD13 LEU 117 -7.161 10.407 -14.844 867 HD21 LEU 117 HD21 LEU 117 -5.093 11.370 -16.202 868 HD22 LEU 117 HD22 LEU 117 -4.032 10.565 -15.038 869 HD23 LEU 117 HD23 LEU 117 -3.884 12.298 -15.310 870 H GLU 118 H GLU 118 -4.957 16.854 -14.244 871 HA GLU 118 HA GLU 118 -5.931 18.873 -14.020 872 HB2 GLU 118 HB2 GLU 118 -7.993 17.592 -15.847 873 HB3 GLU 118 HB3 GLU 118 -8.175 19.248 -15.298 874 HG2 GLU 118 HG2 GLU 118 -7.231 19.192 -17.522 875 HG3 GLU 118 HG3 GLU 118 -6.086 19.862 -16.368 876 H ASN 119 H ASN 119 -8.970 17.067 -14.031 877 HA ASN 119 HA ASN 119 -9.698 18.208 -11.404 878 HB2 ASN 119 HB2 ASN 119 -11.278 17.241 -13.810 879 HB3 ASN 119 HB3 ASN 119 -12.061 17.608 -12.268 880 HD21 ASN 119 HD21 ASN 119 -12.362 18.879 -14.892 881 HD22 ASN 119 HD22 ASN 119 -12.004 20.549 -14.653 882 H ARG 120 H ARG 120 -8.489 15.359 -12.626 883 HA ARG 120 HA ARG 120 -9.441 13.850 -10.252 884 HB2 ARG 120 HB2 ARG 120 -9.021 12.684 -13.046 885 HB3 ARG 120 HB3 ARG 120 -9.325 11.737 -11.589 886 HG2 ARG 120 HG2 ARG 120 -11.561 12.853 -11.392 887 HG3 ARG 120 HG3 ARG 120 -11.247 13.676 -12.928 888 HD2 ARG 120 HD2 ARG 120 -11.459 10.674 -12.474 889 HD3 ARG 120 HD3 ARG 120 -12.628 11.699 -13.315 890 HE ARG 120 HE ARG 120 -10.232 12.022 -14.653 891 HH11 ARG 120 HH11 ARG 120 -12.330 9.347 -14.021 892 HH12 ARG 120 HH12 ARG 120 -11.895 8.543 -15.484 893 HH21 ARG 120 HH21 ARG 120 -9.694 10.973 -16.489 894 HH22 ARG 120 HH22 ARG 120 -10.417 9.448 -16.859 895 H THR 121 H THR 121 -7.872 11.753 -10.118 896 HA THR 121 HA THR 121 -5.117 12.304 -10.953 897 HB THR 121 HB THR 121 -5.830 11.922 -8.008 898 HG1 THR 121 HG1 THR 121 -6.090 14.061 -8.797 899 HG21 THR 121 HG21 THR 121 -3.728 10.726 -8.510 900 HG22 THR 121 HG22 THR 121 -3.400 12.170 -7.552 901 HG23 THR 121 HG23 THR 121 -3.073 12.171 -9.289 902 H ARG 122 H ARG 122 -3.913 10.485 -11.282 903 HA ARG 122 HA ARG 122 -5.239 7.853 -10.982 904 HB2 ARG 122 HB2 ARG 122 -4.752 8.531 -13.300 905 HB3 ARG 122 HB3 ARG 122 -3.063 8.807 -12.888 906 HG2 ARG 122 HG2 ARG 122 -2.800 6.387 -12.412 907 HG3 ARG 122 HG3 ARG 122 -4.487 6.127 -12.880 908 HD2 ARG 122 HD2 ARG 122 -2.293 7.224 -14.680 909 HD3 ARG 122 HD3 ARG 122 -2.912 5.571 -14.703 910 HE ARG 122 HE ARG 122 -5.116 7.172 -15.089 911 HH11 ARG 122 HH11 ARG 122 -2.112 6.801 -16.771 912 HH12 ARG 122 HH12 ARG 122 -2.832 7.113 -18.309 913 HH21 ARG 122 HH21 ARG 122 -6.000 7.538 -17.055 914 HH22 ARG 122 HH22 ARG 122 -4.999 7.533 -18.466 915 H MET 123 H MET 123 -4.345 6.454 -9.561 916 HA MET 123 HA MET 123 -1.668 6.989 -8.412 917 HB2 MET 123 HB2 MET 123 -3.575 7.087 -6.817 918 HB3 MET 123 HB3 MET 123 -4.024 5.445 -7.250 919 HG2 MET 123 HG2 MET 123 -1.762 4.695 -6.392 920 HG3 MET 123 HG3 MET 123 -1.517 6.341 -5.804 921 HE1 MET 123 HE1 MET 123 -4.879 3.552 -4.339 922 HE2 MET 123 HE2 MET 123 -3.753 3.152 -5.630 923 HE3 MET 123 HE3 MET 123 -4.962 4.415 -5.870 924 H THR 124 H THR 124 -0.096 5.480 -8.724 925 HA THR 124 HA THR 124 -0.837 2.716 -9.525 926 HB THR 124 HB THR 124 1.525 4.284 -10.663 927 HG1 THR 124 HG1 THR 124 -0.296 5.060 -11.638 928 HG21 THR 124 HG21 THR 124 0.444 1.525 -11.382 929 HG22 THR 124 HG22 THR 124 1.952 1.839 -10.522 930 HG23 THR 124 HG23 THR 124 1.769 2.356 -12.200 931 H ILE 125 H ILE 125 -0.239 1.389 -7.947 932 HA ILE 125 HA ILE 125 2.125 1.966 -6.244 933 HB ILE 125 HB ILE 125 -0.181 0.035 -5.699 934 HG12 ILE 125 HG12 ILE 125 0.184 2.841 -4.543 935 HG13 ILE 125 HG13 ILE 125 -0.951 2.441 -5.828 936 HG21 ILE 125 HG21 ILE 125 0.646 0.061 -3.355 937 HG22 ILE 125 HG22 ILE 125 1.987 1.102 -3.838 938 HG23 ILE 125 HG23 ILE 125 1.874 -0.543 -4.472 939 HD11 ILE 125 HD11 ILE 125 -2.068 2.610 -3.698 940 HD12 ILE 125 HD12 ILE 125 -1.017 1.374 -3.009 941 HD13 ILE 125 HD13 ILE 125 -2.149 0.956 -4.294 942 H ILE 126 H ILE 126 3.917 0.824 -6.919 943 HA ILE 126 HA ILE 126 3.577 -1.871 -8.115 944 HB ILE 126 HB ILE 126 6.132 -0.170 -8.251 945 HG12 ILE 126 HG12 ILE 126 5.392 0.170 -10.762 946 HG13 ILE 126 HG13 ILE 126 3.769 -0.175 -10.179 947 HG21 ILE 126 HG21 ILE 126 6.461 -2.576 -8.596 948 HG22 ILE 126 HG22 ILE 126 6.747 -1.698 -10.099 949 HG23 ILE 126 HG23 ILE 126 5.238 -2.587 -9.871 950 HD11 ILE 126 HD11 ILE 126 3.907 1.754 -8.687 951 HD12 ILE 126 HD12 ILE 126 4.173 2.199 -10.372 952 HD13 ILE 126 HD13 ILE 126 5.544 2.086 -9.266 953 H SER 127 H SER 127 3.691 -3.313 -6.462 954 HA SER 127 HA SER 127 5.536 -2.988 -4.207 955 HB2 SER 127 HB2 SER 127 3.329 -5.044 -4.687 956 HB3 SER 127 HB3 SER 127 4.246 -4.850 -3.190 957 HG SER 127 HG SER 127 2.476 -3.661 -2.830 958 H THR 128 H THR 128 7.570 -3.665 -4.708 959 HA THR 128 HA THR 128 8.054 -6.031 -6.371 960 HB THR 128 HB THR 128 10.440 -5.340 -6.314 961 HG1 THR 128 HG1 THR 128 11.071 -3.516 -5.181 962 HG21 THR 128 HG21 THR 128 10.241 -3.199 -7.540 963 HG22 THR 128 HG22 THR 128 8.583 -3.012 -6.964 964 HG23 THR 128 HG23 THR 128 8.994 -4.334 -8.061 965 H PHE 129 H PHE 129 9.491 -7.753 -5.651 966 HA PHE 129 HA PHE 129 9.411 -8.220 -2.712 967 HB2 PHE 129 HB2 PHE 129 8.887 -10.269 -4.915 968 HB3 PHE 129 HB3 PHE 129 8.892 -10.604 -3.189 969 HD1 PHE 129 HD1 PHE 129 7.039 -9.758 -1.744 970 HD2 PHE 129 HD2 PHE 129 6.966 -9.212 -5.985 971 HE1 PHE 129 HE1 PHE 129 4.638 -9.231 -1.646 972 HE2 PHE 129 HE2 PHE 129 4.572 -8.688 -5.875 973 HZ PHE 129 HZ PHE 129 3.402 -8.693 -3.708 974 H GLU 130 H GLU 130 10.966 -9.799 -1.913 975 HA GLU 130 HA GLU 130 13.633 -9.539 -2.841 976 HB2 GLU 130 HB2 GLU 130 12.337 -11.447 -0.858 977 HB3 GLU 130 HB3 GLU 130 14.070 -11.443 -1.157 978 HG2 GLU 130 HG2 GLU 130 12.512 -9.029 -0.164 979 HG3 GLU 130 HG3 GLU 130 13.340 -10.174 0.890 980 H SER 131 H SER 131 11.280 -12.222 -3.128 981 HA SER 131 HA SER 131 12.793 -13.418 -5.333 982 HB2 SER 131 HB2 SER 131 12.969 -15.630 -4.289 983 HB3 SER 131 HB3 SER 131 13.758 -14.441 -3.251 984 HG SER 131 HG SER 131 12.524 -15.483 -1.841 985 H GLU 132 H GLU 132 11.687 -15.077 -6.414 986 HA GLU 132 HA GLU 132 9.011 -14.800 -7.014 987 HB2 GLU 132 HB2 GLU 132 10.626 -15.749 -8.559 988 HB3 GLU 132 HB3 GLU 132 10.982 -17.076 -7.471 989 HG2 GLU 132 HG2 GLU 132 8.202 -16.795 -8.608 990 HG3 GLU 132 HG3 GLU 132 9.490 -17.450 -9.613 991 H GLU 133 H GLU 133 10.558 -17.330 -4.959 992 HA GLU 133 HA GLU 133 8.178 -18.741 -4.339 993 HB2 GLU 133 HB2 GLU 133 9.482 -19.839 -2.551 994 HB3 GLU 133 HB3 GLU 133 10.354 -19.795 -4.078 995 HG2 GLU 133 HG2 GLU 133 11.738 -17.934 -3.259 996 HG3 GLU 133 HG3 GLU 133 10.838 -17.915 -1.741 997 H GLN 134 H GLN 134 9.703 -15.959 -2.725 998 HA GLN 134 HA GLN 134 8.016 -15.861 -0.408 999 HB2 GLN 134 HB2 GLN 134 10.134 -14.582 -0.538 1000 HB3 GLN 134 HB3 GLN 134 9.503 -13.631 -1.877 1001 HG2 GLN 134 HG2 GLN 134 7.601 -13.182 0.106 1002 HG3 GLN 134 HG3 GLN 134 9.082 -13.318 1.044 1003 HE21 GLN 134 HE21 GLN 134 7.403 -10.969 0.656 1004 HE22 GLN 134 HE22 GLN 134 8.415 -9.769 -0.066 1005 H MET 135 H MET 135 8.005 -14.230 -3.526 1006 HA MET 135 HA MET 135 5.647 -12.756 -3.415 1007 HB2 MET 135 HB2 MET 135 7.291 -12.291 -5.098 1008 HB3 MET 135 HB3 MET 135 7.255 -13.937 -5.708 1009 HG2 MET 135 HG2 MET 135 5.275 -13.602 -6.852 1010 HG3 MET 135 HG3 MET 135 4.824 -12.190 -5.895 1011 HE1 MET 135 HE1 MET 135 4.326 -10.386 -7.613 1012 HE2 MET 135 HE2 MET 135 4.257 -11.703 -8.787 1013 HE3 MET 135 HE3 MET 135 5.163 -10.237 -9.160 1014 H GLN 136 H GLN 136 6.104 -16.203 -4.142 1015 HA GLN 136 HA GLN 136 3.459 -16.696 -5.124 1016 HB2 GLN 136 HB2 GLN 136 5.408 -18.663 -3.849 1017 HB3 GLN 136 HB3 GLN 136 3.914 -19.109 -4.672 1018 HG2 GLN 136 HG2 GLN 136 6.454 -17.992 -5.851 1019 HG3 GLN 136 HG3 GLN 136 5.651 -19.511 -6.223 1020 HE21 GLN 136 HE21 GLN 136 5.763 -16.097 -6.839 1021 HE22 GLN 136 HE22 GLN 136 4.651 -16.078 -8.161 1022 H LYS 137 H LYS 137 4.961 -17.070 -1.864 1023 HA LYS 137 HA LYS 137 2.682 -18.099 -0.554 1024 HB2 LYS 137 HB2 LYS 137 4.937 -18.248 0.428 1025 HB3 LYS 137 HB3 LYS 137 4.983 -16.504 0.642 1026 HG2 LYS 137 HG2 LYS 137 4.511 -17.694 2.757 1027 HG3 LYS 137 HG3 LYS 137 3.200 -16.604 2.297 1028 HD2 LYS 137 HD2 LYS 137 1.950 -18.571 1.365 1029 HD3 LYS 137 HD3 LYS 137 3.233 -19.634 1.954 1030 HE2 LYS 137 HE2 LYS 137 1.534 -17.819 3.699 1031 HE3 LYS 137 HE3 LYS 137 1.242 -19.541 3.454 1032 HZ1 LYS 137 HZ1 LYS 137 3.372 -20.015 4.454 1033 HZ2 LYS 137 HZ2 LYS 137 2.427 -19.091 5.503 1034 HZ3 LYS 137 HZ3 LYS 137 3.692 -18.367 4.656 1035 H MET 138 H MET 138 3.687 -14.744 -1.101 1036 HA MET 138 HA MET 138 1.697 -13.338 0.313 1037 HB2 MET 138 HB2 MET 138 2.856 -12.598 -2.409 1038 HB3 MET 138 HB3 MET 138 2.134 -11.490 -1.250 1039 HG2 MET 138 HG2 MET 138 4.554 -13.024 -0.373 1040 HG3 MET 138 HG3 MET 138 4.778 -11.737 -1.547 1041 HE1 MET 138 HE1 MET 138 3.358 -11.095 2.813 1042 HE2 MET 138 HE2 MET 138 3.991 -12.622 2.198 1043 HE3 MET 138 HE3 MET 138 2.399 -12.056 1.682 1044 H ALA 139 H ALA 139 1.698 -14.650 -2.972 1045 HA ALA 139 HA ALA 139 -0.935 -13.868 -3.733 1046 HB1 ALA 139 HB1 ALA 139 0.895 -15.968 -4.940 1047 HB2 ALA 139 HB2 ALA 139 0.891 -14.249 -5.340 1048 HB3 ALA 139 HB3 ALA 139 -0.514 -15.244 -5.722 1049 H GLU 140 H GLU 140 0.338 -16.792 -2.189 1050 HA GLU 140 HA GLU 140 -1.844 -18.555 -2.672 1051 HB2 GLU 140 HB2 GLU 140 0.216 -18.580 -0.420 1052 HB3 GLU 140 HB3 GLU 140 -0.914 -19.893 -0.747 1053 HG2 GLU 140 HG2 GLU 140 1.225 -18.921 -2.665 1054 HG3 GLU 140 HG3 GLU 140 1.384 -20.309 -1.594 1055 H MET 141 H MET 141 -1.056 -16.426 0.062 1056 HA MET 141 HA MET 141 -3.452 -16.926 1.574 1057 HB2 MET 141 HB2 MET 141 -1.557 -14.544 1.704 1058 HB3 MET 141 HB3 MET 141 -2.727 -15.001 2.939 1059 HG2 MET 141 HG2 MET 141 -1.468 -17.089 3.347 1060 HG3 MET 141 HG3 MET 141 -0.301 -16.622 2.108 1061 HE1 MET 141 HE1 MET 141 -0.189 -13.374 2.755 1062 HE2 MET 141 HE2 MET 141 1.202 -14.364 2.311 1063 HE3 MET 141 HE3 MET 141 1.256 -13.367 3.766 1064 H GLY 142 H GLY 142 -2.682 -14.910 -1.149 1065 HA2 GLY 142 HA2 GLY 142 -4.107 -13.707 -2.532 1066 HA3 GLY 142 HA3 GLY 142 -5.410 -13.916 -1.371 1067 H MET 143 H MET 143 -2.303 -12.684 -0.364 1068 HA MET 143 HA MET 143 -3.188 -10.258 0.739 1069 HB2 MET 143 HB2 MET 143 -1.060 -11.311 1.393 1070 HB3 MET 143 HB3 MET 143 -0.403 -11.060 -0.218 1071 HG2 MET 143 HG2 MET 143 -0.645 -8.559 0.197 1072 HG3 MET 143 HG3 MET 143 -1.001 -8.960 1.881 1073 HE1 MET 143 HE1 MET 143 1.110 -7.294 2.498 1074 HE2 MET 143 HE2 MET 143 1.457 -7.050 0.784 1075 HE3 MET 143 HE3 MET 143 2.740 -7.563 1.881 1076 H GLU 144 H GLU 144 -1.985 -11.016 -2.497 1077 HA GLU 144 HA GLU 144 -1.670 -8.441 -3.560 1078 HB2 GLU 144 HB2 GLU 144 -1.879 -9.499 -5.771 1079 HB3 GLU 144 HB3 GLU 144 -0.855 -10.451 -4.709 1080 HG2 GLU 144 HG2 GLU 144 -2.562 -12.114 -4.413 1081 HG3 GLU 144 HG3 GLU 144 -3.774 -11.100 -5.190 1082 H GLU 145 H GLU 145 -4.582 -10.504 -3.425 1083 HA GLU 145 HA GLU 145 -6.347 -8.632 -4.712 1084 HB2 GLU 145 HB2 GLU 145 -6.953 -11.121 -3.061 1085 HB3 GLU 145 HB3 GLU 145 -8.132 -10.240 -4.034 1086 HG2 GLU 145 HG2 GLU 145 -6.802 -10.772 -6.072 1087 HG3 GLU 145 HG3 GLU 145 -5.681 -11.705 -5.081 1088 H GLY 146 H GLY 146 -5.480 -9.376 -1.366 1089 HA2 GLY 146 HA2 GLY 146 -7.494 -7.873 -0.028 1090 HA3 GLY 146 HA3 GLY 146 -5.938 -8.345 0.639 1091 H MET 147 H MET 147 -4.294 -7.005 -1.303 1092 HA MET 147 HA MET 147 -4.290 -4.301 -0.323 1093 HB2 MET 147 HB2 MET 147 -2.225 -5.706 -1.094 1094 HB3 MET 147 HB3 MET 147 -2.675 -5.242 -2.726 1095 HG2 MET 147 HG2 MET 147 -2.488 -2.840 -2.052 1096 HG3 MET 147 HG3 MET 147 -1.936 -3.361 -0.462 1097 HE1 MET 147 HE1 MET 147 0.456 -3.717 -4.398 1098 HE2 MET 147 HE2 MET 147 -1.042 -2.805 -4.201 1099 HE3 MET 147 HE3 MET 147 -1.074 -4.569 -4.180 1100 H ARG 148 H ARG 148 -5.384 -5.913 -3.268 1101 HA ARG 148 HA ARG 148 -6.028 -3.614 -4.808 1102 HB2 ARG 148 HB2 ARG 148 -5.842 -5.892 -5.777 1103 HB3 ARG 148 HB3 ARG 148 -7.272 -6.392 -4.880 1104 HG2 ARG 148 HG2 ARG 148 -8.622 -4.713 -6.160 1105 HG3 ARG 148 HG3 ARG 148 -7.182 -4.322 -7.110 1106 HD2 ARG 148 HD2 ARG 148 -7.099 -6.656 -7.925 1107 HD3 ARG 148 HD3 ARG 148 -8.529 -7.049 -6.962 1108 HE ARG 148 HE ARG 148 -8.414 -5.499 -9.436 1109 HH11 ARG 148 HH11 ARG 148 -10.433 -6.532 -6.814 1110 HH12 ARG 148 HH12 ARG 148 -11.879 -6.353 -7.735 1111 HH21 ARG 148 HH21 ARG 148 -10.281 -5.259 -10.570 1112 HH22 ARG 148 HH22 ARG 148 -11.795 -5.639 -9.829 1113 H GLU 149 H GLU 149 -7.929 -5.572 -2.493 1114 HA GLU 149 HA GLU 149 -10.402 -4.179 -2.686 1115 HB2 GLU 149 HB2 GLU 149 -9.267 -5.863 -0.417 1116 HB3 GLU 149 HB3 GLU 149 -10.921 -5.249 -0.453 1117 HG2 GLU 149 HG2 GLU 149 -11.363 -6.556 -2.491 1118 HG3 GLU 149 HG3 GLU 149 -9.712 -7.173 -2.459 1119 H ALA 150 H ALA 150 -7.535 -3.675 -0.693 1120 HA ALA 150 HA ALA 150 -8.393 -1.563 0.955 1121 HB1 ALA 150 HB1 ALA 150 -6.212 -2.700 1.210 1122 HB2 ALA 150 HB2 ALA 150 -6.006 -0.953 1.092 1123 HB3 ALA 150 HB3 ALA 150 -5.654 -1.980 -0.305 1124 H ILE 151 H ILE 151 -7.053 -1.523 -2.340 1125 HA ILE 151 HA ILE 151 -7.233 1.312 -2.745 1126 HB ILE 151 HB ILE 151 -6.845 -0.930 -4.772 1127 HG12 ILE 151 HG12 ILE 151 -4.729 0.837 -3.451 1128 HG13 ILE 151 HG13 ILE 151 -5.111 -0.792 -2.910 1129 HG21 ILE 151 HG21 ILE 151 -7.562 1.143 -5.889 1130 HG22 ILE 151 HG22 ILE 151 -5.869 0.810 -6.247 1131 HG23 ILE 151 HG23 ILE 151 -6.293 2.047 -5.062 1132 HD11 ILE 151 HD11 ILE 151 -3.115 -0.782 -4.250 1133 HD12 ILE 151 HD12 ILE 151 -3.972 -0.024 -5.590 1134 HD13 ILE 151 HD13 ILE 151 -4.388 -1.666 -5.090 1135 H GLU 152 H GLU 152 -9.411 -1.376 -3.308 1136 HA GLU 152 HA GLU 152 -11.362 0.024 -4.883 1137 HB2 GLU 152 HB2 GLU 152 -11.541 -2.523 -3.207 1138 HB3 GLU 152 HB3 GLU 152 -12.885 -1.905 -4.167 1139 HG2 GLU 152 HG2 GLU 152 -11.607 -2.178 -6.222 1140 HG3 GLU 152 HG3 GLU 152 -10.177 -2.660 -5.314 1141 H GLN 153 H GLN 153 -10.664 -0.190 -1.456 1142 HA GLN 153 HA GLN 153 -13.163 1.101 -0.649 1143 HB2 GLN 153 HB2 GLN 153 -12.144 -0.727 0.714 1144 HB3 GLN 153 HB3 GLN 153 -10.760 0.310 1.045 1145 HG2 GLN 153 HG2 GLN 153 -12.042 1.786 2.396 1146 HG3 GLN 153 HG3 GLN 153 -13.573 1.163 1.781 1147 HE21 GLN 153 HE21 GLN 153 -10.898 0.524 3.924 1148 HE22 GLN 153 HE22 GLN 153 -11.665 -0.723 4.828 1149 H ILE 154 H ILE 154 -9.922 2.078 -1.522 1150 HA ILE 154 HA ILE 154 -9.763 4.654 -0.400 1151 HB ILE 154 HB ILE 154 -8.809 3.652 -3.116 1152 HG12 ILE 154 HG12 ILE 154 -7.339 4.171 -0.499 1153 HG13 ILE 154 HG13 ILE 154 -7.718 2.595 -1.187 1154 HG21 ILE 154 HG21 ILE 154 -9.065 6.085 -3.312 1155 HG22 ILE 154 HG22 ILE 154 -7.357 5.658 -3.276 1156 HG23 ILE 154 HG23 ILE 154 -8.127 6.328 -1.836 1157 HD11 ILE 154 HD11 ILE 154 -6.219 3.085 -3.072 1158 HD12 ILE 154 HD12 ILE 154 -5.403 3.141 -1.512 1159 HD13 ILE 154 HD13 ILE 154 -5.823 4.639 -2.333 1160 H ASP 155 H ASP 155 -11.749 3.458 -3.033 1161 HA ASP 155 HA ASP 155 -12.693 5.819 -4.189 1162 HB2 ASP 155 HB2 ASP 155 -13.080 3.326 -4.869 1163 HB3 ASP 155 HB3 ASP 155 -14.417 3.345 -3.727 1164 H ALA 156 H ALA 156 -13.895 3.995 -1.367 1165 HA ALA 156 HA ALA 156 -16.002 5.772 -0.594 1166 HB1 ALA 156 HB1 ALA 156 -14.484 3.734 1.093 1167 HB2 ALA 156 HB2 ALA 156 -15.923 3.404 0.119 1168 HB3 ALA 156 HB3 ALA 156 -16.034 4.486 1.509 1169 H VAL 157 H VAL 157 -12.553 5.749 0.122 1170 HA VAL 157 HA VAL 157 -12.681 7.543 2.389 1171 HB VAL 157 HB VAL 157 -10.293 6.715 0.670 1172 HG11 VAL 157 HG11 VAL 157 -8.865 7.481 2.551 1173 HG12 VAL 157 HG12 VAL 157 -10.291 8.097 3.389 1174 HG13 VAL 157 HG13 VAL 157 -9.785 8.820 1.860 1175 HG21 VAL 157 HG21 VAL 157 -11.243 5.637 3.354 1176 HG22 VAL 157 HG22 VAL 157 -9.770 5.152 2.512 1177 HG23 VAL 157 HG23 VAL 157 -11.346 4.799 1.801 1178 H LEU 158 H LEU 158 -11.918 7.941 -1.077 1179 HA LEU 158 HA LEU 158 -11.421 10.810 -0.831 1180 HB2 LEU 158 HB2 LEU 158 -11.400 8.964 -3.247 1181 HB3 LEU 158 HB3 LEU 158 -11.005 10.678 -3.314 1182 HG LEU 158 HG LEU 158 -9.456 8.569 -1.746 1183 HD11 LEU 158 HD11 LEU 158 -7.661 8.943 -3.365 1184 HD12 LEU 158 HD12 LEU 158 -8.698 10.036 -4.288 1185 HD13 LEU 158 HD13 LEU 158 -9.115 8.324 -4.145 1186 HD21 LEU 158 HD21 LEU 158 -8.856 11.528 -2.107 1187 HD22 LEU 158 HD22 LEU 158 -7.808 10.347 -1.315 1188 HD23 LEU 158 HD23 LEU 158 -9.372 10.743 -0.611 1189 H SER 159 H SER 159 -14.132 8.802 -1.510 1190 HA SER 159 HA SER 159 -15.748 11.116 -2.480 1191 HB2 SER 159 HB2 SER 159 -15.624 9.011 -3.946 1192 HB3 SER 159 HB3 SER 159 -16.442 8.139 -2.667 1193 HG SER 159 HG SER 159 -17.941 8.829 -4.171 1194 H GLU 160 H GLU 160 -15.032 10.785 0.294 1195 HA GLU 160 HA GLU 160 -16.560 8.884 1.691 1196 HB2 GLU 160 HB2 GLU 160 -14.333 10.025 2.322 1197 HB3 GLU 160 HB3 GLU 160 -15.324 11.277 3.048 1198 HG2 GLU 160 HG2 GLU 160 -16.413 9.438 4.423 1199 HG3 GLU 160 HG3 GLU 160 -15.188 8.346 3.798 1200 HA PRO 161 HA PRO 161 -20.254 11.399 2.540 1201 HB2 PRO 161 HB2 PRO 161 -22.049 9.591 1.826 1202 HB3 PRO 161 HB3 PRO 161 -20.958 10.226 0.581 1203 HG2 PRO 161 HG2 PRO 161 -20.893 7.564 1.988 1204 HG3 PRO 161 HG3 PRO 161 -20.478 7.959 0.307 1205 HD2 PRO 161 HD2 PRO 161 -18.665 7.774 2.568 1206 HD3 PRO 161 HD3 PRO 161 -18.276 8.229 0.893 1207 H ALA 162 H ALA 162 -22.423 9.541 3.533 1208 HA ALA 162 HA ALA 162 -21.510 8.981 6.280 1209 HB1 ALA 162 HB1 ALA 162 -24.318 9.004 5.114 1210 HB2 ALA 162 HB2 ALA 162 -23.559 10.318 6.011 1211 HB3 ALA 162 HB3 ALA 162 -23.908 8.789 6.820 1212 H ASN 163 H ASN 163 -23.203 7.378 3.562 1213 HA ASN 163 HA ASN 163 -23.456 4.810 4.762 1214 HB2 ASN 163 HB2 ASN 163 -24.986 5.496 3.002 1215 HB3 ASN 163 HB3 ASN 163 -23.677 5.728 1.859 1216 HD21 ASN 163 HD21 ASN 163 -22.747 3.895 0.870 1217 HD22 ASN 163 HD22 ASN 163 -23.494 2.340 0.929 1218 H ALA 164 H ALA 164 -21.343 5.879 2.067 1219 HA ALA 164 HA ALA 164 -19.358 5.237 1.230 1220 HB1 ALA 164 HB1 ALA 164 -18.852 3.857 3.882 1221 HB2 ALA 164 HB2 ALA 164 -18.475 5.539 3.506 1222 HB3 ALA 164 HB3 ALA 164 -17.637 4.239 2.656 1223 H LEU 165 H LEU 165 -19.844 2.254 3.150 1224 HA LEU 165 HA LEU 165 -20.922 0.700 1.011 1225 HB2 LEU 165 HB2 LEU 165 -18.929 -0.872 0.777 1226 HB3 LEU 165 HB3 LEU 165 -18.768 0.703 0.033 1227 HG LEU 165 HG LEU 165 -17.380 1.394 2.109 1228 HD11 LEU 165 HD11 LEU 165 -17.954 -0.413 3.643 1229 HD12 LEU 165 HD12 LEU 165 -16.220 -0.377 3.347 1230 HD13 LEU 165 HD13 LEU 165 -17.221 -1.600 2.561 1231 HD21 LEU 165 HD21 LEU 165 -16.362 1.024 -0.085 1232 HD22 LEU 165 HD22 LEU 165 -16.226 -0.706 0.243 1233 HD23 LEU 165 HD23 LEU 165 -15.299 0.452 1.200 1234 H GLU 166 H GLU 166 -21.201 -1.612 1.593 1235 HA GLU 166 HA GLU 166 -20.561 -2.571 4.221 1236 HB2 GLU 166 HB2 GLU 166 -22.543 -1.171 4.768 1237 HB3 GLU 166 HB3 GLU 166 -23.501 -2.054 3.580 1238 HG2 GLU 166 HG2 GLU 166 -23.186 -4.134 4.903 1239 HG3 GLU 166 HG3 GLU 166 -22.266 -3.213 6.095 1240 H HIS 167 H HIS 167 -23.300 -3.336 1.997 1241 HA HIS 167 HA HIS 167 -22.166 -6.060 1.578 1242 HB2 HIS 167 HB2 HIS 167 -25.086 -5.178 1.515 1243 HB3 HIS 167 HB3 HIS 167 -24.512 -6.805 1.167 1244 HD1 HIS 167 HD1 HIS 167 -26.041 -5.026 3.791 1245 HD2 HIS 167 HD2 HIS 167 -22.933 -7.772 3.622 1246 HE1 HIS 167 HE1 HIS 167 -25.901 -6.020 6.089 1247 HE2 HIS 167 HE2 HIS 167 -24.181 -7.836 5.885 1248 H HIS 168 H HIS 168 -21.047 -5.841 -0.315 1249 HA HIS 168 HA HIS 168 -22.656 -5.420 -2.764 1250 HB2 HIS 168 HB2 HIS 168 -21.280 -3.362 -2.356 1251 HB3 HIS 168 HB3 HIS 168 -19.817 -4.338 -2.402 1252 HD1 HIS 168 HD1 HIS 168 -19.052 -5.194 -4.755 1253 HD2 HIS 168 HD2 HIS 168 -22.437 -2.796 -4.853 1254 HE1 HIS 168 HE1 HIS 168 -19.369 -4.600 -7.165 1255 HE2 HIS 168 HE2 HIS 168 -21.480 -3.236 -7.214 1256 H HIS 169 H HIS 169 -19.494 -6.538 -1.502 1257 HA HIS 169 HA HIS 169 -18.124 -8.281 -1.941 1258 HB2 HIS 169 HB2 HIS 169 -20.676 -9.643 -2.895 1259 HB3 HIS 169 HB3 HIS 169 -19.152 -10.476 -2.610 1260 HD1 HIS 169 HD1 HIS 169 -18.605 -11.113 -0.225 1261 HD2 HIS 169 HD2 HIS 169 -21.991 -8.729 -0.492 1262 HE1 HIS 169 HE1 HIS 169 -19.674 -11.231 2.035 1263 HE2 HIS 169 HE2 HIS 169 -21.806 -9.923 1.798 1264 H HIS 170 H HIS 170 -17.899 -10.152 -3.997 1265 HA HIS 170 HA HIS 170 -18.195 -8.747 -6.574 1266 HB2 HIS 170 HB2 HIS 170 -15.793 -8.542 -5.635 1267 HB3 HIS 170 HB3 HIS 170 -15.649 -10.281 -5.862 1268 HD1 HIS 170 HD1 HIS 170 -15.218 -11.110 -8.231 1269 HD2 HIS 170 HD2 HIS 170 -15.954 -7.033 -8.073 1270 HE1 HIS 170 HE1 HIS 170 -14.673 -10.251 -10.521 1271 HE2 HIS 170 HE2 HIS 170 -14.889 -7.758 -10.317 1272 H HIS 171 H HIS 171 -17.239 -11.823 -5.013 1273 HA HIS 171 HA HIS 171 -19.421 -13.252 -6.364 1274 HB2 HIS 171 HB2 HIS 171 -16.496 -14.090 -6.549 1275 HB3 HIS 171 HB3 HIS 171 -17.804 -15.248 -6.748 1276 HD1 HIS 171 HD1 HIS 171 -19.411 -14.842 -8.830 1277 HD2 HIS 171 HD2 HIS 171 -15.902 -12.619 -8.837 1278 HE1 HIS 171 HE1 HIS 171 -19.156 -14.002 -11.175 1279 HE2 HIS 171 HE2 HIS 171 -17.047 -12.645 -11.163 1280 H HIS 172 H HIS 172 -19.585 -15.562 -5.381 1281 HA HIS 172 HA HIS 172 -19.395 -15.404 -2.451 1282 HB2 HIS 172 HB2 HIS 172 -20.752 -17.431 -4.276 1283 HB3 HIS 172 HB3 HIS 172 -20.798 -17.501 -2.516 1284 HD1 HIS 172 HD1 HIS 172 -22.816 -16.442 -5.229 1285 HD2 HIS 172 HD2 HIS 172 -21.956 -14.871 -1.480 1286 HE1 HIS 172 HE1 HIS 172 -24.689 -14.857 -4.722 1287 HE2 HIS 172 HE2 HIS 172 -24.229 -14.037 -2.394 Start of MODEL 18 1 H1 THR 1 H1 THR 1 -12.970 1.344 -7.650 2 H2 THR 1 H2 THR 1 -13.140 2.990 -8.028 3 H3 THR 1 H3 THR 1 -11.623 2.372 -7.610 4 HA THR 1 HA THR 1 -13.198 1.667 -10.012 5 HB THR 1 HB THR 1 -11.088 2.672 -11.201 6 HG1 THR 1 HG1 THR 1 -10.778 4.484 -9.157 7 HG21 THR 1 HG21 THR 1 -13.302 3.722 -11.347 8 HG22 THR 1 HG22 THR 1 -12.024 4.931 -11.217 9 HG23 THR 1 HG23 THR 1 -13.023 4.550 -9.810 10 H VAL 2 H VAL 2 -9.769 1.559 -9.008 11 HA VAL 2 HA VAL 2 -8.083 0.213 -9.670 12 HB VAL 2 HB VAL 2 -9.993 -2.068 -9.005 13 HG11 VAL 2 HG11 VAL 2 -7.906 -2.816 -10.079 14 HG12 VAL 2 HG12 VAL 2 -7.931 -3.299 -8.384 15 HG13 VAL 2 HG13 VAL 2 -6.954 -1.920 -8.890 16 HG21 VAL 2 HG21 VAL 2 -9.149 -1.940 -6.677 17 HG22 VAL 2 HG22 VAL 2 -9.991 -0.460 -7.141 18 HG23 VAL 2 HG23 VAL 2 -8.226 -0.490 -7.092 19 H VAL 3 H VAL 3 -8.262 0.959 -11.861 20 HA VAL 3 HA VAL 3 -10.090 -0.222 -13.724 21 HB VAL 3 HB VAL 3 -9.003 1.274 -15.430 22 HG11 VAL 3 HG11 VAL 3 -9.792 2.628 -12.812 23 HG12 VAL 3 HG12 VAL 3 -10.896 2.105 -14.089 24 HG13 VAL 3 HG13 VAL 3 -9.748 3.409 -14.396 25 HG21 VAL 3 HG21 VAL 3 -7.242 2.157 -13.105 26 HG22 VAL 3 HG22 VAL 3 -7.307 2.930 -14.692 27 HG23 VAL 3 HG23 VAL 3 -6.688 1.283 -14.537 28 H SER 4 H SER 4 -6.798 -0.961 -12.849 29 HA SER 4 HA SER 4 -6.855 -3.405 -14.391 30 HB2 SER 4 HB2 SER 4 -6.018 -1.816 -16.138 31 HB3 SER 4 HB3 SER 4 -4.699 -1.343 -15.069 32 HG SER 4 HG SER 4 -3.639 -2.993 -15.808 33 H VAL 5 H VAL 5 -5.408 -4.957 -13.509 34 HA VAL 5 HA VAL 5 -3.309 -4.037 -11.623 35 HB VAL 5 HB VAL 5 -5.134 -6.443 -11.132 36 HG11 VAL 5 HG11 VAL 5 -2.723 -5.509 -9.514 37 HG12 VAL 5 HG12 VAL 5 -2.819 -6.994 -10.465 38 HG13 VAL 5 HG13 VAL 5 -3.837 -6.793 -9.040 39 HG21 VAL 5 HG21 VAL 5 -4.766 -3.900 -9.513 40 HG22 VAL 5 HG22 VAL 5 -5.803 -5.261 -9.075 41 HG23 VAL 5 HG23 VAL 5 -6.170 -4.298 -10.508 42 H ASP 6 H ASP 6 -1.524 -4.448 -12.694 43 HA ASP 6 HA ASP 6 -1.100 -6.932 -14.211 44 HB2 ASP 6 HB2 ASP 6 0.393 -4.278 -14.072 45 HB3 ASP 6 HB3 ASP 6 0.981 -5.655 -14.994 46 H LYS 7 H LYS 7 0.361 -8.474 -13.544 47 HA LYS 7 HA LYS 7 2.335 -7.817 -11.430 48 HB2 LYS 7 HB2 LYS 7 0.441 -9.146 -10.427 49 HB3 LYS 7 HB3 LYS 7 0.760 -10.437 -11.578 50 HG2 LYS 7 HG2 LYS 7 3.086 -10.652 -10.592 51 HG3 LYS 7 HG3 LYS 7 2.622 -9.460 -9.375 52 HD2 LYS 7 HD2 LYS 7 2.391 -11.643 -8.384 53 HD3 LYS 7 HD3 LYS 7 0.763 -11.017 -8.658 54 HE2 LYS 7 HE2 LYS 7 0.701 -12.388 -10.792 55 HE3 LYS 7 HE3 LYS 7 2.235 -13.103 -10.313 56 HZ1 LYS 7 HZ1 LYS 7 -0.329 -13.278 -8.833 57 HZ2 LYS 7 HZ2 LYS 7 1.142 -13.900 -8.285 58 HZ3 LYS 7 HZ3 LYS 7 0.431 -14.522 -9.685 59 H ASP 8 H ASP 8 4.353 -8.326 -12.091 60 HA ASP 8 HA ASP 8 4.693 -10.362 -14.238 61 HB2 ASP 8 HB2 ASP 8 5.259 -7.893 -14.815 62 HB3 ASP 8 HB3 ASP 8 6.666 -8.093 -13.774 63 H VAL 9 H VAL 9 5.395 -12.159 -13.349 64 HA VAL 9 HA VAL 9 6.655 -12.312 -10.763 65 HB VAL 9 HB VAL 9 6.136 -14.560 -12.767 66 HG11 VAL 9 HG11 VAL 9 6.505 -14.694 -9.749 67 HG12 VAL 9 HG12 VAL 9 7.661 -15.260 -10.959 68 HG13 VAL 9 HG13 VAL 9 6.094 -16.055 -10.794 69 HG21 VAL 9 HG21 VAL 9 4.038 -13.348 -12.307 70 HG22 VAL 9 HG22 VAL 9 4.292 -13.534 -10.570 71 HG23 VAL 9 HG23 VAL 9 4.001 -14.955 -11.577 72 H GLU 10 H GLU 10 7.825 -12.301 -14.049 73 HA GLU 10 HA GLU 10 10.458 -13.375 -13.494 74 HB2 GLU 10 HB2 GLU 10 9.479 -11.760 -15.888 75 HB3 GLU 10 HB3 GLU 10 10.988 -12.670 -15.807 76 HG2 GLU 10 HG2 GLU 10 8.191 -13.853 -15.689 77 HG3 GLU 10 HG3 GLU 10 9.246 -13.851 -17.100 78 H ALA 11 H ALA 11 8.988 -10.174 -13.634 79 HA ALA 11 HA ALA 11 11.515 -8.759 -13.151 80 HB1 ALA 11 HB1 ALA 11 10.164 -6.714 -13.399 81 HB2 ALA 11 HB2 ALA 11 8.686 -7.683 -13.472 82 HB3 ALA 11 HB3 ALA 11 9.888 -7.811 -14.756 83 H LEU 12 H LEU 12 9.312 -10.374 -11.253 84 HA LEU 12 HA LEU 12 8.680 -10.442 -9.082 85 HB2 LEU 12 HB2 LEU 12 11.208 -8.827 -8.576 86 HB3 LEU 12 HB3 LEU 12 10.348 -9.804 -7.395 87 HG LEU 12 HG LEU 12 11.862 -10.849 -9.825 88 HD11 LEU 12 HD11 LEU 12 13.349 -10.062 -8.044 89 HD12 LEU 12 HD12 LEU 12 13.415 -11.817 -8.187 90 HD13 LEU 12 HD13 LEU 12 12.507 -11.076 -6.866 91 HD21 LEU 12 HD21 LEU 12 9.921 -12.265 -9.400 92 HD22 LEU 12 HD22 LEU 12 10.362 -12.410 -7.696 93 HD23 LEU 12 HD23 LEU 12 11.401 -13.109 -8.942 94 H SER 13 H SER 13 7.590 -8.212 -10.610 95 HA SER 13 HA SER 13 7.230 -6.122 -8.526 96 HB2 SER 13 HB2 SER 13 6.733 -4.552 -10.418 97 HB3 SER 13 HB3 SER 13 8.371 -5.195 -10.471 98 HG SER 13 HG SER 13 7.720 -5.506 -12.494 99 H PHE 14 H PHE 14 5.156 -5.212 -8.278 100 HA PHE 14 HA PHE 14 2.863 -6.567 -9.564 