NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
25684 | 2kb4 | 16039 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 MET 1 1HT MET 1 -65.180 -10.982 -31.843 2 H2 MET 1 2HT MET 1 -65.762 -9.406 -31.832 3 H3 MET 1 3HT MET 1 -65.034 -10.084 -30.451 4 HA MET 1 HA MET 1 -63.670 -9.732 -33.010 5 HB2 MET 1 2HB MET 1 -62.356 -7.901 -31.853 6 HB3 MET 1 1HB MET 1 -64.014 -7.492 -32.234 7 HG2 MET 1 2HG MET 1 -64.656 -7.866 -29.919 8 HG3 MET 1 1HG MET 1 -63.005 -8.340 -29.522 9 HE1 MET 1 2HE MET 1 -62.994 -6.551 -27.536 10 HE2 MET 1 3HE MET 1 -64.657 -6.127 -27.942 11 HE3 MET 1 1HE MET 1 -63.442 -4.860 -27.752 12 H SER 2 H SER 2 -62.724 -11.678 -33.021 13 HA SER 2 HA SER 2 -61.562 -12.786 -30.711 14 HB2 SER 2 2HB SER 2 -60.704 -14.429 -32.465 15 HB3 SER 2 1HB SER 2 -62.456 -14.282 -32.287 16 HG SER 2 HG SER 2 -60.833 -13.675 -34.383 17 H ASP 3 H ASP 3 -60.414 -10.901 -33.413 18 HA ASP 3 HA ASP 3 -57.641 -11.180 -32.549 19 HB2 ASP 3 2HB ASP 3 -58.858 -9.766 -34.937 20 HB3 ASP 3 1HB ASP 3 -57.147 -9.711 -34.540 21 H ASN 4 H ASN 4 -56.413 -9.397 -31.985 22 HA ASN 4 HA ASN 4 -55.826 -7.429 -31.158 23 HB2 ASN 4 2HB ASN 4 -58.428 -6.411 -32.301 24 HB3 ASN 4 1HB ASN 4 -57.249 -5.369 -31.514 25 HD21 ASN 4 1HD2 ASN 4 -55.277 -4.983 -32.537 26 HD22 ASN 4 2HD2 ASN 4 -55.037 -5.317 -34.215 27 H ASN 5 H ASN 5 -58.986 -8.461 -30.257 28 HA ASN 5 HA ASN 5 -59.004 -7.042 -27.761 29 HB2 ASN 5 2HB ASN 5 -61.128 -7.609 -28.704 30 HB3 ASN 5 1HB ASN 5 -60.702 -9.309 -28.815 31 HD21 ASN 5 1HD2 ASN 5 -60.964 -10.595 -27.056 32 HD22 ASN 5 2HD2 ASN 5 -61.700 -10.090 -25.579 33 H GLY 6 H GLY 6 -57.631 -9.997 -28.832 34 HA2 GLY 6 2HA GLY 6 -57.295 -10.945 -26.087 35 HA3 GLY 6 1HA GLY 6 -57.015 -11.885 -27.547 36 H THR 7 H THR 7 -55.848 -8.643 -27.339 37 HA THR 7 HA THR 7 -53.125 -9.580 -27.496 38 HB THR 7 HB THR 7 -54.276 -6.774 -27.487 39 HG1 THR 7 1HG THR 7 -53.465 -8.464 -29.611 40 HG21 THR 7 3HG2 THR 7 -52.120 -6.114 -28.504 41 HG22 THR 7 1HG2 THR 7 -51.534 -7.768 -28.330 42 HG23 THR 7 2HG2 THR 7 -51.886 -6.803 -26.899 43 HA PRO 8 HA PRO 8 -52.746 -8.957 -23.021 44 HB2 PRO 8 2HB PRO 8 -50.062 -9.464 -22.885 45 HB3 PRO 8 1HB PRO 8 -51.280 -10.739 -22.927 46 HG2 PRO 8 2HG PRO 8 -49.580 -9.673 -25.137 47 HG3 PRO 8 1HG PRO 8 -50.034 -11.348 -24.785 48 HD2 PRO 8 2HD PRO 8 -51.227 -9.866 -26.711 49 HD3 PRO 8 1HD PRO 8 -52.092 -11.130 -25.812 50 H GLU 9 H GLU 9 -52.545 -6.954 -22.163 51 HA GLU 9 HA GLU 9 -50.742 -5.155 -23.533 52 HB2 GLU 9 2HB GLU 9 -51.924 -3.316 -22.368 53 HB3 GLU 9 1HB GLU 9 -52.997 -4.290 -23.358 54 HG2 GLU 9 2HG GLU 9 -53.818 -5.418 -21.376 55 HG3 GLU 9 1HG GLU 9 -52.696 -4.496 -20.374 56 HA PRO 10 HA PRO 10 -48.008 -5.639 -20.134 57 HB2 PRO 10 2HB PRO 10 -46.633 -3.180 -20.686 58 HB3 PRO 10 1HB PRO 10 -46.133 -4.824 -21.075 59 HG2 PRO 10 2HG PRO 10 -46.853 -2.918 -22.942 60 HG3 PRO 10 1HG PRO 10 -46.879 -4.662 -23.225 61 HD2 PRO 10 2HD PRO 10 -49.121 -2.806 -22.591 62 HD3 PRO 10 1HD PRO 10 -49.086 -4.239 -23.639 63 H GLN 11 H GLN 11 -48.631 -5.296 -18.121 64 HA GLN 11 HA GLN 11 -49.873 -2.847 -17.324 65 HB2 GLN 11 2HB GLN 11 -49.057 -5.291 -15.736 66 HB3 GLN 11 1HB GLN 11 -49.909 -3.912 -15.060 67 HG2 GLN 11 2HG GLN 11 -50.946 -5.709 -17.246 68 HG3 GLN 11 1HG GLN 11 -51.416 -5.776 -15.550 69 HE21 GLN 11 1HE2 GLN 11 -51.751 -4.090 -18.552 70 HE22 GLN 11 2HE2 GLN 11 -53.036 -3.050 -18.045 71 H VAL 12 H VAL 12 -49.004 -2.023 -15.099 72 HA VAL 12 HA VAL 12 -47.549 -0.589 -14.207 73 HB VAL 12 HB VAL 12 -45.421 -2.482 -15.213 74 HG11 VAL 12 1HG1 VAL 12 -45.323 -0.467 -12.952 75 HG12 VAL 12 2HG1 VAL 12 -44.492 -0.329 -14.502 76 HG13 VAL 12 3HG1 VAL 12 -44.022 -1.590 -13.360 77 HG21 VAL 12 3HG2 VAL 12 -45.464 -3.526 -12.972 78 HG22 VAL 12 1HG2 VAL 12 -46.989 -3.706 -13.841 79 HG23 VAL 12 2HG2 VAL 12 -46.844 -2.509 -12.554 80 H GLU 13 H GLU 13 -48.151 0.975 -15.683 81 HA GLU 13 HA GLU 13 -46.852 1.131 -18.201 82 HB2 GLU 13 2HB GLU 13 -48.151 3.155 -18.569 83 HB3 GLU 13 1HB GLU 13 -49.176 1.856 -17.990 84 HG2 GLU 13 2HG GLU 13 -49.019 2.906 -15.709 85 HG3 GLU 13 1HG GLU 13 -48.190 4.252 -16.473 86 H THR 14 H THR 14 -45.194 2.296 -18.791 87 HA THR 14 HA THR 14 -44.024 3.969 -16.751 88 HB THR 14 HB THR 14 -42.790 1.872 -16.769 89 HG1 THR 14 1HG THR 14 -40.748 3.048 -17.934 90 HG21 THR 14 3HG2 THR 14 -41.530 1.081 -18.749 91 HG22 THR 14 1HG2 THR 14 -42.266 2.362 -19.712 92 HG23 THR 14 2HG2 THR 14 -43.270 1.078 -19.045 93 H THR 15 H THR 15 -44.270 5.930 -17.450 94 HA THR 15 HA THR 15 -43.559 6.459 -20.230 95 HB THR 15 HB THR 15 -45.920 7.082 -19.638 96 HG1 THR 15 1HG THR 15 -45.020 8.244 -21.246 97 HG21 THR 15 3HG2 THR 15 -46.327 9.015 -18.186 98 HG22 THR 15 1HG2 THR 15 -44.607 9.081 -17.794 99 HG23 THR 15 2HG2 THR 15 -45.575 7.689 -17.305 100 H SER 16 H SER 16 -42.434 6.489 -17.230 101 HA SER 16 HA SER 16 -40.899 8.929 -17.285 102 HB2 SER 16 2HB SER 16 -40.175 7.798 -15.071 103 HB3 SER 16 1HB SER 16 -41.826 8.414 -15.205 104 HG SER 16 HG SER 16 -41.719 6.281 -14.369 105 H VAL 17 H VAL 17 -40.481 7.064 -19.349 106 HA VAL 17 HA VAL 17 -38.382 5.258 -18.835 107 HB VAL 17 HB VAL 17 -38.291 4.962 -21.271 108 HG11 VAL 17 1HG1 VAL 17 -39.955 3.704 -20.055 109 HG12 VAL 17 2HG1 VAL 17 -40.610 4.187 -21.619 110 HG13 VAL 17 3HG1 VAL 17 -41.084 5.050 -20.156 111 HG21 VAL 17 3HG2 VAL 17 -40.328 7.191 -21.388 112 HG22 VAL 17 1HG2 VAL 17 -39.835 6.185 -22.751 113 HG23 VAL 17 2HG2 VAL 17 -38.672 7.269 -21.986 114 H PHE 18 H PHE 18 -36.403 5.337 -19.833 115 HA PHE 18 HA PHE 18 -35.240 7.945 -20.387 116 HB2 PHE 18 2HB PHE 18 -33.241 7.309 -18.999 117 HB3 PHE 18 1HB PHE 18 -34.687 7.546 -18.036 118 HD1 PHE 18 2HD PHE 18 -35.768 5.653 -16.938 119 HD2 PHE 18 1HD PHE 18 -32.221 5.123 -19.226 120 HE1 PHE 18 2HE PHE 18 -35.444 3.436 -15.921 121 HE2 PHE 18 1HE PHE 18 -31.893 2.908 -18.213 122 HZ PHE 18 HZ PHE 18 -33.509 2.062 -16.560 123 H ARG 19 H ARG 19 -32.945 7.476 -21.309 124 HA ARG 19 HA ARG 19 -33.361 5.572 -23.413 125 HB2 ARG 19 2HB ARG 19 -31.112 7.478 -22.805 126 HB3 ARG 19 1HB ARG 19 -30.978 6.273 -24.062 127 HG2 ARG 19 2HG ARG 19 -31.574 8.347 -25.079 128 HG3 ARG 19 1HG ARG 19 -32.955 7.262 -25.176 129 HD2 ARG 19 2HD ARG 19 -33.991 8.416 -23.289 130 HD3 ARG 19 1HD ARG 19 -32.597 9.494 -23.177 131 HE ARG 19 HE ARG 19 -34.017 9.340 -25.700 132 HH11 ARG 19 1HH1 ARG 19 -33.408 11.214 -22.751 133 HH12 ARG 19 2HH1 ARG 19 -33.926 12.682 -23.417 134 HH21 ARG 19 1HH2 ARG 19 -34.715 11.335 -26.611 135 HH22 ARG 19 2HH2 ARG 19 -34.654 12.774 -25.691 136 H ALA 20 H ALA 20 -32.624 3.589 -23.470 137 HA ALA 20 HA ALA 20 -31.136 2.596 -21.234 138 HB1 ALA 20 1HB ALA 20 -32.886 1.197 -22.240 139 HB2 ALA 20 2HB ALA 20 -31.314 0.413 -22.386 140 HB3 ALA 20 3HB ALA 20 -32.029 1.220 -23.782 141 H ASP 21 H ASP 21 -29.144 3.452 -21.256 142 HA ASP 21 HA ASP 21 -27.595 3.637 -23.680 143 HB2 ASP 21 2HB ASP 21 -26.787 4.121 -20.801 144 HB3 ASP 21 1HB ASP 21 -25.775 4.424 -22.200 145 H LEU 22 H LEU 22 -28.144 1.513 -21.163 146 HA LEU 22 HA LEU 22 -27.587 -0.556 -20.685 147 HB2 LEU 22 2HB LEU 22 -27.595 -1.087 -23.072 148 HB3 LEU 22 1HB LEU 22 -25.939 -0.533 -23.215 149 HG LEU 22 HG LEU 22 -25.235 -2.383 -21.708 150 HD11 LEU 22 1HD1 LEU 22 -27.312 -2.732 -20.508 151 HD12 LEU 22 2HD1 LEU 22 -26.785 -4.221 -21.289 152 HD13 LEU 22 3HD1 LEU 22 -28.097 -3.276 -21.991 153 HD21 LEU 22 3HD2 LEU 22 -25.486 -4.148 -23.370 154 HD22 LEU 22 1HD2 LEU 22 -25.090 -2.603 -24.119 155 HD23 LEU 22 2HD2 LEU 22 -26.745 -3.214 -24.181 156 H LEU 23 H LEU 23 -26.679 0.097 -18.873 157 HA LEU 23 HA LEU 23 -23.824 0.520 -18.783 158 HB2 LEU 23 2HB LEU 23 -24.076 0.929 -16.403 159 HB3 LEU 23 1HB LEU 23 -25.287 1.841 -17.264 160 HG LEU 23 HG LEU 23 -25.846 -0.748 -15.785 161 HD11 LEU 23 1HD1 LEU 23 -25.117 0.968 -14.243 162 HD12 LEU 23 2HD1 LEU 23 -26.846 0.657 -14.062 163 HD13 LEU 23 3HD1 LEU 23 -26.296 2.095 -14.915 164 HD21 LEU 23 3HD2 LEU 23 -27.536 -0.335 -17.474 165 HD22 LEU 23 1HD2 LEU 23 -27.691 1.348 -16.948 166 HD23 LEU 23 2HD2 LEU 23 -28.198 0.039 -15.889 167 H LYS 24 H LYS 24 -22.419 -1.090 -18.489 168 HA LYS 24 HA LYS 24 -23.601 -3.702 -17.979 169 HB2 LYS 24 2HB LYS 24 -20.966 -2.990 -19.243 170 HB3 LYS 24 1HB LYS 24 -21.523 -4.631 -18.958 171 HG2 LYS 24 2HG LYS 24 -23.519 -4.097 -20.395 172 HG3 LYS 24 1HG LYS 24 -22.731 -2.571 -20.799 173 HD2 LYS 24 2HD LYS 24 -22.286 -4.181 -22.543 174 HD3 LYS 24 1HD LYS 24 -20.791 -3.871 -21.658 175 HE2 LYS 24 2HE LYS 24 -21.082 -5.925 -20.390 176 HE3 LYS 24 1HE LYS 24 -22.625 -6.234 -21.179 177 HZ1 LYS 24 3HZ LYS 24 -21.355 -6.319 -23.298 178 HZ2 LYS 24 1HZ LYS 24 -20.944 -7.532 -22.185 179 HZ3 LYS 24 2HZ LYS 24 -19.941 -6.185 -22.399 180 H GLU 25 H GLU 25 -23.544 -4.323 -15.996 181 HA GLU 25 HA GLU 25 -21.584 -3.388 -14.114 182 HB2 GLU 25 2HB GLU 25 -23.812 -5.409 -13.878 183 HB3 GLU 25 1HB GLU 25 -22.821 -4.842 -12.541 184 HG2 GLU 25 2HG GLU 25 -24.557 -3.068 -14.244 185 HG3 GLU 25 1HG GLU 25 -25.044 -3.746 -12.693 186 H MET 26 H MET 26 -20.043 -4.690 -13.012 187 HA MET 26 HA MET 26 -19.528 -7.383 -13.723 188 HB2 MET 26 2HB MET 26 -17.436 -7.056 -14.942 189 HB3 MET 26 1HB MET 26 -18.754 -6.296 -15.818 190 HG2 MET 26 2HG MET 26 -18.057 -4.107 -14.935 191 HG3 MET 26 1HG MET 26 -16.727 -4.890 -14.085 192 HE1 MET 26 3HE MET 26 -18.219 -3.805 -17.514 193 HE2 MET 26 1HE MET 26 -18.167 -5.551 -17.745 194 HE3 MET 26 2HE MET 26 -17.091 -4.508 -18.673 195 H GLU 27 H GLU 27 -17.060 -7.786 -12.951 196 HA GLU 27 HA GLU 27 -16.367 -6.053 -10.750 197 HB2 GLU 27 2HB GLU 27 -17.838 -7.733 -9.721 198 HB3 GLU 27 1HB GLU 27 -16.914 -9.025 -10.464 199 HG2 GLU 27 2HG GLU 27 -16.435 -8.766 -8.074 200 HG3 GLU 27 1HG GLU 27 -15.009 -8.532 -9.077 201 H SER 28 H SER 28 -14.184 -6.382 -10.117 202 HA SER 28 HA SER 28 -12.559 -7.952 -11.980 203 HB2 SER 28 2HB SER 28 -12.644 -5.569 -12.752 204 HB3 SER 28 1HB SER 28 -11.955 -5.079 -11.211 205 HG SER 28 HG SER 28 -10.773 -6.165 -13.413 206 H SER 29 H SER 29 -12.989 -6.482 -8.795 207 HA SER 29 HA SER 29 -10.436 -7.481 -7.887 208 HB2 SER 29 2HB SER 29 -12.647 -6.036 -6.421 209 HB3 SER 29 1HB SER 29 -11.035 -6.375 -5.790 210 HG SER 29 HG SER 29 -11.172 -4.300 -6.587 211 H THR 30 H THR 30 -10.190 -9.203 -6.525 212 HA THR 30 HA THR 30 -12.138 -11.202 -6.522 213 HB THR 30 HB THR 30 -10.508 -12.268 -4.855 214 HG1 THR 30 1HG THR 30 -9.491 -10.539 -4.045 215 HG21 THR 30 3HG2 THR 30 -10.482 -12.739 -7.278 216 HG22 THR 30 1HG2 THR 30 -8.850 -12.704 -6.612 217 HG23 THR 30 2HG2 THR 30 -9.458 -11.327 -7.534 218 H GLY 31 H GLY 31 -13.989 -11.008 -5.345 219 HA2 GLY 31 2HA GLY 31 -13.721 -10.193 -2.555 220 HA3 GLY 31 1HA GLY 31 -14.918 -9.412 -3.580 221 H THR 32 H THR 32 -13.905 -12.783 -3.148 222 HA THR 32 HA THR 32 -16.683 -13.512 -2.891 223 HB THR 32 HB THR 32 -14.191 -15.234 -2.654 224 HG1 THR 32 1HG THR 32 -14.472 -14.212 -4.732 225 HG21 THR 32 3HG2 THR 32 -15.692 -17.114 -3.114 226 HG22 THR 32 1HG2 THR 32 -17.060 -16.005 -3.219 227 HG23 THR 32 2HG2 THR 32 -16.230 -16.237 -1.680 228 H ALA 33 H ALA 33 -17.575 -14.133 -0.942 229 HA ALA 33 HA ALA 33 -16.695 -12.884 1.370 230 HB1 ALA 33 1HB ALA 33 -18.453 -14.139 2.517 231 HB2 ALA 33 2HB ALA 33 -18.604 -15.210 1.124 232 HB3 ALA 33 3HB ALA 33 -19.027 -13.504 0.977 233 HA PRO 34 HA PRO 34 -13.363 -15.641 2.319 234 HB2 PRO 34 2HB PRO 34 -12.709 -14.521 4.728 235 HB3 PRO 34 1HB PRO 34 -12.178 -13.933 3.153 236 HG2 PRO 34 2HG PRO 34 -14.367 -12.933 4.918 237 HG3 PRO 34 1HG PRO 34 -13.250 -12.013 3.898 238 HD2 PRO 34 2HD PRO 34 -15.820 -12.518 3.203 239 HD3 PRO 34 1HD PRO 34 -14.520 -12.323 2.011 240 H ALA 35 H ALA 35 -13.806 -17.577 2.873 241 HA ALA 35 HA ALA 35 -15.519 -18.265 5.072 242 HB1 ALA 35 1HB ALA 35 -14.940 -20.596 4.486 243 HB2 ALA 35 2HB ALA 35 -13.739 -19.999 3.339 244 HB3 ALA 35 3HB ALA 35 -15.451 -19.685 3.064 245 H SER 36 H SER 36 -14.807 -17.946 7.021 246 HA SER 36 HA SER 36 -13.609 -17.906 8.882 247 HB2 SER 36 2HB SER 36 -11.730 -19.820 7.472 248 HB3 SER 36 1HB SER 36 -11.788 -19.519 9.211 249 HG SER 36 HG SER 36 -13.050 -21.339 8.016 250 H THR 37 H THR 37 -12.955 -15.864 9.081 251 HA THR 37 HA THR 37 -10.823 -14.828 7.467 252 HB THR 37 HB THR 37 -12.169 -13.509 9.848 253 HG1 THR 37 1HG THR 37 -13.521 -14.221 7.931 254 HG21 THR 37 3HG2 THR 37 -11.444 -11.416 8.765 255 HG22 THR 37 1HG2 THR 37 -10.693 -12.344 7.467 256 HG23 THR 37 2HG2 THR 37 -10.061 -12.454 9.107 257 H GLY 38 H GLY 38 -9.232 -16.346 8.110 258 HA2 GLY 38 2HA GLY 38 -7.773 -15.453 10.457 259 HA3 GLY 38 1HA GLY 38 -8.211 -17.158 10.367 260 H ALA 39 H ALA 39 -6.367 -18.107 10.027 261 HA ALA 39 HA ALA 39 -4.165 -17.074 8.632 262 HB1 ALA 39 1HB ALA 39 -3.994 -18.830 10.333 263 HB2 ALA 39 2HB ALA 39 -3.198 -19.293 8.826 264 HB3 ALA 39 3HB ALA 39 -4.779 -19.959 9.231 265 H GLU 40 H GLU 40 -6.851 -19.029 7.536 266 HA GLU 40 HA GLU 40 -5.585 -19.483 4.996 267 HB2 GLU 40 2HB GLU 40 -7.800 -20.507 4.329 268 HB3 GLU 40 1HB GLU 40 -6.909 -21.308 5.610 269 HG2 GLU 40 2HG GLU 40 -9.164 -19.396 6.165 270 HG3 GLU 40 1HG GLU 40 -9.433 -21.111 5.862 271 H ASN 41 H ASN 41 -7.301 -16.978 6.298 272 HA ASN 41 HA ASN 41 -8.398 -16.052 3.767 273 HB2 ASN 41 2HB ASN 41 -9.547 -15.496 5.922 274 HB3 ASN 41 1HB ASN 41 -8.140 -14.552 6.395 275 HD21 ASN 41 1HD2 ASN 41 -9.604 -14.692 3.190 276 HD22 ASN 41 2HD2 ASN 41 -10.081 -13.032 3.137 277 H LEU 42 H LEU 42 -5.836 -15.287 6.008 278 HA LEU 42 HA LEU 42 -4.711 -13.203 4.450 279 HB2 LEU 42 2HB LEU 42 -3.863 -14.682 6.920 280 HB3 LEU 42 1HB LEU 42 -2.731 -13.629 6.114 281 HG LEU 42 HG LEU 42 -4.325 -11.729 6.464 282 HD11 LEU 42 1HD1 LEU 42 -6.115 -11.956 8.114 283 HD12 LEU 42 2HD1 LEU 42 -5.846 -13.699 8.150 284 HD13 LEU 42 3HD1 LEU 42 -6.404 -12.922 6.668 285 HD21 LEU 42 3HD2 LEU 42 -3.856 -11.468 8.846 286 HD22 LEU 42 1HD2 LEU 42 -2.455 -12.073 7.963 287 HD23 LEU 42 2HD2 LEU 42 -3.420 -13.172 8.945 288 HA PRO 43 HA PRO 43 -2.076 -15.613 1.839 289 HB2 PRO 43 2HB PRO 43 -0.201 -13.889 1.179 290 HB3 PRO 43 1HB PRO 43 -1.895 -13.551 0.793 291 HG2 PRO 43 2HG PRO 43 -0.225 -12.503 3.047 292 HG3 PRO 43 1HG PRO 43 -1.323 -11.614 1.977 293 HD2 PRO 43 2HD PRO 43 -1.987 -12.508 4.490 294 HD3 PRO 43 1HD PRO 43 -3.162 -12.203 3.197 295 H ALA 44 H ALA 44 0.323 -16.168 1.458 296 HA ALA 44 HA ALA 44 1.608 -16.555 4.069 297 HB1 ALA 44 1HB ALA 44 2.523 -18.645 3.194 298 HB2 ALA 44 2HB ALA 44 1.717 -18.358 1.651 299 HB3 ALA 44 3HB ALA 44 0.760 -18.642 3.101 300 H GLY 45 H GLY 45 3.242 -15.143 4.209 301 HA2 GLY 45 2HA GLY 45 5.441 -14.531 3.836 302 HA3 GLY 45 1HA GLY 45 5.405 -15.382 2.308 303 H SER 46 H SER 46 3.522 -14.206 0.891 304 HA SER 46 HA SER 46 4.455 -11.415 0.688 305 HB2 SER 46 2HB SER 46 3.408 -13.131 -1.550 306 HB3 SER 46 1HB SER 46 4.266 -11.601 -1.676 307 HG SER 46 HG SER 46 5.792 -13.118 -0.258 308 H ALA 47 H ALA 47 2.888 -9.901 -0.071 309 HA ALA 47 HA ALA 47 0.069 -10.678 0.110 310 HB1 ALA 47 1HB ALA 47 1.321 -8.483 1.758 311 HB2 ALA 47 2HB ALA 47 0.679 -10.003 2.382 312 HB3 ALA 47 3HB ALA 47 -0.409 -8.815 1.659 313 H LEU 48 H LEU 48 -1.318 -8.437 -0.450 314 HA LEU 48 HA LEU 48 0.291 -7.013 -2.376 315 HB2 LEU 48 2HB LEU 48 -1.308 -7.310 -4.188 316 HB3 LEU 48 1HB LEU 48 -0.644 -8.834 -3.653 317 HG LEU 48 HG LEU 48 -2.878 -9.045 -2.327 318 HD11 LEU 48 1HD1 LEU 48 -3.693 -6.798 -2.712 319 HD12 LEU 48 2HD1 LEU 48 -4.779 -7.988 -3.444 320 HD13 LEU 48 3HD1 LEU 48 -3.669 -7.069 -4.455 321 HD21 LEU 48 3HD2 LEU 48 -3.914 -10.130 -4.250 322 HD22 LEU 48 1HD2 LEU 48 -2.193 -10.499 -4.163 323 HD23 LEU 48 2HD2 LEU 48 -2.784 -9.312 -5.326 324 H LEU 49 H LEU 49 -0.713 -5.063 -3.210 325 HA LEU 49 HA LEU 49 -2.963 -4.144 -1.650 326 HB2 LEU 49 2HB LEU 49 -1.955 -1.986 -1.149 327 HB3 LEU 49 1HB LEU 49 -1.036 -3.272 -0.420 328 HG LEU 49 HG LEU 49 0.621 -2.959 -2.380 329 HD11 LEU 49 1HD1 LEU 49 -0.847 -0.346 -2.631 330 HD12 LEU 49 2HD1 LEU 49 -0.766 -1.619 -3.850 331 HD13 LEU 49 3HD1 LEU 49 0.695 -0.743 -3.392 332 HD21 LEU 49 3HD2 LEU 49 1.067 -2.281 -0.061 333 HD22 LEU 49 1HD2 LEU 49 0.292 -0.733 -0.371 334 HD23 LEU 49 2HD2 LEU 49 1.776 -1.159 -1.221 335 H VAL 50 H VAL 50 -4.161 -2.583 -2.637 336 HA VAL 50 HA VAL 50 -3.429 -2.111 -5.423 337 HB VAL 50 HB VAL 50 -5.768 -2.132 -6.097 338 HG11 VAL 50 1HG1 VAL 50 -5.134 -4.629 -4.555 339 HG12 VAL 50 2HG1 VAL 50 -4.687 -4.273 -6.221 340 HG13 VAL 50 3HG1 VAL 50 -6.384 -4.484 -5.788 341 HG21 VAL 50 3HG2 VAL 50 -6.457 -2.804 -3.241 342 HG22 VAL 50 1HG2 VAL 50 -7.604 -2.784 -4.581 343 HG23 VAL 50 2HG2 VAL 50 -6.823 -1.289 -4.067 344 H VAL 51 H VAL 51 -3.673 -0.023 -6.091 345 HA VAL 51 HA VAL 51 -4.186 1.809 -3.915 346 HB VAL 51 HB VAL 51 -3.227 2.423 -6.726 347 HG11 VAL 51 1HG1 VAL 51 -4.306 4.317 -5.629 348 HG12 VAL 51 2HG1 VAL 51 -2.567 4.585 -5.772 349 HG13 VAL 51 3HG1 VAL 51 -3.261 4.109 -4.225 350 HG21 VAL 51 3HG2 VAL 51 -1.590 1.050 -5.557 351 HG22 VAL 51 1HG2 VAL 51 -1.646 2.138 -4.167 352 HG23 VAL 51 2HG2 VAL 51 -1.004 2.707 -5.707 353 H LYS 52 H LYS 52 -6.079 2.572 -3.648 354 HA LYS 52 HA LYS 52 -8.158 2.036 -5.530 355 HB2 LYS 52 2HB LYS 52 -8.349 1.716 -3.105 356 HB3 LYS 52 1HB LYS 52 -8.214 3.432 -2.839 357 HG2 LYS 52 2HG LYS 52 -10.358 3.787 -3.942 358 HG3 LYS 52 1HG LYS 52 -10.448 2.067 -4.341 359 HD2 LYS 52 2HD LYS 52 -10.476 1.486 -1.974 360 HD3 LYS 52 1HD LYS 52 -10.323 3.184 -1.539 361 HE2 LYS 52 2HE LYS 52 -12.486 3.674 -2.407 362 HE3 LYS 52 1HE LYS 52 -12.626 2.073 -3.129 363 HZ1 LYS 52 3HZ LYS 52 -12.706 1.095 -0.985 364 HZ2 LYS 52 1HZ LYS 52 -13.868 2.296 -1.028 365 HZ3 LYS 52 2HZ LYS 52 -12.427 2.532 -0.176 366 H ARG 53 H ARG 53 -6.198 4.726 -4.534 367 HA ARG 53 HA ARG 53 -6.011 5.775 -6.995 368 HB2 ARG 53 2HB ARG 53 -8.464 6.507 -6.710 369 HB3 ARG 53 1HB ARG 53 -7.869 7.655 -5.508 370 HG2 ARG 53 2HG ARG 53 -6.449 8.704 -7.136 371 HG3 ARG 53 1HG ARG 53 -6.874 7.492 -8.333 372 HD2 ARG 53 2HD ARG 53 -9.225 8.305 -8.196 373 HD3 ARG 53 1HD ARG 53 -8.640 9.634 -7.183 374 HE ARG 53 HE ARG 53 -7.085 9.375 -9.506 375 HH11 ARG 53 1HH1 ARG 53 -10.196 10.648 -8.489 376 HH12 ARG 53 2HH1 ARG 53 -10.347 11.760 -9.762 377 HH21 ARG 53 1HH2 ARG 53 -7.222 10.832 -11.232 378 HH22 ARG 53 2HH2 ARG 53 -8.523 11.902 -11.397 379 H GLY 54 H GLY 54 -4.263 7.037 -7.042 380 HA2 GLY 54 2HA GLY 54 -3.629 9.001 -5.193 381 HA3 GLY 54 1HA GLY 54 -2.847 7.521 -4.662 382 HA PRO 55 HA PRO 55 -0.438 9.661 -8.288 383 HB2 PRO 55 2HB PRO 55 1.177 11.081 -6.292 384 HB3 PRO 55 1HB PRO 55 0.385 11.710 -7.737 385 HG2 PRO 55 2HG PRO 55 -0.493 12.311 -5.269 386 HG3 PRO 55 1HG PRO 55 -1.594 12.122 -6.645 387 HD2 PRO 55 2HD PRO 55 -0.952 10.178 -4.453 388 HD3 PRO 55 1HD PRO 55 -2.525 10.614 -5.157 389 H ASN 56 H ASN 56 0.079 7.963 -5.441 390 HA ASN 56 HA ASN 56 2.837 7.537 -5.426 391 HB2 ASN 56 2HB ASN 56 2.395 5.556 -4.013 392 HB3 ASN 56 1HB ASN 56 1.471 6.952 -3.490 393 HD21 ASN 56 1HD2 ASN 56 1.119 4.098 -3.046 394 HD22 ASN 56 2HD2 ASN 56 -0.484 3.723 -3.566 395 H ALA 57 H ALA 57 0.213 5.836 -6.997 396 HA ALA 57 HA ALA 57 1.898 4.837 -9.075 397 HB1 ALA 57 1HB ALA 57 2.440 3.177 -7.358 398 HB2 ALA 57 2HB ALA 57 1.509 2.445 -8.668 399 HB3 ALA 57 3HB ALA 57 0.724 2.832 -7.140 400 H GLY 58 H GLY 58 -1.091 4.033 -7.361 401 HA2 GLY 58 2HA GLY 58 -3.292 4.170 -8.098 402 HA3 GLY 58 1HA GLY 58 -2.687 4.876 -9.597 403 H ALA 59 H ALA 59 -1.616 1.811 -8.262 404 HA ALA 59 HA ALA 59 -3.047 0.315 -10.286 405 HB1 ALA 59 1HB ALA 59 -0.025 0.320 -10.000 406 HB2 ALA 59 2HB ALA 59 -0.926 1.024 -11.335 407 HB3 ALA 59 3HB ALA 59 -0.961 -0.718 -11.080 408 H ARG 60 H ARG 60 -1.672 -2.082 -9.814 409 HA ARG 60 HA ARG 60 -1.985 -2.345 -6.936 410 HB2 ARG 60 2HB ARG 60 -2.783 -4.667 -7.281 411 HB3 ARG 60 1HB ARG 60 -3.817 -3.431 -7.976 412 HG2 ARG 60 2HG ARG 60 -2.944 -3.920 -10.194 413 HG3 ARG 60 1HG ARG 60 -1.902 -5.177 -9.511 414 HD2 ARG 60 2HD ARG 60 -4.915 -5.120 -9.373 415 HD3 ARG 60 1HD ARG 60 -3.970 -6.092 -10.495 416 HE ARG 60 HE ARG 60 -2.959 -6.909 -8.214 417 HH11 ARG 60 1HH1 ARG 60 -6.406 -6.336 -8.937 418 HH12 ARG 60 2HH1 ARG 60 -6.962 -7.623 -7.989 419 HH21 ARG 60 1HH2 ARG 60 -3.729 -8.705 -6.975 420 HH22 ARG 60 2HH2 ARG 60 -5.395 -9.053 -6.873 421 H PHE 61 H PHE 61 -0.573 -3.578 -5.799 422 HA PHE 61 HA PHE 61 1.974 -4.113 -7.186 423 HB2 PHE 61 2HB PHE 61 1.910 -1.844 -6.222 424 HB3 PHE 61 1HB PHE 61 1.500 -2.520 -4.661 425 HD1 PHE 61 1HD PHE 61 4.157 -2.353 -7.222 426 HD2 PHE 61 2HD PHE 61 3.195 -3.122 -3.152 427 HE1 PHE 61 1HE PHE 61 6.548 -2.342 -6.658 428 HE2 PHE 61 2HE PHE 61 5.588 -3.126 -2.582 429 HZ PHE 61 HZ PHE 61 7.268 -2.729 -4.334 430 H LEU 62 H LEU 62 3.245 -5.745 -6.213 431 HA LEU 62 HA LEU 62 1.922 -7.339 -4.142 432 HB2 LEU 62 2HB LEU 62 4.090 -8.051 -6.119 433 HB3 LEU 62 1HB LEU 62 3.517 -9.117 -4.861 434 HG LEU 62 HG LEU 62 1.901 -8.131 -7.218 435 HD11 LEU 62 1HD1 LEU 62 2.040 -10.456 -7.958 436 HD12 LEU 62 2HD1 LEU 62 3.093 -10.825 -6.592 437 HD13 LEU 62 3HD1 LEU 62 3.632 -9.709 -7.847 438 HD21 LEU 62 3HD2 LEU 62 0.261 -9.812 -6.460 439 HD22 LEU 62 1HD2 LEU 62 0.483 -8.497 -5.304 440 HD23 LEU 62 2HD2 LEU 62 1.231 -10.068 -5.007 441 H LEU 63 H LEU 63 2.931 -7.595 -2.205 442 HA LEU 63 HA LEU 63 5.566 -6.347 -1.964 443 HB2 LEU 63 2HB LEU 63 3.521 -6.815 0.214 444 HB3 LEU 63 1HB LEU 63 5.103 -6.119 0.443 445 HG LEU 63 HG LEU 63 4.288 -4.244 -1.114 446 HD11 LEU 63 1HD1 LEU 63 1.628 -5.438 -0.371 447 HD12 LEU 63 2HD1 LEU 63 2.322 -5.335 -1.993 448 HD13 LEU 63 3HD1 LEU 63 1.893 -3.863 -1.119 449 HD21 LEU 63 3HD2 LEU 63 3.181 -3.091 0.769 450 HD22 LEU 63 1HD2 LEU 63 4.673 -3.907 1.239 451 HD23 LEU 63 2HD2 LEU 63 3.117 -4.627 1.634 452 H ASP 64 H ASP 64 7.040 -7.871 -2.028 453 HA ASP 64 HA ASP 64 6.736 -10.062 -0.108 454 HB2 ASP 64 2HB ASP 64 7.839 -11.594 -1.581 455 HB3 ASP 64 1HB ASP 64 6.583 -10.824 -2.531 456 H GLN 65 H GLN 65 8.034 -7.287 -0.659 457 HA GLN 65 HA GLN 65 10.834 -7.718 -0.116 458 HB2 GLN 65 2HB GLN 65 9.177 -5.174 -0.086 459 HB3 GLN 65 1HB GLN 65 10.927 -5.258 -0.040 460 HG2 GLN 65 2HG GLN 65 11.000 -6.091 -2.264 461 HG3 GLN 65 1HG GLN 65 9.235 -6.212 -2.338 462 HE21 GLN 65 1HE2 GLN 65 11.022 -3.536 -0.901 463 HE22 GLN 65 2HE2 GLN 65 10.537 -2.323 -1.993 464 HA PRO 66 HA PRO 66 9.997 -8.236 4.308 465 HB2 PRO 66 2HB PRO 66 12.476 -7.001 5.010 466 HB3 PRO 66 1HB PRO 66 12.110 -8.725 4.961 467 HG2 PRO 66 2HG PRO 66 13.463 -7.027 2.950 468 HG3 PRO 66 1HG PRO 66 13.627 -8.761 3.244 469 HD2 PRO 66 2HD PRO 66 12.351 -7.809 1.100 470 HD3 PRO 66 1HD PRO 66 11.800 -9.284 1.919 471 H THR 67 H THR 67 11.500 -5.195 3.227 472 HA THR 67 HA THR 67 9.563 -3.752 4.863 473 HB THR 67 HB THR 67 12.516 -3.082 4.726 474 HG1 THR 67 1HG THR 67 12.755 -4.120 6.532 475 HG21 THR 67 3HG2 THR 67 11.984 -1.458 6.485 476 HG22 THR 67 1HG2 THR 67 10.283 -1.924 6.407 477 HG23 THR 67 2HG2 THR 67 11.046 -1.137 5.027 478 H THR 68 H THR 68 8.450 -2.478 3.469 479 HA THR 68 HA THR 68 9.881 -1.350 1.165 480 HB THR 68 HB THR 68 6.895 -1.756 1.528 481 HG1 THR 68 1HG THR 68 8.428 -3.666 1.405 482 HG21 THR 68 3HG2 THR 68 8.585 -1.238 -0.931 483 HG22 THR 68 1HG2 THR 68 7.542 -0.058 -0.137 484 HG23 THR 68 2HG2 THR 68 6.837 -1.473 -0.919 485 H THR 69 H THR 69 10.374 0.759 1.614 486 HA THR 69 HA THR 69 8.763 2.178 3.574 487 HB THR 69 HB THR 69 11.395 2.996 2.349 488 HG1 THR 69 1HG THR 69 11.035 1.719 4.901 489 HG21 THR 69 3HG2 THR 69 10.026 3.815 4.931 490 HG22 THR 69 1HG2 THR 69 10.134 4.802 3.473 491 HG23 THR 69 2HG2 THR 69 11.595 4.390 4.373 492 H ALA 70 H ALA 70 7.507 3.867 3.065 493 HA ALA 70 HA ALA 70 7.272 4.562 0.261 494 HB1 ALA 70 1HB ALA 70 5.409 5.046 2.580 495 HB2 ALA 70 2HB ALA 70 5.283 3.728 1.420 496 HB3 ALA 70 3HB ALA 70 5.057 5.391 0.889 497 H GLY 71 H GLY 71 8.395 6.228 -0.321 498 HA2 GLY 71 2HA GLY 71 8.327 8.668 1.298 499 HA3 GLY 71 1HA GLY 71 9.869 8.073 0.673 500 H ARG 72 H ARG 72 10.218 9.764 -0.761 501 HA ARG 72 HA ARG 72 8.927 9.349 -3.301 502 HB2 ARG 72 2HB ARG 72 7.352 10.885 -2.019 503 HB3 ARG 72 1HB ARG 72 8.632 12.072 -2.006 504 HG2 ARG 72 2HG ARG 72 7.724 11.086 -4.663 505 HG3 ARG 72 1HG ARG 72 6.614 12.098 -3.749 506 HD2 ARG 72 2HD ARG 72 8.412 13.812 -3.574 507 HD3 ARG 72 1HD ARG 72 9.425 12.803 -4.606 508 HE ARG 72 HE ARG 72 7.128 13.131 -6.045 509 HH11 ARG 72 1HH1 ARG 72 9.433 15.421 -4.635 510 HH12 ARG 72 2HH1 ARG 72 9.112 16.623 -5.802 511 HH21 ARG 72 1HH2 ARG 72 6.691 14.718 -7.521 512 HH22 ARG 72 2HH2 ARG 72 7.517 16.236 -7.502 513 H HIS 73 H HIS 73 11.631 9.561 -1.780 514 HA HIS 73 HA HIS 73 12.901 11.510 -3.512 515 HB2 HIS 73 2HB HIS 73 13.905 10.125 -0.994 516 HB3 HIS 73 1HB HIS 73 14.843 11.266 -1.949 517 HD1 HIS 73 1HD HIS 73 13.860 11.646 1.148 518 HD2 HIS 73 2HD HIS 73 12.313 13.451 -2.265 519 HE1 HIS 73 1HE HIS 73 12.719 13.729 1.913 520 HA PRO 74 HA PRO 74 14.627 8.418 -6.119 521 HB2 PRO 74 2HB PRO 74 17.336 9.471 -5.480 522 HB3 PRO 74 1HB PRO 74 16.580 9.200 -7.054 523 HG2 PRO 74 2HG PRO 74 16.767 11.661 -6.133 524 HG3 PRO 74 1HG PRO 74 15.262 11.122 -6.897 525 HD2 PRO 74 2HD PRO 74 15.896 11.445 -3.989 526 HD3 PRO 74 1HD PRO 74 14.425 11.890 -4.882 527 H GLU 75 H GLU 75 15.943 8.689 -2.920 528 HA GLU 75 HA GLU 75 17.087 6.021 -3.144 529 HB2 GLU 75 2HB GLU 75 18.121 6.485 -0.920 530 HB3 GLU 75 1HB GLU 75 18.606 7.586 -2.194 531 HG2 GLU 75 2HG GLU 75 18.319 8.858 -0.210 532 HG3 GLU 75 1HG GLU 75 16.977 9.248 -1.277 533 H SER 76 H SER 76 14.139 7.201 -2.464 534 HA SER 76 HA SER 76 13.545 5.570 -0.157 535 HB2 SER 76 2HB SER 76 11.684 7.095 -1.997 536 HB3 SER 76 1HB SER 76 11.313 6.494 -0.380 537 HG SER 76 HG SER 76 13.537 8.039 -0.344 538 H ASP 77 H ASP 77 12.226 3.694 -0.269 539 HA ASP 77 HA ASP 77 12.751 2.008 -2.433 540 HB2 ASP 77 2HB ASP 77 12.116 1.398 0.002 541 HB3 ASP 77 1HB ASP 77 10.456 1.532 -0.554 542 H ILE 78 H ILE 78 9.561 3.270 -1.443 543 HA ILE 78 HA ILE 78 8.881 3.286 -4.295 544 HB ILE 78 HB ILE 78 6.505 2.886 -3.735 545 HG12 ILE 78 2HG1 ILE 78 7.499 2.309 -0.926 546 HG13 ILE 78 1HG1 ILE 78 6.546 3.701 -1.419 547 HG21 ILE 78 1HG2 ILE 78 8.375 0.713 -2.813 548 HG22 ILE 78 2HG2 ILE 78 7.818 1.009 -4.462 549 HG23 ILE 78 3HG2 ILE 78 6.678 0.482 -3.225 550 HD11 ILE 78 3HD1 ILE 78 5.635 0.835 -1.532 551 HD12 ILE 78 1HD1 ILE 78 4.682 2.249 -1.991 552 HD13 ILE 78 2HD1 ILE 78 5.172 2.025 -0.312 553 H PHE 79 H PHE 79 7.276 4.861 -4.904 554 HA PHE 79 HA PHE 79 7.664 7.352 -3.440 555 HB2 PHE 79 2HB PHE 79 6.657 6.824 -6.261 556 HB3 PHE 79 1HB PHE 79 6.892 8.419 -5.553 557 HD1 PHE 79 2HD PHE 79 8.616 5.390 -6.775 558 HD2 PHE 79 1HD PHE 79 9.070 9.402 -5.427 559 HE1 PHE 79 2HE PHE 79 10.953 5.377 -7.537 560 HE2 PHE 79 1HE PHE 79 11.406 9.392 -6.187 561 HZ PHE 79 HZ PHE 79 12.352 7.381 -7.242 562 H LEU 80 H LEU 80 6.009 8.188 -2.327 563 HA LEU 80 HA LEU 80 3.398 6.924 -2.592 564 HB2 LEU 80 2HB LEU 80 4.866 6.646 -0.554 565 HB3 LEU 80 1HB LEU 80 4.528 8.292 -0.147 566 HG LEU 80 HG LEU 80 3.221 6.780 1.137 567 HD11 LEU 80 1HD1 LEU 80 2.123 8.871 0.658 568 HD12 LEU 80 2HD1 LEU 80 0.933 7.571 0.727 569 HD13 LEU 80 3HD1 LEU 80 1.451 8.209 -0.836 570 HD21 LEU 80 3HD2 LEU 80 2.082 5.728 -1.441 571 HD22 LEU 80 1HD2 LEU 80 1.520 5.297 0.171 572 HD23 LEU 80 2HD2 LEU 80 3.155 4.872 -0.336 573 H ASP 81 H ASP 81 4.058 9.793 -0.983 574 HA ASP 81 HA ASP 81 1.945 10.978 -2.610 575 HB2 ASP 81 2HB ASP 81 1.874 11.013 -0.027 576 HB3 ASP 81 1HB ASP 81 3.045 12.325 -0.163 577 H ASP 82 H ASP 82 2.401 12.172 -4.082 578 HA ASP 82 HA ASP 82 5.095 13.217 -4.535 579 HB2 ASP 82 2HB ASP 82 3.942 11.855 -6.154 580 HB3 ASP 82 1HB ASP 82 2.703 13.076 -6.317 581 H VAL 83 H VAL 83 1.810 14.334 -4.272 582 HA VAL 83 HA VAL 83 2.532 17.008 -5.075 583 HB VAL 83 HB VAL 83 0.370 16.116 -5.825 584 HG11 VAL 83 1HG1 VAL 83 -0.421 16.038 -2.920 585 HG12 VAL 83 2HG1 VAL 83 -0.197 14.657 -3.992 586 HG13 VAL 83 3HG1 VAL 83 -1.509 15.798 -4.285 587 HG21 VAL 83 3HG2 VAL 83 0.035 18.417 -3.909 588 HG22 VAL 83 1HG2 VAL 83 -1.083 17.996 -5.206 589 HG23 VAL 83 2HG2 VAL 83 0.558 18.523 -5.590 590 H THR 84 H THR 84 1.929 15.250 -2.192 591 HA THR 84 HA THR 84 2.739 17.582 -0.661 592 HB THR 84 HB THR 84 1.097 16.696 1.174 593 HG1 THR 84 1HG THR 84 0.484 14.974 -0.744 594 HG21 THR 84 3HG2 THR 84 -0.722 18.126 0.326 595 HG22 THR 84 1HG2 THR 84 0.044 18.149 -1.262 596 HG23 THR 84 2HG2 THR 84 0.854 18.889 0.119 597 H VAL 85 H VAL 85 4.708 16.561 -0.787 598 HA VAL 85 HA VAL 85 4.959 13.841 0.057 599 HB VAL 85 HB VAL 85 6.188 14.367 -1.866 600 HG11 VAL 85 1HG1 VAL 85 6.331 16.797 -1.639 601 HG12 VAL 85 2HG1 VAL 85 7.929 16.124 -1.956 602 HG13 VAL 85 3HG1 VAL 85 7.490 16.618 -0.322 603 HG21 VAL 85 3HG2 VAL 85 8.102 14.246 0.463 604 HG22 VAL 85 1HG2 VAL 85 8.540 13.938 -1.217 605 HG23 VAL 85 2HG2 VAL 85 7.394 12.876 -0.393 606 H SER 86 H SER 86 5.342 13.164 1.997 607 HA SER 86 HA SER 86 6.837 14.820 3.864 608 HB2 SER 86 2HB SER 86 5.526 12.087 4.207 609 HB3 SER 86 1HB SER 86 6.256 13.039 5.501 610 HG SER 86 HG SER 86 4.424 14.462 4.092 611 H ARG 87 H ARG 87 8.967 14.169 4.438 612 HA ARG 87 HA ARG 87 10.465 12.916 2.424 613 HB2 ARG 87 2HB ARG 87 12.359 12.900 4.072 614 HB3 ARG 87 1HB ARG 87 11.601 14.464 3.828 615 HG2 ARG 87 2HG ARG 87 10.411 14.223 5.929 616 HG3 ARG 87 1HG ARG 87 11.111 12.615 6.148 617 HD2 ARG 87 2HD ARG 87 12.244 14.396 7.452 618 HD3 ARG 87 1HD ARG 87 13.314 13.552 6.331 619 HE ARG 87 HE ARG 87 13.341 15.429 4.951 620 HH11 ARG 87 1HH1 ARG 87 11.451 16.082 7.906 621 HH12 ARG 87 2HH1 ARG 87 11.714 17.757 7.850 622 HH21 ARG 87 1HH2 ARG 87 13.702 17.758 4.934 623 HH22 ARG 87 2HH2 ARG 87 13.014 18.722 6.151 624 H ARG 88 H ARG 88 9.253 11.623 5.399 625 HA ARG 88 HA ARG 88 9.543 8.941 4.309 626 HB2 ARG 88 2HB ARG 88 10.065 9.793 7.181 627 HB3 ARG 88 1HB ARG 88 9.913 8.130 6.655 628 HG2 ARG 88 2HG ARG 88 12.072 10.059 5.852 629 HG3 ARG 88 1HG ARG 88 12.229 8.704 6.972 630 HD2 ARG 88 2HD ARG 88 11.569 7.189 5.090 631 HD3 ARG 88 1HD ARG 88 11.660 8.585 4.017 632 HE ARG 88 HE ARG 88 13.941 7.741 5.625 633 HH11 ARG 88 1HH1 ARG 88 12.632 8.633 2.443 634 HH12 ARG 88 2HH1 ARG 88 14.112 8.302 1.638 635 HH21 ARG 88 1HH2 ARG 88 15.909 7.301 4.465 636 HH22 ARG 88 2HH2 ARG 88 15.963 7.543 2.773 637 H HIS 89 H HIS 89 7.474 8.563 3.836 638 HA HIS 89 HA HIS 89 5.415 9.899 5.347 639 HB2 HIS 89 2HB HIS 89 5.439 9.750 2.827 640 HB3 HIS 89 1HB HIS 89 5.134 8.029 2.979 641 HD2 HIS 89 2HD HIS 89 2.532 7.411 4.079 642 HE1 HIS 89 1HE HIS 89 1.026 11.220 2.994 643 HE2 HIS 89 2HE HIS 89 0.477 8.971 4.057 644 H ALA 90 H ALA 90 5.783 6.539 4.237 645 HA ALA 90 HA ALA 90 4.938 5.597 6.852 646 HB1 ALA 90 1HB ALA 90 3.416 4.935 4.322 647 HB2 ALA 90 2HB ALA 90 2.814 5.904 5.671 648 HB3 ALA 90 3HB ALA 90 3.156 4.189 5.899 649 H GLU 91 H GLU 91 5.027 3.119 6.818 650 HA GLU 91 HA GLU 91 6.808 2.141 4.767 651 HB2 GLU 91 2HB GLU 91 8.201 3.051 6.586 652 HB3 GLU 91 1HB GLU 91 7.378 1.995 7.717 653 HG2 GLU 91 2HG GLU 91 8.312 0.061 6.685 654 HG3 GLU 91 1HG GLU 91 9.005 1.035 5.386 655 H PHE 92 H PHE 92 6.293 0.177 4.186 656 HA PHE 92 HA PHE 92 4.243 -1.262 5.716 657 HB2 PHE 92 2HB PHE 92 4.960 -1.434 2.773 658 HB3 PHE 92 1HB PHE 92 3.671 -2.322 3.569 659 HD1 PHE 92 2HD PHE 92 1.598 -1.209 4.189 660 HD2 PHE 92 1HD PHE 92 4.726 0.909 2.230 661 HE1 PHE 92 2HE PHE 92 0.034 0.615 3.660 662 HE2 PHE 92 1HE PHE 92 3.167 2.732 1.696 663 HZ PHE 92 HZ PHE 92 0.817 2.588 2.414 664 H ARG 93 H ARG 93 5.053 -2.989 6.736 665 HA ARG 93 HA ARG 93 7.341 -4.281 5.498 666 HB2 ARG 93 2HB ARG 93 8.272 -3.010 7.261 667 HB3 ARG 93 1HB ARG 93 6.981 -3.443 8.361 668 HG2 ARG 93 2HG ARG 93 7.835 -5.673 8.582 669 HG3 ARG 93 1HG ARG 93 9.019 -5.390 7.307 670 HD2 ARG 93 2HD ARG 93 9.837 -5.250 9.721 671 HD3 ARG 93 1HD ARG 93 10.272 -3.929 8.639 672 HE ARG 93 HE ARG 93 9.030 -2.514 9.849 673 HH11 ARG 93 1HH1 ARG 93 8.255 -5.772 11.017 674 HH12 ARG 93 2HH1 ARG 93 7.277 -5.229 12.283 675 HH21 ARG 93 1HH2 ARG 93 7.718 -1.774 11.597 676 HH22 ARG 93 2HH2 ARG 93 6.917 -2.908 12.604 677 H ILE 94 H ILE 94 7.434 -6.428 5.602 678 HA ILE 94 HA ILE 94 5.088 -7.719 6.713 679 HB ILE 94 HB ILE 94 5.277 -9.444 4.895 680 HG12 ILE 94 2HG1 ILE 94 6.549 -8.565 2.747 681 HG13 ILE 94 1HG1 ILE 94 7.510 -7.670 3.908 682 HG21 ILE 94 1HG2 ILE 94 4.306 -8.119 3.099 683 HG22 ILE 94 2HG2 ILE 94 4.976 -6.660 3.814 684 HG23 ILE 94 3HG2 ILE 94 3.722 -7.543 4.668 685 HD11 ILE 94 3HD1 ILE 94 8.147 -9.813 4.966 686 HD12 ILE 94 1HD1 ILE 94 8.630 -9.702 3.269 687 HD13 ILE 94 2HD1 ILE 94 7.224 -10.655 3.718 688 H ASN 95 H ASN 95 5.463 -9.270 8.160 689 HA ASN 95 HA ASN 95 8.268 -9.914 8.584 690 HB2 ASN 95 2HB ASN 95 7.410 -8.291 10.273 691 HB3 ASN 95 1HB ASN 95 6.125 -9.417 10.680 692 HD21 ASN 95 1HD2 ASN 95 6.880 -9.372 12.832 693 HD22 ASN 95 2HD2 ASN 95 8.271 -10.284 13.307 694 H GLU 96 H GLU 96 8.696 -11.936 9.285 695 HA GLU 96 HA GLU 96 7.352 -13.948 8.051 696 HB2 GLU 96 2HB GLU 96 8.691 -15.478 9.682 697 HB3 GLU 96 1HB GLU 96 9.524 -14.495 8.494 698 HG2 GLU 96 2HG GLU 96 10.763 -14.333 10.496 699 HG3 GLU 96 1HG GLU 96 9.930 -12.804 10.312 700 H GLY 97 H GLY 97 6.680 -12.761 11.207 701 HA2 GLY 97 2HA GLY 97 4.763 -14.916 11.644 702 HA3 GLY 97 1HA GLY 97 5.197 -13.671 12.797 703 H GLU 98 H GLU 98 4.678 -11.379 11.011 704 HA GLU 98 HA GLU 98 1.842 -11.569 10.591 705 HB2 GLU 98 2HB GLU 98 1.434 -9.717 12.177 706 HB3 GLU 98 1HB GLU 98 1.862 -11.241 12.958 707 HG2 GLU 98 2HG GLU 98 4.190 -10.380 13.173 708 HG3 GLU 98 1HG GLU 98 3.632 -8.841 12.526 709 H PHE 99 H PHE 99 1.018 -9.313 10.023 710 HA PHE 99 HA PHE 99 3.014 -8.020 8.313 711 HB2 PHE 99 2HB PHE 99 -0.024 -7.969 8.151 712 HB3 PHE 99 1HB PHE 99 1.083 -7.238 6.999 713 HD1 PHE 99 2HD PHE 99 2.396 -8.643 5.491 714 HD2 PHE 99 1HD PHE 99 -0.480 -10.342 8.119 715 HE1 PHE 99 2HE PHE 99 2.446 -10.736 4.187 716 HE2 PHE 99 1HE PHE 99 -0.434 -12.434 6.826 717 HZ PHE 99 HZ PHE 99 1.032 -12.629 4.859 718 H GLU 100 H GLU 100 3.562 -5.869 8.817 719 HA GLU 100 HA GLU 100 1.770 -4.506 10.670 720 HB2 GLU 100 2HB GLU 100 3.559 -5.527 12.012 721 HB3 GLU 100 1HB GLU 100 4.764 -4.705 11.037 722 HG2 GLU 100 2HG GLU 100 4.083 -2.572 11.868 723 HG3 GLU 100 1HG GLU 100 2.684 -3.275 12.676 724 H VAL 101 H VAL 101 1.491 -2.361 10.331 725 HA VAL 101 HA VAL 101 3.147 -1.178 8.249 726 HB VAL 101 HB VAL 101 0.912 -1.570 7.314 727 HG11 VAL 101 1HG1 VAL 101 -0.183 0.068 9.588 728 HG12 VAL 101 2HG1 VAL 101 -0.412 -1.661 9.336 729 HG13 VAL 101 3HG1 VAL 101 -1.103 -0.505 8.196 730 HG21 VAL 101 3HG2 VAL 101 0.311 0.727 6.643 731 HG22 VAL 101 1HG2 VAL 101 2.050 0.438 6.568 732 HG23 VAL 101 2HG2 VAL 101 1.366 1.352 7.910 733 H VAL 102 H VAL 102 4.220 0.565 8.835 734 HA VAL 102 HA VAL 102 3.339 1.890 11.266 735 HB VAL 102 HB VAL 102 5.698 2.348 11.863 736 HG11 VAL 102 1HG1 VAL 102 6.219 0.105 12.716 737 HG12 VAL 102 2HG1 VAL 102 4.991 -0.572 11.648 738 HG13 VAL 102 3HG1 VAL 102 4.523 0.528 12.946 739 HG21 VAL 102 3HG2 VAL 102 6.756 2.104 9.695 740 HG22 VAL 102 1HG2 VAL 102 6.345 0.387 9.653 741 HG23 VAL 102 2HG2 VAL 102 7.493 0.988 10.848 742 H ASP 103 H ASP 103 3.269 3.997 11.330 743 HA ASP 103 HA ASP 103 3.875 5.546 8.966 744 HB2 ASP 103 2HB ASP 103 1.925 6.314 10.099 745 HB3 ASP 103 1HB ASP 103 2.715 6.178 11.671 746 H VAL 104 H VAL 104 5.709 6.548 8.666 747 HA VAL 104 HA VAL 104 7.590 6.501 10.886 748 HB VAL 104 HB VAL 104 8.234 5.108 8.983 749 HG11 VAL 104 1HG1 VAL 104 8.909 6.094 6.833 750 HG12 VAL 104 2HG1 VAL 104 8.125 7.598 7.356 751 HG13 VAL 104 3HG1 VAL 104 7.183 6.127 7.180 752 HG21 VAL 104 3HG2 VAL 104 10.066 7.488 9.268 753 HG22 VAL 104 1HG2 VAL 104 10.531 5.930 8.583 754 HG23 VAL 104 2HG2 VAL 104 10.062 6.044 10.280 755 H GLY 105 H GLY 105 5.559 8.593 9.480 756 HA2 GLY 105 2HA GLY 105 5.934 10.772 10.792 757 HA3 GLY 105 1HA GLY 105 7.400 10.850 9.831 758 H SER 106 H SER 106 4.147 9.844 8.798 759 HA SER 106 HA SER 106 4.343 11.595 6.570 760 HB2 SER 106 2HB SER 106 2.021 10.820 6.078 761 HB3 SER 106 1HB SER 106 3.146 9.492 6.333 762 HG SER 106 HG SER 106 2.340 9.267 8.429 763 H LEU 107 H LEU 107 3.799 13.666 6.475 764 HA LEU 107 HA LEU 107 2.731 14.954 8.797 765 HB2 LEU 107 2HB LEU 107 4.475 15.947 7.367 766 HB3 LEU 107 1HB LEU 107 3.333 16.039 6.046 767 HG LEU 107 HG LEU 107 1.966 17.609 7.373 768 HD11 LEU 107 1HD1 LEU 107 2.952 18.672 9.360 769 HD12 LEU 107 2HD1 LEU 107 4.280 17.513 9.308 770 HD13 LEU 107 3HD1 LEU 107 2.634 16.957 9.614 771 HD21 LEU 107 3HD2 LEU 107 3.477 19.534 7.130 772 HD22 LEU 107 1HD2 LEU 107 3.551 18.453 5.737 773 HD23 LEU 107 2HD2 LEU 107 4.836 18.425 6.946 774 H ASN 108 H ASN 108 1.580 13.753 5.804 775 HA ASN 108 HA ASN 108 -0.920 15.182 5.811 776 HB2 ASN 108 2HB ASN 108 -0.137 12.693 4.280 777 HB3 ASN 108 1HB ASN 108 -1.626 13.588 4.045 778 HD21 ASN 108 1HD2 ASN 108 0.377 13.014 2.087 779 HD22 ASN 108 2HD2 ASN 108 0.960 14.505 1.534 780 H GLY 109 H GLY 109 0.306 12.329 7.259 781 HA2 GLY 109 2HA GLY 109 -0.700 11.292 9.076 782 HA3 GLY 109 1HA GLY 109 -2.256 11.921 8.555 783 H THR 110 H THR 110 -0.865 9.162 9.101 784 HA THR 110 HA THR 110 -2.053 7.844 6.784 785 HB THR 110 HB THR 110 -0.054 6.763 8.810 786 HG1 THR 110 1HG THR 110 0.863 8.288 7.389 787 HG21 THR 110 3HG2 THR 110 -1.513 5.005 7.847 788 HG22 THR 110 1HG2 THR 110 0.148 4.859 7.268 789 HG23 THR 110 2HG2 THR 110 -1.088 5.561 6.227 790 H TYR 111 H TYR 111 -3.973 6.948 7.130 791 HA TYR 111 HA TYR 111 -4.783 6.343 9.908 792 HB2 TYR 111 2HB TYR 111 -6.601 7.422 7.727 793 HB3 TYR 111 1HB TYR 111 -7.009 7.154 9.409 794 HD1 TYR 111 1HD TYR 111 -6.212 8.719 11.139 795 HD2 TYR 111 2HD TYR 111 -5.417 9.406 7.020 796 HE1 TYR 111 1HE TYR 111 -5.609 11.050 11.648 797 HE2 TYR 111 2HE TYR 111 -4.814 11.735 7.516 798 HH TYR 111 HH TYR 111 -5.274 13.414 9.255 799 H VAL 112 H VAL 112 -5.887 4.400 10.145 800 HA VAL 112 HA VAL 112 -6.216 2.899 7.664 801 HB VAL 112 HB VAL 112 -6.455 0.826 9.041 802 HG11 VAL 112 1HG1 VAL 112 -4.105 0.624 9.690 803 HG12 VAL 112 2HG1 VAL 112 -3.929 2.375 9.586 804 HG13 VAL 112 3HG1 VAL 112 -4.282 1.437 8.134 805 HG21 VAL 112 3HG2 VAL 112 -5.911 0.828 11.412 806 HG22 VAL 112 1HG2 VAL 112 -7.281 1.882 11.101 807 HG23 VAL 112 2HG2 VAL 112 -5.683 2.581 11.389 808 H ASN 113 H ASN 113 -8.009 2.880 6.766 809 HA ASN 113 HA ASN 113 -10.121 3.219 6.240 810 HB2 ASN 113 2HB ASN 113 -10.441 1.310 7.970 811 HB3 ASN 113 1HB ASN 113 -10.973 2.573 9.074 812 HD21 ASN 113 1HD2 ASN 113 -11.714 0.652 6.403 813 HD22 ASN 113 2HD2 ASN 113 -13.355 1.168 6.155 814 H ARG 114 H ARG 114 -10.343 4.199 9.613 815 HA ARG 114 HA ARG 114 -10.289 7.028 8.949 816 HB2 ARG 114 2HB ARG 114 -12.673 5.719 10.298 817 HB3 ARG 114 1HB ARG 114 -12.372 7.446 10.340 818 HG2 ARG 114 2HG ARG 114 -12.927 5.786 7.878 819 HG3 ARG 114 1HG ARG 114 -14.068 6.869 8.674 820 HD2 ARG 114 2HD ARG 114 -12.607 8.772 8.179 821 HD3 ARG 114 1HD ARG 114 -11.448 7.695 7.408 822 HE ARG 114 HE ARG 114 -14.179 8.140 6.436 823 HH11 ARG 114 1HH1 ARG 114 -10.798 7.422 5.776 824 HH12 ARG 114 2HH1 ARG 114 -10.853 7.811 4.119 825 HH21 ARG 114 1HH2 ARG 114 -14.302 8.635 4.115 826 HH22 ARG 114 2HH2 ARG 114 -12.895 8.570 3.162 827 H GLU 115 H GLU 115 -8.950 4.726 10.643 828 HA GLU 115 HA GLU 115 -9.094 5.969 13.292 829 HB2 GLU 115 2HB GLU 115 -7.808 3.378 12.431 830 HB3 GLU 115 1HB GLU 115 -8.018 3.939 14.079 831 HG2 GLU 115 2HG GLU 115 -10.228 3.219 12.171 832 HG3 GLU 115 1HG GLU 115 -9.632 2.206 13.481 833 HA PRO 116 HA PRO 116 -4.961 7.692 12.334 834 HB2 PRO 116 2HB PRO 116 -5.057 8.617 15.124 835 HB3 PRO 116 1HB PRO 116 -4.934 9.578 13.650 836 HG2 PRO 116 2HG PRO 116 -7.172 9.562 15.152 837 HG3 PRO 116 1HG PRO 116 -7.229 9.707 13.386 838 HD2 PRO 116 2HD PRO 116 -7.720 7.302 15.104 839 HD3 PRO 116 1HD PRO 116 -8.602 7.873 13.667 840 H ARG 117 H ARG 117 -3.414 6.183 12.358 841 HA ARG 117 HA ARG 117 -2.651 4.963 14.897 842 HB2 ARG 117 2HB ARG 117 -3.235 3.507 12.319 843 HB3 ARG 117 1HB ARG 117 -2.340 2.798 13.649 844 HG2 ARG 117 2HG ARG 117 -5.150 3.826 13.906 845 HG3 ARG 117 1HG ARG 117 -4.763 2.160 13.483 846 HD2 ARG 117 2HD ARG 117 -3.918 3.586 16.007 847 HD3 ARG 117 1HD ARG 117 -5.240 2.432 15.883 848 HE ARG 117 HE ARG 117 -2.400 1.740 15.402 849 HH11 ARG 117 1HH1 ARG 117 -5.628 0.765 16.468 850 HH12 ARG 117 2HH1 ARG 117 -5.101 -0.633 17.267 851 HH21 ARG 117 1HH2 ARG 117 -1.672 -0.234 16.409 852 HH22 ARG 117 2HH2 ARG 117 -2.779 -1.225 17.228 853 H ASN 118 H ASN 118 -0.555 5.399 15.144 854 HA ASN 118 HA ASN 118 0.995 5.932 12.768 855 HB2 ASN 118 2HB ASN 118 1.784 6.114 15.686 856 HB3 ASN 118 1HB ASN 118 2.879 6.467 14.354 857 HD21 ASN 118 1HD2 ASN 118 2.553 8.404 13.104 858 HD22 ASN 118 2HD2 ASN 118 1.521 9.628 13.703 859 H ALA 119 H ALA 119 0.433 3.398 15.002 860 HA ALA 119 HA ALA 119 2.013 1.727 13.189 861 HB1 ALA 119 1HB ALA 119 3.330 1.927 15.266 862 HB2 ALA 119 2HB ALA 119 2.661 0.305 15.114 863 HB3 ALA 119 3HB ALA 119 1.914 1.466 16.212 864 H GLN 120 H GLN 120 0.860 -0.013 12.553 865 HA GLN 120 HA GLN 120 -1.529 -0.721 14.035 866 HB2 GLN 120 2HB GLN 120 -1.696 0.942 11.850 867 HB3 GLN 120 1HB GLN 120 -1.955 -0.646 11.140 868 HG2 GLN 120 2HG GLN 120 -3.499 0.442 13.481 869 HG3 GLN 120 1HG GLN 120 -4.015 0.552 11.803 870 HE21 GLN 120 1HE2 GLN 120 -4.847 -1.265 10.802 871 HE22 GLN 120 2HE2 GLN 120 -5.184 -2.712 11.666 872 H VAL 121 H VAL 121 -2.177 -2.877 13.657 873 HA VAL 121 HA VAL 121 -0.145 -4.511 12.432 874 HB VAL 121 HB VAL 121 -1.330 -5.403 14.446 875 HG11 VAL 121 1HG1 VAL 121 -3.668 -6.125 14.363 876 HG12 VAL 121 2HG1 VAL 121 -3.833 -5.378 12.776 877 HG13 VAL 121 3HG1 VAL 121 -3.503 -4.378 14.188 878 HG21 VAL 121 3HG2 VAL 121 -1.926 -7.635 13.599 879 HG22 VAL 121 1HG2 VAL 121 -0.432 -7.027 12.884 880 HG23 VAL 121 2HG2 VAL 121 -1.934 -6.997 11.957 881 H MET 122 H MET 122 -0.208 -5.154 10.362 882 HA MET 122 HA MET 122 -1.998 -3.599 8.775 883 HB2 MET 122 2HB MET 122 0.406 -3.769 8.233 884 HB3 MET 122 1HB MET 122 0.199 -5.473 7.893 885 HG2 MET 122 2HG MET 122 -1.013 -5.049 5.935 886 HG3 MET 122 1HG MET 122 -1.327 -3.376 6.399 887 HE1 MET 122 3HE MET 122 2.903 -4.848 5.198 888 HE2 MET 122 1HE MET 122 1.507 -5.925 5.283 889 HE3 MET 122 2HE MET 122 2.160 -5.202 6.756 890 H GLN 123 H GLN 123 -3.826 -4.138 8.108 891 HA GLN 123 HA GLN 123 -4.729 -6.897 8.389 892 HB2 GLN 123 2HB GLN 123 -5.860 -5.268 9.778 893 HB3 GLN 123 1HB GLN 123 -6.159 -4.238 8.393 894 HG2 GLN 123 2HG GLN 123 -7.572 -6.089 7.441 895 HG3 GLN 123 1HG GLN 123 -7.404 -6.907 8.993 896 HE21 GLN 123 1HE2 GLN 123 -9.778 -5.812 7.620 897 HE22 GLN 123 2HE2 GLN 123 -10.470 -4.691 8.716 898 H THR 124 H THR 124 -5.567 -7.905 6.713 899 HA THR 124 HA THR 124 -5.357 -6.730 4.101 900 HB THR 124 HB THR 124 -5.871 -9.082 3.389 901 HG1 THR 124 1HG THR 124 -7.025 -9.844 5.110 902 HG21 THR 124 3HG2 THR 124 -3.619 -8.780 5.391 903 HG22 THR 124 1HG2 THR 124 -3.550 -8.348 3.682 904 HG23 THR 124 2HG2 THR 124 -3.730 -10.039 4.160 905 H GLY 125 H GLY 125 -7.086 -5.782 3.178 906 HA2 GLY 125 2HA GLY 125 -9.355 -6.299 2.352 907 HA3 GLY 125 1HA GLY 125 -9.758 -6.696 4.017 908 H ASP 126 H ASP 126 -8.090 -4.403 4.959 909 HA ASP 126 HA ASP 126 -10.276 -2.478 4.736 910 HB2 ASP 126 2HB ASP 126 -9.337 -3.300 6.985 911 HB3 ASP 126 1HB ASP 126 -7.910 -2.343 6.619 912 H GLU 127 H GLU 127 -9.533 -0.139 4.734 913 HA GLU 127 HA GLU 127 -7.418 0.019 2.732 914 HB2 GLU 127 2HB GLU 127 -8.505 1.931 1.659 915 HB3 GLU 127 1HB GLU 127 -9.541 0.521 1.681 916 HG2 GLU 127 2HG GLU 127 -10.898 1.475 3.413 917 HG3 GLU 127 1HG GLU 127 -9.790 2.845 3.571 918 H ILE 128 H ILE 128 -5.888 1.429 2.830 919 HA ILE 128 HA ILE 128 -5.550 2.794 5.380 920 HB ILE 128 HB ILE 128 -3.499 2.083 3.250 921 HG12 ILE 128 2HG1 ILE 128 -4.014 0.791 5.944 922 HG13 ILE 128 1HG1 ILE 128 -4.480 0.107 4.392 923 HG21 ILE 128 1HG2 ILE 128 -1.831 2.679 4.951 924 HG22 ILE 128 2HG2 ILE 128 -3.123 3.164 6.049 925 HG23 ILE 128 3HG2 ILE 128 -2.860 4.055 4.553 926 HD11 ILE 128 3HD1 ILE 128 -2.461 -0.932 5.267 927 HD12 ILE 128 1HD1 ILE 128 -1.664 0.639 5.317 928 HD13 ILE 128 2HD1 ILE 128 -2.127 -0.068 3.766 929 H GLN 129 H GLN 129 -5.798 4.890 5.380 930 HA GLN 129 HA GLN 129 -6.046 6.330 2.874 931 HB2 GLN 129 2HB GLN 129 -6.428 7.310 5.697 932 HB3 GLN 129 1HB GLN 129 -6.878 8.150 4.228 933 HG2 GLN 129 2HG GLN 129 -8.083 5.591 5.233 934 HG3 GLN 129 1HG GLN 129 -8.799 7.192 5.364 935 HE21 GLN 129 1HE2 GLN 129 -8.111 4.541 3.299 936 HE22 GLN 129 2HE2 GLN 129 -9.139 4.999 2.002 937 H ILE 130 H ILE 130 -4.267 7.067 2.106 938 HA ILE 130 HA ILE 130 -2.160 7.893 3.933 939 HB ILE 130 HB ILE 130 -0.786 7.962 1.733 940 HG12 ILE 130 2HG1 ILE 130 -3.083 6.188 0.828 941 HG13 ILE 130 1HG1 ILE 130 -2.718 7.788 0.206 942 HG21 ILE 130 1HG2 ILE 130 -0.402 6.319 3.479 943 HG22 ILE 130 2HG2 ILE 130 -0.265 5.553 1.895 944 HG23 ILE 130 3HG2 ILE 130 -1.720 5.323 2.862 945 HD11 ILE 130 3HD1 ILE 130 -2.003 6.011 -1.309 946 HD12 ILE 130 1HD1 ILE 130 -0.960 5.355 -0.049 947 HD13 ILE 130 2HD1 ILE 130 -0.629 6.949 -0.731 948 H GLY 131 H GLY 131 -2.676 9.862 4.534 949 HA2 GLY 131 2HA GLY 131 -3.059 12.090 4.399 950 HA3 GLY 131 1HA GLY 131 -2.581 12.015 2.697 951 H LYS 132 H LYS 132 -4.093 12.307 1.262 952 HA LYS 132 HA LYS 132 -6.917 12.123 2.081 953 HB2 LYS 132 2HB LYS 132 -6.106 14.282 1.128 954 HB3 LYS 132 1HB LYS 132 -5.692 13.432 -0.351 955 HG2 LYS 132 2HG LYS 132 -8.099 12.811 -0.593 956 HG3 LYS 132 1HG LYS 132 -8.453 13.839 0.796 957 HD2 LYS 132 2HD LYS 132 -8.908 15.074 -1.222 958 HD3 LYS 132 1HD LYS 132 -7.469 15.749 -0.457 959 HE2 LYS 132 2HE LYS 132 -6.049 14.505 -2.015 960 HE3 LYS 132 1HE LYS 132 -7.489 13.806 -2.759 961 HZ1 LYS 132 3HZ LYS 132 -6.727 16.672 -2.726 962 HZ2 LYS 132 1HZ LYS 132 -8.152 16.070 -3.417 963 HZ3 LYS 132 2HZ LYS 132 -6.653 15.644 -4.043 964 H PHE 133 H PHE 133 -4.491 10.535 0.339 965 HA PHE 133 HA PHE 133 -6.211 9.538 -1.768 966 HB2 PHE 133 2HB PHE 133 -3.294 8.962 -1.217 967 HB3 PHE 133 1HB PHE 133 -4.191 8.553 -2.681 968 HD1 PHE 133 1HD PHE 133 -5.368 10.605 -3.844 969 HD2 PHE 133 2HD PHE 133 -2.052 10.887 -1.186 970 HE1 PHE 133 1HE PHE 133 -4.809 12.814 -4.779 971 HE2 PHE 133 2HE PHE 133 -1.487 13.082 -2.109 972 HZ PHE 133 HZ PHE 133 -2.873 14.059 -3.910 973 H ARG 134 H ARG 134 -5.981 7.168 -2.258 974 HA ARG 134 HA ARG 134 -6.596 5.798 0.250 975 HB2 ARG 134 2HB ARG 134 -8.585 4.823 -0.954 976 HB3 ARG 134 1HB ARG 134 -8.687 6.533 -0.568 977 HG2 ARG 134 2HG ARG 134 -7.999 7.061 -2.888 978 HG3 ARG 134 1HG ARG 134 -8.049 5.351 -3.282 979 HD2 ARG 134 2HD ARG 134 -10.473 5.404 -2.498 980 HD3 ARG 134 1HD ARG 134 -10.279 7.161 -2.463 981 HE ARG 134 HE ARG 134 -9.742 5.714 -4.956 982 HH11 ARG 134 1HH1 ARG 134 -11.693 8.081 -3.167 983 HH12 ARG 134 2HH1 ARG 134 -12.541 8.624 -4.535 984 HH21 ARG 134 1HH2 ARG 134 -10.946 6.428 -6.842 985 HH22 ARG 134 2HH2 ARG 134 -12.133 7.624 -6.668 986 H LEU 135 H LEU 135 -5.534 4.001 0.472 987 HA LEU 135 HA LEU 135 -4.830 2.387 -1.864 988 HB2 LEU 135 2HB LEU 135 -2.873 3.597 -0.912 989 HB3 LEU 135 1HB LEU 135 -3.236 2.939 0.660 990 HG LEU 135 HG LEU 135 -2.471 1.127 -1.638 991 HD11 LEU 135 1HD1 LEU 135 -0.636 2.544 0.305 992 HD12 LEU 135 2HD1 LEU 135 -0.744 2.859 -1.429 993 HD13 LEU 135 3HD1 LEU 135 -0.153 1.303 -0.855 994 HD21 LEU 135 3HD2 LEU 135 -3.387 0.088 0.408 995 HD22 LEU 135 1HD2 LEU 135 -2.152 0.905 1.369 996 HD23 LEU 135 2HD2 LEU 135 -1.683 -0.315 0.186 997 H VAL 136 H VAL 136 -5.217 0.112 -1.524 998 HA VAL 136 HA VAL 136 -6.465 -0.504 1.060 999 HB VAL 136 HB VAL 136 -7.228 -1.788 -1.573 1000 HG11 VAL 136 1HG1 VAL 136 -9.183 -2.593 -0.334 1001 HG12 VAL 136 2HG1 VAL 136 -8.571 -1.817 1.124 1002 HG13 VAL 136 3HG1 VAL 136 -7.669 -3.138 0.384 1003 HG21 VAL 136 3HG2 VAL 136 -8.716 0.408 -0.139 1004 HG22 VAL 136 1HG2 VAL 136 -9.271 -0.453 -1.579 1005 HG23 VAL 136 2HG2 VAL 136 -7.826 0.570 -1.644 1006 H PHE 137 H PHE 137 -5.634 -2.279 2.024 1007 HA PHE 137 HA PHE 137 -3.523 -3.664 0.530 1008 HB2 PHE 137 2HB PHE 137 -2.966 -2.484 2.714 1009 HB3 PHE 137 1HB PHE 137 -4.007 -3.650 3.521 1010 HD1 PHE 137 2HD PHE 137 -0.898 -3.189 1.656 1011 HD2 PHE 137 1HD PHE 137 -3.270 -5.899 3.914 1012 HE1 PHE 137 2HE PHE 137 1.006 -4.728 1.798 1013 HE2 PHE 137 1HE PHE 137 -1.367 -7.444 4.061 1014 HZ PHE 137 HZ PHE 137 0.774 -6.858 2.998 1015 H LEU 138 H LEU 138 -3.837 -5.830 0.069 1016 HA LEU 138 HA LEU 138 -6.198 -7.047 1.304 1017 HB2 LEU 138 2HB LEU 138 -5.401 -7.282 -1.595 1018 HB3 LEU 138 1HB LEU 138 -6.618 -8.262 -0.827 1019 HG LEU 138 HG LEU 138 -7.754 -6.694 -2.104 1020 HD11 LEU 138 1HD1 LEU 138 -9.021 -5.353 -0.543 1021 HD12 LEU 138 2HD1 LEU 138 -7.806 -5.654 0.695 1022 HD13 LEU 138 3HD1 LEU 138 -8.750 -6.995 0.043 1023 HD21 LEU 138 3HD2 LEU 138 -5.985 -5.131 -2.574 1024 HD22 LEU 138 1HD2 LEU 138 -6.034 -4.536 -0.912 1025 HD23 LEU 138 2HD2 LEU 138 -7.410 -4.269 -1.985 1026 H ALA 139 H ALA 139 -6.258 -9.352 1.096 1027 HA ALA 139 HA ALA 139 -3.814 -10.529 1.903 1028 HB1 ALA 139 1HB ALA 139 -6.470 -11.777 1.187 1029 HB2 ALA 139 2HB ALA 139 -5.954 -11.293 2.805 1030 HB3 ALA 139 3HB ALA 139 -5.124 -12.605 1.967 1031 H GLY 140 H GLY 140 -2.318 -11.159 0.595 1032 HA2 GLY 140 2HA GLY 140 -2.718 -11.301 -2.215 1033 HA3 GLY 140 1HA GLY 140 -1.226 -11.661 -1.351 1034 HA PRO 141 HA PRO 141 -3.002 -15.542 -2.893 1035 HB2 PRO 141 2HB PRO 141 -0.410 -16.364 -3.717 1036 HB3 PRO 141 1HB PRO 141 -1.812 -15.955 -4.704 1037 HG2 PRO 141 2HG PRO 141 0.508 -14.445 -4.591 1038 HG3 PRO 141 1HG PRO 141 -1.071 -13.831 -5.104 1039 HD2 PRO 141 2HD PRO 141 0.311 -13.562 -2.468 1040 HD3 PRO 141 1HD PRO 141 -0.724 -12.401 -3.333 1041 H ALA 142 H ALA 142 -3.338 -16.953 -1.489 1042 HA ALA 142 HA ALA 142 -1.099 -18.183 -0.041 1043 HB1 ALA 142 1HB ALA 142 -2.906 -19.227 1.360 1044 HB2 ALA 142 2HB ALA 142 -4.103 -18.287 0.467 1045 HB3 ALA 142 3HB ALA 142 -2.917 -17.469 1.480 1046 H GLU 143 H GLU 143 -0.384 -19.731 -1.423 1047 HA GLU 143 HA GLU 143 -2.278 -21.419 -2.781 1048 HB2 GLU 143 2HB GLU 143 -2.130 -19.318 -4.135 1049 HB3 GLU 143 1HB GLU 143 -0.404 -19.558 -4.272 1050 HG2 GLU 143 2HG GLU 143 -0.792 -21.591 -5.577 1051 HG3 GLU 143 1HG GLU 143 -2.532 -21.362 -5.409 Start of MODEL 2 1 H1 MET 1 1HT MET 1 -24.287 65.494 65.424 2 H2 MET 1 2HT MET 1 -25.101 64.172 66.023 3 H3 MET 1 3HT MET 1 -25.655 64.915 64.622 4 HA MET 1 HA MET 1 -24.535 62.887 64.079 5 HB2 MET 1 2HB MET 1 -23.178 65.447 63.309 6 HB3 MET 1 1HB MET 1 -22.533 63.911 62.766 7 HG2 MET 1 2HG MET 1 -25.306 64.937 62.211 8 HG3 MET 1 1HG MET 1 -23.945 64.982 61.092 9 HE1 MET 1 2HE MET 1 -26.676 63.705 60.230 10 HE2 MET 1 3HE MET 1 -26.120 62.222 59.453 11 HE3 MET 1 1HE MET 1 -25.235 63.732 59.215 12 H SER 2 H SER 2 -23.171 61.368 64.726 13 HA SER 2 HA SER 2 -21.117 61.884 66.643 14 HB2 SER 2 2HB SER 2 -21.413 59.475 64.826 15 HB3 SER 2 1HB SER 2 -20.661 59.535 66.421 16 HG SER 2 HG SER 2 -22.822 60.151 67.176 17 H ASP 3 H ASP 3 -21.465 61.202 63.242 18 HA ASP 3 HA ASP 3 -20.261 61.405 61.393 19 HB2 ASP 3 2HB ASP 3 -20.423 63.834 62.125 20 HB3 ASP 3 1HB ASP 3 -18.801 63.660 62.779 21 H ASN 4 H ASN 4 -19.315 59.484 61.486 22 HA ASN 4 HA ASN 4 -16.793 59.195 62.895 23 HB2 ASN 4 2HB ASN 4 -17.010 56.786 62.465 24 HB3 ASN 4 1HB ASN 4 -18.442 57.431 63.239 25 HD21 ASN 4 1HD2 ASN 4 -19.714 55.774 62.600 26 HD22 ASN 4 2HD2 ASN 4 -20.190 55.501 60.967 27 H ASN 5 H ASN 5 -15.130 57.815 61.739 28 HA ASN 5 HA ASN 5 -14.807 58.965 59.073 29 HB2 ASN 5 2HB ASN 5 -12.410 58.463 59.233 30 HB3 ASN 5 1HB ASN 5 -12.923 59.450 60.588 31 HD21 ASN 5 1HD2 ASN 5 -12.808 58.606 62.637 32 HD22 ASN 5 2HD2 ASN 5 -12.052 57.093 62.991 33 H GLY 6 H GLY 6 -14.213 57.742 57.362 34 HA2 GLY 6 2HA GLY 6 -14.579 54.849 57.672 35 HA3 GLY 6 1HA GLY 6 -15.160 55.760 56.273 36 H THR 7 H THR 7 -12.425 54.357 57.819 37 HA THR 7 HA THR 7 -10.662 55.384 55.773 38 HB THR 7 HB THR 7 -8.962 54.129 57.269 39 HG1 THR 7 1HG THR 7 -9.893 54.090 59.501 40 HG21 THR 7 3HG2 THR 7 -9.179 56.583 57.201 41 HG22 THR 7 1HG2 THR 7 -8.861 56.021 58.842 42 HG23 THR 7 2HG2 THR 7 -10.493 56.495 58.374 43 HA PRO 8 HA PRO 8 -11.107 51.392 53.657 44 HB2 PRO 8 2HB PRO 8 -8.774 52.384 52.139 45 HB3 PRO 8 1HB PRO 8 -10.361 51.885 51.540 46 HG2 PRO 8 2HG PRO 8 -9.639 54.456 51.552 47 HG3 PRO 8 1HG PRO 8 -11.299 53.951 51.925 48 HD2 PRO 8 2HD PRO 8 -9.114 54.776 53.796 49 HD3 PRO 8 1HD PRO 8 -10.846 55.197 53.801 50 H GLU 9 H GLU 9 -10.090 49.518 54.143 51 HA GLU 9 HA GLU 9 -7.625 49.751 55.620 52 HB2 GLU 9 2HB GLU 9 -9.536 47.433 55.303 53 HB3 GLU 9 1HB GLU 9 -8.070 47.400 56.281 54 HG2 GLU 9 2HG GLU 9 -8.935 49.175 57.688 55 HG3 GLU 9 1HG GLU 9 -10.394 49.267 56.706 56 HA PRO 10 HA PRO 10 -5.102 48.706 52.123 57 HB2 PRO 10 2HB PRO 10 -3.420 47.467 54.233 58 HB3 PRO 10 1HB PRO 10 -2.965 48.605 52.960 59 HG2 PRO 10 2HG PRO 10 -3.242 49.442 55.448 60 HG3 PRO 10 1HG PRO 10 -3.843 50.427 54.099 61 HD2 PRO 10 2HD PRO 10 -5.368 48.741 56.040 62 HD3 PRO 10 1HD PRO 10 -5.776 50.305 55.304 63 H GLN 11 H GLN 11 -4.543 47.000 50.883 64 HA GLN 11 HA GLN 11 -5.243 44.325 51.815 65 HB2 GLN 11 2HB GLN 11 -7.097 45.225 50.456 66 HB3 GLN 11 1HB GLN 11 -5.977 45.606 49.163 67 HG2 GLN 11 2HG GLN 11 -7.298 43.582 48.712 68 HG3 GLN 11 1HG GLN 11 -5.566 43.253 48.772 69 HE21 GLN 11 1HE2 GLN 11 -8.603 42.812 50.351 70 HE22 GLN 11 2HE2 GLN 11 -8.078 41.590 51.453 71 H VAL 12 H VAL 12 -4.078 42.675 50.707 72 HA VAL 12 HA VAL 12 -1.763 43.625 49.220 73 HB VAL 12 HB VAL 12 -1.063 43.042 51.523 74 HG11 VAL 12 1HG1 VAL 12 -2.757 41.419 52.091 75 HG12 VAL 12 2HG1 VAL 12 -1.148 40.747 52.346 76 HG13 VAL 12 3HG1 VAL 12 -2.084 40.279 50.928 77 HG21 VAL 12 3HG2 VAL 12 -0.091 41.090 49.440 78 HG22 VAL 12 1HG2 VAL 12 0.731 41.456 50.956 79 HG23 VAL 12 2HG2 VAL 12 0.535 42.712 49.732 80 H GLU 13 H GLU 13 -1.337 42.502 47.423 81 HA GLU 13 HA GLU 13 -3.162 40.364 46.720 82 HB2 GLU 13 2HB GLU 13 -2.740 42.245 45.115 83 HB3 GLU 13 1HB GLU 13 -1.056 41.751 45.039 84 HG2 GLU 13 2HG GLU 13 -2.362 40.955 43.119 85 HG3 GLU 13 1HG GLU 13 -1.666 39.636 44.065 86 H THR 14 H THR 14 -2.483 38.290 46.424 87 HA THR 14 HA THR 14 -0.021 37.674 47.720 88 HB THR 14 HB THR 14 -0.822 35.256 47.261 89 HG1 THR 14 1HG THR 14 -3.400 36.273 47.053 90 HG21 THR 14 3HG2 THR 14 -0.998 36.355 49.454 91 HG22 THR 14 1HG2 THR 14 -2.426 35.366 49.134 92 HG23 THR 14 2HG2 THR 14 -2.504 37.118 48.953 93 H THR 15 H THR 15 1.562 38.333 46.434 94 HA THR 15 HA THR 15 1.669 37.386 43.694 95 HB THR 15 HB THR 15 3.510 39.329 45.107 96 HG1 THR 15 1HG THR 15 1.063 39.729 44.948 97 HG21 THR 15 3HG2 THR 15 3.913 40.141 42.818 98 HG22 THR 15 1HG2 THR 15 2.789 38.939 42.188 99 HG23 THR 15 2HG2 THR 15 4.296 38.421 42.941 100 H SER 16 H SER 16 2.529 35.377 43.648 101 HA SER 16 HA SER 16 4.700 34.761 45.471 102 HB2 SER 16 2HB SER 16 2.738 32.891 44.140 103 HB3 SER 16 1HB SER 16 3.936 32.472 45.371 104 HG SER 16 HG SER 16 2.529 34.481 46.318 105 H VAL 17 H VAL 17 6.311 33.462 44.613 106 HA VAL 17 HA VAL 17 6.967 34.023 41.839 107 HB VAL 17 HB VAL 17 8.601 32.617 43.975 108 HG11 VAL 17 1HG1 VAL 17 9.321 31.969 41.748 109 HG12 VAL 17 2HG1 VAL 17 10.530 33.022 42.485 110 HG13 VAL 17 3HG1 VAL 17 9.422 33.659 41.267 111 HG21 VAL 17 3HG2 VAL 17 9.863 34.724 44.120 112 HG22 VAL 17 1HG2 VAL 17 8.169 34.936 44.569 113 HG23 VAL 17 2HG2 VAL 17 8.736 35.466 42.984 114 H PHE 18 H PHE 18 6.583 32.623 40.292 115 HA PHE 18 HA PHE 18 5.919 29.864 41.010 116 HB2 PHE 18 2HB PHE 18 5.462 31.295 38.382 117 HB3 PHE 18 1HB PHE 18 4.884 29.687 38.808 118 HD1 PHE 18 1HD PHE 18 3.301 29.508 40.810 119 HD2 PHE 18 2HD PHE 18 4.172 33.151 38.806 120 HE1 PHE 18 1HE PHE 18 1.244 30.498 41.725 121 HE2 PHE 18 2HE PHE 18 2.126 34.149 39.715 122 HZ PHE 18 HZ PHE 18 0.660 32.830 41.176 123 H ARG 19 H ARG 19 7.631 28.619 41.007 124 HA ARG 19 HA ARG 19 9.681 28.944 38.940 125 HB2 ARG 19 2HB ARG 19 9.693 27.600 41.623 126 HB3 ARG 19 1HB ARG 19 10.950 27.312 40.433 127 HG2 ARG 19 2HG ARG 19 11.570 29.635 40.478 128 HG3 ARG 19 1HG ARG 19 10.240 29.995 41.580 129 HD2 ARG 19 2HD ARG 19 12.476 29.776 42.670 130 HD3 ARG 19 1HD ARG 19 11.242 28.718 43.328 131 HE ARG 19 HE ARG 19 12.257 26.913 41.982 132 HH11 ARG 19 1HH1 ARG 19 14.244 29.730 42.796 133 HH12 ARG 19 2HH1 ARG 19 15.714 28.866 42.789 134 HH21 ARG 19 1HH2 ARG 19 14.258 25.743 41.996 135 HH22 ARG 19 2HH2 ARG 19 15.745 26.556 42.284 136 H ALA 20 H ALA 20 10.596 26.962 38.030 137 HA ALA 20 HA ALA 20 8.643 24.804 37.909 138 HB1 ALA 20 1HB ALA 20 9.447 24.342 35.638 139 HB2 ALA 20 2HB ALA 20 10.538 25.724 35.738 140 HB3 ALA 20 3HB ALA 20 8.789 25.973 35.762 141 H ASP 21 H ASP 21 9.666 23.960 39.721 142 HA ASP 21 HA ASP 21 12.422 23.052 39.475 143 HB2 ASP 21 2HB ASP 21 10.457 22.962 41.765 144 HB3 ASP 21 1HB ASP 21 12.035 22.204 41.817 145 H LEU 22 H LEU 22 9.170 21.856 39.379 146 HA LEU 22 HA LEU 22 10.025 19.144 39.739 147 HB2 LEU 22 2HB LEU 22 7.298 20.235 39.100 148 HB3 LEU 22 1HB LEU 22 7.652 18.558 39.457 149 HG LEU 22 HG LEU 22 8.007 20.866 41.372 150 HD11 LEU 22 1HD1 LEU 22 5.678 20.354 40.956 151 HD12 LEU 22 2HD1 LEU 22 6.157 19.860 42.582 152 HD13 LEU 22 3HD1 LEU 22 5.985 18.653 41.306 153 HD21 LEU 22 3HD2 LEU 22 8.413 19.107 43.052 154 HD22 LEU 22 1HD2 LEU 22 9.655 19.124 41.799 155 HD23 LEU 22 2HD2 LEU 22 8.391 17.900 41.765 156 H LEU 23 H LEU 23 11.412 18.919 38.099 157 HA LEU 23 HA LEU 23 10.270 17.751 35.721 158 HB2 LEU 23 2HB LEU 23 10.780 20.260 35.258 159 HB3 LEU 23 1HB LEU 23 12.459 19.864 35.510 160 HG LEU 23 HG LEU 23 10.728 18.734 33.289 161 HD11 LEU 23 1HD1 LEU 23 11.057 21.113 33.022 162 HD12 LEU 23 2HD1 LEU 23 11.987 20.222 31.819 163 HD13 LEU 23 3HD1 LEU 23 12.797 20.913 33.224 164 HD21 LEU 23 3HD2 LEU 23 13.725 18.608 33.687 165 HD22 LEU 23 1HD2 LEU 23 12.840 17.991 32.290 166 HD23 LEU 23 2HD2 LEU 23 12.610 17.256 33.879 167 H LYS 24 H LYS 24 11.395 15.841 35.611 168 HA LYS 24 HA LYS 24 13.937 15.833 37.031 169 HB2 LYS 24 2HB LYS 24 13.495 13.532 37.786 170 HB3 LYS 24 1HB LYS 24 12.383 14.720 38.437 171 HG2 LYS 24 2HG LYS 24 10.746 13.977 36.655 172 HG3 LYS 24 1HG LYS 24 11.861 12.652 36.314 173 HD2 LYS 24 2HD LYS 24 10.608 13.204 39.014 174 HD3 LYS 24 1HD LYS 24 10.024 12.025 37.854 175 HE2 LYS 24 2HE LYS 24 12.808 11.957 39.023 176 HE3 LYS 24 1HE LYS 24 11.433 11.135 39.741 177 HZ1 LYS 24 3HZ LYS 24 12.696 9.643 38.379 178 HZ2 LYS 24 1HZ LYS 24 12.487 10.569 36.982 179 HZ3 LYS 24 2HZ LYS 24 11.165 9.872 37.731 180 H GLU 25 H GLU 25 12.299 14.525 34.150 181 HA GLU 25 HA GLU 25 14.879 14.021 33.023 182 HB2 GLU 25 2HB GLU 25 14.597 11.613 32.686 183 HB3 GLU 25 1HB GLU 25 14.722 12.043 34.383 184 HG2 GLU 25 2HG GLU 25 12.215 11.914 34.495 185 HG3 GLU 25 1HG GLU 25 12.252 11.265 32.862 186 H MET 26 H MET 26 14.749 13.125 30.852 187 HA MET 26 HA MET 26 12.126 13.238 29.566 188 HB2 MET 26 2HB MET 26 14.594 14.744 28.636 189 HB3 MET 26 1HB MET 26 13.185 14.441 27.631 190 HG2 MET 26 2HG MET 26 11.810 15.734 29.214 191 HG3 MET 26 1HG MET 26 13.250 16.061 30.169 192 HE1 MET 26 3HE MET 26 11.488 16.583 26.687 193 HE2 MET 26 1HE MET 26 13.050 15.916 26.216 194 HE3 MET 26 2HE MET 26 12.663 17.591 25.844 195 H GLU 27 H GLU 27 14.212 11.329 30.473 196 HA GLU 27 HA GLU 27 15.454 10.270 28.168 197 HB2 GLU 27 2HB GLU 27 15.109 9.139 30.947 198 HB3 GLU 27 1HB GLU 27 15.953 8.288 29.667 199 HG2 GLU 27 2HG GLU 27 17.615 9.302 30.999 200 HG3 GLU 27 1HG GLU 27 17.522 10.257 29.531 201 H SER 28 H SER 28 14.416 9.362 26.628 202 HA SER 28 HA SER 28 12.441 7.330 27.251 203 HB2 