NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
563432 | 2m7n | 19197 | cing | 1-original | 6 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H GLY 67 H GLY 67 1.811 -0.001 0.854 2 HA2 GLY 67 HA2 GLY 67 3.077 -0.344 -1.056 3 HA3 GLY 67 HA3 GLY 67 1.594 -0.679 -1.937 4 H GLN 68 H GLN 68 0.491 1.947 -0.901 5 HA GLN 68 HA GLN 68 1.224 3.512 -3.153 6 HB2 GLN 68 HB2 GLN 68 -0.535 3.888 -0.776 7 HB3 GLN 68 HB3 GLN 68 -0.061 5.314 -1.689 8 HG2 GLN 68 HG2 GLN 68 -2.234 4.351 -2.377 9 HG3 GLN 68 HG3 GLN 68 -1.053 4.457 -3.681 10 HE21 GLN 68 HE21 GLN 68 -1.605 2.831 -4.981 11 HE22 GLN 68 HE22 GLN 68 -1.729 1.175 -4.506 12 H ASP 69 H ASP 69 2.821 4.929 -3.402 13 HA ASP 69 HA ASP 69 4.797 5.302 -1.413 14 HB2 ASP 69 HB2 ASP 69 4.300 6.353 -4.153 15 HB3 ASP 69 HB3 ASP 69 5.419 7.251 -3.131 16 H LEU 70 H LEU 70 4.852 6.668 0.239 17 HA LEU 70 HA LEU 70 2.765 8.441 0.842 18 HB2 LEU 70 HB2 LEU 70 5.030 7.438 2.129 19 HB3 LEU 70 HB3 LEU 70 5.240 9.187 2.125 20 HG LEU 70 HG LEU 70 2.569 8.503 2.953 21 HD11 LEU 70 HD11 LEU 70 3.519 7.582 5.217 22 HD12 LEU 70 HD12 LEU 70 4.818 6.988 4.184 23 HD13 LEU 70 HD13 LEU 70 3.153 6.491 3.880 24 HD21 LEU 70 HD21 LEU 70 4.886 10.096 3.888 25 HD22 LEU 70 HD22 LEU 70 3.673 9.649 5.088 26 HD23 LEU 70 HD23 LEU 70 3.202 10.567 3.657 27 H SER 71 H SER 71 3.798 10.806 1.668 28 HA SER 71 HA SER 71 4.538 12.085 -0.875 29 HB2 SER 71 HB2 SER 71 2.785 12.871 1.382 30 HB3 SER 71 HB3 SER 71 3.738 14.163 0.653 31 HG SER 71 HG SER 71 2.354 12.402 -1.026 32 H ASP 72 H ASP 72 6.260 13.465 -1.006 33 HA ASP 72 HA ASP 72 8.559 13.093 0.301 34 HB2 ASP 72 HB2 ASP 72 7.436 15.293 -1.223 35 HB3 ASP 72 HB3 ASP 72 8.572 15.869 -0.006 36 H ASP 73 H ASP 73 9.684 13.952 2.072 37 HA ASP 73 HA ASP 73 8.434 14.063 4.486 38 HB2 ASP 73 HB2 ASP 73 10.892 15.674 3.770 39 HB3 ASP 73 HB3 ASP 73 10.422 15.138 5.381 40 H LYS 74 H LYS 74 8.516 16.531 2.085 41 HA LYS 74 HA LYS 74 7.741 18.659 3.883 42 HB2 LYS 74 HB2 LYS 74 7.687 20.062 1.927 43 HB3 LYS 74 HB3 LYS 74 9.135 19.066 1.860 44 HG2 LYS 74 HG2 LYS 74 7.501 17.499 0.457 45 HG3 LYS 74 HG3 LYS 74 6.740 19.057 0.127 46 HD2 LYS 74 HD2 LYS 74 8.344 18.660 -1.595 47 HD3 LYS 74 HD3 LYS 74 8.998 19.917 -0.541 48 HE2 LYS 74 HE2 LYS 74 9.848 17.455 0.524 49 HE3 LYS 74 HE3 LYS 74 10.100 17.357 -1.218 50 HZ1 LYS 74 HZ1 LYS 74 11.033 19.640 0.427 51 HZ2 LYS 74 HZ2 LYS 74 11.450 19.281 -1.172 52 HZ3 LYS 74 HZ3 LYS 74 11.997 18.292 0.087 53 H ILE 75 H ILE 75 6.110 16.087 3.150 54 HA ILE 75 HA ILE 75 3.773 16.717 1.841 55 HB ILE 75 HB ILE 75 4.205 14.458 2.567 56 HG12 ILE 75 HG12 ILE 75 1.738 15.612 3.887 57 HG13 ILE 75 HG13 ILE 75 1.866 15.052 2.223 58 HG21 ILE 75 HG21 ILE 75 4.190 13.759 4.854 59 HG22 ILE 75 HG22 ILE 75 5.323 15.101 4.701 60 HG23 ILE 75 HG23 ILE 75 3.725 15.371 5.397 61 HD11 ILE 75 HD11 ILE 75 1.453 13.547 4.691 62 HD12 ILE 75 HD12 ILE 75 1.008 13.157 3.029 63 HD13 ILE 75 HD13 ILE 75 2.647 12.845 3.600 64 H GLY 76 H GLY 76 4.652 17.390 5.199 65 HA2 GLY 76 HA2 GLY 76 2.144 18.319 6.070 66 HA3 GLY 76 HA3 GLY 76 3.693 18.748 6.780 67 H LEU 77 H LEU 77 4.943 20.147 4.841 68 HA LEU 77 HA LEU 77 3.797 22.688 5.030 69 HB2 LEU 77 HB2 LEU 77 5.711 21.886 2.860 70 HB3 LEU 77 HB3 LEU 77 5.545 23.452 3.651 71 HG LEU 77 HG LEU 77 6.734 20.940 4.822 72 HD11 LEU 77 HD11 LEU 77 8.561 22.945 5.062 73 HD12 LEU 77 HD12 LEU 77 7.802 23.333 3.519 74 HD13 LEU 77 HD13 LEU 77 8.535 21.748 3.767 75 HD21 LEU 77 HD21 LEU 77 5.899 21.787 6.744 76 HD22 LEU 77 HD22 LEU 77 5.718 23.411 6.081 77 HD23 LEU 77 HD23 LEU 77 7.301 22.849 6.620 78 H LYS 78 H LYS 78 3.796 20.366 2.351 79 HA LYS 78 HA LYS 78 2.464 21.984 0.480 80 HB2 LYS 78 HB2 LYS 78 2.526 18.975 0.764 81 HB3 LYS 78 HB3 LYS 78 1.888 19.825 -0.637 82 HG2 LYS 78 HG2 LYS 78 4.109 20.825 -1.007 83 HG3 LYS 78 HG3 LYS 78 4.732 19.887 0.352 84 HD2 LYS 78 HD2 LYS 78 5.150 18.233 -1.077 85 HD3 LYS 78 HD3 LYS 78 3.407 18.043 -1.282 86 HE2 LYS 78 HE2 LYS 78 3.535 19.827 -3.053 87 HE3 LYS 78 HE3 LYS 78 5.291 19.714 -2.936 88 HZ1 LYS 78 HZ1 LYS 78 5.244 17.491 -3.684 89 HZ2 LYS 78 HZ2 LYS 78 4.236 18.352 -4.734 90 HZ3 LYS 78 HZ3 LYS 78 3.563 17.379 -3.525 91 H VAL 79 H VAL 79 1.245 19.708 2.902 92 HA VAL 79 HA VAL 79 -1.462 19.781 2.173 93 HB VAL 79 HB VAL 79 -0.161 19.284 4.849 94 HG11 VAL 79 HG11 VAL 79 -3.057 19.037 4.052 95 HG12 VAL 79 HG12 VAL 79 -2.363 18.301 5.499 96 HG13 VAL 79 HG13 VAL 79 -2.375 20.056 5.320 97 HG21 VAL 79 HG21 VAL 79 -1.569 17.098 3.554 98 HG22 VAL 79 HG22 VAL 79 -0.264 17.741 2.558 99 HG23 VAL 79 HG23 VAL 79 0.075 17.164 4.190 100 H LEU 80 H LEU 80 0.220 21.605 4.737 101 HA LEU 80 HA LEU 80 -1.917 23.173 5.557 102 HB2 LEU 80 HB2 LEU 80 1.025 23.372 5.688 103 HB3 LEU 80 HB3 LEU 80 0.136 24.875 5.924 104 HG LEU 80 HG LEU 80 -1.144 23.705 7.750 105 HD11 LEU 80 HD11 LEU 80 -0.303 21.677 8.671 106 HD12 LEU 80 HD12 LEU 80 1.065 21.669 7.559 107 HD13 LEU 80 HD13 LEU 80 -0.568 21.407 6.948 108 HD21 LEU 80 HD21 LEU 80 1.351 24.945 7.763 109 HD22 LEU 80 HD22 LEU 80 1.541 23.525 8.792 110 HD23 LEU 80 HD23 LEU 80 0.275 24.704 9.140 111 H PHE 81 H PHE 81 0.575 23.956 3.134 112 HA PHE 81 HA PHE 81 -0.299 26.466 2.395 113 HB2 PHE 81 HB2 PHE 81 1.755 25.750 1.489 114 HB3 PHE 81 HB3 PHE 81 1.050 24.276 0.832 115 HD1 PHE 81 HD1 PHE 81 1.432 27.893 0.374 116 HD2 PHE 81 HD2 PHE 81 -0.093 24.277 -1.274 117 HE1 PHE 81 HE1 PHE 81 1.123 29.015 -1.793 118 HE2 PHE 81 HE2 PHE 81 -0.404 25.394 -3.445 119 HZ PHE 81 HZ PHE 81 0.205 27.766 -3.706 120 H LYS 82 H LYS 82 -1.193 23.378 0.852 121 HA LYS 82 HA LYS 82 -3.072 24.438 -0.930 122 HB2 LYS 82 HB2 LYS 82 -2.255 22.218 -1.278 123 HB3 LYS 82 HB3 LYS 82 -2.816 21.697 0.305 124 HG2 LYS 82 HG2 LYS 82 -5.003 22.727 -1.255 125 HG3 LYS 82 HG3 LYS 82 -4.147 21.455 -2.131 126 HD2 LYS 82 HD2 LYS 82 -5.004 21.146 0.736 127 HD3 LYS 82 HD3 LYS 82 -6.055 20.721 -0.617 128 HE2 LYS 82 HE2 LYS 82 -5.084 18.713 -0.551 129 HE3 LYS 82 HE3 LYS 82 -3.673 19.497 -1.260 130 HZ1 LYS 82 HZ1 LYS 82 -2.659 18.679 0.550 131 HZ2 LYS 82 HZ2 LYS 82 -4.090 18.530 1.439 132 HZ3 LYS 82 HZ3 LYS 82 -3.314 20.030 1.329 133 H LEU 83 H LEU 83 -3.455 23.190 2.361 134 HA LEU 83 HA LEU 83 -6.230 23.264 2.537 135 HB2 LEU 83 HB2 LEU 83 -4.311 22.508 4.207 136 HB3 LEU 83 HB3 LEU 83 -4.632 24.097 4.898 137 HG LEU 83 HG LEU 83 -6.569 21.802 4.633 138 HD11 LEU 83 HD11 LEU 83 -5.571 23.220 7.093 139 HD12 LEU 83 HD12 LEU 83 -4.870 21.728 6.468 140 HD13 LEU 83 HD13 LEU 83 -6.547 21.753 7.012 141 HD21 LEU 83 HD21 LEU 83 -7.797 23.803 4.191 142 HD22 LEU 83 HD22 LEU 83 -7.013 24.645 5.528 143 HD23 LEU 83 HD23 LEU 83 -8.131 23.320 5.854 144 H MET 84 H MET 84 -3.854 25.832 2.981 145 HA MET 84 HA MET 84 -5.733 27.774 3.893 146 HB2 MET 84 HB2 MET 84 -2.988 28.144 2.683 147 HB3 MET 84 HB3 MET 84 -3.913 29.392 3.506 148 HG2 MET 84 HG2 MET 84 -3.249 26.838 4.903 149 HG3 MET 84 HG3 MET 84 -2.056 28.129 4.779 150 HE1 MET 84 HE1 MET 84 -3.738 28.020 8.462 151 HE2 MET 84 HE2 MET 84 -3.309 26.727 7.341 152 HE3 MET 84 HE3 MET 84 -2.156 28.018 7.682 153 H ASP 85 H ASP 85 -5.131 26.414 0.876 154 HA ASP 85 HA ASP 85 -6.195 28.760 -0.542 155 HB2 ASP 85 HB2 ASP 85 -4.310 26.618 -1.266 156 HB3 ASP 85 HB3 ASP 85 -5.495 27.001 -2.512 157 H VAL 86 H VAL 86 -8.311 28.170 0.415 158 HA VAL 86 HA VAL 86 -9.661 25.786 -0.171 159 HB VAL 86 HB VAL 86 -10.425 27.450 1.505 160 HG11 VAL 86 HG11 VAL 86 -10.286 29.217 -0.672 161 HG12 VAL 86 HG12 VAL 86 -11.994 29.091 -0.247 162 HG13 VAL 86 HG13 VAL 86 -10.813 29.570 0.973 163 HG21 VAL 86 HG21 VAL 86 -12.749 27.201 -0.302 164 HG22 VAL 86 HG22 VAL 86 -11.901 25.707 0.096 165 HG23 VAL 86 HG23 VAL 86 -12.563 26.715 1.383 166 H ASP 87 H ASP 87 -8.785 28.379 -2.196 167 HA ASP 87 HA ASP 87 -10.901 28.014 -4.122 168 HB2 ASP 87 HB2 ASP 87 -9.390 29.535 -5.526 169 HB3 ASP 87 HB3 ASP 87 -10.056 30.213 -4.042 170 H GLY 88 H GLY 88 -8.281 26.202 -3.306 171 HA2 GLY 88 HA2 GLY 88 -6.994 24.625 -4.384 172 HA3 GLY 88 HA3 GLY 88 -8.459 24.352 -5.316 173 H ASP 89 H ASP 89 -6.274 27.151 -5.237 174 HA ASP 89 HA ASP 89 -6.101 27.020 -8.150 175 HB2 ASP 89 HB2 ASP 89 -4.962 29.280 -7.846 176 HB3 ASP 89 HB3 ASP 89 -6.661 29.192 -7.391 177 H GLY 90 H GLY 90 -4.268 26.269 -5.369 178 HA2 GLY 90 HA2 GLY 90 -2.237 25.148 -5.269 179 HA3 GLY 90 HA3 GLY 90 -2.071 25.357 -7.006 180 H LYS 91 H LYS 91 -2.784 28.339 -5.946 181 HA LYS 91 HA LYS 91 -0.045 29.034 -5.166 182 HB2 LYS 91 HB2 LYS 91 -0.283 31.049 -6.752 183 HB3 LYS 91 HB3 LYS 91 0.107 29.486 -7.457 184 HG2 LYS 91 HG2 LYS 91 -1.694 29.556 -8.739 185 HG3 LYS 91 HG3 LYS 91 -2.738 29.818 -7.340 186 HD2 LYS 91 HD2 LYS 91 -2.118 32.240 -7.436 187 HD3 LYS 91 HD3 LYS 91 -1.278 31.907 -8.953 188 HE2 LYS 91 HE2 LYS 91 -3.319 32.583 -9.745 189 HE3 LYS 91 HE3 LYS 91 -3.584 30.844 -9.623 190 HZ1 LYS 91 HZ1 LYS 91 -4.435 31.426 -7.277 191 HZ2 LYS 91 HZ2 LYS 91 -5.440 31.719 -8.605 192 HZ3 LYS 91 HZ3 LYS 91 -4.596 32.996 -7.885 193 H LEU 92 H LEU 92 0.070 30.579 -3.638 194 HA LEU 92 HA LEU 92 -2.453 31.728 -2.705 195 HB2 LEU 92 HB2 LEU 92 -1.425 32.051 -0.618 196 HB3 LEU 92 HB3 LEU 92 -0.898 30.463 -1.173 197 HG LEU 92 HG LEU 92 1.178 31.876 -2.040 198 HD11 LEU 92 HD11 LEU 92 1.624 33.823 -0.969 199 HD12 LEU 92 HD12 LEU 92 0.740 33.359 0.484 200 HD13 LEU 92 HD13 LEU 92 -0.137 33.916 -0.941 201 HD21 LEU 92 HD21 LEU 92 1.798 31.541 0.652 202 HD22 LEU 92 HD22 LEU 92 2.032 30.370 -0.646 203 HD23 LEU 92 HD23 LEU 92 0.555 30.334 0.320 204 H THR 93 H THR 93 -2.798 33.909 -2.491 205 HA THR 93 HA THR 93 -1.039 35.617 -4.070 206 HB THR 93 HB THR 93 -3.422 35.742 -4.564 207 HG1 THR 93 HG1 THR 93 -3.640 38.071 -4.178 208 HG21 THR 93 HG21 THR 93 -4.378 37.168 -2.284 209 HG22 THR 93 HG22 THR 93 -3.693 35.634 -1.746 210 HG23 THR 93 HG23 THR 93 -4.968 35.653 -2.964 211 H LYS 94 H LYS 94 -0.409 37.733 -3.302 212 HA LYS 94 HA LYS 94 1.063 37.854 -1.064 213 HB2 LYS 94 HB2 LYS 94 0.646 39.652 -2.889 214 HB3 LYS 94 HB3 LYS 94 -0.581 40.263 -1.787 215 HG2 LYS 94 HG2 LYS 94 1.437 40.118 -0.070 216 HG3 LYS 94 HG3 LYS 94 2.371 40.301 -1.557 217 HD2 LYS 94 HD2 LYS 94 0.156 42.139 -0.648 218 HD3 LYS 94 HD3 LYS 94 1.883 42.464 -0.484 219 HE2 LYS 94 HE2 LYS 94 1.783 43.423 -2.491 220 HE3 LYS 94 HE3 LYS 94 1.558 41.807 -3.160 221 HZ1 LYS 94 HZ1 LYS 94 -0.397 42.519 -3.888 222 HZ2 LYS 94 HZ2 LYS 94 -0.289 43.964 -3.016 223 HZ3 LYS 94 HZ3 LYS 94 -0.927 42.579 -2.282 224 H GLU 95 H GLU 95 -2.338 38.921 -1.179 225 HA GLU 95 HA GLU 95 -2.654 39.581 1.488 226 HB2 GLU 95 HB2 GLU 95 -4.759 38.252 -0.223 227 HB3 GLU 95 HB3 GLU 95 -5.026 39.308 1.158 228 HG2 GLU 95 HG2 GLU 95 -3.436 40.746 -0.664 229 HG3 GLU 95 HG3 GLU 95 -4.722 39.982 -1.596 230 H GLU 96 H GLU 96 -3.053 36.420 -0.071 231 HA GLU 96 HA GLU 96 -3.933 35.017 2.197 232 HB2 GLU 96 HB2 GLU 96 -3.984 34.240 -0.217 233 HB3 GLU 96 HB3 GLU 96 -2.279 33.852 -0.041 234 HG2 GLU 96 HG2 GLU 96 -2.695 32.140 1.476 235 HG3 GLU 96 HG3 GLU 96 -4.311 32.736 1.848 236 H VAL 97 H VAL 97 -0.671 35.470 0.866 237 HA VAL 97 HA VAL 97 0.746 33.888 2.658 238 HB VAL 97 HB VAL 97 1.421 35.586 0.587 239 HG11 VAL 97 HG11 VAL 97 3.088 37.113 1.431 240 HG12 VAL 97 HG12 VAL 97 1.538 37.458 2.199 241 HG13 VAL 97 HG13 VAL 97 2.787 36.581 3.084 242 HG21 VAL 97 HG21 VAL 97 2.429 33.383 1.588 243 HG22 VAL 97 HG22 VAL 97 3.424 34.457 0.605 244 HG23 VAL 97 HG23 VAL 97 3.555 34.497 2.363 245 H THR 98 H THR 98 -0.539 37.123 3.029 246 HA THR 98 HA THR 98 0.890 37.739 5.424 247 HB THR 98 HB THR 98 -1.684 38.981 4.439 248 HG1 THR 98 HG1 THR 98 0.856 40.116 4.016 249 HG21 THR 98 HG21 THR 98 -1.026 39.452 6.801 250 HG22 THR 98 HG22 THR 98 -1.060 40.883 5.771 251 HG23 THR 98 HG23 THR 98 0.481 40.138 6.194 252 H SER 99 H SER 99 -2.271 36.364 4.691 253 HA SER 99 HA SER 99 -3.245 36.415 7.361 254 HB2 SER 99 HB2 SER 99 -4.387 35.943 4.932 255 HB3 SER 99 HB3 SER 99 -4.293 34.307 5.582 256 HG SER 99 HG SER 99 -5.191 35.572 7.571 257 H PHE 100 H PHE 100 -1.543 34.013 5.416 258 HA PHE 100 HA PHE 100 -1.741 31.895 7.288 259 HB2 PHE 100 HB2 PHE 100 -1.241 31.325 5.030 260 HB3 PHE 100 HB3 PHE 100 0.140 32.417 4.988 261 HD1 PHE 100 HD2 PHE 100 -1.102 29.183 6.184 262 HD2 PHE 100 HD1 PHE 100 2.261 31.778 5.904 263 HE1 PHE 100 HE2 PHE 100 0.379 27.328 6.829 264 HE2 PHE 100 HE1 PHE 100 3.747 29.926 6.548 265 HZ PHE 100 HZ PHE 100 2.806 27.698 7.013 266 H PHE 101 H PHE 101 0.784 34.296 6.628 267 HA PHE 101 HA PHE 101 2.517 33.319 8.690 268 HB2 PHE 101 HB2 PHE 101 2.681 35.199 6.547 269 HB3 PHE 101 HB3 PHE 101 3.154 36.015 8.033 270 HD1 PHE 101 HD2 PHE 101 5.104 35.278 9.292 271 HD2 PHE 101 HD1 PHE 101 4.006 33.429 5.619 272 HE1 PHE 101 HE2 PHE 101 7.332 34.245 9.150 273 HE2 PHE 101 HE1 PHE 101 6.233 32.393 5.471 274 HZ PHE 101 HZ PHE 101 7.900 32.801 7.237 275 H LYS 102 H LYS 102 -0.092 35.582 8.511 276 HA LYS 102 HA LYS 102 0.417 37.280 10.632 277 HB2 LYS 102 HB2 LYS 102 -1.928 36.396 9.146 278 HB3 LYS 102 HB3 LYS 102 -2.307 36.767 10.823 279 HG2 LYS 102 HG2 LYS 102 -0.857 38.637 8.964 280 HG3 LYS 102 HG3 LYS 102 -2.596 38.677 9.266 281 HD2 LYS 102 HD2 LYS 102 -1.517 38.666 11.801 282 HD3 LYS 102 HD3 LYS 102 -0.389 39.672 10.891 283 HE2 LYS 102 HE2 LYS 102 -1.823 41.353 11.151 284 HE3 LYS 102 HE3 LYS 102 -2.911 40.501 10.057 285 HZ1 LYS 102 HZ1 LYS 102 -4.246 39.874 11.734 286 HZ2 LYS 102 HZ2 LYS 102 -3.558 41.189 12.545 287 HZ3 LYS 102 HZ3 LYS 102 -2.974 39.625 12.822 288 H LYS 103 H LYS 103 -0.510 33.928 10.662 289 HA LYS 103 HA LYS 103 -1.520 33.662 13.238 290 HB2 LYS 103 HB2 LYS 103 -1.141 31.936 11.249 291 HB3 LYS 103 HB3 LYS 103 0.290 31.538 12.190 292 HG2 LYS 103 HG2 LYS 103 -1.224 31.206 14.165 293 HG3 LYS 103 HG3 LYS 103 -2.584 31.359 13.051 294 HD2 LYS 103 HD2 LYS 103 -2.102 29.025 13.370 295 HD3 LYS 103 HD3 LYS 103 -1.641 29.479 11.728 296 HE2 LYS 103 HE2 LYS 103 0.627 29.368 12.201 297 HE3 LYS 103 HE3 LYS 103 0.377 29.556 13.935 298 HZ1 LYS 103 HZ1 LYS 103 -0.783 27.182 12.723 299 HZ2 LYS 103 HZ2 LYS 103 0.003 27.365 14.209 300 HZ3 LYS 103 HZ3 LYS 103 0.907 27.227 12.785 301 H HIS 104 H HIS 104 1.749 34.124 12.145 302 HA HIS 104 HA HIS 104 2.844 33.522 14.781 303 HB2 HIS 104 HB2 HIS 104 3.850 33.188 12.241 304 HB3 HIS 104 HB3 HIS 104 4.675 34.645 12.787 305 HD1 HIS 104 HD1 HIS 104 6.002 31.783 12.335 306 HD2 HIS 104 HD2 HIS 104 4.922 33.458 15.981 307 HE1 HIS 104 HE1 HIS 104 7.433 30.634 14.054 308 H GLY 105 H GLY 105 1.675 36.178 13.017 309 HA2 GLY 105 HA2 GLY 105 1.377 38.351 13.794 310 HA3 GLY 105 HA3 GLY 105 2.428 37.981 15.153 311 H ILE 106 H ILE 106 3.957 36.985 12.389 312 HA ILE 106 HA ILE 106 5.780 39.229 12.493 313 HB ILE 106 HB ILE 106 5.846 36.724 10.808 314 HG12 ILE 106 HG12 ILE 106 7.833 37.242 12.945 315 HG13 ILE 106 HG13 ILE 106 6.198 36.867 13.480 316 HG21 ILE 106 HG21 ILE 106 7.236 37.986 9.558 317 HG22 ILE 106 HG22 ILE 106 7.532 39.139 10.858 318 HG23 ILE 106 HG23 ILE 106 8.390 37.598 10.834 319 HD11 ILE 106 HD11 ILE 106 7.108 34.781 13.416 320 HD12 ILE 106 HD12 ILE 106 6.456 34.882 11.780 321 HD13 ILE 106 HD13 ILE 106 8.173 35.164 12.064 322 H GLU 107 H GLU 107 5.867 40.883 11.110 323 HA GLU 107 HA GLU 107 3.982 40.905 8.872 324 HB2 GLU 107 HB2 GLU 107 3.745 42.802 10.291 325 HB3 GLU 107 HB3 GLU 107 5.480 43.089 10.312 326 HG2 GLU 107 HG2 GLU 107 5.418 43.705 7.957 327 HG3 GLU 107 HG3 GLU 107 3.683 43.395 7.917 328 H LYS 108 H LYS 108 7.306 40.576 9.528 329 HA LYS 108 HA LYS 108 8.531 41.737 7.326 330 HB2 LYS 108 HB2 LYS 108 9.272 39.148 8.702 331 HB3 LYS 108 HB3 LYS 108 10.329 40.087 7.656 332 HG2 LYS 108 HG2 LYS 108 9.208 40.947 10.314 333 HG3 LYS 108 HG3 LYS 108 10.880 40.502 9.961 334 HD2 LYS 108 HD2 LYS 108 10.994 42.400 8.366 335 HD3 LYS 108 HD3 LYS 108 9.367 42.871 8.862 336 HE2 LYS 108 HE2 LYS 108 11.725 42.635 10.727 337 HE3 LYS 108 HE3 LYS 108 11.178 44.144 9.997 338 HZ1 LYS 108 HZ1 LYS 108 10.364 43.333 12.369 339 HZ2 LYS 108 HZ2 LYS 108 9.182 42.573 11.427 340 HZ3 LYS 108 HZ3 LYS 108 9.382 44.251 11.342 341 H VAL 109 H VAL 109 6.551 38.904 7.523 342 HA VAL 109 HA VAL 109 7.329 37.432 5.324 343 HB VAL 109 HB VAL 109 5.595 36.631 6.806 344 HG11 VAL 109 HG11 VAL 109 4.501 38.712 7.354 345 HG12 VAL 109 HG12 VAL 109 3.918 38.880 5.696 346 HG13 VAL 109 HG13 VAL 109 3.312 37.576 6.718 347 HG21 VAL 109 HG21 VAL 109 4.513 37.017 4.016 348 HG22 VAL 109 HG22 VAL 109 5.639 35.756 4.517 349 HG23 VAL 109 HG23 VAL 109 4.001 35.783 5.167 350 H ALA 110 H ALA 110 5.645 40.481 5.437 351 HA ALA 110 HA ALA 110 4.642 40.485 2.792 352 HB1 ALA 110 HB1 ALA 110 3.696 42.372 3.475 353 HB2 ALA 110 HB2 ALA 110 4.557 42.204 5.006 354 HB3 ALA 110 HB3 ALA 110 5.271 43.137 3.690 355 H GLU 111 H GLU 111 7.637 41.751 4.217 356 HA GLU 111 HA GLU 111 8.627 42.800 1.755 357 HB2 GLU 111 HB2 GLU 111 9.281 43.480 4.145 358 HB3 GLU 111 HB3 GLU 111 10.324 42.066 4.130 359 HG2 GLU 111 HG2 GLU 111 11.528 44.117 3.565 360 HG3 GLU 111 HG3 GLU 111 11.557 42.943 2.251 361 H GLN 112 H GLN 112 8.894 39.740 3.428 362 HA GLN 112 HA GLN 112 11.043 38.709 1.871 363 HB2 GLN 112 HB2 GLN 112 8.940 37.231 3.462 364 HB3 GLN 112 HB3 GLN 112 10.436 36.540 2.849 365 HG2 GLN 112 HG2 GLN 112 10.603 38.925 4.610 366 HG3 GLN 112 HG3 GLN 112 10.208 37.367 5.335 367 HE21 GLN 112 HE21 GLN 112 12.072 37.028 6.426 368 HE22 GLN 112 HE22 GLN 112 13.612 36.819 5.670 369 H VAL 113 H VAL 113 7.517 38.364 1.718 370 HA VAL 113 HA VAL 113 7.519 36.596 -0.506 371 HB VAL 113 HB VAL 113 5.612 36.880 1.098 372 HG11 VAL 113 HG11 VAL 113 4.018 38.703 0.666 373 HG12 VAL 113 HG12 VAL 113 5.580 39.303 1.227 374 HG13 VAL 113 HG13 VAL 113 5.155 39.409 -0.482 375 HG21 VAL 113 HG21 VAL 113 5.018 35.623 -0.736 376 HG22 VAL 113 HG22 VAL 113 3.861 36.949 -0.846 377 HG23 VAL 113 HG23 VAL 113 5.297 36.945 -1.869 378 H MET 114 H MET 114 7.541 40.074 -0.162 379 HA MET 114 HA MET 114 6.882 40.606 -2.905 380 HB2 MET 114 HB2 MET 114 7.567 42.191 -0.508 381 HB3 MET 114 HB3 MET 114 8.027 42.911 -2.045 382 HG2 MET 114 HG2 MET 114 5.316 41.851 -2.042 383 HG3 MET 114 HG3 MET 114 5.577 43.112 -0.839 384 HE1 MET 114 HE1 MET 114 7.734 43.469 -4.361 385 HE2 MET 114 HE2 MET 114 6.643 42.087 -4.278 386 HE3 MET 114 HE3 MET 114 6.265 43.447 -5.337 387 H LYS 115 H LYS 115 9.822 40.282 -1.013 388 HA LYS 115 HA LYS 115 11.516 41.118 -3.206 389 HB2 LYS 115 HB2 LYS 115 12.117 40.017 -0.459 390 HB3 LYS 115 HB3 LYS 115 13.365 40.428 -1.629 391 HG2 LYS 115 HG2 LYS 115 11.321 42.366 -0.565 392 HG3 LYS 115 HG3 LYS 115 12.963 42.188 0.059 393 HD2 LYS 115 HD2 LYS 115 12.247 42.927 -2.779 394 HD3 LYS 115 HD3 LYS 115 12.753 44.064 -1.528 395 HE2 LYS 115 HE2 LYS 115 14.879 42.780 -1.320 396 HE3 LYS 115 HE3 LYS 115 14.370 41.803 -2.697 397 HZ1 LYS 115 HZ1 LYS 115 15.802 43.515 -3.481 398 HZ2 LYS 115 HZ2 LYS 115 14.923 44.718 -2.680 399 HZ3 LYS 115 HZ3 LYS 115 14.235 43.899 -3.991 400 H ALA 116 H ALA 116 10.152 38.201 -2.005 401 HA ALA 116 HA ALA 116 12.092 36.474 -3.289 402 HB1 ALA 116 HB1 ALA 116 9.463 35.772 -1.989 403 HB2 ALA 116 HB2 ALA 116 10.734 34.644 -2.461 404 HB3 ALA 116 HB3 ALA 116 11.026 35.813 -1.173 405 H ASP 117 H ASP 117 9.246 38.123 -4.161 406 HA ASP 117 HA ASP 117 8.429 36.279 -6.227 407 HB2 ASP 117 HB2 ASP 117 7.086 38.174 -4.837 408 HB3 ASP 117 HB3 ASP 117 7.450 39.070 -6.309 409 H ALA 118 H ALA 118 10.414 36.141 -7.408 410 HA ALA 118 HA ALA 118 11.550 38.457 -8.653 411 HB1 ALA 118 HB1 ALA 118 12.279 36.018 -9.978 412 HB2 ALA 118 HB2 ALA 118 13.268 37.093 -8.989 413 HB3 ALA 118 HB3 ALA 118 12.338 35.801 -8.229 414 H ASN 119 H ASN 119 8.915 36.412 -9.354 415 HA ASN 119 HA ASN 119 8.938 37.111 -12.198 416 HB2 ASN 119 HB2 ASN 119 6.827 35.553 -12.110 417 HB3 ASN 119 HB3 ASN 119 8.442 34.853 -12.066 418 HD21 ASN 119 HD21 ASN 119 7.829 33.015 -10.995 419 HD22 ASN 119 HD22 ASN 119 7.326 33.010 -9.342 420 H GLY 120 H GLY 120 7.855 38.408 -9.382 421 HA2 GLY 120 HA2 GLY 120 6.183 39.882 -8.805 422 HA3 GLY 120 HA3 GLY 120 6.381 40.455 -10.455 423 H ASP 121 H ASP 121 5.291 37.218 -9.732 424 HA ASP 121 HA ASP 121 2.946 37.546 -11.310 425 HB2 ASP 121 HB2 ASP 121 2.396 35.230 -10.352 426 HB3 ASP 121 HB3 ASP 121 3.863 35.377 -11.315 427 H GLY 122 H GLY 122 3.666 38.059 -7.993 428 HA2 GLY 122 HA2 GLY 122 2.316 39.115 -6.418 429 HA3 GLY 122 HA3 GLY 122 0.953 38.949 -7.515 430 H TYR 123 H TYR 123 2.299 35.978 -7.408 431 HA TYR 123 HA TYR 123 1.059 35.117 -4.917 432 HB2 TYR 123 HB2 TYR 123 -0.212 33.320 -6.155 433 HB3 TYR 123 HB3 TYR 123 -0.826 34.955 -6.370 434 HD1 TYR 123 HD1 TYR 123 1.554 32.572 -7.994 435 HD2 TYR 123 HD2 TYR 123 -1.344 35.644 -8.511 436 HE1 TYR 123 HE1 TYR 123 1.714 32.304 -10.433 437 HE2 TYR 123 HE2 TYR 123 -1.193 35.383 -10.952 438 HH TYR 123 HH TYR 123 0.832 32.872 -12.410 439 H ILE 124 H ILE 124 1.598 32.922 -4.335 440 HA ILE 124 HA ILE 124 3.977 31.904 -5.748 441 HB ILE 124 HB ILE 124 5.189 31.900 -3.882 442 HG12 ILE 124 HG12 ILE 124 2.778 30.780 -2.435 443 HG13 ILE 124 HG13 ILE 124 4.081 29.843 -3.158 444 HG21 ILE 124 HG21 ILE 124 2.873 33.270 -2.527 445 HG22 ILE 124 HG22 ILE 124 4.585 33.411 -2.130 446 HG23 ILE 124 HG23 ILE 124 3.975 34.067 -3.649 447 HD11 ILE 124 HD11 ILE 124 4.309 29.999 -0.740 448 HD12 ILE 124 HD12 ILE 124 5.655 30.787 -1.564 449 HD13 ILE 124 HD13 ILE 124 4.365 31.758 -0.854 450 H THR 125 H THR 125 3.950 29.819 -6.321 451 HA THR 125 HA THR 125 1.579 28.253 -5.704 452 HB THR 125 HB THR 125 2.378 28.351 -8.034 453 HG1 THR 125 HG1 THR 125 2.643 25.873 -8.142 454 HG21 THR 125 HG21 THR 125 4.818 27.013 -6.874 455 HG22 THR 125 HG22 THR 125 4.740 28.523 -7.782 456 HG23 THR 125 HG23 THR 125 4.426 26.988 -8.592 457 H LEU 126 H LEU 126 2.256 25.718 -5.659 458 HA LEU 126 HA LEU 126 3.120 25.179 -3.100 459 HB2 LEU 126 HB2 LEU 126 3.519 23.307 -5.420 460 HB3 LEU 126 HB3 LEU 126 3.260 22.889 -3.728 461 HG LEU 126 HG LEU 126 0.981 24.292 -4.370 462 HD11 LEU 126 HD11 LEU 126 0.355 24.003 -6.500 463 HD12 LEU 126 HD12 LEU 126 1.038 22.380 -6.585 464 HD13 LEU 126 HD13 LEU 126 2.077 23.786 -6.811 465 HD21 LEU 126 HD21 LEU 126 -0.069 22.359 -3.801 466 HD22 LEU 126 HD22 LEU 126 1.553 21.955 -3.240 467 HD23 LEU 126 HD23 LEU 126 0.985 21.359 -4.800 468 H GLU 127 H GLU 127 5.020 25.247 -6.087 469 HA GLU 127 HA GLU 127 7.438 24.307 -5.055 470 HB2 GLU 127 HB2 GLU 127 6.627 25.929 -7.405 471 HB3 GLU 127 HB3 GLU 127 8.323 25.992 -6.948 472 HG2 GLU 127 HG2 GLU 127 6.744 23.521 -7.620 473 HG3 GLU 127 HG3 GLU 127 7.965 24.297 -8.627 474 H GLU 128 H GLU 128 6.400 27.688 -5.521 475 HA GLU 128 HA GLU 128 8.608 28.915 -4.362 476 HB2 GLU 128 HB2 GLU 128 5.793 29.970 -4.133 477 HB3 GLU 128 HB3 GLU 128 7.288 30.891 -4.211 478 HG2 GLU 128 HG2 GLU 128 7.557 29.819 -6.542 479 HG3 GLU 128 HG3 GLU 128 5.835 29.470 -6.400 480 H PHE 129 H PHE 129 5.561 27.895 -2.849 481 HA PHE 129 HA PHE 129 6.020 28.833 -0.279 482 HB2 PHE 129 HB2 PHE 129 3.875 27.873 -1.069 483 HB3 PHE 129 HB3 PHE 129 4.604 26.271 -1.043 484 HD1 PHE 129 HD1 PHE 129 3.610 29.129 1.077 485 HD2 PHE 129 HD2 PHE 129 4.738 25.027 0.948 486 HE1 PHE 129 HE1 PHE 129 2.961 28.880 3.437 487 HE2 PHE 129 HE2 PHE 129 4.090 24.771 3.307 488 HZ PHE 129 HZ PHE 129 3.200 26.698 4.555 489 H LEU 130 H LEU 130 7.093 25.838 -1.806 490 HA LEU 130 HA LEU 130 8.250 24.754 0.572 491 HB2 LEU 130 HB2 LEU 130 7.654 23.157 -1.010 492 HB3 LEU 130 HB3 LEU 130 8.364 24.071 -2.339 493 HG LEU 130 HG LEU 130 10.614 23.503 -1.474 494 HD11 LEU 130 HD11 LEU 130 9.132 21.672 0.405 495 HD12 LEU 130 HD12 LEU 130 9.934 23.169 0.879 496 HD13 LEU 130 HD13 LEU 130 10.880 21.828 0.234 497 HD21 LEU 130 HD21 LEU 130 9.733 22.165 -3.244 498 HD22 LEU 130 HD22 LEU 130 8.743 21.231 -2.121 499 HD23 LEU 130 HD23 LEU 130 10.501 21.082 -2.082 500 H GLU 131 H GLU 131 9.242 27.069 -1.741 501 HA GLU 131 HA GLU 131 12.076 26.719 -1.300 502 HB2 GLU 131 HB2 GLU 131 10.771 27.686 -3.398 503 HB3 GLU 131 HB3 GLU 131 10.961 29.200 -2.524 504 HG2 GLU 131 HG2 GLU 131 13.289 27.398 -3.081 505 HG3 GLU 131 HG3 GLU 131 12.730 28.593 -4.251 506 H PHE 132 H PHE 132 9.497 28.386 0.197 507 HA PHE 132 HA PHE 132 11.371 30.131 1.647 508 HB2 PHE 132 HB2 PHE 132 8.365 30.387 1.620 509 HB3 PHE 132 HB3 PHE 132 9.550 31.588 2.124 510 HD1 PHE 132 HD2 PHE 132 11.450 31.227 -0.218 511 HD2 PHE 132 HD1 PHE 132 7.221 31.658 -0.004 512 HE1 PHE 132 HE2 PHE 132 11.437 32.189 -2.482 513 HE2 PHE 132 HE1 PHE 132 7.201 32.619 -2.268 514 HZ PHE 132 HZ PHE 132 9.311 32.887 -3.510 515 H SER 133 H SER 133 11.914 28.046 2.793 516 HA SER 133 HA SER 133 10.503 27.997 5.304 517 HB2 SER 133 HB2 SER 133 10.366 25.691 3.382 518 HB3 SER 133 HB3 SER 133 10.319 25.405 5.122 519 HG SER 133 HG SER 133 8.501 26.865 3.525 520 H LEU 134 H LEU 134 12.455 28.614 6.208 521 HA LEU 134 HA LEU 134 14.159 26.633 7.131 522 HB2 LEU 134 HB2 LEU 134 14.732 27.253 4.476 523 HB3 LEU 134 HB3 LEU 134 15.953 28.113 5.413 524 HG LEU 134 HG LEU 134 15.505 25.252 6.060 525 HD11 LEU 134 HD11 LEU 134 16.317 24.363 4.164 526 HD12 LEU 134 HD12 LEU 134 17.400 25.722 3.864 527 HD13 LEU 134 HD13 LEU 134 15.695 25.841 3.429 528 HD21 LEU 134 HD21 LEU 134 18.202 26.267 5.625 529 HD22 LEU 134 HD22 LEU 134 17.509 25.451 7.027 530 HD23 LEU 134 HD23 LEU 134 17.294 27.191 6.822 Start of MODEL 2 1 H GLY 67 H GLY 67 6.784 1.595 0.616 2 HA2 GLY 67 HA2 GLY 67 8.669 1.716 -0.726 3 HA3 GLY 67 HA3 GLY 67 7.659 1.349 -2.117 4 H GLN 68 H GLN 68 5.850 3.638 -1.230 5 HA GLN 68 HA GLN 68 7.010 5.613 -2.910 6 HB2 GLN 68 HB2 GLN 68 4.503 5.248 -1.433 7 HB3 GLN 68 HB3 GLN 68 5.018 6.926 -1.550 8 HG2 GLN 68 HG2 GLN 68 3.476 6.105 -3.361 9 HG3 GLN 68 HG3 GLN 68 4.960 6.889 -3.900 10 HE21 GLN 68 HE21 GLN 68 3.419 3.771 -3.385 11 HE22 GLN 68 HE22 GLN 68 4.346 2.910 -4.559 12 H ASP 69 H ASP 69 8.393 7.182 -2.434 13 HA ASP 69 HA ASP 69 9.498 7.475 0.153 14 HB2 ASP 69 HB2 ASP 69 9.879 8.711 -2.497 15 HB3 ASP 69 HB3 ASP 69 10.292 9.743 -1.131 16 H LEU 70 H LEU 70 9.132 8.925 1.755 17 HA LEU 70 HA LEU 70 6.617 10.144 1.976 18 HB2 LEU 70 HB2 LEU 70 8.821 9.676 3.633 19 HB3 LEU 70 HB3 LEU 70 8.585 11.422 3.650 20 HG LEU 70 HG LEU 70 6.068 10.087 4.021 21 HD11 LEU 70 HD11 LEU 70 6.392 8.760 5.870 22 HD12 LEU 70 HD12 LEU 70 7.946 9.497 6.262 23 HD13 LEU 70 HD13 LEU 70 7.821 8.371 4.910 24 HD21 LEU 70 HD21 LEU 70 6.049 12.197 4.845 25 HD22 LEU 70 HD22 LEU 70 7.746 12.147 5.322 26 HD23 LEU 70 HD23 LEU 70 6.525 11.362 6.323 27 H SER 71 H SER 71 6.906 12.662 2.932 28 HA SER 71 HA SER 71 7.759 14.149 0.541 29 HB2 SER 71 HB2 SER 71 5.470 14.414 2.402 30 HB3 SER 71 HB3 SER 71 6.200 15.924 1.859 31 HG SER 71 HG SER 71 5.592 13.916 -0.009 32 H ASP 72 H ASP 72 9.086 15.908 0.711 33 HA ASP 72 HA ASP 72 11.114 16.072 2.442 34 HB2 ASP 72 HB2 ASP 72 9.719 18.073 0.791 35 HB3 ASP 72 HB3 ASP 72 10.686 18.746 2.100 36 H ASP 73 H ASP 73 11.638 17.151 4.370 37 HA ASP 73 HA ASP 73 9.962 16.894 6.500 38 HB2 ASP 73 HB2 ASP 73 11.989 19.125 6.283 39 HB3 ASP 73 HB3 ASP 73 11.437 18.318 7.748 40 H LYS 74 H LYS 74 9.884 19.353 4.092 41 HA LYS 74 HA LYS 74 8.289 21.191 5.654 42 HB2 LYS 74 HB2 LYS 74 8.163 22.493 3.558 43 HB3 LYS 74 HB3 LYS 74 9.818 22.097 4.002 44 HG2 LYS 74 HG2 LYS 74 10.021 21.462 1.872 45 HG3 LYS 74 HG3 LYS 74 9.173 20.002 2.389 46 HD2 LYS 74 HD2 LYS 74 7.111 21.740 1.911 47 HD3 LYS 74 HD3 LYS 74 8.278 22.190 0.665 48 HE2 LYS 74 HE2 LYS 74 8.188 19.361 0.782 49 HE3 LYS 74 HE3 LYS 74 6.525 19.945 0.753 50 HZ1 LYS 74 HZ1 LYS 74 7.099 19.748 -1.473 51 HZ2 LYS 74 HZ2 LYS 74 8.658 20.363 -1.245 52 HZ3 LYS 74 HZ3 LYS 74 7.322 21.398 -1.171 53 H ILE 75 H ILE 75 7.508 18.309 4.697 54 HA ILE 75 HA ILE 75 5.369 18.374 2.966 55 HB ILE 75 HB ILE 75 6.210 16.276 3.809 56 HG12 ILE 75 HG12 ILE 75 3.332 16.745 4.616 57 HG13 ILE 75 HG13 ILE 75 3.904 16.280 3.017 58 HG21 ILE 75 HG21 ILE 75 6.689 17.154 6.111 59 HG22 ILE 75 HG22 ILE 75 4.978 16.933 6.476 60 HG23 ILE 75 HG23 ILE 75 5.977 15.541 6.060 61 HD11 ILE 75 HD11 ILE 75 3.556 14.181 3.621 62 HD12 ILE 75 HD12 ILE 75 4.924 14.341 4.723 63 HD13 ILE 75 HD13 ILE 75 3.285 14.642 5.301 64 H GLY 76 H GLY 76 5.421 19.150 6.416 65 HA2 GLY 76 HA2 GLY 76 2.648 19.408 6.796 66 HA3 GLY 76 HA3 GLY 76 3.886 20.197 7.763 67 H LEU 77 H LEU 77 5.077 21.824 5.861 68 HA LEU 77 HA LEU 77 3.320 24.027 5.839 69 HB2 LEU 77 HB2 LEU 77 5.911 23.512 4.398 70 HB3 LEU 77 HB3 LEU 77 5.060 25.054 4.335 71 HG LEU 77 HG LEU 77 5.717 23.979 7.020 72 HD11 LEU 77 HD11 LEU 77 7.871 23.671 6.514 73 HD12 LEU 77 HD12 LEU 77 7.960 25.429 6.418 74 HD13 LEU 77 HD13 LEU 77 7.716 24.477 4.953 75 HD21 LEU 77 HD21 LEU 77 6.026 26.317 7.518 76 HD22 LEU 77 HD22 LEU 77 4.500 26.101 6.661 77 HD23 LEU 77 HD23 LEU 77 5.909 26.734 5.809 78 H LYS 78 H LYS 78 4.462 21.915 3.216 79 HA LYS 78 HA LYS 78 3.064 23.146 1.128 80 HB2 LYS 78 HB2 LYS 78 4.622 20.773 1.507 81 HB3 LYS 78 HB3 LYS 78 3.168 20.360 0.605 82 HG2 LYS 78 HG2 LYS 78 4.212 22.754 -0.491 83 HG3 LYS 78 HG3 LYS 78 5.542 21.605 -0.322 84 HD2 LYS 78 HD2 LYS 78 3.885 19.916 -1.385 85 HD3 LYS 78 HD3 LYS 78 3.014 21.357 -1.910 86 HE2 LYS 78 HE2 LYS 78 5.408 22.092 -2.726 87 HE3 LYS 78 HE3 LYS 78 5.701 20.353 -2.716 88 HZ1 LYS 78 HZ1 LYS 78 3.221 21.005 -3.963 89 HZ2 LYS 78 HZ2 LYS 78 4.520 20.106 -4.564 90 HZ3 LYS 78 HZ3 LYS 78 4.514 21.790 -4.719 91 H VAL 79 H VAL 79 2.135 20.418 3.207 92 HA VAL 79 HA VAL 79 -0.334 19.856 2.031 93 HB VAL 79 HB VAL 79 0.592 19.517 4.882 94 HG11 VAL 79 HG11 VAL 79 -1.339 17.919 5.063 95 HG12 VAL 79 HG12 VAL 79 -1.781 19.627 5.006 96 HG13 VAL 79 HG13 VAL 79 -1.966 18.618 3.571 97 HG21 VAL 79 HG21 VAL 79 1.228 18.160 2.530 98 HG22 VAL 79 HG22 VAL 79 1.552 17.635 4.182 99 HG23 VAL 79 HG23 VAL 79 0.077 17.117 3.366 100 H LEU 80 H LEU 80 0.335 21.855 4.910 101 HA LEU 80 HA LEU 80 -2.285 22.753 5.298 102 HB2 LEU 80 HB2 LEU 80 0.412 23.674 6.127 103 HB3 LEU 80 HB3 LEU 80 -0.931 24.801 6.310 104 HG LEU 80 HG LEU 80 -0.804 22.048 7.540 105 HD11 LEU 80 HD11 LEU 80 0.337 22.905 9.235 106 HD12 LEU 80 HD12 LEU 80 -0.827 24.217 9.409 107 HD13 LEU 80 HD13 LEU 80 0.536 24.391 8.306 108 HD21 LEU 80 HD21 LEU 80 -2.899 24.071 7.272 109 HD22 LEU 80 HD22 LEU 80 -2.638 23.519 8.927 110 HD23 LEU 80 HD23 LEU 80 -3.020 22.354 7.657 111 H PHE 81 H PHE 81 0.340 24.055 3.332 112 HA PHE 81 HA PHE 81 -0.781 26.505 2.639 113 HB2 PHE 81 HB2 PHE 81 1.485 26.120 2.050 114 HB3 PHE 81 HB3 PHE 81 1.083 24.661 1.151 115 HD1 PHE 81 HD2 PHE 81 0.139 24.792 -1.079 116 HD2 PHE 81 HD1 PHE 81 1.180 28.305 1.087 117 HE1 PHE 81 HE2 PHE 81 0.003 26.107 -3.154 118 HE2 PHE 81 HE1 PHE 81 1.045 29.626 -0.985 119 HZ PHE 81 HZ PHE 81 0.458 28.527 -3.109 120 H LYS 82 H LYS 82 -0.966 23.425 0.855 121 HA LYS 82 HA LYS 82 -2.794 24.397 -1.086 122 HB2 LYS 82 HB2 LYS 82 -1.303 22.431 -1.415 123 HB3 LYS 82 HB3 LYS 82 -2.281 21.534 -0.262 124 HG2 LYS 82 HG2 LYS 82 -4.018 22.621 -2.223 125 HG3 LYS 82 HG3 LYS 82 -2.668 21.841 -3.050 126 HD2 LYS 82 HD2 LYS 82 -3.809 20.336 -0.790 127 HD3 LYS 82 HD3 LYS 82 -4.878 20.541 -2.179 128 HE2 LYS 82 HE2 LYS 82 -3.058 19.669 -3.631 129 HE3 LYS 82 HE3 LYS 82 -2.106 19.353 -2.182 130 HZ1 LYS 82 HZ1 LYS 82 -4.308 18.078 -1.527 131 HZ2 LYS 82 HZ2 LYS 82 -3.080 17.339 -2.424 132 HZ3 LYS 82 HZ3 LYS 82 -4.449 17.949 -3.208 133 H LEU 83 H LEU 83 -3.192 22.508 1.887 134 HA LEU 83 HA LEU 83 -5.920 21.981 1.689 135 HB2 LEU 83 HB2 LEU 83 -4.120 21.215 3.415 136 HB3 LEU 83 HB3 LEU 83 -4.663 22.625 4.323 