101 HB2 PHE 14 HB2 PHE 14 3.247 -7.701 -7.426 102 HB3 PHE 14 HB3 PHE 14 3.306 -6.163 -6.569 103 HD1 PHE 14 HD1 PHE 14 0.970 -7.873 -8.965 104 HD2 PHE 14 HD2 PHE 14 1.404 -5.747 -5.276 105 HE1 PHE 14 HE1 PHE 14 -1.448 -8.034 -8.573 106 HE2 PHE 14 HE2 PHE 14 -1.017 -5.907 -4.904 107 HZ PHE 14 HZ PHE 14 -2.438 -7.050 -6.551 108 H SER 15 H SER 15 1.998 -4.895 -10.678 109 HA SER 15 HA SER 15 1.900 -2.165 -9.528 110 HB2 SER 15 HB2 SER 15 1.709 -1.441 -11.940 111 HB3 SER 15 HB3 SER 15 3.201 -2.294 -11.576 112 HG SER 15 HG SER 15 1.158 -3.938 -12.389 113 H ILE 16 H ILE 16 -0.088 -1.684 -8.664 114 HA ILE 16 HA ILE 16 -2.562 -2.524 -10.067 115 HB ILE 16 HB ILE 16 -2.251 -1.300 -7.286 116 HG12 ILE 16 HG12 ILE 16 -2.933 -4.157 -8.118 117 HG13 ILE 16 HG13 ILE 16 -1.414 -3.633 -7.397 118 HG21 ILE 16 HG21 ILE 16 -4.765 -2.307 -8.695 119 HG22 ILE 16 HG22 ILE 16 -4.399 -0.631 -8.284 120 HG23 ILE 16 HG23 ILE 16 -4.681 -1.809 -7.004 121 HD11 ILE 16 HD11 ILE 16 -4.121 -3.597 -6.066 122 HD12 ILE 16 HD12 ILE 16 -2.605 -3.045 -5.342 123 HD13 ILE 16 HD13 ILE 16 -2.810 -4.740 -5.775 124 H VAL 17 H VAL 17 -3.517 -1.094 -11.334 125 HA VAL 17 HA VAL 17 -2.916 1.790 -11.192 126 HB VAL 17 HB VAL 17 -4.037 0.146 -13.515 127 HG11 VAL 17 HG11 VAL 17 -3.061 3.028 -13.472 128 HG12 VAL 17 HG12 VAL 17 -4.740 2.510 -13.618 129 HG13 VAL 17 HG13 VAL 17 -3.592 2.143 -14.905 130 HG21 VAL 17 HG21 VAL 17 -1.697 -0.495 -13.033 131 HG22 VAL 17 HG22 VAL 17 -1.204 1.197 -13.133 132 HG23 VAL 17 HG23 VAL 17 -1.813 0.372 -14.569 133 H ALA 18 H ALA 18 -4.535 3.145 -10.602 134 HA ALA 18 HA ALA 18 -7.383 2.478 -10.942 135 HB1 ALA 18 HB1 ALA 18 -6.198 3.248 -8.242 136 HB2 ALA 18 HB2 ALA 18 -6.805 1.650 -8.681 137 HB3 ALA 18 HB3 ALA 18 -7.917 3.017 -8.594 138 H GLU 19 H GLU 19 -8.792 4.415 -10.601 139 HA GLU 19 HA GLU 19 -7.409 7.030 -10.918 140 HB2 GLU 19 HB2 GLU 19 -9.740 6.080 -12.658 141 HB3 GLU 19 HB3 GLU 19 -8.918 7.637 -12.766 142 HG2 GLU 19 HG2 GLU 19 -6.820 6.433 -13.400 143 HG3 GLU 19 HG3 GLU 19 -7.723 4.919 -13.389 144 H PHE 20 H PHE 20 -8.375 8.678 -9.746 145 HA PHE 20 HA PHE 20 -11.037 8.216 -8.506 146 HB2 PHE 20 HB2 PHE 20 -8.610 9.347 -7.032 147 HB3 PHE 20 HB3 PHE 20 -10.200 9.018 -6.341 148 HD1 PHE 20 HD1 PHE 20 -11.026 6.542 -6.399 149 HD2 PHE 20 HD2 PHE 20 -6.935 7.670 -6.951 150 HE1 PHE 20 HE1 PHE 20 -10.318 4.249 -5.870 151 HE2 PHE 20 HE2 PHE 20 -6.241 5.378 -6.415 152 HZ PHE 20 HZ PHE 20 -7.928 3.666 -5.881 153 H ASP 21 H ASP 21 -12.340 10.047 -8.256 154 HA ASP 21 HA ASP 21 -11.616 12.388 -9.839 155 HB2 ASP 21 HB2 ASP 21 -13.883 11.294 -9.946 156 HB3 ASP 21 HB3 ASP 21 -14.176 11.801 -8.284 157 H ALA 22 H ALA 22 -9.931 13.253 -8.590 158 HA ALA 22 HA ALA 22 -10.533 15.209 -6.586 159 HB1 ALA 22 HB1 ALA 22 -10.573 13.229 -5.099 160 HB2 ALA 22 HB2 ALA 22 -9.168 14.231 -4.733 161 HB3 ALA 22 HB3 ALA 22 -8.974 12.745 -5.667 162 H ASP 23 H ASP 23 -8.230 16.150 -5.737 163 HA ASP 23 HA ASP 23 -6.443 16.291 -8.069 164 HB2 ASP 23 HB2 ASP 23 -5.277 18.112 -6.926 165 HB3 ASP 23 HB3 ASP 23 -6.998 18.425 -6.960 166 H VAL 24 H VAL 24 -4.071 16.311 -7.587 167 HA VAL 24 HA VAL 24 -3.295 13.696 -7.003 168 HB VAL 24 HB VAL 24 -1.621 16.219 -7.327 169 HG11 VAL 24 HG11 VAL 24 0.289 14.752 -7.898 170 HG12 VAL 24 HG12 VAL 24 -0.685 13.333 -7.517 171 HG13 VAL 24 HG13 VAL 24 -0.250 14.467 -6.239 172 HG21 VAL 24 HG21 VAL 24 -2.373 14.073 -9.342 173 HG22 VAL 24 HG22 VAL 24 -1.330 15.464 -9.657 174 HG23 VAL 24 HG23 VAL 24 -3.034 15.711 -9.273 175 H LYS 25 H LYS 25 -2.953 16.658 -5.073 176 HA LYS 25 HA LYS 25 -1.405 15.408 -2.994 177 HB2 LYS 25 HB2 LYS 25 -2.803 18.108 -2.918 178 HB3 LYS 25 HB3 LYS 25 -1.576 17.532 -1.789 179 HG2 LYS 25 HG2 LYS 25 -0.197 17.258 -4.122 180 HG3 LYS 25 HG3 LYS 25 -1.277 18.574 -4.576 181 HD2 LYS 25 HD2 LYS 25 0.796 19.520 -3.748 182 HD3 LYS 25 HD3 LYS 25 -0.472 19.856 -2.565 183 HE2 LYS 25 HE2 LYS 25 0.326 18.008 -1.152 184 HE3 LYS 25 HE3 LYS 25 1.545 17.582 -2.358 185 HZ1 LYS 25 HZ1 LYS 25 1.411 20.119 -0.830 186 HZ2 LYS 25 HZ2 LYS 25 2.559 19.751 -2.016 187 HZ3 LYS 25 HZ3 LYS 25 2.509 18.854 -0.585 188 H ARG 26 H ARG 26 -4.824 15.890 -3.533 189 HA ARG 26 HA ARG 26 -5.695 15.365 -0.837 190 HB2 ARG 26 HB2 ARG 26 -6.993 16.592 -2.682 191 HB3 ARG 26 HB3 ARG 26 -7.348 15.019 -3.376 192 HG2 ARG 26 HG2 ARG 26 -8.065 15.570 -0.494 193 HG3 ARG 26 HG3 ARG 26 -9.080 16.224 -1.777 194 HD2 ARG 26 HD2 ARG 26 -9.668 14.052 -2.561 195 HD3 ARG 26 HD3 ARG 26 -8.393 13.277 -1.621 196 HE ARG 26 HE ARG 26 -9.666 13.856 0.398 197 HH11 ARG 26 HH11 ARG 26 -11.460 13.888 -2.579 198 HH12 ARG 26 HH12 ARG 26 -12.941 13.469 -1.796 199 HH21 ARG 26 HH21 ARG 26 -11.553 13.303 1.349 200 HH22 ARG 26 HH22 ARG 26 -12.996 13.156 0.409 201 H VAL 27 H VAL 27 -5.171 13.384 -3.750 202 HA VAL 27 HA VAL 27 -5.870 10.862 -2.515 203 HB VAL 27 HB VAL 27 -4.137 11.290 -5.000 204 HG11 VAL 27 HG11 VAL 27 -3.987 8.991 -4.100 205 HG12 VAL 27 HG12 VAL 27 -4.863 8.995 -5.630 206 HG13 VAL 27 HG13 VAL 27 -5.750 8.852 -4.111 207 HG21 VAL 27 HG21 VAL 27 -6.302 12.442 -5.295 208 HG22 VAL 27 HG22 VAL 27 -7.167 10.968 -4.855 209 HG23 VAL 27 HG23 VAL 27 -6.208 11.021 -6.336 210 H TRP 28 H TRP 28 -2.879 12.745 -2.882 211 HA TRP 28 HA TRP 28 -1.019 10.885 -1.818 212 HB2 TRP 28 HB2 TRP 28 -0.307 12.886 -3.054 213 HB3 TRP 28 HB3 TRP 28 -1.001 13.933 -1.830 214 HD1 TRP 28 HD1 TRP 28 0.571 14.591 0.195 215 HE1 TRP 28 HE1 TRP 28 2.982 14.015 0.852 216 HE3 TRP 28 HE3 TRP 28 1.457 10.864 -3.190 217 HZ2 TRP 28 HZ2 TRP 28 5.003 12.229 0.042 218 HZ3 TRP 28 HZ3 TRP 28 3.665 9.782 -3.189 219 HH2 TRP 28 HH2 TRP 28 5.401 10.455 -1.604 220 H ALA 29 H ALA 29 -3.296 13.068 -0.273 221 HA ALA 29 HA ALA 29 -2.241 13.242 2.321 222 HB1 ALA 29 HB1 ALA 29 -4.488 13.952 3.000 223 HB2 ALA 29 HB2 ALA 29 -5.152 13.344 1.481 224 HB3 ALA 29 HB3 ALA 29 -4.026 14.702 1.471 225 H ILE 30 H ILE 30 -4.151 10.636 0.846 226 HA ILE 30 HA ILE 30 -4.840 9.275 3.292 227 HB ILE 30 HB ILE 30 -5.689 7.469 1.970 228 HG12 ILE 30 HG12 ILE 30 -4.001 8.555 -0.321 229 HG13 ILE 30 HG13 ILE 30 -3.783 7.026 0.506 230 HG21 ILE 30 HG21 ILE 30 -7.027 9.535 1.838 231 HG22 ILE 30 HG22 ILE 30 -7.168 8.591 0.355 232 HG23 ILE 30 HG23 ILE 30 -6.140 10.027 0.388 233 HD11 ILE 30 HD11 ILE 30 -4.707 6.662 -1.651 234 HD12 ILE 30 HD12 ILE 30 -6.026 7.786 -1.339 235 HD13 ILE 30 HD13 ILE 30 -5.930 6.265 -0.444 236 H TRP 31 H TRP 31 -1.911 9.545 1.628 237 HA TRP 31 HA TRP 31 -0.723 7.107 2.804 238 HB2 TRP 31 HB2 TRP 31 0.354 9.090 0.739 239 HB3 TRP 31 HB3 TRP 31 1.217 7.663 1.313 240 HD1 TRP 31 HD1 TRP 31 -1.377 8.706 -1.243 241 HE1 TRP 31 HE1 TRP 31 -2.194 6.628 -2.526 242 HE3 TRP 31 HE3 TRP 31 0.763 5.079 1.652 243 HZ2 TRP 31 HZ2 TRP 31 -1.940 3.821 -2.342 244 HZ3 TRP 31 HZ3 TRP 31 0.442 2.723 1.030 245 HH2 TRP 31 HH2 TRP 31 -0.890 2.100 -0.916 246 H GLU 32 H GLU 32 -0.636 10.608 2.866 247 HA GLU 32 HA GLU 32 1.812 10.866 4.336 248 HB2 GLU 32 HB2 GLU 32 1.066 12.565 2.718 249 HB3 GLU 32 HB3 GLU 32 -0.341 12.931 3.711 250 HG2 GLU 32 HG2 GLU 32 1.005 13.908 5.430 251 HG3 GLU 32 HG3 GLU 32 2.490 13.256 4.740 252 H ASP 33 H ASP 33 -1.642 11.248 5.190 253 HA ASP 33 HA ASP 33 -1.025 11.762 8.000 254 HB2 ASP 33 HB2 ASP 33 -2.866 12.993 6.752 255 HB3 ASP 33 HB3 ASP 33 -3.735 11.474 6.642 256 HA PRO 34 HA PRO 34 -1.218 7.370 9.144 257 HB2 PRO 34 HB2 PRO 34 -1.758 7.632 11.855 258 HB3 PRO 34 HB3 PRO 34 -0.159 7.866 11.141 259 HG2 PRO 34 HG2 PRO 34 -2.240 9.943 11.838 260 HG3 PRO 34 HG3 PRO 34 -0.496 9.953 12.193 261 HD2 PRO 34 HD2 PRO 34 -1.458 11.363 10.124 262 HD3 PRO 34 HD3 PRO 34 0.081 10.488 9.968 263 H ARG 35 H ARG 35 -3.869 9.492 10.300 264 HA ARG 35 HA ARG 35 -5.769 7.383 10.757 265 HB2 ARG 35 HB2 ARG 35 -5.941 10.393 10.713 266 HB3 ARG 35 HB3 ARG 35 -7.431 9.466 10.654 267 HG2 ARG 35 HG2 ARG 35 -6.908 10.203 12.931 268 HG3 ARG 35 HG3 ARG 35 -6.958 8.448 12.809 269 HD2 ARG 35 HD2 ARG 35 -4.285 9.809 12.573 270 HD3 ARG 35 HD3 ARG 35 -5.037 9.716 14.166 271 HE ARG 35 HE ARG 35 -4.943 7.178 12.791 272 HH11 ARG 35 HH11 ARG 35 -3.081 9.290 14.817 273 HH12 ARG 35 HH12 ARG 35 -2.177 7.984 15.495 274 HH21 ARG 35 HH21 ARG 35 -3.760 5.559 13.697 275 HH22 ARG 35 HH22 ARG 35 -2.546 5.921 14.869 276 H GLN 36 H GLN 36 -5.221 9.677 8.088 277 HA GLN 36 HA GLN 36 -7.346 8.862 6.392 278 HB2 GLN 36 HB2 GLN 36 -4.655 10.108 5.731 279 HB3 GLN 36 HB3 GLN 36 -5.947 9.907 4.555 280 HG2 GLN 36 HG2 GLN 36 -6.407 11.472 7.094 281 HG3 GLN 36 HG3 GLN 36 -5.604 12.210 5.713 282 HE21 GLN 36 HE21 GLN 36 -7.217 13.701 5.434 283 HE22 GLN 36 HE22 GLN 36 -8.763 13.296 4.813 284 H LEU 37 H LEU 37 -4.139 7.498 6.928 285 HA LEU 37 HA LEU 37 -4.168 5.722 4.656 286 HB2 LEU 37 HB2 LEU 37 -2.070 6.484 5.616 287 HB3 LEU 37 HB3 LEU 37 -2.473 5.775 7.169 288 HG LEU 37 HG LEU 37 -2.244 3.503 6.237 289 HD11 LEU 37 HD11 LEU 37 -1.466 4.788 3.598 290 HD12 LEU 37 HD12 LEU 37 -2.976 3.919 3.910 291 HD13 LEU 37 HD13 LEU 37 -1.429 3.057 3.981 292 HD21 LEU 37 HD21 LEU 37 -0.273 4.604 7.182 293 HD22 LEU 37 HD22 LEU 37 0.150 5.249 5.592 294 HD23 LEU 37 HD23 LEU 37 0.169 3.502 5.876 295 H GLU 38 H GLU 38 -4.634 5.187 8.186 296 HA GLU 38 HA GLU 38 -5.402 2.424 7.940 297 HB2 GLU 38 HB2 GLU 38 -5.945 2.543 10.315 298 HB3 GLU 38 HB3 GLU 38 -4.439 3.399 10.011 299 HG2 GLU 38 HG2 GLU 38 -5.771 5.552 9.982 300 HG3 GLU 38 HG3 GLU 38 -7.162 4.617 10.535 301 H ARG 39 H ARG 39 -7.070 5.287 7.261 302 HA ARG 39 HA ARG 39 -9.761 4.708 7.786 303 HB2 ARG 39 HB2 ARG 39 -8.787 6.910 7.049 304 HB3 ARG 39 HB3 ARG 39 -8.538 6.237 5.449 305 HG2 ARG 39 HG2 ARG 39 -10.467 7.528 5.220 306 HG3 ARG 39 HG3 ARG 39 -11.088 5.885 5.382 307 HD2 ARG 39 HD2 ARG 39 -10.932 7.889 7.666 308 HD3 ARG 39 HD3 ARG 39 -12.357 7.623 6.665 309 HE ARG 39 HE ARG 39 -11.269 5.318 8.102 310 HH11 ARG 39 HH11 ARG 39 -13.738 7.713 7.973 311 HH12 ARG 39 HH12 ARG 39 -14.756 6.852 9.066 312 HH21 ARG 39 HH21 ARG 39 -12.560 4.255 9.481 313 HH22 ARG 39 HH22 ARG 39 -14.089 4.916 9.919 314 H TRP 40 H TRP 40 -7.560 3.424 5.405 315 HA TRP 40 HA TRP 40 -9.674 1.735 4.232 316 HB2 TRP 40 HB2 TRP 40 -8.833 2.204 1.945 317 HB3 TRP 40 HB3 TRP 40 -9.432 3.661 2.732 318 HD1 TRP 40 HD1 TRP 40 -7.575 5.533 3.436 319 HE1 TRP 40 HE1 TRP 40 -5.165 5.926 2.620 320 HE3 TRP 40 HE3 TRP 40 -6.759 1.057 1.156 321 HZ2 TRP 40 HZ2 TRP 40 -3.191 4.520 1.160 322 HZ3 TRP 40 HZ3 TRP 40 -4.604 0.643 0.064 323 HH2 TRP 40 HH2 TRP 40 -2.867 2.341 0.070 324 H TRP 41 H TRP 41 -6.528 1.890 5.530 325 HA TRP 41 HA TRP 41 -5.093 0.147 3.808 326 HB2 TRP 41 HB2 TRP 41 -4.060 1.770 5.462 327 HB3 TRP 41 HB3 TRP 41 -4.467 0.644 6.752 328 HD1 TRP 41 HD1 TRP 41 -2.432 -0.861 7.390 329 HE1 TRP 41 HE1 TRP 41 -0.360 -1.773 6.174 330 HE3 TRP 41 HE3 TRP 41 -3.300 1.025 2.707 331 HZ2 TRP 41 HZ2 TRP 41 0.756 -1.691 3.606 332 HZ3 TRP 41 HZ3 TRP 41 -1.685 0.552 0.931 333 HH2 TRP 41 HH2 TRP 41 0.310 -0.782 1.367 334 H GLY 42 H GLY 42 -5.435 -1.932 3.471 335 HA2 GLY 42 HA2 GLY 42 -5.776 -4.210 3.951 336 HA3 GLY 42 HA3 GLY 42 -6.292 -3.799 5.580 337 HA PRO 43 HA PRO 43 -10.095 -4.607 2.810 338 HB2 PRO 43 HB2 PRO 43 -10.612 -6.930 4.621 339 HB3 PRO 43 HB3 PRO 43 -10.587 -6.877 2.854 340 HG2 PRO 43 HG2 PRO 43 -8.632 -8.106 4.250 341 HG3 PRO 43 HG3 PRO 43 -8.293 -7.237 2.737 342 HD2 PRO 43 HD2 PRO 43 -7.882 -6.292 5.589 343 HD3 PRO 43 HD3 PRO 43 -6.784 -6.171 4.191 344 HA PRO 44 HA PRO 44 -12.955 -2.681 5.853 345 HB2 PRO 44 HB2 PRO 44 -15.044 -4.559 4.743 346 HB3 PRO 44 HB3 PRO 44 -15.110 -2.803 4.960 347 HG2 PRO 44 HG2 PRO 44 -14.751 -3.854 2.527 348 HG3 PRO 44 HG3 PRO 44 -13.879 -2.383 3.010 349 HD2 PRO 44 HD2 PRO 44 -12.862 -5.212 2.807 350 HD3 PRO 44 HD3 PRO 44 -12.045 -3.686 2.397 351 H THR 45 H THR 45 -12.764 -6.188 5.530 352 HA THR 45 HA THR 45 -13.927 -6.924 8.054 353 HB THR 45 HB THR 45 -12.893 -9.173 7.594 354 HG1 THR 45 HG1 THR 45 -11.715 -9.416 5.643 355 HG21 THR 45 HG21 THR 45 -14.304 -7.945 5.192 356 HG22 THR 45 HG22 THR 45 -15.095 -8.661 6.600 357 HG23 THR 45 HG23 THR 45 -14.139 -9.672 5.517 358 H TRP 46 H TRP 46 -10.611 -6.311 6.939 359 HA TRP 46 HA TRP 46 -9.594 -6.426 9.734 360 HB2 TRP 46 HB2 TRP 46 -8.208 -7.293 7.156 361 HB3 TRP 46 HB3 TRP 46 -7.348 -7.064 8.672 362 HD1 TRP 46 HD1 TRP 46 -10.240 -9.307 7.290 363 HE1 TRP 46 HE1 TRP 46 -10.146 -11.558 8.526 364 HE3 TRP 46 HE3 TRP 46 -6.387 -8.329 10.502 365 HZ2 TRP 46 HZ2 TRP 46 -8.644 -12.775 10.550 366 HZ3 TRP 46 HZ3 TRP 46 -5.669 -10.101 12.054 367 HH2 TRP 46 HH2 TRP 46 -6.774 -12.284 12.074 368 HA PRO 47 HA PRO 47 -8.715 -2.109 8.087 369 HB2 PRO 47 HB2 PRO 47 -9.907 -0.651 10.030 370 HB3 PRO 47 HB3 PRO 47 -10.847 -1.383 8.721 371 HG2 PRO 47 HG2 PRO 47 -10.439 -2.388 11.543 372 HG3 PRO 47 HG3 PRO 47 -11.947 -2.283 10.608 373 HD2 PRO 47 HD2 PRO 47 -10.488 -4.605 10.851 374 HD3 PRO 47 HD3 PRO 47 -11.510 -4.245 9.442 375 H ALA 48 H ALA 48 -6.843 -1.008 8.609 376 HA ALA 48 HA ALA 48 -5.138 -2.041 10.679 377 HB1 ALA 48 HB1 ALA 48 -4.265 -1.383 8.480 378 HB2 ALA 48 HB2 ALA 48 -3.448 -0.512 9.780 379 HB3 ALA 48 HB3 ALA 48 -4.681 0.300 8.809 380 H THR 49 H THR 49 -4.021 -0.794 12.284 381 HA THR 49 HA THR 49 -5.032 1.848 13.070 382 HB THR 49 HB THR 49 -4.933 -0.520 15.004 383 HG1 THR 49 HG1 THR 49 -6.940 0.720 13.603 384 HG21 THR 49 HG21 THR 49 -4.062 1.494 16.137 385 HG22 THR 49 HG22 THR 49 -5.663 1.080 16.755 386 HG23 THR 49 HG23 THR 49 -5.481 2.413 15.615 387 H PHE 50 H PHE 50 -3.264 3.056 13.089 388 HA PHE 50 HA PHE 50 -0.603 1.894 13.290 389 HB2 PHE 50 HB2 PHE 50 -1.643 4.607 12.384 390 HB3 PHE 50 HB3 PHE 50 0.080 4.320 12.629 391 HD1 PHE 50 HD1 PHE 50 -2.882 2.916 10.788 392 HD2 PHE 50 HD2 PHE 50 1.371 3.407 10.863 393 HE1 PHE 50 HE1 PHE 50 -2.718 1.864 8.572 394 HE2 PHE 50 HE2 PHE 50 1.520 2.353 8.646 395 HZ PHE 50 HZ PHE 50 -0.519 1.578 7.503 396 H GLU 51 H GLU 51 0.109 1.573 15.279 397 HA GLU 51 HA GLU 51 -0.105 3.177 17.580 398 HB2 GLU 51 HB2 GLU 51 2.218 1.417 16.670 399 HB3 GLU 51 HB3 GLU 51 1.965 1.986 18.319 400 HG2 GLU 51 HG2 GLU 51 -0.010 0.218 16.843 401 HG3 GLU 51 HG3 GLU 51 1.292 -0.417 17.838 402 H THR 52 H THR 52 2.211 3.211 14.884 403 HA THR 52 HA THR 52 2.726 6.059 15.276 404 HB THR 52 HB THR 52 4.561 4.966 16.576 405 HG1 THR 52 HG1 THR 52 6.065 5.963 14.520 406 HG21 THR 52 HG21 THR 52 4.838 2.873 15.286 407 HG22 THR 52 HG22 THR 52 6.365 3.741 15.437 408 HG23 THR 52 HG23 THR 52 5.469 3.796 13.919 409 H HIS 53 H HIS 53 3.587 7.081 13.379 410 HA HIS 53 HA HIS 53 4.090 5.573 10.944 411 HB2 HIS 53 HB2 HIS 53 1.619 5.754 10.900 412 HB3 HIS 53 HB3 HIS 53 1.720 7.497 11.116 413 HD2 HIS 53 HD2 HIS 53 2.130 4.830 8.271 414 HE1 HIS 53 HE1 HIS 53 2.258 8.712 6.605 415 HE2 HIS 53 HE2 HIS 53 1.937 6.258 6.122 416 H GLU 54 H GLU 54 6.142 6.476 11.090 417 HA GLU 54 HA GLU 54 6.573 9.361 11.155 418 HB2 GLU 54 HB2 GLU 54 8.652 7.181 10.624 419 HB3 GLU 54 HB3 GLU 54 8.957 8.845 11.124 420 HG2 GLU 54 HG2 GLU 54 7.643 6.681 12.773 421 HG3 GLU 54 HG3 GLU 54 9.292 7.274 12.959 422 H PHE 55 H PHE 55 5.535 10.062 9.203 423 HA PHE 55 HA PHE 55 6.269 9.020 6.636 424 HB2 PHE 55 HB2 PHE 55 4.048 10.191 7.309 425 HB3 PHE 55 HB3 PHE 55 4.920 11.711 7.128 426 HD1 PHE 55 HD1 PHE 55 4.108 8.559 5.299 427 HD2 PHE 55 HD2 PHE 55 5.020 12.711 4.956 428 HE1 PHE 55 HE1 PHE 55 3.646 8.459 2.886 429 HE2 PHE 55 HE2 PHE 55 4.551 12.611 2.544 430 HZ PHE 55 HZ PHE 55 3.863 10.485 1.508 431 H THR 56 H THR 56 8.615 9.195 7.219 432 HA THR 56 HA THR 56 9.782 11.527 5.857 433 HB THR 56 HB THR 56 10.033 12.138 8.215 434 HG1 THR 56 HG1 THR 56 11.808 12.681 6.956 435 HG21 THR 56 HG21 THR 56 9.848 9.905 9.256 436 HG22 THR 56 HG22 THR 56 11.298 10.738 9.819 437 HG23 THR 56 HG23 THR 56 11.430 9.460 8.609 438 H VAL 57 H VAL 57 11.988 11.102 5.082 439 HA VAL 57 HA VAL 57 12.346 8.497 3.948 440 HB VAL 57 HB VAL 57 14.204 10.921 4.048 441 HG11 VAL 57 HG11 VAL 57 15.506 9.826 2.216 442 HG12 VAL 57 HG12 VAL 57 14.546 8.361 2.442 443 HG13 VAL 57 HG13 VAL 57 15.595 8.934 3.739 444 HG21 VAL 57 HG21 VAL 57 12.114 11.297 2.777 445 HG22 VAL 57 HG22 VAL 57 12.435 9.862 1.799 446 HG23 VAL 57 HG23 VAL 57 13.507 11.261 1.690 447 H GLY 58 H GLY 58 13.182 6.756 4.931 448 HA2 GLY 58 HA2 GLY 58 14.664 5.452 6.183 449 HA3 GLY 58 HA3 GLY 58 15.323 6.895 6.929 450 H GLY 59 H GLY 59 12.000 7.139 7.120 451 HA2 GLY 59 HA2 GLY 59 11.929 6.346 9.945 452 HA3 GLY 59 HA3 GLY 59 10.707 7.261 9.074 453 H LYS 60 H LYS 60 10.038 5.159 10.807 454 HA LYS 60 HA LYS 60 8.988 3.081 8.966 455 HB2 LYS 60 HB2 LYS 60 9.937 2.741 11.843 456 HB3 LYS 60 HB3 LYS 60 8.958 1.542 11.001 457 HG2 LYS 60 HG2 LYS 60 10.841 1.514 9.229 458 HG3 LYS 60 HG3 LYS 60 11.814 2.361 10.438 459 HD2 LYS 60 HD2 LYS 60 11.442 0.481 12.030 460 HD3 LYS 60 HD3 LYS 60 10.471 -0.353 10.814 461 HE2 LYS 60 HE2 LYS 60 12.692 -1.320 10.852 462 HE3 LYS 60 HE3 LYS 60 12.487 -0.444 9.333 463 HZ1 LYS 60 HZ1 LYS 60 14.641 -0.019 10.321 464 HZ2 LYS 60 HZ2 LYS 60 13.920 0.551 11.736 465 HZ3 LYS 60 HZ3 LYS 60 13.723 1.400 10.289 466 H ALA 61 H ALA 61 7.100 1.898 9.951 467 HA ALA 61 HA ALA 61 5.350 3.532 11.686 468 HB1 ALA 61 HB1 ALA 61 4.622 3.953 9.353 469 HB2 ALA 61 HB2 ALA 61 3.390 3.086 10.266 470 HB3 ALA 61 HB3 ALA 61 4.397 2.220 9.103 471 H ALA 62 H ALA 62 4.066 2.324 13.078 472 HA ALA 62 HA ALA 62 4.246 -0.650 12.951 473 HB1 ALA 62 HB1 ALA 62 4.130 1.090 15.450 474 HB2 ALA 62 HB2 ALA 62 5.528 0.176 14.880 475 HB3 ALA 62 HB3 ALA 62 4.081 -0.679 15.424 476 H TYR 63 H TYR 63 2.320 -1.634 12.790 477 HA TYR 63 HA TYR 63 -0.135 -0.428 13.798 478 HB2 TYR 63 HB2 TYR 63 -1.300 -0.457 11.623 479 HB3 TYR 63 HB3 TYR 63 0.073 0.635 11.583 480 HD1 TYR 63 HD1 TYR 63 2.155 -0.016 10.306 481 HD2 TYR 63 HD2 TYR 63 -1.408 -2.370 10.117 482 HE1 TYR 63 HE1 TYR 63 2.975 -1.100 8.269 483 HE2 TYR 63 HE2 TYR 63 -0.579 -3.455 8.079 484 HH TYR 63 HH TYR 63 2.640 -3.140 6.969 485 H TYR 64 H TYR 64 -2.045 -1.829 13.217 486 HA TYR 64 HA TYR 64 -1.541 -4.609 12.544 487 HB2 TYR 64 HB2 TYR 64 -2.823 -5.408 14.622 488 HB3 TYR 64 HB3 TYR 64 -1.192 -4.826 14.914 489 HD1 TYR 64 HD2 TYR 64 -0.803 -2.690 16.124 490 HD2 TYR 64 HD1 TYR 64 -4.776 -4.153 15.503 491 HE1 TYR 64 HE2 TYR 64 -1.658 -1.114 17.784 492 HE2 TYR 64 HE1 TYR 64 -5.622 -2.564 17.170 493 HH TYR 64 HH TYR 64 -3.702 0.025 18.377 494 H MET 65 H MET 65 -3.253 -5.426 11.410 495 HA MET 65 HA MET 65 -5.646 -3.819 11.010 496 HB2 MET 65 HB2 MET 65 -4.687 -6.439 9.794 497 HB3 MET 65 HB3 MET 65 -6.277 -5.770 9.447 498 HG2 MET 65 HG2 MET 65 -4.803 -5.166 7.658 499 HG3 MET 65 HG3 MET 65 -5.169 -3.707 8.573 500 HE1 MET 65 HE1 MET 65 -2.538 -6.684 9.079 501 HE2 MET 65 HE2 MET 65 -1.095 -5.876 8.463 502 HE3 MET 65 HE3 MET 65 -2.448 -6.209 7.382 503 H THR 66 H THR 66 -7.025 -3.865 12.707 504 HA THR 66 HA THR 66 -7.339 -6.089 14.484 505 HB THR 66 HB THR 66 -9.120 -3.623 14.218 506 HG1 THR 66 HG1 THR 66 -7.781 -2.708 15.741 507 HG21 THR 66 HG21 THR 66 -8.789 -5.565 16.546 508 HG22 THR 66 HG22 THR 66 -10.223 -5.427 15.522 509 HG23 THR 66 HG23 THR 66 -9.754 -4.087 16.572 510 H GLY 67 H GLY 67 -8.090 -7.904 13.533 511 HA2 GLY 67 HA2 GLY 67 -9.919 -8.112 11.412 512 HA3 GLY 67 HA3 GLY 67 -9.415 -9.422 12.460 513 HA PRO 68 HA PRO 68 -14.019 -8.270 13.007 514 HB2 PRO 68 HB2 PRO 68 -15.174 -10.552 12.025 515 HB3 PRO 68 HB3 PRO 68 -14.711 -9.197 10.987 516 HG2 PRO 68 HG2 PRO 68 -13.209 -11.760 11.533 517 HG3 PRO 68 HG3 PRO 68 -13.510 -10.957 9.976 518 HD2 PRO 68 HD2 PRO 68 -11.146 -10.714 11.307 519 HD3 PRO 68 HD3 PRO 68 -11.807 -9.397 10.313 520 H ASP 69 H ASP 69 -11.982 -10.889 13.963 521 HA ASP 69 HA ASP 69 -13.688 -11.704 16.235 522 HB2 ASP 69 HB2 ASP 69 -11.042 -12.884 15.276 523 HB3 ASP 69 HB3 ASP 69 -12.144 -13.594 16.457 524 H GLY 70 H GLY 70 -11.576 -9.283 15.687 525 HA2 GLY 70 HA2 GLY 70 -10.264 -7.915 17.001 526 HA3 GLY 70 HA3 GLY 70 -10.677 -8.905 18.395 527 H THR 71 H THR 71 -9.280 -10.383 15.569 528 HA THR 71 HA THR 71 -7.249 -11.688 17.035 529 HB THR 71 HB THR 71 -7.443 -11.411 14.002 530 HG1 THR 71 HG1 THR 71 -8.402 -13.666 14.472 531 HG21 THR 71 HG21 THR 71 -6.034 -13.515 15.707 532 HG22 THR 71 HG22 THR 71 -5.246 -12.304 14.689 533 HG23 THR 71 HG23 THR 71 -6.222 -13.575 13.953 534 H LYS 72 H LYS 72 -7.054 -8.941 14.765 535 HA LYS 72 HA LYS 72 -5.555 -7.312 14.351 536 HB2 LYS 72 HB2 LYS 72 -4.389 -8.113 17.047 537 HB3 LYS 72 HB3 LYS 72 -3.893 -6.681 16.141 538 HG2 LYS 72 HG2 LYS 72 -6.109 -5.716 16.338 539 HG3 LYS 72 HG3 LYS 72 -6.733 -7.187 17.087 540 HD2 LYS 72 HD2 LYS 72 -5.294 -6.826 19.050 541 HD3 LYS 72 HD3 LYS 72 -4.594 -5.389 18.294 542 HE2 LYS 72 HE2 LYS 72 -6.798 -4.288 18.325 543 HE3 LYS 72 HE3 LYS 72 -7.523 -5.730 19.041 544 HZ1 LYS 72 HZ1 LYS 72 -5.442 -4.025 20.285 545 HZ2 LYS 72 HZ2 LYS 72 -6.097 -5.426 20.967 546 HZ3 LYS 72 HZ3 LYS 72 -7.079 -4.078 20.702 547 H ALA 73 H ALA 73 -4.430 -7.808 12.560 548 HA ALA 73 HA ALA 73 -2.179 -9.717 12.615 549 HB1 ALA 73 HB1 ALA 73 -3.785 -9.957 10.770 550 HB2 ALA 73 HB2 ALA 73 -2.197 -9.502 10.153 551 HB3 ALA 73 HB3 ALA 73 -3.482 -8.294 10.259 552 H ARG 74 H ARG 74 -0.353 -8.776 13.377 553 HA ARG 74 HA ARG 74 0.164 -5.973 13.360 554 HB2 ARG 74 HB2 ARG 74 0.959 -7.673 15.077 555 HB3 ARG 74 HB3 ARG 74 2.146 -8.220 13.904 556 HG2 ARG 74 HG2 ARG 74 3.326 -6.773 15.352 557 HG3 ARG 74 HG3 ARG 74 3.048 -5.814 13.897 558 HD2 ARG 74 HD2 ARG 74 2.661 -4.529 15.996 559 HD3 ARG 74 HD3 ARG 74 1.209 -4.630 14.991 560 HE ARG 74 HE ARG 74 0.990 -6.735 16.729 561 HH11 ARG 74 HH11 ARG 74 1.399 -3.336 17.222 562 HH12 ARG 74 HH12 ARG 74 0.482 -3.345 18.687 563 HH21 ARG 74 HH21 ARG 74 -0.169 -6.716 18.571 564 HH22 ARG 74 HH22 ARG 74 -0.388 -5.241 19.445 565 H GLY 75 H GLY 75 1.425 -4.730 12.003 566 HA2 GLY 75 HA2 GLY 75 3.315 -5.960 10.104 567 HA3 GLY 75 HA3 GLY 75 2.043 -4.920 9.468 568 H TRP 76 H TRP 76 4.668 -4.310 9.002 569 HA TRP 76 HA TRP 76 5.006 -1.757 10.452 570 HB2 TRP 76 HB2 TRP 76 7.455 -2.096 10.573 571 HB3 TRP 76 HB3 TRP 76 6.622 -3.391 11.428 572 HD1 TRP 76 HD1 TRP 76 6.568 -5.841 10.147 573 HE1 TRP 76 HE1 TRP 76 8.201 -6.888 8.479 574 HE3 TRP 76 HE3 TRP 76 9.136 -1.635 8.750 575 HZ2 TRP 76 HZ2 TRP 76 10.303 -6.076 6.810 576 HZ3 TRP 76 HZ3 TRP 76 10.964 -1.868 7.112 577 HH2 TRP 76 HH2 TRP 76 11.535 -4.048 6.161 578 H TRP 77 H TRP 77 5.866 -0.067 9.179 579 HA TRP 77 HA TRP 77 6.452 -0.615 6.315 580 HB2 TRP 77 HB2 TRP 77 5.294 1.830 7.680 581 HB3 TRP 77 HB3 TRP 77 6.134 2.000 6.149 582 HD1 TRP 77 HD1 TRP 77 3.938 -1.098 6.447 583 HE1 TRP 77 HE1 TRP 77 1.848 -0.761 5.002 584 HE3 TRP 77 HE3 TRP 77 4.552 3.813 5.311 585 HZ2 TRP 77 HZ2 TRP 77 0.623 1.351 3.548 586 HZ3 TRP 77 HZ3 TRP 77 2.900 4.930 3.871 587 HH2 TRP 77 HH2 TRP 77 0.975 3.715 3.009 588 H GLN 78 H GLN 78 8.233 0.564 5.352 589 HA GLN 78 HA GLN 78 9.734 2.414 7.020 590 HB2 GLN 78 HB2 GLN 78 10.948 0.288 7.400 591 HB3 GLN 78 HB3 GLN 78 11.183 0.093 5.662 592 HG2 GLN 78 HG2 GLN 78 12.609 2.046 5.568 593 HG3 GLN 78 HG3 GLN 78 12.219 2.481 7.229 594 HE21 GLN 78 HE21 GLN 78 14.405 2.508 7.796 595 HE22 GLN 78 HE22 GLN 78 15.341 1.068 7.962 596 H PHE 79 H PHE 79 9.746 4.191 5.875 597 HA PHE 79 HA PHE 79 9.440 4.293 3.011 598 HB2 PHE 79 HB2 PHE 79 10.068 6.545 4.968 599 HB3 PHE 79 HB3 PHE 79 9.498 6.734 3.313 600 HD1 PHE 79 HD2 PHE 79 7.135 6.258 2.735 601 HD2 PHE 79 HD1 PHE 79 8.531 5.908 6.760 602 HE1 PHE 79 HE2 PHE 79 4.817 6.286 3.547 603 HE2 PHE 79 HE1 PHE 79 6.210 5.932 7.562 604 HZ PHE 79 HZ PHE 79 4.355 6.127 5.962 605 H THR 80 H THR 80 11.036 4.453 1.499 606 HA THR 80 HA THR 80 13.839 4.990 2.332 607 HB THR 80 HB THR 80 14.525 3.955 0.213 608 HG1 THR 80 HG1 THR 80 13.158 3.655 -1.378 609 HG21 THR 80 HG21 THR 80 14.169 2.415 2.116 610 HG22 THR 80 HG22 THR 80 13.764 1.630 0.586 611 HG23 THR 80 HG23 THR 80 12.478 2.213 1.644 612 H THR 81 H THR 81 11.239 6.068 0.242 613 HA THR 81 HA THR 81 12.677 8.557 -0.421 614 HB THR 81 HB THR 81 11.235 6.856 -2.521 615 HG1 THR 81 HG1 THR 81 13.194 6.368 -3.318 616 HG21 THR 81 HG21 THR 81 10.925 9.266 -2.964 617 HG22 THR 81 HG22 THR 81 11.998 8.537 -4.161 618 HG23 THR 81 HG23 THR 81 12.671 9.514 -2.855 619 H ILE 82 H ILE 82 11.375 10.298 -0.177 620 HA ILE 82 HA ILE 82 8.462 10.105 -0.490 621 HB ILE 82 HB ILE 82 9.737 11.415 1.967 622 HG12 ILE 82 HG12 ILE 82 8.017 8.914 1.663 623 HG13 ILE 82 HG13 ILE 82 9.615 9.039 2.387 624 HG21 ILE 82 HG21 ILE 82 7.853 12.754 1.066 625 HG22 ILE 82 HG22 ILE 82 7.432 12.040 2.620 626 HG23 ILE 82 HG23 ILE 82 6.802 11.334 1.130 627 HD11 ILE 82 HD11 ILE 82 7.014 10.045 3.509 628 HD12 ILE 82 HD12 ILE 82 8.596 10.354 4.228 629 HD13 ILE 82 HD13 ILE 82 7.998 8.706 4.088 630 H GLU 83 H GLU 83 8.520 11.211 -2.297 631 HA GLU 83 HA GLU 83 10.325 13.512 -2.603 632 HB2 GLU 83 HB2 GLU 83 10.419 11.433 -4.066 633 HB3 GLU 83 HB3 GLU 83 8.872 11.908 -4.743 634 HG2 GLU 83 HG2 GLU 83 11.085 13.922 -4.836 635 HG3 GLU 83 HG3 GLU 83 11.250 12.508 -5.863 636 H ALA 84 H ALA 84 6.976 12.531 -3.419 637 HA ALA 84 HA ALA 84 4.980 13.550 -3.353 638 HB1 ALA 84 HB1 ALA 84 4.590 15.477 -1.894 639 HB2 ALA 84 HB2 ALA 84 6.325 15.811 -1.832 640 HB3 ALA 84 HB3 ALA 84 5.685 14.336 -1.107 641 HA PRO 85 HA PRO 85 3.129 14.692 -3.476 642 HB2 PRO 85 HB2 PRO 85 1.094 15.587 -4.945 643 HB3 PRO 85 HB3 PRO 85 2.099 16.737 -4.046 644 HG2 PRO 85 HG2 PRO 85 2.187 16.045 -6.987 645 HG3 PRO 85 HG3 PRO 85 2.282 17.642 -6.215 646 HD2 PRO 85 HD2 PRO 85 4.494 16.123 -7.053 647 HD3 PRO 85 HD3 PRO 85 4.557 17.460 -5.882 648 H ASP 86 H ASP 86 4.576 13.500 -6.138 649 HA ASP 86 HA ASP 86 2.417 11.609 -6.920 650 HB2 ASP 86 HB2 ASP 86 3.132 11.841 -9.231 651 HB3 ASP 86 HB3 ASP 86 2.782 13.438 -8.580 652 H HIS 87 H HIS 87 5.015 11.409 -5.153 653 HA HIS 87 HA HIS 87 5.891 8.830 -6.204 654 HB2 HIS 87 HB2 HIS 87 