SER 28 2HB SER 28 12.082 9.526 25.196 204 HB3 SER 28 1HB SER 28 10.966 8.187 25.490 205 HG SER 28 HG SER 28 11.115 9.078 27.772 206 H SER 29 H SER 29 12.524 5.621 25.862 207 HA SER 29 HA SER 29 14.867 5.289 24.290 208 HB2 SER 29 2HB SER 29 13.707 3.032 23.931 209 HB3 SER 29 1HB SER 29 14.119 3.461 25.596 210 HG SER 29 HG SER 29 11.620 3.594 24.302 211 H THR 30 H THR 30 15.005 5.460 22.079 212 HA THR 30 HA THR 30 12.756 6.546 20.673 213 HB THR 30 HB THR 30 14.407 6.597 18.747 214 HG1 THR 30 1HG THR 30 15.820 5.010 19.347 215 HG21 THR 30 3HG2 THR 30 15.211 7.936 21.333 216 HG22 THR 30 1HG2 THR 30 14.034 8.546 20.172 217 HG23 THR 30 2HG2 THR 30 15.738 8.429 19.724 218 H GLY 31 H GLY 31 11.747 5.660 18.869 219 HA2 GLY 31 2HA GLY 31 11.280 2.911 18.823 220 HA3 GLY 31 1HA GLY 31 10.841 4.058 17.557 221 H THR 32 H THR 32 12.353 1.321 17.970 222 HA THR 32 HA THR 32 14.769 1.937 16.563 223 HB THR 32 HB THR 32 13.676 -0.710 17.453 224 HG1 THR 32 1HG THR 32 14.479 1.344 18.861 225 HG21 THR 32 3HG2 THR 32 15.492 -0.875 15.767 226 HG22 THR 32 1HG2 THR 32 16.023 -1.469 17.342 227 HG23 THR 32 2HG2 THR 32 16.514 0.130 16.796 228 H ALA 33 H ALA 33 15.029 1.685 14.544 229 HA ALA 33 HA ALA 33 12.823 1.114 12.784 230 HB1 ALA 33 1HB ALA 33 14.348 2.965 12.299 231 HB2 ALA 33 2HB ALA 33 14.391 1.774 11.002 232 HB3 ALA 33 3HB ALA 33 15.697 1.836 12.184 233 HA PRO 34 HA PRO 34 14.312 -3.117 12.740 234 HB2 PRO 34 2HB PRO 34 12.033 -3.905 11.221 235 HB3 PRO 34 1HB PRO 34 12.383 -4.205 12.923 236 HG2 PRO 34 2HG PRO 34 10.364 -2.546 12.031 237 HG3 PRO 34 1HG PRO 34 11.135 -2.437 13.621 238 HD2 PRO 34 2HD PRO 34 11.605 -0.796 11.173 239 HD3 PRO 34 1HD PRO 34 11.580 -0.326 12.892 240 H ALA 35 H ALA 35 15.937 -3.194 11.445 241 HA ALA 35 HA ALA 35 15.540 -3.455 8.548 242 HB1 ALA 35 1HB ALA 35 18.086 -3.305 10.193 243 HB2 ALA 35 2HB ALA 35 17.393 -1.980 9.259 244 HB3 ALA 35 3HB ALA 35 18.015 -3.410 8.434 245 H SER 36 H SER 36 16.628 -5.019 11.462 246 HA SER 36 HA SER 36 17.193 -7.508 10.275 247 HB2 SER 36 2HB SER 36 16.656 -6.811 13.171 248 HB3 SER 36 1HB SER 36 17.476 -8.254 12.575 249 HG SER 36 HG SER 36 19.224 -7.148 12.190 250 H THR 37 H THR 37 15.174 -7.672 9.092 251 HA THR 37 HA THR 37 12.915 -8.529 10.714 252 HB THR 37 HB THR 37 13.105 -8.049 7.713 253 HG1 THR 37 1HG THR 37 12.689 -6.045 8.272 254 HG21 THR 37 3HG2 THR 37 10.678 -8.606 9.441 255 HG22 THR 37 1HG2 THR 37 11.371 -9.723 8.265 256 HG23 THR 37 2HG2 THR 37 10.642 -8.205 7.727 257 H GLY 38 H GLY 38 15.402 -9.740 8.617 258 HA2 GLY 38 2HA GLY 38 16.232 -11.877 8.544 259 HA3 GLY 38 1HA GLY 38 14.901 -12.395 9.572 260 H ALA 39 H ALA 39 15.555 -11.265 6.298 261 HA ALA 39 HA ALA 39 13.207 -12.182 5.078 262 HB1 ALA 39 1HB ALA 39 15.931 -11.899 3.819 263 HB2 ALA 39 2HB ALA 39 14.794 -10.583 4.071 264 HB3 ALA 39 3HB ALA 39 14.381 -11.904 2.973 265 H GLU 40 H GLU 40 16.044 -13.881 5.987 266 HA GLU 40 HA GLU 40 15.520 -16.212 4.388 267 HB2 GLU 40 2HB GLU 40 17.376 -17.209 5.681 268 HB3 GLU 40 1HB GLU 40 17.787 -15.665 4.957 269 HG2 GLU 40 2HG GLU 40 17.163 -14.676 7.270 270 HG3 GLU 40 1HG GLU 40 17.318 -16.334 7.832 271 H ASN 41 H ASN 41 14.671 -15.145 7.576 272 HA ASN 41 HA ASN 41 13.742 -17.757 8.442 273 HB2 ASN 41 2HB ASN 41 13.827 -15.072 9.801 274 HB3 ASN 41 1HB ASN 41 12.899 -16.405 10.479 275 HD21 ASN 41 1HD2 ASN 41 16.074 -15.112 9.917 276 HD22 ASN 41 2HD2 ASN 41 16.908 -16.350 10.776 277 H LEU 42 H LEU 42 12.442 -14.750 7.351 278 HA LEU 42 HA LEU 42 9.737 -15.328 7.969 279 HB2 LEU 42 2HB LEU 42 10.862 -13.071 7.750 280 HB3 LEU 42 1HB LEU 42 10.876 -13.319 6.025 281 HG LEU 42 HG LEU 42 8.299 -13.204 7.611 282 HD11 LEU 42 1HD1 LEU 42 9.784 -10.972 6.242 283 HD12 LEU 42 2HD1 LEU 42 9.582 -11.172 7.985 284 HD13 LEU 42 3HD1 LEU 42 8.179 -10.868 6.966 285 HD21 LEU 42 3HD2 LEU 42 8.160 -14.128 5.330 286 HD22 LEU 42 1HD2 LEU 42 8.926 -12.668 4.706 287 HD23 LEU 42 2HD2 LEU 42 7.338 -12.573 5.467 288 HA PRO 43 HA PRO 43 9.161 -18.127 4.452 289 HB2 PRO 43 2HB PRO 43 6.300 -17.768 5.135 290 HB3 PRO 43 1HB PRO 43 7.243 -19.256 5.033 291 HG2 PRO 43 2HG PRO 43 6.489 -18.279 7.386 292 HG3 PRO 43 1HG PRO 43 8.078 -19.038 7.176 293 HD2 PRO 43 2HD PRO 43 7.367 -16.132 7.321 294 HD3 PRO 43 1HD PRO 43 8.735 -17.016 8.044 295 H ALA 44 H ALA 44 8.579 -17.834 2.330 296 HA ALA 44 HA ALA 44 8.032 -15.141 1.531 297 HB1 ALA 44 1HB ALA 44 8.299 -17.610 -0.183 298 HB2 ALA 44 2HB ALA 44 9.612 -16.519 0.264 299 HB3 ALA 44 3HB ALA 44 8.301 -15.943 -0.762 300 H GLY 45 H GLY 45 6.073 -14.499 2.007 301 HA2 GLY 45 2HA GLY 45 3.842 -15.593 0.515 302 HA3 GLY 45 1HA GLY 45 3.683 -15.504 2.274 303 H SER 46 H SER 46 3.942 -13.723 -0.640 304 HA SER 46 HA SER 46 4.051 -11.167 0.688 305 HB2 SER 46 2HB SER 46 3.885 -11.886 -2.225 306 HB3 SER 46 1HB SER 46 4.240 -10.292 -1.560 307 HG SER 46 HG SER 46 6.163 -10.861 -1.125 308 H ALA 47 H ALA 47 2.610 -9.417 -0.034 309 HA ALA 47 HA ALA 47 -0.131 -10.239 -0.620 310 HB1 ALA 47 1HB ALA 47 0.062 -9.879 1.793 311 HB2 ALA 47 2HB ALA 47 -0.889 -8.589 1.048 312 HB3 ALA 47 3HB ALA 47 0.786 -8.296 1.509 313 H LEU 48 H LEU 48 -1.385 -8.153 -1.304 314 HA LEU 48 HA LEU 48 0.476 -6.398 -2.666 315 HB2 LEU 48 2HB LEU 48 -0.741 -6.438 -4.779 316 HB3 LEU 48 1HB LEU 48 -0.131 -8.012 -4.378 317 HG LEU 48 HG LEU 48 -2.206 -8.284 -5.469 318 HD11 LEU 48 1HD1 LEU 48 -3.615 -9.459 -3.916 319 HD12 LEU 48 2HD1 LEU 48 -2.674 -8.797 -2.577 320 HD13 LEU 48 3HD1 LEU 48 -1.906 -9.858 -3.759 321 HD21 LEU 48 3HD2 LEU 48 -3.194 -6.098 -5.208 322 HD22 LEU 48 1HD2 LEU 48 -3.478 -6.398 -3.494 323 HD23 LEU 48 2HD2 LEU 48 -4.343 -7.338 -4.710 324 H LEU 49 H LEU 49 -0.325 -4.415 -3.330 325 HA LEU 49 HA LEU 49 -2.757 -3.620 -1.936 326 HB2 LEU 49 2HB LEU 49 -1.631 -1.434 -1.396 327 HB3 LEU 49 1HB LEU 49 -1.028 -2.824 -0.553 328 HG LEU 49 HG LEU 49 0.916 -2.878 -2.181 329 HD11 LEU 49 1HD1 LEU 49 0.009 -1.504 -3.966 330 HD12 LEU 49 2HD1 LEU 49 1.530 -0.858 -3.357 331 HD13 LEU 49 3HD1 LEU 49 0.011 -0.096 -2.902 332 HD21 LEU 49 3HD2 LEU 49 1.143 -2.060 0.095 333 HD22 LEU 49 1HD2 LEU 49 0.639 -0.452 -0.418 334 HD23 LEU 49 2HD2 LEU 49 2.154 -1.128 -1.010 335 H VAL 50 H VAL 50 -4.050 -2.078 -2.963 336 HA VAL 50 HA VAL 50 -3.122 -1.298 -5.633 337 HB VAL 50 HB VAL 50 -5.060 -1.866 -6.783 338 HG11 VAL 50 1HG1 VAL 50 -5.645 -4.161 -6.374 339 HG12 VAL 50 2HG1 VAL 50 -4.974 -4.045 -4.752 340 HG13 VAL 50 3HG1 VAL 50 -3.911 -3.887 -6.142 341 HG21 VAL 50 3HG2 VAL 50 -7.255 -2.420 -5.833 342 HG22 VAL 50 1HG2 VAL 50 -6.723 -0.805 -5.360 343 HG23 VAL 50 2HG2 VAL 50 -6.612 -2.144 -4.215 344 H VAL 51 H VAL 51 -3.622 0.702 -6.278 345 HA VAL 51 HA VAL 51 -4.686 2.495 -4.191 346 HB VAL 51 HB VAL 51 -3.135 3.171 -6.756 347 HG11 VAL 51 1HG1 VAL 51 -3.068 5.448 -5.867 348 HG12 VAL 51 2HG1 VAL 51 -4.062 4.960 -4.495 349 HG13 VAL 51 3HG1 VAL 51 -4.737 4.943 -6.125 350 HG21 VAL 51 3HG2 VAL 51 -1.401 3.878 -5.150 351 HG22 VAL 51 1HG2 VAL 51 -1.733 2.138 -5.066 352 HG23 VAL 51 2HG2 VAL 51 -2.389 3.235 -3.850 353 H LYS 52 H LYS 52 -6.707 2.980 -4.195 354 HA LYS 52 HA LYS 52 -8.375 2.512 -6.464 355 HB2 LYS 52 2HB LYS 52 -8.901 3.843 -3.817 356 HB3 LYS 52 1HB LYS 52 -10.098 3.864 -5.096 357 HG2 LYS 52 2HG LYS 52 -10.038 1.362 -5.083 358 HG3 LYS 52 1HG LYS 52 -8.996 1.458 -3.659 359 HD2 LYS 52 2HD LYS 52 -10.694 2.578 -2.398 360 HD3 LYS 52 1HD LYS 52 -11.699 2.788 -3.829 361 HE2 LYS 52 2HE LYS 52 -12.588 1.006 -2.455 362 HE3 LYS 52 1HE LYS 52 -11.977 0.345 -3.969 363 HZ1 LYS 52 3HZ LYS 52 -10.679 0.232 -1.309 364 HZ2 LYS 52 1HZ LYS 52 -9.946 -0.314 -2.739 365 HZ3 LYS 52 2HZ LYS 52 -11.356 -1.036 -2.162 366 H ARG 53 H ARG 53 -6.885 5.297 -5.041 367 HA ARG 53 HA ARG 53 -6.831 6.676 -7.477 368 HB2 ARG 53 2HB ARG 53 -9.212 7.147 -6.961 369 HB3 ARG 53 1HB ARG 53 -8.726 7.858 -5.424 370 HG2 ARG 53 2HG ARG 53 -7.502 9.592 -6.548 371 HG3 ARG 53 1HG ARG 53 -7.810 8.847 -8.107 372 HD2 ARG 53 2HD ARG 53 -10.210 9.223 -7.755 373 HD3 ARG 53 1HD ARG 53 -9.826 10.093 -6.259 374 HE ARG 53 HE ARG 53 -8.323 11.402 -7.933 375 HH11 ARG 53 1HH1 ARG 53 -11.673 10.372 -8.350 376 HH12 ARG 53 2HH1 ARG 53 -12.065 11.582 -9.484 377 HH21 ARG 53 1HH2 ARG 53 -8.849 13.084 -9.507 378 HH22 ARG 53 2HH2 ARG 53 -10.400 13.150 -10.166 379 H GLY 54 H GLY 54 -5.252 8.099 -7.440 380 HA2 GLY 54 2HA GLY 54 -4.453 9.922 -5.752 381 HA3 GLY 54 1HA GLY 54 -3.843 8.470 -4.963 382 HA PRO 55 HA PRO 55 -1.142 9.732 -8.738 383 HB2 PRO 55 2HB PRO 55 0.337 11.563 -6.943 384 HB3 PRO 55 1HB PRO 55 -0.175 11.813 -8.618 385 HG2 PRO 55 2HG PRO 55 -1.386 13.095 -6.623 386 HG3 PRO 55 1HG PRO 55 -2.313 12.461 -7.993 387 HD2 PRO 55 2HD PRO 55 -1.960 11.294 -5.257 388 HD3 PRO 55 1HD PRO 55 -3.438 11.495 -6.232 389 H ASN 56 H ASN 56 -0.882 8.847 -5.534 390 HA ASN 56 HA ASN 56 1.740 8.007 -5.009 391 HB2 ASN 56 2HB ASN 56 -0.846 6.563 -4.318 392 HB3 ASN 56 1HB ASN 56 0.726 6.200 -3.620 393 HD21 ASN 56 1HD2 ASN 56 -1.706 7.045 -2.265 394 HD22 ASN 56 2HD2 ASN 56 -1.300 8.519 -1.462 395 H ALA 57 H ALA 57 -0.834 6.243 -6.774 396 HA ALA 57 HA ALA 57 0.887 5.071 -8.596 397 HB1 ALA 57 1HB ALA 57 1.593 3.623 -6.719 398 HB2 ALA 57 2HB ALA 57 0.681 2.703 -7.913 399 HB3 ALA 57 3HB ALA 57 -0.090 3.184 -6.411 400 H GLY 58 H GLY 58 -0.575 3.041 -9.489 401 HA2 GLY 58 2HA GLY 58 -3.396 3.582 -9.336 402 HA3 GLY 58 1HA GLY 58 -2.656 4.133 -10.838 403 H ALA 59 H ALA 59 -1.910 1.356 -8.840 404 HA ALA 59 HA ALA 59 -2.932 -0.541 -10.689 405 HB1 ALA 59 1HB ALA 59 0.061 -0.202 -10.360 406 HB2 ALA 59 2HB ALA 59 -0.848 0.115 -11.835 407 HB3 ALA 59 3HB ALA 59 -0.732 -1.532 -11.207 408 H ARG 60 H ARG 60 -1.419 -2.651 -9.846 409 HA ARG 60 HA ARG 60 -1.792 -2.663 -6.951 410 HB2 ARG 60 2HB ARG 60 -2.287 -5.083 -7.182 411 HB3 ARG 60 1HB ARG 60 -3.428 -4.049 -8.041 412 HG2 ARG 60 2HG ARG 60 -2.372 -4.551 -10.140 413 HG3 ARG 60 1HG ARG 60 -1.155 -5.527 -9.317 414 HD2 ARG 60 2HD ARG 60 -2.872 -7.078 -8.573 415 HD3 ARG 60 1HD ARG 60 -4.119 -6.071 -9.313 416 HE ARG 60 HE ARG 60 -2.731 -6.488 -11.415 417 HH11 ARG 60 1HH1 ARG 60 -3.359 -8.938 -8.909 418 HH12 ARG 60 2HH1 ARG 60 -3.195 -10.236 -9.993 419 HH21 ARG 60 1HH2 ARG 60 -2.569 -8.259 -12.839 420 HH22 ARG 60 2HH2 ARG 60 -2.739 -9.854 -12.267 421 H PHE 61 H PHE 61 -0.119 -3.334 -5.750 422 HA PHE 61 HA PHE 61 2.214 -4.379 -7.179 423 HB2 PHE 61 2HB PHE 61 2.211 -2.208 -5.085 424 HB3 PHE 61 1HB PHE 61 3.662 -3.080 -5.561 425 HD1 PHE 61 1HD PHE 61 1.147 -0.623 -6.593 426 HD2 PHE 61 2HD PHE 61 4.678 -2.717 -7.715 427 HE1 PHE 61 1HE PHE 61 1.473 0.930 -8.469 428 HE2 PHE 61 2HE PHE 61 5.012 -1.163 -9.587 429 HZ PHE 61 HZ PHE 61 3.405 0.662 -9.969 430 H LEU 62 H LEU 62 2.847 -6.203 -6.504 431 HA LEU 62 HA LEU 62 1.974 -7.301 -3.962 432 HB2 LEU 62 2HB LEU 62 1.907 -8.608 -6.111 433 HB3 LEU 62 1HB LEU 62 3.647 -8.481 -6.208 434 HG LEU 62 HG LEU 62 3.798 -9.835 -4.099 435 HD11 LEU 62 1HD1 LEU 62 1.834 -11.094 -3.396 436 HD12 LEU 62 2HD1 LEU 62 0.845 -10.203 -4.554 437 HD13 LEU 62 3HD1 LEU 62 1.590 -9.361 -3.195 438 HD21 LEU 62 3HD2 LEU 62 2.299 -11.145 -6.360 439 HD22 LEU 62 1HD2 LEU 62 3.296 -11.960 -5.162 440 HD23 LEU 62 2HD2 LEU 62 4.037 -10.863 -6.331 441 H LEU 63 H LEU 63 3.269 -7.032 -2.207 442 HA LEU 63 HA LEU 63 5.892 -5.888 -2.594 443 HB2 LEU 63 2HB LEU 63 4.507 -6.656 -0.013 444 HB3 LEU 63 1HB LEU 63 6.028 -5.807 -0.117 445 HG LEU 63 HG LEU 63 4.465 -4.168 0.419 446 HD11 LEU 63 1HD1 LEU 63 4.782 -3.969 -2.555 447 HD12 LEU 63 2HD1 LEU 63 5.952 -3.469 -1.340 448 HD13 LEU 63 3HD1 LEU 63 4.392 -2.647 -1.453 449 HD21 LEU 63 3HD2 LEU 63 2.640 -5.223 -1.744 450 HD22 LEU 63 1HD2 LEU 63 2.331 -3.807 -0.737 451 HD23 LEU 63 2HD2 LEU 63 2.412 -5.411 -0.006 452 H ASP 64 H ASP 64 7.581 -7.023 -2.961 453 HA ASP 64 HA ASP 64 7.629 -9.887 -2.340 454 HB2 ASP 64 2HB ASP 64 8.098 -9.100 -4.636 455 HB3 ASP 64 1HB ASP 64 9.455 -8.171 -4.027 456 H GLN 65 H GLN 65 8.879 -6.954 -1.309 457 HA GLN 65 HA GLN 65 11.253 -8.095 -0.056 458 HB2 GLN 65 2HB GLN 65 11.799 -5.673 0.376 459 HB3 GLN 65 1HB GLN 65 11.748 -6.162 -1.313 460 HG2 GLN 65 2HG GLN 65 9.497 -5.224 -1.503 461 HG3 GLN 65 1HG GLN 65 9.571 -4.728 0.182 462 HE21 GLN 65 1HE2 GLN 65 12.350 -3.906 0.061 463 HE22 GLN 65 2HE2 GLN 65 12.340 -2.438 -0.852 464 HA PRO 66 HA PRO 66 9.381 -8.349 3.939 465 HB2 PRO 66 2HB PRO 66 11.631 -8.099 5.486 466 HB3 PRO 66 1HB PRO 66 11.146 -9.581 4.649 467 HG2 PRO 66 2HG PRO 66 13.134 -7.505 3.824 468 HG3 PRO 66 1HG PRO 66 13.251 -9.270 3.729 469 HD2 PRO 66 2HD PRO 66 12.659 -7.797 1.575 470 HD3 PRO 66 1HD PRO 66 11.922 -9.388 1.841 471 H THR 67 H THR 67 11.390 -5.589 3.197 472 HA THR 67 HA THR 67 9.737 -4.049 5.042 473 HB THR 67 HB THR 67 12.741 -3.652 4.784 474 HG1 THR 67 1HG THR 67 11.156 -5.262 6.323 475 HG21 THR 67 3HG2 THR 67 10.700 -2.480 6.698 476 HG22 THR 67 1HG2 THR 67 11.444 -1.613 5.355 477 HG23 THR 67 2HG2 THR 67 12.432 -2.157 6.714 478 H THR 68 H THR 68 8.562 -2.888 3.711 479 HA THR 68 HA THR 68 9.781 -1.755 1.294 480 HB THR 68 HB THR 68 6.840 -1.973 1.990 481 HG1 THR 68 1HG THR 68 8.387 -3.979 1.626 482 HG21 THR 68 3HG2 THR 68 8.274 -1.643 -0.652 483 HG22 THR 68 1HG2 THR 68 7.480 -0.344 0.240 484 HG23 THR 68 2HG2 THR 68 6.528 -1.680 -0.403 485 H THR 69 H THR 69 10.246 0.395 1.378 486 HA THR 69 HA THR 69 9.178 1.977 3.583 487 HB THR 69 HB THR 69 11.248 2.883 1.609 488 HG1 THR 69 1HG THR 69 11.964 0.930 2.126 489 HG21 THR 69 3HG2 THR 69 12.143 4.015 3.605 490 HG22 THR 69 1HG2 THR 69 10.893 3.259 4.594 491 HG23 THR 69 2HG2 THR 69 10.445 4.432 3.361 492 H ALA 70 H ALA 70 7.442 3.290 3.144 493 HA ALA 70 HA ALA 70 6.973 4.077 0.381 494 HB1 ALA 70 1HB ALA 70 4.723 4.681 1.130 495 HB2 ALA 70 2HB ALA 70 5.157 4.259 2.786 496 HB3 ALA 70 3HB ALA 70 5.101 3.009 1.545 497 H GLY 71 H GLY 71 7.103 6.107 -0.251 498 HA2 GLY 71 2HA GLY 71 6.996 8.347 1.447 499 HA3 GLY 71 1HA GLY 71 8.661 7.958 0.995 500 H ARG 72 H ARG 72 8.819 9.829 -0.317 501 HA ARG 72 HA ARG 72 6.912 9.894 -2.494 502 HB2 ARG 72 2HB ARG 72 7.565 12.021 -1.297 503 HB3 ARG 72 1HB ARG 72 9.126 11.893 -2.107 504 HG2 ARG 72 2HG ARG 72 8.059 11.974 -4.271 505 HG3 ARG 72 1HG ARG 72 6.469 11.999 -3.513 506 HD2 ARG 72 2HD ARG 72 7.191 14.148 -2.398 507 HD3 ARG 72 1HD ARG 72 8.584 14.135 -3.485 508 HE ARG 72 HE ARG 72 6.060 13.800 -4.826 509 HH11 ARG 72 1HH1 ARG 72 8.371 16.218 -3.684 510 HH12 ARG 72 2HH1 ARG 72 7.774 17.447 -4.694 511 HH21 ARG 72 1HH2 ARG 72 5.289 15.372 -6.169 512 HH22 ARG 72 2HH2 ARG 72 5.913 16.953 -6.181 513 H HIS 73 H HIS 73 10.374 9.278 -2.030 514 HA HIS 73 HA HIS 73 10.564 7.739 -4.320 515 HB2 HIS 73 2HB HIS 73 10.250 9.881 -5.560 516 HB3 HIS 73 1HB HIS 73 11.750 10.480 -4.870 517 HD1 HIS 73 1HD HIS 73 13.980 9.547 -5.895 518 HD2 HIS 73 2HD HIS 73 10.516 7.945 -7.535 519 HE1 HIS 73 1HE HIS 73 14.702 8.260 -7.906 520 HA PRO 74 HA PRO 74 15.255 9.085 -3.250 521 HB2 PRO 74 2HB PRO 74 14.767 9.857 -0.415 522 HB3 PRO 74 1HB PRO 74 15.980 10.458 -1.549 523 HG2 PRO 74 2HG PRO 74 13.864 11.921 -1.076 524 HG3 PRO 74 1HG PRO 74 14.403 11.708 -2.756 525 HD2 PRO 74 2HD PRO 74 12.133 10.392 -1.312 526 HD3 PRO 74 1HD PRO 74 12.187 11.043 -2.961 527 H GLU 75 H GLU 75 13.442 7.755 -0.445 528 HA GLU 75 HA GLU 75 15.307 5.478 -0.589 529 HB2 GLU 75 2HB GLU 75 15.269 5.251 1.789 530 HB3 GLU 75 1HB GLU 75 15.625 6.935 1.453 531 HG2 GLU 75 2HG GLU 75 12.950 5.825 2.294 532 HG3 GLU 75 1HG GLU 75 14.102 6.664 3.326 533 H SER 76 H SER 76 12.546 6.383 -1.462 534 HA SER 76 HA SER 76 10.761 4.574 -0.146 535 HB2 SER 76 2HB SER 76 10.306 6.249 -2.595 536 HB3 SER 76 1HB SER 76 9.115 5.684 -1.415 537 HG SER 76 HG SER 76 10.992 7.125 -0.087 538 H ASP 77 H ASP 77 10.600 2.544 -0.776 539 HA ASP 77 HA ASP 77 11.971 1.444 -3.000 540 HB2 ASP 77 2HB ASP 77 9.805 0.273 -1.245 541 HB3 ASP 77 1HB ASP 77 10.726 -0.650 -2.425 542 H ILE 78 H ILE 78 8.755 2.518 -2.428 543 HA ILE 78 HA ILE 78 8.306 2.420 -5.289 544 HB ILE 78 HB ILE 78 5.907 2.079 -5.032 545 HG12 ILE 78 2HG1 ILE 78 5.566 3.101 -2.791 546 HG13 ILE 78 1HG1 ILE 78 4.744 1.562 -2.955 547 HG21 ILE 78 1HG2 ILE 78 7.415 -0.097 -3.637 548 HG22 ILE 78 2HG2 ILE 78 7.148 0.087 -5.371 549 HG23 ILE 78 3HG2 ILE 78 5.788 -0.256 -4.298 550 HD11 ILE 78 3HD1 ILE 78 5.703 1.792 -0.753 551 HD12 ILE 78 1HD1 ILE 78 7.299 2.095 -1.440 552 HD13 ILE 78 2HD1 ILE 78 6.546 0.516 -1.633 553 H PHE 79 H PHE 79 7.367 4.290 -6.102 554 HA PHE 79 HA PHE 79 7.689 6.501 -4.260 555 HB2 PHE 79 2HB PHE 79 7.914 7.918 -6.305 556 HB3 PHE 79 1HB PHE 79 9.139 6.678 -6.166 557 HD1 PHE 79 2HD PHE 79 8.890 4.589 -7.618 558 HD2 PHE 79 1HD PHE 79 6.588 8.114 -8.217 559 HE1 PHE 79 2HE PHE 79 8.385 3.863 -9.913 560 HE2 PHE 79 1HE PHE 79 6.080 7.398 -10.513 561 HZ PHE 79 HZ PHE 79 6.976 5.270 -11.364 562 H LEU 80 H LEU 80 5.988 7.445 -3.415 563 HA LEU 80 HA LEU 80 3.433 7.206 -4.707 564 HB2 LEU 80 2HB LEU 80 4.227 7.973 -1.889 565 HB3 LEU 80 1HB LEU 80 2.590 8.037 -2.485 566 HG LEU 80 HG LEU 80 2.725 5.525 -2.802 567 HD11 LEU 80 1HD1 LEU 80 4.393 4.314 -1.521 568 HD12 LEU 80 2HD1 LEU 80 5.210 5.827 -1.135 569 HD13 LEU 80 3HD1 LEU 80 5.142 5.264 -2.807 570 HD21 LEU 80 3HD2 LEU 80 1.558 6.548 -0.955 571 HD22 LEU 80 1HD2 LEU 80 3.060 6.638 -0.033 572 HD23 LEU 80 2HD2 LEU 80 2.369 5.067 -0.439 573 H ASP 81 H ASP 81 2.101 9.398 -3.952 574 HA ASP 81 HA ASP 81 3.633 11.732 -3.832 575 HB2 ASP 81 2HB ASP 81 3.958 11.171 -6.247 576 HB3 ASP 81 1HB ASP 81 2.229 11.341 -6.494 577 H ASP 82 H ASP 82 2.274 11.832 -2.103 578 HA ASP 82 HA ASP 82 -0.459 12.742 -2.647 579 HB2 ASP 82 2HB ASP 82 -0.220 11.213 -0.685 580 HB3 ASP 82 1HB ASP 82 0.999 12.257 0.018 581 H VAL 83 H VAL 83 -0.969 14.941 -1.497 582 HA VAL 83 HA VAL 83 0.972 16.767 -2.492 583 HB VAL 83 HB VAL 83 -1.436 17.295 -2.577 584 HG11 VAL 83 1HG1 VAL 83 -1.290 17.561 0.409 585 HG12 VAL 83 2HG1 VAL 83 -2.205 16.361 -0.508 586 HG13 VAL 83 3HG1 VAL 83 -2.647 18.069 -0.596 587 HG21 VAL 83 3HG2 VAL 83 0.147 19.297 -0.966 588 HG22 VAL 83 1HG2 VAL 83 -1.326 19.653 -1.865 589 HG23 VAL 83 2HG2 VAL 83 0.129 19.145 -2.722 590 H THR 84 H THR 84 0.378 15.351 0.607 591 HA THR 84 HA THR 84 2.465 17.064 1.775 592 HB THR 84 HB THR 84 0.323 15.585 3.334 593 HG1 THR 84 1HG THR 84 0.285 18.124 2.079 594 HG21 THR 84 3HG2 THR 84 1.959 18.071 3.928 595 HG22 THR 84 1HG2 THR 84 2.268 16.465 4.591 596 HG23 THR 84 2HG2 THR 84 0.789 17.327 5.019 597 H VAL 85 H VAL 85 2.960 14.717 0.198 598 HA VAL 85 HA VAL 85 3.412 12.515 2.027 599 HB VAL 85 HB VAL 85 2.822 12.118 -0.404 600 HG11 VAL 85 1HG1 VAL 85 5.597 13.101 -0.938 601 HG12 VAL 85 2HG1 VAL 85 4.079 13.812 -1.497 602 HG13 VAL 85 3HG1 VAL 85 4.590 12.232 -2.091 603 HG21 VAL 85 3HG2 VAL 85 3.782 10.311 0.894 604 HG22 VAL 85 1HG2 VAL 85 5.411 10.884 0.525 605 HG23 VAL 85 2HG2 VAL 85 4.382 10.251 -0.762 606 H SER 86 H SER 86 5.378 11.899 2.866 607 HA SER 86 HA SER 86 7.591 13.755 2.360 608 HB2 SER 86 2HB SER 86 6.889 12.337 4.936 609 HB3 SER 86 1HB SER 86 8.224 13.464 4.680 610 HG SER 86 HG SER 86 5.910 14.535 3.867 611 H ARG 87 H ARG 87 9.592 12.816 2.082 612 HA ARG 87 HA ARG 87 9.876 10.097 1.477 613 HB2 ARG 87 2HB ARG 87 12.298 10.422 1.519 614 HB3 ARG 87 1HB ARG 87 11.562 11.822 0.782 615 HG2 ARG 87 2HG ARG 87 12.646 11.683 3.607 616 HG3 ARG 87 1HG ARG 87 13.482 12.392 2.229 617 HD2 ARG 87 2HD ARG 87 11.459 13.932 2.031 618 HD3 ARG 87 1HD ARG 87 11.003 13.359 3.633 619 HE ARG 87 HE ARG 87 13.641 14.532 3.171 620 HH11 ARG 87 1HH1 ARG 87 10.639 14.541 5.056 621 HH12 ARG 87 2HH1 ARG 87 10.960 16.048 5.786 622 HH21 ARG 87 1HH2 ARG 87 14.064 16.570 4.226 623 HH22 ARG 87 2HH2 ARG 87 12.921 17.219 5.318 624 H ARG 88 H ARG 88 10.359 8.311 2.712 625 HA ARG 88 HA ARG 88 9.913 7.003 4.517 626 HB2 ARG 88 2HB ARG 88 11.702 9.115 5.668 627 HB3 ARG 88 1HB ARG 88 10.910 8.012 6.781 628 HG2 ARG 88 2HG ARG 88 12.107 6.200 6.048 629 HG3 ARG 88 1HG ARG 88 12.395 6.910 4.457 630 HD2 ARG 88 2HD ARG 88 13.586 8.044 6.973 631 HD3 ARG 88 1HD ARG 88 14.398 6.790 6.025 632 HE ARG 88 HE ARG 88 13.762 8.688 4.188 633 HH11 ARG 88 1HH1 ARG 88 15.598 8.941 7.225 634 HH12 ARG 88 2HH1 ARG 88 16.676 10.085 6.564 635 HH21 ARG 88 1HH2 ARG 88 15.190 10.184 3.374 636 HH22 ARG 88 2HH2 ARG 88 16.452 10.819 4.352 637 H HIS 89 H HIS 89 7.727 7.456 4.136 638 HA HIS 89 HA HIS 89 6.413 9.311 5.990 639 HB2 HIS 89 2HB HIS 89 5.932 9.374 3.501 640 HB3 HIS 89 1HB HIS 89 5.284 7.752 3.640 641 HD2 HIS 89 2HD HIS 89 3.036 7.832 5.741 642 HE1 HIS 89 1HE HIS 89 1.821 11.496 4.021 643 HE2 HIS 89 2HE HIS 89 1.210 9.647 5.654 644 H ALA 90 H ALA 90 6.002 6.042 4.672 645 HA ALA 90 HA ALA 90 5.254 5.115 7.325 646 HB1 ALA 90 1HB ALA 90 3.731 4.535 4.781 647 HB2 ALA 90 2HB ALA 90 3.155 5.513 6.129 648 HB3 ALA 90 3HB ALA 90 3.433 3.785 6.349 649 H GLU 91 H GLU 91 6.126 3.192 7.754 650 HA GLU 91 HA GLU 91 7.596 1.952 5.545 651 HB2 GLU 91 2HB GLU 91 8.953 2.791 7.451 652 HB3 GLU 91 1HB GLU 91 8.049 1.747 8.530 653 HG2 GLU 91 2HG GLU 91 8.948 -0.212 7.453 654 HG3 GLU 91 1HG GLU 91 9.778 0.792 6.262 655 H PHE 92 H PHE 92 6.939 0.032 4.906 656 HA PHE 92 HA PHE 92 4.833 -1.306 6.427 657 HB2 PHE 92 2HB PHE 92 5.582 -1.400 3.501 658 HB3 PHE 92 1HB PHE 92 4.403 -2.477 4.233 659 HD1 PHE 92 1HD PHE 92 5.132 1.059 3.410 660 HD2 PHE 92 2HD PHE 92 2.189 -1.785 4.564 661 HE1 PHE 92 1HE PHE 92 3.361 2.707 2.955 662 HE2 PHE 92 2HE PHE 92 0.425 -0.153 4.117 663 HZ PHE 92 HZ PHE 92 1.003 2.105 3.308 664 H ARG 93 H ARG 93 5.592 -2.886 7.581 665 HA ARG 93 HA ARG 93 7.824 -4.428 6.480 666 HB2 ARG 93 2HB ARG 93 8.419 -3.144 8.508 667 HB3 ARG 93 1HB ARG 93 7.086 -3.892 9.367 668 HG2 ARG 93 2HG ARG 93 8.179 -6.084 9.105 669 HG3 ARG 93 1HG ARG 93 9.536 -5.285 8.307 670 HD2 ARG 93 2HD ARG 93 9.990 -3.996 10.292 671 HD3 ARG 93 1HD ARG 93 8.566 -4.662 11.085 672 HE ARG 93 HE ARG 93 10.842 -6.330 10.249 673 HH11 ARG 93 1HH1 ARG 93 8.620 -5.171 12.797 674 HH12 ARG 93 2HH1 ARG 93 9.028 -6.361 13.918 675 HH21 ARG 93 1HH2 ARG 93 11.437 -8.009 11.853 676 HH22 ARG 93 2HH2 ARG 93 10.637 -8.042 13.356 677 H ILE 94 H ILE 94 7.632 -6.634 6.640 678 HA ILE 94 HA ILE 94 4.972 -7.570 7.419 679 HB ILE 94 HB ILE 94 5.232 -7.935 5.047 680 HG12 ILE 94 2HG1 ILE 94 5.701 -10.548 6.516 681 HG13 ILE 94 1HG1 ILE 94 4.146 -9.777 6.242 682 HG21 ILE 94 1HG2 ILE 94 7.592 -7.719 4.812 683 HG22 ILE 94 2HG2 ILE 94 7.067 -9.226 4.056 684 HG23 ILE 94 3HG2 ILE 94 7.864 -9.255 5.630 685 HD11 ILE 94 3HD1 ILE 94 4.485 -11.651 4.736 686 HD12 ILE 94 1HD1 ILE 94 5.962 -10.909 4.119 687 HD13 ILE 94 2HD1 ILE 94 4.400 -10.137 3.836 688 H ASN 95 H ASN 95 4.816 -9.182 8.804 689 HA ASN 95 HA ASN 95 7.259 -10.393 9.808 690 HB2 ASN 95 2HB ASN 95 6.071 -8.729 11.391 691 HB3 ASN 95 1HB ASN 95 4.746 -9.886 11.422 692 HD21 ASN 95 1HD2 ASN 95 5.069 -10.179 13.645 693 HD22 ASN 95 2HD2 ASN 95 6.380 -11.121 14.273 694 H GLU 96 H GLU 96 7.053 -12.539 10.344 695 HA GLU 96 HA GLU 96 6.045 -14.097 8.380 696 HB2 GLU 96 2HB GLU 96 6.305 -16.041 9.976 697 HB3 GLU 96 1HB GLU 96 7.707 -15.035 9.685 698 HG2 GLU 96 2HG GLU 96 7.626 -15.608 12.016 699 HG3 GLU 96 1HG GLU 96 7.285 -13.892 11.851 700 H GLY 97 H GLY 97 4.010 -12.862 10.815 701 HA2 GLY 97 2HA GLY 97 1.937 -14.773 9.980 702 HA3 GLY 97 1HA GLY 97 2.014 -14.090 11.592 703 H GLU 98 H GLU 98 2.727 -11.325 10.376 704 HA GLU 98 HA GLU 98 0.342 -10.597 8.995 705 HB2 GLU 98 2HB GLU 98 -0.404 -11.109 11.384 706 HB3 GLU 98 1HB GLU 98 0.566 -9.742 11.890 707 HG2 GLU 98 2HG GLU 98 -0.873 -8.210 10.780 708 HG3 GLU 98 1HG GLU 98 -1.713 -9.520 9.939 709 H PHE 99 H PHE 99 0.216 -7.900 9.297 710 HA PHE 99 HA PHE 99 2.937 -7.159 8.550 711 HB2 PHE 99 2HB PHE 99 0.283 -6.111 7.611 712 HB3 PHE 99 1HB PHE 99 1.798 -5.279 7.287 713 HD1 PHE 99 1HD PHE 99 -0.011 -8.474 6.748 714 HD2 PHE 99 2HD PHE 99 3.188 -5.948 5.529 715 HE1 PHE 99 1HE PHE 99 0.363 -9.899 4.780 716 HE2 PHE 99 2HE PHE 99 3.561 -7.365 3.560 717 HZ PHE 99 HZ PHE 99 2.150 -9.343 3.185 718 H GLU 100 H GLU 100 3.933 -5.436 9.275 719 HA GLU 100 HA GLU 100 2.699 -3.947 11.476 720 HB2 GLU 100 2HB GLU 100 4.558 -5.329 12.251 721 HB3 GLU 100 1HB GLU 100 5.585 -4.715 10.968 722 HG2 GLU 100 2HG GLU 100 5.554 -2.503 11.969 723 HG3 GLU 100 1HG GLU 100 4.465 -3.074 13.230 724 H VAL 101 H VAL 101 2.261 -1.877 10.870 725 HA VAL 101 HA VAL 101 3.978 -0.710 8.799 726 HB VAL 101 HB VAL 101 1.050 -0.161 9.296 727 HG11 VAL 101 1HG1 VAL 101 2.868 0.861 7.107 728 HG12 VAL 101 2HG1 VAL 101 2.222 1.805 8.448 729 HG13 VAL 101 3HG1 VAL 101 1.133 1.163 7.213 730 HG21 VAL 101 3HG2 VAL 101 2.332 -1.675 7.019 731 HG22 VAL 101 1HG2 VAL 101 0.624 -1.242 7.118 732 HG23 VAL 101 2HG2 VAL 101 1.320 -2.355 8.295 733 H VAL 102 H VAL 102 5.097 0.932 9.559 734 HA VAL 102 HA VAL 102 4.033 2.295 11.912 735 HB VAL 102 HB VAL 102 6.373 2.924 12.536 736 HG11 VAL 102 1HG1 VAL 102 5.824 -0.035 12.361 737 HG12 VAL 102 2HG1 VAL 102 5.277 1.058 13.632 738 HG13 VAL 102 3HG1 VAL 102 6.998 0.724 13.436 739 HG21 VAL 102 3HG2 VAL 102 7.448 2.676 10.359 740 HG22 VAL 102 1HG2 VAL 102 7.141 0.940 10.394 741 HG23 VAL 102 2HG2 VAL 102 8.248 1.665 11.562 742 H ASP 103 H ASP 103 3.755 4.370 11.933 743 HA ASP 103 HA ASP 103 4.104 5.807 9.439 744 HB2 ASP 103 2HB ASP 103 1.914 5.939 10.405 745 HB3 ASP 103 1HB ASP 103 2.575 6.374 11.972 746 H VAL 104 H VAL 104 5.896 6.870 9.205 747 HA VAL 104 HA VAL 104 7.090 8.092 11.576 748 HB VAL 104 HB VAL 104 9.308 7.984 10.365 749 HG11 VAL 104 1HG1 VAL 104 7.957 5.341 10.902 750 HG12 VAL 104 2HG1 VAL 104 8.754 6.364 12.099 751 HG13 VAL 104 3HG1 VAL 104 9.698 5.602 10.818 752 HG21 VAL 104 3HG2 VAL 104 8.469 7.717 8.079 753 HG22 VAL 104 1HG2 VAL 104 7.799 6.143 8.502 754 HG23 VAL 104 2HG2 VAL 104 9.545 6.389 8.511 755 H GLY 105 H GLY 105 5.178 8.842 9.275 756 HA2 GLY 105 2HA GLY 105 6.377 11.479 8.787 757 HA3 GLY 105 1HA GLY 105 5.468 10.608 7.552 758 H SER 106 H SER 106 5.000 11.224 10.987 759 HA SER 106 HA SER 106 2.219 11.324 10.942 760 HB2 SER 106 2HB SER 106 4.073 12.573 12.972 761 HB3 SER 106 1HB SER 106 2.399 12.078 13.233 762 HG SER 106 HG SER 106 3.297 9.930 12.401 763 H LEU 107 H LEU 107 4.349 13.656 9.804 764 HA LEU 107 HA LEU 107 3.128 16.128 10.237 765 HB2 LEU 107 2HB LEU 107 5.280 15.771 9.090 766 HB3 LEU 107 1HB LEU 107 4.447 15.011 7.767 767 HG LEU 107 HG LEU 107 3.311 17.131 7.243 768 HD11 LEU 107 1HD1 LEU 107 5.106 18.276 9.366 769 HD12 LEU 107 2HD1 LEU 107 3.344 18.194 9.405 770 HD13 LEU 107 3HD1 LEU 107 4.154 19.220 8.222 771 HD21 LEU 107 3HD2 LEU 107 5.270 18.260 6.286 772 HD22 LEU 107 1HD2 LEU 107 5.333 16.512 6.054 773 HD23 LEU 107 2HD2 LEU 107 6.321 17.274 7.300 774 H ASN 108 H ASN 108 2.618 13.646 7.836 775 HA ASN 108 HA ASN 108 0.106 14.887 6.995 776 HB2 ASN 108 2HB ASN 108 1.809 14.043 5.302 777 HB3 ASN 108 1HB ASN 108 1.453 12.423 5.893 778 HD21 ASN 108 1HD2 ASN 108 1.114 13.395 3.291 779 HD22 ASN 108 2HD2 ASN 108 -0.540 13.298 2.838 780 H GLY 109 H GLY 109 1.555 11.800 7.995 781 HA2 GLY 109 2HA GLY 109 0.721 10.378 9.631 782 HA3 GLY 109 1HA GLY 109 -0.839 11.182 9.523 783 H THR 110 H THR 110 0.367 8.367 9.196 784 HA THR 110 HA THR 110 -0.944 7.594 6.739 785 HB THR 110 HB THR 110 0.327 5.866 8.885 786 HG1 THR 110 1HG THR 110 1.877 7.300 8.056 787 HG21 THR 110 3HG2 THR 110 -1.156 4.668 7.301 788 HG22 THR 110 1HG2 THR 110 0.535 4.217 7.069 789 HG23 THR 110 2HG2 THR 110 -0.238 5.339 5.953 790 H TYR 111 H TYR 111 -3.072 7.017 6.712 791 HA TYR 111 HA TYR 111 -4.415 6.735 9.296 792 HB2 TYR 111 2HB TYR 111 -5.464 7.358 6.538 793 HB3 TYR 111 1HB TYR 111 -6.489 7.115 7.944 794 HD1 TYR 111 1HD TYR 111 -3.710 9.277 6.670 795 HD2 TYR 111 2HD TYR 111 -7.094 8.954 9.224 796 HE1 TYR 111 1HE TYR 111 -3.572 11.680 7.152 797 HE2 TYR 111 2HE TYR 111 -6.957 11.355 9.719 798 HH TYR 111 HH TYR 111 -5.029 13.449 7.895 799 H VAL 112 H VAL 112 -5.285 4.883 9.838 800 HA VAL 112 HA VAL 112 -5.478 2.820 7.802 801 HB VAL 112 HB VAL 112 -4.081 2.061 9.664 802 HG11 VAL 112 1HG1 VAL 112 -4.810 3.567 11.397 803 HG12 VAL 112 2HG1 VAL 112 -4.917 1.896 11.963 804 HG13 VAL 112 3HG1 VAL 112 -6.374 2.758 11.471 805 HG21 VAL 112 3HG2 VAL 112 -6.815 0.811 9.812 806 HG22 VAL 112 1HG2 VAL 112 -5.328 0.075 10.410 807 HG23 VAL 112 2HG2 VAL 112 -5.528 0.387 8.685 808 H ASN 113 H ASN 113 -7.341 2.471 7.049 809 HA ASN 113 HA ASN 113 -9.513 2.631 6.561 810 HB2 ASN 113 2HB ASN 113 -9.927 2.634 9.554 811 HB3 ASN 113 1HB ASN 113 -11.222 2.503 8.380 812 HD21 ASN 113 1HD2 ASN 113 -9.490 0.717 6.699 813 HD22 ASN 113 2HD2 ASN 113 -9.496 -0.797 7.537 814 H ARG 114 H ARG 114 -9.550 4.504 9.501 815 HA ARG 114 HA ARG 114 -10.217 6.970 8.012 816 HB2 ARG 114 2HB ARG 114 -11.750 5.875 10.370 817 HB3 ARG 114 1HB ARG 114 -12.029 7.419 9.590 818 HG2 ARG 114 2HG ARG 114 -12.867 6.356 7.630 819 HG3 ARG 114 1HG ARG 114 -12.337 4.772 8.202 820 HD2 ARG 114 2HD ARG 114 -14.375 6.509 9.571 821 HD3 ARG 114 1HD ARG 114 -14.768 5.139 8.527 822 HE ARG 114 HE ARG 114 -13.119 4.040 10.345 823 HH11 ARG 114 1HH1 ARG 114 -15.989 6.069 10.812 824 HH12 ARG 114 2HH1 ARG 114 -16.466 5.274 12.238 825 HH21 ARG 114 1HH2 ARG 114 -13.759 2.993 12.319 826 HH22 ARG 114 2HH2 ARG 114 -15.195 3.496 13.098 827 H GLU 115 H GLU 115 -8.280 5.454 10.336 828 HA GLU 115 HA GLU 115 -8.266 7.815 12.092 829 HB2 GLU 115 2HB GLU 115 -7.614 4.972 12.846 830 HB3 GLU 115 1HB GLU 115 -7.775 6.347 13.930 831 HG2 GLU 115 2HG GLU 115 -10.161 6.501 13.370 832 HG3 GLU 115 1HG GLU 115 -9.993 5.113 12.301 833 HA PRO 116 HA PRO 116 -3.917 7.897 10.917 834 HB2 PRO 116 2HB PRO 116 -3.213 10.086 12.336 835 HB3 PRO 116 1HB PRO 116 -4.142 10.207 10.839 836 HG2 PRO 116 2HG PRO 116 -5.052 10.462 13.665 837 HG3 PRO 116 1HG PRO 116 -5.637 11.295 12.219 838 HD2 PRO 116 2HD PRO 116 -6.874 9.119 13.446 839 HD3 PRO 116 1HD PRO 116 -7.169 9.671 11.786 840 H ARG 117 H ARG 117 -2.545 6.465 11.809 841 HA ARG 117 HA ARG 117 -2.291 6.474 14.748 842 HB2 ARG 117 2HB ARG 117 -2.094 4.071 12.917 843 HB3 ARG 117 1HB ARG 117 -1.800 4.057 14.648 844 HG2 ARG 117 2HG ARG 117 -4.418 4.667 13.292 845 HG3 ARG 117 1HG ARG 117 -4.001 3.179 14.143 846 HD2 ARG 117 2HD ARG 117 -3.776 4.430 16.229 847 HD3 ARG 117 1HD ARG 117 -4.132 5.926 15.367 848 HE ARG 117 HE ARG 117 -6.155 3.993 15.009 849 HH11 ARG 117 1HH1 ARG 117 -4.944 6.410 17.277 850 HH12 ARG 117 2HH1 ARG 117 -6.444 6.698 18.020 851 HH21 ARG 117 1HH2 ARG 117 -8.242 4.365 16.016 852 HH22 ARG 117 2HH2 ARG 117 -8.372 5.473 17.297 853 H ASN 118 H ASN 118 -0.238 5.945 15.585 854 HA ASN 118 HA ASN 118 1.882 6.993 13.906 855 HB2 ASN 118 2HB ASN 118 1.611 7.675 16.301 856 HB3 ASN 118 1HB ASN 118 1.988 6.029 16.778 857 HD21 ASN 118 1HD2 ASN 118 3.601 7.868 14.180 858 HD22 ASN 118 2HD2 ASN 118 5.113 7.921 15.002 859 H ALA 119 H ALA 119 0.733 3.975 15.138 860 HA ALA 119 HA ALA 119 2.411 2.507 13.326 861 HB1 ALA 119 1HB ALA 119 2.535 1.995 16.311 862 HB2 ALA 119 2HB ALA 119 3.859 2.618 15.322 863 HB3 ALA 119 3HB ALA 119 3.258 0.981 15.062 864 H GLN 120 H GLN 120 1.315 0.697 12.677 865 HA GLN 120 HA GLN 120 -0.895 -0.151 14.323 866 HB2 GLN 120 2HB GLN 120 -1.865 1.473 12.720 867 HB3 GLN 120 1HB GLN 120 -1.256 0.497 11.390 868 HG2 GLN 120 2HG GLN 120 -3.652 0.113 11.811 869 HG3 GLN 120 1HG GLN 120 -2.692 -1.347 12.033 870 HE21 GLN 120 1HE2 GLN 120 -4.497 1.068 13.582 871 HE22 GLN 120 2HE2 GLN 120 -4.671 0.311 15.131 872 H VAL 121 H VAL 121 -1.563 -2.216 13.968 873 HA VAL 121 HA VAL 121 0.341 -3.906 12.471 874 HB VAL 121 HB VAL 121 -1.618 -4.795 14.634 875 HG11 VAL 121 1HG1 VAL 121 0.700 -6.235 13.344 876 HG12 VAL 121 2HG1 VAL 121 -1.012 -6.557 13.074 877 HG13 VAL 121 3HG1 VAL 121 -0.293 -6.866 14.657 878 HG21 VAL 121 3HG2 VAL 121 1.348 -4.305 14.899 879 HG22 VAL 121 1HG2 VAL 121 0.311 -5.011 16.139 880 HG23 VAL 121 2HG2 VAL 121 0.069 -3.339 15.629 881 H MET 122 H MET 122 -0.496 -4.277 10.522 882 HA MET 122 HA MET 122 -3.398 -4.147 10.331 883 HB2 MET 122 2HB MET 122 -1.368 -3.460 8.238 884 HB3 MET 122 1HB MET 122 -3.090 -3.610 7.924 885 HG2 MET 122 2HG MET 122 -3.427 -1.874 9.732 886 HG3 MET 122 1HG MET 122 -1.685 -1.607 9.663 887 HE1 MET 122 3HE MET 122 -4.660 -0.871 6.223 888 HE2 MET 122 1HE MET 122 -5.061 -1.531 7.798 889 HE3 MET 122 2HE MET 122 -4.138 -2.492 6.639 890 H GLN 123 H GLN 123 -4.508 -5.348 8.917 891 HA GLN 123 HA GLN 123 -3.330 -7.976 8.463 892 HB2 GLN 123 2HB GLN 123 -5.192 -7.637 10.236 893 HB3 GLN 123 1HB GLN 123 -6.239 -7.391 8.841 894 HG2 GLN 123 2HG GLN 123 -5.906 -9.590 8.072 895 HG3 GLN 123 1HG GLN 123 -4.570 -9.860 9.190 896 HE21 GLN 123 1HE2 GLN 123 -5.026 -10.071 11.387 897 HE22 GLN 123 2HE2 GLN 123 -6.561 -10.635 11.927 898 H THR 124 H THR 124 -4.131 -9.076 6.528 899 HA THR 124 HA THR 124 -4.238 -7.249 4.369 900 HB THR 124 HB THR 124 -4.355 -9.565 3.189 901 HG1 THR 124 1HG THR 124 -3.187 -11.037 4.834 902 HG21 THR 124 3HG2 THR 124 -1.917 -9.789 3.459 903 HG22 THR 124 1HG2 THR 124 -1.980 -8.700 4.842 904 HG23 THR 124 2HG2 THR 124 -2.389 -8.107 3.231 905 H GLY 125 H GLY 125 -5.939 -6.639 3.228 906 HA2 GLY 125 2HA GLY 125 -8.052 -7.119 2.196 907 HA3 GLY 125 1HA GLY 125 -8.519 -7.982 3.660 908 H ASP 126 H ASP 126 -6.710 -5.237 4.344 909 HA ASP 126 HA ASP 126 -9.163 -3.830 5.141 910 HB2 ASP 126 2HB ASP 126 -7.684 -4.746 6.970 911 HB3 ASP 126 1HB ASP 126 -6.432 -3.635 6.442 912 H GLU 127 H GLU 127 -8.662 -1.367 5.508 913 HA GLU 127 HA GLU 127 -7.607 -0.427 2.923 914 HB2 GLU 127 2HB GLU 127 -9.988 -0.221 3.042 915 HB3 GLU 127 1HB GLU 127 -9.894 0.591 4.594 916 HG2 GLU 127 2HG GLU 127 -8.976 2.545 3.592 917 HG3 GLU 127 1HG GLU 127 -8.786 1.728 2.044 918 H ILE 128 H ILE 128 -6.332 1.389 2.748 919 HA ILE 128 HA ILE 128 -5.276 2.586 5.226 920 HB ILE 128 HB ILE 128 -3.723 1.915 2.705 921 HG12 ILE 128 2HG1 ILE 128 -3.569 0.593 5.408 922 HG13 ILE 128 1HG1 ILE 128 -4.348 -0.116 3.989 923 HG21 ILE 128 1HG2 ILE 128 -2.788 2.978 5.374 924 HG22 ILE 128 2HG2 ILE 128 -2.859 3.877 3.862 925 HG23 ILE 128 3HG2 ILE 128 -1.738 2.528 4.030 926 HD11 ILE 128 3HD1 ILE 128 -2.136 -1.052 4.362 927 HD12 ILE 128 1HD1 ILE 128 -1.441 0.569 4.296 928 HD13 ILE 128 2HD1 ILE 128 -2.178 -0.136 2.853 929 H GLN 129 H GLN 129 -5.309 4.810 5.137 930 HA GLN 129 HA GLN 129 -5.482 5.978 2.471 931 HB2 GLN 129 2HB GLN 129 -6.730 7.025 5.007 932 HB3 GLN 129 1HB GLN 129 -6.495 8.031 3.582 933 HG2 GLN 129 2HG GLN 129 -7.847 6.377 2.301 934 HG3 GLN 129 1HG GLN 129 -8.188 5.562 3.824 935 HE21 GLN 129 1HE2 GLN 129 -9.527 6.557 5.316 936 HE22 GLN 129 2HE2 GLN 129 -10.530 7.891 4.879 937 H ILE 130 H ILE 130 -3.943 7.185 1.846 938 HA ILE 130 HA ILE 130 -1.865 7.882 3.800 939 HB ILE 130 HB ILE 130 -1.550 7.612 0.796 940 HG12 ILE 130 2HG1 ILE 130 -1.006 5.571 2.961 941 HG13 ILE 130 1HG1 ILE 130 -2.294 5.538 1.754 942 HG21 ILE 130 1HG2 ILE 130 0.849 7.477 1.351 943 HG22 ILE 130 2HG2 ILE 130 0.463 7.655 3.063 944 HG23 ILE 130 3HG2 ILE 130 0.147 8.982 1.945 945 HD11 ILE 130 3HD1 ILE 130 -0.433 4.030 1.209 946 HD12 ILE 130 1HD1 ILE 130 0.648 5.418 1.137 947 HD13 ILE 130 2HD1 ILE 130 -0.677 5.274 -0.020 948 H GLY 131 H GLY 131 -2.434 9.890 4.371 949 HA2 GLY 131 2HA GLY 131 -2.657 12.145 4.176 950 HA3 GLY 131 1HA GLY 131 -2.192 11.985 2.483 951 H LYS 132 H LYS 132 -3.645 12.049 0.995 952 HA LYS 132 HA LYS 132 -6.455 12.158 1.828 953 HB2 LYS 132 2HB LYS 132 -5.680 14.296 1.037 954 HB3 LYS 132 1HB LYS 132 -4.994 13.579 -0.403 955 HG2 LYS 132 2HG LYS 132 -7.091 14.858 -0.787 956 HG3 LYS 132 1HG LYS 132 -7.176 13.180 -1.319 957 HD2 LYS 132 2HD LYS 132 -9.224 13.816 -0.210 958 HD3 LYS 132 1HD LYS 132 -8.378 12.605 0.741 959 HE2 LYS 132 2HE LYS 132 -7.502 14.454 2.176 960 HE3 LYS 132 1HE LYS 132 -8.520 15.567 1.254 961 HZ1 LYS 132 3HZ LYS 132 -9.675 14.896 3.247 962 HZ2 LYS 132 1HZ LYS 132 -9.442 13.270 2.879 963 HZ3 LYS 132 2HZ LYS 132 -10.462 14.208 1.932 964 H PHE 133 H PHE 133 -4.252 10.167 0.276 965 HA PHE 133 HA PHE 133 -6.258 9.455 -1.692 966 HB2 PHE 133 2HB PHE 133 -3.277 9.064 -1.844 967 HB3 PHE 133 1HB PHE 133 -4.451 8.561 -3.073 968 HD1 PHE 133 1HD PHE 133 -6.120 10.448 -3.846 969 HD2 PHE 133 2HD PHE 133 -2.319 11.194 -2.077 970 HE1 PHE 133 1HE PHE 133 -6.132 12.713 -4.790 971 HE2 PHE 133 2HE PHE 133 -2.332 13.471 -3.025 972 HZ PHE 133 HZ PHE 133 -4.239 14.229 -4.377 973 H ARG 134 H ARG 134 -6.721 7.315 -2.173 974 HA ARG 134 HA ARG 134 -6.528 5.831 0.326 975 HB2 ARG 134 2HB ARG 134 -8.722 6.781 -0.096 976 HB3 ARG 134 1HB ARG 134 -8.825 5.912 -1.617 977 HG2 ARG 134 2HG ARG 134 -9.078 3.873 -0.570 978 HG3 ARG 134 1HG ARG 134 -8.482 4.474 0.977 979 HD2 ARG 134 2HD ARG 134 -10.896 4.168 1.062 980 HD3 ARG 134 1HD ARG 134 -10.487 5.864 1.202 981 HE ARG 134 HE ARG 134 -11.155 6.121 -1.112 982 HH11 ARG 134 1HH1 ARG 134 -12.252 3.144 0.536 983 HH12 ARG 134 2HH1 ARG 134 -13.739 3.078 -0.287 984 HH21 ARG 134 1HH2 ARG 134 -13.246 5.966 -2.283 985 HH22 ARG 134 2HH2 ARG 134 -14.300 4.685 -1.939 986 H LEU 135 H LEU 135 -5.907 3.881 0.462 987 HA LEU 135 HA LEU 135 -5.130 2.325 -1.901 988 HB2 LEU 135 2HB LEU 135 -3.247 3.424 -0.807 989 HB3 LEU 135 1HB LEU 135 -3.762 2.815 0.745 990 HG LEU 135 HG LEU 135 -3.314 0.490 -0.172 991 HD11 LEU 135 1HD1 LEU 135 -3.317 1.065 -2.529 992 HD12 LEU 135 2HD1 LEU 135 -1.779 0.350 -2.051 993 HD13 LEU 135 3HD1 LEU 135 -1.906 2.087 -2.276 994 HD21 LEU 135 3HD2 LEU 135 -1.827 1.656 1.396 995 HD22 LEU 135 1HD2 LEU 135 -0.988 2.384 0.029 996 HD23 LEU 135 2HD2 LEU 135 -0.938 0.635 0.268 997 H VAL 136 H VAL 136 -5.578 0.067 -1.670 998 HA VAL 136 HA VAL 136 -6.466 -0.754 0.985 999 HB VAL 136 HB VAL 136 -8.471 -0.752 -0.446 1000 HG11 VAL 136 1HG1 VAL 136 -8.698 -2.235 -2.358 1001 HG12 VAL 136 2HG1 VAL 136 -6.976 -2.614 -2.231 1002 HG13 VAL 136 3HG1 VAL 136 -7.496 -0.967 -2.595 1003 HG21 VAL 136 3HG2 VAL 136 -7.553 -3.558 0.149 1004 HG22 VAL 136 1HG2 VAL 136 -9.218 -3.077 -0.172 1005 HG23 VAL 136 2HG2 VAL 136 -8.381 -2.471 1.260 1006 H PHE 137 H PHE 137 -5.639 -2.633 1.793 1007 HA PHE 137 HA PHE 137 -3.374 -3.711 0.244 1008 HB2 PHE 137 2HB PHE 137 -2.927 -2.312 2.331 1009 HB3 PHE 137 1HB PHE 137 -3.708 -3.587 3.250 1010 HD1 PHE 137 2HD PHE 137 -2.619 -5.779 3.482 1011 HD2 PHE 137 1HD PHE 137 -0.743 -2.542 1.471 1012 HE1 PHE 137 2HE PHE 137 -0.454 -6.927 3.654 1013 HE2 PHE 137 1HE PHE 137 1.424 -3.684 1.636 1014 HZ PHE 137 HZ PHE 137 1.570 -5.878 2.729 1015 H LEU 138 H LEU 138 -3.688 -5.819 -0.318 1016 HA LEU 138 HA LEU 138 -5.614 -7.399 1.254 1017 HB2 LEU 138 2HB LEU 138 -5.134 -7.574 -1.714 1018 HB3 LEU 138 1HB LEU 138 -6.233 -8.570 -0.794 1019 HG LEU 138 HG LEU 138 -7.395 -6.292 -0.255 1020 HD11 LEU 138 1HD1 LEU 138 -5.721 -4.837 -1.223 1021 HD12 LEU 138 2HD1 LEU 138 -7.255 -4.692 -2.088 1022 HD13 LEU 138 3HD1 LEU 138 -5.931 -5.616 -2.794 1023 HD21 LEU 138 3HD2 LEU 138 -7.552 -7.611 -2.945 1024 HD22 LEU 138 1HD2 LEU 138 -8.762 -6.547 -2.223 1025 HD23 LEU 138 2HD2 LEU 138 -8.398 -8.103 -1.469 1026 H ALA 139 H ALA 139 -5.315 -9.730 0.996 1027 HA ALA 139 HA ALA 139 -2.573 -10.495 1.337 1028 HB1 ALA 139 1HB ALA 139 -4.341 -11.578 2.649 1029 HB2 ALA 139 2HB ALA 139 -3.485 -12.760 1.660 1030 HB3 ALA 139 3HB ALA 139 -5.075 -12.184 1.167 1031 H GLY 140 H GLY 140 -1.374 -11.861 -0.005 1032 HA2 GLY 140 2HA GLY 140 -2.264 -11.753 -2.787 1033 HA3 GLY 140 1HA GLY 140 -0.587 -11.821 -2.253 1034 HA PRO 141 HA PRO 141 -2.192 -16.096 -3.340 1035 HB2 PRO 141 2HB PRO 141 -0.334 -16.653 -5.234 1036 HB3 PRO 141 1HB PRO 141 -1.869 -15.868 -5.605 1037 HG2 PRO 141 2HG PRO 141 0.839 -14.654 -5.223 1038 HG3 PRO 141 1HG PRO 141 -0.384 -14.281 -6.449 1039 HD2 PRO 141 2HD PRO 141 -0.021 -12.742 -4.262 1040 HD3 PRO 141 1HD PRO 141 -1.619 -12.974 -5.004 1041 H ALA 142 H ALA 142 -1.304 -17.949 -2.571 1042 HA ALA 142 HA ALA 142 1.191 -17.792 -1.142 1043 HB1 ALA 142 1HB ALA 142 0.679 -20.144 -0.522 1044 HB2 ALA 142 2HB ALA 142 -0.730 -20.096 -1.590 1045 HB3 ALA 142 3HB ALA 142 -0.668 -19.064 -0.164 1046 H GLU 143 H GLU 143 2.998 -18.046 -2.222 1047 HA GLU 143 HA GLU 143 2.867 -19.250 -4.857 1048 HB2 GLU 143 2HB GLU 143 3.882 -16.944 -4.391 1049 HB3 GLU 143 1HB GLU 143 5.233 -17.810 -3.673 1050 HG2 GLU 143 2HG GLU 143 5.743 -17.214 -5.952 1051 HG3 GLU 143 1HG GLU 143 5.599 -18.968 -5.805 Start of MODEL 3 1 H1 MET 1 1HT MET 1 -41.162 39.196 -0.207 2 H2 MET 1 2HT MET 1 -41.121 40.570 0.790 3 H3 MET 1 3HT MET 1 -42.574 40.005 0.149 4 HA MET 1 HA MET 1 -40.958 38.426 2.025 5 HB2 MET 1 2HB MET 1 -43.512 40.000 2.469 6 HB3 MET 1 1HB MET 1 -42.862 38.834 3.600 7 HG2 MET 1 2HG MET 1 -42.377 41.045 4.364 8 HG3 MET 1 1HG MET 1 -40.878 40.266 3.892 9 HE1 MET 1 2HE MET 1 -40.318 44.077 3.082 10 HE2 MET 1 3HE MET 1 -39.712 42.678 3.968 11 HE3 MET 1 1HE MET 1 -41.258 43.403 4.410 12 H SER 2 H SER 2 -41.546 36.297 1.981 13 HA SER 2 HA SER 2 -43.770 35.484 0.350 14 HB2 SER 2 2HB SER 2 -42.019 33.836 2.207 15 HB3 SER 2 1HB SER 2 -43.005 33.237 0.875 16 HG SER 2 HG SER 2 -41.404 33.592 -0.382 17 H ASP 3 H ASP 3 -42.954 36.028 3.643 18 HA ASP 3 HA ASP 3 -45.699 36.099 4.445 19 HB2 ASP 3 2HB ASP 3 -45.403 34.667 6.418 20 HB3 ASP 3 1HB ASP 3 -44.976 33.731 4.998 21 H ASN 4 H ASN 4 -45.923 37.687 6.018 22 HA ASN 4 HA ASN 4 -43.477 39.237 6.365 23 HB2 ASN 4 2HB ASN 4 -44.899 41.207 6.726 24 HB3 ASN 4 1HB ASN 4 -45.226 40.448 5.178 25 HD21 ASN 4 1HD2 ASN 4 -46.837 42.232 6.827 26 HD22 ASN 4 2HD2 ASN 4 -48.336 41.430 7.084 27 H ASN 5 H ASN 5 -43.318 40.553 8.305 28 HA ASN 5 HA ASN 5 -42.832 40.651 10.498 29 HB2 ASN 5 2HB ASN 5 -45.197 41.295 10.695 30 HB3 ASN 5 1HB ASN 5 -45.649 39.601 10.868 31 HD21 ASN 5 1HD2 ASN 5 -46.519 39.812 12.900 32 HD22 ASN 5 2HD2 ASN 5 -45.588 40.149 14.309 33 H GLY 6 H GLY 6 -41.231 39.146 10.436 34 HA2 GLY 6 2HA GLY 6 -41.980 36.508 11.469 35 HA3 GLY 6 1HA GLY 6 -40.512 36.842 10.542 36 H THR 7 H THR 7 -40.033 35.574 12.772 37 HA THR 7 HA THR 7 -39.753 37.223 15.042 38 HB THR 7 HB THR 7 -38.259 34.691 14.284 39 HG1 THR 7 1HG THR 7 -40.844 35.171 14.862 40 HG21 THR 7 3HG2 THR 7 -37.287 35.908 16.215 41 HG22 THR 7 1HG2 THR 7 -38.005 34.373 16.708 42 HG23 THR 7 2HG2 THR 7 -38.862 35.883 17.007 43 HA PRO 8 HA PRO 8 -36.335 39.765 13.589 44 HB2 PRO 8 2HB PRO 8 -35.169 40.126 16.103 45 HB3 PRO 8 1HB PRO 8 -36.440 41.136 15.405 46 HG2 PRO 8 2HG PRO 8 -36.658 38.874 17.340 47 HG3 PRO 8 1HG PRO 8 -37.549 40.406 17.299 48 HD2 PRO 8 2HD PRO 8 -38.687 38.157 16.476 49 HD3 PRO 8 1HD PRO 8 -38.962 39.678 15.592 50 H GLU 9 H GLU 9 -34.116 39.511 13.135 51 HA GLU 9 HA GLU 9 -33.005 36.924 13.561 52 HB2 GLU 9 2HB GLU 9 -32.994 38.218 11.425 53 HB3 GLU 9 1HB GLU 9 -31.996 39.424 12.212 54 HG2 GLU 9 2HG GLU 9 -30.649 38.076 10.879 55 HG3 GLU 9 1HG GLU 9 -30.323 37.734 12.590 56 HA PRO 10 HA PRO 10 -30.738 39.015 16.934 57 HB2 PRO 10 2HB PRO 10 -30.991 37.114 18.779 58 HB3 PRO 10 1HB PRO 10 -32.350 38.148 18.323 59 HG2 PRO 10 2HG PRO 10 -31.912 35.286 17.756 60 HG3 PRO 10 1HG PRO 10 -33.421 36.214 17.738 61 HD2 PRO 10 2HD PRO 10 -31.681 35.506 15.502 62 HD3 PRO 10 1HD PRO 10 -33.296 36.255 15.476 63 H GLN 11 H GLN 11 -28.634 38.735 17.791 64 HA GLN 11 HA GLN 11 -27.115 36.620 16.595 65 HB2 GLN 11 2HB GLN 11 -25.133 37.644 17.826 66 HB3 GLN 11 1HB GLN 11 -25.909 38.680 16.642 67 HG2 GLN 11 2HG GLN 11 -27.088 39.841 18.464 68 HG3 GLN 11 1HG GLN 11 -26.259 38.816 19.633 69 HE21 GLN 11 1HE2 GLN 11 -26.232 41.740 19.180 70 HE22 GLN 11 2HE2 GLN 11 -24.569 42.151 19.001 71 H VAL 12 H VAL 12 -28.352 35.057 17.454 72 HA VAL 12 HA VAL 12 -28.682 34.413 20.150 73 HB VAL 12 HB VAL 12 -30.084 33.530 18.329 74 HG11 VAL 12 1HG1 VAL 12 -29.337 31.704 16.879 75 HG12 VAL 12 2HG1 VAL 12 -27.705 31.877 17.523 76 HG13 VAL 12 3HG1 VAL 12 -28.432 33.196 16.608 77 HG21 VAL 12 3HG2 VAL 12 -30.103 32.299 20.408 78 HG22 VAL 12 1HG2 VAL 12 -28.713 31.344 19.892 79 HG23 VAL 12 2HG2 VAL 12 -30.256 31.180 19.053 80 H GLU 13 H GLU 13 -27.497 33.062 21.535 81 HA GLU 13 HA GLU 13 -24.779 32.885 20.863 82 HB2 GLU 13 2HB GLU 13 -24.449 31.774 23.052 83 HB3 GLU 13 1HB GLU 13 -25.270 33.311 23.176 84 HG2 GLU 13 2HG GLU 13 -26.262 31.876 24.755 85 HG3 GLU 13 1HG GLU 13 -27.416 32.000 23.434 86 H THR 14 H THR 14 -23.562 31.244 20.347 87 HA THR 14 HA THR 14 -24.918 28.746 19.772 88 HB THR 14 HB THR 14 -22.964 30.142 17.908 89 HG1 THR 14 1HG THR 14 -25.580 30.424 18.311 90 HG21 THR 14 3HG2 THR 14 -23.606 28.364 16.318 91 HG22 THR 14 1HG2 THR 14 -24.646 27.637 17.543 92 HG23 THR 14 2HG2 THR 14 -22.900 27.666 17.776 93 H THR 15 H THR 15 -24.048 27.815 21.519 94 HA THR 15 HA THR 15 -21.366 28.180 22.266 95 HB THR 15 HB THR 15 -23.384 26.122 23.206 96 HG1 THR 15 1HG THR 15 -24.068 28.220 23.870 97 HG21 THR 15 3HG2 THR 15 -21.058 25.399 23.655 98 HG22 THR 15 1HG2 THR 15 -21.891 25.826 25.149 99 HG23 THR 15 2HG2 THR 15 -20.733 26.947 24.436 100 H SER 16 H SER 16 -19.956 27.656 20.808 101 HA SER 16 HA SER 16 -19.625 24.848 20.150 102 HB2 SER 16 2HB SER 16 -20.635 26.070 18.183 103 HB3 SER 16 1HB SER 16 -19.251 27.160 18.209 104 HG SER 16 HG SER 16 -19.459 24.518 17.408 105 H VAL 17 H VAL 17 -17.764 24.367 21.062 106 HA VAL 17 HA VAL 17 -15.914 26.552 21.608 107 HB VAL 17 HB VAL 17 -15.003 25.066 23.408 108 HG11 VAL 17 1HG1 VAL 17 -16.909 25.330 24.929 109 HG12 VAL 17 2HG1 VAL 17 -17.972 25.599 23.550 110 HG13 VAL 17 3HG1 VAL 17 -16.700 26.762 23.921 111 HG21 VAL 17 3HG2 VAL 17 -17.371 23.326 22.714 112 HG22 VAL 17 1HG2 VAL 17 -16.295 23.105 24.090 113 HG23 VAL 17 2HG2 VAL 17 -15.678 22.907 22.447 114 H PHE 18 H PHE 18 -13.619 25.300 22.092 115 HA PHE 18 HA PHE 18 -12.801 24.502 19.467 116 HB2 PHE 18 2HB PHE 18 -10.496 24.479 20.489 117 HB3 PHE 18 1HB PHE 18 -11.331 26.020 20.583 118 HD1 PHE 18 1HD PHE 18 -10.086 23.142 22.493 119 HD2 PHE 18 2HD PHE 18 -11.991 26.943 22.703 120 HE1 PHE 18 1HE PHE 18 -9.677 23.212 24.909 121 HE2 PHE 18 2HE PHE 18 -11.583 27.015 25.121 122 HZ PHE 18 HZ PHE 18 -10.430 25.157 26.232 123 H ARG 19 H ARG 19 -12.243 22.571 18.803 124 HA ARG 19 HA ARG 19 -13.098 20.313 20.358 125 HB2 ARG 19 2HB ARG 19 -11.708 20.412 17.679 126 HB3 ARG 19 1HB ARG 19 -12.474 18.994 18.380 127 HG2 ARG 19 2HG ARG 19 -14.642 20.098 18.282 128 HG3 ARG 19 1HG ARG 19 -13.879 21.538 17.609 129 HD2 ARG 19 2HD ARG 19 -14.901 20.196 15.854 130 HD3 ARG 19 1HD ARG 19 -13.144 20.234 15.668 131 HE ARG 19 HE ARG 19 -14.088 18.010 17.185 132 HH11 ARG 19 1HH1 ARG 19 -13.449 19.125 13.869 133 HH12 ARG 19 2HH1 ARG 19 -13.313 17.555 13.246 134 HH21 ARG 19 1HH2 ARG 19 -13.873 15.888 16.306 135 HH22 ARG 19 2HH2 ARG 19 -13.568 15.665 14.648 136 H ALA 20 H ALA 20 -11.827 19.795 22.006 137 HA ALA 20 HA ALA 20 -8.978 20.097 21.848 138 HB1 ALA 20 1HB ALA 20 -10.121 20.661 23.923 139 HB2 ALA 20 2HB ALA 20 -8.974 19.344 24.196 140 HB3 ALA 20 3HB ALA 20 -10.701 19.007 24.065 141 H ASP 21 H ASP 21 -8.271 18.731 20.352 142 HA ASP 21 HA ASP 21 -8.966 15.978 20.214 143 HB2 ASP 21 2HB ASP 21 -8.196 17.175 18.219 144 HB3 ASP 21 1HB ASP 21 -6.629 17.450 18.974 145 H LEU 22 H LEU 22 -6.376 17.795 21.641 146 HA LEU 22 HA LEU 22 -4.887 17.373 23.248 147 HB2 LEU 22 2HB LEU 22 -6.543 16.040 24.491 148 HB3 LEU 22 1HB LEU 22 -6.243 14.673 23.456 149 HG LEU 22 HG LEU 22 -4.007 15.673 25.214 150 HD11 LEU 22 1HD1 LEU 22 -6.256 13.837 26.044 151 HD12 LEU 22 2HD1 LEU 22 -5.946 15.450 26.699 152 HD13 LEU 22 3HD1 LEU 22 -4.789 14.151 26.969 153 HD21 LEU 22 3HD2 LEU 22 -4.833 12.923 24.277 154 HD22 LEU 22 1HD2 LEU 22 -3.376 13.330 25.184 155 HD23 LEU 22 2HD2 LEU 22 -3.581 13.916 23.531 156 H LEU 23 H LEU 23 -2.864 17.271 22.823 157 HA LEU 23 HA LEU 23 -1.912 15.814 20.563 158 HB2 LEU 23 2HB LEU 23 -0.346 17.245 22.736 159 HB3 LEU 23 1HB LEU 23 0.338 16.594 21.265 160 HG LEU 23 HG LEU 23 0.241 18.909 20.975 161 HD11 LEU 23 1HD1 LEU 23 -1.272 19.260 19.104 162 HD12 LEU 23 2HD1 LEU 23 -2.110 17.765 19.513 163 HD13 LEU 23 3HD1 LEU 23 -0.419 17.720 19.011 164 HD21 LEU 23 3HD2 LEU 23 -1.786 20.278 21.268 165 HD22 LEU 23 1HD2 LEU 23 -1.273 19.513 22.774 166 HD23 LEU 23 2HD2 LEU 23 -2.638 18.858 21.872 167 H LYS 24 H LYS 24 -1.083 13.856 20.533 168 HA LYS 24 HA LYS 24 -1.517 12.188 22.748 169 HB2 LYS 24 2HB LYS 24 -0.687 11.809 19.968 170 HB3 LYS 24 1HB LYS 24 0.033 10.655 21.079 171 HG2 LYS 24 2HG LYS 24 -2.076 9.861 20.035 172 HG3 LYS 24 1HG LYS 24 -2.110 9.877 21.788 173 HD2 LYS 24 2HD LYS 24 -4.220 10.669 20.975 174 HD3 LYS 24 1HD LYS 24 -3.374 12.032 21.686 175 HE2 LYS 24 2HE LYS 24 -2.746 12.792 19.441 176 HE3 LYS 24 1HE LYS 24 -3.596 11.416 18.733 177 HZ1 LYS 24 3HZ LYS 24 -5.668 12.269 19.722 178 HZ2 LYS 24 1HZ LYS 24 -5.002 13.463 18.733 179 HZ3 LYS 24 2HZ LYS 24 -4.817 13.576 20.366 180 H GLU 25 H GLU 25 0.165 10.549 23.401 181 HA GLU 25 HA GLU 25 1.880 12.036 25.108 182 HB2 GLU 25 2HB GLU 25 1.604 9.063 24.760 183 HB3 GLU 25 1HB GLU 25 2.330 9.895 26.130 184 HG2 GLU 25 2HG GLU 25 -0.549 10.015 25.291 185 HG3 GLU 25 1HG GLU 25 0.116 9.128 26.664 186 H MET 26 H MET 26 4.008 10.463 25.536 187 HA MET 26 HA MET 26 5.686 11.021 23.257 188 HB2 MET 26 2HB MET 26 6.285 9.945 26.014 189 HB3 MET 26 1HB MET 26 7.502 10.146 24.762 190 HG2 MET 26 2HG MET 26 7.152 12.530 24.759 191 HG3 MET 26 1HG MET 26 5.825 12.367 25.908 192 HE1 MET 26 3HE MET 26 9.681 11.816 25.359 193 HE2 MET 26 1HE MET 26 9.185 10.272 26.051 194 HE3 MET 26 2HE MET 26 10.216 11.363 26.977 195 H GLU 27 H GLU 27 5.380 9.611 21.704 196 HA GLU 27 HA GLU 27 4.685 6.887 22.085 197 HB2 GLU 27 2HB GLU 27 5.936 8.123 19.624 198 HB3 GLU 27 1HB GLU 27 5.007 6.640 19.703 199 HG2 GLU 27 2HG GLU 27 3.984 9.434 20.096 200 HG3 GLU 27 1HG GLU 27 3.711 8.406 18.696 201 H SER 28 H SER 28 6.052 5.094 21.377 202 HA SER 28 HA SER 28 8.716 5.384 22.389 203 HB2 SER 28 2HB SER 28 7.313 3.370 22.873 204 HB3 SER 28 1HB SER 28 7.326 2.970 21.162 205 HG SER 28 HG SER 28 9.387 2.843 23.055 206 H SER 29 H SER 29 10.480 4.285 20.928 207 HA SER 29 HA SER 29 10.388 5.639 18.360 208 HB2 SER 29 2HB SER 29 12.614 4.089 19.708 209 HB3 SER 29 1HB SER 29 12.768 5.147 18.312 210 HG SER 29 HG SER 29 11.559 6.429 20.363 211 H THR 30 H THR 30 11.987 3.889 16.833 212 HA THR 30 HA THR 30 10.195 1.902 16.026 213 HB THR 30 HB THR 30 13.193 2.075 15.575 214 HG1 THR 30 1HG THR 30 12.630 3.258 13.751 215 HG21 THR 30 3HG2 THR 30 12.205 -0.090 14.905 216 HG22 THR 30 1HG2 THR 30 12.717 0.844 13.499 217 HG23 THR 30 2HG2 THR 30 11.009 0.770 13.936 218 H GLY 31 H GLY 31 9.806 -0.088 16.874 219 HA2 GLY 31 2HA GLY 31 11.154 -0.828 19.296 220 HA3 GLY 31 1HA GLY 31 9.793 -1.648 18.554 221 H THR 32 H THR 32 10.145 -3.432 17.398 222 HA THR 32 HA THR 32 12.850 -4.427 17.559 223 HB THR 32 HB THR 32 11.069 -5.864 18.487 224 HG1 THR 32 1HG THR 32 11.643 -7.495 16.425 225 HG21 THR 32 3HG2 THR 32 9.212 -5.289 17.028 226 HG22 THR 32 1HG2 THR 32 9.490 -7.024 16.974 227 HG23 THR 32 2HG2 THR 32 10.039 -6.001 15.642 228 H ALA 33 H ALA 33 13.911 -5.367 15.852 229 HA ALA 33 HA ALA 33 13.326 -4.249 13.251 230 HB1 ALA 33 1HB ALA 33 15.612 -4.121 14.130 231 HB2 ALA 33 2HB ALA 33 15.554 -5.107 12.668 232 HB3 ALA 33 3HB ALA 33 15.671 -5.880 14.247 233 HA PRO 34 HA PRO 34 11.232 -8.182 12.446 234 HB2 PRO 34 2HB PRO 34 10.963 -7.035 9.739 235 HB3 PRO 34 1HB PRO 34 9.699 -7.581 10.830 236 HG2 PRO 34 2HG PRO 34 10.055 -4.992 10.365 237 HG3 PRO 34 1HG PRO 34 9.638 -5.581 11.985 238 HD2 PRO 34 2HD PRO 34 12.304 -4.737 10.911 239 HD3 PRO 34 1HD PRO 34 11.532 -4.376 12.476 240 H ALA 35 H ALA 35 12.365 -9.921 12.071 241 HA ALA 35 HA ALA 35 14.843 -9.848 10.664 242 HB1 ALA 35 1HB ALA 35 13.390 -12.204 11.846 243 HB2 ALA 35 2HB ALA 35 14.525 -11.172 12.711 244 HB3 ALA 35 3HB ALA 35 15.082 -12.155 11.356 245 H SER 36 H SER 36 15.132 -10.167 8.606 246 HA SER 36 HA SER 36 13.037 -11.383 7.032 247 HB2 SER 36 2HB SER 36 14.101 -9.300 6.185 248 HB3 SER 36 1HB SER 36 15.658 -10.124 6.155 249 HG SER 36 HG SER 36 15.123 -10.800 4.252 250 H THR 37 H THR 37 13.092 -13.523 7.383 251 HA THR 37 HA THR 37 15.607 -14.904 7.347 252 HB THR 37 HB THR 37 13.993 -16.844 7.906 253 HG1 THR 37 1HG THR 37 12.094 -15.671 9.042 254 HG21 THR 37 3HG2 THR 37 13.860 -16.085 10.266 255 HG22 THR 37 1HG2 THR 37 14.356 -14.477 9.756 256 HG23 THR 37 2HG2 THR 37 15.460 -15.849 9.574 257 H GLY 38 H GLY 38 14.125 -13.692 4.961 258 HA2 GLY 38 2HA GLY 38 14.522 -14.379 2.715 259 HA3 GLY 38 1HA GLY 38 14.438 -16.053 3.252 260 H ALA 39 H ALA 39 12.698 -13.340 2.118 261 HA ALA 39 HA ALA 39 10.088 -14.150 2.854 262 HB1 ALA 39 1HB ALA 39 10.656 -11.831 2.281 263 HB2 ALA 39 2HB ALA 39 9.311 -12.442 1.314 264 HB3 ALA 39 3HB ALA 39 10.922 -12.320 0.608 265 H GLU 40 H GLU 40 12.175 -15.028 0.225 266 HA GLU 40 HA GLU 40 10.001 -16.189 -1.257 267 HB2 GLU 40 2HB GLU 40 11.757 -17.002 -2.846 268 HB3 GLU 40 1HB GLU 40 11.720 -15.263 -2.645 269 HG2 GLU 40 2HG GLU 40 13.686 -17.038 -1.207 270 HG3 GLU 40 1HG GLU 40 13.992 -16.340 -2.795 271 H ASN 41 H ASN 41 12.032 -17.122 1.242 272 HA ASN 41 HA ASN 41 11.745 -19.968 0.731 273 HB2 ASN 41 2HB ASN 41 13.790 -19.228 1.916 274 HB3 ASN 41 1HB ASN 41 12.806 -18.559 3.212 275 HD21 ASN 41 1HD2 ASN 41 12.022 -19.951 4.816 276 HD22 ASN 41 2HD2 ASN 41 12.410 -21.614 4.877 277 H LEU 42 H LEU 42 10.298 -17.448 2.613 278 HA LEU 42 HA LEU 42 8.561 -19.008 4.181 279 HB2 LEU 42 2HB LEU 42 8.240 -16.187 3.140 280 HB3 LEU 42 1HB LEU 42 7.300 -16.904 4.430 281 HG LEU 42 HG LEU 42 10.257 -16.298 4.516 282 HD11 LEU 42 1HD1 LEU 42 8.874 -14.299 4.597 283 HD12 LEU 42 2HD1 LEU 42 9.648 -14.605 6.150 284 HD13 LEU 42 3HD1 LEU 42 7.943 -14.991 5.926 285 HD21 LEU 42 3HD2 LEU 42 10.106 -16.896 6.893 286 HD22 LEU 42 1HD2 LEU 42 9.735 -18.272 5.855 287 HD23 LEU 42 2HD2 LEU 42 8.432 -17.395 6.658 288 HA PRO 43 HA PRO 43 5.580 -20.394 1.205 289 HB2 PRO 43 2HB PRO 43 3.258 -20.173 2.674 290 HB3 PRO 43 1HB PRO 43 4.402 -21.508 2.831 291 HG2 PRO 43 2HG PRO 43 4.112 -19.056 4.512 292 HG3 PRO 43 1HG PRO 43 4.415 -20.731 5.015 293 HD2 PRO 43 2HD PRO 43 6.394 -18.925 4.929 294 HD3 PRO 43 1HD PRO 43 6.666 -20.618 4.473 295 H ALA 44 H ALA 44 3.880 -19.704 -0.140 296 HA ALA 44 HA ALA 44 3.810 -16.872 -0.492 297 HB1 ALA 44 1HB ALA 44 2.509 -17.375 -2.510 298 HB2 ALA 44 2HB ALA 44 2.425 -19.069 -2.025 299 HB3 ALA 44 3HB ALA 44 3.980 -18.343 -2.430 300 H GLY 45 H GLY 45 2.687 -15.866 0.904 301 HA2 GLY 45 2HA GLY 45 -0.160 -15.984 0.863 302 HA3 GLY 45 1HA GLY 45 0.520 -16.525 2.402 303 H SER 46 H SER 46 1.549 -14.149 0.102 304 HA SER 46 HA SER 46 2.109 -12.259 2.227 305 HB2 SER 46 2HB SER 46 2.641 -12.026 -0.727 306 HB3 SER 46 1HB SER 46 3.417 -11.135 0.586 307 HG SER 46 HG SER 46 4.805 -12.710 0.691 308 H ALA 47 H ALA 47 1.570 -9.913 1.665 309 HA ALA 47 HA ALA 47 -1.215 -9.812 0.799 310 HB1 ALA 47 1HB ALA 47 -1.331 -7.747 2.088 311 HB2 ALA 47 2HB ALA 47 0.389 -7.874 2.462 312 HB3 ALA 47 3HB ALA 47 -0.740 -9.072 3.091 313 H LEU 48 H LEU 48 -1.814 -7.698 -0.287 314 HA LEU 48 HA LEU 48 0.394 -6.578 -1.796 315 HB2 LEU 48 2HB LEU 48 -0.669 -6.687 -3.907 316 HB3 LEU 48 1HB LEU 48 -0.794 -8.294 -3.243 317 HG LEU 48 HG LEU 48 -3.060 -6.288 -3.289 318 HD11 LEU 48 1HD1 LEU 48 -2.487 -8.600 -5.135 319 HD12 LEU 48 2HD1 LEU 48 -2.398 -6.886 -5.548 320 HD13 LEU 48 3HD1 LEU 48 -3.950 -7.615 -5.142 321 HD21 LEU 48 3HD2 LEU 48 -4.467 -8.259 -2.872 322 HD22 LEU 48 1HD2 LEU 48 -3.311 -7.994 -1.562 323 HD23 LEU 48 2HD2 LEU 48 -3.012 -9.250 -2.758 324 H LEU 49 H LEU 49 -0.023 -4.476 -2.543 325 HA LEU 49 HA LEU 49 -2.197 -3.224 -1.048 326 HB2 LEU 49 2HB LEU 49 -0.847 -1.159 -0.984 327 HB3 LEU 49 1HB LEU 49 -0.050 -2.486 -0.197 328 HG LEU 49 HG LEU 49 1.302 -2.716 -2.400 329 HD11 LEU 49 1HD1 LEU 49 0.338 0.123 -2.723 330 HD12 LEU 49 2HD1 LEU 49 -0.027 -1.235 -3.786 331 HD13 LEU 49 3HD1 LEU 49 1.629 -0.651 -3.642 332 HD21 LEU 49 3HD2 LEU 49 2.255 -1.999 -0.284 333 HD22 LEU 49 1HD2 LEU 49 1.696 -0.353 -0.575 334 HD23 LEU 49 2HD2 LEU 49 2.923 -1.063 -1.620 335 H VAL 50 H VAL 50 -3.624 -2.017 -2.056 336 HA VAL 50 HA VAL 50 -3.383 -1.863 -4.976 337 HB VAL 50 HB VAL 50 -5.868 -2.241 -3.268 338 HG11 VAL 50 1HG1 VAL 50 -6.352 -0.832 -5.206 339 HG12 VAL 50 2HG1 VAL 50 -7.104 -2.421 -5.378 340 HG13 VAL 50 3HG1 VAL 50 -5.626 -2.041 -6.263 341 HG21 VAL 50 3HG2 VAL 50 -4.543 -4.095 -5.244 342 HG22 VAL 50 1HG2 VAL 50 -6.060 -4.409 -4.405 343 HG23 VAL 50 2HG2 VAL 50 -4.556 -4.285 -3.490 344 H VAL 51 H VAL 51 -3.155 0.167 -5.632 345 HA VAL 51 HA VAL 51 -4.129 2.389 -3.946 346 HB VAL 51 HB VAL 51 -2.565 2.642 -6.552 347 HG11 VAL 51 1HG1 VAL 51 -3.707 4.624 -5.727 348 HG12 VAL 51 2HG1 VAL 51 -1.956 4.798 -5.630 349 HG13 VAL 51 3HG1 VAL 51 -2.890 4.460 -4.173 350 HG21 VAL 51 3HG2 VAL 51 -1.400 2.491 -3.771 351 HG22 VAL 51 1HG2 VAL 51 -0.524 2.768 -5.272 352 HG23 VAL 51 2HG2 VAL 51 -1.292 1.208 -4.976 353 H LYS 52 H LYS 52 -5.988 3.140 -4.228 354 HA LYS 52 HA LYS 52 -7.562 2.339 -6.484 355 HB2 LYS 52 2HB LYS 52 -8.240 4.391 -4.369 356 HB3 LYS 52 1HB LYS 52 -9.360 3.584 -5.457 357 HG2 LYS 52 2HG LYS 52 -8.771 1.417 -4.345 358 HG3 LYS 52 1HG LYS 52 -7.788 2.334 -3.211 359 HD2 LYS 52 2HD LYS 52 -9.911 1.905 -2.178 360 HD3 LYS 52 1HD LYS 52 -9.820 3.621 -2.567 361 HE2 LYS 52 2HE LYS 52 -12.019 2.742 -3.113 362 HE3 LYS 52 1HE LYS 52 -11.177 3.216 -4.585 363 HZ1 LYS 52 3HZ LYS 52 -10.624 0.878 -4.956 364 HZ2 LYS 52 1HZ LYS 52 -12.281 1.118 -4.863 365 HZ3 LYS 52 2HZ LYS 52 -11.498 0.441 -3.563 366 H ARG 53 H ARG 53 -6.010 5.250 -5.319 367 HA ARG 53 HA ARG 53 -5.593 6.404 -7.826 368 HB2 ARG 53 2HB ARG 53 -8.086 6.688 -7.777 369 HB3 ARG 53 1HB ARG 53 -7.921 7.635 -6.308 370 HG2 ARG 53 2HG ARG 53 -6.631 9.319 -7.545 371 HG3 ARG 53 1HG ARG 53 -6.814 8.363 -9.013 372 HD2 ARG 53 2HD ARG 53 -9.233 8.635 -8.898 373 HD3 ARG 53 1HD ARG 53 -9.067 9.555 -7.404 374 HE ARG 53 HE ARG 53 -7.608 10.574 -9.667 375 HH11 ARG 53 1HH1 ARG 53 -10.654 10.716 -7.877 376 HH12 ARG 53 2HH1 ARG 53 -11.033 12.310 -8.335 377 HH21 ARG 53 1HH2 ARG 53 -8.117 12.793 -10.299 378 HH22 ARG 53 2HH2 ARG 53 -9.548 13.513 -9.748 379 H GLY 54 H GLY 54 -4.580 8.468 -7.613 380 HA2 GLY 54 2HA GLY 54 -4.132 10.355 -6.081 381 HA3 GLY 54 1HA GLY 54 -3.714 9.132 -4.889 382 HA PRO 55 HA PRO 55 -0.080 10.427 -8.034 383 HB2 PRO 55 2HB PRO 55 1.113 12.145 -6.164 384 HB3 PRO 55 1HB PRO 55 0.295 12.611 -7.655 385 HG2 PRO 55 2HG PRO 55 -0.746 12.517 -4.866 386 HG3 PRO 55 1HG PRO 55 -1.095 13.680 -6.156 387 HD2 PRO 55 2HD PRO 55 -2.859 11.830 -5.492 388 HD3 PRO 55 1HD PRO 55 -2.604 12.236 -7.204 389 H ASN 56 H ASN 56 -0.583 9.185 -4.944 390 HA ASN 56 HA ASN 56 1.946 8.603 -3.998 391 HB2 ASN 56 2HB ASN 56 -0.163 8.091 -2.762 392 HB3 ASN 56 1HB ASN 56 -0.509 6.802 -3.897 393 HD21 ASN 56 1HD2 ASN 56 2.452 5.871 -3.806 394 HD22 ASN 56 2HD2 ASN 56 2.540 5.088 -2.267 395 H ALA 57 H ALA 57 -0.231 6.767 -6.173 396 HA ALA 57 HA ALA 57 1.581 5.801 -7.995 397 HB1 ALA 57 1HB ALA 57 1.510 3.345 -7.328 398 HB2 ALA 57 2HB ALA 57 0.934 3.875 -5.731 399 HB3 ALA 57 3HB ALA 57 2.520 4.354 -6.301 400 H GLY 58 H GLY 58 0.222 3.533 -8.836 401 HA2 GLY 58 2HA GLY 58 -2.595 3.877 -8.606 402 HA3 GLY 58 1HA GLY 58 -1.954 4.557 -10.100 403 H ALA 59 H ALA 59 -1.365 1.695 -8.143 404 HA ALA 59 HA ALA 59 -2.163 -0.110 -10.165 405 HB1 ALA 59 1HB ALA 59 0.041 0.491 -11.070 406 HB2 ALA 59 2HB ALA 59 0.070 -1.161 -10.448 407 HB3 ALA 59 3HB ALA 59 0.789 0.148 -9.509 408 H ARG 60 H ARG 60 -0.961 -2.356 -9.224 409 HA ARG 60 HA ARG 60 -1.160 -2.283 -6.327 410 HB2 ARG 60 2HB ARG 60 -2.482 -4.353 -6.346 411 HB3 ARG 60 1HB ARG 60 -3.353 -3.041 -7.124 412 HG2 ARG 60 2HG ARG 60 -2.778 -3.953 -9.319 413 HG3 ARG 60 1HG ARG 60 -1.867 -5.248 -8.543 414 HD2 ARG 60 2HD ARG 60 -4.044 -6.053 -9.199 415 HD3 ARG 60 1HD ARG 60 -3.934 -5.998 -7.439 416 HE ARG 60 HE ARG 60 -5.039 -3.628 -8.568 417 HH11 ARG 60 1HH1 ARG 60 -5.832 -6.931 -7.554 418 HH12 ARG 60 2HH1 ARG 60 -7.474 -6.602 -7.279 419 HH21 ARG 60 1HH2 ARG 60 -7.292 -3.193 -8.265 420 HH22 ARG 60 2HH2 ARG 60 -8.356 -4.400 -7.723 421 H PHE 61 H PHE 61 0.327 -3.611 -5.370 422 HA PHE 61 HA PHE 61 1.517 -5.620 -7.010 423 HB2 PHE 61 2HB PHE 61 3.867 -5.026 -6.512 424 HB3 PHE 61 1HB PHE 61 3.056 -3.840 -7.512 425 HD1 PHE 61 1HD PHE 61 4.492 -4.529 -4.205 426 HD2 PHE 61 2HD PHE 61 2.743 -1.596 -6.745 427 HE1 PHE 61 1HE PHE 61 5.293 -2.754 -2.703 428 HE2 PHE 61 2HE PHE 61 3.528 0.174 -5.253 429 HZ PHE 61 HZ PHE 61 4.813 -0.397 -3.221 430 H LEU 62 H LEU 62 2.627 -7.174 -6.031 431 HA LEU 62 HA LEU 62 1.496 -7.938 -3.484 432 HB2 LEU 62 2HB LEU 62 1.572 -9.344 -5.576 433 HB3 LEU 62 1HB LEU 62 3.306 -9.344 -5.467 434 HG LEU 62 HG LEU 62 1.504 -10.634 -3.394 435 HD11 LEU 62 1HD1 LEU 62 2.910 -11.821 -5.781 436 HD12 LEU 62 2HD1 LEU 62 1.168 -11.638 -5.587 437 HD13 LEU 62 3HD1 LEU 62 2.064 -12.728 -4.530 438 HD21 LEU 62 3HD2 LEU 62 4.435 -11.003 -4.034 439 HD22 LEU 62 1HD2 LEU 62 3.524 -11.880 -2.806 440 HD23 LEU 62 2HD2 LEU 62 3.800 -10.145 -2.631 441 H LEU 63 H LEU 63 2.693 -7.946 -1.601 442 HA LEU 63 HA LEU 63 5.384 -6.877 -1.773 443 HB2 LEU 63 2HB LEU 63 3.620 -7.578 0.589 444 HB3 LEU 63 1HB LEU 63 5.267 -7.033 0.757 445 HG LEU 63 HG LEU 63 4.610 -4.844 -0.245 446 HD11 LEU 63 1HD1 LEU 63 2.253 -4.243 -0.406 447 HD12 LEU 63 2HD1 LEU 63 1.801 -5.906 -0.036 448 HD13 LEU 63 3HD1 LEU 63 2.662 -5.539 -1.532 449 HD21 LEU 63 3HD2 LEU 63 3.060 -5.707 2.185 450 HD22 LEU 63 1HD2 LEU 63 3.407 -4.042 1.724 451 HD23 LEU 63 2HD2 LEU 63 4.725 -5.129 2.156 452 H ASP 64 H ASP 64 6.901 -8.273 -2.208 453 HA ASP 64 HA ASP 64 6.901 -10.886 -0.845 454 HB2 ASP 64 2HB ASP 64 8.024 -11.845 -2.811 455 HB3 ASP 64 1HB ASP 64 6.499 -11.126 -3.291 456 H GLN 65 H GLN 65 7.924 -8.215 -0.301 457 HA GLN 65 HA GLN 65 10.796 -8.749 -0.123 458 HB2 GLN 65 2HB GLN 65 11.081 -6.282 -0.241 459 HB3 GLN 65 1HB GLN 65 10.358 -6.940 -1.704 460 HG2 GLN 65 2HG GLN 65 8.134 -6.284 -0.831 461 HG3 GLN 65 1HG GLN 65 8.939 -5.517 0.529 462 HE21 GLN 65 1HE2 GLN 65 11.152 -4.517 -1.141 463 HE22 GLN 65 2HE2 GLN 65 10.469 -3.205 -2.035 464 HA PRO 66 HA PRO 66 10.165 -8.473 4.257 465 HB2 PRO 66 2HB PRO 66 12.517 -7.248 5.009 466 HB3 PRO 66 1HB PRO 66 12.358 -8.974 4.667 467 HG2 PRO 66 2HG PRO 66 13.363 -6.771 2.923 468 HG3 PRO 66 1HG PRO 66 13.982 -8.420 3.111 469 HD2 PRO 66 2HD PRO 66 12.496 -7.693 0.995 470 HD3 PRO 66 1HD PRO 66 12.361 -9.310 1.716 471 H THR 67 H THR 67 11.301 -5.540 2.619 472 HA THR 67 HA THR 67 9.505 -4.026 4.327 473 HB THR 67 HB THR 67 12.339 -3.184 3.687 474 HG1 THR 67 1HG THR 67 11.385 -4.811 5.472 475 HG21 THR 67 3HG2 THR 67 10.226 -1.920 5.450 476 HG22 THR 67 1HG2 THR 67 10.749 -1.300 3.886 477 HG23 THR 67 2HG2 THR 67 11.878 -1.334 5.241 478 H THR 68 H THR 68 8.143 -2.971 3.074 479 HA THR 68 HA THR 68 8.983 -2.124 0.400 480 HB THR 68 HB THR 68 6.238 -1.878 1.682 481 HG1 THR 68 1HG THR 68 7.102 -3.802 -0.218 482 HG21 THR 68 3HG2 THR 68 6.642 -0.370 -0.218 483 HG22 THR 68 1HG2 THR 68 5.456 -1.610 -0.631 484 HG23 THR 68 2HG2 THR 68 7.119 -1.747 -1.209 485 H THR 69 H THR 69 9.766 -0.129 0.250 486 HA THR 69 HA THR 69 9.278 1.657 2.494 487 HB THR 69 HB THR 69 11.477 2.666 1.150 488 HG1 THR 69 1HG THR 69 11.423 0.556 -0.048 489 HG21 THR 69 3HG2 THR 69 11.240 2.450 3.579 490 HG22 THR 69 1HG2 THR 69 12.766 1.760 3.038 491 HG23 THR 69 2HG2 THR 69 11.420 0.699 3.454 492 H ALA 70 H ALA 70 7.609 2.975 2.005 493 HA ALA 70 HA ALA 70 7.606 4.224 -0.638 494 HB1 ALA 70 1HB ALA 70 5.251 4.736 -0.224 495 HB2 ALA 70 2HB ALA 70 5.363 4.001 1.377 496 HB3 ALA 70 3HB ALA 70 5.553 3.004 -0.068 497 H GLY 71 H GLY 71 8.364 6.199 -0.733 498 HA2 GLY 71 2HA GLY 71 7.605 8.343 0.836 499 HA3 GLY 71 1HA GLY 71 9.071 7.691 1.553 500 H ARG 72 H ARG 72 9.950 9.809 0.923 501 HA ARG 72 HA ARG 72 10.721 9.834 -1.915 502 HB2 ARG 72 2HB ARG 72 11.214 12.270 -1.571 503 HB3 ARG 72 1HB ARG 72 9.518 11.852 -1.412 504 HG2 ARG 72 2HG ARG 72 9.640 12.014 0.972 505 HG3 ARG 72 1HG ARG 72 11.390 12.219 0.912 506 HD2 ARG 72 2HD ARG 72 10.270 14.359 1.272 507 HD3 ARG 72 1HD ARG 72 11.117 14.316 -0.270 508 HE ARG 72 HE ARG 72 8.453 13.582 -0.693 509 HH11 ARG 72 1HH1 ARG 72 10.382 16.408 0.156 510 HH12 ARG 72 2HH1 ARG 72 9.302 17.548 -0.484 511 HH21 ARG 72 1HH2 ARG 72 6.910 15.152 -1.587 512 HH22 ARG 72 2HH2 ARG 72 7.283 16.807 -1.529 513 H HIS 73 H HIS 73 11.796 8.419 0.373 514 HA HIS 73 HA HIS 73 14.425 9.535 0.825 515 HB2 HIS 73 2HB HIS 73 14.696 7.405 2.229 516 HB3 HIS 73 1HB HIS 73 13.459 8.529 2.769 517 HD1 HIS 73 1HD HIS 73 11.069 7.658 2.848 518 HD2 HIS 73 2HD HIS 73 13.713 5.016 1.052 519 HE1 HIS 73 1HE HIS 73 9.819 5.482 2.569 520 HA PRO 74 HA PRO 74 16.878 7.632 -2.253 521 HB2 PRO 74 2HB PRO 74 18.188 5.906 -0.208 522 HB3 PRO 74 1HB PRO 74 18.921 6.916 -1.462 523 HG2 PRO 74 2HG PRO 74 18.894 7.789 1.016 524 HG3 PRO 74 1HG PRO 74 18.472 8.898 -0.302 525 HD2 PRO 74 2HD PRO 74 16.690 7.494 1.638 526 HD3 PRO 74 1HD PRO 74 16.586 9.152 1.007 527 H GLU 75 H GLU 75 15.736 5.055 -0.020 528 HA GLU 75 HA GLU 75 15.879 3.215 -2.292 529 HB2 GLU 75 2HB GLU 75 15.429 2.651 0.622 530 HB3 GLU 75 1HB GLU 75 15.432 1.430 -0.637 531 HG2 GLU 75 2HG GLU 75 17.748 2.114 -1.202 532 HG3 GLU 75 1HG GLU 75 17.724 3.167 0.214 533 H SER 76 H SER 76 13.817 5.225 -2.133 534 HA SER 76 HA SER 76 11.324 4.266 -1.394 535 HB2 SER 76 2HB SER 76 10.501 5.829 -3.180 536 HB3 SER 76 1HB SER 76 11.642 6.555 -2.042 537 HG SER 76 HG SER 76 12.788 5.356 -4.234 538 H ASP 77 H ASP 77 10.421 2.395 -2.010 539 HA ASP 77 HA ASP 77 10.940 1.026 -4.460 540 HB2 ASP 77 2HB ASP 77 8.678 0.832 -2.443 541 HB3 ASP 77 1HB ASP 77 8.723 -0.193 -3.860 542 H ILE 78 H ILE 78 8.353 2.974 -3.219 543 HA ILE 78 HA ILE 78 7.862 4.040 -5.871 544 HB ILE 78 HB ILE 78 5.413 4.204 -5.318 545 HG12 ILE 78 2HG1 ILE 78 6.047 2.213 -3.116 546 HG13 ILE 78 1HG1 ILE 78 5.648 3.904 -2.853 547 HG21 ILE 78 1HG2 ILE 78 4.830 1.893 -5.885 548 HG22 ILE 78 2HG2 ILE 78 6.484 1.396 -5.526 549 HG23 ILE 78 3HG2 ILE 78 6.166 2.502 -6.861 550 HD11 ILE 78 3HD1 ILE 78 3.837 1.828 -4.068 551 HD12 ILE 78 1HD1 ILE 78 3.426 3.521 -3.798 552 HD13 ILE 78 2HD1 ILE 78 3.741 2.462 -2.425 553 H PHE 79 H PHE 79 7.589 6.225 -5.812 554 HA PHE 79 HA PHE 79 7.770 7.362 -3.133 555 HB2 PHE 79 2HB PHE 79 8.754 9.388 -4.092 556 HB3 PHE 79 1HB PHE 79 9.669 7.994 -4.618 557 HD1 PHE 79 1HD PHE 79 9.403 7.206 -6.991 558 HD2 PHE 79 2HD PHE 79 7.744 10.868 -5.613 559 HE1 PHE 79 1HE PHE 79 9.207 7.991 -9.315 560 HE2 PHE 79 2HE PHE 79 7.534 11.652 -7.925 561 HZ PHE 79 HZ PHE 79 8.266 10.212 -9.784 562 H LEU 80 H LEU 80 5.997 8.123 -2.345 563 HA LEU 80 HA LEU 80 3.806 8.592 -4.082 564 HB2 LEU 80 2HB LEU 80 2.453 9.162 -2.124 565 HB3 LEU 80 1HB LEU 80 3.338 7.691 -1.836 566 HG LEU 80 HG LEU 80 4.045 10.394 -0.691 567 HD11 LEU 80 1HD1 LEU 80 3.110 9.520 1.398 568 HD12 LEU 80 2HD1 LEU 80 2.564 8.083 0.533 569 HD13 LEU 80 3HD1 LEU 80 1.903 9.665 0.122 570 HD21 LEU 80 3HD2 LEU 80 5.367 9.039 0.932 571 HD22 LEU 80 1HD2 LEU 80 5.990 8.962 -0.716 572 HD23 LEU 80 2HD2 LEU 80 5.052 7.620 -0.064 573 H ASP 81 H ASP 81 3.582 10.377 -5.268 574 HA ASP 81 HA ASP 81 5.301 12.525 -4.479 575 HB2 ASP 81 2HB ASP 81 5.300 11.760 -6.848 576 HB3 ASP 81 1HB ASP 81 3.675 12.419 -7.016 577 H ASP 82 H ASP 82 3.987 12.895 -2.657 578 HA ASP 82 HA ASP 82 2.132 15.079 -3.344 579 HB2 ASP 82 2HB ASP 82 1.010 13.262 -2.035 580 HB3 ASP 82 1HB ASP 82 2.149 13.545 -0.718 581 H VAL 83 H VAL 83 2.293 17.007 -2.110 582 HA VAL 83 HA VAL 83 5.005 17.758 -1.695 583 HB VAL 83 HB VAL 83 3.279 19.221 -2.728 584 HG11 VAL 83 1HG1 VAL 83 2.199 19.531 0.058 585 HG12 VAL 83 2HG1 VAL 83 1.406 18.730 -1.291 586 HG13 VAL 83 3HG1 VAL 83 1.704 20.471 -1.353 587 HG21 VAL 83 3HG2 VAL 83 5.309 20.280 -1.959 588 HG22 VAL 83 1HG2 VAL 83 4.669 20.376 -0.315 589 HG23 VAL 83 2HG2 VAL 83 3.942 21.331 -1.605 590 H THR 84 H THR 84 2.590 16.536 0.447 591 HA THR 84 HA THR 84 3.604 17.996 2.736 592 HB THR 84 HB THR 84 1.508 15.849 2.916 593 HG1 THR 84 1HG THR 84 0.818 16.997 1.188 594 HG21 THR 84 3HG2 THR 84 1.851 18.563 4.218 595 HG22 THR 84 1HG2 THR 84 2.251 17.013 4.953 596 HG23 THR 84 2HG2 THR 84 0.574 17.403 4.583 597 H VAL 85 H VAL 85 4.838 15.487 1.183 598 HA VAL 85 HA VAL 85 5.177 13.589 3.342 599 HB VAL 85 HB VAL 85 6.558 13.686 0.638 600 HG11 VAL 85 1HG1 VAL 85 6.268 11.411 2.597 601 HG12 VAL 85 2HG1 VAL 85 7.752 12.295 2.248 602 HG13 VAL 85 3HG1 VAL 85 7.003 11.296 0.995 603 HG21 VAL 85 3HG2 VAL 85 4.928 12.076 -0.112 604 HG22 VAL 85 1HG2 VAL 85 4.122 13.546 0.421 605 HG23 VAL 85 2HG2 VAL 85 4.115 12.112 1.455 606 H SER 86 H SER 86 6.963 13.377 4.622 607 HA SER 86 HA SER 86 8.758 15.634 4.685 608 HB2 SER 86 2HB SER 86 9.536 14.482 6.821 609 HB3 SER 86 1HB SER 86 7.860 15.034 6.790 610 HG SER 86 HG SER 86 7.439 13.050 7.299 611 H ARG 87 H ARG 87 9.403 12.185 5.105 612 HA ARG 87 HA ARG 87 11.577 12.252 3.142 613 HB2 ARG 87 2HB ARG 87 12.495 12.963 5.432 614 HB3 ARG 87 1HB ARG 87 12.113 11.348 5.992 615 HG2 ARG 87 2HG ARG 87 14.417 11.348 5.472 616 HG3 ARG 87 1HG ARG 87 13.622 10.487 4.152 617 HD2 ARG 87 2HD ARG 87 15.283 12.031 3.265 618 HD3 ARG 87 1HD ARG 87 13.659 12.554 2.809 619 HE ARG 87 HE ARG 87 14.333 13.829 5.192 620 HH11 ARG 87 1HH1 ARG 87 15.274 13.916 1.802 621 HH12 ARG 87 2HH1 ARG 87 15.936 15.480 1.854 622 HH21 ARG 87 1HH2 ARG 87 15.198 15.959 5.313 623 HH22 ARG 87 2HH2 ARG 87 15.896 16.682 3.942 624 H ARG 88 H ARG 88 10.639 10.266 5.903 625 HA ARG 88 HA ARG 88 10.040 8.025 4.145 626 HB2 ARG 88 2HB ARG 88 10.425 8.295 7.124 627 HB3 ARG 88 1HB ARG 88 9.700 6.870 6.401 628 HG2 ARG 88 2HG ARG 88 11.772 6.535 5.096 629 HG3 ARG 88 1HG ARG 88 12.491 7.896 5.966 630 HD2 ARG 88 2HD ARG 88 12.310 6.783 8.038 631 HD3 ARG 88 1HD ARG 88 11.283 5.527 7.349 632 HE ARG 88 HE ARG 88 14.063 5.849 6.468 633 HH11 ARG 88 1HH1 ARG 88 11.428 3.818 7.674 634 HH12 ARG 88 2HH1 ARG 88 12.371 2.407 7.801 635 HH21 ARG 88 1HH2 ARG 88 15.386 3.889 6.643 636 HH22 ARG 88 2HH2 ARG 88 14.663 2.454 7.212 637 H HIS 89 H HIS 89 7.940 6.848 4.933 638 HA HIS 89 HA HIS 89 6.040 8.761 5.878 639 HB2 HIS 89 2HB HIS 89 6.317 9.200 3.368 640 HB3 HIS 89 1HB HIS 89 5.554 7.633 3.120 641 HD2 HIS 89 2HD HIS 89 2.875 7.505 4.284 642 HE1 HIS 89 1HE HIS 89 2.468 11.706 4.000 643 HE2 HIS 89 2HE HIS 89 1.472 9.542 4.896 644 H ALA 90 H ALA 90 5.939 5.833 3.874 645 HA ALA 90 HA ALA 90 4.648 4.531 6.130 646 HB1 ALA 90 1HB ALA 90 3.616 4.468 3.293 647 HB2 ALA 90 2HB ALA 90 2.854 5.290 4.657 648 HB3 ALA 90 3HB ALA 90 2.977 3.533 4.645 649 H GLU 91 H GLU 91 6.148 3.126 6.599 650 HA GLU 91 HA GLU 91 7.202 1.576 4.368 651 HB2 GLU 91 2HB GLU 91 8.310 1.764 7.172 652 HB3 GLU 91 1HB GLU 91 8.934 0.707 5.922 653 HG2 GLU 91 2HG GLU 91 10.411 2.437 5.787 654 HG3 GLU 91 1HG GLU 91 9.213 2.962 4.608 655 H PHE 92 H PHE 92 6.736 -0.425 4.135 656 HA PHE 92 HA PHE 92 5.019 -1.698 6.137 657 HB2 PHE 92 2HB PHE 92 5.769 -2.645 3.346 658 HB3 PHE 92 1HB PHE 92 4.601 -3.389 4.408 659 HD1 PHE 92 2HD PHE 92 5.231 -0.174 2.604 660 HD2 PHE 92 1HD PHE 92 2.355 -2.847 4.253 661 HE1 PHE 92 2HE PHE 92 3.428 1.176 1.627 662 HE2 PHE 92 1HE PHE 92 0.545 -1.499 3.271 663 HZ PHE 92 HZ PHE 92 1.081 0.511 1.959 664 H ARG 93 H ARG 93 6.122 -2.829 7.568 665 HA ARG 93 HA ARG 93 8.690 -3.983 6.730 666 HB2 ARG 93 2HB ARG 93 7.967 -2.988 9.502 667 HB3 ARG 93 1HB ARG 93 9.538 -3.563 8.961 668 HG2 ARG 93 2HG ARG 93 9.775 -1.637 7.502 669 HG3 ARG 93 1HG ARG 93 8.173 -1.064 7.969 670 HD2 ARG 93 2HD ARG 93 9.016 -1.025 10.338 671 HD3 ARG 93 1HD ARG 93 10.629 -1.307 9.686 672 HE ARG 93 HE ARG 93 9.882 0.821 8.294 673 HH11 ARG 93 1HH1 ARG 93 9.847 0.106 11.744 674 HH12 ARG 93 2HH1 ARG 93 9.762 1.747 12.227 675 HH21 ARG 93 1HH2 ARG 93 9.718 3.183 8.997 676 HH22 ARG 93 2HH2 ARG 93 9.696 3.465 10.669 677 H ILE 94 H ILE 94 8.511 -6.123 6.715 678 HA ILE 94 HA ILE 94 6.408 -7.179 8.421 679 HB ILE 94 HB ILE 94 5.856 -8.847 6.750 680 HG12 ILE 94 2HG1 ILE 94 6.852 -8.481 4.344 681 HG13 ILE 94 1HG1 ILE 94 8.196 -7.737 5.193 682 HG21 ILE 94 1HG2 ILE 94 5.990 -6.080 5.598 683 HG22 ILE 94 2HG2 ILE 94 4.675 -6.777 6.552 684 HG23 ILE 94 3HG2 ILE 94 5.022 -7.385 4.930 685 HD11 ILE 94 3HD1 ILE 94 8.612 -9.845 6.368 686 HD12 ILE 94 1HD1 ILE 94 8.671 -10.055 4.617 687 HD13 ILE 94 2HD1 ILE 94 7.251 -10.583 5.519 688 H ASN 95 H ASN 95 6.669 -9.003 9.506 689 HA ASN 95 HA ASN 95 9.321 -10.233 9.551 690 HB2 ASN 95 2HB ASN 95 8.609 -8.980 11.697 691 HB3 ASN 95 1HB ASN 95 7.298 -10.144 11.806 692 HD21 ASN 95 1HD2 ASN 95 7.974 -11.078 13.682 693 HD22 ASN 95 2HD2 ASN 95 9.423 -12.010 13.826 694 H GLU 96 H GLU 96 9.244 -12.480 9.604 695 HA GLU 96 HA GLU 96 7.349 -13.758 8.087 696 HB2 GLU 96 2HB GLU 96 8.222 -15.880 9.027 697 HB3 GLU 96 1HB GLU 96 9.485 -14.768 8.527 698 HG2 GLU 96 2HG GLU 96 9.872 -14.117 10.816 699 HG3 GLU 96 1HG GLU 96 8.536 -15.133 11.354 700 H GLY 97 H GLY 97 7.233 -13.211 11.541 701 HA2 GLY 97 2HA GLY 97 4.915 -14.895 11.882 702 HA3 GLY 97 1HA GLY 97 5.690 -13.916 13.116 703 H GLU 98 H GLU 98 5.563 -11.362 12.016 704 HA GLU 98 HA GLU 98 2.746 -11.013 11.524 705 HB2 GLU 98 2HB GLU 98 2.671 -9.101 13.099 706 HB3 GLU 98 1HB GLU 98 2.828 -10.667 13.867 707 HG2 GLU 98 2HG GLU 98 5.155 -8.821 13.400 708 HG3 GLU 98 1HG GLU 98 4.152 -8.732 14.843 709 H PHE 99 H PHE 99 2.205 -9.549 10.160 710 HA PHE 99 HA PHE 99 4.308 -8.039 8.789 711 HB2 PHE 99 2HB PHE 99 1.475 -8.784 7.976 712 HB3 PHE 99 1HB PHE 99 2.582 -7.855 6.974 713 HD1 PHE 99 2HD PHE 99 2.449 -11.150 8.767 714 HD2 PHE 99 1HD PHE 99 3.704 -9.014 5.315 715 HE1 PHE 99 2HE PHE 99 3.260 -13.248 7.774 716 HE2 PHE 99 1HE PHE 99 4.515 -11.104 4.311 717 HZ PHE 99 HZ PHE 99 4.296 -13.229 5.538 718 H GLU 100 H GLU 100 4.376 -5.827 9.096 719 HA GLU 100 HA GLU 100 1.977 -4.567 10.166 720 HB2 GLU 100 2HB GLU 100 4.753 -4.378 11.231 721 HB3 GLU 100 1HB GLU 100 3.550 -3.134 11.544 722 HG2 GLU 100 2HG GLU 100 2.130 -4.691 12.572 723 HG3 GLU 100 1HG GLU 100 3.206 -6.040 12.197 724 H VAL 101 H VAL 101 1.474 -2.692 9.509 725 HA VAL 101 HA VAL 101 3.299 -1.341 7.640 726 HB VAL 101 HB VAL 101 1.335 -1.978 6.365 727 HG11 VAL 101 1HG1 VAL 101 -0.950 -1.302 6.963 728 HG12 VAL 101 2HG1 VAL 101 -0.348 -0.638 8.483 729 HG13 VAL 101 3HG1 VAL 101 -0.243 -2.369 8.177 730 HG21 VAL 101 3HG2 VAL 101 2.198 0.239 5.854 731 HG22 VAL 101 1HG2 VAL 101 1.145 0.953 7.076 732 HG23 VAL 101 2HG2 VAL 101 0.447 0.204 5.642 733 H VAL 102 H VAL 102 4.154 0.484 8.363 734 HA VAL 102 HA VAL 102 2.679 1.879 10.452 735 HB VAL 102 HB VAL 102 4.861 2.556 11.468 736 HG11 VAL 102 1HG1 VAL 102 5.285 0.395 12.575 737 HG12 VAL 102 2HG1 VAL 102 4.291 -0.405 11.353 738 HG13 VAL 102 3HG1 VAL 102 3.566 0.766 12.452 739 HG21 VAL 102 3HG2 VAL 102 6.335 2.162 9.550 740 HG22 VAL 102 1HG2 VAL 102 6.008 0.432 9.641 741 HG23 VAL 102 2HG2 VAL 102 6.876 1.234 10.949 742 H ASP 103 H ASP 103 2.003 3.869 9.845 743 HA ASP 103 HA ASP 103 3.540 5.337 7.936 744 HB2 ASP 103 2HB ASP 103 1.229 5.702 7.756 745 HB3 ASP 103 1HB ASP 103 1.002 5.892 9.484 746 H VAL 104 H VAL 104 5.143 6.507 8.419 747 HA VAL 104 HA VAL 104 5.433 7.538 11.159 748 HB VAL 104 HB VAL 104 7.884 7.632 10.767 749 HG11 VAL 104 1HG1 VAL 104 6.968 5.685 11.889 750 HG12 VAL 104 2HG1 VAL 104 8.329 5.213 10.869 751 HG13 VAL 104 3HG1 VAL 104 6.675 4.905 10.336 752 HG21 VAL 104 3HG2 VAL 104 8.865 6.462 8.831 753 HG22 VAL 104 1HG2 VAL 104 7.879 7.837 8.334 754 HG23 VAL 104 2HG2 VAL 104 7.246 6.199 8.184 755 H GLY 105 H GLY 105 4.524 8.389 8.170 756 HA2 GLY 105 2HA GLY 105 5.651 11.091 8.342 757 HA3 GLY 105 1HA GLY 105 5.147 10.313 6.845 758 H SER 106 H SER 106 3.798 10.975 10.047 759 HA SER 106 HA SER 106 1.118 10.961 9.155 760 HB2 SER 106 2HB SER 106 2.315 11.959 11.730 761 HB3 SER 106 1HB SER 106 0.628 11.519 11.456 762 HG SER 106 HG SER 106 1.862 9.406 10.678 763 H LEU 107 H LEU 107 3.063 13.063 8.080 764 HA LEU 107 HA LEU 107 2.000 15.596 8.916 765 HB2 LEU 107 2HB LEU 107 3.738 14.882 6.549 766 HB3 LEU 107 1HB LEU 107 3.236 16.509 6.918 767 HG LEU 107 HG LEU 107 4.490 16.252 9.119 768 HD11 LEU 107 1HD1 LEU 107 4.680 13.844 9.193 769 HD12 LEU 107 2HD1 LEU 107 6.280 14.595 9.190 770 HD13 LEU 107 3HD1 LEU 107 5.647 13.856 7.719 771 HD21 LEU 107 3HD2 LEU 107 6.670 16.697 8.046 772 HD22 LEU 107 1HD2 LEU 107 5.340 17.591 7.308 773 HD23 LEU 107 2HD2 LEU 107 5.986 16.162 6.511 774 H ASN 108 H ASN 108 1.460 13.320 6.323 775 HA ASN 108 HA ASN 108 -0.466 15.012 4.992 776 HB2 ASN 108 2HB ASN 108 0.359 12.144 4.604 777 HB3 ASN 108 1HB ASN 108 -1.059 12.792 3.796 778 HD21 ASN 108 1HD2 ASN 108 -0.803 14.239 2.135 779 HD22 ASN 108 2HD2 ASN 108 0.724 14.581 1.428 780 H GLY 109 H GLY 109 -0.460 12.762 7.514 781 HA2 GLY 109 2HA GLY 109 -2.178 12.376 9.038 782 HA3 GLY 109 1HA GLY 109 -3.298 13.172 7.928 783 H THR 110 H THR 110 -1.503 10.195 8.508 784 HA THR 110 HA THR 110 -3.047 8.876 6.497 785 HB THR 110 HB THR 110 -0.904 7.798 8.391 786 HG1 THR 110 1HG THR 110 0.480 8.376 6.861 787 HG21 THR 110 3HG2 THR 110 -2.176 6.617 5.900 788 HG22 THR 110 1HG2 THR 110 -2.430 6.046 7.546 789 HG23 THR 110 2HG2 THR 110 -0.834 5.917 6.798 790 H TYR 111 H TYR 111 -4.931 8.053 6.882 791 HA TYR 111 HA TYR 111 -5.648 7.332 9.647 792 HB2 TYR 111 2HB TYR 111 -7.492 8.114 7.370 793 HB3 TYR 111 1HB TYR 111 -7.954 7.772 9.028 794 HD1 TYR 111 2HD TYR 111 -7.500 9.432 10.796 795 HD2 TYR 111 1HD TYR 111 -6.608 10.236 6.722 796 HE1 TYR 111 2HE TYR 111 -7.319 11.831 11.308 797 HE2 TYR 111 1HE TYR 111 -6.434 12.634 7.222 798 HH TYR 111 HH TYR 111 -7.048 14.221 8.803 799 H VAL 112 H VAL 112 -6.225 5.221 9.869 800 HA VAL 112 HA VAL 112 -6.772 3.810 7.390 801 HB VAL 112 HB VAL 112 -4.635 2.994 8.308 802 HG11 VAL 112 1HG1 VAL 112 -4.953 3.550 10.613 803 HG12 VAL 112 2HG1 VAL 112 -4.504 1.859 10.428 804 HG13 VAL 112 3HG1 VAL 112 -6.184 2.290 10.778 805 HG21 VAL 112 3HG2 VAL 112 -5.124 0.608 8.418 806 HG22 VAL 112 1HG2 VAL 112 -6.066 1.390 7.151 807 HG23 VAL 112 2HG2 VAL 112 -6.831 0.962 8.679 808 H ASN 113 H ASN 113 -8.538 2.699 7.278 809 HA ASN 113 HA ASN 113 -10.705 2.187 7.654 810 HB2 ASN 113 2HB ASN 113 -9.532 0.851 9.556 811 HB3 ASN 113 1HB ASN 113 -10.113 2.121 10.625 812 HD21 ASN 113 1HD2 ASN 113 -10.987 -0.408 8.496 813 HD22 ASN 113 2HD2 ASN 113 -12.585 -0.692 9.090 814 H ARG 114 H ARG 114 -9.606 4.805 7.704 815 HA ARG 114 HA ARG 114 -10.228 6.967 7.677 816 HB2 ARG 114 2HB ARG 114 -12.932 6.246 8.844 817 HB3 ARG 114 1HB ARG 114 -12.522 7.664 7.902 818 HG2 ARG 114 2HG ARG 114 -12.044 6.033 5.997 819 HG3 ARG 114 1HG ARG 114 -12.892 4.835 6.974 820 HD2 ARG 114 2HD ARG 114 -14.809 6.501 7.086 821 HD3 ARG 114 1HD ARG 114 -13.972 7.410 5.837 822 HE ARG 114 HE ARG 114 -15.687 5.319 5.414 823 HH11 ARG 114 1HH1 ARG 114 -12.347 6.024 4.241 824 HH12 ARG 114 2HH1 ARG 114 -12.493 4.992 2.899 825 HH21 ARG 114 1HH2 ARG 114 -15.845 4.065 3.470 826 HH22 ARG 114 2HH2 ARG 114 -14.535 3.955 2.395 827 H GLU 115 H GLU 115 -9.437 5.382 10.267 828 HA GLU 115 HA GLU 115 -10.189 7.409 12.238 829 HB2 GLU 115 2HB GLU 115 -10.796 5.036 12.686 830 HB3 GLU 115 1HB GLU 115 -9.099 4.613 12.590 831 HG2 GLU 115 2HG GLU 115 -8.640 6.027 14.531 832 HG3 GLU 115 1HG GLU 115 -10.351 6.431 14.630 833 HA PRO 116 HA PRO 116 -5.872 8.679 12.233 834 HB2 PRO 116 2HB PRO 116 -6.215 9.503 15.038 835 HB3 PRO 116 1HB PRO 116 -5.820 10.488 13.627 836 HG2 PRO 116 2HG PRO 116 -8.227 10.644 14.800 837 HG3 PRO 116 1HG PRO 116 -8.041 10.790 13.048 838 HD2 PRO 116 2HD PRO 116 -8.921 8.420 14.656 839 HD3 PRO 116 1HD PRO 116 -9.580 9.070 13.141 840 H ARG 117 H ARG 117 -5.067 6.625 12.153 841 HA ARG 117 HA ARG 117 -3.403 6.017 14.334 842 HB2 ARG 117 2HB ARG 117 -3.957 3.450 14.061 843 HB3 ARG 117 1HB ARG 117 -4.847 4.437 15.194 844 HG2 ARG 117 2HG ARG 117 -6.740 4.528 13.736 845 HG3 ARG 117 1HG ARG 117 -5.831 3.774 12.424 846 HD2 ARG 117 2HD ARG 117 -5.751 1.692 13.525 847 HD3 ARG 117 1HD ARG 117 -6.183 2.414 15.073 848 HE ARG 117 HE ARG 117 -8.385 2.749 14.230 849 HH11 ARG 117 1HH1 ARG 117 -6.426 0.366 12.443 850 HH12 ARG 117 2HH1 ARG 117 -7.773 -0.540 11.914 851 HH21 ARG 117 1HH2 ARG 117 -10.250 1.391 13.468 852 HH22 ARG 117 2HH2 ARG 117 -9.901 0.037 12.492 853 H ASN 118 H ASN 118 -1.548 5.851 13.587 854 HA ASN 118 HA ASN 118 -1.133 5.691 10.757 855 HB2 ASN 118 2HB ASN 118 1.192 6.336 11.329 856 HB3 ASN 118 1HB ASN 118 -0.034 7.380 12.039 857 HD21 ASN 118 1HD2 ASN 118 2.735 6.820 12.719 858 HD22 ASN 118 2HD2 ASN 118 2.712 6.403 14.411 859 H ALA 119 H ALA 119 -0.549 3.648 13.491 860 HA ALA 119 HA ALA 119 0.888 1.785 11.697 861 HB1 ALA 119 1HB ALA 119 2.086 2.378 13.754 862 HB2 ALA 119 2HB ALA 119 1.684 0.660 13.715 863 HB3 ALA 119 3HB ALA 119 0.740 1.763 14.711 864 H GLN 120 H GLN 120 0.140 -0.163 11.216 865 HA GLN 120 HA GLN 120 -2.139 -1.209 12.655 866 HB2 GLN 120 2HB GLN 120 -2.256 -0.261 9.911 867 HB3 GLN 120 1HB GLN 120 -2.821 -1.917 10.114 868 HG2 GLN 120 2HG GLN 120 -3.791 0.453 11.683 869 HG3 GLN 120 1HG GLN 120 -4.620 -0.290 10.304 870 HE21 GLN 120 1HE2 GLN 120 -5.647 -2.247 10.581 871 HE22 GLN 120 2HE2 GLN 120 -5.925 -2.932 12.139 872 H VAL 121 H VAL 121 -2.482 -3.289 12.561 873 HA VAL 121 HA VAL 121 -0.254 -4.945 11.732 874 HB VAL 121 HB VAL 121 -1.161 -5.293 14.032 875 HG11 VAL 121 1HG1 VAL 121 -3.379 -6.271 14.398 876 HG12 VAL 121 2HG1 VAL 121 -3.745 -6.060 12.685 877 HG13 VAL 121 3HG1 VAL 121 -3.466 -4.651 13.705 878 HG21 VAL 121 3HG2 VAL 121 -0.142 -7.204 12.927 879 HG22 VAL 121 1HG2 VAL 121 -1.687 -7.630 12.195 880 HG23 VAL 121 2HG2 VAL 121 -1.480 -7.738 13.943 881 H MET 122 H MET 122 -0.404 -6.304 10.031 882 HA MET 122 HA MET 122 -1.961 -5.960 7.871 883 HB2 MET 122 2HB MET 122 -0.118 -7.414 7.690 884 HB3 MET 122 1HB MET 122 -0.771 -8.532 8.877 885 HG2 MET 122 2HG MET 122 -2.530 -9.176 7.311 886 HG3 MET 122 1HG MET 122 -1.921 -8.042 6.115 887 HE1 MET 122 3HE MET 122 -2.459 -11.239 5.703 888 HE2 MET 122 1HE MET 122 -1.083 -11.628 4.676 889 HE3 MET 122 2HE MET 122 -1.990 -10.134 4.418 890 H GLN 123 H GLN 123 -4.059 -5.605 7.958 891 HA GLN 123 HA GLN 123 -5.769 -7.896 8.573 892 HB2 GLN 123 2HB GLN 123 -6.143 -5.898 10.073 893 HB3 GLN 123 1HB GLN 123 -6.501 -4.949 8.638 894 HG2 GLN 123 2HG GLN 123 -8.388 -6.482 8.147 895 HG3 GLN 123 1HG GLN 123 -8.069 -7.310 9.668 896 HE21 GLN 123 1HE2 GLN 123 -9.358 -4.532 8.169 897 HE22 GLN 123 2HE2 GLN 123 -10.037 -3.803 9.579 898 H THR 124 H THR 124 -6.597 -8.654 6.727 899 HA THR 124 HA THR 124 -6.235 -7.125 4.343 900 HB THR 124 HB THR 124 -5.744 -9.469 4.185 901 HG1 THR 124 1HG THR 124 -8.183 -9.219 2.768 902 HG21 THR 124 3HG2 THR 124 -7.202 -10.353 5.947 903 HG22 THR 124 1HG2 THR 124 -7.450 -11.231 4.438 904 HG23 THR 124 2HG2 THR 124 -8.618 -10.015 4.957 905 H GLY 125 H GLY 125 -7.637 -5.934 3.340 906 HA2 GLY 125 2HA GLY 125 -9.822 -5.496 2.496 907 HA3 GLY 125 1HA GLY 125 -10.484 -6.328 3.896 908 H ASP 126 H ASP 126 -7.897 -4.130 4.504 909 HA ASP 126 HA ASP 126 -9.929 -2.286 5.536 910 HB2 ASP 126 2HB ASP 126 -8.320 -3.503 7.186 911 HB3 ASP 126 1HB ASP 126 -7.118 -2.362 6.592 912 H GLU 127 H GLU 127 -9.462 -0.057 5.431 913 HA GLU 127 HA GLU 127 -7.851 0.503 3.043 914 HB2 GLU 127 2HB GLU 127 -10.175 0.792 2.526 915 HB3 GLU 127 1HB GLU 127 -10.413 1.818 3.932 916 HG2 GLU 127 2HG GLU 127 -9.091 3.564 2.959 917 HG3 GLU 127 1HG GLU 127 -8.624 2.526 1.616 918 H ILE 128 H ILE 128 -6.393 1.977 3.034 919 HA ILE 128 HA ILE 128 -5.892 3.563 5.439 920 HB ILE 128 HB ILE 128 -3.987 2.703 3.231 921 HG12 ILE 128 2HG1 ILE 128 -4.178 1.680 6.075 922 HG13 ILE 128 1HG1 ILE 128 -4.747 0.804 4.657 923 HG21 ILE 128 1HG2 ILE 128 -3.448 4.087 5.862 924 HG22 ILE 128 2HG2 ILE 128 -3.350 4.819 4.262 925 HG23 ILE 128 3HG2 ILE 128 -2.222 3.541 4.718 926 HD11 ILE 128 3HD1 ILE 128 -2.448 0.708 3.819 927 HD12 ILE 128 1HD1 ILE 128 -2.595 -0.033 5.412 928 HD13 ILE 128 2HD1 ILE 128 -1.896 1.576 5.251 929 H GLN 129 H GLN 129 -6.387 5.631 5.137 930 HA GLN 129 HA GLN 129 -6.305 6.744 2.432 931 HB2 GLN 129 2HB GLN 129 -7.881 7.641 4.851 932 HB3 GLN 129 1HB GLN 129 -7.811 8.516 3.333 933 HG2 GLN 129 2HG GLN 129 -8.835 6.609 2.198 934 HG3 GLN 129 1HG GLN 129 -8.916 5.749 3.732 935 HE21 GLN 129 1HE2 GLN 129 -10.168 8.410 1.894 936 HE22 GLN 129 2HE2 GLN 129 -11.571 8.678 2.845 937 H ILE 130 H ILE 130 -4.519 7.817 2.138 938 HA ILE 130 HA ILE 130 -3.287 9.149 4.419 939 HB ILE 130 HB ILE 130 -1.351 9.586 2.835 940 HG12 ILE 130 2HG1 ILE 130 -2.765 7.582 1.047 941 HG13 ILE 130 1HG1 ILE 130 -2.657 9.312 0.734 942 HG21 ILE 130 1HG2 ILE 130 -1.222 7.812 4.441 943 HG22 ILE 130 2HG2 ILE 130 -0.478 7.285 2.932 944 HG23 ILE 130 3HG2 ILE 130 -2.092 6.721 3.362 945 HD11 ILE 130 3HD1 ILE 130 -0.339 7.413 0.922 946 HD12 ILE 130 1HD1 ILE 130 -0.245 9.137 0.570 947 HD13 ILE 130 2HD1 ILE 130 -1.041 8.048 -0.567 948 H GLY 131 H GLY 131 -4.383 10.934 4.766 949 HA2 GLY 131 2HA GLY 131 -5.212 13.033 4.498 950 HA3 GLY 131 1HA GLY 131 -4.099 13.198 3.149 951 H LYS 132 H LYS 132 -4.783 12.496 1.108 952 HA LYS 132 HA LYS 132 -7.684 12.868 0.666 953 HB2 LYS 132 2HB LYS 132 -5.394 13.543 -1.172 954 HB3 LYS 132 1HB LYS 132 -7.089 13.873 -1.463 955 HG2 LYS 132 2HG LYS 132 -7.122 15.471 0.364 956 HG3 LYS 132 1HG LYS 132 -5.449 15.081 0.757 957 HD2 LYS 132 2HD LYS 132 -6.402 16.324 -1.840 958 HD3 LYS 132 1HD LYS 132 -5.647 17.192 -0.511 959 HE2 LYS 132 2HE LYS 132 -3.615 15.788 -0.796 960 HE3 LYS 132 1HE LYS 132 -4.377 15.018 -2.181 961 HZ1 LYS 132 3HZ LYS 132 -2.849 16.777 -2.850 962 HZ2 LYS 132 1HZ LYS 132 -3.735 17.903 -1.965 963 HZ3 LYS 132 2HZ LYS 132 -4.423 17.149 -3.312 964 H PHE 133 H PHE 133 -5.120 10.614 0.356 965 HA PHE 133 HA PHE 133 -6.280 9.549 -2.128 966 HB2 PHE 133 2HB PHE 133 -3.475 9.049 -1.130 967 HB3 PHE 133 1HB PHE 133 -4.139 8.662 -2.718 968 HD1 PHE 133 1HD PHE 133 -5.448 10.860 -3.719 969 HD2 PHE 133 2HD PHE 133 -2.036 10.852 -1.179 970 HE1 PHE 133 1HE PHE 133 -4.876 13.106 -4.499 971 HE2 PHE 133 2HE PHE 133 -1.452 13.103 -1.968 972 HZ PHE 133 HZ PHE 133 -2.895 14.227 -3.632 973 H ARG 134 H ARG 134 -6.270 7.232 -2.461 974 HA ARG 134 HA ARG 134 -6.874 5.944 0.112 975 HB2 ARG 134 2HB ARG 134 -8.438 5.711 -2.457 976 HB3 ARG 134 1HB ARG 134 -8.754 4.787 -0.994 977 HG2 ARG 134 2HG ARG 134 -9.273 6.820 0.221 978 HG3 ARG 134 1HG ARG 134 -8.875 7.787 -1.197 979 HD2 ARG 134 2HD ARG 134 -11.282 7.534 -0.957 980 HD3 ARG 134 1HD ARG 134 -10.715 6.735 -2.424 981 HE ARG 134 HE ARG 134 -10.756 4.804 -0.424 982 HH11 ARG 134 1HH1 ARG 134 -13.195 6.878 -1.916 983 HH12 ARG 134 2HH1 ARG 134 -14.415 5.689 -1.803 984 HH21 ARG 134 1HH2 ARG 134 -12.325 3.341 -0.239 985 HH22 ARG 134 2HH2 ARG 134 -13.940 3.594 -0.792 986 H LEU 135 H LEU 135 -5.825 4.214 0.535 987 HA LEU 135 HA LEU 135 -4.729 2.504 -1.585 988 HB2 LEU 135 2HB LEU 135 -3.015 3.813 -0.412 989 HB3 LEU 135 1HB LEU 135 -3.641 3.272 1.128 990 HG LEU 135 HG LEU 135 -2.971 0.940 0.479 991 HD11 LEU 135 1HD1 LEU 135 -2.915 1.189 -1.912 992 HD12 LEU 135 2HD1 LEU 135 -1.310 0.724 -1.321 993 HD13 LEU 135 3HD1 LEU 135 -1.636 2.394 -1.769 994 HD21 LEU 135 3HD2 LEU 135 -0.782 3.014 0.584 995 HD22 LEU 135 1HD2 LEU 135 -0.591 1.293 0.915 996 HD23 LEU 135 2HD2 LEU 135 -1.597 2.287 1.970 997 H VAL 136 H VAL 136 -5.406 0.361 -1.321 998 HA VAL 136 HA VAL 136 -6.675 -0.260 1.258 999 HB VAL 136 HB VAL 136 -7.359 -1.578 -1.400 1000 HG11 VAL 136 1HG1 VAL 136 -9.316 -2.453 -0.208 1001 HG12 VAL 136 2HG1 VAL 136 -8.770 -1.665 1.271 1002 HG13 VAL 136 3HG1 VAL 136 -7.812 -2.965 0.561 1003 HG21 VAL 136 3HG2 VAL 136 -8.893 0.565 0.069 1004 HG22 VAL 136 1HG2 VAL 136 -9.447 -0.291 -1.367 1005 HG23 VAL 136 2HG2 VAL 136 -8.036 0.764 -1.458 1006 H PHE 137 H PHE 137 -6.067 -2.156 2.254 1007 HA PHE 137 HA PHE 137 -3.724 -3.438 1.036 1008 HB2 PHE 137 2HB PHE 137 -3.425 -2.064 3.142 1009 HB3 PHE 137 1HB PHE 137 -4.422 -3.246 3.972 1010 HD1 PHE 137 2HD PHE 137 -1.391 -3.091 1.813 1011 HD2 PHE 137 1HD PHE 137 -3.335 -4.926 5.125 1012 HE1 PHE 137 2HE PHE 137 0.640 -4.391 2.277 1013 HE2 PHE 137 1HE PHE 137 -1.295 -6.222 5.596 1014 HZ PHE 137 HZ PHE 137 0.688 -5.954 4.175 1015 H LEU 138 H LEU 138 -4.091 -5.470 0.369 1016 HA LEU 138 HA LEU 138 -6.194 -7.036 1.720 1017 HB2 LEU 138 2HB LEU 138 -5.509 -7.078 -1.228 1018 HB3 LEU 138 1HB LEU 138 -6.613 -8.173 -0.446 1019 HG LEU 138 HG LEU 138 -7.928 -6.684 -1.640 1020 HD11 LEU 138 1HD1 LEU 138 -9.222 -5.443 -0.021 1021 HD12 LEU 138 2HD1 LEU 138 -7.956 -5.705 1.178 1022 HD13 LEU 138 3HD1 LEU 138 -8.836 -7.081 0.511 1023 HD21 LEU 138 3HD2 LEU 138 -6.335 -4.397 -0.501 1024 HD22 LEU 138 1HD2 LEU 138 -7.762 -4.236 -1.527 1025 HD23 LEU 138 2HD2 LEU 138 -6.298 -4.985 -2.162 1026 H ALA 139 H ALA 139 -5.840 -9.306 1.673 1027 HA ALA 139 HA ALA 139 -3.082 -10.114 1.680 1028 HB1 ALA 139 1HB ALA 139 -4.637 -11.124 3.286 1029 HB2 ALA 139 2HB ALA 139 -4.010 -12.362 2.199 1030 HB3 ALA 139 3HB ALA 139 -5.637 -11.724 1.965 1031 H GLY 140 H GLY 140 -2.120 -11.426 0.085 1032 HA2 GLY 140 2HA GLY 140 -3.522 -11.235 -2.459 1033 HA3 GLY 140 1HA GLY 140 -1.783 -11.399 -2.237 1034 HA PRO 141 HA PRO 141 -3.188 -15.469 -3.543 1035 HB2 PRO 141 2HB PRO 141 -0.730 -16.368 -4.258 1036 HB3 PRO 141 1HB PRO 141 -1.864 -15.493 -5.296 1037 HG2 PRO 141 2HG PRO 141 0.552 -14.500 -3.856 1038 HG3 PRO 141 1HG PRO 141 -0.071 -14.023 -5.442 1039 HD2 PRO 141 2HD PRO 141 -0.400 -12.550 -3.178 1040 HD3 PRO 141 1HD PRO 141 -1.535 -12.505 -4.542 1041 H ALA 142 H ALA 142 -3.580 -16.791 -2.154 1042 HA ALA 142 HA ALA 142 -1.577 -17.583 -0.158 1043 HB1 ALA 142 1HB ALA 142 -3.726 -16.839 0.782 1044 HB2 ALA 142 2HB ALA 142 -3.479 -18.556 1.090 1045 HB3 ALA 142 3HB ALA 142 -4.572 -18.039 -0.195 1046 H GLU 143 H GLU 143 -0.431 -19.153 -1.032 1047 HA GLU 143 HA GLU 143 -1.800 -21.102 -2.726 1048 HB2 GLU 143 2HB GLU 143 0.173 -19.793 -3.626 1049 HB3 GLU 143 1HB GLU 143 1.160 -20.605 -2.423 1050 HG2 GLU 143 2HG GLU 143 0.672 -22.760 -3.444 1051 HG3 GLU 143 1HG GLU 143 -0.361 -21.963 -4.632 Start of MODEL 4 1 H1 MET 1 1HT MET 1 -56.623 7.886 -44.469 2 H2 MET 1 2HT MET 1 -55.976 9.046 -45.440 3 H3 MET 1 3HT MET 1 -57.602 8.576 -45.636 4 HA MET 1 HA MET 1 -56.344 9.826 -43.237 5 HB2 MET 1 2HB MET 1 -58.316 11.029 -45.205 6 HB3 MET 1 1HB MET 1 -57.893 11.781 -43.679 7 HG2 MET 1 2HG MET 1 -55.562 11.952 -44.420 8 HG3 MET 1 1HG MET 1 -56.004 11.199 -45.952 9 HE1 MET 1 2HE MET 1 -55.313 14.922 -46.992 10 HE2 MET 1 3HE MET 1 -54.922 13.229 -47.291 11 HE3 MET 1 1HE MET 1 -54.454 13.988 -45.770 12 H SER 2 H SER 2 -59.785 9.838 -44.343 13 HA SER 2 HA SER 2 -60.515 8.791 -41.793 14 HB2 SER 2 2HB SER 2 -62.828 8.701 -42.971 15 HB3 SER 2 1HB SER 2 -62.108 10.288 -42.718 16 HG SER 2 HG SER 2 -62.500 10.457 -44.741 17 H ASP 3 H ASP 3 -59.853 7.694 -44.934 18 HA ASP 3 HA ASP 3 -60.553 4.936 -44.437 19 HB2 ASP 3 2HB ASP 3 -59.822 4.568 -46.680 20 HB3 ASP 3 1HB ASP 3 -60.680 6.097 -46.711 21 H ASN 4 H ASN 4 -58.955 3.360 -44.021 22 HA ASN 4 HA ASN 4 -56.171 3.883 -44.113 23 HB2 ASN 4 2HB ASN 4 -55.671 3.776 -41.727 24 HB3 ASN 4 1HB ASN 4 -56.759 5.126 -42.002 25 HD21 ASN 4 1HD2 ASN 4 -58.872 5.009 -41.185 26 HD22 ASN 4 2HD2 ASN 4 -59.352 3.812 -40.045 27 H ASN 5 H ASN 5 -55.036 1.925 -43.083 28 HA ASN 5 HA ASN 5 -56.867 -0.301 -42.774 29 HB2 ASN 5 2HB ASN 5 -55.919 -0.424 -45.102 30 HB3 ASN 5 1HB ASN 5 -54.308 -0.548 -44.413 31 HD21 ASN 5 1HD2 ASN 5 -57.322 -2.124 -44.966 32 HD22 ASN 5 2HD2 ASN 5 -56.806 -3.723 -44.556 33 H GLY 6 H GLY 6 -56.439 0.538 -40.681 34 HA2 GLY 6 2HA GLY 6 -53.834 -0.097 -39.544 35 HA3 GLY 6 1HA GLY 6 -55.137 0.798 -38.764 36 H THR 7 H THR 7 -54.208 -2.349 -39.899 37 HA THR 7 HA THR 7 -56.299 -3.704 -38.519 38 HB THR 7 HB THR 7 -54.850 -5.700 -39.174 39 HG1 THR 7 1HG THR 7 -53.011 -4.039 -39.337 40 HG21 THR 7 3HG2 THR 7 -55.717 -3.758 -41.332 41 HG22 THR 7 1HG2 THR 7 -56.757 -4.942 -40.544 42 HG23 THR 7 2HG2 THR 7 -55.428 -5.479 -41.574 43 HA PRO 8 HA PRO 8 -53.971 -3.693 -34.643 44 HB2 PRO 8 2HB PRO 8 -55.640 -5.433 -33.306 45 HB3 PRO 8 1HB PRO 8 -55.914 -3.693 -33.419 46 HG2 PRO 8 2HG PRO 8 -57.154 -5.913 -34.951 47 HG3 PRO 8 1HG PRO 8 -57.876 -4.402 -34.383 48 HD2 PRO 8 2HD PRO 8 -57.129 -4.831 -36.958 49 HD3 PRO 8 1HD PRO 8 -57.127 -3.220 -36.212 50 H GLU 9 H GLU 9 -52.536 -5.083 -33.737 51 HA GLU 9 HA GLU 9 -51.615 -7.149 -35.386 52 HB2 GLU 9 2HB GLU 9 -50.810 -6.584 -32.521 53 HB3 GLU 9 1HB GLU 9 -49.887 -7.505 -33.691 54 HG2 GLU 9 2HG GLU 9 -48.794 -5.441 -33.591 55 HG3 GLU 9 1HG GLU 9 -49.776 -5.324 -35.045 56 HA PRO 10 HA PRO 10 -54.348 -10.498 -34.150 57 HB2 PRO 10 2HB PRO 10 -51.941 -12.046 -35.007 58 HB3 PRO 10 1HB PRO 10 -53.637 -12.283 -35.448 59 HG2 PRO 10 2HG PRO 10 -51.991 -11.148 -37.164 60 HG3 PRO 10 1HG PRO 10 -53.626 -10.497 -36.951 61 HD2 PRO 10 2HD PRO 10 -51.015 -9.436 -35.952 62 HD3 PRO 10 1HD PRO 10 -52.448 -8.569 -36.549 63 H GLN 11 H GLN 11 -54.376 -12.278 -32.680 64 HA GLN 11 HA GLN 11 -53.436 -11.663 -30.177 65 HB2 GLN 11 2HB GLN 11 -55.322 -13.189 -30.745 66 HB3 GLN 11 1HB GLN 11 -54.141 -14.439 -31.113 67 HG2 GLN 11 2HG GLN 11 -55.009 -14.788 -28.899 68 HG3 GLN 11 1HG GLN 11 -53.321 -14.284 -28.786 69 HE21 GLN 11 1HE2 GLN 11 -53.569 -13.520 -26.699 70 HE22 GLN 11 2HE2 GLN 11 -54.450 -12.075 -26.335 71 H VAL 12 H VAL 12 -51.391 -11.425 -29.698 72 HA VAL 12 HA VAL 12 -49.394 -13.329 -30.528 73 HB VAL 12 HB VAL 12 -48.869 -10.890 -30.358 74 HG11 VAL 12 1HG1 VAL 12 -50.206 -10.283 -28.444 75 HG12 VAL 12 2HG1 VAL 12 -48.525 -9.819 -28.190 76 HG13 VAL 12 3HG1 VAL 12 -49.174 -11.252 -27.391 77 HG21 VAL 12 3HG2 VAL 12 -47.241 -12.622 -28.503 78 HG22 VAL 12 1HG2 VAL 12 -46.704 -11.090 -29.191 79 HG23 VAL 12 2HG2 VAL 12 -47.028 -12.465 -30.246 80 H GLU 13 H GLU 13 -48.298 -14.707 -29.070 81 HA GLU 13 HA GLU 13 -49.910 -15.391 -26.729 82 HB2 GLU 13 2HB GLU 13 -49.611 -17.011 -28.630 83 HB3 GLU 13 1HB GLU 13 -47.898 -17.036 -28.290 84 HG2 GLU 13 2HG GLU 13 -50.099 -17.982 -26.463 85 HG3 GLU 13 1HG GLU 13 -49.081 -19.011 -27.455 86 H THR 14 H THR 14 -49.001 -14.831 -24.826 87 HA THR 14 HA THR 14 -46.082 -14.722 -24.660 88 HB THR 14 HB THR 14 -47.948 -12.733 -23.341 89 HG1 THR 14 1HG THR 14 -46.711 -12.764 -25.864 90 HG21 THR 14 3HG2 THR 14 -45.730 -13.042 -22.298 91 HG22 THR 14 1HG2 THR 14 -45.882 -11.439 -23.021 92 HG23 THR 14 2HG2 THR 14 -44.961 -12.693 -23.846 93 H THR 15 H THR 15 -45.429 -16.086 -22.991 94 HA THR 15 HA THR 15 -47.400 -16.615 -20.959 95 HB THR 15 HB THR 15 -47.003 -18.590 -22.463 96 HG1 THR 15 1HG THR 15 -47.563 -19.523 -20.709 97 HG21 THR 15 3HG2 THR 15 -44.887 -19.833 -22.322 98 HG22 THR 15 1HG2 THR 15 -44.218 -18.570 -21.285 99 HG23 THR 15 2HG2 THR 15 -44.619 -18.208 -22.959 100 H SER 16 H SER 16 -46.814 -16.357 -18.995 101 HA SER 16 HA SER 16 -44.207 -15.265 -18.401 102 HB2 SER 16 2HB SER 16 -46.684 -15.507 -16.672 103 HB3 SER 16 1HB SER 16 -45.235 -14.564 -16.301 104 HG SER 16 HG SER 16 -47.350 -13.750 -17.549 105 H VAL 17 H VAL 17 -42.757 -16.427 -17.429 106 HA VAL 17 HA VAL 17 -43.528 -18.972 -16.204 107 HB VAL 17 HB VAL 17 -41.281 -19.815 -16.751 108 HG11 VAL 17 1HG1 VAL 17 -43.070 -20.333 -18.303 109 HG12 VAL 17 2HG1 VAL 17 -41.569 -20.085 -19.192 110 HG13 VAL 17 3HG1 VAL 17 -42.796 -18.817 -19.162 111 HG21 VAL 17 3HG2 VAL 17 -40.053 -17.719 -16.835 112 HG22 VAL 17 1HG2 VAL 17 -40.935 -17.239 -18.286 113 HG23 VAL 17 2HG2 VAL 17 -39.833 -18.616 -18.341 114 H PHE 18 H PHE 18 -41.903 -19.613 -14.508 115 HA PHE 18 HA PHE 18 -41.478 -17.348 -12.791 116 HB2 PHE 18 2HB PHE 18 -42.299 -19.413 -11.776 117 HB3 PHE 18 1HB PHE 18 -40.906 -20.300 -12.379 118 HD1 PHE 18 2HD PHE 18 -41.858 -17.506 -10.115 119 HD2 PHE 18 1HD PHE 18 -38.991 -20.500 -11.077 120 HE1 PHE 18 2HE PHE 18 -40.645 -17.003 -8.050 121 HE2 PHE 18 1HE PHE 18 -37.770 -19.995 -9.005 122 HZ PHE 18 HZ PHE 18 -38.597 -18.243 -7.493 123 H ARG 19 H ARG 19 -39.779 -16.126 -12.999 124 HA ARG 19 HA ARG 19 -37.490 -16.684 -14.442 125 HB2 ARG 19 2HB ARG 19 -36.416 -14.836 -13.071 126 HB3 ARG 19 1HB ARG 19 -37.809 -14.408 -14.031 127 HG2 ARG 19 2HG ARG 19 -39.200 -14.488 -11.991 128 HG3 ARG 19 1HG ARG 19 -37.782 -14.966 -11.062 129 HD2 ARG 19 2HD ARG 19 -37.985 -12.404 -12.628 130 HD3 ARG 19 1HD ARG 19 -38.344 -12.541 -10.909 131 HE ARG 19 HE ARG 19 -35.882 -13.615 -11.134 132 HH11 ARG 19 1HH1 ARG 19 -37.188 -10.485 -12.172 133 HH12 ARG 19 2HH1 ARG 19 -35.754 -9.638 -11.888 134 HH21 ARG 19 1HH2 ARG 19 -33.919 -12.432 -10.701 135 HH22 ARG 19 2HH2 ARG 19 -33.835 -10.759 -11.031 136 H ALA 20 H ALA 20 -36.103 -18.166 -14.158 137 HA ALA 20 HA ALA 20 -35.190 -18.704 -11.447 138 HB1 ALA 20 1HB ALA 20 -34.735 -20.984 -12.090 139 HB2 ALA 20 2HB ALA 20 -35.279 -20.653 -13.732 140 HB3 ALA 20 3HB ALA 20 -36.433 -20.605 -12.390 141 H ASP 21 H ASP 21 -34.028 -16.778 -12.255 142 HA ASP 21 HA ASP 21 -31.700 -17.233 -13.886 143 HB2 ASP 21 2HB ASP 21 -32.377 -14.960 -12.000 144 HB3 ASP 21 1HB ASP 21 -31.027 -14.980 -13.122 145 H LEU 22 H LEU 22 -32.609 -17.323 -10.573 146 HA LEU 22 HA LEU 22 -31.588 -17.489 -8.624 147 HB2 LEU 22 2HB LEU 22 -30.101 -19.484 -8.255 148 HB3 LEU 22 1HB LEU 22 -31.654 -19.825 -8.965 149 HG LEU 22 HG LEU 22 -29.242 -19.619 -10.756 150 HD11 LEU 22 1HD1 LEU 22 -28.564 -21.089 -8.913 151 HD12 LEU 22 2HD1 LEU 22 -28.858 -22.026 -10.383 152 HD13 LEU 22 3HD1 LEU 22 -30.058 -22.003 -9.094 153 HD21 LEU 22 3HD2 LEU 22 -31.743 -21.324 -10.781 154 HD22 LEU 22 1HD2 LEU 22 -30.491 -21.302 -12.022 155 HD23 LEU 22 2HD2 LEU 22 -31.482 -19.869 -11.741 156 H LEU 23 H LEU 23 -30.767 -15.542 -8.482 157 HA LEU 23 HA LEU 23 -27.908 -15.361 -8.950 158 HB2 LEU 23 2HB LEU 23 -28.264 -12.872 -8.838 159 HB3 LEU 23 1HB LEU 23 -28.972 -13.684 -10.212 160 HG LEU 23 HG LEU 23 -31.178 -13.598 -8.895 161 HD11 LEU 23 1HD1 LEU 23 -30.324 -13.034 -6.711 162 HD12 LEU 23 2HD1 LEU 23 -31.408 -11.769 -7.296 163 HD13 LEU 23 3HD1 LEU 23 -29.665 -11.520 -7.336 164 HD21 LEU 23 3HD2 LEU 23 -30.757 -12.266 -10.872 165 HD22 LEU 23 1HD2 LEU 23 -29.915 -11.060 -9.898 166 HD23 LEU 23 2HD2 LEU 23 -31.644 -11.326 -9.670 167 H LYS 24 H LYS 24 -26.643 -14.133 -7.436 168 HA LYS 24 HA LYS 24 -27.499 -14.688 -4.686 169 HB2 LYS 24 2HB LYS 24 -24.716 -14.563 -5.869 170 HB3 LYS 24 1HB LYS 24 -25.094 -14.928 -4.196 171 HG2 LYS 24 2HG LYS 24 -26.210 -16.986 -4.866 172 HG3 LYS 24 1HG LYS 24 -25.935 -16.602 -6.558 173 HD2 LYS 24 2HD LYS 24 -24.257 -18.150 -6.051 174 HD3 LYS 24 1HD LYS 24 -23.440 -16.599 -5.971 175 HE2 LYS 24 2HE LYS 24 -24.408 -18.240 -3.610 176 HE3 LYS 24 1HE LYS 24 -22.750 -18.086 -4.149 177 HZ1 LYS 24 3HZ LYS 24 -22.915 -15.673 -3.607 178 HZ2 LYS 24 1HZ LYS 24 -23.090 -16.699 -2.288 179 HZ3 LYS 24 2HZ LYS 24 -24.439 -15.977 -2.932 180 H GLU 25 H GLU 25 -27.812 -12.917 -3.507 181 HA GLU 25 HA GLU 25 -26.912 -10.355 -4.539 182 HB2 GLU 25 2HB GLU 25 -29.296 -10.664 -3.890 183 HB3 GLU 25 1HB GLU 25 -28.791 -11.006 -2.246 184 HG2 GLU 25 2HG GLU 25 -29.665 -8.724 -2.556 185 HG3 GLU 25 1HG GLU 25 -28.008 -8.756 -1.960 186 H MET 26 H MET 26 -25.904 -8.809 -3.057 187 HA MET 26 HA MET 26 -23.878 -10.219 -1.505 188 HB2 MET 26 2HB MET 26 -22.517 -8.244 -1.651 189 HB3 MET 26 1HB MET 26 -23.179 -8.560 -3.238 190 HG2 MET 26 2HG MET 26 -23.373 -6.263 -3.065 191 HG3 MET 26 1HG MET 26 -24.966 -6.814 -2.575 192 HE1 MET 26 3HE MET 26 -23.691 -3.887 -2.000 193 HE2 MET 26 1HE MET 26 -24.279 -3.607 -0.362 194 HE3 MET 26 2HE MET 26 -25.340 -4.336 -1.563 195 H GLU 27 H GLU 27 -23.134 -9.290 0.565 196 HA GLU 27 HA GLU 27 -24.921 -7.738 2.134 197 HB2 GLU 27 2HB GLU 27 -26.090 -9.962 2.041 198 HB3 GLU 27 1HB GLU 27 -24.649 -10.720 2.692 199 HG2 GLU 27 2HG GLU 27 -26.365 -10.405 4.382 200 HG3 GLU 27 1HG GLU 27 -24.908 -9.479 4.752 201 H SER 28 H SER 28 -23.865 -7.386 4.257 202 HA SER 28 HA SER 28 -21.000 -7.671 4.033 203 HB2 SER 28 2HB SER 28 -22.589 -6.527 6.362 204 HB3 SER 28 1HB SER 28 -20.854 -6.418 6.129 205 HG SER 28 HG SER 28 -22.102 -5.579 3.925 206 H SER 29 H SER 29 -23.526 -8.954 6.189 207 HA SER 29 HA SER 29 -21.614 -10.692 7.424 208 HB2 SER 29 2HB SER 29 -24.621 -10.587 7.737 209 HB3 SER 29 1HB SER 29 -23.516 -11.531 8.738 210 HG SER 29 HG SER 29 -22.541 -9.131 8.767 211 H THR 30 H THR 30 -20.931 -11.614 5.418 212 HA THR 30 HA THR 30 -21.634 -14.237 5.199 213 HB THR 30 HB THR 30 -23.688 -13.304 3.964 214 HG1 THR 30 1HG THR 30 -22.745 -15.391 3.544 215 HG21 THR 30 3HG2 THR 30 -22.575 -11.393 2.855 216 HG22 THR 30 1HG2 THR 30 -23.381 -12.442 1.684 217 HG23 THR 30 2HG2 THR 30 -21.632 -12.524 1.888 218 H GLY 31 H GLY 31 -20.395 -15.107 3.153 219 HA2 GLY 31 2HA GLY 31 -18.537 -14.781 1.694 220 HA3 GLY 31 1HA GLY 31 -18.096 -13.364 2.639 221 H THR 32 H THR 32 -17.602 -16.683 2.227 222 HA THR 32 HA THR 32 -16.595 -17.005 4.910 223 HB THR 32 HB THR 32 -17.878 -18.849 3.999 224 HG1 THR 32 1HG THR 32 -16.657 -20.088 5.103 225 HG21 THR 32 3HG2 THR 32 -15.737 -19.037 1.872 226 HG22 THR 32 1HG2 THR 32 -17.432 -18.626 1.622 227 HG23 THR 32 2HG2 THR 32 -16.985 -20.253 2.140 228 H ALA 33 H ALA 33 -14.565 -17.253 5.459 229 HA ALA 33 HA ALA 33 -12.523 -16.252 3.631 230 HB1 ALA 33 1HB ALA 33 -12.452 -16.833 6.602 231 HB2 ALA 33 2HB ALA 33 -12.647 -15.242 5.862 232 HB3 ALA 33 3HB ALA 33 -11.132 -16.127 5.672 233 HA PRO 34 HA PRO 34 -11.030 -20.418 2.978 234 HB2 PRO 34 2HB PRO 34 -8.314 -19.399 2.928 235 HB3 PRO 34 1HB PRO 34 -9.208 -20.196 1.634 236 HG2 PRO 34 2HG PRO 34 -8.641 -17.557 1.529 237 HG3 PRO 34 1HG PRO 34 -10.134 -18.228 0.854 238 HD2 PRO 34 2HD PRO 34 -9.709 -16.735 3.404 239 HD3 PRO 34 1HD PRO 34 -11.082 -16.697 2.274 240 H ALA 35 H ALA 35 -11.262 -21.418 4.798 241 HA ALA 35 HA ALA 35 -9.498 -20.936 7.045 242 HB1 ALA 35 1HB ALA 35 -11.875 -21.099 7.505 243 HB2 ALA 35 2HB ALA 35 -11.028 -22.440 8.272 244 HB3 ALA 35 3HB ALA 35 -11.932 -22.699 6.776 245 H SER 36 H SER 36 -7.614 -21.797 6.606 246 HA SER 36 HA SER 36 -5.994 -23.243 6.480 247 HB2 SER 36 2HB SER 36 -8.105 -25.391 6.702 248 HB3 SER 36 1HB SER 36 -6.364 -25.684 6.790 249 HG SER 36 HG SER 36 -6.399 -25.077 8.748 250 H THR 37 H THR 37 -8.407 -23.108 4.182 251 HA THR 37 HA THR 37 -7.187 -24.686 2.179 252 HB THR 37 HB THR 37 -9.097 -22.345 1.862 253 HG1 THR 37 1HG THR 37 -9.366 -25.073 2.448 254 HG21 THR 37 3HG2 THR 37 -9.672 -23.407 -0.286 255 HG22 THR 37 1HG2 THR 37 -8.486 -24.676 0.016 256 HG23 THR 37 2HG2 THR 37 -7.954 -23.016 -0.242 257 H GLY 38 H GLY 38 -5.365 -24.349 1.324 258 HA2 GLY 38 2HA GLY 38 -3.876 -23.036 0.021 259 HA3 GLY 38 1HA GLY 38 -4.375 -21.608 0.937 260 H ALA 39 H ALA 39 -4.449 -23.182 3.372 261 HA ALA 39 HA ALA 39 -1.765 -22.505 4.193 262 HB1 ALA 39 1HB ALA 39 -2.523 -22.962 6.462 263 HB2 ALA 39 2HB ALA 39 -4.023 -23.639 5.837 264 HB3 ALA 39 3HB ALA 39 -3.679 -21.920 5.631 265 H GLU 40 H GLU 40 -3.594 -25.251 3.384 266 HA GLU 40 HA GLU 40 -2.058 -27.184 4.734 267 HB2 GLU 40 2HB GLU 40 -3.249 -28.853 3.486 268 HB3 GLU 40 1HB GLU 40 -4.384 -27.580 3.873 269 HG2 GLU 40 2HG GLU 40 -3.071 -28.019 1.192 270 HG3 GLU 40 1HG GLU 40 -4.725 -28.481 1.628 271 H ASN 41 H ASN 41 -1.856 -25.741 1.579 272 HA ASN 41 HA ASN 41 0.346 -27.302 0.610 273 HB2 ASN 41 2HB ASN 41 -1.217 -26.117 -0.861 274 HB3 ASN 41 1HB ASN 41 -0.674 -24.576 -0.216 275 HD21 ASN 41 1HD2 ASN 41 0.160 -23.706 -2.127 276 HD22 ASN 41 2HD2 ASN 41 1.492 -24.380 -2.954 277 H LEU 42 H LEU 42 -0.019 -24.613 2.700 278 HA LEU 42 HA LEU 42 1.213 -22.946 3.495 279 HB2 LEU 42 2HB LEU 42 2.704 -24.883 4.188 280 HB3 LEU 42 1HB LEU 42 3.584 -24.647 2.698 281 HG LEU 42 HG LEU 42 4.770 -23.770 4.740 282 HD11 LEU 42 1HD1 LEU 42 5.358 -22.779 2.620 283 HD12 LEU 42 2HD1 LEU 42 5.402 -21.573 3.910 284 HD13 LEU 42 3HD1 LEU 42 4.046 -21.609 2.781 285 HD21 LEU 42 3HD2 LEU 42 3.950 -21.736 5.828 286 HD22 LEU 42 1HD2 LEU 42 2.842 -23.094 6.032 287 HD23 LEU 42 2HD2 LEU 42 2.479 -21.820 4.863 288 HA PRO 43 HA PRO 43 1.248 -21.732 -0.750 289 HB2 PRO 43 2HB PRO 43 -0.391 -19.709 -0.569 290 HB3 PRO 43 1HB PRO 43 -0.962 -21.345 -0.210 291 HG2 PRO 43 2HG PRO 43 -0.209 -19.149 1.679 292 HG3 PRO 43 1HG PRO 43 -1.577 -20.274 1.761 293 HD2 PRO 43 2HD PRO 43 0.843 -20.590 3.112 294 HD3 PRO 43 1HD PRO 43 -0.338 -21.874 2.779 295 H ALA 44 H ALA 44 2.009 -20.137 -2.022 296 HA ALA 44 HA ALA 44 3.636 -18.081 -0.822 297 HB1 ALA 44 1HB ALA 44 4.011 -17.405 -3.200 298 HB2 ALA 44 2HB ALA 44 2.883 -18.660 -3.711 299 HB3 ALA 44 3HB ALA 44 4.405 -19.103 -2.933 300 H GLY 45 H GLY 45 2.253 -16.818 0.258 301 HA2 GLY 45 2HA GLY 45 0.089 -15.595 -1.248 302 HA3 GLY 45 1HA GLY 45 -0.274 -16.419 0.264 303 H SER 46 H SER 46 1.674 -13.918 -1.153 304 HA SER 46 HA SER 46 1.940 -12.682 1.434 305 HB2 SER 46 2HB SER 46 2.984 -11.865 -1.295 306 HB3 SER 46 1HB SER 46 3.421 -11.119 0.246 307 HG SER 46 HG SER 46 4.951 -12.659 -0.494 308 H ALA 47 H ALA 47 1.428 -10.282 1.417 309 HA ALA 47 HA ALA 47 -1.265 -9.989 0.354 310 HB1 ALA 47 1HB ALA 47 0.307 -8.312 2.301 311 HB2 ALA 47 2HB ALA 47 -0.858 -9.563 2.726 312 HB3 ALA 47 3HB ALA 47 -1.393 -8.103 1.889 313 H LEU 48 H LEU 48 -1.868 -8.083 -0.713 314 HA LEU 48 HA LEU 48 0.322 -6.651 -1.969 315 HB2 LEU 48 2HB LEU 48 -0.628 -6.761 -4.155 316 HB3 LEU 48 1HB LEU 48 -0.488 -8.395 -3.574 317 HG LEU 48 HG LEU 48 -3.079 -6.831 -3.674 318 HD11 LEU 48 1HD1 LEU 48 -1.984 -8.926 -5.541 319 HD12 LEU 48 2HD1 LEU 48 -2.203 -7.215 -5.902 320 HD13 LEU 48 3HD1 LEU 48 -3.607 -8.240 -5.601 321 HD21 LEU 48 3HD2 LEU 48 -4.129 -9.041 -3.385 322 HD22 LEU 48 1HD2 LEU 48 -3.112 -8.623 -2.003 323 HD23 LEU 48 2HD2 LEU 48 -2.528 -9.762 -3.216 324 H LEU 49 H LEU 49 -0.190 -4.573 -2.560 325 HA LEU 49 HA LEU 49 -2.678 -3.651 -1.367 326 HB2 LEU 49 2HB LEU 49 -1.589 -1.484 -0.981 327 HB3 LEU 49 1HB LEU 49 -0.887 -2.777 -0.032 328 HG LEU 49 HG LEU 49 0.948 -2.750 -1.909 329 HD11 LEU 49 1HD1 LEU 49 1.336 -0.564 -2.894 330 HD12 LEU 49 2HD1 LEU 49 -0.212 0.001 -2.261 331 HD13 LEU 49 3HD1 LEU 49 -0.166 -1.291 -3.459 332 HD21 LEU 49 3HD2 LEU 49 0.713 -0.536 0.125 333 HD22 LEU 49 1HD2 LEU 49 2.200 -1.055 -0.668 334 HD23 LEU 49 2HD2 LEU 49 1.344 -2.153 0.416 335 H VAL 50 H VAL 50 -3.949 -2.338 -2.463 336 HA VAL 50 HA VAL 50 -3.215 -1.888 -5.273 337 HB VAL 50 HB VAL 50 -6.002 -2.110 -4.129 338 HG11 VAL 50 1HG1 VAL 50 -6.711 -2.351 -6.462 339 HG12 VAL 50 2HG1 VAL 50 -5.044 -2.101 -6.981 340 HG13 VAL 50 3HG1 VAL 50 -5.912 -0.812 -6.149 341 HG21 VAL 50 3HG2 VAL 50 -6.147 -4.348 -5.147 342 HG22 VAL 50 1HG2 VAL 50 -4.919 -4.280 -3.884 343 HG23 VAL 50 2HG2 VAL 50 -4.443 -4.256 -5.584 344 H VAL 51 H VAL 51 -2.905 0.197 -5.689 345 HA VAL 51 HA VAL 51 -4.045 2.189 -3.859 346 HB VAL 51 HB VAL 51 -2.142 2.662 -6.179 347 HG11 VAL 51 1HG1 VAL 51 -1.694 4.761 -5.036 348 HG12 VAL 51 2HG1 VAL 51 -2.832 4.325 -3.761 349 HG13 VAL 51 3HG1 VAL 51 -3.412 4.600 -5.404 350 HG21 VAL 51 3HG2 VAL 51 -0.338 2.767 -4.487 351 HG22 VAL 51 1HG2 VAL 51 -1.055 1.158 -4.598 352 HG23 VAL 51 2HG2 VAL 51 -1.485 2.228 -3.265 353 H LYS 52 H LYS 52 -5.858 2.943 -4.281 354 HA LYS 52 HA LYS 52 -7.049 2.533 -6.875 355 HB2 LYS 52 2HB LYS 52 -8.274 2.010 -4.810 356 HB3 LYS 52 1HB LYS 52 -8.170 3.691 -4.319 357 HG2 LYS 52 2HG LYS 52 -9.542 4.347 -6.209 358 HG3 LYS 52 1HG LYS 52 -9.610 2.673 -6.757 359 HD2 LYS 52 2HD LYS 52 -10.672 3.685 -4.112 360 HD3 LYS 52 1HD LYS 52 -11.644 3.376 -5.548 361 HE2 LYS 52 2HE LYS 52 -10.941 1.002 -5.470 362 HE3 LYS 52 1HE LYS 52 -10.056 1.338 -3.980 363 HZ1 LYS 52 3HZ LYS 52 -12.232 0.375 -3.559 364 HZ2 LYS 52 1HZ LYS 52 -12.989 1.627 -4.362 365 HZ3 LYS 52 2HZ LYS 52 -12.180 1.911 -2.906 366 H ARG 53 H ARG 53 -5.981 5.144 -4.823 367 HA ARG 53 HA ARG 53 -6.063 6.964 -7.071 368 HB2 ARG 53 2HB ARG 53 -7.607 7.446 -4.523 369 HB3 ARG 53 1HB ARG 53 -7.074 8.762 -5.552 370 HG2 ARG 53 2HG ARG 53 -8.897 6.518 -6.391 371 HG3 ARG 53 1HG ARG 53 -9.411 8.153 -5.962 372 HD2 ARG 53 2HD ARG 53 -7.961 9.012 -7.803 373 HD3 ARG 53 1HD ARG 53 -7.640 7.341 -8.254 374 HE ARG 53 HE ARG 53 -10.417 7.905 -8.159 375 HH11 ARG 53 1HH1 ARG 53 -7.542 8.026 -10.218 376 HH12 ARG 53 2HH1 ARG 53 -8.425 8.325 -11.648 377 HH21 ARG 53 1HH2 ARG 53 -11.594 8.240 -10.101 378 HH22 ARG 53 2HH2 ARG 53 -10.799 8.388 -11.602 379 H GLY 54 H GLY 54 -4.769 8.781 -6.795 380 HA2 GLY 54 2HA GLY 54 -3.419 9.976 -5.027 381 HA3 GLY 54 1HA GLY 54 -2.736 8.388 -4.733 382 HA PRO 55 HA PRO 55 -0.710 10.454 -8.598 383 HB2 PRO 55 2HB PRO 55 0.991 12.136 -6.893 384 HB3 PRO 55 1HB PRO 55 0.072 12.582 -8.333 385 HG2 PRO 55 2HG PRO 55 -0.629 13.408 -5.868 386 HG3 PRO 55 1HG PRO 55 -1.820 13.081 -7.139 387 HD2 PRO 55 2HD PRO 55 -1.026 11.395 -4.804 388 HD3 PRO 55 1HD PRO 55 -2.632 11.702 -5.502 389 H ASN 56 H ASN 56 0.117 9.299 -5.552 390 HA ASN 56 HA ASN 56 2.862 8.651 -5.745 391 HB2 ASN 56 2HB ASN 56 2.343 7.004 -3.940 392 HB3 ASN 56 1HB ASN 56 1.779 8.637 -3.617 393 HD21 ASN 56 1HD2 ASN 56 0.903 5.340 -4.010 394 HD22 ASN 56 2HD2 ASN 56 -0.780 5.579 -3.688 395 H ALA 57 H ALA 57 -0.082 6.702 -6.558 396 HA ALA 57 HA ALA 57 1.268 5.213 -8.531 397 HB1 ALA 57 1HB ALA 57 2.250 4.069 -6.604 398 HB2 ALA 57 2HB ALA 57 1.072 3.001 -7.377 399 HB3 ALA 57 3HB ALA 57 0.651 3.859 -5.898 400 H GLY 58 H GLY 58 -0.260 3.414 -9.228 401 HA2 GLY 58 2HA GLY 58 -3.034 3.744 -8.444 402 HA3 GLY 58 1HA GLY 58 -2.637 4.233 -10.094 403 H ALA 59 H ALA 59 -1.018 1.700 -8.403 404 HA ALA 59 HA ALA 59 -2.314 -0.312 -10.074 405 HB1 ALA 59 1HB ALA 59 0.667 -0.004 -9.674 406 HB2 ALA 59 2HB ALA 59 -0.211 0.334 -11.168 407 HB3 ALA 59 3HB ALA 59 -0.129 -1.313 -10.547 408 H ARG 60 H ARG 60 -0.870 -2.486 -9.195 409 HA ARG 60 HA ARG 60 -1.105 -2.400 -6.303 410 HB2 ARG 60 2HB ARG 60 -2.338 -4.506 -6.303 411 HB3 ARG 60 1HB ARG 60 -3.232 -3.270 -7.170 412 HG2 ARG 60 2HG ARG 60 -2.434 -4.250 -9.296 413 HG3 ARG 60 1HG ARG 60 -1.652 -5.533 -8.372 414 HD2 ARG 60 2HD ARG 60 -3.744 -6.359 -9.138 415 HD3 ARG 60 1HD ARG 60 -3.885 -6.080 -7.404 416 HE ARG 60 HE ARG 60 -4.736 -3.895 -9.077 417 HH11 ARG 60 1HH1 ARG 60 -5.776 -6.812 -7.327 418 HH12 ARG 60 2HH1 ARG 60 -7.416 -6.385 -7.312 419 HH21 ARG 60 1HH2 ARG 60 -7.054 -3.337 -9.074 420 HH22 ARG 60 2HH2 ARG 60 -8.154 -4.372 -8.312 421 H PHE 61 H PHE 61 0.462 -3.598 -5.306 422 HA PHE 61 HA PHE 61 1.926 -5.443 -6.984 423 HB2 PHE 61 2HB PHE 61 4.137 -4.666 -6.207 424 HB3 PHE 61 1HB PHE 61 3.293 -3.431 -7.115 425 HD1 PHE 61 2HD PHE 61 4.484 -4.456 -3.788 426 HD2 PHE 61 1HD PHE 61 2.695 -1.349 -6.086 427 HE1 PHE 61 2HE PHE 61 4.952 -2.859 -1.983 428 HE2 PHE 61 1HE PHE 61 3.171 0.256 -4.283 429 HZ PHE 61 HZ PHE 61 4.300 -0.498 -2.230 430 H LEU 62 H LEU 62 3.028 -7.050 -5.956 431 HA LEU 62 HA LEU 62 1.705 -7.899 -3.526 432 HB2 LEU 62 2HB LEU 62 1.986 -9.325 -5.562 433 HB3 LEU 62 1HB LEU 62 3.713 -9.271 -5.310 434 HG LEU 62 HG LEU 62 3.378 -10.461 -3.145 435 HD11 LEU 62 1HD1 LEU 62 1.216 -11.557 -2.765 436 HD12 LEU 62 2HD1 LEU 62 0.532 -10.663 -4.121 437 HD13 LEU 62 3HD1 LEU 62 1.092 -9.803 -2.687 438 HD21 LEU 62 3HD2 LEU 62 2.876 -12.628 -4.172 439 HD22 LEU 62 1HD2 LEU 62 3.990 -11.676 -5.156 440 HD23 LEU 62 2HD2 LEU 62 2.290 -11.800 -5.611 441 H LEU 63 H LEU 63 2.672 -7.679 -1.562 442 HA LEU 63 HA LEU 63 5.310 -6.526 -1.510 443 HB2 LEU 63 2HB LEU 63 3.346 -7.062 0.715 444 HB3 LEU 63 1HB LEU 63 4.943 -6.407 0.970 445 HG LEU 63 HG LEU 63 4.245 -4.437 -0.457 446 HD11 LEU 63 1HD1 LEU 63 1.863 -4.012 -0.683 447 HD12 LEU 63 2HD1 LEU 63 1.512 -5.639 -0.096 448 HD13 LEU 63 3HD1 LEU 63 2.372 -5.413 -1.621 449 HD21 LEU 63 3HD2 LEU 63 3.009 -3.373 1.352 450 HD22 LEU 63 1HD2 LEU 63 4.360 -4.326 1.963 451 HD23 LEU 63 2HD2 LEU 63 2.713 -4.949 2.083 452 H ASP 64 H ASP 64 6.946 -7.770 -1.576 453 HA ASP 64 HA ASP 64 7.079 -9.988 0.344 454 HB2 ASP 64 2HB ASP 64 8.109 -9.975 -2.487 455 HB3 ASP 64 1HB ASP 64 8.799 -11.039 -1.270 456 H GLN 65 H GLN 65 7.881 -7.093 -0.164 457 HA GLN 65 HA GLN 65 10.729 -7.214 0.280 458 HB2 GLN 65 2HB GLN 65 9.674 -5.536 -1.196 459 HB3 GLN 65 1HB GLN 65 8.831 -4.873 0.191 460 HG2 GLN 65 2HG GLN 65 10.978 -4.258 1.194 461 HG3 GLN 65 1HG GLN 65 11.816 -4.936 -0.203 462 HE21 GLN 65 1HE2 GLN 65 9.623 -3.976 -1.963 463 HE22 GLN 65 2HE2 GLN 65 9.893 -2.298 -2.163 464 HA PRO 66 HA PRO 66 10.044 -7.674 4.685 465 HB2 PRO 66 2HB PRO 66 12.502 -6.520 5.402 466 HB3 PRO 66 1HB PRO 66 12.221 -8.230 5.083 467 HG2 PRO 66 2HG PRO 66 13.296 -6.121 3.266 468 HG3 PRO 66 1HG PRO 66 13.775 -7.821 3.415 469 HD2 PRO 66 2HD PRO 66 12.302 -6.996 1.394 470 HD3 PRO 66 1HD PRO 66 11.955 -8.560 2.163 471 H THR 67 H THR 67 11.522 -4.651 3.551 472 HA THR 67 HA THR 67 9.490 -3.216 5.045 473 HB THR 67 HB THR 67 12.435 -2.473 4.999 474 HG1 THR 67 1HG THR 67 11.096 -4.125 6.541 475 HG21 THR 67 3HG2 THR 67 11.783 -0.654 6.529 476 HG22 THR 67 1HG2 THR 67 10.089 -1.133 6.389 477 HG23 THR 67 2HG2 THR 67 10.945 -0.500 4.986 478 H THR 68 H THR 68 8.324 -2.587 3.324 479 HA THR 68 HA THR 68 9.547 -1.749 0.866 480 HB THR 68 HB THR 68 6.681 -1.403 1.758 481 HG1 THR 68 1HG THR 68 7.970 -3.672 1.596 482 HG21 THR 68 3HG2 THR 68 6.196 -1.559 -0.646 483 HG22 THR 68 1HG2 THR 68 7.916 -1.761 -0.981 484 HG23 THR 68 2HG2 THR 68 7.322 -0.242 -0.313 485 H THR 69 H THR 69 10.343 0.259 0.600 486 HA THR 69 HA THR 69 9.880 2.142 2.738 487 HB THR 69 HB THR 69 11.860 2.403 0.497 488 HG1 THR 69 1HG THR 69 11.628 0.352 2.229 489 HG21 THR 69 3HG2 THR 69 11.915 3.131 3.441 490 HG22 THR 69 1HG2 THR 69 11.628 4.257 2.114 491 HG23 THR 69 2HG2 THR 69 13.197 3.467 2.276 492 H ALA 70 H ALA 70 7.886 3.054 2.193 493 HA ALA 70 HA ALA 70 7.577 4.205 -0.463 494 HB1 ALA 70 1HB ALA 70 5.538 3.959 1.736 495 HB2 ALA 70 2HB ALA 70 5.759 2.784 0.453 496 HB3 ALA 70 3HB ALA 70 5.235 4.427 0.061 497 H GLY 71 H GLY 71 7.668 6.285 -0.828 498 HA2 GLY 71 2HA GLY 71 6.794 8.394 0.578 499 HA3 GLY 71 1HA GLY 71 8.365 8.055 1.293 500 H ARG 72 H ARG 72 9.506 9.748 0.468 501 HA ARG 72 HA ARG 72 9.796 9.524 -2.404 502 HB2 ARG 72 2HB ARG 72 9.360 11.830 -1.671 503 HB3 ARG 72 1HB ARG 72 10.739 11.764 -0.588 504 HG2 ARG 72 2HG ARG 72 11.166 13.026 -2.688 505 HG3 ARG 72 1HG ARG 72 12.270 11.676 -2.440 506 HD2 ARG 72 2HD ARG 72 11.021 10.319 -4.016 507 HD3 ARG 72 1HD ARG 72 9.810 11.588 -4.193 508 HE ARG 72 HE ARG 72 11.567 12.965 -5.158 509 HH11 ARG 72 1HH1 ARG 72 12.209 9.397 -5.188 510 HH12 ARG 72 2HH1 ARG 72 13.158 9.492 -6.567 511 HH21 ARG 72 1HH2 ARG 72 12.851 12.984 -7.075 512 HH22 ARG 72 2HH2 ARG 72 13.553 11.545 -7.651 513 H HIS 73 H HIS 73 12.222 10.529 0.026 514 HA HIS 73 HA HIS 73 14.199 9.670 0.650 515 HB2 HIS 73 2HB HIS 73 13.471 7.038 -0.684 516 HB3 HIS 73 1HB HIS 73 14.649 7.339 0.579 517 HD1 HIS 73 1HD HIS 73 11.032 6.739 0.008 518 HD2 HIS 73 2HD HIS 73 13.622 7.462 3.154 519 HE1 HIS 73 1HE HIS 73 9.753 6.166 2.104 520 HA PRO 74 HA PRO 74 16.848 9.729 -3.046 521 HB2 PRO 74 2HB PRO 74 18.954 8.235 -2.096 522 HB3 PRO 74 1HB PRO 74 18.755 9.956 -1.751 523 HG2 PRO 74 2HG PRO 74 18.046 7.588 -0.066 524 HG3 PRO 74 1HG PRO 74 18.806 9.113 0.423 525 HD2 PRO 74 2HD PRO 74 16.217 8.646 0.867 526 HD3 PRO 74 1HD PRO 74 16.792 10.260 0.401 527 H GLU 75 H GLU 75 15.789 6.938 -1.354 528 HA GLU 75 HA GLU 75 16.236 5.212 -3.672 529 HB2 GLU 75 2HB GLU 75 16.168 4.346 -0.768 530 HB3 GLU 75 1HB GLU 75 16.499 3.326 -2.156 531 HG2 GLU 75 2HG GLU 75 18.559 4.567 -2.575 532 HG3 GLU 75 1HG GLU 75 18.236 5.580 -1.168 533 H SER 76 H SER 76 14.161 6.059 -4.287 534 HA SER 76 HA SER 76 11.827 5.473 -2.706 535 HB2 SER 76 2HB SER 76 11.837 6.099 -5.670 536 HB3 SER 76 1HB SER 76 10.582 6.393 -4.455 537 HG SER 76 HG SER 76 12.223 7.775 -3.444 538 H ASP 77 H ASP 77 11.367 3.235 -2.440 539 HA ASP 77 HA ASP 77 11.818 1.376 -4.556 540 HB2 ASP 77 2HB ASP 77 11.582 0.693 -2.161 541 HB3 ASP 77 1HB ASP 77 9.887 1.167 -2.222 542 H ILE 78 H ILE 78 9.101 3.133 -3.305 543 HA ILE 78 HA ILE 78 8.024 3.430 -5.945 544 HB ILE 78 HB ILE 78 5.687 3.220 -5.180 545 HG12 ILE 78 2HG1 ILE 78 5.974 3.699 -2.754 546 HG13 ILE 78 1HG1 ILE 78 4.998 2.272 -3.038 547 HG21 ILE 78 1HG2 ILE 78 5.465 0.796 -4.968 548 HG22 ILE 78 2HG2 ILE 78 7.207 0.687 -4.715 549 HG23 ILE 78 3HG2 ILE 78 6.575 1.301 -6.243 550 HD11 ILE 78 3HD1 ILE 78 7.860 2.369 -2.149 551 HD12 ILE 78 1HD1 ILE 78 6.973 0.878 -2.503 552 HD13 ILE 78 2HD1 ILE 78 6.458 1.925 -1.178 553 H PHE 79 H PHE 79 6.883 5.490 -6.059 554 HA PHE 79 HA PHE 79 7.810 7.167 -3.865 555 HB2 PHE 79 2HB PHE 79 8.314 8.977 -5.461 556 HB3 PHE 79 1HB PHE 79 9.274 7.542 -5.766 557 HD1 PHE 79 1HD PHE 79 8.748 6.115 -7.750 558 HD2 PHE 79 2HD PHE 79 6.839 9.864 -7.087 559 HE1 PHE 79 1HE PHE 79 8.048 6.176 -10.108 560 HE2 PHE 79 2HE PHE 79 6.133 9.925 -9.442 561 HZ PHE 79 HZ PHE 79 6.738 8.081 -10.955 562 H LEU 80 H LEU 80 6.431 8.306 -2.923 563 HA LEU 80 HA LEU 80 3.786 8.614 -3.957 564 HB2 LEU 80 2HB LEU 80 5.049 9.403 -1.334 565 HB3 LEU 80 1HB LEU 80 3.456 9.961 -1.784 566 HG LEU 80 HG LEU 80 2.664 7.616 -1.846 567 HD11 LEU 80 1HD1 LEU 80 4.752 6.485 -2.352 568 HD12 LEU 80 2HD1 LEU 80 3.979 5.827 -0.912 569 HD13 LEU 80 3HD1 LEU 80 5.371 6.901 -0.751 570 HD21 LEU 80 3HD2 LEU 80 2.669 7.258 0.569 571 HD22 LEU 80 1HD2 LEU 80 2.367 8.943 0.157 572 HD23 LEU 80 2HD2 LEU 80 3.956 8.446 0.740 573 H ASP 81 H ASP 81 3.645 10.040 -5.558 574 HA ASP 81 HA ASP 81 5.265 12.388 -5.552 575 HB2 ASP 81 2HB ASP 81 4.896 11.229 -7.680 576 HB3 ASP 81 1HB ASP 81 3.163 11.492 -7.544 577 H ASP 82 H ASP 82 4.246 12.809 -3.532 578 HA ASP 82 HA ASP 82 2.253 14.928 -3.961 579 HB2 ASP 82 2HB ASP 82 1.061 13.133 -2.797 580 HB3 ASP 82 1HB ASP 82 2.321 13.042 -1.573 581 H VAL 83 H VAL 83 2.556 16.781 -2.679 582 HA VAL 83 HA VAL 83 5.363 17.208 -2.198 583 HB VAL 83 HB VAL 83 4.743 19.596 -1.920 584 HG11 VAL 83 1HG1 VAL 83 3.652 18.256 -4.390 585 HG12 VAL 83 2HG1 VAL 83 5.337 18.688 -4.109 586 HG13 VAL 83 3HG1 VAL 83 4.116 19.953 -4.256 587 HG21 VAL 83 3HG2 VAL 83 1.949 18.603 -2.522 588 HG22 VAL 83 1HG2 VAL 83 2.439 20.296 -2.461 589 HG23 VAL 83 2HG2 VAL 83 2.494 19.308 -1.003 590 H THR 84 H THR 84 3.085 16.004 -0.169 591 HA THR 84 HA THR 84 4.102 17.478 2.157 592 HB THR 84 HB THR 84 1.850 15.538 2.389 593 HG1 THR 84 1HG THR 84 1.300 16.483 0.500 594 HG21 THR 84 3HG2 THR 84 0.930 17.353 3.784 595 HG22 THR 84 1HG2 THR 84 2.309 18.368 3.364 596 HG23 THR 84 2HG2 THR 84 2.548 16.884 4.295 597 H VAL 85 H VAL 85 5.138 15.087 0.454 598 HA VAL 85 HA VAL 85 5.176 12.901 2.323 599 HB VAL 85 HB VAL 85 6.423 13.214 -0.418 600 HG11 VAL 85 1HG1 VAL 85 6.823 10.802 -0.343 601 HG12 VAL 85 2HG1 VAL 85 6.249 10.756 1.325 602 HG13 VAL 85 3HG1 VAL 85 7.728 11.630 0.923 603 HG21 VAL 85 3HG2 VAL 85 4.044 11.647 0.547 604 HG22 VAL 85 1HG2 VAL 85 4.665 11.686 -1.104 605 HG23 VAL 85 2HG2 VAL 85 4.002 13.151 -0.371 606 H SER 86 H SER 86 6.741 12.281 3.605 607 HA SER 86 HA SER 86 9.047 14.064 3.992 608 HB2 SER 86 2HB SER 86 7.861 11.989 5.836 609 HB3 SER 86 1HB SER 86 8.958 13.303 6.266 610 HG SER 86 HG SER 86 6.857 14.314 5.026 611 H ARG 87 H ARG 87 11.127 12.927 4.631 612 HA ARG 87 HA ARG 87 11.451 10.420 3.319 613 HB2 ARG 87 2HB ARG 87 13.798 10.381 4.374 614 HB3 ARG 87 1HB ARG 87 13.498 11.653 3.230 615 HG2 ARG 87 2HG ARG 87 14.845 12.480 5.038 616 HG3 ARG 87 1HG ARG 87 13.273 13.249 5.123 617 HD2 ARG 87 2HD ARG 87 12.637 11.820 6.965 618 HD3 