137 HG LEU 83 HG LEU 83 -6.376 20.281 3.495 138 HD11 LEU 83 HD11 LEU 83 -6.281 19.536 5.693 139 HD12 LEU 83 HD12 LEU 83 -5.677 21.079 6.296 140 HD13 LEU 83 HD13 LEU 83 -4.619 20.022 5.361 141 HD21 LEU 83 HD21 LEU 83 -7.841 22.085 3.534 142 HD22 LEU 83 HD22 LEU 83 -6.985 22.881 4.854 143 HD23 LEU 83 HD23 LEU 83 -7.953 21.441 5.172 144 H MET 84 H MET 84 -4.235 24.801 3.007 145 HA MET 84 HA MET 84 -6.600 26.109 3.909 146 HB2 MET 84 HB2 MET 84 -3.822 27.151 3.339 147 HB3 MET 84 HB3 MET 84 -5.104 28.121 4.049 148 HG2 MET 84 HG2 MET 84 -4.280 25.537 5.302 149 HG3 MET 84 HG3 MET 84 -3.360 27.013 5.585 150 HE1 MET 84 HE1 MET 84 -4.987 24.845 7.131 151 HE2 MET 84 HE2 MET 84 -5.095 25.850 8.577 152 HE3 MET 84 HE3 MET 84 -6.565 25.317 7.763 153 H ASP 85 H ASP 85 -5.342 25.564 0.843 154 HA ASP 85 HA ASP 85 -6.384 28.010 -0.337 155 HB2 ASP 85 HB2 ASP 85 -4.568 25.874 -1.160 156 HB3 ASP 85 HB3 ASP 85 -5.705 26.329 -2.426 157 H VAL 86 H VAL 86 -8.556 27.292 0.611 158 HA VAL 86 HA VAL 86 -10.017 25.156 -0.436 159 HB VAL 86 HB VAL 86 -11.165 27.824 0.384 160 HG11 VAL 86 HG11 VAL 86 -12.854 26.521 -0.618 161 HG12 VAL 86 HG12 VAL 86 -12.294 25.046 0.173 162 HG13 VAL 86 HG13 VAL 86 -13.068 26.317 1.121 163 HG21 VAL 86 HG21 VAL 86 -10.185 27.423 2.359 164 HG22 VAL 86 HG22 VAL 86 -11.425 26.183 2.554 165 HG23 VAL 86 HG23 VAL 86 -9.827 25.746 1.948 166 H ASP 87 H ASP 87 -9.024 28.075 -1.908 167 HA ASP 87 HA ASP 87 -11.116 28.151 -3.893 168 HB2 ASP 87 HB2 ASP 87 -9.508 29.861 -4.958 169 HB3 ASP 87 HB3 ASP 87 -10.234 30.271 -3.407 170 H GLY 88 H GLY 88 -8.555 26.143 -3.419 171 HA2 GLY 88 HA2 GLY 88 -7.322 24.743 -4.765 172 HA3 GLY 88 HA3 GLY 88 -8.755 24.750 -5.782 173 H ASP 89 H ASP 89 -6.441 27.341 -5.037 174 HA ASP 89 HA ASP 89 -6.116 27.773 -7.915 175 HB2 ASP 89 HB2 ASP 89 -4.989 29.922 -7.121 176 HB3 ASP 89 HB3 ASP 89 -6.719 29.781 -6.820 177 H GLY 90 H GLY 90 -4.420 26.667 -5.117 178 HA2 GLY 90 HA2 GLY 90 -2.376 25.606 -4.973 179 HA3 GLY 90 HA3 GLY 90 -2.204 25.796 -6.712 180 H LYS 91 H LYS 91 -2.904 28.777 -5.489 181 HA LYS 91 HA LYS 91 -0.164 29.454 -4.755 182 HB2 LYS 91 HB2 LYS 91 -0.247 31.407 -6.372 183 HB3 LYS 91 HB3 LYS 91 -0.019 29.818 -7.090 184 HG2 LYS 91 HG2 LYS 91 -1.777 30.145 -8.386 185 HG3 LYS 91 HG3 LYS 91 -2.805 30.328 -6.963 186 HD2 LYS 91 HD2 LYS 91 -2.293 32.701 -6.867 187 HD3 LYS 91 HD3 LYS 91 -1.189 32.537 -8.234 188 HE2 LYS 91 HE2 LYS 91 -4.139 31.924 -8.334 189 HE3 LYS 91 HE3 LYS 91 -3.422 33.451 -8.842 190 HZ1 LYS 91 HZ1 LYS 91 -3.854 31.805 -10.656 191 HZ2 LYS 91 HZ2 LYS 91 -2.632 30.839 -9.995 192 HZ3 LYS 91 HZ3 LYS 91 -2.265 32.382 -10.581 193 H LEU 92 H LEU 92 -0.020 31.138 -3.349 194 HA LEU 92 HA LEU 92 -2.554 32.240 -2.391 195 HB2 LEU 92 HB2 LEU 92 0.159 31.868 -1.221 196 HB3 LEU 92 HB3 LEU 92 -0.873 33.141 -0.575 197 HG LEU 92 HG LEU 92 -2.401 31.634 0.303 198 HD11 LEU 92 HD11 LEU 92 -2.976 30.258 -1.482 199 HD12 LEU 92 HD12 LEU 92 -2.239 29.148 -0.327 200 HD13 LEU 92 HD13 LEU 92 -1.317 29.710 -1.721 201 HD21 LEU 92 HD21 LEU 92 0.416 30.726 0.549 202 HD22 LEU 92 HD22 LEU 92 -0.848 29.684 1.203 203 HD23 LEU 92 HD23 LEU 92 -0.689 31.344 1.778 204 H THR 93 H THR 93 -2.948 34.434 -2.206 205 HA THR 93 HA THR 93 -1.349 36.116 -3.977 206 HB THR 93 HB THR 93 -3.924 36.908 -2.626 207 HG1 THR 93 HG1 THR 93 -3.847 34.874 -4.085 208 HG21 THR 93 HG21 THR 93 -3.033 38.813 -3.588 209 HG22 THR 93 HG22 THR 93 -4.030 38.189 -4.903 210 HG23 THR 93 HG23 THR 93 -2.287 37.921 -4.913 211 H LYS 94 H LYS 94 -0.699 38.252 -3.354 212 HA LYS 94 HA LYS 94 0.856 38.545 -1.202 213 HB2 LYS 94 HB2 LYS 94 0.313 40.233 -3.086 214 HB3 LYS 94 HB3 LYS 94 -0.903 40.856 -1.979 215 HG2 LYS 94 HG2 LYS 94 1.043 41.016 -0.292 216 HG3 LYS 94 HG3 LYS 94 2.075 40.882 -1.718 217 HD2 LYS 94 HD2 LYS 94 1.584 42.965 -2.419 218 HD3 LYS 94 HD3 LYS 94 -0.115 42.823 -1.963 219 HE2 LYS 94 HE2 LYS 94 1.054 42.879 0.474 220 HE3 LYS 94 HE3 LYS 94 2.177 43.880 -0.445 221 HZ1 LYS 94 HZ1 LYS 94 -0.729 44.312 -0.060 222 HZ2 LYS 94 HZ2 LYS 94 0.182 45.159 -1.206 223 HZ3 LYS 94 HZ3 LYS 94 0.541 45.310 0.441 224 H GLU 95 H GLU 95 -2.626 39.238 -1.208 225 HA GLU 95 HA GLU 95 -2.738 40.013 1.521 226 HB2 GLU 95 HB2 GLU 95 -5.015 38.917 -0.129 227 HB3 GLU 95 HB3 GLU 95 -5.122 39.969 1.276 228 HG2 GLU 95 HG2 GLU 95 -3.753 41.625 -0.169 229 HG3 GLU 95 HG3 GLU 95 -4.295 40.626 -1.516 230 H GLU 96 H GLU 96 -3.440 36.975 -0.170 231 HA GLU 96 HA GLU 96 -4.321 35.531 2.076 232 HB2 GLU 96 HB2 GLU 96 -4.487 34.934 -0.429 233 HB3 GLU 96 HB3 GLU 96 -2.870 34.271 -0.237 234 HG2 GLU 96 HG2 GLU 96 -3.664 32.730 1.446 235 HG3 GLU 96 HG3 GLU 96 -5.279 33.431 1.359 236 H VAL 97 H VAL 97 -1.125 35.585 0.498 237 HA VAL 97 HA VAL 97 0.203 33.884 2.249 238 HB VAL 97 HB VAL 97 1.180 34.645 0.133 239 HG11 VAL 97 HG11 VAL 97 2.151 36.851 -0.094 240 HG12 VAL 97 HG12 VAL 97 0.431 36.993 0.277 241 HG13 VAL 97 HG13 VAL 97 1.633 37.276 1.536 242 HG21 VAL 97 HG21 VAL 97 3.456 34.849 0.881 243 HG22 VAL 97 HG22 VAL 97 2.929 35.406 2.469 244 HG23 VAL 97 HG23 VAL 97 2.602 33.749 1.963 245 H THR 98 H THR 98 -0.422 37.344 2.493 246 HA THR 98 HA THR 98 1.218 37.822 4.750 247 HB THR 98 HB THR 98 -1.202 39.337 3.752 248 HG1 THR 98 HG1 THR 98 1.453 40.238 3.549 249 HG21 THR 98 HG21 THR 98 -0.130 41.224 5.088 250 HG22 THR 98 HG22 THR 98 0.804 39.971 5.906 251 HG23 THR 98 HG23 THR 98 -0.957 39.971 6.013 252 H SER 99 H SER 99 -2.235 37.086 4.402 253 HA SER 99 HA SER 99 -2.811 37.248 7.182 254 HB2 SER 99 HB2 SER 99 -4.298 35.915 4.910 255 HB3 SER 99 HB3 SER 99 -4.931 36.072 6.547 256 HG SER 99 HG SER 99 -4.307 38.453 6.070 257 H PHE 100 H PHE 100 -1.877 34.638 5.016 258 HA PHE 100 HA PHE 100 -2.370 32.484 6.751 259 HB2 PHE 100 HB2 PHE 100 -0.639 32.900 4.349 260 HB3 PHE 100 HB3 PHE 100 -0.420 31.442 5.311 261 HD1 PHE 100 HD2 PHE 100 -3.638 33.156 4.752 262 HD2 PHE 100 HD1 PHE 100 -1.157 29.853 3.728 263 HE1 PHE 100 HE2 PHE 100 -5.527 32.104 3.579 264 HE2 PHE 100 HE1 PHE 100 -3.042 28.796 2.553 265 HZ PHE 100 HZ PHE 100 -5.232 29.922 2.478 266 H PHE 101 H PHE 101 0.612 34.324 6.141 267 HA PHE 101 HA PHE 101 2.078 32.937 8.177 268 HB2 PHE 101 HB2 PHE 101 2.616 35.032 6.188 269 HB3 PHE 101 HB3 PHE 101 3.513 35.222 7.691 270 HD1 PHE 101 HD1 PHE 101 2.861 32.949 4.863 271 HD2 PHE 101 HD2 PHE 101 5.321 33.799 8.232 272 HE1 PHE 101 HE1 PHE 101 4.481 31.260 4.103 273 HE2 PHE 101 HE2 PHE 101 6.944 32.112 7.476 274 HZ PHE 101 HZ PHE 101 6.525 30.840 5.409 275 H LYS 102 H LYS 102 0.103 35.785 8.025 276 HA LYS 102 HA LYS 102 1.005 37.240 10.205 277 HB2 LYS 102 HB2 LYS 102 -1.487 37.029 8.680 278 HB3 LYS 102 HB3 LYS 102 -1.731 37.531 10.348 279 HG2 LYS 102 HG2 LYS 102 0.452 39.009 9.303 280 HG3 LYS 102 HG3 LYS 102 -0.871 39.080 8.137 281 HD2 LYS 102 HD2 LYS 102 -1.114 39.709 11.078 282 HD3 LYS 102 HD3 LYS 102 -0.955 40.910 9.794 283 HE2 LYS 102 HE2 LYS 102 -3.030 39.509 8.837 284 HE3 LYS 102 HE3 LYS 102 -3.269 39.232 10.561 285 HZ1 LYS 102 HZ1 LYS 102 -2.802 41.870 10.491 286 HZ2 LYS 102 HZ2 LYS 102 -4.345 41.177 10.465 287 HZ3 LYS 102 HZ3 LYS 102 -3.608 41.653 9.018 288 H LYS 103 H LYS 103 -0.796 34.265 10.107 289 HA LYS 103 HA LYS 103 -1.900 34.227 12.664 290 HB2 LYS 103 HB2 LYS 103 -1.996 32.527 10.618 291 HB3 LYS 103 HB3 LYS 103 -0.757 31.706 11.558 292 HG2 LYS 103 HG2 LYS 103 -2.316 31.717 13.500 293 HG3 LYS 103 HG3 LYS 103 -3.561 32.363 12.427 294 HD2 LYS 103 HD2 LYS 103 -4.059 30.283 11.820 295 HD3 LYS 103 HD3 LYS 103 -2.448 30.135 11.113 296 HE2 LYS 103 HE2 LYS 103 -3.279 29.452 13.930 297 HE3 LYS 103 HE3 LYS 103 -2.788 28.329 12.662 298 HZ1 LYS 103 HZ1 LYS 103 -0.761 28.511 13.525 299 HZ2 LYS 103 HZ2 LYS 103 -1.173 29.855 14.464 300 HZ3 LYS 103 HZ3 LYS 103 -0.697 30.062 12.854 301 H HIS 104 H HIS 104 1.381 33.703 11.600 302 HA HIS 104 HA HIS 104 2.243 32.656 14.157 303 HB2 HIS 104 HB2 HIS 104 3.227 32.503 11.563 304 HB3 HIS 104 HB3 HIS 104 4.368 33.563 12.384 305 HD1 HIS 104 HD1 HIS 104 5.066 30.664 11.417 306 HD2 HIS 104 HD2 HIS 104 3.973 31.715 15.286 307 HE1 HIS 104 HE1 HIS 104 6.013 28.864 12.895 308 H GLY 105 H GLY 105 1.629 35.699 12.875 309 HA2 GLY 105 HA2 GLY 105 1.776 37.714 14.065 310 HA3 GLY 105 HA3 GLY 105 2.932 36.961 15.153 311 H ILE 106 H ILE 106 4.011 36.126 12.211 312 HA ILE 106 HA ILE 106 6.023 38.222 12.234 313 HB ILE 106 HB ILE 106 6.820 35.954 11.992 314 HG12 ILE 106 HG12 ILE 106 7.252 36.858 9.214 315 HG13 ILE 106 HG13 ILE 106 7.602 38.056 10.454 316 HG21 ILE 106 HG21 ILE 106 4.544 35.624 10.385 317 HG22 ILE 106 HG22 ILE 106 5.932 35.350 9.333 318 HG23 ILE 106 HG23 ILE 106 5.748 34.407 10.812 319 HD11 ILE 106 HD11 ILE 106 9.316 36.804 11.359 320 HD12 ILE 106 HD12 ILE 106 8.717 35.296 10.667 321 HD13 ILE 106 HD13 ILE 106 9.481 36.500 9.630 322 H GLU 107 H GLU 107 5.923 39.965 10.991 323 HA GLU 107 HA GLU 107 4.009 40.027 8.781 324 HB2 GLU 107 HB2 GLU 107 5.211 42.037 10.581 325 HB3 GLU 107 HB3 GLU 107 4.960 42.560 8.922 326 HG2 GLU 107 HG2 GLU 107 2.814 41.354 10.649 327 HG3 GLU 107 HG3 GLU 107 3.089 43.086 10.471 328 H LYS 108 H LYS 108 7.327 39.675 9.344 329 HA LYS 108 HA LYS 108 8.520 40.993 7.211 330 HB2 LYS 108 HB2 LYS 108 9.855 39.957 8.934 331 HB3 LYS 108 HB3 LYS 108 9.243 38.363 8.510 332 HG2 LYS 108 HG2 LYS 108 10.786 38.091 6.939 333 HG3 LYS 108 HG3 LYS 108 10.459 39.678 6.239 334 HD2 LYS 108 HD2 LYS 108 11.978 39.500 8.802 335 HD3 LYS 108 HD3 LYS 108 12.804 39.132 7.285 336 HE2 LYS 108 HE2 LYS 108 12.222 41.311 6.404 337 HE3 LYS 108 HE3 LYS 108 11.285 41.676 7.852 338 HZ1 LYS 108 HZ1 LYS 108 13.638 41.101 8.935 339 HZ2 LYS 108 HZ2 LYS 108 13.198 42.664 8.461 340 HZ3 LYS 108 HZ3 LYS 108 14.162 41.714 7.448 341 H VAL 109 H VAL 109 6.547 38.147 7.244 342 HA VAL 109 HA VAL 109 7.286 36.840 4.930 343 HB VAL 109 HB VAL 109 5.583 35.934 6.391 344 HG11 VAL 109 HG11 VAL 109 3.283 37.407 5.536 345 HG12 VAL 109 HG12 VAL 109 3.894 37.148 7.172 346 HG13 VAL 109 HG13 VAL 109 4.473 38.515 6.218 347 HG21 VAL 109 HG21 VAL 109 3.912 35.251 4.701 348 HG22 VAL 109 HG22 VAL 109 4.546 36.485 3.611 349 HG23 VAL 109 HG23 VAL 109 5.570 35.137 4.109 350 H ALA 110 H ALA 110 5.593 39.864 5.295 351 HA ALA 110 HA ALA 110 4.558 40.045 2.660 352 HB1 ALA 110 HB1 ALA 110 5.149 42.623 3.807 353 HB2 ALA 110 HB2 ALA 110 3.589 41.877 3.459 354 HB3 ALA 110 HB3 ALA 110 4.396 41.558 4.995 355 H GLU 111 H GLU 111 7.513 41.307 4.179 356 HA GLU 111 HA GLU 111 8.468 42.530 1.781 357 HB2 GLU 111 HB2 GLU 111 9.072 43.108 4.217 358 HB3 GLU 111 HB3 GLU 111 10.191 41.756 4.122 359 HG2 GLU 111 HG2 GLU 111 11.238 43.949 3.680 360 HG3 GLU 111 HG3 GLU 111 11.411 42.802 2.352 361 H GLN 112 H GLN 112 8.884 39.413 3.324 362 HA GLN 112 HA GLN 112 11.066 38.566 1.692 363 HB2 GLN 112 HB2 GLN 112 9.106 36.980 3.358 364 HB3 GLN 112 HB3 GLN 112 10.540 36.307 2.595 365 HG2 GLN 112 HG2 GLN 112 10.690 38.584 4.540 366 HG3 GLN 112 HG3 GLN 112 10.694 36.899 5.058 367 HE21 GLN 112 HE21 GLN 112 12.566 35.856 5.100 368 HE22 GLN 112 HE22 GLN 112 14.044 36.416 4.403 369 H VAL 113 H VAL 113 7.562 38.038 1.614 370 HA VAL 113 HA VAL 113 7.597 36.318 -0.647 371 HB VAL 113 HB VAL 113 5.717 36.547 1.044 372 HG11 VAL 113 HG11 VAL 113 5.576 39.000 0.984 373 HG12 VAL 113 HG12 VAL 113 4.995 38.916 -0.679 374 HG13 VAL 113 HG13 VAL 113 4.026 38.238 0.630 375 HG21 VAL 113 HG21 VAL 113 5.598 36.126 -1.824 376 HG22 VAL 113 HG22 VAL 113 4.844 35.213 -0.517 377 HG23 VAL 113 HG23 VAL 113 4.050 36.650 -1.163 378 H MET 114 H MET 114 7.474 39.785 -0.231 379 HA MET 114 HA MET 114 6.736 40.331 -2.956 380 HB2 MET 114 HB2 MET 114 7.436 41.935 -0.555 381 HB3 MET 114 HB3 MET 114 7.693 42.692 -2.122 382 HG2 MET 114 HG2 MET 114 5.097 41.388 -1.861 383 HG3 MET 114 HG3 MET 114 5.357 42.699 -0.714 384 HE1 MET 114 HE1 MET 114 4.872 44.666 -0.935 385 HE2 MET 114 HE2 MET 114 5.239 45.764 -2.265 386 HE3 MET 114 HE3 MET 114 3.649 45.008 -2.159 387 H LYS 115 H LYS 115 9.712 40.152 -1.099 388 HA LYS 115 HA LYS 115 11.333 41.129 -3.286 389 HB2 LYS 115 HB2 LYS 115 12.019 39.989 -0.576 390 HB3 LYS 115 HB3 LYS 115 13.234 40.488 -1.746 391 HG2 LYS 115 HG2 LYS 115 11.108 42.299 -0.622 392 HG3 LYS 115 HG3 LYS 115 12.759 42.184 -0.009 393 HD2 LYS 115 HD2 LYS 115 11.996 42.955 -2.827 394 HD3 LYS 115 HD3 LYS 115 12.450 44.087 -1.550 395 HE2 LYS 115 HE2 LYS 115 14.536 43.857 -2.321 396 HE3 LYS 115 HE3 LYS 115 14.520 42.286 -1.523 397 HZ1 LYS 115 HZ1 LYS 115 13.782 41.281 -3.589 398 HZ2 LYS 115 HZ2 LYS 115 15.236 42.112 -3.825 399 HZ3 LYS 115 HZ3 LYS 115 13.779 42.789 -4.356 400 H ALA 116 H ALA 116 10.148 38.107 -2.153 401 HA ALA 116 HA ALA 116 12.162 36.526 -3.505 402 HB1 ALA 116 HB1 ALA 116 10.956 34.606 -2.700 403 HB2 ALA 116 HB2 ALA 116 11.116 35.775 -1.388 404 HB3 ALA 116 HB3 ALA 116 9.581 35.612 -2.243 405 H ASP 117 H ASP 117 9.167 37.992 -4.269 406 HA ASP 117 HA ASP 117 8.339 36.195 -6.323 407 HB2 ASP 117 HB2 ASP 117 7.122 38.232 -5.004 408 HB3 ASP 117 HB3 ASP 117 7.508 39.023 -6.530 409 H ALA 118 H ALA 118 10.313 35.903 -7.499 410 HA ALA 118 HA ALA 118 11.568 38.098 -8.841 411 HB1 ALA 118 HB1 ALA 118 12.725 35.981 -8.189 412 HB2 ALA 118 HB2 ALA 118 11.842 35.168 -9.481 413 HB3 ALA 118 HB3 ALA 118 12.973 36.464 -9.868 414 H ASN 119 H ASN 119 8.806 36.199 -9.448 415 HA ASN 119 HA ASN 119 8.849 36.793 -12.318 416 HB2 ASN 119 HB2 ASN 119 6.651 35.363 -12.160 417 HB3 ASN 119 HB3 ASN 119 8.225 34.573 -12.106 418 HD21 ASN 119 HD21 ASN 119 7.509 32.810 -10.971 419 HD22 ASN 119 HD22 ASN 119 7.026 32.890 -9.314 420 H GLY 120 H GLY 120 7.855 38.233 -9.533 421 HA2 GLY 120 HA2 GLY 120 6.256 39.802 -8.993 422 HA3 GLY 120 HA3 GLY 120 6.516 40.342 -10.645 423 H ASP 121 H ASP 121 5.211 37.190 -9.898 424 HA ASP 121 HA ASP 121 2.918 37.646 -11.521 425 HB2 ASP 121 HB2 ASP 121 2.210 35.378 -10.553 426 HB3 ASP 121 HB3 ASP 121 3.700 35.425 -11.492 427 H GLY 122 H GLY 122 3.617 38.141 -8.196 428 HA2 GLY 122 HA2 GLY 122 2.299 39.330 -6.679 429 HA3 GLY 122 HA3 GLY 122 0.934 39.166 -7.773 430 H TYR 123 H TYR 123 2.169 36.159 -7.570 431 HA TYR 123 HA TYR 123 0.737 35.457 -5.107 432 HB2 TYR 123 HB2 TYR 123 0.389 33.844 -7.626 433 HB3 TYR 123 HB3 TYR 123 -0.557 33.774 -6.143 434 HD1 TYR 123 HD2 TYR 123 -2.230 35.504 -5.655 435 HD2 TYR 123 HD1 TYR 123 -0.059 35.500 -9.314 436 HE1 TYR 123 HE2 TYR 123 -3.863 37.070 -6.621 437 HE2 TYR 123 HE1 TYR 123 -1.685 37.066 -10.289 438 HH TYR 123 HH TYR 123 -3.322 38.797 -9.421 439 H ILE 124 H ILE 124 1.222 33.252 -4.356 440 HA ILE 124 HA ILE 124 3.842 32.290 -5.292 441 HB ILE 124 HB ILE 124 4.659 31.994 -3.124 442 HG12 ILE 124 HG12 ILE 124 1.808 32.366 -2.210 443 HG13 ILE 124 HG13 ILE 124 2.818 30.934 -2.041 444 HG21 ILE 124 HG21 ILE 124 4.971 34.144 -2.559 445 HG22 ILE 124 HG22 ILE 124 3.972 34.484 -3.971 446 HG23 ILE 124 HG23 ILE 124 3.244 34.446 -2.366 447 HD11 ILE 124 HD11 ILE 124 2.627 32.006 0.084 448 HD12 ILE 124 HD12 ILE 124 4.275 32.220 -0.503 449 HD13 ILE 124 HD13 ILE 124 3.126 33.553 -0.598 450 H THR 125 H THR 125 3.768 30.252 -5.939 451 HA THR 125 HA THR 125 1.502 28.581 -5.195 452 HB THR 125 HB THR 125 2.190 28.711 -7.571 453 HG1 THR 125 HG1 THR 125 2.093 26.450 -7.895 454 HG21 THR 125 HG21 THR 125 4.304 28.454 -8.235 455 HG22 THR 125 HG22 THR 125 4.440 26.911 -7.391 456 HG23 THR 125 HG23 THR 125 4.767 28.416 -6.534 457 H LEU 126 H LEU 126 2.305 26.085 -5.167 458 HA LEU 126 HA LEU 126 3.357 25.630 -2.655 459 HB2 LEU 126 HB2 LEU 126 3.558 23.777 -5.024 460 HB3 LEU 126 HB3 LEU 126 3.644 23.318 -3.323 461 HG LEU 126 HG LEU 126 1.171 24.704 -4.106 462 HD11 LEU 126 HD11 LEU 126 1.243 21.861 -4.913 463 HD12 LEU 126 HD12 LEU 126 1.994 23.021 -6.009 464 HD13 LEU 126 HD13 LEU 126 0.298 23.205 -5.558 465 HD21 LEU 126 HD21 LEU 126 1.900 23.437 -1.920 466 HD22 LEU 126 HD22 LEU 126 1.333 22.026 -2.813 467 HD23 LEU 126 HD23 LEU 126 0.235 23.372 -2.498 468 H GLU 127 H GLU 127 5.016 26.097 -5.693 469 HA GLU 127 HA GLU 127 7.532 25.079 -5.035 470 HB2 GLU 127 HB2 GLU 127 6.613 27.232 -6.915 471 HB3 GLU 127 HB3 GLU 127 8.326 26.905 -6.702 472 HG2 GLU 127 HG2 GLU 127 6.263 24.898 -7.582 473 HG3 GLU 127 HG3 GLU 127 7.392 25.743 -8.639 474 H GLU 128 H GLU 128 6.362 28.439 -4.790 475 HA GLU 128 HA GLU 128 8.632 29.537 -3.619 476 HB2 GLU 128 HB2 GLU 128 5.837 30.426 -2.937 477 HB3 GLU 128 HB3 GLU 128 7.296 31.402 -3.040 478 HG2 GLU 128 HG2 GLU 128 6.975 30.245 -5.567 479 HG3 GLU 128 HG3 GLU 128 5.371 30.782 -5.070 480 H PHE 129 H PHE 129 5.781 28.090 -2.082 481 HA PHE 129 HA PHE 129 6.438 28.588 0.574 482 HB2 PHE 129 HB2 PHE 129 4.415 27.248 -0.745 483 HB3 PHE 129 HB3 PHE 129 5.216 25.964 0.155 484 HD1 PHE 129 HD1 PHE 129 3.948 29.435 0.655 485 HD2 PHE 129 HD2 PHE 129 4.532 25.557 2.308 486 HE1 PHE 129 HE1 PHE 129 2.752 30.126 2.692 487 HE2 PHE 129 HE2 PHE 129 3.336 26.241 4.347 488 HZ PHE 129 HZ PHE 129 2.444 28.529 4.540 489 H LEU 130 H LEU 130 7.452 25.974 -1.565 490 HA LEU 130 HA LEU 130 8.847 24.528 0.471 491 HB2 LEU 130 HB2 LEU 130 8.152 23.207 -1.308 492 HB3 LEU 130 HB3 LEU 130 8.694 24.374 -2.512 493 HG LEU 130 HG LEU 130 11.027 23.768 -2.027 494 HD11 LEU 130 HD11 LEU 130 10.480 23.034 0.347 495 HD12 LEU 130 HD12 LEU 130 11.635 22.050 -0.553 496 HD13 LEU 130 HD13 LEU 130 9.968 21.504 -0.364 497 HD21 LEU 130 HD21 LEU 130 10.327 21.115 -2.582 498 HD22 LEU 130 HD22 LEU 130 10.701 22.392 -3.738 499 HD23 LEU 130 HD23 LEU 130 9.030 22.104 -3.251 500 H GLU 131 H GLU 131 9.566 27.242 -1.492 501 HA GLU 131 HA GLU 131 12.437 26.938 -1.336 502 HB2 GLU 131 HB2 GLU 131 10.959 28.150 -3.161 503 HB3 GLU 131 HB3 GLU 131 11.137 29.521 -2.076 504 HG2 GLU 131 HG2 GLU 131 13.693 28.757 -2.222 505 HG3 GLU 131 HG3 GLU 131 13.131 28.184 -3.791 506 H PHE 132 H PHE 132 9.945 28.245 0.596 507 HA PHE 132 HA PHE 132 11.897 29.782 2.176 508 HB2 PHE 132 HB2 PHE 132 8.900 30.049 2.364 509 HB3 PHE 132 HB3 PHE 132 10.129 31.166 2.946 510 HD1 PHE 132 HD2 PHE 132 11.879 31.210 0.506 511 HD2 PHE 132 HD1 PHE 132 7.654 31.450 0.960 512 HE1 PHE 132 HE2 PHE 132 11.728 32.475 -1.599 513 HE2 PHE 132 HE1 PHE 132 7.496 32.714 -1.145 514 HZ PHE 132 HZ PHE 132 9.535 33.230 -2.427 515 H SER 133 H SER 133 12.483 27.558 2.973 516 HA SER 133 HA SER 133 11.198 27.125 5.512 517 HB2 SER 133 HB2 SER 133 11.095 24.990 3.370 518 HB3 SER 133 HB3 SER 133 10.797 24.682 5.081 519 HG SER 133 HG SER 133 9.111 26.313 4.908 520 H LEU 134 H LEU 134 13.203 27.594 6.392 521 HA LEU 134 HA LEU 134 14.930 25.488 6.913 522 HB2 LEU 134 HB2 LEU 134 15.371 26.501 4.357 523 HB3 LEU 134 HB3 LEU 134 16.648 27.207 5.347 524 HG LEU 134 HG LEU 134 16.202 24.280 5.574 525 HD11 LEU 134 HD11 LEU 134 18.015 25.028 3.402 526 HD12 LEU 134 HD12 LEU 134 16.309 25.309 3.054 527 HD13 LEU 134 HD13 LEU 134 16.861 23.698 3.516 528 HD21 LEU 134 HD21 LEU 134 18.536 24.242 5.971 529 HD22 LEU 134 HD22 LEU 134 17.900 25.624 6.866 530 HD23 LEU 134 HD23 LEU 134 18.743 25.874 5.336 Start of MODEL 3 1 H GLY 67 H GLY 67 3.307 0.456 -1.863 2 HA2 GLY 67 HA2 GLY 67 5.220 0.413 -3.169 3 HA3 GLY 67 HA3 GLY 67 4.204 0.257 -4.594 4 H GLN 68 H GLN 68 2.667 2.695 -3.642 5 HA GLN 68 HA GLN 68 4.123 4.599 -5.162 6 HB2 GLN 68 HB2 GLN 68 1.530 4.459 -3.809 7 HB3 GLN 68 HB3 GLN 68 2.245 6.065 -3.786 8 HG2 GLN 68 HG2 GLN 68 0.712 5.596 -5.704 9 HG3 GLN 68 HG3 GLN 68 2.319 6.169 -6.144 10 HE21 GLN 68 HE21 GLN 68 3.390 5.057 -7.619 11 HE22 GLN 68 HE22 GLN 68 3.029 3.448 -8.134 12 H ASP 69 H ASP 69 5.653 5.976 -4.552 13 HA ASP 69 HA ASP 69 6.690 5.986 -1.921 14 HB2 ASP 69 HB2 ASP 69 7.259 7.455 -4.446 15 HB3 ASP 69 HB3 ASP 69 7.866 8.154 -2.947 16 H LEU 70 H LEU 70 6.495 7.423 -0.260 17 HA LEU 70 HA LEU 70 4.109 8.866 0.011 18 HB2 LEU 70 HB2 LEU 70 6.259 8.132 1.645 19 HB3 LEU 70 HB3 LEU 70 6.177 9.890 1.734 20 HG LEU 70 HG LEU 70 3.545 8.832 2.052 21 HD11 LEU 70 HD11 LEU 70 5.158 7.849 4.314 22 HD12 LEU 70 HD12 LEU 70 5.235 6.894 2.833 23 HD13 LEU 70 HD13 LEU 70 3.679 7.203 3.603 24 HD21 LEU 70 HD21 LEU 70 3.464 10.387 3.679 25 HD22 LEU 70 HD22 LEU 70 4.983 10.928 2.962 26 HD23 LEU 70 HD23 LEU 70 5.000 9.885 4.384 27 H SER 71 H SER 71 4.638 11.306 1.066 28 HA SER 71 HA SER 71 5.481 12.810 -1.303 29 HB2 SER 71 HB2 SER 71 3.266 13.381 -0.581 30 HB3 SER 71 HB3 SER 71 3.798 13.575 1.089 31 HG SER 71 HG SER 71 4.542 15.192 -1.122 32 H ASP 72 H ASP 72 7.067 14.347 -1.252 33 HA ASP 72 HA ASP 72 9.315 14.113 0.171 34 HB2 ASP 72 HB2 ASP 72 8.046 16.330 -1.245 35 HB3 ASP 72 HB3 ASP 72 9.144 16.872 0.021 36 H ASP 73 H ASP 73 10.252 14.966 2.052 37 HA ASP 73 HA ASP 73 8.859 14.814 4.387 38 HB2 ASP 73 HB2 ASP 73 11.153 16.742 4.002 39 HB3 ASP 73 HB3 ASP 73 10.697 15.891 5.476 40 H LYS 74 H LYS 74 8.835 17.412 2.129 41 HA LYS 74 HA LYS 74 7.779 19.358 3.988 42 HB2 LYS 74 HB2 LYS 74 7.586 20.810 2.012 43 HB3 LYS 74 HB3 LYS 74 9.195 20.112 2.153 44 HG2 LYS 74 HG2 LYS 74 9.014 19.442 0.053 45 HG3 LYS 74 HG3 LYS 74 7.750 18.323 0.569 46 HD2 LYS 74 HD2 LYS 74 6.110 20.206 0.279 47 HD3 LYS 74 HD3 LYS 74 7.414 21.133 -0.467 48 HE2 LYS 74 HE2 LYS 74 6.190 20.146 -2.238 49 HE3 LYS 74 HE3 LYS 74 7.685 19.224 -2.089 50 HZ1 LYS 74 HZ1 LYS 74 6.376 17.625 -0.693 51 HZ2 LYS 74 HZ2 LYS 74 5.950 17.669 -2.330 52 HZ3 LYS 74 HZ3 LYS 74 4.976 18.441 -1.181 53 H ILE 75 H ILE 75 6.434 16.692 3.020 54 HA ILE 75 HA ILE 75 4.113 17.186 1.631 55 HB ILE 75 HB ILE 75 4.704 14.936 2.240 56 HG12 ILE 75 HG12 ILE 75 2.106 15.788 3.534 57 HG13 ILE 75 HG13 ILE 75 2.335 15.337 1.848 58 HG21 ILE 75 HG21 ILE 75 4.061 15.625 5.101 59 HG22 ILE 75 HG22 ILE 75 4.680 14.095 4.480 60 HG23 ILE 75 HG23 ILE 75 5.697 15.535 4.447 61 HD11 ILE 75 HD11 ILE 75 2.090 13.649 4.248 62 HD12 ILE 75 HD12 ILE 75 1.544 13.369 2.594 63 HD13 ILE 75 HD13 ILE 75 3.236 13.112 3.021 64 H GLY 76 H GLY 76 4.742 17.689 5.079 65 HA2 GLY 76 HA2 GLY 76 2.118 18.360 5.839 66 HA3 GLY 76 HA3 GLY 76 3.580 18.847 6.683 67 H LEU 77 H LEU 77 4.804 20.412 4.753 68 HA LEU 77 HA LEU 77 3.504 22.875 5.114 69 HB2 LEU 77 HB2 LEU 77 5.999 22.157 4.450 70 HB3 LEU 77 HB3 LEU 77 5.395 22.605 2.856 71 HG LEU 77 HG LEU 77 4.850 24.846 3.710 72 HD11 LEU 77 HD11 LEU 77 5.496 23.567 6.252 73 HD12 LEU 77 HD12 LEU 77 4.526 25.000 5.914 74 HD13 LEU 77 HD13 LEU 77 6.281 25.131 6.025 75 HD21 LEU 77 HD21 LEU 77 6.985 24.508 2.635 76 HD22 LEU 77 HD22 LEU 77 7.695 23.944 4.147 77 HD23 LEU 77 HD23 LEU 77 7.179 25.624 3.988 78 H LYS 78 H LYS 78 3.790 20.798 2.245 79 HA LYS 78 HA LYS 78 2.344 22.447 0.490 80 HB2 LYS 78 HB2 LYS 78 3.383 19.726 0.500 81 HB3 LYS 78 HB3 LYS 78 1.858 19.851 -0.366 82 HG2 LYS 78 HG2 LYS 78 3.235 22.009 -1.318 83 HG3 LYS 78 HG3 LYS 78 4.514 20.816 -1.090 84 HD2 LYS 78 HD2 LYS 78 3.042 19.187 -2.346 85 HD3 LYS 78 HD3 LYS 78 2.020 20.566 -2.759 86 HE2 LYS 78 HE2 LYS 78 3.387 21.115 -4.421 87 HE3 LYS 78 HE3 LYS 78 4.743 21.231 -3.299 88 HZ1 LYS 78 HZ1 LYS 78 3.907 18.963 -4.971 89 HZ2 LYS 78 HZ2 LYS 78 4.736 18.662 -3.528 90 HZ3 LYS 78 HZ3 LYS 78 5.452 19.608 -4.734 91 H VAL 79 H VAL 79 1.305 19.798 2.601 92 HA VAL 79 HA VAL 79 -1.371 19.675 1.794 93 HB VAL 79 HB VAL 79 -0.089 19.043 4.450 94 HG11 VAL 79 HG11 VAL 79 -2.204 17.786 4.923 95 HG12 VAL 79 HG12 VAL 79 -2.366 19.544 4.953 96 HG13 VAL 79 HG13 VAL 79 -2.935 18.629 3.556 97 HG21 VAL 79 HG21 VAL 79 -1.251 16.864 2.938 98 HG22 VAL 79 HG22 VAL 79 -0.033 17.732 2.004 99 HG23 VAL 79 HG23 VAL 79 0.382 17.048 3.576 100 H LEU 80 H LEU 80 0.042 21.407 4.576 101 HA LEU 80 HA LEU 80 -2.276 22.653 5.463 102 HB2 LEU 80 HB2 LEU 80 0.625 23.158 5.719 103 HB3 LEU 80 HB3 LEU 80 -0.442 24.510 6.090 104 HG LEU 80 HG LEU 80 -1.406 22.194 7.447 105 HD11 LEU 80 HD11 LEU 80 0.611 21.964 8.978 106 HD12 LEU 80 HD12 LEU 80 1.547 22.691 7.672 107 HD13 LEU 80 HD13 LEU 80 0.702 21.166 7.408 108 HD21 LEU 80 HD21 LEU 80 -1.910 24.344 8.257 109 HD22 LEU 80 HD22 LEU 80 -0.215 24.831 8.260 110 HD23 LEU 80 HD23 LEU 80 -0.795 23.652 9.436 111 H PHE 81 H PHE 81 0.191 23.933 3.235 112 HA PHE 81 HA PHE 81 -0.910 26.400 2.706 113 HB2 PHE 81 HB2 PHE 81 1.180 26.087 1.749 114 HB3 PHE 81 HB3 PHE 81 0.755 24.513 1.085 115 HD1 PHE 81 HD1 PHE 81 0.417 28.149 0.640 116 HD2 PHE 81 HD2 PHE 81 -0.226 24.304 -1.071 117 HE1 PHE 81 HE1 PHE 81 -0.035 29.198 -1.540 118 HE2 PHE 81 HE2 PHE 81 -0.676 25.347 -3.253 119 HZ PHE 81 HZ PHE 81 -0.581 27.797 -3.490 120 H LYS 82 H LYS 82 -1.466 23.414 0.839 121 HA LYS 82 HA LYS 82 -3.410 24.472 -0.878 122 HB2 LYS 82 HB2 LYS 82 -2.313 22.378 -1.385 123 HB3 LYS 82 HB3 LYS 82 -2.965 21.637 0.070 124 HG2 LYS 82 HG2 LYS 82 -5.145 22.629 -1.442 125 HG3 LYS 82 HG3 LYS 82 -4.087 21.729 -2.532 126 HD2 LYS 82 HD2 LYS 82 -4.138 20.072 -0.390 127 HD3 LYS 82 HD3 LYS 82 -5.750 20.786 -0.292 128 HE2 LYS 82 HE2 LYS 82 -6.463 19.543 -1.991 129 HE3 LYS 82 HE3 LYS 82 -5.133 20.092 -3.011 130 HZ1 LYS 82 HZ1 LYS 82 -5.372 17.662 -1.416 131 HZ2 LYS 82 HZ2 LYS 82 -3.837 18.368 -1.501 132 HZ3 LYS 82 HZ3 LYS 82 -4.633 17.901 -2.920 133 H LEU 83 H LEU 83 -3.734 22.787 2.224 134 HA LEU 83 HA LEU 83 -6.502 22.585 2.329 135 HB2 LEU 83 HB2 LEU 83 -4.573 21.796 3.952 136 HB3 LEU 83 HB3 LEU 83 -5.004 23.276 4.807 137 HG LEU 83 HG LEU 83 -6.760 20.884 4.280 138 HD11 LEU 83 HD11 LEU 83 -5.406 20.436 6.132 139 HD12 LEU 83 HD12 LEU 83 -6.910 21.041 6.826 140 HD13 LEU 83 HD13 LEU 83 -5.501 22.097 6.718 141 HD21 LEU 83 HD21 LEU 83 -8.143 22.805 3.979 142 HD22 LEU 83 HD22 LEU 83 -7.454 23.595 5.397 143 HD23 LEU 83 HD23 LEU 83 -8.465 22.161 5.589 144 H MET 84 H MET 84 -4.402 25.278 3.261 145 HA MET 84 HA MET 84 -6.517 26.906 4.261 146 HB2 MET 84 HB2 MET 84 -3.829 27.847 3.261 147 HB3 MET 84 HB3 MET 84 -4.883 28.653 4.416 148 HG2 MET 84 HG2 MET 84 -4.345 26.086 5.445 149 HG3 MET 84 HG3 MET 84 -2.814 26.756 4.888 150 HE1 MET 84 HE1 MET 84 -4.401 26.010 7.780 151 HE2 MET 84 HE2 MET 84 -2.667 26.289 7.942 152 HE3 MET 84 HE3 MET 84 -3.805 27.208 8.928 153 H ASP 85 H ASP 85 -5.604 26.022 1.150 154 HA ASP 85 HA ASP 85 -6.771 28.447 -0.033 155 HB2 ASP 85 HB2 ASP 85 -4.700 26.535 -0.899 156 HB3 ASP 85 HB3 ASP 85 -5.826 27.028 -2.160 157 H VAL 86 H VAL 86 -8.893 27.619 0.674 158 HA VAL 86 HA VAL 86 -10.008 25.233 -0.319 159 HB VAL 86 HB VAL 86 -11.526 27.760 0.335 160 HG11 VAL 86 HG11 VAL 86 -12.296 25.094 -0.430 161 HG12 VAL 86 HG12 VAL 86 -12.910 25.483 1.178 162 HG13 VAL 86 HG13 VAL 86 -13.298 26.526 -0.191 163 HG21 VAL 86 HG21 VAL 86 -10.487 27.539 2.332 164 HG22 VAL 86 HG22 VAL 86 -11.718 26.301 2.582 165 HG23 VAL 86 HG23 VAL 86 -10.097 25.840 2.066 166 H ASP 87 H ASP 87 -9.166 28.087 -1.912 167 HA ASP 87 HA ASP 87 -11.200 27.988 -3.949 168 HB2 ASP 87 HB2 ASP 87 -9.636 29.672 -5.083 169 HB3 ASP 87 HB3 ASP 87 -10.348 30.150 -3.545 170 H GLY 88 H GLY 88 -8.611 26.066 -3.292 171 HA2 GLY 88 HA2 GLY 88 -7.281 24.650 -4.530 172 HA3 GLY 88 HA3 GLY 88 -8.724 24.487 -5.519 173 H ASP 89 H ASP 89 -6.556 27.261 -5.048 174 HA ASP 89 HA ASP 89 -6.353 27.530 -7.945 175 HB2 ASP 89 HB2 ASP 89 -5.126 29.684 -7.290 176 HB3 ASP 89 HB3 ASP 89 -6.843 29.590 -6.912 177 H GLY 90 H GLY 90 -4.498 26.457 -5.249 178 HA2 GLY 90 HA2 GLY 90 -2.492 25.291 -5.280 179 HA3 GLY 90 HA3 GLY 90 -2.365 25.617 -7.002 180 H LYS 91 H LYS 91 -2.973 28.535 -5.728 181 HA LYS 91 HA LYS 91 -0.215 29.113 -4.935 182 HB2 LYS 91 HB2 LYS 91 -0.393 31.207 -6.429 183 HB3 LYS 91 HB3 LYS 91 -0.027 29.668 -7.196 184 HG2 LYS 91 HG2 LYS 91 -1.854 29.760 -8.451 185 HG3 LYS 91 HG3 LYS 91 -2.877 30.141 -7.063 186 HD2 LYS 91 HD2 LYS 91 -2.766 32.381 -7.426 187 HD3 LYS 91 HD3 LYS 91 -1.118 32.305 -8.056 188 HE2 LYS 91 HE2 LYS 91 -2.827 30.903 -9.846 189 HE3 LYS 91 HE3 LYS 91 -3.563 32.466 -9.492 190 HZ1 LYS 91 HZ1 LYS 91 -1.649 32.055 -11.333 191 HZ2 LYS 91 HZ2 LYS 91 -0.728 32.579 -10.015 192 HZ3 LYS 91 HZ3 LYS 91 -1.978 33.550 -10.611 193 H LEU 92 H LEU 92 0.032 31.194 -3.880 194 HA LEU 92 HA LEU 92 -2.494 32.223 -2.766 195 HB2 LEU 92 HB2 LEU 92 -1.512 32.447 -0.630 196 HB3 LEU 92 HB3 LEU 92 -1.150 30.815 -1.187 197 HG LEU 92 HG LEU 92 1.101 32.020 -1.968 198 HD11 LEU 92 HD11 LEU 92 1.749 33.836 -0.749 199 HD12 LEU 92 HD12 LEU 92 0.679 33.457 0.599 200 HD13 LEU 92 HD13 LEU 92 0.020 34.163 -0.877 201 HD21 LEU 92 HD21 LEU 92 0.255 30.661 0.516 202 HD22 LEU 92 HD22 LEU 92 1.820 31.474 0.555 203 HD23 LEU 92 HD23 LEU 92 1.503 30.226 -0.652 204 H THR 93 H THR 93 -2.669 34.421 -2.472 205 HA THR 93 HA THR 93 -0.742 36.028 -3.955 206 HB THR 93 HB THR 93 -3.123 36.339 -4.460 207 HG1 THR 93 HG1 THR 93 -3.088 38.735 -3.831 208 HG21 THR 93 HG21 THR 93 -3.454 36.166 -1.696 209 HG22 THR 93 HG22 THR 93 -4.701 36.526 -2.891 210 HG23 THR 93 HG23 THR 93 -3.836 37.840 -2.095 211 H LYS 94 H LYS 94 0.054 38.052 -3.108 212 HA LYS 94 HA LYS 94 1.477 37.976 -0.837 213 HB2 LYS 94 HB2 LYS 94 1.290 39.852 -2.609 214 HB3 LYS 94 HB3 LYS 94 0.068 40.537 -1.546 215 HG2 LYS 94 HG2 LYS 94 2.072 40.096 0.215 216 HG3 LYS 94 HG3 LYS 94 2.987 40.436 -1.256 217 HD2 LYS 94 HD2 LYS 94 1.093 42.389 -1.336 218 HD3 LYS 94 HD3 LYS 94 1.341 42.216 0.403 219 HE2 LYS 94 HE2 LYS 94 3.839 42.351 -0.124 220 HE3 LYS 94 HE3 LYS 94 3.348 42.927 -1.716 221 HZ1 LYS 94 HZ1 LYS 94 2.058 44.281 0.477 222 HZ2 LYS 94 HZ2 LYS 94 2.796 44.919 -0.904 223 HZ3 LYS 94 HZ3 LYS 94 3.735 44.495 0.437 224 H GLU 95 H GLU 95 -1.793 39.399 -0.985 225 HA GLU 95 HA GLU 95 -2.109 39.979 1.698 226 HB2 GLU 95 HB2 GLU 95 -4.021 39.291 -0.496 227 HB3 GLU 95 HB3 GLU 95 -4.623 39.433 1.150 228 HG2 GLU 95 HG2 GLU 95 -2.916 41.647 0.261 229 HG3 GLU 95 HG3 GLU 95 -4.443 41.481 -0.605 230 H GLU 96 H GLU 96 -2.787 36.942 0.001 231 HA GLU 96 HA GLU 96 -3.890 35.547 2.169 232 HB2 GLU 96 HB2 GLU 96 -4.030 34.779 -0.170 233 HB3 GLU 96 HB3 GLU 96 -2.305 34.446 -0.159 234 HG2 GLU 96 HG2 GLU 96 -2.528 32.595 1.179 235 HG3 GLU 96 HG3 GLU 96 -4.044 33.154 1.883 236 H VAL 97 H VAL 97 -0.540 35.708 0.994 237 HA VAL 97 HA VAL 97 0.626 33.939 2.792 238 HB VAL 97 HB VAL 97 1.565 35.604 0.805 239 HG11 VAL 97 HG11 VAL 97 2.890 36.420 3.388 240 HG12 VAL 97 HG12 VAL 97 3.330 36.947 1.763 241 HG13 VAL 97 HG13 VAL 97 1.782 37.428 2.458 242 HG21 VAL 97 HG21 VAL 97 3.459 34.251 2.682 243 HG22 VAL 97 HG22 VAL 97 2.310 33.296 1.744 244 HG23 VAL 97 HG23 VAL 97 3.487 34.319 0.920 245 H THR 98 H THR 98 -0.312 37.292 3.206 246 HA THR 98 HA THR 98 1.043 37.651 5.701 247 HB THR 98 HB THR 98 -1.238 39.249 4.518 248 HG1 THR 98 HG1 THR 98 0.896 39.078 3.363 249 HG21 THR 98 HG21 THR 98 0.729 39.946 6.703 250 HG22 THR 98 HG22 THR 98 -0.986 39.601 6.928 251 HG23 THR 98 HG23 THR 98 -0.485 41.028 6.023 252 H SER 99 H SER 99 -2.117 36.534 4.716 253 HA SER 99 HA SER 99 -3.369 36.758 7.259 254 HB2 SER 99 HB2 SER 99 -4.568 36.549 5.052 255 HB3 SER 99 HB3 SER 99 -4.105 34.847 5.032 256 HG SER 99 HG SER 99 -5.143 34.969 7.290 257 H PHE 100 H PHE 100 -1.845 34.051 5.534 258 HA PHE 100 HA PHE 100 -2.276 32.145 7.583 259 HB2 PHE 100 HB2 PHE 100 -0.180 32.169 5.401 260 HB3 PHE 100 HB3 PHE 100 -0.634 30.771 6.371 261 HD1 PHE 100 HD1 PHE 100 -3.670 31.851 6.248 262 HD2 PHE 100 HD2 PHE 100 -0.687 30.774 3.409 263 HE1 PHE 100 HE1 PHE 100 -5.427 31.291 4.619 264 HE2 PHE 100 HE2 PHE 100 -2.439 30.213 1.776 265 HZ PHE 100 HZ PHE 100 -4.813 30.472 2.379 266 H PHE 101 H PHE 101 0.415 34.299 6.814 267 HA PHE 101 HA PHE 101 2.110 33.271 8.883 268 HB2 PHE 101 HB2 PHE 101 2.236 35.503 6.915 269 HB3 PHE 101 HB3 PHE 101 3.259 35.620 8.344 270 HD1 PHE 101 HD2 PHE 101 2.391 33.333 5.546 