7.348 10.472 -7.361 655 HB3 HIS 87 HB3 HIS 87 7.887 11.097 -5.814 656 HD1 HIS 87 HD1 HIS 87 10.223 10.424 -7.112 657 HD2 HIS 87 HD2 HIS 87 7.949 7.299 -5.569 658 HE1 HIS 87 HE1 HIS 87 11.782 8.461 -6.972 659 HE2 HIS 87 HE2 HIS 87 10.355 6.553 -6.172 660 H LEU 88 H LEU 88 5.573 7.600 -4.517 661 HA LEU 88 HA LEU 88 6.910 8.192 -1.939 662 HB2 LEU 88 HB2 LEU 88 4.436 8.370 -1.727 663 HB3 LEU 88 HB3 LEU 88 4.256 6.742 -2.338 664 HG LEU 88 HG LEU 88 5.435 5.857 -0.329 665 HD11 LEU 88 HD11 LEU 88 6.872 7.764 0.188 666 HD12 LEU 88 HD12 LEU 88 5.903 7.325 1.592 667 HD13 LEU 88 HD13 LEU 88 5.464 8.738 0.628 668 HD21 LEU 88 HD21 LEU 88 3.652 6.261 1.304 669 HD22 LEU 88 HD22 LEU 88 2.988 5.992 -0.307 670 HD23 LEU 88 HD23 LEU 88 3.069 7.629 0.352 671 H GLU 89 H GLU 89 8.142 6.520 -1.146 672 HA GLU 89 HA GLU 89 7.826 3.796 -2.231 673 HB2 GLU 89 HB2 GLU 89 10.440 5.322 -1.884 674 HB3 GLU 89 HB3 GLU 89 10.368 3.570 -2.024 675 HG2 GLU 89 HG2 GLU 89 9.319 3.814 -4.265 676 HG3 GLU 89 HG3 GLU 89 9.487 5.567 -4.124 677 H PHE 90 H PHE 90 7.474 2.436 -0.649 678 HA PHE 90 HA PHE 90 8.846 2.627 1.931 679 HB2 PHE 90 HB2 PHE 90 6.764 2.269 3.222 680 HB3 PHE 90 HB3 PHE 90 6.683 3.782 2.332 681 HD1 PHE 90 HD2 PHE 90 5.305 0.351 2.582 682 HD2 PHE 90 HD1 PHE 90 5.082 4.071 0.488 683 HE1 PHE 90 HE2 PHE 90 3.169 -0.337 1.588 684 HE2 PHE 90 HE1 PHE 90 2.948 3.374 -0.494 685 HZ PHE 90 HZ PHE 90 1.986 1.174 0.045 686 H ASP 91 H ASP 91 8.373 0.595 3.219 687 HA ASP 91 HA ASP 91 8.149 -1.780 1.475 688 HB2 ASP 91 HB2 ASP 91 9.342 -1.470 4.265 689 HB3 ASP 91 HB3 ASP 91 9.234 -2.994 3.381 690 H ASP 92 H ASP 92 6.278 -2.849 1.525 691 HA ASP 92 HA ASP 92 4.006 -2.159 2.959 692 HB2 ASP 92 HB2 ASP 92 4.657 -4.904 1.801 693 HB3 ASP 92 HB3 ASP 92 3.041 -4.314 2.185 694 H GLY 93 H GLY 93 6.033 -5.058 3.554 695 HA2 GLY 93 HA2 GLY 93 6.931 -5.956 5.441 696 HA3 GLY 93 HA3 GLY 93 6.655 -4.410 6.204 697 H PHE 94 H PHE 94 5.895 -7.688 6.299 698 HA PHE 94 HA PHE 94 3.602 -7.271 8.133 699 HB2 PHE 94 HB2 PHE 94 4.736 -9.803 6.871 700 HB3 PHE 94 HB3 PHE 94 3.464 -9.812 8.093 701 HD1 PHE 94 HD2 PHE 94 1.302 -8.570 7.615 702 HD2 PHE 94 HD1 PHE 94 4.177 -9.451 4.578 703 HE1 PHE 94 HE2 PHE 94 -0.402 -8.189 5.893 704 HE2 PHE 94 HE1 PHE 94 2.465 -9.059 2.854 705 HZ PHE 94 HZ PHE 94 0.178 -8.431 3.517 706 H ALA 95 H ALA 95 3.684 -7.927 10.275 707 HA ALA 95 HA ALA 95 6.335 -8.620 11.411 708 HB1 ALA 95 HB1 ALA 95 4.421 -6.525 12.514 709 HB2 ALA 95 HB2 ALA 95 5.941 -6.195 11.681 710 HB3 ALA 95 HB3 ALA 95 5.955 -7.020 13.242 711 H ASP 96 H ASP 96 6.310 -9.851 13.250 712 HA ASP 96 HA ASP 96 4.014 -11.408 14.017 713 HB2 ASP 96 HB2 ASP 96 6.312 -12.303 14.086 714 HB3 ASP 96 HB3 ASP 96 6.796 -11.061 15.227 715 H GLU 97 H GLU 97 3.429 -11.438 16.519 716 HA GLU 97 HA GLU 97 1.823 -9.265 16.989 717 HB2 GLU 97 HB2 GLU 97 1.457 -10.186 19.257 718 HB3 GLU 97 HB3 GLU 97 1.450 -11.437 18.019 719 HG2 GLU 97 HG2 GLU 97 3.746 -12.088 18.638 720 HG3 GLU 97 HG3 GLU 97 3.796 -10.809 19.847 721 H HIS 98 H HIS 98 5.198 -9.493 18.085 722 HA HIS 98 HA HIS 98 4.935 -7.335 20.053 723 HB2 HIS 98 HB2 HIS 98 7.508 -8.694 19.150 724 HB3 HIS 98 HB3 HIS 98 7.265 -7.756 20.621 725 HD1 HIS 98 HD1 HIS 98 5.844 -8.925 22.516 726 HD2 HIS 98 HD2 HIS 98 6.837 -11.378 19.319 727 HE1 HIS 98 HE1 HIS 98 5.392 -11.259 23.302 728 HE2 HIS 98 HE2 HIS 98 5.750 -12.681 21.273 729 H GLY 99 H GLY 99 5.477 -7.452 16.709 730 HA2 GLY 99 HA2 GLY 99 5.533 -5.518 15.343 731 HA3 GLY 99 HA3 GLY 99 6.319 -4.629 16.634 732 H ALA 100 H ALA 100 7.514 -7.796 15.693 733 HA ALA 100 HA ALA 100 9.904 -6.570 14.414 734 HB1 ALA 100 HB1 ALA 100 10.375 -7.905 16.442 735 HB2 ALA 100 HB2 ALA 100 11.107 -8.630 15.009 736 HB3 ALA 100 HB3 ALA 100 9.630 -9.316 15.690 737 HA PRO 101 HA PRO 101 8.641 -7.939 10.338 738 HB2 PRO 101 HB2 PRO 101 11.554 -8.662 9.951 739 HB3 PRO 101 HB3 PRO 101 10.491 -7.680 8.930 740 HG2 PRO 101 HG2 PRO 101 12.277 -6.484 10.488 741 HG3 PRO 101 HG3 PRO 101 10.638 -5.809 10.348 742 HD2 PRO 101 HD2 PRO 101 11.837 -7.433 12.593 743 HD3 PRO 101 HD3 PRO 101 10.758 -6.020 12.673 744 H VAL 102 H VAL 102 7.972 -9.768 9.260 745 HA VAL 102 HA VAL 102 8.490 -12.404 10.400 746 HB VAL 102 HB VAL 102 6.628 -11.549 8.126 747 HG11 VAL 102 HG11 VAL 102 7.280 -13.910 7.811 748 HG12 VAL 102 HG12 VAL 102 5.595 -13.801 8.317 749 HG13 VAL 102 HG13 VAL 102 6.834 -14.276 9.482 750 HG21 VAL 102 HG21 VAL 102 5.989 -12.306 11.005 751 HG22 VAL 102 HG22 VAL 102 4.802 -11.911 9.758 752 HG23 VAL 102 HG23 VAL 102 5.929 -10.677 10.327 753 H ASP 103 H ASP 103 9.832 -13.891 9.557 754 HA ASP 103 HA ASP 103 11.681 -13.187 7.454 755 HB2 ASP 103 HB2 ASP 103 12.749 -15.403 8.032 756 HB3 ASP 103 HB3 ASP 103 12.551 -14.326 9.411 757 H GLU 104 H GLU 104 9.035 -15.490 7.805 758 HA GLU 104 HA GLU 104 9.393 -17.001 5.445 759 HB2 GLU 104 HB2 GLU 104 8.087 -17.789 7.361 760 HB3 GLU 104 HB3 GLU 104 6.925 -16.480 7.155 761 HG2 GLU 104 HG2 GLU 104 6.225 -17.438 4.999 762 HG3 GLU 104 HG3 GLU 104 7.404 -18.738 5.187 763 H LEU 105 H LEU 105 7.272 -14.211 6.140 764 HA LEU 105 HA LEU 105 6.228 -14.002 3.448 765 HB2 LEU 105 HB2 LEU 105 6.000 -12.133 5.837 766 HB3 LEU 105 HB3 LEU 105 5.107 -11.941 4.331 767 HG LEU 105 HG LEU 105 4.837 -14.278 6.274 768 HD11 LEU 105 HD11 LEU 105 2.584 -13.429 6.715 769 HD12 LEU 105 HD12 LEU 105 2.890 -12.036 5.673 770 HD13 LEU 105 HD13 LEU 105 3.816 -12.249 7.161 771 HD21 LEU 105 HD21 LEU 105 3.340 -13.742 3.689 772 HD22 LEU 105 HD22 LEU 105 2.975 -15.030 4.843 773 HD23 LEU 105 HD23 LEU 105 4.509 -15.036 3.977 774 H GLY 106 H GLY 106 8.931 -12.689 5.188 775 HA2 GLY 106 HA2 GLY 106 10.771 -11.525 4.472 776 HA3 GLY 106 HA3 GLY 106 10.173 -11.686 2.828 777 H VAL 107 H VAL 107 10.973 -9.552 2.459 778 HA VAL 107 HA VAL 107 9.211 -7.362 3.419 779 HB VAL 107 HB VAL 107 12.179 -7.096 2.718 780 HG11 VAL 107 HG11 VAL 107 11.970 -4.794 3.643 781 HG12 VAL 107 HG12 VAL 107 10.242 -5.055 3.890 782 HG13 VAL 107 HG13 VAL 107 10.905 -5.036 2.255 783 HG21 VAL 107 HG21 VAL 107 12.580 -6.722 5.145 784 HG22 VAL 107 HG22 VAL 107 11.951 -8.342 4.827 785 HG23 VAL 107 HG23 VAL 107 10.885 -7.093 5.475 786 H THR 108 H THR 108 8.300 -6.162 1.819 787 HA THR 108 HA THR 108 9.328 -6.293 -0.948 788 HB THR 108 HB THR 108 7.478 -7.856 -0.939 789 HG1 THR 108 HG1 THR 108 5.958 -6.171 -2.227 790 HG21 THR 108 HG21 THR 108 6.226 -7.101 1.046 791 HG22 THR 108 HG22 THR 108 5.163 -7.222 -0.357 792 HG23 THR 108 HG23 THR 108 5.725 -5.641 0.188 793 H HIS 109 H HIS 109 8.489 -4.444 -2.306 794 HA HIS 109 HA HIS 109 8.507 -2.006 -0.608 795 HB2 HIS 109 HB2 HIS 109 10.795 -2.724 -1.446 796 HB3 HIS 109 HB3 HIS 109 10.225 -2.444 -3.089 797 HD1 HIS 109 HD1 HIS 109 10.665 -0.555 0.154 798 HD2 HIS 109 HD2 HIS 109 10.578 0.174 -3.930 799 HE1 HIS 109 HE1 HIS 109 11.230 1.855 -0.103 800 HE2 HIS 109 HE2 HIS 109 11.457 2.190 -2.579 801 H ALA 110 H ALA 110 6.536 -1.114 -1.049 802 HA ALA 110 HA ALA 110 5.398 -1.130 -3.752 803 HB1 ALA 110 HB1 ALA 110 4.256 -0.045 -1.162 804 HB2 ALA 110 HB2 ALA 110 3.945 -1.639 -1.850 805 HB3 ALA 110 HB3 ALA 110 3.392 -0.194 -2.694 806 H THR 111 H THR 111 5.297 0.589 -5.098 807 HA THR 111 HA THR 111 6.436 3.202 -4.242 808 HB THR 111 HB THR 111 6.503 2.084 -7.100 809 HG1 THR 111 HG1 THR 111 7.803 0.774 -5.705 810 HG21 THR 111 HG21 THR 111 8.240 3.816 -7.444 811 HG22 THR 111 HG22 THR 111 8.037 4.359 -5.779 812 HG23 THR 111 HG23 THR 111 6.714 4.540 -6.933 813 H VAL 112 H VAL 112 4.750 4.588 -4.014 814 HA VAL 112 HA VAL 112 2.282 4.289 -5.593 815 HB VAL 112 HB VAL 112 2.869 6.126 -3.228 816 HG11 VAL 112 HG11 VAL 112 1.031 7.001 -4.635 817 HG12 VAL 112 HG12 VAL 112 0.409 6.419 -3.091 818 HG13 VAL 112 HG13 VAL 112 0.204 5.441 -4.546 819 HG21 VAL 112 HG21 VAL 112 3.013 3.746 -2.588 820 HG22 VAL 112 HG22 VAL 112 1.416 3.451 -3.284 821 HG23 VAL 112 HG23 VAL 112 1.583 4.502 -1.877 822 H LYS 113 H LYS 113 1.980 5.468 -7.356 823 HA LYS 113 HA LYS 113 3.415 8.034 -7.761 824 HB2 LYS 113 HB2 LYS 113 2.985 5.724 -9.707 825 HB3 LYS 113 HB3 LYS 113 3.647 7.290 -10.173 826 HG2 LYS 113 HG2 LYS 113 5.647 6.954 -8.958 827 HG3 LYS 113 HG3 LYS 113 4.948 5.673 -7.971 828 HD2 LYS 113 HD2 LYS 113 6.586 4.816 -9.621 829 HD3 LYS 113 HD3 LYS 113 4.976 4.133 -9.851 830 HE2 LYS 113 HE2 LYS 113 5.994 4.694 -12.003 831 HE3 LYS 113 HE3 LYS 113 4.587 5.707 -11.706 832 HZ1 LYS 113 HZ1 LYS 113 6.092 7.480 -10.987 833 HZ2 LYS 113 HZ2 LYS 113 6.399 7.001 -12.576 834 HZ3 LYS 113 HZ3 LYS 113 7.419 6.491 -11.333 835 H LEU 114 H LEU 114 2.248 9.699 -8.701 836 HA LEU 114 HA LEU 114 -0.654 9.256 -9.160 837 HB2 LEU 114 HB2 LEU 114 0.645 11.463 -7.512 838 HB3 LEU 114 HB3 LEU 114 -1.056 11.432 -7.956 839 HG LEU 114 HG LEU 114 0.300 9.315 -6.224 840 HD11 LEU 114 HD11 LEU 114 0.235 11.427 -5.030 841 HD12 LEU 114 HD12 LEU 114 -0.934 10.310 -4.336 842 HD13 LEU 114 HD13 LEU 114 -1.480 11.622 -5.389 843 HD21 LEU 114 HD21 LEU 114 -2.639 9.759 -6.842 844 HD22 LEU 114 HD22 LEU 114 -1.983 8.555 -5.729 845 HD23 LEU 114 HD23 LEU 114 -1.632 8.441 -7.451 846 H GLU 115 H GLU 115 -1.542 10.322 -10.897 847 HA GLU 115 HA GLU 115 0.148 12.291 -12.354 848 HB2 GLU 115 HB2 GLU 115 -1.692 10.201 -13.593 849 HB3 GLU 115 HB3 GLU 115 -0.743 11.394 -14.481 850 HG2 GLU 115 HG2 GLU 115 1.327 10.371 -13.580 851 HG3 GLU 115 HG3 GLU 115 0.354 9.141 -12.777 852 HA PRO 116 HA PRO 116 -3.483 14.915 -11.726 853 HB2 PRO 116 HB2 PRO 116 -2.622 17.132 -13.101 854 HB3 PRO 116 HB3 PRO 116 -2.008 16.686 -11.504 855 HG2 PRO 116 HG2 PRO 116 -0.772 16.213 -14.209 856 HG3 PRO 116 HG3 PRO 116 0.003 16.743 -12.703 857 HD2 PRO 116 HD2 PRO 116 0.105 14.160 -13.607 858 HD3 PRO 116 HD3 PRO 116 0.179 14.577 -11.883 859 H LEU 117 H LEU 117 -5.128 13.897 -12.851 860 HA LEU 117 HA LEU 117 -5.437 14.272 -15.769 861 HB2 LEU 117 HB2 LEU 117 -7.371 12.934 -13.838 862 HB3 LEU 117 HB3 LEU 117 -7.341 12.767 -15.583 863 HG LEU 117 HG LEU 117 -5.252 11.661 -13.656 864 HD11 LEU 117 HD11 LEU 117 -7.417 10.197 -15.211 865 HD12 LEU 117 HD12 LEU 117 -7.377 10.460 -13.465 866 HD13 LEU 117 HD13 LEU 117 -6.158 9.440 -14.226 867 HD21 LEU 117 HD21 LEU 117 -4.316 10.481 -15.593 868 HD22 LEU 117 HD22 LEU 117 -4.246 12.226 -15.817 869 HD23 LEU 117 HD23 LEU 117 -5.478 11.281 -16.659 870 H GLU 118 H GLU 118 -5.382 16.710 -14.647 871 HA GLU 118 HA GLU 118 -6.328 18.664 -14.093 872 HB2 GLU 118 HB2 GLU 118 -8.471 17.517 -15.891 873 HB3 GLU 118 HB3 GLU 118 -8.723 19.073 -15.119 874 HG2 GLU 118 HG2 GLU 118 -7.919 19.377 -17.383 875 HG3 GLU 118 HG3 GLU 118 -6.734 19.970 -16.225 876 H ASN 119 H ASN 119 -9.478 17.021 -13.914 877 HA ASN 119 HA ASN 119 -9.797 17.962 -11.138 878 HB2 ASN 119 HB2 ASN 119 -12.200 17.531 -11.509 879 HB3 ASN 119 HB3 ASN 119 -11.531 18.544 -12.780 880 HD21 ASN 119 HD21 ASN 119 -12.805 15.386 -12.029 881 HD22 ASN 119 HD22 ASN 119 -13.017 14.877 -13.664 882 H ARG 120 H ARG 120 -9.151 15.088 -12.881 883 HA ARG 120 HA ARG 120 -9.727 13.311 -10.570 884 HB2 ARG 120 HB2 ARG 120 -9.060 12.610 -13.464 885 HB3 ARG 120 HB3 ARG 120 -9.474 11.457 -12.200 886 HG2 ARG 120 HG2 ARG 120 -11.751 12.180 -12.155 887 HG3 ARG 120 HG3 ARG 120 -11.389 13.614 -13.122 888 HD2 ARG 120 HD2 ARG 120 -12.519 11.833 -14.442 889 HD3 ARG 120 HD3 ARG 120 -10.924 12.248 -15.081 890 HE ARG 120 HE ARG 120 -11.112 9.947 -13.279 891 HH11 ARG 120 HH11 ARG 120 -10.695 11.042 -16.540 892 HH12 ARG 120 HH12 ARG 120 -10.209 9.482 -17.096 893 HH21 ARG 120 HH21 ARG 120 -10.544 7.987 -14.024 894 HH22 ARG 120 HH22 ARG 120 -10.112 7.768 -15.682 895 H THR 121 H THR 121 -7.986 11.434 -10.468 896 HA THR 121 HA THR 121 -5.272 12.172 -11.280 897 HB THR 121 HB THR 121 -5.966 11.668 -8.339 898 HG1 THR 121 HG1 THR 121 -6.283 13.838 -9.136 899 HG21 THR 121 HG21 THR 121 -3.816 10.568 -8.878 900 HG22 THR 121 HG22 THR 121 -3.545 11.998 -7.879 901 HG23 THR 121 HG23 THR 121 -3.223 12.062 -9.616 902 H ARG 122 H ARG 122 -3.890 10.422 -11.511 903 HA ARG 122 HA ARG 122 -5.108 7.724 -11.553 904 HB2 ARG 122 HB2 ARG 122 -4.358 8.524 -13.731 905 HB3 ARG 122 HB3 ARG 122 -2.804 9.013 -13.075 906 HG2 ARG 122 HG2 ARG 122 -2.390 7.036 -14.312 907 HG3 ARG 122 HG3 ARG 122 -2.331 6.558 -12.617 908 HD2 ARG 122 HD2 ARG 122 -3.551 4.868 -13.784 909 HD3 ARG 122 HD3 ARG 122 -4.730 5.788 -12.851 910 HE ARG 122 HE ARG 122 -5.503 6.808 -14.857 911 HH11 ARG 122 HH11 ARG 122 -3.117 4.392 -15.529 912 HH12 ARG 122 HH12 ARG 122 -3.682 4.136 -17.139 913 HH21 ARG 122 HH21 ARG 122 -6.189 6.471 -16.925 914 HH22 ARG 122 HH22 ARG 122 -5.386 5.306 -17.919 915 H MET 123 H MET 123 -4.450 6.376 -9.902 916 HA MET 123 HA MET 123 -1.793 6.755 -8.642 917 HB2 MET 123 HB2 MET 123 -3.810 6.892 -7.139 918 HB3 MET 123 HB3 MET 123 -4.194 5.226 -7.542 919 HG2 MET 123 HG2 MET 123 -1.925 4.579 -6.609 920 HG3 MET 123 HG3 MET 123 -1.766 6.242 -6.044 921 HE1 MET 123 HE1 MET 123 -4.893 3.214 -4.541 922 HE2 MET 123 HE2 MET 123 -3.655 2.871 -5.747 923 HE3 MET 123 HE3 MET 123 -5.008 3.933 -6.148 924 H THR 124 H THR 124 -0.277 5.350 -9.375 925 HA THR 124 HA THR 124 -1.008 2.505 -9.804 926 HB THR 124 HB THR 124 1.277 4.020 -11.161 927 HG1 THR 124 HG1 THR 124 -0.067 4.301 -12.792 928 HG21 THR 124 HG21 THR 124 1.534 1.968 -12.534 929 HG22 THR 124 HG22 THR 124 0.294 1.162 -11.573 930 HG23 THR 124 HG23 THR 124 1.827 1.622 -10.829 931 H ILE 125 H ILE 125 -0.299 1.279 -8.170 932 HA ILE 125 HA ILE 125 2.083 2.041 -6.573 933 HB ILE 125 HB ILE 125 -0.106 0.032 -5.851 934 HG12 ILE 125 HG12 ILE 125 0.151 2.909 -4.849 935 HG13 ILE 125 HG13 ILE 125 -1.024 2.374 -6.049 936 HG21 ILE 125 HG21 ILE 125 2.028 -0.372 -4.683 937 HG22 ILE 125 HG22 ILE 125 0.806 0.200 -3.547 938 HG23 ILE 125 HG23 ILE 125 2.060 1.303 -4.120 939 HD11 ILE 125 HD11 ILE 125 -2.055 0.905 -4.375 940 HD12 ILE 125 HD12 ILE 125 -2.035 2.589 -3.857 941 HD13 ILE 125 HD13 ILE 125 -0.877 1.450 -3.177 942 H ILE 126 H ILE 126 3.937 0.916 -7.172 943 HA ILE 126 HA ILE 126 3.653 -1.846 -8.225 944 HB ILE 126 HB ILE 126 6.115 -0.054 -8.590 945 HG12 ILE 126 HG12 ILE 126 5.265 0.027 -11.081 946 HG13 ILE 126 HG13 ILE 126 3.692 -0.376 -10.411 947 HG21 ILE 126 HG21 ILE 126 6.738 -1.699 -10.336 948 HG22 ILE 126 HG22 ILE 126 5.303 -2.651 -9.952 949 HG23 ILE 126 HG23 ILE 126 6.582 -2.456 -8.748 950 HD11 ILE 126 HD11 ILE 126 3.749 1.681 -9.085 951 HD12 ILE 126 HD12 ILE 126 3.909 1.989 -10.813 952 HD13 ILE 126 HD13 ILE 126 5.329 2.071 -9.771 953 H SER 127 H SER 127 4.006 -3.302 -6.659 954 HA SER 127 HA SER 127 5.866 -2.833 -4.436 955 HB2 SER 127 HB2 SER 127 3.506 -3.484 -3.930 956 HB3 SER 127 HB3 SER 127 3.751 -5.015 -4.770 957 HG SER 127 HG SER 127 4.564 -4.195 -2.264 958 H THR 128 H THR 128 7.893 -3.501 -4.880 959 HA THR 128 HA THR 128 8.444 -5.815 -6.599 960 HB THR 128 HB THR 128 10.850 -5.023 -6.417 961 HG1 THR 128 HG1 THR 128 10.962 -3.849 -4.573 962 HG21 THR 128 HG21 THR 128 10.579 -3.035 -7.851 963 HG22 THR 128 HG22 THR 128 8.878 -2.918 -7.394 964 HG23 THR 128 HG23 THR 128 9.448 -4.302 -8.334 965 H PHE 129 H PHE 129 9.183 -7.718 -5.842 966 HA PHE 129 HA PHE 129 9.476 -8.142 -2.934 967 HB2 PHE 129 HB2 PHE 129 9.013 -10.211 -5.138 968 HB3 PHE 129 HB3 PHE 129 8.891 -10.475 -3.399 969 HD1 PHE 129 HD2 PHE 129 7.217 -9.010 -6.355 970 HD2 PHE 129 HD1 PHE 129 6.903 -9.708 -2.149 971 HE1 PHE 129 HE2 PHE 129 4.832 -8.437 -6.435 972 HE2 PHE 129 HE1 PHE 129 4.513 -9.132 -2.238 973 HZ PHE 129 HZ PHE 129 3.477 -8.486 -4.381 974 H GLU 130 H GLU 130 11.167 -9.658 -2.181 975 HA GLU 130 HA GLU 130 13.734 -9.141 -3.370 976 HB2 GLU 130 HB2 GLU 130 12.986 -11.049 -1.115 977 HB3 GLU 130 HB3 GLU 130 14.628 -10.559 -1.534 978 HG2 GLU 130 HG2 GLU 130 14.152 -8.257 -0.900 979 HG3 GLU 130 HG3 GLU 130 12.458 -8.652 -0.612 980 H SER 131 H SER 131 11.535 -11.935 -3.419 981 HA SER 131 HA SER 131 13.177 -13.247 -5.465 982 HB2 SER 131 HB2 SER 131 13.186 -15.425 -4.284 983 HB3 SER 131 HB3 SER 131 13.999 -14.195 -3.313 984 HG SER 131 HG SER 131 12.519 -15.504 -2.116 985 H GLU 132 H GLU 132 12.118 -15.051 -6.486 986 HA GLU 132 HA GLU 132 9.451 -14.554 -7.297 987 HB2 GLU 132 HB2 GLU 132 11.307 -15.558 -8.684 988 HB3 GLU 132 HB3 GLU 132 11.173 -17.040 -7.756 989 HG2 GLU 132 HG2 GLU 132 8.839 -15.940 -9.339 990 HG3 GLU 132 HG3 GLU 132 10.082 -16.930 -10.098 991 H GLU 133 H GLU 133 10.829 -17.117 -5.208 992 HA GLU 133 HA GLU 133 8.352 -18.452 -4.742 993 HB2 GLU 133 HB2 GLU 133 9.591 -19.645 -2.920 994 HB3 GLU 133 HB3 GLU 133 10.395 -19.684 -4.477 995 HG2 GLU 133 HG2 GLU 133 12.209 -19.288 -3.102 996 HG3 GLU 133 HG3 GLU 133 11.766 -17.634 -3.514 997 H GLN 134 H GLN 134 9.866 -15.673 -3.172 998 HA GLN 134 HA GLN 134 8.222 -15.514 -0.860 999 HB2 GLN 134 HB2 GLN 134 10.322 -14.175 -1.191 1000 HB3 GLN 134 HB3 GLN 134 9.488 -13.202 -2.401 1001 HG2 GLN 134 HG2 GLN 134 7.805 -12.615 -0.530 1002 HG3 GLN 134 HG3 GLN 134 8.969 -13.329 0.587 1003 HE21 GLN 134 HE21 GLN 134 8.059 -10.613 0.560 1004 HE22 GLN 134 HE22 GLN 134 9.443 -9.619 0.282 1005 H MET 135 H MET 135 7.893 -14.011 -4.117 1006 HA MET 135 HA MET 135 5.511 -12.574 -3.513 1007 HB2 MET 135 HB2 MET 135 5.384 -11.976 -5.822 1008 HB3 MET 135 HB3 MET 135 7.070 -11.967 -5.364 1009 HG2 MET 135 HG2 MET 135 7.353 -14.151 -6.496 1010 HG3 MET 135 HG3 MET 135 5.669 -14.079 -7.014 1011 HE1 MET 135 HE1 MET 135 5.512 -10.789 -7.536 1012 HE2 MET 135 HE2 MET 135 4.732 -11.988 -8.573 1013 HE3 MET 135 HE3 MET 135 5.804 -10.779 -9.277 1014 H GLN 136 H GLN 136 6.030 -15.858 -4.663 1015 HA GLN 136 HA GLN 136 3.306 -16.499 -5.245 1016 HB2 GLN 136 HB2 GLN 136 5.543 -18.339 -4.294 1017 HB3 GLN 136 HB3 GLN 136 4.007 -18.871 -4.981 1018 HG2 GLN 136 HG2 GLN 136 6.201 -17.337 -6.393 1019 HG3 GLN 136 HG3 GLN 136 5.748 -19.018 -6.657 1020 HE21 GLN 136 HE21 GLN 136 5.873 -16.838 -8.587 1021 HE22 GLN 136 HE22 GLN 136 4.289 -16.690 -9.263 1022 H LYS 137 H LYS 137 5.261 -16.760 -2.261 1023 HA LYS 137 HA LYS 137 3.270 -17.771 -0.527 1024 HB2 LYS 137 HB2 LYS 137 5.667 -17.751 0.059 1025 HB3 LYS 137 HB3 LYS 137 5.667 -15.993 0.087 1026 HG2 LYS 137 HG2 LYS 137 5.652 -16.881 2.357 1027 HG3 LYS 137 HG3 LYS 137 4.149 -16.009 2.029 1028 HD2 LYS 137 HD2 LYS 137 3.023 -18.223 1.590 1029 HD3 LYS 137 HD3 LYS 137 4.522 -19.040 2.053 1030 HE2 LYS 137 HE2 LYS 137 4.351 -17.955 4.306 1031 HE3 LYS 137 HE3 LYS 137 2.797 -17.268 3.822 1032 HZ1 LYS 137 HZ1 LYS 137 1.900 -19.453 3.597 1033 HZ2 LYS 137 HZ2 LYS 137 2.610 -19.310 5.124 1034 HZ3 LYS 137 HZ3 LYS 137 3.404 -20.169 3.903 1035 H MET 138 H MET 138 4.007 -14.460 -1.539 1036 HA MET 138 HA MET 138 2.200 -13.062 0.154 1037 HB2 MET 138 HB2 MET 138 3.238 -12.331 -2.612 1038 HB3 MET 138 HB3 MET 138 2.428 -11.218 -1.516 1039 HG2 MET 138 HG2 MET 138 4.930 -12.594 -0.577 1040 HG3 MET 138 HG3 MET 138 5.062 -11.267 -1.718 1041 HE1 MET 138 HE1 MET 138 3.682 -10.897 2.670 1042 HE2 MET 138 HE2 MET 138 4.425 -12.326 1.955 1043 HE3 MET 138 HE3 MET 138 2.764 -11.895 1.544 1044 H ALA 139 H ALA 139 1.817 -14.495 -3.078 1045 HA ALA 139 HA ALA 139 -0.907 -13.804 -3.499 1046 HB1 ALA 139 HB1 ALA 139 0.683 -16.128 -4.635 1047 HB2 ALA 139 HB2 ALA 139 0.573 -14.504 -5.322 1048 HB3 ALA 139 HB3 ALA 139 -0.861 -15.533 -5.261 1049 H GLU 140 H GLU 140 0.614 -16.523 -1.776 1050 HA GLU 140 HA GLU 140 -1.752 -18.019 -1.204 1051 HB2 GLU 140 HB2 GLU 140 0.833 -17.856 0.412 1052 HB3 GLU 140 HB3 GLU 140 -0.422 -19.075 0.620 1053 HG2 GLU 140 HG2 GLU 140 1.325 -18.702 -1.831 1054 HG3 GLU 140 HG3 GLU 140 1.494 -19.964 -0.615 1055 H MET 141 H MET 141 -0.284 -15.189 0.293 1056 HA MET 141 HA MET 141 -2.023 -15.100 2.605 1057 HB2 MET 141 HB2 MET 141 -0.293 -12.936 1.339 1058 HB3 MET 141 HB3 MET 141 -1.076 -12.812 2.913 1059 HG2 MET 141 HG2 MET 141 1.048 -14.831 2.163 1060 HG3 MET 141 HG3 MET 141 1.305 -13.373 3.112 1061 HE1 MET 141 HE1 MET 141 -0.677 -14.194 6.408 1062 HE2 MET 141 HE2 MET 141 -1.238 -13.268 5.016 1063 HE3 MET 141 HE3 MET 141 0.405 -13.045 5.619 1064 H GLY 142 H GLY 142 -2.268 -14.068 -0.699 1065 HA2 GLY 142 HA2 GLY 142 -4.149 -13.342 -1.853 1066 HA3 GLY 142 HA3 GLY 142 -4.992 -13.100 -0.328 1067 H MET 143 H MET 143 -1.834 -11.793 -1.294 1068 HA MET 143 HA MET 143 -2.420 -9.121 -0.461 1069 HB2 MET 143 HB2 MET 143 -0.120 -10.311 -2.061 1070 HB3 MET 143 HB3 MET 143 -0.180 -8.607 -1.615 1071 HG2 MET 143 HG2 MET 143 -0.176 -10.917 0.344 1072 HG3 MET 143 HG3 MET 143 1.222 -9.927 -0.079 1073 HE1 MET 143 HE1 MET 143 1.597 -7.438 0.722 1074 HE2 MET 143 HE2 MET 143 0.324 -6.451 1.438 1075 HE3 MET 143 HE3 MET 143 0.184 -6.986 -0.237 1076 H GLU 144 H GLU 144 -2.742 -10.755 -3.544 1077 HA GLU 144 HA GLU 144 -2.564 -8.481 -5.232 1078 HB2 GLU 144 HB2 GLU 144 -3.813 -11.191 -5.791 1079 HB3 GLU 144 HB3 GLU 144 -3.480 -9.961 -7.013 1080 HG2 GLU 144 HG2 GLU 144 -1.063 -10.099 -6.476 1081 HG3 GLU 144 HG3 GLU 144 -1.408 -11.366 -5.295 1082 H GLU 145 H GLU 145 -5.451 -10.407 -4.301 1083 HA GLU 145 HA GLU 145 -7.292 -8.318 -5.058 1084 HB2 GLU 145 HB2 GLU 145 -7.761 -10.844 -3.426 1085 HB3 GLU 145 HB3 GLU 145 -9.028 -9.755 -3.989 1086 HG2 GLU 145 HG2 GLU 145 -8.239 -10.225 -6.356 1087 HG3 GLU 145 HG3 GLU 145 -7.202 -11.487 -5.685 1088 H GLY 146 H GLY 146 -5.689 -9.266 -2.072 1089 HA2 GLY 146 HA2 GLY 146 -7.288 -8.071 -0.118 1090 HA3 GLY 146 HA3 GLY 146 -5.563 -8.343 0.017 1091 H MET 147 H MET 147 -4.340 -6.618 -1.604 1092 HA MET 147 HA MET 147 -4.830 -4.042 -0.430 1093 HB2 MET 147 HB2 MET 147 -2.526 -4.883 -1.068 1094 HB3 MET 147 HB3 MET 147 -2.949 -4.613 -2.754 1095 HG2 MET 147 HG2 MET 147 -3.164 -2.228 -2.380 1096 HG3 MET 147 HG3 MET 147 -2.983 -2.439 -0.641 1097 HE1 MET 147 HE1 MET 147 -1.181 -2.384 -4.117 1098 HE2 MET 147 HE2 MET 147 -0.889 -4.056 -3.631 1099 HE3 MET 147 HE3 MET 147 0.451 -2.911 -3.700 1100 H ARG 148 H ARG 148 -5.731 -5.547 -3.506 1101 HA ARG 148 HA ARG 148 -6.634 -3.292 -4.940 1102 HB2 ARG 148 HB2 ARG 148 -6.522 -5.414 -6.089 1103 HB3 ARG 148 HB3 ARG 148 -7.594 -6.177 -4.922 1104 HG2 ARG 148 HG2 ARG 148 -9.449 -4.671 -5.746 1105 HG3 ARG 148 HG3 ARG 148 -8.361 -4.116 -7.017 1106 HD2 ARG 148 HD2 ARG 148 -9.099 -7.029 -6.615 1107 HD3 ARG 148 HD3 ARG 148 -10.013 -5.938 -7.652 1108 HE ARG 148 HE ARG 148 -7.938 -5.653 -8.967 1109 HH11 ARG 148 HH11 ARG 148 -8.151 -8.492 -7.007 1110 HH12 ARG 148 HH12 ARG 148 -7.263 -9.458 -8.131 1111 HH21 ARG 148 HH21 ARG 148 -6.850 -6.921 -10.399 1112 HH22 ARG 148 HH22 ARG 148 -6.526 -8.578 -10.021 1113 H GLU 149 H GLU 149 -8.304 -5.267 -2.470 1114 HA GLU 149 HA GLU 149 -10.851 -3.954 -2.591 1115 HB2 GLU 149 HB2 GLU 149 -9.587 -5.657 -0.398 1116 HB3 GLU 149 HB3 GLU 149 -11.279 -5.156 -0.417 1117 HG2 GLU 149 HG2 GLU 149 -11.697 -6.440 -2.424 1118 HG3 GLU 149 HG3 GLU 149 -9.987 -6.832 -2.583 1119 H ALA 150 H ALA 150 -7.945 -3.491 -0.630 1120 HA ALA 150 HA ALA 150 -8.786 -1.394 1.057 1121 HB1 ALA 150 HB1 ALA 150 -6.385 -0.857 1.257 1122 HB2 ALA 150 HB2 ALA 150 -6.030 -1.862 -0.155 1123 HB3 ALA 150 HB3 ALA 150 -6.643 -2.603 1.327 1124 H ILE 151 H ILE 151 -7.558 -1.364 -2.272 1125 HA ILE 151 HA ILE 151 -7.570 1.504 -2.609 1126 HB ILE 151 HB ILE 151 -7.237 -0.770 -4.602 1127 HG12 ILE 151 HG12 ILE 151 -5.126 1.102 -3.424 1128 HG13 ILE 151 HG13 ILE 151 -5.467 -0.504 -2.791 1129 HG21 ILE 151 HG21 ILE 151 -8.031 1.208 -5.815 1130 HG22 ILE 151 HG22 ILE 151 -6.336 0.903 -6.195 1131 HG23 ILE 151 HG23 ILE 151 -6.769 2.198 -5.075 1132 HD11 ILE 151 HD11 ILE 151 -3.507 -0.548 -4.172 1133 HD12 ILE 151 HD12 ILE 151 -4.391 0.150 -5.525 1134 HD13 ILE 151 HD13 ILE 151 -4.792 -1.475 -4.953 1135 H GLU 152 H GLU 152 -9.861 -1.082 -3.290 1136 HA GLU 152 HA GLU 152 -11.826 0.475 -4.658 1137 HB2 GLU 152 HB2 GLU 152 -11.935 -2.115 -3.085 1138 HB3 GLU 152 HB3 GLU 152 -13.412 -1.380 -3.705 1139 HG2 GLU 152 HG2 GLU 152 -11.053 -2.103 -5.475 1140 HG3 GLU 152 HG3 GLU 152 -12.391 -3.202 -5.141 1141 H GLN 153 H GLN 153 -10.930 0.115 -1.294 1142 HA GLN 153 HA GLN 153 -13.236 1.630 -0.349 1143 HB2 GLN 153 HB2 GLN 153 -12.289 -0.286 0.973 1144 HB3 GLN 153 HB3 GLN 153 -10.841 0.674 1.264 1145 HG2 GLN 153 HG2 GLN 153 -12.038 2.264 2.594 1146 HG3 GLN 153 HG3 GLN 153 -13.601 1.666 2.047 1147 HE21 GLN 153 HE21 GLN 153 -10.916 1.059 4.154 1148 HE22 GLN 153 HE22 GLN 153 -11.680 -0.131 5.125 1149 H ILE 154 H ILE 154 -9.887 2.302 -1.342 1150 HA ILE 154 HA ILE 154 -9.666 4.973 -0.399 1151 HB ILE 154 HB ILE 154 -8.721 3.847 -3.077 1152 HG12 ILE 154 HG12 ILE 154 -7.171 4.396 -0.514 1153 HG13 ILE 154 HG13 ILE 154 -7.645 2.806 -1.105 1154 HG21 ILE 154 HG21 ILE 154 -8.944 6.285 -3.294 1155 HG22 ILE 154 HG22 ILE 154 -7.240 5.843 -3.259 1156 HG23 ILE 154 HG23 ILE 154 -8.000 6.529 -1.822 1157 HD11 ILE 154 HD11 ILE 154 -6.207 3.123 -3.068 1158 HD12 ILE 154 HD12 ILE 154 -5.318 3.236 -1.552 1159 HD13 ILE 154 HD13 ILE 154 -5.717 4.700 -2.442 1160 H ASP 155 H ASP 155 -11.303 3.605 -3.236 1161 HA ASP 155 HA ASP 155 -12.276 5.974 -4.404 1162 HB2 ASP 155 HB2 ASP 155 -12.178 3.503 -5.310 1163 HB3 ASP 155 HB3 ASP 155 -13.725 3.295 -4.502 1164 H ALA 156 H ALA 156 -13.476 3.902 -1.808 1165 HA ALA 156 HA ALA 156 -15.921 5.360 -1.315 1166 HB1 ALA 156 HB1 ALA 156 -14.446 3.395 0.503 1167 HB2 ALA 156 HB2 ALA 156 -15.662 2.964 -0.706 1168 HB3 ALA 156 HB3 ALA 156 -16.119 3.944 0.684 1169 H VAL 157 H VAL 157 -12.584 5.708 -0.137 1170 HA VAL 157 HA VAL 157 -13.178 7.304 2.198 1171 HB VAL 157 HB VAL 157 -10.593 6.916 0.611 1172 HG11 VAL 157 HG11 VAL 157 -10.903 8.516 3.192 1173 HG12 VAL 157 HG12 VAL 157 -10.452 9.170 1.616 1174 HG13 VAL 157 HG13 VAL 157 -9.364 8.062 2.453 1175 HG21 VAL 157 HG21 VAL 157 -11.410 5.941 3.372 1176 HG22 VAL 157 HG22 VAL 157 -9.856 5.636 2.593 1177 HG23 VAL 157 HG23 VAL 157 -11.333 4.960 1.913 1178 H LEU 158 H LEU 158 -12.368 8.018 -1.165 1179 HA LEU 158 