ARG 87 1HD ARG 87 14.109 10.873 6.783 619 HE ARG 87 HE ARG 87 15.367 12.747 7.550 620 HH11 ARG 87 1HH1 ARG 87 11.885 13.186 7.968 621 HH12 ARG 87 2HH1 ARG 87 12.020 14.200 9.322 622 HH21 ARG 87 1HH2 ARG 87 15.566 14.156 9.385 623 HH22 ARG 87 2HH2 ARG 87 14.175 14.815 10.116 624 H ARG 88 H ARG 88 11.523 8.419 4.144 625 HA ARG 88 HA ARG 88 10.578 6.798 5.306 626 HB2 ARG 88 2HB ARG 88 11.252 8.405 7.814 627 HB3 ARG 88 1HB ARG 88 10.873 6.692 7.760 628 HG2 ARG 88 2HG ARG 88 13.303 7.998 6.549 629 HG3 ARG 88 1HG ARG 88 13.263 7.085 8.055 630 HD2 ARG 88 2HD ARG 88 12.493 5.914 5.386 631 HD3 ARG 88 1HD ARG 88 14.127 5.856 6.013 632 HE ARG 88 HE ARG 88 11.843 4.625 7.441 633 HH11 ARG 88 1HH1 ARG 88 15.184 4.470 6.238 634 HH12 ARG 88 2HH1 ARG 88 15.411 2.849 6.710 635 HH21 ARG 88 1HH2 ARG 88 12.178 2.413 8.071 636 HH22 ARG 88 2HH2 ARG 88 13.688 1.673 7.837 637 H HIS 89 H HIS 89 8.628 7.197 4.402 638 HA HIS 89 HA HIS 89 6.896 8.996 5.898 639 HB2 HIS 89 2HB HIS 89 7.342 9.467 3.474 640 HB3 HIS 89 1HB HIS 89 6.547 7.950 3.081 641 HD2 HIS 89 2HD HIS 89 3.735 7.940 3.757 642 HE1 HIS 89 1HE HIS 89 3.566 12.153 3.584 643 HE2 HIS 89 2HE HIS 89 2.244 10.024 3.960 644 H ALA 90 H ALA 90 6.316 6.152 3.838 645 HA ALA 90 HA ALA 90 4.687 5.095 6.021 646 HB1 ALA 90 1HB ALA 90 3.197 4.138 4.298 647 HB2 ALA 90 2HB ALA 90 4.121 4.979 3.050 648 HB3 ALA 90 3HB ALA 90 3.220 5.897 4.251 649 H GLU 91 H GLU 91 5.807 3.476 6.790 650 HA GLU 91 HA GLU 91 7.318 1.891 4.870 651 HB2 GLU 91 2HB GLU 91 7.460 2.059 7.869 652 HB3 GLU 91 1HB GLU 91 8.365 0.891 6.917 653 HG2 GLU 91 2HG GLU 91 9.519 2.673 5.765 654 HG3 GLU 91 1HG GLU 91 8.562 3.875 6.627 655 H PHE 92 H PHE 92 6.602 0.057 4.248 656 HA PHE 92 HA PHE 92 4.467 -1.215 5.799 657 HB2 PHE 92 2HB PHE 92 5.254 -1.760 2.916 658 HB3 PHE 92 1HB PHE 92 3.859 -2.388 3.750 659 HD1 PHE 92 1HD PHE 92 2.167 -0.593 4.652 660 HD2 PHE 92 2HD PHE 92 5.008 0.118 1.565 661 HE1 PHE 92 1HE PHE 92 0.804 1.281 3.838 662 HE2 PHE 92 2HE PHE 92 3.648 2.003 0.751 663 HZ PHE 92 HZ PHE 92 1.547 2.583 1.884 664 H ARG 93 H ARG 93 5.222 -2.785 7.025 665 HA ARG 93 HA ARG 93 7.740 -4.028 6.216 666 HB2 ARG 93 2HB ARG 93 6.599 -3.527 8.961 667 HB3 ARG 93 1HB ARG 93 8.104 -4.373 8.620 668 HG2 ARG 93 2HG ARG 93 9.076 -2.393 7.704 669 HG3 ARG 93 1HG ARG 93 7.551 -1.516 7.868 670 HD2 ARG 93 2HD ARG 93 7.666 -1.817 10.286 671 HD3 ARG 93 1HD ARG 93 9.197 -2.668 10.110 672 HE ARG 93 HE ARG 93 9.560 -0.239 8.876 673 HH11 ARG 93 1HH1 ARG 93 8.636 -1.315 12.098 674 HH12 ARG 93 2HH1 ARG 93 9.351 0.021 12.882 675 HH21 ARG 93 1HH2 ARG 93 10.470 1.547 9.880 676 HH22 ARG 93 2HH2 ARG 93 10.459 1.712 11.586 677 H ILE 94 H ILE 94 7.732 -6.170 6.057 678 HA ILE 94 HA ILE 94 5.266 -7.441 6.939 679 HB ILE 94 HB ILE 94 5.364 -9.045 5.158 680 HG12 ILE 94 2HG1 ILE 94 7.802 -7.700 4.012 681 HG13 ILE 94 1HG1 ILE 94 7.929 -9.073 5.112 682 HG21 ILE 94 1HG2 ILE 94 5.853 -6.299 3.996 683 HG22 ILE 94 2HG2 ILE 94 4.308 -6.894 4.585 684 HG23 ILE 94 3HG2 ILE 94 5.055 -7.638 3.171 685 HD11 ILE 94 3HD1 ILE 94 6.597 -10.385 3.625 686 HD12 ILE 94 1HD1 ILE 94 8.056 -9.799 2.814 687 HD13 ILE 94 2HD1 ILE 94 6.486 -9.032 2.486 688 H ASN 95 H ASN 95 5.436 -9.191 8.070 689 HA ASN 95 HA ASN 95 8.088 -10.278 8.537 690 HB2 ASN 95 2HB ASN 95 7.195 -9.034 10.559 691 HB3 ASN 95 1HB ASN 95 5.848 -10.168 10.589 692 HD21 ASN 95 1HD2 ASN 95 9.181 -9.686 11.287 693 HD22 ASN 95 2HD2 ASN 95 9.465 -11.194 12.063 694 H GLU 96 H GLU 96 8.107 -12.556 8.590 695 HA GLU 96 HA GLU 96 6.188 -13.861 7.032 696 HB2 GLU 96 2HB GLU 96 7.281 -15.969 7.769 697 HB3 GLU 96 1HB GLU 96 8.408 -14.754 7.192 698 HG2 GLU 96 2HG GLU 96 8.935 -14.176 9.525 699 HG3 GLU 96 1HG GLU 96 7.839 -15.446 10.065 700 H GLY 97 H GLY 97 6.044 -13.070 10.345 701 HA2 GLY 97 2HA GLY 97 4.045 -15.083 10.972 702 HA3 GLY 97 1HA GLY 97 4.710 -13.888 12.074 703 H GLU 98 H GLU 98 4.183 -11.574 10.345 704 HA GLU 98 HA GLU 98 1.459 -11.408 9.691 705 HB2 GLU 98 2HB GLU 98 1.174 -11.569 12.152 706 HB3 GLU 98 1HB GLU 98 2.266 -10.219 12.376 707 HG2 GLU 98 2HG GLU 98 -0.050 -9.542 12.670 708 HG3 GLU 98 1HG GLU 98 0.672 -8.738 11.280 709 H PHE 99 H PHE 99 0.892 -9.125 9.190 710 HA PHE 99 HA PHE 99 3.251 -7.759 8.114 711 HB2 PHE 99 2HB PHE 99 0.321 -7.384 7.449 712 HB3 PHE 99 1HB PHE 99 1.675 -6.667 6.575 713 HD1 PHE 99 1HD PHE 99 3.346 -8.391 5.552 714 HD2 PHE 99 2HD PHE 99 -0.620 -9.337 6.741 715 HE1 PHE 99 1HE PHE 99 3.380 -10.358 4.072 716 HE2 PHE 99 2HE PHE 99 -0.599 -11.308 5.270 717 HZ PHE 99 HZ PHE 99 1.401 -11.820 3.929 718 H GLU 100 H GLU 100 3.740 -5.573 8.577 719 HA GLU 100 HA GLU 100 2.173 -4.282 10.722 720 HB2 GLU 100 2HB GLU 100 4.215 -5.286 11.642 721 HB3 GLU 100 1HB GLU 100 5.184 -4.456 10.441 722 HG2 GLU 100 2HG GLU 100 4.565 -2.301 11.433 723 HG3 GLU 100 1HG GLU 100 3.597 -3.140 12.642 724 H VAL 101 H VAL 101 1.751 -2.094 10.409 725 HA VAL 101 HA VAL 101 3.129 -0.819 8.157 726 HB VAL 101 HB VAL 101 0.744 -1.127 7.605 727 HG11 VAL 101 1HG1 VAL 101 -1.032 0.047 8.792 728 HG12 VAL 101 2HG1 VAL 101 0.131 0.529 10.029 729 HG13 VAL 101 3HG1 VAL 101 -0.247 -1.178 9.793 730 HG21 VAL 101 3HG2 VAL 101 1.437 1.768 8.104 731 HG22 VAL 101 1HG2 VAL 101 0.164 1.192 7.026 732 HG23 VAL 101 2HG2 VAL 101 1.850 0.820 6.675 733 H VAL 102 H VAL 102 4.301 0.919 8.568 734 HA VAL 102 HA VAL 102 3.903 2.251 11.147 735 HB VAL 102 HB VAL 102 6.527 1.677 9.733 736 HG11 VAL 102 1HG1 VAL 102 6.046 3.232 12.277 737 HG12 VAL 102 2HG1 VAL 102 6.618 3.899 10.747 738 HG13 VAL 102 3HG1 VAL 102 7.627 2.766 11.646 739 HG21 VAL 102 3HG2 VAL 102 5.437 0.756 12.386 740 HG22 VAL 102 1HG2 VAL 102 7.043 0.395 11.757 741 HG23 VAL 102 2HG2 VAL 102 5.611 -0.227 10.933 742 H ASP 103 H ASP 103 3.473 4.313 11.054 743 HA ASP 103 HA ASP 103 3.979 5.782 8.569 744 HB2 ASP 103 2HB ASP 103 1.650 5.901 9.088 745 HB3 ASP 103 1HB ASP 103 1.981 6.295 10.763 746 H VAL 104 H VAL 104 5.550 7.038 8.576 747 HA VAL 104 HA VAL 104 6.036 8.668 10.920 748 HB VAL 104 HB VAL 104 8.585 8.614 10.105 749 HG11 VAL 104 1HG1 VAL 104 7.790 7.905 12.326 750 HG12 VAL 104 2HG1 VAL 104 9.009 6.798 11.699 751 HG13 VAL 104 3HG1 VAL 104 7.306 6.348 11.652 752 HG21 VAL 104 3HG2 VAL 104 9.234 6.380 9.321 753 HG22 VAL 104 1HG2 VAL 104 8.171 7.177 8.160 754 HG23 VAL 104 2HG2 VAL 104 7.535 5.922 9.221 755 H GLY 105 H GLY 105 4.742 8.745 8.169 756 HA2 GLY 105 2HA GLY 105 5.966 11.229 7.190 757 HA3 GLY 105 1HA GLY 105 4.993 10.119 6.223 758 H SER 106 H SER 106 4.537 11.317 9.442 759 HA SER 106 HA SER 106 1.774 11.614 9.248 760 HB2 SER 106 2HB SER 106 3.602 12.837 11.292 761 HB3 SER 106 1HB SER 106 1.933 12.291 11.493 762 HG SER 106 HG SER 106 2.804 10.146 10.821 763 H LEU 107 H LEU 107 4.163 13.620 8.009 764 HA LEU 107 HA LEU 107 3.020 16.171 8.406 765 HB2 LEU 107 2HB LEU 107 5.339 15.647 7.577 766 HB3 LEU 107 1HB LEU 107 4.629 15.152 6.062 767 HG LEU 107 HG LEU 107 3.751 17.456 5.774 768 HD11 LEU 107 1HD1 LEU 107 5.473 18.066 8.164 769 HD12 LEU 107 2HD1 LEU 107 3.714 18.194 8.074 770 HD13 LEU 107 3HD1 LEU 107 4.727 19.264 7.110 771 HD21 LEU 107 3HD2 LEU 107 5.916 18.442 5.143 772 HD22 LEU 107 1HD2 LEU 107 5.782 16.754 4.645 773 HD23 LEU 107 2HD2 LEU 107 6.738 17.179 6.064 774 H ASN 108 H ASN 108 2.666 13.626 5.999 775 HA ASN 108 HA ASN 108 0.478 14.997 4.634 776 HB2 ASN 108 2HB ASN 108 2.121 13.673 3.290 777 HB3 ASN 108 1HB ASN 108 1.668 12.245 4.210 778 HD21 ASN 108 1HD2 ASN 108 0.766 14.365 1.568 779 HD22 ASN 108 2HD2 ASN 108 -0.575 13.418 1.093 780 H GLY 109 H GLY 109 1.142 12.176 6.635 781 HA2 GLY 109 2HA GLY 109 -0.278 11.530 8.420 782 HA3 GLY 109 1HA GLY 109 -1.614 12.318 7.598 783 H THR 110 H THR 110 0.309 9.395 7.822 784 HA THR 110 HA THR 110 -1.365 8.064 5.893 785 HB THR 110 HB THR 110 0.721 6.958 7.778 786 HG1 THR 110 1HG THR 110 2.009 8.012 6.651 787 HG21 THR 110 3HG2 THR 110 -0.718 5.233 6.828 788 HG22 THR 110 1HG2 THR 110 0.891 5.127 6.117 789 HG23 THR 110 2HG2 THR 110 -0.439 5.849 5.203 790 H TYR 111 H TYR 111 -3.290 7.272 6.519 791 HA TYR 111 HA TYR 111 -3.690 6.677 9.361 792 HB2 TYR 111 2HB TYR 111 -5.807 7.241 7.282 793 HB3 TYR 111 1HB TYR 111 -6.031 7.132 9.019 794 HD1 TYR 111 2HD TYR 111 -4.814 8.926 10.436 795 HD2 TYR 111 1HD TYR 111 -5.507 9.306 6.263 796 HE1 TYR 111 2HE TYR 111 -4.511 11.353 10.610 797 HE2 TYR 111 1HE TYR 111 -5.205 11.740 6.427 798 HH TYR 111 HH TYR 111 -5.393 13.461 8.150 799 H VAL 112 H VAL 112 -4.312 4.654 9.824 800 HA VAL 112 HA VAL 112 -4.676 2.842 7.555 801 HB VAL 112 HB VAL 112 -2.651 2.295 8.841 802 HG11 VAL 112 1HG1 VAL 112 -2.762 1.586 11.163 803 HG12 VAL 112 2HG1 VAL 112 -4.474 2.013 11.202 804 HG13 VAL 112 3HG1 VAL 112 -3.256 3.266 10.953 805 HG21 VAL 112 3HG2 VAL 112 -4.870 0.299 9.292 806 HG22 VAL 112 1HG2 VAL 112 -3.146 -0.060 9.397 807 HG23 VAL 112 2HG2 VAL 112 -3.851 0.426 7.858 808 H ASN 113 H ASN 113 -6.429 1.573 7.490 809 HA ASN 113 HA ASN 113 -8.509 0.989 7.720 810 HB2 ASN 113 2HB ASN 113 -8.318 1.756 10.670 811 HB3 ASN 113 1HB ASN 113 -9.648 0.873 9.931 812 HD21 ASN 113 1HD2 ASN 113 -9.216 -1.253 9.174 813 HD22 ASN 113 2HD2 ASN 113 -7.928 -2.180 9.850 814 H ARG 114 H ARG 114 -8.607 3.509 10.123 815 HA ARG 114 HA ARG 114 -9.355 5.571 8.234 816 HB2 ARG 114 2HB ARG 114 -11.249 4.832 10.508 817 HB3 ARG 114 1HB ARG 114 -11.400 6.243 9.496 818 HG2 ARG 114 2HG ARG 114 -11.853 3.362 8.713 819 HG3 ARG 114 1HG ARG 114 -13.065 4.622 8.902 820 HD2 ARG 114 2HD ARG 114 -10.960 4.373 6.753 821 HD3 ARG 114 1HD ARG 114 -12.703 4.278 6.560 822 HE ARG 114 HE ARG 114 -12.205 6.780 7.562 823 HH11 ARG 114 1HH1 ARG 114 -11.306 4.936 4.577 824 HH12 ARG 114 2HH1 ARG 114 -10.988 6.350 3.717 825 HH21 ARG 114 1HH2 ARG 114 -11.794 8.662 6.259 826 HH22 ARG 114 2HH2 ARG 114 -11.241 8.468 4.642 827 H GLU 115 H GLU 115 -7.318 4.706 10.480 828 HA GLU 115 HA GLU 115 -7.787 6.925 12.357 829 HB2 GLU 115 2HB GLU 115 -6.707 4.180 12.939 830 HB3 GLU 115 1HB GLU 115 -6.874 5.486 14.102 831 HG2 GLU 115 2HG GLU 115 -9.248 5.436 13.908 832 HG3 GLU 115 1HG GLU 115 -9.157 4.281 12.579 833 HA PRO 116 HA PRO 116 -3.421 7.872 11.562 834 HB2 PRO 116 2HB PRO 116 -3.339 9.421 14.004 835 HB3 PRO 116 1HB PRO 116 -3.383 10.020 12.348 836 HG2 PRO 116 2HG PRO 116 -5.440 10.328 14.138 837 HG3 PRO 116 1HG PRO 116 -5.657 10.308 12.383 838 HD2 PRO 116 2HD PRO 116 -6.132 8.149 14.386 839 HD3 PRO 116 1HD PRO 116 -7.059 8.592 12.935 840 H ARG 117 H ARG 117 -1.892 6.424 12.049 841 HA ARG 117 HA ARG 117 -1.491 5.642 14.851 842 HB2 ARG 117 2HB ARG 117 -1.705 3.785 12.478 843 HB3 ARG 117 1HB ARG 117 -1.077 3.312 14.044 844 HG2 ARG 117 2HG ARG 117 -3.870 4.354 13.608 845 HG3 ARG 117 1HG ARG 117 -3.443 2.643 13.595 846 HD2 ARG 117 2HD ARG 117 -3.085 4.564 15.891 847 HD3 ARG 117 1HD ARG 117 -4.299 3.293 15.769 848 HE ARG 117 HE ARG 117 -1.398 2.791 15.903 849 HH11 ARG 117 1HH1 ARG 117 -4.709 1.849 16.746 850 HH12 ARG 117 2HH1 ARG 117 -4.211 0.498 17.649 851 HH21 ARG 117 1HH2 ARG 117 -0.754 0.955 17.145 852 HH22 ARG 117 2HH2 ARG 117 -1.921 -0.015 17.899 853 H ASN 118 H ASN 118 0.656 5.203 15.334 854 HA ASN 118 HA ASN 118 2.534 5.961 13.262 855 HB2 ASN 118 2HB ASN 118 4.312 5.857 15.008 856 HB3 ASN 118 1HB ASN 118 2.988 6.908 15.487 857 HD21 ASN 118 1HD2 ASN 118 4.660 3.941 16.109 858 HD22 ASN 118 2HD2 ASN 118 3.937 3.624 17.636 859 H ALA 119 H ALA 119 1.700 3.135 15.188 860 HA ALA 119 HA ALA 119 2.641 1.565 12.931 861 HB1 ALA 119 1HB ALA 119 4.471 1.425 14.561 862 HB2 ALA 119 2HB ALA 119 3.613 -0.116 14.471 863 HB3 ALA 119 3HB ALA 119 3.323 0.977 15.825 864 H GLN 120 H GLN 120 1.257 -0.024 12.485 865 HA GLN 120 HA GLN 120 -0.652 -0.843 14.495 866 HB2 GLN 120 2HB GLN 120 -1.573 1.092 13.103 867 HB3 GLN 120 1HB GLN 120 -1.518 0.011 11.729 868 HG2 GLN 120 2HG GLN 120 -3.105 -0.685 14.182 869 HG3 GLN 120 1HG GLN 120 -3.760 0.392 12.959 870 HE21 GLN 120 1HE2 GLN 120 -4.724 -2.205 13.818 871 HE22 GLN 120 2HE2 GLN 120 -4.667 -3.197 12.408 872 H VAL 121 H VAL 121 -1.369 -2.977 14.142 873 HA VAL 121 HA VAL 121 0.300 -4.479 12.332 874 HB VAL 121 HB VAL 121 0.043 -5.387 14.574 875 HG11 VAL 121 1HG1 VAL 121 -2.900 -5.608 14.037 876 HG12 VAL 121 2HG1 VAL 121 -2.130 -4.510 15.178 877 HG13 VAL 121 3HG1 VAL 121 -2.065 -6.255 15.449 878 HG21 VAL 121 3HG2 VAL 121 0.365 -7.007 12.837 879 HG22 VAL 121 1HG2 VAL 121 -1.375 -7.101 12.561 880 HG23 VAL 121 2HG2 VAL 121 -0.693 -7.666 14.086 881 H MET 122 H MET 122 -0.239 -4.903 10.345 882 HA MET 122 HA MET 122 -2.489 -3.795 9.115 883 HB2 MET 122 2HB MET 122 -0.573 -5.859 8.140 884 HB3 MET 122 1HB MET 122 -1.829 -5.185 7.119 885 HG2 MET 122 2HG MET 122 -0.829 -2.973 7.377 886 HG3 MET 122 1HG MET 122 0.418 -3.662 8.425 887 HE1 MET 122 3HE MET 122 0.917 -1.974 5.666 888 HE2 MET 122 1HE MET 122 2.268 -2.888 4.998 889 HE3 MET 122 2HE MET 122 2.225 -2.526 6.723 890 H GLN 123 H GLN 123 -4.340 -4.536 8.271 891 HA GLN 123 HA GLN 123 -5.134 -7.252 8.984 892 HB2 GLN 123 2HB GLN 123 -6.218 -5.507 10.418 893 HB3 GLN 123 1HB GLN 123 -6.883 -4.785 8.964 894 HG2 GLN 123 2HG GLN 123 -8.492 -6.200 10.200 895 HG3 GLN 123 1HG GLN 123 -8.221 -6.715 8.531 896 HE21 GLN 123 1HE2 GLN 123 -7.645 -7.464 11.885 897 HE22 GLN 123 2HE2 GLN 123 -7.162 -9.092 11.639 898 H THR 124 H THR 124 -6.092 -8.373 7.417 899 HA THR 124 HA THR 124 -5.847 -7.343 4.759 900 HB THR 124 HB THR 124 -5.070 -9.586 5.095 901 HG1 THR 124 1HG THR 124 -7.402 -10.217 3.721 902 HG21 THR 124 3HG2 THR 124 -7.876 -10.288 5.995 903 HG22 THR 124 1HG2 THR 124 -6.435 -10.263 7.011 904 HG23 THR 124 2HG2 THR 124 -6.582 -11.452 5.716 905 H GLY 125 H GLY 125 -7.384 -6.656 3.447 906 HA2 GLY 125 2HA GLY 125 -9.533 -6.726 2.493 907 HA3 GLY 125 1HA GLY 125 -10.155 -7.394 3.993 908 H ASP 126 H ASP 126 -8.014 -4.774 4.292 909 HA ASP 126 HA ASP 126 -10.312 -3.010 4.713 910 HB2 ASP 126 2HB ASP 126 -9.011 -4.027 6.801 911 HB3 ASP 126 1HB ASP 126 -7.886 -2.724 6.433 912 H GLU 127 H GLU 127 -8.862 -0.698 5.315 913 HA GLU 127 HA GLU 127 -7.299 -0.347 2.886 914 HB2 GLU 127 2HB GLU 127 -8.542 1.748 2.362 915 HB3 GLU 127 1HB GLU 127 -9.439 0.258 2.123 916 HG2 GLU 127 2HG GLU 127 -10.655 0.617 4.172 917 HG3 GLU 127 1HG GLU 127 -9.688 2.053 4.520 918 H ILE 128 H ILE 128 -6.001 1.411 2.760 919 HA ILE 128 HA ILE 128 -5.365 2.712 5.309 920 HB ILE 128 HB ILE 128 -3.519 2.080 2.968 921 HG12 ILE 128 2HG1 ILE 128 -3.574 0.922 5.770 922 HG13 ILE 128 1HG1 ILE 128 -4.101 0.090 4.313 923 HG21 ILE 128 1HG2 ILE 128 -1.697 2.938 4.387 924 HG22 ILE 128 2HG2 ILE 128 -2.876 3.389 5.617 925 HG23 ILE 128 3HG2 ILE 128 -2.900 4.184 4.046 926 HD11 ILE 128 3HD1 ILE 128 -1.901 -0.660 5.025 927 HD12 ILE 128 1HD1 ILE 128 -1.292 0.992 4.931 928 HD13 ILE 128 2HD1 ILE 128 -1.800 0.155 3.464 929 H GLN 129 H GLN 129 -5.568 4.851 5.292 930 HA GLN 129 HA GLN 129 -6.281 6.200 2.776 931 HB2 GLN 129 2HB GLN 129 -7.920 6.242 4.664 932 HB3 GLN 129 1HB GLN 129 -6.718 7.010 5.673 933 HG2 GLN 129 2HG GLN 129 -8.034 8.788 5.028 934 HG3 GLN 129 1HG GLN 129 -6.733 8.853 3.846 935 HE21 GLN 129 1HE2 GLN 129 -7.182 8.222 1.696 936 HE22 GLN 129 2HE2 GLN 129 -8.809 8.131 1.139 937 H ILE 130 H ILE 130 -4.493 7.191 1.949 938 HA ILE 130 HA ILE 130 -2.540 8.231 3.848 939 HB ILE 130 HB ILE 130 -0.998 8.421 1.825 940 HG12 ILE 130 2HG1 ILE 130 -3.065 6.582 0.575 941 HG13 ILE 130 1HG1 ILE 130 -2.693 8.232 0.084 942 HG21 ILE 130 1HG2 ILE 130 -0.639 6.756 3.476 943 HG22 ILE 130 2HG2 ILE 130 -0.363 6.038 1.884 944 HG23 ILE 130 3HG2 ILE 130 -1.859 5.701 2.762 945 HD11 ILE 130 3HD1 ILE 130 -0.810 5.887 -0.058 946 HD12 ILE 130 1HD1 ILE 130 -0.453 7.533 -0.580 947 HD13 ILE 130 2HD1 ILE 130 -1.687 6.591 -1.417 948 H GLY 131 H GLY 131 -3.138 10.149 4.412 949 HA2 GLY 131 2HA GLY 131 -3.625 12.362 4.302 950 HA3 GLY 131 1HA GLY 131 -3.027 12.329 2.648 951 H LYS 132 H LYS 132 -4.434 11.913 0.993 952 HA LYS 132 HA LYS 132 -7.310 12.189 1.610 953 HB2 LYS 132 2HB LYS 132 -5.797 13.550 -0.633 954 HB3 LYS 132 1HB LYS 132 -7.526 13.656 -0.353 955 HG2 LYS 132 2HG LYS 132 -5.408 14.650 1.554 956 HG3 LYS 132 1HG LYS 132 -6.262 15.653 0.387 957 HD2 LYS 132 2HD LYS 132 -7.623 14.060 2.553 958 HD3 LYS 132 1HD LYS 132 -7.153 15.742 2.742 959 HE2 LYS 132 2HE LYS 132 -9.086 14.655 0.678 960 HE3 LYS 132 1HE LYS 132 -9.520 15.527 2.142 961 HZ1 LYS 132 3HZ LYS 132 -7.945 16.623 -0.120 962 HZ2 LYS 132 1HZ LYS 132 -8.331 17.475 1.288 963 HZ3 LYS 132 2HZ LYS 132 -9.539 16.970 0.207 964 H PHE 133 H PHE 133 -5.014 10.191 0.348 965 HA PHE 133 HA PHE 133 -6.651 9.354 -1.952 966 HB2 PHE 133 2HB PHE 133 -3.776 8.559 -1.476 967 HB3 PHE 133 1HB PHE 133 -4.674 8.580 -2.979 968 HD1 PHE 133 1HD PHE 133 -5.633 11.074 -3.558 969 HD2 PHE 133 2HD PHE 133 -2.160 10.177 -1.254 970 HE1 PHE 133 1HE PHE 133 -4.721 13.309 -4.056 971 HE2 PHE 133 2HE PHE 133 -1.244 12.403 -1.753 972 HZ PHE 133 HZ PHE 133 -2.530 13.976 -3.147 973 H ARG 134 H ARG 134 -6.777 6.921 -2.235 974 HA ARG 134 HA ARG 134 -6.574 5.642 0.380 975 HB2 ARG 134 2HB ARG 134 -8.733 4.547 0.120 976 HB3 ARG 134 1HB ARG 134 -8.905 6.290 0.061 977 HG2 ARG 134 2HG ARG 134 -8.947 6.059 -2.463 978 HG3 ARG 134 1HG ARG 134 -9.099 4.325 -2.200 979 HD2 ARG 134 2HD ARG 134 -10.986 6.464 -1.216 980 HD3 ARG 134 1HD ARG 134 -11.286 5.325 -2.522 981 HE ARG 134 HE ARG 134 -10.748 3.842 -0.238 982 HH11 ARG 134 1HH1 ARG 134 -13.269 6.077 -1.375 983 HH12 ARG 134 2HH1 ARG 134 -14.462 5.432 -0.339 984 HH21 ARG 134 1HH2 ARG 134 -12.425 3.040 1.213 985 HH22 ARG 134 2HH2 ARG 134 -13.983 3.730 1.125 986 H LEU 135 H LEU 135 -5.931 3.665 0.528 987 HA LEU 135 HA LEU 135 -5.211 2.162 -1.882 988 HB2 LEU 135 2HB LEU 135 -3.289 3.284 -0.881 989 HB3 LEU 135 1HB LEU 135 -3.736 2.733 0.700 990 HG LEU 135 HG LEU 135 -2.795 0.809 -1.445 991 HD11 LEU 135 1HD1 LEU 135 -1.184 2.309 0.630 992 HD12 LEU 135 2HD1 LEU 135 -1.098 2.560 -1.110 993 HD13 LEU 135 3HD1 LEU 135 -0.572 1.028 -0.412 994 HD21 LEU 135 3HD2 LEU 135 -2.873 0.716 1.583 995 HD22 LEU 135 1HD2 LEU 135 -2.147 -0.525 0.566 996 HD23 LEU 135 2HD2 LEU 135 -3.881 -0.222 0.489 997 H VAL 136 H VAL 136 -5.744 -0.057 -1.703 998 HA VAL 136 HA VAL 136 -6.980 -0.817 0.841 999 HB VAL 136 HB VAL 136 -8.655 -0.720 -0.975 1000 HG11 VAL 136 1HG1 VAL 136 -7.314 -1.144 -2.887 1001 HG12 VAL 136 2HG1 VAL 136 -8.632 -2.316 -2.835 1002 HG13 VAL 136 3HG1 VAL 136 -7.002 -2.796 -2.355 1003 HG21 VAL 136 3HG2 VAL 136 -9.622 -2.985 -0.749 1004 HG22 VAL 136 1HG2 VAL 136 -9.066 -2.320 0.790 1005 HG23 VAL 136 2HG2 VAL 136 -8.103 -3.535 -0.048 1006 H PHE 137 H PHE 137 -6.452 -2.797 1.757 1007 HA PHE 137 HA PHE 137 -3.986 -3.973 0.650 1008 HB2 PHE 137 2HB PHE 137 -3.579 -2.617 2.638 1009 HB3 PHE 137 1HB PHE 137 -4.798 -3.515 3.527 1010 HD1 PHE 137 2HD PHE 137 -1.486 -3.770 1.914 1011 HD2 PHE 137 1HD PHE 137 -4.248 -5.510 4.642 1012 HE1 PHE 137 2HE PHE 137 0.259 -5.316 2.691 1013 HE2 PHE 137 1HE PHE 137 -2.513 -7.059 5.429 1014 HZ PHE 137 HZ PHE 137 -0.255 -6.967 4.452 1015 H LEU 138 H LEU 138 -4.165 -6.083 0.101 1016 HA LEU 138 HA LEU 138 -6.143 -7.725 1.546 1017 HB2 LEU 138 2HB LEU 138 -5.542 -7.869 -1.406 1018 HB3 LEU 138 1HB LEU 138 -6.525 -9.005 -0.529 1019 HG LEU 138 HG LEU 138 -7.988 -7.744 -1.700 1020 HD11 LEU 138 1HD1 LEU 138 -7.978 -6.527 1.019 1021 HD12 LEU 138 2HD1 LEU 138 -8.781 -8.011 0.503 1022 HD13 LEU 138 3HD1 LEU 138 -9.322 -6.450 -0.120 1023 HD21 LEU 138 3HD2 LEU 138 -6.559 -5.221 -0.878 1024 HD22 LEU 138 1HD2 LEU 138 -8.047 -5.275 -1.821 1025 HD23 LEU 138 2HD2 LEU 138 -6.562 -5.955 -2.482 1026 H ALA 139 H ALA 139 -5.523 -9.714 2.041 1027 HA ALA 139 HA ALA 139 -2.825 -10.670 1.273 1028 HB1 ALA 139 1HB ALA 139 -3.260 -10.624 3.704 1029 HB2 ALA 139 2HB ALA 139 -3.149 -12.296 3.152 1030 HB3 ALA 139 3HB ALA 139 -4.727 -11.577 3.470 1031 H GLY 140 H GLY 140 -4.503 -10.595 -0.599 1032 HA2 GLY 140 2HA GLY 140 -6.658 -12.370 -0.827 1033 HA3 GLY 140 1HA GLY 140 -5.901 -11.512 -2.143 1034 HA PRO 141 HA PRO 141 -4.579 -15.205 -3.844 1035 HB2 PRO 141 2HB PRO 141 -1.827 -14.799 -4.273 1036 HB3 PRO 141 1HB PRO 141 -3.173 -14.528 -5.380 1037 HG2 PRO 141 2HG PRO 141 -1.571 -12.512 -4.272 1038 HG3 PRO 141 1HG PRO 141 -3.160 -12.269 -5.012 1039 HD2 PRO 141 2HD PRO 141 -2.415 -12.442 -2.138 1040 HD3 PRO 141 1HD PRO 141 -3.701 -11.505 -2.920 1041 H ALA 142 H ALA 142 -4.495 -17.022 -2.928 1042 HA ALA 142 HA ALA 142 -2.220 -17.700 -1.200 1043 HB1 ALA 142 1HB ALA 142 -4.963 -18.973 -1.342 1044 HB2 ALA 142 2HB ALA 142 -4.395 -17.901 -0.066 1045 HB3 ALA 142 3HB ALA 142 -3.653 -19.488 -0.280 1046 H GLU 143 H GLU 143 -0.688 -18.560 -2.671 1047 HA GLU 143 HA GLU 143 -1.744 -20.531 -4.472 1048 HB2 GLU 143 2HB GLU 143 0.755 -18.869 -4.549 1049 HB3 GLU 143 1HB GLU 143 0.280 -20.077 -5.729 1050 HG2 GLU 143 2HG GLU 143 -1.850 -18.665 -6.024 1051 HG3 GLU 143 1HG GLU 143 -0.971 -17.416 -5.155 Start of MODEL 5 1 H1 MET 1 1HT MET 1 -7.086 -77.455 30.576 2 H2 MET 1 2HT MET 1 -6.564 -77.777 29.003 3 H3 MET 1 3HT MET 1 -7.301 -76.282 29.404 4 HA MET 1 HA MET 1 -4.713 -77.141 30.509 5 HB2 MET 1 2HB MET 1 -5.447 -74.923 28.560 6 HB3 MET 1 1HB MET 1 -3.842 -75.226 29.184 7 HG2 MET 1 2HG MET 1 -3.781 -77.344 27.970 8 HG3 MET 1 1HG MET 1 -5.411 -77.039 27.373 9 HE1 MET 1 2HE MET 1 -4.768 -77.277 24.849 10 HE2 MET 1 3HE MET 1 -3.160 -77.754 25.389 11 HE3 MET 1 1HE MET 1 -3.344 -76.531 24.131 12 H SER 2 H SER 2 -3.879 -74.564 31.081 13 HA SER 2 HA SER 2 -5.562 -73.609 33.113 14 HB2 SER 2 2HB SER 2 -4.018 -71.586 32.865 15 HB3 SER 2 1HB SER 2 -3.203 -73.126 33.171 16 HG SER 2 HG SER 2 -2.307 -71.839 31.456 17 H ASP 3 H ASP 3 -4.865 -72.675 29.817 18 HA ASP 3 HA ASP 3 -6.035 -71.824 28.108 19 HB2 ASP 3 2HB ASP 3 -8.437 -72.412 29.831 20 HB3 ASP 3 1HB ASP 3 -8.569 -71.720 28.222 21 H ASN 4 H ASN 4 -5.528 -70.200 30.792 22 HA ASN 4 HA ASN 4 -6.961 -67.874 29.849 23 HB2 ASN 4 2HB ASN 4 -6.380 -66.807 32.019 24 HB3 ASN 4 1HB ASN 4 -7.306 -68.280 32.220 25 HD21 ASN 4 1HD2 ASN 4 -5.451 -66.774 33.954 26 HD22 ASN 4 2HD2 ASN 4 -4.312 -67.946 34.526 27 H ASN 5 H ASN 5 -5.927 -66.916 28.346 28 HA ASN 5 HA ASN 5 -3.032 -66.800 28.359 29 HB2 ASN 5 2HB ASN 5 -5.040 -65.696 26.365 30 HB3 ASN 5 1HB ASN 5 -3.292 -65.622 26.180 31 HD21 ASN 5 1HD2 ASN 5 -2.166 -67.501 25.685 32 HD22 ASN 5 2HD2 ASN 5 -2.945 -68.939 25.144 33 H GLY 6 H GLY 6 -2.130 -65.333 29.538 34 HA2 GLY 6 2HA GLY 6 -3.463 -63.130 30.674 35 HA3 GLY 6 1HA GLY 6 -1.721 -63.376 30.651 36 H THR 7 H THR 7 -4.236 -61.529 29.510 37 HA THR 7 HA THR 7 -2.798 -60.678 27.143 38 HB THR 7 HB THR 7 -5.157 -61.163 26.772 39 HG1 THR 7 1HG THR 7 -5.642 -58.568 26.512 40 HG21 THR 7 3HG2 THR 7 -6.961 -59.836 27.825 41 HG22 THR 7 1HG2 THR 7 -5.765 -59.058 28.863 42 HG23 THR 7 2HG2 THR 7 -6.069 -60.791 29.008 43 HA PRO 8 HA PRO 8 -1.301 -57.076 29.356 44 HB2 PRO 8 2HB PRO 8 -1.193 -55.823 26.679 45 HB3 PRO 8 1HB PRO 8 0.115 -56.077 27.839 46 HG2 PRO 8 2HG PRO 8 -0.058 -57.504 25.578 47 HG3 PRO 8 1HG PRO 8 0.542 -58.217 27.088 48 HD2 PRO 8 2HD PRO 8 -2.129 -58.518 25.785 49 HD3 PRO 8 1HD PRO 8 -1.138 -59.711 26.656 50 H GLU 9 H GLU 9 -2.433 -55.421 30.168 51 HA GLU 9 HA GLU 9 -4.913 -54.744 28.808 52 HB2 GLU 9 2HB GLU 9 -4.116 -54.519 31.716 53 HB3 GLU 9 1HB GLU 9 -5.641 -53.916 31.062 54 HG2 GLU 9 2HG GLU 9 -6.264 -56.153 30.366 55 HG3 GLU 9 1HG GLU 9 -4.725 -56.778 30.934 56 HA PRO 10 HA PRO 10 -3.669 -50.826 27.345 57 HB2 PRO 10 2HB PRO 10 -5.797 -49.673 28.992 58 HB3 PRO 10 1HB PRO 10 -5.503 -49.470 27.271 59 HG2 PRO 10 2HG PRO 10 -7.453 -51.138 28.308 60 HG3 PRO 10 1HG PRO 10 -6.733 -51.295 26.701 61 HD2 PRO 10 2HD PRO 10 -6.467 -53.053 28.975 62 HD3 PRO 10 1HD PRO 10 -5.843 -53.267 27.329 63 H GLN 11 H GLN 11 -1.957 -50.028 28.105 64 HA GLN 11 HA GLN 11 -1.341 -49.674 30.817 65 HB2 GLN 11 2HB GLN 11 0.703 -48.494 29.997 66 HB3 GLN 11 1HB GLN 11 0.460 -50.089 29.317 67 HG2 GLN 11 2HG GLN 11 -0.447 -49.028 27.274 68 HG3 GLN 11 1HG GLN 11 -0.060 -47.455 27.972 69 HE21 GLN 11 1HE2 GLN 11 2.071 -46.846 28.187 70 HE22 GLN 11 2HE2 GLN 11 3.350 -47.626 27.352 71 H VAL 12 H VAL 12 -1.789 -48.168 32.136 72 HA VAL 12 HA VAL 12 -3.223 -45.879 31.151 73 HB VAL 12 HB VAL 12 -4.254 -47.084 32.997 74 HG11 VAL 12 1HG1 VAL 12 -1.834 -46.389 34.643 75 HG12 VAL 12 2HG1 VAL 12 -2.336 -47.998 34.126 76 HG13 VAL 12 3HG1 VAL 12 -3.324 -47.092 35.267 77 HG21 VAL 12 3HG2 VAL 12 -4.688 -45.214 34.542 78 HG22 VAL 12 1HG2 VAL 12 -4.725 -44.715 32.849 79 HG23 VAL 12 2HG2 VAL 12 -3.315 -44.347 33.844 80 H GLU 13 H GLU 13 -2.380 -44.052 30.787 81 HA GLU 13 HA GLU 13 0.020 -43.229 32.232 82 HB2 GLU 13 2HB GLU 13 0.521 -43.770 29.861 83 HB3 GLU 13 1HB GLU 13 -0.738 -42.657 29.348 84 HG2 GLU 13 2HG GLU 13 1.503 -41.710 29.095 85 HG3 GLU 13 1HG GLU 13 0.510 -40.783 30.217 86 H THR 14 H THR 14 -0.023 -41.123 32.920 87 HA THR 14 HA THR 14 -2.698 -40.035 33.105 88 HB THR 14 HB THR 14 -1.411 -40.175 35.188 89 HG1 THR 14 1HG THR 14 -2.037 -38.334 35.918 90 HG21 THR 14 3HG2 THR 14 0.859 -39.978 34.303 91 HG22 THR 14 1HG2 THR 14 0.593 -38.786 35.573 92 HG23 THR 14 2HG2 THR 14 0.566 -38.292 33.880 93 H THR 15 H THR 15 -3.346 -38.148 32.118 94 HA THR 15 HA THR 15 -1.553 -37.158 30.082 95 HB THR 15 HB THR 15 -3.673 -36.006 29.317 96 HG1 THR 15 1HG THR 15 -5.207 -35.997 30.738 97 HG21 THR 15 3HG2 THR 15 -2.949 -38.169 28.371 98 HG22 THR 15 1HG2 THR 15 -4.708 -38.079 28.483 99 HG23 THR 15 2HG2 THR 15 -3.797 -39.011 29.667 100 H SER 16 H SER 16 -1.533 -36.546 33.069 101 HA SER 16 HA SER 16 -2.220 -33.787 33.288 102 HB2 SER 16 2HB SER 16 -0.688 -35.545 35.191 103 HB3 SER 16 1HB SER 16 -1.442 -33.992 35.563 104 HG SER 16 HG SER 16 -2.575 -36.494 35.134 105 H VAL 17 H VAL 17 -0.989 -32.610 31.916 106 HA VAL 17 HA VAL 17 1.795 -32.317 32.702 107 HB VAL 17 HB VAL 17 2.239 -31.500 30.336 108 HG11 VAL 17 1HG1 VAL 17 1.368 -34.384 30.601 109 HG12 VAL 17 2HG1 VAL 17 2.952 -33.735 31.026 110 HG13 VAL 17 3HG1 VAL 17 2.427 -33.751 29.343 111 HG21 VAL 17 3HG2 VAL 17 -0.404 -32.830 29.747 112 HG22 VAL 17 1HG2 VAL 17 0.713 -32.173 28.550 113 HG23 VAL 17 2HG2 VAL 17 -0.101 -31.095 29.691 114 H PHE 18 H PHE 18 2.479 -30.171 32.901 115 HA PHE 18 HA PHE 18 0.279 -28.389 33.490 116 HB2 PHE 18 2HB PHE 18 2.383 -28.797 34.946 117 HB3 PHE 18 1HB PHE 18 3.218 -27.766 33.797 118 HD1 PHE 18 1HD PHE 18 0.112 -27.740 35.857 119 HD2 PHE 18 2HD PHE 18 3.434 -25.539 34.370 120 HE1 PHE 18 1HE PHE 18 -0.593 -25.795 37.184 121 HE2 PHE 18 2HE PHE 18 2.730 -23.589 35.695 122 HZ PHE 18 HZ PHE 18 0.716 -23.714 37.100 123 H ARG 19 H ARG 19 0.198 -26.180 32.671 124 HA ARG 19 HA ARG 19 1.138 -26.007 29.883 125 HB2 ARG 19 2HB ARG 19 -1.227 -24.728 31.260 126 HB3 ARG 19 1HB ARG 19 -0.837 -24.589 29.558 127 HG2 ARG 19 2HG ARG 19 -1.423 -26.795 29.120 128 HG3 ARG 19 1HG ARG 19 -1.367 -27.239 30.833 129 HD2 ARG 19 2HD ARG 19 -3.335 -25.353 29.565 130 HD3 ARG 19 1HD ARG 19 -3.653 -27.037 30.000 131 HE ARG 19 HE ARG 19 -2.786 -25.155 32.084 132 HH11 ARG 19 1HH1 ARG 19 -5.300 -27.307 30.805 133 HH12 ARG 19 2HH1 ARG 19 -6.300 -27.139 32.171 134 HH21 ARG 19 1HH2 ARG 19 -4.161 -24.914 33.870 135 HH22 ARG 19 2HH2 ARG 19 -5.624 -25.817 33.993 136 H ALA 20 H ALA 20 0.603 -23.314 29.545 137 HA ALA 20 HA ALA 20 2.615 -22.019 31.181 138 HB1 ALA 20 1HB ALA 20 2.586 -21.653 28.749 139 HB2 ALA 20 2HB ALA 20 2.330 -20.137 29.615 140 HB3 ALA 20 3HB ALA 20 0.966 -20.963 28.865 141 H ASP 21 H ASP 21 0.412 -22.831 32.599 142 HA ASP 21 HA ASP 21 -1.726 -21.123 33.035 143 HB2 ASP 21 2HB ASP 21 -0.258 -22.954 34.911 144 HB3 ASP 21 1HB ASP 21 -1.690 -22.058 35.388 145 H LEU 22 H LEU 22 1.474 -21.090 34.505 146 HA LEU 22 HA LEU 22 0.775 -18.689 35.977 147 HB2 LEU 22 2HB LEU 22 3.324 -20.315 35.930 148 HB3 LEU 22 1HB LEU 22 3.026 -18.933 36.961 149 HG LEU 22 HG LEU 22 1.530 -21.551 37.087 150 HD11 LEU 22 1HD1 LEU 22 3.827 -21.772 37.838 151 HD12 LEU 22 2HD1 LEU 22 2.711 -21.843 39.207 152 HD13 LEU 22 3HD1 LEU 22 3.630 -20.377 38.896 153 HD21 LEU 22 3HD2 LEU 22 0.594 -20.644 39.166 154 HD22 LEU 22 1HD2 LEU 22 0.145 -19.664 37.769 155 HD23 LEU 22 2HD2 LEU 22 1.413 -19.111 38.862 156 H LEU 23 H LEU 23 0.761 -17.007 34.717 157 HA LEU 23 HA LEU 23 2.200 -16.685 32.325 158 HB2 LEU 23 2HB LEU 23 0.082 -15.469 33.373 159 HB3 LEU 23 1HB LEU 23 1.285 -14.360 33.976 160 HG LEU 23 HG LEU 23 0.665 -14.941 31.081 161 HD11 LEU 23 1HD1 LEU 23 -0.140 -12.655 31.047 162 HD12 LEU 23 2HD1 LEU 23 0.187 -12.513 32.772 163 HD13 LEU 23 3HD1 LEU 23 -1.031 -13.652 32.194 164 HD21 LEU 23 3HD2 LEU 23 2.179 -13.104 30.543 165 HD22 LEU 23 1HD2 LEU 23 3.041 -14.418 31.343 166 HD23 LEU 23 2HD2 LEU 23 2.619 -12.964 32.247 167 H LYS 24 H LYS 24 4.296 -16.271 32.097 168 HA LYS 24 HA LYS 24 6.025 -15.784 34.320 169 HB2 LYS 24 2HB LYS 24 7.827 -15.849 32.654 170 HB3 LYS 24 1HB LYS 24 6.732 -17.208 32.452 171 HG2 LYS 24 2HG LYS 24 5.633 -15.985 30.586 172 HG3 LYS 24 1HG LYS 24 6.827 -14.704 30.764 173 HD2 LYS 24 2HD LYS 24 7.460 -17.590 30.115 174 HD3 LYS 24 1HD LYS 24 7.353 -16.296 28.930 175 HE2 LYS 24 2HE LYS 24 9.319 -16.418 31.230 176 HE3 LYS 24 1HE LYS 24 9.675 -16.833 29.563 177 HZ1 LYS 24 3HZ LYS 24 10.437 -14.634 29.990 178 HZ2 LYS 24 1HZ LYS 24 8.934 -14.109 30.561 179 HZ3 LYS 24 2HZ LYS 24 9.143 -14.526 28.945 180 H GLU 25 H GLU 25 7.901 -14.061 33.716 181 HA GLU 25 HA GLU 25 6.552 -11.524 33.638 182 HB2 GLU 25 2HB GLU 25 8.397 -11.920 35.238 183 HB3 GLU 25 1HB GLU 25 9.499 -12.188 33.897 184 HG2 GLU 25 2HG GLU 25 9.705 -9.945 34.928 185 HG3 GLU 25 1HG GLU 25 9.323 -9.902 33.206 186 H MET 26 H MET 26 7.027 -9.900 32.099 187 HA MET 26 HA MET 26 7.252 -11.018 29.448 188 HB2 MET 26 2HB MET 26 5.474 -9.385 29.887 189 HB3 MET 26 1HB MET 26 6.679 -8.194 30.357 190 HG2 MET 26 2HG MET 26 7.588 -8.214 28.084 191 HG3 MET 26 1HG MET 26 6.383 -9.401 27.608 192 HE1 MET 26 3HE MET 26 5.390 -5.045 28.809 193 HE2 MET 26 1HE MET 26 7.023 -5.703 28.772 194 HE3 MET 26 2HE MET 26 5.873 -6.259 29.992 195 H GLU 27 H GLU 27 9.113 -11.209 28.560 196 HA GLU 27 HA GLU 27 11.333 -9.536 29.330 197 HB2 GLU 27 2HB GLU 27 11.079 -11.881 27.444 198 HB3 GLU 27 1HB GLU 27 12.584 -10.995 27.685 199 HG2 GLU 27 2HG GLU 27 12.671 -11.610 29.989 200 HG3 GLU 27 1HG GLU 27 11.052 -12.293 29.925 201 H SER 28 H SER 28 12.716 -8.679 27.382 202 HA SER 28 HA SER 28 11.361 -6.517 26.423 203 HB2 SER 28 2HB SER 28 13.833 -7.731 25.207 204 HB3 SER 28 1HB SER 28 13.302 -6.057 25.070 205 HG SER 28 HG SER 28 13.446 -5.912 27.352 206 H SER 29 H SER 29 11.707 -9.653 24.812 207 HA SER 29 HA SER 29 10.846 -10.505 22.888 208 HB2 SER 29 2HB SER 29 8.737 -8.350 23.294 209 HB3 SER 29 1HB SER 29 8.543 -9.838 22.365 210 HG SER 29 HG SER 29 8.980 -9.598 25.160 211 H THR 30 H THR 30 12.904 -9.057 22.419 212 HA THR 30 HA THR 30 12.800 -6.673 21.060 213 HB THR 30 HB THR 30 14.851 -8.852 20.790 214 HG1 THR 30 1HG THR 30 15.441 -8.400 22.743 215 HG21 THR 30 3HG2 THR 30 15.112 -6.951 19.218 216 HG22 THR 30 1HG2 THR 30 16.410 -7.011 20.413 217 HG23 THR 30 2HG2 THR 30 15.109 -5.842 20.595 218 H GLY 31 H GLY 31 11.788 -6.329 19.190 219 HA2 GLY 31 2HA GLY 31 11.746 -8.319 17.096 220 HA3 GLY 31 1HA GLY 31 11.027 -6.703 17.029 221 H THR 32 H THR 32 13.818 -8.592 16.418 222 HA THR 32 HA THR 32 15.714 -6.528 16.309 223 HB THR 32 HB THR 32 17.021 -8.236 14.978 224 HG1 THR 32 1HG THR 32 15.888 -10.392 15.236 225 HG21 THR 32 3HG2 THR 32 15.767 -9.142 17.573 226 HG22 THR 32 1HG2 THR 32 17.202 -8.133 17.415 227 HG23 THR 32 2HG2 THR 32 17.235 -9.814 16.869 228 H ALA 33 H ALA 33 16.637 -5.548 14.462 229 HA ALA 33 HA ALA 33 14.820 -4.712 12.488 230 HB1 ALA 33 1HB ALA 33 16.787 -3.386 13.105 231 HB2 ALA 33 2HB ALA 33 16.803 -3.736 11.374 232 HB3 ALA 33 3HB ALA 33 17.839 -4.648 12.471 233 HA PRO 34 HA PRO 34 14.483 -8.464 10.179 234 HB2 PRO 34 2HB PRO 34 14.198 -6.635 7.904 235 HB3 PRO 34 1HB PRO 34 13.152 -7.973 8.380 236 HG2 PRO 34 2HG PRO 34 12.428 -5.412 8.859 237 HG3 PRO 34 1HG PRO 34 12.021 -6.729 9.968 238 HD2 PRO 34 2HD PRO 34 14.000 -4.557 10.278 239 HD3 PRO 34 1HD PRO 34 13.160 -5.515 11.511 240 H ALA 35 H ALA 35 16.267 -9.425 9.967 241 HA ALA 35 HA ALA 35 18.271 -8.509 8.038 242 HB1 ALA 35 1HB ALA 35 18.496 -10.544 10.273 243 HB2 ALA 35 2HB ALA 35 19.165 -8.911 10.295 244 HB3 ALA 35 3HB ALA 35 19.795 -10.108 9.162 245 H SER 36 H SER 36 17.514 -9.254 6.183 246 HA SER 36 HA SER 36 16.434 -11.954 6.173 247 HB2 SER 36 2HB SER 36 14.848 -10.195 5.541 248 HB3 SER 36 1HB SER 36 15.935 -9.679 4.256 249 HG SER 36 HG SER 36 14.278 -11.900 4.420 250 H THR 37 H THR 37 17.187 -13.438 4.843 251 HA THR 37 HA THR 37 19.642 -12.981 3.392 252 HB THR 37 HB THR 37 17.987 -15.500 3.790 253 HG1 THR 37 1HG THR 37 19.559 -14.064 5.505 254 HG21 THR 37 3HG2 THR 37 20.918 -15.108 3.137 255 HG22 THR 37 1HG2 THR 37 19.683 -15.664 2.007 256 HG23 THR 37 2HG2 THR 37 20.127 -16.659 3.396 257 H GLY 38 H GLY 38 16.234 -13.165 3.000 258 HA2 GLY 38 2HA GLY 38 15.922 -12.244 0.488 259 HA3 GLY 38 1HA GLY 38 16.151 -13.978 0.256 260 H ALA 39 H ALA 39 14.008 -11.512 1.336 261 HA ALA 39 HA ALA 39 12.240 -13.041 2.899 262 HB1 ALA 39 1HB ALA 39 12.286 -10.599 2.940 263 HB2 ALA 39 2HB ALA 39 10.659 -11.215 2.635 264 HB3 ALA 39 3HB ALA 39 11.617 -10.560 1.308 265 H GLU 40 H GLU 40 12.591 -12.783 -0.484 266 HA GLU 40 HA GLU 40 10.082 -13.697 -1.302 267 HB2 GLU 40 2HB GLU 40 11.197 -14.293 -3.443 268 HB3 GLU 40 1HB GLU 40 11.533 -12.661 -2.902 269 HG2 GLU 40 2HG GLU 40 13.705 -13.482 -2.013 270 HG3 GLU 40 1HG GLU 40 13.360 -15.039 -2.773 271 H ASN 41 H ASN 41 12.470 -15.333 0.369 272 HA ASN 41 HA ASN 41 12.103 -18.011 -0.375 273 HB2 ASN 41 2HB ASN 41 13.902 -17.404 1.109 274 HB3 ASN 41 1HB ASN 41 12.787 -16.704 2.265 275 HD21 ASN 41 1HD2 ASN 41 11.843 -18.015 3.804 276 HD22 ASN 41 2HD2 ASN 41 12.195 -19.692 3.942 277 H LEU 42 H LEU 42 10.205 -15.803 1.508 278 HA LEU 42 HA LEU 42 8.264 -17.911 2.146 279 HB2 LEU 42 2HB LEU 42 9.483 -16.714 4.042 280 HB3 LEU 42 1HB LEU 42 8.700 -15.244 3.535 281 HG LEU 42 HG LEU 42 7.214 -17.673 4.585 282 HD11 LEU 42 1HD1 LEU 42 8.689 -16.819 6.299 283 HD12 LEU 42 2HD1 LEU 42 7.014 -16.406 6.673 284 HD13 LEU 42 3HD1 LEU 42 8.099 -15.181 6.020 285 HD21 LEU 42 3HD2 LEU 42 6.362 -14.798 4.251 286 HD22 LEU 42 1HD2 LEU 42 5.389 -16.097 4.940 287 HD23 LEU 42 2HD2 LEU 42 5.846 -16.145 3.237 288 HA PRO 43 HA PRO 43 6.094 -15.097 -0.764 289 HB2 PRO 43 2HB PRO 43 5.263 -16.942 -2.529 290 HB3 PRO 43 1HB PRO 43 6.923 -16.343 -2.515 291 HG2 PRO 43 2HG PRO 43 5.888 -18.977 -1.704 292 HG3 PRO 43 1HG PRO 43 7.534 -18.510 -2.153 293 HD2 PRO 43 2HD PRO 43 6.397 -18.825 0.498 294 HD3 PRO 43 1HD PRO 43 8.082 -18.480 0.052 295 H ALA 44 H ALA 44 4.993 -17.233 1.479 296 HA ALA 44 HA ALA 44 2.187 -16.935 0.644 297 HB1 ALA 44 1HB ALA 44 1.646 -18.826 2.073 298 HB2 ALA 44 2HB ALA 44 3.293 -18.886 2.675 299 HB3 ALA 44 3HB ALA 44 2.957 -19.283 0.984 300 H GLY 45 H GLY 45 3.931 -15.052 1.947 301 HA2 GLY 45 2HA GLY 45 2.105 -14.275 4.105 302 HA3 GLY 45 1HA GLY 45 3.817 -14.398 4.503 303 H SER 46 H SER 46 2.645 -13.426 1.419 304 HA SER 46 HA SER 46 3.898 -10.829 1.795 305 HB2 SER 46 2HB SER 46 3.026 -12.218 -0.746 306 HB3 SER 46 1HB SER 46 4.106 -10.824 -0.592 307 HG SER 46 HG SER 46 5.536 -12.216 0.597 308 H ALA 47 H ALA 47 2.664 -9.004 0.675 309 HA ALA 47 HA ALA 47 -0.221 -9.450 0.664 310 HB1 ALA 47 1HB ALA 47 1.172 -7.287 2.245 311 HB2 ALA 47 2HB ALA 47 0.333 -8.684 2.919 312 HB3 ALA 47 3HB ALA 47 -0.571 -7.451 2.043 313 H LEU 48 H LEU 48 -1.342 -7.427 -0.277 314 HA LEU 48 HA LEU 48 0.453 -6.078 -2.105 315 HB2 LEU 48 2HB LEU 48 -1.002 -6.534 -4.029 316 HB3 LEU 48 1HB LEU 48 -0.260 -7.974 -3.386 317 HG LEU 48 HG LEU 48 -2.560 -8.260 -2.160 318 HD11 LEU 48 1HD1 LEU 48 -3.526 -6.131 -2.791 319 HD12 LEU 48 2HD1 LEU 48 -4.449 -7.462 -3.498 320 HD13 LEU 48 3HD1 LEU 48 -3.338 -6.529 -4.496 321 HD21 LEU 48 3HD2 LEU 48 -2.193 -8.771 -5.099 322 HD22 LEU 48 1HD2 LEU 48 -3.354 -9.579 -4.047 323 HD23 LEU 48 2HD2 LEU 48 -1.623 -9.795 -3.783 324 H LEU 49 H LEU 49 -0.530 -4.245 -3.188 325 HA LEU 49 HA LEU 49 -2.793 -3.201 -1.687 326 HB2 LEU 49 2HB LEU 49 -1.743 -0.969 -1.585 327 HB3 LEU 49 1HB LEU 49 -0.903 -2.175 -0.662 328 HG LEU 49 HG LEU 49 0.776 -2.321 -2.560 329 HD11 LEU 49 1HD1 LEU 49 1.021 -0.404 -4.026 330 HD12 LEU 49 2HD1 LEU 49 -0.489 0.271 -3.427 331 HD13 LEU 49 3HD1 LEU 49 -0.494 -1.251 -4.325 332 HD21 LEU 49 3HD2 LEU 49 0.542 0.279 -1.061 333 HD22 LEU 49 1HD2 LEU 49 2.009 -0.358 -1.796 334 HD23 LEU 49 2HD2 LEU 49 1.256 -1.212 -0.446 335 H VAL 50 H VAL 50 -4.151 -1.838 -2.742 336 HA VAL 50 HA VAL 50 -3.752 -1.613 -5.644 337 HB VAL 50 HB VAL 50 -6.398 -2.096 -4.239 338 HG11 VAL 50 1HG1 VAL 50 -7.315 -2.425 -6.468 339 HG12 VAL 50 2HG1 VAL 50 -5.750 -2.035 -7.176 340 HG13 VAL 50 3HG1 VAL 50 -6.636 -0.811 -6.266 341 HG21 VAL 50 3HG2 VAL 50 -4.779 -4.049 -5.877 342 HG22 VAL 50 1HG2 VAL 50 -6.400 -4.337 -5.248 343 HG23 VAL 50 2HG2 VAL 50 -5.044 -4.128 -4.138 344 H VAL 51 H VAL 51 -3.757 0.464 -6.237 345 HA VAL 51 HA VAL 51 -4.766 2.500 -4.371 346 HB VAL 51 HB VAL 51 -3.383 2.947 -7.008 347 HG11 VAL 51 1HG1 VAL 51 -2.757 5.104 -6.033 348 HG12 VAL 51 2HG1 VAL 51 -3.643 4.692 -4.565 349 HG13 VAL 51 3HG1 VAL 51 -4.507 4.886 -6.090 350 HG21 VAL 51 3HG2 VAL 51 -1.858 1.574 -5.780 351 HG22 VAL 51 1HG2 VAL 51 -2.117 2.526 -4.314 352 HG23 VAL 51 2HG2 VAL 51 -1.293 3.249 -5.676 353 H LYS 52 H LYS 52 -6.715 3.183 -4.582 354 HA LYS 52 HA LYS 52 -8.100 2.674 -7.082 355 HB2 LYS 52 2HB LYS 52 -9.117 3.589 -4.401 356 HB3 LYS 52 1HB LYS 52 -10.136 3.415 -5.821 357 HG2 LYS 52 2HG LYS 52 -8.610 1.209 -4.439 358 HG3 LYS 52 1HG LYS 52 -10.360 1.467 -4.399 359 HD2 LYS 52 2HD LYS 52 -10.376 1.192 -6.884 360 HD3 LYS 52 1HD LYS 52 -8.671 0.774 -6.800 361 HE2 LYS 52 2HE LYS 52 -9.224 -1.135 -5.359 362 HE3 LYS 52 1HE LYS 52 -10.934 -0.721 -5.504 363 HZ1 LYS 52 3HZ LYS 52 -9.149 -1.518 -7.747 364 HZ2 LYS 52 1HZ LYS 52 -10.743 -1.023 -7.909 365 HZ3 LYS 52 2HZ LYS 52 -10.379 -2.436 -7.087 366 H ARG 53 H ARG 53 -6.894 5.341 -5.210 367 HA ARG 53 HA ARG 53 -7.163 6.986 -7.521 368 HB2 ARG 53 2HB ARG 53 -9.403 7.282 -6.485 369 HB3 ARG 53 1HB ARG 53 -8.632 7.824 -5.001 370 HG2 ARG 53 2HG ARG 53 -9.470 9.712 -6.314 371 HG3 ARG 53 1HG ARG 53 -7.712 9.763 -6.162 372 HD2 ARG 53 2HD ARG 53 -7.508 8.744 -8.400 373 HD3 ARG 53 1HD ARG 53 -9.265 8.752 -8.551 374 HE ARG 53 HE ARG 53 -8.823 11.293 -8.145 375 HH11 ARG 53 1HH1 ARG 53 -7.002 9.068 -10.208 376 HH12 ARG 53 2HH1 ARG 53 -6.529 10.247 -11.331 377 HH21 ARG 53 1HH2 ARG 53 -8.205 12.930 -9.716 378 HH22 ARG 53 2HH2 ARG 53 -7.238 12.512 -11.048 379 H GLY 54 H GLY 54 -5.439 8.244 -7.646 380 HA2 GLY 54 2HA GLY 54 -4.369 10.030 -6.145 381 HA3 GLY 54 1HA GLY 54 -3.857 8.615 -5.244 382 HA PRO 55 HA PRO 55 -1.111 9.530 -9.267 383 HB2 PRO 55 2HB PRO 55 0.238 11.540 -7.513 384 HB3 PRO 55 1HB PRO 55 -0.045 11.598 -9.256 385 HG2 PRO 55 2HG PRO 55 -1.511 13.091 -7.653 386 HG3 PRO 55 1HG PRO 55 -2.280 12.222 -8.995 387 HD2 PRO 55 2HD PRO 55 -2.206 11.519 -6.084 388 HD3 PRO 55 1HD PRO 55 -3.581 11.488 -7.221 389 H ASN 56 H ASN 56 -0.913 9.070 -5.989 390 HA ASN 56 HA ASN 56 1.341 8.014 -4.946 391 HB2 ASN 56 2HB ASN 56 -0.893 7.835 -3.974 392 HB3 ASN 56 1HB ASN 56 -1.405 6.755 -5.250 393 HD21 ASN 56 1HD2 ASN 56 0.183 7.077 -2.259 394 HD22 ASN 56 2HD2 ASN 56 0.408 5.384 -1.974 395 H ALA 57 H ALA 57 -0.752 6.320 -7.275 396 HA ALA 57 HA ALA 57 1.329 5.300 -8.853 397 HB1 ALA 57 1HB ALA 57 1.625 3.746 -6.910 398 HB2 ALA 57 2HB ALA 57 1.183 2.924 -8.400 399 HB3 ALA 57 3HB ALA 57 -0.033 3.186 -7.156 400 H GLY 58 H GLY 58 -1.869 4.388 -7.669 401 HA2 GLY 58 2HA GLY 58 -3.888 4.276 -8.805 402 HA3 GLY 58 1HA GLY 58 -3.085 4.971 -10.212 403 H ALA 59 H ALA 59 -1.934 2.175 -8.519 404 HA ALA 59 HA ALA 59 -2.770 0.374 -10.634 405 HB1 ALA 59 1HB ALA 59 -0.430 -0.440 -10.856 406 HB2 ALA 59 2HB ALA 59 0.094 0.865 -9.795 407 HB3 ALA 59 3HB ALA 59 -0.606 1.238 -11.368 408 H ARG 60 H ARG 60 -1.580 -1.871 -9.871 409 HA ARG 60 HA ARG 60 -1.809 -2.090 -6.974 410 HB2 ARG 60 2HB ARG 60 -3.155 -4.116 -7.159 411 HB3 ARG 60 1HB ARG 60 -3.987 -2.772 -7.931 412 HG2 ARG 60 2HG ARG 60 -3.194 -3.629 -10.122 413 HG3 ARG 60 1HG ARG 60 -2.520 -5.025 -9.282 414 HD2 ARG 60 2HD ARG 60 -4.808 -5.480 -8.396 415 HD3 ARG 60 1HD ARG 60 -5.416 -4.200 -9.435 416 HE ARG 60 HE ARG 60 -4.122 -6.663 -10.364 417 HH11 ARG 60 1HH1 ARG 60 -6.317 -3.960 -11.048 418 HH12 ARG 60 2HH1 ARG 60 -6.963 -4.672 -12.454 419 HH21 ARG 60 1HH2 ARG 60 -5.070 -7.640 -12.254 420 HH22 ARG 60 2HH2 ARG 60 -6.273 -6.812 -13.125 421 H PHE 61 H PHE 61 -0.340 -3.467 -6.075 422 HA PHE 61 HA PHE 61 1.036 -5.387 -7.642 423 HB2 PHE 61 2HB PHE 61 3.327 -4.466 -7.292 424 HB3 PHE 61 1HB PHE 61 2.350 -3.504 -8.382 425 HD1 PHE 61 2HD PHE 61 1.631 -1.256 -7.739 426 HD2 PHE 61 1HD PHE 61 4.053 -3.623 -5.155 427 HE1 PHE 61 2HE PHE 61 2.202 0.752 -6.441 428 HE2 PHE 61 1HE PHE 61 4.632 -1.613 -3.855 429 HZ PHE 61 HZ PHE 61 3.704 0.575 -4.495 430 H LEU 62 H LEU 62 2.477 -6.696 -6.436 431 HA LEU 62 HA LEU 62 1.594 -6.908 -3.678 432 HB2 LEU 62 2HB LEU 62 1.193 -8.832 -5.145 433 HB3 LEU 62 1HB LEU 62 2.887 -8.911 -5.545 434 HG LEU 62 HG LEU 62 2.002 -9.354 -2.693 435 HD11 LEU 62 1HD1 LEU 62 1.787 -11.738 -3.189 436 HD12 LEU 62 2HD1 LEU 62 2.048 -11.410 -4.901 437 HD13 LEU 62 3HD1 LEU 62 0.597 -10.807 -4.099 438 HD21 LEU 62 3HD2 LEU 62 4.402 -9.179 -3.141 439 HD22 LEU 62 1HD2 LEU 62 4.264 -10.419 -4.389 440 HD23 LEU 62 2HD2 LEU 62 3.975 -10.839 -2.706 441 H LEU 63 H LEU 63 2.960 -6.970 -1.977 442 HA LEU 63 HA LEU 63 5.722 -6.093 -2.438 443 HB2 LEU 63 2HB LEU 63 3.886 -5.669 -0.065 444 HB3 LEU 63 1HB LEU 63 5.572 -5.225 -0.096 445 HG LEU 63 HG LEU 63 5.024 -3.546 -1.892 446 HD11 LEU 63 1HD1 LEU 63 2.954 -4.552 -2.730 447 HD12 LEU 63 2HD1 LEU 63 2.729 -2.881 -2.224 448 HD13 LEU 63 3HD1 LEU 63 2.163 -4.198 -1.191 449 HD21 LEU 63 3HD2 LEU 63 4.006 -1.950 -0.366 450 HD22 LEU 63 1HD2 LEU 63 5.243 -2.911 0.444 451 HD23 LEU 63 2HD2 LEU 63 3.538 -3.269 0.708 452 H ASP 64 H ASP 64 7.249 -7.534 -1.841 453 HA ASP 64 HA ASP 64 6.662 -9.287 0.400 454 HB2 ASP 64 2HB ASP 64 7.507 -11.290 -0.698 455 HB3 ASP 64 1HB ASP 64 6.191 -10.626 -1.642 456 H GLN 65 H GLN 65 8.204 -6.905 -0.068 457 HA GLN 65 HA GLN 65 10.946 -7.805 0.293 458 HB2 GLN 65 2HB GLN 65 9.825 -4.975 0.238 459 HB3 GLN 65 1HB GLN 65 11.526 -5.376 0.376 460 HG2 GLN 65 2HG GLN 65 11.262 -4.773 -1.859 461 HG3 GLN 65 1HG GLN 65 11.236 -6.528 -1.896 462 HE21 GLN 65 1HE2 GLN 65 9.390 -3.651 -2.253 463 HE22 GLN 65 2HE2 GLN 65 8.009 -4.365 -3.006 464 HA PRO 66 HA PRO 66 10.767 -8.000 4.713 465 HB2 PRO 66 2HB PRO 66 13.244 -6.409 4.874 466 HB3 PRO 66 1HB PRO 66 12.931 -8.049 5.442 467 HG2 PRO 66 2HG PRO 66 14.455 -7.519 3.272 468 HG3 PRO 66 1HG PRO 66 13.484 -8.986 3.455 469 HD2 PRO 66 2HD PRO 66 13.022 -6.626 1.732 470 HD3 PRO 66 1HD PRO 66 12.540 -8.313 1.505 471 H THR 67 H THR 67 12.013 -4.963 3.538 472 HA THR 67 HA THR 67 10.058 -3.560 5.189 473 HB THR 67 HB THR 67 12.987 -2.842 4.950 474 HG1 THR 67 1HG THR 67 11.592 -4.369 6.601 475 HG21 THR 67 3HG2 THR 67 12.468 -1.005 6.532 476 HG22 THR 67 1HG2 THR 67 10.753 -1.400 6.437 477 HG23 THR 67 2HG2 THR 67 11.596 -0.807 5.014 478 H THR 68 H THR 68 8.772 -2.986 3.509 479 HA THR 68 HA THR 68 9.976 -1.740 1.177 480 HB THR 68 HB THR 68 7.029 -2.080 1.810 481 HG1 THR 68 1HG THR 68 8.683 -4.007 1.558 482 HG21 THR 68 3HG2 THR 68 6.783 -1.923 -0.648 483 HG22 THR 68 1HG2 THR 68 8.524 -1.710 -0.800 484 HG23 THR 68 2HG2 THR 68 7.551 -0.481 0.007 485 H THR 69 H THR 69 10.477 0.374 1.324 486 HA THR 69 HA THR 69 9.094 1.939 3.366 487 HB THR 69 HB THR 69 11.659 2.659 1.919 488 HG1 THR 69 1HG THR 69 11.562 0.630 3.289 489 HG21 THR 69 3HG2 THR 69 10.463 4.516 3.023 490 HG22 THR 69 1HG2 THR 69 11.976 4.147 3.853 491 HG23 THR 69 2HG2 THR 69 10.438 3.597 4.526 492 H ALA 70 H ALA 70 7.602 3.328 2.781 493 HA ALA 70 HA ALA 70 7.241 4.063 -0.021 494 HB1 ALA 70 1HB ALA 70 5.348 3.041 1.034 495 HB2 ALA 70 2HB ALA 70 4.965 4.772 0.889 496 HB3 ALA 70 3HB ALA 70 5.490 4.108 2.417 497 H GLY 71 H GLY 71 7.641 6.122 -0.701 498 HA2 GLY 71 2HA GLY 71 7.099 8.458 0.778 499 HA3 GLY 71 1HA GLY 71 8.826 8.113 0.855 500 H ARG 72 H ARG 72 10.086 8.725 -0.803 501 HA ARG 72 HA ARG 72 8.873 9.131 -3.423 502 HB2 ARG 72 2HB ARG 72 10.908 11.029 -2.213 503 HB3 ARG 72 1HB ARG 72 10.317 11.089 -3.855 504 HG2 ARG 72 2HG ARG 72 8.695 11.528 -1.377 505 HG3 ARG 72 1HG ARG 72 9.309 12.779 -2.450 506 HD2 ARG 72 2HD ARG 72 7.310 10.629 -3.171 507 HD3 ARG 72 1HD ARG 72 6.951 12.327 -2.897 508 HE ARG 72 HE ARG 72 8.909 11.882 -4.942 509 HH11 ARG 72 1HH1 ARG 72 5.432 12.232 -4.288 510 HH12 ARG 72 2HH1 ARG 72 5.022 12.548 -5.896 511 HH21 ARG 72 1HH2 ARG 72 8.358 12.289 -7.126 512 HH22 ARG 72 2HH2 ARG 72 6.734 12.576 -7.570 513 H HIS 73 H HIS 73 12.195 9.648 -2.249 514 HA HIS 73 HA HIS 73 13.098 7.259 -3.511 515 HB2 HIS 73 2HB HIS 73 13.001 8.569 -5.529 516 HB3 HIS 73 1HB HIS 73 13.776 9.948 -4.799 517 HD1 HIS 73 1HD HIS 73 14.486 7.175 -7.002 518 HD2 HIS 73 2HD HIS 73 16.620 9.298 -4.143 519 HE1 HIS 73 1HE HIS 73 16.920 6.734 -7.469 520 HA PRO 74 HA PRO 74 16.994 9.442 -1.308 521 HB2 PRO 74 2HB PRO 74 15.337 11.345 0.290 522 HB3 PRO 74 1HB PRO 74 17.012 11.497 -0.249 523 HG2 PRO 74 2HG PRO 74 15.095 12.793 -1.514 524 HG3 PRO 74 1HG PRO 74 16.405 12.016 -2.421 525 HD2 PRO 74 2HD PRO 74 13.559 11.174 -2.130 526 HD3 PRO 74 1HD PRO 74 14.697 10.984 -3.477 527 H GLU 75 H GLU 75 13.839 9.209 0.358 528 HA GLU 75 HA GLU 75 15.227 7.844 2.580 529 HB2 GLU 75 2HB GLU 75 12.499 9.094 2.532 530 HB3 GLU 75 1HB GLU 75 13.241 8.308 3.905 531 HG2 GLU 75 2HG GLU 75 14.972 10.015 3.948 532 HG3 GLU 75 1HG GLU 75 14.217 10.810 2.560 533 H SER 76 H SER 76 13.692 6.872 -0.144 534 HA SER 76 HA SER 76 12.512 4.603 1.218 535 HB2 SER 76 2HB SER 76 10.357 4.983 0.024 536 HB3 SER 76 1HB SER 76 10.730 6.150 1.299 537 HG SER 76 HG SER 76 10.594 6.475 -1.435 538 H ASP 77 H ASP 77 11.219 3.337 -0.646 539 HA ASP 77 HA ASP 77 13.216 2.881 -2.741 540 HB2 ASP 77 2HB ASP 77 12.654 1.012 -1.257 541 HB3 ASP 77 1HB ASP 77 10.967 1.135 -1.744 542 H ILE 78 H ILE 78 9.764 3.308 -2.181 543 HA ILE 78 HA ILE 78 9.451 3.882 -5.038 544 HB ILE 78 HB ILE 78 7.020 3.255 -4.708 545 HG12 ILE 78 2HG1 ILE 78 8.069 1.911 -2.202 546 HG13 ILE 78 1HG1 ILE 78 7.069 3.357 -2.208 547 HG21 ILE 78 1HG2 ILE 78 9.091 1.090 -4.399 548 HG22 ILE 78 2HG2 ILE 78 8.535 1.806 -5.910 549 HG23 ILE 78 3HG2 ILE 78 7.430 0.840 -4.931 550 HD11 ILE 78 3HD1 ILE 78 5.767 1.368 -1.710 551 HD12 ILE 78 1HD1 ILE 78 6.260 0.641 -3.243 552 HD13 ILE 78 2HD1 ILE 78 5.257 2.095 -3.231 553 H PHE 79 H PHE 79 7.983 5.515 -5.612 554 HA PHE 79 HA PHE 79 7.533 7.499 -3.523 555 HB2 PHE 79 2HB PHE 79 7.386 9.166 -5.415 556 HB3 PHE 79 1HB PHE 79 8.961 8.413 -5.250 557 HD1 PHE 79 2HD PHE 79 9.797 6.890 -6.933 558 HD2 PHE 79 1HD PHE 79 6.022 8.786 -7.355 559 HE1 PHE 79 2HE PHE 79 9.786 6.330 -9.321 560 HE2 PHE 79 1HE PHE 79 6.002 8.236 -9.747 561 HZ PHE 79 HZ PHE 79 7.884 7.003 -10.734 562 H LEU 80 H LEU 80 5.483 8.068 -2.996 563 HA LEU 80 HA LEU 80 3.371 7.554 -4.768 564 HB2 LEU 80 2HB LEU 80 2.137 5.955 -3.348 565 HB3 LEU 80 1HB LEU 80 3.596 5.314 -4.054 566 HG LEU 80 HG LEU 80 3.424 6.198 -1.159 567 HD11 LEU 80 1HD1 LEU 80 3.116 3.436 -2.350 568 HD12 LEU 80 2HD1 LEU 80 1.829 4.371 -1.588 569 HD13 LEU 80 3HD1 LEU 80 3.200 3.816 -0.633 570 HD21 LEU 80 3HD2 LEU 80 5.345 4.465 -2.688 571 HD22 LEU 80 1HD2 LEU 80 5.419 4.758 -0.954 572 HD23 LEU 80 2HD2 LEU 80 5.667 6.084 -2.084 573 H ASP 81 H ASP 81 4.574 9.542 -2.608 574 HA ASP 81 HA ASP 81 1.859 10.455 -2.042 575 HB2 ASP 81 2HB ASP 81 3.017 9.847 0.149 576 HB3 ASP 81 1HB ASP 81 4.145 11.169 -0.167 577 H ASP 82 H ASP 82 1.394 12.287 -2.700 578 HA ASP 82 HA ASP 82 3.488 14.031 -3.848 579 HB2 ASP 82 2HB ASP 82 0.833 13.293 -4.959 580 HB3 ASP 82 1HB ASP 82 1.807 14.649 -5.514 581 H VAL 83 H VAL 83 1.095 13.850 -1.578 582 HA VAL 83 HA VAL 83 -0.042 16.418 -2.297 583 HB VAL 83 HB VAL 83 -1.643 14.663 -1.577 584 HG11 VAL 83 1HG1 VAL 83 -0.321 13.443 0.036 585 HG12 VAL 83 2HG1 VAL 83 -1.839 13.975 0.762 586 HG13 VAL 83 3HG1 VAL 83 -0.342 14.826 1.131 587 HG21 VAL 83 3HG2 VAL 83 -2.935 16.017 0.031 588 HG22 VAL 83 1HG2 VAL 83 -2.288 16.976 -1.303 589 HG23 VAL 83 2HG2 VAL 83 -1.515 17.035 0.280 590 H THR 84 H THR 84 1.960 14.908 0.003 591 HA THR 84 HA THR 84 3.287 17.302 0.783 592 HB THR 84 HB THR 84 1.587 16.113 3.037 593 HG1 THR 84 1HG THR 84 0.866 17.945 1.191 594 HG21 THR 84 3HG2 THR 84 3.683 17.149 3.759 595 HG22 THR 84 1HG2 THR 84 2.306 18.110 4.295 596 HG23 THR 84 2HG2 THR 84 3.261 18.633 2.908 597 H VAL 85 H VAL 85 4.975 15.696 0.177 598 HA VAL 85 HA VAL 85 5.011 13.518 2.026 599 HB VAL 85 HB VAL 85 5.618 12.947 -0.261 600 HG11 VAL 85 1HG1 VAL 85 7.758 13.660 -1.244 601 HG12 VAL 85 2HG1 VAL 85 7.945 14.822 0.075 602 HG13 VAL 85 3HG1 VAL 85 6.592 14.960 -1.051 603 HG21 VAL 85 3HG2 VAL 85 7.621 11.640 0.178 604 HG22 VAL 85 1HG2 VAL 85 6.551 11.630 1.568 605 HG23 VAL 85 2HG2 VAL 85 7.995 12.645 1.578 606 H SER 86 H SER 86 5.517 13.841 3.893 607 HA SER 86 HA SER 86 7.082 16.044 4.800 608 HB2 SER 86 2HB SER 86 5.828 13.717 6.250 609 HB3 SER 86 1HB SER 86 6.510 15.132 7.043 610 HG SER 86 HG SER 86 4.143 14.939 5.478 611 H ARG 87 H ARG 87 7.522 12.565 4.719 612 HA ARG 87 HA ARG 87 10.347 12.577 4.743 613 HB2 ARG 87 2HB ARG 87 8.807 11.901 7.263 614 HB3 ARG 87 1HB ARG 87 10.269 11.028 6.885 615 HG2 ARG 87 2HG ARG 87 10.043 13.992 7.377 616 HG3 ARG 87 1HG ARG 87 10.713 12.786 8.484 617 HD2 ARG 87 2HD ARG 87 12.311 12.194 6.599 618 HD3 ARG 87 1HD ARG 87 11.787 13.687 5.835 619 HE ARG 87 HE ARG 87 12.500 14.629 8.143 620 HH11 ARG 87 1HH1 ARG 87 14.107 12.088 6.251 621 HH12 ARG 87 2HH1 ARG 87 15.677 12.471 6.766 622 HH21 ARG 87 1HH2 ARG 87 14.694 15.168 8.872 623 HH22 ARG 87 2HH2 ARG 87 16.024 14.266 8.313 624 H ARG 88 H ARG 88 10.759 9.957 5.284 625 HA ARG 88 HA ARG 88 9.209 8.449 3.548 626 HB2 ARG 88 2HB ARG 88 9.854 6.351 4.780 627 HB3 ARG 88 1HB ARG 88 11.232 7.369 4.454 628 HG2 ARG 88 2HG ARG 88 9.844 7.282 7.129 629 HG3 ARG 88 1HG ARG 88 11.177 6.213 6.696 630 HD2 ARG 88 2HD ARG 88 12.578 8.224 6.276 631 HD3 ARG 88 1HD ARG 88 11.234 9.220 6.824 632 HE ARG 88 HE ARG 88 11.779 7.385 8.803 633 HH11 ARG 88 1HH1 ARG 88 13.372 10.150 7.209 634 HH12 ARG 88 2HH1 ARG 88 14.249 10.615 8.590 635 HH21 ARG 88 1HH2 ARG 88 13.057 8.017 10.702 636 HH22 ARG 88 2HH2 ARG 88 14.073 9.368 10.595 637 H HIS 89 H HIS 89 7.280 7.553 3.617 638 HA HIS 89 HA HIS 89 5.543 8.967 5.472 639 HB2 HIS 89 2HB HIS 89 5.528 9.178 2.963 640 HB3 HIS 89 1HB HIS 89 4.889 7.552 2.911 641 HD2 HIS 89 2HD HIS 89 2.402 7.810 2.274 642 HE1 HIS 89 1HE HIS 89 1.531 11.241 4.591 643 HE2 HIS 89 2HE HIS 89 1.018 10.002 2.508 644 H ALA 90 H ALA 90 5.833 5.734 4.036 645 HA ALA 90 HA ALA 90 4.654 4.679 6.494 646 HB1 ALA 90 1HB ALA 90 2.803 4.876 4.897 647 HB2 ALA 90 2HB ALA 90 3.164 3.189 5.259 648 HB3 ALA 90 3HB ALA 90 3.701 3.897 3.735 649 H GLU 91 H GLU 91 5.443 2.717 7.103 650 HA GLU 91 HA GLU 91 7.424 1.513 5.296 651 HB2 GLU 91 2HB GLU 91 7.333 1.550 8.313 652 HB3 GLU 91 1HB GLU 91 8.451 0.586 7.366 653 HG2 GLU 91 2HG GLU 91 9.430 2.627 6.455 654 HG3 GLU 91 1HG GLU 91 8.301 3.590 7.410 655 H PHE 92 H PHE 92 6.919 -0.456 4.637 656 HA PHE 92 HA PHE 92 4.897 -1.950 6.168 657 HB2 PHE 92 2HB PHE 92 5.815 -2.345 3.300 658 HB3 PHE 92 1HB PHE 92 4.547 -3.248 4.104 659 HD1 PHE 92 2HD PHE 92 5.457 -0.023 2.598 660 HD2 PHE 92 1HD PHE 92 2.348 -2.318 4.376 661 HE1 PHE 92 2HE PHE 92 3.799 1.605 1.789 662 HE2 PHE 92 1HE PHE 92 0.685 -0.698 3.568 663 HZ PHE 92 HZ PHE 92 1.408 1.266 2.271 664 H ARG 93 H ARG 93 5.864 -3.390 7.493 665 HA ARG 93 HA ARG 93 8.295 -4.654 6.499 666 HB2 ARG 93 2HB ARG 93 7.714 -3.826 9.352 667 HB3 ARG 93 1HB ARG 93 9.153 -4.673 8.799 668 HG2 ARG 93 2HG ARG 93 9.682 -2.756 7.358 669 HG3 ARG 93 1HG ARG 93 8.311 -1.885 8.039 670 HD2 ARG 93 2HD ARG 93 10.759 -2.862 9.510 671 HD3 ARG 93 1HD ARG 93 10.373 -1.193 9.116 672 HE ARG 93 HE ARG 93 8.710 -2.814 10.921 673 HH11 ARG 93 1HH1 ARG 93 10.251 0.345 10.163 674 HH12 ARG 93 2HH1 ARG 93 9.979 0.958 11.704 675 HH21 ARG 93 1HH2 ARG 93 8.327 -1.914 12.975 676 HH22 ARG 93 2HH2 ARG 93 8.894 -0.347 13.387 677 H ILE 94 H ILE 94 8.185 -6.760 6.446 678 HA ILE 94 HA ILE 94 5.985 -7.916 7.927 679 HB ILE 94 HB ILE 94 5.778 -9.662 6.089 680 HG12 ILE 94 2HG1 ILE 94 6.432 -8.716 3.748 681 HG13 ILE 94 1HG1 ILE 94 7.570 -7.708 4.622 682 HG21 ILE 94 1HG2 ILE 94 4.369 -8.257 4.682 683 HG22 ILE 94 2HG2 ILE 94 5.120 -6.826 5.373 684 HG23 ILE 94 3HG2 ILE 94 4.151 -7.884 6.400 685 HD11 ILE 94 3HD1 ILE 94 8.693 -9.715 5.438 686 HD12 ILE 94 1HD1 ILE 94 8.646 -9.660 3.676 687 HD13 ILE 94 2HD1 ILE 94 7.540 -10.718 4.556 688 H ASN 95 H ASN 95 6.350 -9.357 9.359 689 HA ASN 95 HA ASN 95 8.843 -10.844 9.233 690 HB2 ASN 95 2HB ASN 95 8.882 -9.211 11.097 691 HB3 ASN 95 1HB ASN 95 7.321 -9.806 11.653 692 HD21 ASN 95 1HD2 ASN 95 10.745 -10.468 11.488 693 HD22 ASN 95 2HD2 ASN 95 10.710 -11.799 12.576 694 H GLU 96 H GLU 96 8.622 -13.019 9.726 695 HA GLU 96 HA GLU 96 6.311 -14.318 8.922 696 HB2 GLU 96 2HB GLU 96 7.314 -16.352 9.858 697 HB3 GLU 96 1HB GLU 96 8.490 -15.396 8.965 698 HG2 GLU 96 2HG GLU 96 9.330 -14.494 11.091 699 HG3 GLU 96 1HG GLU 96 8.192 -15.520 11.956 700 H GLY 97 H GLY 97 7.153 -13.131 12.116 701 HA2 GLY 97 2HA GLY 97 5.126 -14.616 13.483 702 HA3 GLY 97 1HA GLY 97 6.151 -13.349 14.146 703 H GLU 98 H GLU 98 5.538 -11.171 12.429 704 HA GLU 98 HA GLU 98 2.678 -10.878 12.544 705 HB2 GLU 98 2HB GLU 98 4.570 -9.049 14.026 706 HB3 GLU 98 1HB GLU 98 2.906 -8.663 13.646 707 HG2 GLU 98 2HG GLU 98 2.239 -10.656 15.026 708 HG3 GLU 98 1HG GLU 98 3.928 -10.788 15.516 709 H PHE 99 H PHE 99 1.947 -9.421 11.090 710 HA PHE 99 HA PHE 99 3.886 -8.317 9.220 711 HB2 PHE 99 2HB PHE 99 0.860 -8.452 9.089 712 HB3 PHE 99 1HB PHE 99 1.931 -8.008 7.761 713 HD1 PHE 99 2HD PHE 99 3.450 -9.783 6.798 714 HD2 PHE 99 1HD PHE 99 0.322 -10.695 9.537 715 HE1 PHE 99 2HE PHE 99 3.553 -12.139 6.129 716 HE2 PHE 99 1HE PHE 99 0.421 -13.059 8.862 717 HZ PHE 99 HZ PHE 99 2.039 -13.781 7.159 718 H GLU 100 H GLU 100 4.466 -6.208 9.561 719 HA GLU 100 HA GLU 100 2.710 -4.611 11.285 720 HB2 GLU 100 2HB GLU 100 4.622 -5.403 12.529 721 HB3 GLU 100 1HB GLU 100 5.714 -4.878 11.264 722 HG2 GLU 100 2HG GLU 100 5.094 -2.535 11.764 723 HG3 GLU 100 1HG GLU 100 4.095 -3.117 13.093 724 H VAL 101 H VAL 101 1.917 -2.934 10.164 725 HA VAL 101 HA VAL 101 3.735 -1.595 8.331 726 HB VAL 101 HB VAL 101 1.686 -2.207 7.134 727 HG11 VAL 101 1HG1 VAL 101 0.167 -0.702 9.236 728 HG12 VAL 101 2HG1 VAL 101 0.160 -2.448 8.990 729 HG13 VAL 101 3HG1 VAL 101 -0.521 -1.383 7.761 730 HG21 VAL 101 3HG2 VAL 101 0.896 0.003 6.380 731 HG22 VAL 101 1HG2 VAL 101 2.653 -0.085 6.499 732 HG23 VAL 101 2HG2 VAL 101 1.724 0.744 7.745 733 H VAL 102 H VAL 102 4.507 0.283 8.841 734 HA VAL 102 HA VAL 102 3.462 1.498 11.295 735 HB VAL 102 HB VAL 102 6.300 1.675 10.238 736 HG11 VAL 102 1HG1 VAL 102 6.839 2.623 12.407 737 HG12 VAL 102 2HG1 VAL 102 5.165 2.434 12.918 738 HG13 VAL 102 3HG1 VAL 102 5.557 3.573 11.638 739 HG21 VAL 102 3HG2 VAL 102 6.902 0.167 12.076 740 HG22 VAL 102 1HG2 VAL 102 5.809 -0.600 10.922 741 HG23 VAL 102 2HG2 VAL 102 5.192 -0.019 12.468 742 H ASP 103 H ASP 103 2.406 3.233 10.911 743 HA ASP 103 HA ASP 103 2.693 4.777 8.524 744 HB2 ASP 103 2HB ASP 103 0.959 5.043 10.972 745 HB3 ASP 103 1HB ASP 103 0.827 6.017 9.518 746 H VAL 104 H VAL 104 4.329 6.197 8.500 747 HA VAL 104 HA VAL 104 4.909 7.620 10.993 748 HB VAL 104 HB VAL 104 7.304 7.862 10.102 749 HG11 VAL 104 1HG1 VAL 104 7.972 5.671 10.920 750 HG12 VAL 104 2HG1 VAL 104 6.330 5.088 10.704 751 HG13 VAL 104 3HG1 VAL 104 6.669 6.320 11.923 752 HG21 VAL 104 3HG2 VAL 104 6.374 5.617 8.313 753 HG22 VAL 104 1HG2 VAL 104 8.046 6.139 8.515 754 HG23 VAL 104 2HG2 VAL 104 6.866 7.225 7.784 755 H GLY 105 H GLY 105 3.248 8.192 8.537 756 HA2 GLY 105 2HA GLY 105 4.362 10.872 7.953 757 HA3 GLY 105 1HA GLY 105 3.296 9.984 6.866 758 H SER 106 H SER 106 3.167 10.665 10.327 759 HA SER 106 HA SER 106 0.385 10.897 10.435 760 HB2 SER 106 2HB SER 106 2.391 11.927 12.426 761 HB3 SER 106 1HB SER 106 0.738 11.390 12.734 762 HG SER 106 HG SER 106 1.403 9.289 11.989 763 H LEU 107 H LEU 107 2.864 13.238 9.741 764 HA LEU 107 HA LEU 107 1.531 15.623 10.416 765 HB2 LEU 107 2HB LEU 107 3.464 15.084 8.163 766 HB3 LEU 107 1HB LEU 107 2.822 16.669 8.497 767 HG LEU 107 HG LEU 107 5.014 16.603 9.380 768 HD11 LEU 107 1HD1 LEU 107 3.137 16.255 11.692 769 HD12 LEU 107 2HD1 LEU 107 3.461 17.741 10.804 770 HD13 LEU 107 3HD1 LEU 107 4.740 16.984 11.750 771 HD21 LEU 107 3HD2 LEU 107 4.291 14.064 10.834 772 HD22 LEU 107 1HD2 LEU 107 5.820 14.930 10.978 773 HD23 LEU 107 2HD2 LEU 107 5.364 14.193 9.439 774 H ASN 108 H ASN 108 1.409 13.704 7.483 775 HA ASN 108 HA ASN 108 -0.593 15.322 6.204 776 HB2 ASN 108 2HB ASN 108 0.126 12.412 5.711 777 HB3 ASN 108 1HB ASN 108 -0.833 13.437 4.662 778 HD21 ASN 108 1HD2 ASN 108 0.563 12.985 2.905 779 HD22 ASN 108 2HD2 ASN 108 2.103 13.718 2.852 780 H GLY 109 H GLY 109 -0.384 12.217 7.745 781 HA2 GLY 109 2HA GLY 109 -2.095 11.756 9.458 782 HA3 GLY 109 1HA GLY 109 -3.266 12.328 8.266 783 H THR 110 H THR 110 -1.391 9.692 9.352 784 HA THR 110 HA THR 110 -2.068 8.108 7.071 785 HB THR 110 HB THR 110 -0.845 6.435 8.707 786 HG1 THR 110 1HG THR 110 -0.404 7.398 10.533 787 HG21 THR 110 3HG2 THR 110 1.333 7.250 7.850 788 HG22 THR 110 1HG2 THR 110 0.580 8.785 7.421 789 HG23 THR 110 2HG2 THR 110 0.103 7.306 6.588 790 H TYR 111 H TYR 111 -3.979 7.068 7.066 791 HA TYR 111 HA TYR 111 -5.359 6.815 9.647 792 HB2 TYR 111 2HB TYR 111 -6.648 7.342 6.981 793 HB3 TYR 111 1HB TYR 111 -7.447 7.233 8.534 794 HD1 TYR 111 1HD TYR 111 -6.899 9.029 10.280 795 HD2 TYR 111 2HD TYR 111 -5.863 9.394 6.180 796 HE1 TYR 111 1HE TYR 111 -6.688 11.465 10.555 797 HE2 TYR 111 2HE TYR 111 -5.642 11.821 6.441 798 HH TYR 111 HH TYR 111 -6.462 13.548 7.898 799 H VAL 112 H VAL 112 -6.272 4.988 10.111 800 HA VAL 112 HA VAL 112 -6.460 2.895 8.078 801 HB VAL 112 HB VAL 112 -5.187 2.230 10.122 802 HG11 VAL 112 1HG1 VAL 112 -6.227 1.930 12.281 803 HG12 VAL 112 2HG1 VAL 112 -7.677 2.745 11.690 804 HG13 VAL 112 3HG1 VAL 112 -6.149 3.624 11.793 805 HG21 VAL 112 3HG2 VAL 112 -6.341 0.499 8.940 806 HG22 VAL 112 1HG2 VAL 112 -7.813 0.833 9.849 807 HG23 VAL 112 2HG2 VAL 112 -6.400 0.179 10.676 808 H ASN 113 H ASN 113 -8.374 2.873 7.155 809 HA ASN 113 HA ASN 113 -10.565 3.242 6.712 810 HB2 ASN 113 2HB ASN 113 -10.911 2.265 9.572 811 HB3 ASN 113 1HB ASN 113 -12.211 2.378 8.391 812 HD21 ASN 113 1HD2 ASN 113 -9.590 0.592 9.516 813 HD22 ASN 113 2HD2 ASN 113 -9.578 -0.700 8.393 814 H ARG 114 H ARG 114 -9.134 5.470 7.480 815 HA ARG 114 HA ARG 114 -9.465 7.659 7.579 816 HB2 ARG 114 2HB ARG 114 -12.331 7.002 8.192 817 HB3 ARG 114 1HB ARG 114 -11.733 8.655 8.122 818 HG2 ARG 114 2HG ARG 114 -11.123 8.406 5.823 819 HG3 ARG 114 1HG ARG 114 -11.473 6.679 5.877 820 HD2 ARG 114 2HD ARG 114 -13.502 8.857 6.312 821 HD3 ARG 114 1HD ARG 114 -13.245 8.011 4.786 822 HE ARG 114 HE ARG 114 -14.246 6.796 7.277 823 HH11 ARG 114 1HH1 ARG 114 -14.003 6.787 3.741 824 HH12 ARG 114 2HH1 ARG 114 -14.949 5.392 3.540 825 HH21 ARG 114 1HH2 ARG 114 -15.555 4.906 7.000 826 HH22 ARG 114 2HH2 ARG 114 -15.863 4.273 5.457 827 H GLU 115 H GLU 115 -9.232 5.789 10.202 828 HA GLU 115 HA GLU 115 -9.183 8.197 11.849 829 HB2 GLU 115 2HB GLU 115 -9.218 6.755 13.846 830 HB3 GLU 115 1HB GLU 115 -10.630 6.508 12.834 831 HG2 GLU 115 2HG GLU 115 -9.672 4.455 11.985 832 HG3 GLU 115 1HG GLU 115 -8.213 4.729 12.939 833 HA PRO 116 HA PRO 116 -4.799 8.313 11.588 834 HB2 PRO 116 2HB PRO 116 -4.711 9.172 14.417 835 HB3 PRO 116 1HB PRO 116 -4.140 10.009 12.972 836 HG2 PRO 116 2HG PRO 116 -6.338 10.812 14.254 837 HG3 PRO 116 1HG PRO 116 -6.224 10.880 12.491 838 HD2 PRO 116 2HD PRO 116 -7.672 8.911 14.214 839 HD3 PRO 116 1HD PRO 116 -8.148 9.642 12.666 840 H ARG 117 H ARG 117 -3.097 7.010 11.903 841 HA ARG 117 HA ARG 117 -2.830 5.448 14.349 842 HB2 ARG 117 2HB ARG 117 -2.301 3.406 13.019 843 HB3 ARG 117 1HB ARG 117 -3.990 3.875 13.021 844 HG2 ARG 117 2HG ARG 117 -3.923 4.562 10.780 845 HG3 ARG 117 1HG ARG 117 -2.157 4.672 10.782 846 HD2 ARG 117 2HD ARG 117 -1.889 2.384 10.756 847 HD3 ARG 117 1HD ARG 117 -3.516 2.079 11.335 848 HE ARG 117 HE ARG 117 -4.181 2.963 9.063 849 HH11 ARG 117 1HH1 ARG 117 -0.955 1.884 9.149 850 HH12 ARG 117 2HH1 ARG 117 -1.081 0.595 8.039 851 HH21 ARG 117 1HH2 ARG 117 -4.593 1.089 7.481 852 HH22 ARG 117 2HH2 ARG 117 -3.267 0.150 7.052 853 H ASN 118 H ASN 118 -0.729 4.413 14.545 854 HA ASN 118 HA ASN 118 1.318 5.498 12.773 855 HB2 ASN 118 2HB ASN 118 1.404 5.366 15.757 856 HB3 ASN 118 1HB ASN 118 2.896 5.249 14.819 857 HD21 ASN 118 1HD2 ASN 118 3.501 7.020 13.524 858 HD22 ASN 118 2HD2 ASN 118 2.885 8.599 13.816 859 H ALA 119 H ALA 119 -0.013 2.709 14.228 860 HA ALA 119 HA ALA 119 1.738 1.128 12.575 861 HB1 ALA 119 1HB ALA 119 2.395 -0.402 14.383 862 HB2 ALA 119 2HB ALA 119 1.620 0.654 15.564 863 HB3 ALA 119 3HB ALA 119 3.028 1.222 14.662 864 H GLN 120 H GLN 120 0.696 -0.643 11.871 865 HA GLN 120 HA GLN 120 -1.725 -1.492 13.236 866 HB2 GLN 120 2HB GLN 120 -2.164 0.295 11.423 867 HB3 GLN 120 1HB GLN 120 -1.678 -0.915 10.261 868 HG2 GLN 120 2HG GLN 120 -3.943 -1.382 12.171 869 HG3 GLN 120 1HG GLN 120 -4.169 -0.526 10.651 870 HE21 GLN 120 1HE2 GLN 120 -5.278 -3.022 11.602 871 HE22 GLN 120 2HE2 GLN 120 -4.782 -4.219 10.443 872 H VAL 121 H VAL 121 -2.209 -3.705 12.778 873 HA VAL 121 HA VAL 121 -0.012 -5.123 11.490 874 HB VAL 121 HB VAL 121 -0.279 -5.879 13.766 875 HG11 VAL 121 1HG1 VAL 121 -2.508 -5.136 14.234 876 HG12 VAL 121 2HG1 VAL 121 -2.373 -6.855 14.628 877 HG13 VAL 121 3HG1 VAL 121 -3.179 -6.346 13.143 878 HG21 VAL 121 3HG2 VAL 121 -0.786 -8.276 13.499 879 HG22 VAL 121 1HG2 VAL 121 0.230 -7.658 12.197 880 HG23 VAL 121 2HG2 VAL 121 -1.489 -7.937 11.917 881 H MET 122 H MET 122 -0.289 -5.775 9.563 882 HA MET 122 HA MET 122 -2.176 -5.164 7.787 883 HB2 MET 122 2HB MET 122 -0.479 -7.619 7.768 884 HB3 MET 122 1HB MET 122 -1.604 -7.295 6.473 885 HG2 MET 122 2HG MET 122 0.599 -6.607 5.845 886 HG3 MET 122 1HG MET 122 -0.440 -5.202 5.995 887 HE1 MET 122 3HE MET 122 2.833 -5.384 5.856 888 HE2 MET 122 1HE MET 122 3.208 -4.040 6.934 889 HE3 MET 122 2HE MET 122 1.890 -3.899 5.762 890 H GLN 123 H GLN 123 -4.251 -5.375 7.619 891 HA GLN 123 HA GLN 123 -5.453 -8.024 7.990 892 HB2 GLN 123 2HB GLN 123 -6.740 -5.291 8.311 893 HB3 GLN 123 1HB GLN 123 -7.625 -6.805 8.313 894 HG2 GLN 123 2HG GLN 123 -6.352 -7.485 10.314 895 HG3 GLN 123 1HG GLN 123 -5.593 -5.895 10.337 896 HE21 GLN 123 1HE2 GLN 123 -7.265 -7.164 12.301 897 HE22 GLN 123 2HE2 GLN 123 -8.638 -6.151 12.552 898 H THR 124 H THR 124 -6.852 -8.648 6.301 899 HA THR 124 HA THR 124 -6.194 -7.217 3.880 900 HB THR 124 HB THR 124 -5.837 -9.673 3.893 901 HG1 THR 124 1HG THR 124 -7.616 -9.874 1.972 902 HG21 THR 124 3HG2 THR 124 -8.851 -9.870 4.100 903 HG22 THR 124 1HG2 THR 124 -7.690 -10.383 5.324 904 HG23 THR 124 2HG2 THR 124 -7.767 -11.222 3.773 905 H GLY 125 H GLY 125 -7.551 -6.027 2.734 906 HA2 GLY 125 2HA GLY 125 -9.662 -5.326 1.930 907 HA3 GLY 125 1HA GLY 125 -10.429 -6.176 3.270 908 H ASP 126 H ASP 126 -7.672 -4.311 3.964 909 HA ASP 126 HA ASP 126 -9.330 -2.449 5.486 910 HB2 ASP 126 2HB ASP 126 -7.460 -3.733 6.597 911 HB3 ASP 126 1HB ASP 126 -6.333 -2.836 5.581 912 H GLU 127 H GLU 127 -9.157 -0.239 5.131 913 HA GLU 127 HA GLU 127 -7.649 0.388 2.731 914 HB2 GLU 127 2HB GLU 127 -9.176 2.219 2.257 915 HB3 GLU 127 1HB GLU 127 -10.006 0.678 2.317 916 HG2 GLU 127 2HG GLU 127 -10.910 1.214 4.484 917 HG3 GLU 127 1HG GLU 127 -9.983 2.720 4.525 918 H ILE 128 H ILE 128 -6.183 1.778 2.753 919 HA ILE 128 HA ILE 128 -5.572 3.117 5.289 920 HB ILE 128 HB ILE 128 -3.677 2.570 2.988 921 HG12 ILE 128 2HG1 ILE 128 -4.086 0.875 5.472 922 HG13 ILE 128 1HG1 ILE 128 -4.570 0.418 3.846 923 HG21 ILE 128 1HG2 ILE 128 -1.947 2.939 4.688 924 HG22 ILE 128 2HG2 ILE 128 -3.195 3.180 5.907 925 HG23 ILE 128 3HG2 ILE 128 -3.035 4.330 4.580 926 HD11 ILE 128 3HD1 ILE 128 -2.504 -0.683 4.516 927 HD12 ILE 128 1HD1 ILE 128 -1.739 0.884 4.772 928 HD13 ILE 128 2HD1 ILE 128 -2.231 0.397 3.150 929 H GLN 129 H GLN 129 -5.837 5.285 5.211 930 HA GLN 129 HA GLN 129 -5.597 6.524 2.576 931 HB2 GLN 129 2HB GLN 129 -7.717 7.120 3.670 932 HB3 GLN 129 1HB GLN 129 -6.854 7.666 5.098 933 HG2 GLN 129 2HG GLN 129 -5.790 9.434 3.763 934 HG3 GLN 129 1HG GLN 129 -6.684 8.894 2.352 935 HE21 GLN 129 1HE2 GLN 129 -6.656 11.466 3.757 936 HE22 GLN 129 2HE2 GLN 129 -8.290 11.788 4.187 937 H ILE 130 H ILE 130 -3.679 7.172 2.209 938 HA ILE 130 HA ILE 130 -2.121 8.122 4.469 939 HB ILE 130 HB ILE 130 -0.114 7.950 2.917 940 HG12 ILE 130 2HG1 ILE 130 -2.005 6.255 1.248 941 HG13 ILE 130 1HG1 ILE 130 -1.354 7.818 0.774 942 HG21 ILE 130 1HG2 ILE 130 -0.488 6.357 4.694 943 HG22 ILE 130 2HG2 ILE 130 0.180 5.552 3.276 944 HG23 ILE 130 3HG2 ILE 130 -1.537 5.402 3.643 945 HD11 ILE 130 3HD1 ILE 130 -0.171 5.986 -0.298 946 HD12 ILE 130 1HD1 ILE 130 0.247 5.319 1.282 947 HD13 ILE 130 2HD1 ILE 130 0.899 6.882 0.778 948 H GLY 131 H GLY 131 -2.545 10.102 4.771 949 HA2 GLY 131 2HA GLY 131 -2.509 12.330 4.420 950 HA3 GLY 131 1HA GLY 131 -1.788 12.045 2.830 951 H LYS 132 H LYS 132 -3.119 11.660 1.105 952 HA LYS 132 HA LYS 132 -5.949 12.364 1.521 953 HB2 LYS 132 2HB LYS 132 -4.437 14.288 0.821 954 HB3 LYS 132 1HB LYS 132 -4.261 13.465 -0.716 955 HG2 LYS 132 2HG LYS 132 -6.679 13.615 -1.059 956 HG3 LYS 132 1HG LYS 132 -6.832 14.479 0.473 957 HD2 LYS 132 2HD LYS 132 -5.212 16.168 -0.443 958 HD3 LYS 132 1HD LYS 132 -5.368 15.362 -2.005 959 HE2 LYS 132 2HE LYS 132 -6.866 17.244 -1.936 960 HE3 LYS 132 1HE LYS 132 -7.808 15.752 -1.911 961 HZ1 LYS 132 3HZ LYS 132 -7.144 17.424 0.443 962 HZ2 LYS 132 1HZ LYS 132 -8.058 16.012 0.501 963 HZ3 LYS 132 2HZ LYS 132 -8.645 17.349 -0.318 964 H PHE 133 H PHE 133 -3.945 10.020 0.493 965 HA PHE 133 HA PHE 133 -5.392 9.460 -1.999 966 HB2 PHE 133 2HB PHE 133 -2.888 8.111 -0.961 967 HB3 PHE 133 1HB PHE 133 -3.564 7.998 -2.585 968 HD1 PHE 133 2HD PHE 133 -3.936 10.409 -3.717 969 HD2 PHE 133 1HD PHE 133 -1.082 9.496 -0.700 970 HE1 PHE 133 2HE PHE 133 -2.610 12.371 -4.371 971 HE2 PHE 133 1HE PHE 133 0.231 11.459 -1.349 972 HZ PHE 133 HZ PHE 133 -0.527 12.892 -3.190 973 H ARG 134 H ARG 134 -6.431 7.432 -2.307 974 HA ARG 134 HA ARG 134 -7.018 6.106 0.250 975 HB2 ARG 134 2HB ARG 134 -8.886 7.305 -1.065 976 HB3 ARG 134 1HB ARG 134 -8.715 6.046 -2.267 977 HG2 ARG 134 2HG ARG 134 -9.465 5.531 0.622 978 HG3 ARG 134 1HG ARG 134 -10.635 5.789 -0.659 979 HD2 ARG 134 2HD ARG 134 -9.756 3.787 -1.817 980 HD3 ARG 134 1HD ARG 134 -8.620 3.548 -0.496 981 HE ARG 134 HE ARG 134 -10.834 3.497 0.903 982 HH11 ARG 134 1HH1 ARG 134 -10.505 2.138 -2.340 983 HH12 ARG 134 2HH1 ARG 134 -11.530 0.816 -2.060 984 HH21 ARG 134 1HH2 ARG 134 -12.296 1.686 1.298 985 HH22 ARG 134 2HH2 ARG 134 -12.552 0.547 0.067 986 H LEU 135 H LEU 135 -6.185 4.183 0.462 987 HA LEU 135 HA LEU 135 -5.372 2.647 -1.903 988 HB2 LEU 135 2HB LEU 135 -3.539 3.722 -0.624 989 HB3 LEU 135 1HB LEU 135 -4.102 2.922 0.822 990 HG LEU 135 HG LEU 135 -3.588 0.734 -0.309 991 HD11 LEU 135 1HD1 LEU 135 -2.043 0.832 -2.215 992 HD12 LEU 135 2HD1 LEU 135 -2.275 2.577 -2.273 993 HD13 LEU 135 3HD1 LEU 135 -3.632 1.494 -2.594 994 HD21 LEU 135 3HD2 LEU 135 -1.300 2.666 0.062 995 HD22 LEU 135 1HD2 LEU 135 -1.188 0.905 0.100 996 HD23 LEU 135 2HD2 LEU 135 -2.096 1.760 1.349 997 H VAL 136 H VAL 136 -5.939 0.449 -1.768 998 HA VAL 136 HA VAL 136 -7.125 -0.362 0.761 999 HB VAL 136 HB VAL 136 -8.889 -0.259 -0.993 1000 HG11 VAL 136 1HG1 VAL 136 -7.553 -0.663 -2.967 1001 HG12 VAL 136 2HG1 VAL 136 -8.918 -1.781 -2.883 1002 HG13 VAL 136 3HG1 VAL 136 -7.296 -2.334 -2.451 1003 HG21 VAL 136 3HG2 VAL 136 -8.229 -3.077 -0.148 1004 HG22 VAL 136 1HG2 VAL 136 -9.800 -2.532 -0.732 1005 HG23 VAL 136 2HG2 VAL 136 -9.152 -1.892 0.778 1006 H PHE 137 H PHE 137 -6.326 -2.132 1.685 1007 HA PHE 137 HA PHE 137 -3.971 -3.233 0.344 1008 HB2 PHE 137 2HB PHE 137 -3.725 -1.753 2.404 1009 HB3 PHE 137 1HB PHE 137 -4.477 -3.059 3.304 1010 HD1 PHE 137 1HD PHE 137 -1.529 -2.008 1.429 1011 HD2 PHE 137 2HD PHE 137 -3.277 -5.067 3.803 1012 HE1 PHE 137 1HE PHE 137 0.681 -3.044 1.693 1013 HE2 PHE 137 2HE PHE 137 -1.075 -6.111 4.073 1014 HZ PHE 137 HZ PHE 137 0.908 -5.103 3.020 1015 H LEU 138 H LEU 138 -3.869 -5.377 0.072 1016 HA LEU 138 HA LEU 138 -5.825 -7.083 1.442 1017 HB2 LEU 138 2HB LEU 138 -4.997 -7.273 -1.468 1018 HB3 LEU 138 1HB LEU 138 -5.955 -8.460 -0.630 1019 HG LEU 138 HG LEU 138 -7.420 -7.274 -2.016 1020 HD11 LEU 138 1HD1 LEU 138 -7.774 -6.224 0.754 1021 HD12 LEU 138 2HD1 LEU 138 -8.384 -7.739 0.092 1022 HD13 LEU 138 3HD1 LEU 138 -8.994 -6.198 -0.514 1023 HD21 LEU 138 3HD2 LEU 138 -6.324 -4.693 -0.902 1024 HD22 LEU 138 1HD2 LEU 138 -7.700 -4.819 -1.998 1025 HD23 LEU 138 2HD2 LEU 138 -6.096 -5.315 -2.535 1026 H ALA 139 H ALA 139 -5.099 -9.405 1.217 1027 HA ALA 139 HA ALA 139 -2.245 -9.563 1.770 1028 HB1 ALA 139 1HB ALA 139 -3.793 -10.722 3.282 1029 HB2 ALA 139 2HB ALA 139 -2.742 -11.879 2.463 1030 HB3 ALA 139 3HB ALA 139 -4.410 -11.668 1.927 1031 H GLY 140 H GLY 140 -1.002 -11.402 0.717 1032 HA2 GLY 140 2HA GLY 140 -1.508 -11.347 -2.106 1033 HA3 GLY 140 1HA GLY 140 -0.139 -12.103 -1.298 1034 HA PRO 141 HA PRO 141 -3.694 -15.206 -1.947 1035 HB2 PRO 141 2HB PRO 141 -3.115 -15.819 -4.668 1036 HB3 PRO 141 1HB PRO 141 -4.631 -15.252 -3.966 1037 HG2 PRO 141 2HG PRO 141 -3.066 -13.732 -5.678 1038 HG3 PRO 141 1HG PRO 141 -4.210 -13.059 -4.506 1039 HD2 PRO 141 2HD PRO 141 -1.241 -13.311 -4.328 1040 HD3 PRO 141 1HD PRO 141 -2.320 -12.024 -3.738 1041 H ALA 142 H ALA 142 -2.908 -16.883 -1.092 1042 HA ALA 142 HA ALA 142 -0.398 -18.035 -2.081 1043 HB1 ALA 142 1HB ALA 142 -0.260 -17.276 0.241 1044 HB2 ALA 142 2HB ALA 142 -0.165 -19.036 0.161 1045 HB3 ALA 142 3HB ALA 142 -1.667 -18.254 0.653 1046 H GLU 143 H GLU 143 -0.834 -19.672 -3.400 1047 HA GLU 143 HA GLU 143 -3.118 -21.329 -2.791 1048 HB2 GLU 143 2HB GLU 143 -2.441 -21.950 -5.360 1049 HB3 GLU 143 1HB GLU 143 -3.679 -20.793 -4.898 1050 HG2 GLU 143 2HG GLU 143 -2.288 -19.870 -6.642 1051 HG3 GLU 143 1HG GLU 143 -2.023 -18.975 -5.155 Start of MODEL 6 1 H1 MET 1 1HT MET 1 25.801 58.098 49.358 2 H2 MET 1 2HT MET 1 26.192 58.955 50.756 3 H3 MET 1 3HT MET 1 26.682 57.350 50.578 4 HA MET 1 HA MET 1 28.150 57.824 48.853 5 HB2 MET 1 2HB MET 1 27.235 60.700 49.186 6 HB3 MET 1 1HB MET 1 28.647 60.229 48.262 7 HG2 MET 1 2HG MET 1 27.237 58.946 46.746 8 HG3 MET 1 1HG MET 1 25.813 59.384 47.676 9 HE1 MET 1 2HE MET 1 25.980 59.802 44.566 10 HE2 MET 1 3HE MET 1 25.320 61.427 44.399 11 HE3 MET 1 1HE MET 1 24.589 60.291 45.533 12 H SER 2 H SER 2 28.051 60.607 51.148 13 HA SER 2 HA SER 2 30.561 59.758 52.205 14 HB2 SER 2 2HB SER 2 30.016 61.710 53.759 15 HB3 SER 2 1HB SER 2 30.235 62.109 52.056 16 HG SER 2 HG SER 2 28.299 62.964 53.225 17 H ASP 3 H ASP 3 27.254 60.133 53.239 18 HA ASP 3 HA ASP 3 27.691 58.227 55.407 19 HB2 ASP 3 2HB ASP 3 25.265 59.962 54.853 20 HB3 ASP 3 1HB ASP 3 25.498 58.940 56.258 21 H ASN 4 H ASN 4 26.996 56.222 55.085 22 HA ASN 4 HA ASN 4 25.290 55.796 52.742 23 HB2 ASN 4 2HB ASN 4 27.444 54.022 53.893 24 HB3 ASN 4 1HB ASN 4 26.313 53.499 52.647 25 HD21 ASN 4 1HD2 ASN 4 29.236 53.867 52.640 26 HD22 ASN 4 2HD2 ASN 4 29.592 54.911 51.321 27 H ASN 5 H ASN 5 23.695 54.200 52.830 28 HA ASN 5 HA ASN 5 22.626 53.930 55.513 29 HB2 ASN 5 2HB ASN 5 21.340 53.501 52.804 30 HB3 ASN 5 1HB ASN 5 20.531 53.173 54.330 31 HD21 ASN 5 1HD2 ASN 5 19.809 55.025 52.249 32 HD22 ASN 5 2HD2 ASN 5 19.760 56.587 52.963 33 H GLY 6 H GLY 6 23.079 52.206 56.575 34 HA2 GLY 6 2HA GLY 6 23.380 49.687 55.094 35 HA3 GLY 6 1HA GLY 6 24.337 50.122 56.513 36 H THR 7 H THR 7 21.426 48.781 55.385 37 HA THR 7 HA THR 7 20.019 48.956 57.877 38 HB THR 7 HB THR 7 19.490 47.145 55.493 39 HG1 THR 7 1HG THR 7 19.578 49.379 54.921 40 HG21 THR 7 3HG2 THR 7 17.641 48.231 57.632 41 HG22 THR 7 1HG2 THR 7 18.249 46.576 57.554 42 HG23 THR 7 2HG2 THR 7 17.175 47.183 56.293 43 HA PRO 8 HA PRO 8 22.369 45.499 59.651 44 HB2 PRO 8 2HB PRO 8 20.037 45.465 61.508 45 HB3 PRO 8 1HB PRO 8 21.761 45.508 61.888 46 HG2 PRO 8 2HG PRO 8 20.326 47.702 62.180 47 HG3 PRO 8 1HG PRO 8 21.930 47.796 61.439 48 HD2 PRO 8 2HD PRO 8 19.245 47.823 60.101 49 HD3 PRO 8 1HD PRO 8 20.676 48.830 59.789 50 H GLU 9 H GLU 9 22.289 43.469 58.994 51 HA GLU 9 HA GLU 9 19.727 42.376 58.166 52 HB2 GLU 9 2HB GLU 9 21.124 40.738 56.860 53 HB3 GLU 9 1HB GLU 9 21.301 42.412 56.365 54 HG2 GLU 9 2HG GLU 9 23.405 42.564 57.563 55 HG3 GLU 9 1HG GLU 9 23.226 40.903 58.121 56 HA PRO 10 HA PRO 10 19.844 39.705 61.694 57 HB2 PRO 10 2HB PRO 10 18.037 37.841 60.776 58 HB3 PRO 10 1HB PRO 10 17.593 39.356 61.560 59 HG2 PRO 10 2HG PRO 10 17.634 38.652 58.673 60 HG3 PRO 10 1HG PRO 10 16.499 39.689 59.551 61 HD2 PRO 10 2HD PRO 10 18.488 40.656 57.971 62 HD3 PRO 10 1HD PRO 10 17.881 41.532 59.388 63 H GLN 11 H GLN 11 21.284 38.261 62.136 64 HA GLN 11 HA GLN 11 22.578 36.723 60.067 65 HB2 GLN 11 2HB GLN 11 23.007 36.763 63.059 66 HB3 GLN 11 1HB GLN 11 24.068 36.026 61.875 67 HG2 GLN 11 2HG GLN 11 24.637 38.166 60.965 68 HG3 GLN 11 1HG GLN 11 23.448 38.965 61.992 69 HE21 GLN 11 1HE2 GLN 11 26.282 39.422 61.819 70 HE22 GLN 11 2HE2 GLN 11 26.928 39.116 63.389 71 H VAL 12 H VAL 12 21.452 35.039 59.416 72 HA VAL 12 HA VAL 12 20.040 33.393 61.407 73 HB VAL 12 HB VAL 12 19.599 33.474 58.407 74 HG11 VAL 12 1HG1 VAL 12 17.464 32.389 58.888 75 HG12 VAL 12 2HG1 VAL 12 17.869 32.356 60.599 76 HG13 VAL 12 3HG1 VAL 12 18.833 31.430 59.451 77 HG21 VAL 12 3HG2 VAL 12 17.592 34.820 58.794 78 HG22 VAL 12 1HG2 VAL 12 19.051 35.678 59.284 79 HG23 VAL 12 2HG2 VAL 12 18.002 34.947 60.500 80 H GLU 13 H GLU 13 20.498 31.098 61.303 81 HA GLU 13 HA GLU 13 22.799 30.482 59.730 82 HB2 GLU 13 2HB GLU 13 22.562 28.190 60.643 83 HB3 GLU 13 1HB GLU 13 22.671 29.389 61.914 84 HG2 GLU 13 2HG GLU 13 20.038 28.320 60.975 85 HG3 GLU 13 1HG GLU 13 21.022 27.460 62.150 86 H THR 14 H THR 14 22.674 29.829 57.774 87 HA THR 14 HA THR 14 20.264 29.854 56.361 88 HB THR 14 HB THR 14 22.945 28.713 55.514 89 HG1 THR 14 1HG THR 14 21.758 31.279 55.526 90 HG21 THR 14 3HG2 THR 14 22.164 29.182 53.224 91 HG22 THR 14 1HG2 THR 14 20.621 29.753 53.860 92 HG23 THR 14 2HG2 THR 14 21.066 28.055 54.022 93 H THR 15 H THR 15 18.738 28.475 56.703 94 HA THR 15 HA THR 15 19.280 25.856 57.674 95 HB THR 15 HB THR 15 16.616 27.144 57.041 96 HG1 THR 15 1HG THR 15 18.399 28.011 58.690 97 HG21 THR 15 3HG2 THR 15 17.404 24.929 58.962 98 HG22 THR 15 1HG2 THR 15 16.556 24.689 57.436 99 HG23 THR 15 2HG2 THR 15 15.779 25.573 58.751 100 H SER 16 H SER 16 20.136 24.703 56.082 101 HA SER 16 HA SER 16 18.402 23.983 53.850 102 HB2 SER 16 2HB SER 16 21.405 24.397 53.640 103 HB3 SER 16 1HB SER 16 20.323 23.904 52.337 104 HG SER 16 HG SER 16 19.229 26.039 53.087 105 H VAL 17 H VAL 17 17.848 22.225 55.141 106 HA VAL 17 HA VAL 17 19.985 20.297 55.717 107 HB VAL 17 HB VAL 17 17.176 20.343 56.839 108 HG11 VAL 17 1HG1 VAL 17 19.605 18.777 57.675 109 HG12 VAL 17 2HG1 VAL 17 18.173 18.146 56.863 110 HG13 VAL 17 3HG1 VAL 17 18.050 18.772 58.507 111 HG21 VAL 17 3HG2 VAL 17 18.154 21.160 58.949 112 HG22 VAL 17 1HG2 VAL 17 18.352 22.321 57.636 113 HG23 VAL 17 2HG2 VAL 17 19.714 21.324 58.144 114 H PHE 18 H PHE 18 20.088 18.822 54.205 115 HA PHE 18 HA PHE 18 17.605 17.990 52.889 116 HB2 PHE 18 2HB PHE 18 18.953 17.258 50.980 117 HB3 PHE 18 1HB PHE 18 19.252 18.954 51.314 118 HD1 PHE 18 1HD PHE 18 21.405 19.653 52.300 119 HD2 PHE 18 2HD PHE 18 20.668 15.623 51.163 120 HE1 PHE 18 1HE PHE 18 23.806 19.199 52.366 121 HE2 PHE 18 2HE PHE 18 23.075 15.154 51.229 122 HZ PHE 18 HZ PHE 18 24.653 16.942 51.832 123 H ARG 19 H ARG 19 17.642 15.650 52.238 124 HA ARG 19 HA ARG 19 18.915 14.148 54.381 125 HB2 ARG 19 2HB ARG 19 16.195 13.754 53.113 126 HB3 ARG 19 1HB ARG 19 16.993 12.475 54.005 127 HG2 ARG 19 2HG ARG 19 15.436 13.527 55.493 128 HG3 ARG 19 1HG ARG 19 17.052 13.997 55.999 129 HD2 ARG 19 2HD ARG 19 16.721 16.136 54.699 130 HD3 ARG 19 1HD ARG 19 15.037 15.659 54.485 131 HE ARG 19 HE ARG 19 15.725 15.529 57.199 132 HH11 ARG 19 1HH1 ARG 19 14.998 17.942 54.707 133 HH12 ARG 19 2HH1 ARG 19 14.597 19.160 55.817 134 HH21 ARG 19 1HH2 ARG 19 15.137 17.221 58.709 135 HH22 ARG 19 2HH2 ARG 19 14.661 18.746 58.126 136 H ALA 20 H ALA 20 18.907 11.682 53.651 137 HA ALA 20 HA ALA 20 20.777 11.596 51.468 138 HB1 ALA 20 1HB ALA 20 19.629 9.388 53.173 139 HB2 ALA 20 2HB ALA 20 21.068 10.334 53.552 140 HB3 ALA 20 3HB ALA 20 21.062 9.275 52.146 141 H ASP 21 H ASP 21 18.166 12.314 50.682 142 HA ASP 21 HA ASP 21 16.622 10.172 49.584 143 HB2 ASP 21 2HB ASP 21 16.579 13.076 48.743 144 HB3 ASP 21 1HB ASP 21 15.316 11.884 48.516 145 H LEU 22 H LEU 22 19.159 12.234 48.492 146 HA LEU 22 HA LEU 22 18.836 11.703 45.699 147 HB2 LEU 22 2HB LEU 22 21.187 12.904 47.170 148 HB3 LEU 22 1HB LEU 22 21.036 12.827 45.433 149 HG LEU 22 HG LEU 22 20.567 15.035 46.019 150 HD11 LEU 22 1HD1 LEU 22 18.276 15.419 45.372 151 HD12 LEU 22 2HD1 LEU 22 17.906 13.721 45.646 152 HD13 LEU 22 3HD1 LEU 22 19.044 14.181 44.377 153 HD21 LEU 22 3HD2 LEU 22 20.239 14.776 48.418 154 HD22 LEU 22 1HD2 LEU 22 18.654 14.052 48.140 155 HD23 LEU 22 2HD2 LEU 22 18.942 15.738 47.715 156 H LEU 23 H LEU 23 19.008 9.661 45.190 157 HA LEU 23 HA LEU 23 21.187 8.008 46.219 158 HB2 LEU 23 2HB LEU 23 18.824 7.315 44.471 159 HB3 LEU 23 1HB LEU 23 19.989 6.168 45.094 160 HG LEU 23 HG LEU 23 18.076 7.792 46.777 161 HD11 LEU 23 1HD1 LEU 23 16.943 5.657 47.146 162 HD12 LEU 23 2HD1 LEU 23 18.033 4.877 46.002 163 HD13 LEU 23 3HD1 LEU 23 16.914 6.125 45.447 164 HD21 LEU 23 3HD2 LEU 23 18.799 6.324 48.593 165 HD22 LEU 23 1HD2 LEU 23 20.144 7.259 47.946 166 HD23 LEU 23 2HD2 LEU 23 19.965 5.558 47.514 167 H LYS 24 H LYS 24 22.305 6.611 44.624 168 HA LYS 24 HA LYS 24 23.282 8.106 42.386 169 HB2 LYS 24 2HB LYS 24 24.675 6.444 43.745 170 HB3 LYS 24 1HB LYS 24 23.719 5.153 43.057 171 HG2 LYS 24 2HG LYS 24 25.462 7.025 41.426 172 HG3 LYS 24 1HG LYS 24 26.004 5.476 42.047 173 HD2 LYS 24 2HD LYS 24 24.377 4.313 40.691 174 HD3 LYS 24 1HD LYS 24 23.654 5.835 40.185 175 HE2 LYS 24 2HE LYS 24 25.034 5.015 38.399 176 HE3 LYS 24 1HE LYS 24 25.810 6.430 39.094 177 HZ1 LYS 24 3HZ LYS 24 27.346 4.655 38.621 178 HZ2 LYS 24 1HZ LYS 24 26.534 3.614 39.659 179 HZ3 LYS 24 2HZ LYS 24 27.339 4.966 40.279 180 H GLU 25 H GLU 25 21.868 8.417 40.803 181 HA GLU 25 HA GLU 25 19.900 6.466 40.138 182 HB2 GLU 25 2HB GLU 25 20.699 9.035 38.780 183 HB3 GLU 25 1HB GLU 25 19.380 8.015 38.228 184 HG2 GLU 25 2HG GLU 25 19.583 9.444 40.867 185 HG3 GLU 25 1HG GLU 25 18.491 9.821 39.532 186 H MET 26 H MET 26 19.904 5.027 38.575 187 HA MET 26 HA MET 26 22.519 4.490 37.450 188 HB2 MET 26 2HB MET 26 21.654 2.258 36.900 189 HB3 MET 26 1HB MET 26 21.503 2.618 38.611 190 HG2 MET 26 2HG MET 26 19.122 3.056 38.305 191 HG3 MET 26 1HG MET 26 19.285 2.745 36.579 192 HE1 MET 26 3HE MET 26 17.314 0.973 36.698 193 HE2 MET 26 1HE MET 26 17.147 1.308 38.421 194 HE3 MET 26 2HE MET 26 17.266 -0.358 37.855 195 H GLU 27 H GLU 27 23.002 4.768 35.444 196 HA GLU 27 HA GLU 27 20.904 5.662 33.643 197 HB2 GLU 27 2HB GLU 27 23.902 5.945 33.539 198 HB3 GLU 27 1HB GLU 27 22.819 6.511 32.283 199 HG2 GLU 27 2HG GLU 27 22.877 7.469 35.140 200 HG3 GLU 27 1HG GLU 27 23.496 8.339 33.740 201 H SER 28 H SER 28 21.367 5.025 31.279 202 HA SER 28 HA SER 28 22.509 2.389 31.038 203 HB2 SER 28 2HB SER 28 20.410 1.681 29.754 204 HB3 SER 28 1HB SER 28 20.231 1.799 31.505 205 HG SER 28 HG SER 28 19.416 3.989 31.060 206 H SER 29 H SER 29 23.096 1.927 28.858 207 HA SER 29 HA SER 29 23.261 4.329 27.213 208 HB2 SER 29 2HB SER 29 24.819 1.742 27.101 209 HB3 SER 29 1HB SER 29 25.143 3.170 26.118 210 HG SER 29 HG SER 29 26.318 3.823 27.692 211 H THR 30 H THR 30 23.228 3.772 24.739 212 HA THR 30 HA THR 30 21.218 1.718 24.264 213 HB THR 30 HB THR 30 20.108 3.957 24.363 214 HG1 THR 30 1HG THR 30 19.061 2.578 23.089 215 HG21 THR 30 3HG2 THR 30 21.811 4.602 21.945 216 HG22 THR 30 1HG2 THR 30 21.948 5.356 23.533 217 HG23 THR 30 2HG2 THR 30 20.493 5.597 22.566 218 H GLY 31 H GLY 31 21.386 0.653 22.316 219 HA2 GLY 31 2HA GLY 31 23.986 0.862 21.028 220 HA3 GLY 31 1HA GLY 31 22.822 -0.443 20.835 221 H THR 32 H THR 32 23.526 -0.030 18.543 222 HA THR 32 HA THR 32 22.491 2.318 17.256 223 HB THR 32 HB THR 32 23.697 -0.200 16.080 224 HG1 THR 32 1HG THR 32 25.578 1.346 16.036 225 HG21 THR 32 3HG2 THR 32 23.522 2.624 15.009 226 HG22 THR 32 1HG2 THR 32 22.554 1.262 14.451 227 HG23 THR 32 2HG2 THR 32 24.299 1.259 14.204 228 H ALA 33 H ALA 33 20.778 2.294 15.706 229 HA ALA 33 HA ALA 33 18.811 0.212 16.069 230 HB1 ALA 33 1HB ALA 33 18.103 2.550 16.131 231 HB2 ALA 33 2HB ALA 33 17.356 1.710 14.769 232 HB3 ALA 33 3HB ALA 33 18.717 2.794 14.495 233 HA PRO 34 HA PRO 34 20.361 -1.709 12.248 234 HB2 PRO 34 2HB PRO 34 18.121 -3.565 12.591 235 HB3 PRO 34 1HB PRO 34 19.849 -3.909 12.631 236 HG2 PRO 34 2HG PRO 34 18.314 -4.029 14.837 237 HG3 PRO 34 1HG PRO 34 20.008 -3.516 14.895 238 HD2 PRO 34 2HD PRO 34 17.519 -1.854 14.948 239 HD3 PRO 34 1HD PRO 34 19.020 -1.701 15.894 240 H ALA 35 H ALA 35 19.807 -1.009 10.252 241 HA ALA 35 HA ALA 35 17.045 -0.279 9.733 242 HB1 ALA 35 1HB ALA 35 19.530 0.091 8.044 243 HB2 ALA 35 2HB ALA 35 18.773 1.332 9.043 244 HB3 ALA 35 3HB ALA 35 17.926 0.695 7.637 245 H SER 36 H SER 36 16.057 -2.217 9.600 246 HA SER 36 HA SER 36 16.993 -4.525 8.443 247 HB2 SER 36 2HB SER 36 14.131 -3.628 8.786 248 HB3 SER 36 1HB SER 36 14.696 -5.292 8.608 249 HG SER 36 HG SER 36 14.341 -4.641 10.794 250 H THR 37 H THR 37 17.518 -4.888 6.447 251 HA THR 37 HA THR 37 15.706 -4.294 4.313 252 HB THR 37 HB THR 37 17.246 -2.314 4.380 253 HG1 THR 37 1HG THR 37 18.066 -3.803 2.123 254 HG21 THR 37 3HG2 THR 37 19.202 -3.385 5.378 255 HG22 THR 37 1HG2 THR 37 19.626 -2.591 3.860 256 HG23 THR 37 2HG2 THR 37 19.433 -4.345 3.917 257 H GLY 38 H GLY 38 16.269 -5.685 2.461 258 HA2 GLY 38 2HA GLY 38 17.912 -7.457 1.769 259 HA3 GLY 38 1HA GLY 38 17.752 -8.030 3.421 260 H ALA 39 H ALA 39 16.403 -8.033 0.322 261 HA ALA 39 HA ALA 39 13.759 -8.779 1.075 262 HB1 ALA 39 1HB ALA 39 15.131 -9.081 -1.594 263 HB2 ALA 39 2HB ALA 39 14.209 -7.677 -1.061 264 HB3 ALA 39 3HB ALA 39 13.397 -9.222 -1.302 265 H GLU 40 H GLU 40 16.664 -10.469 0.336 266 HA GLU 40 HA GLU 40 15.361 -13.041 0.199 267 HB2 GLU 40 2HB GLU 40 17.581 -13.947 -0.271 268 HB3 GLU 40 1HB GLU 40 17.268 -12.571 -1.304 269 HG2 GLU 40 2HG GLU 40 18.947 -12.490 1.196 270 HG3 GLU 40 1HG GLU 40 19.605 -12.698 -0.427 271 H ASN 41 H ASN 41 17.176 -11.136 2.371 272 HA ASN 41 HA ASN 41 17.798 -13.218 4.239 273 HB2 ASN 41 2HB ASN 41 19.315 -11.350 3.890 274 HB3 ASN 41 1HB ASN 41 18.082 -10.214 4.380 275 HD21 ASN 41 1HD2 ASN 41 20.840 -10.974 5.316 276 HD22 ASN 41 2HD2 ASN 41 20.693 -11.144 7.030 277 H LEU 42 H LEU 42 15.382 -10.619 4.143 278 HA LEU 42 HA LEU 42 14.524 -11.300 6.791 279 HB2 LEU 42 2HB LEU 42 13.467 -9.326 4.787 280 HB3 LEU 42 1HB LEU 42 12.904 -9.472 6.436 281 HG LEU 42 HG LEU 42 15.687 -8.642 5.597 282 HD11 LEU 42 1HD1 LEU 42 15.030 -6.430 6.384 283 HD12 LEU 42 2HD1 LEU 42 13.394 -7.020 6.674 284 HD13 LEU 42 3HD1 LEU 42 14.033 -6.969 5.032 285 HD21 LEU 42 3HD2 LEU 42 15.971 -8.039 7.952 286 HD22 LEU 42 1HD2 LEU 42 15.671 -9.767 7.761 287 HD23 LEU 42 2HD2 LEU 42 14.376 -8.704 8.311 288 HA PRO 43 HA PRO 43 11.356 -14.260 5.774 289 HB2 PRO 43 2HB PRO 43 9.593 -12.745 7.631 290 HB3 PRO 43 1HB PRO 43 10.060 -14.444 7.683 291 HG2 PRO 43 2HG PRO 43 11.127 -12.759 9.398 292 HG3 PRO 43 1HG PRO 43 12.155 -13.966 8.601 293 HD2 PRO 43 2HD PRO 43 11.812 -11.059 7.979 294 HD3 PRO 43 1HD PRO 43 13.302 -12.019 8.122 295 H ALA 44 H ALA 44 9.996 -14.385 4.099 296 HA ALA 44 HA ALA 44 8.578 -11.977 3.247 297 HB1 ALA 44 1HB ALA 44 9.089 -14.542 1.761 298 HB2 ALA 44 2HB ALA 44 10.017 -13.049 1.573 299 HB3 ALA 44 3HB ALA 44 8.313 -13.112 1.098 300 H GLY 45 H GLY 45 6.576 -12.965 1.791 301 HA2 GLY 45 2HA GLY 45 4.736 -14.696 2.117 302 HA3 GLY 45 1HA GLY 45 4.801 -14.176 3.802 303 H SER 46 H SER 46 4.805 -12.588 0.642 304 HA SER 46 HA SER 46 3.676 -10.274 1.916 305 HB2 SER 46 2HB SER 46 4.511 -10.673 -0.914 306 HB3 SER 46 1HB SER 46 4.320 -9.164 -0.051 307 HG SER 46 HG SER 46 6.456 -9.667 -0.124 308 H ALA 47 H ALA 47 1.948 -9.220 1.137 309 HA ALA 47 HA ALA 47 -0.044 -10.777 -0.344 310 HB1 ALA 47 1HB ALA 47 -0.396 -8.632 1.762 311 HB2 ALA 47 2HB ALA 47 -0.698 -10.358 1.977 312 HB3 ALA 47 3HB ALA 47 -1.710 -9.412 0.885 313 H LEU 48 H LEU 48 -1.756 -8.481 -0.841 314 HA LEU 48 HA LEU 48 0.036 -6.822 -2.371 315 HB2 LEU 48 2HB LEU 48 -1.449 -6.958 -4.353 316 HB3 LEU 48 1HB LEU 48 -0.579 -8.430 -4.002 317 HG LEU 48 HG LEU 48 -2.777 -9.262 -2.947 318 HD11 LEU 48 1HD1 LEU 48 -4.831 -8.269 -3.786 319 HD12 LEU 48 2HD1 LEU 48 -3.904 -6.978 -4.544 320 HD13 LEU 48 3HD1 LEU 48 -3.927 -7.127 -2.786 321 HD21 LEU 48 3HD2 LEU 48 -1.904 -10.098 -5.056 322 HD22 LEU 48 1HD2 LEU 48 -2.648 -8.749 -5.912 323 HD23 LEU 48 2HD2 LEU 48 -3.661 -9.957 -5.119 324 H LEU 49 H LEU 49 -0.839 -4.853 -3.096 325 HA LEU 49 HA LEU 49 -3.196 -4.017 -1.656 326 HB2 LEU 49 2HB LEU 49 -2.041 -1.860 -1.114 327 HB3 LEU 49 1HB LEU 49 -1.502 -3.247 -0.198 328 HG LEU 49 HG LEU 49 0.465 -3.309 -1.883 329 HD11 LEU 49 1HD1 LEU 49 1.111 -1.124 -2.794 330 HD12 LEU 49 2HD1 LEU 49 -0.475 -0.492 -2.348 331 HD13 LEU 49 3HD1 LEU 49 -0.344 -1.787 -3.537 332 HD21 LEU 49 3HD2 LEU 49 0.224 -1.094 0.145 333 HD22 LEU 49 1HD2 LEU 49 1.734 -1.693 -0.542 334 HD23 LEU 49 2HD2 LEU 49 0.735 -2.751 0.454 335 H VAL 50 H VAL 50 -4.404 -2.488 -2.641 336 HA VAL 50 HA VAL 50 -3.655 -1.931 -5.447 337 HB VAL 50 HB VAL 50 -6.456 -2.343 -4.354 338 HG11 VAL 50 1HG1 VAL 50 -6.405 -0.805 -6.232 339 HG12 VAL 50 2HG1 VAL 50 -7.174 -2.323 -6.687 340 HG13 VAL 50 3HG1 VAL 50 -5.520 -1.985 -7.201 341 HG21 VAL 50 3HG2 VAL 50 -6.496 -4.442 -5.623 342 HG22 VAL 50 1HG2 VAL 50 -5.231 -4.465 -4.394 343 HG23 VAL 50 2HG2 VAL 50 -4.814 -4.201 -6.089 344 H VAL 51 H VAL 51 -3.517 0.223 -5.899 345 HA VAL 51 HA VAL 51 -4.731 2.103 -3.999 346 HB VAL 51 HB VAL 51 -2.928 2.754 -6.385 347 HG11 VAL 51 1HG1 VAL 51 -2.606 4.872 -5.260 348 HG12 VAL 51 2HG1 VAL 51 -3.713 4.370 -3.982 349 HG13 VAL 51 3HG1 VAL 51 -4.308 4.587 -5.625 350 HG21 VAL 51 3HG2 VAL 51 -1.725 1.319 -4.784 351 HG22 VAL 51 1HG2 VAL 51 -2.145 2.435 -3.487 352 HG23 VAL 51 2HG2 VAL 51 -1.089 2.965 -4.800 353 H LYS 52 H LYS 52 -6.632 2.695 -4.298 354 HA LYS 52 HA LYS 52 -8.127 2.209 -6.661 355 HB2 LYS 52 2HB LYS 52 -8.671 3.976 -4.277 356 HB3 LYS 52 1HB LYS 52 -9.818 3.723 -5.579 357 HG2 LYS 52 2HG LYS 52 -9.931 1.357 -5.034 358 HG3 LYS 52 1HG LYS 52 -8.734 1.589 -3.754 359 HD2 LYS 52 2HD LYS 52 -10.203 3.003 -2.525 360 HD3 LYS 52 1HD LYS 52 -11.341 3.088 -3.865 361 HE2 LYS 52 2HE LYS 52 -11.800 0.676 -3.591 362 HE3 LYS 52 1HE LYS 52 -10.650 0.637 -2.261 363 HZ1 LYS 52 3HZ LYS 52 -12.980 0.796 -1.561 364 HZ2 LYS 52 1HZ LYS 52 -13.093 2.331 -2.245 365 HZ3 LYS 52 2HZ LYS 52 -12.011 2.028 -0.969 366 H ARG 53 H ARG 53 -6.642 4.992 -5.218 367 HA ARG 53 HA ARG 53 -6.069 6.207 -7.671 368 HB2 ARG 53 2HB ARG 53 -8.554 6.749 -7.487 369 HB3 ARG 53 1HB ARG 53 -8.179 7.651 -6.027 370 HG2 ARG 53 2HG ARG 53 -8.405 9.144 -7.941 371 HG3 ARG 53 1HG ARG 53 -6.748 9.164 -7.334 372 HD2 ARG 53 2HD ARG 53 -6.060 7.629 -9.100 373 HD3 ARG 53 1HD ARG 53 -7.719 7.538 -9.695 374 HE ARG 53 HE ARG 53 -7.121 10.175 -9.804 375 HH11 ARG 53 1HH1 ARG 53 -5.408 7.320 -11.006 376 HH12 ARG 53 2HH1 ARG 53 -4.853 8.081 -12.420 377 HH21 ARG 53 1HH2 ARG 53 -6.300 11.220 -11.704 378 HH22 ARG 53 2HH2 ARG 53 -5.360 10.336 -12.844 379 H GLY 54 H GLY 54 -4.431 7.547 -7.320 380 HA2 GLY 54 2HA GLY 54 -3.980 9.143 -5.136 381 HA3 GLY 54 1HA GLY 54 -3.222 7.590 -4.799 382 HA PRO 55 HA PRO 55 -1.017 10.112 -8.278 383 HB2 PRO 55 2HB PRO 55 0.364 11.854 -6.361 384 HB3 PRO 55 1HB PRO 55 -0.496 12.278 -7.842 385 HG2 PRO 55 2HG PRO 55 -1.466 12.874 -5.409 386 HG3 PRO 55 1HG PRO 55 -2.518 12.480 -6.779 387 HD2 PRO 55 2HD PRO 55 -1.686 10.763 -4.473 388 HD3 PRO 55 1HD PRO 55 -3.268 10.918 -5.268 389 H ASN 56 H ASN 56 -0.228 8.690 -5.347 390 HA ASN 56 HA ASN 56 2.575 8.467 -5.308 391 HB2 ASN 56 2HB ASN 56 2.276 6.419 -4.005 392 HB3 ASN 56 1HB ASN 56 1.173 7.665 -3.426 393 HD21 ASN 56 1HD2 ASN 56 1.169 4.837 -3.027 394 HD22 ASN 56 2HD2 ASN 56 -0.320 4.227 -3.650 395 H ALA 57 H ALA 57 0.174 6.503 -7.035 396 HA ALA 57 HA ALA 57 2.003 5.953 -9.133 397 HB1 ALA 57 1HB ALA 57 1.276 3.641 -7.349 398 HB2 ALA 57 2HB ALA 57 2.886 4.348 -7.516 399 HB3 ALA 57 3HB ALA 57 2.129 3.529 -8.889 400 H GLY 58 H GLY 58 -0.920 4.846 -7.458 401 HA2 GLY 58 2HA GLY 58 -3.038 4.398 -8.286 402 HA3 GLY 58 1HA GLY 58 -2.556 5.227 -9.766 403 H ALA 59 H ALA 59 -1.878 2.202 -8.032 404 HA ALA 59 HA ALA 59 -2.492 0.527 -10.236 405 HB1 ALA 59 1HB ALA 59 -0.175 -0.376 -10.496 406 HB2 ALA 59 2HB ALA 59 0.415 0.918 -9.455 407 HB3 ALA 59 3HB ALA 59 -0.297 1.305 -11.017 408 H ARG 60 H ARG 60 -1.495 -1.786 -9.477 409 HA ARG 60 HA ARG 60 -1.789 -1.821 -6.576 410 HB2 ARG 60 2HB ARG 60 -2.678 -4.062 -6.677 411 HB3 ARG 60 1HB ARG 60 -3.633 -3.029 -7.716 412 HG2 ARG 60 2HG ARG 60 -2.537 -3.979 -9.678 413 HG3 ARG 60 1HG ARG 60 -1.529 -4.991 -8.633 414 HD2 ARG 60 2HD ARG 60 -3.614 -5.968 -7.694 415 HD3 ARG 60 1HD ARG 60 -4.531 -5.049 -8.881 416 HE ARG 60 HE ARG 60 -2.528 -7.081 -9.611 417 HH11 ARG 60 1HH1 ARG 60 -5.723 -5.591 -10.112 418 HH12 ARG 60 2HH1 ARG 60 -6.230 -6.749 -11.235 419 HH21 ARG 60 1HH2 ARG 60 -3.253 -8.654 -11.205 420 HH22 ARG 60 2HH2 ARG 60 -4.799 -8.499 -11.888 421 H PHE 61 H PHE 61 -0.419 -3.111 -5.388 422 HA PHE 61 HA PHE 61 1.957 -4.015 -6.837 423 HB2 PHE 61 2HB PHE 61 1.964 -2.295 -4.354 424 HB3 PHE 61 1HB PHE 61 3.383 -3.057 -5.049 425 HD1 PHE 61 1HD PHE 61 4.217 -2.297 -7.268 426 HD2 PHE 61 2HD PHE 61 1.091 -0.284 -5.203 427 HE1 PHE 61 1HE PHE 61 4.568 -0.324 -8.676 428 HE2 PHE 61 2HE PHE 61 1.435 1.693 -6.609 429 HZ PHE 61 HZ PHE 61 3.179 1.677 -8.350 430 H LEU 62 H LEU 62 3.133 -5.546 -5.775 431 HA LEU 62 HA LEU 62 1.835 -6.894 -3.521 432 HB2 LEU 62 2HB LEU 62 2.043 -8.152 -5.730 433 HB3 LEU 62 1HB LEU 62 3.777 -7.994 -5.601 434 HG LEU 62 HG LEU 62 2.129 -9.523 -3.567 435 HD11 LEU 62 1HD1 LEU 62 3.469 -10.557 -6.065 436 HD12 LEU 62 2HD1 LEU 62 1.729 -10.489 -5.772 437 HD13 LEU 62 3HD1 LEU 62 2.749 -11.549 -4.798 438 HD21 LEU 62 3HD2 LEU 62 4.251 -10.666 -3.136 439 HD22 LEU 62 1HD2 LEU 62 4.411 -8.927 -2.880 440 HD23 LEU 62 2HD2 LEU 62 5.042 -9.669 -4.353 441 H LEU 63 H LEU 63 3.251 -7.185 -1.697 442 HA LEU 63 HA LEU 63 5.317 -5.208 -1.667 443 HB2 LEU 63 2HB LEU 63 4.599 -7.293 0.420 444 HB3 LEU 63 1HB LEU 63 5.892 -6.145 0.634 445 HG LEU 63 HG LEU 63 4.176 -4.307 0.481 446 HD11 LEU 63 1HD1 LEU 63 1.832 -4.853 0.858 447 HD12 LEU 63 2HD1 LEU 63 2.200 -6.570 0.684 448 HD13 LEU 63 3HD1 LEU 63 2.402 -5.480 -0.688 449 HD21 LEU 63 3HD2 LEU 63 5.053 -5.059 2.613 450 HD22 LEU 63 1HD2 LEU 63 3.839 -6.334 2.684 451 HD23 LEU 63 2HD2 LEU 63 3.344 -4.644 2.757 452 H ASP 64 H ASP 64 7.150 -5.384 -2.454 453 HA ASP 64 HA ASP 64 8.136 -7.791 -3.617 454 HB2 ASP 64 2HB ASP 64 8.400 -5.532 -4.628 455 HB3 ASP 64 1HB ASP 64 9.480 -5.095 -3.312 456 H GLN 65 H GLN 65 9.489 -5.549 -1.278 457 HA GLN 65 HA GLN 65 11.208 -7.670 -0.335 458 HB2 GLN 65 2HB GLN 65 12.420 -5.756 -1.028 459 HB3 GLN 65 1HB GLN 65 11.344 -4.671 -0.168 460 HG2 GLN 65 2HG GLN 65 12.195 -5.514 1.957 461 HG3 GLN 65 1HG GLN 65 13.272 -6.607 1.088 462 HE21 GLN 65 1HE2 GLN 65 12.612 -3.362 -0.064 463 HE22 GLN 65 2HE2 GLN 65 14.172 -2.742 0.271 464 HA PRO 66 HA PRO 66 8.748 -8.352 3.420 465 HB2 PRO 66 2HB PRO 66 11.191 -8.252 4.955 466 HB3 PRO 66 1HB PRO 66 10.207 -9.659 4.545 467 HG2 PRO 66 2HG PRO 66 12.598 -8.562 3.172 468 HG3 PRO 66 1HG PRO 66 11.988 -10.226 3.200 469 HD2 PRO 66 2HD PRO 66 11.820 -8.763 1.033 470 HD3 PRO 66 1HD PRO 66 10.443 -9.778 1.508 471 H THR 67 H THR 67 11.473 -6.077 3.721 472 HA THR 67 HA THR 67 9.642 -4.354 5.211 473 HB THR 67 HB THR 67 12.671 -4.241 5.059 474 HG1 THR 67 1HG THR 67 11.069 -5.770 6.506 475 HG21 THR 67 3HG2 THR 67 11.742 -2.011 5.398 476 HG22 THR 67 1HG2 THR 67 12.466 -2.577 6.897 477 HG23 THR 67 2HG2 THR 67 10.710 -2.589 6.696 478 H THR 68 H THR 68 8.566 -3.353 3.632 479 HA THR 68 HA THR 68 9.942 -2.301 1.305 480 HB THR 68 HB THR 68 7.026 -2.033 2.071 481 HG1 THR 68 1HG THR 68 8.344 -4.297 1.366 482 HG21 THR 68 3HG2 THR 68 8.442 -1.892 -0.584 483 HG22 THR 68 1HG2 THR 68 7.797 -0.522 0.319 484 HG23 THR 68 2HG2 THR 68 6.701 -1.739 -0.335 485 H THR 69 H THR 69 10.860 -0.342 1.544 486 HA THR 69 HA THR 69 9.723 1.427 3.528 487 HB THR 69 HB THR 69 12.127 1.003 3.778 488 HG1 THR 69 1HG THR 69 12.032 2.878 4.551 489 HG21 THR 69 3HG2 THR 69 13.771 1.867 2.146 490 HG22 THR 69 1HG2 THR 69 12.451 2.285 1.053 491 HG23 THR 69 2HG2 THR 69 12.765 0.596 1.450 492 H ALA 70 H ALA 70 8.426 3.022 2.956 493 HA ALA 70 HA ALA 70 8.437 3.839 0.158 494 HB1 ALA 70 1HB ALA 70 6.377 2.757 0.902 495 HB2 ALA 70 2HB ALA 70 6.115 4.450 0.475 496 HB3 ALA 70 3HB ALA 70 6.203 3.968 2.170 497 H GLY 71 H GLY 71 8.241 5.985 -0.330 498 HA2 GLY 71 2HA GLY 71 7.820 8.200 0.971 499 HA3 GLY 71 1HA GLY 71 9.392 7.741 1.638 500 H ARG 72 H ARG 72 10.678 9.148 0.663 501 HA ARG 72 HA ARG 72 10.684 8.791 -2.182 502 HB2 ARG 72 2HB ARG 72 12.063 11.099 -2.110 503 HB3 ARG 72 1HB ARG 72 10.324 11.010 -2.308 504 HG2 ARG 72 2HG ARG 72 10.082 11.348 0.135 505 HG3 ARG 72 1HG ARG 72 11.837 11.554 0.225 506 HD2 ARG 72 2HD ARG 72 11.765 13.500 -1.138 507 HD3 ARG 72 1HD ARG 72 10.090 13.201 -1.581 508 HE ARG 72 HE ARG 72 9.410 13.864 0.566 509 HH11 ARG 72 1HH1 ARG 72 12.892 14.352 0.070 510 HH12 ARG 72 2HH1 ARG 72 13.029 15.611 1.191 511 HH21 ARG 72 1HH2 ARG 72 9.570 15.622 2.086 512 HH22 ARG 72 2HH2 ARG 72 11.082 16.348 2.375 513 H HIS 73 H HIS 73 13.406 10.137 -0.249 514 HA HIS 73 HA HIS 73 15.539 9.458 -0.123 515 HB2 HIS 73 2HB HIS 73 14.282 6.718 -0.509 516 HB3 HIS 73 1HB HIS 73 15.956 6.984 -0.087 517 HD1 HIS 73 1HD HIS 73 13.332 5.648 1.532 518 HD2 HIS 73 2HD HIS 73 15.610 9.013 2.410 519 HE1 HIS 73 1HE HIS 73 13.149 5.971 3.999 520 HA PRO 74 HA PRO 74 17.199 8.755 -4.306 521 HB2 PRO 74 2HB PRO 74 19.227 6.941 -3.905 522 HB3 PRO 74 1HB PRO 74 19.387 8.673 -3.603 523 HG2 PRO 74 2HG PRO 74 18.793 6.469 -1.675 524 HG3 PRO 74 1HG PRO 74 19.921 7.830 -1.511 525 HD2 PRO 74 2HD PRO 74 17.568 7.924 -0.302 526 HD3 PRO 74 1HD PRO 74 18.222 9.354 -1.108 527 H GLU 75 H GLU 75 16.124 6.100 -2.318 528 HA GLU 75 HA GLU 75 15.530 4.525 -4.669 529 HB2 GLU 75 2HB GLU 75 16.844 3.449 -2.170 530 HB3 GLU 75 1HB GLU 75 16.094 2.445 -3.395 531 HG2 GLU 75 2HG GLU 75 17.717 3.295 -5.029 532 HG3 GLU 75 1HG GLU 75 18.477 4.246 -3.752 533 H SER 76 H SER 76 13.497 5.151 -4.458 534 HA SER 76 HA SER 76 11.878 4.611 -2.135 535 HB2 SER 76 2HB SER 76 10.989 4.900 -5.026 536 HB3 SER 76 1HB SER 76 10.025 5.196 -3.579 537 HG SER 76 HG SER 76 11.912 6.794 -3.185 538 H ASP 77 H ASP 77 11.417 2.451 -1.518 539 HA ASP 77 HA ASP 77 11.999 0.347 -3.372 540 HB2 ASP 77 2HB ASP 77 12.192 0.209 -0.786 541 HB3 ASP 77 1HB ASP 77 10.454 -0.060 -0.792 542 H ILE 78 H ILE 78 9.105 1.883 -2.190 543 HA ILE 78 HA ILE 78 7.906 1.098 -4.692 544 HB ILE 78 HB ILE 78 5.618 1.080 -3.773 545 HG12 ILE 78 2HG1 ILE 78 5.492 0.610 -1.153 546 HG13 ILE 78 1HG1 ILE 78 6.931 1.622 -1.151 547 HG21 ILE 78 1HG2 ILE 78 5.602 -1.075 -2.611 548 HG22 ILE 78 2HG2 ILE 78 7.364 -0.998 -2.550 549 HG23 ILE 78 3HG2 ILE 78 6.531 -1.022 -4.104 550 HD11 ILE 78 3HD1 ILE 78 5.671 3.414 -2.241 551 HD12 ILE 78 1HD1 ILE 78 4.918 2.931 -0.722 552 HD13 ILE 78 2HD1 ILE 78 4.233 2.394 -2.255 553 H PHE 79 H PHE 79 6.114 2.779 -5.245 554 HA PHE 79 HA PHE 79 7.575 5.257 -4.809 555 HB2 PHE 79 2HB PHE 79 5.813 4.492 -7.132 556 HB3 PHE 79 1HB PHE 79 6.684 6.014 -6.965 557 HD1 PHE 79 1HD PHE 79 9.222 5.925 -6.815 558 HD2 PHE 79 2HD PHE 79 6.854 2.615 -8.061 559 HE1 PHE 79 1HE PHE 79 11.196 4.911 -7.864 560 HE2 PHE 79 2HE PHE 79 8.827 1.595 -9.115 561 HZ PHE 79 HZ PHE 79 11.007 2.741 -9.013 562 H LEU 80 H LEU 80 6.739 7.087 -4.191 563 HA LEU 80 HA LEU 80 3.895 7.349 -3.808 564 HB2 LEU 80 2HB LEU 80 6.078 8.184 -1.891 565 HB3 LEU 80 1HB LEU 80 4.417 8.711 -1.777 566 HG LEU 80 HG LEU 80 5.384 5.897 -1.514 567 HD11 LEU 80 1HD1 LEU 80 4.787 6.184 0.888 568 HD12 LEU 80 2HD1 LEU 80 4.443 7.886 0.566 569 HD13 LEU 80 3HD1 LEU 80 6.082 7.261 0.374 570 HD21 LEU 80 3HD2 LEU 80 3.098 5.461 -0.611 571 HD22 LEU 80 1HD2 LEU 80 3.139 5.880 -2.324 572 HD23 LEU 80 2HD2 LEU 80 2.643 7.083 -1.136 573 H ASP 81 H ASP 81 3.257 9.452 -3.996 574 HA ASP 81 HA ASP 81 5.060 11.503 -4.849 575 HB2 ASP 81 2HB ASP 81 4.910 10.278 -6.971 576 HB3 ASP 81 1HB ASP 81 3.153 10.318 -6.892 577 H ASP 82 H ASP 82 4.216 12.635 -3.290 578 HA ASP 82 HA ASP 82 1.833 14.108 -3.937 579 HB2 ASP 82 2HB ASP 82 0.931 12.231 -2.549 580 HB3 ASP 82 1HB ASP 82 2.043 12.675 -1.260 581 H VAL 83 H VAL 83 1.821 16.115 -2.785 582 HA VAL 83 HA VAL 83 4.348 17.205 -2.305 583 HB VAL 83 HB VAL 83 2.470 18.576 -3.056 584 HG11 VAL 83 1HG1 VAL 83 0.648 17.553 -1.863 585 HG12 VAL 83 2HG1 VAL 83 0.690 19.284 -1.519 586 HG13 VAL 83 3HG1 VAL 83 1.291 18.133 -0.326 587 HG21 VAL 83 3HG2 VAL 83 3.541 19.483 -0.385 588 HG22 VAL 83 1HG2 VAL 83 2.770 20.528 -1.577 589 HG23 VAL 83 2HG2 VAL 83 4.298 19.741 -1.959 590 H THR 84 H THR 84 2.178 15.606 -0.116 591 HA THR 84 HA THR 84 3.708 16.644 2.118 592 HB THR 84 HB THR 84 1.922 15.471 3.536 593 HG1 THR 84 1HG THR 84 0.814 15.195 0.931 594 HG21 THR 84 3HG2 THR 84 1.151 17.777 1.748 595 HG22 THR 84 1HG2 THR 84 2.032 17.885 3.272 596 HG23 THR 84 2HG2 THR 84 0.358 17.341 3.259 597 H VAL 85 H VAL 85 4.730 14.512 0.258 598 HA VAL 85 HA VAL 85 4.890 12.243 2.025 599 HB VAL 85 HB VAL 85 4.837 11.876 -0.452 600 HG11 VAL 85 1HG1 VAL 85 6.146 13.738 -1.235 601 HG12 VAL 85 2HG1 VAL 85 6.847 12.221 -1.801 602 HG13 VAL 85 3HG1 VAL 85 7.589 13.086 -0.459 603 HG21 VAL 85 3HG2 VAL 85 5.728 10.123 0.962 604 HG22 VAL 85 1HG2 VAL 85 7.329 10.856 0.898 605 HG23 VAL 85 2HG2 VAL 85 6.616 10.178 -0.562 606 H SER 86 H SER 86 6.357 11.865 3.475 607 HA SER 86 HA SER 86 8.339 13.887 4.032 608 HB2 SER 86 2HB SER 86 7.693 11.293 5.455 609 HB3 SER 86 1HB SER 86 8.590 12.664 6.121 610 HG SER 86 HG SER 86 6.178 13.347 5.064 611 H ARG 87 H ARG 87 10.684 13.172 4.455 612 HA ARG 87 HA ARG 87 11.642 11.754 2.226 613 HB2 ARG 87 2HB ARG 87 13.867 11.928 3.068 614 HB3 ARG 87 1HB ARG 87 13.067 13.379 3.622 615 HG2 ARG 87 2HG ARG 87 13.590 10.930 5.318 616 HG3 ARG 87 1HG ARG 87 14.637 12.337 5.254 617 HD2 ARG 87 2HD ARG 87 12.928 13.707 6.253 618 HD3 ARG 87 1HD ARG 87 11.745 12.398 6.133 619 HE ARG 87 HE ARG 87 13.797 11.335 7.553 620 HH11 ARG 87 1HH1 ARG 87 11.716 14.152 8.059 621 HH12 ARG 87 2HH1 ARG 87 11.848 14.120 9.759 622 HH21 ARG 87 1HH2 ARG 87 13.942 11.254 9.878 623 HH22 ARG 87 2HH2 ARG 87 13.133 12.422 10.809 624 H ARG 88 H ARG 88 11.067 10.795 5.481 625 HA ARG 88 HA ARG 88 11.367 7.946 4.866 626 HB2 ARG 88 2HB ARG 88 12.711 9.076 6.738 627 HB3 ARG 88 1HB ARG 88 11.175 9.428 7.507 628 HG2 ARG 88 2HG ARG 88 12.051 7.538 8.588 629 HG3 ARG 88 1HG ARG 88 10.772 6.937 7.529 630 HD2 ARG 88 2HD ARG 88 12.409 6.292 5.880 631 HD3 ARG 88 1HD ARG 88 13.710 6.951 6.873 632 HE ARG 88 HE ARG 88 12.028 4.651 7.625 633 HH11 ARG 88 1HH1 ARG 88 15.161 6.317 7.771 634 HH12 ARG 88 2HH1 ARG 88 15.915 5.038 8.576 635 HH21 ARG 88 1HH2 ARG 88 13.010 3.020 8.651 636 HH22 ARG 88 2HH2 ARG 88 14.663 3.038 9.113 637 H HIS 89 H HIS 89 9.214 7.276 4.350 638 HA HIS 89 HA HIS 89 7.186 8.926 5.642 639 HB2 HIS 89 2HB HIS 89 7.391 9.121 3.143 640 HB3 HIS 89 1HB HIS 89 6.824 7.461 3.032 641 HD2 HIS 89 2HD HIS 89 4.127 7.089 3.763 642 HE1 HIS 89 1HE HIS 89 3.276 11.223 3.603 643 HE2 HIS 89 2HE HIS 89 2.433 8.908 4.283 644 H ALA 90 H ALA 90 6.747 5.805 4.022 645 HA ALA 90 HA ALA 90 5.677 4.869 6.582 646 HB1 ALA 90 1HB ALA 90 4.396 4.482 3.874 647 HB2 ALA 90 2HB ALA 90 3.788 5.507 5.176 648 HB3 ALA 90 3HB ALA 90 3.848 3.761 5.386 649 H GLU 91 H GLU 91 6.579 3.104 7.171 650 HA GLU 91 HA GLU 91 7.737 1.501 5.010 651 HB2 GLU 91 2HB GLU 91 8.644 1.591 7.888 652 HB3 GLU 91 1HB GLU 91 9.344 0.574 6.630 653 HG2 GLU 91 2HG GLU 91 9.887 2.641 5.348 654 HG3 GLU 91 1HG GLU 91 9.326 3.579 6.725 655 H PHE 92 H PHE 92 7.108 -0.406 4.654 656 HA PHE 92 HA PHE 92 4.966 -1.515 6.317 657 HB2 PHE 92 2HB PHE 92 5.723 -2.156 3.448 658 HB3 PHE 92 1HB PHE 92 4.340 -2.780 4.314 659 HD1 PHE 92 2HD PHE 92 5.794 0.331 2.905 660 HD2 PHE 92 1HD PHE 92 2.285 -1.637 4.299 661 HE1 PHE 92 2HE PHE 92 4.414 2.169 2.026 662 HE2 PHE 92 1HE PHE 92 0.904 0.193 3.414 663 HZ PHE 92 HZ PHE 92 1.969 2.100 2.278 664 H ARG 93 H ARG 93 5.701 -3.081 7.626 665 HA ARG 93 HA ARG 93 7.910 -4.717 6.646 666 HB2 ARG 93 2HB ARG 93 7.050 -4.171 9.491 667 HB3 ARG 93 1HB ARG 93 8.282 -5.333 9.035 668 HG2 ARG 93 2HG ARG 93 9.565 -3.488 8.018 669 HG3 ARG 93 1HG ARG 93 8.374 -2.350 8.650 670 HD2 ARG 93 2HD ARG 93 10.105 -4.229 10.267 671 HD3 ARG 93 1HD ARG 93 10.343 -2.495 10.095 672 HE ARG 93 HE ARG 93 7.788 -3.329 11.179 673 HH11 ARG 93 1HH1 ARG 93 11.080 -2.280 11.917 674 HH12 ARG 93 2HH1 ARG 93 10.709 -1.738 13.487 675 HH21 ARG 93 1HH2 ARG 93 7.285 -2.565 13.390 676 HH22 ARG 93 2HH2 ARG 93 8.559 -1.931 14.319 677 H ILE 94 H ILE 94 7.403 -6.634 6.054 678 HA ILE 94 HA ILE 94 5.114 -7.841 7.348 679 HB ILE 94 HB ILE 94 4.659 -7.468 4.949 680 HG12 ILE 94 2HG1 ILE 94 3.695 -9.520 6.001 681 HG13 ILE 94 1HG1 ILE 94 3.873 -9.633 4.264 682 HG21 ILE 94 1HG2 ILE 94 5.852 -8.595 3.154 683 HG22 ILE 94 2HG2 ILE 94 7.044 -9.149 4.325 684 HG23 ILE 94 3HG2 ILE 94 6.843 -7.421 4.022 685 HD11 ILE 94 3HD1 ILE 94 5.850 -11.058 4.576 686 HD12 ILE 94 1HD1 ILE 94 4.420 -11.729 5.364 687 HD13 ILE 94 2HD1 ILE 94 5.662 -10.924 6.324 688 H ASN 95 H ASN 95 5.600 -9.250 8.656 689 HA ASN 95 HA ASN 95 8.032 -10.820 8.393 690 HB2 ASN 95 2HB ASN 95 6.615 -9.648 10.785 691 HB3 ASN 95 1HB ASN 95 7.701 -11.021 10.949 692 HD21 ASN 95 1HD2 ASN 95 9.852 -10.692 10.877 693 HD22 ASN 95 2HD2 ASN 95 10.608 -9.149 10.769 694 H GLU 96 H GLU 96 7.752 -12.995 8.843 695 HA GLU 96 HA GLU 96 5.395 -14.114 7.900 696 HB2 GLU 96 2HB GLU 96 6.318 -16.281 8.678 697 HB3 GLU 96 1HB GLU 96 7.475 -15.314 7.778 698 HG2 GLU 96 2HG GLU 96 8.535 -14.617 9.836 699 HG3 GLU 96 1HG GLU 96 7.357 -15.532 10.775 700 H GLY 97 H GLY 97 6.135 -13.076 11.075 701 HA2 GLY 97 2HA GLY 97 3.920 -14.568 12.245 702 HA3 GLY 97 1HA GLY 97 5.101 -13.606 13.115 703 H GLU 98 H GLU 98 4.715 -11.209 11.328 704 HA GLU 98 HA GLU 98 2.003 -10.395 11.912 705 HB2 GLU 98 2HB GLU 98 4.404 -9.236 13.281 706 HB3 GLU 98 1HB GLU 98 2.967 -8.281 13.014 707 HG2 GLU 98 2HG GLU 98 2.871 -10.907 14.453 708 HG3 GLU 98 1HG GLU 98 3.251 -9.400 15.292 709 H PHE 99 H PHE 99 1.365 -8.719 10.745 710 HA PHE 99 HA PHE 99 3.159 -7.646 8.651 711 HB2 PHE 99 2HB PHE 99 0.135 -7.867 8.828 712 HB3 PHE 99 1HB PHE 99 0.964 -6.966 7.577 713 HD1 PHE 99 2HD PHE 99 1.184 -10.430 9.024 714 HD2 PHE 99 1HD PHE 99 0.957 -7.982 5.554 715 HE1 PHE 99 2HE PHE 99 1.203 -12.439 7.600 716 HE2 PHE 99 1HE PHE 99 0.964 -9.989 4.133 717 HZ PHE 99 HZ PHE 99 1.088 -12.220 5.160 718 H GLU 100 H GLU 100 3.865 -5.575 9.231 719 HA GLU 100 HA GLU 100 1.912 -3.919 10.663 720 HB2 GLU 100 2HB GLU 100 3.454 -4.882 12.307 721 HB3 GLU 100 1HB GLU 100 4.816 -4.208 11.429 722 HG2 GLU 100 2HG GLU 100 4.000 -1.953 11.894 723 HG3 GLU 100 1HG GLU 100 2.634 -2.631 12.775 724 H VAL 101 H VAL 101 1.783 -1.850 10.031 725 HA VAL 101 HA VAL 101 3.843 -0.918 8.201 726 HB VAL 101 HB VAL 101 1.793 -1.135 6.910 727 HG11 VAL 101 1HG1 VAL 101 0.144 -1.158 8.686 728 HG12 VAL 101 2HG1 VAL 101 -0.285 0.036 7.461 729 HG13 VAL 101 3HG1 VAL 101 0.420 0.558 8.992 730 HG21 VAL 101 3HG2 VAL 101 1.429 1.183 6.169 731 HG22 VAL 101 1HG2 VAL 101 3.141 0.822 6.401 732 HG23 VAL 101 2HG2 VAL 101 2.261 1.761 7.610 733 H VAL 102 H VAL 102 5.004 0.659 8.936 734 HA VAL 102 HA VAL 102 3.944 2.234 11.184 735 HB VAL 102 HB VAL 102 6.847 1.750 10.444 736 HG11 VAL 102 1HG1 VAL 102 5.636 3.058 12.874 737 HG12 VAL 102 2HG1 VAL 102 6.514 3.868 11.577 738 HG13 VAL 102 3HG1 VAL 102 7.353 2.733 12.636 739 HG21 VAL 102 3HG2 VAL 102 5.826 -0.317 11.244 740 HG22 VAL 102 1HG2 VAL 102 5.240 0.518 12.683 741 HG23 VAL 102 2HG2 VAL 102 6.974 0.311 12.429 742 H ASP 103 H ASP 103 3.314 4.163 10.474 743 HA ASP 103 HA ASP 103 4.773 5.310 8.235 744 HB2 ASP 103 2HB ASP 103 2.430 5.118 7.760 745 HB3 ASP 103 1HB ASP 103 2.015 5.909 9.277 746 H VAL 104 H VAL 104 5.994 6.880 8.525 747 HA VAL 104 HA VAL 104 5.623 8.551 10.908 748 HB VAL 104 HB VAL 104 8.058 9.115 10.814 749 HG11 VAL 104 1HG1 VAL 104 7.466 6.174 11.079 750 HG12 VAL 104 2HG1 VAL 104 7.329 7.389 12.350 751 HG13 VAL 104 3HG1 VAL 104 8.911 6.979 11.685 752 HG21 VAL 104 3HG2 VAL 104 8.188 6.933 8.740 753 HG22 VAL 104 1HG2 VAL 104 9.578 7.721 9.483 754 HG23 VAL 104 2HG2 VAL 104 8.480 8.649 8.464 755 H GLY 105 H GLY 105 4.705 8.577 7.975 756 HA2 GLY 105 2HA GLY 105 5.673 11.225 7.208 757 HA3 GLY 105 1HA GLY 105 4.839 10.077 6.162 758 H SER 106 H SER 106 4.213 11.427 9.333 759 HA SER 106 HA SER 106 1.449 11.400 9.234 760 HB2 SER 106 2HB SER 106 3.123 13.250 10.897 761 HB3 SER 106 1HB SER 106 1.577 12.506 11.307 762 HG SER 106 HG SER 106 2.536 10.556 11.555 763 H LEU 107 H LEU 107 3.679 13.662 7.873 764 HA LEU 107 HA LEU 107 2.174 16.026 7.682 765 HB2 LEU 107 2HB LEU 107 4.070 14.772 5.711 766 HB3 LEU 107 1HB LEU 107 3.398 16.370 5.515 767 HG LEU 107 HG LEU 107 5.249 15.474 7.740 768 HD11 LEU 107 1HD1 LEU 107 5.744 17.261 5.370 769 HD12 LEU 107 2HD1 LEU 107 6.385 15.632 5.597 770 HD13 LEU 107 3HD1 LEU 107 6.885 16.937 6.674 771 HD21 LEU 107 3HD2 LEU 107 5.353 17.858 8.319 772 HD22 LEU 107 1HD2 LEU 107 3.725 17.212 8.516 773 HD23 LEU 107 2HD2 LEU 107 4.120 18.199 7.110 774 H ASN 108 H ASN 108 2.186 13.137 5.756 775 HA ASN 108 HA ASN 108 -0.033 14.057 4.115 776 HB2 ASN 108 2HB ASN 108 1.905 12.803 3.124 777 HB3 ASN 108 1HB ASN 108 1.471 11.449 4.166 778 HD21 ASN 108 1HD2 ASN 108 0.420 13.399 1.470 779 HD22 ASN 108 2HD2 ASN 108 -0.612 12.191 0.781 780 H GLY 109 H GLY 109 0.867 11.477 6.327 781 HA2 GLY 109 2HA GLY 109 -0.366 10.789 8.196 782 HA3 GLY 109 1HA GLY 109 -1.772 11.603 7.536 783 H THR 110 H THR 110 0.094 8.662 7.579 784 HA THR 110 HA THR 110 -1.884 7.339 5.941 785 HB THR 110 HB THR 110 0.584 6.300 7.334 786 HG1 THR 110 1HG THR 110 1.656 7.095 5.748 787 HG21 THR 110 3HG2 THR 110 -1.016 4.517 6.820 788 HG22 THR 110 1HG2 THR 110 0.396 4.397 5.773 789 HG23 THR 110 2HG2 THR 110 -1.116 5.068 5.151 790 H TYR 111 H TYR 111 -3.621 6.486 6.858 791 HA TYR 111 HA TYR 111 -3.548 5.425 9.616 792 HB2 TYR 111 2HB TYR 111 -5.783 7.135 8.476 793 HB3 TYR 111 1HB TYR 111 -5.759 6.382 10.065 794 HD1 TYR 111 1HD TYR 111 -4.186 7.261 11.811 795 HD2 TYR 111 2HD TYR 111 -4.744 9.222 8.080 796 HE1 TYR 111 1HE TYR 111 -3.211 9.316 12.750 797 HE2 TYR 111 2HE TYR 111 -3.769 11.276 9.005 798 HH TYR 111 HH TYR 111 -2.156 11.346 12.036 799 H VAL 112 H VAL 112 -5.605 4.014 9.927 800 HA VAL 112 HA VAL 112 -6.030 2.599 7.414 801 HB VAL 112 HB VAL 112 -6.323 1.599 10.272 802 HG11 VAL 112 1HG1 VAL 112 -6.492 -0.638 9.292 803 HG12 VAL 112 2HG1 VAL 112 -6.432 0.067 7.674 804 HG13 VAL 112 3HG1 VAL 112 -7.796 0.412 8.735 805 HG21 VAL 112 3HG2 VAL 112 -3.987 2.008 9.742 806 HG22 VAL 112 1HG2 VAL 112 -4.138 1.051 8.269 807 HG23 VAL 112 2HG2 VAL 112 -4.301 0.274 9.844 808 H ASN 113 H ASN 113 -8.143 2.195 6.793 809 HA ASN 113 HA ASN 113 -10.155 3.994 7.378 810 HB2 ASN 113 2HB ASN 113 -10.353 2.835 5.360 811 HB3 ASN 113 1HB ASN 113 -10.120 1.268 6.117 812 HD21 ASN 113 1HD2 ASN 113 -11.862 0.174 6.893 813 HD22 ASN 113 2HD2 ASN 113 -13.489 0.695 6.673 814 H ARG 114 H ARG 114 -9.556 0.872 8.797 815 HA ARG 114 HA ARG 114 -11.824 1.100 10.557 816 HB2 ARG 114 2HB ARG 114 -11.180 -1.122 9.859 817 HB3 ARG 114 1HB ARG 114 -9.552 -0.883 10.471 818 HG2 ARG 114 2HG ARG 114 -10.404 -0.754 12.748 819 HG3 ARG 114 1HG ARG 114 -12.045 -0.965 12.154 820 HD2 ARG 114 2HD ARG 114 -11.568 -3.184 11.427 821 HD3 ARG 114 1HD ARG 114 -9.840 -2.971 11.732 822 HE ARG 114 HE ARG 114 -10.816 -2.496 14.125 823 HH11 ARG 114 1HH1 ARG 114 -11.681 -5.139 11.930 824 HH12 ARG 114 2HH1 ARG 114 -11.931 -6.257 13.190 825 HH21 ARG 114 1HH2 ARG 114 -11.226 -4.020 15.824 826 HH22 ARG 114 2HH2 ARG 114 -11.703 -5.616 15.416 827 H GLU 115 H GLU 115 -8.393 1.807 10.735 828 HA GLU 115 HA GLU 115 -8.721 2.327 13.596 829 HB2 GLU 115 2HB GLU 115 -7.569 0.202 13.136 830 HB3 GLU 115 1HB GLU 115 -6.328 1.089 12.265 831 HG2 GLU 115 2HG GLU 115 -5.616 0.513 14.501 832 HG3 GLU 115 1HG GLU 115 -5.734 2.259 14.281 833 HA PRO 116 HA PRO 116 -7.107 6.280 12.108 834 HB2 PRO 116 2HB PRO 116 -7.778 7.715 14.277 835 HB3 PRO 116 1HB PRO 116 -9.001 7.151 13.136 836 HG2 PRO 116 2HG PRO 116 -8.218 6.019 15.790 837 HG3 PRO 116 1HG PRO 116 -9.838 6.252 15.109 838 HD2 PRO 116 2HD PRO 116 -8.498 3.859 15.111 839 HD3 PRO 116 1HD PRO 116 -9.745 4.302 13.927 840 H ARG 117 H ARG 117 -5.278 4.388 13.160 841 HA ARG 117 HA ARG 117 -3.601 6.098 14.824 842 HB2 ARG 117 2HB ARG 117 -3.821 3.098 14.846 843 HB3 ARG 117 1HB ARG 117 -2.337 3.883 15.372 844 HG2 ARG 117 2HG ARG 117 -3.620 5.179 17.021 845 HG3 ARG 117 1HG ARG 117 -5.078 4.345 16.484 846 HD2 ARG 117 2HD ARG 117 -2.707 2.802 17.497 847 HD3 ARG 117 1HD ARG 117 -3.864 3.498 18.622 848 HE ARG 117 HE ARG 117 -5.467 2.200 16.961 849 HH11 ARG 117 1HH1 ARG 117 -2.542 1.099 18.658 850 HH12 ARG 117 2HH1 ARG 117 -3.056 -0.512 18.792 851 HH21 ARG 117 1HH2 ARG 117 -6.175 -0.024 17.191 852 HH22 ARG 117 2HH2 ARG 117 -5.183 -1.177 17.947 853 H ASN 118 H ASN 118 -1.436 6.284 14.386 854 HA ASN 118 HA ASN 118 -1.051 6.619 11.581 855 HB2 ASN 118 2HB ASN 118 -0.181 8.063 13.571 856 HB3 ASN 118 1HB ASN 118 1.158 6.928 13.591 857 HD21 ASN 118 1HD2 ASN 118 0.845 6.710 10.557 858 HD22 ASN 118 2HD2 ASN 118 1.649 8.087 9.954 859 H ALA 119 H ALA 119 0.337 4.385 13.995 860 HA ALA 119 HA ALA 119 1.395 2.863 11.702 861 HB1 ALA 119 1HB ALA 119 2.287 2.838 14.597 862 HB2 ALA 119 2HB ALA 119 3.179 3.552 13.253 863 HB3 ALA 119 3HB ALA 119 2.938 1.808 13.324 864 H GLN 120 H GLN 120 0.669 0.814 11.507 865 HA GLN 120 HA GLN 120 -0.983 -0.255 13.597 866 HB2 GLN 120 2HB GLN 120 -2.119 0.871 11.204 867 HB3 GLN 120 1HB GLN 120 -2.563 -0.816 11.415 868 HG2 GLN 120 2HG GLN 120 -2.896 1.353 13.467 869 HG3 GLN 120 1HG GLN 120 -4.173 0.673 12.456 870 HE21 GLN 120 1HE2 GLN 120 -4.925 -1.427 12.889 871 HE22 GLN 120 2HE2 GLN 120 -4.598 -2.211 14.377 872 H VAL 121 H VAL 121 -1.371 -2.372 13.596 873 HA VAL 121 HA VAL 121 0.298 -3.945 11.879 874 HB VAL 121 HB VAL 121 -0.030 -4.691 14.214 875 HG11 VAL 121 1HG1 VAL 121 -2.167 -5.501 15.043 876 HG12 VAL 121 2HG1 VAL 121 -2.938 -4.968 13.545 877 HG13 VAL 121 3HG1 VAL 121 -2.220 -3.784 14.636 878 HG21 VAL 121 3HG2 VAL 121 -1.362 -6.575 12.278 879 HG22 VAL 121 1HG2 VAL 121 -0.705 -7.025 13.853 880 HG23 VAL 121 2HG2 VAL 121 0.369 -6.439 12.582 881 H MET 122 H MET 122 -0.401 -4.925 10.077 882 HA MET 122 HA MET 122 -2.466 -3.628 8.672 883 HB2 MET 122 2HB MET 122 -1.033 -6.168 7.906 884 HB3 MET 122 1HB MET 122 -1.974 -5.151 6.833 885 HG2 MET 122 2HG MET 122 -0.395 -3.331 7.112 886 HG3 MET 122 1HG MET 122 0.540 -4.291 8.254 887 HE1 MET 122 3HE MET 122 2.806 -4.053 6.952 888 HE2 MET 122 1HE MET 122 1.977 -2.950 5.857 889 HE3 MET 122 2HE MET 122 2.953 -4.269 5.207 890 H GLN 123 H GLN 123 -4.466 -4.141 8.155 891 HA GLN 123 HA GLN 123 -5.634 -6.560 9.332 892 HB2 GLN 123 2HB GLN 123 -6.390 -4.084 9.908 893 HB3 GLN 123 1HB GLN 123 -7.149 -4.153 8.334 894 HG2 GLN 123 2HG GLN 123 -7.732 -5.984 10.651 895 HG3 GLN 123 1HG GLN 123 -8.721 -4.618 10.158 896 HE21 GLN 123 1HE2 GLN 123 -9.946 -4.818 8.278 897 HE22 GLN 123 2HE2 GLN 123 -10.303 -6.350 7.572 898 H THR 124 H THR 124 -6.270 -8.042 7.829 899 HA THR 124 HA THR 124 -5.731 -7.469 5.098 900 HB THR 124 HB THR 124 -6.412 -9.913 4.858 901 HG1 THR 124 1HG THR 124 -7.710 -10.049 6.742 902 HG21 THR 124 3HG2 THR 124 -4.359 -10.713 5.955 903 HG22 THR 124 1HG2 THR 124 -4.258 -9.206 6.862 904 HG23 THR 124 2HG2 THR 124 -4.069 -9.192 5.109 905 H GLY 125 H GLY 125 -7.160 -6.532 3.786 906 HA2 GLY 125 2HA GLY 125 -9.162 -6.678 2.571 907 HA3 GLY 125 1HA GLY 125 -9.946 -7.374 3.982 908 H ASP 126 H ASP 126 -7.945 -4.686 4.720 909 HA ASP 126 HA ASP 126 -10.345 -3.019 4.643 910 HB2 ASP 126 2HB ASP 126 -9.517 -3.708 7.003 911 HB3 ASP 126 1HB ASP 126 -8.186 -2.589 6.724 912 H GLU 127 H GLU 127 -9.438 -0.556 5.046 913 HA GLU 127 HA GLU 127 -7.845 -0.261 2.618 914 HB2 GLU 127 2HB GLU 127 -10.237 0.296 2.428 915 HB3 GLU 127 1HB GLU 127 -10.061 1.470 3.712 916 HG2 GLU 127 2HG GLU 127 -8.589 2.795 2.299 917 HG3 GLU 127 1HG GLU 127 -8.731 1.593 1.015 918 H ILE 128 H ILE 128 -6.155 1.049 2.710 919 HA ILE 128 HA ILE 128 -5.511 2.317 5.251 920 HB ILE 128 HB ILE 128 -3.707 1.534 2.936 921 HG12 ILE 128 2HG1 ILE 128 -3.981 0.304 5.697 922 HG13 ILE 128 1HG1 ILE 128 -4.567 -0.406 4.201 923 HG21 ILE 128 1HG2 ILE 128 -2.874 3.508 4.100 924 HG22 ILE 128 2HG2 ILE 128 -1.842 2.119 4.444 925 HG23 ILE 128 3HG2 ILE 128 -3.003 2.675 5.648 926 HD11 ILE 128 3HD1 ILE 128 -2.271 -0.607 3.397 927 HD12 ILE 128 1HD1 ILE 128 -2.495 -1.444 4.932 928 HD13 ILE 128 2HD1 ILE 128 -1.677 0.119 4.891 929 H GLN 129 H GLN 129 -5.597 4.439 5.300 930 HA GLN 129 HA GLN 129 -6.019 5.856 2.794 931 HB2 GLN 129 2HB GLN 129 -6.541 6.666 5.647 932 HB3 GLN 129 1HB GLN 129 -6.749 7.725 4.265 933 HG2 GLN 129 2HG GLN 129 -8.440 6.158 3.377 934 HG3 GLN 129 1HG GLN 129 -8.268 5.195 4.844 935 HE21 GLN 129 1HE2 GLN 129 -9.069 6.019 6.805 936 HE22 GLN 129 2HE2 GLN 129 -10.116 7.381 6.827 937 H ILE 130 H ILE 130 -4.271 6.633 1.986 938 HA ILE 130 HA ILE 130 -2.243 7.658 3.781 939 HB ILE 130 HB ILE 130 -0.856 7.736 1.563 940 HG12 ILE 130 2HG1 ILE 130 -3.022 5.753 0.788 941 HG13 ILE 130 1HG1 ILE 130 -2.674 7.284 -0.008 942 HG21 ILE 130 1HG2 ILE 130 -0.118 5.417 1.870 943 HG22 ILE 130 2HG2 ILE 130 -1.539 5.109 2.868 944 HG23 ILE 130 3HG2 ILE 130 -0.320 6.270 3.400 945 HD11 ILE 130 3HD1 ILE 130 -0.870 4.870 0.086 946 HD12 ILE 130 1HD1 ILE 130 -0.494 6.397 -0.710 947 HD13 ILE 130 2HD1 ILE 130 -1.827 5.404 -1.296 948 H GLY 131 H GLY 131 -2.812 9.599 4.293 949 HA2 GLY 131 2HA GLY 131 -3.278 11.824 4.038 950 HA3 GLY 131 1HA GLY 131 -3.080 11.629 2.290 951 H LYS 132 H LYS 132 -4.841 11.839 1.147 952 HA LYS 132 HA LYS 132 -7.319 10.878 2.338 953 HB2 LYS 132 2HB LYS 132 -6.997 13.345 0.616 954 HB3 LYS 132 1HB LYS 132 -8.545 12.663 1.100 955 HG2 LYS 132 2HG LYS 132 -8.018 13.033 3.440 956 HG3 LYS 132 1HG LYS 132 -6.425 13.639 3.000 957 HD2 LYS 132 2HD LYS 132 -7.513 15.479 1.768 958 HD3 LYS 132 1HD LYS 132 -9.080 14.881 2.311 959 HE2 LYS 132 2HE LYS 132 -8.244 16.740 3.711 960 HE3 LYS 132 1HE LYS 132 -8.476 15.252 4.625 961 HZ1 LYS 132 3HZ LYS 132 -6.111 14.868 4.611 962 HZ2 LYS 132 1HZ LYS 132 -6.398 16.416 5.160 963 HZ3 LYS 132 2HZ LYS 132 -5.820 16.178 3.604 964 H PHE 133 H PHE 133 -5.118 10.079 0.234 965 HA PHE 133 HA PHE 133 -7.076 9.163 -1.668 966 HB2 PHE 133 2HB PHE 133 -5.036 8.467 -3.108 967 HB3 PHE 133 1HB PHE 133 -5.421 10.167 -3.006 968 HD1 PHE 133 2HD PHE 133 -3.981 11.617 -1.485 969 HD2 PHE 133 1HD PHE 133 -2.915 7.650 -2.577 970 HE1 PHE 133 2HE PHE 133 -1.619 12.100 -0.942 971 HE2 PHE 133 1HE PHE 133 -0.554 8.146 -2.046 972 HZ PHE 133 HZ PHE 133 0.080 10.363 -1.229 973 H ARG 134 H ARG 134 -6.866 6.824 -2.419 974 HA ARG 134 HA ARG 134 -6.650 5.450 0.168 975 HB2 ARG 134 2HB ARG 134 -8.927 5.190 -1.778 976 HB3 ARG 134 1HB ARG 134 -8.750 4.273 -0.284 977 HG2 ARG 134 2HG ARG 134 -8.800 6.365 0.995 978 HG3 ARG 134 1HG ARG 134 -9.014 7.264 -0.502 979 HD2 ARG 134 2HD ARG 134 -11.133 6.084 -0.885 980 HD3 ARG 134 1HD ARG 134 -10.917 5.217 0.637 981 HE ARG 134 HE ARG 134 -11.390 8.086 0.317 982 HH11 ARG 134 1HH1 ARG 134 -11.325 5.222 2.447 983 HH12 ARG 134 2HH1 ARG 134 -12.071 6.047 3.746 984 HH21 ARG 134 1HH2 ARG 134 -12.429 9.157 2.156 985 HH22 ARG 134 2HH2 ARG 134 -12.688 8.270 3.581 986 H LEU 135 H LEU 135 -5.825 3.569 0.348 987 HA LEU 135 HA LEU 135 -5.183 1.957 -2.008 988 HB2 LEU 135 2HB LEU 135 -3.215 3.140 -1.170 989 HB3 LEU 135 1HB LEU 135 -3.577 2.670 0.463 990 HG LEU 135 HG LEU 135 -2.770 0.618 -1.614 991 HD11 LEU 135 1HD1 LEU 135 -1.016 2.282 0.205 992 HD12 LEU 135 2HD1 LEU 135 -1.041 2.357 -1.557 993 HD13 LEU 135 3HD1 LEU 135 -0.468 0.902 -0.741 994 HD21 LEU 135 3HD2 LEU 135 -2.549 0.740 1.402 995 HD22 LEU 135 1HD2 LEU 135 -1.990 -0.592 0.398 996 HD23 LEU 135 2HD2 LEU 135 -3.712 -0.234 0.500 997 H VAL 136 H VAL 136 -5.761 -0.225 -1.717 998 HA VAL 136 HA VAL 136 -6.930 -0.910 0.908 999 HB VAL 136 HB VAL 136 -7.587 -2.215 -1.753 1000 HG11 VAL 136 1HG1 VAL 136 -8.962 -2.385 0.928 1001 HG12 VAL 136 2HG1 VAL 136 -7.994 -3.648 0.171 1002 HG13 VAL 136 3HG1 VAL 136 -9.518 -3.151 -0.563 1003 HG21 VAL 136 3HG2 VAL 136 -9.184 -0.149 -0.254 1004 HG22 VAL 136 1HG2 VAL 136 -9.691 -1.017 -1.701 1005 HG23 VAL 136 2HG2 VAL 136 -8.327 0.108 -1.779 1006 H PHE 137 H PHE 137 -6.229 -2.769 1.913 1007 HA PHE 137 HA PHE 137 -3.954 -4.107 0.620 1008 HB2 PHE 137 2HB PHE 137 -3.381 -2.925 2.701 1009 HB3 PHE 137 1HB PHE 137 -4.625 -3.817 3.562 1010 HD1 PHE 137 2HD PHE 137 -1.466 -4.256 1.670 1011 HD2 PHE 137 1HD PHE 137 -4.124 -5.858 4.582 1012 HE1 PHE 137 2HE PHE 137 0.170 -6.016 2.197 1013 HE2 PHE 137 1HE PHE 137 -2.492 -7.613 5.113 1014 HZ PHE 137 HZ PHE 137 -0.345 -7.694 3.914 1015 H LEU 138 H LEU 138 -4.347 -6.116 -0.097 1016 HA LEU 138 HA LEU 138 -6.516 -7.625 1.192 1017 HB2 LEU 138 2HB LEU 138 -5.675 -7.751 -1.707 1018 HB3 LEU 138 1HB LEU 138 -6.843 -8.805 -0.962 1019 HG LEU 138 HG LEU 138 -8.086 -7.325 -2.189 1020 HD11 LEU 138 1HD1 LEU 138 -9.050 -7.599 -0.041 1021 HD12 LEU 138 2HD1 LEU 138 -9.363 -5.966 -0.637 1022 HD13 LEU 138 3HD1 LEU 138 -8.130 -6.232 0.591 1023 HD21 LEU 138 3HD2 LEU 138 -7.846 -4.864 -2.171 1024 HD22 LEU 138 1HD2 LEU 138 -6.399 -5.684 -2.760 1025 HD23 LEU 138 2HD2 LEU 138 -6.439 -5.034 -1.121 1026 H ALA 139 H ALA 139 -6.213 -9.733 1.570 1027 HA ALA 139 HA ALA 139 -3.449 -10.675 1.426 1028 HB1 ALA 139 1HB ALA 139 -4.472 -10.768 3.648 1029 HB2 ALA 139 2HB ALA 139 -4.143 -12.393 3.049 1030 HB3 ALA 139 3HB ALA 139 -5.788 -11.753 3.014 1031 H GLY 140 H GLY 140 -3.359 -11.269 -0.640 1032 HA2 GLY 140 2HA GLY 140 -5.273 -13.303 -1.532 1033 HA3 GLY 140 1HA GLY 140 -4.334 -12.282 -2.616 1034 HA PRO 141 HA PRO 141 -1.260 -15.368 -2.730 1035 HB2 PRO 141 2HB PRO 141 1.028 -13.641 -2.517 1036 HB3 PRO 141 1HB PRO 141 0.347 -14.392 -3.961 1037 HG2 PRO 141 2HG PRO 141 0.285 -11.675 -3.416 1038 HG3 PRO 141 1HG PRO 141 -0.803 -12.509 -4.534 1039 HD2 PRO 141 2HD PRO 141 -1.284 -11.585 -1.749 1040 HD3 PRO 141 1HD PRO 141 -2.401 -11.681 -3.121 1041 H ALA 142 H ALA 142 -0.567 -16.716 -1.260 1042 HA ALA 142 HA ALA 142 0.624 -15.698 1.219 1043 HB1 ALA 142 1HB ALA 142 -0.013 -17.845 2.247 1044 HB2 ALA 142 2HB ALA 142 -0.737 -18.360 0.727 1045 HB3 ALA 142 3HB ALA 142 -1.431 -17.005 1.618 1046 H GLU 143 H GLU 143 2.798 -15.833 1.072 1047 HA GLU 143 HA GLU 143 3.840 -17.958 -0.612 1048 HB2 GLU 143 2HB GLU 143 4.420 -15.598 -1.213 1049 HB3 GLU 143 1HB GLU 143 5.234 -15.438 0.333 1050 HG2 GLU 143 2HG GLU 143 6.831 -17.138 -0.297 1051 HG3 GLU 143 1HG GLU 143 5.976 -17.403 -1.814 Start of MODEL 7 1 H1 MET 1 1HT MET 1 -75.955 18.098 35.069 2 H2 MET 1 2HT MET 1 -74.796 19.194 35.603 3 H3 MET 1 3HT MET 1 -76.353 19.276 36.209 4 HA MET 1 HA MET 1 -74.791 18.364 37.752 5 HB2 MET 1 2HB MET 1 -76.022 16.317 38.400 6 HB3 MET 1 1HB MET 1 -77.074 17.670 38.069 7 HG2 MET 1 2HG MET 1 -78.096 15.695 37.212 8 HG3 MET 1 1HG MET 1 -77.577 16.664 35.844 9 HE1 MET 1 2HE MET 1 -75.426 12.800 37.259 10 HE2 MET 1 3HE MET 1 -76.841 13.491 38.049 11 HE3 MET 1 1HE MET 1 -75.294 14.328 38.126 12 H SER 2 H SER 2 -74.389 17.054 34.597 13 HA SER 2 HA SER 2 -72.870 14.801 35.393 14 HB2 SER 2 2HB SER 2 -72.860 16.297 32.767 15 HB3 SER 2 1HB SER 2 -72.383 14.616 33.041 16 HG SER 2 HG SER 2 -74.672 14.482 33.915 17 H ASP 3 H ASP 3 -72.283 18.170 34.792 18 HA ASP 3 HA ASP 3 -70.612 19.536 35.042 19 HB2 ASP 3 2HB ASP 3 -70.283 19.019 37.257 20 HB3 ASP 3 1HB ASP 3 -69.765 17.382 36.916 21 H ASN 4 H ASN 4 -69.815 20.040 33.309 22 HA ASN 4 HA ASN 4 -67.637 18.462 32.152 23 HB2 ASN 4 2HB ASN 4 -68.350 19.392 29.937 24 HB3 ASN 4 1HB ASN 4 -69.560 18.349 30.669 25 HD21 ASN 4 1HD2 ASN 4 -68.845 21.557 29.556 26 HD22 ASN 4 2HD2 ASN 4 -70.401 22.213 29.862 27 H ASN 5 H ASN 5 -65.790 19.614 31.604 28 HA ASN 5 HA ASN 5 -65.753 22.487 31.998 29 HB2 ASN 5 2HB ASN 5 -65.530 21.503 34.281 30 HB3 ASN 5 1HB ASN 5 -64.135 20.589 33.720 31 HD21 ASN 5 1HD2 ASN 5 -62.754 21.522 35.183 32 HD22 ASN 5 2HD2 ASN 5 -62.245 23.165 35.063 33 H GLY 6 H GLY 6 -63.700 23.376 31.289 34 HA2 GLY 6 2HA GLY 6 -62.556 21.932 29.102 35 HA3 GLY 6 1HA GLY 6 -62.066 23.525 29.676 36 H THR 7 H THR 7 -61.281 20.267 29.564 37 HA THR 7 HA THR 7 -59.451 20.551 31.789 38 HB THR 7 HB THR 7 -60.801 18.533 31.889 39 HG1 THR 7 1HG THR 7 -59.133 17.673 32.703 40 HG21 THR 7 3HG2 THR 7 -60.597 16.731 30.207 41 HG22 THR 7 1HG2 THR 7 -59.624 17.801 29.198 42 HG23 THR 7 2HG2 THR 7 -61.314 18.194 29.533 43 HA PRO 8 HA PRO 8 -56.217 21.465 28.913 44 HB2 PRO 8 2HB PRO 8 -54.109 21.141 30.614 45 HB3 PRO 8 1HB PRO 8 -55.137 22.578 30.611 46 HG2 PRO 8 2HG PRO 8 -55.239 20.184 32.400 47 HG3 PRO 8 1HG PRO 8 -55.389 21.901 32.821 48 HD2 PRO 8 2HD PRO 8 -57.527 20.287 32.597 49 HD3 PRO 8 1HD PRO 8 -57.596 21.999 32.128 50 H GLU 9 H GLU 9 -55.356 20.134 27.468 51 HA GLU 9 HA GLU 9 -54.997 17.357 28.184 52 HB2 GLU 9 2HB GLU 9 -54.837 18.722 25.494 53 HB3 GLU 9 1HB GLU 9 -54.743 16.984 25.761 54 HG2 GLU 9 2HG GLU 9 -57.006 17.057 26.752 55 HG3 GLU 9 1HG GLU 9 -57.093 18.764 26.338 56 HA PRO 10 HA PRO 10 -50.785 17.772 29.204 57 HB2 PRO 10 2HB PRO 10 -50.424 15.209 27.763 58 HB3 PRO 10 1HB PRO 10 -49.922 15.660 29.393 59 HG2 PRO 10 2HG PRO 10 -52.060 14.106 29.026 60 HG3 PRO 10 1HG PRO 10 -52.041 15.350 30.288 61 HD2 PRO 10 2HD PRO 10 -53.441 15.334 27.661 62 HD3 PRO 10 1HD PRO 10 -53.921 16.058 29.213 63 H GLN 11 H GLN 11 -49.281 18.901 28.333 64 HA GLN 11 HA GLN 11 -48.571 18.617 25.492 65 HB2 GLN 11 2HB GLN 11 -48.067 20.908 27.420 66 HB3 GLN 11 1HB GLN 11 -47.501 20.847 25.763 67 HG2 GLN 11 2HG GLN 11 -49.800 20.871 24.974 68 HG3 GLN 11 1HG GLN 11 -50.371 20.923 26.644 69 HE21 GLN 11 1HE2 GLN 11 -50.109 22.826 27.833 70 HE22 GLN 11 2HE2 GLN 11 -49.695 24.318 27.096 71 H VAL 12 H VAL 12 -46.874 17.240 25.418 72 HA VAL 12 HA VAL 12 -45.006 17.475 27.619 73 HB VAL 12 HB VAL 12 -46.239 15.386 27.756 74 HG11 VAL 12 1HG1 VAL 12 -46.816 14.982 25.475 75 HG12 VAL 12 2HG1 VAL 12 -45.974 13.579 26.134 76 HG13 VAL 12 3HG1 VAL 12 -45.127 14.691 25.059 77 HG21 VAL 12 3HG2 VAL 12 -44.310 13.811 27.875 78 HG22 VAL 12 1HG2 VAL 12 -44.017 15.372 28.648 79 HG23 VAL 12 2HG2 VAL 12 -43.337 15.038 27.063 80 H GLU 13 H GLU 13 -43.308 18.500 27.038 81 HA GLU 13 HA GLU 13 -41.863 17.684 24.643 82 HB2 GLU 13 2HB GLU 13 -43.343 19.885 24.406 83 HB3 GLU 13 1HB GLU 13 -42.078 20.605 25.385 84 HG2 GLU 13 2HG GLU 13 -41.741 19.344 22.656 85 HG3 GLU 13 1HG GLU 13 -41.719 21.062 23.025 86 H THR 14 H THR 14 -39.637 17.809 25.039 87 HA THR 14 HA THR 14 -38.660 18.973 27.460 88 HB THR 14 HB THR 14 -38.448 15.963 27.067 89 HG1 THR 14 1HG THR 14 -40.271 17.515 28.271 90 HG21 THR 14 3HG2 THR 14 -37.440 17.728 29.322 91 HG22 THR 14 1HG2 THR 14 -36.432 16.960 28.094 92 HG23 THR 14 2HG2 THR 14 -37.320 15.971 29.254 93 H THR 15 H THR 15 -37.303 20.221 26.190 94 HA THR 15 HA THR 15 -35.304 18.730 24.701 95 HB THR 15 HB THR 15 -34.914 21.115 23.638 96 HG1 THR 15 1HG THR 15 -37.700 21.275 24.130 97 HG21 THR 15 3HG2 THR 15 -37.258 19.366 22.878 98 HG22 THR 15 1HG2 THR 15 -35.586 19.125 22.373 99 HG23 THR 15 2HG2 THR 15 -36.478 20.544 21.821 100 H SER 16 H SER 16 -33.624 18.420 25.945 101 HA SER 16 HA SER 16 -32.022 20.575 26.808 102 HB2 SER 16 2HB SER 16 -33.633 20.523 28.705 103 HB3 SER 16 1HB SER 16 -33.300 18.810 28.938 104 HG SER 16 HG SER 16 -31.419 19.249 29.770 105 H VAL 17 H VAL 17 -30.121 19.773 26.123 106 HA VAL 17 HA VAL 17 -29.416 17.070 26.909 107 HB VAL 17 HB VAL 17 -30.319 16.939 24.579 108 HG11 VAL 17 1HG1 VAL 17 -29.023 17.846 22.698 109 HG12 VAL 17 2HG1 VAL 17 -28.026 18.741 23.848 110 HG13 VAL 17 3HG1 VAL 17 -29.748 19.092 23.714 111 HG21 VAL 17 3HG2 VAL 17 -28.689 15.281 25.284 112 HG22 VAL 17 1HG2 VAL 17 -27.366 16.347 24.813 113 HG23 VAL 17 2HG2 VAL 17 -28.439 15.679 23.585 114 H PHE 18 H PHE 18 -27.246 16.789 27.282 115 HA PHE 18 HA PHE 18 -25.475 19.039 26.744 116 HB2 PHE 18 2HB PHE 18 -25.653 17.408 29.300 117 HB3 PHE 18 1HB PHE 18 -24.332 18.511 28.931 118 HD1 PHE 18 1HD PHE 18 -24.687 20.913 28.890 119 HD2 PHE 18 2HD PHE 18 -27.834 18.240 29.920 120 HE1 PHE 18 1HE PHE 18 -25.994 22.793 29.778 121 HE2 PHE 18 2HE PHE 18 -29.143 20.115 30.808 122 HZ PHE 18 HZ PHE 18 -28.219 22.402 30.734 123 H ARG 19 H ARG 19 -23.197 18.335 26.664 124 HA ARG 19 HA ARG 19 -23.010 15.574 25.766 125 HB2 ARG 19 2HB ARG 19 -21.412 16.481 23.996 126 HB3 ARG 19 1HB ARG 19 -23.142 16.660 23.729 127 HG2 ARG 19 2HG ARG 19 -23.027 18.978 24.386 128 HG3 ARG 19 1HG ARG 19 -21.317 18.810 24.790 129 HD2 ARG 19 2HD ARG 19 -20.749 18.395 22.514 130 HD3 ARG 19 1HD ARG 19 -22.441 18.285 22.049 131 HE ARG 19 HE ARG 19 -22.657 20.603 22.339 132 HH11 ARG 19 1HH1 ARG 19 -19.318 19.599 22.881 133 HH12 ARG 19 2HH1 ARG 19 -18.645 21.030 22.247 134 HH21 ARG 19 1HH2 ARG 19 -21.700 22.612 21.519 135 HH22 ARG 19 2HH2 ARG 19 -20.002 22.763 21.506 136 H ALA 20 H ALA 20 -21.232 14.501 26.263 137 HA ALA 20 HA ALA 20 -19.298 15.805 28.029 138 HB1 ALA 20 1HB ALA 20 -18.745 13.512 28.721 139 HB2 ALA 20 2HB ALA 20 -19.870 12.884 27.516 140 HB3 ALA 20 3HB ALA 20 -20.473 13.832 28.873 141 H ASP 21 H ASP 21 -18.992 16.428 25.312 142 HA ASP 21 HA ASP 21 -17.183 14.673 23.992 143 HB2 ASP 21 2HB ASP 21 -16.866 16.490 22.386 144 HB3 ASP 21 1HB ASP 21 -18.573 16.207 22.709 145 H LEU 22 H LEU 22 -16.755 16.907 26.454 146 HA LEU 22 HA LEU 22 -13.963 17.437 25.953 147 HB2 LEU 22 2HB LEU 22 -15.452 18.989 27.232 148 HB3 LEU 22 1HB LEU 22 -15.607 17.771 28.479 149 HG LEU 22 HG LEU 22 -13.159 17.954 28.879 150 HD11 LEU 22 1HD1 LEU 22 -13.350 20.298 27.010 151 HD12 LEU 22 2HD1 LEU 22 -12.465 18.797 26.729 152 HD13 LEU 22 3HD1 LEU 22 -11.958 19.887 28.011 153 HD21 LEU 22 3HD2 LEU 22 -14.772 20.477 29.169 154 HD22 LEU 22 1HD2 LEU 22 -13.289 20.110 30.053 155 HD23 LEU 22 2HD2 LEU 22 -14.728 19.123 30.298 156 H LEU 23 H LEU 23 -12.237 16.549 27.385 157 HA LEU 23 HA LEU 23 -11.125 14.953 28.495 158 HB2 LEU 23 2HB LEU 23 -13.882 14.145 29.369 159 HB3 LEU 23 1HB LEU 23 -12.555 13.040 29.632 160 HG LEU 23 HG LEU 23 -11.466 14.636 31.115 161 HD11 LEU 23 1HD1 LEU 23 -13.787 16.465 30.528 162 HD12 LEU 23 2HD1 LEU 23 -12.093 16.724 30.084 163 HD13 LEU 23 3HD1 LEU 23 -12.568 16.712 31.780 164 HD21 LEU 23 3HD2 LEU 23 -14.381 14.315 31.751 165 HD22 LEU 23 1HD2 LEU 23 -13.088 14.633 32.905 166 HD23 LEU 23 2HD2 LEU 23 -13.121 13.108 32.014 167 H LYS 24 H LYS 24 -11.690 14.880 25.830 168 HA LYS 24 HA LYS 24 -12.023 12.101 25.080 169 HB2 LYS 24 2HB LYS 24 -13.047 13.932 23.721 170 HB3 LYS 24 1HB LYS 24 -11.451 14.571 23.407 171 HG2 LYS 24 2HG LYS 24 -12.222 11.794 22.532 172 HG3 LYS 24 1HG LYS 24 -12.626 13.200 21.557 173 HD2 LYS 24 2HD LYS 24 -10.209 13.775 21.482 174 HD3 LYS 24 1HD LYS 24 -9.858 12.304 22.385 175 HE2 LYS 24 2HE LYS 24 -9.479 11.934 20.014 176 HE3 LYS 24 1HE LYS 24 -10.849 10.977 20.562 177 HZ1 LYS 24 3HZ LYS 24 -12.349 12.516 19.571 178 HZ2 LYS 24 1HZ LYS 24 -11.222 12.088 18.417 179 HZ3 LYS 24 2HZ LYS 24 -11.127 13.599 19.160 180 H GLU 25 H GLU 25 -10.388 10.816 25.232 181 HA GLU 25 HA GLU 25 -7.657 11.852 25.000 182 HB2 GLU 25 2HB GLU 25 -8.775 9.365 26.300 183 HB3 GLU 25 1HB GLU 25 -7.056 9.672 26.110 184 HG2 GLU 25 2HG GLU 25 -8.971 11.410 27.648 185 HG3 GLU 25 1HG GLU 25 -7.905 10.199 28.352 186 H MET 26 H MET 26 -6.226 9.784 24.237 187 HA MET 26 HA MET 26 -7.525 8.403 22.053 188 HB2 MET 26 2HB MET 26 -5.746 9.052 20.450 189 HB3 MET 26 1HB MET 26 -6.674 10.442 20.977 190 HG2 MET 26 2HG MET 26 -4.903 11.118 22.462 191 HG3 MET 26 1HG MET 26 -3.977 9.671 22.077 192 HE1 MET 26 3HE MET 26 -1.883 12.551 20.425 193 HE2 MET 26 1HE MET 26 -1.868 11.207 21.569 194 HE3 MET 26 2HE MET 26 -2.807 12.660 21.924 195 H GLU 27 H GLU 27 -6.619 6.410 21.717 196 HA GLU 27 HA GLU 27 -4.718 5.586 23.688 197 HB2 GLU 27 2HB GLU 27 -6.597 4.087 22.954 198 HB3 GLU 27 1HB GLU 27 -5.828 3.961 21.379 199 HG2 GLU 27 2HG GLU 27 -5.377 2.019 22.841 200 HG3 GLU 27 1HG GLU 27 -3.909 2.858 22.336 201 H SER 28 H SER 28 -2.667 5.065 23.410 202 HA SER 28 HA SER 28 -1.335 6.604 21.393 203 HB2 SER 28 2HB SER 28 -0.184 4.913 23.594 204 HB3 SER 28 1HB SER 28 0.598 6.249 22.738 205 HG SER 28 HG SER 28 -1.712 7.124 23.656 206 H SER 29 H SER 29 0.365 5.796 20.080 207 HA SER 29 HA SER 29 -0.128 3.137 19.032 208 HB2 SER 29 2HB SER 29 1.682 5.332 18.015 209 HB3 SER 29 1HB SER 29 1.118 3.918 17.122 210 HG SER 29 HG SER 29 -0.491 6.003 18.154 211 H THR 30 H THR 30 1.576 1.640 18.849 212 HA THR 30 HA THR 30 3.902 2.173 20.538 213 HB THR 30 HB THR 30 2.387 0.289 21.294 214 HG1 THR 30 1HG THR 30 4.445 -1.312 20.863 215 HG21 THR 30 3HG2 THR 30 3.279 -1.016 18.713 216 HG22 THR 30 1HG2 THR 30 1.636 -0.521 19.113 217 HG23 THR 30 2HG2 THR 30 2.409 -1.833 20.008 218 H GLY 31 H GLY 31 5.720 0.400 19.571 219 HA2 GLY 31 2HA GLY 31 5.859 1.101 16.708 220 HA3 GLY 31 1HA GLY 31 7.268 1.052 17.766 221 H THR 32 H THR 32 7.655 -0.408 15.661 222 HA THR 32 HA THR 32 6.582 -3.033 15.829 223 HB THR 32 HB THR 32 9.013 -2.086 14.298 224 HG1 THR 32 1HG THR 32 6.248 -2.090 13.709 225 HG21 THR 32 3HG2 THR 32 7.071 -4.358 13.783 226 HG22 THR 32 1HG2 THR 32 8.721 -4.535 14.380 227 HG23 THR 32 2HG2 THR 32 8.433 -3.925 12.750 228 H ALA 33 H ALA 33 7.512 -4.792 16.737 229 HA ALA 33 HA ALA 33 9.624 -4.395 18.637 230 HB1 ALA 33 1HB ALA 33 7.753 -5.899 19.154 231 HB2 ALA 33 2HB ALA 33 9.280 -6.786 19.153 232 HB3 ALA 33 3HB ALA 33 8.185 -6.915 17.778 233 HA PRO 34 HA PRO 34 12.948 -5.495 15.855 234 HB2 PRO 34 2HB PRO 34 14.270 -6.779 18.127 235 HB3 PRO 34 1HB PRO 34 14.839 -5.435 17.140 236 HG2 PRO 34 2HG PRO 34 14.010 -5.051 19.685 237 HG3 PRO 34 1HG PRO 34 13.746 -3.842 18.422 238 HD2 PRO 34 2HD PRO 34 11.819 -5.783 19.616 239 HD3 PRO 34 1HD PRO 34 11.561 -4.109 19.074 240 H ALA 35 H ALA 35 12.452 -7.077 14.582 241 HA ALA 35 HA ALA 35 12.845 -9.805 15.325 242 HB1 ALA 35 1HB ALA 35 10.108 -8.845 14.474 243 HB2 ALA 35 2HB ALA 35 10.531 -9.494 16.058 244 HB3 ALA 35 3HB ALA 35 10.603 -10.529 14.629 245 H SER 36 H SER 36 14.024 -10.440 13.679 246 HA SER 36 HA SER 36 13.795 -9.225 11.117 247 HB2 SER 36 2HB SER 36 15.565 -11.024 10.605 248 HB3 SER 36 1HB SER 36 15.994 -9.781 11.781 249 HG SER 36 HG SER 36 15.643 -12.481 12.110 250 H THR 37 H THR 37 13.076 -10.273 9.252 251 HA THR 37 HA THR 37 11.275 -12.493 9.834 252 HB THR 37 HB THR 37 10.123 -10.405 9.132 253 HG1 THR 37 1HG THR 37 9.283 -12.469 8.572 254 HG21 THR 37 3HG2 THR 37 10.352 -9.613 6.804 255 HG22 THR 37 1HG2 THR 37 11.652 -10.779 6.549 256 HG23 THR 37 2HG2 THR 37 11.866 -9.454 7.696 257 H GLY 38 H GLY 38 11.015 -14.075 8.201 258 HA2 GLY 38 2HA GLY 38 13.119 -14.166 6.183 259 HA3 GLY 38 1HA GLY 38 12.755 -15.569 7.197 260 H ALA 39 H ALA 39 10.785 -13.136 5.645 261 HA ALA 39 HA ALA 39 8.653 -14.861 5.057 262 HB1 ALA 39 1HB ALA 39 8.398 -12.433 5.271 263 HB2 ALA 39 2HB ALA 39 7.772 -13.014 3.727 264 HB3 ALA 39 3HB ALA 39 9.336 -12.207 3.796 265 H GLU 40 H GLU 40 11.535 -14.018 3.327 266 HA GLU 40 HA GLU 40 10.671 -14.987 0.788 267 HB2 GLU 40 2HB GLU 40 12.989 -14.794 0.081 268 HB3 GLU 40 1HB GLU 40 12.496 -13.367 0.972 269 HG2 GLU 40 2HG GLU 40 13.688 -14.113 2.919 270 HG3 GLU 40 1HG GLU 40 14.074 -15.641 2.134 271 H ASN 41 H ASN 41 11.673 -16.581 3.621 272 HA ASN 41 HA ASN 41 12.738 -18.956 2.428 273 HB2 ASN 41 2HB ASN 41 13.248 -18.462 4.757 274 HB3 ASN 41 1HB ASN 41 11.538 -18.447 5.166 275 HD21 ASN 41 1HD2 ASN 41 14.284 -20.447 4.409 276 HD22 ASN 41 2HD2 ASN 41 13.596 -21.927 4.937 277 H LEU 42 H LEU 42 9.614 -17.729 3.164 278 HA LEU 42 HA LEU 42 8.289 -20.214 2.645 279 HB2 LEU 42 2HB LEU 42 7.280 -17.403 3.154 280 HB3 LEU 42 1HB LEU 42 6.229 -18.753 2.811 281 HG LEU 42 HG LEU 42 6.131 -18.363 5.140 282 HD11 LEU 42 1HD1 LEU 42 7.892 -20.746 4.708 283 HD12 LEU 42 2HD1 LEU 42 6.137 -20.681 4.560 284 HD13 LEU 42 3HD1 LEU 42 6.899 -20.430 6.129 285 HD21 LEU 42 3HD2 LEU 42 9.146 -18.490 5.231 286 HD22 LEU 42 1HD2 LEU 42 8.086 -18.361 6.636 287 HD23 LEU 42 2HD2 LEU 42 8.157 -17.048 5.460 288 HA PRO 43 HA PRO 43 8.032 -19.455 -1.719 289 HB2 PRO 43 2HB PRO 43 5.287 -20.494 -1.778 290 HB3 PRO 43 1HB PRO 43 6.746 -21.160 -2.509 291 HG2 PRO 43 2HG PRO 43 5.563 -22.329 -0.397 292 HG3 PRO 43 1HG PRO 43 7.323 -22.338 -0.619 293 HD2 PRO 43 2HD PRO 43 5.651 -20.623 1.166 294 HD3 PRO 43 1HD PRO 43 7.206 -21.421 1.491 295 H ALA 44 H ALA 44 6.407 -18.540 -3.410 296 HA ALA 44 HA ALA 44 5.738 -15.933 -2.543 297 HB1 ALA 44 1HB ALA 44 4.980 -15.584 -4.853 298 HB2 ALA 44 2HB ALA 44 5.195 -17.311 -5.165 299 HB3 ALA 44 3HB ALA 44 6.583 -16.306 -4.772 300 H GLY 45 H GLY 45 4.145 -15.585 -1.338 301 HA2 GLY 45 2HA GLY 45 1.441 -16.111 -2.142 302 HA3 GLY 45 1HA GLY 45 1.929 -16.882 -0.621 303 H SER 46 H SER 46 2.706 -13.914 -2.206 304 HA SER 46 HA SER 46 2.952 -12.565 0.324 305 HB2 SER 46 2HB SER 46 3.481 -11.689 -2.480 306 HB3 SER 46 1HB SER 46 4.115 -10.944 -1.014 307 HG SER 46 HG SER 46 5.542 -12.455 -0.848 308 H ALA 47 H ALA 47 2.129 -10.318 0.429 309 HA ALA 47 HA ALA 47 -0.631 -10.221 -0.468 310 HB1 ALA 47 1HB ALA 47 -0.855 -8.436 1.189 311 HB2 ALA 47 2HB ALA 47 0.880 -8.514 1.509 312 HB3 ALA 47 3HB ALA 47 -0.156 -9.884 1.910 313 H LEU 48 H LEU 48 -1.429 -8.008 -1.145 314 HA LEU 48 HA LEU 48 0.623 -6.568 -2.628 315 HB2 LEU 48 2HB LEU 48 -0.616 -6.496 -4.666 316 HB3 LEU 48 1HB LEU 48 -0.474 -8.169 -4.206 317 HG LEU 48 HG LEU 48 -2.985 -6.511 -3.836 318 HD11 LEU 48 1HD1 LEU 48 -2.278 -8.486 -5.999 319 HD12 LEU 48 2HD1 LEU 48 -2.450 -6.744 -6.197 320 HD13 LEU 48 3HD1 LEU 48 -3.851 -7.724 -5.774 321 HD21 LEU 48 3HD2 LEU 48 -2.536 -9.495 -3.702 322 HD22 LEU 48 1HD2 LEU 48 -4.094 -8.679 -3.561 323 HD23 LEU 48 2HD2 LEU 48 -2.856 -8.440 -2.325 324 H LEU 49 H LEU 49 0.009 -4.437 -3.220 325 HA LEU 49 HA LEU 49 -2.119 -3.371 -1.487 326 HB2 LEU 49 2HB LEU 49 -1.010 -1.265 -1.382 327 HB3 LEU 49 1HB LEU 49 0.231 -2.450 -1.062 328 HG LEU 49 HG LEU 49 -0.134 -1.100 -3.756 329 HD11 LEU 49 1HD1 LEU 49 0.340 0.613 -2.142 330 HD12 LEU 49 2HD1 LEU 49 1.778 0.307 -3.115 331 HD13 LEU 49 3HD1 LEU 49 1.670 -0.334 -1.474 332 HD21 LEU 49 3HD2 LEU 49 2.207 -2.562 -2.555 333 HD22 LEU 49 1HD2 LEU 49 2.178 -1.772 -4.126 334 HD23 LEU 49 2HD2 LEU 49 1.151 -3.169 -3.836 335 H VAL 50 H VAL 50 -3.775 -2.412 -2.440 336 HA VAL 50 HA VAL 50 -3.569 -1.955 -5.336 337 HB VAL 50 HB VAL 50 -6.047 -2.658 -3.726 338 HG11 VAL 50 1HG1 VAL 50 -6.561 -1.258 -5.637 339 HG12 VAL 50 2HG1 VAL 50 -7.160 -2.896 -5.900 340 HG13 VAL 50 3HG1 VAL 50 -5.685 -2.356 -6.703 341 HG21 VAL 50 3HG2 VAL 50 -4.587 -4.599 -3.898 342 HG22 VAL 50 1HG2 VAL 50 -4.484 -4.392 -5.646 343 HG23 VAL 50 2HG2 VAL 50 -6.023 -4.819 -4.897 344 H VAL 51 H VAL 51 -3.449 0.132 -5.713 345 HA VAL 51 HA VAL 51 -4.731 1.949 -3.827 346 HB VAL 51 HB VAL 51 -3.039 2.574 -6.264 347 HG11 VAL 51 1HG1 VAL 51 -4.559 4.373 -5.639 348 HG12 VAL 51 2HG1 VAL 51 -2.893 4.817 -5.274 349 HG13 VAL 51 3HG1 VAL 51 -3.975 4.307 -3.979 350 HG21 VAL 51 3HG2 VAL 51 -2.259 2.527 -3.345 351 HG22 VAL 51 1HG2 VAL 51 -1.240 3.089 -4.671 352 HG23 VAL 51 2HG2 VAL 51 -1.717 1.393 -4.581 353 H LYS 52 H LYS 52 -6.684 2.440 -4.135 354 HA LYS 52 HA LYS 52 -7.985 1.896 -6.658 355 HB2 LYS 52 2HB LYS 52 -9.118 3.139 -4.143 356 HB3 LYS 52 1HB LYS 52 -10.022 2.518 -5.516 357 HG2 LYS 52 2HG LYS 52 -8.278 0.850 -3.720 358 HG3 LYS 52 1HG LYS 52 -10.021 1.011 -3.551 359 HD2 LYS 52 2HD LYS 52 -8.759 0.018 -6.103 360 HD3 LYS 52 1HD LYS 52 -9.085 -1.062 -4.760 361 HE2 LYS 52 2HE LYS 52 -10.904 -1.240 -6.302 362 HE3 LYS 52 1HE LYS 52 -11.480 -0.387 -4.881 363 HZ1 LYS 52 3HZ LYS 52 -11.411 1.691 -6.127 364 HZ2 LYS 52 1HZ LYS 52 -12.286 0.537 -6.961 365 HZ3 LYS 52 2HZ LYS 52 -10.738 0.900 -7.474 366 H ARG 53 H ARG 53 -7.052 4.616 -4.675 367 HA ARG 53 HA ARG 53 -7.225 6.354 -6.976 368 HB2 ARG 53 2HB ARG 53 -9.418 6.614 -5.939 369 HB3 ARG 53 1HB ARG 53 -8.670 6.899 -4.373 370 HG2 ARG 53 2HG ARG 53 -7.627 8.932 -5.262 371 HG3 ARG 53 1HG ARG 53 -8.433 8.662 -6.801 372 HD2 ARG 53 2HD ARG 53 -10.601 8.861 -5.721 373 HD3 ARG 53 1HD ARG 53 -9.813 9.071 -4.151 374 HE ARG 53 HE ARG 53 -8.930 10.940 -6.111 375 HH11 ARG 53 1HH1 ARG 53 -11.453 10.365 -3.694 376 HH12 ARG 53 2HH1 ARG 53 -11.869 12.006 -3.536 377 HH21 ARG 53 1HH2 ARG 53 -9.410 13.127 -5.870 378 HH22 ARG 53 2HH2 ARG 53 -10.606 13.674 -4.796 379 H GLY 54 H GLY 54 -5.199 7.145 -7.025 380 HA2 GLY 54 2HA GLY 54 -4.260 8.833 -5.009 381 HA3 GLY 54 1HA GLY 54 -3.513 7.263 -4.781 382 HA PRO 55 HA PRO 55 -1.502 9.782 -8.453 383 HB2 PRO 55 2HB PRO 55 -0.081 11.735 -7.209 384 HB3 PRO 55 1HB PRO 55 -1.718 12.002 -7.822 385 HG2 PRO 55 2HG PRO 55 -0.820 11.359 -5.040 386 HG3 PRO 55 1HG PRO 55 -1.986 12.583 -5.577 387 HD2 PRO 55 2HD PRO 55 -2.777 10.230 -4.581 388 HD3 PRO 55 1HD PRO 55 -3.666 11.023 -5.895 389 H ASN 56 H ASN 56 -0.751 8.510 -5.448 390 HA ASN 56 HA ASN 56 1.969 8.372 -5.181 391 HB2 ASN 56 2HB ASN 56 1.535 6.059 -4.128 392 HB3 ASN 56 1HB ASN 56 0.724 7.451 -3.412 393 HD21 ASN 56 1HD2 ASN 56 -0.815 6.179 -2.452 394 HD22 ASN 56 2HD2 ASN 56 -2.033 5.339 -3.333 395 H ALA 57 H ALA 57 -0.078 6.322 -7.077 396 HA ALA 57 HA ALA 57 1.772 5.800 -9.135 397 HB1 ALA 57 1HB ALA 57 2.767 4.256 -7.491 398 HB2 ALA 57 2HB ALA 57 1.986 3.351 -8.788 399 HB3 ALA 57 3HB ALA 57 1.189 3.513 -7.225 400 H GLY 58 H GLY 58 -1.047 4.820 -7.256 401 HA2 GLY 58 2HA GLY 58 -3.191 4.317 -7.854 402 HA3 GLY 58 1HA GLY 58 -2.856 5.105 -9.398 403 H ALA 59 H ALA 59 -1.518 2.246 -7.800 404 HA ALA 59 HA ALA 59 -2.270 0.619 -10.062 405 HB1 ALA 59 1HB ALA 59 0.071 -0.163 -10.298 406 HB2 ALA 59 2HB ALA 59 0.578 1.067 -9.144 407 HB3 ALA 59 3HB ALA 59 -0.100 1.546 -10.696 408 H ARG 60 H ARG 60 -1.161 -1.648 -9.463 409 HA ARG 60 HA ARG 60 -1.283 -2.074 -6.615 410 HB2 ARG 60 2HB ARG 60 -2.811 -4.027 -6.983 411 HB3 ARG 60 1HB ARG 60 -3.544 -2.450 -7.236 412 HG2 ARG 60 2HG ARG 60 -3.185 -2.777 -9.678 413 HG3 ARG 60 1HG ARG 60 -2.718 -4.443 -9.318 414 HD2 ARG 60 2HD ARG 60 -4.864 -4.812 -8.244 415 HD3 ARG 60 1HD ARG 60 -5.324 -3.143 -8.569 416 HE ARG 60 HE ARG 60 -4.831 -5.179 -10.606 417 HH11 ARG 60 1HH1 ARG 60 -6.462 -2.177 -9.590 418 HH12 ARG 60 2HH1 ARG 60 -7.615 -2.230 -10.823 419 HH21 ARG 60 1HH2 ARG 60 -6.435 -5.222 -12.308 420 HH22 ARG 60 2HH2 ARG 60 -7.600 -3.993 -12.419 421 H PHE 61 H PHE 61 0.141 -3.536 -5.939 422 HA PHE 61 HA PHE 61 1.197 -5.472 -7.689 423 HB2 PHE 61 2HB PHE 61 3.608 -4.707 -7.511 424 HB3 PHE 61 1HB PHE 61 2.586 -3.785 -8.590 425 HD1 PHE 61 2HD PHE 61 1.853 -1.499 -7.896 426 HD2 PHE 61 1HD PHE 61 4.716 -3.740 -5.687 427 HE1 PHE 61 2HE PHE 61 2.623 0.569 -6.819 428 HE2 PHE 61 1HE PHE 61 5.500 -1.674 -4.608 429 HZ PHE 61 HZ PHE 61 4.447 0.487 -5.177 430 H LEU 62 H LEU 62 2.737 -6.861 -6.779 431 HA LEU 62 HA LEU 62 1.905 -7.565 -4.118 432 HB2 LEU 62 2HB LEU 62 1.907 -9.228 -5.874 433 HB3 LEU 62 1HB LEU 62 3.580 -8.913 -6.236 434 HG LEU 62 HG LEU 62 2.826 -10.058 -3.560 435 HD11 LEU 62 1HD1 LEU 62 1.705 -11.449 -5.261 436 HD12 LEU 62 2HD1 LEU 62 3.081 -12.306 -4.565 437 HD13 LEU 62 3HD1 LEU 62 3.219 -11.569 -6.159 438 HD21 LEU 62 3HD2 LEU 62 5.148 -9.335 -3.943 439 HD22 LEU 62 1HD2 LEU 62 5.223 -10.359 -5.376 440 HD23 LEU 62 2HD2 LEU 62 5.051 -11.091 -3.783 441 H LEU 63 H LEU 63 3.177 -7.636 -2.283 442 HA LEU 63 HA LEU 63 5.766 -6.254 -2.465 443 HB2 LEU 63 2HB LEU 63 4.057 -6.797 -0.025 444 HB3 LEU 63 1HB LEU 63 5.597 -5.981 -0.006 445 HG LEU 63 HG LEU 63 4.027 -4.308 0.244 446 HD11 LEU 63 1HD1 LEU 63 4.692 -4.313 -2.681 447 HD12 LEU 63 2HD1 LEU 63 5.703 -3.720 -1.361 448 HD13 LEU 63 3HD1 LEU 63 4.182 -2.916 -1.727 449 HD21 LEU 63 3HD2 LEU 63 2.021 -4.010 -1.105 450 HD22 LEU 63 1HD2 LEU 63 2.031 -5.592 -0.332 451 HD23 LEU 63 2HD2 LEU 63 2.427 -5.445 -2.047 452 H ASP 64 H ASP 64 7.475 -7.551 -2.541 453 HA ASP 64 HA ASP 64 7.399 -10.059 -0.992 454 HB2 ASP 64 2HB ASP 64 7.775 -10.249 -3.480 455 HB3 ASP 64 1HB ASP 64 9.234 -9.291 -3.293 456 H GLN 65 H GLN 65 8.351 -7.004 -0.875 457 HA GLN 65 HA GLN 65 11.066 -7.234 0.000 458 HB2 GLN 65 2HB GLN 65 9.200 -4.845 0.103 459 HB3 GLN 65 1HB GLN 65 10.913 -4.803 0.461 460 HG2 GLN 65 2HG GLN 65 10.658 -3.904 -1.707 461 HG3 GLN 65 1HG GLN 65 11.311 -5.522 -1.931 462 HE21 GLN 65 1HE2 GLN 65 8.515 -3.492 -2.298 463 HE22 GLN 65 2HE2 GLN 65 7.677 -4.534 -3.398 464 HA PRO 66 HA PRO 66 9.908 -8.269 4.228 465 HB2 PRO 66 2HB PRO 66 12.397 -7.727 5.327 466 HB3 PRO 66 1HB PRO 66 11.952 -9.257 4.569 467 HG2 PRO 66 2HG PRO 66 13.471 -6.951 3.438 468 HG3 PRO 66 1HG PRO 66 13.745 -8.686 3.225 469 HD2 PRO 66 2HD PRO 66 12.590 -7.192 1.330 470 HD3 PRO 66 1HD PRO 66 12.095 -8.875 1.609 471 H THR 67 H THR 67 11.519 -5.364 3.266 472 HA THR 67 HA THR 67 9.908 -3.885 5.153 473 HB THR 67 HB THR 67 12.838 -3.354 4.531 474 HG1 THR 67 1HG THR 67 11.691 -4.916 6.299 475 HG21 THR 67 3HG2 THR 67 10.916 -1.874 6.346 476 HG22 THR 67 1HG2 THR 67 11.531 -1.278 4.805 477 HG23 THR 67 2HG2 THR 67 12.635 -1.522 6.156 478 H THR 68 H THR 68 8.659 -2.680 4.000 479 HA THR 68 HA THR 68 9.420 -1.949 1.286 480 HB THR 68 HB THR 68 6.707 -2.138 2.605 481 HG1 THR 68 1HG THR 68 7.934 -4.153 2.061 482 HG21 THR 68 3HG2 THR 68 6.806 -0.455 0.789 483 HG22 THR 68 1HG2 THR 68 5.781 -1.834 0.378 484 HG23 THR 68 2HG2 THR 68 7.395 -1.721 -0.300 485 H THR 69 H THR 69 10.134 0.015 1.174 486 HA THR 69 HA THR 69 9.633 2.001 3.186 487 HB THR 69 HB THR 69 11.187 3.353 1.710 488 HG1 THR 69 1HG THR 69 11.578 0.876 0.364 489 HG21 THR 69 3HG2 THR 69 12.075 0.597 2.561 490 HG22 THR 69 1HG2 THR 69 12.032 2.030 3.584 491 HG23 THR 69 2HG2 THR 69 13.153 1.949 2.222 492 H ALA 70 H ALA 70 8.174 3.661 3.098 493 HA ALA 70 HA ALA 70 6.708 4.009 0.599 494 HB1 ALA 70 1HB ALA 70 4.847 4.798 1.929 495 HB2 ALA 70 2HB ALA 70 5.836 4.737 3.384 496 HB3 ALA 70 3HB ALA 70 5.391 3.240 2.566 497 H GLY 71 H GLY 71 7.232 5.701 -0.501 498 HA2 GLY 71 2HA GLY 71 7.110 8.312 0.158 499 HA3 GLY 71 1HA GLY 71 8.798 7.847 0.452 500 H ARG 72 H ARG 72 9.290 9.250 -1.513 501 HA ARG 72 HA ARG 72 9.511 7.360 -3.647 502 HB2 ARG 72 2HB ARG 72 7.237 8.508 -3.949 503 HB3 ARG 72 1HB ARG 72 8.162 9.939 -4.387 504 HG2 ARG 72 2HG ARG 72 9.252 8.654 -6.176 505 HG3 ARG 72 1HG ARG 72 8.240 7.270 -5.758 506 HD2 ARG 72 2HD ARG 72 7.181 8.339 -7.586 507 HD3 ARG 72 1HD ARG 72 6.244 8.755 -6.153 508 HE ARG 72 HE ARG 72 8.195 10.508 -7.468 509 HH11 ARG 72 1HH1 ARG 72 5.363 10.212 -5.367 510 HH12 ARG 72 2HH1 ARG 72 4.806 11.797 -5.695 511 HH21 ARG 72 1HH2 ARG 72 7.481 12.684 -7.793 512 HH22 ARG 72 2HH2 ARG 72 6.069 13.266 -7.048 513 H HIS 73 H HIS 73 11.680 7.728 -2.955 514 HA HIS 73 HA HIS 73 13.058 9.220 -4.796 515 HB2 HIS 73 2HB HIS 73 12.356 11.249 -3.530 516 HB3 HIS 73 1HB HIS 73 13.222 10.682 -2.126 517 HD1 HIS 73 1HD HIS 73 13.652 12.662 -5.163 518 HD2 HIS 73 2HD HIS 73 16.116 10.557 -2.571 519 HE1 HIS 73 1HE HIS 73 15.998 13.507 -5.572 520 HA PRO 74 HA PRO 74 16.780 7.997 -2.131 521 HB2 PRO 74 2HB PRO 74 16.503 6.946 0.362 522 HB3 PRO 74 1HB PRO 74 16.655 8.679 0.069 523 HG2 PRO 74 2HG PRO 74 14.196 7.049 0.559 524 HG3 PRO 74 1HG PRO 74 14.638 8.628 1.239 525 HD2 PRO 74 2HD PRO 74 12.894 8.406 -0.796 526 HD3 PRO 74 1HD PRO 74 14.041 9.758 -0.660 527 H GLU 75 H GLU 75 14.074 5.957 -1.229 528 HA GLU 75 HA GLU 75 14.785 3.713 -2.666 529 HB2 GLU 75 2HB GLU 75 15.006 3.548 0.389 530 HB3 GLU 75 1HB GLU 75 14.863 2.151 -0.660 531 HG2 GLU 75 2HG GLU 75 17.033 2.860 -1.711 532 HG3 GLU 75 1HG GLU 75 17.172 4.070 -0.446 533 H SER 76 H SER 76 12.859 3.386 -3.275 534 HA SER 76 HA SER 76 10.683 3.564 -1.351 535 HB2 SER 76 2HB SER 76 10.631 4.778 -4.122 536 HB3 SER 76 1HB SER 76 9.327 4.831 -2.925 537 HG SER 76 HG SER 76 11.243 5.658 -1.594 538 H ASP 77 H ASP 77 10.204 1.536 -1.226 539 HA ASP 77 HA ASP 77 10.303 -0.288 -3.440 540 HB2 ASP 77 2HB ASP 77 9.073 -0.656 -0.708 541 HB3 ASP 77 1HB ASP 77 9.344 -1.947 -1.884 542 H ILE 78 H ILE 78 7.887 1.563 -1.811 543 HA ILE 78 HA ILE 78 6.148 0.956 -4.054 544 HB ILE 78 HB ILE 78 4.207 1.663 -2.670 545 HG12 ILE 78 2HG1 ILE 78 6.082 1.470 -0.297 546 HG13 ILE 78 1HG1 ILE 78 5.474 2.976 -0.975 547 HG21 ILE 78 1HG2 ILE 78 3.999 -0.387 -1.331 548 HG22 ILE 78 2HG2 ILE 78 5.703 -0.722 -1.650 549 HG23 ILE 78 3HG2 ILE 78 4.551 -0.663 -2.981 550 HD11 ILE 78 3HD1 ILE 78 3.798 0.795 0.258 551 HD12 ILE 78 1HD1 ILE 78 3.200 2.314 -0.408 552 HD13 ILE 78 2HD1 ILE 78 4.240 2.325 1.019 553 H PHE 79 H PHE 79 5.415 2.669 -5.132 554 HA PHE 79 HA PHE 79 6.783 5.135 -4.564 555 HB2 PHE 79 2HB PHE 79 5.050 4.258 -6.893 556 HB3 PHE 79 1HB PHE 79 5.791 5.849 -6.770 557 HD1 PHE 79 2HD PHE 79 6.599 2.214 -6.937 558 HD2 PHE 79 1HD PHE 79 8.006 6.195 -7.481 559 HE1 PHE 79 2HE PHE 79 8.663 1.346 -7.954 560 HE2 PHE 79 1HE PHE 79 10.066 5.330 -8.490 561 HZ PHE 79 HZ PHE 79 10.397 2.904 -8.730 562 H LEU 80 H LEU 80 5.871 6.785 -3.570 563 HA LEU 80 HA LEU 80 3.011 6.641 -3.086 564 HB2 LEU 80 2HB LEU 80 4.418 5.948 -1.144 565 HB3 LEU 80 1HB LEU 80 5.155 7.535 -1.167 566 HG LEU 80 HG LEU 80 2.932 8.535 -0.676 567 HD11 LEU 80 1HD1 LEU 80 2.082 5.664 -0.364 568 HD12 LEU 80 2HD1 LEU 80 1.518 6.791 -1.596 569 HD13 LEU 80 3HD1 LEU 80 1.132 7.073 0.100 570 HD21 LEU 80 3HD2 LEU 80 3.856 6.443 1.282 571 HD22 LEU 80 1HD2 LEU 80 2.857 7.844 1.658 572 HD23 LEU 80 2HD2 LEU 80 4.522 8.068 1.116 573 H ASP 81 H ASP 81 2.005 8.664 -2.716 574 HA ASP 81 HA ASP 81 3.259 11.132 -2.970 575 HB2 ASP 81 2HB ASP 81 3.194 10.273 -5.422 576 HB3 ASP 81 1HB ASP 81 1.446 10.350 -5.271 577 H ASP 82 H ASP 82 1.676 12.615 -2.641 578 HA ASP 82 HA ASP 82 -1.045 12.150 -2.204 579 HB2 ASP 82 2HB ASP 82 -0.399 10.818 -0.239 580 HB3 ASP 82 1HB ASP 82 0.721 12.058 0.293 581 H VAL 83 H VAL 83 -1.954 14.109 -1.079 582 HA VAL 83 HA VAL 83 -0.829 16.419 -2.229 583 HB VAL 83 HB VAL 83 -2.574 17.686 -1.020 584 HG11 VAL 83 1HG1 VAL 83 -3.563 15.139 -2.293 585 HG12 VAL 83 2HG1 VAL 83 -3.114 16.619 -3.139 586 HG13 VAL 83 3HG1 VAL 83 -4.513 16.605 -2.060 587 HG21 VAL 83 3HG2 VAL 83 -3.259 15.023 0.241 588 HG22 VAL 83 1HG2 VAL 83 -4.218 16.499 0.374 589 HG23 VAL 83 2HG2 VAL 83 -2.603 16.433 1.077 590 H THR 84 H THR 84 -0.369 14.904 0.877 591 HA THR 84 HA THR 84 1.679 16.823 1.335 592 HB THR 84 HB THR 84 -0.407 16.198 3.460 593 HG1 THR 84 1HG THR 84 -0.022 18.220 1.643 594 HG21 THR 84 3HG2 THR 84 2.000 18.047 3.565 595 HG22 THR 84 1HG2 THR 84 1.860 16.512 4.420 596 HG23 THR 84 2HG2 THR 84 0.796 17.853 4.842 597 H VAL 85 H VAL 85 2.763 14.956 0.500 598 HA VAL 85 HA VAL 85 2.984 12.637 2.254 599 HB VAL 85 HB VAL 85 2.600 12.239 -0.181 600 HG11 VAL 85 1HG1 VAL 85 5.276 13.522 -0.594 601 HG12 VAL 85 2HG1 VAL 85 3.709 14.100 -1.165 602 HG13 VAL 85 3HG1 VAL 85 4.386 12.611 -1.812 603 HG21 VAL 85 3HG2 VAL 85 5.284 11.265 0.783 604 HG22 VAL 85 1HG2 VAL 85 4.354 10.564 -0.543 605 HG23 VAL 85 2HG2 VAL 85 3.724 10.505 1.105 606 H SER 86 H SER 86 4.886 12.060 3.275 607 HA SER 86 HA SER 86 6.915 14.147 3.387 608 HB2 SER 86 2HB SER 86 5.962 13.199 5.506 609 HB3 SER 86 1HB SER 86 6.632 11.635 5.058 610 HG SER 86 HG SER 86 8.197 12.481 6.312 611 H ARG 87 H ARG 87 9.192 13.539 3.309 612 HA ARG 87 HA ARG 87 10.032 12.116 1.042 613 HB2 ARG 87 2HB ARG 87 11.371 13.863 2.168 614 HB3 ARG 87 1HB ARG 87 11.558 12.819 3.564 615 HG2 ARG 87 2HG ARG 87 13.595 12.829 2.282 616 HG3 ARG 87 1HG ARG 87 12.845 11.238 2.167 617 HD2 ARG 87 2HD ARG 87 13.712 11.962 0.008 618 HD3 ARG 87 1HD ARG 87 11.960 11.815 -0.035 619 HE ARG 87 HE ARG 87 11.937 14.299 0.275 620 HH11 ARG 87 1HH1 ARG 87 14.874 12.849 -1.089 621 HH12 ARG 87 2HH1 ARG 87 15.146 14.153 -2.162 622 HH21 ARG 87 1HH2 ARG 87 12.357 16.051 -1.210 623 HH22 ARG 87 2HH2 ARG 87 13.731 15.975 -2.232 624 H ARG 88 H ARG 88 10.129 11.270 4.451 625 HA ARG 88 HA ARG 88 10.133 8.430 3.730 626 HB2 ARG 88 2HB ARG 88 12.212 9.269 4.969 627 HB3 ARG 88 1HB ARG 88 11.158 9.690 6.303 628 HG2 ARG 88 2HG ARG 88 12.249 7.610 6.796 629 HG3 ARG 88 1HG ARG 88 10.538 7.294 6.505 630 HD2 ARG 88 2HD ARG 88 11.020 6.547 4.261 631 HD3 ARG 88 1HD ARG 88 12.720 6.958 4.454 632 HE ARG 88 HE ARG 88 11.655 5.035 6.341 633 HH11 ARG 88 1HH1 ARG 88 13.373 5.523 3.295 634 HH12 ARG 88 2HH1 ARG 88 14.089 3.972 3.273 635 HH21 ARG 88 1HH2 ARG 88 12.612 2.843 6.292 636 HH22 ARG 88 2HH2 ARG 88 13.634 2.428 5.007 637 H HIS 89 H HIS 89 7.897 8.419 3.619 638 HA HIS 89 HA HIS 89 6.372 9.774 5.654 639 HB2 HIS 89 2HB HIS 89 5.694 9.819 3.261 640 HB3 HIS 89 1HB HIS 89 5.407 8.085 3.337 641 HD2 HIS 89 2HD HIS 89 3.153 7.321 4.873 642 HE1 HIS 89 1HE HIS 89 1.499 11.214 4.877 643 HE2 HIS 89 2HE HIS 89 1.220 8.793 5.653 644 H ALA 90 H ALA 90 6.708 6.404 4.592 645 HA ALA 90 HA ALA 90 6.090 5.639 7.308 646 HB1 ALA 90 1HB ALA 90 4.346 4.067 6.624 647 HB2 ALA 90 2HB ALA 90 4.444 4.658 4.967 648 HB3 ALA 90 3HB ALA 90 3.889 5.727 6.257 649 H GLU 91 H GLU 91 6.552 3.443 7.692 650 HA GLU 91 HA GLU 91 8.105 2.137 5.568 651 HB2 GLU 91 2HB GLU 91 9.644 3.124 7.259 652 HB3 GLU 91 1HB GLU 91 8.834 2.187 8.503 653 HG2 GLU 91 2HG GLU 91 9.599 0.128 7.525 654 HG3 GLU 91 1HG GLU 91 10.288 0.997 6.156 655 H PHE 92 H PHE 92 7.401 0.153 5.176 656 HA PHE 92 HA PHE 92 5.575 -1.032 7.117 657 HB2 PHE 92 2HB PHE 92 4.463 -0.642 5.030 658 HB3 PHE 92 1HB PHE 92 5.793 -1.335 4.119 659 HD1 PHE 92 2HD PHE 92 3.344 -2.284 6.770 660 HD2 PHE 92 1HD PHE 92 5.554 -3.530 3.350 661 HE1 PHE 92 2HE PHE 92 2.216 -4.446 6.829 662 HE2 PHE 92 1HE PHE 92 4.428 -5.699 3.409 663 HZ PHE 92 HZ PHE 92 2.756 -6.169 5.144 664 H ARG 93 H ARG 93 6.229 -2.738 8.151 665 HA ARG 93 HA ARG 93 8.444 -4.251 7.001 666 HB2 ARG 93 2HB ARG 93 7.725 -3.838 9.915 667 HB3 ARG 93 1HB ARG 93 8.960 -4.947 9.343 668 HG2 ARG 93 2HG ARG 93 10.198 -3.031 8.385 669 HG3 ARG 93 1HG ARG 93 8.973 -1.946 9.048 670 HD2 ARG 93 2HD ARG 93 9.507 -2.693 11.303 671 HD3 ARG 93 1HD ARG 93 10.690 -3.828 10.663 672 HE ARG 93 HE ARG 93 11.138 -1.066 9.926 673 HH11 ARG 93 1HH1 ARG 93 11.911 -3.608 12.336 674 HH12 ARG 93 2HH1 ARG 93 13.314 -2.782 12.864 675 HH21 ARG 93 1HH2 ARG 93 13.022 -0.018 10.733 676 HH22 ARG 93 2HH2 ARG 93 13.951 -0.745 11.960 677 H ILE 94 H ILE 94 8.128 -6.414 6.788 678 HA ILE 94 HA ILE 94 5.482 -7.271 7.630 679 HB ILE 94 HB ILE 94 5.521 -7.098 5.195 680 HG12 ILE 94 2HG1 ILE 94 5.613 -9.992 6.091 681 HG13 ILE 94 1HG1 ILE 94 4.221 -8.929 6.203 682 HG21 ILE 94 1HG2 ILE 94 7.864 -8.987 5.265 683 HG22 ILE 94 2HG2 ILE 94 7.893 -7.292 4.775 684 HG23 ILE 94 3HG2 ILE 94 7.015 -8.475 3.804 685 HD11 ILE 94 3HD1 ILE 94 4.128 -8.795 3.766 686 HD12 ILE 94 1HD1 ILE 94 4.028 -10.463 4.328 687 HD13 ILE 94 2HD1 ILE 94 5.538 -9.846 3.658 688 H ASN 95 H ASN 95 5.326 -8.941 8.787 689 HA ASN 95 HA ASN 95 7.675 -10.599 9.322 690 HB2 ASN 95 2HB ASN 95 6.773 -9.391 11.300 691 HB3 ASN 95 1HB ASN 95 5.175 -10.036 10.969 692 HD21 ASN 95 1HD2 ASN 95 8.313 -10.695 12.254 693 HD22 ASN 95 2HD2 ASN 95 7.945 -12.208 12.970 694 H GLU 96 H GLU 96 7.285 -12.844 9.164 695 HA GLU 96 HA GLU 96 5.526 -13.584 7.168 696 HB2 GLU 96 2HB GLU 96 5.955 -16.007 8.022 697 HB3 GLU 96 1HB GLU 96 7.265 -15.090 7.314 698 HG2 GLU 96 2HG GLU 96 6.869 -15.151 10.285 699 HG3 GLU 96 1HG GLU 96 7.684 -16.474 9.454 700 H GLY 97 H GLY 97 4.808 -13.209 10.507 701 HA2 GLY 97 2HA GLY 97 2.186 -14.429 9.960 702 HA3 GLY 97 1HA GLY 97 2.920 -14.370 11.553 703 H GLU 98 H GLU 98 3.415 -11.367 9.934 704 HA GLU 98 HA GLU 98 0.890 -10.206 10.576 705 HB2 GLU 98 2HB GLU 98 1.790 -10.553 12.857 706 HB3 GLU 98 1HB GLU 98 3.169 -9.535 12.466 707 HG2 GLU 98 2HG GLU 98 1.716 -7.616 12.244 708 HG3 GLU 98 1HG GLU 98 0.294 -8.633 12.458 709 H PHE 99 H PHE 99 0.718 -8.002 9.997 710 HA PHE 99 HA PHE 99 2.890 -7.057 8.209 711 HB2 PHE 99 2HB PHE 99 -0.078 -6.511 7.923 712 HB3 PHE 99 1HB PHE 99 1.179 -6.193 6.741 713 HD1 PHE 99 2HD PHE 99 2.222 -8.141 5.532 714 HD2 PHE 99 1HD PHE 99 -1.191 -8.566 8.038 715 HE1 PHE 99 2HE PHE 99 1.708 -10.297 4.468 716 HE2 PHE 99 1HE PHE 99 -1.707 -10.719 6.977 717 HZ PHE 99 HZ PHE 99 -0.259 -11.588 5.187 718 H GLU 100 H GLU 100 3.792 -5.144 9.184 719 HA GLU 100 HA GLU 100 1.832 -3.380 10.425 720 HB2 GLU 100 2HB GLU 100 2.876 -4.680 12.221 721 HB3 GLU 100 1HB GLU 100 4.461 -4.144 11.694 722 HG2 GLU 100 2HG GLU 100 3.953 -1.872 12.300 723 HG3 GLU 100 1HG GLU 100 2.289 -2.308 12.680 724 H VAL 101 H VAL 101 2.079 -1.273 10.116 725 HA VAL 101 HA VAL 101 4.444 -0.366 8.641 726 HB VAL 101 HB VAL 101 2.541 -0.522 7.097 727 HG11 VAL 101 1HG1 VAL 101 0.681 -0.310 8.621 728 HG12 VAL 101 2HG1 VAL 101 0.548 0.890 7.334 729 HG13 VAL 101 3HG1 VAL 101 1.096 1.374 8.937 730 HG21 VAL 101 3HG2 VAL 101 3.236 2.336 7.758 731 HG22 VAL 101 1HG2 VAL 101 2.524 1.790 6.239 732 HG23 VAL 101 2HG2 VAL 101 4.144 1.259 6.699 733 H VAL 102 H VAL 102 5.428 1.363 9.422 734 HA VAL 102 HA VAL 102 4.120 2.750 11.638 735 HB VAL 102 HB VAL 102 6.379 3.469 12.389 736 HG11 VAL 102 1HG1 VAL 102 6.076 0.485 12.096 737 HG12 VAL 102 2HG1 VAL 102 5.347 1.486 13.349 738 HG13 VAL 102 3HG1 VAL 102 7.100 1.315 13.271 739 HG21 VAL 102 3HG2 VAL 102 7.556 3.352 10.242 740 HG22 VAL 102 1HG2 VAL 102 7.395 1.598 10.246 741 HG23 VAL 102 2HG2 VAL 102 8.381 2.395 11.474 742 H ASP 103 H ASP 103 3.824 4.847 11.635 743 HA ASP 103 HA ASP 103 4.198 6.303 9.138 744 HB2 ASP 103 2HB ASP 103 2.004 6.283 10.401 745 HB3 ASP 103 1HB ASP 103 2.827 7.107 11.715 746 H VAL 104 H VAL 104 6.115 7.205 8.994 747 HA VAL 104 HA VAL 104 7.322 8.388 11.401 748 HB VAL 104 HB VAL 104 9.555 8.125 10.272 749 HG11 VAL 104 1HG1 VAL 104 8.838 6.538 11.963 750 HG12 VAL 104 2HG1 VAL 104 9.748 5.709 10.698 751 HG13 VAL 104 3HG1 VAL 104 7.989 5.593 10.739 752 HG21 VAL 104 3HG2 VAL 104 8.795 7.950 7.959 753 HG22 VAL 104 1HG2 VAL 104 7.979 6.432 8.330 754 HG23 VAL 104 2HG2 VAL 104 9.738 6.526 8.407 755 H GLY 105 H GLY 105 5.543 9.379 9.101 756 HA2 GLY 105 2HA GLY 105 6.909 11.940 8.843 757 HA3 GLY 105 1HA GLY 105 6.391 11.127 7.364 758 H SER 106 H SER 106 5.171 11.926 10.545 759 HA SER 106 HA SER 106 2.458 11.772 9.752 760 HB2 SER 106 2HB SER 106 3.644 12.878 12.285 761 HB3 SER 106 1HB SER 106 1.995 12.279 12.052 762 HG SER 106 HG SER 106 3.356 10.314 11.248 763 H LEU 107 H LEU 107 3.158 13.444 8.011 764 HA LEU 107 HA LEU 107 2.734 16.203 8.846 765 HB2 LEU 107 2HB LEU 107 2.948 15.032 6.070 766 HB3 LEU 107 1HB LEU 107 2.934 16.735 6.462 767 HG LEU 107 HG LEU 107 5.114 14.771 7.166 768 HD11 LEU 107 1HD1 LEU 107 5.041 17.039 5.184 769 HD12 LEU 107 2HD1 LEU 107 5.018 15.322 4.797 770 HD13 LEU 107 3HD1 LEU 107 6.441 16.034 5.560 771 HD21 LEU 107 3HD2 LEU 107 6.361 16.746 7.920 772 HD22 LEU 107 1HD2 LEU 107 4.902 16.502 8.880 773 HD23 LEU 107 2HD2 LEU 107 4.944 17.753 7.634 774 H ASN 108 H ASN 108 1.175 13.770 6.855 775 HA ASN 108 HA ASN 108 -1.345 15.238 7.180 776 HB2 ASN 108 2HB ASN 108 -0.356 15.074 4.890 777 HB3 ASN 108 1HB ASN 108 -0.606 13.346 4.951 778 HD21 ASN 108 1HD2 ASN 108 -1.794 13.938 2.910 779 HD22 ASN 108 2HD2 ASN 108 -3.445 14.330 3.055 780 H GLY 109 H GLY 109 0.213 12.073 7.246 781 HA2 GLY 109 2HA GLY 109 -0.240 10.702 9.133 782 HA3 GLY 109 1HA GLY 109 -1.881 11.310 9.129 783 H THR 110 H THR 110 -0.436 8.626 8.938 784 HA THR 110 HA THR 110 -1.823 7.486 6.665 785 HB THR 110 HB THR 110 -0.082 6.156 8.771 786 HG1 THR 110 1HG THR 110 1.205 7.618 7.917 787 HG21 THR 110 3HG2 THR 110 0.290 4.487 7.000 788 HG22 THR 110 1HG2 THR 110 -0.749 5.403 5.907 789 HG23 THR 110 2HG2 THR 110 -1.433 4.639 7.342 790 H TYR 111 H TYR 111 -3.622 6.161 6.961 791 HA TYR 111 HA TYR 111 -4.687 5.836 9.704 792 HB2 TYR 111 2HB TYR 111 -6.275 6.510 7.218 793 HB3 TYR 111 1HB TYR 111 -6.924 6.235 8.817 794 HD1 TYR 111 2HD TYR 111 -4.823 8.546 6.807 795 HD2 TYR 111 1HD TYR 111 -7.155 8.018 10.314 796 HE1 TYR 111 2HE TYR 111 -4.716 10.958 7.232 797 HE2 TYR 111 1HE TYR 111 -7.067 10.419 10.742 798 HH TYR 111 HH TYR 111 -5.938 12.651 8.410 799 H VAL 112 H VAL 112 -5.812 3.913 9.976 800 HA VAL 112 HA VAL 112 -6.340 2.386 7.541 801 HB VAL 112 HB VAL 112 -4.474 1.210 8.679 802 HG11 VAL 112 1HG1 VAL 112 -6.334 0.894 11.006 803 HG12 VAL 112 2HG1 VAL 112 -4.944 1.966 10.932 804 HG13 VAL 112 3HG1 VAL 112 -4.708 0.211 10.850 805 HG21 VAL 112 3HG2 VAL 112 -5.460 -1.029 8.850 806 HG22 VAL 112 1HG2 VAL 112 -6.073 -0.153 7.449 807 HG23 VAL 112 2HG2 VAL 112 -7.070 -0.310 8.893 808 H ASN 113 H ASN 113 -8.372 2.032 7.223 809 HA ASN 113 HA ASN 113 -10.613 2.384 7.489 810 HB2 ASN 113 2HB ASN 113 -9.918 0.525 9.758 811 HB3 ASN 113 1HB ASN 113 -11.582 1.044 9.514 812 HD21 ASN 113 1HD2 ASN 113 -12.153 -1.126 9.114 813 HD22 ASN 113 2HD2 ASN 113 -11.795 -1.915 7.625 814 H ARG 114 H ARG 114 -9.556 4.620 8.090 815 HA ARG 114 HA ARG 114 -9.969 6.657 8.972 816 HB2 ARG 114 2HB ARG 114 -12.150 5.239 10.478 817 HB3 ARG 114 1HB ARG 114 -11.817 6.943 10.709 818 HG2 ARG 114 2HG ARG 114 -12.347 7.406 8.415 819 HG3 ARG 114 1HG ARG 114 -12.523 5.682 8.074 820 HD2 ARG 114 2HD ARG 114 -14.699 6.791 8.379 821 HD3 ARG 114 1HD ARG 114 -14.401 5.544 9.588 822 HE ARG 114 HE ARG 114 -13.741 8.264 10.359 823 HH11 ARG 114 1HH1 ARG 114 -16.131 5.647 10.475 824 HH12 ARG 114 2HH1 ARG 114 -16.969 6.295 11.810 825 HH21 ARG 114 1HH2 ARG 114 -14.896 9.134 12.169 826 HH22 ARG 114 2HH2 ARG 114 -16.262 8.346 12.799 827 H GLU 115 H GLU 115 -8.962 4.111 10.972 828 HA GLU 115 HA GLU 115 -8.586 5.656 13.331 829 HB2 GLU 115 2HB GLU 115 -8.960 3.270 13.481 830 HB3 GLU 115 1HB GLU 115 -7.533 2.949 12.509 831 HG2 GLU 115 2HG GLU 115 -6.104 3.754 14.266 832 HG3 GLU 115 1HG GLU 115 -7.500 4.241 15.225 833 HA PRO 116 HA PRO 116 -4.648 7.263 11.849 834 HB2 PRO 116 2HB PRO 116 -4.639 9.431 13.495 835 HB3 PRO 116 1HB PRO 116 -5.523 9.372 11.972 836 HG2 PRO 116 2HG PRO 116 -6.565 9.406 14.691 837 HG3 PRO 116 1HG PRO 116 -7.434 9.613 13.166 838 HD2 PRO 116 2HD PRO 116 -7.219 7.237 14.849 839 HD3 PRO 116 1HD PRO 116 -8.275 7.554 13.452 840 H ARG 117 H ARG 117 -3.188 5.796 12.683 841 HA ARG 117 HA ARG 117 -2.198 6.517 15.343 842 HB2 ARG 117 2HB ARG 117 -2.712 3.725 14.332 843 HB3 ARG 117 1HB ARG 117 -1.557 4.017 15.632 844 HG2 ARG 117 2HG ARG 117 -3.280 4.949 17.020 845 HG3 ARG 117 1HG ARG 117 -4.435 4.904 15.696 846 HD2 ARG 117 2HD ARG 117 -4.833 3.113 17.298 847 HD3 ARG 117 1HD ARG 117 -4.391 2.470 15.726 848 HE ARG 117 HE ARG 117 -2.179 2.040 16.639 849 HH11 ARG 117 1HH1 ARG 117 -4.852 2.468 18.968 850 HH12 ARG 117 2HH1 ARG 117 -4.113 1.502 20.162 851 HH21 ARG 117 1HH2 ARG 117 -1.236 0.669 18.293 852 HH22 ARG 117 2HH2 ARG 117 -2.022 0.472 19.786 853 H ASN 118 H ASN 118 0.095 5.860 15.722 854 HA ASN 118 HA ASN 118 1.515 6.668 13.345 855 HB2 ASN 118 2HB ASN 118 2.222 6.754 16.215 856 HB3 ASN 118 1HB ASN 118 3.551 6.625 15.062 857 HD21 ASN 118 1HD2 ASN 118 3.884 8.255 13.581 858 HD22 ASN 118 2HD2 ASN 118 3.198 9.817 13.734 859 H ALA 119 H ALA 119 0.839 3.797 14.719 860 HA ALA 119 HA ALA 119 2.410 2.570 12.670 861 HB1 ALA 119 1HB ALA 119 3.317 0.842 14.186 862 HB2 ALA 119 2HB ALA 119 2.674 1.734 15.567 863 HB3 ALA 119 3HB ALA 119 3.952 2.441 14.585 864 H GLN 120 H GLN 120 1.309 0.878 11.931 865 HA GLN 120 HA GLN 120 -0.920 -0.060 13.482 866 HB2 GLN 120 2HB GLN 120 -1.235 1.468 10.991 867 HB3 GLN 120 1HB GLN 120 -2.285 0.076 11.245 868 HG2 GLN 120 2HG GLN 120 -1.931 2.412 13.072 869 HG3 GLN 120 1HG GLN 120 -3.344 2.054 12.061 870 HE21 GLN 120 1HE2 GLN 120 -4.627 0.247 12.597 871 HE22 GLN 120 2HE2 GLN 120 -4.625 -0.375 14.200 872 H VAL 121 H VAL 121 -1.772 -1.886 12.990 873 HA VAL 121 HA VAL 121 -0.114 -3.698 11.434 874 HB VAL 121 HB VAL 121 -2.686 -4.307 12.929 875 HG11 VAL 121 1HG1 VAL 121 -1.861 -6.607 12.973 876 HG12 VAL 121 2HG1 VAL 121 -0.425 -6.109 12.084 877 HG13 VAL 121 3HG1 VAL 121 -2.008 -6.010 11.318 878 HG21 VAL 121 3HG2 VAL 121 -1.275 -5.072 14.799 879 HG22 VAL 121 1HG2 VAL 121 -1.113 -3.339 14.502 880 HG23 VAL 121 2HG2 VAL 121 0.140 -4.443 13.952 881 H MET 122 H MET 122 -0.641 -4.092 9.374 882 HA MET 122 HA MET 122 -2.913 -2.782 8.224 883 HB2 MET 122 2HB MET 122 -0.838 -4.593 7.008 884 HB3 MET 122 1HB MET 122 -2.221 -4.022 6.093 885 HG2 MET 122 2HG MET 122 -1.489 -1.691 6.582 886 HG3 MET 122 1HG MET 122 -0.037 -2.362 7.321 887 HE1 MET 122 3HE MET 122 1.123 -0.873 3.803 888 HE2 MET 122 1HE MET 122 1.305 -0.730 5.551 889 HE3 MET 122 2HE MET 122 -0.210 -0.257 4.779 890 H GLN 123 H GLN 123 -4.754 -3.599 7.424 891 HA GLN 123 HA GLN 123 -5.391 -6.253 8.439 892 HB2 GLN 123 2HB GLN 123 -6.708 -4.367 9.355 893 HB3 GLN 123 1HB GLN 123 -7.241 -3.964 7.730 894 HG2 GLN 123 2HG GLN 123 -8.971 -5.198 8.867 895 HG3 GLN 123 1HG GLN 123 -8.311 -6.185 7.562 896 HE21 GLN 123 1HE2 GLN 123 -8.847 -8.125 8.450 897 HE22 GLN 123 2HE2 GLN 123 -8.114 -8.756 9.874 898 H THR 124 H THR 124 -5.953 -7.790 7.045 899 HA THR 124 HA THR 124 -5.590 -7.323 4.275 900 HB THR 124 HB THR 124 -6.317 -9.877 4.385 901 HG1 THR 124 1HG THR 124 -5.229 -9.681 6.966 902 HG21 THR 124 3HG2 THR 124 -3.963 -10.443 4.885 903 HG22 THR 124 1HG2 THR 124 -3.708 -8.810 5.501 904 HG23 THR 124 2HG2 THR 124 -4.068 -9.064 3.792 905 H GLY 125 H GLY 125 -7.128 -6.592 3.022 906 HA2 GLY 125 2HA GLY 125 -9.178 -6.908 1.868 907 HA3 GLY 125 1HA GLY 125 -9.849 -7.648 3.316 908 H ASP 126 H ASP 126 -8.061 -4.908 4.068 909 HA ASP 126 HA ASP 126 -10.457 -3.260 3.986 910 HB2 ASP 126 2HB ASP 126 -8.767 -3.853 6.371 911 HB3 ASP 126 1HB ASP 126 -9.556 -2.280 6.264 912 H GLU 127 H GLU 127 -9.531 -0.894 5.052 913 HA GLU 127 HA GLU 127 -7.855 -0.159 2.772 914 HB2 GLU 127 2HB GLU 127 -10.019 1.402 4.134 915 HB3 GLU 127 1HB GLU 127 -8.925 2.068 2.933 916 HG2 GLU 127 2HG GLU 127 -9.752 0.409 1.326 917 HG3 GLU 127 1HG GLU 127 -10.930 -0.127 2.530 918 H ILE 128 H ILE 128 -6.124 0.874 3.022 919 HA ILE 128 HA ILE 128 -5.457 2.106 5.576 920 HB ILE 128 HB ILE 128 -3.614 0.886 3.466 921 HG12 ILE 128 2HG1 ILE 128 -2.774 -0.526 5.412 922 HG13 ILE 128 1HG1 ILE 128 -4.146 0.068 6.339 923 HG21 ILE 128 1HG2 ILE 128 -2.610 2.916 4.303 924 HG22 ILE 128 2HG2 ILE 128 -1.723 1.516 4.906 925 HG23 ILE 128 3HG2 ILE 128 -2.839 2.376 5.966 926 HD11 ILE 128 3HD1 ILE 128 -4.270 -1.587 3.827 927 HD12 ILE 128 1HD1 ILE 128 -5.654 -1.017 4.757 928 HD13 ILE 128 2HD1 ILE 128 -4.523 -2.168 5.472 929 H GLN 129 H GLN 129 -5.371 4.226 5.413 930 HA GLN 129 HA GLN 129 -5.356 5.372 2.733 931 HB2 GLN 129 2HB GLN 129 -7.380 5.887 3.939 932 HB3 GLN 129 1HB GLN 129 -6.462 6.471 5.314 933 HG2 GLN 129 2HG GLN 129 -5.613 8.317 3.986 934 HG3 GLN 129 1HG GLN 129 -6.486 7.715 2.580 935 HE21 GLN 129 1HE2 GLN 129 -6.640 10.224 4.069 936 HE22 GLN 129 2HE2 GLN 129 -8.296 10.410 4.516 937 H ILE 130 H ILE 130 -3.681 6.397 2.129 938 HA ILE 130 HA ILE 130 -1.810 7.302 4.137 939 HB ILE 130 HB ILE 130 -0.252 7.441 1.943 940 HG12 ILE 130 2HG1 ILE 130 -0.548 5.279 0.625 941 HG13 ILE 130 1HG1 ILE 130 -2.139 5.130 1.347 942 HG21 ILE 130 1HG2 ILE 130 0.367 6.344 3.973 943 HG22 ILE 130 2HG2 ILE 130 0.731 5.296 2.605 944 HG23 ILE 130 3HG2 ILE 130 -0.687 4.977 3.603 945 HD11 ILE 130 3HD1 ILE 130 -1.204 7.334 -0.473 946 HD12 ILE 130 1HD1 ILE 130 -2.807 7.210 0.248 947 HD13 ILE 130 2HD1 ILE 130 -2.263 5.993 -0.906 948 H GLY 131 H GLY 131 -2.312 9.248 4.668 949 HA2 GLY 131 2HA GLY 131 -2.426 11.507 4.428 950 HA3 GLY 131 1HA GLY 131 -2.139 11.321 2.698 951 H LYS 132 H LYS 132 -3.771 11.544 1.387 952 HA LYS 132 HA LYS 132 -6.512 11.518 2.500 953 HB2 LYS 132 2HB LYS 132 -5.374 12.941 0.105 954 HB3 LYS 132 1HB LYS 132 -7.092 12.844 0.430 955 HG2 LYS 132 2HG LYS 132 -5.047 14.108 2.248 956 HG3 LYS 132 1HG LYS 132 -6.068 14.981 1.109 957 HD2 LYS 132 2HD LYS 132 -7.023 13.356 3.483 958 HD3 LYS 132 1HD LYS 132 -6.971 15.112 3.383 959 HE2 LYS 132 2HE LYS 132 -8.690 13.264 1.710 960 HE3 LYS 132 1HE LYS 132 -9.234 14.300 3.019 961 HZ1 LYS 132 3HZ LYS 132 -9.707 15.306 0.881 962 HZ2 LYS 132 1HZ LYS 132 -8.097 15.234 0.426 963 HZ3 LYS 132 2HZ LYS 132 -8.564 16.242 1.671 964 H PHE 133 H PHE 133 -4.425 9.753 0.565 965 HA PHE 133 HA PHE 133 -6.578 8.887 -1.198 966 HB2 PHE 133 2HB PHE 133 -3.596 8.554 -1.491 967 HB3 PHE 133 1HB PHE 133 -4.808 8.016 -2.663 968 HD1 PHE 133 2HD PHE 133 -6.424 9.757 -3.590 969 HD2 PHE 133 1HD PHE 133 -2.822 10.764 -1.566 970 HE1 PHE 133 2HE PHE 133 -6.531 12.028 -4.542 971 HE2 PHE 133 1HE PHE 133 -2.920 13.029 -2.498 972 HZ PHE 133 HZ PHE 133 -4.777 13.673 -3.992 973 H ARG 134 H ARG 134 -6.807 6.630 -1.773 974 HA ARG 134 HA ARG 134 -6.629 5.157 0.754 975 HB2 ARG 134 2HB ARG 134 -8.911 5.142 -1.226 976 HB3 ARG 134 1HB ARG 134 -8.841 4.206 0.264 977 HG2 ARG 134 2HG ARG 134 -8.818 6.207 1.594 978 HG3 ARG 134 1HG ARG 134 -8.696 7.210 0.154 979 HD2 ARG 134 2HD ARG 134 -10.930 7.322 0.914 980 HD3 ARG 134 1HD ARG 134 -10.925 6.325 -0.536 981 HE ARG 134 HE ARG 134 -10.993 4.370 1.069 982 HH11 ARG 134 1HH1 ARG 134 -12.397 7.527 1.877 983 HH12 ARG 134 2HH1 ARG 134 -13.549 6.906 2.954 984 HH21 ARG 134 1HH2 ARG 134 -12.603 3.509 2.516 985 HH22 ARG 134 2HH2 ARG 134 -13.644 4.579 3.363 986 H LEU 135 H LEU 135 -5.822 3.259 0.795 987 HA LEU 135 HA LEU 135 -5.211 1.808 -1.671 988 HB2 LEU 135 2HB LEU 135 -3.270 2.923 -0.651 989 HB3 LEU 135 1HB LEU 135 -3.667 2.252 0.899 990 HG LEU 135 HG LEU 135 -2.734 0.550 -1.437 991 HD11 LEU 135 1HD1 LEU 135 -1.190 1.862 0.800 992 HD12 LEU 135 2HD1 LEU 135 -1.036 2.214 -0.927 993 HD13 LEU 135 3HD1 LEU 135 -0.539 0.644 -0.291 994 HD21 LEU 135 3HD2 LEU 135 -2.125 -1.042 0.343 995 HD22 LEU 135 1HD2 LEU 135 -3.846 -0.673 0.412 996 HD23 LEU 135 2HD2 LEU 135 -2.734 0.071 1.560 997 H VAL 136 H VAL 136 -5.844 -0.329 -1.586 998 HA VAL 136 HA VAL 136 -7.001 -1.291 0.943 999 HB VAL 136 HB VAL 136 -7.513 -2.414 -1.840 1000 HG11 VAL 136 1HG1 VAL 136 -8.987 -2.813 0.766 1001 HG12 VAL 136 2HG1 VAL 136 -7.909 -3.974 -0.006 1002 HG13 VAL 136 3HG1 VAL 136 -9.426 -3.528 -0.787 1003 HG21 VAL 136 3HG2 VAL 136 -9.291 -0.554 -0.276 1004 HG22 VAL 136 1HG2 VAL 136 -9.673 -1.286 -1.828 1005 HG23 VAL 136 2HG2 VAL 136 -8.365 -0.099 -1.701 1006 H PHE 137 H PHE 137 -5.973 -2.957 1.872 1007 HA PHE 137 HA PHE 137 -3.694 -4.110 0.407 1008 HB2 PHE 137 2HB PHE 137 -3.164 -2.851 2.462 1009 HB3 PHE 137 1HB PHE 137 -4.219 -3.911 3.381 1010 HD1 PHE 137 1HD PHE 137 -1.114 -3.808 1.371 1011 HD2 PHE 137 2HD PHE 137 -3.390 -5.905 4.295 1012 HE1 PHE 137 1HE PHE 137 0.822 -5.248 1.844 1013 HE2 PHE 137 2HE PHE 137 -1.460 -7.350 4.767 1014 HZ PHE 137 HZ PHE 137 0.648 -7.018 3.543 1015 H LEU 138 H LEU 138 -3.861 -6.198 -0.191 1016 HA LEU 138 HA LEU 138 -5.746 -7.892 1.297 1017 HB2 LEU 138 2HB LEU 138 -5.445 -7.974 -1.714 1018 HB3 LEU 138 1HB LEU 138 -6.479 -8.986 -0.742 1019 HG LEU 138 HG LEU 138 -7.687 -6.753 -0.147 1020 HD11 LEU 138 1HD1 LEU 138 -7.608 -5.091 -1.935 1021 HD12 LEU 138 2HD1 LEU 138 -6.290 -5.978 -2.696 1022 HD13 LEU 138 3HD1 LEU 138 -6.058 -5.246 -1.109 1023 HD21 LEU 138 3HD2 LEU 138 -8.698 -8.563 -1.419 1024 HD22 LEU 138 1HD2 LEU 138 -7.888 -8.004 -2.885 1025 HD23 LEU 138 2HD2 LEU 138 -9.118 -7.001 -2.120 1026 H ALA 139 H ALA 139 -5.299 -10.144 1.100 1027 HA ALA 139 HA ALA 139 -2.496 -10.770 0.892 1028 HB1 ALA 139 1HB ALA 139 -4.906 -12.558 1.317 1029 HB2 ALA 139 2HB ALA 139 -3.898 -11.878 2.594 1030 HB3 ALA 139 3HB ALA 139 -3.224 -13.061 1.474 1031 H GLY 140 H GLY 140 -1.536 -11.777 -0.869 1032 HA2 GLY 140 2HA GLY 140 -3.141 -11.621 -3.278 1033 HA3 GLY 140 1HA GLY 140 -1.387 -11.670 -3.178 1034 HA PRO 141 HA PRO 141 -2.903 -15.771 -4.505 1035 HB2 PRO 141 2HB PRO 141 -1.396 -16.050 -6.684 1036 HB3 PRO 141 1HB PRO 141 -2.837 -15.023 -6.680 1037 HG2 PRO 141 2HG PRO 141 0.041 -14.247 -6.470 1038 HG3 PRO 141 1HG PRO 141 -1.263 -13.478 -7.391 1039 HD2 PRO 141 2HD PRO 141 -0.370 -12.620 -4.927 1040 HD3 PRO 141 1HD PRO 141 -1.982 -12.275 -5.587 1041 H ALA 142 H ALA 142 -1.931 -17.799 -4.569 1042 HA ALA 142 HA ALA 142 0.747 -17.960 -3.392 1043 HB1 ALA 142 1HB ALA 142 -1.014 -18.958 -2.005 1044 HB2 ALA 142 2HB ALA 142 0.061 -20.210 -2.630 1045 HB3 ALA 142 3HB ALA 142 -1.524 -19.962 -3.361 1046 H GLU 143 H GLU 143 2.176 -18.262 -4.957 1047 HA GLU 143 HA GLU 143 1.444 -19.421 -7.458 1048 HB2 GLU 143 2HB GLU 143 3.920 -18.198 -6.311 1049 HB3 GLU 143 1HB GLU 143 3.853 -18.854 -7.930 1050 HG2 GLU 143 2HG GLU 143 2.053 -16.654 -6.924 1051 HG3 GLU 143 1HG GLU 143 3.560 -16.376 -7.799 Start of MODEL 8 1 H1 MET 1 1HT MET 1 44.749 0.451 56.571 2 H2 MET 1 2HT MET 1 44.739 2.035 56.070 3 H3 MET 1 3HT MET 1 46.076 1.427 56.898 4 HA MET 1 HA MET 1 45.061 0.503 54.285 5 HB2 MET 1 2HB MET 1 47.501 2.198 54.866 6 HB3 MET 1 1HB MET 1 47.200 1.408 53.330 7 HG2 MET 1 2HG MET 1 45.469 3.508 54.609 8 HG3 MET 1 1HG MET 1 46.557 3.740 53.247 9 HE1 MET 1 2HE MET 1 46.072 1.028 51.559 10 HE2 MET 1 3HE MET 1 46.193 2.634 50.840 11 HE3 MET 1 1HE MET 1 44.833 1.583 50.440 12 H SER 2 H SER 2 47.680 0.151 56.747 13 HA SER 2 HA SER 2 48.697 -2.212 55.664 14 HB2 SER 2 2HB SER 2 49.367 -2.441 58.177 15 HB3 SER 2 1HB SER 2 50.013 -1.063 57.279 16 HG SER 2 HG SER 2 48.660 -0.946 59.477 17 H ASP 3 H ASP 3 46.393 -1.492 58.219 18 HA ASP 3 HA ASP 3 45.065 -4.046 57.829 19 HB2 ASP 3 2HB ASP 3 43.732 -3.359 59.794 20 HB3 ASP 3 1HB ASP 3 45.443 -3.208 60.168 21 H ASN 4 H ASN 4 42.810 -3.948 57.133 22 HA ASN 4 HA ASN 4 41.951 -1.410 56.029 23 HB2 ASN 4 2HB ASN 4 41.583 -2.310 53.765 24 HB3 ASN 4 1HB ASN 4 43.285 -2.324 54.191 25 HD21 ASN 4 1HD2 ASN 4 44.333 -4.304 54.429 26 HD22 ASN 4 2HD2 ASN 4 43.605 -5.786 53.923 27 H ASN 5 H ASN 5 39.739 -1.393 55.398 28 HA ASN 5 HA ASN 5 38.118 -3.662 56.074 29 HB2 ASN 5 2HB ASN 5 38.494 -2.676 58.286 30 HB3 ASN 5 1HB ASN 5 37.963 -1.112 57.678 31 HD21 ASN 5 1HD2 ASN 5 36.309 -0.923 59.081 32 HD22 ASN 5 2HD2 ASN 5 34.868 -1.867 59.005 33 H GLY 6 H GLY 6 37.357 -3.547 54.069 34 HA2 GLY 6 2HA GLY 6 35.389 -1.478 53.559 35 HA3 GLY 6 1HA GLY 6 36.620 -1.771 52.320 36 H THR 7 H THR 7 33.911 -3.073 54.022 37 HA THR 7 HA THR 7 34.108 -5.665 52.848 38 HB THR 7 HB THR 7 31.741 -4.442 54.266 39 HG1 THR 7 1HG THR 7 34.253 -5.261 55.155 40 HG21 THR 7 3HG2 THR 7 31.380 -6.620 53.156 41 HG22 THR 7 1HG2 THR 7 31.299 -6.759 54.913 42 HG23 THR 7 2HG2 THR 7 32.744 -7.288 54.052 43 HA PRO 8 HA PRO 8 31.749 -4.507 49.127 44 HB2 PRO 8 2HB PRO 8 31.765 -7.036 48.087 45 HB3 PRO 8 1HB PRO 8 33.119 -5.924 47.908 46 HG2 PRO 8 2HG PRO 8 32.780 -8.195 49.805 47 HG3 PRO 8 1HG PRO 8 34.225 -7.660 48.928 48 HD2 PRO 8 2HD PRO 8 33.775 -7.126 51.539 49 HD3 PRO 8 1HD PRO 8 34.729 -6.062 50.484 50 H GLU 9 H GLU 9 29.497 -4.588 48.862 51 HA GLU 9 HA GLU 9 28.202 -6.484 50.608 52 HB2 GLU 9 2HB GLU 9 26.084 -5.268 50.226 53 HB3 GLU 9 1HB GLU 9 27.337 -4.222 50.855 54 HG2 GLU 9 2HG GLU 9 27.608 -3.149 48.766 55 HG3 GLU 9 1HG GLU 9 26.646 -4.380 47.939 56 HA PRO 10 HA PRO 10 27.163 -9.000 47.105 57 HB2 PRO 10 2HB PRO 10 25.108 -10.287 48.712 58 HB3 PRO 10 1HB PRO 10 26.640 -10.962 48.149 59 HG2 PRO 10 2HG PRO 10 26.127 -10.424 50.761 60 HG3 PRO 10 1HG PRO 10 27.751 -10.359 50.055 61 HD2 PRO 10 2HD PRO 10 25.859 -8.129 50.670 62 HD3 PRO 10 1HD PRO 10 27.623 -8.245 50.904 63 H GLN 11 H GLN 11 25.866 -8.410 45.514 64 HA GLN 11 HA GLN 11 23.627 -6.710 45.824 65 HB2 GLN 11 2HB GLN 11 24.468 -8.417 43.479 66 HB3 GLN 11 1HB GLN 11 23.261 -7.146 43.427 67 HG2 GLN 11 2HG GLN 11 24.944 -5.485 43.907 68 HG3 GLN 11 1HG GLN 11 26.173 -6.740 44.070 69 HE21 GLN 11 1HE2 GLN 11 27.403 -5.905 42.417 70 HE22 GLN 11 2HE2 GLN 11 26.955 -6.032 40.758 71 H VAL 12 H VAL 12 21.655 -7.320 46.449 72 HA VAL 12 HA VAL 12 20.914 -10.126 46.228 73 HB VAL 12 HB VAL 12 19.307 -7.842 47.449 74 HG11 VAL 12 1HG1 VAL 12 17.995 -9.611 48.526 75 HG12 VAL 12 2HG1 VAL 12 18.950 -10.831 47.681 76 HG13 VAL 12 3HG1 VAL 12 17.922 -9.730 46.767 77 HG21 VAL 12 3HG2 VAL 12 21.386 -8.174 48.689 78 HG22 VAL 12 1HG2 VAL 12 21.035 -9.897 48.833 79 HG23 VAL 12 2HG2 VAL 12 20.000 -8.714 49.632 80 H GLU 13 H GLU 13 20.558 -10.454 44.109 81 HA GLU 13 HA GLU 13 19.170 -8.594 42.480 82 HB2 GLU 13 2HB GLU 13 20.871 -10.490 41.835 83 HB3 GLU 13 1HB GLU 13 19.460 -11.532 41.847 84 HG2 GLU 13 2HG GLU 13 19.858 -9.100 40.105 85 HG3 GLU 13 1HG GLU 13 20.029 -10.773 39.592 86 H THR 14 H THR 14 17.047 -8.456 42.168 87 HA THR 14 HA THR 14 15.439 -9.973 44.064 88 HB THR 14 HB THR 14 14.750 -7.365 42.726 89 HG1 THR 14 1HG THR 14 16.764 -7.741 44.260 90 HG21 THR 14 3HG2 THR 14 12.888 -8.607 43.795 91 HG22 THR 14 1HG2 THR 14 13.262 -7.119 44.666 92 HG23 THR 14 2HG2 THR 14 13.813 -8.671 45.295 93 H THR 15 H THR 15 15.771 -9.487 40.557 94 HA THR 15 HA THR 15 13.024 -10.212 40.288 95 HB THR 15 HB THR 15 13.723 -8.378 38.830 96 HG1 THR 15 1HG THR 15 13.146 -10.493 37.046 97 HG21 THR 15 3HG2 THR 15 16.045 -9.040 38.337 98 HG22 THR 15 1HG2 THR 15 15.145 -8.752 36.845 99 HG23 THR 15 2HG2 THR 15 15.451 -10.402 37.386 100 H SER 16 H SER 16 13.312 -12.072 41.267 101 HA SER 16 HA SER 16 13.516 -14.281 39.403 102 HB2 SER 16 2HB SER 16 14.604 -14.214 42.243 103 HB3 SER 16 1HB SER 16 14.539 -15.648 41.216 104 HG SER 16 HG SER 16 15.749 -13.444 40.098 105 H VAL 17 H VAL 17 11.802 -15.716 39.791 106 HA VAL 17 HA VAL 17 9.695 -16.268 40.319 107 HB VAL 17 HB VAL 17 9.997 -14.609 42.853 108 HG11 VAL 17 1HG1 VAL 17 8.120 -15.931 43.742 109 HG12 VAL 17 2HG1 VAL 17 7.977 -16.752 42.190 110 HG13 VAL 17 3HG1 VAL 17 7.667 -15.019 42.302 111 HG21 VAL 17 3HG2 VAL 17 10.402 -17.576 42.491 112 HG22 VAL 17 1HG2 VAL 17 10.409 -16.738 44.043 113 HG23 VAL 17 2HG2 VAL 17 11.655 -16.386 42.845 114 H PHE 18 H PHE 18 8.261 -15.393 39.063 115 HA PHE 18 HA PHE 18 7.848 -12.526 39.271 116 HB2 PHE 18 2HB PHE 18 7.671 -12.317 36.813 117 HB3 PHE 18 1HB PHE 18 9.266 -12.830 37.329 118 HD1 PHE 18 2HD PHE 18 10.012 -15.151 36.910 119 HD2 PHE 18 1HD PHE 18 6.292 -13.694 35.446 120 HE1 PHE 18 2HE PHE 18 9.893 -17.038 35.339 121 HE2 PHE 18 1HE PHE 18 6.167 -15.576 33.872 122 HZ PHE 18 HZ PHE 18 7.966 -17.253 33.821 123 H ARG 19 H ARG 19 5.877 -11.808 39.039 124 HA ARG 19 HA ARG 19 3.721 -13.787 38.855 125 HB2 ARG 19 2HB ARG 19 3.848 -11.100 40.229 126 HB3 ARG 19 1HB ARG 19 2.428 -12.136 40.171 127 HG2 ARG 19 2HG ARG 19 3.547 -13.820 41.476 128 HG3 ARG 19 1HG ARG 19 5.054 -12.911 41.409 129 HD2 ARG 19 2HD ARG 19 4.077 -11.112 42.690 130 HD3 ARG 19 1HD ARG 19 2.510 -11.918 42.686 131 HE ARG 19 HE ARG 19 3.490 -13.670 43.989 132 HH11 ARG 19 1HH1 ARG 19 5.314 -10.590 43.946 133 HH12 ARG 19 2HH1 ARG 19 6.062 -10.884 45.445 134 HH21 ARG 19 1HH2 ARG 19 4.573 -13.994 46.078 135 HH22 ARG 19 2HH2 ARG 19 5.639 -12.787 46.660 136 H ALA 20 H ALA 20 3.126 -13.688 36.732 137 HA ALA 20 HA ALA 20 3.207 -11.149 35.386 138 HB1 ALA 20 1HB ALA 20 2.578 -12.392 33.382 139 HB2 ALA 20 2HB ALA 20 2.304 -13.839 34.350 140 HB3 ALA 20 3HB ALA 20 3.930 -13.179 34.197 141 H ASP 21 H ASP 21 1.717 -10.004 36.515 142 HA ASP 21 HA ASP 21 -1.030 -10.921 36.644 143 HB2 ASP 21 2HB ASP 21 -0.079 -9.490 38.451 144 HB3 ASP 21 1HB ASP 21 0.101 -8.182 37.286 145 H LEU 22 H LEU 22 0.904 -8.650 34.897 146 HA LEU 22 HA LEU 22 -1.281 -7.775 33.266 147 HB2 LEU 22 2HB LEU 22 0.518 -6.213 33.731 148 HB3 LEU 22 1HB LEU 22 1.692 -7.304 33.028 149 HG LEU 22 HG LEU 22 0.581 -7.008 30.821 150 HD11 LEU 22 1HD1 LEU 22 -0.952 -5.133 30.504 151 HD12 LEU 22 2HD1 LEU 22 -0.992 -4.886 32.251 152 HD13 LEU 22 3HD1 LEU 22 -1.631 -6.375 31.557 153 HD21 LEU 22 3HD2 LEU 22 2.566 -5.730 31.382 154 HD22 LEU 22 1HD2 LEU 22 1.576 -4.489 32.152 155 HD23 LEU 22 2HD2 LEU 22 1.461 -4.756 30.412 156 H LEU 23 H LEU 23 -2.104 -9.346 32.169 157 HA LEU 23 HA LEU 23 -0.437 -10.730 30.186 158 HB2 LEU 23 2HB LEU 23 -1.706 -12.100 32.022 159 HB3 LEU 23 1HB LEU 23 -3.169 -11.569 31.241 160 HG LEU 23 HG LEU 23 -2.552 -13.899 30.697 161 HD11 LEU 23 1HD1 LEU 23 -2.480 -12.096 28.299 162 HD12 LEU 23 2HD1 LEU 23 -3.917 -12.728 29.100 163 HD13 LEU 23 3HD1 LEU 23 -2.806 -13.829 28.284 164 HD21 LEU 23 3HD2 LEU 23 -0.136 -13.684 30.785 165 HD22 LEU 23 1HD2 LEU 23 -0.155 -12.692 29.328 166 HD23 LEU 23 2HD2 LEU 23 -0.649 -14.384 29.251 167 H LYS 24 H LYS 24 -1.298 -10.450 28.018 168 HA LYS 24 HA LYS 24 -2.669 -8.019 27.813 169 HB2 LYS 24 2HB LYS 24 -1.851 -9.935 25.652 170 HB3 LYS 24 1HB LYS 24 -2.764 -8.473 25.304 171 HG2 LYS 24 2HG LYS 24 -0.944 -7.206 26.528 172 HG3 LYS 24 1HG LYS 24 -0.011 -8.697 26.479 173 HD2 LYS 24 2HD LYS 24 -0.052 -8.691 24.060 174 HD3 LYS 24 1HD LYS 24 -1.120 -7.281 24.051 175 HE2 LYS 24 2HE LYS 24 0.637 -5.999 25.233 176 HE3 LYS 24 1HE LYS 24 1.705 -7.391 25.097 177 HZ1 LYS 24 3HZ LYS 24 1.615 -7.180 22.693 178 HZ2 LYS 24 1HZ LYS 24 2.132 -5.748 23.408 179 HZ3 LYS 24 2HZ LYS 24 0.563 -5.853 22.824 180 H GLU 25 H GLU 25 -4.517 -7.397 27.333 181 HA GLU 25 HA GLU 25 -6.734 -8.975 28.132 182 HB2 GLU 25 2HB GLU 25 -7.977 -6.931 27.688 183 HB3 GLU 25 1HB GLU 25 -6.507 -6.588 28.594 184 HG2 GLU 25 2HG GLU 25 -5.462 -6.098 26.285 185 HG3 GLU 25 1HG GLU 25 -7.123 -6.023 25.726 186 H MET 26 H MET 26 -8.688 -9.238 26.805 187 HA MET 26 HA MET 26 -7.993 -10.137 24.163 188 HB2 MET 26 2HB MET 26 -9.498 -11.505 25.562 189 HB3 MET 26 1HB MET 26 -10.670 -10.194 25.563 190 HG2 MET 26 2HG MET 26 -10.916 -10.395 23.147 