271 HD2 PHE 101 HD1 PHE 101 5.312 34.550 8.392 272 HE1 PHE 101 HE2 PHE 101 4.043 31.858 4.475 273 HE2 PHE 101 HE1 PHE 101 6.969 33.077 7.325 274 HZ PHE 101 HZ PHE 101 6.336 31.727 5.365 275 H LYS 102 H LYS 102 -0.353 35.689 8.666 276 HA LYS 102 HA LYS 102 0.284 37.404 10.739 277 HB2 LYS 102 HB2 LYS 102 -2.113 36.655 9.278 278 HB3 LYS 102 HB3 LYS 102 -2.473 37.046 10.955 279 HG2 LYS 102 HG2 LYS 102 -0.697 38.919 9.524 280 HG3 LYS 102 HG3 LYS 102 -2.382 38.871 9.004 281 HD2 LYS 102 HD2 LYS 102 -1.514 39.215 11.871 282 HD3 LYS 102 HD3 LYS 102 -1.886 40.557 10.787 283 HE2 LYS 102 HE2 LYS 102 -4.075 38.934 10.497 284 HE3 LYS 102 HE3 LYS 102 -3.673 38.725 12.201 285 HZ1 LYS 102 HZ1 LYS 102 -4.453 40.735 12.662 286 HZ2 LYS 102 HZ2 LYS 102 -5.068 40.810 11.088 287 HZ3 LYS 102 HZ3 LYS 102 -3.545 41.462 11.433 288 H LYS 103 H LYS 103 -0.864 34.121 10.863 289 HA LYS 103 HA LYS 103 -1.855 33.993 13.458 290 HB2 LYS 103 HB2 LYS 103 -0.433 31.952 11.756 291 HB3 LYS 103 HB3 LYS 103 -1.066 31.563 13.350 292 HG2 LYS 103 HG2 LYS 103 -2.790 32.738 11.194 293 HG3 LYS 103 HG3 LYS 103 -2.522 31.001 11.350 294 HD2 LYS 103 HD2 LYS 103 -3.485 32.679 13.650 295 HD3 LYS 103 HD3 LYS 103 -4.598 31.973 12.476 296 HE2 LYS 103 HE2 LYS 103 -4.263 29.857 13.229 297 HE3 LYS 103 HE3 LYS 103 -2.580 30.160 13.656 298 HZ1 LYS 103 HZ1 LYS 103 -3.219 30.365 15.750 299 HZ2 LYS 103 HZ2 LYS 103 -4.845 30.176 15.327 300 HZ3 LYS 103 HZ3 LYS 103 -4.148 31.718 15.341 301 H HIS 104 H HIS 104 1.398 34.299 12.326 302 HA HIS 104 HA HIS 104 2.495 33.652 14.959 303 HB2 HIS 104 HB2 HIS 104 3.439 33.239 12.373 304 HB3 HIS 104 HB3 HIS 104 4.423 34.566 12.984 305 HD1 HIS 104 HD1 HIS 104 4.894 33.766 15.848 306 HD2 HIS 104 HD2 HIS 104 4.988 31.049 12.707 307 HE1 HIS 104 HE1 HIS 104 6.280 31.835 16.670 308 H GLY 105 H GLY 105 1.647 36.338 12.993 309 HA2 GLY 105 HA2 GLY 105 1.448 38.542 13.796 310 HA3 GLY 105 HA3 GLY 105 2.566 38.147 15.092 311 H ILE 106 H ILE 106 4.031 36.894 12.507 312 HA ILE 106 HA ILE 106 5.880 39.090 12.303 313 HB ILE 106 HB ILE 106 5.823 36.447 10.840 314 HG12 ILE 106 HG12 ILE 106 7.913 36.988 12.838 315 HG13 ILE 106 HG13 ILE 106 6.288 36.887 13.504 316 HG21 ILE 106 HG21 ILE 106 8.393 37.221 10.746 317 HG22 ILE 106 HG22 ILE 106 7.227 37.562 9.469 318 HG23 ILE 106 HG23 ILE 106 7.601 38.795 10.673 319 HD11 ILE 106 HD11 ILE 106 6.935 34.710 13.650 320 HD12 ILE 106 HD12 ILE 106 6.192 34.700 12.050 321 HD13 ILE 106 HD13 ILE 106 7.945 34.796 12.208 322 H GLU 107 H GLU 107 5.927 40.633 10.803 323 HA GLU 107 HA GLU 107 4.048 40.439 8.558 324 HB2 GLU 107 HB2 GLU 107 5.520 42.886 9.547 325 HB3 GLU 107 HB3 GLU 107 4.186 42.842 8.403 326 HG2 GLU 107 HG2 GLU 107 4.117 42.290 11.352 327 HG3 GLU 107 HG3 GLU 107 3.290 43.565 10.459 328 H LYS 108 H LYS 108 7.333 40.176 9.271 329 HA LYS 108 HA LYS 108 8.612 41.311 7.085 330 HB2 LYS 108 HB2 LYS 108 9.331 38.728 8.483 331 HB3 LYS 108 HB3 LYS 108 10.411 39.697 7.489 332 HG2 LYS 108 HG2 LYS 108 9.110 40.699 10.010 333 HG3 LYS 108 HG3 LYS 108 10.715 39.968 9.949 334 HD2 LYS 108 HD2 LYS 108 11.636 41.757 8.844 335 HD3 LYS 108 HD3 LYS 108 10.104 42.221 8.098 336 HE2 LYS 108 HE2 LYS 108 9.345 42.834 10.458 337 HE3 LYS 108 HE3 LYS 108 11.045 42.711 10.909 338 HZ1 LYS 108 HZ1 LYS 108 9.685 44.751 9.370 339 HZ2 LYS 108 HZ2 LYS 108 11.184 44.276 8.747 340 HZ3 LYS 108 HZ3 LYS 108 11.073 44.863 10.330 341 H VAL 109 H VAL 109 6.644 38.464 7.279 342 HA VAL 109 HA VAL 109 7.477 36.986 5.100 343 HB VAL 109 HB VAL 109 5.671 36.327 6.692 344 HG11 VAL 109 HG11 VAL 109 3.975 38.151 4.992 345 HG12 VAL 109 HG12 VAL 109 3.378 37.050 6.236 346 HG13 VAL 109 HG13 VAL 109 4.407 38.413 6.681 347 HG21 VAL 109 HG21 VAL 109 4.138 35.443 4.724 348 HG22 VAL 109 HG22 VAL 109 5.471 36.047 3.740 349 HG23 VAL 109 HG23 VAL 109 5.769 34.824 4.974 350 H ALA 110 H ALA 110 5.713 39.995 5.177 351 HA ALA 110 HA ALA 110 4.742 39.966 2.524 352 HB1 ALA 110 HB1 ALA 110 3.781 41.871 3.147 353 HB2 ALA 110 HB2 ALA 110 4.565 41.677 4.716 354 HB3 ALA 110 HB3 ALA 110 5.344 42.630 3.452 355 H GLU 111 H GLU 111 7.703 41.300 3.961 356 HA GLU 111 HA GLU 111 8.693 42.343 1.498 357 HB2 GLU 111 HB2 GLU 111 9.315 43.051 3.891 358 HB3 GLU 111 HB3 GLU 111 10.390 41.661 3.887 359 HG2 GLU 111 HG2 GLU 111 11.666 43.580 3.310 360 HG3 GLU 111 HG3 GLU 111 11.488 42.592 1.861 361 H GLN 112 H GLN 112 8.984 39.299 3.189 362 HA GLN 112 HA GLN 112 11.169 38.295 1.660 363 HB2 GLN 112 HB2 GLN 112 9.082 36.802 3.259 364 HB3 GLN 112 HB3 GLN 112 10.585 36.120 2.650 365 HG2 GLN 112 HG2 GLN 112 10.553 38.474 4.506 366 HG3 GLN 112 HG3 GLN 112 10.502 36.814 5.097 367 HE21 GLN 112 HE21 GLN 112 12.463 39.345 4.068 368 HE22 GLN 112 HE22 GLN 112 13.960 38.489 3.987 369 H VAL 113 H VAL 113 7.651 37.885 1.489 370 HA VAL 113 HA VAL 113 7.698 36.097 -0.718 371 HB VAL 113 HB VAL 113 5.774 36.364 0.869 372 HG11 VAL 113 HG11 VAL 113 5.703 38.787 0.979 373 HG12 VAL 113 HG12 VAL 113 5.291 38.873 -0.735 374 HG13 VAL 113 HG13 VAL 113 4.156 38.159 0.411 375 HG21 VAL 113 HG21 VAL 113 5.419 36.465 -2.104 376 HG22 VAL 113 HG22 VAL 113 5.285 35.086 -1.013 377 HG23 VAL 113 HG23 VAL 113 4.026 36.322 -1.031 378 H MET 114 H MET 114 7.662 39.578 -0.409 379 HA MET 114 HA MET 114 7.023 40.063 -3.169 380 HB2 MET 114 HB2 MET 114 7.636 41.695 -0.782 381 HB3 MET 114 HB3 MET 114 8.088 42.407 -2.324 382 HG2 MET 114 HG2 MET 114 5.425 41.285 -2.402 383 HG3 MET 114 HG3 MET 114 5.599 42.482 -1.122 384 HE1 MET 114 HE1 MET 114 6.997 42.184 -4.938 385 HE2 MET 114 HE2 MET 114 5.317 41.672 -4.762 386 HE3 MET 114 HE3 MET 114 5.701 43.157 -5.636 387 H LYS 115 H LYS 115 9.940 39.849 -1.224 388 HA LYS 115 HA LYS 115 11.651 40.709 -3.390 389 HB2 LYS 115 HB2 LYS 115 12.217 39.629 -0.628 390 HB3 LYS 115 HB3 LYS 115 13.485 40.040 -1.776 391 HG2 LYS 115 HG2 LYS 115 11.403 41.969 -0.773 392 HG3 LYS 115 HG3 LYS 115 13.032 41.812 -0.112 393 HD2 LYS 115 HD2 LYS 115 12.370 42.521 -2.971 394 HD3 LYS 115 HD3 LYS 115 12.843 43.671 -1.719 395 HE2 LYS 115 HE2 LYS 115 14.859 41.878 -1.541 396 HE3 LYS 115 HE3 LYS 115 14.471 41.757 -3.257 397 HZ1 LYS 115 HZ1 LYS 115 15.085 44.284 -1.821 398 HZ2 LYS 115 HZ2 LYS 115 14.777 44.128 -3.477 399 HZ3 LYS 115 HZ3 LYS 115 16.169 43.437 -2.807 400 H ALA 116 H ALA 116 10.338 37.759 -2.207 401 HA ALA 116 HA ALA 116 12.334 36.081 -3.473 402 HB1 ALA 116 HB1 ALA 116 11.027 34.218 -2.651 403 HB2 ALA 116 HB2 ALA 116 11.264 35.399 -1.362 404 HB3 ALA 116 HB3 ALA 116 9.713 35.304 -2.198 405 H ASP 117 H ASP 117 9.397 37.609 -4.330 406 HA ASP 117 HA ASP 117 8.799 35.763 -6.492 407 HB2 ASP 117 HB2 ASP 117 7.444 38.087 -5.234 408 HB3 ASP 117 HB3 ASP 117 7.095 37.789 -6.935 409 H ALA 118 H ALA 118 10.768 36.031 -7.677 410 HA ALA 118 HA ALA 118 11.524 38.583 -8.729 411 HB1 ALA 118 HB1 ALA 118 12.756 36.123 -8.470 412 HB2 ALA 118 HB2 ALA 118 12.540 36.304 -10.211 413 HB3 ALA 118 HB3 ALA 118 13.408 37.539 -9.298 414 H ASN 119 H ASN 119 9.225 36.216 -9.607 415 HA ASN 119 HA ASN 119 9.151 36.962 -12.409 416 HB2 ASN 119 HB2 ASN 119 7.067 35.417 -12.328 417 HB3 ASN 119 HB3 ASN 119 8.661 34.694 -12.131 418 HD21 ASN 119 HD21 ASN 119 7.781 32.929 -11.046 419 HD22 ASN 119 HD22 ASN 119 7.231 33.044 -9.412 420 H GLY 120 H GLY 120 8.092 38.363 -9.635 421 HA2 GLY 120 HA2 GLY 120 6.443 39.880 -9.105 422 HA3 GLY 120 HA3 GLY 120 6.631 40.385 -10.778 423 H ASP 121 H ASP 121 5.520 37.190 -9.920 424 HA ASP 121 HA ASP 121 3.152 37.494 -11.477 425 HB2 ASP 121 HB2 ASP 121 2.607 35.202 -10.478 426 HB3 ASP 121 HB3 ASP 121 4.074 35.322 -11.446 427 H GLY 122 H GLY 122 3.936 38.070 -8.184 428 HA2 GLY 122 HA2 GLY 122 2.648 39.086 -6.552 429 HA3 GLY 122 HA3 GLY 122 1.290 39.071 -7.667 430 H TYR 123 H TYR 123 2.478 36.002 -7.605 431 HA TYR 123 HA TYR 123 0.957 35.184 -5.240 432 HB2 TYR 123 HB2 TYR 123 0.553 33.716 -7.829 433 HB3 TYR 123 HB3 TYR 123 -0.451 33.704 -6.383 434 HD1 TYR 123 HD1 TYR 123 -1.541 36.029 -5.776 435 HD2 TYR 123 HD2 TYR 123 -0.141 34.961 -9.649 436 HE1 TYR 123 HE1 TYR 123 -2.999 37.743 -6.768 437 HE2 TYR 123 HE2 TYR 123 -1.594 36.673 -10.652 438 HH TYR 123 HH TYR 123 -3.093 39.096 -8.853 439 H ILE 124 H ILE 124 1.374 32.958 -4.597 440 HA ILE 124 HA ILE 124 3.894 31.878 -5.664 441 HB ILE 124 HB ILE 124 4.961 32.173 -3.742 442 HG12 ILE 124 HG12 ILE 124 2.628 30.846 -2.343 443 HG13 ILE 124 HG13 ILE 124 3.970 29.991 -3.096 444 HG21 ILE 124 HG21 ILE 124 2.378 33.346 -2.722 445 HG22 ILE 124 HG22 ILE 124 3.946 33.506 -1.933 446 HG23 ILE 124 HG23 ILE 124 3.685 34.215 -3.527 447 HD11 ILE 124 HD11 ILE 124 3.953 31.665 -0.622 448 HD12 ILE 124 HD12 ILE 124 4.531 30.014 -0.853 449 HD13 ILE 124 HD13 ILE 124 5.449 31.371 -1.507 450 H THR 125 H THR 125 3.786 29.795 -6.183 451 HA THR 125 HA THR 125 1.401 28.284 -5.473 452 HB THR 125 HB THR 125 2.133 28.263 -7.815 453 HG1 THR 125 HG1 THR 125 2.239 25.889 -7.976 454 HG21 THR 125 HG21 THR 125 4.463 28.468 -7.773 455 HG22 THR 125 HG22 THR 125 4.202 26.801 -8.288 456 HG23 THR 125 HG23 THR 125 4.651 27.149 -6.619 457 H LEU 126 H LEU 126 2.045 25.751 -5.325 458 HA LEU 126 HA LEU 126 2.973 25.322 -2.763 459 HB2 LEU 126 HB2 LEU 126 3.268 23.315 -4.981 460 HB3 LEU 126 HB3 LEU 126 3.015 23.006 -3.264 461 HG LEU 126 HG LEU 126 0.821 24.533 -4.303 462 HD11 LEU 126 HD11 LEU 126 1.796 23.198 -6.375 463 HD12 LEU 126 HD12 LEU 126 0.063 23.364 -6.099 464 HD13 LEU 126 HD13 LEU 126 0.892 21.881 -5.628 465 HD21 LEU 126 HD21 LEU 126 0.496 21.687 -3.599 466 HD22 LEU 126 HD22 LEU 126 -0.372 23.108 -3.019 467 HD23 LEU 126 HD23 LEU 126 1.218 22.717 -2.363 468 H GLU 127 H GLU 127 4.772 25.398 -5.785 469 HA GLU 127 HA GLU 127 7.200 24.352 -4.871 470 HB2 GLU 127 HB2 GLU 127 6.342 26.052 -7.144 471 HB3 GLU 127 HB3 GLU 127 8.053 26.084 -6.742 472 HG2 GLU 127 HG2 GLU 127 6.415 23.661 -7.449 473 HG3 GLU 127 HG3 GLU 127 7.644 24.438 -8.447 474 H GLU 128 H GLU 128 6.258 27.775 -5.230 475 HA GLU 128 HA GLU 128 8.534 28.887 -4.074 476 HB2 GLU 128 HB2 GLU 128 5.783 30.079 -3.778 477 HB3 GLU 128 HB3 GLU 128 7.322 30.916 -3.918 478 HG2 GLU 128 HG2 GLU 128 7.436 29.813 -6.254 479 HG3 GLU 128 HG3 GLU 128 5.701 29.583 -6.040 480 H PHE 129 H PHE 129 5.481 27.897 -2.567 481 HA PHE 129 HA PHE 129 5.974 28.798 0.019 482 HB2 PHE 129 HB2 PHE 129 3.865 27.658 -1.077 483 HB3 PHE 129 HB3 PHE 129 4.567 26.192 -0.399 484 HD1 PHE 129 HD1 PHE 129 3.067 29.446 0.373 485 HD2 PHE 129 HD2 PHE 129 4.604 25.811 1.967 486 HE1 PHE 129 HE1 PHE 129 2.062 29.981 2.554 487 HE2 PHE 129 HE2 PHE 129 3.601 26.340 4.150 488 HZ PHE 129 HZ PHE 129 2.327 28.428 4.446 489 H LEU 130 H LEU 130 6.953 25.808 -1.574 490 HA LEU 130 HA LEU 130 8.081 24.637 0.778 491 HB2 LEU 130 HB2 LEU 130 7.431 23.094 -0.837 492 HB3 LEU 130 HB3 LEU 130 8.169 24.012 -2.147 493 HG LEU 130 HG LEU 130 10.397 23.349 -1.324 494 HD11 LEU 130 HD11 LEU 130 8.792 22.329 0.893 495 HD12 LEU 130 HD12 LEU 130 10.499 22.767 0.832 496 HD13 LEU 130 HD13 LEU 130 9.977 21.176 0.279 497 HD21 LEU 130 HD21 LEU 130 9.857 20.749 -1.678 498 HD22 LEU 130 HD22 LEU 130 9.879 21.918 -2.998 499 HD23 LEU 130 HD23 LEU 130 8.346 21.442 -2.266 500 H GLU 131 H GLU 131 9.144 26.953 -1.511 501 HA GLU 131 HA GLU 131 11.964 26.513 -1.070 502 HB2 GLU 131 HB2 GLU 131 10.698 27.540 -3.159 503 HB3 GLU 131 HB3 GLU 131 10.918 29.039 -2.266 504 HG2 GLU 131 HG2 GLU 131 13.405 28.133 -2.109 505 HG3 GLU 131 HG3 GLU 131 12.918 27.302 -3.586 506 H PHE 132 H PHE 132 9.437 28.237 0.448 507 HA PHE 132 HA PHE 132 11.363 29.906 1.920 508 HB2 PHE 132 HB2 PHE 132 8.371 30.268 1.929 509 HB3 PHE 132 HB3 PHE 132 9.611 31.431 2.386 510 HD1 PHE 132 HD2 PHE 132 11.445 31.039 0.029 511 HD2 PHE 132 HD1 PHE 132 7.222 31.492 0.291 512 HE1 PHE 132 HE2 PHE 132 11.408 31.973 -2.246 513 HE2 PHE 132 HE1 PHE 132 7.177 32.426 -1.985 514 HZ PHE 132 HZ PHE 132 9.273 32.669 -3.256 515 H SER 133 H SER 133 11.838 27.791 3.041 516 HA SER 133 HA SER 133 10.422 27.756 5.550 517 HB2 SER 133 HB2 SER 133 9.516 25.999 3.591 518 HB3 SER 133 HB3 SER 133 10.573 25.009 4.597 519 HG SER 133 HG SER 133 8.902 24.921 5.866 520 H LEU 134 H LEU 134 12.389 28.291 6.471 521 HA LEU 134 HA LEU 134 14.027 26.240 7.362 522 HB2 LEU 134 HB2 LEU 134 14.625 26.886 4.719 523 HB3 LEU 134 HB3 LEU 134 15.870 27.691 5.671 524 HG LEU 134 HG LEU 134 15.329 24.834 6.267 525 HD11 LEU 134 HD11 LEU 134 15.536 25.443 3.654 526 HD12 LEU 134 HD12 LEU 134 16.154 23.953 4.366 527 HD13 LEU 134 HD13 LEU 134 17.243 25.311 4.080 528 HD21 LEU 134 HD21 LEU 134 17.197 26.727 7.029 529 HD22 LEU 134 HD22 LEU 134 18.064 25.715 5.875 530 HD23 LEU 134 HD23 LEU 134 17.302 24.986 7.288 Start of MODEL 4 1 H GLY 67 H GLY 67 0.459 0.912 -1.682 2 HA2 GLY 67 HA2 GLY 67 2.267 0.562 -3.087 3 HA3 GLY 67 HA3 GLY 67 1.186 0.724 -4.464 4 H GLN 68 H GLN 68 0.283 3.363 -3.163 5 HA GLN 68 HA GLN 68 1.981 5.037 -4.703 6 HB2 GLN 68 HB2 GLN 68 -0.436 5.339 -3.078 7 HB3 GLN 68 HB3 GLN 68 0.623 6.741 -3.019 8 HG2 GLN 68 HG2 GLN 68 -1.139 6.823 -4.779 9 HG3 GLN 68 HG3 GLN 68 0.510 7.035 -5.368 10 HE21 GLN 68 HE21 GLN 68 0.252 6.324 -7.413 11 HE22 GLN 68 HE22 GLN 68 -0.205 4.712 -7.832 12 H ASP 69 H ASP 69 3.825 6.006 -4.173 13 HA ASP 69 HA ASP 69 5.097 5.530 -1.692 14 HB2 ASP 69 HB2 ASP 69 5.719 7.067 -4.158 15 HB3 ASP 69 HB3 ASP 69 6.590 7.523 -2.696 16 H LEU 70 H LEU 70 5.460 6.844 0.060 17 HA LEU 70 HA LEU 70 3.468 8.640 0.819 18 HB2 LEU 70 HB2 LEU 70 6.008 7.699 1.879 19 HB3 LEU 70 HB3 LEU 70 5.662 9.367 2.328 20 HG LEU 70 HG LEU 70 3.343 7.724 2.767 21 HD11 LEU 70 HD11 LEU 70 5.483 6.139 3.017 22 HD12 LEU 70 HD12 LEU 70 4.061 6.009 4.053 23 HD13 LEU 70 HD13 LEU 70 5.487 6.882 4.617 24 HD21 LEU 70 HD21 LEU 70 3.518 9.775 3.887 25 HD22 LEU 70 HD22 LEU 70 5.160 9.437 4.435 26 HD23 LEU 70 HD23 LEU 70 3.799 8.561 5.135 27 H SER 71 H SER 71 4.249 10.935 1.721 28 HA SER 71 HA SER 71 5.268 12.368 -0.635 29 HB2 SER 71 HB2 SER 71 3.205 12.973 1.406 30 HB3 SER 71 HB3 SER 71 4.185 14.335 0.863 31 HG SER 71 HG SER 71 3.068 12.589 -1.031 32 H ASP 72 H ASP 72 6.931 13.815 -0.474 33 HA ASP 72 HA ASP 72 9.053 13.464 1.110 34 HB2 ASP 72 HB2 ASP 72 8.026 15.727 -0.415 35 HB3 ASP 72 HB3 ASP 72 9.035 16.233 0.938 36 H ASP 73 H ASP 73 9.898 14.275 3.051 37 HA ASP 73 HA ASP 73 8.336 14.219 5.279 38 HB2 ASP 73 HB2 ASP 73 10.781 15.976 5.004 39 HB3 ASP 73 HB3 ASP 73 10.145 15.271 6.487 40 H LYS 74 H LYS 74 8.629 16.803 3.023 41 HA LYS 74 HA LYS 74 7.537 18.811 4.796 42 HB2 LYS 74 HB2 LYS 74 7.529 20.231 2.746 43 HB3 LYS 74 HB3 LYS 74 9.106 19.556 3.133 44 HG2 LYS 74 HG2 LYS 74 9.239 18.702 1.101 45 HG3 LYS 74 HG3 LYS 74 7.793 17.736 1.406 46 HD2 LYS 74 HD2 LYS 74 6.487 19.868 0.826 47 HD3 LYS 74 HD3 LYS 74 8.009 20.457 0.152 48 HE2 LYS 74 HE2 LYS 74 6.799 19.484 -1.641 49 HE3 LYS 74 HE3 LYS 74 8.086 18.354 -1.226 50 HZ1 LYS 74 HZ1 LYS 74 6.439 17.108 0.100 51 HZ2 LYS 74 HZ2 LYS 74 6.060 17.151 -1.548 52 HZ3 LYS 74 HZ3 LYS 74 5.225 18.144 -0.463 53 H ILE 75 H ILE 75 6.126 16.222 3.734 54 HA ILE 75 HA ILE 75 3.957 16.833 2.155 55 HB ILE 75 HB ILE 75 4.378 14.559 2.829 56 HG12 ILE 75 HG12 ILE 75 1.720 15.558 3.875 57 HG13 ILE 75 HG13 ILE 75 2.078 15.092 2.216 58 HG21 ILE 75 HG21 ILE 75 4.095 13.747 5.064 59 HG22 ILE 75 HG22 ILE 75 5.194 15.124 5.113 60 HG23 ILE 75 HG23 ILE 75 3.513 15.318 5.613 61 HD11 ILE 75 HD11 ILE 75 1.248 13.471 4.431 62 HD12 ILE 75 HD12 ILE 75 1.370 13.061 2.718 63 HD13 ILE 75 HD13 ILE 75 2.775 12.884 3.770 64 H GLY 76 H GLY 76 4.335 17.338 5.638 65 HA2 GLY 76 HA2 GLY 76 1.708 18.142 6.207 66 HA3 GLY 76 HA3 GLY 76 3.131 18.599 7.130 67 H LEU 77 H LEU 77 4.546 20.108 5.350 68 HA LEU 77 HA LEU 77 3.275 22.601 5.519 69 HB2 LEU 77 HB2 LEU 77 5.814 21.690 4.949 70 HB3 LEU 77 HB3 LEU 77 5.305 22.438 3.437 71 HG LEU 77 HG LEU 77 4.822 24.526 4.707 72 HD11 LEU 77 HD11 LEU 77 6.490 23.786 6.973 73 HD12 LEU 77 HD12 LEU 77 4.964 22.904 6.921 74 HD13 LEU 77 HD13 LEU 77 4.963 24.668 6.927 75 HD21 LEU 77 HD21 LEU 77 7.419 24.763 5.343 76 HD22 LEU 77 HD22 LEU 77 6.817 24.813 3.686 77 HD23 LEU 77 HD23 LEU 77 7.490 23.316 4.336 78 H LYS 78 H LYS 78 3.920 20.575 2.660 79 HA LYS 78 HA LYS 78 2.699 22.162 0.746 80 HB2 LYS 78 HB2 LYS 78 3.516 19.370 0.975 81 HB3 LYS 78 HB3 LYS 78 2.121 19.581 -0.073 82 HG2 LYS 78 HG2 LYS 78 3.992 21.593 -0.738 83 HG3 LYS 78 HG3 LYS 78 4.864 20.063 -0.632 84 HD2 LYS 78 HD2 LYS 78 2.266 20.062 -2.066 85 HD3 LYS 78 HD3 LYS 78 3.630 20.855 -2.857 86 HE2 LYS 78 HE2 LYS 78 4.950 18.820 -2.653 87 HE3 LYS 78 HE3 LYS 78 3.622 18.027 -1.807 88 HZ1 LYS 78 HZ1 LYS 78 4.064 18.068 -4.523 89 HZ2 LYS 78 HZ2 LYS 78 2.749 19.103 -4.284 90 HZ3 LYS 78 HZ3 LYS 78 2.679 17.507 -3.729 91 H VAL 79 H VAL 79 1.259 19.681 2.828 92 HA VAL 79 HA VAL 79 -1.323 19.721 1.744 93 HB VAL 79 HB VAL 79 -0.362 19.071 4.527 94 HG11 VAL 79 HG11 VAL 79 -2.603 17.999 4.825 95 HG12 VAL 79 HG12 VAL 79 -2.634 19.763 4.784 96 HG13 VAL 79 HG13 VAL 79 -3.134 18.838 3.367 97 HG21 VAL 79 HG21 VAL 79 -0.127 16.944 3.822 98 HG22 VAL 79 HG22 VAL 79 -1.547 17.020 2.779 99 HG23 VAL 79 HG23 VAL 79 -0.012 17.691 2.229 100 H LEU 80 H LEU 80 -0.054 21.445 4.597 101 HA LEU 80 HA LEU 80 -2.316 22.853 5.303 102 HB2 LEU 80 HB2 LEU 80 0.594 23.276 5.611 103 HB3 LEU 80 HB3 LEU 80 -0.438 24.679 5.878 104 HG LEU 80 HG LEU 80 -0.724 22.054 7.338 105 HD11 LEU 80 HD11 LEU 80 0.491 22.923 9.115 106 HD12 LEU 80 HD12 LEU 80 0.374 24.578 8.518 107 HD13 LEU 80 HD13 LEU 80 1.429 23.420 7.707 108 HD21 LEU 80 HD21 LEU 80 -2.121 23.387 8.861 109 HD22 LEU 80 HD22 LEU 80 -2.784 23.327 7.227 110 HD23 LEU 80 HD23 LEU 80 -1.947 24.775 7.787 111 H PHE 81 H PHE 81 0.208 23.819 2.993 112 HA PHE 81 HA PHE 81 -0.840 26.315 2.311 113 HB2 PHE 81 HB2 PHE 81 1.360 25.857 1.591 114 HB3 PHE 81 HB3 PHE 81 0.882 24.353 0.811 115 HD1 PHE 81 HD2 PHE 81 -0.182 24.364 -1.368 116 HD2 PHE 81 HD1 PHE 81 1.042 27.983 0.508 117 HE1 PHE 81 HE2 PHE 81 -0.409 25.548 -3.513 118 HE2 PHE 81 HE1 PHE 81 0.816 29.174 -1.634 119 HZ PHE 81 HZ PHE 81 0.091 27.956 -3.648 120 H LYS 82 H LYS 82 -1.227 23.216 0.590 121 HA LYS 82 HA LYS 82 -2.988 24.080 -1.372 122 HB2 LYS 82 HB2 LYS 82 -1.942 21.888 -1.453 123 HB3 LYS 82 HB3 LYS 82 -2.821 21.382 -0.016 124 HG2 LYS 82 HG2 LYS 82 -4.672 22.293 -1.998 125 HG3 LYS 82 HG3 LYS 82 -3.584 21.094 -2.701 126 HD2 LYS 82 HD2 LYS 82 -4.611 20.436 -0.024 127 HD3 LYS 82 HD3 LYS 82 -5.829 20.495 -1.301 128 HE2 LYS 82 HE2 LYS 82 -5.211 18.385 -1.726 129 HE3 LYS 82 HE3 LYS 82 -3.804 19.110 -2.505 130 HZ1 LYS 82 HZ1 LYS 82 -3.621 18.695 0.369 131 HZ2 LYS 82 HZ2 LYS 82 -2.447 18.494 -0.832 132 HZ3 LYS 82 HZ3 LYS 82 -3.618 17.299 -0.586 133 H LEU 83 H LEU 83 -3.762 22.649 1.796 134 HA LEU 83 HA LEU 83 -6.559 22.872 1.537 135 HB2 LEU 83 HB2 LEU 83 -4.890 21.702 3.318 136 HB3 LEU 83 HB3 LEU 83 -5.436 23.094 4.248 137 HG LEU 83 HG LEU 83 -7.130 20.881 3.100 138 HD11 LEU 83 HD11 LEU 83 -5.799 20.597 5.274 139 HD12 LEU 83 HD12 LEU 83 -7.523 20.229 5.303 140 HD13 LEU 83 HD13 LEU 83 -6.937 21.757 5.961 141 HD21 LEU 83 HD21 LEU 83 -8.251 23.049 2.837 142 HD22 LEU 83 HD22 LEU 83 -8.016 23.371 4.555 143 HD23 LEU 83 HD23 LEU 83 -9.048 22.036 4.041 144 H MET 84 H MET 84 -4.108 25.164 2.345 145 HA MET 84 HA MET 84 -5.762 27.028 3.720 146 HB2 MET 84 HB2 MET 84 -3.679 27.714 4.192 147 HB3 MET 84 HB3 MET 84 -3.007 26.884 2.795 148 HG2 MET 84 HG2 MET 84 -3.479 28.733 1.373 149 HG3 MET 84 HG3 MET 84 -4.412 29.536 2.635 150 HE1 MET 84 HE1 MET 84 -0.892 29.778 0.933 151 HE2 MET 84 HE2 MET 84 0.115 29.172 2.247 152 HE3 MET 84 HE3 MET 84 -1.117 28.133 1.529 153 H ASP 85 H ASP 85 -4.886 26.527 0.354 154 HA ASP 85 HA ASP 85 -6.237 28.943 -0.506 155 HB2 ASP 85 HB2 ASP 85 -4.461 26.942 -1.724 156 HB3 ASP 85 HB3 ASP 85 -5.725 27.534 -2.798 157 H VAL 86 H VAL 86 -8.330 28.346 0.387 158 HA VAL 86 HA VAL 86 -9.809 26.101 -0.350 159 HB VAL 86 HB VAL 86 -10.491 27.650 1.441 160 HG11 VAL 86 HG11 VAL 86 -10.267 29.583 -0.625 161 HG12 VAL 86 HG12 VAL 86 -11.939 29.577 -0.059 162 HG13 VAL 86 HG13 VAL 86 -10.621 29.836 1.084 163 HG21 VAL 86 HG21 VAL 86 -12.079 26.101 0.110 164 HG22 VAL 86 HG22 VAL 86 -12.773 27.311 1.188 165 HG23 VAL 86 HG23 VAL 86 -12.726 27.603 -0.550 166 H ASP 87 H ASP 87 -8.861 28.794 -2.217 167 HA ASP 87 HA ASP 87 -11.015 28.651 -4.124 168 HB2 ASP 87 HB2 ASP 87 -9.422 30.160 -5.466 169 HB3 ASP 87 HB3 ASP 87 -10.060 30.791 -3.950 170 H GLY 88 H GLY 88 -8.506 26.637 -3.471 171 HA2 GLY 88 HA2 GLY 88 -7.360 25.033 -4.656 172 HA3 GLY 88 HA3 GLY 88 -8.824 24.959 -5.625 173 H ASP 89 H ASP 89 -6.403 27.537 -5.288 174 HA ASP 89 HA ASP 89 -6.167 27.597 -8.204 175 HB2 ASP 89 HB2 ASP 89 -4.932 29.772 -7.733 176 HB3 ASP 89 HB3 ASP 89 -6.645 29.746 -7.325 177 H GLY 90 H GLY 90 -4.459 26.629 -5.398 178 HA2 GLY 90 HA2 GLY 90 -2.485 25.420 -5.272 179 HA3 GLY 90 HA3 GLY 90 -2.277 25.643 -7.003 180 H LYS 91 H LYS 91 -2.849 28.644 -5.922 181 HA LYS 91 HA LYS 91 -0.071 29.175 -5.135 182 HB2 LYS 91 HB2 LYS 91 -0.302 31.290 -6.620 183 HB3 LYS 91 HB3 LYS 91 0.082 29.752 -7.383 184 HG2 LYS 91 HG2 LYS 91 -1.793 29.760 -8.581 185 HG3 LYS 91 HG3 LYS 91 -2.780 30.231 -7.196 186 HD2 LYS 91 HD2 LYS 91 -2.769 32.393 -7.787 187 HD3 LYS 91 HD3 LYS 91 -1.047 32.370 -8.176 188 HE2 LYS 91 HE2 LYS 91 -1.416 31.974 -10.364 189 HE3 LYS 91 HE3 LYS 91 -2.780 30.903 -10.046 190 HZ1 LYS 91 HZ1 LYS 91 -4.094 32.557 -10.667 191 HZ2 LYS 91 HZ2 LYS 91 -2.798 33.637 -10.779 192 HZ3 LYS 91 HZ3 LYS 91 -3.602 33.433 -9.306 193 H LEU 92 H LEU 92 0.165 30.673 -3.566 194 HA LEU 92 HA LEU 92 -2.282 31.853 -2.482 195 HB2 LEU 92 HB2 LEU 92 -1.207 32.001 -0.433 196 HB3 LEU 92 HB3 LEU 92 -0.592 30.494 -1.113 197 HG LEU 92 HG LEU 92 1.364 32.088 -1.925 198 HD11 LEU 92 HD11 LEU 92 0.933 33.397 0.686 199 HD12 LEU 92 HD12 LEU 92 -0.067 33.960 -0.654 200 HD13 LEU 92 HD13 LEU 92 1.690 34.010 -0.785 201 HD21 LEU 92 HD21 LEU 92 0.895 30.613 0.604 202 HD22 LEU 92 HD22 LEU 92 2.328 31.636 0.511 203 HD23 LEU 92 HD23 LEU 92 2.090 30.342 -0.664 204 H THR 93 H THR 93 -2.593 34.024 -2.236 205 HA THR 93 HA THR 93 -0.811 35.749 -3.779 206 HB THR 93 HB THR 93 -3.180 35.901 -4.314 207 HG1 THR 93 HG1 THR 93 -2.506 38.262 -2.889 208 HG21 THR 93 HG21 THR 93 -3.526 35.681 -1.528 209 HG22 THR 93 HG22 THR 93 -4.777 35.822 -2.763 210 HG23 THR 93 HG23 THR 93 -4.139 37.269 -1.983 211 H LYS 94 H LYS 94 -0.203 37.859 -2.956 212 HA LYS 94 HA LYS 94 1.246 37.934 -0.704 213 HB2 LYS 94 HB2 LYS 94 0.832 39.777 -2.482 214 HB3 LYS 94 HB3 LYS 94 -0.414 40.345 -1.378 215 HG2 LYS 94 HG2 LYS 94 1.611 40.151 0.347 216 HG3 LYS 94 HG3 LYS 94 2.529 40.437 -1.133 217 HD2 LYS 94 HD2 LYS 94 0.266 42.160 -0.122 218 HD3 LYS 94 HD3 LYS 94 1.984 42.526 0.058 219 HE2 LYS 94 HE2 LYS 94 1.756 43.643 -1.869 220 HE3 LYS 94 HE3 LYS 94 1.773 42.050 -2.627 221 HZ1 LYS 94 HZ1 LYS 94 -0.759 42.146 -2.142 222 HZ2 LYS 94 HZ2 LYS 94 -0.132 42.961 -3.484 223 HZ3 LYS 94 HZ3 LYS 94 -0.510 43.818 -2.075 224 H GLU 95 H GLU 95 -2.158 38.997 -0.813 225 HA GLU 95 HA GLU 95 -2.498 39.571 1.869 226 HB2 GLU 95 HB2 GLU 95 -4.513 38.367 -0.036 227 HB3 GLU 95 HB3 GLU 95 -4.903 39.126 1.501 228 HG2 GLU 95 HG2 GLU 95 -3.870 41.228 0.630 229 HG3 GLU 95 HG3 GLU 95 -3.737 40.438 -0.940 230 H GLU 96 H GLU 96 -2.882 36.456 0.214 231 HA GLU 96 HA GLU 96 -3.767 34.986 2.437 232 HB2 GLU 96 HB2 GLU 96 -3.819 34.276 0.006 233 HB3 GLU 96 HB3 GLU 96 -2.109 33.896 0.162 234 HG2 GLU 96 HG2 GLU 96 -2.502 32.125 1.603 235 HG3 GLU 96 HG3 GLU 96 -4.106 32.709 2.044 236 H VAL 97 H VAL 97 -0.503 35.490 1.131 237 HA VAL 97 HA VAL 97 0.921 33.850 2.859 238 HB VAL 97 HB VAL 97 1.590 35.641 0.869 239 HG11 VAL 97 HG11 VAL 97 3.227 37.159 1.784 240 HG12 VAL 97 HG12 VAL 97 1.667 37.448 2.559 241 HG13 VAL 97 HG13 VAL 97 2.926 36.556 3.414 242 HG21 VAL 97 HG21 VAL 97 4.005 34.862 2.020 243 HG22 VAL 97 HG22 VAL 97 2.857 33.602 2.475 244 HG23 VAL 97 HG23 VAL 97 3.097 34.005 0.775 245 H THR 98 H THR 98 -0.397 37.054 3.373 246 HA THR 98 HA THR 98 1.015 37.569 5.801 247 HB THR 98 HB THR 98 -1.532 38.832 4.769 248 HG1 THR 98 HG1 THR 98 0.990 40.070 4.675 249 HG21 THR 98 HG21 THR 98 -1.488 39.466 6.991 250 HG22 THR 98 HG22 THR 98 -0.543 40.755 6.243 251 HG23 THR 98 HG23 THR 98 0.273 39.431 7.075 252 H SER 99 H SER 99 -2.108 36.171 4.982 253 HA SER 99 HA SER 99 -3.125 36.110 7.634 254 HB2 SER 99 HB2 SER 99 -4.138 34.013 5.861 255 HB3 SER 99 HB3 SER 99 -5.001 35.332 6.654 256 HG SER 99 HG SER 99 -4.838 35.325 4.245 257 H PHE 100 H PHE 100 -1.354 33.797 5.639 258 HA PHE 100 HA PHE 100 -1.514 31.644 7.485 259 HB2 PHE 100 HB2 PHE 100 -1.057 31.167 5.170 260 HB3 PHE 100 HB3 PHE 100 0.376 32.190 5.190 261 HD1 PHE 100 HD1 PHE 100 2.416 31.448 6.308 262 HD2 PHE 100 HD2 PHE 100 -1.014 28.942 6.048 263 HE1 PHE 100 HE1 PHE 100 3.798 29.502 6.902 264 HE2 PHE 100 HE2 PHE 100 0.362 26.991 6.644 265 HZ PHE 100 HZ PHE 100 2.771 27.270 7.073 266 H PHE 101 H PHE 101 0.946 34.106 6.820 267 HA PHE 101 HA PHE 101 2.756 33.117 8.808 268 HB2 PHE 101 HB2 PHE 101 2.988 34.814 6.652 269 HB3 PHE 101 HB3 PHE 101 3.087 35.920 8.018 270 HD1 PHE 101 HD1 PHE 101 4.666 33.081 6.326 271 HD2 PHE 101 HD2 PHE 101 4.958 35.881 9.519 272 HE1 PHE 101 HE1 PHE 101 7.028 32.469 6.643 273 HE2 PHE 101 HE2 PHE 101 7.321 35.274 9.841 274 HZ PHE 101 HZ PHE 101 8.359 33.566 8.402 275 H LYS 102 H LYS 102 0.075 35.293 8.768 276 HA LYS 102 HA LYS 102 0.588 36.969 10.900 277 HB2 LYS 102 HB2 LYS 102 -1.767 36.014 9.485 278 HB3 LYS 102 HB3 LYS 102 -2.102 36.315 11.185 279 HG2 LYS 102 HG2 LYS 102 -0.560 38.470 10.077 280 HG3 LYS 102 HG3 LYS 102 -2.007 38.179 9.108 281 HD2 LYS 102 HD2 LYS 102 -3.075 38.037 11.568 282 HD3 LYS 102 HD3 LYS 102 -1.741 39.149 11.888 283 HE2 LYS 102 HE2 LYS 102 -3.563 40.518 11.312 284 HE3 LYS 102 HE3 LYS 102 -2.554 40.459 9.867 285 HZ1 LYS 102 HZ1 LYS 102 -5.134 39.111 10.367 286 HZ2 LYS 102 HZ2 LYS 102 -4.078 38.553 9.168 287 HZ3 LYS 102 HZ3 LYS 102 -4.700 40.124 9.082 288 H LYS 103 H LYS 103 -0.181 33.577 10.907 289 HA LYS 103 HA LYS 103 -1.074 33.223 13.515 290 HB2 LYS 103 HB2 LYS 103 0.528 31.440 11.689 291 HB3 LYS 103 HB3 LYS 103 -0.003 30.912 13.281 292 HG2 LYS 103 HG2 LYS 103 -1.879 31.914 11.154 293 HG3 LYS 103 HG3 LYS 103 -1.466 30.212 11.379 294 HD2 LYS 103 HD2 LYS 103 -2.313 31.615 13.818 295 HD3 LYS 103 HD3 LYS 103 -3.559 31.465 12.577 296 HE2 LYS 103 HE2 LYS 103 -3.923 29.437 13.455 297 HE3 LYS 103 HE3 LYS 103 -2.461 28.963 12.590 298 HZ1 LYS 103 HZ1 LYS 103 -1.781 30.144 15.065 299 HZ2 LYS 103 HZ2 LYS 103 -1.446 28.583 14.506 300 HZ3 LYS 103 HZ3 LYS 103 -2.895 28.897 15.323 301 H HIS 104 H HIS 104 2.082 33.980 12.331 302 HA HIS 104 HA HIS 104 3.311 33.365 14.917 303 HB2 HIS 104 HB2 HIS 104 4.243 33.041 12.351 304 HB3 HIS 104 HB3 HIS 104 5.024 34.541 12.845 305 HD1 HIS 104 HD1 HIS 104 5.455 33.734 15.856 306 HD2 HIS 104 HD2 HIS 104 6.444 31.408 12.559 307 HE1 HIS 104 HE1 HIS 104 7.251 32.166 16.654 308 H GLY 105 H GLY 105 2.123 35.993 13.050 309 HA2 GLY 105 HA2 GLY 105 1.699 38.135 13.941 310 HA3 GLY 105 HA3 GLY 105 2.910 37.836 15.178 311 H ILE 106 H ILE 106 4.398 36.829 12.501 312 HA ILE 106 HA ILE 106 5.924 39.272 12.266 313 HB ILE 106 HB ILE 106 6.248 36.622 10.853 314 HG12 ILE 106 HG12 ILE 106 8.010 37.740 13.022 315 HG13 ILE 106 HG13 ILE 106 6.573 36.801 13.411 316 HG21 ILE 106 HG21 ILE 106 7.680 39.203 10.649 317 HG22 ILE 106 HG22 ILE 106 8.663 37.741 10.670 318 HG23 ILE 106 HG23 ILE 106 7.421 37.950 9.436 319 HD11 ILE 106 HD11 ILE 106 8.447 35.618 11.461 320 HD12 ILE 106 HD12 ILE 106 8.982 35.717 13.139 321 HD13 ILE 106 HD13 ILE 106 7.498 34.857 12.736 322 H GLU 107 H GLU 107 5.795 40.744 10.688 323 HA GLU 107 HA GLU 107 3.899 40.242 8.505 324 HB2 GLU 107 HB2 GLU 107 5.029 42.867 9.487 325 HB3 GLU 107 HB3 GLU 107 3.787 42.670 8.258 326 HG2 GLU 107 HG2 GLU 107 3.070 41.327 10.713 327 HG3 GLU 107 HG3 GLU 107 3.406 43.038 10.978 328 H LYS 108 H LYS 108 7.190 40.376 9.137 329 HA LYS 108 HA LYS 108 8.289 41.641 6.924 330 HB2 LYS 108 HB2 LYS 108 9.675 40.901 8.761 331 HB3 LYS 108 HB3 LYS 108 9.266 39.220 8.446 332 HG2 LYS 108 HG2 LYS 108 10.851 39.019 6.896 333 HG3 LYS 108 HG3 LYS 108 10.414 40.547 6.128 334 HD2 LYS 108 HD2 LYS 108 11.725 40.834 8.735 335 HD3 LYS 108 HD3 LYS 108 12.732 40.085 7.493 336 HE2 LYS 108 HE2 LYS 108 13.201 42.250 7.019 337 HE3 LYS 108 HE3 LYS 108 11.728 42.102 6.060 338 HZ1 LYS 108 HZ1 LYS 108 11.691 43.030 8.870 339 HZ2 LYS 108 HZ2 LYS 108 10.481 43.189 7.701 340 HZ3 LYS 108 HZ3 LYS 108 11.901 44.098 7.574 341 H VAL 109 H VAL 109 6.631 38.612 7.154 342 HA VAL 109 HA VAL 109 7.581 37.199 4.984 343 HB VAL 109 HB VAL 109 5.833 36.411 6.595 344 HG11 VAL 109 HG11 VAL 109 4.374 38.353 6.543 345 HG12 VAL 109 HG12 VAL 109 3.999 38.046 4.845 346 HG13 VAL 109 HG13 VAL 109 3.484 36.901 6.085 347 HG21 VAL 109 HG21 VAL 109 6.326 35.092 4.649 348 HG22 VAL 109 HG22 VAL 109 4.582 35.082 4.908 349 HG23 VAL 109 HG23 VAL 109 5.281 36.099 3.648 350 H ALA 110 H ALA 110 5.579 40.051 5.035 351 HA ALA 110 HA ALA 110 4.598 39.909 2.388 352 HB1 ALA 110 HB1 ALA 110 3.479 41.727 3.002 353 HB2 ALA 110 HB2 ALA 110 4.296 41.629 4.563 354 HB3 ALA 110 HB3 ALA 110 4.974 42.625 3.275 355 H GLU 111 H GLU 111 7.436 41.516 3.795 356 HA GLU 111 HA GLU 111 8.327 42.603 1.313 357 HB2 GLU 111 HB2 GLU 111 8.892 43.390 3.700 358 HB3 GLU 111 HB3 GLU 111 10.090 42.103 3.699 359 HG2 GLU 111 HG2 GLU 111 11.019 44.303 3.100 360 HG3 GLU 111 HG3 GLU 111 11.236 43.090 1.839 361 H GLN 112 H GLN 112 8.896 39.625 3.054 362 HA GLN 112 HA GLN 112 11.152 38.790 1.526 363 HB2 GLN 112 HB2 GLN 112 9.229 37.038 3.061 364 HB3 GLN 112 HB3 GLN 112 10.885 36.655 2.608 365 HG2 GLN 112 HG2 GLN 112 10.930 39.064 4.096 366 HG3 GLN 112 HG3 GLN 112 9.929 37.903 4.967 367 HE21 GLN 112 HE21 GLN 112 13.026 38.112 3.255 368 HE22 GLN 112 HE22 GLN 112 13.894 37.090 4.343 369 H VAL 113 H VAL 113 7.683 38.064 1.384 370 HA VAL 113 HA VAL 113 7.871 36.250 -0.790 371 HB VAL 113 HB VAL 113 5.935 36.400 0.802 372 HG11 VAL 113 HG11 VAL 113 4.167 38.038 0.279 373 HG12 VAL 113 HG12 VAL 113 5.650 38.803 0.852 374 HG13 VAL 113 HG13 VAL 113 5.256 38.818 -0.867 375 HG21 VAL 113 HG21 VAL 113 5.983 35.797 -1.951 376 HG22 VAL 113 HG22 VAL 113 4.890 35.164 -0.720 377 HG23 VAL 113 HG23 VAL 113 4.450 36.608 -1.631 378 H MET 114 H MET 114 7.551 39.723 -0.551 379 HA MET 114 HA MET 114 6.855 40.108 -3.309 380 HB2 MET 114 HB2 MET 114 7.351 41.810 -0.956 381 HB3 MET 114 HB3 MET 114 7.799 42.532 -2.495 382 HG2 MET 114 HG2 MET 114 5.114 41.269 -2.116 383 HG3 MET 114 HG3 MET 114 5.431 42.917 -1.577 384 HE1 MET 114 HE1 MET 114 3.720 41.663 -5.187 385 HE2 MET 114 HE2 MET 114 5.279 40.865 -5.397 386 HE3 MET 114 HE3 MET 114 4.360 40.628 -3.909 387 H LYS 115 H LYS 115 9.810 40.148 -1.404 388 HA LYS 115 HA LYS 115 11.421 41.063 -3.625 389 HB2 LYS 115 HB2 LYS 115 12.124 40.109 -0.847 390 HB3 LYS 115 HB3 LYS 115 13.324 40.615 -2.029 391 HG2 LYS 115 HG2 LYS 115 11.087 42.361 -1.026 392 HG3 LYS 115 HG3 LYS 115 12.730 42.365 -0.379 393 HD2 LYS 115 HD2 LYS 115 11.995 42.945 -3.248 394 HD3 LYS 115 HD3 LYS 115 12.337 44.168 -2.024 395 HE2 LYS 115 HE2 LYS 115 14.589 43.161 -1.732 396 HE3 LYS 115 HE3 LYS 115 14.231 42.063 -3.063 397 HZ1 LYS 115 HZ1 LYS 115 13.823 44.131 -4.422 398 HZ2 LYS 115 HZ2 LYS 115 15.432 43.834 -3.991 399 HZ3 LYS 115 HZ3 LYS 115 14.536 45.006 -3.162 400 H ALA 116 H ALA 116 10.333 38.070 -2.341 401 HA ALA 116 HA ALA 116 12.439 36.493 -3.552 402 HB1 ALA 116 HB1 ALA 116 10.961 34.568 -2.803 403 HB2 ALA 116 HB2 ALA 116 11.620 35.601 -1.534 404 HB3 ALA 116 HB3 ALA 116 9.941 35.787 -2.038 405 H ASP 117 H ASP 117 9.409 37.793 -4.466 406 HA ASP 117 HA ASP 117 9.041 35.869 -6.633 407 HB2 ASP 117 HB2 ASP 117 7.347 37.944 -5.335 408 HB3 ASP 117 HB3 ASP 117 7.030 37.582 -7.031 409 H ALA 118 H ALA 118 10.914 36.456 -7.839 410 HA ALA 118 HA ALA 118 11.371 39.096 -8.778 411 HB1 ALA 118 HB1 ALA 118 12.798 36.746 -8.777 412 HB2 ALA 118 HB2 ALA 118 12.428 36.988 -10.485 413 HB3 ALA 118 HB3 ALA 118 13.273 38.243 -9.579 414 H ASN 119 H ASN 119 9.209 36.620 -9.729 415 HA ASN 119 HA ASN 119 8.904 37.541 -12.452 416 HB2 ASN 119 HB2 ASN 119 6.887 35.915 -12.331 417 HB3 ASN 119 HB3 ASN 119 8.515 35.245 -12.267 418 HD21 ASN 119 HD21 ASN 119 7.747 33.392 -11.234 419 HD22 ASN 119 HD22 ASN 119 7.300 33.401 -9.565 420 H GLY 120 H GLY 120 7.964 38.747 -9.543 421 HA2 GLY 120 HA2 GLY 120 6.300 40.173 -8.837 422 HA3 GLY 120 HA3 GLY 120 6.364 40.769 -10.488 423 H ASP 121 H ASP 121 5.433 37.488 -9.768 424 HA ASP 121 HA ASP 121 2.977 37.755 -11.165 425 HB2 ASP 121 HB2 ASP 121 2.558 35.422 -10.175 426 HB3 ASP 121 HB3 ASP 121 3.946 35.613 -11.242 427 H GLY 122 H GLY 122 3.897 38.192 -7.869 428 HA2 GLY 122 HA2 GLY 122 2.662 39.133 -6.149 429 HA3 GLY 122 HA3 GLY 122 1.259 39.141 -7.208 430 H TYR 123 H TYR 123 2.401 36.095 -7.398 431 HA TYR 123 HA TYR 123 1.080 35.137 -4.966 432 HB2 TYR 123 HB2 TYR 123 0.422 33.705 -7.491 433 HB3 TYR 123 HB3 TYR 123 -0.534 33.899 -6.027 434 HD1 TYR 123 HD1 TYR 123 -1.358 36.367 -5.567 435 HD2 TYR 123 HD2 TYR 123 -0.204 34.876 -9.382 436 HE1 TYR 123 HE1 TYR 123 -2.663 38.147 -6.652 437 HE2 TYR 123 HE2 TYR 123 -1.505 36.653 -10.477 438 HH TYR 123 HH TYR 123 -2.375 38.889 -9.950 439 H ILE 124 H ILE 124 1.590 32.945 -4.417 440 HA ILE 124 HA ILE 124 3.989 31.908 -5.780 441 HB ILE 124 HB ILE 124 5.175 31.903 -3.899 442 HG12 ILE 124 HG12 ILE 124 2.753 30.781 -2.474 443 HG13 ILE 124 HG13 ILE 124 4.037 29.837 -3.222 444 HG21 ILE 124 HG21 ILE 124 3.970 34.068 -3.656 445 HG22 ILE 124 HG22 ILE 124 2.838 33.263 -2.570 446 HG23 ILE 124 HG23 ILE 124 4.541 33.390 -2.131 447 HD11 ILE 124 HD11 ILE 124 4.246 29.981 -0.781 448 HD12 ILE 124 HD12 ILE 124 5.632 30.679 -1.621 449 HD13 ILE 124 HD13 ILE 124 4.406 31.732 -0.914 450 H THR 125 H THR 125 3.859 29.867 -6.447 451 HA THR 125 HA THR 125 1.483 28.326 -5.828 452 HB THR 125 HB THR 125 2.288 28.415 -8.148 453 HG1 THR 125 HG1 THR 125 1.303 26.539 -8.099 454 HG21 THR 125 HG21 THR 125 4.746 27.182 -6.938 455 HG22 THR 125 HG22 THR 125 4.621 28.576 -8.012 456 HG23 THR 125 HG23 THR 125 4.343 26.951 -8.639 457 H LEU 126 H LEU 126 2.104 25.781 -5.789 458 HA LEU 126 HA LEU 126 2.917 25.191 -3.234 459 HB2 LEU 126 HB2 LEU 126 3.169 23.461 -5.689 460 HB3 LEU 126 HB3 LEU 126 3.277 22.881 -4.028 461 HG LEU 126 HG LEU 126 0.856 24.070 -3.959 462 HD11 LEU 126 HD11 LEU 126 1.503 23.910 -6.726 463 HD12 LEU 126 HD12 LEU 126 0.015 24.474 -5.967 464 HD13 LEU 126 HD13 LEU 126 0.200 22.771 -6.383 465 HD21 LEU 126 HD21 LEU 126 1.726 21.648 -3.483 466 HD22 LEU 126 HD22 LEU 126 1.019 21.303 -5.062 467 HD23 LEU 126 HD23 LEU 126 0.010 21.943 -3.763 468 H GLU 127 H GLU 127 4.899 25.128 -6.184 469 HA GLU 127 HA GLU 127 7.279 24.229 -5.065 470 HB2 GLU 127 HB2 GLU 127 6.544 25.802 -7.470 471 HB3 GLU 127 HB3 GLU 127 8.227 25.869 -6.969 472 HG2 GLU 127 HG2 GLU 127 8.515 23.555 -7.252 473 HG3 GLU 127 HG3 GLU 127 6.779 23.270 -7.346 474 H GLU 128 H GLU 128 6.270 27.606 -5.614 475 HA GLU 128 HA GLU 128 8.468 28.827 -4.412 476 HB2 GLU 128 HB2 GLU 128 5.685 29.968 -4.290 477 HB3 GLU 128 HB3 GLU 128 7.213 30.828 -4.418 478 HG2 GLU 128 HG2 GLU 128 7.445 29.642 -6.687 479 HG3 GLU 128 HG3 GLU 128 5.718 29.328 -6.527 480 H PHE 129 H PHE 129 5.465 27.627 -3.015 481 HA PHE 129 HA PHE 129 5.765 28.716 -0.443 482 HB2 PHE 129 HB2 PHE 129 3.646 27.777 -1.207 483 HB3 PHE 129 HB3 PHE 129 4.370 26.175 -1.308 484 HD1 PHE 129 HD2 PHE 129 3.431 28.872 1.044 485 HD2 PHE 129 HD1 PHE 129 4.465 24.770 0.565 486 HE1 PHE 129 HE2 PHE 129 2.789 28.440 3.379 487 HE2 PHE 129 HE1 PHE 129 3.823 24.332 2.899 488 HZ PHE 129 HZ PHE 129 2.985 26.168 4.311 489 H LEU 130 H LEU 130 6.934 25.712 -1.873 490 HA LEU 130 HA LEU 130 7.978 24.652 0.560 491 HB2 LEU 130 HB2 LEU 130 7.524 23.046 -1.055 492 HB3 LEU 130 HB3 LEU 130 8.277 23.986 -2.341 493 HG LEU 130 HG LEU 130 10.489 23.462 -1.420 494 HD11 LEU 130 HD11 LEU 130 8.985 22.725 0.863 495 HD12 LEU 130 HD12 LEU 130 10.737 22.749 0.661 496 HD13 LEU 130 HD13 LEU 130 9.825 21.287 0.282 497 HD21 LEU 130 HD21 LEU 130 9.887 21.999 -3.118 498 HD22 LEU 130 HD22 LEU 130 8.614 21.246 -2.156 499 HD23 LEU 130 HD23 LEU 130 10.309 20.913 -1.794 500 H GLU 131 H GLU 131 9.119 26.904 -1.792 501 HA GLU 131 HA GLU 131 11.899 26.652 -1.030 502 HB2 GLU 131 HB2 GLU 131 10.885 27.357 -3.344 503 HB3 GLU 131 HB3 GLU 131 10.822 28.954 -2.614 504 HG2 GLU 131 HG2 GLU 131 13.364 27.403 -2.523 505 HG3 GLU 131 HG3 GLU 131 12.890 28.219 -4.013 506 H PHE 132 H PHE 132 9.147 28.356 0.043 507 HA PHE 132 HA PHE 132 10.832 30.241 1.552 508 HB2 PHE 132 HB2 PHE 132 8.492 30.667 0.004 509 HB3 PHE 132 HB3 PHE 132 8.058 30.937 1.689 510 HD1 PHE 132 HD2 PHE 132 11.229 31.618 -0.137 511 HD2 PHE 132 HD1 PHE 132 7.898 33.220 1.974 512 HE1 PHE 132 HE2 PHE 132 12.247 33.855 -0.238 513 HE2 PHE 132 HE1 PHE 132 8.909 35.461 1.875 514 HZ PHE 132 HZ PHE 132 11.087 35.780 0.770 515 H SER 133 H SER 133 11.166 28.275 2.948 516 HA SER 133 HA SER 133 9.415 28.459 5.224 517 HB2 SER 133 HB2 SER 133 9.600 25.886 3.645 518 HB3 SER 133 HB3 SER 133 9.011 25.969 5.306 519 HG SER 133 HG SER 133 7.871 27.033 2.959 520 H LEU 134 H LEU 134 11.241 29.123 6.335 521 HA LEU 134 HA LEU 134 12.745 27.204 7.653 522 HB2 LEU 134 HB2 LEU 134 13.697 27.579 5.062 523 HB3 LEU 134 HB3 LEU 134 14.801 28.495 6.086 524 HG LEU 134 HG LEU 134 14.187 25.718 6.917 525 HD11 LEU 134 HD11 LEU 134 16.180 26.208 4.730 526 HD12 LEU 134 HD12 LEU 134 14.519 25.727 4.389 527 HD13 LEU 134 HD13 LEU 134 15.564 24.673 5.342 528 HD21 LEU 134 HD21 LEU 134 16.795 27.211 6.741 529 HD22 LEU 134 HD22 LEU 134 16.439 25.762 7.681 530 HD23 LEU 134 HD23 LEU 134 15.709 27.305 8.128 Start of MODEL 5 1 H GLY 67 H GLY 67 2.454 0.291 0.306 2 HA2 GLY 67 HA2 GLY 67 3.764 0.051 -1.590 3 HA3 GLY 67 HA3 GLY 67 2.298 -0.186 -2.531 4 H GLN 68 H GLN 68 1.208 2.378 -1.372 5 HA GLN 68 HA GLN 68 2.064 4.080 -3.477 6 HB2 GLN 68 HB2 GLN 68 0.130 4.217 -1.252 7 HB3 GLN 68 HB3 GLN 68 0.763 5.767 -1.793 8 HG2 GLN 68 HG2 GLN 68 -1.360 5.066 -2.885 9 HG3 GLN 68 HG3 GLN 68 -0.040 5.418 -3.999 10 HE21 GLN 68 HE21 GLN 68 -1.975 2.904 -2.549 11 HE22 GLN 68 HE22 GLN 68 -1.590 1.673 -3.697 12 H ASP 69 H ASP 69 3.715 5.448 -3.560 13 HA ASP 69 HA ASP 69 5.587 5.665 -1.450 14 HB2 ASP 69 HB2 ASP 69 5.265 6.878 -4.151 15 HB3 ASP 69 HB3 ASP 69 6.351 7.682 -3.022 16 H LEU 70 H LEU 70 5.622 6.967 0.255 17 HA LEU 70 HA LEU 70 3.539 8.710 0.906 18 HB2 LEU 70 HB2 LEU 70 5.996 7.820 2.079 19 HB3 LEU 70 HB3 LEU 70 5.827 9.558 2.313 20 HG LEU 70 HG LEU 70 3.577 7.716 3.024 21 HD11 LEU 70 HD11 LEU 70 5.466 8.477 5.159 22 HD12 LEU 70 HD12 LEU 70 5.995 7.204 4.062 23 HD13 LEU 70 HD13 LEU 70 4.492 7.020 4.967 24 HD21 LEU 70 HD21 LEU 70 3.085 9.489 4.630 25 HD22 LEU 70 HD22 LEU 70 3.167 10.121 2.986 26 HD23 LEU 70 HD23 LEU 70 4.513 10.376 4.097 27 H SER 71 H SER 71 4.329 11.078 1.734 28 HA SER 71 HA SER 71 5.207 12.429 -0.725 29 HB2 SER 71 HB2 SER 71 2.994 13.107 -0.053 30 HB3 SER 71 HB3 SER 71 3.535 13.412 1.597 31 HG SER 71 HG SER 71 4.812 15.110 0.802 32 H ASP 72 H ASP 72 6.852 13.906 -0.708 33 HA ASP 72 HA ASP 72 9.063 13.643 0.764 34 HB2 ASP 72 HB2 ASP 72 7.965 15.753 -0.860 35 HB3 ASP 72 HB3 ASP 72 8.866 16.441 0.488 36 H ASP 73 H ASP 73 10.002 14.530 2.628 37 HA ASP 73 HA ASP 73 8.565 14.531 4.940 38 HB2 ASP 73 HB2 ASP 73 11.174 15.693 4.143 39 HB3 ASP 73 HB3 ASP 73 10.489 16.276 5.657 40 H LYS 74 H LYS 74 8.691 17.037 2.583 41 HA LYS 74 HA LYS 74 7.681 19.096 4.343 42 HB2 LYS 74 HB2 LYS 74 7.743 20.537 2.444 43 HB3 LYS 74 HB3 LYS 74 9.195 19.547 2.385 44 HG2 LYS 74 HG2 LYS 74 7.309 18.119 0.924 45 HG3 LYS 74 HG3 LYS 74 7.062 19.805 0.464 46 HD2 LYS 74 HD2 LYS 74 9.492 19.991 0.014 47 HD3 LYS 74 HD3 LYS 74 9.659 18.270 0.370 48 HE2 LYS 74 HE2 LYS 74 8.191 17.714 -1.473 49 HE3 LYS 74 HE3 LYS 74 7.894 19.423 -1.789 50 HZ1 LYS 74 HZ1 LYS 74 10.653 19.026 -1.810 51 HZ2 LYS 74 HZ2 LYS 74 9.651 19.427 -3.112 52 HZ3 LYS 74 HZ3 LYS 74 9.971 17.804 -2.761 53 H ILE 75 H ILE 75 6.244 16.452 3.464 54 HA ILE 75 HA ILE 75 3.973 16.980 2.004 55 HB ILE 75 HB ILE 75 4.467 14.736 2.728 56 HG12 ILE 75 HG12 ILE 75 1.866 15.747 3.897 57 HG13 ILE 75 HG13 ILE 75 2.129 15.208 2.242 58 HG21 ILE 75 HG21 ILE 75 5.411 15.408 4.940 59 HG22 ILE 75 HG22 ILE 75 3.758 15.571 5.533 60 HG23 ILE 75 HG23 ILE 75 4.352 13.999 4.998 61 HD11 ILE 75 HD11 ILE 75 1.522 13.678 4.616 62 HD12 ILE 75 HD12 ILE 75 1.414 13.223 2.915 63 HD13 ILE 75 HD13 ILE 75 2.945 13.062 3.775 64 H GLY 76 H GLY 76 4.554 17.602 5.441 65 HA2 GLY 76 HA2 GLY 76 1.950 18.410 6.125 66 HA3 GLY 76 HA3 GLY 76 3.417 18.885 6.967 67 H LEU 77 H LEU 77 4.721 20.311 4.981 68 HA LEU 77 HA LEU 77 3.501 22.832 5.202 69 HB2 LEU 77 HB2 LEU 77 5.969 22.171 4.764 70 HB3 LEU 77 HB3 LEU 77 5.497 22.189 3.065 71 HG LEU 77 HG LEU 77 4.862 24.552 3.278 72 HD11 LEU 77 HD11 LEU 77 4.225 24.740 5.550 73 HD12 LEU 77 HD12 LEU 77 5.655 25.752 5.347 74 HD13 LEU 77 HD13 LEU 77 5.796 24.170 6.112 75 HD21 LEU 77 HD21 LEU 77 7.609 24.482 4.388 76 HD22 LEU 77 HD22 LEU 77 6.981 25.306 2.960 77 HD23 LEU 77 HD23 LEU 77 7.309 23.573 2.907 78 H LYS 78 H LYS 78 3.778 20.624 2.429 79 HA LYS 78 HA LYS 78 2.401 22.234 0.584 80 HB2 LYS 78 HB2 LYS 78 2.796 19.246 0.736 81 HB3 LYS 78 HB3 LYS 78 2.003 20.038 -0.619 82 HG2 LYS 78 HG2 LYS 78 4.289 21.474 -0.467 83 HG3 LYS 78 HG3 LYS 78 4.847 19.894 0.088 84 HD2 LYS 78 HD2 LYS 78 3.114 19.912 -2.307 85 HD3 LYS 78 HD3 LYS 78 4.729 20.597 -2.503 86 HE2 LYS 78 HE2 LYS 78 5.685 18.581 -2.451 87 HE3 LYS 78 HE3 LYS 78 4.774 18.106 -1.019 88 HZ1 LYS 78 HZ1 LYS 78 4.451 16.957 -3.375 89 HZ2 LYS 78 HZ2 LYS 78 3.302 18.189 -3.528 90 HZ3 LYS 78 HZ3 LYS 78 3.197 17.089 -2.247 91 H VAL 79 H VAL 79 1.258 19.659 2.742 92 HA VAL 79 HA VAL 79 -1.402 19.578 1.907 93 HB VAL 79 HB VAL 79 -0.174 19.024 4.604 94 HG11 VAL 79 HG11 VAL 79 -2.431 19.605 5.077 95 HG12 VAL 79 HG12 VAL 79 -3.025 18.675 3.701 96 HG13 VAL 79 HG13 VAL 79 -2.336 17.845 5.096 97 HG21 VAL 79 HG21 VAL 79 -1.400 16.839 3.126 98 HG22 VAL 79 HG22 VAL 79 -0.089 17.615 2.238 99 HG23 VAL 79 HG23 VAL 79 0.205 16.957 3.847 100 H LEU 80 H LEU 80 0.007 21.408 4.625 101 HA LEU 80 HA LEU 80 -2.301 22.736 5.421 102 HB2 LEU 80 HB2 LEU 80 0.592 23.115 5.757 103 HB3 LEU 80 HB3 LEU 80 -0.373 24.577 5.944 104 HG LEU 80 HG LEU 80 -1.759 22.943 7.549 105 HD11 LEU 80 HD11 LEU 80 -0.141 21.602 8.860 106 HD12 LEU 80 HD12 LEU 80 1.074 21.918 7.621 107 HD13 LEU 80 HD13 LEU 80 -0.380 21.004 7.218 108 HD21 LEU 80 HD21 LEU 80 -0.982 25.053 8.286 109 HD22 LEU 80 HD22 LEU 80 0.706 24.556 8.166 110 HD23 LEU 80 HD23 LEU 80 -0.333 23.863 9.414 111 H PHE 81 H PHE 81 0.214 23.822 3.149 112 HA PHE 81 HA PHE 81 -0.777 26.306 2.503 113 HB2 PHE 81 HB2 PHE 81 1.325 25.735 1.604 114 HB3 PHE 81 HB3 PHE 81 0.703 24.265 0.860 115 HD1 PHE 81 HD1 PHE 81 -0.500 24.341 -1.236 116 HD2 PHE 81 HD2 PHE 81 1.016 27.889 0.560 117 HE1 PHE 81 HE1 PHE 81 -0.827 25.550 -3.354 118 HE2 PHE 81 HE2 PHE 81 0.690 29.104 -1.554 119 HZ PHE 81 HZ PHE 81 -0.233 27.934 -3.515 120 H LYS 82 H LYS 82 -1.500 23.253 0.810 121 HA LYS 82 HA LYS 82 -3.426 24.340 -0.931 122 HB2 LYS 82 HB2 LYS 82 -2.356 22.192 -1.364 123 HB3 LYS 82 HB3 LYS 82 -3.101 21.507 0.074 124 HG2 LYS 82 HG2 LYS 82 -5.157 22.595 -1.557 125 HG3 LYS 82 HG3 LYS 82 -4.109 21.596 -2.568 126 HD2 LYS 82 HD2 LYS 82 -4.854 20.472 0.063 127 HD3 LYS 82 HD3 LYS 82 -6.153 20.612 -1.124 128 HE2 LYS 82 HE2 LYS 82 -4.971 18.424 -1.175 129 HE3 LYS 82 HE3 LYS 82 -4.931 19.293 -2.708 130 HZ1 LYS 82 HZ1 LYS 82 -2.712 19.597 -0.799 131 HZ2 LYS 82 HZ2 LYS 82 -2.707 19.772 -2.480 132 HZ3 LYS 82 HZ3 LYS 82 -2.781 18.228 -1.791 133 H LEU 83 H LEU 83 -3.760 22.676 2.188 134 HA LEU 83 HA LEU 83 -6.528 22.586 2.338 135 HB2 LEU 83 HB2 LEU 83 -4.609 21.721 3.928 136 HB3 LEU 83 HB3 LEU 83 -4.964 23.217 4.790 137 HG LEU 83 HG LEU 83 -6.834 20.907 4.290 138 HD11 LEU 83 HD11 LEU 83 -5.147 20.700 6.117 139 HD12 LEU 83 HD12 LEU 83 -6.823 20.646 6.661 140 HD13 LEU 83 HD13 LEU 83 -5.875 22.117 6.875 141 HD21 LEU 83 HD21 LEU 83 -8.146 22.876 4.038 142 HD22 LEU 83 HD22 LEU 83 -7.372 23.645 5.424 143 HD23 LEU 83 HD23 LEU 83 -8.438 22.260 5.665 144 H MET 84 H MET 84 -4.312 25.198 3.221 145 HA MET 84 HA MET 84 -6.339 26.906 4.266 146 HB2 MET 84 HB2 MET 84 -3.595 27.640 3.230 147 HB3 MET 84 HB3 MET 84 -4.618 28.632 4.261 148 HG2 MET 84 HG2 MET 84 -4.089 25.981 5.351 149 HG3 MET 84 HG3 MET 84 -2.638 26.950 5.108 150 HE1 MET 84 HE1 MET 84 -2.286 28.900 7.977 151 HE2 MET 84 HE2 MET 84 -1.777 28.405 6.363 152 HE3 MET 84 HE3 MET 84 -2.742 29.867 6.573 153 H ASP 85 H ASP 85 -5.450 26.026 1.123 154 HA ASP 85 HA ASP 85 -6.603 28.469 -0.030 155 HB2 ASP 85 HB2 ASP 85 -4.561 26.548 -0.912 156 HB3 ASP 85 HB3 ASP 85 -5.713 27.003 -2.166 157 H VAL 86 H VAL 86 -8.732 27.677 0.708 158 HA VAL 86 HA VAL 86 -9.918 25.324 -0.256 159 HB VAL 86 HB VAL 86 -10.854 26.688 1.586 160 HG11 VAL 86 HG11 VAL 86 -10.705 28.755 -0.322 161 HG12 VAL 86 HG12 VAL 86 -12.418 28.507 0.029 162 HG13 VAL 86 HG13 VAL 86 -11.287 28.851 1.340 163 HG21 VAL 86 HG21 VAL 86 -13.101 26.649 -0.306 164 HG22 VAL 86 HG22 VAL 86 -12.179 25.148 -0.211 165 HG23 VAL 86 HG23 VAL 86 -12.905 25.829 1.243 166 H ASP 87 H ASP 87 -9.056 28.176 -1.878 167 HA ASP 87 HA ASP 87 -11.076 28.029 -3.930 168 HB2 ASP 87 HB2 ASP 87 -9.539 29.736 -5.061 169 HB3 ASP 87 HB3 ASP 87 -10.266 30.209 -3.528 170 H GLY 88 H GLY 88 -8.453 26.165 -3.237 171 HA2 GLY 88 HA2 GLY 88 -7.081 24.768 -4.452 172 HA3 GLY 88 HA3 GLY 88 -8.514 24.565 -5.449 173 H ASP 89 H ASP 89 -6.407 27.388 -4.990 174 HA ASP 89 HA ASP 89 -6.185 27.629 -7.889 175 HB2 ASP 89 HB2 ASP 89 -5.036 29.827 -7.256 176 HB3 ASP 89 HB3 ASP 89 -6.751 29.686 -6.882 177 H GLY 90 H GLY 90 -4.351 26.594 -5.178 178 HA2 GLY 90 HA2 GLY 90 -2.300 25.526 -5.142 179 HA3 GLY 90 HA3 GLY 90 -2.178 25.785 -6.876 180 H LYS 91 H LYS 91 -2.879 28.718 -5.589 181 HA LYS 91 HA LYS 91 -0.114 29.397 -4.916 182 HB2 LYS 91 HB2 LYS 91 -0.550 31.519 -6.405 183 HB3 LYS 91 HB3 LYS 91 0.049 30.031 -7.123 184 HG2 LYS 91 HG2 LYS 91 -1.766 29.790 -8.387 185 HG3 LYS 91 HG3 LYS 91 -2.853 30.142 -7.042 186 HD2 LYS 91 HD2 LYS 91 -2.275 32.573 -7.355 187 HD3 LYS 91 HD3 LYS 91 -1.448 32.107 -8.844 188 HE2 LYS 91 HE2 LYS 91 -4.037 30.923 -8.837 189 HE3 LYS 91 HE3 LYS 91 -4.206 32.633 -8.441 190 HZ1 LYS 91 HZ1 LYS 91 -4.312 32.385 -10.795 191 HZ2 LYS 91 HZ2 LYS 91 -2.885 31.479 -10.834 192 HZ3 LYS 91 HZ3 LYS 91 -2.833 33.120 -10.427 193 H LEU 92 H LEU 92 0.080 31.569 -3.959 194 HA LEU 92 HA LEU 92 -2.423 32.431 -2.667 195 HB2 LEU 92 HB2 LEU 92 0.343 32.263 -1.481 196 HB3 LEU 92 HB3 LEU 92 -1.030 33.043 -0.697 197 HG LEU 92 HG LEU 92 -1.007 30.127 -1.451 198 HD11 LEU 92 HD11 LEU 92 -0.647 29.848 1.069 199 HD12 LEU 92 HD12 LEU 92 -0.038 31.502 1.032 200 HD13 LEU 92 HD13 LEU 92 0.754 30.250 0.074 201 HD21 LEU 92 HD21 LEU 92 -2.662 31.587 0.596 202 HD22 LEU 92 HD22 LEU 92 -2.884 29.945 -0.010 203 HD23 LEU 92 HD23 LEU 92 -3.187 31.326 -1.067 204 H THR 93 H THR 93 -2.674 34.643 -2.267 205 HA THR 93 HA THR 93 -1.088 36.345 -4.031 206 HB THR 93 HB THR 93 -3.350 37.518 -2.524 207 HG1 THR 93 HG1 THR 93 -4.303 35.558 -2.998 208 HG21 THR 93 HG21 THR 93 -3.644 38.785 -4.437 209 HG22 THR 93 HG22 THR 93 -2.987 37.534 -5.491 210 HG23 THR 93 HG23 THR 93 -1.907 38.487 -4.474 211 H LYS 94 H LYS 94 -0.220 38.355 -3.333 212 HA LYS 94 HA LYS 94 1.425 38.411 -1.222 213 HB2 LYS 94 HB2 LYS 94 1.059 40.205 -3.015 214 HB3 LYS 94 HB3 LYS 94 -0.143 40.887 -1.925 215 HG2 LYS 94 HG2 LYS 94 2.131 40.491 -0.356 216 HG3 LYS 94 HG3 LYS 94 2.721 41.142 -1.888 217 HD2 LYS 94 HD2 LYS 94 2.204 43.139 -1.005 218 HD3 LYS 94 HD3 LYS 94 0.540 42.715 -1.411 219 HE2 LYS 94 HE2 LYS 94 1.090 41.484 1.054 220 HE3 LYS 94 HE3 LYS 94 1.741 43.118 1.165 221 HZ1 LYS 94 HZ1 LYS 94 -0.342 44.051 0.754 222 HZ2 LYS 94 HZ2 LYS 94 -0.671 42.780 1.819 223 HZ3 LYS 94 HZ3 LYS 94 -0.994 42.605 0.168 224 H GLU 95 H GLU 95 -1.800 39.935 -1.043 225 HA GLU 95 HA GLU 95 -1.806 40.452 1.679 226 HB2 GLU 95 HB2 GLU 95 -4.086 39.822 -0.195 227 HB3 GLU 95 HB3 GLU 95 -4.328 40.341 1.467 228 HG2 GLU 95 HG2 GLU 95 -3.028 42.402 0.933 229 HG3 GLU 95 HG3 GLU 95 -3.027 41.892 -0.755 230 H GLU 96 H GLU 96 -2.891 37.544 -0.035 231 HA GLU 96 HA GLU 96 -3.891 36.154 2.181 232 HB2 GLU 96 HB2 GLU 96 -4.090 35.601 -0.329 233 HB3 GLU 96 HB3 GLU 96 -2.538 34.800 -0.140 234 HG2 GLU 96 HG2 GLU 96 -3.422 33.223 1.373 235 HG3 GLU 96 HG3 GLU 96 -4.911 34.143 1.575 236 H VAL 97 H VAL 97 -0.664 36.057 0.686 237 HA VAL 97 HA VAL 97 0.542 34.152 2.266 238 HB VAL 97 HB VAL 97 1.704 36.668 1.078 239 HG11 VAL 97 HG11 VAL 97 2.937 34.635 2.831 240 HG12 VAL 97 HG12 VAL 97 3.859 35.106 1.402 241 HG13 VAL 97 HG13 VAL 97 3.365 36.327 2.577 242 HG21 VAL 97 HG21 VAL 97 1.206 33.924 0.153 243 HG22 VAL 97 HG22 VAL 97 1.351 35.424 -0.764 244 HG23 VAL 97 HG23 VAL 97 2.800 34.568 -0.240 245 H THR 98 H THR 98 0.201 37.623 2.925 246 HA THR 98 HA THR 98 1.592 37.561 5.400 247 HB THR 98 HB THR 98 -0.438 39.572 4.410 248 HG1 THR 98 HG1 THR 98 2.366 39.920 4.415 249 HG21 THR 98 HG21 THR 98 -0.139 39.741 6.815 250 HG22 THR 98 HG22 THR 98 0.655 41.100 6.017 251 HG23 THR 98 HG23 THR 98 1.614 39.747 6.619 252 H SER 99 H SER 99 -1.725 37.002 4.470 253 HA SER 99 HA SER 99 -2.853 37.229 7.072 254 HB2 SER 99 HB2 SER 99 -4.322 37.446 5.192 255 HB3 SER 99 HB3 SER 99 -3.824 35.883 4.545 256 HG SER 99 HG SER 99 -5.099 34.888 5.924 257 H PHE 100 H PHE 100 -1.908 34.431 5.086 258 HA PHE 100 HA PHE 100 -2.535 32.482 7.029 259 HB2 PHE 100 HB2 PHE 100 -0.708 32.442 4.628 260 HB3 PHE 100 HB3 PHE 100 -0.971 31.027 5.642 261 HD1 PHE 100 HD2 PHE 100 -3.935 32.821 5.685 262 HD2 PHE 100 HD1 PHE 100 -1.607 30.333 3.134 263 HE1 PHE 100 HE2 PHE 100 -5.952 32.269 4.388 264 HE2 PHE 100 HE1 PHE 100 -3.619 29.778 1.832 265 HZ PHE 100 HZ PHE 100 -5.795 30.745 2.460 266 H PHE 101 H PHE 101 0.422 34.256 6.289 267 HA PHE 101 HA PHE 101 2.020 32.811 8.181 268 HB2 PHE 101 HB2 PHE 101 2.660 34.297 6.040 269 HB3 PHE 101 HB3 PHE 101 2.857 35.519 7.291 270 HD1 PHE 101 HD1 PHE 101 4.450 35.088 9.173 271 HD2 PHE 101 HD2 PHE 101 4.264 32.612 5.716 272 HE1 PHE 101 HE1 PHE 101 6.681 34.194 9.698 273 HE2 PHE 101 HE2 PHE 101 6.494 31.714 6.235 274 HZ PHE 101 HZ PHE 101 7.706 32.504 8.229 275 H LYS 102 H LYS 102 -0.031 35.600 8.268 276 HA LYS 102 HA LYS 102 0.949 37.007 10.437 277 HB2 LYS 102 HB2 LYS 102 -1.562 36.812 9.009 278 HB3 LYS 102 HB3 LYS 102 -1.837 37.056 10.729 279 HG2 LYS 102 HG2 LYS 102 0.211 38.791 9.539 280 HG3 LYS 102 HG3 LYS 102 -1.431 39.042 8.944 281 HD2 LYS 102 HD2 LYS 102 -0.697 38.958 11.867 282 HD3 LYS 102 HD3 LYS 102 -0.803 40.446 10.924 283 HE2 LYS 102 HE2 LYS 102 -3.131 38.635 10.774 284 HE3 LYS 102 HE3 LYS 102 -2.854 39.416 12.330 285 HZ1 LYS 102 HZ1 LYS 102 -4.321 40.671 10.787 286 HZ2 LYS 102 HZ2 LYS 102 -2.996 40.889 9.759 287 HZ3 LYS 102 HZ3 LYS 102 -2.973 41.546 11.317 288 H LYS 103 H LYS 103 -0.717 33.955 10.353 289 HA LYS 103 HA LYS 103 -1.642 33.768 12.969 290 HB2 LYS 103 HB2 LYS 103 -0.619 31.680 11.051 291 HB3 LYS 103 HB3 LYS 103 -1.248 31.260 12.637 292 HG2 LYS 103 HG2 LYS 103 -2.826 32.845 10.632 293 HG3 LYS 103 HG3 LYS 103 -2.860 31.082 10.708 294 HD2 LYS 103 HD2 LYS 103 -3.494 32.869 13.050 295 HD3 LYS 103 HD3 LYS 103 -4.716 32.235 11.945 296 HE2 LYS 103 HE2 LYS 103 -2.921 30.174 12.946 297 HE3 LYS 103 HE3 LYS 103 -3.787 31.007 14.237 298 HZ1 LYS 103 HZ1 LYS 103 -4.814 29.282 12.122 299 HZ2 LYS 103 HZ2 LYS 103 -5.781 30.597 12.566 300 HZ3 LYS 103 HZ3 LYS 103 -5.327 29.452 13.726 301 H HIS 104 H HIS 104 1.585 33.660 11.736 302 HA HIS 104 HA HIS 104 2.682 32.504 14.164 303 HB2 HIS 104 HB2 HIS 104 3.519 32.376 11.602 304 HB3 HIS 104 HB3 HIS 104 4.488 33.735 12.163 305 HD1 HIS 104 HD1 HIS 104 5.590 30.857 11.388 306 HD2 HIS 104 HD2 HIS 104 4.931 32.287 15.232 307 HE1 HIS 104 HE1 HIS 104 7.090 29.495 12.878 308 H GLY 105 H GLY 105 2.028 35.611 12.833 309 HA2 GLY 105 HA2 GLY 105 1.994 37.570 14.174 310 HA3 GLY 105 HA3 GLY 105 3.205 36.843 15.219 311 H ILE 106 H ILE 106 4.522 36.069 12.479 312 HA ILE 106 HA ILE 106 6.302 38.337 12.465 313 HB ILE 106 HB ILE 106 6.296 35.840 10.766 314 HG12 ILE 106 HG12 ILE 106 8.496 36.143 12.618 315 HG13 ILE 106 HG13 ILE 106 6.955 36.216 13.469 316 HG21 ILE 106 HG21 ILE 106 7.617 37.109 9.452 317 HG22 ILE 106 HG22 ILE 106 7.959 38.269 10.734 318 HG23 ILE 106 HG23 ILE 106 8.835 36.740 10.672 319 HD11 ILE 106 HD11 ILE 106 7.532 34.032 11.509 320 HD12 ILE 106 HD12 ILE 106 8.089 33.941 13.180 321 HD13 ILE 106 HD13 ILE 106 6.365 34.064 12.830 322 H GLU 107 H GLU 107 6.323 39.988 11.072 323 HA GLU 107 HA GLU 107 4.335 39.986 8.918 324 HB2 GLU 107 HB2 GLU 107 5.896 42.335 9.997 325 HB3 GLU 107 HB3 GLU 107 4.489 42.387 8.946 326 HG2 GLU 107 HG2 GLU 107 4.618 41.649 11.848 327 HG3 GLU 107 HG3 GLU 107 3.714 42.955 11.084 328 H LYS 108 H LYS 108 7.675 39.724 9.455 329 HA LYS 108 HA LYS 108 8.808 40.978 7.254 330 HB2 LYS 108 HB2 LYS 108 10.201 40.051 8.983 331 HB3 LYS 108 HB3 LYS 108 9.604 38.429 8.663 332 HG2 LYS 108 HG2 LYS 108 11.103 38.091 7.059 333 HG3 LYS 108 HG3 LYS 108 10.763 39.650 6.303 334 HD2 LYS 108 HD2 LYS 108 12.447 39.349 8.782 335 HD3 LYS 108 HD3 LYS 108 13.118 39.338 7.150 336 HE2 LYS 108 HE2 LYS 108 11.896 41.568 6.839 337 HE3 LYS 108 HE3 LYS 108 11.724 41.571 8.594 338 HZ1 LYS 108 HZ1 LYS 108 14.324 41.051 8.342 339 HZ2 LYS 108 HZ2 LYS 108 13.695 42.613 8.496 340 HZ3 LYS 108 HZ3 LYS 108 14.084 42.006 6.966 341 H VAL 109 H VAL 109 6.910 38.084 7.429 342 HA VAL 109 HA VAL 109 7.651 36.715 5.149 343 HB VAL 109 HB VAL 109 6.002 35.828 6.702 344 HG11 VAL 109 HG11 VAL 109 3.656 37.187 5.738 345 HG12 VAL 109 HG12 VAL 109 4.229 36.976 7.393 346 HG13 VAL 109 HG13 VAL 109 4.799 38.338 6.428 347 HG21 VAL 109 HG21 VAL 109 4.339 34.998 5.051 348 HG22 VAL 109 HG22 VAL 109 4.974 36.159 3.886 349 HG23 VAL 109 HG23 VAL 109 6.009 34.868 4.498 350 H ALA 110 H ALA 110 5.848 39.685 5.447 351 HA ALA 110 HA ALA 110 4.724 39.751 2.857 352 HB1 ALA 110 HB1 ALA 110 5.260 42.398 3.710 353 HB2 ALA 110 HB2 ALA 110 3.729 41.523 3.743 354 HB3 ALA 110 HB3 ALA 110 4.815 41.453 5.131 355 H GLU 111 H GLU 111 7.758 41.044 4.165 356 HA GLU 111 HA GLU 111 8.588 42.202 1.692 357 HB2 GLU 111 HB2 GLU 111 9.349 42.813 4.075 358 HB3 GLU 111 HB3 GLU 111 10.437 41.439 3.940 359 HG2 GLU 111 HG2 GLU 111 11.621 43.443 3.380 360 HG3 GLU 111 HG3 GLU 111 11.431 42.461 1.929 361 H GLN 112 H GLN 112 8.998 39.093 3.231 362 HA GLN 112 HA GLN 112 11.087 38.179 1.514 363 HB2 GLN 112 HB2 GLN 112 9.164 36.664 3.286 364 HB3 GLN 112 HB3 GLN 112 10.532 35.938 2.453 365 HG2 GLN 112 HG2 GLN 112 10.569 37.950 4.676 366 HG3 GLN 112 HG3 GLN 112 11.222 36.313 4.670 367 HE21 GLN 112 HE21 GLN 112 13.183 35.910 3.676 368 HE22 GLN 112 HE22 GLN 112 14.262 37.172 3.205 369 H VAL 113 H VAL 113 7.572 37.735 1.599 370 HA VAL 113 HA VAL 113 7.456 36.002 -0.646 371 HB VAL 113 HB VAL 113 5.653 36.239 1.081 372 HG11 VAL 113 HG11 VAL 113 5.599 38.662 1.236 373 HG12 VAL 113 HG12 VAL 113 5.051 38.776 -0.438 374 HG13 VAL 113 HG13 VAL 113 4.011 38.041 0.783 375 HG21 VAL 113 HG21 VAL 113 3.827 36.468 -0.903 376 HG22 VAL 113 HG22 VAL 113 5.288 36.148 -1.838 377 HG23 VAL 113 HG23 VAL 113 4.771 35.013 -0.592 378 H MET 114 H MET 114 7.439 39.478 -0.263 379 HA MET 114 HA MET 114 6.632 40.000 -2.977 380 HB2 MET 114 HB2 MET 114 7.327 41.605 -0.593 381 HB3 MET 114 HB3 MET 114 7.676 42.354 -2.145 382 HG2 MET 114 HG2 MET 114 5.035 41.149 -2.047 383 HG3 MET 114 HG3 MET 114 5.269 42.391 -0.820 384 HE1 MET 114 HE1 MET 114 5.729 44.988 -1.389 385 HE2 MET 114 HE2 MET 114 4.575 45.507 -2.619 386 HE3 MET 114 HE3 MET 114 4.069 44.393 -1.347 387 H LYS 115 H LYS 115 9.645 39.830 -1.176 388 HA LYS 115 HA LYS 115 11.234 40.780 -3.390 389 HB2 LYS 115 HB2 LYS 115 11.931 39.635 -0.689 390 HB3 LYS 115 HB3 LYS 115 13.151 40.062 -1.881 391 HG2 LYS 115 HG2 LYS 115 11.122 41.976 -0.749 392 HG3 LYS 115 HG3 LYS 115 12.784 41.809 -0.176 393 HD2 LYS 115 HD2 LYS 115 11.960 42.579 -2.977 394 HD3 LYS 115 HD3 LYS 115 12.531 43.693 -1.732 395 HE2 LYS 115 HE2 LYS 115 14.646 42.344 -1.636 396 HE3 LYS 115 HE3 LYS 115 14.069 41.462 -3.050 397 HZ1 LYS 115 HZ1 LYS 115 13.815 43.861 -4.006 398 HZ2 LYS 115 HZ2 LYS 115 15.317 43.086 -4.027 399 HZ3 LYS 115 HZ3 LYS 115 14.979 44.242 -2.839 400 H ALA 116 H ALA 116 10.029 37.765 -2.258 401 HA ALA 116 HA ALA 116 11.997 36.155 -3.630 402 HB1 ALA 116 HB1 ALA 116 10.569 34.258 -2.944 403 HB2 ALA 116 HB2 ALA 116 11.035 35.294 -1.594 404 HB3 ALA 116 HB3 ALA 116 9.412 35.407 -2.272 405 H ASP 117 H ASP 117 9.066 37.724 -4.418 406 HA ASP 117 HA ASP 117 8.220 35.972 -6.510 407 HB2 ASP 117 HB2 ASP 117 6.943 37.890 -5.172 408 HB3 ASP 117 HB3 ASP 117 7.473 38.856 -6.546 409 H ALA 118 H ALA 118 10.223 35.681 -7.652 410 HA ALA 118 HA ALA 118 11.498 37.895 -8.950 411 HB1 ALA 118 HB1 ALA 118 12.248 35.330 -8.347 412 HB2 ALA 118 HB2 ALA 118 12.016 35.261 -10.094 413 HB3 ALA 118 HB3 ALA 118 13.131 36.437 -9.399 414 H ASN 119 H ASN 119 8.960 35.650 -9.755 415 HA ASN 119 HA ASN 119 9.006 36.295 -12.575 416 HB2 ASN 119 HB2 ASN 119 6.802 34.933 -12.495 417 HB3 ASN 119 HB3 ASN 119 8.320 34.091 -12.200 418 HD21 ASN 119 HD21 ASN 119 7.220 32.466 -11.077 419 HD22 ASN 119 HD22 ASN 119 6.636 32.712 -9.470 420 H GLY 120 H GLY 120 7.991 37.911 -9.901 421 HA2 GLY 120 HA2 GLY 120 6.468 39.588 -9.495 422 HA3 GLY 120 HA3 GLY 120 6.739 39.989 -11.185 423 H ASP 121 H ASP 121 5.339 36.945 -10.200 424 HA ASP 121 HA ASP 121 3.046 37.364 -11.839 425 HB2 ASP 121 HB2 ASP 121 2.283 35.182 -10.745 426 HB3 ASP 121 HB3 ASP 121 3.782 35.127 -11.668 427 H GLY 122 H GLY 122 3.791 38.036 -8.554 428 HA2 GLY 122 HA2 GLY 122 2.517 39.376 -7.119 429 HA3 GLY 122 HA3 GLY 122 1.130 39.146 -8.174 430 H TYR 123 H TYR 123 2.402 36.157 -7.713 431 HA TYR 123 HA TYR 123 1.131 35.639 -5.145 432 HB2 TYR 123 HB2 TYR 123 -0.227 33.780 -6.117 433 HB3 TYR 123 HB3 TYR 123 -0.739 35.381 -6.640 434 HD1 TYR 123 HD2 TYR 123 1.419 32.535 -7.716 435 HD2 TYR 123 HD1 TYR 123 -1.050 35.789 -8.903 436 HE1 TYR 123 HE2 TYR 123 1.622 31.825 -10.063 437 HE2 TYR 123 HE1 TYR 123 -0.856 35.089 -11.252 438 HH TYR 123 HH TYR 123 -0.089 33.542 -12.655 439 H ILE 124 H ILE 124 1.524 33.424 -4.381 440 HA ILE 124 HA ILE 124 3.979 32.290 -5.555 441 HB ILE 124 HB ILE 124 4.909 31.914 -3.488 442 HG12 ILE 124 HG12 ILE 124 2.112 32.056 -2.351 443 HG13 ILE 124 HG13 ILE 124 3.136 30.630 -2.489 444 HG21 ILE 124 HG21 ILE 124 3.332 34.209 -2.480 445 HG22 ILE 124 HG22 ILE 124 5.077 33.970 -2.537 446 HG23 ILE 124 HG23 ILE 124 4.202 34.427 -3.998 447 HD11 ILE 124 HD11 ILE 124 4.625 32.436 -0.989 448 HD12 ILE 124 HD12 ILE 124 2.975 32.578 -0.382 449 HD13 ILE 124 HD13 ILE 124 3.774 31.006 -0.407 450 H THR 125 H THR 125 3.832 30.262 -6.238 451 HA THR 125 HA THR 125 1.426 28.740 -5.734 452 HB THR 125 HB THR 125 2.400 28.766 -7.990 453 HG1 THR 125 HG1 THR 125 2.650 26.287 -8.034 454 HG21 THR 125 HG21 THR 125 4.751 27.547 -6.572 455 HG22 THR 125 HG22 THR 125 4.719 28.917 -7.682 456 HG23 THR 125 HG23 THR 125 4.476 27.280 -8.293 457 H LEU 126 H LEU 126 2.012 26.195 -5.579 458 HA LEU 126 HA LEU 126 2.681 25.701 -2.946 459 HB2 LEU 126 HB2 LEU 126 3.116 23.744 -5.189 460 HB3 LEU 126 HB3 LEU 126 2.752 23.385 -3.503 461 HG LEU 126 HG LEU 126 0.647 24.976 -4.629 462 HD11 LEU 126 HD11 LEU 126 1.716 23.718 -6.685 463 HD12 LEU 126 HD12 LEU 126 -0.032 23.843 -6.489 464 HD13 LEU 126 HD13 LEU 126 0.803 22.359 -6.028 465 HD21 LEU 126 HD21 LEU 126 0.387 22.085 -3.951 466 HD22 LEU 126 HD22 LEU 126 -0.694 23.431 -3.588 467 HD23 LEU 126 HD23 LEU 126 0.804 23.232 -2.677 468 H GLU 127 H GLU 127 4.751 25.386 -5.821 469 HA GLU 127 HA GLU 127 7.048 24.428 -4.616 470 HB2 GLU 127 HB2 GLU 127 6.431 25.938 -7.075 471 HB3 GLU 127 HB3 GLU 127 8.092 26.070 -6.513 472 HG2 GLU 127 HG2 GLU 127 6.615 23.530 -7.157 473 HG3 GLU 127 HG3 GLU 127 7.895 24.277 -8.109 474 H GLU 128 H GLU 128 6.174 27.836 -5.185 475 HA GLU 128 HA GLU 128 8.392 29.007 -3.988 476 HB2 GLU 128 HB2 GLU 128 5.607 30.153 -3.841 477 HB3 GLU 128 HB3 GLU 128 7.132 31.026 -3.890 478 HG2 GLU 128 HG2 GLU 128 7.410 29.877 -6.203 479 HG3 GLU 128 HG3 GLU 128 5.665 29.659 -6.096 480 H PHE 129 H PHE 129 5.272 28.127 -2.531 481 HA PHE 129 HA PHE 129 5.705 29.079 0.034 482 HB2 PHE 129 HB2 PHE 129 3.576 28.073 -0.928 483 HB3 PHE 129 HB3 PHE 129 4.268 26.495 -0.569 484 HD1 PHE 129 HD1 PHE 129 3.171 29.682 0.953 485 HD2 PHE 129 HD2 PHE 129 4.176 25.597 1.597 486 HE1 PHE 129 HE1 PHE 129 2.311 29.837 3.252 487 HE2 PHE 129 HE2 PHE 129 3.317 25.745 3.897 488 HZ PHE 129 HZ PHE 129 2.382 27.867 4.728 489 H LEU 130 H LEU 130 6.709 26.023 -1.421 490 HA LEU 130 HA LEU 130 7.774 24.936 0.995 491 HB2 LEU 130 HB2 LEU 130 7.183 23.334 -0.576 492 HB3 LEU 130 HB3 LEU 130 7.931 24.218 -1.903 493 HG LEU 130 HG LEU 130 10.154 23.607 -1.014 494 HD11 LEU 130 HD11 LEU 130 9.285 23.315 1.352 495 HD12 LEU 130 HD12 LEU 130 10.440 22.114 0.778 496 HD13 LEU 130 HD13 LEU 130 8.721 21.726 0.838 497 HD21 LEU 130 HD21 LEU 130 9.295 22.245 -2.757 498 HD22 LEU 130 HD22 LEU 130 8.219 21.390 -1.651 499 HD23 LEU 130 HD23 LEU 130 9.965 21.155 -1.541 500 H GLU 131 H GLU 131 8.909 27.173 -1.340 501 HA GLU 131 HA GLU 131 11.713 26.751 -0.786 502 HB2 GLU 131 HB2 GLU 131 10.546 27.672 -2.966 503 HB3 GLU 131 HB3 GLU 131 10.684 29.213 -2.132 504 HG2 GLU 131 HG2 GLU 131 13.141 27.624 -2.143 505 HG3 GLU 131 HG3 GLU 131 12.584 28.126 -3.739 506 H PHE 132 H PHE 132 9.137 28.522 0.579 507 HA PHE 132 HA PHE 132 11.012 30.251 2.049 508 HB2 PHE 132 HB2 PHE 132 8.031 30.647 1.972 509 HB3 PHE 132 HB3 PHE 132 9.288 31.824 2.340 510 HD1 PHE 132 HD2 PHE 132 11.129 31.336 0.057 511 HD2 PHE 132 HD1 PHE 132 6.887 31.647 0.208 512 HE1 PHE 132 HE2 PHE 132 11.105 32.093 -2.284 513 HE2 PHE 132 HE1 PHE 132 6.856 32.403 -2.134 514 HZ PHE 132 HZ PHE 132 8.966 32.628 -3.381 515 H SER 133 H SER 133 11.426 28.185 3.277 516 HA SER 133 HA SER 133 9.909 28.262 5.725 517 HB2 SER 133 HB2 SER 133 9.413 26.189 3.737 518 HB3 SER 133 HB3 SER 133 9.924 25.516 5.286 519 HG SER 133 HG SER 133 8.003 25.936 5.990 520 H LEU 134 H LEU 134 11.845 28.829 6.693 521 HA LEU 134 HA LEU 134 13.428 26.810 7.741 522 HB2 LEU 134 HB2 LEU 134 14.136 27.328 5.099 523 HB3 LEU 134 HB3 LEU 134 15.347 28.175 6.060 524 HG LEU 134 HG LEU 134 14.766 25.348 6.762 525 HD11 LEU 134 HD11 LEU 134 15.117 25.865 4.133 526 HD12 LEU 134 HD12 LEU 134 15.644 24.385 4.932 527 HD13 LEU 134 HD13 LEU 134 16.791 25.696 4.663 528 HD21 LEU 134 HD21 LEU 134 17.448 26.626 6.451 529 HD22 LEU 134 HD22 LEU 134 16.930 25.356 7.561 530 HD23 LEU 134 