HA LEU 158 -12.205 10.900 -0.724 1180 HB2 LEU 158 HB2 LEU 158 -11.933 9.344 -3.326 1181 HB3 LEU 158 HB3 LEU 158 -11.472 11.020 -3.052 1182 HG LEU 158 HG LEU 158 -10.129 8.560 -1.851 1183 HD11 LEU 158 HD11 LEU 158 -9.086 10.531 -3.902 1184 HD12 LEU 158 HD12 LEU 158 -9.578 8.860 -4.199 1185 HD13 LEU 158 HD13 LEU 158 -8.179 9.193 -3.182 1186 HD21 LEU 158 HD21 LEU 158 -9.415 11.478 -1.421 1187 HD22 LEU 158 HD22 LEU 158 -8.460 10.097 -0.883 1188 HD23 LEU 158 HD23 LEU 158 -10.064 10.368 -0.213 1189 H SER 159 H SER 159 -14.431 8.534 -2.090 1190 HA SER 159 HA SER 159 -16.297 10.647 -3.058 1191 HB2 SER 159 HB2 SER 159 -15.356 8.747 -4.622 1192 HB3 SER 159 HB3 SER 159 -16.470 7.698 -3.781 1193 HG SER 159 HG SER 159 -18.171 9.127 -4.410 1194 H GLU 160 H GLU 160 -16.059 9.754 -0.233 1195 HA GLU 160 HA GLU 160 -17.869 7.738 0.479 1196 HB2 GLU 160 HB2 GLU 160 -16.002 8.767 1.889 1197 HB3 GLU 160 HB3 GLU 160 -17.127 10.052 2.298 1198 HG2 GLU 160 HG2 GLU 160 -18.664 8.356 3.272 1199 HG3 GLU 160 HG3 GLU 160 -17.504 7.092 2.877 1200 HA PRO 161 HA PRO 161 -21.623 10.248 0.003 1201 HB2 PRO 161 HB2 PRO 161 -23.345 8.300 -0.606 1202 HB3 PRO 161 HB3 PRO 161 -22.017 8.675 -1.717 1203 HG2 PRO 161 HG2 PRO 161 -22.247 6.415 0.273 1204 HG3 PRO 161 HG3 PRO 161 -21.607 6.385 -1.384 1205 HD2 PRO 161 HD2 PRO 161 -20.059 6.632 0.970 1206 HD3 PRO 161 HD3 PRO 161 -19.502 6.992 -0.681 1207 H ALA 162 H ALA 162 -20.670 8.753 2.705 1208 HA ALA 162 HA ALA 162 -21.348 8.493 4.841 1209 HB1 ALA 162 HB1 ALA 162 -23.915 9.918 4.089 1210 HB2 ALA 162 HB2 ALA 162 -22.430 10.697 4.635 1211 HB3 ALA 162 HB3 ALA 162 -23.318 9.635 5.730 1212 H ASN 163 H ASN 163 -24.280 7.907 2.873 1213 HA ASN 163 HA ASN 163 -25.465 5.727 3.890 1214 HB2 ASN 163 HB2 ASN 163 -26.344 6.699 1.913 1215 HB3 ASN 163 HB3 ASN 163 -24.842 6.504 1.027 1216 HD21 ASN 163 HD21 ASN 163 -27.678 4.785 2.245 1217 HD22 ASN 163 HD22 ASN 163 -27.534 3.466 1.136 1218 H ALA 164 H ALA 164 -22.725 5.389 1.571 1219 HA ALA 164 HA ALA 164 -21.132 3.835 1.222 1220 HB1 ALA 164 HB1 ALA 164 -20.074 2.772 3.160 1221 HB2 ALA 164 HB2 ALA 164 -21.465 3.179 4.167 1222 HB3 ALA 164 HB3 ALA 164 -20.446 4.461 3.514 1223 H LEU 165 H LEU 165 -23.160 2.981 0.035 1224 HA LEU 165 HA LEU 165 -24.369 0.554 0.860 1225 HB2 LEU 165 HB2 LEU 165 -25.296 0.370 -1.374 1226 HB3 LEU 165 HB3 LEU 165 -25.448 2.017 -0.803 1227 HG LEU 165 HG LEU 165 -23.295 1.145 -2.765 1228 HD11 LEU 165 HD11 LEU 165 -25.479 0.723 -3.780 1229 HD12 LEU 165 HD12 LEU 165 -24.654 2.059 -4.578 1230 HD13 LEU 165 HD13 LEU 165 -25.972 2.387 -3.446 1231 HD21 LEU 165 HD21 LEU 165 -24.306 3.922 -2.104 1232 HD22 LEU 165 HD22 LEU 165 -23.089 3.528 -3.323 1233 HD23 LEU 165 HD23 LEU 165 -22.755 3.235 -1.618 1234 H GLU 166 H GLU 166 -23.414 -1.370 1.063 1235 HA GLU 166 HA GLU 166 -21.141 -2.208 -0.584 1236 HB2 GLU 166 HB2 GLU 166 -22.650 -3.632 1.656 1237 HB3 GLU 166 HB3 GLU 166 -21.266 -4.307 0.800 1238 HG2 GLU 166 HG2 GLU 166 -19.854 -2.448 1.644 1239 HG3 GLU 166 HG3 GLU 166 -21.242 -1.811 2.528 1240 H HIS 167 H HIS 167 -21.882 -2.563 -2.669 1241 HA HIS 167 HA HIS 167 -23.820 -4.763 -3.052 1242 HB2 HIS 167 HB2 HIS 167 -24.997 -2.562 -3.419 1243 HB3 HIS 167 HB3 HIS 167 -23.872 -2.205 -4.726 1244 HD1 HIS 167 HD1 HIS 167 -24.113 -3.649 -6.913 1245 HD2 HIS 167 HD2 HIS 167 -27.039 -4.375 -4.057 1246 HE1 HIS 167 HE1 HIS 167 -25.876 -4.991 -8.085 1247 HE2 HIS 167 HE2 HIS 167 -27.643 -5.407 -6.352 1248 H HIS 168 H HIS 168 -22.453 -6.289 -3.779 1249 HA HIS 168 HA HIS 168 -20.387 -5.790 -5.749 1250 HB2 HIS 168 HB2 HIS 168 -20.017 -8.259 -5.648 1251 HB3 HIS 168 HB3 HIS 168 -19.961 -7.488 -4.069 1252 HD1 HIS 168 HD1 HIS 168 -21.745 -8.173 -2.352 1253 HD2 HIS 168 HD2 HIS 168 -22.176 -10.046 -6.038 1254 HE1 HIS 168 HE1 HIS 168 -23.420 -10.004 -1.982 1255 HE2 HIS 168 HE2 HIS 168 -23.507 -11.236 -4.170 1256 H HIS 169 H HIS 169 -20.533 -6.001 -7.926 1257 HA HIS 169 HA HIS 169 -22.561 -7.588 -9.252 1258 HB2 HIS 169 HB2 HIS 169 -23.860 -5.530 -8.748 1259 HB3 HIS 169 HB3 HIS 169 -22.645 -4.548 -9.558 1260 HD1 HIS 169 HD1 HIS 169 -22.820 -4.339 -12.087 1261 HD2 HIS 169 HD2 HIS 169 -25.455 -7.152 -10.533 1262 HE1 HIS 169 HE1 HIS 169 -24.346 -4.946 -13.982 1263 HE2 HIS 169 HE2 HIS 169 -26.004 -6.553 -12.994 1264 H HIS 170 H HIS 170 -20.945 -8.638 -10.357 1265 HA HIS 170 HA HIS 170 -19.580 -7.087 -12.490 1266 HB2 HIS 170 HB2 HIS 170 -18.466 -9.474 -10.951 1267 HB3 HIS 170 HB3 HIS 170 -17.742 -8.839 -12.427 1268 HD1 HIS 170 HD1 HIS 170 -17.045 -8.731 -9.034 1269 HD2 HIS 170 HD2 HIS 170 -17.445 -5.738 -11.883 1270 HE1 HIS 170 HE1 HIS 170 -15.778 -6.771 -8.129 1271 HE2 HIS 170 HE2 HIS 170 -15.887 -5.052 -9.940 1272 H HIS 171 H HIS 171 -21.222 -7.426 -13.925 1273 HA HIS 171 HA HIS 171 -21.234 -9.988 -15.325 1274 HB2 HIS 171 HB2 HIS 171 -23.116 -10.185 -13.673 1275 HB3 HIS 171 HB3 HIS 171 -23.839 -8.722 -14.329 1276 HD1 HIS 171 HD1 HIS 171 -24.763 -8.916 -16.827 1277 HD2 HIS 171 HD2 HIS 171 -23.769 -12.516 -15.008 1278 HE1 HIS 171 HE1 HIS 171 -25.839 -10.695 -18.236 1279 HE2 HIS 171 HE2 HIS 171 -25.407 -12.830 -16.985 1280 H HIS 172 H HIS 172 -20.217 -8.890 -17.011 1281 HA HIS 172 HA HIS 172 -21.492 -6.561 -18.259 1282 HB2 HIS 172 HB2 HIS 172 -19.003 -6.630 -17.870 1283 HB3 HIS 172 HB3 HIS 172 -18.892 -7.977 -18.999 1284 HD1 HIS 172 HD1 HIS 172 -18.512 -7.339 -21.391 1285 HD2 HIS 172 HD2 HIS 172 -20.032 -4.175 -19.170 1286 HE1 HIS 172 HE1 HIS 172 -18.447 -5.352 -22.925 1287 HE2 HIS 172 HE2 HIS 172 -19.388 -3.455 -21.566 Start of MODEL 19 1 H1 THR 1 H1 THR 1 -13.290 1.517 -6.801 2 H2 THR 1 H2 THR 1 -13.380 3.194 -6.984 3 H3 THR 1 H3 THR 1 -11.907 2.467 -6.580 4 HA THR 1 HA THR 1 -13.405 2.089 -9.098 5 HB THR 1 HB THR 1 -10.829 3.637 -8.678 6 HG1 THR 1 HG1 THR 1 -12.282 5.452 -9.227 7 HG21 THR 1 HG21 THR 1 -11.172 4.408 -11.004 8 HG22 THR 1 HG22 THR 1 -12.593 3.371 -11.147 9 HG23 THR 1 HG23 THR 1 -10.991 2.653 -10.943 10 H VAL 2 H VAL 2 -9.864 1.977 -8.631 11 HA VAL 2 HA VAL 2 -8.330 0.553 -9.481 12 HB VAL 2 HB VAL 2 -10.100 -1.630 -8.294 13 HG11 VAL 2 HG11 VAL 2 -8.397 -2.580 -9.798 14 HG12 VAL 2 HG12 VAL 2 -7.992 -2.948 -8.121 15 HG13 VAL 2 HG13 VAL 2 -7.127 -1.668 -8.973 16 HG21 VAL 2 HG21 VAL 2 -8.697 -1.419 -6.259 17 HG22 VAL 2 HG22 VAL 2 -9.557 0.083 -6.609 18 HG23 VAL 2 HG23 VAL 2 -7.841 -0.058 -6.994 19 H VAL 3 H VAL 3 -8.452 0.838 -11.677 20 HA VAL 3 HA VAL 3 -10.487 -0.488 -13.303 21 HB VAL 3 HB VAL 3 -9.396 0.770 -15.234 22 HG11 VAL 3 HG11 VAL 3 -10.349 2.448 -12.876 23 HG12 VAL 3 HG12 VAL 3 -11.383 1.670 -14.078 24 HG13 VAL 3 HG13 VAL 3 -10.301 2.979 -14.562 25 HG21 VAL 3 HG21 VAL 3 -7.769 2.058 -12.998 26 HG22 VAL 3 HG22 VAL 3 -7.809 2.602 -14.681 27 HG23 VAL 3 HG23 VAL 3 -7.123 1.024 -14.279 28 H SER 4 H SER 4 -7.084 -0.956 -12.552 29 HA SER 4 HA SER 4 -7.029 -3.430 -14.139 30 HB2 SER 4 HB2 SER 4 -6.117 -1.744 -15.701 31 HB3 SER 4 HB3 SER 4 -4.936 -1.239 -14.495 32 HG SER 4 HG SER 4 -3.735 -2.907 -14.971 33 H VAL 5 H VAL 5 -5.765 -5.005 -13.267 34 HA VAL 5 HA VAL 5 -3.865 -4.373 -11.073 35 HB VAL 5 HB VAL 5 -5.773 -6.771 -11.141 36 HG11 VAL 5 HG11 VAL 5 -4.835 -7.370 -8.920 37 HG12 VAL 5 HG12 VAL 5 -3.674 -6.049 -9.049 38 HG13 VAL 5 HG13 VAL 5 -3.586 -7.410 -10.169 39 HG21 VAL 5 HG21 VAL 5 -6.914 -4.684 -10.485 40 HG22 VAL 5 HG22 VAL 5 -5.703 -4.407 -9.231 41 HG23 VAL 5 HG23 VAL 5 -6.790 -5.794 -9.115 42 H ASP 6 H ASP 6 -1.993 -4.628 -12.154 43 HA ASP 6 HA ASP 6 -1.524 -6.871 -13.999 44 HB2 ASP 6 HB2 ASP 6 0.254 -4.443 -13.462 45 HB3 ASP 6 HB3 ASP 6 0.394 -5.582 -14.799 46 H LYS 7 H LYS 7 -0.144 -8.530 -13.500 47 HA LYS 7 HA LYS 7 1.787 -8.269 -11.271 48 HB2 LYS 7 HB2 LYS 7 -0.100 -9.465 -10.312 49 HB3 LYS 7 HB3 LYS 7 -0.192 -10.554 -11.693 50 HG2 LYS 7 HG2 LYS 7 1.973 -11.547 -11.072 51 HG3 LYS 7 HG3 LYS 7 2.100 -10.439 -9.701 52 HD2 LYS 7 HD2 LYS 7 0.337 -11.503 -8.527 53 HD3 LYS 7 HD3 LYS 7 -0.267 -12.312 -9.973 54 HE2 LYS 7 HE2 LYS 7 2.432 -12.952 -8.735 55 HE3 LYS 7 HE3 LYS 7 0.950 -13.811 -8.320 56 HZ1 LYS 7 HZ1 LYS 7 0.712 -14.502 -10.595 57 HZ2 LYS 7 HZ2 LYS 7 2.249 -14.936 -10.045 58 HZ3 LYS 7 HZ3 LYS 7 2.062 -13.601 -11.062 59 H ASP 8 H ASP 8 3.798 -8.926 -11.846 60 HA ASP 8 HA ASP 8 4.154 -10.901 -14.022 61 HB2 ASP 8 HB2 ASP 8 4.586 -8.498 -14.810 62 HB3 ASP 8 HB3 ASP 8 5.960 -8.461 -13.712 63 H VAL 9 H VAL 9 5.330 -12.585 -13.372 64 HA VAL 9 HA VAL 9 6.586 -12.646 -10.752 65 HB VAL 9 HB VAL 9 6.446 -14.902 -12.808 66 HG11 VAL 9 HG11 VAL 9 8.023 -15.320 -10.938 67 HG12 VAL 9 HG12 VAL 9 6.637 -16.409 -10.868 68 HG13 VAL 9 HG13 VAL 9 6.723 -15.023 -9.777 69 HG21 VAL 9 HG21 VAL 9 4.385 -15.658 -11.680 70 HG22 VAL 9 HG22 VAL 9 4.174 -14.060 -12.394 71 HG23 VAL 9 HG23 VAL 9 4.412 -14.222 -10.653 72 H GLU 10 H GLU 10 7.639 -12.479 -14.082 73 HA GLU 10 HA GLU 10 10.305 -13.523 -13.742 74 HB2 GLU 10 HB2 GLU 10 9.034 -11.891 -15.981 75 HB3 GLU 10 HB3 GLU 10 10.613 -12.677 -16.083 76 HG2 GLU 10 HG2 GLU 10 9.601 -14.859 -15.857 77 HG3 GLU 10 HG3 GLU 10 8.014 -14.156 -15.563 78 H ALA 11 H ALA 11 8.862 -10.340 -13.699 79 HA ALA 11 HA ALA 11 11.411 -8.935 -13.329 80 HB1 ALA 11 HB1 ALA 11 8.567 -7.876 -13.541 81 HB2 ALA 11 HB2 ALA 11 9.721 -8.004 -14.871 82 HB3 ALA 11 HB3 ALA 11 10.042 -6.898 -13.531 83 H LEU 12 H LEU 12 9.263 -10.560 -11.365 84 HA LEU 12 HA LEU 12 8.607 -10.586 -9.197 85 HB2 LEU 12 HB2 LEU 12 11.169 -9.008 -8.737 86 HB3 LEU 12 HB3 LEU 12 10.288 -9.905 -7.511 87 HG LEU 12 HG LEU 12 11.728 -11.122 -9.909 88 HD11 LEU 12 HD11 LEU 12 13.316 -12.021 -8.275 89 HD12 LEU 12 HD12 LEU 12 12.471 -11.184 -6.969 90 HD13 LEU 12 HD13 LEU 12 13.288 -10.258 -8.231 91 HD21 LEU 12 HD21 LEU 12 11.240 -13.308 -8.894 92 HD22 LEU 12 HD22 LEU 12 9.759 -12.450 -9.310 93 HD23 LEU 12 HD23 LEU 12 10.292 -12.518 -7.629 94 H SER 13 H SER 13 7.466 -8.463 -10.749 95 HA SER 13 HA SER 13 7.178 -6.252 -8.776 96 HB2 SER 13 HB2 SER 13 7.251 -5.990 -11.809 97 HB3 SER 13 HB3 SER 13 6.975 -4.668 -10.678 98 HG SER 13 HG SER 13 9.282 -6.239 -10.377 99 H PHE 14 H PHE 14 5.155 -5.697 -8.244 100 HA PHE 14 HA PHE 14 2.854 -6.723 -9.809 101 HB2 PHE 14 HB2 PHE 14 3.018 -8.007 -7.768 102 HB3 PHE 14 HB3 PHE 14 3.247 -6.558 -6.790 103 HD1 PHE 14 HD1 PHE 14 0.762 -7.780 -9.326 104 HD2 PHE 14 HD2 PHE 14 1.382 -5.977 -5.498 105 HE1 PHE 14 HE1 PHE 14 -1.652 -7.606 -9.024 106 HE2 PHE 14 HE2 PHE 14 -1.045 -5.808 -5.201 107 HZ PHE 14 HZ PHE 14 -2.565 -6.615 -6.963 108 H SER 15 H SER 15 1.845 -5.050 -10.766 109 HA SER 15 HA SER 15 1.890 -2.332 -9.554 110 HB2 SER 15 HB2 SER 15 3.067 -2.470 -11.694 111 HB3 SER 15 HB3 SER 15 1.670 -3.211 -12.465 112 HG SER 15 HG SER 15 0.621 -1.315 -12.443 113 H ILE 16 H ILE 16 -0.058 -1.507 -8.861 114 HA ILE 16 HA ILE 16 -2.598 -2.506 -10.073 115 HB ILE 16 HB ILE 16 -2.173 -1.195 -7.340 116 HG12 ILE 16 HG12 ILE 16 -2.997 -4.044 -8.057 117 HG13 ILE 16 HG13 ILE 16 -1.409 -3.560 -7.470 118 HG21 ILE 16 HG21 ILE 16 -4.779 -2.192 -8.582 119 HG22 ILE 16 HG22 ILE 16 -4.358 -0.506 -8.271 120 HG23 ILE 16 HG23 ILE 16 -4.588 -1.619 -6.922 121 HD11 ILE 16 HD11 ILE 16 -3.989 -3.336 -5.927 122 HD12 ILE 16 HD12 ILE 16 -2.377 -2.897 -5.347 123 HD13 ILE 16 HD13 ILE 16 -2.751 -4.576 -5.729 124 H VAL 17 H VAL 17 -3.637 -1.111 -11.370 125 HA VAL 17 HA VAL 17 -3.052 1.787 -11.271 126 HB VAL 17 HB VAL 17 -4.429 0.209 -13.500 127 HG11 VAL 17 HG11 VAL 17 -3.315 3.049 -13.495 128 HG12 VAL 17 HG12 VAL 17 -5.026 2.608 -13.485 129 HG13 VAL 17 HG13 VAL 17 -4.026 2.223 -14.885 130 HG21 VAL 17 HG21 VAL 17 -2.294 0.364 -14.756 131 HG22 VAL 17 HG22 VAL 17 -2.103 -0.572 -13.272 132 HG23 VAL 17 HG23 VAL 17 -1.515 1.093 -13.347 133 H ALA 18 H ALA 18 -4.488 2.823 -10.021 134 HA ALA 18 HA ALA 18 -7.407 2.351 -10.339 135 HB1 ALA 18 HB1 ALA 18 -5.935 3.256 -7.829 136 HB2 ALA 18 HB2 ALA 18 -6.635 1.658 -8.099 137 HB3 ALA 18 HB3 ALA 18 -7.686 3.072 -7.989 138 H GLU 19 H GLU 19 -8.741 4.308 -10.241 139 HA GLU 19 HA GLU 19 -7.329 6.901 -10.577 140 HB2 GLU 19 HB2 GLU 19 -9.533 5.861 -12.425 141 HB3 GLU 19 HB3 GLU 19 -8.780 7.452 -12.523 142 HG2 GLU 19 HG2 GLU 19 -6.632 6.429 -13.106 143 HG3 GLU 19 HG3 GLU 19 -7.328 4.818 -12.932 144 H PHE 20 H PHE 20 -8.301 8.518 -9.431 145 HA PHE 20 HA PHE 20 -11.037 8.096 -8.342 146 HB2 PHE 20 HB2 PHE 20 -8.674 9.332 -6.841 147 HB3 PHE 20 HB3 PHE 20 -10.290 9.055 -6.193 148 HD1 PHE 20 HD1 PHE 20 -11.123 6.582 -6.088 149 HD2 PHE 20 HD2 PHE 20 -7.000 7.644 -6.596 150 HE1 PHE 20 HE1 PHE 20 -10.444 4.334 -5.365 151 HE2 PHE 20 HE2 PHE 20 -6.335 5.389 -5.872 152 HZ PHE 20 HZ PHE 20 -8.055 3.734 -5.261 153 H ASP 21 H ASP 21 -12.383 9.859 -8.250 154 HA ASP 21 HA ASP 21 -11.777 12.162 -9.884 155 HB2 ASP 21 HB2 ASP 21 -14.212 11.500 -8.172 156 HB3 ASP 21 HB3 ASP 21 -14.109 12.858 -9.286 157 H ALA 22 H ALA 22 -10.035 13.075 -8.786 158 HA ALA 22 HA ALA 22 -10.483 15.075 -6.814 159 HB1 ALA 22 HB1 ALA 22 -9.126 14.096 -4.959 160 HB2 ALA 22 HB2 ALA 22 -9.031 12.572 -5.844 161 HB3 ALA 22 HB3 ALA 22 -10.588 13.154 -5.257 162 H ASP 23 H ASP 23 -8.251 16.008 -6.071 163 HA ASP 23 HA ASP 23 -6.443 16.049 -8.381 164 HB2 ASP 23 HB2 ASP 23 -5.319 17.932 -7.253 165 HB3 ASP 23 HB3 ASP 23 -7.046 18.212 -7.347 166 H VAL 24 H VAL 24 -4.054 16.122 -7.832 167 HA VAL 24 HA VAL 24 -3.179 13.601 -7.084 168 HB VAL 24 HB VAL 24 -1.605 16.202 -7.289 169 HG11 VAL 24 HG11 VAL 24 -0.260 14.540 -6.057 170 HG12 VAL 24 HG12 VAL 24 0.410 14.800 -7.669 171 HG13 VAL 24 HG13 VAL 24 -0.539 13.352 -7.337 172 HG21 VAL 24 HG21 VAL 24 -2.074 14.013 -9.349 173 HG22 VAL 24 HG22 VAL 24 -1.055 15.439 -9.572 174 HG23 VAL 24 HG23 VAL 24 -2.797 15.626 -9.357 175 H LYS 25 H LYS 25 -3.119 16.609 -5.196 176 HA LYS 25 HA LYS 25 -1.639 15.522 -2.986 177 HB2 LYS 25 HB2 LYS 25 -3.279 18.082 -3.097 178 HB3 LYS 25 HB3 LYS 25 -2.044 17.677 -1.903 179 HG2 LYS 25 HG2 LYS 25 -0.343 17.631 -3.739 180 HG3 LYS 25 HG3 LYS 25 -1.595 18.145 -4.869 181 HD2 LYS 25 HD2 LYS 25 -0.263 20.063 -4.198 182 HD3 LYS 25 HD3 LYS 25 -1.896 20.235 -3.545 183 HE2 LYS 25 HE2 LYS 25 -1.102 19.473 -1.339 184 HE3 LYS 25 HE3 LYS 25 0.521 19.233 -1.991 185 HZ1 LYS 25 HZ1 LYS 25 -0.912 21.825 -1.851 186 HZ2 LYS 25 HZ2 LYS 25 0.653 21.591 -2.441 187 HZ3 LYS 25 HZ3 LYS 25 0.321 21.325 -0.807 188 H ARG 26 H ARG 26 -5.063 15.838 -3.723 189 HA ARG 26 HA ARG 26 -6.123 15.264 -1.136 190 HB2 ARG 26 HB2 ARG 26 -7.514 16.258 -2.894 191 HB3 ARG 26 HB3 ARG 26 -7.294 14.845 -3.914 192 HG2 ARG 26 HG2 ARG 26 -9.512 14.816 -2.936 193 HG3 ARG 26 HG3 ARG 26 -8.566 13.472 -2.298 194 HD2 ARG 26 HD2 ARG 26 -8.191 14.719 -0.205 195 HD3 ARG 26 HD3 ARG 26 -9.091 16.098 -0.853 196 HE ARG 26 HE ARG 26 -10.703 13.788 -0.975 197 HH11 ARG 26 HH11 ARG 26 -9.503 16.029 1.379 198 HH12 ARG 26 HH12 ARG 26 -10.783 15.702 2.488 199 HH21 ARG 26 HH21 ARG 26 -12.326 13.398 0.457 200 HH22 ARG 26 HH22 ARG 26 -12.356 14.213 1.978 201 H VAL 27 H VAL 27 -5.334 13.193 -3.943 202 HA VAL 27 HA VAL 27 -5.948 10.704 -2.636 203 HB VAL 27 HB VAL 27 -4.114 11.028 -5.055 204 HG11 VAL 27 HG11 VAL 27 -4.098 8.767 -4.069 205 HG12 VAL 27 HG12 VAL 27 -4.894 8.738 -5.643 206 HG13 VAL 27 HG13 VAL 27 -5.860 8.689 -4.165 207 HG21 VAL 27 HG21 VAL 27 -7.158 10.833 -5.077 208 HG22 VAL 27 HG22 VAL 27 -6.118 10.773 -6.502 209 HG23 VAL 27 HG23 VAL 27 -6.203 12.245 -5.536 210 H TRP 28 H TRP 28 -3.042 12.706 -2.892 211 HA TRP 28 HA TRP 28 -1.163 10.914 -1.726 212 HB2 TRP 28 HB2 TRP 28 -0.489 12.942 -2.973 213 HB3 TRP 28 HB3 TRP 28 -1.216 13.964 -1.746 214 HD1 TRP 28 HD1 TRP 28 0.321 14.623 0.302 215 HE1 TRP 28 HE1 TRP 28 2.736 14.076 0.974 216 HE3 TRP 28 HE3 TRP 28 1.284 10.900 -3.072 217 HZ2 TRP 28 HZ2 TRP 28 4.787 12.314 0.177 218 HZ3 TRP 28 HZ3 TRP 28 3.504 9.845 -3.056 219 HH2 TRP 28 HH2 TRP 28 5.220 10.539 -1.461 220 H ALA 29 H ALA 29 -3.575 13.069 -0.329 221 HA ALA 29 HA ALA 29 -2.626 13.428 2.269 222 HB1 ALA 29 HB1 ALA 29 -4.935 14.001 2.868 223 HB2 ALA 29 HB2 ALA 29 -5.521 13.257 1.376 224 HB3 ALA 29 HB3 ALA 29 -4.501 14.696 1.303 225 H ILE 30 H ILE 30 -4.395 10.663 0.937 226 HA ILE 30 HA ILE 30 -5.048 9.362 3.392 227 HB ILE 30 HB ILE 30 -5.540 7.376 2.090 228 HG12 ILE 30 HG12 ILE 30 -3.945 8.707 -0.139 229 HG13 ILE 30 HG13 ILE 30 -3.542 7.222 0.700 230 HG21 ILE 30 HG21 ILE 30 -6.309 9.845 0.489 231 HG22 ILE 30 HG22 ILE 30 -7.157 9.224 1.909 232 HG23 ILE 30 HG23 ILE 30 -7.114 8.274 0.425 233 HD11 ILE 30 HD11 ILE 30 -4.306 6.724 -1.481 234 HD12 ILE 30 HD12 ILE 30 -5.781 7.657 -1.246 235 HD13 ILE 30 HD13 ILE 30 -5.522 6.167 -0.332 236 H TRP 31 H TRP 31 -2.081 9.496 1.528 237 HA TRP 31 HA TRP 31 -0.804 7.256 2.920 238 HB2 TRP 31 HB2 TRP 31 0.292 9.222 0.853 239 HB3 TRP 31 HB3 TRP 31 1.172 7.830 1.488 240 HD1 TRP 31 HD1 TRP 31 -1.244 8.768 -1.245 241 HE1 TRP 31 HE1 TRP 31 -1.958 6.660 -2.536 242 HE3 TRP 31 HE3 TRP 31 0.630 5.197 1.909 243 HZ2 TRP 31 HZ2 TRP 31 -1.745 3.857 -2.266 244 HZ3 TRP 31 HZ3 TRP 31 0.342 2.826 1.319 245 HH2 TRP 31 HH2 TRP 31 -0.831 2.166 -0.716 246 H GLU 32 H GLU 32 -0.653 10.784 2.819 247 HA GLU 32 HA GLU 32 1.686 11.050 4.460 248 HB2 GLU 32 HB2 GLU 32 1.036 12.673 2.677 249 HB3 GLU 32 HB3 GLU 32 -0.354 13.170 3.643 250 HG2 GLU 32 HG2 GLU 32 1.094 14.068 5.367 251 HG3 GLU 32 HG3 GLU 32 2.523 13.401 4.580 252 H ASP 33 H ASP 33 -1.806 11.466 5.019 253 HA ASP 33 HA ASP 33 -1.448 11.991 7.868 254 HB2 ASP 33 HB2 ASP 33 -3.919 11.804 6.097 255 HB3 ASP 33 HB3 ASP 33 -3.992 12.081 7.835 256 HA PRO 34 HA PRO 34 -1.501 7.503 8.664 257 HB2 PRO 34 HB2 PRO 34 -1.492 7.673 11.435 258 HB3 PRO 34 HB3 PRO 34 -0.057 7.816 10.420 259 HG2 PRO 34 HG2 PRO 34 -1.752 10.007 11.610 260 HG3 PRO 34 HG3 PRO 34 0.021 9.875 11.555 261 HD2 PRO 34 HD2 PRO 34 -1.302 11.446 9.816 262 HD3 PRO 34 HD3 PRO 34 0.123 10.516 9.296 263 H ARG 35 H ARG 35 -3.796 9.713 10.305 264 HA ARG 35 HA ARG 35 -5.656 7.707 11.129 265 HB2 ARG 35 HB2 ARG 35 -5.806 10.707 10.874 266 HB3 ARG 35 HB3 ARG 35 -7.293 9.811 11.129 267 HG2 ARG 35 HG2 ARG 35 -6.437 10.694 13.234 268 HG3 ARG 35 HG3 ARG 35 -6.444 8.934 13.255 269 HD2 ARG 35 HD2 ARG 35 -3.907 10.405 12.530 270 HD3 ARG 35 HD3 ARG 35 -4.386 10.271 14.223 271 HE ARG 35 HE ARG 35 -4.414 7.721 12.915 272 HH11 ARG 35 HH11 ARG 35 -2.211 10.004 14.313 273 HH12 ARG 35 HH12 ARG 35 -1.080 8.775 14.741 274 HH21 ARG 35 HH21 ARG 35 -2.939 6.219 13.473 275 HH22 ARG 35 HH22 ARG 35 -1.483 6.679 14.276 276 H GLN 36 H GLN 36 -5.443 9.681 8.161 277 HA GLN 36 HA GLN 36 -7.841 8.668 6.949 278 HB2 GLN 36 HB2 GLN 36 -5.372 9.872 5.622 279 HB3 GLN 36 HB3 GLN 36 -6.911 9.570 4.817 280 HG2 GLN 36 HG2 GLN 36 -7.995 11.177 6.402 281 HG3 GLN 36 HG3 GLN 36 -6.403 11.529 7.075 282 HE21 GLN 36 HE21 GLN 36 -6.426 13.693 6.471 283 HE22 GLN 36 HE22 GLN 36 -6.327 14.217 4.832 284 H LEU 37 H LEU 37 -4.456 7.671 6.933 285 HA LEU 37 HA LEU 37 -4.497 5.736 4.885 286 HB2 LEU 37 HB2 LEU 37 -2.456 6.738 5.779 287 HB3 LEU 37 HB3 LEU 37 -2.750 6.021 7.351 288 HG LEU 37 HG LEU 37 -2.319 3.765 6.422 289 HD11 LEU 37 HD11 LEU 37 -1.435 3.423 4.178 290 HD12 LEU 37 HD12 LEU 37 -1.659 5.139 3.801 291 HD13 LEU 37 HD13 LEU 37 -3.065 4.109 4.102 292 HD21 LEU 37 HD21 LEU 37 -0.111 5.751 5.815 293 HD22 LEU 37 HD22 LEU 37 0.087 4.013 6.079 294 HD23 LEU 37 HD23 LEU 37 -0.479 5.042 7.392 295 H GLU 38 H GLU 38 -4.750 5.292 8.429 296 HA GLU 38 HA GLU 38 -4.992 2.457 8.400 297 HB2 GLU 38 HB2 GLU 38 -5.547 2.685 10.789 298 HB3 GLU 38 HB3 GLU 38 -4.188 3.708 10.350 299 HG2 GLU 38 HG2 GLU 38 -5.740 5.662 10.243 300 HG3 GLU 38 HG3 GLU 38 -7.043 4.614 10.809 301 H ARG 39 H ARG 39 -7.325 4.974 7.955 302 HA ARG 39 HA ARG 39 -9.737 3.681 8.591 303 HB2 ARG 39 HB2 ARG 39 -9.996 5.980 8.346 304 HB3 ARG 39 HB3 ARG 39 -8.880 6.077 6.996 305 HG2 ARG 39 HG2 ARG 39 -10.578 5.252 5.466 306 HG3 ARG 39 HG3 ARG 39 -11.707 5.016 6.791 307 HD2 ARG 39 HD2 ARG 39 -10.600 7.779 6.439 308 HD3 ARG 39 HD3 ARG 39 -11.723 7.209 5.205 309 HE ARG 39 HE ARG 39 -12.591 6.978 7.985 310 HH11 ARG 39 HH11 ARG 39 -12.744 8.812 5.047 311 HH12 ARG 39 HH12 ARG 39 -14.232 9.575 5.471 312 HH21 ARG 39 HH21 ARG 39 -14.517 8.002 8.502 313 HH22 ARG 39 HH22 ARG 39 -15.217 9.122 7.388 314 H TRP 40 H TRP 40 -7.698 3.441 5.694 315 HA TRP 40 HA TRP 40 -9.650 1.545 4.481 316 HB2 TRP 40 HB2 TRP 40 -8.878 2.240 2.252 317 HB3 TRP 40 HB3 TRP 40 -9.482 3.621 3.156 318 HD1 TRP 40 HD1 TRP 40 -7.698 5.537 3.809 319 HE1 TRP 40 HE1 TRP 40 -5.325 6.048 2.968 320 HE3 TRP 40 HE3 TRP 40 -6.705 1.137 1.424 321 HZ2 TRP 40 HZ2 TRP 40 -3.315 4.778 1.453 322 HZ3 TRP 40 HZ3 TRP 40 -4.544 0.859 0.295 323 HH2 TRP 40 HH2 TRP 40 -2.892 2.643 0.317 324 H TRP 41 H TRP 41 -6.546 1.768 5.825 325 HA TRP 41 HA TRP 41 -4.995 0.182 4.034 326 HB2 TRP 41 HB2 TRP 41 -4.122 1.815 5.775 327 HB3 TRP 41 HB3 TRP 41 -4.471 0.611 7.006 328 HD1 TRP 41 HD1 TRP 41 -2.346 -0.696 7.674 329 HE1 TRP 41 HE1 TRP 41 -0.142 -1.337 6.534 330 HE3 TRP 41 HE3 TRP 41 -3.223 1.189 2.983 331 HZ2 TRP 41 HZ2 TRP 41 1.066 -1.107 4.017 332 HZ3 TRP 41 HZ3 TRP 41 -1.500 0.911 1.274 333 HH2 TRP 41 HH2 TRP 41 0.613 -0.215 1.772 334 H GLY 42 H GLY 42 -5.724 -1.805 3.537 335 HA2 GLY 42 HA2 GLY 42 -5.765 -4.181 4.107 336 HA3 GLY 42 HA3 GLY 42 -6.486 -3.752 5.656 337 HA PRO 43 HA PRO 43 -9.875 -4.688 2.388 338 HB2 PRO 43 HB2 PRO 43 -10.853 -7.038 3.424 339 HB3 PRO 43 HB3 PRO 43 -9.509 -7.005 2.270 340 HG2 PRO 43 HG2 PRO 43 -9.412 -7.206 5.286 341 HG3 PRO 43 HG3 PRO 43 -8.526 -8.167 4.082 342 HD2 PRO 43 HD2 PRO 43 -7.365 -6.072 5.371 343 HD3 PRO 43 HD3 PRO 43 -6.964 -6.458 3.680 344 HA PRO 44 HA PRO 44 -13.228 -2.881 4.865 345 HB2 PRO 44 HB2 PRO 44 -14.992 -5.117 3.825 346 HB3 PRO 44 HB3 PRO 44 -15.297 -3.370 3.866 347 HG2 PRO 44 HG2 PRO 44 -14.582 -4.505 1.575 348 HG3 PRO 44 HG3 PRO 44 -13.862 -2.948 2.040 349 HD2 PRO 44 HD2 PRO 44 -12.650 -5.711 2.168 350 HD3 PRO 44 HD3 PRO 44 -11.898 -4.170 1.694 351 H THR 45 H THR 45 -12.607 -6.316 5.218 352 HA THR 45 HA THR 45 -14.069 -6.650 7.716 353 HB THR 45 HB THR 45 -12.987 -8.965 7.675 354 HG1 THR 45 HG1 THR 45 -11.545 -9.415 6.165 355 HG21 THR 45 HG21 THR 45 -14.494 -8.164 5.153 356 HG22 THR 45 HG22 THR 45 -15.234 -8.629 6.687 357 HG23 THR 45 HG23 THR 45 -14.304 -9.811 5.761 358 H TRP 46 H TRP 46 -10.756 -5.898 6.779 359 HA TRP 46 HA TRP 46 -9.854 -5.992 9.619 360 HB2 TRP 46 HB2 TRP 46 -8.261 -6.646 7.097 361 HB3 TRP 46 HB3 TRP 46 -7.518 -6.406 8.671 362 HD1 TRP 46 HD1 TRP 46 -10.075 -8.842 7.009 363 HE1 TRP 46 HE1 TRP 46 -9.845 -11.122 8.165 364 HE3 TRP 46 HE3 TRP 46 -6.585 -7.651 10.547 365 HZ2 TRP 46 HZ2 TRP 46 -8.388 -12.281 10.241 366 HZ3 TRP 46 HZ3 TRP 46 -5.815 -9.416 12.075 367 HH2 TRP 46 HH2 TRP 46 -6.696 -11.689 11.926 368 HA PRO 47 HA PRO 47 -9.072 -1.542 8.367 369 HB2 PRO 47 HB2 PRO 47 -10.187 -0.354 10.547 370 HB3 PRO 47 HB3 PRO 47 -11.167 -0.870 9.165 371 HG2 PRO 47 HG2 PRO 47 -10.715 -2.294 11.794 372 HG3 PRO 47 HG3 PRO 47 -12.241 -2.031 10.922 373 HD2 PRO 47 HD2 PRO 47 -10.846 -4.388 10.778 374 HD3 PRO 47 HD3 PRO 47 -11.844 -3.787 9.440 375 H ALA 48 H ALA 48 -7.151 -0.540 8.944 376 HA ALA 48 HA ALA 48 -5.499 -1.789 11.000 377 HB1 ALA 48 HB1 ALA 48 -4.806 0.417 9.038 378 HB2 ALA 48 HB2 ALA 48 -4.561 -1.312 8.776 379 HB3 ALA 48 HB3 ALA 48 -3.662 -0.478 10.048 380 H THR 49 H THR 49 -4.085 -0.407 12.375 381 HA THR 49 HA THR 49 -5.015 2.278 13.105 382 HB THR 49 HB THR 49 -4.751 0.025 15.162 383 HG1 THR 49 HG1 THR 49 -6.872 1.034 13.834 384 HG21 THR 49 HG21 THR 49 -3.808 2.111 16.086 385 HG22 THR 49 HG22 THR 49 -5.343 1.725 16.868 386 HG23 THR 49 HG23 THR 49 -5.275 2.987 15.634 387 H PHE 50 H PHE 50 -3.188 3.481 12.905 388 HA PHE 50 HA PHE 50 -0.548 2.238 13.117 389 HB2 PHE 50 HB2 PHE 50 -1.524 4.888 12.010 390 HB3 PHE 50 HB3 PHE 50 0.190 4.644 12.340 391 HD1 PHE 50 HD1 PHE 50 -2.683 3.145 10.459 392 HD2 PHE 50 HD2 PHE 50 1.562 3.548 10.744 393 HE1 PHE 50 HE1 PHE 50 -2.429 1.963 8.324 394 HE2 PHE 50 HE2 PHE 50 1.811 2.363 8.605 395 HZ PHE 50 HZ PHE 50 -0.180 1.567 7.394 396 H GLU 51 H GLU 51 0.230 2.034 15.106 397 HA GLU 51 HA GLU 51 -0.142 3.812 17.295 398 HB2 GLU 51 HB2 GLU 51 2.009 1.709 16.816 399 HB3 GLU 51 HB3 GLU 51 1.676 2.478 18.368 400 HG2 GLU 51 HG2 GLU 51 -0.248 0.715 16.808 401 HG3 GLU 51 HG3 GLU 51 0.684 0.222 18.219 402 H THR 52 H THR 52 2.433 3.500 14.839 403 HA THR 52 HA THR 52 3.065 6.341 15.276 404 HB THR 52 HB THR 52 4.908 5.111 16.443 405 HG1 THR 52 HG1 THR 52 6.595 6.261 15.332 406 HG21 THR 52 HG21 THR 52 6.609 3.887 15.145 407 HG22 THR 52 HG22 THR 52 5.626 4.045 13.690 408 HG23 THR 52 HG23 THR 52 5.044 3.073 15.046 409 H HIS 53 H HIS 53 3.909 7.402 13.431 410 HA HIS 53 HA HIS 53 4.285 6.049 10.892 411 HB2 HIS 53 HB2 HIS 53 1.794 6.244 11.074 412 HB3 HIS 53 HB3 HIS 53 1.948 7.982 11.281 413 HD2 HIS 53 HD2 HIS 53 1.950 5.307 8.458 414 HE1 HIS 53 HE1 HIS 53 2.098 9.159 6.730 415 HE2 HIS 53 HE2 HIS 53 1.581 6.726 6.324 416 H GLU 54 H GLU 54 6.321 6.975 10.876 417 HA GLU 54 HA GLU 54 6.949 9.673 11.572 418 HB2 GLU 54 HB2 GLU 54 8.582 7.693 9.919 419 HB3 GLU 54 HB3 GLU 54 9.207 9.155 10.675 420 HG2 GLU 54 HG2 GLU 54 8.031 6.797 12.172 421 HG3 GLU 54 HG3 GLU 54 9.747 7.054 11.921 422 H PHE 55 H PHE 55 6.577 8.042 8.439 423 HA PHE 55 HA PHE 55 6.523 8.660 6.284 424 HB2 PHE 55 HB2 PHE 55 4.359 9.677 7.284 425 HB3 PHE 55 HB3 PHE 55 5.160 11.237 7.146 426 HD1 PHE 55 HD1 PHE 55 4.128 8.250 5.149 427 HD2 PHE 55 HD2 PHE 55 5.076 12.416 5.040 428 HE1 PHE 55 HE1 PHE 55 3.409 8.350 2.806 429 HE2 PHE 55 HE2 PHE 55 4.345 12.506 2.693 430 HZ PHE 55 HZ PHE 55 3.516 10.473 1.576 431 H THR 56 H THR 56 8.922 8.884 6.691 432 HA THR 56 HA THR 56 9.913 11.244 5.324 433 HB THR 56 HB THR 56 10.059 12.009 7.677 434 HG1 THR 56 HG1 THR 56 11.981 12.862 7.313 435 HG21 THR 56 HG21 THR 56 10.245 9.836 8.839 436 HG22 THR 56 HG22 THR 