191 HG3 MET 26 1HG MET 26 -9.725 -11.689 23.130 192 HE1 MET 26 3HE MET 26 -13.332 -10.592 24.230 193 HE2 MET 26 1HE MET 26 -12.613 -11.033 25.777 194 HE3 MET 26 2HE MET 26 -13.905 -12.016 25.097 195 H GLU 27 H GLU 27 -7.590 -8.425 22.962 196 HA GLU 27 HA GLU 27 -9.616 -6.317 22.736 197 HB2 GLU 27 2HB GLU 27 -7.046 -5.914 23.142 198 HB3 GLU 27 1HB GLU 27 -6.877 -6.312 21.442 199 HG2 GLU 27 2HG GLU 27 -8.332 -4.406 20.852 200 HG3 GLU 27 1HG GLU 27 -8.535 -4.057 22.562 201 H SER 28 H SER 28 -8.823 -5.655 19.960 202 HA SER 28 HA SER 28 -10.535 -7.265 18.512 203 HB2 SER 28 2HB SER 28 -8.222 -5.611 17.494 204 HB3 SER 28 1HB SER 28 -9.700 -6.040 16.618 205 HG SER 28 HG SER 28 -9.630 -3.893 17.579 206 H SER 29 H SER 29 -10.230 -9.137 17.419 207 HA SER 29 HA SER 29 -7.851 -10.585 17.894 208 HB2 SER 29 2HB SER 29 -10.284 -11.233 16.240 209 HB3 SER 29 1HB SER 29 -9.023 -12.389 16.695 210 HG SER 29 HG SER 29 -9.552 -11.762 18.922 211 H THR 30 H THR 30 -6.247 -10.959 16.592 212 HA THR 30 HA THR 30 -6.042 -9.327 14.224 213 HB THR 30 HB THR 30 -4.257 -9.055 15.810 214 HG1 THR 30 1HG THR 30 -3.026 -10.657 13.841 215 HG21 THR 30 3HG2 THR 30 -2.727 -10.899 16.466 216 HG22 THR 30 1HG2 THR 30 -3.796 -12.035 15.645 217 HG23 THR 30 2HG2 THR 30 -4.372 -11.131 17.047 218 H GLY 31 H GLY 31 -6.318 -10.150 12.265 219 HA2 GLY 31 2HA GLY 31 -6.658 -12.991 11.856 220 HA3 GLY 31 1HA GLY 31 -6.755 -11.732 10.622 221 H THR 32 H THR 32 -4.352 -10.534 11.239 222 HA THR 32 HA THR 32 -2.484 -12.099 9.837 223 HB THR 32 HB THR 32 -2.129 -9.578 11.491 224 HG1 THR 32 1HG THR 32 -3.007 -8.520 9.769 225 HG21 THR 32 3HG2 THR 32 -0.589 -10.652 9.123 226 HG22 THR 32 1HG2 THR 32 -0.062 -10.709 10.807 227 HG23 THR 32 2HG2 THR 32 -0.262 -9.149 9.998 228 H ALA 33 H ALA 33 -0.610 -13.126 10.766 229 HA ALA 33 HA ALA 33 -1.188 -14.238 13.359 230 HB1 ALA 33 1HB ALA 33 -0.580 -15.702 11.525 231 HB2 ALA 33 2HB ALA 33 0.617 -15.787 12.821 232 HB3 ALA 33 3HB ALA 33 0.966 -14.870 11.361 233 HA PRO 34 HA PRO 34 1.662 -11.262 15.207 234 HB2 PRO 34 2HB PRO 34 1.536 -12.363 17.741 235 HB3 PRO 34 1HB PRO 34 0.413 -11.148 17.129 236 HG2 PRO 34 2HG PRO 34 0.071 -14.101 17.364 237 HG3 PRO 34 1HG PRO 34 -1.125 -12.815 17.587 238 HD2 PRO 34 2HD PRO 34 -1.002 -14.349 15.361 239 HD3 PRO 34 1HD PRO 34 -1.563 -12.664 15.334 240 H ALA 35 H ALA 35 3.757 -11.487 15.010 241 HA ALA 35 HA ALA 35 4.913 -14.109 14.740 242 HB1 ALA 35 1HB ALA 35 6.213 -11.400 14.506 243 HB2 ALA 35 2HB ALA 35 5.426 -12.279 13.196 244 HB3 ALA 35 3HB ALA 35 6.876 -12.940 13.954 245 H SER 36 H SER 36 4.088 -13.089 17.410 246 HA SER 36 HA SER 36 6.466 -12.800 18.963 247 HB2 SER 36 2HB SER 36 3.656 -13.494 19.847 248 HB3 SER 36 1HB SER 36 4.942 -12.812 20.848 249 HG SER 36 HG SER 36 4.797 -11.189 18.868 250 H THR 37 H THR 37 4.410 -15.428 17.911 251 HA THR 37 HA THR 37 6.400 -17.329 18.457 252 HB THR 37 HB THR 37 5.407 -17.223 20.740 253 HG1 THR 37 1HG THR 37 6.126 -19.191 20.176 254 HG21 THR 37 3HG2 THR 37 3.138 -16.469 20.198 255 HG22 THR 37 1HG2 THR 37 3.079 -17.946 21.165 256 HG23 THR 37 2HG2 THR 37 2.791 -18.017 19.427 257 H GLY 38 H GLY 38 6.281 -18.762 16.823 258 HA2 GLY 38 2HA GLY 38 5.420 -20.006 15.108 259 HA3 GLY 38 1HA GLY 38 3.815 -19.722 15.778 260 H ALA 39 H ALA 39 6.390 -18.010 14.058 261 HA ALA 39 HA ALA 39 4.670 -15.971 13.091 262 HB1 ALA 39 1HB ALA 39 7.091 -15.650 13.327 263 HB2 ALA 39 2HB ALA 39 6.548 -15.307 11.684 264 HB3 ALA 39 3HB ALA 39 7.368 -16.825 12.042 265 H GLU 40 H GLU 40 5.712 -19.042 11.866 266 HA GLU 40 HA GLU 40 4.956 -18.839 9.174 267 HB2 GLU 40 2HB GLU 40 5.110 -21.301 10.871 268 HB3 GLU 40 1HB GLU 40 4.991 -21.283 9.114 269 HG2 GLU 40 2HG GLU 40 6.990 -19.850 9.108 270 HG3 GLU 40 1HG GLU 40 7.178 -20.207 10.811 271 H ASN 41 H ASN 41 3.085 -18.885 11.707 272 HA ASN 41 HA ASN 41 0.705 -20.264 10.998 273 HB2 ASN 41 2HB ASN 41 1.311 -19.351 13.229 274 HB3 ASN 41 1HB ASN 41 0.963 -17.752 12.628 275 HD21 ASN 41 1HD2 ASN 41 -0.691 -17.356 14.070 276 HD22 ASN 41 2HD2 ASN 41 -2.241 -18.109 13.932 277 H LEU 42 H LEU 42 2.085 -17.355 9.721 278 HA LEU 42 HA LEU 42 0.060 -15.725 9.145 279 HB2 LEU 42 2HB LEU 42 1.274 -14.842 7.231 280 HB3 LEU 42 1HB LEU 42 2.260 -15.015 8.637 281 HG LEU 42 HG LEU 42 3.521 -15.415 6.584 282 HD11 LEU 42 1HD1 LEU 42 4.564 -17.526 7.036 283 HD12 LEU 42 2HD1 LEU 42 3.250 -17.920 8.146 284 HD13 LEU 42 3HD1 LEU 42 4.313 -16.554 8.485 285 HD21 LEU 42 3HD2 LEU 42 1.658 -17.706 6.056 286 HD22 LEU 42 1HD2 LEU 42 3.171 -17.413 5.196 287 HD23 LEU 42 2HD2 LEU 42 1.857 -16.244 5.094 288 HA PRO 43 HA PRO 43 -2.794 -17.589 6.386 289 HB2 PRO 43 2HB PRO 43 -4.166 -15.391 5.618 290 HB3 PRO 43 1HB PRO 43 -4.308 -16.070 7.243 291 HG2 PRO 43 2HG PRO 43 -2.732 -13.710 6.305 292 HG3 PRO 43 1HG PRO 43 -3.666 -13.913 7.797 293 HD2 PRO 43 2HD PRO 43 -0.938 -14.162 7.645 294 HD3 PRO 43 1HD PRO 43 -1.939 -14.961 8.870 295 H ALA 44 H ALA 44 -0.552 -15.181 5.349 296 HA ALA 44 HA ALA 44 -0.334 -16.295 2.744 297 HB1 ALA 44 1HB ALA 44 -0.816 -14.188 1.537 298 HB2 ALA 44 2HB ALA 44 -1.350 -13.453 3.048 299 HB3 ALA 44 3HB ALA 44 -2.252 -14.801 2.357 300 H GLY 45 H GLY 45 1.780 -16.153 2.281 301 HA2 GLY 45 2HA GLY 45 3.534 -14.673 4.000 302 HA3 GLY 45 1HA GLY 45 4.002 -15.601 2.581 303 H SER 46 H SER 46 2.091 -14.190 0.921 304 HA SER 46 HA SER 46 3.308 -11.544 0.806 305 HB2 SER 46 2HB SER 46 2.557 -13.155 -1.610 306 HB3 SER 46 1HB SER 46 3.562 -11.724 -1.536 307 HG SER 46 HG SER 46 4.208 -14.340 -0.725 308 H ALA 47 H ALA 47 1.863 -10.019 0.068 309 HA ALA 47 HA ALA 47 -0.888 -10.731 -0.516 310 HB1 ALA 47 1HB ALA 47 -0.910 -10.547 1.931 311 HB2 ALA 47 2HB ALA 47 -1.766 -9.179 1.212 312 HB3 ALA 47 3HB ALA 47 -0.126 -8.972 1.825 313 H LEU 48 H LEU 48 -2.062 -8.358 -0.863 314 HA LEU 48 HA LEU 48 -0.038 -6.743 -2.113 315 HB2 LEU 48 2HB LEU 48 -1.451 -6.559 -4.183 316 HB3 LEU 48 1HB LEU 48 -0.601 -8.066 -3.957 317 HG LEU 48 HG LEU 48 -2.801 -9.034 -3.124 318 HD11 LEU 48 1HD1 LEU 48 -4.853 -7.953 -3.853 319 HD12 LEU 48 2HD1 LEU 48 -3.933 -6.545 -4.382 320 HD13 LEU 48 3HD1 LEU 48 -3.990 -6.971 -2.668 321 HD21 LEU 48 3HD2 LEU 48 -2.604 -8.094 -5.978 322 HD22 LEU 48 1HD2 LEU 48 -3.637 -9.399 -5.401 323 HD23 LEU 48 2HD2 LEU 48 -1.880 -9.549 -5.304 324 H LEU 49 H LEU 49 -0.631 -4.676 -2.637 325 HA LEU 49 HA LEU 49 -3.042 -3.781 -1.285 326 HB2 LEU 49 2HB LEU 49 -1.988 -1.663 -0.699 327 HB3 LEU 49 1HB LEU 49 -1.141 -2.992 0.040 328 HG LEU 49 HG LEU 49 0.431 -1.357 -0.528 329 HD11 LEU 49 1HD1 LEU 49 1.983 -2.364 -2.040 330 HD12 LEU 49 2HD1 LEU 49 0.731 -3.466 -2.593 331 HD13 LEU 49 3HD1 LEU 49 1.273 -3.517 -0.912 332 HD21 LEU 49 3HD2 LEU 49 0.807 -0.426 -2.779 333 HD22 LEU 49 1HD2 LEU 49 -0.770 -0.004 -2.106 334 HD23 LEU 49 2HD2 LEU 49 -0.646 -1.262 -3.335 335 H VAL 50 H VAL 50 -4.272 -2.327 -2.290 336 HA VAL 50 HA VAL 50 -3.531 -1.787 -5.095 337 HB VAL 50 HB VAL 50 -6.348 -2.160 -4.051 338 HG11 VAL 50 1HG1 VAL 50 -6.234 -0.794 -6.027 339 HG12 VAL 50 2HG1 VAL 50 -6.959 -2.354 -6.425 340 HG13 VAL 50 3HG1 VAL 50 -5.284 -2.023 -6.863 341 HG21 VAL 50 3HG2 VAL 50 -6.377 -4.363 -5.179 342 HG22 VAL 50 1HG2 VAL 50 -5.225 -4.308 -3.847 343 HG23 VAL 50 2HG2 VAL 50 -4.653 -4.201 -5.508 344 H VAL 51 H VAL 51 -3.143 0.330 -5.228 345 HA VAL 51 HA VAL 51 -4.689 2.156 -3.533 346 HB VAL 51 HB VAL 51 -2.356 2.755 -5.399 347 HG11 VAL 51 1HG1 VAL 51 -3.837 4.692 -5.120 348 HG12 VAL 51 2HG1 VAL 51 -2.293 4.954 -4.310 349 HG13 VAL 51 3HG1 VAL 51 -3.723 4.532 -3.368 350 HG21 VAL 51 3HG2 VAL 51 -2.482 2.500 -2.400 351 HG22 VAL 51 1HG2 VAL 51 -1.088 3.105 -3.296 352 HG23 VAL 51 2HG2 VAL 51 -1.628 1.444 -3.525 353 H LYS 52 H LYS 52 -6.467 2.897 -4.242 354 HA LYS 52 HA LYS 52 -7.115 2.512 -7.052 355 HB2 LYS 52 2HB LYS 52 -8.592 1.788 -5.090 356 HB3 LYS 52 1HB LYS 52 -8.999 3.487 -4.916 357 HG2 LYS 52 2HG LYS 52 -9.829 3.518 -7.217 358 HG3 LYS 52 1HG LYS 52 -9.460 1.802 -7.362 359 HD2 LYS 52 2HD LYS 52 -10.993 1.393 -5.434 360 HD3 LYS 52 1HD LYS 52 -11.453 3.093 -5.518 361 HE2 LYS 52 2HE LYS 52 -11.767 1.034 -7.692 362 HE3 LYS 52 1HE LYS 52 -13.061 1.712 -6.710 363 HZ1 LYS 52 3HZ LYS 52 -11.389 3.162 -8.700 364 HZ2 LYS 52 1HZ LYS 52 -12.560 3.888 -7.711 365 HZ3 LYS 52 2HZ LYS 52 -13.011 2.731 -8.842 366 H ARG 53 H ARG 53 -6.423 5.063 -4.819 367 HA ARG 53 HA ARG 53 -6.480 6.942 -7.031 368 HB2 ARG 53 2HB ARG 53 -8.668 7.155 -5.723 369 HB3 ARG 53 1HB ARG 53 -7.684 7.660 -4.352 370 HG2 ARG 53 2HG ARG 53 -6.753 9.473 -5.854 371 HG3 ARG 53 1HG ARG 53 -8.029 9.059 -6.996 372 HD2 ARG 53 2HD ARG 53 -8.908 10.835 -5.764 373 HD3 ARG 53 1HD ARG 53 -9.634 9.409 -5.023 374 HE ARG 53 HE ARG 53 -7.407 10.988 -3.924 375 HH11 ARG 53 1HH1 ARG 53 -10.013 8.665 -3.359 376 HH12 ARG 53 2HH1 ARG 53 -9.999 8.855 -1.671 377 HH21 ARG 53 1HH2 ARG 53 -7.365 11.209 -1.626 378 HH22 ARG 53 2HH2 ARG 53 -8.439 10.347 -0.653 379 H GLY 54 H GLY 54 -4.483 7.758 -6.991 380 HA2 GLY 54 2HA GLY 54 -3.214 9.207 -5.245 381 HA3 GLY 54 1HA GLY 54 -3.050 7.643 -4.476 382 HA PRO 55 HA PRO 55 -0.243 8.092 -8.488 383 HB2 PRO 55 2HB PRO 55 1.186 10.371 -7.305 384 HB3 PRO 55 1HB PRO 55 0.697 10.135 -8.992 385 HG2 PRO 55 2HG PRO 55 -0.541 11.926 -7.455 386 HG3 PRO 55 1HG PRO 55 -1.465 10.921 -8.592 387 HD2 PRO 55 2HD PRO 55 -1.140 10.639 -5.630 388 HD3 PRO 55 1HD PRO 55 -2.598 10.473 -6.639 389 H ASN 56 H ASN 56 0.061 8.395 -5.167 390 HA ASN 56 HA ASN 56 2.598 7.818 -4.352 391 HB2 ASN 56 2HB ASN 56 0.010 6.617 -3.314 392 HB3 ASN 56 1HB ASN 56 1.527 6.595 -2.434 393 HD21 ASN 56 1HD2 ASN 56 0.683 7.784 -0.693 394 HD22 ASN 56 2HD2 ASN 56 0.324 9.458 -0.808 395 H ALA 57 H ALA 57 0.249 5.673 -5.765 396 HA ALA 57 HA ALA 57 2.323 3.882 -6.627 397 HB1 ALA 57 1HB ALA 57 0.042 2.808 -4.949 398 HB2 ALA 57 2HB ALA 57 1.724 2.901 -4.427 399 HB3 ALA 57 3HB ALA 57 1.273 1.843 -5.762 400 H GLY 58 H GLY 58 -1.201 3.982 -6.225 401 HA2 GLY 58 2HA GLY 58 -2.901 4.089 -7.747 402 HA3 GLY 58 1HA GLY 58 -1.711 4.605 -8.930 403 H ALA 59 H ALA 59 -1.319 1.565 -7.269 404 HA ALA 59 HA ALA 59 -2.449 0.021 -9.374 405 HB1 ALA 59 1HB ALA 59 0.548 0.158 -8.990 406 HB2 ALA 59 2HB ALA 59 -0.340 0.690 -10.419 407 HB3 ALA 59 3HB ALA 59 -0.293 -1.020 -9.994 408 H ARG 60 H ARG 60 -1.571 -2.331 -8.907 409 HA ARG 60 HA ARG 60 -1.560 -2.683 -6.007 410 HB2 ARG 60 2HB ARG 60 -2.499 -4.930 -6.379 411 HB3 ARG 60 1HB ARG 60 -3.511 -3.671 -7.085 412 HG2 ARG 60 2HG ARG 60 -3.027 -4.283 -9.253 413 HG3 ARG 60 1HG ARG 60 -1.523 -5.084 -8.807 414 HD2 ARG 60 2HD ARG 60 -3.195 -6.727 -9.470 415 HD3 ARG 60 1HD ARG 60 -2.824 -6.891 -7.766 416 HE ARG 60 HE ARG 60 -4.953 -6.151 -7.228 417 HH11 ARG 60 1HH1 ARG 60 -4.491 -6.072 -10.741 418 HH12 ARG 60 2HH1 ARG 60 -6.164 -6.135 -11.087 419 HH21 ARG 60 1HH2 ARG 60 -7.241 -6.318 -7.751 420 HH22 ARG 60 2HH2 ARG 60 -7.727 -6.254 -9.385 421 H PHE 61 H PHE 61 0.164 -3.681 -5.104 422 HA PHE 61 HA PHE 61 1.696 -5.433 -6.790 423 HB2 PHE 61 2HB PHE 61 3.908 -4.539 -6.148 424 HB3 PHE 61 1HB PHE 61 2.981 -3.359 -7.046 425 HD1 PHE 61 2HD PHE 61 2.209 -1.313 -5.947 426 HD2 PHE 61 1HD PHE 61 4.539 -4.204 -3.865 427 HE1 PHE 61 2HE PHE 61 2.729 0.354 -4.218 428 HE2 PHE 61 1HE PHE 61 5.067 -2.538 -2.134 429 HZ PHE 61 HZ PHE 61 4.161 -0.260 -2.305 430 H LEU 62 H LEU 62 3.047 -6.917 -5.626 431 HA LEU 62 HA LEU 62 1.731 -7.460 -3.130 432 HB2 LEU 62 2HB LEU 62 2.579 -9.773 -3.369 433 HB3 LEU 62 1HB LEU 62 1.487 -9.276 -4.636 434 HG LEU 62 HG LEU 62 3.623 -8.901 -6.040 435 HD11 LEU 62 1HD1 LEU 62 5.535 -10.299 -5.455 436 HD12 LEU 62 2HD1 LEU 62 4.777 -10.687 -3.912 437 HD13 LEU 62 3HD1 LEU 62 5.265 -9.028 -4.262 438 HD21 LEU 62 3HD2 LEU 62 2.031 -10.664 -6.482 439 HD22 LEU 62 1HD2 LEU 62 2.767 -11.672 -5.236 440 HD23 LEU 62 2HD2 LEU 62 3.675 -11.264 -6.692 441 H LEU 63 H LEU 63 2.683 -7.808 -1.263 442 HA LEU 63 HA LEU 63 5.249 -6.573 -0.901 443 HB2 LEU 63 2HB LEU 63 3.414 -7.926 1.084 444 HB3 LEU 63 1HB LEU 63 4.935 -7.199 1.523 445 HG LEU 63 HG LEU 63 3.253 -5.704 2.178 446 HD11 LEU 63 1HD1 LEU 63 3.677 -3.683 0.896 447 HD12 LEU 63 2HD1 LEU 63 4.421 -4.650 -0.372 448 HD13 LEU 63 3HD1 LEU 63 5.143 -4.599 1.238 449 HD21 LEU 63 3HD2 LEU 63 1.401 -6.578 0.834 450 HD22 LEU 63 1HD2 LEU 63 2.083 -5.820 -0.603 451 HD23 LEU 63 2HD2 LEU 63 1.495 -4.821 0.732 452 H ASP 64 H ASP 64 6.988 -7.616 -1.340 453 HA ASP 64 HA ASP 64 7.536 -10.196 -0.110 454 HB2 ASP 64 2HB ASP 64 6.828 -10.741 -2.434 455 HB3 ASP 64 1HB ASP 64 8.008 -9.604 -3.066 456 H GLN 65 H GLN 65 8.123 -7.254 -0.008 457 HA GLN 65 HA GLN 65 11.019 -7.471 0.121 458 HB2 GLN 65 2HB GLN 65 10.440 -6.055 -1.753 459 HB3 GLN 65 1HB GLN 65 9.321 -5.136 -0.761 460 HG2 GLN 65 2HG GLN 65 11.178 -4.257 0.531 461 HG3 GLN 65 1HG GLN 65 12.309 -5.189 -0.453 462 HE21 GLN 65 1HE2 GLN 65 9.974 -2.644 -0.489 463 HE22 GLN 65 2HE2 GLN 65 10.564 -1.825 -1.897 464 HA PRO 66 HA PRO 66 9.666 -7.231 4.438 465 HB2 PRO 66 2HB PRO 66 12.345 -6.656 5.231 466 HB3 PRO 66 1HB PRO 66 11.469 -8.179 5.385 467 HG2 PRO 66 2HG PRO 66 13.458 -7.351 3.396 468 HG3 PRO 66 1HG PRO 66 12.924 -8.970 3.837 469 HD2 PRO 66 2HD PRO 66 12.321 -7.759 1.495 470 HD3 PRO 66 1HD PRO 66 11.286 -8.999 2.234 471 H THR 67 H THR 67 12.046 -4.863 3.296 472 HA THR 67 HA THR 67 10.590 -2.925 4.922 473 HB THR 67 HB THR 67 13.485 -2.795 4.040 474 HG1 THR 67 1HG THR 67 13.887 -3.822 5.788 475 HG21 THR 67 3HG2 THR 67 13.620 -0.889 5.604 476 HG22 THR 67 1HG2 THR 67 11.892 -1.033 5.926 477 HG23 THR 67 2HG2 THR 67 12.453 -0.569 4.320 478 H THR 68 H THR 68 9.108 -2.193 3.488 479 HA THR 68 HA THR 68 10.136 -1.097 0.991 480 HB THR 68 HB THR 68 7.323 -1.914 1.785 481 HG1 THR 68 1HG THR 68 8.543 -3.741 1.325 482 HG21 THR 68 3HG2 THR 68 7.311 -0.001 0.214 483 HG22 THR 68 1HG2 THR 68 6.739 -1.473 -0.576 484 HG23 THR 68 2HG2 THR 68 8.377 -0.891 -0.871 485 H THR 69 H THR 69 10.430 1.040 1.084 486 HA THR 69 HA THR 69 8.971 2.487 3.149 487 HB THR 69 HB THR 69 11.562 3.230 1.759 488 HG1 THR 69 1HG THR 69 10.933 2.094 4.280 489 HG21 THR 69 3HG2 THR 69 10.291 5.181 2.613 490 HG22 THR 69 1HG2 THR 69 11.762 4.910 3.548 491 HG23 THR 69 2HG2 THR 69 10.198 4.419 4.201 492 H ALA 70 H ALA 70 7.608 3.999 2.579 493 HA ALA 70 HA ALA 70 7.412 4.761 -0.229 494 HB1 ALA 70 1HB ALA 70 5.409 3.799 0.736 495 HB2 ALA 70 2HB ALA 70 5.154 5.516 0.415 496 HB3 ALA 70 3HB ALA 70 5.456 4.959 2.065 497 H GLY 71 H GLY 71 7.907 6.807 -0.762 498 HA2 GLY 71 2HA GLY 71 7.700 8.987 1.018 499 HA3 GLY 71 1HA GLY 71 9.369 8.451 0.846 500 H ARG 72 H ARG 72 10.215 10.043 -0.373 501 HA ARG 72 HA ARG 72 8.668 11.116 -2.543 502 HB2 ARG 72 2HB ARG 72 10.150 12.531 -1.095 503 HB3 ARG 72 1HB ARG 72 11.529 11.707 -1.808 504 HG2 ARG 72 2HG ARG 72 11.028 12.603 -3.972 505 HG3 ARG 72 1HG ARG 72 9.518 13.295 -3.382 506 HD2 ARG 72 2HD ARG 72 12.305 14.068 -2.530 507 HD3 ARG 72 1HD ARG 72 11.218 15.020 -3.537 508 HE ARG 72 HE ARG 72 10.838 14.419 -0.679 509 HH11 ARG 72 1HH1 ARG 72 10.119 16.479 -3.497 510 HH12 ARG 72 2HH1 ARG 72 9.338 17.670 -2.591 511 HH21 ARG 72 1HH2 ARG 72 9.720 16.078 0.551 512 HH22 ARG 72 2HH2 ARG 72 9.087 17.439 -0.242 513 H HIS 73 H HIS 73 11.874 9.570 -2.297 514 HA HIS 73 HA HIS 73 11.524 7.578 -4.110 515 HB2 HIS 73 2HB HIS 73 11.188 9.337 -5.875 516 HB3 HIS 73 1HB HIS 73 12.837 9.886 -5.596 517 HD1 HIS 73 1HD HIS 73 14.487 8.892 -7.223 518 HD2 HIS 73 2HD HIS 73 11.218 6.405 -6.595 519 HE1 HIS 73 1HE HIS 73 14.803 6.916 -8.746 520 HA PRO 74 HA PRO 74 16.391 8.378 -3.739 521 HB2 PRO 74 2HB PRO 74 16.395 10.036 -1.271 522 HB3 PRO 74 1HB PRO 74 17.462 10.109 -2.677 523 HG2 PRO 74 2HG PRO 74 15.588 11.951 -2.334 524 HG3 PRO 74 1HG PRO 74 15.923 11.290 -3.945 525 HD2 PRO 74 2HD PRO 74 13.681 10.661 -2.070 526 HD3 PRO 74 1HD PRO 74 13.641 10.892 -3.829 527 H GLU 75 H GLU 75 14.236 8.104 -1.008 528 HA GLU 75 HA GLU 75 15.954 5.966 0.116 529 HB2 GLU 75 2HB GLU 75 14.124 7.845 1.595 530 HB3 GLU 75 1HB GLU 75 15.173 6.628 2.303 531 HG2 GLU 75 2HG GLU 75 17.121 7.844 1.583 532 HG3 GLU 75 1HG GLU 75 16.104 9.036 0.770 533 H SER 76 H SER 76 13.668 5.875 -1.828 534 HA SER 76 HA SER 76 11.918 4.123 -0.306 535 HB2 SER 76 2HB SER 76 10.902 6.451 -1.945 536 HB3 SER 76 1HB SER 76 9.921 5.272 -1.071 537 HG SER 76 HG SER 76 11.513 6.078 0.711 538 H ASP 77 H ASP 77 11.161 2.439 -1.554 539 HA ASP 77 HA ASP 77 12.363 2.077 -4.056 540 HB2 ASP 77 2HB ASP 77 11.803 0.112 -2.732 541 HB3 ASP 77 1HB ASP 77 10.085 0.480 -2.861 542 H ILE 78 H ILE 78 9.149 2.949 -3.059 543 HA ILE 78 HA ILE 78 8.366 3.414 -5.825 544 HB ILE 78 HB ILE 78 6.052 3.727 -4.857 545 HG12 ILE 78 2HG1 ILE 78 7.311 2.531 -2.368 546 HG13 ILE 78 1HG1 ILE 78 6.737 4.188 -2.514 547 HG21 ILE 78 1HG2 ILE 78 6.639 1.682 -5.973 548 HG22 ILE 78 2HG2 ILE 78 5.630 1.309 -4.572 549 HG23 ILE 78 3HG2 ILE 78 7.371 1.044 -4.501 550 HD11 ILE 78 3HD1 ILE 78 5.152 2.789 -1.305 551 HD12 ILE 78 1HD1 ILE 78 5.052 1.699 -2.689 552 HD13 ILE 78 2HD1 ILE 78 4.453 3.352 -2.824 553 H PHE 79 H PHE 79 7.643 5.414 -6.488 554 HA PHE 79 HA PHE 79 8.485 7.608 -4.766 555 HB2 PHE 79 2HB PHE 79 8.528 8.984 -6.855 556 HB3 PHE 79 1HB PHE 79 9.658 7.648 -6.888 557 HD1 PHE 79 1HD PHE 79 9.088 5.625 -8.296 558 HD2 PHE 79 2HD PHE 79 6.861 9.248 -8.496 559 HE1 PHE 79 1HE PHE 79 8.181 4.949 -10.481 560 HE2 PHE 79 2HE PHE 79 5.949 8.567 -10.675 561 HZ PHE 79 HZ PHE 79 6.606 6.416 -11.666 562 H LEU 80 H LEU 80 6.964 8.693 -3.742 563 HA LEU 80 HA LEU 80 4.279 8.415 -4.718 564 HB2 LEU 80 2HB LEU 80 5.359 9.280 -2.049 565 HB3 LEU 80 1HB LEU 80 3.678 9.459 -2.479 566 HG LEU 80 HG LEU 80 3.504 6.979 -2.682 567 HD11 LEU 80 1HD1 LEU 80 5.812 6.457 -3.188 568 HD12 LEU 80 2HD1 LEU 80 5.229 5.567 -1.780 569 HD13 LEU 80 3HD1 LEU 80 6.282 6.968 -1.566 570 HD21 LEU 80 3HD2 LEU 80 4.529 7.968 -0.034 571 HD22 LEU 80 1HD2 LEU 80 3.524 6.544 -0.302 572 HD23 LEU 80 2HD2 LEU 80 2.882 8.153 -0.634 573 H ASP 81 H ASP 81 3.398 9.991 -5.831 574 HA ASP 81 HA ASP 81 4.249 12.714 -5.221 575 HB2 ASP 81 2HB ASP 81 4.134 12.143 -7.672 576 HB3 ASP 81 1HB ASP 81 2.422 11.801 -7.501 577 H ASP 82 H ASP 82 3.368 12.421 -3.210 578 HA ASP 82 HA ASP 82 0.533 12.012 -2.831 579 HB2 ASP 82 2HB ASP 82 2.397 11.229 -1.225 580 HB3 ASP 82 1HB ASP 82 2.606 12.927 -0.818 581 H VAL 83 H VAL 83 -0.249 13.855 -1.031 582 HA VAL 83 HA VAL 83 -0.085 16.289 -2.587 583 HB VAL 83 HB VAL 83 -2.351 15.482 -1.906 584 HG11 VAL 83 1HG1 VAL 83 -1.492 16.090 0.901 585 HG12 VAL 83 2HG1 VAL 83 -1.851 14.498 0.232 586 HG13 VAL 83 3HG1 VAL 83 -3.133 15.701 0.389 587 HG21 VAL 83 3HG2 VAL 83 -1.579 18.143 -0.731 588 HG22 VAL 83 1HG2 VAL 83 -3.230 17.630 -1.084 589 HG23 VAL 83 2HG2 VAL 83 -2.067 17.830 -2.396 590 H THR 84 H THR 84 1.058 14.838 0.316 591 HA THR 84 HA THR 84 2.851 17.046 0.681 592 HB THR 84 HB THR 84 1.174 16.217 3.083 593 HG1 THR 84 1HG THR 84 0.759 18.067 1.082 594 HG21 THR 84 3HG2 THR 84 2.188 18.201 4.108 595 HG22 THR 84 1HG2 THR 84 3.069 18.526 2.613 596 HG23 THR 84 2HG2 THR 84 3.435 17.080 3.549 597 H VAL 85 H VAL 85 4.368 15.485 0.077 598 HA VAL 85 HA VAL 85 4.808 13.284 1.966 599 HB VAL 85 HB VAL 85 4.410 12.467 -0.312 600 HG11 VAL 85 1HG1 VAL 85 5.926 12.958 -2.174 601 HG12 VAL 85 2HG1 VAL 85 6.746 14.158 -1.176 602 HG13 VAL 85 3HG1 VAL 85 5.054 14.386 -1.620 603 HG21 VAL 85 3HG2 VAL 85 5.960 11.187 1.026 604 HG22 VAL 85 1HG2 VAL 85 7.304 12.188 0.478 605 HG23 VAL 85 2HG2 VAL 85 6.458 11.148 -0.667 606 H SER 86 H SER 86 6.757 13.128 3.017 607 HA SER 86 HA SER 86 8.416 15.482 2.865 608 HB2 SER 86 2HB SER 86 9.430 14.458 4.955 609 HB3 SER 86 1HB SER 86 7.719 14.881 5.065 610 HG SER 86 HG SER 86 7.559 12.854 5.721 611 H ARG 87 H ARG 87 9.358 12.273 3.623 612 HA ARG 87 HA ARG 87 10.988 11.725 1.356 613 HB2 ARG 87 2HB ARG 87 13.189 11.633 2.567 614 HB3 ARG 87 1HB ARG 87 12.583 13.266 2.357 615 HG2 ARG 87 2HG ARG 87 11.836 13.269 4.695 616 HG3 ARG 87 1HG ARG 87 12.471 11.637 4.891 617 HD2 ARG 87 2HD ARG 87 14.123 14.030 4.086 618 HD3 ARG 87 1HD ARG 87 13.992 13.440 5.733 619 HE ARG 87 HE ARG 87 14.862 11.354 3.996 620 HH11 ARG 87 1HH1 ARG 87 16.035 14.285 5.587 621 HH12 ARG 87 2HH1 ARG 87 17.662 13.773 5.591 622 HH21 ARG 87 1HH2 ARG 87 17.065 10.654 4.110 623 HH22 ARG 87 2HH2 ARG 87 18.259 11.706 4.752 624 H ARG 88 H ARG 88 10.077 11.088 4.658 625 HA ARG 88 HA ARG 88 9.995 8.221 4.073 626 HB2 ARG 88 2HB ARG 88 10.432 9.581 6.765 627 HB3 ARG 88 1HB ARG 88 10.349 7.852 6.485 628 HG2 ARG 88 2HG ARG 88 12.510 9.665 5.431 629 HG3 ARG 88 1HG ARG 88 12.632 8.663 6.877 630 HD2 ARG 88 2HD ARG 88 12.317 6.660 5.499 631 HD3 ARG 88 1HD ARG 88 12.161 7.672 4.072 632 HE ARG 88 HE ARG 88 14.437 8.417 4.467 633 HH11 ARG 88 1HH1 ARG 88 13.494 5.366 6.025 634 HH12 ARG 88 2HH1 ARG 88 15.042 4.682 5.974 635 HH21 ARG 88 1HH2 ARG 88 16.563 7.489 4.416 636 HH22 ARG 88 2HH2 ARG 88 16.844 5.903 4.999 637 H HIS 89 H HIS 89 7.841 8.052 3.594 638 HA HIS 89 HA HIS 89 5.975 9.837 4.971 639 HB2 HIS 89 2HB HIS 89 6.175 9.507 2.403 640 HB3 HIS 89 1HB HIS 89 5.374 7.974 2.670 641 HD2 HIS 89 2HD HIS 89 2.625 8.130 2.831 642 HE1 HIS 89 1HE HIS 89 2.469 12.351 2.519 643 HE2 HIS 89 2HE HIS 89 1.327 10.236 1.944 644 H ALA 90 H ALA 90 6.144 6.428 3.918 645 HA ALA 90 HA ALA 90 5.074 5.592 6.472 646 HB1 ALA 90 1HB ALA 90 3.729 4.888 3.858 647 HB2 ALA 90 2HB ALA 90 3.070 5.954 5.100 648 HB3 ALA 90 3HB ALA 90 3.312 4.243 5.444 649 H GLU 91 H GLU 91 5.652 3.564 6.987 650 HA GLU 91 HA GLU 91 7.557 2.207 5.233 651 HB2 GLU 91 2HB GLU 91 7.041 2.111 8.195 652 HB3 GLU 91 1HB GLU 91 8.066 0.952 7.367 653 HG2 GLU 91 2HG GLU 91 8.555 3.882 7.167 654 HG3 GLU 91 1HG GLU 91 9.139 2.936 8.536 655 H PHE 92 H PHE 92 6.920 0.422 4.334 656 HA PHE 92 HA PHE 92 4.592 -0.955 5.407 657 HB2 PHE 92 2HB PHE 92 5.883 -1.001 2.673 658 HB3 PHE 92 1HB PHE 92 4.609 -2.123 3.145 659 HD1 PHE 92 1HD PHE 92 5.442 1.339 2.270 660 HD2 PHE 92 2HD PHE 92 2.332 -1.350 3.352 661 HE1 PHE 92 1HE PHE 92 3.752 2.992 1.559 662 HE2 PHE 92 2HE PHE 92 0.654 0.294 2.644 663 HZ PHE 92 HZ PHE 92 1.368 2.466 1.744 664 H ARG 93 H ARG 93 5.097 -2.482 6.677 665 HA ARG 93 HA ARG 93 7.696 -3.796 6.498 666 HB2 ARG 93 2HB ARG 93 5.872 -3.043 8.688 667 HB3 ARG 93 1HB ARG 93 6.660 -4.598 8.851 668 HG2 ARG 93 2HG ARG 93 7.831 -2.764 10.001 669 HG3 ARG 93 1HG ARG 93 8.826 -3.558 8.792 670 HD2 ARG 93 2HD ARG 93 8.287 -1.714 7.222 671 HD3 ARG 93 1HD ARG 93 7.407 -0.917 8.529 672 HE ARG 93 HE ARG 93 9.368 -0.235 9.399 673 HH11 ARG 93 1HH1 ARG 93 10.092 -3.017 7.317 674 HH12 ARG 93 2HH1 ARG 93 11.774 -2.774 7.330 675 HH21 ARG 93 1HH2 ARG 93 11.671 0.103 9.402 676 HH22 ARG 93 2HH2 ARG 93 12.707 -0.952 8.564 677 H ILE 94 H ILE 94 7.657 -5.713 5.655 678 HA ILE 94 HA ILE 94 5.347 -7.306 6.360 679 HB ILE 94 HB ILE 94 5.440 -6.944 3.875 680 HG12 ILE 94 2HG1 ILE 94 4.407 -9.038 4.747 681 HG13 ILE 94 1HG1 ILE 94 5.024 -9.188 3.114 682 HG21 ILE 94 1HG2 ILE 94 7.765 -6.735 3.496 683 HG22 ILE 94 2HG2 ILE 94 7.107 -8.020 2.482 684 HG23 ILE 94 3HG2 ILE 94 8.025 -8.424 3.932 685 HD11 ILE 94 3HD1 ILE 94 5.443 -11.193 4.400 686 HD12 ILE 94 1HD1 ILE 94 6.306 -10.255 5.621 687 HD13 ILE 94 2HD1 ILE 94 6.969 -10.404 3.994 688 H ASN 95 H ASN 95 5.739 -8.656 7.763 689 HA ASN 95 HA ASN 95 8.453 -9.613 8.211 690 HB2 ASN 95 2HB ASN 95 7.592 -8.119 10.037 691 HB3 ASN 95 1HB ASN 95 6.214 -9.199 10.232 692 HD21 ASN 95 1HD2 ASN 95 6.787 -9.586 12.399 693 HD22 ASN 95 2HD2 ASN 95 8.106 -10.612 12.804 694 H GLU 96 H GLU 96 8.593 -11.747 8.723 695 HA GLU 96 HA GLU 96 7.222 -13.654 7.257 696 HB2 GLU 96 2HB GLU 96 8.395 -15.255 8.754 697 HB3 GLU 96 1HB GLU 96 9.418 -13.989 8.085 698 HG2 GLU 96 2HG GLU 96 9.180 -12.727 10.197 699 HG3 GLU 96 1HG GLU 96 8.254 -14.067 10.858 700 H GLY 97 H GLY 97 5.311 -12.169 9.064 701 HA2 GLY 97 2HA GLY 97 3.595 -14.281 9.834 702 HA3 GLY 97 1HA GLY 97 4.339 -13.534 11.241 703 H GLU 98 H GLU 98 4.565 -10.900 10.333 704 HA GLU 98 HA GLU 98 1.743 -10.121 10.257 705 HB2 GLU 98 2HB GLU 98 3.960 -8.930 11.893 706 HB3 GLU 98 1HB GLU 98 2.413 -8.144 11.646 707 HG2 GLU 98 2HG GLU 98 1.260 -9.903 12.771 708 HG3 GLU 98 1HG GLU 98 2.729 -10.870 12.859 709 H PHE 99 H PHE 99 1.159 -8.441 9.126 710 HA PHE 99 HA PHE 99 3.118 -7.095 7.410 711 HB2 PHE 99 2HB PHE 99 0.096 -7.369 7.232 712 HB3 PHE 99 1HB PHE 99 1.057 -6.391 6.136 713 HD1 PHE 99 1HD PHE 99 0.310 -9.837 7.231 714 HD2 PHE 99 2HD PHE 99 2.146 -7.380 4.285 715 HE1 PHE 99 1HE PHE 99 0.531 -11.785 5.751 716 HE2 PHE 99 2HE PHE 99 2.376 -9.329 2.801 717 HZ PHE 99 HZ PHE 99 1.571 -11.532 3.531 718 H GLU 100 H GLU 100 3.565 -5.045 8.045 719 HA GLU 100 HA GLU 100 1.666 -3.759 9.853 720 HB2 GLU 100 2HB GLU 100 4.624 -4.039 10.285 721 HB3 GLU 100 1HB GLU 100 3.638 -2.858 11.141 722 HG2 GLU 100 2HG GLU 100 2.266 -4.543 11.995 723 HG3 GLU 100 1HG GLU 100 3.151 -5.820 11.152 724 H VAL 101 H VAL 101 1.345 -1.732 9.655 725 HA VAL 101 HA VAL 101 2.961 -0.311 7.646 726 HB VAL 101 HB VAL 101 0.684 -0.657 6.756 727 HG11 VAL 101 1HG1 VAL 101 -0.321 0.856 9.152 728 HG12 VAL 101 2HG1 VAL 101 -0.613 -0.839 8.770 729 HG13 VAL 101 3HG1 VAL 101 -1.287 0.426 7.741 730 HG21 VAL 101 3HG2 VAL 101 0.105 1.678 6.208 731 HG22 VAL 101 1HG2 VAL 101 1.834 1.358 6.068 732 HG23 VAL 101 2HG2 VAL 101 1.210 2.226 7.469 733 H VAL 102 H VAL 102 4.112 1.275 8.421 734 HA VAL 102 HA VAL 102 3.268 2.492 10.974 735 HB VAL 102 HB VAL 102 6.126 2.046 10.058 736 HG11 VAL 102 1HG1 VAL 102 6.752 2.668 12.334 737 HG12 VAL 102 2HG1 VAL 102 5.062 2.984 12.713 738 HG13 VAL 102 3HG1 VAL 102 5.895 3.973 11.512 739 HG21 VAL 102 3HG2 VAL 102 6.277 0.331 11.816 740 HG22 VAL 102 1HG2 VAL 102 5.100 -0.101 10.577 741 HG23 VAL 102 2HG2 VAL 102 4.554 0.521 12.133 742 H ASP 103 H ASP 103 2.984 4.698 10.842 743 HA ASP 103 HA ASP 103 3.952 6.102 8.500 744 HB2 ASP 103 2HB ASP 103 1.801 6.733 9.729 745 HB3 ASP 103 1HB ASP 103 2.827 7.328 11.026 746 H VAL 104 H VAL 104 5.822 7.207 8.407 747 HA VAL 104 HA VAL 104 7.302 7.469 10.925 748 HB VAL 104 HB VAL 104 9.429 7.062 9.642 749 HG11 VAL 104 1HG1 VAL 104 9.200 4.625 9.723 750 HG12 VAL 104 2HG1 VAL 104 7.449 4.791 9.783 751 HG13 VAL 104 3HG1 VAL 104 8.437 5.384 11.119 752 HG21 VAL 104 3HG2 VAL 104 8.495 7.431 7.393 753 HG22 VAL 104 1HG2 VAL 104 7.520 5.975 7.565 754 HG23 VAL 104 2HG2 VAL 104 9.284 5.859 7.521 755 H GLY 105 H GLY 105 5.771 9.346 8.996 756 HA2 GLY 105 2HA GLY 105 6.853 11.679 9.674 757 HA3 GLY 105 1HA GLY 105 7.958 11.181 8.411 758 H SER 106 H SER 106 4.546 10.396 8.155 759 HA SER 106 HA SER 106 4.411 12.082 5.846 760 HB2 SER 106 2HB SER 106 3.234 9.955 5.785 761 HB3 SER 106 1HB SER 106 2.329 10.378 7.238 762 HG SER 106 HG SER 106 1.765 10.873 4.717 763 H LEU 107 H LEU 107 3.610 14.078 5.804 764 HA LEU 107 HA LEU 107 2.999 15.346 8.300 765 HB2 LEU 107 2HB LEU 107 2.811 16.409 5.498 766 HB3 LEU 107 1HB LEU 107 2.491 17.331 6.950 767 HG LEU 107 HG LEU 107 4.644 17.974 6.216 768 HD11 LEU 107 1HD1 LEU 107 5.060 15.998 8.428 769 HD12 LEU 107 2HD1 LEU 107 4.552 17.678 8.589 770 HD13 LEU 107 3HD1 LEU 107 6.164 17.295 7.981 771 HD21 LEU 107 3HD2 LEU 107 6.475 16.436 5.725 772 HD22 LEU 107 1HD2 LEU 107 5.107 16.166 4.649 773 HD23 LEU 107 2HD2 LEU 107 5.402 15.061 5.993 774 H ASN 108 H ASN 108 1.274 13.766 5.930 775 HA ASN 108 HA ASN 108 -1.275 14.985 6.589 776 HB2 ASN 108 2HB ASN 108 -0.436 12.798 4.700 777 HB3 ASN 108 1HB ASN 108 -2.124 13.228 4.960 778 HD21 ASN 108 1HD2 ASN 108 -0.328 13.405 2.547 779 HD22 ASN 108 2HD2 ASN 108 -0.452 15.040 2.103 780 H GLY 109 H GLY 109 0.543 12.089 7.033 781 HA2 GLY 109 2HA GLY 109 0.427 10.707 8.947 782 HA3 GLY 109 1HA GLY 109 -1.147 11.391 9.311 783 H THR 110 H THR 110 0.367 8.697 8.379 784 HA THR 110 HA THR 110 -1.622 7.614 6.604 785 HB THR 110 HB THR 110 0.627 6.263 8.111 786 HG1 THR 110 1HG THR 110 1.551 7.817 6.940 787 HG21 THR 110 3HG2 THR 110 -0.993 4.695 7.134 788 HG22 THR 110 1HG2 THR 110 0.533 4.632 6.256 789 HG23 THR 110 2HG2 THR 110 -0.846 5.492 5.571 790 H TYR 111 H TYR 111 -3.496 6.804 7.354 791 HA TYR 111 HA TYR 111 -3.598 5.495 9.967 792 HB2 TYR 111 2HB TYR 111 -5.520 7.658 9.056 793 HB3 TYR 111 1HB TYR 111 -5.826 6.584 10.410 794 HD1 TYR 111 1HD TYR 111 -4.362 6.716 12.418 795 HD2 TYR 111 2HD TYR 111 -4.149 9.579 9.288 796 HE1 TYR 111 1HE TYR 111 -3.195 8.257 13.923 797 HE2 TYR 111 2HE TYR 111 -2.971 11.131 10.785 798 HH TYR 111 HH TYR 111 -2.836 11.489 13.252 799 H VAL 112 H VAL 112 -5.609 4.189 10.175 800 HA VAL 112 HA VAL 112 -6.348 3.146 7.544 801 HB VAL 112 HB VAL 112 -6.895 1.919 10.252 802 HG11 VAL 112 1HG1 VAL 112 -7.183 -0.182 8.990 803 HG12 VAL 112 2HG1 VAL 112 -6.955 0.718 7.493 804 HG13 VAL 112 3HG1 VAL 112 -8.340 1.066 8.527 805 HG21 VAL 112 3HG2 VAL 112 -4.989 0.395 9.853 806 HG22 VAL 112 1HG2 VAL 112 -4.487 2.079 10.009 807 HG23 VAL 112 2HG2 VAL 112 -4.574 1.330 8.417 808 H ASN 113 H ASN 113 -8.548 3.085 6.988 809 HA ASN 113 HA ASN 113 -10.051 5.279 7.916 810 HB2 ASN 113 2HB ASN 113 -11.690 4.726 6.329 811 HB3 ASN 113 1HB ASN 113 -10.244 3.996 5.647 812 HD21 ASN 113 1HD2 ASN 113 -10.022 1.693 5.811 813 HD22 ASN 113 2HD2 ASN 113 -11.405 0.696 6.044 814 H ARG 114 H ARG 114 -9.927 2.030 9.059 815 HA ARG 114 HA ARG 114 -12.278 2.474 10.755 816 HB2 ARG 114 2HB ARG 114 -10.841 -0.051 9.955 817 HB3 ARG 114 1HB ARG 114 -12.105 0.001 11.174 818 HG2 ARG 114 2HG ARG 114 -13.712 0.722 9.559 819 HG3 ARG 114 1HG ARG 114 -12.459 0.896 8.331 820 HD2 ARG 114 2HD ARG 114 -12.064 -1.497 8.351 821 HD3 ARG 114 1HD ARG 114 -13.230 -1.699 9.664 822 HE ARG 114 HE ARG 114 -14.957 -1.264 8.232 823 HH11 ARG 114 1HH1 ARG 114 -11.851 -1.299 6.470 824 HH12 ARG 114 2HH1 ARG 114 -12.606 -1.320 4.927 825 HH21 ARG 114 1HH2 ARG 114 -15.930 -1.322 6.073 826 HH22 ARG 114 2HH2 ARG 114 -14.928 -1.333 4.700 827 H GLU 115 H GLU 115 -8.947 2.747 10.924 828 HA GLU 115 HA GLU 115 -8.994 2.063 13.765 829 HB2 GLU 115 2HB GLU 115 -8.003 0.237 12.283 830 HB3 GLU 115 1HB GLU 115 -6.676 1.348 11.999 831 HG2 GLU 115 2HG GLU 115 -6.063 -0.177 13.694 832 HG3 GLU 115 1HG GLU 115 -6.253 1.434 14.385 833 HA PRO 116 HA PRO 116 -7.052 6.189 13.620 834 HB2 PRO 116 2HB PRO 116 -7.435 6.149 16.515 835 HB3 PRO 116 1HB PRO 116 -8.178 7.217 15.325 836 HG2 PRO 116 2HG PRO 116 -9.587 5.336 16.663 837 HG3 PRO 116 1HG PRO 116 -9.978 5.817 15.001 838 HD2 PRO 116 2HD PRO 116 -8.480 3.413 15.973 839 HD3 PRO 116 1HD PRO 116 -9.739 3.552 14.718 840 H ARG 117 H ARG 117 -5.253 4.390 13.305 841 HA ARG 117 HA ARG 117 -3.288 4.689 15.470 842 HB2 ARG 117 2HB ARG 117 -3.828 2.298 13.702 843 HB3 ARG 117 1HB ARG 117 -2.422 2.450 14.742 844 HG2 ARG 117 2HG ARG 117 -5.224 2.537 15.812 845 HG3 ARG 117 1HG ARG 117 -4.354 1.020 15.564 846 HD2 ARG 117 2HD ARG 117 -3.450 3.319 17.287 847 HD3 ARG 117 1HD ARG 117 -4.220 1.850 17.881 848 HE ARG 117 HE ARG 117 -1.556 2.054 16.667 849 HH11 ARG 117 1HH1 ARG 117 -3.937 0.073 18.394 850 HH12 ARG 117 2HH1 ARG 117 -2.830 -1.052 18.997 851 HH21 ARG 117 1HH2 ARG 117 0.019 0.504 17.508 852 HH22 ARG 117 2HH2 ARG 117 -0.473 -0.782 18.483 853 H ASN 118 H ASN 118 -1.384 5.577 14.684 854 HA ASN 118 HA ASN 118 -1.234 6.023 11.827 855 HB2 ASN 118 2HB ASN 118 0.699 7.437 12.216 856 HB3 ASN 118 1HB ASN 118 -0.610 7.864 13.324 857 HD21 ASN 118 1HD2 ASN 118 2.198 8.473 13.498 858 HD22 ASN 118 2HD2 ASN 118 2.765 7.809 14.979 859 H ALA 119 H ALA 119 -0.014 3.928 14.096 860 HA ALA 119 HA ALA 119 1.142 2.481 11.802 861 HB1 ALA 119 1HB ALA 119 2.971 3.111 13.343 862 HB2 ALA 119 2HB ALA 119 2.728 1.365 13.326 863 HB3 ALA 119 3HB ALA 119 2.117 2.326 14.673 864 H GLN 120 H GLN 120 0.302 0.528 11.536 865 HA GLN 120 HA GLN 120 -1.227 -0.706 13.637 866 HB2 GLN 120 2HB GLN 120 -2.885 0.752 12.610 867 HB3 GLN 120 1HB GLN 120 -2.520 0.098 11.025 868 HG2 GLN 120 2HG GLN 120 -4.631 -0.774 11.928 869 HG3 GLN 120 1HG GLN 120 -3.452 -2.046 11.647 870 HE21 GLN 120 1HE2 GLN 120 -5.770 -2.105 13.349 871 HE22 GLN 120 2HE2 GLN 120 -5.199 -2.432 14.944 872 H VAL 121 H VAL 121 -1.598 -2.910 13.387 873 HA VAL 121 HA VAL 121 0.014 -4.215 11.390 874 HB VAL 121 HB VAL 121 -0.194 -5.249 13.654 875 HG11 VAL 121 1HG1 VAL 121 -2.431 -4.575 14.262 876 HG12 VAL 121 2HG1 VAL 121 -2.273 -6.325 14.393 877 HG13 VAL 121 3HG1 VAL 121 -3.115 -5.619 13.016 878 HG21 VAL 121 3HG2 VAL 121 -0.725 -7.559 12.979 879 HG22 VAL 121 1HG2 VAL 121 0.292 -6.735 11.797 880 HG23 VAL 121 2HG2 VAL 121 -1.431 -6.947 11.484 881 H MET 122 H MET 122 -0.759 -5.023 9.518 882 HA MET 122 HA MET 122 -3.074 -3.768 8.472 883 HB2 MET 122 2HB MET 122 -1.331 -5.893 7.244 884 HB3 MET 122 1HB MET 122 -2.567 -4.987 6.392 885 HG2 MET 122 2HG MET 122 -1.338 -2.923 6.742 886 HG3 MET 122 1HG MET 122 -0.127 -3.790 7.690 887 HE1 MET 122 3HE MET 122 1.895 -3.021 4.456 888 HE2 MET 122 1HE MET 122 1.787 -2.807 6.200 889 HE3 MET 122 2HE MET 122 0.670 -1.946 5.127 890 H GLN 123 H GLN 123 -4.840 -4.735 7.421 891 HA GLN 123 HA GLN 123 -5.668 -7.367 8.363 892 HB2 GLN 123 2HB GLN 123 -6.783 -5.699 9.770 893 HB3 GLN 123 1HB GLN 123 -7.260 -4.783 8.349 894 HG2 GLN 123 2HG GLN 123 -9.151 -6.012 9.217 895 HG3 GLN 123 1HG GLN 123 -8.685 -6.649 7.642 896 HE21 GLN 123 1HE2 GLN 123 -8.837 -7.236 11.016 897 HE22 GLN 123 2HE2 GLN 123 -8.505 -8.933 10.951 898 H THR 124 H THR 124 -6.583 -8.527 6.709 899 HA THR 124 HA THR 124 -6.449 -7.320 4.109 900 HB THR 124 HB THR 124 -5.642 -9.608 4.248 901 HG1 THR 124 1HG THR 124 -8.130 -9.692 2.874 902 HG21 THR 124 3HG2 THR 124 -7.144 -11.514 4.757 903 HG22 THR 124 1HG2 THR 124 -8.433 -10.376 5.149 904 HG23 THR 124 2HG2 THR 124 -6.977 -10.432 6.141 905 H GLY 125 H GLY 125 -8.048 -6.504 3.022 906 HA2 GLY 125 2HA GLY 125 -10.268 -6.315 2.322 907 HA3 GLY 125 1HA GLY 125 -10.776 -7.212 3.752 908 H ASP 126 H ASP 126 -8.479 -4.710 4.169 909 HA ASP 126 HA ASP 126 -10.633 -2.944 5.064 910 HB2 ASP 126 2HB ASP 126 -9.156 -4.126 6.918 911 HB3 ASP 126 1HB ASP 126 -7.945 -2.944 6.439 912 H GLU 127 H GLU 127 -9.507 -0.685 5.378 913 HA GLU 127 HA GLU 127 -7.973 -0.229 2.916 914 HB2 GLU 127 2HB GLU 127 -10.389 0.105 2.555 915 HB3 GLU 127 1HB GLU 127 -10.376 1.348 3.795 916 HG2 GLU 127 2HG GLU 127 -8.819 2.648 2.438 917 HG3 GLU 127 1HG GLU 127 -8.899 1.411 1.186 918 H ILE 128 H ILE 128 -6.346 1.066 3.151 919 HA ILE 128 HA ILE 128 -5.962 2.484 5.693 920 HB ILE 128 HB ILE 128 -3.862 1.395 3.786 921 HG12 ILE 128 2HG1 ILE 128 -4.718 0.287 6.479 922 HG13 ILE 128 1HG1 ILE 128 -5.163 -0.400 4.924 923 HG21 ILE 128 1HG2 ILE 128 -3.088 3.329 5.051 924 HG22 ILE 128 2HG2 ILE 128 -2.275 1.865 5.606 925 HG23 ILE 128 3HG2 ILE 128 -3.586 2.561 6.559 926 HD11 ILE 128 3HD1 ILE 128 -2.813 -0.866 4.459 927 HD12 ILE 128 1HD1 ILE 128 -3.337 -1.634 5.958 928 HD13 ILE 128 2HD1 ILE 128 -2.359 -0.164 6.009 929 H GLN 129 H GLN 129 -5.611 4.676 5.526 930 HA GLN 129 HA GLN 129 -5.497 5.727 2.822 931 HB2 GLN 129 2HB GLN 129 -7.342 6.528 4.281 932 HB3 GLN 129 1HB GLN 129 -6.151 7.151 5.413 933 HG2 GLN 129 2HG GLN 129 -5.342 8.717 3.762 934 HG3 GLN 129 1HG GLN 129 -6.427 8.040 2.552 935 HE21 GLN 129 1HE2 GLN 129 -7.477 9.972 2.201 936 HE22 GLN 129 2HE2 GLN 129 -8.540 10.670 3.361 937 H ILE 130 H ILE 130 -3.602 6.161 2.148 938 HA ILE 130 HA ILE 130 -1.453 6.600 4.048 939 HB ILE 130 HB ILE 130 0.057 6.423 2.014 940 HG12 ILE 130 2HG1 ILE 130 -2.481 5.423 0.669 941 HG13 ILE 130 1HG1 ILE 130 -1.659 6.928 0.290 942 HG21 ILE 130 1HG2 ILE 130 -1.672 4.059 2.723 943 HG22 ILE 130 2HG2 ILE 130 -0.193 4.575 3.539 944 HG23 ILE 130 3HG2 ILE 130 -0.124 3.966 1.885 945 HD11 ILE 130 3HD1 ILE 130 -1.181 5.192 -1.347 946 HD12 ILE 130 1HD1 ILE 130 -0.532 4.159 -0.074 947 HD13 ILE 130 2HD1 ILE 130 0.284 5.670 -0.487 948 H GLY 131 H GLY 131 -1.515 8.531 4.750 949 HA2 GLY 131 2HA GLY 131 -1.140 10.772 4.771 950 HA3 GLY 131 1HA GLY 131 -0.856 10.718 3.029 951 H LYS 132 H LYS 132 -2.626 10.666 1.672 952 HA LYS 132 HA LYS 132 -5.224 11.397 2.833 953 HB2 LYS 132 2HB LYS 132 -4.009 13.458 2.063 954 HB3 LYS 132 1HB LYS 132 -3.983 12.790 0.446 955 HG2 LYS 132 2HG LYS 132 -5.760 14.392 0.571 956 HG3 LYS 132 1HG LYS 132 -6.469 12.784 0.443 957 HD2 LYS 132 2HD LYS 132 -7.719 13.998 2.087 958 HD3 LYS 132 1HD LYS 132 -6.761 12.793 2.934 959 HE2 LYS 132 2HE LYS 132 -6.655 14.875 4.146 960 HE3 LYS 132 1HE LYS 132 -5.075 14.549 3.443 961 HZ1 LYS 132 3HZ LYS 132 -7.103 16.473 2.415 962 HZ2 LYS 132 1HZ LYS 132 -5.666 16.113 1.623 963 HZ3 LYS 132 2HZ LYS 132 -5.626 16.847 3.118 964 H PHE 133 H PHE 133 -3.463 9.390 0.768 965 HA PHE 133 HA PHE 133 -5.611 9.167 -1.173 966 HB2 PHE 133 2HB PHE 133 -2.741 8.275 -1.279 967 HB3 PHE 133 1HB PHE 133 -3.939 7.949 -2.537 968 HD1 PHE 133 2HD PHE 133 -5.142 9.900 -3.588 969 HD2 PHE 133 1HD PHE 133 -1.630 10.366 -1.235 970 HE1 PHE 133 2HE PHE 133 -4.817 12.131 -4.537 971 HE2 PHE 133 1HE PHE 133 -1.308 12.617 -2.178 972 HZ PHE 133 HZ PHE 133 -2.893 13.501 -3.831 973 H ARG 134 H ARG 134 -6.096 7.028 -2.045 974 HA ARG 134 HA ARG 134 -6.954 5.550 0.350 975 HB2 ARG 134 2HB ARG 134 -8.609 6.711 -1.105 976 HB3 ARG 134 1HB ARG 134 -8.142 5.661 -2.421 977 HG2 ARG 134 2HG ARG 134 -9.057 3.755 -1.318 978 HG3 ARG 134 1HG ARG 134 -9.335 4.678 0.163 979 HD2 ARG 134 2HD ARG 134 -10.858 6.175 -1.153 980 HD3 ARG 134 1HD ARG 134 -10.681 5.073 -2.513 981 HE ARG 134 HE ARG 134 -11.492 3.397 -0.639 982 HH11 ARG 134 1HH1 ARG 134 -12.754 6.639 -1.259 983 HH12 ARG 134 2HH1 ARG 134 -14.351 6.250 -0.812 984 HH21 ARG 134 1HH2 ARG 134 -13.643 2.867 -0.059 985 HH22 ARG 134 2HH2 ARG 134 -14.881 4.038 -0.120 986 H LEU 135 H LEU 135 -6.071 3.633 0.721 987 HA LEU 135 HA LEU 135 -5.142 1.966 -1.497 988 HB2 LEU 135 2HB LEU 135 -3.250 3.002 -0.328 989 HB3 LEU 135 1HB LEU 135 -3.872 2.483 1.209 990 HG LEU 135 HG LEU 135 -2.931 0.477 -0.862 991 HD11 LEU 135 1HD1 LEU 135 -1.112 2.058 -0.439 992 HD12 LEU 135 2HD1 LEU 135 -0.773 0.504 0.319 993 HD13 LEU 135 3HD1 LEU 135 -1.330 1.859 1.298 994 HD21 LEU 135 3HD2 LEU 135 -2.563 -0.927 1.125 995 HD22 LEU 135 1HD2 LEU 135 -4.243 -0.392 1.048 996 HD23 LEU 135 2HD2 LEU 135 -3.109 0.383 2.159 997 H VAL 136 H VAL 136 -6.016 -0.017 -1.500 998 HA VAL 136 HA VAL 136 -7.473 -0.902 0.899 999 HB VAL 136 HB VAL 136 -7.746 -1.929 -1.946 1000 HG11 VAL 136 1HG1 VAL 136 -8.417 -3.544 -0.254 1001 HG12 VAL 136 2HG1 VAL 136 -9.817 -2.967 -1.159 1002 HG13 VAL 136 3HG1 VAL 136 -9.506 -2.360 0.466 1003 HG21 VAL 136 3HG2 VAL 136 -8.476 0.396 -1.857 1004 HG22 VAL 136 1HG2 VAL 136 -9.533 0.025 -0.494 1005 HG23 VAL 136 2HG2 VAL 136 -9.855 -0.684 -2.078 1006 H PHE 137 H PHE 137 -6.662 -2.675 1.940 1007 HA PHE 137 HA PHE 137 -4.380 -3.986 0.653 1008 HB2 PHE 137 2HB PHE 137 -3.880 -2.939 2.825 1009 HB3 PHE 137 1HB PHE 137 -5.143 -3.900 3.587 1010 HD1 PHE 137 1HD PHE 137 -1.957 -4.200 1.708 1011 HD2 PHE 137 2HD PHE 137 -4.635 -5.992 4.481 1012 HE1 PHE 137 1HE PHE 137 -0.321 -5.979 2.129 1013 HE2 PHE 137 2HE PHE 137 -3.000 -7.780 4.910 1014 HZ PHE 137 HZ PHE 137 -0.842 -7.774 3.736 1015 H LEU 138 H LEU 138 -4.540 -6.032 0.018 1016 HA LEU 138 HA LEU 138 -6.680 -7.681 1.114 1017 HB2 LEU 138 2HB LEU 138 -6.236 -7.104 -1.808 1018 HB3 LEU 138 1HB LEU 138 -7.221 -8.427 -1.218 1019 HG LEU 138 HG LEU 138 -7.777 -5.555 -0.552 1020 HD11 LEU 138 1HD1 LEU 138 -9.502 -5.620 -2.290 1021 HD12 LEU 138 2HD1 LEU 138 -9.019 -7.256 -2.723 1022 HD13 LEU 138 3HD1 LEU 138 -7.913 -5.908 -3.003 1023 HD21 LEU 138 3HD2 LEU 138 -10.013 -6.419 -0.027 1024 HD22 LEU 138 1HD2 LEU 138 -8.764 -7.177 0.961 1025 HD23 LEU 138 2HD2 LEU 138 -9.461 -8.050 -0.402 1026 H ALA 139 H ALA 139 -6.143 -9.719 1.336 1027 HA ALA 139 HA ALA 139 -3.484 -10.561 0.625 1028 HB1 ALA 139 1HB ALA 139 -4.476 -11.331 2.745 1029 HB2 ALA 139 2HB ALA 139 -4.088 -12.696 1.699 1030 HB3 ALA 139 3HB ALA 139 -5.759 -12.146 1.849 1031 H GLY 140 H GLY 140 -3.453 -10.465 -1.559 1032 HA2 GLY 140 2HA GLY 140 -5.371 -11.592 -3.278 1033 HA3 GLY 140 1HA GLY 140 -3.725 -11.191 -3.730 1034 HA PRO 141 HA PRO 141 -2.976 -15.535 -3.719 1035 HB2 PRO 141 2HB PRO 141 -0.234 -15.352 -3.038 1036 HB3 PRO 141 1HB PRO 141 -0.958 -15.573 -4.632 1037 HG2 PRO 141 2HG PRO 141 0.419 -13.279 -3.842 1038 HG3 PRO 141 1HG PRO 141 -0.769 -13.333 -5.158 1039 HD2 PRO 141 2HD PRO 141 -1.111 -12.425 -2.332 1040 HD3 PRO 141 1HD PRO 141 -1.806 -11.759 -3.825 1041 H ALA 142 H ALA 142 -3.560 -16.801 -2.233 1042 HA ALA 142 HA ALA 142 -2.666 -16.454 0.525 1043 HB1 ALA 142 1HB ALA 142 -5.052 -16.870 0.167 1044 HB2 ALA 142 2HB ALA 142 -4.320 -18.194 1.072 1045 HB3 ALA 142 3HB ALA 142 -4.676 -18.388 -0.647 1046 H GLU 143 H GLU 143 -0.731 -17.249 0.827 1047 HA GLU 143 HA GLU 143 -0.082 -19.945 0.058 1048 HB2 GLU 143 2HB GLU 143 0.413 -18.561 -1.926 1049 HB3 GLU 143 1HB GLU 143 1.406 -17.510 -0.937 1050 HG2 GLU 143 2HG GLU 143 2.944 -19.367 -0.537 1051 HG3 GLU 143 1HG GLU 143 1.941 -20.399 -1.562 Start of MODEL 9 1 H1 MET 1 1HT MET 1 -47.048 -26.477 -12.895 2 H2 MET 1 2HT MET 1 -47.353 -25.390 -11.677 3 H3 MET 1 3HT MET 1 -47.997 -26.943 -11.568 4 HA MET 1 HA MET 1 -46.088 -26.659 -10.106 5 HB2 MET 1 2HB MET 1 -45.343 -28.254 -12.573 6 HB3 MET 1 1HB MET 1 -44.567 -28.383 -11.008 7 HG2 MET 1 2HG MET 1 -46.657 -29.206 -10.046 8 HG3 MET 1 1HG MET 1 -47.423 -29.086 -11.630 9 HE1 MET 1 2HE MET 1 -47.077 -32.943 -11.181 10 HE2 MET 1 3HE MET 1 -48.173 -31.606 -11.521 11 HE3 MET 1 1HE MET 1 -47.444 -31.762 -9.924 12 H SER 2 H SER 2 -43.955 -25.946 -9.845 13 HA SER 2 HA SER 2 -43.226 -23.831 -11.617 14 HB2 SER 2 2HB SER 2 -42.857 -23.682 -9.179 15 HB3 SER 2 1HB SER 2 -41.742 -25.041 -9.267 16 HG SER 2 HG SER 2 -41.160 -22.953 -10.987 17 H ASP 3 H ASP 3 -42.179 -27.082 -10.922 18 HA ASP 3 HA ASP 3 -40.442 -28.299 -11.589 19 HB2 ASP 3 2HB ASP 3 -40.684 -29.132 -13.949 20 HB3 ASP 3 1HB ASP 3 -42.157 -29.167 -13.005 21 H ASN 4 H ASN 4 -38.822 -27.136 -10.948 22 HA ASN 4 HA ASN 4 -37.521 -25.304 -12.700 23 HB2 ASN 4 2HB ASN 4 -37.498 -25.021 -10.236 24 HB3 ASN 4 1HB ASN 4 -36.527 -26.482 -10.099 25 HD21 ASN 4 1HD2 ASN 4 -36.572 -23.159 -11.062 26 HD22 ASN 4 2HD2 ASN 4 -34.876 -22.946 -11.198 27 H ASN 5 H ASN 5 -36.940 -26.309 -14.464 28 HA ASN 5 HA ASN 5 -35.072 -28.541 -14.274 29 HB2 ASN 5 2HB ASN 5 -35.423 -28.774 -16.731 30 HB3 ASN 5 1HB ASN 5 -36.915 -28.926 -15.812 31 HD21 ASN 5 1HD2 ASN 5 -35.166 -27.015 -18.119 32 HD22 ASN 5 2HD2 ASN 5 -36.471 -25.958 -18.511 33 H GLY 6 H GLY 6 -32.970 -28.343 -14.880 34 HA2 GLY 6 2HA GLY 6 -31.787 -26.665 -16.609 35 HA3 GLY 6 1HA GLY 6 -31.971 -25.676 -15.170 36 H THR 7 H THR 7 -29.661 -27.030 -16.637 37 HA THR 7 HA THR 7 -28.571 -28.392 -14.321 38 HB THR 7 HB THR 7 -28.460 -29.795 -16.296 39 HG1 THR 7 1HG THR 7 -25.989 -28.708 -15.483 40 HG21 THR 7 3HG2 THR 7 -26.959 -27.541 -17.645 41 HG22 THR 7 1HG2 THR 7 -28.581 -28.098 -18.053 42 HG23 THR 7 2HG2 THR 7 -27.195 -29.153 -18.322 43 HA PRO 8 HA PRO 8 -26.051 -24.729 -13.688 44 HB2 PRO 8 2HB PRO 8 -24.285 -26.540 -12.162 45 HB3 PRO 8 1HB PRO 8 -25.145 -25.098 -11.607 46 HG2 PRO 8 2HG PRO 8 -25.913 -27.544 -10.844 47 HG3 PRO 8 1HG PRO 8 -27.096 -26.266 -11.183 48 HD2 PRO 8 2HD PRO 8 -26.250 -28.566 -12.908 49 HD3 PRO 8 1HD PRO 8 -27.874 -27.914 -12.592 50 H GLU 9 H GLU 9 -24.462 -23.964 -14.946 51 HA GLU 9 HA GLU 9 -23.024 -25.773 -16.625 52 HB2 GLU 9 2HB GLU 9 -22.164 -23.716 -17.693 53 HB3 GLU 9 1HB GLU 9 -23.916 -23.756 -17.591 54 HG2 GLU 9 2HG GLU 9 -23.734 -22.305 -15.562 55 HG3 GLU 9 1HG GLU 9 -22.017 -22.156 -15.915 56 HA PRO 10 HA PRO 10 -19.300 -26.077 -14.230 57 HB2 PRO 10 2HB PRO 10 -17.780 -25.877 -16.761 58 HB3 PRO 10 1HB PRO 10 -17.822 -27.195 -15.589 59 HG2 PRO 10 2HG PRO 10 -19.009 -27.413 -17.985 60 HG3 PRO 10 1HG PRO 10 -19.699 -28.159 -16.537 61 HD2 PRO 10 2HD PRO 10 -20.520 -25.668 -17.959 62 HD3 PRO 10 1HD PRO 10 -21.512 -26.918 -17.178 63 H GLN 11 H GLN 11 -17.903 -24.640 -13.308 64 HA GLN 11 HA GLN 11 -17.989 -21.929 -14.260 65 HB2 GLN 11 2HB GLN 11 -18.234 -22.470 -11.834 66 HB3 GLN 11 1HB GLN 11 -16.599 -23.108 -11.841 67 HG2 GLN 11 2HG GLN 11 -15.780 -20.855 -12.515 68 HG3 GLN 11 1HG GLN 11 -17.427 -20.256 -12.331 69 HE21 GLN 11 1HE2 GLN 11 -18.310 -20.122 -10.259 70 HE22 GLN 11 2HE2 GLN 11 -17.307 -20.142 -8.854 71 H VAL 12 H VAL 12 -16.248 -20.919 -15.185 72 HA VAL 12 HA VAL 12 -14.138 -22.576 -16.066 73 HB VAL 12 HB VAL 12 -13.249 -20.546 -17.204 74 HG11 VAL 12 1HG1 VAL 12 -16.180 -21.095 -17.651 75 HG12 VAL 12 2HG1 VAL 12 -14.837 -22.010 -18.329 76 HG13 VAL 12 3HG1 VAL 12 -15.097 -20.333 -18.816 77 HG21 VAL 12 3HG2 VAL 12 -15.693 -19.165 -16.069 78 HG22 VAL 12 1HG2 VAL 12 -14.608 -18.495 -17.287 79 HG23 VAL 12 2HG2 VAL 12 -14.019 -18.809 -15.653 80 H GLU 13 H GLU 13 -13.133 -23.292 -14.321 81 HA GLU 13 HA GLU 13 -11.848 -21.434 -12.490 82 HB2 GLU 13 2HB GLU 13 -13.031 -23.394 -11.583 83 HB3 GLU 13 1HB GLU 13 -11.986 -24.458 -12.506 84 HG2 GLU 13 2HG GLU 13 -10.055 -23.609 -11.217 85 HG3 GLU 13 1HG GLU 13 -11.169 -22.646 -10.249 86 H THR 14 H THR 14 -9.675 -21.141 -12.457 87 HA THR 14 HA THR 14 -8.261 -21.857 -14.791 88 HB THR 14 HB THR 14 -6.322 -20.765 -13.484 89 HG1 THR 14 1HG THR 14 -8.280 -19.606 -11.850 90 HG21 THR 14 3HG2 THR 14 -8.852 -19.189 -14.005 91 HG22 THR 14 1HG2 THR 14 -7.618 -19.581 -15.202 92 HG23 THR 14 2HG2 THR 14 -7.237 -18.505 -13.858 93 H THR 15 H THR 15 -6.982 -23.579 -15.162 94 HA THR 15 HA THR 15 -6.589 -25.553 -13.126 95 HB THR 15 HB THR 15 -6.924 -26.120 -15.609 96 HG1 THR 15 1HG THR 15 -5.881 -27.521 -13.986 97 HG21 THR 15 3HG2 THR 15 -5.398 -24.394 -16.525 98 HG22 THR 15 1HG2 THR 15 -4.985 -26.017 -17.091 99 HG23 THR 15 2HG2 THR 15 -4.036 -25.255 -15.816 100 H SER 16 H SER 16 -5.181 -22.786 -13.956 101 HA SER 16 HA SER 16 -2.473 -23.251 -13.228 102 HB2 SER 16 2HB SER 16 -4.052 -20.671 -13.250 103 HB3 SER 16 1HB SER 16 -2.303 -20.849 -13.406 104 HG SER 16 HG SER 16 -2.573 -21.806 -15.368 105 H VAL 17 H VAL 17 -2.336 -24.092 -11.207 106 HA VAL 17 HA VAL 17 -4.032 -23.110 -9.140 107 HB VAL 17 HB VAL 17 -2.797 -24.801 -7.659 108 HG11 VAL 17 1HG1 VAL 17 -4.233 -25.795 -10.126 109 HG12 VAL 17 2HG1 VAL 17 -4.996 -25.243 -8.635 110 HG13 VAL 17 3HG1 VAL 17 -4.014 -26.705 -8.633 111 HG21 VAL 17 3HG2 VAL 17 -1.748 -25.737 -10.341 112 HG22 VAL 17 1HG2 VAL 17 -1.554 -26.572 -8.801 113 HG23 VAL 17 2HG2 VAL 17 -0.766 -25.013 -9.072 114 H PHE 18 H PHE 18 -3.553 -21.151 -8.759 115 HA PHE 18 HA PHE 18 -0.858 -20.271 -8.213 116 HB2 PHE 18 2HB PHE 18 -2.519 -18.845 -9.410 117 HB3 PHE 18 1HB PHE 18 -3.527 -18.854 -7.974 118 HD1 PHE 18 2HD PHE 18 0.036 -18.130 -8.821 119 HD2 PHE 18 1HD PHE 18 -3.477 -16.919 -6.754 120 HE1 PHE 18 2HE PHE 18 1.189 -16.104 -8.063 121 HE2 PHE 18 1HE PHE 18 -2.326 -14.889 -5.993 122 HZ PHE 18 HZ PHE 18 0.012 -14.480 -6.648 123 H ARG 19 H ARG 19 -0.001 -20.590 -6.278 124 HA ARG 19 HA ARG 19 -1.413 -21.851 -4.224 125 HB2 ARG 19 2HB ARG 19 1.241 -20.445 -4.098 126 HB3 ARG 19 1HB ARG 19 0.559 -21.357 -2.783 127 HG2 ARG 19 2HG ARG 19 0.556 -23.382 -4.235 128 HG3 ARG 19 1HG ARG 19 1.403 -22.431 -5.462 129 HD2 ARG 19 2HD ARG 19 3.224 -22.004 -3.880 130 HD3 ARG 19 1HD ARG 19 2.384 -22.928 -2.646 131 HE ARG 19 HE ARG 19 2.712 -24.544 -4.876 132 HH11 ARG 19 1HH1 ARG 19 4.731 -23.008 -2.330 133 HH12 ARG 19 2HH1 ARG 19 5.974 -24.148 -2.455 134 HH21 ARG 19 1HH2 ARG 19 4.449 -26.150 -4.966 135 HH22 ARG 19 2HH2 ARG 19 5.811 -25.981 -3.958 136 H ALA 20 H ALA 20 -3.037 -20.960 -3.307 137 HA ALA 20 HA ALA 20 -2.588 -18.453 -1.899 138 HB1 ALA 20 1HB ALA 20 -4.957 -17.876 -2.215 139 HB2 ALA 20 2HB ALA 20 -5.188 -19.339 -3.171 140 HB3 ALA 20 3HB ALA 20 -4.139 -18.052 -3.770 141 H ASP 21 H ASP 21 -1.793 -20.155 -0.447 142 HA ASP 21 HA ASP 21 -3.557 -21.879 0.916 143 HB2 ASP 21 2HB ASP 21 -1.155 -22.189 1.173 144 HB3 ASP 21 1HB ASP 21 -0.979 -20.593 1.881 145 H LEU 22 H LEU 22 -2.586 -18.584 1.467 146 HA LEU 22 HA LEU 22 -3.319 -16.905 2.729 147 HB2 LEU 22 2HB LEU 22 -5.232 -17.041 1.260 148 HB3 LEU 22 1HB LEU 22 -5.966 -18.272 2.261 149 HG LEU 22 HG LEU 22 -6.323 -16.630 4.050 150 HD11 LEU 22 1HD1 LEU 22 -4.402 -15.173 3.645 151 HD12 LEU 22 2HD1 LEU 22 -5.905 -14.256 3.681 152 HD13 LEU 22 3HD1 LEU 22 -5.133 -14.616 2.140 153 HD21 LEU 22 3HD2 LEU 22 -8.063 -16.935 2.383 154 HD22 LEU 22 1HD2 LEU 22 -7.304 -15.722 1.351 155 HD23 LEU 22 2HD2 LEU 22 -7.994 -15.249 2.900 156 H LEU 23 H LEU 23 -2.339 -17.106 4.605 157 HA LEU 23 HA LEU 23 -3.465 -18.848 6.589 158 HB2 LEU 23 2HB LEU 23 -1.607 -18.138 8.045 159 HB3 LEU 23 1HB LEU 23 -1.047 -18.749 6.512 160 HG LEU 23 HG LEU 23 -0.865 -16.207 5.881 161 HD11 LEU 23 1HD1 LEU 23 -0.277 -14.761 7.749 162 HD12 LEU 23 2HD1 LEU 23 -0.731 -16.035 8.881 163 HD13 LEU 23 3HD1 LEU 23 -1.956 -15.299 7.845 164 HD21 LEU 23 3HD2 LEU 23 1.050 -17.553 7.771 165 HD22 LEU 23 1HD2 LEU 23 1.424 -16.175 6.736 166 HD23 LEU 23 2HD2 LEU 23 1.010 -17.729 6.016 167 H LYS 24 H LYS 24 -4.842 -18.350 8.109 168 HA LYS 24 HA LYS 24 -5.162 -15.537 8.602 169 HB2 LYS 24 2HB LYS 24 -7.615 -15.777 9.016 170 HB3 LYS 24 1HB LYS 24 -7.167 -16.087 7.358 171 HG2 LYS 24 2HG LYS 24 -7.703 -18.282 9.356 172 HG3 LYS 24 1HG LYS 24 -8.959 -17.561 8.360 173 HD2 LYS 24 2HD LYS 24 -7.738 -18.263 6.346 174 HD3 LYS 24 1HD LYS 24 -6.503 -19.008 7.356 175 HE2 LYS 24 2HE LYS 24 -8.079 -20.703 6.583 176 HE3 LYS 24 1HE LYS 24 -8.224 -20.493 8.325 177 HZ1 LYS 24 3HZ LYS 24 -10.041 -19.368 6.265 178 HZ2 LYS 24 1HZ LYS 24 -10.206 -19.128 7.929 179 HZ3 LYS 24 2HZ LYS 24 -10.363 -20.655 7.275 180 H GLU 25 H GLU 25 -3.508 -16.178 9.968 181 HA GLU 25 HA GLU 25 -4.086 -17.622 12.371 182 HB2 GLU 25 2HB GLU 25 -1.784 -17.259 11.239 183 HB3 GLU 25 1HB GLU 25 -1.854 -15.633 11.888 184 HG2 GLU 25 2HG GLU 25 -0.511 -16.961 13.346 185 HG3 GLU 25 1HG GLU 25 -2.030 -16.610 14.169 186 H MET 26 H MET 26 -5.298 -16.763 13.931 187 HA MET 26 HA MET 26 -6.222 -14.088 13.882 188 HB2 MET 26 2HB MET 26 -7.523 -15.942 14.850 189 HB3 MET 26 1HB MET 26 -6.325 -16.122 16.120 190 HG2 MET 26 2HG MET 26 -6.864 -13.873 16.943 191 HG3 MET 26 1HG MET 26 -8.076 -13.709 15.676 192 HE1 MET 26 3HE MET 26 -10.725 -16.417 16.690 193 HE2 MET 26 1HE MET 26 -9.365 -16.646 15.590 194 HE3 MET 26 2HE MET 26 -10.298 -15.151 15.541 195 H GLU 27 H GLU 27 -5.420 -12.312 14.751 196 HA GLU 27 HA GLU 27 -2.881 -11.877 15.475 197 HB2 GLU 27 2HB GLU 27 -5.245 -10.325 16.559 198 HB3 GLU 27 1HB GLU 27 -3.589 -9.761 16.544 199 HG2 GLU 27 2HG GLU 27 -4.606 -8.651 14.756 200 HG3 GLU 27 1HG GLU 27 -3.725 -9.967 13.993 201 H SER 28 H SER 28 -1.900 -13.249 16.871 202 HA SER 28 HA SER 28 -2.712 -13.043 19.671 203 HB2 SER 28 2HB SER 28 -1.298 -15.375 18.338 204 HB3 SER 28 1HB SER 28 -1.923 -15.317 19.987 205 HG SER 28 HG SER 28 -3.429 -15.174 17.586 206 H SER 29 H SER 29 -1.361 -11.077 19.348 207 HA SER 29 HA SER 29 1.419 -11.667 19.824 208 HB2 SER 29 2HB SER 29 1.228 -11.342 17.396 209 HB3 SER 29 1HB SER 29 0.400 -9.812 17.666 210 HG SER 29 HG SER 29 2.454 -9.351 17.243 211 H THR 30 H THR 30 2.301 -10.196 21.186 212 HA THR 30 HA THR 30 0.643 -7.896 21.929 213 HB THR 30 HB THR 30 2.462 -9.412 23.832 214 HG1 THR 30 1HG THR 30 0.031 -10.071 22.761 215 HG21 THR 30 3HG2 THR 30 0.037 -7.643 24.276 216 HG22 THR 30 1HG2 THR 30 1.713 -7.144 24.498 217 HG23 THR 30 2HG2 THR 30 1.021 -8.390 25.536 218 H GLY 31 H GLY 31 3.001 -8.523 20.075 219 HA2 GLY 31 2HA GLY 31 4.785 -7.334 19.275 220 HA3 GLY 31 1HA GLY 31 4.439 -6.106 20.487 221 H THR 32 H THR 32 5.447 -9.512 20.606 222 HA THR 32 HA THR 32 7.329 -8.763 22.658 223 HB THR 32 HB THR 32 7.726 -11.226 22.879 224 HG1 THR 32 1HG THR 32 5.488 -11.562 21.173 225 HG21 THR 32 3HG2 THR 32 6.069 -10.150 24.289 226 HG22 THR 32 1HG2 THR 32 5.529 -11.770 23.853 227 HG23 THR 32 2HG2 THR 32 4.839 -10.360 23.043 228 H ALA 33 H ALA 33 9.587 -9.364 22.486 229 HA ALA 33 HA ALA 33 10.644 -8.810 19.894 230 HB1 ALA 33 1HB ALA 33 12.044 -9.669 22.429 231 HB2 ALA 33 2HB ALA 33 11.757 -8.008 21.915 232 HB3 ALA 33 3HB ALA 33 12.838 -9.046 20.983 233 HA PRO 34 HA PRO 34 10.517 -13.196 18.965 234 HB2 PRO 34 2HB PRO 34 11.095 -12.663 16.232 235 HB3 PRO 34 1HB PRO 34 9.548 -13.086 16.970 236 HG2 PRO 34 2HG PRO 34 10.150 -10.617 15.836 237 HG3 PRO 34 1HG PRO 34 8.845 -10.916 16.993 238 HD2 PRO 34 2HD PRO 34 11.564 -9.768 17.459 239 HD3 PRO 34 1HD PRO 34 9.997 -9.370 18.208 240 H ALA 35 H ALA 35 12.241 -14.084 19.754 241 HA ALA 35 HA ALA 35 14.842 -13.751 18.492 242 HB1 ALA 35 1HB ALA 35 15.618 -15.352 20.207 243 HB2 ALA 35 2HB ALA 35 13.958 -15.543 20.772 244 HB3 ALA 35 3HB ALA 35 14.775 -13.989 20.938 245 H SER 36 H SER 36 12.081 -15.791 18.589 246 HA SER 36 HA SER 36 13.174 -17.974 17.178 247 HB2 SER 36 2HB SER 36 10.324 -17.057 17.527 248 HB3 SER 36 1HB SER 36 10.811 -18.647 16.936 249 HG SER 36 HG SER 36 12.123 -18.446 19.086 250 H THR 37 H THR 37 12.494 -18.517 14.919 251 HA THR 37 HA THR 37 11.787 -16.234 13.312 252 HB THR 37 HB THR 37 14.274 -16.233 13.393 253 HG1 THR 37 1HG THR 37 12.922 -15.852 11.355 254 HG21 THR 37 3HG2 THR 37 14.637 -18.649 13.766 255 HG22 THR 37 1HG2 THR 37 15.559 -18.064 12.380 256 HG23 THR 37 2HG2 THR 37 14.074 -18.975 12.130 257 H GLY 38 H GLY 38 10.967 -16.838 11.296 258 HA2 GLY 38 2HA GLY 38 10.699 -19.661 10.695 259 HA3 GLY 38 1HA GLY 38 9.210 -18.804 11.071 260 H ALA 39 H ALA 39 11.588 -16.875 9.562 261 HA ALA 39 HA ALA 39 10.016 -16.198 7.379 262 HB1 ALA 39 1HB ALA 39 13.023 -16.045 7.514 263 HB2 ALA 39 2HB ALA 39 11.918 -14.859 8.202 264 HB3 ALA 39 3HB ALA 39 11.974 -15.104 6.455 265 H GLU 40 H GLU 40 12.546 -18.619 7.550 266 HA GLU 40 HA GLU 40 12.223 -19.367 4.779 267 HB2 GLU 40 2HB GLU 40 13.862 -21.150 5.360 268 HB3 GLU 40 1HB GLU 40 14.414 -19.520 5.721 269 HG2 GLU 40 2HG GLU 40 13.803 -19.860 8.084 270 HG3 GLU 40 1HG GLU 40 13.307 -21.498 7.693 271 H ASN 41 H ASN 41 10.853 -20.242 7.768 272 HA ASN 41 HA ASN 41 10.089 -22.909 6.969 273 HB2 ASN 41 2HB ASN 41 9.397 -21.372 9.475 274 HB3 ASN 41 1HB ASN 41 9.032 -23.071 9.191 275 HD21 ASN 41 1HD2 ASN 41 10.761 -24.565 9.125 276 HD22 ASN 41 2HD2 ASN 41 12.287 -24.184 9.826 277 H LEU 42 H LEU 42 8.584 -19.824 7.442 278 HA LEU 42 HA LEU 42 5.944 -20.758 6.815 279 HB2 LEU 42 2HB LEU 42 6.695 -18.850 8.420 280 HB3 LEU 42 1HB LEU 42 7.027 -17.926 6.987 281 HG LEU 42 HG LEU 42 4.953 -17.255 8.082 282 HD11 LEU 42 1HD1 LEU 42 5.058 -16.872 5.732 283 HD12 LEU 42 2HD1 LEU 42 3.412 -17.300 6.205 284 HD13 LEU 42 3HD1 LEU 42 4.438 -18.488 5.405 285 HD21 LEU 42 3HD2 LEU 42 3.985 -20.052 7.524 286 HD22 LEU 42 1HD2 LEU 42 2.985 -18.719 8.099 287 HD23 LEU 42 2HD2 LEU 42 4.297 -19.328 9.099 288 HA PRO 43 HA PRO 43 6.781 -20.429 2.353 289 HB2 PRO 43 2HB PRO 43 4.165 -20.019 1.561 290 HB3 PRO 43 1HB PRO 43 4.864 -21.608 1.893 291 HG2 PRO 43 2HG PRO 43 3.215 -19.853 3.678 292 HG3 PRO 43 1HG PRO 43 3.092 -21.602 3.417 293 HD2 PRO 43 2HD PRO 43 4.272 -20.651 5.581 294 HD3 PRO 43 1HD PRO 43 4.962 -22.051 4.733 295 H ALA 44 H ALA 44 5.821 -18.843 0.505 296 HA ALA 44 HA ALA 44 6.485 -16.226 1.485 297 HB1 ALA 44 1HB ALA 44 5.743 -17.102 -1.301 298 HB2 ALA 44 2HB ALA 44 7.387 -16.994 -0.671 299 HB3 ALA 44 3HB ALA 44 6.412 -15.535 -0.848 300 H GLY 45 H GLY 45 4.893 -15.733 2.793 301 HA2 GLY 45 2HA GLY 45 2.136 -15.729 1.968 302 HA3 GLY 45 1HA GLY 45 2.774 -15.154 3.511 303 H SER 46 H SER 46 2.875 -14.480 0.170 304 HA SER 46 HA SER 46 3.365 -11.684 0.674 305 HB2 SER 46 2HB SER 46 3.367 -11.654 -1.909 306 HB3 SER 46 1HB SER 46 4.704 -12.409 -1.049 307 HG SER 46 HG SER 46 2.557 -14.092 -1.637 308 H ALA 47 H ALA 47 2.140 -10.043 -0.255 309 HA ALA 47 HA ALA 47 -0.675 -10.727 -0.624 310 HB1 ALA 47 1HB ALA 47 -0.351 -10.157 1.710 311 HB2 ALA 47 2HB ALA 47 -1.290 -8.909 0.887 312 HB3 ALA 47 3HB ALA 47 0.419 -8.641 1.245 313 H LEU 48 H LEU 48 -1.881 -8.715 -1.353 314 HA LEU 48 HA LEU 48 -0.149 -7.150 -3.079 315 HB2 LEU 48 2HB LEU 48 -1.626 -7.360 -4.984 316 HB3 LEU 48 1HB LEU 48 -1.059 -8.934 -4.487 317 HG LEU 48 HG LEU 48 -3.826 -7.871 -3.846 318 HD11 LEU 48 1HD1 LEU 48 -3.523 -8.029 -6.258 319 HD12 LEU 48 2HD1 LEU 48 -4.605 -9.295 -5.678 320 HD13 LEU 48 3HD1 LEU 48 -2.934 -9.682 -6.088 321 HD21 LEU 48 3HD2 LEU 48 -2.684 -10.677 -3.780 322 HD22 LEU 48 1HD2 LEU 48 -4.361 -10.240 -3.447 323 HD23 LEU 48 2HD2 LEU 48 -3.080 -9.692 -2.372 324 H LEU 49 H LEU 49 -0.712 -5.125 -3.370 325 HA LEU 49 HA LEU 49 -3.209 -4.269 -2.172 326 HB2 LEU 49 2HB LEU 49 -2.007 -2.212 -1.344 327 HB3 LEU 49 1HB LEU 49 -1.701 -3.692 -0.470 328 HG LEU 49 HG LEU 49 0.465 -3.842 -1.822 329 HD11 LEU 49 1HD1 LEU 49 0.012 -2.263 -3.563 330 HD12 LEU 49 2HD1 LEU 49 1.409 -1.727 -2.626 331 HD13 LEU 49 3HD1 LEU 49 -0.161 -0.959 -2.394 332 HD21 LEU 49 3HD2 LEU 49 0.098 -1.624 0.188 333 HD22 LEU 49 1HD2 LEU 49 1.646 -2.319 -0.293 334 HD23 LEU 49 2HD2 LEU 49 0.446 -3.315 0.527 335 H VAL 50 H VAL 50 -4.128 -2.416 -3.039 336 HA VAL 50 HA VAL 50 -2.949 -1.628 -5.590 337 HB VAL 50 HB VAL 50 -5.149 -1.487 -6.652 338 HG11 VAL 50 1HG1 VAL 50 -4.730 -4.197 -5.436 339 HG12 VAL 50 2HG1 VAL 50 -3.971 -3.567 -6.898 340 HG13 VAL 50 3HG1 VAL 50 -5.713 -3.848 -6.861 341 HG21 VAL 50 3HG2 VAL 50 -6.276 -2.664 -4.119 342 HG22 VAL 50 1HG2 VAL 50 -7.171 -2.385 -5.613 343 HG23 VAL 50 2HG2 VAL 50 -6.527 -1.018 -4.700 344 H VAL 51 H VAL 51 -3.038 0.453 -6.081 345 HA VAL 51 HA VAL 51 -4.181 2.262 -4.048 346 HB VAL 51 HB VAL 51 -2.165 2.974 -6.220 347 HG11 VAL 51 1HG1 VAL 51 -3.497 4.853 -5.402 348 HG12 VAL 51 2HG1 VAL 51 -1.818 5.007 -4.894 349 HG13 VAL 51 3HG1 VAL 51 -3.040 4.466 -3.740 350 HG21 VAL 51 3HG2 VAL 51 -1.658 2.347 -3.311 351 HG22 VAL 51 1HG2 VAL 51 -0.461 3.001 -4.427 352 HG23 VAL 51 2HG2 VAL 51 -1.125 1.390 -4.690 353 H LYS 52 H LYS 52 -6.023 3.059 -4.556 354 HA LYS 52 HA LYS 52 -6.739 3.002 -7.379 355 HB2 LYS 52 2HB LYS 52 -8.530 3.027 -4.963 356 HB3 LYS 52 1HB LYS 52 -9.082 3.025 -6.633 357 HG2 LYS 52 2HG LYS 52 -7.842 0.873 -6.965 358 HG3 LYS 52 1HG LYS 52 -7.493 0.872 -5.240 359 HD2 LYS 52 2HD LYS 52 -9.367 -0.575 -5.667 360 HD3 LYS 52 1HD LYS 52 -9.944 0.851 -4.806 361 HE2 LYS 52 2HE LYS 52 -10.743 1.816 -6.895 362 HE3 LYS 52 1HE LYS 52 -10.084 0.451 -7.795 363 HZ1 LYS 52 3HZ LYS 52 -12.445 0.224 -7.447 364 HZ2 LYS 52 1HZ LYS 52 -12.245 0.322 -5.775 365 HZ3 LYS 52 2HZ LYS 52 -11.623 -0.992 -6.605 366 H ARG 53 H ARG 53 -6.296 5.138 -4.750 367 HA ARG 53 HA ARG 53 -6.926 7.332 -6.577 368 HB2 ARG 53 2HB ARG 53 -8.936 6.994 -5.183 369 HB3 ARG 53 1HB ARG 53 -7.959 7.212 -3.740 370 HG2 ARG 53 2HG ARG 53 -9.175 9.247 -4.202 371 HG3 ARG 53 1HG ARG 53 -7.453 9.526 -4.466 372 HD2 ARG 53 2HD ARG 53 -7.789 9.206 -6.889 373 HD3 ARG 53 1HD ARG 53 -9.505 8.939 -6.587 374 HE ARG 53 HE ARG 53 -8.650 11.459 -5.574 375 HH11 ARG 53 1HH1 ARG 53 -9.620 9.781 -8.541 376 HH12 ARG 53 2HH1 ARG 53 -10.036 11.203 -9.374 377 HH21 ARG 53 1HH2 ARG 53 -9.263 13.411 -6.721 378 HH22 ARG 53 2HH2 ARG 53 -9.826 13.306 -8.328 379 H GLY 54 H GLY 54 -5.024 8.393 -6.742 380 HA2 GLY 54 2HA GLY 54 -4.076 10.195 -5.146 381 HA3 GLY 54 1HA GLY 54 -3.515 8.779 -4.280 382 HA PRO 55 HA PRO 55 -0.716 10.280 -8.142 383 HB2 PRO 55 2HB PRO 55 0.585 11.804 -5.928 384 HB3 PRO 55 1HB PRO 55 0.460 12.202 -7.641 385 HG2 PRO 55 2HG PRO 55 -1.117 13.411 -5.902 386 HG3 PRO 55 1HG PRO 55 -1.757 12.872 -7.464 387 HD2 PRO 55 2HD PRO 55 -2.134 11.685 -4.751 388 HD3 PRO 55 1HD PRO 55 -3.270 11.802 -6.111 389 H ASN 56 H ASN 56 -0.478 8.789 -5.132 390 HA ASN 56 HA ASN 56 2.248 8.055 -4.862 391 HB2 ASN 56 2HB ASN 56 0.593 7.658 -3.076 392 HB3 ASN 56 1HB ASN 56 -0.252 6.511 -4.101 393 HD21 ASN 56 1HD2 ASN 56 -0.009 4.828 -2.621 