HD23 LEU 134 16.438 27.028 7.840 Start of MODEL 6 1 H GLY 67 H GLY 67 1.155 0.968 -3.139 2 HA2 GLY 67 HA2 GLY 67 2.376 0.999 -5.108 3 HA3 GLY 67 HA3 GLY 67 0.867 1.117 -6.001 4 H GLN 68 H GLN 68 0.070 3.477 -4.328 5 HA GLN 68 HA GLN 68 1.088 5.482 -6.061 6 HB2 GLN 68 HB2 GLN 68 -0.797 5.363 -3.784 7 HB3 GLN 68 HB3 GLN 68 -0.031 6.921 -4.063 8 HG2 GLN 68 HG2 GLN 68 -2.185 6.740 -5.195 9 HG3 GLN 68 HG3 GLN 68 -0.858 6.958 -6.334 10 HE21 GLN 68 HE21 GLN 68 -1.981 4.059 -4.650 11 HE22 GLN 68 HE22 GLN 68 -2.333 3.152 -6.077 12 H ASP 69 H ASP 69 2.875 6.658 -5.906 13 HA ASP 69 HA ASP 69 4.760 6.255 -3.835 14 HB2 ASP 69 HB2 ASP 69 4.569 8.001 -6.238 15 HB3 ASP 69 HB3 ASP 69 5.729 8.458 -4.994 16 H LEU 70 H LEU 70 5.041 7.253 -1.945 17 HA LEU 70 HA LEU 70 3.121 8.995 -0.882 18 HB2 LEU 70 HB2 LEU 70 5.758 7.959 -0.046 19 HB3 LEU 70 HB3 LEU 70 5.211 9.434 0.748 20 HG LEU 70 HG LEU 70 3.063 8.122 1.265 21 HD11 LEU 70 HD11 LEU 70 4.201 5.595 1.513 22 HD12 LEU 70 HD12 LEU 70 4.613 6.120 -0.118 23 HD13 LEU 70 HD13 LEU 70 2.927 6.083 0.396 24 HD21 LEU 70 HD21 LEU 70 5.732 7.555 2.530 25 HD22 LEU 70 HD22 LEU 70 4.208 6.991 3.216 26 HD23 LEU 70 HD23 LEU 70 4.508 8.719 3.036 27 H SER 71 H SER 71 3.990 11.119 0.272 28 HA SER 71 HA SER 71 5.049 12.800 -1.894 29 HB2 SER 71 HB2 SER 71 3.051 13.222 0.255 30 HB3 SER 71 HB3 SER 71 4.083 14.599 -0.129 31 HG SER 71 HG SER 71 2.252 13.234 -1.775 32 H ASP 72 H ASP 72 6.778 14.142 -1.582 33 HA ASP 72 HA ASP 72 8.909 13.495 -0.109 34 HB2 ASP 72 HB2 ASP 72 8.048 15.859 -1.455 35 HB3 ASP 72 HB3 ASP 72 8.805 16.336 0.062 36 H ASP 73 H ASP 73 9.824 14.005 1.903 37 HA ASP 73 HA ASP 73 8.300 13.719 4.139 38 HB2 ASP 73 HB2 ASP 73 10.900 15.235 3.857 39 HB3 ASP 73 HB3 ASP 73 10.192 14.774 5.402 40 H LYS 74 H LYS 74 8.670 16.565 2.238 41 HA LYS 74 HA LYS 74 7.707 18.366 4.285 42 HB2 LYS 74 HB2 LYS 74 7.958 20.095 2.677 43 HB3 LYS 74 HB3 LYS 74 9.329 19.016 2.456 44 HG2 LYS 74 HG2 LYS 74 7.341 18.049 0.749 45 HG3 LYS 74 HG3 LYS 74 7.302 19.805 0.580 46 HD2 LYS 74 HD2 LYS 74 9.706 19.821 0.139 47 HD3 LYS 74 HD3 LYS 74 9.756 18.065 0.326 48 HE2 LYS 74 HE2 LYS 74 8.099 17.919 -1.555 49 HE3 LYS 74 HE3 LYS 74 8.329 19.649 -1.804 50 HZ1 LYS 74 HZ1 LYS 74 10.841 18.393 -1.684 51 HZ2 LYS 74 HZ2 LYS 74 10.139 19.224 -2.979 52 HZ3 LYS 74 HZ3 LYS 74 9.877 17.563 -2.799 53 H ILE 75 H ILE 75 6.157 16.003 2.923 54 HA ILE 75 HA ILE 75 3.984 16.919 1.505 55 HB ILE 75 HB ILE 75 4.323 14.556 1.841 56 HG12 ILE 75 HG12 ILE 75 1.732 15.509 3.078 57 HG13 ILE 75 HG13 ILE 75 2.039 15.254 1.364 58 HG21 ILE 75 HG21 ILE 75 4.074 13.445 3.936 59 HG22 ILE 75 HG22 ILE 75 5.197 14.783 4.172 60 HG23 ILE 75 HG23 ILE 75 3.528 14.927 4.720 61 HD11 ILE 75 HD11 ILE 75 2.658 12.819 2.442 62 HD12 ILE 75 HD12 ILE 75 1.304 13.353 3.437 63 HD13 ILE 75 HD13 ILE 75 1.126 13.253 1.686 64 H GLY 76 H GLY 76 4.459 16.900 5.013 65 HA2 GLY 76 HA2 GLY 76 1.892 17.705 5.783 66 HA3 GLY 76 HA3 GLY 76 3.362 18.006 6.699 67 H LEU 77 H LEU 77 4.745 19.689 5.031 68 HA LEU 77 HA LEU 77 3.538 22.172 5.574 69 HB2 LEU 77 HB2 LEU 77 6.046 21.317 4.893 70 HB3 LEU 77 HB3 LEU 77 5.541 22.180 3.441 71 HG LEU 77 HG LEU 77 5.027 24.148 4.950 72 HD11 LEU 77 HD11 LEU 77 4.896 23.265 7.097 73 HD12 LEU 77 HD12 LEU 77 6.467 24.067 7.077 74 HD13 LEU 77 HD13 LEU 77 6.371 22.315 6.902 75 HD21 LEU 77 HD21 LEU 77 7.671 23.076 4.199 76 HD22 LEU 77 HD22 LEU 77 7.673 24.402 5.364 77 HD23 LEU 77 HD23 LEU 77 6.908 24.611 3.788 78 H LYS 78 H LYS 78 4.079 20.508 2.471 79 HA LYS 78 HA LYS 78 2.812 22.370 0.829 80 HB2 LYS 78 HB2 LYS 78 3.331 19.425 0.594 81 HB3 LYS 78 HB3 LYS 78 2.377 20.250 -0.632 82 HG2 LYS 78 HG2 LYS 78 4.410 21.903 -0.659 83 HG3 LYS 78 HG3 LYS 78 5.267 20.518 0.023 84 HD2 LYS 78 HD2 LYS 78 3.558 19.973 -2.325 85 HD3 LYS 78 HD3 LYS 78 5.000 20.948 -2.619 86 HE2 LYS 78 HE2 LYS 78 6.244 19.109 -2.595 87 HE3 LYS 78 HE3 LYS 78 5.740 18.788 -0.936 88 HZ1 LYS 78 HZ1 LYS 78 3.653 18.042 -2.639 89 HZ2 LYS 78 HZ2 LYS 78 4.608 17.048 -1.660 90 HZ3 LYS 78 HZ3 LYS 78 5.077 17.366 -3.254 91 H VAL 79 H VAL 79 1.478 19.488 2.425 92 HA VAL 79 HA VAL 79 -1.119 19.640 1.427 93 HB VAL 79 HB VAL 79 -0.057 18.567 4.034 94 HG11 VAL 79 HG11 VAL 79 -2.887 18.554 3.008 95 HG12 VAL 79 HG12 VAL 79 -2.297 17.435 4.237 96 HG13 VAL 79 HG13 VAL 79 -2.296 19.171 4.549 97 HG21 VAL 79 HG21 VAL 79 -0.077 16.497 3.024 98 HG22 VAL 79 HG22 VAL 79 -1.312 16.959 1.852 99 HG23 VAL 79 HG23 VAL 79 0.344 17.537 1.664 100 H LEU 80 H LEU 80 0.178 20.981 4.463 101 HA LEU 80 HA LEU 80 -2.139 22.177 5.405 102 HB2 LEU 80 HB2 LEU 80 0.710 22.387 5.902 103 HB3 LEU 80 HB3 LEU 80 -0.111 23.932 6.112 104 HG LEU 80 HG LEU 80 -1.739 22.288 7.530 105 HD11 LEU 80 HD11 LEU 80 1.064 21.255 7.940 106 HD12 LEU 80 HD12 LEU 80 -0.254 20.366 7.176 107 HD13 LEU 80 HD13 LEU 80 -0.364 20.814 8.878 108 HD21 LEU 80 HD21 LEU 80 0.728 23.503 8.739 109 HD22 LEU 80 HD22 LEU 80 -0.884 23.352 9.440 110 HD23 LEU 80 HD23 LEU 80 -0.597 24.488 8.120 111 H PHE 81 H PHE 81 0.428 23.673 3.435 112 HA PHE 81 HA PHE 81 -0.652 26.186 3.124 113 HB2 PHE 81 HB2 PHE 81 1.545 25.768 2.298 114 HB3 PHE 81 HB3 PHE 81 0.970 24.511 1.209 115 HD1 PHE 81 HD2 PHE 81 -0.156 25.081 -0.867 116 HD2 PHE 81 HD1 PHE 81 1.328 28.098 1.742 117 HE1 PHE 81 HE2 PHE 81 -0.369 26.741 -2.670 118 HE2 PHE 81 HE1 PHE 81 1.117 29.763 -0.057 119 HZ PHE 81 HZ PHE 81 0.268 29.085 -2.266 120 H LYS 82 H LYS 82 -1.120 23.414 0.931 121 HA LYS 82 HA LYS 82 -2.971 24.656 -0.764 122 HB2 LYS 82 HB2 LYS 82 -1.835 22.598 -1.388 123 HB3 LYS 82 HB3 LYS 82 -2.634 21.730 -0.084 124 HG2 LYS 82 HG2 LYS 82 -4.682 22.896 -1.604 125 HG3 LYS 82 HG3 LYS 82 -3.531 22.216 -2.758 126 HD2 LYS 82 HD2 LYS 82 -4.259 20.546 -0.418 127 HD3 LYS 82 HD3 LYS 82 -5.490 20.775 -1.662 128 HE2 LYS 82 HE2 LYS 82 -4.359 18.849 -2.336 129 HE3 LYS 82 HE3 LYS 82 -3.650 20.124 -3.324 130 HZ1 LYS 82 HZ1 LYS 82 -2.379 18.392 -1.495 131 HZ2 LYS 82 HZ2 LYS 82 -2.153 19.991 -0.994 132 HZ3 LYS 82 HZ3 LYS 82 -1.682 19.517 -2.549 133 H LEU 83 H LEU 83 -3.445 22.719 2.161 134 HA LEU 83 HA LEU 83 -6.212 22.497 2.109 135 HB2 LEU 83 HB2 LEU 83 -4.361 21.590 3.757 136 HB3 LEU 83 HB3 LEU 83 -4.845 22.993 4.706 137 HG LEU 83 HG LEU 83 -6.561 20.652 3.898 138 HD11 LEU 83 HD11 LEU 83 -6.813 20.819 6.534 139 HD12 LEU 83 HD12 LEU 83 -5.210 21.540 6.383 140 HD13 LEU 83 HD13 LEU 83 -5.506 19.914 5.769 141 HD21 LEU 83 HD21 LEU 83 -8.316 21.822 5.263 142 HD22 LEU 83 HD22 LEU 83 -7.956 22.567 3.705 143 HD23 LEU 83 HD23 LEU 83 -7.308 23.268 5.188 144 H MET 84 H MET 84 -4.175 25.135 3.278 145 HA MET 84 HA MET 84 -6.309 26.669 4.370 146 HB2 MET 84 HB2 MET 84 -3.671 27.760 3.404 147 HB3 MET 84 HB3 MET 84 -4.712 28.405 4.666 148 HG2 MET 84 HG2 MET 84 -4.096 25.810 5.478 149 HG3 MET 84 HG3 MET 84 -2.592 26.474 4.844 150 HE1 MET 84 HE1 MET 84 -1.216 26.946 7.621 151 HE2 MET 84 HE2 MET 84 -1.118 27.434 5.928 152 HE3 MET 84 HE3 MET 84 -1.216 28.659 7.195 153 H ASP 85 H ASP 85 -5.312 26.042 1.198 154 HA ASP 85 HA ASP 85 -6.481 28.516 0.153 155 HB2 ASP 85 HB2 ASP 85 -4.550 26.524 -0.855 156 HB3 ASP 85 HB3 ASP 85 -5.680 27.144 -2.055 157 H VAL 86 H VAL 86 -8.624 27.783 0.892 158 HA VAL 86 HA VAL 86 -9.909 25.498 -0.099 159 HB VAL 86 HB VAL 86 -11.236 28.127 0.570 160 HG11 VAL 86 HG11 VAL 86 -12.920 26.850 -0.322 161 HG12 VAL 86 HG12 VAL 86 -12.185 25.328 0.187 162 HG13 VAL 86 HG13 VAL 86 -13.002 26.354 1.367 163 HG21 VAL 86 HG21 VAL 86 -10.058 26.006 2.296 164 HG22 VAL 86 HG22 VAL 86 -10.089 27.755 2.520 165 HG23 VAL 86 HG23 VAL 86 -11.541 26.802 2.825 166 H ASP 87 H ASP 87 -8.925 28.310 -1.704 167 HA ASP 87 HA ASP 87 -10.975 28.318 -3.725 168 HB2 ASP 87 HB2 ASP 87 -9.322 29.901 -4.880 169 HB3 ASP 87 HB3 ASP 87 -9.997 30.426 -3.340 170 H GLY 88 H GLY 88 -8.494 26.251 -3.087 171 HA2 GLY 88 HA2 GLY 88 -7.247 24.768 -4.338 172 HA3 GLY 88 HA3 GLY 88 -8.718 24.664 -5.294 173 H ASP 89 H ASP 89 -6.410 27.335 -4.901 174 HA ASP 89 HA ASP 89 -6.235 27.533 -7.809 175 HB2 ASP 89 HB2 ASP 89 -4.971 29.681 -7.232 176 HB3 ASP 89 HB3 ASP 89 -6.683 29.631 -6.822 177 H GLY 90 H GLY 90 -4.411 26.463 -5.102 178 HA2 GLY 90 HA2 GLY 90 -2.429 25.259 -5.105 179 HA3 GLY 90 HA3 GLY 90 -2.293 25.550 -6.833 180 H LYS 91 H LYS 91 -2.837 28.504 -5.615 181 HA LYS 91 HA LYS 91 -0.054 29.030 -4.859 182 HB2 LYS 91 HB2 LYS 91 -0.215 31.122 -6.350 183 HB3 LYS 91 HB3 LYS 91 0.084 29.574 -7.130 184 HG2 LYS 91 HG2 LYS 91 -1.728 29.799 -8.380 185 HG3 LYS 91 HG3 LYS 91 -2.737 30.035 -6.951 186 HD2 LYS 91 HD2 LYS 91 -1.949 32.433 -6.940 187 HD3 LYS 91 HD3 LYS 91 -1.241 32.121 -8.527 188 HE2 LYS 91 HE2 LYS 91 -4.149 31.713 -7.842 189 HE3 LYS 91 HE3 LYS 91 -3.502 33.161 -8.609 190 HZ1 LYS 91 HZ1 LYS 91 -3.385 30.408 -9.718 191 HZ2 LYS 91 HZ2 LYS 91 -2.735 31.785 -10.452 192 HZ3 LYS 91 HZ3 LYS 91 -4.408 31.649 -10.246 193 H LEU 92 H LEU 92 0.234 30.741 -3.463 194 HA LEU 92 HA LEU 92 -2.220 31.786 -2.259 195 HB2 LEU 92 HB2 LEU 92 -1.064 31.080 -0.467 196 HB3 LEU 92 HB3 LEU 92 0.482 31.157 -1.310 197 HG LEU 92 HG LEU 92 -0.817 33.698 -0.443 198 HD11 LEU 92 HD11 LEU 92 0.993 32.823 1.568 199 HD12 LEU 92 HD12 LEU 92 -0.247 31.589 1.354 200 HD13 LEU 92 HD13 LEU 92 -0.712 33.250 1.723 201 HD21 LEU 92 HD21 LEU 92 1.470 33.156 -1.771 202 HD22 LEU 92 HD22 LEU 92 2.061 33.177 -0.109 203 HD23 LEU 92 HD23 LEU 92 1.227 34.586 -0.767 204 H THR 93 H THR 93 -2.680 33.938 -2.105 205 HA THR 93 HA THR 93 -1.132 35.701 -3.843 206 HB THR 93 HB THR 93 -3.590 35.583 -4.142 207 HG1 THR 93 HG1 THR 93 -3.023 38.173 -3.184 208 HG21 THR 93 HG21 THR 93 -3.923 37.145 -1.611 209 HG22 THR 93 HG22 THR 93 -3.914 35.382 -1.560 210 HG23 THR 93 HG23 THR 93 -5.120 36.230 -2.528 211 H LYS 94 H LYS 94 -0.566 37.853 -3.174 212 HA LYS 94 HA LYS 94 0.953 38.106 -0.957 213 HB2 LYS 94 HB2 LYS 94 0.473 39.783 -2.900 214 HB3 LYS 94 HB3 LYS 94 -0.709 40.461 -1.788 215 HG2 LYS 94 HG2 LYS 94 1.378 40.400 -0.146 216 HG3 LYS 94 HG3 LYS 94 2.249 40.504 -1.678 217 HD2 LYS 94 HD2 LYS 94 -0.032 42.357 -1.109 218 HD3 LYS 94 HD3 LYS 94 1.568 42.686 -0.441 219 HE2 LYS 94 HE2 LYS 94 1.907 43.757 -2.386 220 HE3 LYS 94 HE3 LYS 94 2.186 42.138 -3.024 221 HZ1 LYS 94 HZ1 LYS 94 0.549 42.584 -4.437 222 HZ2 LYS 94 HZ2 LYS 94 0.071 43.970 -3.594 223 HZ3 LYS 94 HZ3 LYS 94 -0.524 42.454 -3.135 224 H GLU 95 H GLU 95 -2.420 39.266 -1.109 225 HA GLU 95 HA GLU 95 -2.721 40.018 1.525 226 HB2 GLU 95 HB2 GLU 95 -4.821 38.703 -0.207 227 HB3 GLU 95 HB3 GLU 95 -5.124 39.690 1.216 228 HG2 GLU 95 HG2 GLU 95 -3.984 41.581 0.019 229 HG3 GLU 95 HG3 GLU 95 -3.999 40.570 -1.426 230 H GLU 96 H GLU 96 -3.082 36.800 0.104 231 HA GLU 96 HA GLU 96 -3.992 35.531 2.470 232 HB2 GLU 96 HB2 GLU 96 -4.303 34.582 0.211 233 HB3 GLU 96 HB3 GLU 96 -2.568 34.325 0.091 234 HG2 GLU 96 HG2 GLU 96 -2.596 32.677 1.779 235 HG3 GLU 96 HG3 GLU 96 -4.242 33.092 2.256 236 H VAL 97 H VAL 97 -0.803 36.098 1.092 237 HA VAL 97 HA VAL 97 0.694 34.422 2.762 238 HB VAL 97 HB VAL 97 1.291 36.154 0.711 239 HG11 VAL 97 HG11 VAL 97 2.693 37.180 3.175 240 HG12 VAL 97 HG12 VAL 97 2.915 37.738 1.515 241 HG13 VAL 97 HG13 VAL 97 1.383 38.017 2.345 242 HG21 VAL 97 HG21 VAL 97 2.479 34.048 2.073 243 HG22 VAL 97 HG22 VAL 97 3.055 34.797 0.584 244 HG23 VAL 97 HG23 VAL 97 3.673 35.345 2.142 245 H THR 98 H THR 98 -0.586 37.649 3.257 246 HA THR 98 HA THR 98 0.898 38.157 5.655 247 HB THR 98 HB THR 98 -1.560 39.514 4.533 248 HG1 THR 98 HG1 THR 98 1.023 40.636 4.655 249 HG21 THR 98 HG21 THR 98 -0.941 41.361 6.095 250 HG22 THR 98 HG22 THR 98 0.215 40.267 6.854 251 HG23 THR 98 HG23 THR 98 -1.509 39.901 6.904 252 H SER 99 H SER 99 -2.333 36.960 4.894 253 HA SER 99 HA SER 99 -3.260 36.941 7.587 254 HB2 SER 99 HB2 SER 99 -4.251 36.022 4.964 255 HB3 SER 99 HB3 SER 99 -4.834 35.096 6.346 256 HG SER 99 HG SER 99 -5.187 37.406 7.209 257 H PHE 100 H PHE 100 -1.949 34.448 5.429 258 HA PHE 100 HA PHE 100 -2.178 32.306 7.251 259 HB2 PHE 100 HB2 PHE 100 -0.442 32.753 4.828 260 HB3 PHE 100 HB3 PHE 100 -0.370 31.266 5.767 261 HD1 PHE 100 HD2 PHE 100 -3.637 32.492 5.912 262 HD2 PHE 100 HD1 PHE 100 -0.934 30.482 3.309 263 HE1 PHE 100 HE2 PHE 100 -5.539 31.596 4.633 264 HE2 PHE 100 HE1 PHE 100 -2.832 29.584 2.026 265 HZ PHE 100 HZ PHE 100 -5.138 30.139 2.690 266 H PHE 101 H PHE 101 0.483 34.528 6.522 267 HA PHE 101 HA PHE 101 2.263 33.311 8.414 268 HB2 PHE 101 HB2 PHE 101 2.763 34.773 6.265 269 HB3 PHE 101 HB3 PHE 101 2.680 36.098 7.422 270 HD1 PHE 101 HD2 PHE 101 4.155 35.897 9.524 271 HD2 PHE 101 HD1 PHE 101 4.730 33.588 5.994 272 HE1 PHE 101 HE2 PHE 101 6.482 35.459 10.193 273 HE2 PHE 101 HE1 PHE 101 7.058 33.146 6.659 274 HZ PHE 101 HZ PHE 101 7.937 34.082 8.759 275 H LYS 102 H LYS 102 -0.181 35.737 8.520 276 HA LYS 102 HA LYS 102 0.590 37.354 10.616 277 HB2 LYS 102 HB2 LYS 102 -1.878 36.666 9.294 278 HB3 LYS 102 HB3 LYS 102 -2.148 36.835 11.023 279 HG2 LYS 102 HG2 LYS 102 -0.520 38.960 9.833 280 HG3 LYS 102 HG3 LYS 102 -2.180 38.875 9.238 281 HD2 LYS 102 HD2 LYS 102 -1.519 38.843 12.172 282 HD3 LYS 102 HD3 LYS 102 -1.754 40.345 11.275 283 HE2 LYS 102 HE2 LYS 102 -3.814 38.192 11.104 284 HE3 LYS 102 HE3 LYS 102 -3.752 39.217 12.538 285 HZ1 LYS 102 HZ1 LYS 102 -5.176 40.383 11.202 286 HZ2 LYS 102 HZ2 LYS 102 -4.403 39.935 9.766 287 HZ3 LYS 102 HZ3 LYS 102 -3.710 41.107 10.771 288 H LYS 103 H LYS 103 -0.419 34.031 10.680 289 HA LYS 103 HA LYS 103 -1.208 33.726 13.322 290 HB2 LYS 103 HB2 LYS 103 0.224 31.857 11.442 291 HB3 LYS 103 HB3 LYS 103 -0.276 31.361 13.054 292 HG2 LYS 103 HG2 LYS 103 -2.187 32.480 11.023 293 HG3 LYS 103 HG3 LYS 103 -1.835 30.757 11.176 294 HD2 LYS 103 HD2 LYS 103 -2.718 32.389 13.536 295 HD3 LYS 103 HD3 LYS 103 -3.887 31.690 12.412 296 HE2 LYS 103 HE2 LYS 103 -1.821 29.826 13.337 297 HE3 LYS 103 HE3 LYS 103 -2.876 30.434 14.613 298 HZ1 LYS 103 HZ1 LYS 103 -3.996 29.378 12.094 299 HZ2 LYS 103 HZ2 LYS 103 -4.744 29.535 13.604 300 HZ3 LYS 103 HZ3 LYS 103 -3.576 28.336 13.359 301 H HIS 104 H HIS 104 1.933 34.311 12.010 302 HA HIS 104 HA HIS 104 3.290 33.539 14.468 303 HB2 HIS 104 HB2 HIS 104 4.074 33.486 11.847 304 HB3 HIS 104 HB3 HIS 104 4.841 34.966 12.414 305 HD1 HIS 104 HD1 HIS 104 5.489 33.916 15.316 306 HD2 HIS 104 HD2 HIS 104 6.341 31.929 11.767 307 HE1 HIS 104 HE1 HIS 104 7.384 32.354 15.858 308 H GLY 105 H GLY 105 2.082 36.371 12.878 309 HA2 GLY 105 HA2 GLY 105 1.653 38.388 14.055 310 HA3 GLY 105 HA3 GLY 105 2.935 37.971 15.182 311 H ILE 106 H ILE 106 4.377 37.250 12.443 312 HA ILE 106 HA ILE 106 5.619 39.889 12.232 313 HB ILE 106 HB ILE 106 6.508 37.237 11.089 314 HG12 ILE 106 HG12 ILE 106 6.656 37.208 13.500 315 HG13 ILE 106 HG13 ILE 106 8.277 37.400 12.843 316 HG21 ILE 106 HG21 ILE 106 7.544 38.721 9.691 317 HG22 ILE 106 HG22 ILE 106 7.582 40.004 10.900 318 HG23 ILE 106 HG23 ILE 106 8.721 38.662 11.002 319 HD11 ILE 106 HD11 ILE 106 8.507 39.106 14.235 320 HD12 ILE 106 HD12 ILE 106 7.380 39.992 13.208 321 HD13 ILE 106 HD13 ILE 106 6.787 39.115 14.618 322 H GLU 107 H GLU 107 5.122 41.222 10.631 323 HA GLU 107 HA GLU 107 3.599 40.230 8.355 324 HB2 GLU 107 HB2 GLU 107 3.699 42.676 9.823 325 HB3 GLU 107 HB3 GLU 107 4.092 43.024 8.146 326 HG2 GLU 107 HG2 GLU 107 1.770 41.265 8.599 327 HG3 GLU 107 HG3 GLU 107 1.593 42.945 9.101 328 H LYS 108 H LYS 108 6.774 40.516 9.067 329 HA LYS 108 HA LYS 108 7.956 41.835 6.925 330 HB2 LYS 108 HB2 LYS 108 9.234 41.070 8.854 331 HB3 LYS 108 HB3 LYS 108 8.925 39.393 8.422 332 HG2 LYS 108 HG2 LYS 108 10.616 39.350 6.976 333 HG3 LYS 108 HG3 LYS 108 10.150 40.893 6.257 334 HD2 LYS 108 HD2 LYS 108 11.248 41.174 8.941 335 HD3 LYS 108 HD3 LYS 108 12.382 40.435 7.807 336 HE2 LYS 108 HE2 LYS 108 12.647 42.846 7.811 337 HE3 LYS 108 HE3 LYS 108 12.021 42.304 6.255 338 HZ1 LYS 108 HZ1 LYS 108 10.441 43.524 8.453 339 HZ2 LYS 108 HZ2 LYS 108 9.790 42.935 7.007 340 HZ3 LYS 108 HZ3 LYS 108 10.846 44.256 6.982 341 H VAL 109 H VAL 109 6.324 38.792 7.035 342 HA VAL 109 HA VAL 109 7.402 37.397 4.919 343 HB VAL 109 HB VAL 109 5.587 36.555 6.387 344 HG11 VAL 109 HG11 VAL 109 4.136 38.480 6.426 345 HG12 VAL 109 HG12 VAL 109 3.852 38.344 4.689 346 HG13 VAL 109 HG13 VAL 109 3.248 37.098 5.783 347 HG21 VAL 109 HG21 VAL 109 5.149 36.394 3.409 348 HG22 VAL 109 HG22 VAL 109 6.097 35.299 4.417 349 HG23 VAL 109 HG23 VAL 109 4.342 35.352 4.581 350 H ALA 110 H ALA 110 5.397 40.247 4.863 351 HA ALA 110 HA ALA 110 4.575 40.125 2.162 352 HB1 ALA 110 HB1 ALA 110 4.182 41.851 4.329 353 HB2 ALA 110 HB2 ALA 110 4.907 42.836 3.059 354 HB3 ALA 110 HB3 ALA 110 3.426 41.935 2.738 355 H GLU 111 H GLU 111 7.339 41.710 3.736 356 HA GLU 111 HA GLU 111 8.377 42.788 1.306 357 HB2 GLU 111 HB2 GLU 111 8.797 43.577 3.727 358 HB3 GLU 111 HB3 GLU 111 10.002 42.299 3.789 359 HG2 GLU 111 HG2 GLU 111 10.964 44.488 3.247 360 HG3 GLU 111 HG3 GLU 111 11.226 43.296 1.974 361 H GLN 112 H GLN 112 8.831 39.817 3.092 362 HA GLN 112 HA GLN 112 11.164 38.977 1.673 363 HB2 GLN 112 HB2 GLN 112 9.244 37.153 3.104 364 HB3 GLN 112 HB3 GLN 112 10.971 36.935 2.852 365 HG2 GLN 112 HG2 GLN 112 10.767 39.319 4.259 366 HG3 GLN 112 HG3 GLN 112 9.570 38.256 4.999 367 HE21 GLN 112 HE21 GLN 112 12.958 38.609 4.174 368 HE22 GLN 112 HE22 GLN 112 13.555 37.479 5.338 369 H VAL 113 H VAL 113 7.706 38.230 1.434 370 HA VAL 113 HA VAL 113 7.958 36.350 -0.671 371 HB VAL 113 HB VAL 113 5.958 36.619 0.844 372 HG11 VAL 113 HG11 VAL 113 5.699 39.026 0.703 373 HG12 VAL 113 HG12 VAL 113 5.367 38.911 -1.026 374 HG13 VAL 113 HG13 VAL 113 4.233 38.226 0.139 375 HG21 VAL 113 HG21 VAL 113 5.634 35.125 -0.899 376 HG22 VAL 113 HG22 VAL 113 4.311 36.269 -1.128 377 HG23 VAL 113 HG23 VAL 113 5.757 36.379 -2.133 378 H MET 114 H MET 114 7.676 39.835 -0.576 379 HA MET 114 HA MET 114 7.135 40.106 -3.386 380 HB2 MET 114 HB2 MET 114 7.480 41.912 -1.078 381 HB3 MET 114 HB3 MET 114 7.981 42.572 -2.629 382 HG2 MET 114 HG2 MET 114 5.335 41.239 -2.465 383 HG3 MET 114 HG3 MET 114 5.519 42.829 -1.730 384 HE1 MET 114 HE1 MET 114 4.677 41.617 -5.794 385 HE2 MET 114 HE2 MET 114 6.418 41.341 -5.733 386 HE3 MET 114 HE3 MET 114 5.365 40.609 -4.521 387 H LYS 115 H LYS 115 9.956 40.319 -1.288 388 HA LYS 115 HA LYS 115 11.706 41.169 -3.412 389 HB2 LYS 115 HB2 LYS 115 12.205 40.264 -0.577 390 HB3 LYS 115 HB3 LYS 115 13.499 40.713 -1.679 391 HG2 LYS 115 HG2 LYS 115 11.232 42.530 -0.893 392 HG3 LYS 115 HG3 LYS 115 12.822 42.522 -0.128 393 HD2 LYS 115 HD2 LYS 115 12.296 43.046 -3.054 394 HD3 LYS 115 HD3 LYS 115 12.607 44.286 -1.836 395 HE2 LYS 115 HE2 LYS 115 14.734 44.052 -2.565 396 HE3 LYS 115 HE3 LYS 115 14.737 42.708 -1.423 397 HZ1 LYS 115 HZ1 LYS 115 14.803 42.675 -4.319 398 HZ2 LYS 115 HZ2 LYS 115 13.787 41.521 -3.614 399 HZ3 LYS 115 HZ3 LYS 115 15.428 41.563 -3.208 400 H ALA 116 H ALA 116 10.545 38.183 -2.182 401 HA ALA 116 HA ALA 116 12.726 36.634 -3.329 402 HB1 ALA 116 HB1 ALA 116 11.929 35.832 -1.235 403 HB2 ALA 116 HB2 ALA 116 10.258 35.837 -1.801 404 HB3 ALA 116 HB3 ALA 116 11.411 34.681 -2.468 405 H ASP 117 H ASP 117 9.640 37.809 -4.215 406 HA ASP 117 HA ASP 117 9.214 35.793 -6.268 407 HB2 ASP 117 HB2 ASP 117 7.622 38.016 -5.101 408 HB3 ASP 117 HB3 ASP 117 7.279 37.576 -6.772 409 H ALA 118 H ALA 118 11.111 36.216 -7.515 410 HA ALA 118 HA ALA 118 11.570 38.782 -8.693 411 HB1 ALA 118 HB1 ALA 118 12.690 36.217 -9.765 412 HB2 ALA 118 HB2 ALA 118 13.416 37.825 -9.741 413 HB3 ALA 118 HB3 ALA 118 13.269 36.901 -8.246 414 H ASN 119 H ASN 119 9.529 36.136 -9.423 415 HA ASN 119 HA ASN 119 9.318 36.713 -12.248 416 HB2 ASN 119 HB2 ASN 119 7.356 35.037 -12.020 417 HB3 ASN 119 HB3 ASN 119 8.997 34.441 -11.798 418 HD21 ASN 119 HD21 ASN 119 8.191 32.696 -10.596 419 HD22 ASN 119 HD22 ASN 119 7.676 32.892 -8.958 420 H GLY 120 H GLY 120 8.218 38.230 -9.552 421 HA2 GLY 120 HA2 GLY 120 6.494 39.683 -9.097 422 HA3 GLY 120 HA3 GLY 120 6.582 40.047 -10.813 423 H ASP 121 H ASP 121 5.748 36.867 -9.654 424 HA ASP 121 HA ASP 121 3.333 36.825 -11.139 425 HB2 ASP 121 HB2 ASP 121 2.957 34.655 -9.818 426 HB3 ASP 121 HB3 ASP 121 4.376 34.736 -10.859 427 H GLY 122 H GLY 122 4.121 37.820 -7.937 428 HA2 GLY 122 HA2 GLY 122 2.807 38.921 -6.389 429 HA3 GLY 122 HA3 GLY 122 1.454 38.782 -7.502 430 H TYR 123 H TYR 123 2.757 35.764 -7.120 431 HA TYR 123 HA TYR 123 1.349 35.101 -4.666 432 HB2 TYR 123 HB2 TYR 123 0.052 33.287 -5.819 433 HB3 TYR 123 HB3 TYR 123 -0.464 34.920 -6.225 434 HD1 TYR 123 HD1 TYR 123 1.809 32.228 -7.463 435 HD2 TYR 123 HD2 TYR 123 -0.752 35.476 -8.454 436 HE1 TYR 123 HE1 TYR 123 2.095 31.716 -9.852 437 HE2 TYR 123 HE2 TYR 123 -0.476 34.972 -10.845 438 HH TYR 123 HH TYR 123 1.804 32.546 -11.960 439 H ILE 124 H ILE 124 1.699 32.837 -4.020 440 HA ILE 124 HA ILE 124 4.164 31.723 -5.191 441 HB ILE 124 HB ILE 124 5.124 31.342 -3.146 442 HG12 ILE 124 HG12 ILE 124 2.340 31.409 -1.974 443 HG13 ILE 124 HG13 ILE 124 3.392 30.009 -2.150 444 HG21 ILE 124 HG21 ILE 124 4.327 33.862 -3.584 445 HG22 ILE 124 HG22 ILE 124 3.552 33.578 -2.027 446 HG23 ILE 124 HG23 ILE 124 5.298 33.386 -2.191 447 HD11 ILE 124 HD11 ILE 124 3.317 30.753 0.149 448 HD12 ILE 124 HD12 ILE 124 4.934 30.977 -0.518 449 HD13 ILE 124 HD13 ILE 124 3.857 32.361 -0.333 450 H THR 125 H THR 125 3.944 29.726 -5.934 451 HA THR 125 HA THR 125 1.554 28.203 -5.296 452 HB THR 125 HB THR 125 2.290 28.358 -7.641 453 HG1 THR 125 HG1 THR 125 2.140 26.090 -8.045 454 HG21 THR 125 HG21 THR 125 4.309 26.737 -8.133 455 HG22 THR 125 HG22 THR 125 4.781 27.185 -6.494 456 HG23 THR 125 HG23 THR 125 4.586 28.430 -7.728 457 H LEU 126 H LEU 126 2.167 25.646 -5.370 458 HA LEU 126 HA LEU 126 3.036 24.962 -2.861 459 HB2 LEU 126 HB2 LEU 126 3.248 23.334 -5.389 460 HB3 LEU 126 HB3 LEU 126 3.402 22.686 -3.757 461 HG LEU 126 HG LEU 126 0.972 23.861 -3.593 462 HD11 LEU 126 HD11 LEU 126 0.363 22.590 -6.079 463 HD12 LEU 126 HD12 LEU 126 1.544 23.872 -6.346 464 HD13 LEU 126 HD13 LEU 126 0.010 24.235 -5.553 465 HD21 LEU 126 HD21 LEU 126 0.194 21.740 -3.342 466 HD22 LEU 126 HD22 LEU 126 1.925 21.403 -3.271 467 HD23 LEU 126 HD23 LEU 126 1.036 21.141 -4.773 468 H GLU 127 H GLU 127 4.969 24.985 -5.847 469 HA GLU 127 HA GLU 127 7.374 24.099 -4.740 470 HB2 GLU 127 HB2 GLU 127 6.591 25.602 -7.178 471 HB3 GLU 127 HB3 GLU 127 8.282 25.689 -6.704 472 HG2 GLU 127 HG2 GLU 127 7.689 23.001 -6.506 473 HG3 GLU 127 HG3 GLU 127 6.808 23.526 -7.940 474 H GLU 128 H GLU 128 6.328 27.450 -5.371 475 HA GLU 128 HA GLU 128 8.524 28.741 -4.258 476 HB2 GLU 128 HB2 GLU 128 5.693 29.772 -4.123 477 HB3 GLU 128 HB3 GLU 128 7.177 30.714 -4.178 478 HG2 GLU 128 HG2 GLU 128 7.511 29.506 -6.469 479 HG3 GLU 128 HG3 GLU 128 5.767 29.269 -6.365 480 H PHE 129 H PHE 129 5.548 27.608 -2.723 481 HA PHE 129 HA PHE 129 5.941 28.721 -0.191 482 HB2 PHE 129 HB2 PHE 129 3.810 27.749 -0.812 483 HB3 PHE 129 HB3 PHE 129 4.546 26.159 -0.987 484 HD1 PHE 129 HD2 PHE 129 3.911 28.829 1.519 485 HD2 PHE 129 HD1 PHE 129 4.562 24.685 0.798 486 HE1 PHE 129 HE2 PHE 129 3.406 28.343 3.877 487 HE2 PHE 129 HE1 PHE 129 4.058 24.192 3.156 488 HZ PHE 129 HZ PHE 129 3.480 26.023 4.699 489 H LEU 130 H LEU 130 7.070 25.668 -1.566 490 HA LEU 130 HA LEU 130 8.222 24.682 0.836 491 HB2 LEU 130 HB2 LEU 130 7.769 23.049 -0.751 492 HB3 LEU 130 HB3 LEU 130 8.470 23.993 -2.064 493 HG LEU 130 HG LEU 130 10.719 23.544 -1.129 494 HD11 LEU 130 HD11 LEU 130 10.025 23.187 1.202 495 HD12 LEU 130 HD12 LEU 130 11.003 21.856 0.583 496 HD13 LEU 130 HD13 LEU 130 9.255 21.672 0.726 497 HD21 LEU 130 HD21 LEU 130 10.327 20.876 -1.459 498 HD22 LEU 130 HD22 LEU 130 10.486 22.038 -2.777 499 HD23 LEU 130 HD23 LEU 130 8.885 21.538 -2.231 500 H GLU 131 H GLU 131 9.266 26.921 -1.577 501 HA GLU 131 HA GLU 131 12.064 26.747 -0.855 502 HB2 GLU 131 HB2 GLU 131 11.037 27.355 -3.173 503 HB3 GLU 131 HB3 GLU 131 10.878 28.966 -2.487 504 HG2 GLU 131 HG2 GLU 131 13.503 27.549 -2.384 505 HG3 GLU 131 HG3 GLU 131 12.982 28.351 -3.866 506 H PHE 132 H PHE 132 9.294 28.402 0.232 507 HA PHE 132 HA PHE 132 10.954 30.372 1.658 508 HB2 PHE 132 HB2 PHE 132 8.628 30.734 0.123 509 HB3 PHE 132 HB3 PHE 132 8.122 30.926 1.799 510 HD1 PHE 132 HD2 PHE 132 11.318 31.833 0.121 511 HD2 PHE 132 HD1 PHE 132 7.821 33.190 2.133 512 HE1 PHE 132 HE2 PHE 132 12.214 34.124 0.124 513 HE2 PHE 132 HE1 PHE 132 8.711 35.484 2.138 514 HZ PHE 132 HZ PHE 132 10.910 35.954 1.134 515 H SER 133 H SER 133 11.379 28.444 3.086 516 HA SER 133 HA SER 133 9.680 28.631 5.402 517 HB2 SER 133 HB2 SER 133 9.324 26.452 3.554 518 HB3 SER 133 HB3 SER 133 9.922 25.835 5.094 519 HG SER 133 HG SER 133 7.867 27.723 5.145 520 H LEU 134 H LEU 134 11.508 29.373 6.457 521 HA LEU 134 HA LEU 134 13.103 27.527 7.775 522 HB2 LEU 134 HB2 LEU 134 13.981 27.880 5.156 523 HB3 LEU 134 HB3 LEU 134 15.074 28.860 6.131 524 HG LEU 134 HG LEU 134 14.582 26.073 7.025 525 HD11 LEU 134 HD11 LEU 134 16.702 26.380 5.003 526 HD12 LEU 134 HD12 LEU 134 15.049 26.354 4.394 527 HD13 LEU 134 HD13 LEU 134 15.654 25.007 5.355 528 HD21 LEU 134 HD21 LEU 134 17.305 27.069 6.804 529 HD22 LEU 134 HD22 LEU 134 16.440 26.434 8.204 530 HD23 LEU 134 HD23 LEU 134 16.265 28.130 7.753 Start of MODEL 7 1 H GLY 67 H GLY 67 0.950 1.454 -3.864 2 HA2 GLY 67 HA2 GLY 67 2.449 1.334 -5.626 3 HA3 GLY 67 HA3 GLY 67 1.149 1.784 -6.718 4 H GLN 68 H GLN 68 0.670 4.142 -4.790 5 HA GLN 68 HA GLN 68 2.327 5.988 -6.255 6 HB2 GLN 68 HB2 GLN 68 0.186 6.830 -5.929 7 HB3 GLN 68 HB3 GLN 68 0.098 6.244 -4.274 8 HG2 GLN 68 HG2 GLN 68 1.094 8.076 -3.423 9 HG3 GLN 68 HG3 GLN 68 2.156 8.280 -4.814 10 HE21 GLN 68 HE21 GLN 68 1.469 10.561 -4.287 11 HE22 GLN 68 HE22 GLN 68 0.072 11.158 -5.110 12 H ASP 69 H ASP 69 4.232 6.758 -5.642 13 HA ASP 69 HA ASP 69 5.492 5.929 -3.248 14 HB2 ASP 69 HB2 ASP 69 6.183 7.752 -5.502 15 HB3 ASP 69 HB3 ASP 69 7.111 7.901 -4.013 16 H LEU 70 H LEU 70 5.943 7.014 -1.363 17 HA LEU 70 HA LEU 70 4.069 8.735 -0.300 18 HB2 LEU 70 HB2 LEU 70 6.830 7.947 0.419 19 HB3 LEU 70 HB3 LEU 70 6.181 9.383 1.208 20 HG LEU 70 HG LEU 70 4.338 8.071 2.112 21 HD11 LEU 70 HD11 LEU 70 4.173 5.705 1.823 22 HD12 LEU 70 HD12 LEU 70 5.668 5.662 0.888 23 HD13 LEU 70 HD13 LEU 70 4.236 6.450 0.225 24 HD21 LEU 70 HD21 LEU 70 5.580 7.471 3.865 25 HD22 LEU 70 HD22 LEU 70 6.971 7.999 2.917 26 HD23 LEU 70 HD23 LEU 70 6.499 6.299 2.920 27 H SER 71 H SER 71 4.571 10.979 0.594 28 HA SER 71 HA SER 71 5.537 12.622 -1.634 29 HB2 SER 71 HB2 SER 71 3.709 13.207 0.696 30 HB3 SER 71 HB3 SER 71 4.351 14.479 -0.344 31 HG SER 71 HG SER 71 2.471 13.941 -1.287 32 H ASP 72 H ASP 72 7.138 14.124 -1.411 33 HA ASP 72 HA ASP 72 9.311 13.775 0.099 34 HB2 ASP 72 HB2 ASP 72 8.103 16.140 -1.164 35 HB3 ASP 72 HB3 ASP 72 9.246 16.514 0.124 36 H ASP 73 H ASP 73 10.157 14.460 2.079 37 HA ASP 73 HA ASP 73 8.629 14.194 4.323 38 HB2 ASP 73 HB2 ASP 73 11.289 15.246 3.729 39 HB3 ASP 73 HB3 ASP 73 10.570 15.980 5.160 40 H LYS 74 H LYS 74 8.824 16.937 2.255 41 HA LYS 74 HA LYS 74 7.739 18.793 4.190 42 HB2 LYS 74 HB2 LYS 74 7.715 20.385 2.316 43 HB3 LYS 74 HB3 LYS 74 9.285 19.613 2.494 44 HG2 LYS 74 HG2 LYS 74 9.157 19.248 0.302 45 HG3 LYS 74 HG3 LYS 74 8.022 17.962 0.715 46 HD2 LYS 74 HD2 LYS 74 6.223 19.793 0.618 47 HD3 LYS 74 HD3 LYS 74 7.443 20.755 -0.222 48 HE2 LYS 74 HE2 LYS 74 6.182 19.705 -1.914 49 HE3 LYS 74 HE3 LYS 74 7.689 18.797 -1.811 50 HZ1 LYS 74 HZ1 LYS 74 5.116 18.004 -0.558 51 HZ2 LYS 74 HZ2 LYS 74 6.561 17.127 -0.491 52 HZ3 LYS 74 HZ3 LYS 74 5.766 17.336 -1.970 53 H ILE 75 H ILE 75 6.362 16.258 2.927 54 HA ILE 75 HA ILE 75 4.133 16.978 1.475 55 HB ILE 75 HB ILE 75 4.636 14.655 1.872 56 HG12 ILE 75 HG12 ILE 75 2.414 13.816 2.385 57 HG13 ILE 75 HG13 ILE 75 1.997 15.323 3.195 58 HG21 ILE 75 HG21 ILE 75 5.510 14.972 4.177 59 HG22 ILE 75 HG22 ILE 75 3.846 15.081 4.749 60 HG23 ILE 75 HG23 ILE 75 4.429 13.588 4.011 61 HD11 ILE 75 HD11 ILE 75 1.515 16.360 1.273 62 HD12 ILE 75 HD12 ILE 75 2.867 15.622 0.414 63 HD13 ILE 75 HD13 ILE 75 1.368 14.721 0.638 64 H GLY 76 H GLY 76 4.628 17.134 4.972 65 HA2 GLY 76 HA2 GLY 76 1.989 17.783 5.700 66 HA3 GLY 76 HA3 GLY 76 3.428 18.161 6.636 67 H LEU 77 H LEU 77 4.770 19.915 5.070 68 HA LEU 77 HA LEU 77 3.466 22.336 5.550 69 HB2 LEU 77 HB2 LEU 77 5.993 21.583 4.850 70 HB3 LEU 77 HB3 LEU 77 5.439 22.389 3.384 71 HG LEU 77 HG LEU 77 4.874 24.379 4.820 72 HD11 LEU 77 HD11 LEU 77 6.446 24.275 6.959 73 HD12 LEU 77 HD12 LEU 77 6.025 22.566 6.861 74 HD13 LEU 77 HD13 LEU 77 4.754 23.779 7.006 75 HD21 LEU 77 HD21 LEU 77 7.507 24.712 5.277 76 HD22 LEU 77 HD22 LEU 77 6.761 24.868 3.687 77 HD23 LEU 77 HD23 LEU 77 7.556 23.360 4.145 78 H LYS 78 H LYS 78 3.997 20.647 2.459 79 HA LYS 78 HA LYS 78 2.666 22.447 0.804 80 HB2 LYS 78 HB2 LYS 78 3.608 19.693 0.631 81 HB3 LYS 78 HB3 LYS 78 2.151 19.961 -0.317 82 HG2 LYS 78 HG2 LYS 78 3.753 22.145 -0.903 83 HG3 LYS 78 HG3 LYS 78 4.871 20.781 -0.837 84 HD2 LYS 78 HD2 LYS 78 2.309 20.794 -2.426 85 HD3 LYS 78 HD3 LYS 78 3.892 21.197 -3.095 86 HE2 LYS 78 HE2 LYS 78 4.637 19.036 -2.989 87 HE3 LYS 78 HE3 LYS 78 3.603 18.632 -1.620 88 HZ1 LYS 78 HZ1 LYS 78 1.723 18.959 -3.356 89 HZ2 LYS 78 HZ2 LYS 78 2.591 17.508 -3.325 90 HZ3 LYS 78 HZ3 LYS 78 2.951 18.685 -4.486 91 H VAL 79 H VAL 79 1.403 19.618 2.538 92 HA VAL 79 HA VAL 79 -1.216 19.698 1.580 93 HB VAL 79 HB VAL 79 -0.095 18.728 4.202 94 HG11 VAL 79 HG11 VAL 79 -2.345 19.320 4.710 95 HG12 VAL 79 HG12 VAL 79 -2.937 18.606 3.208 96 HG13 VAL 79 HG13 VAL 79 -2.302 17.571 4.490 97 HG21 VAL 79 HG21 VAL 79 -0.085 17.676 1.623 98 HG22 VAL 79 HG22 VAL 79 0.298 16.822 3.119 99 HG23 VAL 79 HG23 VAL 79 -1.344 16.780 2.475 100 H LEU 80 H LEU 80 0.124 21.147 4.547 101 HA LEU 80 HA LEU 80 -2.187 22.347 5.496 102 HB2 LEU 80 HB2 LEU 80 0.703 22.737 5.848 103 HB3 LEU 80 HB3 LEU 80 -0.284 24.152 6.208 104 HG LEU 80 HG LEU 80 -1.502 22.925 7.895 105 HD11 LEU 80 HD11 LEU 80 -0.915 20.628 8.479 106 HD12 LEU 80 HD12 LEU 80 0.216 20.568 7.128 107 HD13 LEU 80 HD13 LEU 80 -1.513 20.735 6.824 108 HD21 LEU 80 HD21 LEU 80 0.398 22.392 9.442 109 HD22 LEU 80 HD22 LEU 80 0.474 23.987 8.691 110 HD23 LEU 80 HD23 LEU 80 1.493 22.679 8.089 111 H PHE 81 H PHE 81 0.320 23.808 3.424 112 HA PHE 81 HA PHE 81 -0.804 26.296 3.058 113 HB2 PHE 81 HB2 PHE 81 1.393 25.860 2.214 114 HB3 PHE 81 HB3 PHE 81 0.797 24.593 1.146 115 HD1 PHE 81 HD2 PHE 81 -0.425 25.158 -0.892 116 HD2 PHE 81 HD1 PHE 81 1.222 28.170 1.624 117 HE1 PHE 81 HE2 PHE 81 -0.672 26.803 -2.705 118 HE2 PHE 81 HE1 PHE 81 0.976 29.821 -0.184 119 HZ PHE 81 HZ PHE 81 0.029 29.138 -2.353 120 H LYS 82 H LYS 82 -1.256 23.455 0.950 121 HA LYS 82 HA LYS 82 -3.153 24.610 -0.751 122 HB2 LYS 82 HB2 LYS 82 -1.979 22.534 -1.293 123 HB3 LYS 82 HB3 LYS 82 -2.803 21.708 0.022 124 HG2 LYS 82 HG2 LYS 82 -4.871 22.755 -1.471 125 HG3 LYS 82 HG3 LYS 82 -3.692 22.251 -2.685 126 HD2 LYS 82 HD2 LYS 82 -4.172 20.342 -0.488 127 HD3 LYS 82 HD3 LYS 82 -5.525 20.600 -1.591 128 HE2 LYS 82 HE2 LYS 82 -4.344 18.828 -2.548 129 HE3 LYS 82 HE3 LYS 82 -3.815 20.237 -3.465 130 HZ1 LYS 82 HZ1 LYS 82 -1.814 19.304 -3.005 131 HZ2 LYS 82 HZ2 LYS 82 -2.328 18.597 -1.557 132 HZ3 LYS 82 HZ3 LYS 82 -1.967 20.248 -1.610 133 H LEU 83 H LEU 83 -3.565 22.740 2.231 134 HA LEU 83 HA LEU 83 -6.331 22.503 2.227 135 HB2 LEU 83 HB2 LEU 83 -4.451 21.636 3.863 136 HB3 LEU 83 HB3 LEU 83 -4.926 23.057 4.790 137 HG LEU 83 HG LEU 83 -6.648 20.695 4.055 138 HD11 LEU 83 HD11 LEU 83 -6.847 20.924 6.699 139 HD12 