56 11.570 10.908 9.298 437 HG23 THR 56 HG23 THR 56 11.857 9.599 8.150 438 H VAL 57 H VAL 57 12.333 10.981 4.875 439 HA VAL 57 HA VAL 57 12.815 8.446 3.644 440 HB VAL 57 HB VAL 57 14.753 10.764 4.145 441 HG11 VAL 57 HG11 VAL 57 16.101 9.824 2.277 442 HG12 VAL 57 HG12 VAL 57 15.007 8.443 2.187 443 HG13 VAL 57 HG13 VAL 57 15.989 8.696 3.630 444 HG21 VAL 57 HG21 VAL 57 12.788 11.492 2.848 445 HG22 VAL 57 HG22 VAL 57 13.024 10.172 1.702 446 HG23 VAL 57 HG23 VAL 57 14.220 11.468 1.814 447 H GLY 58 H GLY 58 13.267 6.639 4.828 448 HA2 GLY 58 HA2 GLY 58 14.582 5.213 6.123 449 HA3 GLY 58 HA3 GLY 58 15.455 6.590 6.772 450 H GLY 59 H GLY 59 12.113 7.106 7.018 451 HA2 GLY 59 HA2 GLY 59 12.036 6.358 9.881 452 HA3 GLY 59 HA3 GLY 59 10.917 7.427 9.046 453 H LYS 60 H LYS 60 10.030 5.303 10.741 454 HA LYS 60 HA LYS 60 8.758 3.480 8.782 455 HB2 LYS 60 HB2 LYS 60 9.928 2.689 11.477 456 HB3 LYS 60 HB3 LYS 60 8.813 1.668 10.569 457 HG2 LYS 60 HG2 LYS 60 10.469 1.834 8.624 458 HG3 LYS 60 HG3 LYS 60 11.606 2.524 9.784 459 HD2 LYS 60 HD2 LYS 60 11.474 0.450 11.132 460 HD3 LYS 60 HD3 LYS 60 10.316 -0.224 9.978 461 HE2 LYS 60 HE2 LYS 60 12.612 -1.085 9.617 462 HE3 LYS 60 HE3 LYS 60 12.004 -0.202 8.219 463 HZ1 LYS 60 HZ1 LYS 60 14.280 0.384 8.691 464 HZ2 LYS 60 HZ2 LYS 60 13.875 0.857 10.260 465 HZ3 LYS 60 HZ3 LYS 60 13.278 1.722 8.939 466 H ALA 61 H ALA 61 6.969 2.180 9.854 467 HA ALA 61 HA ALA 61 5.223 3.809 11.579 468 HB1 ALA 61 HB1 ALA 61 3.323 3.497 10.042 469 HB2 ALA 61 HB2 ALA 61 4.374 2.677 8.883 470 HB3 ALA 61 HB3 ALA 61 4.628 4.383 9.255 471 H ALA 62 H ALA 62 4.008 2.585 12.969 472 HA ALA 62 HA ALA 62 4.142 -0.388 12.758 473 HB1 ALA 62 HB1 ALA 62 3.942 1.326 15.270 474 HB2 ALA 62 HB2 ALA 62 5.355 0.412 14.737 475 HB3 ALA 62 HB3 ALA 62 3.889 -0.442 15.228 476 H TYR 63 H TYR 63 2.213 -1.350 12.467 477 HA TYR 63 HA TYR 63 -0.268 -0.065 13.388 478 HB2 TYR 63 HB2 TYR 63 -1.388 -0.439 11.220 479 HB3 TYR 63 HB3 TYR 63 -0.025 0.653 11.050 480 HD1 TYR 63 HD1 TYR 63 2.094 -0.150 9.897 481 HD2 TYR 63 HD2 TYR 63 -1.443 -2.561 10.011 482 HE1 TYR 63 HE1 TYR 63 2.970 -1.527 8.063 483 HE2 TYR 63 HE2 TYR 63 -0.566 -3.938 8.179 484 HH TYR 63 HH TYR 63 1.084 -3.705 6.304 485 H TYR 64 H TYR 64 -2.162 -1.525 13.132 486 HA TYR 64 HA TYR 64 -1.717 -4.354 12.678 487 HB2 TYR 64 HB2 TYR 64 -2.745 -5.080 14.829 488 HB3 TYR 64 HB3 TYR 64 -1.227 -4.237 15.081 489 HD1 TYR 64 HD2 TYR 64 -1.232 -1.876 16.011 490 HD2 TYR 64 HD1 TYR 64 -4.815 -4.215 15.764 491 HE1 TYR 64 HE2 TYR 64 -2.346 -0.368 17.595 492 HE2 TYR 64 HE1 TYR 64 -5.918 -2.701 17.346 493 HH TYR 64 HH TYR 64 -4.619 0.332 18.214 494 H MET 65 H MET 65 -3.495 -5.256 11.736 495 HA MET 65 HA MET 65 -5.941 -3.653 11.449 496 HB2 MET 65 HB2 MET 65 -5.090 -6.233 10.063 497 HB3 MET 65 HB3 MET 65 -6.586 -5.363 9.742 498 HG2 MET 65 HG2 MET 65 -5.115 -4.771 7.990 499 HG3 MET 65 HG3 MET 65 -5.131 -3.377 9.066 500 HE1 MET 65 HE1 MET 65 -3.184 -6.863 9.240 501 HE2 MET 65 HE2 MET 65 -1.623 -6.347 8.601 502 HE3 MET 65 HE3 MET 65 -3.050 -6.319 7.566 503 H THR 66 H THR 66 -7.680 -4.040 12.696 504 HA THR 66 HA THR 66 -7.831 -6.451 14.386 505 HB THR 66 HB THR 66 -9.608 -3.963 14.408 506 HG1 THR 66 HG1 THR 66 -7.546 -3.392 15.072 507 HG21 THR 66 HG21 THR 66 -9.354 -6.211 16.457 508 HG22 THR 66 HG22 THR 66 -10.744 -5.939 15.402 509 HG23 THR 66 HG23 THR 66 -10.337 -4.755 16.645 510 H GLY 67 H GLY 67 -8.852 -8.169 13.534 511 HA2 GLY 67 HA2 GLY 67 -10.395 -7.938 11.085 512 HA3 GLY 67 HA3 GLY 67 -9.826 -9.411 11.839 513 HA PRO 68 HA PRO 68 -14.500 -9.048 12.389 514 HB2 PRO 68 HB2 PRO 68 -15.259 -11.218 10.923 515 HB3 PRO 68 HB3 PRO 68 -14.967 -9.640 10.181 516 HG2 PRO 68 HG2 PRO 68 -13.135 -12.038 10.314 517 HG3 PRO 68 HG3 PRO 68 -13.484 -10.979 8.928 518 HD2 PRO 68 HD2 PRO 68 -11.233 -10.713 10.485 519 HD3 PRO 68 HD3 PRO 68 -11.993 -9.341 9.652 520 H ASP 69 H ASP 69 -12.136 -11.581 12.735 521 HA ASP 69 HA ASP 69 -13.525 -13.151 14.703 522 HB2 ASP 69 HB2 ASP 69 -11.710 -14.022 13.197 523 HB3 ASP 69 HB3 ASP 69 -10.551 -12.985 14.018 524 H GLY 70 H GLY 70 -11.700 -10.211 14.743 525 HA2 GLY 70 HA2 GLY 70 -11.403 -8.761 16.608 526 HA3 GLY 70 HA3 GLY 70 -11.489 -10.139 17.698 527 H THR 71 H THR 71 -9.592 -11.310 15.374 528 HA THR 71 HA THR 71 -7.161 -11.239 16.782 529 HB THR 71 HB THR 71 -7.727 -11.947 13.856 530 HG1 THR 71 HG1 THR 71 -8.412 -13.759 14.706 531 HG21 THR 71 HG21 THR 71 -5.234 -12.593 15.499 532 HG22 THR 71 HG22 THR 71 -5.303 -11.498 14.114 533 HG23 THR 71 HG23 THR 71 -5.601 -13.221 13.889 534 H LYS 72 H LYS 72 -5.499 -9.798 16.838 535 HA LYS 72 HA LYS 72 -5.375 -7.519 14.989 536 HB2 LYS 72 HB2 LYS 72 -3.738 -8.222 17.464 537 HB3 LYS 72 HB3 LYS 72 -3.450 -6.792 16.475 538 HG2 LYS 72 HG2 LYS 72 -5.677 -5.925 17.032 539 HG3 LYS 72 HG3 LYS 72 -6.019 -7.373 17.988 540 HD2 LYS 72 HD2 LYS 72 -4.196 -6.815 19.544 541 HD3 LYS 72 HD3 LYS 72 -3.750 -5.416 18.561 542 HE2 LYS 72 HE2 LYS 72 -5.958 -4.387 19.065 543 HE3 LYS 72 HE3 LYS 72 -6.370 -5.784 20.063 544 HZ1 LYS 72 HZ1 LYS 72 -4.084 -3.953 20.554 545 HZ2 LYS 72 HZ2 LYS 72 -4.549 -5.254 21.524 546 HZ3 LYS 72 HZ3 LYS 72 -5.564 -3.916 21.370 547 H ALA 73 H ALA 73 -4.389 -7.925 13.075 548 HA ALA 73 HA ALA 73 -1.950 -9.600 12.937 549 HB1 ALA 73 HB1 ALA 73 -3.633 -8.431 10.687 550 HB2 ALA 73 HB2 ALA 73 -3.692 -10.095 11.270 551 HB3 ALA 73 HB3 ALA 73 -2.230 -9.490 10.490 552 H ARG 74 H ARG 74 -0.224 -8.381 13.564 553 HA ARG 74 HA ARG 74 -0.102 -5.517 13.148 554 HB2 ARG 74 HB2 ARG 74 1.897 -7.460 14.360 555 HB3 ARG 74 HB3 ARG 74 2.162 -5.721 14.265 556 HG2 ARG 74 HG2 ARG 74 0.028 -5.433 15.624 557 HG3 ARG 74 HG3 ARG 74 0.051 -7.182 15.883 558 HD2 ARG 74 HD2 ARG 74 1.063 -5.915 17.762 559 HD3 ARG 74 HD3 ARG 74 2.209 -7.023 17.004 560 HE ARG 74 HE ARG 74 2.720 -4.713 15.719 561 HH11 ARG 74 HH11 ARG 74 2.457 -5.367 19.094 562 HH12 ARG 74 HH12 ARG 74 3.604 -4.147 19.520 563 HH21 ARG 74 HH21 ARG 74 4.210 -3.192 16.294 564 HH22 ARG 74 HH22 ARG 74 4.579 -2.932 17.960 565 H GLY 75 H GLY 75 1.567 -4.372 12.101 566 HA2 GLY 75 HA2 GLY 75 3.514 -5.803 10.432 567 HA3 GLY 75 HA3 GLY 75 2.411 -4.685 9.633 568 H TRP 76 H TRP 76 5.297 -4.581 9.847 569 HA TRP 76 HA TRP 76 5.549 -1.824 10.926 570 HB2 TRP 76 HB2 TRP 76 7.994 -2.132 10.982 571 HB3 TRP 76 HB3 TRP 76 7.223 -3.396 11.937 572 HD1 TRP 76 HD1 TRP 76 7.393 -5.920 11.007 573 HE1 TRP 76 HE1 TRP 76 8.863 -7.008 9.212 574 HE3 TRP 76 HE3 TRP 76 9.265 -1.704 8.761 575 HZ2 TRP 76 HZ2 TRP 76 10.587 -6.223 7.153 576 HZ3 TRP 76 HZ3 TRP 76 10.834 -1.973 6.879 577 HH2 TRP 76 HH2 TRP 76 11.488 -4.193 6.094 578 H TRP 77 H TRP 77 6.446 -0.262 9.455 579 HA TRP 77 HA TRP 77 6.388 -1.013 6.576 580 HB2 TRP 77 HB2 TRP 77 4.185 -0.101 7.818 581 HB3 TRP 77 HB3 TRP 77 4.969 1.459 7.630 582 HD1 TRP 77 HD1 TRP 77 4.808 -1.357 4.952 583 HE1 TRP 77 HE1 TRP 77 3.501 -0.444 2.946 584 HE3 TRP 77 HE3 TRP 77 3.483 3.181 6.851 585 HZ2 TRP 77 HZ2 TRP 77 2.094 1.915 2.249 586 HZ3 TRP 77 HZ3 TRP 77 2.162 4.708 5.457 587 HH2 TRP 77 HH2 TRP 77 1.480 4.091 3.203 588 H GLN 78 H GLN 78 8.228 -0.197 5.578 589 HA GLN 78 HA GLN 78 9.767 1.955 6.936 590 HB2 GLN 78 HB2 GLN 78 11.109 -0.007 6.666 591 HB3 GLN 78 HB3 GLN 78 10.581 -0.244 5.007 592 HG2 GLN 78 HG2 GLN 78 12.852 0.510 4.932 593 HG3 GLN 78 HG3 GLN 78 11.851 1.822 4.361 594 HE21 GLN 78 HE21 GLN 78 14.570 1.916 5.340 595 HE22 GLN 78 HE22 GLN 78 14.571 2.990 6.693 596 H PHE 79 H PHE 79 9.537 3.941 6.128 597 HA PHE 79 HA PHE 79 8.855 4.511 3.363 598 HB2 PHE 79 HB2 PHE 79 9.608 6.387 5.644 599 HB3 PHE 79 HB3 PHE 79 8.962 6.880 4.083 600 HD1 PHE 79 HD2 PHE 79 6.618 6.087 3.436 601 HD2 PHE 79 HD1 PHE 79 8.144 5.833 7.428 602 HE1 PHE 79 HE2 PHE 79 4.332 5.918 4.316 603 HE2 PHE 79 HE1 PHE 79 5.855 5.656 8.293 604 HZ PHE 79 HZ PHE 79 3.956 5.704 6.737 605 H THR 80 H THR 80 10.341 4.822 1.784 606 HA THR 80 HA THR 80 13.168 5.382 2.486 607 HB THR 80 HB THR 80 13.732 4.373 0.240 608 HG1 THR 80 HG1 THR 80 11.169 3.203 0.190 609 HG21 THR 80 HG21 THR 80 13.344 2.010 0.893 610 HG22 THR 80 HG22 THR 80 12.222 2.549 2.146 611 HG23 THR 80 HG23 THR 80 13.935 2.974 2.252 612 H THR 81 H THR 81 11.335 5.855 -0.595 613 HA THR 81 HA THR 81 12.563 8.556 -0.774 614 HB THR 81 HB THR 81 11.339 6.896 -3.016 615 HG1 THR 81 HG1 THR 81 13.433 6.428 -3.598 616 HG21 THR 81 HG21 THR 81 12.448 8.527 -4.528 617 HG22 THR 81 HG22 THR 81 12.935 9.482 -3.124 618 HG23 THR 81 HG23 THR 81 11.223 9.299 -3.516 619 H ILE 82 H ILE 82 11.171 9.962 0.181 620 HA ILE 82 HA ILE 82 8.397 10.154 -0.885 621 HB ILE 82 HB ILE 82 9.376 11.180 1.822 622 HG12 ILE 82 HG12 ILE 82 7.754 8.679 1.180 623 HG13 ILE 82 HG13 ILE 82 9.384 8.719 1.832 624 HG21 ILE 82 HG21 ILE 82 7.499 12.480 0.891 625 HG22 ILE 82 HG22 ILE 82 6.973 11.547 2.291 626 HG23 ILE 82 HG23 ILE 82 6.562 10.997 0.666 627 HD11 ILE 82 HD11 ILE 82 8.524 9.717 3.893 628 HD12 ILE 82 HD12 ILE 82 7.774 8.165 3.530 629 HD13 ILE 82 HD13 ILE 82 6.888 9.655 3.231 630 H GLU 83 H GLU 83 8.557 11.675 -2.474 631 HA GLU 83 HA GLU 83 10.133 14.145 -1.981 632 HB2 GLU 83 HB2 GLU 83 9.121 13.071 -4.645 633 HB3 GLU 83 HB3 GLU 83 10.225 14.424 -4.402 634 HG2 GLU 83 HG2 GLU 83 11.845 12.776 -3.348 635 HG3 GLU 83 HG3 GLU 83 10.766 11.490 -3.875 636 H ALA 84 H ALA 84 6.924 12.994 -2.928 637 HA ALA 84 HA ALA 84 4.852 13.860 -2.828 638 HB1 ALA 84 HB1 ALA 84 4.349 15.792 -1.390 639 HB2 ALA 84 HB2 ALA 84 6.065 16.198 -1.312 640 HB3 ALA 84 HB3 ALA 84 5.481 14.698 -0.590 641 HA PRO 85 HA PRO 85 2.946 14.836 -2.978 642 HB2 PRO 85 HB2 PRO 85 0.842 15.709 -4.338 643 HB3 PRO 85 HB3 PRO 85 1.846 16.864 -3.446 644 HG2 PRO 85 HG2 PRO 85 1.826 16.273 -6.408 645 HG3 PRO 85 HG3 PRO 85 1.927 17.845 -5.587 646 HD2 PRO 85 HD2 PRO 85 4.129 16.355 -6.561 647 HD3 PRO 85 HD3 PRO 85 4.223 17.704 -5.407 648 H ASP 86 H ASP 86 4.393 13.693 -5.637 649 HA ASP 86 HA ASP 86 2.216 11.819 -6.411 650 HB2 ASP 86 HB2 ASP 86 3.325 11.672 -8.647 651 HB3 ASP 86 HB3 ASP 86 2.711 13.274 -8.267 652 H HIS 87 H HIS 87 5.706 12.007 -5.709 653 HA HIS 87 HA HIS 87 6.032 9.127 -6.238 654 HB2 HIS 87 HB2 HIS 87 7.638 10.865 -7.176 655 HB3 HIS 87 HB3 HIS 87 8.211 11.145 -5.539 656 HD1 HIS 87 HD1 HIS 87 10.344 10.316 -7.314 657 HD2 HIS 87 HD2 HIS 87 7.913 7.459 -5.534 658 HE1 HIS 87 HE1 HIS 87 11.664 8.195 -7.376 659 HE2 HIS 87 HE2 HIS 87 10.186 6.487 -6.291 660 H LEU 88 H LEU 88 5.533 7.874 -4.597 661 HA LEU 88 HA LEU 88 6.869 8.219 -1.973 662 HB2 LEU 88 HB2 LEU 88 4.459 8.458 -1.688 663 HB3 LEU 88 HB3 LEU 88 4.150 7.003 -2.609 664 HG LEU 88 HG LEU 88 5.198 5.650 -0.779 665 HD11 LEU 88 HD11 LEU 88 6.719 7.320 0.151 666 HD12 LEU 88 HD12 LEU 88 5.675 6.652 1.401 667 HD13 LEU 88 HD13 LEU 88 5.351 8.262 0.750 668 HD21 LEU 88 HD21 LEU 88 3.361 5.862 0.828 669 HD22 LEU 88 HD22 LEU 88 2.770 5.957 -0.827 670 HD23 LEU 88 HD23 LEU 88 2.919 7.426 0.139 671 H GLU 89 H GLU 89 8.188 6.543 -1.414 672 HA GLU 89 HA GLU 89 7.763 3.857 -2.582 673 HB2 GLU 89 HB2 GLU 89 10.443 5.256 -2.166 674 HB3 GLU 89 HB3 GLU 89 10.284 3.523 -2.434 675 HG2 GLU 89 HG2 GLU 89 9.223 3.996 -4.633 676 HG3 GLU 89 HG3 GLU 89 9.507 5.717 -4.371 677 H PHE 90 H PHE 90 7.764 2.243 -1.126 678 HA PHE 90 HA PHE 90 8.943 2.518 1.517 679 HB2 PHE 90 HB2 PHE 90 6.829 1.924 2.716 680 HB3 PHE 90 HB3 PHE 90 6.761 3.504 1.951 681 HD1 PHE 90 HD2 PHE 90 5.641 -0.051 1.577 682 HD2 PHE 90 HD1 PHE 90 5.041 4.011 0.383 683 HE1 PHE 90 HE2 PHE 90 3.528 -0.668 0.476 684 HE2 PHE 90 HE1 PHE 90 2.947 3.376 -0.707 685 HZ PHE 90 HZ PHE 90 2.182 1.040 -0.672 686 H ASP 91 H ASP 91 8.407 0.437 2.830 687 HA ASP 91 HA ASP 91 8.545 -1.951 1.090 688 HB2 ASP 91 HB2 ASP 91 10.285 -1.246 3.482 689 HB3 ASP 91 HB3 ASP 91 10.237 -2.841 2.747 690 H ASP 92 H ASP 92 6.849 -3.223 1.545 691 HA ASP 92 HA ASP 92 5.632 -3.437 4.192 692 HB2 ASP 92 HB2 ASP 92 5.008 -5.106 1.713 693 HB3 ASP 92 HB3 ASP 92 3.971 -4.834 3.110 694 H GLY 93 H GLY 93 6.702 -4.722 5.685 695 HA2 GLY 93 HA2 GLY 93 8.034 -7.229 4.757 696 HA3 GLY 93 HA3 GLY 93 8.577 -6.263 6.112 697 H PHE 94 H PHE 94 5.743 -5.894 6.988 698 HA PHE 94 HA PHE 94 4.095 -6.768 8.266 699 HB2 PHE 94 HB2 PHE 94 4.965 -9.439 7.101 700 HB3 PHE 94 HB3 PHE 94 3.600 -9.274 8.197 701 HD1 PHE 94 HD2 PHE 94 1.527 -8.172 7.474 702 HD2 PHE 94 HD1 PHE 94 4.806 -8.668 4.764 703 HE1 PHE 94 HE2 PHE 94 0.040 -7.682 5.579 704 HE2 PHE 94 HE1 PHE 94 3.310 -8.170 2.876 705 HZ PHE 94 HZ PHE 94 0.929 -7.685 3.279 706 H ALA 95 H ALA 95 3.693 -7.835 10.319 707 HA ALA 95 HA ALA 95 6.111 -8.637 11.843 708 HB1 ALA 95 HB1 ALA 95 5.834 -6.211 12.155 709 HB2 ALA 95 HB2 ALA 95 5.517 -7.078 13.657 710 HB3 ALA 95 HB3 ALA 95 4.173 -6.456 12.695 711 H ASP 96 H ASP 96 5.630 -9.743 13.860 712 HA ASP 96 HA ASP 96 3.128 -11.284 13.813 713 HB2 ASP 96 HB2 ASP 96 4.199 -12.817 15.265 714 HB3 ASP 96 HB3 ASP 96 5.502 -12.269 14.218 715 H GLU 97 H GLU 97 2.618 -11.802 16.487 716 HA GLU 97 HA GLU 97 1.003 -9.687 17.333 717 HB2 GLU 97 HB2 GLU 97 0.609 -10.971 19.354 718 HB3 GLU 97 HB3 GLU 97 0.732 -12.082 17.996 719 HG2 GLU 97 HG2 GLU 97 3.118 -12.550 18.674 720 HG3 GLU 97 HG3 GLU 97 2.858 -11.549 20.094 721 H HIS 98 H HIS 98 4.396 -10.313 18.098 722 HA HIS 98 HA HIS 98 4.511 -8.330 20.247 723 HB2 HIS 98 HB2 HIS 98 6.747 -9.966 18.975 724 HB3 HIS 98 HB3 HIS 98 6.901 -8.977 20.424 725 HD1 HIS 98 HD1 HIS 98 5.209 -9.817 22.456 726 HD2 HIS 98 HD2 HIS 98 6.158 -12.562 19.493 727 HE1 HIS 98 HE1 HIS 98 4.669 -12.065 23.421 728 HE2 HIS 98 HE2 HIS 98 5.129 -13.686 21.569 729 H GLY 99 H GLY 99 5.201 -8.483 16.805 730 HA2 GLY 99 HA2 GLY 99 5.259 -6.370 15.600 731 HA3 GLY 99 HA3 GLY 99 6.239 -5.691 16.884 732 H ALA 100 H ALA 100 7.475 -8.746 16.342 733 HA ALA 100 HA ALA 100 9.859 -7.725 15.086 734 HB1 ALA 100 HB1 ALA 100 9.089 -10.598 15.722 735 HB2 ALA 100 HB2 ALA 100 9.969 -9.496 16.782 736 HB3 ALA 100 HB3 ALA 100 10.704 -10.034 15.274 737 HA PRO 101 HA PRO 101 8.867 -8.173 10.717 738 HB2 PRO 101 HB2 PRO 101 11.750 -9.029 10.395 739 HB3 PRO 101 HB3 PRO 101 10.842 -7.766 9.543 740 HG2 PRO 101 HG2 PRO 101 12.575 -7.080 11.439 741 HG3 PRO 101 HG3 PRO 101 11.003 -6.255 11.347 742 HD2 PRO 101 HD2 PRO 101 11.881 -8.459 13.231 743 HD3 PRO 101 HD3 PRO 101 10.958 -6.979 13.584 744 H VAL 102 H VAL 102 7.974 -9.750 9.512 745 HA VAL 102 HA VAL 102 8.485 -12.573 10.090 746 HB VAL 102 HB VAL 102 6.397 -11.310 8.244 747 HG11 VAL 102 HG11 VAL 102 6.870 -13.645 7.608 748 HG12 VAL 102 HG12 VAL 102 5.261 -13.514 8.322 749 HG13 VAL 102 HG13 VAL 102 6.595 -14.174 9.273 750 HG21 VAL 102 HG21 VAL 102 4.762 -11.745 10.051 751 HG22 VAL 102 HG22 VAL 102 6.029 -10.643 10.595 752 HG23 VAL 102 HG23 VAL 102 6.061 -12.336 11.094 753 H ASP 103 H ASP 103 10.401 -13.109 9.139 754 HA ASP 103 HA ASP 103 11.335 -12.309 6.564 755 HB2 ASP 103 HB2 ASP 103 12.205 -14.738 8.194 756 HB3 ASP 103 HB3 ASP 103 13.121 -13.969 6.898 757 H GLU 104 H GLU 104 9.315 -14.894 7.681 758 HA GLU 104 HA GLU 104 9.275 -16.718 5.569 759 HB2 GLU 104 HB2 GLU 104 8.193 -16.969 7.810 760 HB3 GLU 104 HB3 GLU 104 6.983 -15.780 7.345 761 HG2 GLU 104 HG2 GLU 104 6.292 -17.336 5.493 762 HG3 GLU 104 HG3 GLU 104 7.391 -18.535 6.169 763 H LEU 105 H LEU 105 7.535 -13.638 5.961 764 HA LEU 105 HA LEU 105 6.283 -13.778 3.305 765 HB2 LEU 105 HB2 LEU 105 6.099 -11.727 5.546 766 HB3 LEU 105 HB3 LEU 105 5.239 -11.585 4.018 767 HG LEU 105 HG LEU 105 4.841 -13.804 6.069 768 HD11 LEU 105 HD11 LEU 105 3.019 -11.491 5.351 769 HD12 LEU 105 HD12 LEU 105 3.920 -11.690 6.858 770 HD13 LEU 105 HD13 LEU 105 2.630 -12.819 6.450 771 HD21 LEU 105 HD21 LEU 105 4.498 -14.633 3.795 772 HD22 LEU 105 HD22 LEU 105 3.381 -13.308 3.458 773 HD23 LEU 105 HD23 LEU 105 2.965 -14.536 4.658 774 H GLY 106 H GLY 106 8.972 -12.258 4.923 775 HA2 GLY 106 HA2 GLY 106 10.816 -11.154 4.116 776 HA3 GLY 106 HA3 GLY 106 10.227 -11.440 2.489 777 H VAL 107 H VAL 107 11.434 -9.190 2.636 778 HA VAL 107 HA VAL 107 9.561 -6.960 3.191 779 HB VAL 107 HB VAL 107 12.555 -6.927 2.550 780 HG11 VAL 107 HG11 VAL 107 11.483 -4.829 1.838 781 HG12 VAL 107 HG12 VAL 107 12.506 -4.546 3.248 782 HG13 VAL 107 HG13 VAL 107 10.753 -4.639 3.435 783 HG21 VAL 107 HG21 VAL 107 12.888 -6.376 4.945 784 HG22 VAL 107 HG22 VAL 107 12.110 -7.947 4.754 785 HG23 VAL 107 HG23 VAL 107 11.152 -6.543 5.226 786 H THR 108 H THR 108 8.644 -5.808 1.470 787 HA THR 108 HA THR 108 9.766 -6.166 -1.252 788 HB THR 108 HB THR 108 7.909 -7.715 -1.180 789 HG1 THR 108 HG1 THR 108 6.509 -6.480 -2.800 790 HG21 THR 108 HG21 THR 108 6.113 -5.392 -0.380 791 HG22 THR 108 HG22 THR 108 6.550 -6.760 0.648 792 HG23 THR 108 HG23 THR 108 5.570 -7.022 -0.797 793 H HIS 109 H HIS 109 9.783 -4.375 -2.525 794 HA HIS 109 HA HIS 109 9.301 -1.852 -1.095 795 HB2 HIS 109 HB2 HIS 109 11.588 -2.605 -2.050 796 HB3 HIS 109 HB3 HIS 109 10.939 -2.200 -3.632 797 HD1 HIS 109 HD1 HIS 109 12.714 -0.787 -0.841 798 HD2 HIS 109 HD2 HIS 109 10.132 0.719 -3.711 799 HE1 HIS 109 HE1 HIS 109 13.184 1.665 -0.946 800 HE2 HIS 109 HE2 HIS 109 11.744 2.514 -2.804 801 H ALA 110 H ALA 110 7.242 -1.164 -1.511 802 HA ALA 110 HA ALA 110 6.115 -1.257 -4.242 803 HB1 ALA 110 HB1 ALA 110 4.758 -0.600 -1.614 804 HB2 ALA 110 HB2 ALA 110 4.730 -2.160 -2.429 805 HB3 ALA 110 HB3 ALA 110 3.959 -0.762 -3.178 806 H THR 111 H THR 111 5.674 0.536 -5.437 807 HA THR 111 HA THR 111 6.544 3.184 -4.399 808 HB THR 111 HB THR 111 6.747 2.243 -7.315 809 HG1 THR 111 HG1 THR 111 9.094 2.328 -6.718 810 HG21 THR 111 HG21 THR 111 6.575 4.691 -7.078 811 HG22 THR 111 HG22 THR 111 8.196 4.228 -7.596 812 HG23 THR 111 HG23 THR 111 7.903 4.686 -5.918 813 H VAL 112 H VAL 112 4.787 4.431 -4.111 814 HA VAL 112 HA VAL 112 2.352 4.182 -5.746 815 HB VAL 112 HB VAL 112 2.959 5.919 -3.301 816 HG11 VAL 112 HG11 VAL 112 1.208 6.974 -4.695 817 HG12 VAL 112 HG12 VAL 112 0.513 6.353 -3.196 818 HG13 VAL 112 HG13 VAL 112 0.292 5.463 -4.704 819 HG21 VAL 112 HG21 VAL 112 2.933 3.503 -2.790 820 HG22 VAL 112 HG22 VAL 112 1.329 3.362 -3.515 821 HG23 VAL 112 HG23 VAL 112 1.553 4.324 -2.053 822 H LYS 113 H LYS 113 2.229 5.358 -7.566 823 HA LYS 113 HA LYS 113 3.575 8.001 -7.752 824 HB2 LYS 113 HB2 LYS 113 3.382 5.815 -9.867 825 HB3 LYS 113 HB3 LYS 113 4.045 7.427 -10.149 826 HG2 LYS 113 HG2 LYS 113 5.886 7.035 -8.649 827 HG3 LYS 113 HG3 LYS 113 5.152 5.555 -8.032 828 HD2 LYS 113 HD2 LYS 113 7.011 5.050 -9.541 829 HD3 LYS 113 HD3 LYS 113 5.485 4.464 -10.196 830 HE2 LYS 113 HE2 LYS 113 5.375 6.364 -11.714 831 HE3 LYS 113 HE3 LYS 113 6.845 7.044 -11.020 832 HZ1 LYS 113 HZ1 LYS 113 8.061 5.136 -11.823 833 HZ2 LYS 113 HZ2 LYS 113 7.257 5.894 -13.099 834 HZ3 LYS 113 HZ3 LYS 113 6.648 4.455 -12.456 835 H LEU 114 H LEU 114 2.104 9.535 -7.879 836 HA LEU 114 HA LEU 114 -0.587 9.072 -8.948 837 HB2 LEU 114 HB2 LEU 114 0.634 11.408 -7.433 838 HB3 LEU 114 HB3 LEU 114 -1.048 11.330 -7.939 839 HG LEU 114 HG LEU 114 0.233 9.303 -6.055 840 HD11 LEU 114 HD11 LEU 114 -0.969 10.409 -4.227 841 HD12 LEU 114 HD12 LEU 114 -1.498 11.683 -5.331 842 HD13 LEU 114 HD13 LEU 114 0.218 11.483 -4.966 843 HD21 LEU 114 HD21 LEU 114 -2.677 9.809 -6.742 844 HD22 LEU 114 HD22 LEU 114 -2.074 8.636 -5.565 845 HD23 LEU 114 HD23 LEU 114 -1.700 8.437 -7.274 846 H GLU 115 H GLU 115 -1.454 10.089 -10.698 847 HA GLU 115 HA GLU 115 0.288 11.740 -12.438 848 HB2 GLU 115 HB2 GLU 115 -0.115 9.415 -13.288 849 HB3 GLU 115 HB3 GLU 115 -1.847 9.723 -13.269 850 HG2 GLU 115 HG2 GLU 115 -1.171 9.977 -15.535 851 HG3 GLU 115 HG3 GLU 115 -1.413 11.615 -14.929 852 HA PRO 116 HA PRO 116 -3.202 14.650 -11.756 853 HB2 PRO 116 HB2 PRO 116 -2.119 16.767 -13.173 854 HB3 PRO 116 HB3 PRO 116 -1.693 16.380 -11.502 855 HG2 PRO 116 HG2 PRO 116 -0.224 15.687 -14.040 856 HG3 PRO 116 HG3 PRO 116 0.430 16.269 -12.496 857 HD2 PRO 116 HD2 PRO 116 0.521 13.645 -13.202 858 HD3 PRO 116 HD3 PRO 116 0.331 14.152 -11.512 859 H LEU 117 H LEU 117 -4.799 13.612 -12.931 860 HA LEU 117 HA LEU 117 -4.938 13.890 -15.873 861 HB2 LEU 117 HB2 LEU 117 -6.952 12.611 -13.979 862 HB3 LEU 117 HB3 LEU 117 -6.946 12.477 -15.729 863 HG LEU 117 HG LEU 117 -4.893 11.270 -13.830 864 HD11 LEU 117 HD11 LEU 117 -5.820 9.098 -14.532 865 HD12 LEU 117 HD12 LEU 117 -7.046 9.925 -15.499 866 HD13 LEU 117 HD13 LEU 117 -7.036 10.103 -13.741 867 HD21 LEU 117 HD21 LEU 117 -5.038 11.033 -16.857 868 HD22 LEU 117 HD22 LEU 117 -3.925 10.159 -15.799 869 HD23 LEU 117 HD23 LEU 117 -3.812 11.912 -15.935 870 H GLU 118 H GLU 118 -4.935 16.347 -14.637 871 HA GLU 118 HA GLU 118 -5.894 18.374 -14.497 872 HB2 GLU 118 HB2 GLU 118 -7.982 17.091 -16.303 873 HB3 GLU 118 HB3 GLU 118 -7.972 18.806 -15.910 874 HG2 GLU 118 HG2 GLU 118 -5.817 19.088 -16.997 875 HG3 GLU 118 HG3 GLU 118 -5.693 17.355 -17.285 876 H ASN 119 H ASN 119 -9.020 16.681 -14.593 877 HA ASN 119 HA ASN 119 -9.907 17.930 -12.111 878 HB2 ASN 119 HB2 ASN 119 -11.279 17.747 -14.249 879 HB3 ASN 119 HB3 ASN 119 -11.375 16.012 -13.991 880 HD21 ASN 119 HD21 ASN 119 -13.484 18.042 -14.141 881 HD22 ASN 119 HD22 ASN 119 -14.380 17.906 -12.671 882 H ARG 120 H ARG 120 -9.018 14.771 -13.352 883 HA ARG 120 HA ARG 120 -9.547 13.416 -10.759 884 HB2 ARG 120 HB2 ARG 120 -9.244 12.332 -13.597 885 HB3 ARG 120 HB3 ARG 120 -9.431 11.318 -12.166 886 HG2 ARG 120 HG2 ARG 120 -11.657 12.120 -11.765 887 HG3 ARG 120 HG3 ARG 120 -11.479 13.413 -12.952 888 HD2 ARG 120 HD2 ARG 120 -12.883 11.441 -13.693 889 HD3 ARG 120 HD3 ARG 120 -11.561 11.874 -14.777 890 HE ARG 120 HE ARG 120 -10.389 9.943 -14.116 891 HH11 ARG 120 HH11 ARG 120 -13.497 10.026 -12.593 892 HH12 ARG 120 HH12 ARG 120 -13.512 8.319 -12.330 893 HH21 ARG 120 HH21 ARG 120 -10.445 7.789 -13.755 894 HH22 ARG 120 HH22 ARG 120 -11.801 7.078 -12.956 895 H THR 121 H THR 121 -7.942 11.419 -10.541 896 HA THR 121 HA THR 121 -5.208 11.942 -11.464 897 HB THR 121 HB THR 121 -5.910 11.806 -8.490 898 HG1 THR 121 HG1 THR 121 -6.054 13.884 -9.441 899 HG21 THR 121 HG21 THR 121 -3.455 11.989 -8.063 900 HG22 THR 121 HG22 THR 121 -3.151 11.761 -9.789 901 HG23 THR 121 HG23 THR 121 -3.879 10.461 -8.842 902 H ARG 122 H ARG 122 -3.971 10.114 -11.671 903 HA ARG 122 HA ARG 122 -5.264 7.495 -11.192 904 HB2 ARG 122 HB2 ARG 122 -4.753 8.092 -13.550 905 HB3 ARG 122 HB3 ARG 122 -3.056 8.311 -13.136 906 HG2 ARG 122 HG2 ARG 122 -2.825 5.930 -12.647 907 HG3 ARG 122 HG3 ARG 122 -4.556 5.680 -12.913 908 HD2 ARG 122 HD2 ARG 122 -2.548 6.599 -15.004 909 HD3 ARG 122 HD3 ARG 122 -3.237 4.983 -14.870 910 HE ARG 122 HE ARG 122 -5.449 6.490 -15.115 911 HH11 ARG 122 HH11 ARG 122 -2.562 6.504 -17.014 912 HH12 ARG 122 HH12 ARG 122 -3.402 6.953 -18.455 913 HH21 ARG 122 HH21 ARG 122 -6.476 7.075 -16.961 914 HH22 ARG 122 HH22 ARG 122 -5.580 7.277 -18.425 915 H MET 123 H MET 123 -4.338 6.156 -9.703 916 HA MET 123 HA MET 123 -1.599 6.681 -8.719 917 HB2 MET 123 HB2 MET 123 -3.420 6.871 -7.018 918 HB3 MET 123 HB3 MET 123 -3.865 5.196 -7.314 919 HG2 MET 123 HG2 MET 123 -1.644 4.463 -6.520 920 HG3 MET 123 HG3 MET 123 -1.186 6.143 -6.249 921 HE1 MET 123 HE1 MET 123 -4.712 4.446 -5.487 922 HE2 MET 123 HE2 MET 123 -4.392 3.877 -3.851 923 HE3 MET 123 HE3 MET 123 -3.488 3.207 -5.203 924 H THR 124 H THR 124 -0.140 5.281 -9.513 925 HA THR 124 HA THR 124 -0.881 2.437 -9.937 926 HB THR 124 HB THR 124 1.381 3.983 -11.292 927 HG1 THR 124 HG1 THR 124 -0.706 4.598 -12.042 928 HG21 THR 124 HG21 THR 124 1.561 2.004 -12.765 929 HG22 THR 124 HG22 THR 124 0.319 1.176 -11.824 930 HG23 THR 124 HG23 THR 124 1.878 1.558 -11.087 931 H ILE 125 H ILE 125 -0.172 1.188 -8.288 932 HA ILE 125 HA ILE 125 2.269 1.925 -6.765 933 HB ILE 125 HB ILE 125 0.128 -0.082 -5.921 934 HG12 ILE 125 HG12 ILE 125 0.340 2.855 -5.090 935 HG13 ILE 125 HG13 ILE 125 -0.906 2.179 -6.133 936 HG21 ILE 125 HG21 ILE 125 2.318 -0.392 -4.824 937 HG22 ILE 125 HG22 ILE 125 1.123 0.175 -3.659 938 HG23 ILE 125 HG23 ILE 125 2.321 1.298 -4.308 939 HD11 ILE 125 HD11 ILE 125 -1.680 0.776 -4.243 940 HD12 ILE 125 HD12 ILE 125 -1.779 2.506 -3.913 941 HD13 ILE 125 HD13 ILE 125 -0.474 1.550 -3.211 942 H ILE 126 H ILE 126 4.083 0.794 -7.419 943 HA ILE 126 HA ILE 126 3.749 -1.963 -8.484 944 HB ILE 126 HB ILE 126 6.199 -0.186 -8.971 945 HG12 ILE 126 HG12 ILE 126 5.163 -0.011 -11.402 946 HG13 ILE 126 HG13 ILE 126 3.634 -0.354 -10.608 947 HG21 ILE 126 HG21 ILE 126 6.659 -1.788 -10.807 948 HG22 ILE 126 HG22 ILE 126 5.228 -2.716 -10.357 949 HG23 ILE 126 HG23 ILE 126 6.589 -2.592 -9.236 950 HD11 ILE 126 HD11 ILE 126 3.952 2.020 -10.970 951 HD12 ILE 126 HD12 ILE 126 5.444 1.992 -10.031 952 HD13 ILE 126 HD13 ILE 126 3.898 1.660 -9.245 953 H SER 127 H SER 127 4.362 -3.518 -7.085 954 HA SER 127 HA SER 127 6.195 -2.953 -4.842 955 HB2 SER 127 HB2 SER 127 3.867 -3.728 -4.319 956 HB3 SER 127 HB3 SER 127 4.187 -5.238 -5.171 957 HG SER 127 HG SER 127 4.973 -4.403 -2.661 958 H THR 128 H THR 128 8.257 -3.543 -5.297 959 HA THR 128 HA THR 128 8.872 -5.853 -7.000 960 HB THR 128 HB THR 128 11.247 -5.036 -6.880 961 HG1 THR 128 HG1 THR 128 11.652 -3.765 -5.232 962 HG21 THR 128 HG21 THR 128 10.943 -3.006 -8.252 963 HG22 THR 128 HG22 THR 128 9.255 -2.903 -7.749 964 HG23 THR 128 HG23 THR 128 9.800 -4.261 -8.737 965 H PHE 129 H PHE 129 8.943 -7.737 -5.987 966 HA PHE 129 HA PHE 129 9.572 -8.085 -3.182 967 HB2 PHE 129 HB2 PHE 129 9.037 -10.220 -5.306 968 HB3 PHE 129 HB3 PHE 129 8.933 -10.417 -3.557 969 HD1 PHE 129 HD1 PHE 129 6.984 -9.529 -2.306 970 HD2 PHE 129 HD2 PHE 129 7.229 -9.084 -6.555 971 HE1 PHE 129 HE1 PHE 129 4.599 -8.933 -2.391 972 HE2 PHE 129 HE2 PHE 129 4.851 -8.493 -6.626 973 HZ PHE 129 HZ PHE 129 3.533 -8.405 -4.549 974 H GLU 130 H GLU 130 11.346 -9.304 -2.358 975 HA GLU 130 HA GLU 130 13.892 -9.085 -3.516 976 HB2 GLU 130 HB2 GLU 130 13.070 -11.166 -1.442 977 HB3 GLU 130 HB3 GLU 130 14.691 -10.537 -1.713 978 HG2 GLU 130 HG2 GLU 130 12.337 -8.962 -0.634 979 HG3 GLU 130 HG3 GLU 130 13.634 -9.650 0.337 980 H SER 131 H SER 131 11.651 -11.862 -3.446 981 HA SER 131 HA SER 131 13.161 -13.256 -5.554 982 HB2 SER 131 HB2 SER 131 12.541 -14.467 -2.825 983 HB3 SER 131 HB3 SER 131 13.092 -15.403 -4.215 984 HG SER 131 HG SER 131 14.787 -13.414 -3.971 985 H GLU 132 H GLU 132 12.040 -15.092 -6.458 986 HA GLU 132 HA GLU 132 9.348 -14.643 -7.155 987 HB2 GLU 132 HB2 GLU 132 10.842 -15.868 -8.637 988 HB3 GLU 132 HB3 GLU 132 11.088 -17.130 -7.431 989 HG2 GLU 132 HG2 GLU 132 8.716 -17.802 -7.651 990 HG3 GLU 132 HG3 GLU 132 8.470 -16.534 -8.851 991 H GLU 133 H GLU 133 10.723 -17.216 -5.069 992 HA GLU 133 HA GLU 133 8.359 -18.473 -4.279 993 HB2 GLU 133 HB2 GLU 133 9.684 -19.356 -2.359 994 HB3 GLU 133 HB3 GLU 133 10.551 -19.460 -3.887 995 HG2 GLU 133 HG2 GLU 133 11.783 -17.346 -3.254 996 HG3 GLU 133 HG3 GLU 133 11.011 -17.435 -1.671 997 H GLN 134 H GLN 134 9.775 -15.480 -3.047 998 HA GLN 134 HA GLN 134 8.105 -15.126 -0.772 999 HB2 GLN 134 HB2 GLN 134 10.111 -13.792 -0.931 1000 HB3 GLN 134 HB3 GLN 134 9.625 -13.132 -2.492 1001 HG2 GLN 134 HG2 GLN 134 7.708 -11.972 -1.370 1002 HG3 GLN 134 HG3 GLN 134 8.290 -12.578 0.181 1003 HE21 GLN 134 HE21 GLN 134 8.441 -10.380 0.852 1004 HE22 GLN 134 HE22 GLN 134 9.771 -9.398 0.355 1005 H MET 135 H MET 135 7.825 -13.862 -4.158 1006 HA MET 135 HA MET 135 5.376 -12.469 -3.652 1007 HB2 MET 135 HB2 MET 135 5.262 -11.955 -5.965 1008 HB3 MET 135 HB3 MET 135 6.950 -11.895 -5.522 1009 HG2 MET 135 HG2 MET 135 7.326 -14.047 -6.626 1010 HG3 MET 135 HG3 MET 135 5.611 -14.152 -7.035 1011 HE1 MET 135 HE1 MET 135 5.076 -10.950 -7.693 1012 HE2 MET 135 HE2 MET 135 4.376 -12.275 -8.627 1013 HE3 MET 135 HE3 MET 135 5.265 -10.991 -9.446 1014 H GLN 136 H GLN 136 6.058 -15.757 -4.670 1015 HA GLN 136 HA GLN 136 3.413 -16.608 -5.272 1016 HB2 GLN 136 HB2 GLN 136 5.694 -18.225 -4.047 1017 HB3 GLN 136 HB3 GLN 136 4.259 -18.892 -4.821 1018 HG2 GLN 136 HG2 GLN 136 6.443 -17.288 -6.173 1019 HG3 GLN 136 HG3 GLN 136 6.215 -19.029 -6.285 1020 HE21 GLN 136 HE21 GLN 136 6.290 -16.997 -8.394 1021 HE22 GLN 136 HE22 GLN 136 4.798 -17.137 -9.250 1022 H LYS 137 H LYS 137 5.319 -16.608 -2.263 1023 HA LYS 137 HA LYS 137 3.436 -17.626 -0.434 1024 HB2 LYS 137 HB2 LYS 137 5.839 -17.428 0.052 1025 HB3 LYS 137 HB3 LYS 137 5.742 -15.677 -0.039 1026 HG2 LYS 137 HG2 LYS 137 5.891 -16.334 2.266 1027 HG3 LYS 137 HG3 LYS 137 4.280 -15.673 1.969 1028 HD2 LYS 137 HD2 LYS 137 3.370 -17.983 1.824 1029 HD3 LYS 137 HD3 LYS 137 4.985 -18.636 2.132 1030 HE2 LYS 137 HE2 LYS 137 4.980 -17.436 4.333 1031 HE3 LYS 137 HE3 LYS 137 3.313 -16.947 4.023 1032 HZ1 LYS 137 HZ1 LYS 137 2.713 -19.293 3.932 1033 HZ2 LYS 137 HZ2 LYS 137 3.395 -18.874 5.421 1034 HZ3 LYS 137 HZ3 LYS 137 4.308 -19.727 4.282 1035 H MET 138 H MET 138 3.993 -14.319 -1.567 1036 HA MET 138 HA MET 138 2.212 -12.916 0.124 1037 HB2 MET 138 HB2 MET 138 3.172 -12.312 -2.704 1038 HB3 MET 138 HB3 MET 138 2.297 -11.166 -1.701 1039 HG2 MET 138 HG2 MET 138 4.858 -12.317 -0.634 1040 HG3 MET 138 HG3 MET 138 4.934 -11.091 -1.891 1041 HE1 MET 138 HE1 MET 138 3.459 -10.384 2.431 1042 HE2 MET 138 HE2 MET 138 4.378 -11.792 1.899 1043 HE3 MET 138 HE3 MET 138 2.692 -11.601 1.411 1044 H ALA 139 H ALA 139 1.781 -14.318 -3.130 1045 HA ALA 139 HA ALA 139 -0.937 -13.748 -3.533 1046 HB1 ALA 139 HB1 ALA 139 0.566 -14.479 -5.309 1047 HB2 ALA 139 HB2 ALA 139 -0.862 -15.515 -5.243 1048 HB3 ALA 139 HB3 ALA 139 0.681 -16.090 -4.590 1049 H GLU 140 H GLU 140 0.590 -16.434 -1.774 1050 HA GLU 140 HA GLU 140 -1.728 -18.001 -1.277 1051 HB2 GLU 140 HB2 GLU 140 0.709 -17.725 0.538 1052 HB3 GLU 140 HB3 GLU 140 -0.446 -19.055 0.538 1053 HG2 GLU 140 HG2 GLU 140 1.542 -18.371 -1.644 1054 HG3 GLU 140 HG3 GLU 140 1.639 -19.719 -0.522 1055 H MET 141 H MET 141 -0.263 -15.299 0.489 1056 HA MET 141 HA MET 141 -2.189 -15.193 2.638 1057 HB2 MET 141 HB2 MET 141 -0.113 -13.208 1.612 1058 HB3 MET 141 HB3 MET 141 -1.112 -12.906 3.034 1059 HG2 MET 141 HG2 MET 141 0.748 -15.275 2.758 1060 HG3 MET 141 HG3 MET 141 1.176 -13.755 3.546 1061 HE1 MET 141 HE1 MET 141 0.196 -12.939 5.879 1062 HE2 MET 141 HE2 MET 141 -1.187 -13.701 6.666 1063 HE3 MET 141 HE3 MET 141 -1.396 -12.872 5.122 1064 H GLY 142 H GLY 142 -2.370 -14.264 -0.647 1065 HA2 GLY 142 HA2 GLY 142 -3.907 -13.084 -1.872 1066 HA3 GLY 142 HA3 GLY 142 -4.868 -12.891 -0.410 1067 H MET 143 H MET 143 -1.552 -11.840 -1.177 1068 HA MET 143 HA MET 143 -1.820 -9.249 -0.006 1069 HB2 MET 143 HB2 MET 143 0.334 -10.469 -0.173 1070 HB3 MET 143 HB3 MET 143 0.290 -10.332 -1.925 1071 HG2 MET 143 HG2 MET 143 1.849 -8.731 -0.991 1072 HG3 MET 143 HG3 MET 143 0.486 -7.871 -1.710 1073 HE1 MET 143 HE1 MET 143 1.654 -5.748 1.480 1074 HE2 MET 143 HE2 MET 143 1.525 -5.727 -0.278 1075 HE3 MET 143 HE3 MET 143 2.709 -6.776 0.512 1076 H GLU 144 H GLU 144 -1.729 -10.415 -3.361 1077 HA GLU 144 HA GLU 144 -2.013 -8.005 -4.719 1078 HB2 GLU 144 HB2 GLU 144 -2.925 -10.788 -5.520 1079 HB3 GLU 144 HB3 GLU 144 -2.952 -9.407 -6.607 1080 HG2 GLU 144 HG2 GLU 144 -0.945 -10.307 -7.247 1081 HG3 GLU 144 HG3 GLU 144 -0.368 -9.251 -5.966 1082 H GLU 145 H GLU 145 -4.456 -10.215 -3.510 1083 HA GLU 145 HA GLU 145 -6.793 -8.846 -4.476 1084 HB2 GLU 145 HB2 GLU 145 -6.451 -11.029 -2.368 1085 HB3 GLU 145 HB3 GLU 145 -7.973 -10.586 -3.138 1086 HG2 GLU 145 HG2 GLU 145 -7.271 -11.434 -5.260 1087 HG3 GLU 145 HG3 GLU 145 -5.593 -11.573 -4.734 1088 H GLY 146 H GLY 146 -5.002 -8.905 -1.434 1089 HA2 GLY 146 HA2 GLY 146 -6.934 -7.604 0.231 1090 HA3 GLY 146 HA3 GLY 146 -5.242 -7.877 0.609 1091 H MET 147 H MET 147 -3.916 -6.462 -1.353 1092 HA MET 147 HA MET 147 -4.080 -3.730 -0.740 1093 HB2 MET 147 HB2 MET 147 -2.948 -5.143 -3.177 1094 HB3 MET 147 HB3 MET 147 -2.890 -3.392 -3.028 1095 HG2 MET 147 HG2 MET 147 -1.582 -3.630 -0.949 1096 HG3 MET 147 HG3 MET 147 -1.606 -5.368 -1.165 1097 HE1 MET 147 HE1 MET 147 0.588 -2.439 -3.987 1098 HE2 MET 147 HE2 MET 147 -0.233 -1.952 -2.506 1099 HE3 MET 147 HE3 MET 147 -1.173 -2.506 -3.893 1100 H ARG 148 H ARG 148 -5.500 -5.520 -3.504 1101 HA ARG 148 HA ARG 148 -6.555 -3.376 -4.942 1102 HB2 ARG 148 HB2 ARG 148 -6.411 -5.615 -5.880 1103 HB3 ARG 148 HB3 ARG 148 -7.562 -6.237 -4.697 1104 HG2 ARG 148 HG2 ARG 148 -9.342 -4.837 -5.686 1105 HG3 ARG 148 HG3 ARG 148 -8.191 -4.195 -6.862 1106 HD2 ARG 148 HD2 ARG 148 -7.937 -6.367 -7.888 1107 HD3 ARG 148 HD3 ARG 148 -8.899 -7.134 -6.618 1108 HE ARG 148 HE ARG 148 -10.656 -5.372 -7.589 1109 HH11 ARG 148 HH11 ARG 148 -8.621 -7.589 -9.301 1110 HH12 ARG 148 HH12 ARG 148 -9.760 -7.805 -10.579 1111 HH21 ARG 148 HH21 ARG 148 -12.083 -5.663 -9.243 1112 HH22 ARG 148 HH22 ARG 148 -11.692 -6.719 -10.553 1113 H GLU 149 H GLU 149 -8.205 -5.308 -2.376 1114 HA GLU 149 HA GLU 149 -10.690 -3.897 -2.473 1115 HB2 GLU 149 HB2 GLU 149 -9.468 -5.643 -0.306 1116 HB3 GLU 149 HB3 GLU 149 -11.112 -5.008 -0.233 1117 HG2 GLU 149 HG2 GLU 149 -11.677 -6.217 -2.299 1118 HG3 GLU 149 HG3 GLU 149 -10.032 -6.850 -2.388 1119 H ALA 150 H ALA 150 -7.774 -3.440 -0.494 1120 HA ALA 150 HA ALA 150 -8.675 -1.358 1.201 1121 HB1 ALA 150 HB1 ALA 150 -6.274 -0.847 1.501 1122 HB2 ALA 150 HB2 ALA 150 -5.876 -1.867 0.111 1123 HB3 ALA 150 HB3 ALA 150 -6.570 -2.587 1.566 1124 H ILE 151 H ILE 151 -7.230 -1.320 -2.018 1125 HA ILE 151 HA ILE 151 -7.091 1.532 -2.314 1126 HB ILE 151 HB ILE 151 -6.674 -0.739 -4.309 1127 HG12 ILE 151 HG12 ILE 151 -4.558 0.983 -2.925 1128 HG13 ILE 151 HG13 ILE 151 -5.101 -0.560 -2.276 1129 HG21 ILE 151 HG21 ILE 151 -5.507 0.911 -5.747 1130 HG22 ILE 151 HG22 ILE 151 -5.976 2.203 -4.640 1131 HG23 ILE 151 HG23 ILE 151 -7.210 1.319 -5.539 1132 HD11 ILE 151 HD11 ILE 151 -3.024 -0.844 -3.432 1133 HD12 ILE 151 HD12 ILE 151 -3.685 -0.123 -4.900 1134 HD13 ILE 151 HD13 ILE 151 -4.298 -1.678 -4.323 1135 H GLU 152 H GLU 152 -9.457 -0.929 -3.098 1136 HA GLU 152 HA GLU 152 -11.262 0.698 -4.608 1137 HB2 GLU 152 HB2 GLU 152 -11.653 -1.800 -2.918 1138 HB3 GLU 152 HB3 GLU 152 -13.002 -1.007 -3.723 1139 HG2 GLU 152 HG2 GLU 152 -12.019 -1.427 -5.904 1140 HG3 GLU 152 HG3 GLU 152 -10.566 -2.098 -5.159 1141 H GLN 153 H GLN 153 -10.641 0.262 -1.156 1142 HA GLN 153 HA GLN 153 -13.075 1.588 -0.292 1143 HB2 GLN 153 HB2 GLN 153 -11.944 -0.333 0.938 1144 HB3 GLN 153 HB3 GLN 153 -10.679 0.793 1.418 1145 HG2 GLN 153 HG2 GLN 153 -12.183 2.062 2.778 1146 HG3 GLN 153 HG3 GLN 153 -13.600 1.297 2.065 1147 HE21 GLN 153 HE21 GLN 153 -10.989 0.892 4.330 1148 HE22 GLN 153 HE22 GLN 153 -11.603 -0.516 5.102 1149 H ILE 154 H ILE 154 -9.831 2.575 -1.117 1150 HA ILE 154 HA ILE 154 -9.619 5.120 0.047 1151 HB ILE 154 HB ILE 154 -8.811 4.247 -2.761 1152 HG12 ILE 154 HG12 ILE 154 -7.151 4.476 -0.217 1153 HG13 ILE 154 HG13 ILE 154 -7.728 2.971 -0.925 1154 HG21 ILE 154 HG21 ILE 154 -8.949 6.701 -2.716 1155 HG22 ILE 154 HG22 ILE 154 -7.262 6.196 -2.794 1156 HG23 ILE 154 HG23 ILE 154 -7.943 6.754 -1.265 1157 HD11 ILE 154 HD11 ILE 154 -5.388 3.359 -1.405 1158 HD12 ILE 154 HD12 ILE 154 -5.774 4.882 -2.201 1159 HD13 ILE 154 HD13 ILE 154 -6.336 3.357 -2.889 1160 H ASP 155 H ASP 155 -11.507 4.044 -2.743 1161 HA ASP 155 HA ASP 155 -12.428 6.517 -3.718 1162 HB2 ASP 155 HB2 ASP 155 -12.532 4.301 -4.902 1163 HB3 ASP 155 HB3 ASP 155 -13.794 3.787 -3.791 1164 H ALA 156 H ALA 156 -13.641 4.371 -1.156 1165 HA ALA 156 HA ALA 156 -15.974 5.898 -0.466 1166 HB1 ALA 156 HB1 ALA 156 -15.779 3.501 0.097 1167 HB2 ALA 156 HB2 ALA 156 -16.080 4.470 1.540 1168 HB3 ALA 156 HB3 ALA 156 -14.452 3.854 1.210 1169 H VAL 157 H VAL 157 -12.595 6.098 0.480 1170 HA VAL 157 HA VAL 157 -12.944 7.699 2.861 1171 HB VAL 157 HB VAL 157 -10.469 7.302 1.094 1172 HG11 VAL 157 HG11 VAL 157 -9.132 8.084 3.058 1173 HG12 VAL 157 HG12 VAL 157 -10.627 8.507 3.892 1174 HG13 VAL 157 HG13 VAL 157 -10.175 9.354 2.412 1175 HG21 VAL 157 HG21 VAL 157 -11.265 5.905 3.674 1176 HG22 VAL 157 HG22 VAL 157 -9.736 5.687 2.822 1177 HG23 VAL 157 HG23 VAL 157 -11.246 5.192 2.060 1178 H LEU 158 H LEU 158 -12.080 8.430 -0.529 1179 HA LEU 158 HA LEU 158 -11.687 11.260 -0.061 1180 HB2 LEU 158 HB2 LEU 158 -11.769 9.672 -2.659 1181 HB3 LEU 158 HB3 LEU 158 -11.298 11.362 -2.531 1182 HG LEU 158 HG LEU 158 -9.813 8.991 -1.326 1183 HD11 LEU 158 HD11 LEU 158 -9.516 9.113 -3.734 1184 HD12 LEU 158 HD12 LEU 158 -8.021 9.546 -2.908 1185 HD13 LEU 158 HD13 LEU 158 -9.029 10.809 -3.624 1186 HD21 LEU 158 HD21 LEU 158 -9.128 11.947 -1.173 1187 HD22 LEU 158 HD22 LEU 158 -8.079 10.625 -0.654 1188 HD23 LEU 158 HD23 LEU 158 -9.613 10.901 0.166 1189 H SER 159 H SER 159 -14.203 9.231 -1.488 1190 HA SER 159 HA SER 159 -15.878 11.490 -2.295 1191 HB2 SER 159 HB2 SER 159 -15.749 9.334 -3.626 1192 HB3 SER 159 HB3 SER 159 -16.557 8.510 -2.308 1193 HG SER 159 HG SER 159 -17.809 10.806 -3.242 1194 H GLU 160 H GLU 160 -15.982 8.829 0.058 1195 HA GLU 160 HA GLU 160 -17.519 8.054 1.499 1196 HB2 GLU 160 HB2 GLU 160 -16.437 10.258 2.564 1197 HB3 GLU 160 HB3 GLU 160 -18.109 10.790 2.583 1198 HG2 GLU 160 HG2 GLU 160 -18.722 8.790 3.895 1199 HG3 GLU 160 HG3 GLU 160 -17.052 8.246 3.856 1200 HA PRO 161 HA PRO 161 -20.817 9.098 -1.505 1201 HB2 PRO 161 HB2 PRO 161 -21.528 6.600 -2.240 1202 HB3 PRO 161 HB3 PRO 161 -19.935 7.254 -2.672 1203 HG2 PRO 161 HG2 PRO 161 -20.665 5.439 -0.352 1204 HG3 PRO 161 HG3 PRO 161 -19.344 5.248 -1.527 1205 HD2 PRO 161 HD2 PRO 161 -18.951 6.357 0.953 1206 HD3 PRO 161 HD3 PRO 161 -18.002 6.834 -0.470 1207 H ALA 162 H ALA 162 -22.056 9.990 0.460 1208 HA ALA 162 HA ALA 162 -24.015 10.333 1.542 1209 HB1 ALA 162 HB1 ALA 162 -24.937 10.028 -0.729 1210 HB2 ALA 162 HB2 ALA 162 -26.077 9.486 0.507 1211 HB3 ALA 162 HB3 ALA 162 -25.145 8.303 -0.414 1212 H ASN 163 H ASN 163 -24.644 6.891 0.891 1213 HA ASN 163 HA ASN 163 -25.336 6.016 3.452 1214 HB2 ASN 163 HB2 ASN 163 -25.745 4.744 1.362 1215 HB3 ASN 163 HB3 ASN 163 -24.017 4.510 1.140 1216 HD21 ASN 163 HD21 ASN 163 -24.118 2.293 1.136 1217 HD22 ASN 163 HD22 ASN 163 -24.495 1.363 2.541 1218 H ALA 164 H ALA 164 -22.155 6.146 1.874 1219 HA ALA 164 HA ALA 164 -20.065 6.480 2.624 1220 HB1 ALA 164 HB1 ALA 164 -19.556 6.960 4.970 1221 HB2 ALA 164 HB2 ALA 164 -21.173 6.426 5.440 1222 HB3 ALA 164 HB3 ALA 164 -20.981 7.865 4.439 1223 H LEU 165 H LEU 165 -21.468 4.228 5.038 1224 HA LEU 165 HA LEU 165 -19.309 2.288 4.473 1225 HB2 LEU 165 HB2 LEU 165 -19.851 1.311 6.669 1226 HB3 LEU 165 HB3 LEU 165 -19.447 3.009 6.769 1227 HG LEU 165 HG LEU 165 -22.060 3.389 6.851 1228 HD11 LEU 165 HD11 LEU 165 -23.352 1.613 7.947 1229 HD12 LEU 165 HD12 LEU 165 -21.983 0.509 7.794 1230 HD13 LEU 165 HD13 LEU 165 -22.795 1.115 6.351 1231 HD21 LEU 165 HD21 LEU 165 -20.595 2.247 9.252 1232 HD22 LEU 165 HD22 LEU 165 -22.055 3.240 9.302 1233 HD23 LEU 165 HD23 LEU 165 -20.546 3.925 8.702 1234 H GLU 166 H GLU 166 -19.845 -0.009 4.296 1235 HA GLU 166 HA GLU 166 -22.473 -0.496 2.989 1236 HB2 GLU 166 HB2 GLU 166 -19.894 -2.111 2.778 1237 HB3 GLU 166 HB3 GLU 166 -21.367 -2.367 1.843 1238 HG2 GLU 166 HG2 GLU 166 -21.030 -0.115 0.801 1239 HG3 GLU 166 HG3 GLU 166 -19.504 0.018 1.677 1240 H HIS 167 H HIS 167 -23.878 -1.969 3.869 1241 HA HIS 167 HA HIS 167 -23.116 -3.560 6.203 1242 HB2 HIS 167 HB2 HIS 167 -25.567 -4.252 6.210 1243 HB3 HIS 167 HB3 HIS 167 -25.254 -2.547 6.470 1244 HD1 HIS 167 HD1 HIS 167 -26.369 -0.916 4.901 1245 HD2 HIS 167 HD2 HIS 167 -26.791 -4.840 3.626 1246 HE1 HIS 167 HE1 HIS 167 -28.017 -0.833 3.017 1247 HE2 HIS 167 HE2 HIS 167 -28.110 -3.184 2.149 1248 H HIS 168 H HIS 168 -21.645 -5.043 5.333 1249 HA HIS 168 HA HIS 168 -22.482 -6.980 3.319 1250 HB2 HIS 168 HB2 HIS 168 -19.956 -6.725 5.006 1251 HB3 HIS 168 HB3 HIS 168 -20.220 -8.039 3.866 1252 HD1 HIS 168 HD1 HIS 168 -20.488 -7.301 1.303 1253 HD2 HIS 168 HD2 HIS 168 -18.969 -4.397 3.866 1254 HE1 HIS 168 HE1 HIS 168 -19.423 -5.586 -0.183 1255 HE2 HIS 168 HE2 HIS 168 -18.586 -3.800 1.374 1256 H HIS 169 H HIS 169 -21.219 -7.451 6.680 1257 HA HIS 169 HA HIS 169 -22.025 -8.501 8.513 1258 HB2 HIS 169 HB2 HIS 169 -24.127 -7.338 8.110 1259 HB3 HIS 169 HB3 HIS 169 -24.629 -8.541 6.932 1260 HD1 HIS 169 HD1 HIS 169 -25.606 -10.745 7.842 1261 HD2 HIS 169 HD2 HIS 169 -24.531 -8.058 10.818 1262 HE1 HIS 169 HE1 HIS 169 -26.629 -11.637 9.949 1263 HE2 HIS 169 HE2 HIS 169 -25.849 -10.076 11.756 1264 H HIS 170 H HIS 170 -21.870 -10.217 5.549 1265 HA HIS 170 HA HIS 170 -23.072 -12.691 6.426 1266 HB2 HIS 170 HB2 HIS 170 -23.085 -11.769 4.037 1267 HB3 HIS 170 HB3 HIS 170 -21.410 -12.291 3.909 1268 HD1 HIS 170 HD1 HIS 170 -21.627 -14.213 2.293 1269 HD2 HIS 170 HD2 HIS 170 -24.421 -14.446 5.355 1270 HE1 HIS 170 HE1 HIS 170 -22.759 -16.430 2.000 1271 HE2 HIS 170 HE2 HIS 170 -24.290 -16.628 3.984 1272 H HIS 171 H HIS 171 -19.978 -11.394 6.951 1273 HA HIS 171 HA HIS 171 -19.052 -14.013 7.953 1274 HB2 HIS 171 HB2 HIS 171 -17.517 -12.200 6.089 1275 HB3 HIS 171 HB3 HIS 171 -16.621 -13.112 7.293 1276 HD1 HIS 171 HD1 HIS 171 -16.588 -13.515 4.085 1277 HD2 HIS 171 HD2 HIS 171 -18.426 -15.943 6.913 1278 HE1 HIS 171 HE1 HIS 171 -16.754 -15.784 3.024 1279 HE2 HIS 171 HE2 HIS 171 -17.978 -17.196 4.697 1280 H HIS 172 H HIS 172 -18.256 -13.991 9.954 1281 HA HIS 172 HA HIS 172 -17.303 -11.507 11.241 1282 HB2 HIS 172 HB2 HIS 172 -19.440 -13.375 12.366 1283 HB3 HIS 172 HB3 HIS 172 -18.574 -12.205 13.355 1284 HD1 HIS 172 HD1 HIS 172 -21.675 -12.527 11.748 1285 HD2 HIS 172 HD2 HIS 172 -18.918 -9.443 12.030 1286 HE1 HIS 172 HE1 HIS 172 -22.958 -10.443 11.235 1287 HE2 HIS 172 HE2 HIS 172 -21.224 -8.625 11.203 Start of MODEL 20 1 H1 THR 1 H1 THR 1 -11.824 1.351 -7.781 2 H2 THR 1 H2 THR 1 -13.094 0.432 -8.396 3 H3 THR 1 H3 THR 1 -13.257 2.117 -8.257 4 HA THR 1 HA THR 1 -12.884 1.479 -10.517 5 HB THR 1 HB THR 1 -10.432 2.890 -9.380 6 HG1 THR 1 HG1 THR 1 -11.812 4.795 -9.806 7 HG21 THR 1 HG21 THR 1 -10.382 4.107 -11.530 8 HG22 THR 1 HG22 THR 1 -11.747 3.153 -12.113 9 HG23 THR 1 HG23 THR 1 -10.198 2.369 -11.793 10 H VAL 2 H VAL 2 -9.570 1.079 -9.181 11 HA VAL 2 HA VAL 2 -7.787 0.094 -10.224 12 HB VAL 2 HB VAL 2 -9.521 -2.291 -9.460 13 HG11 VAL 2 HG11 VAL 2 -6.565 -2.298 -10.206 14 HG12 VAL 2 HG12 VAL 2 -7.863 -3.068 -11.123 15 HG13 VAL 2 HG13 VAL 2 -7.450 -3.664 -9.516 16 HG21 VAL 2 HG21 VAL 2 -7.138 -1.004 -8.062 17 HG22 VAL 2 HG22 VAL 2 -8.069 -2.384 -7.475 18 HG23 VAL 2 HG23 VAL 2 -8.829 -0.799 -7.599 19 H VAL 3 H VAL 3 -7.721 0.821 -12.323 20 HA VAL 3 HA VAL 3 -9.226 -0.459 -14.458 21 HB VAL 3 HB VAL 3 -7.936 1.133 -15.974 22 HG11 VAL 3 HG11 VAL 3 -9.489 2.385 -13.672 23 HG12 VAL 3 HG12 VAL 3 -10.191 1.688 -15.134 24 HG13 VAL 3 HG13 VAL 3 -9.190 3.136 -15.242 25 HG21 VAL 3 HG21 VAL 3 -5.920 1.446 -14.573 26 HG22 VAL 3 HG22 VAL 3 -6.893 2.234 -13.326 27 HG23 VAL 3 HG23 VAL 3 -6.690 3.002 -14.906 28 H SER 4 H SER 4 -6.123 -1.006 -12.993 29 HA SER 4 HA SER 4 -5.699 -3.282 -14.769 30 HB2 SER 4 HB2 SER 4 -4.469 -1.537 -15.992 31 HB3 SER 4 HB3 SER 4 -3.607 -1.072 -14.526 32 HG SER 4 HG SER 4 -2.193 -2.525 -15.053 33 H VAL 5 H VAL 5 -4.676 -4.973 -13.723 34 HA VAL 5 HA VAL 5 -2.946 -4.389 -11.380 35 HB VAL 5 HB VAL 5 -4.659 -6.913 -11.713 36 HG11 VAL 5 HG11 VAL 5 -2.465 -7.453 -10.683 37 HG12 VAL 5 HG12 VAL 5 -3.760 -7.593 -9.493 38 HG13 VAL 5 HG13 VAL 5 -2.704 -6.179 -9.481 39 HG21 VAL 5 HG21 VAL 5 -4.840 -4.696 -9.642 40 HG22 VAL 5 HG22 VAL 5 -5.802 -6.178 -9.649 41 HG23 VAL 5 HG23 VAL 5 -5.992 -4.996 -10.946 42 H ASP 6 H ASP 6 -1.063 -4.379 -12.451 43 HA ASP 6 HA ASP 6 -0.213 -6.531 -14.227 44 HB2 ASP 6 HB2 ASP 6 1.506 -4.267 -13.116 45 HB3 ASP 6 HB3 ASP 6 1.762 -5.202 -14.591 46 H LYS 7 H LYS 7 1.016 -8.267 -13.533 47 HA LYS 7 HA LYS 7 2.547 -8.042 -11.005 48 HB2 LYS 7 HB2 LYS 7 0.494 -9.376 -10.571 49 HB3 LYS 7 HB3 LYS 7 0.934 -10.486 -11.865 50 HG2 LYS 7 HG2 LYS 7 2.995 -11.105 -10.603 51 HG3 LYS 7 HG3 LYS 7 2.493 -10.027 -9.298 52 HD2 LYS 7 HD2 LYS 7 1.944 -12.329 -8.720 53 HD3 LYS 7 HD3 LYS 7 0.456 -11.416 -8.945 54 HE2 LYS 7 HE2 LYS 7 1.635 -13.141 -11.153 55 HE3 LYS 7 HE3 LYS 7 0.553 -13.799 -9.932 56 HZ1 LYS 7 HZ1 LYS 7 -1.111 -12.136 -10.650 57 HZ2 LYS 7 HZ2 LYS 7 -0.699 -13.244 -11.854 58 HZ3 LYS 7 HZ3 LYS 7 -0.073 -11.680 -11.906 59 H ASP 8 H ASP 8 4.536 -7.887 -11.823 60 HA ASP 8 HA ASP 8 5.438 -9.518 -14.085 61 HB2 ASP 8 HB2 ASP 8 7.026 -7.412 -12.554 62 HB3 ASP 8 HB3 ASP 8 7.353 -8.048 -14.163 63 H VAL 9 H VAL 9 5.494 -11.553 -13.075 64 HA VAL 9 HA VAL 9 6.851 -12.174 -10.656 65 HB VAL 9 HB VAL 9 6.319 -14.047 -13.008 66 HG11 VAL 9 HG11 VAL 9 7.886 -15.007 -11.338 67 HG12 VAL 9 HG12 VAL 9 6.344 -15.864 -11.333 68 HG13 VAL 9 HG13 VAL 9 6.711 -14.703 -10.053 69 HG21 VAL 9 HG21 VAL 9 4.232 -12.922 -12.332 70 HG22 VAL 9 HG22 VAL 9 4.497 -13.405 -10.654 71 HG23 VAL 9 HG23 VAL 9 4.193 -14.632 -11.886 72 H GLU 10 H GLU 10 7.864 -11.899 -13.980 73 HA GLU 10 HA GLU 10 10.477 -13.021 -13.844 74 HB2 GLU 10 HB2 GLU 10 9.324 -10.963 -15.787 75 HB3 GLU 10 HB3 GLU 10 10.775 -11.933 -16.053 76 HG2 GLU 10 HG2 GLU 10 9.444 -13.977 -16.071 77 HG3 GLU 10 HG3 GLU 10 7.986 -13.073 -15.689 78 H ALA 11 H ALA 11 9.198 -9.830 -13.174 79 HA ALA 11 HA ALA 11 11.899 -8.690 -12.692 80 HB1 ALA 11 HB1 ALA 11 9.245 -7.245 -13.035 81 HB2 ALA 11 HB2 ALA 11 10.454 -7.477 -14.299 82 HB3 ALA 11 HB3 ALA 11 10.837 -6.490 -12.887 83 H LEU 12 H LEU 12 9.645 -10.273 -10.956 84 HA LEU 12 HA LEU 12 8.843 -10.410 -8.850 85 HB2 LEU 12 HB2 LEU 12 11.464 -9.039 -8.152 86 HB3 LEU 12 HB3 LEU 12 10.450 -9.930 -7.026 87 HG LEU 12 HG LEU 12 11.908 -11.120 -9.427 88 HD11 LEU 12 HD11 LEU 12 13.436 -10.522 -7.587 89 HD12 LEU 12 HD12 LEU 12 13.308 -12.270 -7.759 90 HD13 LEU 12 HD13 LEU 12 12.454 -11.450 -6.445 91 HD21 LEU 12 HD21 LEU 12 10.183 -12.503 -7.342 92 HD22 LEU 12 HD22 LEU 12 11.158 -13.315 -8.570 93 HD23 LEU 12 HD23 LEU 12 9.805 -12.298 -9.055 94 H SER 13 H SER 13 8.023 -7.991 -10.287 95 HA SER 13 HA SER 13 7.483 -6.123 -8.041 96 HB2 SER 13 HB2 SER 13 7.134 -4.387 -9.821 97 HB3 SER 13 HB3 SER 13 8.772 -5.017 -9.783 98 HG SER 13 HG SER 13 6.719 -5.763 -11.602 99 H PHE 14 H PHE 14 5.359 -5.176 -7.953 100 HA PHE 14 HA PHE 14 3.187 -6.560 -9.423 101 HB2 PHE 14 HB2 PHE 14 3.443 -7.850 -7.404 102 HB3 PHE 14 HB3 PHE 14 3.576 -6.412 -6.403 103 HD1 PHE 14 HD1 PHE 14 1.093 -7.863 -8.851 104 HD2 PHE 14 HD2 PHE 14 1.742 -6.012 -5.042 105 HE1 PHE 14 HE1 PHE 14 -1.307 -8.021 -8.346 106 HE2 PHE 14 HE2 PHE 14 -0.657 -6.176 -4.555 107 HZ PHE 14 HZ PHE 14 -2.180 -7.179 -6.197 108 H SER 15 H SER 15 2.290 -4.881 -10.449 109 HA SER 15 HA SER 15 2.065 -2.216 -9.182 110 HB2 SER 15 HB2 SER 15 3.315 -2.086 -11.210 111 HB3 SER 15 HB3 SER 15 2.203 -3.143 -12.065 112 HG SER 15 HG SER 15 0.866 -1.511 -12.396 113 H ILE 16 H ILE 16 0.063 -1.524 -8.537 114 HA ILE 16 HA ILE 16 -2.341 -2.495 -10.014 115 HB ILE 16 HB ILE 16 -2.270 -1.464 -7.137 116 HG12 ILE 16 HG12 ILE 16 -2.774 -4.306 -8.138 117 HG13 ILE 16 HG13 ILE 16 -1.272 -3.759 -7.397 118 HG21 ILE 16 HG21 ILE 16 -4.606 -2.570 -8.763 119 HG22 ILE 16 HG22 ILE 16 -4.388 -0.887 -8.275 120 HG23 ILE 16 HG23 ILE 16 -4.667 -2.129 -7.054 121 HD11 ILE 16 HD11 ILE 16 -2.463 -3.310 -5.314 122 HD12 ILE 16 HD12 ILE 16 -2.637 -4.985 -5.824 123 HD13 ILE 16 HD13 ILE 16 -3.972 -3.858 -6.050 124 H VAL 17 H VAL 17 -3.244 -0.999 -11.238 125 HA VAL 17 HA VAL 17 -2.673 1.878 -10.850 126 HB VAL 17 HB VAL 17 -3.622 0.448 -13.380 127 HG11 VAL 17 HG11 VAL 17 -2.526 3.262 -13.004 128 HG12 VAL 17 HG12 VAL 17 -4.209 2.840 -13.334 129 HG13 VAL 17 HG13 VAL 17 -2.968 2.527 -14.547 130 HG21 VAL 17 HG21 VAL 17 -1.371 -0.364 -12.786 131 HG22 VAL 17 HG22 VAL 17 -0.785 1.298 -12.684 132 HG23 VAL 17 HG23 VAL 17 -1.311 0.645 -14.236 133 H ALA 18 H ALA 18 -4.373 3.116 -10.183 134 HA ALA 18 HA ALA 18 -7.161 2.407 -10.850 135 HB1 ALA 18 HB1 ALA 18 -6.210 2.885 -7.999 136 HB2 ALA 18 HB2 ALA 18 -6.702 1.330 -8.677 137 HB3 ALA 18 HB3 ALA 18 -7.884 2.630 -8.509 138 H GLU 19 H GLU 19 -8.308 4.187 -11.414 139 HA GLU 19 HA GLU 19 -7.165 6.877 -10.974 140 HB2 GLU 19 HB2 GLU 19 -9.383 5.968 -12.859 141 HB3 GLU 19 HB3 GLU 19 -8.659 7.575 -12.813 142 HG2 GLU 19 HG2 GLU 19 -6.508 6.654 -13.541 143 HG3 GLU 19 HG3 GLU 19 -7.171 5.020 -13.505 144 H PHE 20 H PHE 20 -8.059 8.237 -9.547 145 HA PHE 20 HA PHE 20 -10.835 7.823 -8.573 146 HB2 PHE 20 HB2 PHE 20 -8.467 9.007 -7.036 147 HB3 PHE 20 HB3 PHE 20 -10.100 8.792 -6.406 148 HD1 PHE 20 HD1 PHE 20 -11.050 6.378 -6.342 149 HD2 PHE 20 HD2 PHE 20 -6.882 7.247 -6.810 150 HE1 PHE 20 HE1 PHE 20 -10.488 4.089 -5.646 151 HE2 PHE 20 HE2 PHE 20 -6.332 4.957 -6.111 152 HZ PHE 20 HZ PHE 20 -8.132 3.379 -5.534 153 H ASP 21 H ASP 21 -12.217 9.557 -8.635 154 HA ASP 21 HA ASP 21 -11.520 11.793 -10.320 155 HB2 ASP 21 HB2 ASP 21 -13.741 10.629 -10.400 156 HB3 ASP 21 HB3 ASP 21 -14.103 11.249 -8.790 157 H ALA 22 H ALA 22 -9.950 12.905 -9.169 158 HA ALA 22 HA ALA 22 -10.668 14.943 -7.315 159 HB1 ALA 22 HB1 ALA 22 -10.692 13.053 -5.711 160 HB2 ALA 22 HB2 ALA 22 -9.353 14.148 -5.356 161 HB3 ALA 22 HB3 ALA 22 -9.048 12.618 -6.184 162 H ASP 23 H ASP 23 -8.311 15.754 -6.292 163 HA ASP 23 HA ASP 23 -6.456 15.951 -8.580 164 HB2 ASP 23 HB2 ASP 23 -5.378 17.790 -7.308 165 HB3 ASP 23 HB3 ASP 23 -7.087 18.093 -7.591 166 H VAL 24 H VAL 24 -4.087 16.106 -7.865 167 HA VAL 24 HA VAL 24 -3.260 13.529 -7.136 168 HB VAL 24 HB VAL 24 -1.658 16.104 -7.432 169 HG11 VAL 24 HG11 VAL 24 -0.319 14.528 -6.107 170 HG12 VAL 24 HG12 VAL 24 0.351 14.666 -7.736 171 HG13 VAL 24 HG13 VAL 24 -0.609 13.250 -7.296 172 HG21 VAL 24 HG21 VAL 24 -2.111 13.807 -9.373 173 HG22 VAL 24 HG22 VAL 24 -1.103 15.227 -9.671 174 HG23 VAL 24 HG23 VAL 24 -2.847 15.409 -9.473 175 H LYS 25 H LYS 25 -3.268 16.556 -5.271 176 HA LYS 25 HA LYS 25 -1.818 15.508 -3.029 177 HB2 LYS 25 HB2 LYS 25 -3.564 17.993 -3.193 178 HB3 LYS 25 HB3 LYS 25 -2.448 17.604 -1.880 179 HG2 LYS 25 HG2 LYS 25 -0.592 17.602 -3.639 180 HG3 LYS 25 HG3 LYS 25 -1.767 18.299 -4.752 181 HD2 LYS 25 HD2 LYS 25 -0.388 20.060 -3.766 182 HD3 LYS 25 HD3 LYS 25 -2.058 20.231 -3.209 183 HE2 LYS 25 HE2 LYS 25 -1.479 19.188 -1.068 184 HE3 LYS 25 HE3 LYS 25 0.166 18.878 -1.631 185 HZ1 LYS 25 HZ1 LYS 25 -1.044 21.565 -1.273 186 HZ2 LYS 25 HZ2 LYS 25 0.547 21.239 -1.746 187 HZ3 LYS 25 HZ3 LYS 25 0.024 20.818 -0.196 188 H ARG 26 H ARG 26 -5.207 15.630 -3.874 189 HA ARG 26 HA ARG 26 -6.374 15.016 -1.348 190 HB2 ARG 26 HB2 ARG 26 -7.652 15.932 -3.246 191 HB3 ARG 26 HB3 ARG 26 -7.329 14.486 -4.190 192 HG2 ARG 26 HG2 ARG 26 -9.601 14.425 -3.404 193 HG3 ARG 26 HG3 ARG 26 -8.688 13.156 -2.588 194 HD2 ARG 26 HD2 ARG 26 -8.594 14.460 -0.549 195 HD3 ARG 26 HD3 ARG 26 -9.305 15.865 -1.356 196 HE ARG 26 HE ARG 26 -11.144 13.870 -1.702 197 HH11 ARG 26 HH11 ARG 26 -9.679 15.186 1.144 198 HH12 ARG 26 HH12 ARG 26 -11.111 14.981 2.088 199 HH21 ARG 26 HH21 ARG 26 -12.940 13.638 -0.485 200 HH22 ARG 26 HH22 ARG 26 -12.928 14.108 1.174 201 H VAL 27 H VAL 27 -5.336 12.978 -4.086 202 HA VAL 27 HA VAL 27 -5.845 10.450 -2.794 203 HB VAL 27 HB VAL 27 -4.083 10.955 -5.236 204 HG11 VAL 27 HG11 VAL 27 -3.793 8.691 -4.305 205 HG12 VAL 27 HG12 VAL 27 -4.643 8.607 -5.849 206 HG13 VAL 27 HG13 VAL 27 -5.541 8.432 -4.341 207 HG21 VAL 27 HG21 VAL 27 -7.086 10.443 -5.161 208 HG22 VAL 27 HG22 VAL 27 -6.098 10.499 -6.623 209 HG23 VAL 27 HG23 VAL 27 -6.299 11.950 -5.639 210 H TRP 28 H TRP 28 -3.041 12.602 -3.021 211 HA TRP 28 HA TRP 28 -1.070 10.903 -1.876 212 HB2 TRP 28 HB2 TRP 28 -0.511 13.001 -3.056 213 HB3 TRP 28 HB3 TRP 28 -1.309 13.941 -1.807 214 HD1 TRP 28 HD1 TRP 28 0.199 14.694 0.218 215 HE1 TRP 28 HE1 TRP 28 2.624 14.251 0.927 216 HE3 TRP 28 HE3 TRP 28 1.351 10.989 -3.119 217 HZ2 TRP 28 HZ2 TRP 28 4.758 12.559 0.160 218 HZ3 TRP 