LEU 83 HD12 LEU 83 -5.239 21.615 6.489 140 HD13 LEU 83 HD13 LEU 83 -5.576 19.981 5.920 141 HD21 LEU 83 HD21 LEU 83 -8.052 22.602 3.857 142 HD22 LEU 83 HD22 LEU 83 -7.376 23.333 5.313 143 HD23 LEU 83 HD23 LEU 83 -8.378 21.886 5.435 144 H MET 84 H MET 84 -4.293 25.169 3.329 145 HA MET 84 HA MET 84 -6.424 26.713 4.410 146 HB2 MET 84 HB2 MET 84 -3.772 27.755 3.419 147 HB3 MET 84 HB3 MET 84 -4.824 28.482 4.626 148 HG2 MET 84 HG2 MET 84 -4.218 25.883 5.526 149 HG3 MET 84 HG3 MET 84 -2.709 26.606 4.974 150 HE1 MET 84 HE1 MET 84 -1.907 26.687 8.114 151 HE2 MET 84 HE2 MET 84 -1.358 27.085 6.486 152 HE3 MET 84 HE3 MET 84 -1.470 28.349 7.713 153 H ASP 85 H ASP 85 -5.507 26.001 1.249 154 HA ASP 85 HA ASP 85 -6.703 28.458 0.179 155 HB2 ASP 85 HB2 ASP 85 -4.727 26.500 -0.831 156 HB3 ASP 85 HB3 ASP 85 -5.849 27.146 -2.025 157 H VAL 86 H VAL 86 -8.829 27.678 0.893 158 HA VAL 86 HA VAL 86 -10.031 25.338 -0.082 159 HB VAL 86 HB VAL 86 -11.451 27.924 0.557 160 HG11 VAL 86 HG11 VAL 86 -12.295 25.132 0.078 161 HG12 VAL 86 HG12 VAL 86 -13.097 25.989 1.395 162 HG13 VAL 86 HG13 VAL 86 -13.141 26.645 -0.241 163 HG21 VAL 86 HG21 VAL 86 -10.044 27.427 2.422 164 HG22 VAL 86 HG22 VAL 86 -11.686 26.941 2.847 165 HG23 VAL 86 HG23 VAL 86 -10.498 25.723 2.381 166 H ASP 87 H ASP 87 -9.120 28.160 -1.706 167 HA ASP 87 HA ASP 87 -11.159 28.090 -3.738 168 HB2 ASP 87 HB2 ASP 87 -9.565 29.721 -4.895 169 HB3 ASP 87 HB3 ASP 87 -10.243 30.231 -3.350 170 H GLY 88 H GLY 88 -8.617 26.109 -3.069 171 HA2 GLY 88 HA2 GLY 88 -7.312 24.661 -4.301 172 HA3 GLY 88 HA3 GLY 88 -8.778 24.492 -5.256 173 H ASP 89 H ASP 89 -6.563 27.247 -4.894 174 HA ASP 89 HA ASP 89 -6.419 27.449 -7.800 175 HB2 ASP 89 HB2 ASP 89 -5.160 29.603 -7.226 176 HB3 ASP 89 HB3 ASP 89 -6.867 29.536 -6.799 177 H GLY 90 H GLY 90 -4.543 26.364 -5.138 178 HA2 GLY 90 HA2 GLY 90 -2.554 25.169 -5.196 179 HA3 GLY 90 HA3 GLY 90 -2.438 25.507 -6.917 180 H LYS 91 H LYS 91 -2.993 28.425 -5.638 181 HA LYS 91 HA LYS 91 -0.211 28.957 -4.884 182 HB2 LYS 91 HB2 LYS 91 -0.478 31.112 -6.325 183 HB3 LYS 91 HB3 LYS 91 -0.035 29.598 -7.103 184 HG2 LYS 91 HG2 LYS 91 -1.890 29.567 -8.334 185 HG3 LYS 91 HG3 LYS 91 -2.913 29.987 -6.959 186 HD2 LYS 91 HD2 LYS 91 -2.514 32.303 -7.251 187 HD3 LYS 91 HD3 LYS 91 -1.190 32.006 -8.378 188 HE2 LYS 91 HE2 LYS 91 -2.774 31.081 -9.995 189 HE3 LYS 91 HE3 LYS 91 -4.098 31.365 -8.866 190 HZ1 LYS 91 HZ1 LYS 91 -4.237 33.467 -9.512 191 HZ2 LYS 91 HZ2 LYS 91 -3.155 33.110 -10.762 192 HZ3 LYS 91 HZ3 LYS 91 -2.580 33.731 -9.298 193 H LEU 92 H LEU 92 0.093 30.959 -3.738 194 HA LEU 92 HA LEU 92 -2.371 31.858 -2.399 195 HB2 LEU 92 HB2 LEU 92 -1.231 31.185 -0.595 196 HB3 LEU 92 HB3 LEU 92 0.309 31.185 -1.452 197 HG LEU 92 HG LEU 92 -0.893 33.782 -0.594 198 HD11 LEU 92 HD11 LEU 92 0.938 32.959 1.382 199 HD12 LEU 92 HD12 LEU 92 -0.236 31.657 1.195 200 HD13 LEU 92 HD13 LEU 92 -0.785 33.293 1.562 201 HD21 LEU 92 HD21 LEU 92 1.141 34.611 -1.048 202 HD22 LEU 92 HD22 LEU 92 1.360 33.125 -1.972 203 HD23 LEU 92 HD23 LEU 92 1.973 33.236 -0.321 204 H THR 93 H THR 93 -2.833 34.008 -2.238 205 HA THR 93 HA THR 93 -1.292 35.781 -3.971 206 HB THR 93 HB THR 93 -3.657 35.800 -4.392 207 HG1 THR 93 HG1 THR 93 -4.074 38.104 -3.684 208 HG21 THR 93 HG21 THR 93 -4.900 36.951 -2.215 209 HG22 THR 93 HG22 THR 93 -3.819 35.765 -1.483 210 HG23 THR 93 HG23 THR 93 -5.003 35.255 -2.687 211 H LYS 94 H LYS 94 -0.731 37.934 -3.292 212 HA LYS 94 HA LYS 94 0.805 38.177 -1.088 213 HB2 LYS 94 HB2 LYS 94 0.306 39.867 -3.012 214 HB3 LYS 94 HB3 LYS 94 -0.876 40.530 -1.889 215 HG2 LYS 94 HG2 LYS 94 1.241 40.449 -0.265 216 HG3 LYS 94 HG3 LYS 94 2.077 40.615 -1.812 217 HD2 LYS 94 HD2 LYS 94 -0.119 42.429 -0.811 218 HD3 LYS 94 HD3 LYS 94 1.607 42.793 -0.758 219 HE2 LYS 94 HE2 LYS 94 1.173 43.810 -2.724 220 HE3 LYS 94 HE3 LYS 94 1.339 42.176 -3.362 221 HZ1 LYS 94 HZ1 LYS 94 -1.265 43.290 -2.496 222 HZ2 LYS 94 HZ2 LYS 94 -0.983 41.908 -3.430 223 HZ3 LYS 94 HZ3 LYS 94 -0.692 43.443 -4.081 224 H GLU 95 H GLU 95 -2.580 39.306 -1.203 225 HA GLU 95 HA GLU 95 -2.862 40.048 1.437 226 HB2 GLU 95 HB2 GLU 95 -4.955 38.729 -0.303 227 HB3 GLU 95 HB3 GLU 95 -5.271 39.669 1.149 228 HG2 GLU 95 HG2 GLU 95 -3.712 40.985 -0.993 229 HG3 GLU 95 HG3 GLU 95 -5.423 40.693 -1.300 230 H GLU 96 H GLU 96 -3.193 36.832 0.007 231 HA GLU 96 HA GLU 96 -4.072 35.545 2.378 232 HB2 GLU 96 HB2 GLU 96 -4.396 34.607 0.112 233 HB3 GLU 96 HB3 GLU 96 -2.661 34.355 -0.016 234 HG2 GLU 96 HG2 GLU 96 -2.673 32.694 1.651 235 HG3 GLU 96 HG3 GLU 96 -4.305 33.116 2.166 236 H VAL 97 H VAL 97 -0.905 36.153 0.967 237 HA VAL 97 HA VAL 97 0.622 34.482 2.623 238 HB VAL 97 HB VAL 97 1.186 36.195 0.551 239 HG11 VAL 97 HG11 VAL 97 1.278 38.074 2.176 240 HG12 VAL 97 HG12 VAL 97 2.624 37.261 2.976 241 HG13 VAL 97 HG13 VAL 97 2.790 37.811 1.308 242 HG21 VAL 97 HG21 VAL 97 2.425 34.132 1.967 243 HG22 VAL 97 HG22 VAL 97 2.929 34.817 0.422 244 HG23 VAL 97 HG23 VAL 97 3.605 35.443 1.925 245 H THR 98 H THR 98 -0.676 37.699 3.118 246 HA THR 98 HA THR 98 0.844 38.249 5.481 247 HB THR 98 HB THR 98 -1.667 39.547 4.409 248 HG1 THR 98 HG1 THR 98 0.638 39.654 3.397 249 HG21 THR 98 HG21 THR 98 -1.019 41.424 5.942 250 HG22 THR 98 HG22 THR 98 0.139 40.329 6.695 251 HG23 THR 98 HG23 THR 98 -1.585 39.971 6.764 252 H SER 99 H SER 99 -2.427 37.071 4.819 253 HA SER 99 HA SER 99 -3.236 37.004 7.548 254 HB2 SER 99 HB2 SER 99 -4.406 36.423 4.982 255 HB3 SER 99 HB3 SER 99 -4.756 35.110 6.105 256 HG SER 99 HG SER 99 -5.240 37.091 7.561 257 H PHE 100 H PHE 100 -1.983 34.571 5.298 258 HA PHE 100 HA PHE 100 -2.196 32.367 7.040 259 HB2 PHE 100 HB2 PHE 100 -0.523 32.927 4.604 260 HB3 PHE 100 HB3 PHE 100 -0.331 31.430 5.511 261 HD1 PHE 100 HD2 PHE 100 -3.659 32.681 5.611 262 HD2 PHE 100 HD1 PHE 100 -0.932 30.434 3.236 263 HE1 PHE 100 HE2 PHE 100 -5.547 31.697 4.378 264 HE2 PHE 100 HE1 PHE 100 -2.817 29.448 2.000 265 HZ PHE 100 HZ PHE 100 -5.128 30.078 2.571 266 H PHE 101 H PHE 101 0.485 34.587 6.363 267 HA PHE 101 HA PHE 101 2.250 33.315 8.232 268 HB2 PHE 101 HB2 PHE 101 2.730 34.864 6.113 269 HB3 PHE 101 HB3 PHE 101 2.728 36.119 7.347 270 HD1 PHE 101 HD2 PHE 101 4.348 35.985 9.231 271 HD2 PHE 101 HD1 PHE 101 4.541 33.376 5.875 272 HE1 PHE 101 HE2 PHE 101 6.672 35.422 9.808 273 HE2 PHE 101 HE1 PHE 101 6.867 32.808 6.446 274 HZ PHE 101 HZ PHE 101 7.936 33.832 8.414 275 H LYS 102 H LYS 102 -0.156 35.785 8.381 276 HA LYS 102 HA LYS 102 0.636 37.323 10.531 277 HB2 LYS 102 HB2 LYS 102 -1.853 36.710 9.184 278 HB3 LYS 102 HB3 LYS 102 -2.107 36.919 10.912 279 HG2 LYS 102 HG2 LYS 102 -0.389 38.972 9.793 280 HG3 LYS 102 HG3 LYS 102 -1.976 38.919 9.023 281 HD2 LYS 102 HD2 LYS 102 -1.589 38.966 12.010 282 HD3 LYS 102 HD3 LYS 102 -1.787 40.426 11.037 283 HE2 LYS 102 HE2 LYS 102 -3.973 39.812 10.389 284 HE3 LYS 102 HE3 LYS 102 -3.763 38.161 10.970 285 HZ1 LYS 102 HZ1 LYS 102 -3.322 39.677 13.179 286 HZ2 LYS 102 HZ2 LYS 102 -4.765 38.877 12.808 287 HZ3 LYS 102 HZ3 LYS 102 -4.575 40.507 12.403 288 H LYS 103 H LYS 103 -0.481 34.033 10.485 289 HA LYS 103 HA LYS 103 -1.304 33.684 13.114 290 HB2 LYS 103 HB2 LYS 103 0.059 31.814 11.183 291 HB3 LYS 103 HB3 LYS 103 -0.465 31.291 12.778 292 HG2 LYS 103 HG2 LYS 103 -2.302 32.519 10.737 293 HG3 LYS 103 HG3 LYS 103 -2.057 30.781 10.926 294 HD2 LYS 103 HD2 LYS 103 -3.003 32.624 13.120 295 HD3 LYS 103 HD3 LYS 103 -4.068 31.644 12.108 296 HE2 LYS 103 HE2 LYS 103 -1.933 30.656 13.996 297 HE3 LYS 103 HE3 LYS 103 -3.678 30.504 14.197 298 HZ1 LYS 103 HZ1 LYS 103 -2.813 28.441 13.406 299 HZ2 LYS 103 HZ2 LYS 103 -2.004 29.193 12.126 300 HZ3 LYS 103 HZ3 LYS 103 -3.695 29.146 12.146 301 H HIS 104 H HIS 104 1.866 34.179 11.833 302 HA HIS 104 HA HIS 104 3.189 33.260 14.254 303 HB2 HIS 104 HB2 HIS 104 3.984 33.292 11.650 304 HB3 HIS 104 HB3 HIS 104 4.761 34.754 12.254 305 HD1 HIS 104 HD1 HIS 104 6.498 32.415 11.383 306 HD2 HIS 104 HD2 HIS 104 5.156 32.945 15.280 307 HE1 HIS 104 HE1 HIS 104 8.112 31.139 12.829 308 H GLY 105 H GLY 105 2.013 36.190 12.859 309 HA2 GLY 105 HA2 GLY 105 1.665 38.173 14.085 310 HA3 GLY 105 HA3 GLY 105 2.873 37.640 15.245 311 H ILE 106 H ILE 106 4.269 37.052 12.377 312 HA ILE 106 HA ILE 106 5.763 39.560 12.477 313 HB ILE 106 HB ILE 106 6.384 37.067 10.893 314 HG12 ILE 106 HG12 ILE 106 8.204 37.485 13.041 315 HG13 ILE 106 HG13 ILE 106 6.575 37.558 13.702 316 HG21 ILE 106 HG21 ILE 106 7.731 38.545 9.857 317 HG22 ILE 106 HG22 ILE 106 7.660 39.703 11.186 318 HG23 ILE 106 HG23 ILE 106 8.743 38.314 11.283 319 HD11 ILE 106 HD11 ILE 106 8.103 35.283 12.950 320 HD12 ILE 106 HD12 ILE 106 6.511 35.353 13.704 321 HD13 ILE 106 HD13 ILE 106 6.654 35.357 11.947 322 H GLU 107 H GLU 107 5.689 41.075 10.931 323 HA GLU 107 HA GLU 107 3.898 40.611 8.663 324 HB2 GLU 107 HB2 GLU 107 5.086 43.194 9.691 325 HB3 GLU 107 HB3 GLU 107 3.889 43.049 8.413 326 HG2 GLU 107 HG2 GLU 107 3.566 42.559 11.347 327 HG3 GLU 107 HG3 GLU 107 2.671 43.661 10.302 328 H LYS 108 H LYS 108 7.155 40.541 9.355 329 HA LYS 108 HA LYS 108 8.392 41.806 7.216 330 HB2 LYS 108 HB2 LYS 108 9.679 40.909 9.055 331 HB3 LYS 108 HB3 LYS 108 9.165 39.271 8.669 332 HG2 LYS 108 HG2 LYS 108 10.793 39.014 7.179 333 HG3 LYS 108 HG3 LYS 108 10.442 40.565 6.412 334 HD2 LYS 108 HD2 LYS 108 11.808 40.561 9.059 335 HD3 LYS 108 HD3 LYS 108 12.742 40.119 7.628 336 HE2 LYS 108 HE2 LYS 108 13.026 42.451 7.916 337 HE3 LYS 108 HE3 LYS 108 11.904 42.250 6.571 338 HZ1 LYS 108 HZ1 LYS 108 10.075 42.750 8.014 339 HZ2 LYS 108 HZ2 LYS 108 11.222 43.984 8.157 340 HZ3 LYS 108 HZ3 LYS 108 11.086 42.812 9.369 341 H VAL 109 H VAL 109 6.508 38.912 7.284 342 HA VAL 109 HA VAL 109 7.410 37.491 5.106 343 HB VAL 109 HB VAL 109 5.538 36.807 6.615 344 HG11 VAL 109 HG11 VAL 109 3.930 38.677 4.879 345 HG12 VAL 109 HG12 VAL 109 3.261 37.534 6.045 346 HG13 VAL 109 HG13 VAL 109 4.265 38.876 6.599 347 HG21 VAL 109 HG21 VAL 109 4.963 36.669 3.657 348 HG22 VAL 109 HG22 VAL 109 6.020 35.583 4.559 349 HG23 VAL 109 HG23 VAL 109 4.288 35.603 4.888 350 H ALA 110 H ALA 110 5.670 40.509 5.172 351 HA ALA 110 HA ALA 110 4.808 40.527 2.474 352 HB1 ALA 110 HB1 ALA 110 3.813 42.423 3.074 353 HB2 ALA 110 HB2 ALA 110 4.482 42.171 4.687 354 HB3 ALA 110 HB3 ALA 110 5.348 43.169 3.519 355 H GLU 111 H GLU 111 7.673 41.875 4.085 356 HA GLU 111 HA GLU 111 8.774 42.958 1.683 357 HB2 GLU 111 HB2 GLU 111 9.245 43.664 4.115 358 HB3 GLU 111 HB3 GLU 111 10.355 42.301 4.156 359 HG2 GLU 111 HG2 GLU 111 11.443 44.463 3.657 360 HG3 GLU 111 HG3 GLU 111 11.684 43.242 2.408 361 H GLN 112 H GLN 112 9.070 39.925 3.406 362 HA GLN 112 HA GLN 112 11.332 38.983 1.937 363 HB2 GLN 112 HB2 GLN 112 9.324 37.262 3.382 364 HB3 GLN 112 HB3 GLN 112 11.020 36.918 3.070 365 HG2 GLN 112 HG2 GLN 112 11.001 39.299 4.528 366 HG3 GLN 112 HG3 GLN 112 9.805 38.258 5.298 367 HE21 GLN 112 HE21 GLN 112 10.583 35.951 5.615 368 HE22 GLN 112 HE22 GLN 112 12.193 35.763 6.211 369 H VAL 113 H VAL 113 7.834 38.450 1.730 370 HA VAL 113 HA VAL 113 7.949 36.593 -0.408 371 HB VAL 113 HB VAL 113 5.987 36.977 1.151 372 HG11 VAL 113 HG11 VAL 113 4.349 38.667 0.479 373 HG12 VAL 113 HG12 VAL 113 5.877 39.407 0.960 374 HG13 VAL 113 HG13 VAL 113 5.465 39.261 -0.749 375 HG21 VAL 113 HG21 VAL 113 4.364 36.312 -0.493 376 HG22 VAL 113 HG22 VAL 113 5.338 36.997 -1.794 377 HG23 VAL 113 HG23 VAL 113 5.916 35.586 -0.908 378 H MET 114 H MET 114 7.873 40.085 -0.248 379 HA MET 114 HA MET 114 7.310 40.440 -3.046 380 HB2 MET 114 HB2 MET 114 7.834 42.189 -0.717 381 HB3 MET 114 HB3 MET 114 8.292 42.839 -2.285 382 HG2 MET 114 HG2 MET 114 5.655 41.645 -2.334 383 HG3 MET 114 HG3 MET 114 5.788 42.921 -1.126 384 HE1 MET 114 HE1 MET 114 4.880 43.251 -5.344 385 HE2 MET 114 HE2 MET 114 4.620 42.026 -4.103 386 HE3 MET 114 HE3 MET 114 3.774 43.572 -4.009 387 H LYS 115 H LYS 115 10.169 40.433 -0.990 388 HA LYS 115 HA LYS 115 11.934 41.215 -3.129 389 HB2 LYS 115 HB2 LYS 115 12.428 40.233 -0.317 390 HB3 LYS 115 HB3 LYS 115 13.724 40.639 -1.435 391 HG2 LYS 115 HG2 LYS 115 11.568 42.553 -0.572 392 HG3 LYS 115 HG3 LYS 115 13.168 42.446 0.166 393 HD2 LYS 115 HD2 LYS 115 12.629 43.051 -2.742 394 HD3 LYS 115 HD3 LYS 115 13.010 44.254 -1.508 395 HE2 LYS 115 HE2 LYS 115 15.153 43.044 -1.096 396 HE3 LYS 115 HE3 LYS 115 14.775 42.008 -2.472 397 HZ1 LYS 115 HZ1 LYS 115 15.199 44.945 -2.532 398 HZ2 LYS 115 HZ2 LYS 115 14.695 44.027 -3.859 399 HZ3 LYS 115 HZ3 LYS 115 16.220 43.760 -3.179 400 H ALA 116 H ALA 116 10.610 38.287 -1.927 401 HA ALA 116 HA ALA 116 12.675 36.632 -3.149 402 HB1 ALA 116 HB1 ALA 116 11.723 36.024 -0.945 403 HB2 ALA 116 HB2 ALA 116 10.162 35.770 -1.726 404 HB3 ALA 116 HB3 ALA 116 11.538 34.757 -2.158 405 H ASP 117 H ASP 117 10.057 38.271 -4.236 406 HA ASP 117 HA ASP 117 9.078 36.208 -6.048 407 HB2 ASP 117 HB2 ASP 117 7.794 38.257 -4.801 408 HB3 ASP 117 HB3 ASP 117 8.114 38.979 -6.376 409 H ALA 118 H ALA 118 11.037 35.947 -7.248 410 HA ALA 118 HA ALA 118 12.173 38.139 -8.703 411 HB1 ALA 118 HB1 ALA 118 13.307 36.145 -9.944 412 HB2 ALA 118 HB2 ALA 118 13.745 36.512 -8.275 413 HB3 ALA 118 HB3 ALA 118 12.629 35.191 -8.624 414 H ASN 119 H ASN 119 9.526 36.039 -9.191 415 HA ASN 119 HA ASN 119 9.495 36.523 -12.081 416 HB2 ASN 119 HB2 ASN 119 7.416 34.954 -11.867 417 HB3 ASN 119 HB3 ASN 119 9.036 34.271 -11.748 418 HD21 ASN 119 HD21 ASN 119 8.357 32.518 -10.550 419 HD22 ASN 119 HD22 ASN 119 7.862 32.654 -8.900 420 H GLY 120 H GLY 120 8.445 38.012 -9.347 421 HA2 GLY 120 HA2 GLY 120 6.777 39.520 -8.857 422 HA3 GLY 120 HA3 GLY 120 6.929 39.958 -10.551 423 H ASP 121 H ASP 121 5.907 36.770 -9.589 424 HA ASP 121 HA ASP 121 3.533 36.925 -11.124 425 HB2 ASP 121 HB2 ASP 121 3.005 34.724 -9.911 426 HB3 ASP 121 HB3 ASP 121 4.457 34.772 -10.906 427 H GLY 122 H GLY 122 4.279 37.777 -7.881 428 HA2 GLY 122 HA2 GLY 122 2.975 38.892 -6.333 429 HA3 GLY 122 HA3 GLY 122 1.639 38.825 -7.473 430 H TYR 123 H TYR 123 2.823 35.755 -7.150 431 HA TYR 123 HA TYR 123 1.354 35.082 -4.734 432 HB2 TYR 123 HB2 TYR 123 0.004 33.352 -5.947 433 HB3 TYR 123 HB3 TYR 123 -0.436 35.012 -6.333 434 HD1 TYR 123 HD1 TYR 123 1.716 32.227 -7.576 435 HD2 TYR 123 HD2 TYR 123 -0.626 35.642 -8.557 436 HE1 TYR 123 HE1 TYR 123 2.025 31.745 -9.969 437 HE2 TYR 123 HE2 TYR 123 -0.324 35.169 -10.952 438 HH TYR 123 HH TYR 123 1.957 33.314 -12.185 439 H ILE 124 H ILE 124 1.613 32.793 -4.140 440 HA ILE 124 HA ILE 124 4.052 31.618 -5.304 441 HB ILE 124 HB ILE 124 4.956 31.128 -3.250 442 HG12 ILE 124 HG12 ILE 124 2.158 31.341 -2.128 443 HG13 ILE 124 HG13 ILE 124 3.138 29.889 -2.292 444 HG21 ILE 124 HG21 ILE 124 4.358 33.690 -3.669 445 HG22 ILE 124 HG22 ILE 124 3.482 33.453 -2.157 446 HG23 ILE 124 HG23 ILE 124 5.217 33.140 -2.230 447 HD11 ILE 124 HD11 ILE 124 3.662 32.196 -0.436 448 HD12 ILE 124 HD12 ILE 124 3.074 30.593 0.008 449 HD13 ILE 124 HD13 ILE 124 4.706 30.788 -0.631 450 H THR 125 H THR 125 3.807 29.626 -6.059 451 HA THR 125 HA THR 125 1.335 28.192 -5.549 452 HB THR 125 HB THR 125 2.228 28.342 -7.853 453 HG1 THR 125 HG1 THR 125 1.854 26.154 -8.313 454 HG21 THR 125 HG21 THR 125 4.400 26.475 -6.907 455 HG22 THR 125 HG22 THR 125 4.639 28.202 -7.172 456 HG23 THR 125 HG23 THR 125 4.195 27.155 -8.521 457 H LEU 126 H LEU 126 1.847 25.614 -5.607 458 HA LEU 126 HA LEU 126 2.599 24.911 -3.050 459 HB2 LEU 126 HB2 LEU 126 2.946 23.107 -5.429 460 HB3 LEU 126 HB3 LEU 126 2.586 22.649 -3.766 461 HG LEU 126 HG LEU 126 0.522 24.368 -4.805 462 HD11 LEU 126 HD11 LEU 126 0.511 21.795 -6.266 463 HD12 LEU 126 HD12 LEU 126 1.562 23.068 -6.885 464 HD13 LEU 126 HD13 LEU 126 -0.168 23.359 -6.714 465 HD21 LEU 126 HD21 LEU 126 -0.767 22.989 -3.598 466 HD22 LEU 126 HD22 LEU 126 0.763 22.360 -2.984 467 HD23 LEU 126 HD23 LEU 126 -0.058 21.539 -4.312 468 H GLU 127 H GLU 127 4.572 24.748 -6.006 469 HA GLU 127 HA GLU 127 6.899 23.756 -4.779 470 HB2 GLU 127 HB2 GLU 127 6.262 25.099 -7.355 471 HB3 GLU 127 HB3 GLU 127 7.948 25.068 -6.858 472 HG2 GLU 127 HG2 GLU 127 7.615 22.554 -6.537 473 HG3 GLU 127 HG3 GLU 127 6.134 22.766 -7.469 474 H GLU 128 H GLU 128 6.040 27.092 -5.696 475 HA GLU 128 HA GLU 128 8.301 28.369 -4.728 476 HB2 GLU 128 HB2 GLU 128 6.497 29.421 -6.097 477 HB3 GLU 128 HB3 GLU 128 5.484 29.462 -4.659 478 HG2 GLU 128 HG2 GLU 128 6.921 31.005 -3.582 479 HG3 GLU 128 HG3 GLU 128 8.171 30.797 -4.806 480 H PHE 129 H PHE 129 5.275 27.620 -3.029 481 HA PHE 129 HA PHE 129 5.879 28.837 -0.594 482 HB2 PHE 129 HB2 PHE 129 3.641 28.102 -0.989 483 HB3 PHE 129 HB3 PHE 129 4.164 26.441 -1.249 484 HD1 PHE 129 HD2 PHE 129 3.802 29.085 1.309 485 HD2 PHE 129 HD1 PHE 129 4.359 24.935 0.541 486 HE1 PHE 129 HE2 PHE 129 3.408 28.595 3.688 487 HE2 PHE 129 HE1 PHE 129 3.965 24.439 2.919 488 HZ PHE 129 HZ PHE 129 3.490 26.270 4.496 489 H LEU 130 H LEU 130 6.640 25.601 -1.789 490 HA LEU 130 HA LEU 130 7.740 24.617 0.625 491 HB2 LEU 130 HB2 LEU 130 7.178 22.956 -0.873 492 HB3 LEU 130 HB3 LEU 130 7.871 23.816 -2.245 493 HG LEU 130 HG LEU 130 10.125 23.257 -1.438 494 HD11 LEU 130 HD11 LEU 130 10.379 22.741 0.707 495 HD12 LEU 130 HD12 LEU 130 9.675 21.168 0.340 496 HD13 LEU 130 HD13 LEU 130 8.648 22.479 0.917 497 HD21 LEU 130 HD21 LEU 130 9.518 21.729 -3.021 498 HD22 LEU 130 HD22 LEU 130 8.112 21.176 -2.111 499 HD23 LEU 130 HD23 LEU 130 9.730 20.654 -1.639 500 H GLU 131 H GLU 131 8.973 26.669 -1.871 501 HA GLU 131 HA GLU 131 11.743 26.289 -1.116 502 HB2 GLU 131 HB2 GLU 131 10.794 26.861 -3.473 503 HB3 GLU 131 HB3 GLU 131 10.754 28.512 -2.871 504 HG2 GLU 131 HG2 GLU 131 13.247 27.973 -2.216 505 HG3 GLU 131 HG3 GLU 131 13.077 26.775 -3.500 506 H PHE 132 H PHE 132 9.115 28.227 -0.146 507 HA PHE 132 HA PHE 132 10.924 30.130 1.188 508 HB2 PHE 132 HB2 PHE 132 8.810 30.712 -0.430 509 HB3 PHE 132 HB3 PHE 132 8.040 30.743 1.153 510 HD1 PHE 132 HD2 PHE 132 11.417 31.811 -0.013 511 HD2 PHE 132 HD1 PHE 132 7.722 32.929 1.779 512 HE1 PHE 132 HE2 PHE 132 12.290 34.080 0.362 513 HE2 PHE 132 HE1 PHE 132 8.588 35.202 2.156 514 HZ PHE 132 HZ PHE 132 10.876 35.780 1.448 515 H SER 133 H SER 133 11.207 28.235 2.704 516 HA SER 133 HA SER 133 9.540 28.667 5.013 517 HB2 SER 133 HB2 SER 133 9.130 26.345 3.294 518 HB3 SER 133 HB3 SER 133 9.507 25.893 4.956 519 HG SER 133 HG SER 133 7.651 26.677 5.596 520 H LEU 134 H LEU 134 11.422 29.329 6.025 521 HA LEU 134 HA LEU 134 12.885 27.445 7.438 522 HB2 LEU 134 HB2 LEU 134 13.773 27.593 4.801 523 HB3 LEU 134 HB3 LEU 134 14.943 28.532 5.725 524 HG LEU 134 HG LEU 134 14.240 25.843 6.763 525 HD11 LEU 134 HD11 LEU 134 14.723 25.964 4.113 526 HD12 LEU 134 HD12 LEU 134 15.193 24.610 5.141 527 HD13 LEU 134 HD13 LEU 134 16.370 25.859 4.733 528 HD21 LEU 134 HD21 LEU 134 17.019 26.383 6.577 529 HD22 LEU 134 HD22 LEU 134 16.008 26.302 8.020 530 HD23 LEU 134 HD23 LEU 134 16.219 27.836 7.175 Start of MODEL 8 1 H GLY 67 H GLY 67 2.173 0.105 -0.064 2 HA2 GLY 67 HA2 GLY 67 3.919 -0.105 -1.572 3 HA3 GLY 67 HA3 GLY 67 2.738 -0.258 -2.865 4 H GLN 68 H GLN 68 1.461 2.305 -1.862 5 HA GLN 68 HA GLN 68 2.837 4.056 -3.624 6 HB2 GLN 68 HB2 GLN 68 0.432 4.163 -1.927 7 HB3 GLN 68 HB3 GLN 68 1.226 5.713 -2.177 8 HG2 GLN 68 HG2 GLN 68 -0.555 5.263 -3.812 9 HG3 GLN 68 HG3 GLN 68 1.025 5.495 -4.558 10 HE21 GLN 68 HE21 GLN 68 0.451 4.389 -6.415 11 HE22 GLN 68 HE22 GLN 68 0.249 2.675 -6.449 12 H ASP 69 H ASP 69 4.520 5.331 -3.251 13 HA ASP 69 HA ASP 69 5.833 5.398 -0.747 14 HB2 ASP 69 HB2 ASP 69 6.230 6.662 -3.406 15 HB3 ASP 69 HB3 ASP 69 7.013 7.437 -2.031 16 H LEU 70 H LEU 70 5.983 6.981 0.802 17 HA LEU 70 HA LEU 70 3.725 8.562 1.299 18 HB2 LEU 70 HB2 LEU 70 6.063 7.844 2.657 19 HB3 LEU 70 HB3 LEU 70 6.073 9.605 2.606 20 HG LEU 70 HG LEU 70 3.477 8.688 3.399 21 HD11 LEU 70 HD11 LEU 70 4.126 6.758 4.398 22 HD12 LEU 70 HD12 LEU 70 4.532 7.875 5.701 23 HD13 LEU 70 HD13 LEU 70 5.792 7.295 4.612 24 HD21 LEU 70 HD21 LEU 70 3.966 10.811 4.080 25 HD22 LEU 70 HD22 LEU 70 5.653 10.433 4.427 26 HD23 LEU 70 HD23 LEU 70 4.387 9.928 5.547 27 H SER 71 H SER 71 4.470 11.045 2.051 28 HA SER 71 HA SER 71 5.158 12.305 -0.516 29 HB2 SER 71 HB2 SER 71 3.439 13.208 1.790 30 HB3 SER 71 HB3 SER 71 4.026 14.342 0.572 31 HG SER 71 HG SER 71 2.018 12.510 0.416 32 H ASP 72 H ASP 72 6.732 13.848 -0.649 33 HA ASP 72 HA ASP 72 9.006 13.782 0.742 34 HB2 ASP 72 HB2 ASP 72 7.693 15.811 -0.875 35 HB3 ASP 72 HB3 ASP 72 8.747 16.526 0.342 36 H ASP 73 H ASP 73 9.960 14.769 2.533 37 HA ASP 73 HA ASP 73 8.588 14.847 4.887 38 HB2 ASP 73 HB2 ASP 73 10.926 16.670 4.304 39 HB3 ASP 73 HB3 ASP 73 10.459 15.986 5.859 40 H LYS 74 H LYS 74 8.617 17.246 2.414 41 HA LYS 74 HA LYS 74 7.606 19.361 4.107 42 HB2 LYS 74 HB2 LYS 74 7.512 20.685 2.070 43 HB3 LYS 74 HB3 LYS 74 9.065 19.867 2.186 44 HG2 LYS 74 HG2 LYS 74 7.391 18.134 0.757 45 HG3 LYS 74 HG3 LYS 74 7.094 19.748 0.110 46 HD2 LYS 74 HD2 LYS 74 9.610 20.002 -0.043 47 HD3 LYS 74 HD3 LYS 74 9.711 18.272 0.292 48 HE2 LYS 74 HE2 LYS 74 8.428 17.770 -1.685 49 HE3 LYS 74 HE3 LYS 74 8.148 19.485 -1.983 50 HZ1 LYS 74 HZ1 LYS 74 10.916 19.002 -1.768 51 HZ2 LYS 74 HZ2 LYS 74 10.046 19.596 -3.091 52 HZ3 LYS 74 HZ3 LYS 74 10.256 17.929 -2.897 53 H ILE 75 H ILE 75 6.200 16.659 3.341 54 HA ILE 75 HA ILE 75 3.888 17.134 1.911 55 HB ILE 75 HB ILE 75 4.448 14.900 2.620 56 HG12 ILE 75 HG12 ILE 75 2.272 14.128 3.367 57 HG13 ILE 75 HG13 ILE 75 1.877 15.729 3.982 58 HG21 ILE 75 HG21 ILE 75 4.407 14.159 4.890 59 HG22 ILE 75 HG22 ILE 75 5.433 15.591 4.808 60 HG23 ILE 75 HG23 ILE 75 3.792 15.718 5.443 61 HD11 ILE 75 HD11 ILE 75 2.577 15.596 1.130 62 HD12 ILE 75 HD12 ILE 75 1.075 14.800 1.600 63 HD13 ILE 75 HD13 ILE 75 1.314 16.510 1.954 64 H GLY 76 H GLY 76 4.544 17.772 5.330 65 HA2 GLY 76 HA2 GLY 76 1.940 18.520 6.082 66 HA3 GLY 76 HA3 GLY 76 3.418 19.029 6.886 67 H LEU 77 H LEU 77 4.676 20.559 5.057 68 HA LEU 77 HA LEU 77 3.386 23.018 5.249 69 HB2 LEU 77 HB2 LEU 77 5.407 22.358 3.129 70 HB3 LEU 77 HB3 LEU 77 5.121 23.908 3.917 71 HG LEU 77 HG LEU 77 6.415 21.466 5.126 72 HD11 LEU 77 HD11 LEU 77 8.034 22.504 3.835 73 HD12 LEU 77 HD12 LEU 77 8.266 23.243 5.419 74 HD13 LEU 77 HD13 LEU 77 7.402 24.118 4.156 75 HD21 LEU 77 HD21 LEU 77 6.738 23.647 6.828 76 HD22 LEU 77 HD22 LEU 77 5.734 22.223 7.101 77 HD23 LEU 77 HD23 LEU 77 5.033 23.669 6.375 78 H LYS 78 H LYS 78 3.673 20.845 2.451 79 HA LYS 78 HA LYS 78 2.237 22.434 0.637 80 HB2 LYS 78 HB2 LYS 78 2.912 19.523 0.801 81 HB3 LYS 78 HB3 LYS 78 1.763 20.069 -0.413 82 HG2 LYS 78 HG2 LYS 78 3.683 21.829 -0.898 83 HG3 LYS 78 HG3 LYS 78 4.679 20.548 -0.203 84 HD2 LYS 78 HD2 LYS 78 2.742 19.533 -2.117 85 HD3 LYS 78 HD3 LYS 78 3.831 20.725 -2.830 86 HE2 LYS 78 HE2 LYS 78 5.036 18.796 -3.141 87 HE3 LYS 78 HE3 LYS 78 5.670 19.335 -1.586 88 HZ1 LYS 78 HZ1 LYS 78 3.612 17.247 -2.046 89 HZ2 LYS 78 HZ2 LYS 78 4.027 17.844 -0.518 90 HZ3 LYS 78 HZ3 LYS 78 5.178 17.021 -1.445 91 H VAL 79 H VAL 79 1.170 19.867 2.837 92 HA VAL 79 HA VAL 79 -1.506 19.747 2.030 93 HB VAL 79 HB VAL 79 -0.202 19.162 4.683 94 HG11 VAL 79 HG11 VAL 79 -3.090 18.843 3.888 95 HG12 VAL 79 HG12 VAL 79 -2.352 18.000 5.253 96 HG13 VAL 79 HG13 VAL 79 -2.437 19.762 5.244 97 HG21 VAL 79 HG21 VAL 79 0.157 17.120 3.865 98 HG22 VAL 79 HG22 VAL 79 -1.497 16.988 3.267 99 HG23 VAL 79 HG23 VAL 79 -0.265 17.777 2.284 100 H LEU 80 H LEU 80 -0.044 21.591 4.709 101 HA LEU 80 HA LEU 80 -2.347 22.871 5.595 102 HB2 LEU 80 HB2 LEU 80 0.561 23.399 5.760 103 HB3 LEU 80 HB3 LEU 80 -0.513 24.750 6.116 104 HG LEU 80 HG LEU 80 -0.950 22.146 7.507 105 HD11 LEU 80 HD11 LEU 80 0.824 22.295 8.884 106 HD12 LEU 80 HD12 LEU 80 0.834 24.058 8.858 107 HD13 LEU 80 HD13 LEU 80 1.552 23.153 7.526 108 HD21 LEU 80 HD21 LEU 80 -2.276 24.476 7.583 109 HD22 LEU 80 HD22 LEU 80 -1.087 24.772 8.852 110 HD23 LEU 80 HD23 LEU 80 -2.165 23.381 8.960 111 H PHE 81 H PHE 81 0.089 24.083 3.292 112 HA PHE 81 HA PHE 81 -1.046 26.512 2.673 113 HB2 PHE 81 HB2 PHE 81 1.078 26.098 1.758 114 HB3 PHE 81 HB3 PHE 81 0.569 24.578 1.032 115 HD1 PHE 81 HD1 PHE 81 0.584 28.216 0.698 116 HD2 PHE 81 HD2 PHE 81 -0.614 24.536 -1.072 117 HE1 PHE 81 HE1 PHE 81 0.168 29.379 -1.430 118 HE2 PHE 81 HE2 PHE 81 -1.031 25.692 -3.203 119 HZ PHE 81 HZ PHE 81 -0.640 28.117 -3.384 120 H LYS 82 H LYS 82 -1.584 23.443 0.939 121 HA LYS 82 HA LYS 82 -3.541 24.403 -0.817 122 HB2 LYS 82 HB2 LYS 82 -2.400 22.277 -1.174 123 HB3 LYS 82 HB3 LYS 82 -3.140 21.611 0.275 124 HG2 LYS 82 HG2 LYS 82 -5.277 22.504 -1.266 125 HG3 LYS 82 HG3 LYS 82 -4.164 21.757 -2.414 126 HD2 LYS 82 HD2 LYS 82 -4.616 20.273 0.096 127 HD3 LYS 82 HD3 LYS 82 -6.003 20.387 -0.991 128 HE2 LYS 82 HE2 LYS 82 -4.742 18.386 -1.484 129 HE3 LYS 82 HE3 LYS 82 -4.601 19.521 -2.824 130 HZ1 LYS 82 HZ1 LYS 82 -2.531 18.291 -1.607 131 HZ2 LYS 82 HZ2 LYS 82 -2.533 19.798 -0.839 132 HZ3 LYS 82 HZ3 LYS 82 -2.410 19.707 -2.524 133 H LEU 83 H LEU 83 -3.891 22.742 2.310 134 HA LEU 83 HA LEU 83 -6.661 22.633 2.417 135 HB2 LEU 83 HB2 LEU 83 -4.765 21.762 4.028 136 HB3 LEU 83 HB3 LEU 83 -5.131 23.250 4.896 137 HG LEU 83 HG LEU 83 -6.997 20.945 4.353 138 HD11 LEU 83 HD11 LEU 83 -6.742 20.356 6.521 139 HD12 LEU 83 HD12 LEU 83 -6.484 22.015 7.059 140 HD13 LEU 83 HD13 LEU 83 -5.170 21.123 6.295 141 HD21 LEU 83 HD21 LEU 83 -8.310 22.912 4.114 142 HD22 LEU 83 HD22 LEU 83 -7.538 23.675 5.505 143 HD23 LEU 83 HD23 LEU 83 -8.606 22.290 5.737 144 H MET 84 H MET 84 -4.474 25.248 3.363 145 HA MET 84 HA MET 84 -6.529 26.936 4.389 146 HB2 MET 84 HB2 MET 84 -3.766 27.681 3.414 147 HB3 MET 84 HB3 MET 84 -4.814 28.675 4.418 148 HG2 MET 84 HG2 MET 84 -4.369 26.055 5.569 149 HG3 MET 84 HG3 MET 84 -2.865 26.928 5.288 150 HE1 MET 84 HE1 MET 84 -2.346 27.006 7.969 151 HE2 MET 84 HE2 MET 84 -3.608 27.419 9.131 152 HE3 MET 84 HE3 MET 84 -3.789 25.999 8.098 153 H ASP 85 H ASP 85 -5.664 26.048 1.264 154 HA ASP 85 HA ASP 85 -6.725 28.525 0.097 155 HB2 ASP 85 HB2 ASP 85 -5.001 26.312 -0.971 156 HB3 ASP 85 HB3 ASP 85 -5.911 27.336 -2.079 157 H VAL 86 H VAL 86 -8.874 27.809 0.892 158 HA VAL 86 HA VAL 86 -10.180 25.515 -0.043 159 HB VAL 86 HB VAL 86 -11.013 26.987 1.790 160 HG11 VAL 86 HG11 VAL 86 -11.410 29.144 1.454 161 HG12 VAL 86 HG12 VAL 86 -10.881 28.960 -0.220 162 HG13 VAL 86 HG13 VAL 86 -12.584 28.763 0.195 163 HG21 VAL 86 HG21 VAL 86 -12.405 25.383 0.118 164 HG22 VAL 86 HG22 VAL 86 -13.100 26.172 1.535 165 HG23 VAL 86 HG23 VAL 86 -13.299 26.893 -0.063 166 H ASP 87 H ASP 87 -9.222 28.323 -1.702 167 HA ASP 87 HA ASP 87 -11.260 28.227 -3.738 168 HB2 ASP 87 HB2 ASP 87 -9.673 29.865 -4.899 169 HB3 ASP 87 HB3 ASP 87 -10.365 30.379 -3.363 170 H GLY 88 H GLY 88 -8.696 26.279 -3.046 171 HA2 GLY 88 HA2 GLY 88 -7.374 24.835 -4.264 172 HA3 GLY 88 HA3 GLY 88 -8.834 24.643 -5.221 173 H ASP 89 H ASP 89 -6.657 27.427 -4.876 174 HA ASP 89 HA ASP 89 -6.508 27.609 -7.783 175 HB2 ASP 89 HB2 ASP 89 -5.263 29.777 -7.216 176 HB3 ASP 89 HB3 ASP 89 -6.973 29.700 -6.803 177 H GLY 90 H GLY 90 -4.602 26.614 -5.091 178 HA2 GLY 90 HA2 GLY 90 -2.599 25.442 -5.126 179 HA3 GLY 90 HA3 GLY 90 -2.505 25.714 -6.860 180 H LYS 91 H LYS 91 -3.082 28.672 -5.677 181 HA LYS 91 HA LYS 91 -0.298 29.263 -4.979 182 HB2 LYS 91 HB2 LYS 91 -0.584 31.353 -6.493 183 HB3 LYS 91 HB3 LYS 91 -0.173 29.811 -7.233 184 HG2 LYS 91 HG2 LYS 91 -2.057 29.760 -8.418 185 HG3 LYS 91 HG3 LYS 91 -3.043 30.232 -7.033 186 HD2 LYS 91 HD2 LYS 91 -3.006 32.420 -7.590 187 HD3 LYS 91 HD3 LYS 91 -1.336 32.354 -8.155 188 HE2 LYS 91 HE2 LYS 91 -2.878 32.836 -9.988 189 HE3 LYS 91 HE3 LYS 91 -2.066 31.290 -10.223 190 HZ1 LYS 91 HZ1 LYS 91 -4.352 31.010 -10.744 191 HZ2 LYS 91 HZ2 LYS 91 -4.849 31.729 -9.296 192 HZ3 LYS 91 HZ3 LYS 91 -4.081 30.222 -9.272 193 H LEU 92 H LEU 92 -0.008 31.345 -3.948 194 HA LEU 92 HA LEU 92 -2.491 32.397 -2.757 195 HB2 LEU 92 HB2 LEU 92 -1.497 32.564 -0.654 196 HB3 LEU 92 HB3 LEU 92 -1.009 30.979 -1.250 197 HG LEU 92 HG LEU 92 1.129 32.355 -2.026 198 HD11 LEU 92 HD11 LEU 92 -0.148 34.392 -0.872 199 HD12 LEU 92 HD12 LEU 92 1.609 34.250 -0.883 200 HD13 LEU 92 HD13 LEU 92 0.694 33.758 0.542 201 HD21 LEU 92 HD21 LEU 92 1.945 31.865 0.456 202 HD22 LEU 92 HD22 LEU 92 1.633 30.575 -0.706 203 HD23 LEU 92 HD23 LEU 92 0.418 30.985 0.506 204 H THR 93 H THR 93 -2.657 34.596 -2.507 205 HA THR 93 HA THR 93 -0.749 36.179 -4.044 206 HB THR 93 HB THR 93 -3.081 36.528 -4.590 207 HG1 THR 93 HG1 THR 93 -3.160 38.850 -4.058 208 HG21 THR 93 HG21 THR 93 -4.030 37.900 -2.279 209 HG22 THR 93 HG22 THR 93 -3.455 36.306 -1.787 210 HG23 THR 93 HG23 THR 93 -4.682 36.452 -3.045 211 H LYS 94 H LYS 94 0.064 38.206 -3.240 212 HA LYS 94 HA LYS 94 1.490 38.172 -0.968 213 HB2 LYS 94 HB2 LYS 94 1.307 40.007 -2.787 214 HB3 LYS 94 HB3 LYS 94 0.103 40.728 -1.725 215 HG2 LYS 94 HG2 LYS 94 2.090 40.334 0.038 216 HG3 LYS 94 HG3 LYS 94 3.029 40.560 -1.439 217 HD2 LYS 94 HD2 LYS 94 0.856 42.489 -1.122 218 HD3 LYS 94 HD3 LYS 94 2.064 42.568 0.162 219 HE2 LYS 94 HE2 LYS 94 3.370 42.295 -2.372 220 HE3 LYS 94 HE3 LYS 94 2.221 43.631 -2.443 221 HZ1 LYS 94 HZ1 LYS 94 4.514 43.286 -0.607 222 HZ2 LYS 94 HZ2 LYS 94 3.269 44.382 -0.279 223 HZ3 LYS 94 HZ3 LYS 94 4.206 44.562 -1.675 224 H GLU 95 H GLU 95 -1.776 39.595 -1.151 225 HA GLU 95 HA GLU 95 -2.093 40.261 1.509 226 HB2 GLU 95 HB2 GLU 95 -4.279 39.156 -0.257 227 HB3 GLU 95 HB3 GLU 95 -4.472 40.229 1.122 228 HG2 GLU 95 HG2 GLU 95 -3.021 41.872 -0.211 229 HG3 GLU 95 HG3 GLU 95 -3.380 40.842 -1.595 230 H GLU 96 H GLU 96 -2.756 37.161 -0.077 231 HA GLU 96 HA GLU 96 -3.808 35.854 2.187 232 HB2 GLU 96 HB2 GLU 96 -4.035 35.066 -0.173 233 HB3 GLU 96 HB3 GLU 96 -2.341 34.598 -0.137 234 HG2 GLU 96 HG2 GLU 96 -2.727 32.899 1.431 235 HG3 GLU 96 HG3 GLU 96 -4.321 33.529 1.844 236 H VAL 97 H VAL 97 -0.522 36.132 0.917 237 HA VAL 97 HA VAL 97 0.747 34.316 2.619 238 HB VAL 97 HB VAL 97 1.573 36.049 0.631 239 HG11 VAL 97 HG11 VAL 97 1.840 37.821 2.336 240 HG12 VAL 97 HG12 VAL 97 3.009 36.799 3.175 241 HG13 VAL 97 HG13 VAL 97 3.357 37.388 1.548 242 HG21 VAL 97 HG21 VAL 97 2.390 33.720 1.593 243 HG22 VAL 97 HG22 VAL 97 3.424 34.713 0.565 244 HG23 VAL 97 HG23 VAL 97 3.639 34.736 2.315 245 H THR 98 H THR 98 -0.273 37.624 3.137 246 HA THR 98 HA THR 98 1.191 38.019 5.556 247 HB THR 98 HB THR 98 -1.234 39.482 4.493 248 HG1 THR 98 HG1 THR 98 1.368 40.541 4.528 249 HG21 THR 98 HG21 THR 98 -0.460 41.296 6.039 250 HG22 THR 98 HG22 THR 98 0.648 40.129 6.761 251 HG23 THR 98 HG23 THR 98 -1.093 39.867 6.854 252 H SER 99 H SER 99 -2.170 37.151 4.816 253 HA SER 99 HA SER 99 -2.994 37.011 7.535 254 HB2 SER 99 HB2 SER 99 -4.393 37.191 5.299 255 HB3 SER 99 HB3 SER 99 -4.381 35.431 5.407 256 HG SER 99 HG SER 99 -5.048 35.987 7.739 257 H PHE 100 H PHE 100 -1.791 34.653 5.207 258 HA PHE 100 HA PHE 100 -2.282 32.346 6.757 259 HB2 PHE 100 HB2 PHE 100 -0.506 32.987 4.434 260 HB3 PHE 100 HB3 PHE 100 -0.297 31.456 5.279 261 HD1 PHE 100 HD2 PHE 100 -3.581 33.035 4.971 262 HD2 PHE 100 HD1 PHE 100 -0.909 30.143 3.354 263 HE1 PHE 100 HE2 PHE 100 -5.426 32.065 3.664 264 HE2 PHE 100 HE1 PHE 100 -2.749 29.169 2.044 265 HZ PHE 100 HZ PHE 100 -5.012 30.129 2.198 266 H PHE 101 H PHE 101 0.620 34.360 6.375 267 HA PHE 101 HA PHE 101 2.129 32.854 8.291 268 HB2 PHE 101 HB2 PHE 101 2.800 34.584 6.288 269 HB3 PHE 101 HB3 PHE 101 3.017 35.599 7.710 270 HD1 PHE 101 HD2 PHE 101 3.993 32.345 6.227 271 HD2 PHE 101 HD1 PHE 101 4.928 35.410 9.028 272 HE1 PHE 101 HE2 PHE 101 6.186 31.304 6.631 273 