28 HZ3 TRP 28 3.610 10.024 -3.069 219 HH2 TRP 28 HH2 TRP 28 5.279 10.794 -1.463 220 H ALA 29 H ALA 29 -3.564 12.946 -0.440 221 HA ALA 29 HA ALA 29 -2.570 13.181 2.184 222 HB1 ALA 29 HB1 ALA 29 -4.331 14.622 1.258 223 HB2 ALA 29 HB2 ALA 29 -4.837 13.895 2.785 224 HB3 ALA 29 HB3 ALA 29 -5.455 13.261 1.254 225 H ILE 30 H ILE 30 -4.329 10.516 0.680 226 HA ILE 30 HA ILE 30 -5.123 9.173 3.097 227 HB ILE 30 HB ILE 30 -5.707 7.276 1.733 228 HG12 ILE 30 HG12 ILE 30 -3.928 8.509 -0.405 229 HG13 ILE 30 HG13 ILE 30 -3.677 6.985 0.423 230 HG21 ILE 30 HG21 ILE 30 -7.201 9.218 1.504 231 HG22 ILE 30 HG22 ILE 30 -7.147 8.288 0.006 232 HG23 ILE 30 HG23 ILE 30 -6.250 9.805 0.135 233 HD11 ILE 30 HD11 ILE 30 -4.380 6.569 -1.796 234 HD12 ILE 30 HD12 ILE 30 -5.776 7.630 -1.623 235 HD13 ILE 30 HD13 ILE 30 -5.700 6.115 -0.715 236 H TRP 31 H TRP 31 -2.097 9.466 1.493 237 HA TRP 31 HA TRP 31 -0.838 7.181 2.873 238 HB2 TRP 31 HB2 TRP 31 0.223 9.131 0.771 239 HB3 TRP 31 HB3 TRP 31 1.171 7.825 1.479 240 HD1 TRP 31 HD1 TRP 31 -1.280 8.491 -1.310 241 HE1 TRP 31 HE1 TRP 31 -1.854 6.279 -2.498 242 HE3 TRP 31 HE3 TRP 31 0.850 5.213 1.993 243 HZ2 TRP 31 HZ2 TRP 31 -1.441 3.517 -2.091 244 HZ3 TRP 31 HZ3 TRP 31 0.730 2.806 1.517 245 HH2 TRP 31 HH2 TRP 31 -0.406 1.967 -0.479 246 H GLU 32 H GLU 32 -0.701 10.711 2.654 247 HA GLU 32 HA GLU 32 1.530 11.086 4.392 248 HB2 GLU 32 HB2 GLU 32 0.917 12.686 2.609 249 HB3 GLU 32 HB3 GLU 32 -0.594 13.057 3.435 250 HG2 GLU 32 HG2 GLU 32 0.649 14.024 5.318 251 HG3 GLU 32 HG3 GLU 32 2.176 13.580 4.559 252 H ASP 33 H ASP 33 -1.979 11.297 4.824 253 HA ASP 33 HA ASP 33 -1.765 12.047 7.640 254 HB2 ASP 33 HB2 ASP 33 -3.416 13.116 6.024 255 HB3 ASP 33 HB3 ASP 33 -4.282 11.585 5.980 256 HA PRO 34 HA PRO 34 -1.836 7.625 8.798 257 HB2 PRO 34 HB2 PRO 34 -2.320 8.774 11.539 258 HB3 PRO 34 HB3 PRO 34 -1.088 7.623 10.997 259 HG2 PRO 34 HG2 PRO 34 -0.418 10.153 11.497 260 HG3 PRO 34 HG3 PRO 34 0.281 9.307 10.100 261 HD2 PRO 34 HD2 PRO 34 -1.980 11.315 10.159 262 HD3 PRO 34 HD3 PRO 34 -0.604 11.202 9.036 263 H ARG 35 H ARG 35 -4.326 9.914 10.034 264 HA ARG 35 HA ARG 35 -6.211 7.961 10.914 265 HB2 ARG 35 HB2 ARG 35 -6.719 10.829 10.035 266 HB3 ARG 35 HB3 ARG 35 -7.893 9.813 10.862 267 HG2 ARG 35 HG2 ARG 35 -5.252 10.769 12.016 268 HG3 ARG 35 HG3 ARG 35 -6.839 11.452 12.364 269 HD2 ARG 35 HD2 ARG 35 -6.451 10.068 14.219 270 HD3 ARG 35 HD3 ARG 35 -7.451 9.050 13.189 271 HE ARG 35 HE ARG 35 -5.610 7.681 12.757 272 HH11 ARG 35 HH11 ARG 35 -4.708 10.281 14.865 273 HH12 ARG 35 HH12 ARG 35 -3.160 9.589 15.209 274 HH21 ARG 35 HH21 ARG 35 -3.633 6.832 13.227 275 HH22 ARG 35 HH22 ARG 35 -2.558 7.679 14.288 276 H GLN 36 H GLN 36 -5.818 9.687 7.840 277 HA GLN 36 HA GLN 36 -8.076 8.530 6.516 278 HB2 GLN 36 HB2 GLN 36 -5.576 9.814 5.335 279 HB3 GLN 36 HB3 GLN 36 -7.030 9.403 4.423 280 HG2 GLN 36 HG2 GLN 36 -8.325 10.984 5.853 281 HG3 GLN 36 HG3 GLN 36 -6.823 11.440 6.660 282 HE21 GLN 36 HE21 GLN 36 -6.952 13.588 5.989 283 HE22 GLN 36 HE22 GLN 36 -6.712 14.072 4.354 284 H LEU 37 H LEU 37 -4.655 7.598 6.801 285 HA LEU 37 HA LEU 37 -4.621 5.630 4.737 286 HB2 LEU 37 HB2 LEU 37 -2.581 6.670 5.574 287 HB3 LEU 37 HB3 LEU 37 -2.846 6.000 7.174 288 HG LEU 37 HG LEU 37 -2.421 3.710 6.302 289 HD11 LEU 37 HD11 LEU 37 -1.824 5.017 3.629 290 HD12 LEU 37 HD12 LEU 37 -3.188 3.952 3.984 291 HD13 LEU 37 HD13 LEU 37 -1.538 3.318 4.045 292 HD21 LEU 37 HD21 LEU 37 -0.214 5.664 5.596 293 HD22 LEU 37 HD22 LEU 37 -0.023 3.934 5.914 294 HD23 LEU 37 HD23 LEU 37 -0.555 5.013 7.203 295 H GLU 38 H GLU 38 -4.883 5.251 8.306 296 HA GLU 38 HA GLU 38 -5.121 2.426 8.386 297 HB2 GLU 38 HB2 GLU 38 -5.898 2.755 10.719 298 HB3 GLU 38 HB3 GLU 38 -4.503 3.758 10.346 299 HG2 GLU 38 HG2 GLU 38 -6.098 5.687 9.946 300 HG3 GLU 38 HG3 GLU 38 -7.390 4.662 10.568 301 H ARG 39 H ARG 39 -7.460 4.885 7.714 302 HA ARG 39 HA ARG 39 -9.900 3.627 8.255 303 HB2 ARG 39 HB2 ARG 39 -9.890 5.970 7.897 304 HB3 ARG 39 HB3 ARG 39 -8.993 5.834 6.393 305 HG2 ARG 39 HG2 ARG 39 -10.921 5.057 5.202 306 HG3 ARG 39 HG3 ARG 39 -11.843 4.876 6.685 307 HD2 ARG 39 HD2 ARG 39 -10.842 7.504 5.542 308 HD3 ARG 39 HD3 ARG 39 -12.498 6.900 5.419 309 HE ARG 39 HE ARG 39 -11.588 7.081 8.132 310 HH11 ARG 39 HH11 ARG 39 -13.012 8.931 5.578 311 HH12 ARG 39 HH12 ARG 39 -13.640 10.121 6.656 312 HH21 ARG 39 HH21 ARG 39 -12.441 8.587 9.484 313 HH22 ARG 39 HH22 ARG 39 -13.324 9.928 8.838 314 H TRP 40 H TRP 40 -7.803 3.418 5.372 315 HA TRP 40 HA TRP 40 -9.668 1.418 4.201 316 HB2 TRP 40 HB2 TRP 40 -8.860 2.047 1.968 317 HB3 TRP 40 HB3 TRP 40 -9.524 3.444 2.811 318 HD1 TRP 40 HD1 TRP 40 -7.765 5.348 3.602 319 HE1 TRP 40 HE1 TRP 40 -5.402 5.948 2.753 320 HE3 TRP 40 HE3 TRP 40 -6.725 1.091 0.989 321 HZ2 TRP 40 HZ2 TRP 40 -3.394 4.791 1.148 322 HZ3 TRP 40 HZ3 TRP 40 -4.578 0.913 -0.193 323 HH2 TRP 40 HH2 TRP 40 -2.948 2.727 -0.110 324 H TRP 41 H TRP 41 -6.582 1.740 5.597 325 HA TRP 41 HA TRP 41 -5.058 0.062 3.853 326 HB2 TRP 41 HB2 TRP 41 -4.121 1.780 5.509 327 HB3 TRP 41 HB3 TRP 41 -4.398 0.598 6.782 328 HD1 TRP 41 HD1 TRP 41 -2.221 -0.737 7.320 329 HE1 TRP 41 HE1 TRP 41 -0.125 -1.448 6.013 330 HE3 TRP 41 HE3 TRP 41 -3.428 1.125 2.702 331 HZ2 TRP 41 HZ2 TRP 41 0.879 -1.231 3.417 332 HZ3 TRP 41 HZ3 TRP 41 -1.845 0.815 0.862 333 HH2 TRP 41 HH2 TRP 41 0.272 -0.344 1.207 334 H GLY 42 H GLY 42 -5.550 -1.994 3.520 335 HA2 GLY 42 HA2 GLY 42 -5.711 -4.301 4.177 336 HA3 GLY 42 HA3 GLY 42 -6.376 -3.802 5.729 337 HA PRO 43 HA PRO 43 -9.776 -4.780 2.478 338 HB2 PRO 43 HB2 PRO 43 -10.625 -7.240 3.317 339 HB3 PRO 43 HB3 PRO 43 -9.246 -7.054 2.222 340 HG2 PRO 43 HG2 PRO 43 -9.255 -7.482 5.213 341 HG3 PRO 43 HG3 PRO 43 -8.256 -8.278 3.977 342 HD2 PRO 43 HD2 PRO 43 -7.337 -6.187 5.499 343 HD3 PRO 43 HD3 PRO 43 -6.763 -6.485 3.845 344 HA PRO 44 HA PRO 44 -13.099 -3.417 5.288 345 HB2 PRO 44 HB2 PRO 44 -15.089 -4.852 3.559 346 HB3 PRO 44 HB3 PRO 44 -14.956 -3.127 3.923 347 HG2 PRO 44 HG2 PRO 44 -14.288 -4.063 1.500 348 HG3 PRO 44 HG3 PRO 44 -13.348 -2.761 2.261 349 HD2 PRO 44 HD2 PRO 44 -12.699 -5.716 2.112 350 HD3 PRO 44 HD3 PRO 44 -11.646 -4.315 1.799 351 H THR 45 H THR 45 -12.094 -5.070 6.763 352 HA THR 45 HA THR 45 -13.808 -6.732 8.229 353 HB THR 45 HB THR 45 -12.348 -8.952 7.773 354 HG1 THR 45 HG1 THR 45 -12.310 -7.745 5.189 355 HG21 THR 45 HG21 THR 45 -14.611 -8.247 5.868 356 HG22 THR 45 HG22 THR 45 -14.807 -8.910 7.491 357 HG23 THR 45 HG23 THR 45 -14.022 -9.871 6.235 358 H TRP 46 H TRP 46 -10.490 -6.282 7.052 359 HA TRP 46 HA TRP 46 -9.406 -6.200 9.818 360 HB2 TRP 46 HB2 TRP 46 -8.079 -7.119 7.225 361 HB3 TRP 46 HB3 TRP 46 -7.203 -6.875 8.730 362 HD1 TRP 46 HD1 TRP 46 -10.108 -9.129 7.390 363 HE1 TRP 46 HE1 TRP 46 -10.002 -11.361 8.658 364 HE3 TRP 46 HE3 TRP 46 -6.233 -8.104 10.561 365 HZ2 TRP 46 HZ2 TRP 46 -8.485 -12.552 10.690 366 HZ3 TRP 46 HZ3 TRP 46 -5.505 -9.854 12.132 367 HH2 TRP 46 HH2 TRP 46 -6.606 -12.035 12.195 368 HA PRO 47 HA PRO 47 -8.388 -1.964 8.111 369 HB2 PRO 47 HB2 PRO 47 -9.426 -0.440 10.088 370 HB3 PRO 47 HB3 PRO 47 -10.453 -1.102 8.808 371 HG2 PRO 47 HG2 PRO 47 -10.045 -2.114 11.623 372 HG3 PRO 47 HG3 PRO 47 -11.559 -1.954 10.708 373 HD2 PRO 47 HD2 PRO 47 -10.156 -4.334 10.969 374 HD3 PRO 47 HD3 PRO 47 -11.255 -3.980 9.620 375 H ALA 48 H ALA 48 -6.497 -0.896 8.645 376 HA ALA 48 HA ALA 48 -4.750 -2.062 10.598 377 HB1 ALA 48 HB1 ALA 48 -3.932 -1.237 8.430 378 HB2 ALA 48 HB2 ALA 48 -3.079 -0.475 9.777 379 HB3 ALA 48 HB3 ALA 48 -4.331 0.415 8.903 380 H THR 49 H THR 49 -3.635 -0.951 12.278 381 HA THR 49 HA THR 49 -4.982 1.381 13.521 382 HB THR 49 HB THR 49 -3.960 -1.013 15.129 383 HG1 THR 49 HG1 THR 49 -5.688 -1.868 14.121 384 HG21 THR 49 HG21 THR 49 -4.119 1.125 16.384 385 HG22 THR 49 HG22 THR 49 -5.306 -0.046 16.962 386 HG23 THR 49 HG23 THR 49 -5.814 1.277 15.909 387 H PHE 50 H PHE 50 -3.352 2.845 13.054 388 HA PHE 50 HA PHE 50 -0.547 2.079 13.146 389 HB2 PHE 50 HB2 PHE 50 -2.006 4.578 12.236 390 HB3 PHE 50 HB3 PHE 50 -0.263 4.614 12.483 391 HD1 PHE 50 HD1 PHE 50 -2.957 2.849 10.578 392 HD2 PHE 50 HD2 PHE 50 1.221 3.745 10.822 393 HE1 PHE 50 HE1 PHE 50 -2.604 1.825 8.371 394 HE2 PHE 50 HE2 PHE 50 1.562 2.715 8.616 395 HZ PHE 50 HZ PHE 50 -0.347 1.752 7.391 396 H GLU 51 H GLU 51 0.376 1.912 15.046 397 HA GLU 51 HA GLU 51 -0.179 3.524 17.358 398 HB2 GLU 51 HB2 GLU 51 2.256 1.761 16.837 399 HB3 GLU 51 HB3 GLU 51 1.643 2.287 18.404 400 HG2 GLU 51 HG2 GLU 51 0.331 0.334 16.488 401 HG3 GLU 51 HG3 GLU 51 1.088 -0.046 18.031 402 H THR 52 H THR 52 2.328 3.477 14.838 403 HA THR 52 HA THR 52 2.779 6.338 15.261 404 HB THR 52 HB THR 52 4.642 5.273 16.523 405 HG1 THR 52 HG1 THR 52 6.276 6.522 15.516 406 HG21 THR 52 HG21 THR 52 6.469 4.122 15.345 407 HG22 THR 52 HG22 THR 52 5.534 4.154 13.848 408 HG23 THR 52 HG23 THR 52 4.964 3.210 15.225 409 H HIS 53 H HIS 53 3.536 7.434 13.400 410 HA HIS 53 HA HIS 53 4.046 6.008 10.913 411 HB2 HIS 53 HB2 HIS 53 1.563 6.166 10.967 412 HB3 HIS 53 HB3 HIS 53 1.663 7.905 11.196 413 HD2 HIS 53 HD2 HIS 53 1.829 5.266 8.337 414 HE1 HIS 53 HE1 HIS 53 2.140 9.135 6.659 415 HE2 HIS 53 HE2 HIS 53 1.614 6.711 6.202 416 H GLU 54 H GLU 54 6.108 6.951 11.221 417 HA GLU 54 HA GLU 54 6.514 9.830 11.187 418 HB2 GLU 54 HB2 GLU 54 8.555 7.606 10.678 419 HB3 GLU 54 HB3 GLU 54 8.920 9.298 11.014 420 HG2 GLU 54 HG2 GLU 54 7.619 7.352 12.920 421 HG3 GLU 54 HG3 GLU 54 9.317 7.811 12.940 422 H PHE 55 H PHE 55 5.354 10.429 9.233 423 HA PHE 55 HA PHE 55 6.121 9.406 6.664 424 HB2 PHE 55 HB2 PHE 55 3.854 10.464 7.329 425 HB3 PHE 55 HB3 PHE 55 4.650 12.027 7.167 426 HD1 PHE 55 HD1 PHE 55 3.973 8.862 5.311 427 HD2 PHE 55 HD2 PHE 55 4.729 13.052 5.000 428 HE1 PHE 55 HE1 PHE 55 3.515 8.759 2.895 429 HE2 PHE 55 HE2 PHE 55 4.259 12.948 2.583 430 HZ PHE 55 HZ PHE 55 3.650 10.802 1.536 431 H THR 56 H THR 56 8.443 9.715 7.280 432 HA THR 56 HA THR 56 9.540 12.109 5.983 433 HB THR 56 HB THR 56 9.770 12.789 8.275 434 HG1 THR 56 HG1 THR 56 12.248 12.229 8.521 435 HG21 THR 56 HG21 THR 56 9.344 10.642 9.409 436 HG22 THR 56 HG22 THR 56 10.810 11.399 10.040 437 HG23 THR 56 HG23 THR 56 10.932 10.053 8.906 438 H VAL 57 H VAL 57 11.768 11.779 5.244 439 HA VAL 57 HA VAL 57 12.109 9.218 3.996 440 HB VAL 57 HB VAL 57 13.993 11.619 4.090 441 HG11 VAL 57 HG11 VAL 57 15.028 10.641 2.046 442 HG12 VAL 57 HG12 VAL 57 13.999 9.218 2.221 443 HG13 VAL 57 HG13 VAL 57 15.212 9.583 3.449 444 HG21 VAL 57 HG21 VAL 57 11.803 12.203 3.112 445 HG22 VAL 57 HG22 VAL 57 11.917 10.840 1.996 446 HG23 VAL 57 HG23 VAL 57 13.049 12.189 1.861 447 H GLY 58 H GLY 58 13.117 7.468 4.824 448 HA2 GLY 58 HA2 GLY 58 14.590 6.143 6.048 449 HA3 GLY 58 HA3 GLY 58 15.303 7.571 6.766 450 H GLY 59 H GLY 59 12.013 7.893 7.102 451 HA2 GLY 59 HA2 GLY 59 11.978 7.054 9.908 452 HA3 GLY 59 HA3 GLY 59 10.736 7.969 9.066 453 H LYS 60 H LYS 60 9.923 5.939 10.721 454 HA LYS 60 HA LYS 60 9.039 3.794 8.861 455 HB2 LYS 60 HB2 LYS 60 10.001 3.393 11.732 456 HB3 LYS 60 HB3 LYS 60 9.249 2.146 10.733 457 HG2 LYS 60 HG2 LYS 60 11.144 2.412 9.097 458 HG3 LYS 60 HG3 LYS 60 11.917 3.510 10.247 459 HD2 LYS 60 HD2 LYS 60 12.055 1.706 11.912 460 HD3 LYS 60 HD3 LYS 60 11.182 0.613 10.835 461 HE2 LYS 60 HE2 LYS 60 13.054 0.782 9.198 462 HE3 LYS 60 HE3 LYS 60 13.934 1.802 10.340 463 HZ1 LYS 60 HZ1 LYS 60 14.692 -0.438 10.499 464 HZ2 LYS 60 HZ2 LYS 60 13.126 -1.025 10.733 465 HZ3 LYS 60 HZ3 LYS 60 13.855 -0.065 11.920 466 H ALA 61 H ALA 61 7.234 2.460 9.843 467 HA ALA 61 HA ALA 61 5.352 4.002 11.526 468 HB1 ALA 61 HB1 ALA 61 4.734 4.508 9.183 469 HB2 ALA 61 HB2 ALA 61 3.481 3.553 9.975 470 HB3 ALA 61 HB3 ALA 61 4.588 2.784 8.833 471 H ALA 62 H ALA 62 4.254 2.727 12.958 472 HA ALA 62 HA ALA 62 4.514 -0.236 12.754 473 HB1 ALA 62 HB1 ALA 62 4.304 1.460 15.272 474 HB2 ALA 62 HB2 ALA 62 5.744 0.614 14.701 475 HB3 ALA 62 HB3 ALA 62 4.331 -0.309 15.227 476 H TYR 63 H TYR 63 2.647 -1.365 12.710 477 HA TYR 63 HA TYR 63 0.158 -0.318 13.759 478 HB2 TYR 63 HB2 TYR 63 -1.086 -0.376 11.633 479 HB3 TYR 63 HB3 TYR 63 0.221 0.794 11.554 480 HD1 TYR 63 HD1 TYR 63 2.312 0.231 10.212 481 HD2 TYR 63 HD2 TYR 63 -1.186 -2.225 10.072 482 HE1 TYR 63 HE1 TYR 63 3.103 -0.777 8.120 483 HE2 TYR 63 HE2 TYR 63 -0.389 -3.238 7.984 484 HH TYR 63 HH TYR 63 2.789 -2.776 6.779 485 H TYR 64 H TYR 64 -1.673 -1.825 13.283 486 HA TYR 64 HA TYR 64 -1.061 -4.495 12.349 487 HB2 TYR 64 HB2 TYR 64 -2.151 -5.545 14.442 488 HB3 TYR 64 HB3 TYR 64 -0.504 -4.960 14.609 489 HD1 TYR 64 HD1 TYR 64 -4.062 -4.138 15.424 490 HD2 TYR 64 HD2 TYR 64 0.051 -3.278 16.245 491 HE1 TYR 64 HE1 TYR 64 -4.727 -2.841 17.397 492 HE2 TYR 64 HE2 TYR 64 -0.622 -1.986 18.218 493 HH TYR 64 HH TYR 64 -2.660 -0.731 18.994 494 H MET 65 H MET 65 -2.823 -5.436 11.379 495 HA MET 65 HA MET 65 -5.265 -3.881 11.137 496 HB2 MET 65 HB2 MET 65 -4.367 -6.500 9.872 497 HB3 MET 65 HB3 MET 65 -5.983 -5.841 9.633 498 HG2 MET 65 HG2 MET 65 -4.654 -5.234 7.740 499 HG3 MET 65 HG3 MET 65 -4.939 -3.772 8.680 500 HE1 MET 65 HE1 MET 65 -2.370 -6.323 7.313 501 HE2 MET 65 HE2 MET 65 -2.265 -6.762 9.022 502 HE3 MET 65 HE3 MET 65 -0.904 -5.966 8.229 503 H THR 66 H THR 66 -6.570 -3.929 12.825 504 HA THR 66 HA THR 66 -6.921 -6.206 14.572 505 HB THR 66 HB THR 66 -8.494 -3.584 14.486 506 HG1 THR 66 HG1 THR 66 -6.965 -2.766 15.766 507 HG21 THR 66 HG21 THR 66 -9.087 -4.111 16.837 508 HG22 THR 66 HG22 THR 66 -8.258 -5.663 16.700 509 HG23 THR 66 HG23 THR 66 -9.704 -5.348 15.737 510 H GLY 67 H GLY 67 -7.975 -7.896 13.754 511 HA2 GLY 67 HA2 GLY 67 -9.785 -7.766 11.527 512 HA3 GLY 67 HA3 GLY 67 -9.299 -9.202 12.405 513 HA PRO 68 HA PRO 68 -13.843 -8.207 13.324 514 HB2 PRO 68 HB2 PRO 68 -14.965 -10.500 12.351 515 HB3 PRO 68 HB3 PRO 68 -14.608 -9.109 11.318 516 HG2 PRO 68 HG2 PRO 68 -12.994 -11.632 11.718 517 HG3 PRO 68 HG3 PRO 68 -13.407 -10.807 10.201 518 HD2 PRO 68 HD2 PRO 68 -10.980 -10.510 11.419 519 HD3 PRO 68 HD3 PRO 68 -11.725 -9.209 10.466 520 H ASP 69 H ASP 69 -11.641 -10.761 14.015 521 HA ASP 69 HA ASP 69 -13.123 -11.819 16.327 522 HB2 ASP 69 HB2 ASP 69 -10.348 -12.633 15.360 523 HB3 ASP 69 HB3 ASP 69 -11.472 -13.568 16.346 524 H GLY 70 H GLY 70 -11.399 -9.115 15.847 525 HA2 GLY 70 HA2 GLY 70 -10.182 -7.669 17.155 526 HA3 GLY 70 HA3 GLY 70 -10.399 -8.760 18.514 527 H THR 71 H THR 71 -9.054 -10.201 15.709 528 HA THR 71 HA THR 71 -6.588 -10.844 17.055 529 HB THR 71 HB THR 71 -7.485 -11.503 14.202 530 HG1 THR 71 HG1 THR 71 -7.720 -13.656 15.494 531 HG21 THR 71 HG21 THR 71 -5.279 -12.762 15.898 532 HG22 THR 71 HG22 THR 71 -5.038 -11.772 14.456 533 HG23 THR 71 HG23 THR 71 -5.823 -13.345 14.324 534 H LYS 72 H LYS 72 -4.665 -9.841 16.852 535 HA LYS 72 HA LYS 72 -4.355 -7.525 15.097 536 HB2 LYS 72 HB2 LYS 72 -2.741 -8.625 17.428 537 HB3 LYS 72 HB3 LYS 72 -2.070 -7.386 16.379 538 HG2 LYS 72 HG2 LYS 72 -2.967 -6.326 18.339 539 HG3 LYS 72 HG3 LYS 72 -3.966 -5.895 16.951 540 HD2 LYS 72 HD2 LYS 72 -5.646 -7.588 17.666 541 HD3 LYS 72 HD3 LYS 72 -4.653 -7.953 19.082 542 HE2 LYS 72 HE2 LYS 72 -4.922 -5.609 19.852 543 HE3 LYS 72 HE3 LYS 72 -5.938 -5.270 18.446 544 HZ1 LYS 72 HZ1 LYS 72 -6.516 -7.171 20.647 545 HZ2 LYS 72 HZ2 LYS 72 -7.451 -7.024 19.249 546 HZ3 LYS 72 HZ3 LYS 72 -7.316 -5.718 20.316 547 H ALA 73 H ALA 73 -3.901 -8.146 13.005 548 HA ALA 73 HA ALA 73 -1.612 -9.912 12.431 549 HB1 ALA 73 HB1 ALA 73 -3.358 -8.271 10.549 550 HB2 ALA 73 HB2 ALA 73 -3.548 -9.990 10.905 551 HB3 ALA 73 HB3 ALA 73 -2.109 -9.420 10.057 552 H ARG 74 H ARG 74 0.292 -8.952 13.032 553 HA ARG 74 HA ARG 74 0.518 -6.070 13.198 554 HB2 ARG 74 HB2 ARG 74 1.407 -7.972 14.845 555 HB3 ARG 74 HB3 ARG 74 2.831 -7.932 13.820 556 HG2 ARG 74 HG2 ARG 74 1.730 -5.431 15.158 557 HG3 ARG 74 HG3 ARG 74 2.847 -6.519 15.982 558 HD2 ARG 74 HD2 ARG 74 4.554 -6.106 14.294 559 HD3 ARG 74 HD3 ARG 74 3.438 -5.092 13.364 560 HE ARG 74 HE ARG 74 3.683 -4.063 15.980 561 HH11 ARG 74 HH11 ARG 74 5.484 -4.213 13.018 562 HH12 ARG 74 HH12 ARG 74 6.528 -2.918 13.473 563 HH21 ARG 74 HH21 ARG 74 5.009 -2.412 16.511 564 HH22 ARG 74 HH22 ARG 74 6.255 -1.899 15.430 565 H GLY 75 H GLY 75 1.613 -4.717 11.854 566 HA2 GLY 75 HA2 GLY 75 3.485 -5.812 9.828 567 HA3 GLY 75 HA3 GLY 75 2.211 -4.686 9.371 568 H TRP 76 H TRP 76 5.005 -4.296 8.989 569 HA TRP 76 HA TRP 76 5.398 -1.780 10.488 570 HB2 TRP 76 HB2 TRP 76 7.816 -2.259 10.681 571 HB3 TRP 76 HB3 TRP 76 6.877 -3.515 11.477 572 HD1 TRP 76 HD1 TRP 76 7.034 -6.041 10.417 573 HE1 TRP 76 HE1 TRP 76 8.655 -7.084 8.743 574 HE3 TRP 76 HE3 TRP 76 9.223 -1.776 8.576 575 HZ2 TRP 76 HZ2 TRP 76 10.587 -6.259 6.901 576 HZ3 TRP 76 HZ3 TRP 76 10.957 -2.004 6.847 577 HH2 TRP 76 HH2 TRP 76 11.629 -4.206 6.027 578 H TRP 77 H TRP 77 6.470 -0.128 9.312 579 HA TRP 77 HA TRP 77 7.018 -0.569 6.423 580 HB2 TRP 77 HB2 TRP 77 5.739 1.772 7.857 581 HB3 TRP 77 HB3 TRP 77 6.579 2.035 6.338 582 HD1 TRP 77 HD1 TRP 77 4.716 -1.209 6.144 583 HE1 TRP 77 HE1 TRP 77 2.541 -0.869 4.813 584 HE3 TRP 77 HE3 TRP 77 4.632 3.879 6.047 585 HZ2 TRP 77 HZ2 TRP 77 1.008 1.312 3.832 586 HZ3 TRP 77 HZ3 TRP 77 2.798 5.024 4.876 587 HH2 TRP 77 HH2 TRP 77 1.022 3.758 3.792 588 H GLN 78 H GLN 78 8.725 0.748 5.487 589 HA GLN 78 HA GLN 78 10.145 2.636 7.217 590 HB2 GLN 78 HB2 GLN 78 11.568 0.610 7.346 591 HB3 GLN 78 HB3 GLN 78 11.652 0.536 5.586 592 HG2 GLN 78 HG2 GLN 78 12.844 2.685 5.522 593 HG3 GLN 78 HG3 GLN 78 12.705 2.840 7.273 594 HE21 GLN 78 HE21 GLN 78 14.927 2.982 7.528 595 HE22 GLN 78 HE22 GLN 78 15.985 1.643 7.309 596 H PHE 79 H PHE 79 9.613 4.450 6.153 597 HA PHE 79 HA PHE 79 9.335 4.789 3.344 598 HB2 PHE 79 HB2 PHE 79 9.888 6.876 5.496 599 HB3 PHE 79 HB3 PHE 79 9.401 7.238 3.845 600 HD1 PHE 79 HD2 PHE 79 7.096 6.810 3.086 601 HD2 PHE 79 HD1 PHE 79 8.265 6.043 7.129 602 HE1 PHE 79 HE2 PHE 79 4.738 6.754 3.763 603 HE2 PHE 79 HE1 PHE 79 5.902 5.983 7.796 604 HZ PHE 79 HZ PHE 79 4.140 6.347 6.118 605 H THR 80 H THR 80 10.849 5.112 1.788 606 HA THR 80 HA THR 80 13.686 5.590 2.547 607 HB THR 80 HB THR 80 14.301 4.461 0.463 608 HG1 THR 80 HG1 THR 80 12.823 4.721 -1.054 609 HG21 THR 80 HG21 THR 80 12.205 2.873 1.996 610 HG22 THR 80 HG22 THR 80 13.932 2.952 2.365 611 HG23 THR 80 HG23 THR 80 13.378 2.180 0.872 612 H THR 81 H THR 81 11.064 6.690 0.460 613 HA THR 81 HA THR 81 12.564 9.077 -0.368 614 HB THR 81 HB THR 81 11.375 7.125 -2.400 615 HG1 THR 81 HG1 THR 81 13.398 6.610 -2.876 616 HG21 THR 81 HG21 THR 81 10.921 9.424 -3.144 617 HG22 THR 81 HG22 THR 81 12.180 8.697 -4.144 618 HG23 THR 81 HG23 THR 81 12.615 9.860 -2.888 619 H ILE 82 H ILE 82 11.209 10.691 0.191 620 HA ILE 82 HA ILE 82 8.335 10.518 -0.560 621 HB ILE 82 HB ILE 82 9.423 11.922 1.928 622 HG12 ILE 82 HG12 ILE 82 7.834 9.331 1.645 623 HG13 ILE 82 HG13 ILE 82 9.465 9.498 2.277 624 HG21 ILE 82 HG21 ILE 82 7.049 12.343 2.493 625 HG22 ILE 82 HG22 ILE 82 6.545 11.599 0.975 626 HG23 ILE 82 HG23 ILE 82 7.477 13.097 0.954 627 HD11 ILE 82 HD11 ILE 82 8.527 10.774 4.188 628 HD12 ILE 82 HD12 ILE 82 7.946 9.116 4.069 629 HD13 ILE 82 HD13 ILE 82 6.909 10.445 3.559 630 H GLU 83 H GLU 83 8.449 11.669 -2.423 631 HA GLU 83 HA GLU 83 9.986 14.153 -2.622 632 HB2 GLU 83 HB2 GLU 83 8.356 12.678 -4.738 633 HB3 GLU 83 HB3 GLU 83 9.431 14.046 -5.025 634 HG2 GLU 83 HG2 GLU 83 10.273 11.310 -4.017 635 HG3 GLU 83 HG3 GLU 83 10.465 11.901 -5.664 636 H ALA 84 H ALA 84 6.620 13.072 -3.102 637 HA ALA 84 HA ALA 84 4.596 14.029 -2.923 638 HB1 ALA 84 HB1 ALA 84 4.232 15.972 -1.471 639 HB2 ALA 84 HB2 ALA 84 5.965 16.321 -1.473 640 HB3 ALA 84 HB3 ALA 84 5.364 14.842 -0.720 641 HA PRO 85 HA PRO 85 2.696 15.133 -2.994 642 HB2 PRO 85 HB2 PRO 85 0.600 15.895 -4.448 643 HB3 PRO 85 HB3 PRO 85 1.579 17.115 -3.615 644 HG2 PRO 85 HG2 PRO 85 1.666 16.287 -6.522 645 HG3 PRO 85 HG3 PRO 85 1.650 17.925 -5.836 646 HD2 PRO 85 HD2 PRO 85 3.958 16.574 -6.623 647 HD3 PRO 85 HD3 PRO 85 3.932 17.905 -5.444 648 H ASP 86 H ASP 86 4.201 13.736 -5.417 649 HA ASP 86 HA ASP 86 2.020 11.929 -6.289 650 HB2 ASP 86 HB2 ASP 86 3.038 11.877 -8.516 651 HB3 ASP 86 HB3 ASP 86 2.634 13.523 -8.055 652 H HIS 87 H HIS 87 5.593 12.094 -5.871 653 HA HIS 87 HA HIS 87 5.809 9.189 -6.214 654 HB2 HIS 87 HB2 HIS 87 7.351 10.763 -7.421 655 HB3 HIS 87 HB3 HIS 87 8.021 11.257 -5.880 656 HD1 HIS 87 HD1 HIS 87 10.096 10.321 -7.613 657 HD2 HIS 87 HD2 HIS 87 7.838 7.539 -5.515 658 HE1 HIS 87 HE1 HIS 87 11.473 8.227 -7.592 659 HE2 HIS 87 HE2 HIS 87 10.184 6.655 -6.132 660 H LEU 88 H LEU 88 5.676 7.906 -4.548 661 HA LEU 88 HA LEU 88 6.968 8.520 -1.955 662 HB2 LEU 88 HB2 LEU 88 4.514 8.681 -1.706 663 HB3 LEU 88 HB3 LEU 88 4.310 7.095 -2.413 664 HG LEU 88 HG LEU 88 5.468 6.084 -0.440 665 HD11 LEU 88 HD11 LEU 88 6.889 7.970 0.212 666 HD12 LEU 88 HD12 LEU 88 5.909 7.421 1.568 667 HD13 LEU 88 HD13 LEU 88 5.465 8.895 0.704 668 HD21 LEU 88 HD21 LEU 88 3.028 6.214 -0.461 669 HD22 LEU 88 HD22 LEU 88 3.087 7.814 0.285 670 HD23 LEU 88 HD23 LEU 88 3.657 6.398 1.175 671 H GLU 89 H GLU 89 8.227 6.851 -1.166 672 HA GLU 89 HA GLU 89 7.926 4.114 -2.190 673 HB2 GLU 89 HB2 GLU 89 10.589 5.598 -2.003 674 HB3 GLU 89 HB3 GLU 89 10.442 3.853 -2.200 675 HG2 GLU 89 HG2 GLU 89 9.261 4.238 -4.359 676 HG3 GLU 89 HG3 GLU 89 9.537 5.971 -4.167 677 H PHE 90 H PHE 90 8.145 2.600 -0.669 678 HA PHE 90 HA PHE 90 9.580 2.969 1.802 679 HB2 PHE 90 HB2 PHE 90 7.632 2.530 3.304 680 HB3 PHE 90 HB3 PHE 90 7.473 4.059 2.456 681 HD1 PHE 90 HD2 PHE 90 6.107 0.640 2.809 682 HD2 PHE 90 HD1 PHE 90 5.715 4.385 0.773 683 HE1 PHE 90 HE2 PHE 90 3.864 -0.004 2.038 684 HE2 PHE 90 HE1 PHE 90 3.474 3.730 0.008 685 HZ PHE 90 HZ PHE 90 2.547 1.537 0.637 686 H ASP 91 H ASP 91 9.222 0.915 3.210 687 HA ASP 91 HA ASP 91 9.025 -1.480 1.480 688 HB2 ASP 91 HB2 ASP 91 10.608 -1.025 4.045 689 HB3 ASP 91 HB3 ASP 91 10.424 -2.598 3.264 690 H ASP 92 H ASP 92 6.921 -2.047 1.672 691 HA ASP 92 HA ASP 92 5.486 -2.163 4.165 692 HB2 ASP 92 HB2 ASP 92 4.329 -1.851 1.958 693 HB3 ASP 92 HB3 ASP 92 4.841 -3.469 1.480 694 H GLY 93 H GLY 93 6.297 -3.534 5.646 695 HA2 GLY 93 HA2 GLY 93 7.046 -6.307 4.879 696 HA3 GLY 93 HA3 GLY 93 7.745 -5.410 6.218 697 H PHE 94 H PHE 94 6.223 -7.985 6.036 698 HA PHE 94 HA PHE 94 3.984 -7.500 7.880 699 HB2 PHE 94 HB2 PHE 94 5.007 -10.048 6.529 700 HB3 PHE 94 HB3 PHE 94 3.667 -10.019 7.674 701 HD1 PHE 94 HD2 PHE 94 1.550 -8.795 7.095 702 HD2 PHE 94 HD1 PHE 94 4.666 -9.359 4.215 703 HE1 PHE 94 HE2 PHE 94 -0.016 -8.240 5.285 704 HE2 PHE 94 HE1 PHE 94 3.090 -8.792 2.411 705 HZ PHE 94 HZ PHE 94 0.749 -8.236 2.943 706 H ALA 95 H ALA 95 3.985 -8.284 9.989 707 HA ALA 95 HA ALA 95 6.581 -9.152 11.131 708 HB1 ALA 95 HB1 ALA 95 4.715 -7.063 12.312 709 HB2 ALA 95 HB2 ALA 95 6.275 -6.748 11.553 710 HB3 ALA 95 HB3 ALA 95 6.199 -7.669 13.053 711 H ASP 96 H ASP 96 6.479 -10.615 12.760 712 HA ASP 96 HA ASP 96 4.262 -12.367 12.938 713 HB2 ASP 96 HB2 ASP 96 6.642 -12.125 14.840 714 HB3 ASP 96 HB3 ASP 96 5.562 -13.515 14.711 715 H GLU 97 H GLU 97 5.657 -10.729 15.769 716 HA GLU 97 HA GLU 97 3.137 -9.427 16.489 717 HB2 GLU 97 HB2 GLU 97 3.120 -10.420 18.784 718 HB3 GLU 97 HB3 GLU 97 2.874 -11.631 17.532 719 HG2 GLU 97 HG2 GLU 97 5.250 -12.312 17.727 720 HG3 GLU 97 HG3 GLU 97 5.485 -11.116 18.995 721 H HIS 98 H HIS 98 6.586 -9.944 17.098 722 HA HIS 98 HA HIS 98 6.802 -7.768 19.029 723 HB2 HIS 98 HB2 HIS 98 8.980 -9.548 17.850 724 HB3 HIS 98 HB3 HIS 98 9.173 -8.469 19.229 725 HD1 HIS 98 HD1 HIS 98 7.221 -9.149 21.222 726 HD2 HIS 98 HD2 HIS 98 8.679 -12.103 18.687 727 HE1 HIS 98 HE1 HIS 98 6.759 -11.323 22.389 728 HE2 HIS 98 HE2 HIS 98 7.787 -13.081 20.915 729 H GLY 99 H GLY 99 6.366 -7.476 15.883 730 HA2 GLY 99 HA2 GLY 99 6.869 -5.768 14.387 731 HA3 GLY 99 HA3 GLY 99 8.075 -5.153 15.499 732 H ALA 100 H ALA 100 8.733 -8.361 15.198 733 HA ALA 100 HA ALA 100 11.026 -7.992 13.490 734 HB1 ALA 100 HB1 ALA 100 11.156 -9.433 15.480 735 HB2 ALA 100 HB2 ALA 100 11.499 -10.361 14.020 736 HB3 ALA 100 HB3 ALA 100 9.923 -10.506 14.807 737 HA PRO 101 HA PRO 101 8.824 -8.882 9.672 738 HB2 PRO 101 HB2 PRO 101 11.469 -9.846 8.600 739 HB3 PRO 101 HB3 PRO 101 10.394 -8.578 7.987 740 HG2 PRO 101 HG2 PRO 101 12.667 -7.928 9.237 741 HG3 PRO 101 HG3 PRO 101 11.188 -6.979 9.506 742 HD2 PRO 101 HD2 PRO 101 12.415 -9.115 11.266 743 HD3 PRO 101 HD3 PRO 101 11.744 -7.530 11.722 744 H VAL 102 H VAL 102 7.603 -10.599 9.147 745 HA VAL 102 HA VAL 102 7.954 -13.267 9.961 746 HB VAL 102 HB VAL 102 6.295 -12.143 7.654 747 HG11 VAL 102 HG11 VAL 102 4.945 -14.232 7.774 748 HG12 VAL 102 HG12 VAL 102 6.085 -14.903 8.946 749 HG13 VAL 102 HG13 VAL 102 6.611 -14.565 7.294 750 HG21 VAL 102 HG21 VAL 102 4.400 -12.268 9.231 751 HG22 VAL 102 HG22 VAL 102 5.680 -11.227 9.855 752 HG23 VAL 102 HG23 VAL 102 5.485 -12.860 10.497 753 H ASP 103 H ASP 103 9.058 -14.959 9.113 754 HA ASP 103 HA ASP 103 11.194 -14.475 7.280 755 HB2 ASP 103 HB2 ASP 103 11.367 -15.962 9.269 756 HB3 ASP 103 HB3 ASP 103 10.199 -17.066 8.550 757 H GLU 104 H GLU 104 8.130 -16.167 7.102 758 HA GLU 104 HA GLU 104 8.407 -17.375 4.548 759 HB2 GLU 104 HB2 GLU 104 6.823 -18.194 6.223 760 HB3 GLU 104 HB3 GLU 104 5.969 -16.654 6.222 761 HG2 GLU 104 HG2 GLU 104 5.256 -17.058 3.889 762 HG3 GLU 104 HG3 GLU 104 6.096 -18.612 3.909 763 H LEU 105 H LEU 105 6.624 -14.415 5.566 764 HA LEU 105 HA LEU 105 5.776 -13.831 2.846 765 HB2 LEU 105 HB2 LEU 105 5.306 -12.262 5.409 766 HB3 LEU 105 HB3 LEU 105 4.495 -11.983 3.871 767 HG LEU 105 HG LEU 105 4.206 -14.443 5.648 768 HD11 LEU 105 HD11 LEU 105 1.885 -13.723 5.938 769 HD12 LEU 105 HD12 LEU 105 2.192 -12.282 4.964 770 HD13 LEU 105 HD13 LEU 105 3.015 -12.497 6.513 771 HD21 LEU 105 HD21 LEU 105 2.521 -15.251 4.039 772 HD22 LEU 105 HD22 LEU 105 4.117 -15.131 3.302 773 HD23 LEU 105 HD23 LEU 105 