HE2 PHE 101 HE1 PHE 101 7.122 34.375 9.435 274 HZ PHE 101 HZ PHE 101 7.754 32.318 8.236 275 H LYS 102 H LYS 102 -0.036 35.544 8.400 276 HA LYS 102 HA LYS 102 0.744 36.889 10.681 277 HB2 LYS 102 HB2 LYS 102 -1.712 36.577 9.150 278 HB3 LYS 102 HB3 LYS 102 -2.031 36.808 10.865 279 HG2 LYS 102 HG2 LYS 102 -0.028 38.653 9.882 280 HG3 LYS 102 HG3 LYS 102 -1.547 38.781 8.992 281 HD2 LYS 102 HD2 LYS 102 -1.339 38.823 12.001 282 HD3 LYS 102 HD3 LYS 102 -1.395 40.270 10.992 283 HE2 LYS 102 HE2 LYS 102 -3.592 39.883 10.344 284 HE3 LYS 102 HE3 LYS 102 -3.512 38.167 10.747 285 HZ1 LYS 102 HZ1 LYS 102 -4.246 40.388 12.393 286 HZ2 LYS 102 HZ2 LYS 102 -3.056 39.428 13.119 287 HZ3 LYS 102 HZ3 LYS 102 -4.520 38.735 12.629 288 H LYS 103 H LYS 103 -0.717 33.750 10.375 289 HA LYS 103 HA LYS 103 -1.760 33.377 12.924 290 HB2 LYS 103 HB2 LYS 103 -0.496 31.454 10.979 291 HB3 LYS 103 HB3 LYS 103 -1.186 30.919 12.506 292 HG2 LYS 103 HG2 LYS 103 -2.736 32.476 10.455 293 HG3 LYS 103 HG3 LYS 103 -2.681 30.713 10.503 294 HD2 LYS 103 HD2 LYS 103 -3.575 32.453 12.799 295 HD3 LYS 103 HD3 LYS 103 -4.667 31.693 11.641 296 HE2 LYS 103 HE2 LYS 103 -4.600 29.781 12.770 297 HE3 LYS 103 HE3 LYS 103 -2.841 29.739 12.664 298 HZ1 LYS 103 HZ1 LYS 103 -4.451 30.271 14.909 299 HZ2 LYS 103 HZ2 LYS 103 -3.510 31.638 14.583 300 HZ3 LYS 103 HZ3 LYS 103 -2.766 30.139 14.826 301 H HIS 104 H HIS 104 1.527 33.545 11.870 302 HA HIS 104 HA HIS 104 2.514 32.454 14.399 303 HB2 HIS 104 HB2 HIS 104 3.460 32.217 11.834 304 HB3 HIS 104 HB3 HIS 104 4.491 33.485 12.488 305 HD1 HIS 104 HD1 HIS 104 5.643 30.724 11.768 306 HD2 HIS 104 HD2 HIS 104 4.324 31.789 15.561 307 HE1 HIS 104 HE1 HIS 104 6.838 29.180 13.354 308 H GLY 105 H GLY 105 1.782 35.431 12.934 309 HA2 GLY 105 HA2 GLY 105 1.766 37.484 14.093 310 HA3 GLY 105 HA3 GLY 105 2.969 36.842 15.202 311 H ILE 106 H ILE 106 4.147 35.950 12.342 312 HA ILE 106 HA ILE 106 5.973 38.210 12.250 313 HB ILE 106 HB ILE 106 6.012 35.614 10.708 314 HG12 ILE 106 HG12 ILE 106 8.094 36.189 12.712 315 HG13 ILE 106 HG13 ILE 106 6.480 35.959 13.377 316 HG21 ILE 106 HG21 ILE 106 8.532 36.467 10.572 317 HG22 ILE 106 HG22 ILE 106 7.320 36.892 9.364 318 HG23 ILE 106 HG23 ILE 106 7.721 38.031 10.649 319 HD11 ILE 106 HD11 ILE 106 8.164 34.032 11.827 320 HD12 ILE 106 HD12 ILE 106 7.437 33.842 13.424 321 HD13 ILE 106 HD13 ILE 106 6.420 33.817 11.983 322 H GLU 107 H GLU 107 5.995 39.747 10.728 323 HA GLU 107 HA GLU 107 4.069 39.503 8.519 324 HB2 GLU 107 HB2 GLU 107 4.489 41.552 10.384 325 HB3 GLU 107 HB3 GLU 107 5.155 42.161 8.875 326 HG2 GLU 107 HG2 GLU 107 2.474 40.893 8.802 327 HG3 GLU 107 HG3 GLU 107 2.621 42.494 9.524 328 H LYS 108 H LYS 108 7.333 39.347 9.185 329 HA LYS 108 HA LYS 108 8.571 40.711 7.108 330 HB2 LYS 108 HB2 LYS 108 9.864 39.708 8.881 331 HB3 LYS 108 HB3 LYS 108 9.321 38.097 8.426 332 HG2 LYS 108 HG2 LYS 108 10.933 37.884 6.915 333 HG3 LYS 108 HG3 LYS 108 10.592 39.468 6.216 334 HD2 LYS 108 HD2 LYS 108 11.949 39.426 8.849 335 HD3 LYS 108 HD3 LYS 108 12.892 38.891 7.455 336 HE2 LYS 108 HE2 LYS 108 13.312 41.184 7.577 337 HE3 LYS 108 HE3 LYS 108 12.079 41.044 6.325 338 HZ1 LYS 108 HZ1 LYS 108 11.614 42.849 7.879 339 HZ2 LYS 108 HZ2 LYS 108 11.561 41.751 9.163 340 HZ3 LYS 108 HZ3 LYS 108 10.404 41.668 7.931 341 H VAL 109 H VAL 109 6.659 37.833 7.041 342 HA VAL 109 HA VAL 109 7.528 36.521 4.781 343 HB VAL 109 HB VAL 109 5.655 35.791 6.279 344 HG11 VAL 109 HG11 VAL 109 4.054 37.722 4.603 345 HG12 VAL 109 HG12 VAL 109 3.386 36.549 5.740 346 HG13 VAL 109 HG13 VAL 109 4.394 37.873 6.327 347 HG21 VAL 109 HG21 VAL 109 6.117 34.609 4.219 348 HG22 VAL 109 HG22 VAL 109 4.375 34.690 4.481 349 HG23 VAL 109 HG23 VAL 109 5.140 35.760 3.306 350 H ALA 110 H ALA 110 5.735 39.514 5.020 351 HA ALA 110 HA ALA 110 4.833 39.711 2.369 352 HB1 ALA 110 HB1 ALA 110 5.000 41.431 4.681 353 HB2 ALA 110 HB2 ALA 110 5.360 42.316 3.198 354 HB3 ALA 110 HB3 ALA 110 3.839 41.438 3.354 355 H GLU 111 H GLU 111 7.818 40.903 3.893 356 HA GLU 111 HA GLU 111 8.861 42.005 1.478 357 HB2 GLU 111 HB2 GLU 111 9.458 42.555 3.954 358 HB3 GLU 111 HB3 GLU 111 10.575 41.205 3.807 359 HG2 GLU 111 HG2 GLU 111 11.962 42.897 3.219 360 HG3 GLU 111 HG3 GLU 111 11.308 42.504 1.631 361 H GLN 112 H GLN 112 9.004 38.888 3.025 362 HA GLN 112 HA GLN 112 11.222 37.874 1.559 363 HB2 GLN 112 HB2 GLN 112 10.979 36.440 3.270 364 HB3 GLN 112 HB3 GLN 112 9.288 36.865 3.495 365 HG2 GLN 112 HG2 GLN 112 8.624 35.334 1.761 366 HG3 GLN 112 HG3 GLN 112 10.310 34.978 1.387 367 HE21 GLN 112 HE21 GLN 112 11.524 33.738 2.838 368 HE22 GLN 112 HE22 GLN 112 10.771 32.738 4.029 369 H VAL 113 H VAL 113 7.707 37.633 1.158 370 HA VAL 113 HA VAL 113 7.836 35.990 -1.164 371 HB VAL 113 HB VAL 113 5.838 36.172 0.337 372 HG11 VAL 113 HG11 VAL 113 4.271 38.036 -0.087 373 HG12 VAL 113 HG12 VAL 113 5.780 38.564 0.659 374 HG13 VAL 113 HG13 VAL 113 5.510 38.821 -1.066 375 HG21 VAL 113 HG21 VAL 113 5.684 35.152 -1.873 376 HG22 VAL 113 HG22 VAL 113 4.198 36.016 -1.474 377 HG23 VAL 113 HG23 VAL 113 5.363 36.731 -2.589 378 H MET 114 H MET 114 7.842 39.439 -0.594 379 HA MET 114 HA MET 114 7.346 40.147 -3.333 380 HB2 MET 114 HB2 MET 114 7.810 41.555 -0.797 381 HB3 MET 114 HB3 MET 114 8.475 42.374 -2.205 382 HG2 MET 114 HG2 MET 114 5.622 41.451 -1.964 383 HG3 MET 114 HG3 MET 114 6.180 43.084 -1.606 384 HE1 MET 114 HE1 MET 114 6.012 44.999 -3.679 385 HE2 MET 114 HE2 MET 114 7.603 44.404 -3.205 386 HE3 MET 114 HE3 MET 114 7.196 44.567 -4.914 387 H LYS 115 H LYS 115 10.161 39.659 -1.300 388 HA LYS 115 HA LYS 115 11.991 40.653 -3.312 389 HB2 LYS 115 HB2 LYS 115 12.399 39.361 -0.616 390 HB3 LYS 115 HB3 LYS 115 13.732 39.802 -1.674 391 HG2 LYS 115 HG2 LYS 115 11.673 41.729 -0.618 392 HG3 LYS 115 HG3 LYS 115 13.276 41.476 0.078 393 HD2 LYS 115 HD2 LYS 115 12.712 42.409 -2.737 394 HD3 LYS 115 HD3 LYS 115 13.206 43.443 -1.395 395 HE2 LYS 115 HE2 LYS 115 15.276 42.062 -1.195 396 HE3 LYS 115 HE3 LYS 115 14.789 41.210 -2.659 397 HZ1 LYS 115 HZ1 LYS 115 15.188 44.146 -2.526 398 HZ2 LYS 115 HZ2 LYS 115 14.961 43.204 -3.912 399 HZ3 LYS 115 HZ3 LYS 115 16.389 43.060 -3.017 400 H ALA 116 H ALA 116 10.589 37.645 -2.370 401 HA ALA 116 HA ALA 116 12.579 36.054 -3.771 402 HB1 ALA 116 HB1 ALA 116 9.999 35.088 -2.558 403 HB2 ALA 116 HB2 ALA 116 11.437 34.143 -2.950 404 HB3 ALA 116 HB3 ALA 116 11.482 35.314 -1.630 405 H ASP 117 H ASP 117 9.617 37.619 -4.435 406 HA ASP 117 HA ASP 117 8.812 35.891 -6.594 407 HB2 ASP 117 HB2 ASP 117 7.774 38.331 -5.294 408 HB3 ASP 117 HB3 ASP 117 7.398 38.171 -7.007 409 H ALA 118 H ALA 118 10.767 35.892 -7.836 410 HA ALA 118 HA ALA 118 11.795 38.310 -8.968 411 HB1 ALA 118 HB1 ALA 118 12.473 35.480 -9.006 412 HB2 ALA 118 HB2 ALA 118 12.733 36.271 -10.561 413 HB3 ALA 118 HB3 ALA 118 13.517 36.899 -9.110 414 H ASN 119 H ASN 119 9.181 36.259 -9.711 415 HA ASN 119 HA ASN 119 9.109 37.028 -12.523 416 HB2 ASN 119 HB2 ASN 119 6.935 35.604 -12.409 417 HB3 ASN 119 HB3 ASN 119 8.493 34.788 -12.311 418 HD21 ASN 119 HD21 ASN 119 7.628 33.031 -11.233 419 HD22 ASN 119 HD22 ASN 119 7.133 33.112 -9.579 420 H GLY 120 H GLY 120 8.210 38.392 -9.672 421 HA2 GLY 120 HA2 GLY 120 6.660 39.973 -9.043 422 HA3 GLY 120 HA3 GLY 120 6.844 40.535 -10.698 423 H ASP 121 H ASP 121 5.557 37.381 -9.921 424 HA ASP 121 HA ASP 121 3.171 37.909 -11.404 425 HB2 ASP 121 HB2 ASP 121 2.533 35.586 -10.545 426 HB3 ASP 121 HB3 ASP 121 3.977 35.694 -11.548 427 H GLY 122 H GLY 122 4.090 38.252 -8.122 428 HA2 GLY 122 HA2 GLY 122 2.911 39.210 -6.379 429 HA3 GLY 122 HA3 GLY 122 1.519 39.340 -7.443 430 H TYR 123 H TYR 123 2.568 36.214 -7.598 431 HA TYR 123 HA TYR 123 1.015 35.339 -5.269 432 HB2 TYR 123 HB2 TYR 123 0.617 33.931 -7.882 433 HB3 TYR 123 HB3 TYR 123 -0.444 33.999 -6.479 434 HD1 TYR 123 HD2 TYR 123 -1.277 36.499 -5.928 435 HD2 TYR 123 HD1 TYR 123 -0.055 35.091 -9.753 436 HE1 TYR 123 HE2 TYR 123 -2.584 38.287 -6.998 437 HE2 TYR 123 HE1 TYR 123 -1.357 36.876 -10.833 438 HH TYR 123 HH TYR 123 -3.452 39.004 -8.973 439 H ILE 124 H ILE 124 1.393 33.110 -4.670 440 HA ILE 124 HA ILE 124 3.868 31.971 -5.775 441 HB ILE 124 HB ILE 124 4.974 32.141 -3.857 442 HG12 ILE 124 HG12 ILE 124 2.531 31.047 -2.447 443 HG13 ILE 124 HG13 ILE 124 3.828 30.079 -3.140 444 HG21 ILE 124 HG21 ILE 124 4.137 33.629 -2.104 445 HG22 ILE 124 HG22 ILE 124 3.847 34.295 -3.710 446 HG23 ILE 124 HG23 ILE 124 2.524 33.553 -2.810 447 HD11 ILE 124 HD11 ILE 124 5.402 31.025 -1.557 448 HD12 ILE 124 HD12 ILE 124 4.131 32.046 -0.884 449 HD13 ILE 124 HD13 ILE 124 4.033 30.294 -0.720 450 H THR 125 H THR 125 3.703 29.892 -6.296 451 HA THR 125 HA THR 125 1.275 28.452 -5.592 452 HB THR 125 HB THR 125 2.022 28.412 -7.931 453 HG1 THR 125 HG1 THR 125 2.247 25.924 -7.931 454 HG21 THR 125 HG21 THR 125 4.370 28.541 -7.824 455 HG22 THR 125 HG22 THR 125 4.038 26.917 -8.425 456 HG23 THR 125 HG23 THR 125 4.480 27.158 -6.735 457 H LEU 126 H LEU 126 1.850 25.896 -5.453 458 HA LEU 126 HA LEU 126 2.707 25.410 -2.889 459 HB2 LEU 126 HB2 LEU 126 3.023 23.483 -5.181 460 HB3 LEU 126 HB3 LEU 126 2.846 23.086 -3.474 461 HG LEU 126 HG LEU 126 0.593 24.625 -4.442 462 HD11 LEU 126 HD11 LEU 126 0.685 21.914 -5.659 463 HD12 LEU 126 HD12 LEU 126 1.488 23.241 -6.498 464 HD13 LEU 126 HD13 LEU 126 -0.236 23.340 -6.138 465 HD21 LEU 126 HD21 LEU 126 -0.512 23.293 -3.011 466 HD22 LEU 126 HD22 LEU 126 1.101 22.843 -2.460 467 HD23 LEU 126 HD23 LEU 126 0.251 21.826 -3.624 468 H GLU 127 H GLU 127 4.619 25.428 -5.859 469 HA GLU 127 HA GLU 127 7.012 24.431 -4.798 470 HB2 GLU 127 HB2 GLU 127 6.255 26.033 -7.184 471 HB3 GLU 127 HB3 GLU 127 7.953 26.030 -6.725 472 HG2 GLU 127 HG2 GLU 127 6.265 23.624 -7.367 473 HG3 GLU 127 HG3 GLU 127 7.535 24.322 -8.371 474 H GLU 128 H GLU 128 6.078 27.825 -5.378 475 HA GLU 128 HA GLU 128 8.306 29.009 -4.200 476 HB2 GLU 128 HB2 GLU 128 5.531 30.184 -4.103 477 HB3 GLU 128 HB3 GLU 128 7.066 31.038 -4.170 478 HG2 GLU 128 HG2 GLU 128 7.348 29.845 -6.450 479 HG3 GLU 128 HG3 GLU 128 5.605 29.608 -6.344 480 H PHE 129 H PHE 129 5.187 28.121 -2.757 481 HA PHE 129 HA PHE 129 5.598 29.152 -0.206 482 HB2 PHE 129 HB2 PHE 129 3.431 28.295 -0.974 483 HB3 PHE 129 HB3 PHE 129 4.076 26.657 -0.991 484 HD1 PHE 129 HD2 PHE 129 3.113 29.476 1.175 485 HD2 PHE 129 HD1 PHE 129 4.237 25.374 0.994 486 HE1 PHE 129 HE2 PHE 129 2.437 29.191 3.522 487 HE2 PHE 129 HE1 PHE 129 3.563 25.084 3.343 488 HZ PHE 129 HZ PHE 129 2.663 26.993 4.611 489 H LEU 130 H LEU 130 6.615 26.083 -1.610 490 HA LEU 130 HA LEU 130 7.631 25.018 0.841 491 HB2 LEU 130 HB2 LEU 130 7.043 23.397 -0.713 492 HB3 LEU 130 HB3 LEU 130 7.820 24.252 -2.043 493 HG LEU 130 HG LEU 130 10.026 23.647 -1.062 494 HD11 LEU 130 HD11 LEU 130 8.325 21.989 0.794 495 HD12 LEU 130 HD12 LEU 130 9.385 23.326 1.241 496 HD13 LEU 130 HD13 LEU 130 10.072 21.830 0.607 497 HD21 LEU 130 HD21 LEU 130 9.823 21.189 -1.633 498 HD22 LEU 130 HD22 LEU 130 9.279 22.324 -2.869 499 HD23 LEU 130 HD23 LEU 130 8.098 21.482 -1.864 500 H GLU 131 H GLU 131 8.810 27.210 -1.513 501 HA GLU 131 HA GLU 131 11.605 26.774 -0.927 502 HB2 GLU 131 HB2 GLU 131 10.428 27.706 -3.118 503 HB3 GLU 131 HB3 GLU 131 10.649 29.244 -2.296 504 HG2 GLU 131 HG2 GLU 131 12.726 29.313 -3.036 505 HG3 GLU 131 HG3 GLU 131 13.092 27.870 -2.093 506 H PHE 132 H PHE 132 9.029 28.593 0.384 507 HA PHE 132 HA PHE 132 10.907 30.313 1.860 508 HB2 PHE 132 HB2 PHE 132 7.927 30.731 1.688 509 HB3 PHE 132 HB3 PHE 132 9.167 31.894 2.146 510 HD1 PHE 132 HD2 PHE 132 11.113 31.346 -0.083 511 HD2 PHE 132 HD1 PHE 132 6.890 31.875 -0.076 512 HE1 PHE 132 HE2 PHE 132 11.213 32.151 -2.406 513 HE2 PHE 132 HE1 PHE 132 6.983 32.680 -2.400 514 HZ PHE 132 HZ PHE 132 9.147 32.820 -3.566 515 H SER 133 H SER 133 11.277 28.259 3.118 516 HA SER 133 HA SER 133 9.726 28.384 5.543 517 HB2 SER 133 HB2 SER 133 9.580 26.005 3.712 518 HB3 SER 133 HB3 SER 133 9.411 25.802 5.456 519 HG SER 133 HG SER 133 7.384 26.109 4.505 520 H LEU 134 H LEU 134 11.655 28.941 6.532 521 HA LEU 134 HA LEU 134 13.199 26.918 7.630 522 HB2 LEU 134 HB2 LEU 134 13.950 27.394 4.990 523 HB3 LEU 134 HB3 LEU 134 15.161 28.229 5.961 524 HG LEU 134 HG LEU 134 14.523 25.424 6.691 525 HD11 LEU 134 HD11 LEU 134 15.363 24.423 4.870 526 HD12 LEU 134 HD12 LEU 134 16.577 25.675 4.616 527 HD13 LEU 134 HD13 LEU 134 14.926 25.922 4.050 528 HD21 LEU 134 HD21 LEU 134 17.282 25.968 6.478 529 HD22 LEU 134 HD22 LEU 134 16.317 25.787 7.943 530 HD23 LEU 134 HD23 LEU 134 16.533 27.382 7.220 Start of MODEL 9 1 H GLY 67 H GLY 67 2.026 3.429 5.254 2 HA2 GLY 67 HA2 GLY 67 0.510 2.601 3.710 3 HA3 GLY 67 HA3 GLY 67 -0.795 3.092 4.780 4 H GLN 68 H GLN 68 0.355 5.864 4.886 5 HA GLN 68 HA GLN 68 -1.180 6.950 2.757 6 HB2 GLN 68 HB2 GLN 68 0.739 8.203 4.719 7 HB3 GLN 68 HB3 GLN 68 -0.165 9.136 3.533 8 HG2 GLN 68 HG2 GLN 68 -1.597 9.342 5.260 9 HG3 GLN 68 HG3 GLN 68 -2.192 7.806 4.632 10 HE21 GLN 68 HE21 GLN 68 0.436 8.917 6.750 11 HE22 GLN 68 HE22 GLN 68 0.154 7.753 7.994 12 H ASP 69 H ASP 69 -0.354 8.487 1.142 13 HA ASP 69 HA ASP 69 1.689 7.318 -0.427 14 HB2 ASP 69 HB2 ASP 69 -0.002 9.767 -0.607 15 HB3 ASP 69 HB3 ASP 69 1.441 9.688 -1.615 16 H LEU 70 H LEU 70 3.814 7.506 -0.243 17 HA LEU 70 HA LEU 70 5.079 9.107 1.679 18 HB2 LEU 70 HB2 LEU 70 5.823 7.144 -0.245 19 HB3 LEU 70 HB3 LEU 70 6.928 8.510 -0.387 20 HG LEU 70 HG LEU 70 6.371 7.039 2.188 21 HD11 LEU 70 HD11 LEU 70 8.657 6.741 0.244 22 HD12 LEU 70 HD12 LEU 70 7.429 5.531 0.619 23 HD13 LEU 70 HD13 LEU 70 8.586 6.026 1.855 24 HD21 LEU 70 HD21 LEU 70 7.350 8.837 3.070 25 HD22 LEU 70 HD22 LEU 70 7.816 9.458 1.487 26 HD23 LEU 70 HD23 LEU 70 8.838 8.277 2.306 27 H SER 71 H SER 71 4.881 11.267 1.611 28 HA SER 71 HA SER 71 5.463 12.631 -0.934 29 HB2 SER 71 HB2 SER 71 3.631 13.242 1.332 30 HB3 SER 71 HB3 SER 71 4.397 14.609 0.522 31 HG SER 71 HG SER 71 3.140 12.577 -0.970 32 H ASP 72 H ASP 72 7.019 14.198 -1.035 33 HA ASP 72 HA ASP 72 9.324 14.090 0.309 34 HB2 ASP 72 HB2 ASP 72 7.944 16.222 -1.153 35 HB3 ASP 72 HB3 ASP 72 9.122 16.822 0.010 36 H ASP 73 H ASP 73 10.313 15.058 2.103 37 HA ASP 73 HA ASP 73 9.007 15.020 4.494 38 HB2 ASP 73 HB2 ASP 73 11.489 16.366 3.547 39 HB3 ASP 73 HB3 ASP 73 10.868 16.824 5.129 40 H LYS 74 H LYS 74 8.877 17.491 2.099 41 HA LYS 74 HA LYS 74 7.859 19.524 3.885 42 HB2 LYS 74 HB2 LYS 74 7.547 20.839 1.803 43 HB3 LYS 74 HB3 LYS 74 9.189 20.242 2.002 44 HG2 LYS 74 HG2 LYS 74 9.063 19.411 -0.044 45 HG3 LYS 74 HG3 LYS 74 7.854 18.267 0.547 46 HD2 LYS 74 HD2 LYS 74 6.144 20.109 0.137 47 HD3 LYS 74 HD3 LYS 74 7.415 20.942 -0.759 48 HE2 LYS 74 HE2 LYS 74 6.216 19.753 -2.386 49 HE3 LYS 74 HE3 LYS 74 7.658 18.782 -2.092 50 HZ1 LYS 74 HZ1 LYS 74 6.380 17.326 -0.685 51 HZ2 LYS 74 HZ2 LYS 74 5.625 17.445 -2.193 52 HZ3 LYS 74 HZ3 LYS 74 4.999 18.286 -0.866 53 H ILE 75 H ILE 75 6.516 16.797 3.100 54 HA ILE 75 HA ILE 75 4.141 17.206 1.766 55 HB ILE 75 HB ILE 75 4.776 14.989 2.437 56 HG12 ILE 75 HG12 ILE 75 2.247 15.890 2.471 57 HG13 ILE 75 HG13 ILE 75 2.662 14.206 2.774 58 HG21 ILE 75 HG21 ILE 75 4.609 14.291 4.827 59 HG22 ILE 75 HG22 ILE 75 5.920 15.421 4.492 60 HG23 ILE 75 HG23 ILE 75 4.436 15.992 5.257 61 HD11 ILE 75 HD11 ILE 75 1.027 15.363 4.363 62 HD12 ILE 75 HD12 ILE 75 2.340 14.418 5.066 63 HD13 ILE 75 HD13 ILE 75 2.449 16.177 5.015 64 H GLY 76 H GLY 76 4.981 18.056 5.070 65 HA2 GLY 76 HA2 GLY 76 2.348 18.655 5.947 66 HA3 GLY 76 HA3 GLY 76 3.838 19.215 6.693 67 H LEU 77 H LEU 77 4.979 20.755 4.785 68 HA LEU 77 HA LEU 77 3.572 23.170 4.995 69 HB2 LEU 77 HB2 LEU 77 5.644 22.619 2.894 70 HB3 LEU 77 HB3 LEU 77 5.286 24.141 3.708 71 HG LEU 77 HG LEU 77 6.660 21.733 4.901 72 HD11 LEU 77 HD11 LEU 77 8.266 23.950 5.184 73 HD12 LEU 77 HD12 LEU 77 7.576 24.154 3.574 74 HD13 LEU 77 HD13 LEU 77 8.454 22.678 3.977 75 HD21 LEU 77 HD21 LEU 77 5.636 22.523 6.770 76 HD22 LEU 77 HD22 LEU 77 5.445 24.150 6.117 77 HD23 LEU 77 HD23 LEU 77 7.013 23.626 6.737 78 H LYS 78 H LYS 78 3.981 20.969 2.237 79 HA LYS 78 HA LYS 78 2.535 22.468 0.363 80 HB2 LYS 78 HB2 LYS 78 3.709 19.852 0.522 81 HB3 LYS 78 HB3 LYS 78 2.114 19.732 -0.208 82 HG2 LYS 78 HG2 LYS 78 3.453 21.952 -1.366 83 HG3 LYS 78 HG3 LYS 78 4.543 20.564 -1.396 84 HD2 LYS 78 HD2 LYS 78 1.684 20.427 -2.331 85 HD3 LYS 78 HD3 LYS 78 3.028 20.826 -3.403 86 HE2 LYS 78 HE2 LYS 78 4.004 18.706 -3.140 87 HE3 LYS 78 HE3 LYS 78 3.031 18.340 -1.717 88 HZ1 LYS 78 HZ1 LYS 78 2.316 17.184 -3.776 89 HZ2 LYS 78 HZ2 LYS 78 1.904 18.685 -4.440 90 HZ3 LYS 78 HZ3 LYS 78 1.098 18.119 -3.064 91 H VAL 79 H VAL 79 1.463 19.760 2.416 92 HA VAL 79 HA VAL 79 -1.207 19.717 1.620 93 HB VAL 79 HB VAL 79 0.090 18.961 4.231 94 HG11 VAL 79 HG11 VAL 79 -2.800 18.715 3.420 95 HG12 VAL 79 HG12 VAL 79 -2.069 17.771 4.720 96 HG13 VAL 79 HG13 VAL 79 -2.140 19.530 4.837 97 HG21 VAL 79 HG21 VAL 79 0.533 17.659 2.114 98 HG22 VAL 79 HG22 VAL 79 -0.112 16.728 3.465 99 HG23 VAL 79 HG23 VAL 79 -1.171 17.204 2.138 100 H LEU 80 H LEU 80 0.248 21.391 4.410 101 HA LEU 80 HA LEU 80 -2.056 22.611 5.373 102 HB2 LEU 80 HB2 LEU 80 0.850 23.148 5.561 103 HB3 LEU 80 HB3 LEU 80 -0.237 24.458 6.017 104 HG LEU 80 HG LEU 80 -0.354 21.701 7.228 105 HD11 LEU 80 HD11 LEU 80 0.930 24.145 8.424 106 HD12 LEU 80 HD12 LEU 80 1.832 22.863 7.617 107 HD13 LEU 80 HD13 LEU 80 0.906 22.505 9.074 108 HD21 LEU 80 HD21 LEU 80 -2.400 23.090 7.345 109 HD22 LEU 80 HD22 LEU 80 -1.469 24.341 8.171 110 HD23 LEU 80 HD23 LEU 80 -1.693 22.762 8.928 111 H PHE 81 H PHE 81 0.355 23.927 3.107 112 HA PHE 81 HA PHE 81 -0.749 26.405 2.646 113 HB2 PHE 81 HB2 PHE 81 1.320 26.071 1.630 114 HB3 PHE 81 HB3 PHE 81 0.836 24.533 0.924 115 HD1 PHE 81 HD1 PHE 81 -0.313 28.084 0.773 116 HD2 PHE 81 HD2 PHE 81 0.670 24.532 -1.355 117 HE1 PHE 81 HE1 PHE 81 -0.810 29.223 -1.350 118 HE2 PHE 81 HE2 PHE 81 0.176 25.665 -3.482 119 HZ PHE 81 HZ PHE 81 -0.564 28.014 -3.481 120 H LYS 82 H LYS 82 -1.381 23.449 0.755 121 HA LYS 82 HA LYS 82 -3.379 24.553 -0.876 122 HB2 LYS 82 HB2 LYS 82 -2.327 22.492 -1.514 123 HB3 LYS 82 HB3 LYS 82 -2.848 21.704 -0.031 124 HG2 LYS 82 HG2 LYS 82 -5.109 22.738 -1.483 125 HG3 LYS 82 HG3 LYS 82 -4.131 21.681 -2.503 126 HD2 LYS 82 HD2 LYS 82 -4.595 20.689 0.224 127 HD3 LYS 82 HD3 LYS 82 -6.045 20.823 -0.775 128 HE2 LYS 82 HE2 LYS 82 -5.175 18.632 -1.089 129 HE3 LYS 82 HE3 LYS 82 -4.821 19.547 -2.554 130 HZ1 LYS 82 HZ1 LYS 82 -2.956 18.769 -0.393 131 HZ2 LYS 82 HZ2 LYS 82 -2.574 19.979 -1.512 132 HZ3 LYS 82 HZ3 LYS 82 -2.864 18.398 -2.041 133 H LEU 83 H LEU 83 -3.617 22.711 2.151 134 HA LEU 83 HA LEU 83 -6.372 22.530 2.349 135 HB2 LEU 83 HB2 LEU 83 -4.411 21.655 3.868 136 HB3 LEU 83 HB3 LEU 83 -4.769 23.111 4.793 137 HG LEU 83 HG LEU 83 -6.599 20.776 4.263 138 HD11 LEU 83 HD11 LEU 83 -6.419 20.294 6.521 139 HD12 LEU 83 HD12 LEU 83 -5.837 21.909 6.924 140 HD13 LEU 83 HD13 LEU 83 -4.775 20.772 6.094 141 HD21 LEU 83 HD21 LEU 83 -7.964 22.717 4.085 142 HD22 LEU 83 HD22 LEU 83 -7.186 23.469 5.477 143 HD23 LEU 83 HD23 LEU 83 -8.212 22.051 5.699 144 H MET 84 H MET 84 -4.235 25.168 3.362 145 HA MET 84 HA MET 84 -6.312 26.759 4.483 146 HB2 MET 84 HB2 MET 84 -3.624 27.682 3.458 147 HB3 MET 84 HB3 MET 84 -4.659 28.519 4.607 148 HG2 MET 84 HG2 MET 84 -4.083 25.868 5.538 149 HG3 MET 84 HG3 MET 84 -2.591 26.722 5.154 150 HE1 MET 84 HE1 MET 84 -2.150 28.976 5.706 151 HE2 MET 84 HE2 MET 84 -2.851 29.949 6.999 152 HE3 MET 84 HE3 MET 84 -1.629 28.732 7.373 153 H ASP 85 H ASP 85 -5.316 26.117 1.288 154 HA ASP 85 HA ASP 85 -6.542 28.566 0.251 155 HB2 ASP 85 HB2 ASP 85 -4.537 26.655 -0.737 156 HB3 ASP 85 HB3 ASP 85 -5.704 27.174 -1.952 157 H VAL 86 H VAL 86 -8.668 27.780 0.988 158 HA VAL 86 HA VAL 86 -9.885 25.467 -0.057 159 HB VAL 86 HB VAL 86 -10.752 26.754 1.886 160 HG11 VAL 86 HG11 VAL 86 -12.393 28.608 0.456 161 HG12 VAL 86 HG12 VAL 86 -11.218 28.920 1.735 162 HG13 VAL 86 HG13 VAL 86 -10.700 28.891 0.049 163 HG21 VAL 86 HG21 VAL 86 -12.937 26.101 1.551 164 HG22 VAL 86 HG22 VAL 86 -12.954 26.640 -0.128 165 HG23 VAL 86 HG23 VAL 86 -12.102 25.161 0.315 166 H ASP 87 H ASP 87 -8.988 28.339 -1.576 167 HA ASP 87 HA ASP 87 -11.089 28.400 -3.545 168 HB2 ASP 87 HB2 ASP 87 -9.485 30.046 -4.677 169 HB3 ASP 87 HB3 ASP 87 -10.126 30.505 -3.102 170 H GLY 88 H GLY 88 -8.571 26.340 -3.042 171 HA2 GLY 88 HA2 GLY 88 -7.337 24.922 -4.376 172 HA3 GLY 88 HA3 GLY 88 -8.829 24.834 -5.299 173 H ASP 89 H ASP 89 -6.550 27.522 -4.866 174 HA ASP 89 HA ASP 89 -6.465 27.850 -7.763 175 HB2 ASP 89 HB2 ASP 89 -5.155 29.955 -7.121 176 HB3 ASP 89 HB3 ASP 89 -6.855 29.900 -6.664 177 H GLY 90 H GLY 90 -4.531 26.667 -5.171 178 HA2 GLY 90 HA2 GLY 90 -2.557 25.457 -5.301 179 HA3 GLY 90 HA3 GLY 90 -2.502 25.797 -7.024 180 H LYS 91 H LYS 91 -2.969 28.716 -5.698 181 HA LYS 91 HA LYS 91 -0.166 29.211 -5.020 182 HB2 LYS 91 HB2 LYS 91 -0.338 31.315 -6.502 183 HB3 LYS 91 HB3 LYS 91 -0.051 29.768 -7.286 184 HG2 LYS 91 HG2 LYS 91 -1.888 29.977 -8.503 185 HG3 LYS 91 HG3 LYS 91 -2.872 30.260 -7.065 186 HD2 LYS 91 HD2 LYS 91 -2.152 32.635 -7.104 187 HD3 LYS 91 HD3 LYS 91 -1.301 32.317 -8.617 188 HE2 LYS 91 HE2 LYS 91 -4.252 31.858 -8.208 189 HE3 LYS 91 HE3 LYS 91 -3.570 33.336 -8.886 190 HZ1 LYS 91 HZ1 LYS 91 -2.760 32.169 -10.746 191 HZ2 LYS 91 HZ2 LYS 91 -4.348 31.628 -10.532 192 HZ3 LYS 91 HZ3 LYS 91 -3.050 30.658 -10.043 193 H LEU 92 H LEU 92 0.151 30.848 -3.568 194 HA LEU 92 HA LEU 92 -2.272 31.964 -2.365 195 HB2 LEU 92 HB2 LEU 92 -1.151 31.181 -0.581 196 HB3 LEU 92 HB3 LEU 92 0.402 31.226 -1.411 197 HG LEU 92 HG LEU 92 -0.819 33.792 -0.506 198 HD11 LEU 92 HD11 LEU 92 -0.315 31.624 1.255 199 HD12 LEU 92 HD12 LEU 92 -0.773 33.281 1.648 200 HD13 LEU 92 HD13 LEU 92 0.930 32.846 1.513 201 HD21 LEU 92 HD21 LEU 92 1.253 34.613 -0.806 202 HD22 LEU 92 HD22 LEU 92 1.470 33.183 -1.816 203 HD23 LEU 92 HD23 LEU 92 2.033 33.177 -0.144 204 H THR 93 H THR 93 -2.660 34.125 -2.184 205 HA THR 93 HA THR 93 -1.024 35.865 -3.867 206 HB THR 93 HB THR 93 -3.396 35.931 -4.329 207 HG1 THR 93 HG1 THR 93 -3.576 38.122 -4.312 208 HG21 THR 93 HG21 THR 93 -3.606 35.869 -1.456 209 HG22 THR 93 HG22 THR 93 -4.849 35.584 -2.673 210 HG23 THR 93 HG23 THR 93 -4.523 37.223 -2.114 211 H LYS 94 H LYS 94 -0.411 37.990 -3.150 212 HA LYS 94 HA LYS 94 1.072 38.168 -0.908 213 HB2 LYS 94 HB2 LYS 94 0.658 39.898 -2.817 214 HB3 LYS 94 HB3 LYS 94 -0.531 40.573 -1.712 215 HG2 LYS 94 HG2 LYS 94 1.551 40.411 -0.046 216 HG3 LYS 94 HG3 LYS 94 2.417 40.590 -1.572 217 HD2 LYS 94 HD2 LYS 94 0.151 42.420 -1.251 218 HD3 LYS 94 HD3 LYS 94 1.441 42.650 -0.069 219 HE2 LYS 94 HE2 LYS 94 2.855 43.473 -1.603 220 HE3 LYS 94 HE3 LYS 94 2.392 42.275 -2.810 221 HZ1 LYS 94 HZ1 LYS 94 0.956 44.788 -2.153 222 HZ2 LYS 94 HZ2 LYS 94 0.352 43.596 -3.191 223 HZ3 LYS 94 HZ3 LYS 94 1.771 44.426 -3.591 224 H GLU 95 H GLU 95 -2.272 39.406 -1.076 225 HA GLU 95 HA GLU 95 -2.596 40.108 1.566 226 HB2 GLU 95 HB2 GLU 95 -4.738 38.822 -0.133 227 HB3 GLU 95 HB3 GLU 95 -4.974 39.922 1.219 228 HG2 GLU 95 HG2 GLU 95 -3.639 41.606 -0.187 229 HG3 GLU 95 HG3 GLU 95 -3.969 40.518 -1.534 230 H GLU 96 H GLU 96 -3.038 36.925 0.079 231 HA GLU 96 HA GLU 96 -3.979 35.632 2.416 232 HB2 GLU 96 HB2 GLU 96 -4.285 34.743 0.121 233 HB3 GLU 96 HB3 GLU 96 -2.558 34.423 0.036 234 HG2 GLU 96 HG2 GLU 96 -2.688 32.758 1.709 235 HG3 GLU 96 HG3 GLU 96 -4.335 33.221 2.137 236 H VAL 97 H VAL 97 -0.772 36.170 1.075 237 HA VAL 97 HA VAL 97 0.682 34.423 2.711 238 HB VAL 97 HB VAL 97 1.324 36.205 0.713 239 HG11 VAL 97 HG11 VAL 97 2.739 37.116 3.214 240 HG12 VAL 97 HG12 VAL 97 2.982 37.724 1.575 241 HG13 VAL 97 HG13 VAL 97 1.453 38.012 2.406 242 HG21 VAL 97 HG21 VAL 97 3.056 34.814 0.548 243 HG22 VAL 97 HG22 VAL 97 3.681 35.294 2.126 244 HG23 VAL 97 HG23 VAL 97 2.458 34.028 2.009 245 H THR 98 H THR 98 -0.552 37.652 3.285 246 HA THR 98 HA THR 98 0.930 38.094 5.692 247 HB THR 98 HB THR 98 -1.519 39.475 4.585 248 HG1 THR 98 HG1 THR 98 1.033 40.634 4.825 249 HG21 THR 98 HG21 THR 98 -0.837 41.287 6.237 250 HG22 THR 98 HG22 THR 98 0.134 40.049 7.034 251 HG23 THR 98 HG23 THR 98 -1.615 39.858 6.914 252 H SER 99 H SER 99 -2.364 37.029 4.940 253 HA SER 99 HA SER 99 -3.215 36.877 7.650 254 HB2 SER 99 HB2 SER 99 -4.370 35.361 5.303 255 HB3 SER 99 HB3 SER 99 -5.188 35.801 6.802 256 HG SER 99 HG SER 99 -5.688 37.200 5.025 257 H PHE 100 H PHE 100 -1.968 34.504 5.338 258 HA PHE 100 HA PHE 100 -2.272 32.235 6.974 259 HB2 PHE 100 HB2 PHE 100 -0.535 32.878 4.611 260 HB3 PHE 100 HB3 PHE 100 -0.340 31.354 5.471 261 HD1 PHE 100 HD2 PHE 100 -3.676 32.659 5.460 262 HD2 PHE 100 HD1 PHE 100 -0.893 30.326 3.240 263 HE1 PHE 100 HE2 PHE 100 -5.528 31.693 4.160 264 HE2 PHE 100 HE1 PHE 100 -2.741 29.358 1.935 265 HZ PHE 100 HZ PHE 100 -5.062 30.040 2.395 266 H PHE 101 H PHE 101 0.491 34.406 6.471 267 HA PHE 101 HA PHE 101 2.145 33.027 8.363 268 HB2 PHE 101 HB2 PHE 101 2.717 34.666 6.311 269 HB3 PHE 101 HB3 PHE 101 2.771 35.834 7.628 270 HD1 PHE 101 HD1 PHE 101 4.245 35.234 9.650 271 HD2 PHE 101 HD2 PHE 101 4.559 33.347 5.848 272 HE1 PHE 101 HE1 PHE 101 6.528 34.503 10.205 273 HE2 PHE 101 HE2 PHE 101 6.842 32.612 6.397 274 HZ PHE 101 HZ PHE 101 7.829 33.188 8.579 275 H LYS 102 H LYS 102 -0.199 35.552 8.505 276 HA LYS 102 HA LYS 102 0.555 37.007 10.724 277 HB2 LYS 102 HB2 LYS 102 -1.905 36.487 9.282 278 HB3 LYS 102 HB3 LYS 102 -2.207 36.663 11.005 279 HG2 LYS 102 HG2 LYS 102 -0.429 38.683 9.812 280 HG3 LYS 102 HG3 LYS 102 -2.111 38.719 9.275 281 HD2 LYS 102 HD2 LYS 102 -2.134 38.364 12.080 282 HD3 LYS 102 HD3 LYS 102 -0.985 39.657 11.728 283 HE2 LYS 102 HE2 LYS 102 -2.970 40.820 11.909 284 HE3 LYS 102 HE3 LYS 102 -2.871 40.543 10.171 285 HZ1 LYS 102 HZ1 LYS 102 -4.453 38.839 10.289 286 HZ2 LYS 102 HZ2 LYS 102 -5.076 40.068 11.270 287 HZ3 LYS 102 HZ3 LYS 102 -4.343 38.714 11.972 288 H LYS 103 H LYS 103 -0.642 33.749 10.545 289 HA LYS 103 HA LYS 103 -1.558 33.346 13.135 290 HB2 LYS 103 HB2 LYS 103 -0.185 31.501 11.190 291 HB3 LYS 103 HB3 LYS 103 -0.763 30.942 12.754 292 HG2 LYS 103 HG2 LYS 103 -2.552 32.318 10.774 293 HG3 LYS 103 HG3 LYS 103 -2.291 30.573 10.773 294 HD2 LYS 103 HD2 LYS 103 -3.204 32.084 13.212 295 HD3 LYS 103 HD3 LYS 103 -4.328 31.405 12.033 296 HE2 LYS 103 HE2 LYS 103 -2.254 29.556 12.990 297 HE3 LYS 103 HE3 LYS 103 -3.401 30.088 14.217 298 HZ1 LYS 103 HZ1 LYS 103 -4.050 28.036 12.994 299 HZ2 LYS 103 HZ2 LYS 103 -4.219 28.970 11.595 300 HZ3 LYS 103 HZ3 LYS 103 -5.204 29.272 12.937 301 H HIS 104 H HIS 104 1.664 33.791 11.969 302 HA HIS 104 HA HIS 104 2.848 32.827 14.457 303 HB2 HIS 104 HB2 HIS 104 3.732 32.714 11.872 304 HB3 HIS 104 HB3 HIS 104 4.609 34.115 12.481 305 HD1 HIS 104 HD1 HIS 104 5.861 31.281 11.732 306 HD2 HIS 104 HD2 HIS 104 5.024 32.684 15.552 307 HE1 HIS 104 HE1 HIS 104 7.373 29.987 13.270 308 H GLY 105 H GLY 105 1.882 35.755 12.930 309 HA2 GLY 105 HA2 GLY 105 1.618 37.782 14.132 310 HA3 GLY 105 HA3 GLY 105 2.871 37.253 15.246 311 H ILE 106 H ILE 106 4.223 36.475 12.467 312 HA ILE 106 HA ILE 106 5.708 38.981 12.324 313 HB ILE 106 HB ILE 106 6.251 36.285 11.077 314 HG12 ILE 106 HG12 ILE 106 6.579 36.294 13.486 315 HG13 ILE 106 HG13 ILE 106 8.145 36.250 12.682 316 HG21 ILE 106 HG21 ILE 106 8.538 37.358 10.659 317 HG22 ILE 106 HG22 ILE 106 7.211 37.809 9.589 318 HG23 ILE 106 HG23 ILE 106 7.711 38.899 10.883 319 HD11 ILE 106 HD11 ILE 106 6.835 38.614 13.995 320 HD12 ILE 106 HD12 ILE 106 8.287 37.757 14.515 321 HD13 ILE 106 HD13 ILE 106 8.308 38.709 13.031 322 H GLU 107 H GLU 107 5.412 40.432 10.770 323 HA GLU 107 HA GLU 107 3.719 39.723 8.490 324 HB2 GLU 107 HB2 GLU 107 4.573 42.387 9.626 325 HB3 GLU 107 HB3 GLU 107 3.654 42.220 8.136 326 HG2 GLU 107 HG2 GLU 107 2.394 40.724 10.227 327 HG3 GLU 107 HG3 GLU 107 2.676 42.382 10.755 328 H LYS 108 H LYS 108 6.921 39.797 9.186 329 HA LYS 108 HA LYS 108 8.147 41.183 7.113 330 HB2 LYS 108 HB2 LYS 108 9.233 40.027 9.107 331 HB3 LYS 108 HB3 LYS 108 9.129 38.537 8.176 332 HG2 LYS 108 HG2 LYS 108 10.430 39.720 6.367 333 HG3 LYS 108 HG3 LYS 108 10.713 41.008 7.539 334 HD2 LYS 108 HD2 LYS 108 11.341 38.653 8.893 335 HD3 LYS 108 HD3 LYS 108 12.010 38.439 7.273 336 HE2 LYS 108 HE2 LYS 108 13.273 40.463 7.457 337 HE3 LYS 108 HE3 LYS 108 12.470 40.888 8.967 338 HZ1 LYS 108 HZ1 LYS 108 13.702 38.324 9.117 339 HZ2 LYS 108 HZ2 LYS 108 13.909 39.673 10.115 340 HZ3 LYS 108 HZ3 LYS 108 14.827 39.518 8.702 341 H VAL 109 H VAL 109 6.365 38.222 7.057 342 HA VAL 109 HA VAL 109 7.346 36.915 4.838 343 HB VAL 109 HB VAL 109 5.494 36.099 6.301 344 HG11 VAL 109 HG11 VAL 109 3.835 37.988 4.635 345 HG12 VAL 109 HG12 VAL 109 3.190 36.756 5.720 346 HG13 VAL 109 HG13 VAL 109 4.131 38.099 6.369 347 HG21 VAL 109 HG21 VAL 109 5.945 34.854 4.336 348 HG22 VAL 109 HG22 VAL 109 4.194 35.046 4.410 349 HG23 VAL 109 HG23 VAL 109 5.144 36.046 3.311 350 H ALA 110 H ALA 110 5.467 39.848 4.995 351 HA ALA 110 HA ALA 110 4.629 39.933 2.295 352 HB1 ALA 110 HB1 ALA 110 3.565 41.773 2.949 353 HB2 ALA 110 HB2 ALA 110 4.228 41.483 4.559 354 HB3 ALA 110 HB3 ALA 110 5.069 42.554 3.438 355 H GLU 111 H GLU 111 7.423 41.362 3.967 356 HA GLU 111 HA GLU 111 8.497 42.552 1.607 357 HB2 GLU 111 HB2 GLU 111 8.922 43.190 4.072 358 HB3 GLU 111 HB3 GLU 111 10.100 41.886 4.062 359 HG2 GLU 111 HG2 GLU 111 11.088 44.105 3.648 360 HG3 GLU 111 HG3 GLU 111 11.369 42.959 2.339 361 H GLN 112 H GLN 112 8.860 39.468 3.204 362 HA GLN 112 HA GLN 112 11.188 38.661 1.753 363 HB2 GLN 112 HB2 GLN 112 9.195 36.857 3.122 364 HB3 GLN 112 HB3 GLN 112 10.883 36.516 2.768 365 HG2 GLN 112 HG2 GLN 112 10.837 38.856 4.332 366 HG3 GLN 112 HG3 GLN 112 9.732 37.709 5.087 367 HE21 GLN 112 HE21 GLN 112 10.536 36.020 6.185 368 HE22 GLN 112 HE22 GLN 112 12.219 35.660 6.340 369 H VAL 113 H VAL 113 7.717 37.992 1.463 370 HA VAL 113 HA VAL 113 7.938 36.242 -0.750 371 HB VAL 113 HB VAL 113 5.935 36.473 0.775 372 HG11 VAL 113 HG11 VAL 113 5.399 38.863 -0.985 373 HG12 VAL 113 HG12 VAL 113 4.247 38.147 0.144 374 HG13 VAL 113 HG13 VAL 113 5.729 38.892 0.746 375 HG21 VAL 113 HG21 VAL 113 6.133 35.570 -1.775 376 HG22 VAL 113 HG22 VAL 113 4.695 35.405 -0.768 377 HG23 VAL 113 HG23 VAL 113 4.813 36.730 -1.926 378 H MET 114 H MET 114 7.724 39.720 -0.450 379 HA MET 114 HA MET 114 7.205 40.167 -3.243 380 HB2 MET 114 HB2 MET 114 7.579 41.827 -0.830 381 HB3 MET 114 HB3 MET 114 8.100 42.566 -2.339 382 HG2 MET 114 HG2 MET 114 5.472 41.285 -2.464 383 HG3 MET 114 HG3 MET 114 5.574 42.642 -1.345 384 HE1 MET 114 HE1 MET 114 5.999 41.190 -4.627 385 HE2 MET 114 HE2 MET 114 4.882 42.260 -5.477 386 HE3 MET 114 HE3 MET 114 6.623 42.456 -5.685 387 H LYS 115 H LYS 115 10.020 40.231 -1.120 388 HA LYS 115 HA LYS 115 11.796 41.158 -3.184 389 HB2 LYS 115 HB2 LYS 115 12.264 40.069 -0.408 390 HB3 LYS 115 HB3 LYS 115 13.572 40.561 -1.476 391 HG2 LYS 115 HG2 LYS 115 11.337 42.368 -0.585 392 HG3 LYS 115 HG3 LYS 115 12.923 42.280 0.183 393 HD2 LYS 115 HD2 LYS 115 12.428 42.991 -2.708 394 HD3 LYS 115 HD3 LYS 115 12.742 44.153 -1.416 395 HE2 LYS 115 HE2 LYS 115 14.898 42.856 -1.005 396 HE3 LYS 115 HE3 LYS 115 14.591 42.071 -2.553 397 HZ1 LYS 115 HZ1 LYS 115 14.444 44.971 -2.548 398 HZ2 LYS 115 HZ2 LYS 115 15.110 43.922 -3.695 399 HZ3 LYS 115 HZ3 LYS 115 15.984 44.316 -2.302 400 H ALA 116 H ALA 116 10.563 38.127 -2.153 401 HA ALA 116 HA ALA 116 12.706 36.636 -3.470 402 HB1 ALA 116 HB1 ALA 116 12.046 35.772 -1.333 403 HB2 ALA 116 HB2 ALA 116 10.354 35.718 -1.826 404 HB3 ALA 116 HB3 ALA 116 11.526 34.638 -2.578 405 H ASP 117 H ASP 117 10.122 38.225 -4.519 406 HA ASP 117 HA ASP 117 9.059 36.152 -6.276 407 HB2 ASP 117 HB2 ASP 117 7.838 38.242 -5.027 408 HB3 ASP 117 HB3 ASP 117 8.128 38.930 -6.622 409 H ALA 118 H ALA 118 10.971 35.839 -7.528 410 HA ALA 118 HA ALA 118 12.127 37.994 -9.020 411 HB1 ALA 118 HB1 ALA 118 12.445 35.006 -9.254 412 HB2 ALA 118 HB2 ALA 118 13.379 36.186 -10.175 413 HB3 ALA 118 HB3 ALA 118 13.516 36.131 -8.417 414 H ASN 119 H ASN 119 9.394 36.002 -9.424 415 HA ASN 119 HA ASN 119 9.309 36.473 -12.316 416 HB2 ASN 119 HB2 ASN 119 7.188 34.958 -12.030 417 HB3 ASN 119 HB3 ASN 119 8.794 34.237 -11.994 418 HD21 ASN 119 HD21 ASN 119 8.178 32.491 -10.771 419 HD22 ASN 119 HD22 ASN 119 7.746 32.619 -9.103 420 H GLY 120 H GLY 120 8.366 37.979 -9.553 421 HA2 GLY 120 HA2 GLY 120 6.745 39.523 -9.014 422 HA3 GLY 120 HA3 GLY 120 6.872 39.969 -10.710 423 H ASP 121 H ASP 121 5.788 36.803 -9.733 424 HA ASP 121 HA ASP 121 3.387 37.026 -11.220 425 HB2 ASP 121 HB2 ASP 121 2.830 34.833 -10.002 426 HB3 ASP 121 HB3 ASP 121 4.257 34.849 -11.035 427 H GLY 122 H GLY 122 4.224 37.839 -7.988 428 HA2 GLY 122 HA2 GLY 122 2.971 39.016 -6.435 429 HA3 GLY 122 HA3 GLY 122 1.594 38.915 -7.521 430 H TYR 123 H TYR 123 2.746 35.853 -7.229 431 HA TYR 123 HA TYR 123 1.398 35.224 -4.726 432 HB2 TYR 123 HB2 TYR 123 0.014 33.464 -5.860 433 HB3 TYR 123 HB3 TYR 123 -0.453 35.116 -6.250 434 HD1 TYR 123 HD1 TYR 123 1.694 32.346 -7.542 435 HD2 TYR 123 HD2 TYR 123 -0.761 35.695 -8.472 436 HE1 TYR 123 HE1 TYR 123 1.912 31.833 -9.937 437 HE2 TYR 123 HE2 TYR 123 -0.551 35.191 -10.869 438 HH TYR 123 HH TYR 123 0.240 32.460 -12.113 439 H ILE 124 H ILE 124 1.687 32.948 -4.099 440 HA ILE 124 HA ILE 124 4.109 31.781 -5.308 441 HB ILE 124 HB ILE 124 5.045 31.318 -3.271 442 HG12 ILE 124 HG12 ILE 124 2.254 31.412 -2.118 443 HG13 ILE 124 HG13 ILE 124 3.277 29.996 -2.326 444 HG21 ILE 124 HG21 ILE 124 3.486 33.575 -2.144 445 HG22 ILE 124 HG22 ILE 124 5.228 33.311 -2.188 446 HG23 ILE 124 HG23 ILE 124 4.383 33.859 -3.636 447 HD11 ILE 124 HD11 ILE 124 4.825 30.877 -0.652 448 HD12 ILE 124 HD12 ILE 124 3.778 32.281 -0.435 449 HD13 ILE 124 HD13 ILE 124 3.196 30.673 -0.006 450 H THR 125 H THR 125 3.835 29.816 -6.115 451 HA THR 125 HA THR 125 1.399 28.344 -5.536 452 HB THR 125 HB THR 125 2.158 28.550 -7.872 453 HG1 THR 125 HG1 THR 125 2.286 26.070 -8.142 454 HG21 THR 125 HG21 THR 125 4.129 26.872 -8.391 455 HG22 THR 125 HG22 THR 125 4.604 27.275 -6.742 456 HG23 THR 125 HG23 THR 125 4.452 28.548 -7.952 457 H LEU 126 H LEU 126 1.951 25.771 -5.694 458 HA LEU 126 HA LEU 126 2.772 24.983 -3.200 459 HB2 LEU 126 HB2 LEU 126 3.088 23.372 -5.729 460 HB3 LEU 126 HB3 LEU 126 2.985 22.739 -4.087 461 HG LEU 126 HG LEU 126 0.703 24.350 -5.110 462 HD11 LEU 126 HD11 LEU 126 -0.069 22.853 -6.598 463 HD12 LEU 126 HD12 LEU 126 0.570 21.474 -5.704 464 HD13 LEU 126 HD13 LEU 126 1.633 22.416 -6.749 465 HD21 LEU 126 HD21 LEU 126 -0.234 23.550 -3.266 466 HD22 LEU 126 HD22 LEU 126 1.282 22.738 -2.870 467 HD23 LEU 126 HD23 LEU 126 0.047 21.895 -3.807 468 H GLU 127 H GLU 127 4.741 25.055 -6.163 469 HA GLU 127 HA GLU 127 7.111 24.080 -5.053 470 HB2 GLU 127 HB2 GLU 127 6.400 25.675 -7.455 471 HB3 GLU 127 HB3 GLU 127 8.087 25.687 -6.962 472 HG2 GLU 127 HG2 GLU 127 6.432 23.264 -7.628 473 HG3 GLU 127 HG3 GLU 127 7.711 23.971 -8.612 474 H GLU 128 H GLU 128 6.158 27.471 -5.613 475 HA GLU 128 HA GLU 128 8.369 28.676 -4.436 476 HB2 GLU 128 HB2 GLU 128 5.567 29.784 -4.306 477 HB3 GLU 128 HB3 GLU 128 7.079 30.682 -4.338 478 HG2 GLU 128 HG2 GLU 128 7.396 29.524 -6.648 479 HG3 GLU 128 HG3 GLU 128 5.650 29.302 -6.558 480 H PHE 129 H PHE 129 5.351 27.561 -2.975 481 HA PHE 129 HA PHE 129 5.731 28.608 -0.409 482 HB2 PHE 129 HB2 PHE 129 3.663 27.433 -1.462 483 HB3 PHE 129 HB3 PHE 129 4.403 25.953 -0.860 484 HD1 PHE 129 HD1 PHE 129 4.878 25.762 1.610 485 HD2 PHE 129 HD2 PHE 129 2.438 28.831 -0.046 486 HE1 PHE 129 HE1 PHE 129 3.888 26.167 3.827 487 HE2 PHE 129 HE2 PHE 129 1.445 29.242 2.167 488 HZ PHE 129 HZ PHE 129 2.171 27.909 4.107 489 H LEU 130 H LEU 130 6.821 25.580 -1.859 490 HA LEU 130 HA LEU 130 7.905 24.498 0.538 491 HB2 LEU 130 HB2 LEU 130 7.438 22.910 -1.084 492 HB3 LEU 130 HB3 LEU 130 8.158 23.872 -2.372 493 HG LEU 130 HG LEU 130 10.395 23.351 -1.487 494 HD11 LEU 130 HD11 LEU 130 10.520 22.765 0.658 495 HD12 LEU 130 HD12 LEU 130 10.014 21.158 0.136 496 HD13 LEU 130 HD13 LEU 130 8.816 22.313 0.720 497 HD21 LEU 130 HD21 LEU 130 8.702 21.714 -2.934 498 HD22 LEU 130 HD22 LEU 130 9.379 20.640 -1.709 499 HD23 LEU 130 HD23 LEU 130 10.451 21.540 -2.784 500 H GLU 131 H GLU 131 9.039 26.766 -1.806 501 HA GLU 131 HA GLU 131 11.821 26.500 -1.052 502 HB2 GLU 131 HB2 GLU 131 10.844 27.187 -3.370 503 HB3 GLU 131 HB3 GLU 131 10.716 28.785 -2.651 504 HG2 GLU 131 HG2 GLU 131 13.320 27.465 -2.328 505 HG3 GLU 131 HG3 GLU 131 12.877 27.883 -3.982 506 H PHE 132 H PHE 132 9.080 28.205 0.033 507 HA PHE 132 HA PHE 132 10.771 30.096 1.527 508 HB2 PHE 132 HB2 PHE 132 8.454 30.539 -0.021 509 HB3 PHE 132 HB3 PHE 132 7.971 30.750 1.660 510 HD1 PHE 132 HD1 PHE 132 11.189 31.532 -0.035 511 HD2 PHE 132 HD2 PHE 132 7.753 33.026 1.985 512 HE1 PHE 132 HE1 PHE 132 12.171 33.789 -0.040 513 HE2 PHE 132 HE2 PHE 132 8.728 35.285 1.983 514 HZ PHE 132 HZ PHE 132 10.940 35.668 0.968 515 H SER 133 H SER 133 11.120 28.125 2.918 516 HA SER 133 HA SER 133 9.386 28.306 5.209 517 HB2 SER 133 HB2 SER 133 9.548 25.761 3.592 518 HB3 SER 133 HB3 SER 133 9.047 25.786 5.283 519 HG SER 133 HG SER 133 7.777 26.939 3.043 520 H LEU 134 H LEU 134 11.216 28.987 6.305 521 HA LEU 134 HA LEU 134 12.742 27.078 7.616 522 HB2 LEU 134 HB2 LEU 134 13.674 27.457 5.019 523 HB3 LEU 134 HB3 LEU 134 14.775 28.389 6.031 524 HG LEU 134 HG LEU 134 14.193 25.599 6.861 525 HD11 LEU 134 HD11 LEU 134 14.777 25.991 4.230 526 HD12 LEU 134 HD12 LEU 134 15.180 24.544 5.153 527 HD13 LEU 134 HD13 LEU 134 16.385 25.813 4.934 528 HD21 LEU 134 HD21 LEU 134 15.844 27.537 7.771 529 HD22 LEU 134 HD22 LEU 134 16.929 26.671 6.681 530 HD23 LEU 134 HD23 LEU 134 16.126 25.810 7.995 Start of MODEL 10 1 H GLY 67 H GLY 67 2.504 0.327 0.609 2 HA2 GLY 67 HA2 GLY 67 3.606 0.106 -1.417 3 HA3 GLY 67 HA3 GLY 67 2.055 -0.193 -2.190 4 H GLN 68 H GLN 68 1.077 2.378 -0.863 5 HA GLN 68 HA GLN 68 1.559 4.071 -3.092 6 HB2 GLN 68 HB2 GLN 68 -0.048 4.147 -0.642 7 HB3 GLN 68 HB3 GLN 68 0.538 5.726 -1.148 8 HG2 GLN 68 HG2 GLN 68 -1.721 5.074 -2.012 9 HG3 GLN 68 HG3 GLN 68 -0.551 5.570 -3.234 10 HE21 GLN 68 HE21 GLN 68 -1.386 2.566 -1.530 11 HE22 GLN 68 HE22 GLN 68 -1.462 1.584 -2.948 12 H ASP 69 H ASP 69 3.134 5.490 -3.442 13 HA ASP 69 HA ASP 69 5.326 5.744 -1.670 14 HB2 ASP 69 HB2 ASP 69 4.543 6.920 -4.286 15 HB3 ASP 69 HB3 ASP 69 5.761 7.783 -3.351 16 H LEU 70 H LEU 70 5.672 7.096 -0.033 17 HA LEU 70 HA LEU 70 3.679 8.774 0.987 18 HB2 LEU 70 HB2 LEU 70 6.563 8.332 1.545 19 HB3 LEU 70 HB3 LEU 70 5.805 9.774 2.218 20 HG LEU 70 HG LEU 70 4.035 7.984 3.066 21 HD11 LEU 70 HD11 LEU 70 6.371 6.416 2.237 22 HD12 LEU 70 HD12 LEU 70 4.703 5.916 2.510 23 HD13 LEU 70 HD13 LEU 70 5.804 6.094 3.875 24 HD21 LEU 70 HD21 LEU 70 6.168 9.433 4.169 25 HD22 LEU 70 HD22 LEU 70 6.286 7.804 4.837 26 HD23 LEU 70 HD23 LEU 70 4.792 8.725 5.016 27 H SER 71 H SER 71 4.354 11.173 1.594 28 HA SER 71 HA SER 71 4.836 12.515 -0.974 29 HB2 SER 71 HB2 SER 71 3.379 13.373 1.527 30 HB3 SER 71 HB3 SER 71 3.799 14.508 0.244 31 HG SER 71 HG SER 71 1.786 12.699 0.349 32 H ASP 72 H ASP 72 6.384 14.072 -1.212 33 HA ASP 72 HA ASP 72 8.786 13.973 -0.057 34 HB2 ASP 72 HB2 ASP 72 7.542 15.767 -1.753 35 HB3 ASP 72 HB3 ASP 72 8.035 16.777 -0.397 36 H ASP 73 H ASP 73 9.913 14.911 1.659 37 HA ASP 73 HA ASP 73 8.786 14.906 4.140 38 HB2 ASP 73 HB2 ASP 73 11.050 16.748 3.345 39 HB3 ASP 73 HB3 ASP 73 10.733 16.082 4.945 40 H LYS 74 H LYS 74 8.537 17.376 1.751 41 HA LYS 74 HA LYS 74 7.689 19.429 3.604 42 HB2 LYS 74 HB2 LYS 74 7.545 20.864 1.733 43 HB3 LYS 74 HB3 LYS 74 8.945 19.844 1.430 44 HG2 LYS 74 HG2 LYS 74 6.798 18.488 0.280 45 HG3 LYS 74 HG3 LYS 74 6.551 20.188 -0.128 46 HD2 LYS 74 HD2 LYS 74 8.759 20.328 -1.083 47 HD3 LYS 74 HD3 LYS 74 9.135 18.690 -0.547 48 HE2 LYS 74 HE2 LYS 74 7.113 17.985 -1.968 49 HE3 LYS 74 HE3 LYS 74 7.250 19.581 -2.704 50 HZ1 LYS 74 HZ1 LYS 74 9.778 18.300 -2.601 51 HZ2 LYS 74 HZ2 LYS 74 8.933 18.886 -3.944 52 HZ3 LYS 74 HZ3 LYS 74 8.653 17.313 -3.390 53 H ILE 75 H ILE 75 6.237 16.734 2.911 54 HA ILE 75 HA ILE 75 3.788 17.205 1.736 55 HB ILE 75 HB ILE 75 4.421 14.969 2.350 56 HG12 ILE 75 HG12 ILE 75 2.349 14.174 3.342 57 HG13 ILE 75 HG13 ILE 75 2.019 15.770 4.005 58 HG21 ILE 75 HG21 ILE 75 4.099 15.754 5.241 59 HG22 ILE 75 HG22 ILE 75 4.630 14.198 4.607 60 HG23 ILE 75 HG23 ILE 75 5.651 15.622 4.415 61 HD11 ILE 75 HD11 ILE 75 1.028 14.796 1.667 62 HD12 ILE 75 HD12 ILE 75 1.145 16.505 2.090 63 HD13 ILE 75 HD13 ILE 75 2.404 15.749 1.113 64 H GLY 76 H GLY 76 4.767 17.797 5.088 65 HA2 GLY 76 HA2 GLY 76 2.249 18.514 6.102 66 HA3 GLY 76 HA3 GLY 76 3.793 19.031 6.760 67 H LEU 77 H LEU 77 4.858 20.617 4.886 68 HA LEU 77 HA LEU 77 3.519 23.041 5.208 69 HB2 LEU 77 HB2 LEU 77 5.422 22.479 2.954 70 HB3 LEU 77 HB3 LEU 77 5.151 23.999 3.803 71 HG LEU 77 HG LEU 77 6.570 21.558 4.861 72 HD11 LEU 77 HD11 LEU 77 8.285 22.524 3.802 73 HD12 LEU 77 HD12 LEU 77 8.231 23.717 5.099 74 HD13 LEU 77 HD13 LEU 77 7.411 24.039 3.572 75 HD21 LEU 77 HD21 LEU 77 5.668 22.309 6.809 76 HD22 LEU 77 HD22 LEU 77 5.465 23.957 6.211 77 HD23 LEU 77 HD23 LEU 77 7.058 23.391 6.718 78 H LYS 78 H LYS 78 3.608 20.837 2.434 79 HA LYS 78 HA LYS 78 2.082 22.427 0.684 80 HB2 LYS 78 HB2 LYS 78 2.769 19.521 0.838 81 HB3 LYS 78 HB3 LYS 78 1.529 20.041 -0.296 82 HG2 LYS 78 HG2 LYS 78 3.443 21.814 -0.899 83 HG3 LYS 78 HG3 LYS 78 4.446 20.473 -0.341 84 HD2 LYS 78 HD2 LYS 78 2.337 19.532 -2.068 85 HD3 LYS 78 HD3 LYS 78 3.287 20.789 -2.865 86 HE2 LYS 78 HE2 LYS 78 4.592 19.016 -3.405 87 HE3 LYS 78 HE3 LYS 78 5.279 19.348 -1.816 88 HZ1 LYS 78 HZ1 LYS 78 4.480 16.956 -2.491 89 HZ2 LYS 78 HZ2 LYS 78 2.982 17.541 -1.969 90 HZ3 LYS 78 HZ3 LYS 78 4.299 17.525 -0.908 91 H VAL 79 H VAL 79 1.156 19.936 3.020 92 HA VAL 79 HA VAL 79 -1.566 19.782 2.379 93 HB VAL 79 HB VAL 79 -0.120 19.303 4.980 94 HG11 VAL 79 HG11 VAL 79 -3.030 18.909 4.315 95 HG12 VAL 79 HG12 VAL 79 -2.223 18.109 5.665 96 HG13 VAL 79 HG13 VAL 79 -2.338 19.868 5.622 97 HG21 VAL 79 HG21 VAL 79 0.258 17.246 4.212 98 HG22 VAL 79 HG22 VAL 79 -1.418 17.051 3.698 99 HG23 VAL 79 HG23 VAL 79 -0.253 17.836 2.631 100 H LEU 80 H LEU 80 0.022 21.675 4.952 101 HA LEU 80 HA LEU 80 -2.239 23.002 5.880 102 HB2 LEU 80 HB2 LEU 80 0.681 23.528 5.936 103 HB3 LEU 80 HB3 LEU 80 -0.398 24.857 6.360 104 HG LEU 80 HG LEU 80 -1.392 22.894 7.933 105 HD11 LEU 80 HD11 LEU 80 0.682 21.884 9.003 106 HD12 LEU 80 HD12 LEU 80 1.526 22.322 7.518 107 HD13 LEU 80 HD13 LEU 80 0.164 21.204 7.461 108 HD21 LEU 80 HD21 LEU 80 -0.583 24.136 9.689 109 HD22 LEU 80 HD22 LEU 80 -0.453 25.297 8.367 110 HD23 LEU 80 HD23 LEU 80 0.976 24.419 8.913 111 H PHE 81 H PHE 81 0.151 24.132 3.490 112 HA PHE 81 HA PHE 81 -0.976 26.570 2.863 113 HB2 PHE 81 HB2 PHE 81 1.124 26.145 1.913 114 HB3 PHE 81 HB3 PHE 81 0.610 24.602 1.239 115 HD1 PHE 81 HD1 PHE 81 0.177 28.268 0.912 116 HD2 PHE 81 HD2 PHE 81 -0.180 24.458 -0.953 117 HE1 PHE 81 HE1 PHE 81 -0.280 29.369 -1.240 118 HE2 PHE 81 HE2 PHE 81 -0.637 25.552 -3.108 119 HZ PHE 81 HZ PHE 81 -0.687 28.011 -3.254 120 H LYS 82 H LYS 82 -1.564 23.476 1.192 121 HA LYS 82 HA LYS 82 -3.533 24.411 -0.558 122 HB2 LYS 82 HB2 LYS 82 -2.416 22.251 -0.844 123 HB3 LYS 82 HB3 LYS 82 -3.190 21.644 0.614 124 HG2 LYS 82 HG2 LYS 82 -5.298 22.530 -0.948 125 HG3 LYS 82 HG3 LYS 82 -4.189 21.776 -2.095 126 HD2 LYS 82 HD2 LYS 82 -4.645 20.291 0.412 127 HD3 LYS 82 HD3 LYS 82 -6.037 20.419 -0.667 128 HE2 LYS 82 HE2 LYS 82 -4.637 18.398 -1.053 129 HE3 LYS 82 HE3 LYS 82 -4.807 19.432 -2.470 130 HZ1 LYS 82 HZ1 LYS 82 -2.632 20.313 -2.108 131 HZ2 LYS 82 HZ2 LYS 82 -2.518 18.626 -2.095 132 HZ3 LYS 82 HZ3 LYS 82 -2.471 19.488 -0.640 133 H LEU 83 H LEU 83 -3.859 22.880 2.634 134 HA LEU 83 HA LEU 83 -6.626 22.789 2.786 135 HB2 LEU 83 HB2 LEU 83 -4.706 21.998 4.413 136 HB3 LEU 83 HB3 LEU 83 -5.068 23.526 5.213 137 HG LEU 83 HG LEU 83 -6.925 21.188 4.805 138 HD11 LEU 83 HD11 LEU 83 -6.996 21.244 7.279 139 HD12 LEU 83 HD12 LEU 83 -5.750 22.491 7.256 140 HD13 LEU 83 HD13 LEU 83 -5.395 20.879 6.635 141 HD21 LEU 83 HD21 LEU 83 -8.245 23.141 4.464 142 HD22 LEU 83 HD22 LEU 83 -7.483 23.968 5.824 143 HD23 LEU 83 HD23 LEU 83 -8.543 22.587 6.112 144 H MET 84 H MET 84 -4.420 25.445 3.555 145 HA MET 84 HA MET 84 -6.451 27.187 4.535 146 HB2 MET 84 HB2 MET 84 -3.726 27.911 3.447 147 HB3 MET 84 HB3 MET 84 -4.743 28.912 4.475 148 HG2 MET 84 HG2 MET 84 -4.329 26.400 5.754 149 HG3 MET 84 HG3 MET 84 -2.774 27.048 5.238 150 HE1 MET 84 HE1 MET 84 -3.534 26.270 7.856 151 HE2 MET 84 HE2 MET 84 -2.755 27.524 8.822 152 HE3 MET 84 HE3 MET 84 -4.508 27.331 8.876 153 H ASP 85 H ASP 85 -5.558 26.185 1.426 154 HA ASP 85 HA ASP 85 -6.766 28.562 0.186 155 HB2 ASP 85 HB2 ASP 85 -4.662 26.670 -0.632 156 HB3 ASP 85 HB3 ASP 85 -5.807 27.086 -1.903 157 H VAL 86 H VAL 86 -8.885 27.763 0.883 158 HA VAL 86 HA VAL 86 -9.970 25.323 -0.019 159 HB VAL 86 HB VAL 86 -10.946 26.724 1.799 160 HG11 VAL 86 HG11 VAL 86 -12.621 28.356 0.133 161 HG12 VAL 86 HG12 VAL 86 -11.563 28.831 1.463 162 HG13 VAL 86 HG13 VAL 86 -10.922 28.711 -0.177 163 HG21 VAL 86 HG21 VAL 86 -12.970 25.763 1.517 164 HG22 VAL 86 HG22 VAL 86 -13.181 26.426 -0.103 165 HG23 VAL 86 HG23 VAL 86 -12.178 24.996 0.140 166 H ASP 87 H ASP 87 -9.135 28.112 -1.714 167 HA ASP 87 HA ASP 87 -11.171 27.941 -3.745 168 HB2 ASP 87 HB2 ASP 87 -9.599 29.576 -4.942 169 HB3 ASP 87 HB3 ASP 87 -10.321 30.115 -3.429 170 H GLY 88 H GLY 88 -8.577 26.047 -3.019 171 HA2 GLY 88 HA2 GLY 88 -7.251 24.582 -4.204 172 HA3 GLY 88 HA3 GLY 88 -8.695 24.385 -5.186 173 H ASP 89 H ASP 89 -6.525 27.173 -4.817 174 HA ASP 89 HA ASP 89 -6.301 27.309 -7.725 175 HB2 ASP 89 HB2 ASP 89 -5.134 29.521 -7.169 176 HB3 ASP 89 HB3 ASP 89 -6.853 29.409 -6.805 177 H GLY 90 H GLY 90 -4.455 26.456 -4.936 178 HA2 GLY 90 HA2 GLY 90 -2.428 25.327 -4.873 179 HA3 GLY 90 HA3 GLY 90 -2.282 25.553 -6.610 180 H LYS 91 H LYS 91 -2.966 28.532 -5.592 181 HA LYS 91 HA LYS 91 -0.242 29.220 -4.759 182 HB2 LYS 91 HB2 LYS 91 -0.368 31.178 -6.399 183 HB3 LYS 91 HB3 LYS 91 -0.049 29.586 -7.075 184 HG2 LYS 91 HG2 LYS 91 -2.579 29.465 -7.473 185 HG3 LYS 91 HG3 LYS 91 -2.562 31.209 -7.199 186 HD2 LYS 91 HD2 LYS 91 -0.977 29.711 -9.286 187 HD3 LYS 91 HD3 LYS 91 -2.402 30.712 -9.577 188 HE2 LYS 91 HE2 LYS 91 -1.091 32.619 -8.534 189 HE3 LYS 91 HE3 LYS 91 0.327 31.578 -8.650 190 HZ1 LYS 91 HZ1 LYS 91 0.522 32.536 -10.654 191 HZ2 LYS 91 HZ2 LYS 91 -1.105 32.989 -10.734 192 HZ3 LYS 91 HZ3 LYS 91 -0.647 31.410 -11.130 193 H LEU 92 H LEU 92 -0.057 31.303 -3.763 194 HA LEU 92 HA LEU 92 -2.629 32.414 -2.852 195 HB2 LEU 92 HB2 LEU 92 -1.762 32.739 -0.677 196 HB3 LEU 92 HB3 LEU 92 -1.400 31.075 -1.130 197 HG LEU 92 HG LEU 92 0.912 32.190 -1.840 198 HD11 LEU 92 HD11 LEU 92 1.502 34.096 -0.769 199 HD12 LEU 92 HD12 LEU 92 0.451 33.781 0.612 200 HD13 LEU 92 HD13 LEU 92 -0.230 34.405 -0.891 201 HD21 LEU 92 HD21 LEU 92 -0.097 31.034 0.693 202 HD22 LEU 92 HD22 LEU 92 1.500 31.783 0.730 203 HD23 LEU 92 HD23 LEU 92 1.171 30.462 -0.393 204 H THR 93 H THR 93 -2.793 34.626 -2.673 205 HA THR 93 HA THR 93 -0.776 36.141 -4.130 206 HB THR 93 HB THR 93 -3.127 36.457 -4.756 207 HG1 THR 93 HG1 THR 93 -3.079 38.885 -4.208 208 HG21 THR 93 HG21 THR 93 -3.583 36.415 -2.004 209 HG22 THR 93 HG22 THR 93 -4.770 36.736 -3.270 210 HG23 THR 93 HG23 THR 93 -3.923 38.074 -2.494 211 H LYS 94 H LYS 94 -0.005 38.203 -3.340 212 HA LYS 94 HA LYS 94 1.332 38.222 -1.019 213 HB2 LYS 94 HB2 LYS 94 -0.071 40.644 -2.166 214 HB3 LYS 94 HB3 LYS 94 1.293 40.677 -1.056 215 HG2 LYS 94 HG2 LYS 94 1.352 39.491 -3.823 216 HG3 LYS 94 HG3 LYS 94 1.939 41.100 -3.392 217 HD2 LYS 94 HD2 LYS 94 3.864 40.282 -2.611 218 HD3 LYS 94 HD3 LYS 94 3.038 39.040 -1.667 219 HE2 LYS 94 HE2 LYS 94 3.248 37.471 -3.296 220 HE3 LYS 94 HE3 LYS 94 3.130 38.652 -4.599 221 HZ1 LYS 94 HZ1 LYS 94 5.322 38.679 -4.766 222 HZ2 LYS 94 HZ2 LYS 94 5.428 37.468 -3.591 223 HZ3 LYS 94 HZ3 LYS 94 5.496 39.096 -3.135 224 H GLU 95 H GLU 95 -1.957 39.560 -1.344 225 HA GLU 95 HA GLU 95 -2.380 40.288 1.288 226 HB2 GLU 95 HB2 GLU 95 -4.395 39.147 -0.656 227 HB3 GLU 95 HB3 GLU 95 -4.790 40.021 0.817 228 HG2 GLU 95 HG2 GLU 95 -3.174 41.202 -1.425 229 HG3 GLU 95 HG3 GLU 95 -4.926 41.350 -1.299 230 H GLU 96 H GLU 96 -2.922 37.135 -0.242 231 HA GLU 96 HA GLU 96 -4.009 35.856 2.021 232 HB2 GLU 96 HB2 GLU 96 -4.150 35.005 -0.322 233 HB3 GLU 96 HB3 GLU 96 -2.446 34.584 -0.231 234 HG2 GLU 96 HG2 GLU 96 -2.845 32.944 1.429 235 HG3 GLU 96 HG3 GLU 96 -4.499 33.500 1.673 236 H VAL 97 H VAL 97 -0.693 36.166 0.834 237 HA VAL 97 HA VAL 97 0.566 34.427 2.619 238 HB VAL 97 HB VAL 97 1.410 36.139 0.616 239 HG11 VAL 97 HG11 VAL 97 2.759 36.960 3.187 240 HG12 VAL 97 HG12 VAL 97 3.145 37.526 1.560 241 HG13 VAL 97 HG13 VAL 97 1.599 37.946 2.297 242 HG21 VAL 97 HG21 VAL 97 3.392 34.932 0.704 243 HG22 VAL 97 HG22 VAL 97 3.351 34.799 2.462 244 HG23 VAL 97 HG23 VAL 97 2.239 33.846 1.480 245 H THR 98 H THR 98 -0.543 37.721 3.028 246 HA THR 98 HA THR 98 0.838 38.202 5.481 247 HB THR 98 HB THR 98 -1.577 39.594 4.307 248 HG1 THR 98 HG1 THR 98 1.020 40.676 4.398 249 HG21 THR 98 HG21 THR 98 -0.920 41.451 5.833 250 HG22 THR 98 HG22 THR 98 0.232 40.358 6.600 251 HG23 THR 98 HG23 THR 98 -1.497 40.014 6.677 252 H SER 99 H SER 99 -2.482 37.256 4.655 253 HA SER 99 HA SER 99 -3.390 37.163 7.348 254 HB2 SER 99 HB2 SER 99 -4.512 35.849 4.861 255 HB3 SER 99 HB3 SER 99 -5.349 35.971 6.409 256 HG SER 99 HG SER 99 -5.483 38.154 6.168 257 H PHE 100 H PHE 100 -2.041 34.787 5.129 258 HA PHE 100 HA PHE 100 -2.549 32.502 6.710 259 HB2 PHE 100 HB2 PHE 100 -0.677 33.121 4.454 260 HB3 PHE 100 HB3 PHE 100 -0.516 31.602 5.330 261 HD1 PHE 100 HD1 PHE 100 -3.821 33.046 4.997 262 HD2 PHE 100 HD2 PHE 100 -0.988 30.405 3.233 263 HE1 PHE 100 HE1 PHE 100 -5.603 32.064 3.614 264 HE2 PHE 100 HE2 PHE 100 -2.765 29.419 1.846 265 HZ PHE 100 HZ PHE 100 -5.076 30.249 2.035 266 H PHE 101 H PHE 101 0.326 34.563 6.384 267 HA PHE 101 HA PHE 101 1.788 33.135 8.394 268 HB2 PHE 101 HB2 PHE 101 2.499 34.834 6.372 269 HB3 PHE 101 HB3 PHE 101 2.655 35.879 7.780 270 HD1 PHE 101 HD1 PHE 101 3.820 32.745 6.232 271 HD2 PHE 101 HD2 PHE 101 4.428 35.605 9.324 272 HE1 PHE 101 HE1 PHE 101 6.012 31.741 6.725 273 HE2 PHE 101 HE2 PHE 101 6.621 34.608 9.822 274 HZ PHE 101 HZ PHE 101 7.416 32.673 8.520 275 H LYS 102 H LYS 102 -0.431 35.781 8.353 276 HA LYS 102 HA LYS 102 0.238 37.206 10.620 277 HB2 LYS 102 HB2 LYS 102 -2.139 36.813 9.002 278 HB3 LYS 102 HB3 LYS 102 -2.548 37.039 10.697 279 HG2 LYS 102 HG2 LYS 102 -0.561 38.928 9.663 280 HG3 LYS 102 HG3 LYS 102 -2.155 39.043 8.914 281 HD2 LYS 102 HD2 LYS 102 -2.831 38.840 11.532 282 HD3 LYS 102 HD3 LYS 102 -1.294 39.698 11.651 283 HE2 LYS 102 HE2 LYS 102 -2.097 41.558 10.613 284 HE3 LYS 102 HE3 LYS 102 -3.220 40.645 9.608 285 HZ1 LYS 102 HZ1 LYS 102 -3.750 42.022 11.986 286 HZ2 LYS 102 HZ2 LYS 102 -4.013 40.376 12.277 287 HZ3 LYS 102 HZ3 LYS 102 -4.831 41.153 11.016 288 H LYS 103 H LYS 103 -1.135 34.024 10.354 289 HA LYS 103 HA LYS 103 -2.261 33.697 12.873 290 HB2 LYS 103 HB2 LYS 103 -0.879 31.753 11.031 291 HB3 LYS 103 HB3 LYS 103 -1.606 31.244 12.549 292 HG2 LYS 103 HG2 LYS 103 -3.122 32.694 10.395 293 HG3 LYS 103 HG3 LYS 103 -3.030 30.935 10.512 294 HD2 LYS 103 HD2 LYS 103 -4.055 32.754 12.691 295 HD3 LYS 103 HD3 LYS 103 -5.077 31.886 11.542 296 HE2 LYS 103 HE2 LYS 103 -5.024 30.100 12.858 297 HE3 LYS 103 HE3 LYS 103 -3.274 30.015 12.668 298 HZ1 LYS 103 HZ1 LYS 103 -3.061 31.572 14.528 299 HZ2 LYS 103 HZ2 LYS 103 -3.851 30.148 14.987 300 HZ3 LYS 103 HZ3 LYS 103 -4.739 31.566 14.734 301 H HIS 104 H HIS 104 1.056 33.926 11.936 302 HA HIS 104 HA HIS 104 1.982 32.924 14.522 303 HB2 HIS 104 HB2 HIS 104 3.032 32.694 11.986 304 HB3 HIS 104 HB3 HIS 104 4.009 33.979 12.690 305 HD1 HIS 104 HD1 HIS 104 5.046 33.284 15.161 306 HD2 HIS 104 HD2 HIS 104 3.927 30.217 12.591 307 HE1 HIS 104 HE1 HIS 104 6.242 31.236 15.997 308 H GLY 105 H GLY 105 1.228 35.849 12.959 309 HA2 GLY 105 HA2 GLY 105 1.094 37.919 14.086 310 HA3 GLY 105 HA3 GLY 105 2.282 37.339 15.244 311 H ILE 106 H ILE 106 3.601 36.429 12.462 312 HA ILE 106 HA ILE 106 5.314 38.781 12.359 313 HB ILE 106 HB ILE 106 5.583 36.114 10.965 314 HG12 ILE 106 HG12 ILE 106 7.250 37.161 13.248 315 HG13 ILE 106 HG13 ILE 106 5.780 36.233 13.524 316 HG21 ILE 106 HG21 ILE 106 7.159 38.621 10.865 317 HG22 ILE 106 HG22 ILE 106 8.051 37.101 10.896 318 HG23 ILE 106 HG23 ILE 106 6.876 37.408 9.616 319 HD11 ILE 106 HD11 ILE 106 7.465 34.888 11.632 320 HD12 ILE 106 HD12 ILE 106 8.356 35.257 13.110 321 HD13 ILE 106 HD13 ILE 106 6.856 34.333 13.191 322 H GLU 107 H GLU 107 5.340 40.231 10.753 323 HA GLU 107 HA GLU 107 3.534 39.771 8.479 324 HB2 GLU 107 HB2 GLU 107 4.352 42.195 10.003 325 HB3 GLU 107 HB3 GLU 107 3.990 42.388 8.294 326 HG2 GLU 107 HG2 GLU 107 1.953 40.817 9.562 327 HG3 GLU 107 HG3 GLU 107 2.192 42.331 10.432 328 H LYS 108 H LYS 108 6.755 39.732 9.271 329 HA LYS 108 HA LYS 108 8.053 41.054 7.202 330 HB2 LYS 108 HB2 LYS 108 8.840 38.462 8.547 331 HB3 LYS 108 HB3 LYS 108 9.911 39.468 7.581 332 HG2 LYS 108 HG2 LYS 108 8.531 40.434 10.072 333 HG3 LYS 108 HG3 LYS 108 10.146 39.723 10.057 334 HD2 LYS 108 HD2 LYS 108 11.009 41.698 9.521 335 HD3 LYS 108 HD3 LYS 108 10.051 41.716 8.039 336 HE2 LYS 108 HE2 LYS 108 9.144 42.688 10.748 337 HE3 LYS 108 HE3 LYS 108 9.638 43.707 9.396 338 HZ1 LYS 108 HZ1 LYS 108 7.784 42.935 8.121 339 HZ2 LYS 108 HZ2 LYS 108 7.207 43.474 9.618 340 HZ3 LYS 108 HZ3 LYS 108 7.352 41.816 9.314 341 H VAL 109 H VAL 109 6.197 38.142 7.150 342 HA VAL 109 HA VAL 109 7.190 36.768 4.980 343 HB VAL 109 HB VAL 109 5.270 36.044 6.409 344 HG11 VAL 109 HG11 VAL 109 3.968 38.084 6.392 345 HG12 VAL 109 HG12 VAL 109 3.722 37.943 4.649 346 HG13 VAL 109 HG13 VAL 109 3.007 36.756 5.741 347 HG21 VAL 109 HG21 VAL 109 5.858 34.882 4.329 348 HG22 VAL 109 HG22 VAL 109 4.123 34.831 4.640 349 HG23 VAL 109 HG23 VAL 109 4.769 35.944 3.436 350 H ALA 110 H ALA 110 5.389 39.757 5.036 351 HA ALA 110 HA ALA 110 4.639 39.819 2.309 352 HB1 ALA 110 HB1 ALA 110 3.535 41.616 2.993 353 HB2 ALA 110 HB2 ALA 110 4.317 41.474 4.569 354 HB3 ALA 110 HB3 ALA 110 5.051 42.462 3.305 355 H GLU 111 H GLU 111 7.468 41.040 4.052 356 HA GLU 111 HA GLU 111 8.636 42.292 1.770 357 HB2 GLU 111 HB2 GLU 111 9.094 42.791 4.242 358 HB3 GLU 111 HB3 GLU 111 10.137 41.377 4.215 359 HG2 GLU 111 HG2 GLU 111 11.605 43.117 3.840 360 HG3 GLU 111 HG3 GLU 111 11.278 42.521 2.215 361 H GLN 112 H GLN 112 9.069 39.172 3.378 362 HA GLN 112 HA GLN 112 11.250 38.290 1.826 363 HB2 GLN 112 HB2 GLN 112 9.130 36.617 3.185 364 HB3 GLN 112 HB3 GLN 112 10.714 36.061 2.662 365 HG2 GLN 112 HG2 GLN 112 10.082 37.998 4.868 366 HG3 GLN 112 HG3 GLN 112 10.811 36.400 5.005 367 HE21 GLN 112 HE21 GLN 112 11.319 39.720 4.119 368 HE22 GLN 112 HE22 GLN 112 13.045 39.655 4.068 369 H VAL 113 H VAL 113 7.752 37.845 1.465 370 HA VAL 113 HA VAL 113 7.911 36.194 -0.835 371 HB VAL 113 HB VAL 113 5.908 36.416 0.681 372 HG11 VAL 113 HG11 VAL 113 5.785 38.815 0.858 373 HG12 VAL 113 HG12 VAL 113 5.543 38.969 -0.883 374 HG13 VAL 113 HG13 VAL 113 4.301 38.216 0.118 375 HG21 VAL 113 HG21 VAL 113 5.116 35.222 -1.030 376 HG22 VAL 113 HG22 VAL 113 4.416 36.728 -1.623 377 HG23 VAL 113 HG23 VAL 113 5.989 36.193 -2.215 378 H MET 114 H MET 114 7.898 39.649 -0.341 379 HA MET 114 HA MET 114 7.296 40.377 -3.024 380 HB2 MET 114 HB2 MET 114 8.069 41.733 -0.551 381 HB3 MET 114 HB3 MET 114 8.745 42.485 -1.990 382 HG2 MET 114 HG2 MET 114 5.851 41.790 -1.943 383 HG3 MET 114 HG3 MET 114 6.413 43.207 -1.059 384 HE1 MET 114 HE1 MET 114 6.958 41.846 -5.102 385 HE2 MET 114 HE2 MET 114 5.591 41.449 -4.061 386 HE3 MET 114 HE3 MET 114 5.422 42.690 -5.303 387 H LYS 115 H LYS 115 10.310 39.943 -1.219 388 HA LYS 115 HA LYS 115 11.933 40.615 -3.514 389 HB2 LYS 115 HB2 LYS 115 12.784 39.421 -0.871 390 HB3 LYS 115 HB3 LYS 115 13.829 40.177 -2.066 391 HG2 LYS 115 HG2 LYS 115 12.690 42.317 -1.689 392 HG3 LYS 115 HG3 LYS 115 11.685 41.550 -0.458 393 HD2 LYS 115 HD2 LYS 115 13.522 41.202 0.974 394 HD3 LYS 115 HD3 LYS 115 14.688 41.515 -0.315 395 HE2 LYS 115 HE2 LYS 115 13.351 43.856 -0.300 396 HE3 LYS 115 HE3 LYS 115 13.188 43.397 1.395 397 HZ1 LYS 115 HZ1 LYS 115 15.565 44.156 -0.103 398 HZ2 LYS 115 HZ2 LYS 115 15.764 42.920 1.033 399 HZ3 LYS 115 HZ3 LYS 115 15.175 44.429 1.520 400 H ALA 116 H ALA 116 10.494 37.805 -2.174 401 HA ALA 116 HA ALA 116 12.325 35.948 -3.430 402 HB1 ALA 116 HB1 ALA 116 11.244 35.424 -1.276 403 HB2 ALA 116 HB2 ALA 116 9.680 35.403 -2.090 404 HB3 ALA 116 HB3 ALA 116 10.912 34.215 -2.516 405 H ASP 117 H ASP 117 9.483 37.654 -4.279 406 HA ASP 117 HA ASP 117 8.722 35.791 -6.377 407 HB2 ASP 117 HB2 ASP 117 7.518 38.164 -5.095 408 HB3 ASP 117 HB3 ASP 117 7.170 37.977 -6.811 409 H ALA 118 H ALA 118 10.692 35.917 -7.594 410 HA ALA 118 HA ALA 118 11.556 38.397 -8.737 411 HB1 ALA 118 HB1 ALA 118 13.398 37.196 -9.020 412 HB2 ALA 118 HB2 ALA 118 12.538 35.721 -8.575 413 HB3 ALA 118 HB3 ALA 118 12.570 36.248 -10.257 414 H ASN 119 H ASN 119 9.205 36.026 -9.553 415 HA ASN 119 HA ASN 119 9.109 36.707 -12.361 416 HB2 ASN 119 HB2 ASN 119 6.964 35.257 -12.209 417 HB3 ASN 119 HB3 ASN 119 8.527 34.475 -11.991 418 HD21 ASN 119 HD21 ASN 119 7.632 32.791 -10.816 419 HD22 ASN 119 HD22 ASN 119 7.075 32.992 -9.194 420 H GLY 120 H GLY 120 8.128 38.244 -9.625 421 HA2 GLY 120 HA2 GLY 120 6.532 39.831 -9.133 422 HA3 GLY 120 HA3 GLY 120 6.766 40.300 -10.811 423 H ASP 121 H ASP 121 5.487 37.181 -9.891 424 HA ASP 121 HA ASP 121 3.136 37.612 -11.471 425 HB2 ASP 121 HB2 ASP 121 2.513 35.311 -10.568 426 HB3 ASP 121 HB3 ASP 121 3.999 35.407 -11.507 427 H GLY 122 H GLY 122 3.969 38.114 -8.193 428 HA2 GLY 122 HA2 GLY 122 2.731 39.114 -6.517 429 HA3 GLY 122 HA3 GLY 122 1.358 39.161 -7.615 430 H TYR 123 H TYR 123 2.481 36.060 -7.616 431 HA TYR 123 HA TYR 123 0.907 35.245 -5.280 432 HB2 TYR 123 HB2 TYR 123 0.589 33.726 -7.840 433 HB3 TYR 123 HB3 TYR 123 -0.495 33.818 -6.458 434 HD1 TYR 123 HD2 TYR 123 -1.400 36.316 -6.014 435 HD2 TYR 123 HD1 TYR 123 -0.086 34.793 -9.764 436 HE1 TYR 123 HE2 TYR 123 -2.735 38.027 -7.170 437 HE2 TYR 123 HE1 TYR 123 -1.418 36.502 -10.931 438 HH TYR 123 HH TYR 123 -2.481 38.548 -10.603 439 H ILE 124 H ILE 124 1.350 33.087 -4.543 440 HA ILE 124 HA ILE 124 3.837 31.920 -5.592 441 HB ILE 124 HB ILE 124 4.966 32.259 -3.712 442 HG12 ILE 124 HG12 ILE 124 2.575 31.198 -2.190 443 HG13 ILE 124 HG13 ILE 124 3.890 30.221 -2.835 444 HG21 ILE 124 HG21 ILE 124 2.493 33.678 -2.729 445 HG22 ILE 124 HG22 ILE 124 4.109 33.835 -2.041 446 HG23 ILE 124 HG23 ILE 124 3.793 34.390 -3.685 447 HD11 ILE 124 HD11 ILE 124 4.218 30.541 -0.486 448 HD12 ILE 124 HD12 ILE 124 5.454 31.444 -1.362 449 HD13 ILE 124 HD13 ILE 124 4.074 32.290 -0.661 450 H THR 125 H THR 125 3.736 29.791 -5.913 451 HA THR 125 HA THR 125 1.374 28.357 -4.932 452 HB THR 125 HB THR 125 1.689 28.255 -7.339 453 HG1 THR 125 HG1 THR 125 1.964 25.859 -7.457 454 HG21 THR 125 HG21 THR 125 4.458 27.814 -6.584 455 HG22 THR 125 HG22 THR 125 3.780 28.336 -8.127 456 HG23 THR 125 HG23 THR 125 3.890 26.617 -7.748 457 H LEU 126 H LEU 126 2.010 25.817 -4.844 458 HA LEU 126 HA LEU 126 3.250 25.374 -2.441 459 HB2 LEU 126 HB2 LEU 126 3.293 23.447 -4.755 460 HB3 LEU 126 HB3 LEU 126 3.393 23.051 -3.041 461 HG LEU 126 HG LEU 126 0.964 24.504 -3.668 462 HD11 LEU 126 HD11 LEU 126 -0.079 23.121 -5.173 463 HD12 LEU 126 HD12 LEU 126 1.016 21.773 -4.863 464 HD13 LEU 126 HD13 LEU 126 1.560 23.149 -5.824 465 HD21 LEU 126 HD21 LEU 126 1.190 21.687 -2.672 466 HD22 LEU 126 HD22 LEU 126 -0.011 22.916 -2.275 467 HD23 LEU 126 HD23 LEU 126 1.633 23.053 -1.648 468 H GLU 127 H GLU 127 4.720 25.691 -5.600 469 HA GLU 127 HA GLU 127 7.247 24.635 -5.069 470 HB2 GLU 127 HB2 GLU 127 6.131 26.571 -7.021 471 HB3 GLU 127 HB3 GLU 127 7.875 26.587 -6.804 472 HG2 GLU 127 HG2 GLU 127 6.181 24.240 -7.621 473 HG3 GLU 127 HG3 GLU 127 7.301 25.146 -8.636 474 H GLU 128 H GLU 128 6.198 28.040 -4.887 475 HA GLU 128 HA GLU 128 8.565 29.100 -3.887 476 HB2 GLU 128 HB2 GLU 128 5.827 30.096 -3.115 477 HB3 GLU 128 HB3 GLU 128 7.310 31.025 -3.273 478 HG2 GLU 128 HG2 GLU 128 6.718 29.724 -5.753 479 HG3 GLU 128 HG3 GLU 128 5.310 30.626 -5.194 480 H PHE 129 H PHE 129 5.758 27.817 -2.135 481 HA PHE 129 HA PHE 129 6.563 28.391 0.457 482 HB2 PHE 129 HB2 PHE 129 4.396 27.201 -0.585 483 HB3 PHE 129 HB3 PHE 129 5.243 25.770 -0.006 484 HD1 PHE 129 HD2 PHE 129 4.535 29.211 1.264 485 HD2 PHE 129 HD1 PHE 129 4.573 25.027 2.046 486 HE1 PHE 129 HE2 PHE 129 3.682 29.631 3.534 487 HE2 PHE 129 HE1 PHE 129 3.719 25.441 4.317 488 HZ PHE 129 HZ PHE 129 3.274 27.745 5.064 489 H LEU 130 H LEU 130 7.423 25.669 -1.617 490 HA LEU 130 HA LEU 130 8.898 24.283 0.399 491 HB2 LEU 130 HB2 LEU 130 8.107 22.909 -1.298 492 HB3 LEU 130 HB3 LEU 130 8.605 24.028 -2.566 493 HG LEU 130 HG LEU 130 10.948 23.406 -2.182 494 HD11 LEU 130 HD11 LEU 130 11.544 22.487 -0.256 495 HD12 LEU 130 HD12 LEU 130 10.693 21.017 -0.729 496 HD13 LEU 130 HD13 LEU 130 9.857 22.258 0.203 497 HD21 LEU 130 HD21 LEU 130 10.513 20.839 -2.743 498 HD22 LEU 130 HD22 LEU 130 10.197 22.129 -3.903 499 HD23 LEU 130 HD23 LEU 130 8.871 21.443 -2.963 500 H GLU 131 H GLU 131 9.565 26.911 -1.696 501 HA GLU 131 HA GLU 131 12.434 26.571 -1.665 502 HB2 GLU 131 HB2 GLU 131 10.911 27.738 -3.464 503 HB3 GLU 131 HB3 GLU 131 11.105 29.141 -2.423 504 HG2 GLU 131 HG2 GLU 131 13.664 27.998 -2.805 505 HG3 GLU 131 HG3 GLU 131 12.882 28.114 -4.381 506 H PHE 132 H PHE 132 10.060 27.965 0.352 507 HA PHE 132 HA PHE 132 12.094 29.554 1.767 508 HB2 PHE 132 HB2 PHE 132 9.120 29.771 2.190 509 HB3 PHE 132 HB3 PHE 132 10.370 30.938 2.606 510 HD1 PHE 132 HD2 PHE 132 11.886 30.899 0.011 511 HD2 PHE 132 HD1 PHE 132 7.717 31.084 0.851 512 HE1 PHE 132 HE2 PHE 132 11.512 32.062 -2.125 513 HE2 PHE 132 HE1 PHE 132 7.336 32.247 -1.284 514 HZ PHE 132 HZ PHE 132 9.234 32.739 -2.774 515 H SER 133 H SER 133 12.777 27.353 2.566 516 HA SER 133 HA SER 133 11.686 26.964 5.203 517 HB2 SER 133 HB2 SER 133 11.385 24.857 3.066 518 HB3 SER 133 HB3 SER 133 11.410 24.448 4.782 519 HG SER 133 HG SER 133 9.548 26.060 3.388 520 H LEU 134 H LEU 134 13.736 27.493 5.931 521 HA LEU 134 HA LEU 134 15.539 25.437 6.379 522 HB2 LEU 134 HB2 LEU 134 15.779 26.394 3.773 523 HB3 LEU 134 HB3 LEU 134 17.108 27.145 4.654 524 HG LEU 134 HG LEU 134 16.725 24.214 4.965 525 HD11 LEU 134 HD11 LEU 134 16.684 25.215 2.428 526 HD12 LEU 134 HD12 LEU 134 17.268 23.614 2.880 527 HD13 LEU 134 HD13 LEU 134 18.407 24.947 2.688 528 HD21 LEU 134 HD21 LEU 134 19.382 24.925 4.452 529 HD22 LEU 134 HD22 LEU 134 18.658 24.532 6.011 530 HD23 LEU 134 HD23 LEU 134 18.733 26.209 5.470
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