2.896 -13.901 2.962 774 H GLY 106 H GLY 106 8.275 -12.716 5.019 775 HA2 GLY 106 HA2 GLY 106 10.202 -11.564 4.582 776 HA3 GLY 106 HA3 GLY 106 9.791 -11.636 2.881 777 H VAL 107 H VAL 107 10.780 -9.569 2.713 778 HA VAL 107 HA VAL 107 9.198 -7.220 3.628 779 HB VAL 107 HB VAL 107 12.130 -7.276 2.730 780 HG11 VAL 107 HG11 VAL 107 12.240 -4.972 3.667 781 HG12 VAL 107 HG12 VAL 107 10.519 -5.047 4.045 782 HG13 VAL 107 HG13 VAL 107 11.052 -5.084 2.364 783 HG21 VAL 107 HG21 VAL 107 12.740 -6.975 5.122 784 HG22 VAL 107 HG22 VAL 107 11.924 -8.515 4.839 785 HG23 VAL 107 HG23 VAL 107 11.043 -7.173 5.570 786 H THR 108 H THR 108 8.332 -5.896 1.980 787 HA THR 108 HA THR 108 9.467 -6.147 -0.741 788 HB THR 108 HB THR 108 7.493 -7.501 -0.872 789 HG1 THR 108 HG1 THR 108 6.418 -6.342 -2.530 790 HG21 THR 108 HG21 THR 108 5.863 -5.148 0.171 791 HG22 THR 108 HG22 THR 108 6.184 -6.650 1.042 792 HG23 THR 108 HG23 THR 108 5.209 -6.678 -0.427 793 H HIS 109 H HIS 109 9.689 -4.304 -1.854 794 HA HIS 109 HA HIS 109 9.293 -1.796 -0.399 795 HB2 HIS 109 HB2 HIS 109 11.534 -2.422 -1.347 796 HB3 HIS 109 HB3 HIS 109 10.853 -2.321 -2.965 797 HD1 HIS 109 HD1 HIS 109 12.031 -0.232 -0.122 798 HD2 HIS 109 HD2 HIS 109 10.390 0.348 -3.871 799 HE1 HIS 109 HE1 HIS 109 12.355 2.186 -0.648 800 HE2 HIS 109 HE2 HIS 109 11.550 2.460 -2.989 801 H ALA 110 H ALA 110 7.316 -0.937 -0.715 802 HA ALA 110 HA ALA 110 5.898 -1.146 -3.281 803 HB1 ALA 110 HB1 ALA 110 4.968 -0.008 -0.623 804 HB2 ALA 110 HB2 ALA 110 4.664 -1.643 -1.212 805 HB3 ALA 110 HB3 ALA 110 3.961 -0.261 -2.054 806 H THR 111 H THR 111 5.951 0.441 -4.741 807 HA THR 111 HA THR 111 6.900 3.164 -4.033 808 HB THR 111 HB THR 111 7.081 1.720 -6.736 809 HG1 THR 111 HG1 THR 111 9.469 2.205 -6.050 810 HG21 THR 111 HG21 THR 111 8.160 4.445 -5.917 811 HG22 THR 111 HG22 THR 111 6.835 4.155 -7.044 812 HG23 THR 111 HG23 THR 111 8.469 3.638 -7.455 813 H VAL 112 H VAL 112 5.142 4.453 -3.855 814 HA VAL 112 HA VAL 112 2.721 4.026 -5.488 815 HB VAL 112 HB VAL 112 3.153 5.914 -3.122 816 HG11 VAL 112 HG11 VAL 112 1.304 6.635 -4.600 817 HG12 VAL 112 HG12 VAL 112 0.675 6.056 -3.057 818 HG13 VAL 112 HG13 VAL 112 0.574 5.029 -4.489 819 HG21 VAL 112 HG21 VAL 112 3.426 3.559 -2.419 820 HG22 VAL 112 HG22 VAL 112 1.868 3.151 -3.143 821 HG23 VAL 112 HG23 VAL 112 1.933 4.243 -1.757 822 H LYS 113 H LYS 113 2.684 5.133 -7.389 823 HA LYS 113 HA LYS 113 3.877 7.849 -7.544 824 HB2 LYS 113 HB2 LYS 113 3.743 5.772 -9.777 825 HB3 LYS 113 HB3 LYS 113 4.484 7.370 -9.877 826 HG2 LYS 113 HG2 LYS 113 6.102 6.653 -8.077 827 HG3 LYS 113 HG3 LYS 113 5.420 5.026 -8.178 828 HD2 LYS 113 HD2 LYS 113 6.888 6.538 -10.369 829 HD3 LYS 113 HD3 LYS 113 7.489 5.150 -9.455 830 HE2 LYS 113 HE2 LYS 113 5.771 3.718 -10.476 831 HE3 LYS 113 HE3 LYS 113 5.112 5.099 -11.349 832 HZ1 LYS 113 HZ1 LYS 113 6.530 3.799 -12.757 833 HZ2 LYS 113 HZ2 LYS 113 7.823 3.955 -11.678 834 HZ3 LYS 113 HZ3 LYS 113 7.233 5.315 -12.495 835 H LEU 114 H LEU 114 2.286 9.285 -7.638 836 HA LEU 114 HA LEU 114 -0.296 8.747 -8.912 837 HB2 LEU 114 HB2 LEU 114 0.677 11.281 -7.525 838 HB3 LEU 114 HB3 LEU 114 -0.983 10.895 -7.959 839 HG LEU 114 HG LEU 114 0.669 9.419 -5.862 840 HD11 LEU 114 HD11 LEU 114 -0.819 10.451 -4.211 841 HD12 LEU 114 HD12 LEU 114 -1.612 11.380 -5.486 842 HD13 LEU 114 HD13 LEU 114 0.088 11.664 -5.109 843 HD21 LEU 114 HD21 LEU 114 -2.244 9.092 -6.625 844 HD22 LEU 114 HD22 LEU 114 -1.439 8.304 -5.264 845 HD23 LEU 114 HD23 LEU 114 -0.945 7.929 -6.912 846 H GLU 115 H GLU 115 -1.049 9.809 -10.761 847 HA GLU 115 HA GLU 115 0.708 11.788 -12.086 848 HB2 GLU 115 HB2 GLU 115 -0.775 9.485 -13.434 849 HB3 GLU 115 HB3 GLU 115 -0.073 10.847 -14.311 850 HG2 GLU 115 HG2 GLU 115 2.162 10.229 -13.254 851 HG3 GLU 115 HG3 GLU 115 1.392 8.746 -12.688 852 HA PRO 116 HA PRO 116 -3.027 14.343 -11.822 853 HB2 PRO 116 HB2 PRO 116 -2.147 16.445 -13.377 854 HB3 PRO 116 HB3 PRO 116 -1.624 16.179 -11.710 855 HG2 PRO 116 HG2 PRO 116 -0.228 15.425 -14.276 856 HG3 PRO 116 HG3 PRO 116 0.446 16.193 -12.823 857 HD2 PRO 116 HD2 PRO 116 0.756 13.553 -13.286 858 HD3 PRO 116 HD3 PRO 116 0.538 14.182 -11.638 859 H LEU 117 H LEU 117 -4.835 13.806 -12.887 860 HA LEU 117 HA LEU 117 -4.898 13.745 -15.878 861 HB2 LEU 117 HB2 LEU 117 -6.771 12.246 -14.011 862 HB3 LEU 117 HB3 LEU 117 -6.663 12.082 -15.756 863 HG LEU 117 HG LEU 117 -4.605 11.143 -13.717 864 HD11 LEU 117 HD11 LEU 117 -6.504 9.573 -15.490 865 HD12 LEU 117 HD12 LEU 117 -6.612 9.768 -13.737 866 HD13 LEU 117 HD13 LEU 117 -5.262 8.883 -14.440 867 HD21 LEU 117 HD21 LEU 117 -3.464 11.871 -15.774 868 HD22 LEU 117 HD22 LEU 117 -4.516 10.836 -16.743 869 HD23 LEU 117 HD23 LEU 117 -3.387 10.119 -15.588 870 H GLU 118 H GLU 118 -5.185 16.163 -14.613 871 HA GLU 118 HA GLU 118 -6.395 18.063 -14.519 872 HB2 GLU 118 HB2 GLU 118 -8.266 16.469 -16.300 873 HB3 GLU 118 HB3 GLU 118 -8.669 18.105 -15.807 874 HG2 GLU 118 HG2 GLU 118 -7.703 18.072 -18.037 875 HG3 GLU 118 HG3 GLU 118 -6.699 18.965 -16.905 876 H ASN 119 H ASN 119 -9.273 16.015 -14.488 877 HA ASN 119 HA ASN 119 -10.052 17.082 -11.844 878 HB2 ASN 119 HB2 ASN 119 -11.616 15.938 -14.192 879 HB3 ASN 119 HB3 ASN 119 -12.367 16.395 -12.658 880 HD21 ASN 119 HD21 ASN 119 -12.790 17.447 -15.362 881 HD22 ASN 119 HD22 ASN 119 -12.467 19.139 -15.271 882 H ARG 120 H ARG 120 -8.663 14.390 -13.164 883 HA ARG 120 HA ARG 120 -9.560 12.575 -10.989 884 HB2 ARG 120 HB2 ARG 120 -8.557 11.749 -13.754 885 HB3 ARG 120 HB3 ARG 120 -9.185 10.685 -12.496 886 HG2 ARG 120 HG2 ARG 120 -11.429 11.417 -12.850 887 HG3 ARG 120 HG3 ARG 120 -10.904 12.818 -13.794 888 HD2 ARG 120 HD2 ARG 120 -10.661 9.906 -14.626 889 HD3 ARG 120 HD3 ARG 120 -11.819 11.079 -15.263 890 HE ARG 120 HE ARG 120 -9.446 12.275 -15.764 891 HH11 ARG 120 HH11 ARG 120 -10.594 9.101 -16.529 892 HH12 ARG 120 HH12 ARG 120 -9.605 8.974 -17.938 893 HH21 ARG 120 HH21 ARG 120 -8.168 12.069 -17.545 894 HH22 ARG 120 HH22 ARG 120 -8.253 10.639 -18.508 895 H THR 121 H THR 121 -7.740 10.873 -10.562 896 HA THR 121 HA THR 121 -5.032 11.638 -11.386 897 HB THR 121 HB THR 121 -5.793 11.435 -8.431 898 HG1 THR 121 HG1 THR 121 -6.094 13.498 -9.542 899 HG21 THR 121 HG21 THR 121 -3.616 10.305 -8.793 900 HG22 THR 121 HG22 THR 121 -3.394 11.827 -7.930 901 HG23 THR 121 HG23 THR 121 -3.011 11.726 -9.651 902 H ARG 122 H ARG 122 -3.638 9.897 -11.516 903 HA ARG 122 HA ARG 122 -4.884 7.228 -11.273 904 HB2 ARG 122 HB2 ARG 122 -4.189 8.147 -13.532 905 HB3 ARG 122 HB3 ARG 122 -2.520 8.103 -12.985 906 HG2 ARG 122 HG2 ARG 122 -2.595 5.685 -12.794 907 HG3 ARG 122 HG3 ARG 122 -4.326 5.674 -13.162 908 HD2 ARG 122 HD2 ARG 122 -2.119 6.590 -15.046 909 HD3 ARG 122 HD3 ARG 122 -2.968 5.047 -15.124 910 HE ARG 122 HE ARG 122 -5.042 6.638 -15.357 911 HH11 ARG 122 HH11 ARG 122 -1.959 7.090 -16.880 912 HH12 ARG 122 HH12 ARG 122 -2.654 7.879 -18.251 913 HH21 ARG 122 HH21 ARG 122 -5.875 7.646 -17.102 914 HH22 ARG 122 HH22 ARG 122 -4.832 8.199 -18.369 915 H MET 123 H MET 123 -4.182 6.058 -9.581 916 HA MET 123 HA MET 123 -1.546 6.546 -8.347 917 HB2 MET 123 HB2 MET 123 -3.539 6.650 -6.854 918 HB3 MET 123 HB3 MET 123 -3.954 4.995 -7.283 919 HG2 MET 123 HG2 MET 123 -1.732 4.276 -6.308 920 HG3 MET 123 HG3 MET 123 -1.511 5.931 -5.747 921 HE1 MET 123 HE1 MET 123 -4.848 3.791 -5.873 922 HE2 MET 123 HE2 MET 123 -4.802 3.064 -4.269 923 HE3 MET 123 HE3 MET 123 -3.572 2.646 -5.460 924 H THR 124 H THR 124 0.043 5.165 -8.946 925 HA THR 124 HA THR 124 -0.622 2.324 -9.530 926 HB THR 124 HB THR 124 1.706 3.954 -10.661 927 HG1 THR 124 HG1 THR 124 -0.335 4.525 -11.545 928 HG21 THR 124 HG21 THR 124 2.079 2.019 -12.142 929 HG22 THR 124 HG22 THR 124 0.770 1.138 -11.348 930 HG23 THR 124 HG23 THR 124 2.239 1.540 -10.457 931 H ILE 125 H ILE 125 -0.078 1.117 -7.794 932 HA ILE 125 HA ILE 125 2.273 1.812 -6.120 933 HB ILE 125 HB ILE 125 0.062 -0.215 -5.520 934 HG12 ILE 125 HG12 ILE 125 0.296 2.632 -4.433 935 HG13 ILE 125 HG13 ILE 125 -0.846 2.134 -5.678 936 HG21 ILE 125 HG21 ILE 125 2.161 -0.659 -4.302 937 HG22 ILE 125 HG22 ILE 125 0.910 -0.113 -3.186 938 HG23 ILE 125 HG23 ILE 125 2.182 1.000 -3.695 939 HD11 ILE 125 HD11 ILE 125 -1.922 0.618 -4.069 940 HD12 ILE 125 HD12 ILE 125 -1.924 2.292 -3.517 941 HD13 ILE 125 HD13 ILE 125 -0.782 1.142 -2.825 942 H ILE 126 H ILE 126 4.113 0.738 -6.744 943 HA ILE 126 HA ILE 126 3.904 -1.968 -7.916 944 HB ILE 126 HB ILE 126 6.343 -0.118 -8.077 945 HG12 ILE 126 HG12 ILE 126 5.565 0.060 -10.606 946 HG13 ILE 126 HG13 ILE 126 3.976 -0.351 -9.976 947 HG21 ILE 126 HG21 ILE 126 7.071 -1.646 -9.889 948 HG22 ILE 126 HG22 ILE 126 5.653 -2.657 -9.602 949 HG23 ILE 126 HG23 ILE 126 6.883 -2.485 -8.347 950 HD11 ILE 126 HD11 ILE 126 4.048 1.638 -8.548 951 HD12 ILE 126 HD12 ILE 126 4.228 2.029 -10.258 952 HD13 ILE 126 HD13 ILE 126 5.639 2.041 -9.200 953 H SER 127 H SER 127 4.063 -3.372 -6.295 954 HA SER 127 HA SER 127 5.828 -3.049 -3.997 955 HB2 SER 127 HB2 SER 127 3.483 -3.838 -3.705 956 HB3 SER 127 HB3 SER 127 3.813 -5.238 -4.724 957 HG SER 127 HG SER 127 4.261 -4.886 -2.099 958 H THR 128 H THR 128 7.951 -3.547 -4.461 959 HA THR 128 HA THR 128 8.631 -5.748 -6.296 960 HB THR 128 HB THR 128 10.971 -4.799 -6.207 961 HG1 THR 128 HG1 THR 128 10.954 -3.684 -4.267 962 HG21 THR 128 HG21 THR 128 10.509 -2.815 -7.598 963 HG22 THR 128 HG22 THR 128 8.827 -2.820 -7.067 964 HG23 THR 128 HG23 THR 128 9.449 -4.152 -8.047 965 H PHE 129 H PHE 129 8.811 -7.622 -5.342 966 HA PHE 129 HA PHE 129 9.366 -8.005 -2.533 967 HB2 PHE 129 HB2 PHE 129 8.947 -10.113 -4.697 968 HB3 PHE 129 HB3 PHE 129 8.761 -10.325 -2.958 969 HD1 PHE 129 HD1 PHE 129 6.801 -9.291 -1.777 970 HD2 PHE 129 HD2 PHE 129 7.184 -9.123 -6.027 971 HE1 PHE 129 HE1 PHE 129 4.438 -8.654 -1.977 972 HE2 PHE 129 HE2 PHE 129 4.827 -8.507 -6.214 973 HZ PHE 129 HZ PHE 129 3.445 -8.259 -4.193 974 H GLU 130 H GLU 130 11.015 -9.452 -1.719 975 HA GLU 130 HA GLU 130 13.615 -9.172 -2.926 976 HB2 GLU 130 HB2 GLU 130 12.750 -10.856 -0.534 977 HB3 GLU 130 HB3 GLU 130 14.412 -10.443 -0.953 978 HG2 GLU 130 HG2 GLU 130 12.250 -8.487 -0.110 979 HG3 GLU 130 HG3 GLU 130 13.547 -9.089 0.915 980 H SER 131 H SER 131 11.193 -11.752 -2.742 981 HA SER 131 HA SER 131 12.904 -13.584 -4.331 982 HB2 SER 131 HB2 SER 131 11.257 -14.390 -1.888 983 HB3 SER 131 HB3 SER 131 12.179 -15.493 -2.918 984 HG SER 131 HG SER 131 13.083 -14.481 -0.815 985 H GLU 132 H GLU 132 11.816 -15.111 -5.587 986 HA GLU 132 HA GLU 132 9.318 -14.414 -6.739 987 HB2 GLU 132 HB2 GLU 132 11.224 -15.687 -7.861 988 HB3 GLU 132 HB3 GLU 132 10.725 -17.111 -6.956 989 HG2 GLU 132 HG2 GLU 132 8.454 -16.900 -8.068 990 HG3 GLU 132 HG3 GLU 132 9.140 -15.634 -9.080 991 H GLU 133 H GLU 133 10.185 -17.238 -4.669 992 HA GLU 133 HA GLU 133 7.715 -18.436 -4.281 993 HB2 GLU 133 HB2 GLU 133 8.642 -19.245 -2.068 994 HB3 GLU 133 HB3 GLU 133 9.719 -19.488 -3.439 995 HG2 GLU 133 HG2 GLU 133 11.107 -17.608 -2.777 996 HG3 GLU 133 HG3 GLU 133 9.968 -17.156 -1.509 997 H GLN 134 H GLN 134 9.009 -15.596 -2.651 998 HA GLN 134 HA GLN 134 7.043 -15.139 -0.699 999 HB2 GLN 134 HB2 GLN 134 9.131 -13.960 -0.585 1000 HB3 GLN 134 HB3 GLN 134 8.939 -13.307 -2.206 1001 HG2 GLN 134 HG2 GLN 134 7.097 -11.863 -1.409 1002 HG3 GLN 134 HG3 GLN 134 7.289 -12.521 0.218 1003 HE21 GLN 134 HE21 GLN 134 7.690 -10.361 0.950 1004 HE22 GLN 134 HE22 GLN 134 9.223 -9.621 0.707 1005 H MET 135 H MET 135 7.280 -13.869 -4.073 1006 HA MET 135 HA MET 135 4.880 -12.323 -3.854 1007 HB2 MET 135 HB2 MET 135 5.173 -11.658 -6.095 1008 HB3 MET 135 HB3 MET 135 6.770 -11.756 -5.392 1009 HG2 MET 135 HG2 MET 135 7.149 -13.875 -6.579 1010 HG3 MET 135 HG3 MET 135 5.542 -13.753 -7.298 1011 HE1 MET 135 HE1 MET 135 5.562 -10.393 -7.668 1012 HE2 MET 135 HE2 MET 135 4.827 -11.520 -8.811 1013 HE3 MET 135 HE3 MET 135 6.016 -10.345 -9.372 1014 H GLN 136 H GLN 136 5.493 -15.620 -5.043 1015 HA GLN 136 HA GLN 136 2.889 -16.179 -6.002 1016 HB2 GLN 136 HB2 GLN 136 5.013 -17.951 -4.763 1017 HB3 GLN 136 HB3 GLN 136 3.409 -18.605 -5.063 1018 HG2 GLN 136 HG2 GLN 136 4.658 -19.234 -6.927 1019 HG3 GLN 136 HG3 GLN 136 3.705 -17.868 -7.488 1020 HE21 GLN 136 HE21 GLN 136 4.774 -15.882 -7.861 1021 HE22 GLN 136 HE22 GLN 136 6.472 -15.819 -8.112 1022 H LYS 137 H LYS 137 4.242 -16.586 -2.707 1023 HA LYS 137 HA LYS 137 2.013 -17.556 -1.378 1024 HB2 LYS 137 HB2 LYS 137 4.606 -16.951 -0.648 1025 HB3 LYS 137 HB3 LYS 137 3.744 -15.692 0.218 1026 HG2 LYS 137 HG2 LYS 137 3.390 -18.692 0.508 1027 HG3 LYS 137 HG3 LYS 137 4.097 -17.581 1.685 1028 HD2 LYS 137 HD2 LYS 137 1.859 -16.457 1.880 1029 HD3 LYS 137 HD3 LYS 137 1.193 -17.674 0.786 1030 HE2 LYS 137 HE2 LYS 137 2.416 -18.202 3.505 1031 HE3 LYS 137 HE3 LYS 137 0.700 -18.223 3.116 1032 HZ1 LYS 137 HZ1 LYS 137 1.662 -20.448 3.214 1033 HZ2 LYS 137 HZ2 LYS 137 2.731 -20.058 1.965 1034 HZ3 LYS 137 HZ3 LYS 137 1.067 -20.100 1.674 1035 H MET 138 H MET 138 2.938 -14.166 -1.936 1036 HA MET 138 HA MET 138 0.955 -12.748 -0.578 1037 HB2 MET 138 HB2 MET 138 2.057 -12.085 -3.342 1038 HB3 MET 138 HB3 MET 138 1.294 -10.949 -2.240 1039 HG2 MET 138 HG2 MET 138 3.823 -12.383 -1.462 1040 HG3 MET 138 HG3 MET 138 3.868 -10.951 -2.474 1041 HE1 MET 138 HE1 MET 138 2.960 -11.064 2.025 1042 HE2 MET 138 HE2 MET 138 3.818 -12.296 1.101 1043 HE3 MET 138 HE3 MET 138 2.067 -12.123 0.929 1044 H ALA 139 H ALA 139 0.865 -14.023 -3.893 1045 HA ALA 139 HA ALA 139 -1.803 -13.193 -4.472 1046 HB1 ALA 139 HB1 ALA 139 -0.103 -13.439 -6.229 1047 HB2 ALA 139 HB2 ALA 139 -1.491 -14.474 -6.576 1048 HB3 ALA 139 HB3 ALA 139 -0.005 -15.174 -5.920 1049 H GLU 140 H GLU 140 -0.398 -16.210 -3.258 1050 HA GLU 140 HA GLU 140 -2.613 -17.944 -3.760 1051 HB2 GLU 140 HB2 GLU 140 -0.257 -18.243 -1.845 1052 HB3 GLU 140 HB3 GLU 140 -1.421 -19.525 -2.173 1053 HG2 GLU 140 HG2 GLU 140 -0.749 -19.556 -4.530 1054 HG3 GLU 140 HG3 GLU 140 0.379 -18.243 -4.246 1055 H MET 141 H MET 141 -1.657 -16.025 -0.918 1056 HA MET 141 HA MET 141 -3.782 -16.911 0.810 1057 HB2 MET 141 HB2 MET 141 -2.168 -14.329 0.887 1058 HB3 MET 141 HB3 MET 141 -3.189 -14.926 2.190 1059 HG2 MET 141 HG2 MET 141 -1.720 -16.879 2.449 1060 HG3 MET 141 HG3 MET 141 -0.699 -16.285 1.136 1061 HE1 MET 141 HE1 MET 141 0.648 -12.901 2.780 1062 HE2 MET 141 HE2 MET 141 -0.868 -13.022 1.887 1063 HE3 MET 141 HE3 MET 141 0.574 -13.849 1.295 1064 H GLY 142 H GLY 142 -3.643 -14.676 -1.829 1065 HA2 GLY 142 HA2 GLY 142 -5.298 -13.350 -2.788 1066 HA3 GLY 142 HA3 GLY 142 -6.376 -13.741 -1.455 1067 H MET 143 H MET 143 -3.139 -12.544 -0.836 1068 HA MET 143 HA MET 143 -4.004 -10.188 0.540 1069 HB2 MET 143 HB2 MET 143 -1.848 -11.514 0.957 1070 HB3 MET 143 HB3 MET 143 -1.182 -10.756 -0.480 1071 HG2 MET 143 HG2 MET 143 -2.172 -9.184 1.912 1072 HG3 MET 143 HG3 MET 143 -0.511 -9.737 1.745 1073 HE1 MET 143 HE1 MET 143 0.801 -7.616 -1.257 1074 HE2 MET 143 HE2 MET 143 0.224 -9.281 -1.281 1075 HE3 MET 143 HE3 MET 143 1.239 -8.717 0.049 1076 H GLU 144 H GLU 144 -3.038 -10.871 -2.767 1077 HA GLU 144 HA GLU 144 -2.885 -8.365 -3.965 1078 HB2 GLU 144 HB2 GLU 144 -2.519 -10.508 -5.153 1079 HB3 GLU 144 HB3 GLU 144 -4.222 -10.909 -5.023 1080 HG2 GLU 144 HG2 GLU 144 -3.361 -8.426 -6.514 1081 HG3 GLU 144 HG3 GLU 144 -3.226 -9.997 -7.289 1082 H GLU 145 H GLU 145 -5.840 -10.314 -3.357 1083 HA GLU 145 HA GLU 145 -7.758 -8.326 -4.034 1084 HB2 GLU 145 HB2 GLU 145 -8.272 -10.763 -3.908 1085 HB3 GLU 145 HB3 GLU 145 -8.075 -10.712 -2.160 1086 HG2 GLU 145 HG2 GLU 145 -9.976 -8.983 -2.144 1087 HG3 GLU 145 HG3 GLU 145 -10.237 -9.405 -3.836 1088 H GLY 146 H GLY 146 -6.181 -9.188 -0.951 1089 HA2 GLY 146 HA2 GLY 146 -7.745 -7.760 0.882 1090 HA3 GLY 146 HA3 GLY 146 -6.044 -8.139 1.089 1091 H MET 147 H MET 147 -4.851 -6.670 -0.906 1092 HA MET 147 HA MET 147 -5.054 -3.952 0.088 1093 HB2 MET 147 HB2 MET 147 -2.846 -5.158 -0.499 1094 HB3 MET 147 HB3 MET 147 -3.249 -4.865 -2.183 1095 HG2 MET 147 HG2 MET 147 -3.230 -2.447 -1.803 1096 HG3 MET 147 HG3 MET 147 -2.946 -2.697 -0.083 1097 HE1 MET 147 HE1 MET 147 -1.414 -2.898 -3.691 1098 HE2 MET 147 HE2 MET 147 -1.306 -4.578 -3.166 1099 HE3 MET 147 HE3 MET 147 0.162 -3.624 -3.374 1100 H ARG 148 H ARG 148 -6.092 -5.706 -2.796 1101 HA ARG 148 HA ARG 148 -6.592 -3.512 -4.534 1102 HB2 ARG 148 HB2 ARG 148 -6.494 -5.897 -5.250 1103 HB3 ARG 148 HB3 ARG 148 -8.022 -6.200 -4.429 1104 HG2 ARG 148 HG2 ARG 148 -9.167 -4.656 -5.985 1105 HG3 ARG 148 HG3 ARG 148 -7.629 -4.322 -6.790 1106 HD2 ARG 148 HD2 ARG 148 -7.457 -6.775 -7.321 1107 HD3 ARG 148 HD3 ARG 148 -9.084 -6.983 -6.666 1108 HE ARG 148 HE ARG 148 -9.645 -5.201 -8.483 1109 HH11 ARG 148 HH11 ARG 148 -7.339 -7.764 -8.835 1110 HH12 ARG 148 HH12 ARG 148 -7.637 -7.934 -10.531 1111 HH21 ARG 148 HH21 ARG 148 -9.996 -5.419 -10.646 1112 HH22 ARG 148 HH22 ARG 148 -9.114 -6.595 -11.555 1113 H GLU 149 H GLU 149 -8.766 -5.246 -2.294 1114 HA GLU 149 HA GLU 149 -11.074 -3.630 -2.674 1115 HB2 GLU 149 HB2 GLU 149 -10.296 -5.423 -0.338 1116 HB3 GLU 149 HB3 GLU 149 -11.887 -4.685 -0.538 1117 HG2 GLU 149 HG2 GLU 149 -10.599 -6.780 -2.315 1118 HG3 GLU 149 HG3 GLU 149 -11.987 -6.991 -1.249 1119 H ALA 150 H ALA 150 -8.335 -3.426 -0.456 1120 HA ALA 150 HA ALA 150 -9.086 -1.235 1.130 1121 HB1 ALA 150 HB1 ALA 150 -7.049 -2.577 1.506 1122 HB2 ALA 150 HB2 ALA 150 -6.664 -0.858 1.405 1123 HB3 ALA 150 HB3 ALA 150 -6.333 -1.920 0.030 1124 H ILE 151 H ILE 151 -7.566 -1.343 -2.082 1125 HA ILE 151 HA ILE 151 -7.368 1.469 -2.518 1126 HB ILE 151 HB ILE 151 -7.182 -0.923 -4.383 1127 HG12 ILE 151 HG12 ILE 151 -5.012 0.961 -3.348 1128 HG13 ILE 151 HG13 ILE 151 -5.377 -0.610 -2.647 1129 HG21 ILE 151 HG21 ILE 151 -7.936 0.948 -5.762 1130 HG22 ILE 151 HG22 ILE 151 -6.249 0.580 -6.124 1131 HG23 ILE 151 HG23 ILE 151 -6.651 1.975 -5.121 1132 HD11 ILE 151 HD11 ILE 151 -4.711 -1.684 -4.762 1133 HD12 ILE 151 HD12 ILE 151 -3.415 -0.730 -4.040 1134 HD13 ILE 151 HD13 ILE 151 -4.308 -0.096 -5.422 1135 H GLU 152 H GLU 152 -9.868 -0.923 -3.330 1136 HA GLU 152 HA GLU 152 -11.529 0.847 -4.864 1137 HB2 GLU 152 HB2 GLU 152 -12.224 -1.736 -3.408 1138 HB3 GLU 152 HB3 GLU 152 -13.292 -0.902 -4.538 1139 HG2 GLU 152 HG2 GLU 152 -10.584 -2.102 -5.219 1140 HG3 GLU 152 HG3 GLU 152 -12.152 -2.819 -5.583 1141 H GLN 153 H GLN 153 -11.001 0.403 -1.505 1142 HA GLN 153 HA GLN 153 -13.451 1.743 -0.641 1143 HB2 GLN 153 HB2 GLN 153 -12.471 -0.223 0.578 1144 HB3 GLN 153 HB3 GLN 153 -11.078 0.767 0.994 1145 HG2 GLN 153 HG2 GLN 153 -12.426 2.210 2.388 1146 HG3 GLN 153 HG3 GLN 153 -13.917 1.457 1.820 1147 HE21 GLN 153 HE21 GLN 153 -11.041 0.954 3.734 1148 HE22 GLN 153 HE22 GLN 153 -11.632 -0.378 4.649 1149 H ILE 154 H ILE 154 -10.219 2.652 -1.570 1150 HA ILE 154 HA ILE 154 -9.920 5.151 -0.262 1151 HB ILE 154 HB ILE 154 -9.074 4.363 -3.082 1152 HG12 ILE 154 HG12 ILE 154 -7.430 4.472 -0.516 1153 HG13 ILE 154 HG13 ILE 154 -8.059 2.999 -1.249 1154 HG21 ILE 154 HG21 ILE 154 -7.486 6.274 -3.017 1155 HG22 ILE 154 HG22 ILE 154 -8.178 6.792 -1.480 1156 HG23 ILE 154 HG23 ILE 154 -9.165 6.815 -2.941 1157 HD11 ILE 154 HD11 ILE 154 -6.663 3.373 -3.215 1158 HD12 ILE 154 HD12 ILE 154 -5.708 3.308 -1.736 1159 HD13 ILE 154 HD13 ILE 154 -6.043 4.862 -2.495 1160 H ASP 155 H ASP 155 -11.687 4.244 -3.215 1161 HA ASP 155 HA ASP 155 -12.746 6.692 -4.005 1162 HB2 ASP 155 HB2 ASP 155 -12.950 4.618 -5.319 1163 HB3 ASP 155 HB3 ASP 155 -13.988 3.905 -4.087 1164 H ALA 156 H ALA 156 -13.891 4.439 -1.503 1165 HA ALA 156 HA ALA 156 -16.176 5.984 -0.692 1166 HB1 ALA 156 HB1 ALA 156 -14.700 3.778 0.810 1167 HB2 ALA 156 HB2 ALA 156 -16.018 3.537 -0.343 1168 HB3 ALA 156 HB3 ALA 156 -16.320 4.386 1.173 1169 H VAL 157 H VAL 157 -12.772 5.984 0.296 1170 HA VAL 157 HA VAL 157 -13.025 7.458 2.738 1171 HB VAL 157 HB VAL 157 -10.644 7.229 0.828 1172 HG11 VAL 157 HG11 VAL 157 -10.652 8.327 3.674 1173 HG12 VAL 157 HG12 VAL 157 -10.346 9.253 2.203 1174 HG13 VAL 157 HG13 VAL 157 -9.208 8.005 2.708 1175 HG21 VAL 157 HG21 VAL 157 -11.222 5.753 3.422 1176 HG22 VAL 157 HG22 VAL 157 -9.756 5.592 2.453 1177 HG23 VAL 157 HG23 VAL 157 -11.307 5.071 1.799 1178 H LEU 158 H LEU 158 -12.285 8.460 -0.603 1179 HA LEU 158 HA LEU 158 -12.085 11.274 0.076 1180 HB2 LEU 158 HB2 LEU 158 -12.009 9.917 -2.648 1181 HB3 LEU 158 HB3 LEU 158 -11.569 11.586 -2.315 1182 HG LEU 158 HG LEU 158 -10.088 9.106 -1.345 1183 HD11 LEU 158 HD11 LEU 158 -8.253 9.869 -2.779 1184 HD12 LEU 158 HD12 LEU 158 -9.243 11.213 -3.359 1185 HD13 LEU 158 HD13 LEU 158 -9.713 9.547 -3.713 1186 HD21 LEU 158 HD21 LEU 158 -9.472 12.028 -0.792 1187 HD22 LEU 158 HD22 LEU 158 -8.403 10.675 -0.419 1188 HD23 LEU 158 HD23 LEU 158 -9.963 10.807 0.384 1189 H SER 159 H SER 159 -14.489 9.143 -1.415 1190 HA SER 159 HA SER 159 -16.264 11.435 -2.076 1191 HB2 SER 159 HB2 SER 159 -15.569 9.527 -3.783 1192 HB3 SER 159 HB3 SER 159 -16.772 8.573 -2.948 1193 HG SER 159 HG SER 159 -17.311 10.053 -4.905 1194 H GLU 160 H GLU 160 -15.924 10.458 0.681 1195 HA GLU 160 HA GLU 160 -18.071 8.721 1.430 1196 HB2 GLU 160 HB2 GLU 160 -15.831 9.288 2.671 1197 HB3 GLU 160 HB3 GLU 160 -16.718 10.625 3.370 1198 HG2 GLU 160 HG2 GLU 160 -17.473 7.694 3.613 1199 HG3 GLU 160 HG3 GLU 160 -16.592 8.604 4.827 1200 HA PRO 161 HA PRO 161 -20.994 12.231 1.172 1201 HB2 PRO 161 HB2 PRO 161 -23.099 10.907 0.224 1202 HB3 PRO 161 HB3 PRO 161 -21.614 10.977 -0.743 1203 HG2 PRO 161 HG2 PRO 161 -22.662 8.718 0.962 1204 HG3 PRO 161 HG3 PRO 161 -21.879 8.647 -0.630 1205 HD2 PRO 161 HD2 PRO 161 -20.594 8.283 1.889 1206 HD3 PRO 161 HD3 PRO 161 -19.796 8.519 0.320 1207 H ALA 162 H ALA 162 -20.531 10.732 3.791 1208 HA ALA 162 HA ALA 162 -21.378 10.477 5.859 1209 HB1 ALA 162 HB1 ALA 162 -22.337 12.748 5.577 1210 HB2 ALA 162 HB2 ALA 162 -23.343 11.729 6.606 1211 HB3 ALA 162 HB3 ALA 162 -23.817 12.033 4.932 1212 H ASN 163 H ASN 163 -21.951 8.563 3.640 1213 HA ASN 163 HA ASN 163 -23.532 6.679 5.079 1214 HB2 ASN 163 HB2 ASN 163 -25.438 6.450 3.535 1215 HB3 ASN 163 HB3 ASN 163 -25.402 8.044 4.248 1216 HD21 ASN 163 HD21 ASN 163 -24.969 6.217 1.301 1217 HD22 ASN 163 HD22 ASN 163 -25.019 7.569 0.228 1218 H ALA 164 H ALA 164 -20.903 6.758 3.845 1219 HA ALA 164 HA ALA 164 -20.933 5.078 1.475 1220 HB1 ALA 164 HB1 ALA 164 -19.162 6.755 1.800 1221 HB2 ALA 164 HB2 ALA 164 -18.482 5.136 1.635 1222 HB3 ALA 164 HB3 ALA 164 -18.592 5.890 3.228 1223 H LEU 165 H LEU 165 -22.331 3.462 2.613 1224 HA LEU 165 HA LEU 165 -20.728 1.319 3.911 1225 HB2 LEU 165 HB2 LEU 165 -23.715 1.883 4.149 1226 HB3 LEU 165 HB3 LEU 165 -22.893 0.507 4.872 1227 HG LEU 165 HG LEU 165 -22.411 3.429 5.614 1228 HD11 LEU 165 HD11 LEU 165 -23.900 1.273 7.149 1229 HD12 LEU 165 HD12 LEU 165 -24.616 2.676 6.348 1230 HD13 LEU 165 HD13 LEU 165 -23.544 2.906 7.725 1231 HD21 LEU 165 HD21 LEU 165 -20.381 2.096 5.920 1232 HD22 LEU 165 HD22 LEU 165 -21.274 0.894 6.854 1233 HD23 LEU 165 HD23 LEU 165 -21.067 2.531 7.485 1234 H GLU 166 H GLU 166 -21.574 2.136 0.972 1235 HA GLU 166 HA GLU 166 -23.334 0.044 0.095 1236 HB2 GLU 166 HB2 GLU 166 -22.900 2.486 -0.910 1237 HB3 GLU 166 HB3 GLU 166 -21.677 1.659 -1.861 1238 HG2 GLU 166 HG2 GLU 166 -24.650 1.035 -1.818 1239 HG3 GLU 166 HG3 GLU 166 -23.799 1.903 -3.088 1240 H HIS 167 H HIS 167 -22.574 -1.986 0.205 1241 HA HIS 167 HA HIS 167 -20.395 -2.742 -1.599 1242 HB2 HIS 167 HB2 HIS 167 -20.586 -3.608 1.310 1243 HB3 HIS 167 HB3 HIS 167 -19.773 -4.614 0.121 1244 HD1 HIS 167 HD1 HIS 167 -19.179 -1.805 2.375 1245 HD2 HIS 167 HD2 HIS 167 -17.455 -3.289 -1.103 1246 HE1 HIS 167 HE1 HIS 167 -16.883 -0.793 2.281 1247 HE2 HIS 167 HE2 HIS 167 -15.802 -1.846 0.268 1248 H HIS 168 H HIS 168 -22.345 -3.134 -2.947 1249 HA HIS 168 HA HIS 168 -24.003 -5.375 -2.629 1250 HB2 HIS 168 HB2 HIS 168 -22.755 -4.129 -5.107 1251 HB3 HIS 168 HB3 HIS 168 -23.771 -5.563 -5.227 1252 HD1 HIS 168 HD1 HIS 168 -23.986 -1.954 -5.235 1253 HD2 HIS 168 HD2 HIS 168 -26.469 -5.076 -4.090 1254 HE1 HIS 168 HE1 HIS 168 -26.305 -0.997 -5.223 1255 HE2 HIS 168 HE2 HIS 168 -27.784 -2.892 -4.493 1256 H HIS 169 H HIS 169 -23.483 -7.426 -2.229 1257 HA HIS 169 HA HIS 169 -20.761 -8.154 -1.833 1258 HB2 HIS 169 HB2 HIS 169 -23.223 -9.938 -1.600 1259 HB3 HIS 169 HB3 HIS 169 -21.650 -10.218 -0.861 1260 HD1 HIS 169 HD1 HIS 169 -20.945 -8.193 0.909 1261 HD2 HIS 169 HD2 HIS 169 -24.979 -8.682 0.054 1262 HE1 HIS 169 HE1 HIS 169 -22.164 -7.018 2.752 1263 HE2 HIS 169 HE2 HIS 169 -24.591 -7.196 2.131 1264 H HIS 170 H HIS 170 -23.214 -9.173 -4.208 1265 HA HIS 170 HA HIS 170 -23.218 -10.529 -6.047 1266 HB2 HIS 170 HB2 HIS 170 -20.262 -9.791 -6.177 1267 HB3 HIS 170 HB3 HIS 170 -21.176 -10.512 -7.496 1268 HD1 HIS 170 HD1 HIS 170 -23.203 -8.940 -8.429 1269 HD2 HIS 170 HD2 HIS 170 -20.282 -7.063 -6.146 1270 HE1 HIS 170 HE1 HIS 170 -23.445 -6.491 -8.910 1271 HE2 HIS 170 HE2 HIS 170 -21.779 -5.371 -7.399 1272 H HIS 171 H HIS 171 -21.329 -12.421 -7.110 1273 HA HIS 171 HA HIS 171 -20.151 -13.891 -4.883 1274 HB2 HIS 171 HB2 HIS 171 -22.605 -14.753 -5.357 1275 HB3 HIS 171 HB3 HIS 171 -21.880 -15.549 -6.753 1276 HD1 HIS 171 HD1 HIS 171 -20.058 -17.398 -6.218 1277 HD2 HIS 171 HD2 HIS 171 -22.091 -15.933 -2.908 1278 HE1 HIS 171 HE1 HIS 171 -19.534 -18.986 -4.353 1279 HE2 HIS 171 HE2 HIS 171 -20.638 -17.986 -2.330 1280 H HIS 172 H HIS 172 -18.149 -13.484 -5.698 1281 HA HIS 172 HA HIS 172 -17.269 -15.187 -7.930 1282 HB2 HIS 172 HB2 HIS 172 -16.542 -12.237 -7.637 1283 HB3 HIS 172 HB3 HIS 172 -15.616 -13.351 -8.631 1284 HD1 HIS 172 HD1 HIS 172 -17.655 -14.793 -10.235 1285 HD2 HIS 172 HD2 HIS 172 -18.031 -10.751 -9.349 1286 HE1 HIS 172 HE1 HIS 172 -19.170 -13.866 -11.998 1287 HE2 HIS 172 HE2 HIS 172 -19.499 -11.466 -11.364
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