394 HD22 ASN 56 2HD2 ASN 56 1.527 4.087 -2.333 395 H ALA 57 H ALA 57 -0.494 6.383 -6.457 396 HA ALA 57 HA ALA 57 1.018 5.327 -8.539 397 HB1 ALA 57 1HB ALA 57 1.015 2.946 -7.916 398 HB2 ALA 57 2HB ALA 57 0.379 3.358 -6.327 399 HB3 ALA 57 3HB ALA 57 1.997 3.885 -6.789 400 H GLY 58 H GLY 58 -0.364 3.332 -9.389 401 HA2 GLY 58 2HA GLY 58 -3.148 3.409 -8.752 402 HA3 GLY 58 1HA GLY 58 -2.754 4.178 -10.294 403 H ALA 59 H ALA 59 -1.634 1.290 -8.552 404 HA ALA 59 HA ALA 59 -2.441 -0.407 -10.695 405 HB1 ALA 59 1HB ALA 59 -0.270 0.428 -11.514 406 HB2 ALA 59 2HB ALA 59 -0.185 -1.279 -11.091 407 HB3 ALA 59 3HB ALA 59 0.485 -0.067 -9.999 408 H ARG 60 H ARG 60 -1.295 -2.638 -10.036 409 HA ARG 60 HA ARG 60 -1.824 -2.948 -7.177 410 HB2 ARG 60 2HB ARG 60 -2.576 -5.166 -7.551 411 HB3 ARG 60 1HB ARG 60 -3.328 -4.170 -8.781 412 HG2 ARG 60 2HG ARG 60 -0.980 -6.037 -9.207 413 HG3 ARG 60 1HG ARG 60 -2.649 -6.377 -9.628 414 HD2 ARG 60 2HD ARG 60 -2.554 -4.416 -11.201 415 HD3 ARG 60 1HD ARG 60 -0.833 -4.292 -10.837 416 HE ARG 60 HE ARG 60 -2.086 -6.675 -11.989 417 HH11 ARG 60 1HH1 ARG 60 0.641 -4.333 -11.977 418 HH12 ARG 60 2HH1 ARG 60 1.454 -5.123 -13.236 419 HH21 ARG 60 1HH2 ARG 60 -0.884 -7.708 -13.764 420 HH22 ARG 60 2HH2 ARG 60 0.606 -7.031 -14.237 421 H PHE 61 H PHE 61 -0.336 -3.937 -5.906 422 HA PHE 61 HA PHE 61 2.141 -4.771 -7.234 423 HB2 PHE 61 2HB PHE 61 1.934 -3.123 -4.701 424 HB3 PHE 61 1HB PHE 61 3.423 -3.759 -5.383 425 HD1 PHE 61 1HD PHE 61 4.312 -2.830 -7.489 426 HD2 PHE 61 2HD PHE 61 0.901 -1.158 -5.574 427 HE1 PHE 61 1HE PHE 61 4.566 -0.781 -8.830 428 HE2 PHE 61 2HE PHE 61 1.145 0.887 -6.909 429 HZ PHE 61 HZ PHE 61 2.981 1.080 -8.542 430 H LEU 62 H LEU 62 2.789 -6.701 -6.660 431 HA LEU 62 HA LEU 62 1.615 -8.006 -4.322 432 HB2 LEU 62 2HB LEU 62 1.578 -9.133 -6.580 433 HB3 LEU 62 1HB LEU 62 3.316 -9.112 -6.601 434 HG LEU 62 HG LEU 62 2.342 -11.341 -6.146 435 HD11 LEU 62 1HD1 LEU 62 3.975 -10.276 -3.866 436 HD12 LEU 62 2HD1 LEU 62 4.589 -10.936 -5.378 437 HD13 LEU 62 3HD1 LEU 62 3.727 -11.980 -4.247 438 HD21 LEU 62 3HD2 LEU 62 0.374 -10.684 -4.910 439 HD22 LEU 62 1HD2 LEU 62 1.376 -10.102 -3.580 440 HD23 LEU 62 2HD2 LEU 62 1.341 -11.820 -3.972 441 H LEU 63 H LEU 63 2.793 -7.896 -2.513 442 HA LEU 63 HA LEU 63 5.578 -7.075 -2.816 443 HB2 LEU 63 2HB LEU 63 3.755 -6.796 -0.438 444 HB3 LEU 63 1HB LEU 63 5.463 -6.451 -0.393 445 HG LEU 63 HG LEU 63 4.360 -4.386 -0.542 446 HD11 LEU 63 1HD1 LEU 63 5.380 -5.041 -3.285 447 HD12 LEU 63 2HD1 LEU 63 6.325 -4.488 -1.905 448 HD13 LEU 63 3HD1 LEU 63 5.120 -3.426 -2.630 449 HD21 LEU 63 3HD2 LEU 63 2.813 -5.452 -2.895 450 HD22 LEU 63 1HD2 LEU 63 2.747 -3.799 -2.285 451 HD23 LEU 63 2HD2 LEU 63 2.179 -5.135 -1.281 452 H ASP 64 H ASP 64 6.967 -8.591 -2.773 453 HA ASP 64 HA ASP 64 6.820 -10.577 -0.594 454 HB2 ASP 64 2HB ASP 64 8.351 -11.949 -1.820 455 HB3 ASP 64 1HB ASP 64 7.223 -11.356 -3.031 456 H GLN 65 H GLN 65 7.887 -7.701 -1.519 457 HA GLN 65 HA GLN 65 10.469 -7.328 -0.507 458 HB2 GLN 65 2HB GLN 65 9.436 -5.801 -2.067 459 HB3 GLN 65 1HB GLN 65 8.108 -5.495 -0.965 460 HG2 GLN 65 2HG GLN 65 9.575 -3.601 -1.038 461 HG3 GLN 65 1HG GLN 65 9.688 -4.363 0.545 462 HE21 GLN 65 1HE2 GLN 65 11.303 -3.737 -2.448 463 HE22 GLN 65 2HE2 GLN 65 12.880 -4.146 -1.905 464 HA PRO 66 HA PRO 66 9.111 -7.933 3.793 465 HB2 PRO 66 2HB PRO 66 11.563 -7.362 4.916 466 HB3 PRO 66 1HB PRO 66 11.090 -8.952 4.307 467 HG2 PRO 66 2HG PRO 66 12.719 -6.824 2.993 468 HG3 PRO 66 1HG PRO 66 12.962 -8.579 2.991 469 HD2 PRO 66 2HD PRO 66 11.907 -7.296 0.897 470 HD3 PRO 66 1HD PRO 66 11.352 -8.921 1.356 471 H THR 67 H THR 67 10.837 -5.105 2.597 472 HA THR 67 HA THR 67 9.356 -3.511 4.516 473 HB THR 67 HB THR 67 12.335 -3.285 4.040 474 HG1 THR 67 1HG THR 67 10.815 -4.690 5.696 475 HG21 THR 67 3HG2 THR 67 10.513 -1.667 5.849 476 HG22 THR 67 1HG2 THR 67 11.250 -1.073 4.363 477 HG23 THR 67 2HG2 THR 67 12.265 -1.505 5.736 478 H THR 68 H THR 68 8.116 -2.256 3.306 479 HA THR 68 HA THR 68 9.258 -1.018 0.898 480 HB THR 68 HB THR 68 6.336 -1.403 1.656 481 HG1 THR 68 1HG THR 68 7.182 -3.397 1.103 482 HG21 THR 68 3HG2 THR 68 5.881 -0.736 -0.675 483 HG22 THR 68 1HG2 THR 68 7.606 -0.466 -0.929 484 HG23 THR 68 2HG2 THR 68 6.712 0.547 0.202 485 H THR 69 H THR 69 9.915 1.060 1.343 486 HA THR 69 HA THR 69 8.660 2.463 3.529 487 HB THR 69 HB THR 69 10.534 4.136 2.967 488 HG1 THR 69 1HG THR 69 12.284 2.724 1.889 489 HG21 THR 69 3HG2 THR 69 10.637 2.610 4.884 490 HG22 THR 69 1HG2 THR 69 12.219 2.769 4.122 491 HG23 THR 69 2HG2 THR 69 11.247 1.326 3.836 492 H ALA 70 H ALA 70 7.549 4.357 3.301 493 HA ALA 70 HA ALA 70 6.902 5.168 0.548 494 HB1 ALA 70 1HB ALA 70 5.181 5.334 3.024 495 HB2 ALA 70 2HB ALA 70 4.996 4.167 1.716 496 HB3 ALA 70 3HB ALA 70 4.722 5.885 1.411 497 H GLY 71 H GLY 71 7.041 7.344 0.065 498 HA2 GLY 71 2HA GLY 71 6.954 9.422 1.820 499 HA3 GLY 71 1HA GLY 71 8.635 8.906 1.780 500 H ARG 72 H ARG 72 9.351 10.666 0.877 501 HA ARG 72 HA ARG 72 8.360 12.259 -1.113 502 HB2 ARG 72 2HB ARG 72 10.114 12.874 0.360 503 HB3 ARG 72 1HB ARG 72 11.192 11.676 -0.323 504 HG2 ARG 72 2HG ARG 72 11.226 12.957 -2.413 505 HG3 ARG 72 1HG ARG 72 10.165 14.165 -1.667 506 HD2 ARG 72 2HD ARG 72 11.787 14.614 0.037 507 HD3 ARG 72 1HD ARG 72 12.818 13.314 -0.544 508 HE ARG 72 HE ARG 72 12.205 15.462 -2.368 509 HH11 ARG 72 1HH1 ARG 72 14.521 14.000 -0.089 510 HH12 ARG 72 2HH1 ARG 72 15.854 14.891 -0.675 511 HH21 ARG 72 1HH2 ARG 72 14.061 16.639 -3.198 512 HH22 ARG 72 2HH2 ARG 72 15.591 16.413 -2.489 513 H HIS 73 H HIS 73 11.187 10.177 -1.802 514 HA HIS 73 HA HIS 73 10.161 8.946 -4.024 515 HB2 HIS 73 2HB HIS 73 10.028 11.193 -5.076 516 HB3 HIS 73 1HB HIS 73 11.737 11.449 -4.830 517 HD1 HIS 73 1HD HIS 73 9.424 10.593 -7.396 518 HD2 HIS 73 2HD HIS 73 13.265 9.336 -6.430 519 HE1 HIS 73 1HE HIS 73 10.377 9.594 -9.495 520 HA PRO 74 HA PRO 74 14.790 7.858 -4.236 521 HB2 PRO 74 2HB PRO 74 16.691 9.397 -3.026 522 HB3 PRO 74 1HB PRO 74 16.200 9.633 -4.706 523 HG2 PRO 74 2HG PRO 74 15.378 11.143 -2.260 524 HG3 PRO 74 1HG PRO 74 15.767 11.750 -3.876 525 HD2 PRO 74 2HD PRO 74 13.212 11.450 -3.005 526 HD3 PRO 74 1HD PRO 74 13.701 11.271 -4.707 527 H GLU 75 H GLU 75 13.542 9.372 -1.490 528 HA GLU 75 HA GLU 75 15.098 7.937 0.482 529 HB2 GLU 75 2HB GLU 75 12.891 9.963 0.799 530 HB3 GLU 75 1HB GLU 75 13.954 9.376 2.072 531 HG2 GLU 75 2HG GLU 75 15.878 10.300 0.810 532 HG3 GLU 75 1HG GLU 75 14.733 10.989 -0.332 533 H SER 76 H SER 76 12.822 6.773 -1.354 534 HA SER 76 HA SER 76 11.710 5.166 0.718 535 HB2 SER 76 2HB SER 76 9.373 5.634 -0.167 536 HB3 SER 76 1HB SER 76 10.113 6.904 0.809 537 HG SER 76 HG SER 76 9.251 6.962 -1.732 538 H ASP 77 H ASP 77 10.379 3.425 -0.244 539 HA ASP 77 HA ASP 77 11.637 2.337 -2.590 540 HB2 ASP 77 2HB ASP 77 10.939 0.958 -0.606 541 HB3 ASP 77 1HB ASP 77 9.264 1.294 -1.021 542 H ILE 78 H ILE 78 8.424 3.425 -1.633 543 HA ILE 78 HA ILE 78 7.732 3.641 -4.461 544 HB ILE 78 HB ILE 78 5.358 3.878 -3.737 545 HG12 ILE 78 2HG1 ILE 78 6.403 3.174 -0.974 546 HG13 ILE 78 1HG1 ILE 78 5.775 4.745 -1.455 547 HG21 ILE 78 1HG2 ILE 78 6.725 1.359 -2.805 548 HG22 ILE 78 2HG2 ILE 78 6.164 1.713 -4.436 549 HG23 ILE 78 3HG2 ILE 78 4.998 1.522 -3.124 550 HD11 ILE 78 3HD1 ILE 78 3.583 3.751 -1.847 551 HD12 ILE 78 1HD1 ILE 78 4.129 3.486 -0.190 552 HD13 ILE 78 2HD1 ILE 78 4.211 2.173 -1.367 553 H PHE 79 H PHE 79 6.932 5.594 -5.253 554 HA PHE 79 HA PHE 79 7.718 7.834 -3.575 555 HB2 PHE 79 2HB PHE 79 8.440 8.996 -5.676 556 HB3 PHE 79 1HB PHE 79 9.387 7.585 -5.239 557 HD1 PHE 79 2HD PHE 79 9.155 5.489 -6.551 558 HD2 PHE 79 1HD PHE 79 7.283 9.118 -7.753 559 HE1 PHE 79 2HE PHE 79 8.893 4.596 -8.825 560 HE2 PHE 79 1HE PHE 79 7.028 8.232 -10.030 561 HZ PHE 79 HZ PHE 79 7.831 5.967 -10.569 562 H LEU 80 H LEU 80 6.200 9.093 -3.029 563 HA LEU 80 HA LEU 80 3.722 9.207 -4.505 564 HB2 LEU 80 2HB LEU 80 4.569 10.442 -1.869 565 HB3 LEU 80 1HB LEU 80 2.977 10.609 -2.561 566 HG LEU 80 HG LEU 80 2.635 8.139 -2.250 567 HD11 LEU 80 1HD1 LEU 80 4.108 6.885 -0.774 568 HD12 LEU 80 2HD1 LEU 80 5.230 8.246 -0.716 569 HD13 LEU 80 3HD1 LEU 80 4.960 7.390 -2.233 570 HD21 LEU 80 3HD2 LEU 80 2.345 8.232 0.155 571 HD22 LEU 80 1HD2 LEU 80 1.808 9.720 -0.619 572 HD23 LEU 80 2HD2 LEU 80 3.355 9.673 0.231 573 H ASP 81 H ASP 81 3.599 10.620 -6.106 574 HA ASP 81 HA ASP 81 5.586 12.715 -6.332 575 HB2 ASP 81 2HB ASP 81 4.906 11.190 -8.223 576 HB3 ASP 81 1HB ASP 81 3.374 12.052 -8.283 577 H ASP 82 H ASP 82 3.053 12.791 -4.555 578 HA ASP 82 HA ASP 82 1.581 15.128 -5.472 579 HB2 ASP 82 2HB ASP 82 0.629 13.274 -4.006 580 HB3 ASP 82 1HB ASP 82 1.638 13.948 -2.719 581 H VAL 83 H VAL 83 1.751 17.171 -4.607 582 HA VAL 83 HA VAL 83 4.322 18.004 -3.775 583 HB VAL 83 HB VAL 83 2.919 19.424 -5.170 584 HG11 VAL 83 1HG1 VAL 83 1.053 19.598 -2.828 585 HG12 VAL 83 2HG1 VAL 83 0.732 18.836 -4.388 586 HG13 VAL 83 3HG1 VAL 83 0.945 20.585 -4.285 587 HG21 VAL 83 3HG2 VAL 83 3.371 20.720 -2.483 588 HG22 VAL 83 1HG2 VAL 83 3.144 21.575 -4.009 589 HG23 VAL 83 2HG2 VAL 83 4.567 20.557 -3.766 590 H THR 84 H THR 84 1.580 16.949 -1.999 591 HA THR 84 HA THR 84 2.371 18.330 0.453 592 HB THR 84 HB THR 84 0.069 16.417 0.277 593 HG1 THR 84 1HG THR 84 -0.158 17.589 -1.581 594 HG21 THR 84 3HG2 THR 84 0.622 17.593 2.381 595 HG22 THR 84 1HG2 THR 84 -0.954 18.077 1.755 596 HG23 THR 84 2HG2 THR 84 0.441 19.139 1.555 597 H VAL 85 H VAL 85 3.886 15.997 -0.817 598 HA VAL 85 HA VAL 85 3.416 13.788 0.971 599 HB VAL 85 HB VAL 85 4.110 13.403 -1.400 600 HG11 VAL 85 1HG1 VAL 85 6.774 14.510 -0.533 601 HG12 VAL 85 2HG1 VAL 85 5.674 15.206 -1.727 602 HG13 VAL 85 3HG1 VAL 85 6.464 13.664 -2.051 603 HG21 VAL 85 3HG2 VAL 85 4.435 11.612 0.169 604 HG22 VAL 85 1HG2 VAL 85 5.961 12.317 0.710 605 HG23 VAL 85 2HG2 VAL 85 5.829 11.672 -0.917 606 H SER 86 H SER 86 4.677 13.168 2.685 607 HA SER 86 HA SER 86 6.475 15.141 3.776 608 HB2 SER 86 2HB SER 86 5.678 12.395 4.783 609 HB3 SER 86 1HB SER 86 6.451 13.677 5.726 610 HG SER 86 HG SER 86 4.398 14.760 4.579 611 H ARG 87 H ARG 87 8.736 14.532 4.378 612 HA ARG 87 HA ARG 87 10.093 13.410 2.174 613 HB2 ARG 87 2HB ARG 87 11.198 13.828 4.960 614 HB3 ARG 87 1HB ARG 87 12.136 13.637 3.490 615 HG2 ARG 87 2HG ARG 87 11.144 15.734 2.634 616 HG3 ARG 87 1HG ARG 87 10.341 15.960 4.188 617 HD2 ARG 87 2HD ARG 87 12.308 17.244 4.310 618 HD3 ARG 87 1HD ARG 87 12.664 15.777 5.222 619 HE ARG 87 HE ARG 87 13.548 16.349 2.486 620 HH11 ARG 87 1HH1 ARG 87 14.087 14.584 5.550 621 HH12 ARG 87 2HH1 ARG 87 15.630 14.043 5.078 622 HH21 ARG 87 1HH2 ARG 87 15.654 15.636 1.957 623 HH22 ARG 87 2HH2 ARG 87 16.547 14.636 3.014 624 H ARG 88 H ARG 88 9.716 12.252 5.479 625 HA ARG 88 HA ARG 88 9.952 9.492 4.518 626 HB2 ARG 88 2HB ARG 88 10.533 10.595 7.294 627 HB3 ARG 88 1HB ARG 88 10.747 8.933 6.771 628 HG2 ARG 88 2HG ARG 88 12.289 11.294 5.704 629 HG3 ARG 88 1HG ARG 88 12.874 10.176 6.935 630 HD2 ARG 88 2HD ARG 88 12.821 8.346 5.364 631 HD3 ARG 88 1HD ARG 88 12.049 9.362 4.150 632 HE ARG 88 HE ARG 88 14.169 10.725 4.279 633 HH11 ARG 88 1HH1 ARG 88 14.197 7.212 4.836 634 HH12 ARG 88 2HH1 ARG 88 15.775 7.022 4.231 635 HH21 ARG 88 1HH2 ARG 88 16.214 10.439 3.455 636 HH22 ARG 88 2HH2 ARG 88 16.984 8.898 3.434 637 H HIS 89 H HIS 89 7.954 8.661 4.471 638 HA HIS 89 HA HIS 89 5.917 9.982 6.082 639 HB2 HIS 89 2HB HIS 89 5.600 9.901 3.609 640 HB3 HIS 89 1HB HIS 89 5.614 8.149 3.673 641 HD2 HIS 89 2HD HIS 89 3.341 7.112 5.204 642 HE1 HIS 89 1HE HIS 89 0.979 10.426 4.123 643 HE2 HIS 89 2HE HIS 89 1.122 8.307 5.504 644 H ALA 90 H ALA 90 6.204 6.618 4.911 645 HA ALA 90 HA ALA 90 5.948 5.700 7.649 646 HB1 ALA 90 1HB ALA 90 3.622 6.020 6.972 647 HB2 ALA 90 2HB ALA 90 3.991 4.308 7.167 648 HB3 ALA 90 3HB ALA 90 3.887 5.007 5.552 649 H GLU 91 H GLU 91 6.014 3.344 7.725 650 HA GLU 91 HA GLU 91 7.455 2.213 5.433 651 HB2 GLU 91 2HB GLU 91 9.016 2.790 7.280 652 HB3 GLU 91 1HB GLU 91 8.101 1.735 8.346 653 HG2 GLU 91 2HG GLU 91 8.675 -0.177 6.952 654 HG3 GLU 91 1HG GLU 91 9.575 0.891 5.874 655 H PHE 92 H PHE 92 6.639 0.383 4.720 656 HA PHE 92 HA PHE 92 4.556 -0.984 6.266 657 HB2 PHE 92 2HB PHE 92 5.198 -1.012 3.300 658 HB3 PHE 92 1HB PHE 92 3.921 -1.951 4.051 659 HD1 PHE 92 2HD PHE 92 5.043 1.526 3.358 660 HD2 PHE 92 1HD PHE 92 1.791 -1.028 4.347 661 HE1 PHE 92 2HE PHE 92 3.473 3.386 2.984 662 HE2 PHE 92 1HE PHE 92 0.214 0.820 3.966 663 HZ PHE 92 HZ PHE 92 1.056 3.034 3.283 664 H ARG 93 H ARG 93 5.170 -2.868 7.167 665 HA ARG 93 HA ARG 93 7.424 -4.299 5.956 666 HB2 ARG 93 2HB ARG 93 6.645 -4.094 8.862 667 HB3 ARG 93 1HB ARG 93 7.836 -5.214 8.236 668 HG2 ARG 93 2HG ARG 93 9.203 -3.287 7.506 669 HG3 ARG 93 1HG ARG 93 8.010 -2.206 8.228 670 HD2 ARG 93 2HD ARG 93 8.379 -3.184 10.413 671 HD3 ARG 93 1HD ARG 93 9.491 -4.364 9.730 672 HE ARG 93 HE ARG 93 10.144 -1.540 9.400 673 HH11 ARG 93 1HH1 ARG 93 10.828 -4.569 11.097 674 HH12 ARG 93 2HH1 ARG 93 12.283 -4.020 11.794 675 HH21 ARG 93 1HH2 ARG 93 12.075 -0.797 10.292 676 HH22 ARG 93 2HH2 ARG 93 13.032 -1.779 11.318 677 H ILE 94 H ILE 94 7.197 -6.393 5.625 678 HA ILE 94 HA ILE 94 4.809 -7.692 6.680 679 HB ILE 94 HB ILE 94 4.775 -7.553 4.166 680 HG12 ILE 94 2HG1 ILE 94 3.682 -9.527 5.261 681 HG13 ILE 94 1HG1 ILE 94 4.171 -9.816 3.606 682 HG21 ILE 94 1HG2 ILE 94 7.061 -7.485 3.619 683 HG22 ILE 94 2HG2 ILE 94 6.314 -8.843 2.771 684 HG23 ILE 94 3HG2 ILE 94 7.303 -9.134 4.202 685 HD11 ILE 94 3HD1 ILE 94 6.091 -11.108 4.416 686 HD12 ILE 94 1HD1 ILE 94 4.564 -11.756 5.019 687 HD13 ILE 94 2HD1 ILE 94 5.597 -10.793 6.079 688 H ASN 95 H ASN 95 5.215 -9.196 8.108 689 HA ASN 95 HA ASN 95 8.032 -9.733 8.647 690 HB2 ASN 95 2HB ASN 95 6.799 -8.217 10.255 691 HB3 ASN 95 1HB ASN 95 5.728 -9.555 10.619 692 HD21 ASN 95 1HD2 ASN 95 7.352 -8.079 12.464 693 HD22 ASN 95 2HD2 ASN 95 8.464 -9.202 13.145 694 H GLU 96 H GLU 96 8.546 -11.813 9.274 695 HA GLU 96 HA GLU 96 7.164 -14.077 8.288 696 HB2 GLU 96 2HB GLU 96 8.932 -15.315 9.465 697 HB3 GLU 96 1HB GLU 96 9.594 -13.930 8.606 698 HG2 GLU 96 2HG GLU 96 9.498 -12.670 10.767 699 HG3 GLU 96 1HG GLU 96 9.074 -14.176 11.551 700 H GLY 97 H GLY 97 5.541 -12.556 10.124 701 HA2 GLY 97 2HA GLY 97 4.342 -14.584 11.692 702 HA3 GLY 97 1HA GLY 97 5.238 -13.469 12.717 703 H GLU 98 H GLU 98 4.755 -11.089 11.147 704 HA GLU 98 HA GLU 98 1.854 -10.749 11.532 705 HB2 GLU 98 2HB GLU 98 3.988 -8.810 12.399 706 HB3 GLU 98 1HB GLU 98 2.259 -8.593 12.535 707 HG2 GLU 98 2HG GLU 98 2.180 -10.442 14.143 708 HG3 GLU 98 1HG GLU 98 3.937 -10.599 14.017 709 H PHE 99 H PHE 99 1.257 -8.506 10.697 710 HA PHE 99 HA PHE 99 2.877 -7.648 8.418 711 HB2 PHE 99 2HB PHE 99 -0.169 -7.504 8.698 712 HB3 PHE 99 1HB PHE 99 0.788 -6.916 7.340 713 HD1 PHE 99 1HD PHE 99 1.716 -8.440 5.708 714 HD2 PHE 99 2HD PHE 99 -0.655 -9.859 8.949 715 HE1 PHE 99 1HE PHE 99 1.431 -10.592 4.554 716 HE2 PHE 99 2HE PHE 99 -0.939 -12.018 7.798 717 HZ PHE 99 HZ PHE 99 0.105 -12.386 5.599 718 H GLU 100 H GLU 100 3.561 -5.535 8.755 719 HA GLU 100 HA GLU 100 2.275 -4.120 10.989 720 HB2 GLU 100 2HB GLU 100 4.183 -5.369 11.858 721 HB3 GLU 100 1HB GLU 100 5.225 -4.671 10.637 722 HG2 GLU 100 2HG GLU 100 4.938 -2.469 11.662 723 HG3 GLU 100 1HG GLU 100 3.883 -3.179 12.887 724 H VAL 101 H VAL 101 1.864 -2.024 10.494 725 HA VAL 101 HA VAL 101 3.651 -0.777 8.584 726 HB VAL 101 HB VAL 101 1.617 -1.170 7.306 727 HG11 VAL 101 1HG1 VAL 101 -0.572 -0.327 7.964 728 HG12 VAL 101 2HG1 VAL 101 0.111 0.254 9.479 729 HG13 VAL 101 3HG1 VAL 101 0.044 -1.480 9.154 730 HG21 VAL 101 3HG2 VAL 101 1.756 1.713 8.183 731 HG22 VAL 101 1HG2 VAL 101 0.962 1.126 6.721 732 HG23 VAL 101 2HG2 VAL 101 2.706 0.956 6.904 733 H VAL 102 H VAL 102 4.619 0.875 9.351 734 HA VAL 102 HA VAL 102 3.445 2.198 11.676 735 HB VAL 102 HB VAL 102 5.772 2.610 12.507 736 HG11 VAL 102 1HG1 VAL 102 4.414 0.834 13.465 737 HG12 VAL 102 2HG1 VAL 102 6.103 0.336 13.394 738 HG13 VAL 102 3HG1 VAL 102 4.951 -0.278 12.207 739 HG21 VAL 102 3HG2 VAL 102 7.593 1.183 11.648 740 HG22 VAL 102 1HG2 VAL 102 6.997 2.296 10.415 741 HG23 VAL 102 2HG2 VAL 102 6.520 0.600 10.375 742 H ASP 103 H ASP 103 3.349 4.319 11.693 743 HA ASP 103 HA ASP 103 4.179 5.855 9.393 744 HB2 ASP 103 2HB ASP 103 2.057 6.257 10.674 745 HB3 ASP 103 1HB ASP 103 3.025 6.699 12.070 746 H VAL 104 H VAL 104 6.090 7.030 9.336 747 HA VAL 104 HA VAL 104 7.658 6.896 11.804 748 HB VAL 104 HB VAL 104 9.705 7.178 10.506 749 HG11 VAL 104 1HG1 VAL 104 7.965 4.969 9.445 750 HG12 VAL 104 2HG1 VAL 104 8.947 4.929 10.909 751 HG13 VAL 104 3HG1 VAL 104 9.723 5.027 9.330 752 HG21 VAL 104 3HG2 VAL 104 9.692 7.095 8.045 753 HG22 VAL 104 1HG2 VAL 104 8.880 8.535 8.660 754 HG23 VAL 104 2HG2 VAL 104 7.930 7.173 8.062 755 H GLY 105 H GLY 105 5.664 9.027 10.624 756 HA2 GLY 105 2HA GLY 105 5.852 11.143 11.933 757 HA3 GLY 105 1HA GLY 105 7.433 11.308 11.190 758 H SER 106 H SER 106 4.206 10.466 9.952 759 HA SER 106 HA SER 106 4.731 11.930 7.533 760 HB2 SER 106 2HB SER 106 2.150 10.714 8.456 761 HB3 SER 106 1HB SER 106 2.610 11.138 6.808 762 HG SER 106 HG SER 106 3.215 9.006 8.349 763 H LEU 107 H LEU 107 4.312 14.012 7.222 764 HA LEU 107 HA LEU 107 2.586 15.512 9.003 765 HB2 LEU 107 2HB LEU 107 3.955 16.310 6.420 766 HB3 LEU 107 1HB LEU 107 2.993 17.388 7.397 767 HG LEU 107 HG LEU 107 4.712 17.064 9.237 768 HD11 LEU 107 1HD1 LEU 107 5.735 15.002 8.441 769 HD12 LEU 107 2HD1 LEU 107 6.929 16.291 8.600 770 HD13 LEU 107 3HD1 LEU 107 6.322 15.843 7.007 771 HD21 LEU 107 3HD2 LEU 107 5.591 18.292 6.633 772 HD22 LEU 107 1HD2 LEU 107 6.309 18.611 8.213 773 HD23 LEU 107 2HD2 LEU 107 4.636 19.067 7.898 774 H ASN 108 H ASN 108 2.488 13.785 6.124 775 HA ASN 108 HA ASN 108 0.150 14.959 4.972 776 HB2 ASN 108 2HB ASN 108 1.924 13.788 3.676 777 HB3 ASN 108 1HB ASN 108 1.438 12.276 4.416 778 HD21 ASN 108 1HD2 ASN 108 0.740 14.659 2.040 779 HD22 ASN 108 2HD2 ASN 108 -0.574 13.826 1.284 780 H GLY 109 H GLY 109 0.796 12.323 7.193 781 HA2 GLY 109 2HA GLY 109 -0.704 11.651 8.877 782 HA3 GLY 109 1HA GLY 109 -2.023 12.329 7.946 783 H THR 110 H THR 110 -0.740 9.505 9.066 784 HA THR 110 HA THR 110 -1.672 7.911 6.817 785 HB THR 110 HB THR 110 -0.106 7.127 9.313 786 HG1 THR 110 1HG THR 110 1.453 7.853 8.221 787 HG21 THR 110 3HG2 THR 110 0.255 4.981 8.172 788 HG22 THR 110 1HG2 THR 110 -0.799 5.479 6.849 789 HG23 THR 110 2HG2 THR 110 -1.462 5.248 8.461 790 H TYR 111 H TYR 111 -3.704 7.141 6.870 791 HA TYR 111 HA TYR 111 -5.054 6.899 9.474 792 HB2 TYR 111 2HB TYR 111 -6.383 7.140 6.777 793 HB3 TYR 111 1HB TYR 111 -7.113 7.279 8.361 794 HD1 TYR 111 1HD TYR 111 -6.547 9.362 9.740 795 HD2 TYR 111 2HD TYR 111 -5.625 8.979 5.615 796 HE1 TYR 111 1HE TYR 111 -6.386 11.813 9.546 797 HE2 TYR 111 2HE TYR 111 -5.454 11.406 5.414 798 HH TYR 111 HH TYR 111 -6.336 13.331 6.543 799 H VAL 112 H VAL 112 -5.742 4.916 9.950 800 HA VAL 112 HA VAL 112 -5.958 2.977 7.770 801 HB VAL 112 HB VAL 112 -4.294 2.193 9.394 802 HG11 VAL 112 1HG1 VAL 112 -6.431 2.508 11.493 803 HG12 VAL 112 2HG1 VAL 112 -4.974 3.486 11.332 804 HG13 VAL 112 3HG1 VAL 112 -4.846 1.773 11.742 805 HG21 VAL 112 3HG2 VAL 112 -5.674 0.472 8.407 806 HG22 VAL 112 1HG2 VAL 112 -6.910 0.717 9.640 807 HG23 VAL 112 2HG2 VAL 112 -5.353 0.048 10.092 808 H ASN 113 H ASN 113 -7.962 2.392 7.267 809 HA ASN 113 HA ASN 113 -10.242 2.453 7.216 810 HB2 ASN 113 2HB ASN 113 -9.848 1.997 10.193 811 HB3 ASN 113 1HB ASN 113 -11.430 1.966 9.425 812 HD21 ASN 113 1HD2 ASN 113 -11.942 0.275 8.099 813 HD22 ASN 113 2HD2 ASN 113 -11.060 -1.214 8.061 814 H ARG 114 H ARG 114 -8.731 4.893 7.569 815 HA ARG 114 HA ARG 114 -9.106 7.102 7.557 816 HB2 ARG 114 2HB ARG 114 -11.928 6.362 8.290 817 HB3 ARG 114 1HB ARG 114 -11.403 8.037 8.252 818 HG2 ARG 114 2HG ARG 114 -11.195 6.160 5.901 819 HG3 ARG 114 1HG ARG 114 -12.555 7.249 6.171 820 HD2 ARG 114 2HD ARG 114 -9.661 8.060 5.793 821 HD3 ARG 114 1HD ARG 114 -10.959 8.241 4.618 822 HE ARG 114 HE ARG 114 -11.861 9.531 6.819 823 HH11 ARG 114 1HH1 ARG 114 -9.040 9.957 4.670 824 HH12 ARG 114 2HH1 ARG 114 -8.814 11.598 5.115 825 HH21 ARG 114 1HH2 ARG 114 -11.510 11.801 7.378 826 HH22 ARG 114 2HH2 ARG 114 -10.241 12.655 6.671 827 H GLU 115 H GLU 115 -8.649 5.333 10.161 828 HA GLU 115 HA GLU 115 -8.856 7.567 12.040 829 HB2 GLU 115 2HB GLU 115 -9.631 5.324 12.768 830 HB3 GLU 115 1HB GLU 115 -8.002 4.706 12.513 831 HG2 GLU 115 2HG GLU 115 -7.243 6.469 14.172 832 HG3 GLU 115 1HG GLU 115 -8.944 6.692 14.561 833 HA PRO 116 HA PRO 116 -4.460 8.080 11.192 834 HB2 PRO 116 2HB PRO 116 -4.113 10.335 12.651 835 HB3 PRO 116 1HB PRO 116 -4.863 10.355 11.055 836 HG2 PRO 116 2HG PRO 116 -6.134 10.537 13.743 837 HG3 PRO 116 1HG PRO 116 -6.596 11.313 12.220 838 HD2 PRO 116 2HD PRO 116 -7.803 9.066 13.303 839 HD3 PRO 116 1HD PRO 116 -7.900 9.555 11.602 840 H ARG 117 H ARG 117 -2.941 6.943 12.251 841 HA ARG 117 HA ARG 117 -2.547 7.360 15.066 842 HB2 ARG 117 2HB ARG 117 -2.527 4.985 15.665 843 HB3 ARG 117 1HB ARG 117 -4.111 5.483 15.118 844 HG2 ARG 117 2HG ARG 117 -3.796 4.389 13.010 845 HG3 ARG 117 1HG ARG 117 -2.118 4.015 13.414 846 HD2 ARG 117 2HD ARG 117 -3.558 2.063 13.747 847 HD3 ARG 117 1HD ARG 117 -2.859 2.613 15.266 848 HE ARG 117 HE ARG 117 -5.361 3.816 15.014 849 HH11 ARG 117 1HH1 ARG 117 -4.071 0.544 15.384 850 HH12 ARG 117 2HH1 ARG 117 -5.446 -0.073 16.170 851 HH21 ARG 117 1HH2 ARG 117 -7.213 3.016 16.058 852 HH22 ARG 117 2HH2 ARG 117 -7.327 1.391 16.569 853 H ASN 118 H ASN 118 -0.602 5.602 15.660 854 HA ASN 118 HA ASN 118 1.462 6.462 13.791 855 HB2 ASN 118 2HB ASN 118 1.764 7.038 16.149 856 HB3 ASN 118 1HB ASN 118 1.721 5.332 16.580 857 HD21 ASN 118 1HD2 ASN 118 3.336 6.819 13.810 858 HD22 ASN 118 2HD2 ASN 118 4.923 6.356 14.257 859 H ALA 119 H ALA 119 0.647 3.484 15.631 860 HA ALA 119 HA ALA 119 2.010 1.984 13.504 861 HB1 ALA 119 1HB ALA 119 3.251 1.885 15.625 862 HB2 ALA 119 2HB ALA 119 2.572 0.311 15.204 863 HB3 ALA 119 3HB ALA 119 1.801 1.300 16.441 864 H GLN 120 H GLN 120 0.949 0.280 12.669 865 HA GLN 120 HA GLN 120 -1.616 -0.432 13.841 866 HB2 GLN 120 2HB GLN 120 -2.190 1.197 12.179 867 HB3 GLN 120 1HB GLN 120 -1.130 0.454 10.997 868 HG2 GLN 120 2HG GLN 120 -3.367 -0.096 10.428 869 HG3 GLN 120 1HG GLN 120 -2.591 -1.554 11.036 870 HE21 GLN 120 1HE2 GLN 120 -4.423 -2.574 11.663 871 HE22 GLN 120 2HE2 GLN 120 -5.466 -2.030 12.924 872 H VAL 121 H VAL 121 -2.042 -2.551 13.694 873 HA VAL 121 HA VAL 121 -0.174 -4.328 12.402 874 HB VAL 121 HB VAL 121 -2.920 -4.929 13.586 875 HG11 VAL 121 1HG1 VAL 121 -2.145 -6.655 12.051 876 HG12 VAL 121 2HG1 VAL 121 -2.137 -7.253 13.710 877 HG13 VAL 121 3HG1 VAL 121 -0.624 -6.779 12.934 878 HG21 VAL 121 3HG2 VAL 121 -1.737 -5.695 15.591 879 HG22 VAL 121 1HG2 VAL 121 -1.442 -3.985 15.289 880 HG23 VAL 121 2HG2 VAL 121 -0.205 -5.174 14.888 881 H MET 122 H MET 122 -0.281 -4.616 10.303 882 HA MET 122 HA MET 122 -2.223 -3.297 8.728 883 HB2 MET 122 2HB MET 122 0.249 -3.855 8.204 884 HB3 MET 122 1HB MET 122 -0.360 -5.435 7.749 885 HG2 MET 122 2HG MET 122 -1.655 -4.498 5.976 886 HG3 MET 122 1HG MET 122 -1.271 -2.859 6.510 887 HE1 MET 122 3HE MET 122 -0.322 -1.989 4.261 888 HE2 MET 122 1HE MET 122 -0.840 -3.506 3.525 889 HE3 MET 122 2HE MET 122 0.791 -2.902 3.242 890 H GLN 123 H GLN 123 -4.147 -3.986 8.028 891 HA GLN 123 HA GLN 123 -4.891 -6.694 8.819 892 HB2 GLN 123 2HB GLN 123 -6.044 -4.834 9.961 893 HB3 GLN 123 1HB GLN 123 -6.643 -4.269 8.409 894 HG2 GLN 123 2HG GLN 123 -8.362 -5.509 9.591 895 HG3 GLN 123 1HG GLN 123 -7.880 -6.365 8.128 896 HE21 GLN 123 1HE2 GLN 123 -8.530 -8.380 8.876 897 HE22 GLN 123 2HE2 GLN 123 -7.711 -9.183 10.161 898 H THR 124 H THR 124 -5.789 -8.071 7.451 899 HA THR 124 HA THR 124 -5.531 -7.569 4.681 900 HB THR 124 HB THR 124 -6.331 -10.017 4.656 901 HG1 THR 124 1HG THR 124 -5.821 -10.841 6.945 902 HG21 THR 124 3HG2 THR 124 -3.963 -9.338 4.538 903 HG22 THR 124 1HG2 THR 124 -4.168 -10.823 5.470 904 HG23 THR 124 2HG2 THR 124 -3.903 -9.291 6.301 905 H GLY 125 H GLY 125 -7.081 -6.646 3.491 906 HA2 GLY 125 2HA GLY 125 -9.227 -6.916 2.486 907 HA3 GLY 125 1HA GLY 125 -9.874 -7.329 4.066 908 H ASP 126 H ASP 126 -7.927 -4.985 4.903 909 HA ASP 126 HA ASP 126 -10.090 -3.046 4.692 910 HB2 ASP 126 2HB ASP 126 -8.037 -3.492 6.789 911 HB3 ASP 126 1HB ASP 126 -8.727 -1.881 6.609 912 H GLU 127 H GLU 127 -9.278 -0.740 5.067 913 HA GLU 127 HA GLU 127 -7.543 -0.208 2.777 914 HB2 GLU 127 2HB GLU 127 -8.837 1.813 2.448 915 HB3 GLU 127 1HB GLU 127 -9.902 0.416 2.490 916 HG2 GLU 127 2HG GLU 127 -10.414 0.954 4.872 917 HG3 GLU 127 1HG GLU 127 -9.463 2.422 4.697 918 H ILE 128 H ILE 128 -5.945 1.227 2.946 919 HA ILE 128 HA ILE 128 -5.507 2.590 5.493 920 HB ILE 128 HB ILE 128 -3.400 1.408 3.635 921 HG12 ILE 128 2HG1 ILE 128 -4.171 0.575 6.449 922 HG13 ILE 128 1HG1 ILE 128 -4.597 -0.297 4.983 923 HG21 ILE 128 1HG2 ILE 128 -1.773 2.110 5.352 924 HG22 ILE 128 2HG2 ILE 128 -3.075 2.863 6.272 925 HG23 ILE 128 3HG2 ILE 128 -2.643 3.491 4.681 926 HD11 ILE 128 3HD1 ILE 128 -1.808 0.164 6.018 927 HD12 ILE 128 1HD1 ILE 128 -2.234 -0.724 4.555 928 HD13 ILE 128 2HD1 ILE 128 -2.730 -1.334 6.134 929 H GLN 129 H GLN 129 -5.552 4.722 5.161 930 HA GLN 129 HA GLN 129 -5.009 5.635 2.437 931 HB2 GLN 129 2HB GLN 129 -7.400 5.959 3.042 932 HB3 GLN 129 1HB GLN 129 -6.885 6.948 4.405 933 HG2 GLN 129 2HG GLN 129 -5.792 8.508 2.860 934 HG3 GLN 129 1HG GLN 129 -6.360 7.547 1.501 935 HE21 GLN 129 1HE2 GLN 129 -7.514 9.199 0.633 936 HE22 GLN 129 2HE2 GLN 129 -8.955 9.821 1.340 937 H ILE 130 H ILE 130 -3.325 6.803 2.312 938 HA ILE 130 HA ILE 130 -2.455 8.146 4.714 939 HB ILE 130 HB ILE 130 -0.198 8.295 3.582 940 HG12 ILE 130 2HG1 ILE 130 -1.439 6.320 1.628 941 HG13 ILE 130 1HG1 ILE 130 -0.892 7.956 1.263 942 HG21 ILE 130 1HG2 ILE 130 0.398 5.938 4.036 943 HG22 ILE 130 2HG2 ILE 130 -1.327 5.559 4.143 944 HG23 ILE 130 3HG2 ILE 130 -0.591 6.683 5.288 945 HD11 ILE 130 3HD1 ILE 130 0.719 6.326 0.481 946 HD12 ILE 130 1HD1 ILE 130 0.850 5.653 2.110 947 HD13 ILE 130 2HD1 ILE 130 1.401 7.294 1.791 948 H GLY 131 H GLY 131 -3.389 9.988 4.753 949 HA2 GLY 131 2HA GLY 131 -4.028 12.132 4.215 950 HA3 GLY 131 1HA GLY 131 -2.750 12.075 3.023 951 H LYS 132 H LYS 132 -3.191 11.680 0.982 952 HA LYS 132 HA LYS 132 -5.995 11.997 0.136 953 HB2 LYS 132 2HB LYS 132 -4.367 13.720 -0.582 954 HB3 LYS 132 1HB LYS 132 -3.401 12.480 -1.365 955 HG2 LYS 132 2HG LYS 132 -5.306 12.031 -2.878 956 HG3 LYS 132 1HG LYS 132 -6.181 13.347 -2.115 957 HD2 LYS 132 2HD LYS 132 -3.560 13.616 -3.606 958 HD3 LYS 132 1HD LYS 132 -5.144 14.000 -4.265 959 HE2 LYS 132 2HE LYS 132 -4.375 16.096 -3.652 960 HE3 LYS 132 1HE LYS 132 -5.274 15.635 -2.217 961 HZ1 LYS 132 3HZ LYS 132 -3.094 16.646 -1.798 962 HZ2 LYS 132 1HZ LYS 132 -2.336 15.371 -2.561 963 HZ3 LYS 132 2HZ LYS 132 -3.167 15.117 -1.097 964 H PHE 133 H PHE 133 -3.395 9.775 0.216 965 HA PHE 133 HA PHE 133 -4.129 8.401 -2.247 966 HB2 PHE 133 2HB PHE 133 -1.927 7.609 -0.365 967 HB3 PHE 133 1HB PHE 133 -2.055 7.324 -2.089 968 HD1 PHE 133 1HD PHE 133 -1.474 9.069 -3.675 969 HD2 PHE 133 2HD PHE 133 -1.119 9.730 0.489 970 HE1 PHE 133 1HE PHE 133 -0.070 11.039 -4.085 971 HE2 PHE 133 2HE PHE 133 0.266 11.678 0.089 972 HZ PHE 133 HZ PHE 133 0.800 12.336 -2.185 973 H ARG 134 H ARG 134 -5.685 6.901 -2.018 974 HA ARG 134 HA ARG 134 -5.766 5.455 0.525 975 HB2 ARG 134 2HB ARG 134 -7.862 6.695 -0.153 976 HB3 ARG 134 1HB ARG 134 -8.009 5.570 -1.496 977 HG2 ARG 134 2HG ARG 134 -8.225 3.706 0.018 978 HG3 ARG 134 1HG ARG 134 -7.936 4.751 1.403 979 HD2 ARG 134 2HD ARG 134 -10.287 4.859 -0.479 980 HD3 ARG 134 1HD ARG 134 -10.300 4.270 1.180 981 HE ARG 134 HE ARG 134 -9.627 7.063 0.559 982 HH11 ARG 134 1HH1 ARG 134 -11.565 4.740 2.428 983 HH12 ARG 134 2HH1 ARG 134 -12.555 5.916 3.135 984 HH21 ARG 134 1HH2 ARG 134 -10.942 8.705 1.641 985 HH22 ARG 134 2HH2 ARG 134 -12.181 8.244 2.685 986 H LEU 135 H LEU 135 -5.238 3.462 0.622 987 HA LEU 135 HA LEU 135 -4.896 1.885 -1.813 988 HB2 LEU 135 2HB LEU 135 -2.777 2.760 -1.028 989 HB3 LEU 135 1HB LEU 135 -3.142 2.316 0.611 990 HG LEU 135 HG LEU 135 -2.649 0.226 -1.526 991 HD11 LEU 135 1HD1 LEU 135 -0.317 0.219 -0.724 992 HD12 LEU 135 2HD1 LEU 135 -0.673 1.598 0.309 993 HD13 LEU 135 3HD1 LEU 135 -0.733 1.773 -1.443 994 HD21 LEU 135 3HD2 LEU 135 -2.001 -1.132 0.432 995 HD22 LEU 135 1HD2 LEU 135 -3.656 -0.541 0.599 996 HD23 LEU 135 2HD2 LEU 135 -2.350 0.230 1.493 997 H VAL 136 H VAL 136 -5.665 -0.229 -1.600 998 HA VAL 136 HA VAL 136 -6.593 -0.970 1.073 999 HB VAL 136 HB VAL 136 -8.539 -0.632 -0.415 1000 HG11 VAL 136 1HG1 VAL 136 -8.991 -2.087 -2.310 1001 HG12 VAL 136 2HG1 VAL 136 -7.387 -2.797 -2.131 1002 HG13 VAL 136 3HG1 VAL 136 -7.555 -1.091 -2.550 1003 HG21 VAL 136 3HG2 VAL 136 -8.772 -2.302 1.329 1004 HG22 VAL 136 1HG2 VAL 136 -8.124 -3.543 0.256 1005 HG23 VAL 136 2HG2 VAL 136 -9.678 -2.790 -0.102 1006 H PHE 137 H PHE 137 -6.106 -2.971 1.860 1007 HA PHE 137 HA PHE 137 -3.895 -4.267 0.418 1008 HB2 PHE 137 2HB PHE 137 -3.200 -3.157 2.441 1009 HB3 PHE 137 1HB PHE 137 -4.461 -3.953 3.362 1010 HD1 PHE 137 2HD PHE 137 -1.453 -4.724 1.297 1011 HD2 PHE 137 1HD PHE 137 -3.929 -5.847 4.569 1012 HE1 PHE 137 2HE PHE 137 0.143 -6.485 1.897 1013 HE2 PHE 137 1HE PHE 137 -2.334 -7.615 5.176 1014 HZ PHE 137 HZ PHE 137 -0.297 -7.936 3.843 1015 H LEU 138 H LEU 138 -4.237 -6.289 -0.296 1016 HA LEU 138 HA LEU 138 -6.189 -7.956 1.124 1017 HB2 LEU 138 2HB LEU 138 -5.560 -7.973 -1.839 1018 HB3 LEU 138 1HB LEU 138 -6.603 -9.109 -1.029 1019 HG LEU 138 HG LEU 138 -8.026 -7.695 -2.149 1020 HD11 LEU 138 1HD1 LEU 138 -9.287 -6.467 -0.476 1021 HD12 LEU 138 2HD1 LEU 138 -7.941 -6.647 0.646 1022 HD13 LEU 138 3HD1 LEU 138 -8.801 -8.075 0.063 1023 HD21 LEU 138 3HD2 LEU 138 -7.959 -5.227 -2.090 1024 HD22 LEU 138 1HD2 LEU 138 -6.499 -5.922 -2.791 1025 HD23 LEU 138 2HD2 LEU 138 -6.477 -5.307 -1.139 1026 H ALA 139 H ALA 139 -5.624 -10.170 1.249 1027 HA ALA 139 HA ALA 139 -2.857 -10.760 0.489 1028 HB1 ALA 139 1HB ALA 139 -2.878 -10.309 2.889 1029 HB2 ALA 139 2HB ALA 139 -2.541 -12.011 2.571 1030 HB3 ALA 139 3HB ALA 139 -4.146 -11.512 3.110 1031 H GLY 140 H GLY 140 -2.460 -12.892 -0.056 1032 HA2 GLY 140 2HA GLY 140 -4.485 -14.889 0.163 1033 HA3 GLY 140 1HA GLY 140 -4.419 -14.210 -1.455 1034 HA PRO 141 HA PRO 141 -1.203 -16.760 -2.822 1035 HB2 PRO 141 2HB PRO 141 0.877 -15.127 -3.426 1036 HB3 PRO 141 1HB PRO 141 -0.484 -15.610 -4.454 1037 HG2 PRO 141 2HG PRO 141 -0.084 -13.073 -2.902 1038 HG3 PRO 141 1HG PRO 141 -0.862 -13.287 -4.479 1039 HD2 PRO 141 2HD PRO 141 -2.273 -12.928 -2.210 1040 HD3 PRO 141 1HD PRO 141 -2.861 -13.957 -3.534 1041 H ALA 142 H ALA 142 -0.593 -17.853 -1.374 1042 HA ALA 142 HA ALA 142 1.820 -17.197 0.186 1043 HB1 ALA 142 1HB ALA 142 1.126 -19.036 1.746 1044 HB2 ALA 142 2HB ALA 142 -0.382 -19.147 0.815 1045 HB3 ALA 142 3HB ALA 142 -0.005 -17.678 1.707 1046 H GLU 143 H GLU 143 3.410 -17.954 -1.033 1047 HA GLU 143 HA GLU 143 2.932 -20.415 -2.524 1048 HB2 GLU 143 2HB GLU 143 3.423 -18.461 -3.911 1049 HB3 GLU 143 1HB GLU 143 4.915 -18.188 -3.037 1050 HG2 GLU 143 2HG GLU 143 5.894 -20.171 -3.957 1051 HG3 GLU 143 1HG GLU 143 4.358 -20.664 -4.665 Start of MODEL 10 1 H1 MET 1 1HT MET 1 5.802 -19.769 -17.819 2 H2 MET 1 2HT MET 1 4.637 -18.992 -16.907 3 H3 MET 1 3HT MET 1 4.547 -18.948 -18.582 4 HA MET 1 HA MET 1 2.911 -20.442 -17.677 5 HB2 MET 1 2HB MET 1 3.925 -20.916 -19.886 6 HB3 MET 1 1HB MET 1 5.164 -21.882 -19.113 7 HG2 MET 1 2HG MET 1 3.413 -23.436 -18.322 8 HG3 MET 1 1HG MET 1 2.210 -22.476 -19.179 9 HE1 MET 1 2HE MET 1 2.228 -22.149 -21.854 10 HE2 MET 1 3HE MET 1 3.379 -22.946 -22.921 11 HE3 MET 1 1HE MET 1 3.925 -21.675 -21.828 12 H SER 2 H SER 2 6.115 -22.028 -17.241 13 HA SER 2 HA SER 2 5.137 -23.364 -14.900 14 HB2 SER 2 2HB SER 2 6.955 -24.236 -16.525 15 HB3 SER 2 1HB SER 2 8.038 -23.080 -15.749 16 HG SER 2 HG SER 2 8.159 -24.339 -14.060 17 H ASP 3 H ASP 3 7.174 -20.645 -15.766 18 HA ASP 3 HA ASP 3 7.566 -19.661 -13.105 19 HB2 ASP 3 2HB ASP 3 8.386 -17.641 -14.202 20 HB3 ASP 3 1HB ASP 3 9.023 -19.023 -15.085 21 H ASN 4 H ASN 4 6.336 -18.023 -12.133 22 HA ASN 4 HA ASN 4 4.397 -17.095 -11.447 23 HB2 ASN 4 2HB ASN 4 4.881 -15.565 -13.423 24 HB3 ASN 4 1HB ASN 4 3.848 -16.597 -14.400 25 HD21 ASN 4 1HD2 ASN 4 3.962 -14.216 -11.882 26 HD22 ASN 4 2HD2 ASN 4 2.276 -13.860 -11.868 27 H ASN 5 H ASN 5 4.094 -19.296 -10.963 28 HA ASN 5 HA ASN 5 2.518 -21.107 -12.474 29 HB2 ASN 5 2HB ASN 5 4.265 -21.770 -10.883 30 HB3 ASN 5 1HB ASN 5 3.373 -21.065 -9.560 31 HD21 ASN 5 1HD2 ASN 5 3.167 -22.875 -8.415 32 HD22 ASN 5 2HD2 ASN 5 2.266 -24.271 -8.875 33 H GLY 6 H GLY 6 0.493 -22.091 -11.484 34 HA2 GLY 6 2HA GLY 6 -1.585 -20.217 -11.396 35 HA3 GLY 6 1HA GLY 6 -1.725 -21.900 -10.918 36 H THR 7 H THR 7 -2.959 -19.550 -9.740 37 HA THR 7 HA THR 7 -1.630 -18.772 -7.399 38 HB THR 7 HB THR 7 -4.576 -18.622 -8.094 39 HG1 THR 7 1HG THR 7 -3.500 -17.476 -9.594 40 HG21 THR 7 3HG2 THR 7 -4.663 -16.770 -6.461 41 HG22 THR 7 1HG2 THR 7 -2.963 -17.038 -6.068 42 HG23 THR 7 2HG2 THR 7 -4.158 -18.271 -5.684 43 HA PRO 8 HA PRO 8 -2.527 -22.418 -4.921 44 HB2 PRO 8 2HB PRO 8 -1.632 -21.381 -2.584 45 HB3 PRO 8 1HB PRO 8 -0.534 -21.990 -3.827 46 HG2 PRO 8 2HG PRO 8 -1.369 -19.180 -3.236 47 HG3 PRO 8 1HG PRO 8 0.247 -19.814 -3.597 48 HD2 PRO 8 2HD PRO 8 -1.237 -18.570 -5.445 49 HD3 PRO 8 1HD PRO 8 -0.153 -19.916 -5.865 50 H GLU 9 H GLU 9 -4.148 -22.963 -3.432 51 HA GLU 9 HA GLU 9 -6.175 -21.015 -2.895 52 HB2 GLU 9 2HB GLU 9 -5.665 -23.749 -1.660 53 HB3 GLU 9 1HB GLU 9 -7.091 -22.773 -1.335 54 HG2 GLU 9 2HG GLU 9 -6.301 -23.885 -4.018 55 HG3 GLU 9 1HG GLU 9 -7.536 -24.553 -2.955 56 HA PRO 10 HA PRO 10 -3.470 -18.968 -0.106 57 HB2 PRO 10 2HB PRO 10 -5.420 -17.416 1.136 58 HB3 PRO 10 1HB PRO 10 -4.449 -17.003 -0.283 59 HG2 PRO 10 2HG PRO 10 -7.247 -17.989 -0.110 60 HG3 PRO 10 1HG PRO 10 -6.510 -16.920 -1.315 61 HD2 PRO 10 2HD PRO 10 -7.101 -19.534 -1.765 62 HD3 PRO 10 1HD PRO 10 -5.774 -18.685 -2.582 63 H GLN 11 H GLN 11 -2.680 -20.105 1.376 64 HA GLN 11 HA GLN 11 -4.292 -21.212 3.510 65 HB2 GLN 11 2HB GLN 11 -2.567 -22.612 2.460 66 HB3 GLN 11 1HB GLN 11 -1.336 -21.444 2.897 67 HG2 GLN 11 2HG GLN 11 -1.702 -21.900 5.251 68 HG3 GLN 11 1HG GLN 11 -2.997 -23.027 4.847 69 HE21 GLN 11 1HE2 GLN 11 0.427 -22.482 4.807 70 HE22 GLN 11 2HE2 GLN 11 0.886 -24.119 4.540 71 H VAL 12 H VAL 12 -4.786 -19.811 5.068 72 HA VAL 12 HA VAL 12 -2.935 -17.688 5.711 73 HB VAL 12 HB VAL 12 -5.705 -18.219 6.850 74 HG11 VAL 12 1HG1 VAL 12 -5.601 -15.885 7.625 75 HG12 VAL 12 2HG1 VAL 12 -3.954 -15.763 7.006 76 HG13 VAL 12 3HG1 VAL 12 -4.314 -16.866 8.333 77 HG21 VAL 12 3HG2 VAL 12 -5.832 -17.760 4.453 78 HG22 VAL 12 1HG2 VAL 12 -4.869 -16.302 4.665 79 HG23 VAL 12 2HG2 VAL 12 -6.479 -16.406 5.377 80 H GLU 13 H GLU 13 -1.326 -18.646 6.726 81 HA GLU 13 HA GLU 13 -1.649 -20.626 8.706 82 HB2 GLU 13 2HB GLU 13 0.810 -20.253 9.075 83 HB3 GLU 13 1HB GLU 13 0.377 -20.602 7.411 84 HG2 GLU 13 2HG GLU 13 0.466 -18.115 6.985 85 HG3 GLU 13 1HG GLU 13 1.152 -17.948 8.599 86 H THR 14 H THR 14 -1.755 -20.457 10.863 87 HA THR 14 HA THR 14 -2.810 -18.083 11.888 88 HB THR 14 HB THR 14 -1.889 -20.535 13.402 89 HG1 THR 14 1HG THR 14 -4.201 -19.833 11.937 90 HG21 THR 14 3HG2 THR 14 -3.627 -19.835 15.005 91 HG22 THR 14 1HG2 THR 14 -3.947 -18.402 14.032 92 HG23 THR 14 2HG2 THR 14 -2.386 -18.596 14.836 93 H THR 15 H THR 15 -1.773 -16.343 12.331 94 HA THR 15 HA THR 15 0.736 -15.706 12.371 95 HB THR 15 HB THR 15 -1.539 -14.538 13.919 96 HG1 THR 15 1HG THR 15 -1.424 -13.161 11.879 97 HG21 THR 15 3HG2 THR 15 -0.240 -12.404 13.617 98 HG22 THR 15 1HG2 THR 15 1.107 -13.390 13.052 99 HG23 THR 15 2HG2 THR 15 0.527 -13.562 14.710 100 H SER 16 H SER 16 2.323 -16.016 13.494 101 HA SER 16 HA SER 16 2.170 -16.566 16.377 102 HB2 SER 16 2HB SER 16 3.012 -18.449 14.944 103 HB3 SER 16 1HB SER 16 4.322 -17.400 14.408 104 HG SER 16 HG SER 16 3.805 -18.270 17.045 105 H VAL 17 H VAL 17 2.479 -14.476 17.232 106 HA VAL 17 HA VAL 17 4.926 -13.073 16.441 107 HB VAL 17 HB VAL 17 3.745 -10.920 16.931 108 HG11 VAL 17 1HG1 VAL 17 4.170 -11.533 14.640 109 HG12 VAL 17 2HG1 VAL 17 2.589 -10.763 14.753 110 HG13 VAL 17 3HG1 VAL 17 2.708 -12.516 14.598 111 HG21 VAL 17 3HG2 VAL 17 1.259 -12.611 16.749 112 HG22 VAL 17 1HG2 VAL 17 1.293 -10.849 16.778 113 HG23 VAL 17 2HG2 VAL 17 1.848 -11.766 18.181 114 H PHE 18 H PHE 18 5.464 -11.372 18.123 115 HA PHE 18 HA PHE 18 5.085 -12.566 20.732 116 HB2 PHE 18 2HB PHE 18 7.058 -11.133 21.438 117 HB3 PHE 18 1HB PHE 18 7.423 -12.373 20.257 118 HD1 PHE 18 2HD PHE 18 7.834 -11.702 17.885 119 HD2 PHE 18 1HD PHE 18 7.435 -8.822 20.988 120 HE1 PHE 18 2HE PHE 18 8.905 -10.013 16.453 121 HE2 PHE 18 1HE PHE 18 8.508 -7.131 19.568 122 HZ PHE 18 HZ PHE 18 9.244 -7.724 17.293 123 H ARG 19 H ARG 19 3.240 -11.886 21.396 124 HA ARG 19 HA ARG 19 1.705 -10.679 22.414 125 HB2 ARG 19 2HB ARG 19 3.576 -9.835 23.782 126 HB3 ARG 19 1HB ARG 19 3.788 -8.503 22.657 127 HG2 ARG 19 2HG ARG 19 1.581 -7.660 23.210 128 HG3 ARG 19 1HG ARG 19 1.315 -9.026 24.289 129 HD2 ARG 19 2HD ARG 19 3.378 -6.853 24.585 130 HD3 ARG 19 1HD ARG 19 1.953 -7.101 25.594 131 HE ARG 19 HE ARG 19 4.371 -8.723 25.520 132 HH11 ARG 19 1HH1 ARG 19 1.214 -8.093 27.061 133 HH12 ARG 19 2HH1 ARG 19 1.575 -8.948 28.474 134 HH21 ARG 19 1HH2 ARG 19 4.880 -9.870 27.534 135 HH22 ARG 19 2HH2 ARG 19 3.720 -9.969 28.763 136 H ALA 20 H ALA 20 0.207 -10.460 20.900 137 HA ALA 20 HA ALA 20 0.406 -8.345 18.927 138 HB1 ALA 20 1HB ALA 20 -0.473 -10.552 18.256 139 HB2 ALA 20 2HB ALA 20 -1.649 -9.264 17.982 140 HB3 ALA 20 3HB ALA 20 -1.821 -10.334 19.372 141 H ASP 21 H ASP 21 -0.494 -8.584 21.953 142 HA ASP 21 HA ASP 21 -2.856 -7.038 22.263 143 HB2 ASP 21 2HB ASP 21 -0.492 -7.140 24.165 144 HB3 ASP 21 1HB ASP 21 -2.137 -6.679 24.558 145 H LEU 22 H LEU 22 0.563 -6.270 22.331 146 HA LEU 22 HA LEU 22 0.101 -3.544 21.543 147 HB2 LEU 22 2HB LEU 22 -0.103 -3.450 23.970 148 HB3 LEU 22 1HB LEU 22 1.407 -4.314 24.150 149 HG LEU 22 HG LEU 22 2.595 -2.389 23.150 150 HD11 LEU 22 1HD1 LEU 22 0.791 -1.469 21.810 151 HD12 LEU 22 2HD1 LEU 22 1.435 -0.258 22.916 152 HD13 LEU 22 3HD1 LEU 22 -0.100 -1.053 23.275 153 HD21 LEU 22 3HD2 LEU 22 0.877 -1.762 25.543 154 HD22 LEU 22 1HD2 LEU 22 2.357 -0.917 25.092 155 HD23 LEU 22 2HD2 LEU 22 2.420 -2.617 25.561 156 H LEU 23 H LEU 23 1.465 -3.459 19.897 157 HA LEU 23 HA LEU 23 4.028 -4.867 20.088 158 HB2 LEU 23 2HB LEU 23 2.462 -5.415 18.178 159 HB3 LEU 23 1HB LEU 23 2.600 -3.764 17.638 160 HG LEU 23 HG LEU 23 3.901 -5.411 16.286 161 HD11 LEU 23 1HD1 LEU 23 5.981 -4.159 16.119 162 HD12 LEU 23 2HD1 LEU 23 5.598 -3.328 17.629 163 HD13 LEU 23 3HD1 LEU 23 4.573 -3.099 16.214 164 HD21 LEU 23 3HD2 LEU 23 4.561 -6.933 18.056 165 HD22 LEU 23 1HD2 LEU 23 5.587 -5.686 18.771 166 HD23 LEU 23 2HD2 LEU 23 5.975 -6.345 17.183 167 H LYS 24 H LYS 24 5.700 -3.612 20.564 168 HA LYS 24 HA LYS 24 5.408 -0.717 20.275 169 HB2 LYS 24 2HB LYS 24 7.520 -2.315 21.736 170 HB3 LYS 24 1HB LYS 24 7.364 -0.567 21.764 171 HG2 LYS 24 2HG LYS 24 5.346 -2.537 22.851 172 HG3 LYS 24 1HG LYS 24 6.496 -1.602 23.805 173 HD2 LYS 24 2HD LYS 24 4.323 -0.401 22.068 174 HD3 LYS 24 1HD LYS 24 4.194 -0.658 23.803 175 HE2 LYS 24 2HE LYS 24 6.122 0.827 24.156 176 HE3 LYS 24 1HE LYS 24 6.215 1.097 22.415 177 HZ1 LYS 24 3HZ LYS 24 4.108 2.184 22.453 178 HZ2 LYS 24 1HZ LYS 24 5.068 2.847 23.664 179 HZ3 LYS 24 2HZ LYS 24 3.844 1.766 24.068 180 H GLU 25 H GLU 25 6.471 0.382 18.785 181 HA GLU 25 HA GLU 25 7.974 -0.954 16.777 182 HB2 GLU 25 2HB GLU 25 8.132 2.033 17.128 183 HB3 GLU 25 1HB GLU 25 8.144 1.104 15.650 184 HG2 GLU 25 2HG GLU 25 6.099 2.228 15.628 185 HG3 GLU 25 1HG GLU 25 5.679 0.604 16.169 186 H MET 26 H MET 26 9.748 -1.866 17.694 187 HA MET 26 HA MET 26 11.541 -0.322 19.335 188 HB2 MET 26 2HB MET 26 11.961 -3.072 18.111 189 HB3 MET 26 1HB MET 26 12.894 -2.365 19.423 190 HG2 MET 26 2HG MET 26 10.954 -2.369 20.860 191 HG3 MET 26 1HG MET 26 9.948 -2.984 19.554 192 HE1 MET 26 3HE MET 26 9.767 -4.313 22.278 193 HE2 MET 26 1HE MET 26 9.917 -6.031 21.900 194 HE3 MET 26 2HE MET 26 8.982 -4.977 20.846 195 H GLU 27 H GLU 27 12.727 1.205 18.402 196 HA GLU 27 HA GLU 27 13.806 0.654 15.736 197 HB2 GLU 27 2HB GLU 27 13.862 3.090 15.331 198 HB3 GLU 27 1HB GLU 27 12.235 2.485 15.579 199 HG2 GLU 27 2HG GLU 27 12.135 3.439 17.757 200 HG3 GLU 27 1HG GLU 27 13.857 3.814 17.737 201 H SER 28 H SER 28 15.921 1.031 15.315 202 HA SER 28 HA SER 28 17.550 1.319 17.649 203 HB2 SER 28 2HB SER 28 19.346 0.589 15.953 204 HB3 SER 28 1HB SER 28 18.128 -0.592 16.431 205 HG SER 28 HG SER 28 18.638 0.490 13.991 206 H SER 29 H SER 29 17.880 3.435 18.134 207 HA SER 29 HA SER 29 18.251 5.433 16.096 208 HB2 SER 29 2HB SER 29 17.303 5.947 18.390 209 HB3 SER 29 1HB SER 29 18.896 5.626 19.070 210 HG SER 29 HG SER 29 18.318 7.553 17.101 211 H THR 30 H THR 30 20.117 3.158 17.675 212 HA THR 30 HA THR 30 22.422 3.645 16.139 213 HB THR 30 HB THR 30 22.910 5.204 17.995 214 HG1 THR 30 1HG THR 30 24.710 4.050 18.999 215 HG21 THR 30 3HG2 THR 30 21.363 4.295 19.678 216 HG22 THR 30 1HG2 THR 30 22.983 4.490 20.348 217 HG23 THR 30 2HG2 THR 30 22.409 2.890 19.883 218 H GLY 31 H GLY 31 23.205 1.549 15.736 219 HA2 GLY 31 2HA GLY 31 23.625 -0.548 17.190 220 HA3 GLY 31 1HA GLY 31 21.867 -0.569 17.231 221 H THR 32 H THR 32 21.750 -2.540 16.137 222 HA THR 32 HA THR 32 22.709 -2.446 13.385 223 HB THR 32 HB THR 32 23.795 -4.204 14.726 224 HG1 THR 32 1HG THR 32 23.474 -4.624 12.562 225 HG21 THR 32 3HG2 THR 32 22.045 -4.686 16.351 226 HG22 THR 32 1HG2 THR 32 22.502 -6.166 15.512 227 HG23 THR 32 2HG2 THR 32 21.007 -5.331 15.084 228 H ALA 33 H ALA 33 21.386 -3.209 11.762 229 HA ALA 33 HA ALA 33 18.551 -2.920 12.295 230 HB1 ALA 33 1HB ALA 33 20.022 -3.164 9.675 231 HB2 ALA 33 2HB ALA 33 19.520 -1.655 10.440 232 HB3 ALA 33 3HB ALA 33 18.308 -2.797 9.860 233 HA PRO 34 HA PRO 34 18.292 -7.430 12.250 234 HB2 PRO 34 2HB PRO 34 15.397 -7.022 12.490 235 HB3 PRO 34 1HB PRO 34 16.506 -7.807 13.615 236 HG2 PRO 34 2HG PRO 34 15.370 -5.417 14.152 237 HG3 PRO 34 1HG PRO 34 16.993 -5.844 14.715 238 HD2 PRO 34 2HD PRO 34 16.182 -4.137 12.393 239 HD3 PRO 34 1HD PRO 34 17.482 -3.904 13.589 240 H ALA 35 H ALA 35 18.475 -8.343 10.374 241 HA ALA 35 HA ALA 35 16.303 -8.262 8.422 242 HB1 ALA 35 1HB ALA 35 17.941 -7.958 6.592 243 HB2 ALA 35 2HB ALA 35 19.217 -7.762 7.788 244 HB3 ALA 35 3HB ALA 35 17.924 -6.566 7.679 245 H SER 36 H SER 36 17.214 -10.103 10.409 246 HA SER 36 HA SER 36 18.844 -12.119 9.224 247 HB2 SER 36 2HB SER 36 18.137 -13.303 11.425 248 HB3 SER 36 1HB SER 36 19.195 -11.890 11.504 249 HG SER 36 HG SER 36 16.365 -11.777 11.744 250 H THR 37 H THR 37 15.728 -11.361 8.659 251 HA THR 37 HA THR 37 14.607 -13.974 8.700 252 HB THR 37 HB THR 37 13.181 -11.940 8.931 253 HG1 THR 37 1HG THR 37 12.132 -13.765 8.269 254 HG21 THR 37 3HG2 THR 37 12.600 -10.615 6.922 255 HG22 THR 37 1HG2 THR 37 13.792 -11.521 5.992 256 HG23 THR 37 2HG2 THR 37 14.317 -10.474 7.307 257 H GLY 38 H GLY 38 13.445 -14.452 6.319 258 HA2 GLY 38 2HA GLY 38 15.710 -15.425 4.809 259 HA3 GLY 38 1HA GLY 38 14.023 -15.813 4.524 260 H ALA 39 H ALA 39 16.381 -13.253 4.174 261 HA ALA 39 HA ALA 39 14.867 -11.803 2.220 262 HB1 ALA 39 1HB ALA 39 16.858 -10.408 1.996 263 HB2 ALA 39 2HB ALA 39 17.797 -11.582 2.916 264 HB3 ALA 39 3HB ALA 39 16.491 -10.691 3.699 265 H GLU 40 H GLU 40 17.375 -14.245 2.179 266 HA GLU 40 HA GLU 40 17.828 -14.036 -0.644 267 HB2 GLU 40 2HB GLU 40 19.235 -16.049 -0.397 268 HB3 GLU 40 1HB GLU 40 19.664 -14.819 0.772 269 HG2 GLU 40 2HG GLU 40 17.840 -17.092 1.490 270 HG3 GLU 40 1HG GLU 40 19.587 -17.273 1.526 271 H ASN 41 H ASN 41 15.711 -15.641 1.444 272 HA ASN 41 HA ASN 41 14.809 -17.690 -0.354 273 HB2 ASN 41 2HB ASN 41 13.478 -16.516 2.108 274 HB3 ASN 41 1HB ASN 41 12.901 -17.928 1.237 275 HD21 ASN 41 1HD2 ASN 41 13.943 -19.877 1.532 276 HD22 ASN 41 2HD2 ASN 41 15.146 -20.134 2.728 277 H LEU 42 H LEU 42 13.963 -14.416 0.430 278 HA LEU 42 HA LEU 42 12.700 -12.829 -0.453 279 HB2 LEU 42 2HB LEU 42 13.591 -13.636 -2.632 280 HB3 LEU 42 1HB LEU 42 12.256 -14.760 -2.710 281 HG LEU 42 HG LEU 42 10.712 -12.741 -2.755 282 HD11 LEU 42 1HD1 LEU 42 11.667 -10.601 -3.398 283 HD12 LEU 42 2HD1 LEU 42 13.286 -11.275 -3.270 284 HD13 LEU 42 3HD1 LEU 42 12.288 -11.112 -1.829 285 HD21 LEU 42 3HD2 LEU 42 12.695 -13.025 -5.006 286 HD22 LEU 42 1HD2 LEU 42 11.109 -12.262 -5.123 287 HD23 LEU 42 2HD2 LEU 42 11.235 -13.986 -4.771 288 HA PRO 43 HA PRO 43 9.004 -14.258 1.612 289 HB2 PRO 43 2HB PRO 43 7.584 -11.884 1.315 290 HB3 PRO 43 1HB PRO 43 8.687 -12.254 2.643 291 HG2 PRO 43 2HG PRO 43 9.166 -10.658 0.168 292 HG3 PRO 43 1HG PRO 43 9.767 -10.386 1.812 293 HD2 PRO 43 2HD PRO 43 11.321 -11.395 -0.109 294 HD3 PRO 43 1HD PRO 43 11.476 -11.933 1.574 295 H ALA 44 H ALA 44 7.884 -15.690 0.510 296 HA ALA 44 HA ALA 44 6.241 -14.778 -1.738 297 HB1 ALA 44 1HB ALA 44 6.256 -17.103 -2.522 298 HB2 ALA 44 2HB ALA 44 7.258 -17.569 -1.149 299 HB3 ALA 44 3HB ALA 44 7.903 -16.487 -2.384 300 H GLY 45 H GLY 45 4.057 -15.678 -1.787 301 HA2 GLY 45 2HA GLY 45 2.114 -16.439 -0.754 302 HA3 GLY 45 1HA GLY 45 3.087 -16.946 0.630 303 H SER 46 H SER 46 3.217 -13.838 -0.807 304 HA SER 46 HA SER 46 2.615 -12.558 1.709 305 HB2 SER 46 2HB SER 46 3.462 -11.383 -0.934 306 HB3 SER 46 1HB SER 46 3.508 -10.594 0.644 307 HG SER 46 HG SER 46 5.509 -11.439 -0.099 308 H ALA 47 H ALA 47 1.306 -10.516 1.534 309 HA ALA 47 HA ALA 47 -1.181 -11.059 0.128 310 HB1 ALA 47 1HB ALA 47 -1.434 -10.672 2.469 311 HB2 ALA 47 2HB ALA 47 -1.978 -9.191 1.641 312 HB3 ALA 47 3HB ALA 47 -0.391 -9.262 2.390 313 H LEU 48 H LEU 48 -2.265 -8.676 -0.440 314 HA LEU 48 HA LEU 48 -0.238 -7.189 -1.838 315 HB2 LEU 48 2HB LEU 48 -1.481 -7.180 -3.952 316 HB3 LEU 48 1HB LEU 48 -0.886 -8.758 -3.532 317 HG LEU 48 HG LEU 48 -2.980 -9.003 -4.618 318 HD11 LEU 48 1HD1 LEU 48 -3.445 -9.507 -1.713 319 HD12 LEU 48 2HD1 LEU 48 -2.700 -10.591 -2.888 320 HD13 LEU 48 3HD1 LEU 48 -4.405 -10.163 -3.040 321 HD21 LEU 48 3HD2 LEU 48 -3.932 -6.803 -4.361 322 HD22 LEU 48 1HD2 LEU 48 -4.193 -7.080 -2.639 323 HD23 LEU 48 2HD2 LEU 48 -5.100 -8.011 -3.829 324 H LEU 49 H LEU 49 -0.990 -5.193 -2.758 325 HA LEU 49 HA LEU 49 -3.298 -4.056 -1.377 326 HB2 LEU 49 2HB LEU 49 -1.900 -1.995 -0.965 327 HB3 LEU 49 1HB LEU 49 -1.511 -3.392 0.006 328 HG LEU 49 HG LEU 49 0.395 -3.825 -1.651 329 HD11 LEU 49 1HD1 LEU 49 1.278 -1.959 -2.857 330 HD12 LEU 49 2HD1 LEU 49 -0.047 -0.939 -2.334 331 HD13 LEU 49 3HD1 LEU 49 -0.359 -2.307 -3.410 332 HD21 LEU 49 3HD2 LEU 49 1.897 -2.335 -0.487 333 HD22 LEU 49 1HD2 LEU 49 0.736 -3.033 0.637 334 HD23 LEU 49 2HD2 LEU 49 0.548 -1.364 0.088 335 H VAL 50 H VAL 50 -4.371 -2.472 -2.451 336 HA VAL 50 HA VAL 50 -3.560 -2.027 -5.255 337 HB VAL 50 HB VAL 50 -6.417 -2.299 -4.257 338 HG11 VAL 50 1HG1 VAL 50 -7.018 -2.428 -6.631 339 HG12 VAL 50 2HG1 VAL 50 -5.332 -2.145 -7.061 340 HG13 VAL 50 3HG1 VAL 50 -6.244 -0.901 -6.208 341 HG21 VAL 50 3HG2 VAL 50 -4.806 -4.350 -5.784 342 HG22 VAL 50 1HG2 VAL 50 -6.518 -4.475 -5.387 343 HG23 VAL 50 2HG2 VAL 50 -5.308 -4.482 -4.102 344 H VAL 51 H VAL 51 -3.767 0.099 -5.930 345 HA VAL 51 HA VAL 51 -4.422 2.039 -3.829 346 HB VAL 51 HB VAL 51 -3.287 2.546 -6.597 347 HG11 VAL 51 1HG1 VAL 51 -2.662 4.733 -5.680 348 HG12 VAL 51 2HG1 VAL 51 -3.446 4.314 -4.157 349 HG13 VAL 51 3HG1 VAL 51 -4.407 4.480 -5.624 350 HG21 VAL 51 3HG2 VAL 51 -1.134 2.886 -5.443 351 HG22 VAL 51 1HG2 VAL 51 -1.705 1.216 -5.329 352 HG23 VAL 51 2HG2 VAL 51 -1.870 2.307 -3.953 353 H LYS 52 H LYS 52 -6.275 2.734 -3.639 354 HA LYS 52 HA LYS 52 -8.354 2.389 -5.574 355 HB2 LYS 52 2HB LYS 52 -8.664 2.176 -3.132 356 HB3 LYS 52 1HB LYS 52 -8.243 3.867 -2.941 357 HG2 LYS 52 2HG LYS 52 -10.255 4.487 -4.200 358 HG3 LYS 52 1HG LYS 52 -10.668 2.773 -4.352 359 HD2 LYS 52 2HD LYS 52 -10.614 2.622 -1.854 360 HD3 LYS 52 1HD LYS 52 -10.412 4.364 -1.808 361 HE2 LYS 52 2HE LYS 52 -12.549 4.691 -2.891 362 HE3 LYS 52 1HE LYS 52 -12.742 2.950 -3.088 363 HZ1 LYS 52 3HZ LYS 52 -12.591 4.373 -0.475 364 HZ2 LYS 52 1HZ LYS 52 -12.724 2.730 -0.679 365 HZ3 LYS 52 2HZ LYS 52 -13.994 3.712 -1.154 366 H ARG 53 H ARG 53 -6.530 5.012 -4.154 367 HA ARG 53 HA ARG 53 -7.087 6.771 -6.411 368 HB2 ARG 53 2HB ARG 53 -8.983 7.121 -4.836 369 HB3 ARG 53 1HB ARG 53 -7.840 7.497 -3.565 370 HG2 ARG 53 2HG ARG 53 -8.700 9.560 -4.322 371 HG3 ARG 53 1HG ARG 53 -7.076 9.444 -4.992 372 HD2 ARG 53 2HD ARG 53 -9.595 8.734 -6.469 373 HD3 ARG 53 1HD ARG 53 -8.799 10.300 -6.601 374 HE ARG 53 HE ARG 53 -6.842 8.920 -7.402 375 HH11 ARG 53 1HH1 ARG 53 -10.223 8.144 -8.104 376 HH12 ARG 53 2HH1 ARG 53 -9.893 7.199 -9.468 377 HH21 ARG 53 1HH2 ARG 53 -6.377 7.648 -9.311 378 HH22 ARG 53 2HH2 ARG 53 -7.649 6.911 -10.173 379 H GLY 54 H GLY 54 -4.921 7.228 -6.852 380 HA2 GLY 54 2HA GLY 54 -3.582 9.040 -5.352 381 HA3 GLY 54 1HA GLY 54 -3.104 7.506 -4.666 382 HA PRO 55 HA PRO 55 -1.014 8.385 -9.022 383 HB2 PRO 55 2HB PRO 55 0.485 10.669 -8.638 384 HB3 PRO 55 1HB PRO 55 -1.053 10.625 -9.491 385 HG2 PRO 55 2HG PRO 55 -0.485 11.434 -6.681 386 HG3 PRO 55 1HG PRO 55 -1.622 12.130 -7.845 387 HD2 PRO 55 2HD PRO 55 -2.403 10.531 -5.842 388 HD3 PRO 55 1HD PRO 55 -3.234 10.556 -7.411 389 H ASN 56 H ASN 56 -0.271 8.440 -5.774 390 HA ASN 56 HA ASN 56 2.405 8.123 -5.287 391 HB2 ASN 56 2HB ASN 56 0.556 7.734 -3.647 392 HB3 ASN 56 1HB ASN 56 0.212 6.201 -4.413 393 HD21 ASN 56 1HD2 ASN 56 3.245 5.584 -4.627 394 HD22 ASN 56 2HD2 ASN 56 3.633 5.179 -2.995 395 H ALA 57 H ALA 57 0.101 5.817 -6.763 396 HA ALA 57 HA ALA 57 2.119 4.585 -8.375 397 HB1 ALA 57 1HB ALA 57 2.301 3.222 -6.332 398 HB2 ALA 57 2HB ALA 57 1.635 2.277 -7.667 399 HB3 ALA 57 3HB ALA 57 0.571 2.884 -6.400 400 H GLY 58 H GLY 58 -1.172 3.877 -7.190 401 HA2 GLY 58 2HA GLY 58 -3.190 3.943 -8.326 402 HA3 GLY 58 1HA GLY 58 -2.339 4.554 -9.738 403 H ALA 59 H ALA 59 -1.581 1.611 -7.986 404 HA ALA 59 HA ALA 59 -2.668 -0.077 -10.063 405 HB1 ALA 59 1HB ALA 59 -0.462 0.545 -10.947 406 HB2 ALA 59 2HB ALA 59 -0.471 -1.147 -10.450 407 HB3 ALA 59 3HB ALA 59 0.293 0.068 -9.425 408 H ARG 60 H ARG 60 -1.323 -2.397 -9.245 409 HA ARG 60 HA ARG 60 -1.835 -2.522 -6.358 410 HB2 ARG 60 2HB ARG 60 -2.868 -4.664 -6.585 411 HB3 ARG 60 1HB ARG 60 -3.636 -3.670 -7.817 412 HG2 ARG 60 2HG ARG 60 -2.332 -4.690 -9.546 413 HG3 ARG 60 1HG ARG 60 -1.322 -5.516 -8.369 414 HD2 ARG 60 2HD ARG 60 -3.620 -6.574 -7.623 415 HD3 ARG 60 1HD ARG 60 -4.108 -6.132 -9.261 416 HE ARG 60 HE ARG 60 -1.592 -7.451 -9.159 417 HH11 ARG 60 1HH1 ARG 60 -5.107 -8.079 -9.369 418 HH12 ARG 60 2HH1 ARG 60 -4.912 -9.687 -9.853 419 HH21 ARG 60 1HH2 ARG 60 -1.368 -9.720 -9.791 420 HH22 ARG 60 2HH2 ARG 60 -2.764 -10.641 -10.104 421 H PHE 61 H PHE 61 -0.344 -4.025 -5.282 422 HA PHE 61 HA PHE 61 1.325 -5.561 -6.896 423 HB2 PHE 61 2HB PHE 61 3.515 -4.731 -6.162 424 HB3 PHE 61 1HB PHE 61 2.671 -3.593 -7.189 425 HD1 PHE 61 2HD PHE 61 3.900 -4.284 -3.793 426 HD2 PHE 61 1HD PHE 61 2.074 -1.413 -6.353 427 HE1 PHE 61 2HE PHE 61 4.406 -2.514 -2.160 428 HE2 PHE 61 1HE PHE 61 2.587 0.361 -4.730 429 HZ PHE 61 HZ PHE 61 3.755 -0.192 -2.629 430 H LEU 62 H LEU 62 2.546 -7.017 -5.924 431 HA LEU 62 HA LEU 62 1.551 -8.011 -3.388 432 HB2 LEU 62 2HB LEU 62 1.849 -9.409 -5.449 433 HB3 LEU 62 1HB LEU 62 3.564 -9.099 -5.369 434 HG LEU 62 HG LEU 62 3.592 -10.258 -3.145 435 HD11 LEU 62 1HD1 LEU 62 1.256 -10.020 -2.571 436 HD12 LEU 62 2HD1 LEU 62 1.705 -11.723 -2.625 437 HD13 LEU 62 3HD1 LEU 62 0.796 -11.006 -3.956 438 HD21 LEU 62 3HD2 LEU 62 4.315 -11.379 -5.181 439 HD22 LEU 62 1HD2 LEU 62 2.654 -11.854 -5.530 440 HD23 LEU 62 2HD2 LEU 62 3.478 -12.505 -4.113 441 H LEU 63 H LEU 63 2.833 -8.067 -1.546 442 HA LEU 63 HA LEU 63 5.205 -6.434 -1.602 443 HB2 LEU 63 2HB LEU 63 3.921 -7.997 0.645 444 HB3 LEU 63 1HB LEU 63 5.407 -7.095 0.850 445 HG LEU 63 HG LEU 63 3.646 -5.812 1.778 446 HD11 LEU 63 1HD1 LEU 63 4.383 -4.612 -0.871 447 HD12 LEU 63 2HD1 LEU 63 5.298 -4.510 0.631 448 HD13 LEU 63 3HD1 LEU 63 3.716 -3.742 0.508 449 HD21 LEU 63 3HD2 LEU 63 2.173 -6.057 -0.850 450 HD22 LEU 63 1HD2 LEU 63 1.673 -5.060 0.517 451 HD23 LEU 63 2HD2 LEU 63 1.720 -6.817 0.674 452 H ASP 64 H ASP 64 7.039 -7.142 -2.282 453 HA ASP 64 HA ASP 64 7.880 -9.866 -1.569 454 HB2 ASP 64 2HB ASP 64 9.034 -10.101 -3.733 455 HB3 ASP 64 1HB ASP 64 7.316 -9.823 -3.977 456 H GLN 65 H GLN 65 8.368 -6.704 -1.164 457 HA GLN 65 HA GLN 65 11.176 -7.067 -0.692 458 HB2 GLN 65 2HB GLN 65 11.488 -4.633 -0.920 459 HB3 GLN 65 1HB GLN 65 10.775 -5.309 -2.355 460 HG2 GLN 65 2HG GLN 65 9.290 -3.712 -0.252 461 HG3 GLN 65 1HG GLN 65 9.933 -3.053 -1.735 462 HE21 GLN 65 1HE2 GLN 65 8.006 -2.337 -2.592 463 HE22 GLN 65 2HE2 GLN 65 6.694 -3.391 -2.993 464 HA PRO 66 HA PRO 66 10.029 -7.656 3.498 465 HB2 PRO 66 2HB PRO 66 12.537 -7.008 4.569 466 HB3 PRO 66 1HB PRO 66 11.982 -8.605 4.067 467 HG2 PRO 66 2HG PRO 66 13.631 -6.619 2.583 468 HG3 PRO 66 1HG PRO 66 13.740 -8.382 2.590 469 HD2 PRO 66 2HD PRO 66 12.679 -7.086 0.537 470 HD3 PRO 66 1HD PRO 66 11.980 -8.625 1.085 471 H THR 67 H THR 67 11.723 -4.671 2.693 472 HA THR 67 HA THR 67 10.019 -3.366 4.657 473 HB THR 67 HB THR 67 12.984 -2.830 4.305 474 HG1 THR 67 1HG THR 67 11.604 -4.506 5.823 475 HG21 THR 67 3HG2 THR 67 12.698 -1.192 6.133 476 HG22 THR 67 1HG2 THR 67 10.963 -1.495 6.137 477 HG23 THR 67 2HG2 THR 67 11.727 -0.740 4.735 478 H THR 68 H THR 68 8.686 -2.249 3.431 479 HA THR 68 HA THR 68 9.727 -0.954 1.022 480 HB THR 68 HB THR 68 6.850 -1.129 1.861 481 HG1 THR 68 1HG THR 68 8.440 -3.242 1.383 482 HG21 THR 68 3HG2 THR 68 6.464 -1.059 -0.550 483 HG22 THR 68 1HG2 THR 68 8.205 -1.087 -0.832 484 HG23 THR 68 2HG2 THR 68 7.467 0.302 -0.038 485 H THR 69 H THR 69 10.369 1.101 1.523 486 HA THR 69 HA THR 69 8.958 2.553 3.585 487 HB THR 69 HB THR 69 11.399 3.313 1.940 488 HG1 THR 69 1HG THR 69 12.066 1.716 3.174 489 HG21 THR 69 3HG2 THR 69 10.190 5.271 2.877 490 HG22 THR 69 1HG2 THR 69 11.753 5.043 3.659 491 HG23 THR 69 2HG2 THR 69 10.276 4.541 4.479 492 H ALA 70 H ALA 70 7.704 4.357 3.159 493 HA ALA 70 HA ALA 70 7.278 5.008 0.345 494 HB1 ALA 70 1HB ALA 70 5.391 3.800 1.370 495 HB2 ALA 70 2HB ALA 70 4.967 5.429 0.882 496 HB3 ALA 70 3HB ALA 70 5.259 5.068 2.592 497 H GLY 71 H GLY 71 7.676 7.078 -0.128 498 HA2 GLY 71 2HA GLY 71 7.209 9.225 1.611 499 HA3 GLY 71 1HA GLY 71 8.905 8.766 1.671 500 H ARG 72 H ARG 72 9.806 10.391 0.670 501 HA ARG 72 HA ARG 72 8.787 11.256 -1.987 502 HB2 ARG 72 2HB ARG 72 8.739 12.913 -0.171 503 HB3 ARG 72 1HB ARG 72 10.468 12.743 0.025 504 HG2 ARG 72 2HG ARG 72 10.560 13.455 -2.474 505 HG3 ARG 72 1HG ARG 72 8.934 14.071 -2.164 506 HD2 ARG 72 2HD ARG 72 11.497 14.825 -0.772 507 HD3 ARG 72 1HD ARG 72 10.463 15.863 -1.748 508 HE ARG 72 HE ARG 72 8.785 15.181 0.162 509 HH11 ARG 72 1HH1 ARG 72 12.139 16.322 0.393 510 HH12 ARG 72 2HH1 ARG 72 11.993 16.920 1.973 511 HH21 ARG 72 1HH2 ARG 72 8.584 15.987 2.378 512 HH22 ARG 72 2HH2 ARG 72 9.916 16.747 3.124 513 H HIS 73 H HIS 73 11.538 9.985 -0.287 514 HA HIS 73 HA HIS 73 13.338 10.834 -2.420 515 HB2 HIS 73 2HB HIS 73 14.001 9.836 0.384 516 HB3 HIS 73 1HB HIS 73 15.184 10.302 -0.827 517 HD1 HIS 73 1HD HIS 73 16.007 12.664 -0.529 518 HD2 HIS 73 2HD HIS 73 12.165 12.143 0.913 519 HE1 HIS 73 1HE HIS 73 15.336 14.864 0.476 520 HA PRO 74 HA PRO 74 13.854 6.899 -4.315 521 HB2 PRO 74 2HB PRO 74 16.759 7.033 -3.677 522 HB3 PRO 74 1HB PRO 74 15.958 6.738 -5.220 523 HG2 PRO 74 2HG PRO 74 17.012 9.114 -4.719 524 HG3 PRO 74 1HG PRO 74 15.451 8.980 -5.551 525 HD2 PRO 74 2HD PRO 74 16.048 9.735 -2.727 526 HD3 PRO 74 1HD PRO 74 14.811 10.364 -3.836 527 H GLU 75 H GLU 75 15.200 7.270 -1.149 528 HA GLU 75 HA GLU 75 15.783 4.612 -0.478 529 HB2 GLU 75 2HB GLU 75 14.649 6.749 1.335 530 HB3 GLU 75 1HB GLU 75 15.523 5.310 1.840 531 HG2 GLU 75 2HG GLU 75 16.639 7.618 0.264 532 HG3 GLU 75 1HG GLU 75 16.943 7.249 1.958 533 H SER 76 H SER 76 12.811 6.243 -0.974 534 HA SER 76 HA SER 76 11.168 4.234 0.285 535 HB2 SER 76 2HB SER 76 10.462 6.598 -1.454 536 HB3 SER 76 1HB SER 76 9.342 5.627 -0.495 537 HG SER 76 HG SER 76 11.535 7.058 0.571 538 H ASP 77 H ASP 77 10.072 2.703 -0.830 539 HA ASP 77 HA ASP 77 11.118 2.093 -3.450 540 HB2 ASP 77 2HB ASP 77 10.790 0.267 -1.812 541 HB3 ASP 77 1HB ASP 77 9.056 0.585 -1.831 542 H ILE 78 H ILE 78 8.210 3.336 -2.050 543 HA ILE 78 HA ILE 78 7.341 3.917 -4.754 544 HB ILE 78 HB ILE 78 4.976 3.789 -4.188 545 HG12 ILE 78 2HG1 ILE 78 5.072 4.185 -1.722 546 HG13 ILE 78 1HG1 ILE 78 4.073 2.810 -2.145 547 HG21 ILE 78 1HG2 ILE 78 4.687 1.365 -4.071 548 HG22 ILE 78 2HG2 ILE 78 6.396 1.213 -3.667 549 HG23 ILE 78 3HG2 ILE 78 5.917 1.884 -5.225 550 HD11 ILE 78 3HD1 ILE 78 6.846 2.756 -0.983 551 HD12 ILE 78 1HD1 ILE 78 5.937 1.324 -1.491 552 HD13 ILE 78 2HD1 ILE 78 5.334 2.331 -0.176 553 H PHE 79 H PHE 79 6.650 5.893 -5.132 554 HA PHE 79 HA PHE 79 7.245 7.840 -3.016 555 HB2 PHE 79 2HB PHE 79 7.005 8.263 -6.001 556 HB3 PHE 79 1HB PHE 79 7.596 9.421 -4.819 557 HD1 PHE 79 1HD PHE 79 9.836 9.208 -3.899 558 HD2 PHE 79 2HD PHE 79 8.374 6.435 -6.771 559 HE1 PHE 79 1HE PHE 79 12.123 8.415 -4.304 560 HE2 PHE 79 2HE PHE 79 10.656 5.635 -7.179 561 HZ PHE 79 HZ PHE 79 12.538 6.626 -5.947 562 H LEU 80 H LEU 80 5.476 8.636 -2.061 563 HA LEU 80 HA LEU 80 2.860 8.546 -3.197 564 HB2 LEU 80 2HB LEU 80 3.877 10.277 -0.926 565 HB3 LEU 80 1HB LEU 80 2.208 10.154 -1.402 566 HG LEU 80 HG LEU 80 2.350 7.705 -0.734 567 HD11 LEU 80 1HD1 LEU 80 4.059 7.177 0.933 568 HD12 LEU 80 2HD1 LEU 80 4.911 8.666 0.506 569 HD13 LEU 80 3HD1 LEU 80 4.710 7.383 -0.692 570 HD21 LEU 80 3HD2 LEU 80 2.046 8.222 1.634 571 HD22 LEU 80 1HD2 LEU 80 1.199 9.366 0.593 572 HD23 LEU 80 2HD2 LEU 80 2.716 9.832 1.364 573 H ASP 81 H ASP 81 2.288 9.818 -4.903 574 HA ASP 81 HA ASP 81 3.739 12.291 -5.139 575 HB2 ASP 81 2HB ASP 81 3.509 11.031 -7.225 576 HB3 ASP 81 1HB ASP 81 1.751 11.136 -7.108 577 H ASP 82 H ASP 82 2.709 12.608 -3.171 578 HA ASP 82 HA ASP 82 0.309 14.318 -3.508 579 HB2 ASP 82 2HB ASP 82 0.061 12.574 -1.706 580 HB3 ASP 82 1HB ASP 82 1.455 13.265 -0.893 581 H VAL 83 H VAL 83 0.402 16.418 -2.451 582 HA VAL 83 HA VAL 83 2.927 17.622 -2.966 583 HB VAL 83 HB VAL 83 0.803 18.723 -3.543 584 HG11 VAL 83 1HG1 VAL 83 -0.548 19.869 -1.862 585 HG12 VAL 83 2HG1 VAL 83 0.403 19.097 -0.593 586 HG13 VAL 83 3HG1 VAL 83 -0.578 18.114 -1.681 587 HG21 VAL 83 3HG2 VAL 83 2.552 20.296 -1.656 588 HG22 VAL 83 1HG2 VAL 83 1.380 21.008 -2.768 589 HG23 VAL 83 2HG2 VAL 83 2.759 20.111 -3.397 590 H THR 84 H THR 84 1.404 16.415 -0.051 591 HA THR 84 HA THR 84 3.473 17.804 1.480 592 HB THR 84 HB THR 84 0.780 16.886 2.539 593 HG1 THR 84 1HG THR 84 0.310 18.499 1.190 594 HG21 THR 84 3HG2 THR 84 2.866 18.774 3.661 595 HG22 THR 84 1HG2 THR 84 2.541 17.143 4.246 596 HG23 THR 84 2HG2 THR 84 1.314 18.402 4.410 597 H VAL 85 H VAL 85 4.764 15.950 0.785 598 HA VAL 85 HA VAL 85 4.239 13.530 2.380 599 HB VAL 85 HB VAL 85 5.906 13.733 -0.155 600 HG11 VAL 85 1HG1 VAL 85 5.061 11.308 1.429 601 HG12 VAL 85 2HG1 VAL 85 6.694 11.967 1.342 602 HG13 VAL 85 3HG1 VAL 85 5.938 11.288 -0.102 603 HG21 VAL 85 3HG2 VAL 85 3.195 12.521 0.290 604 HG22 VAL 85 1HG2 VAL 85 4.116 12.468 -1.212 605 HG23 VAL 85 2HG2 VAL 85 3.536 14.013 -0.589 606 H SER 86 H SER 86 5.778 12.744 3.704 607 HA SER 86 HA SER 86 7.971 14.474 4.480 608 HB2 SER 86 2HB SER 86 6.507 13.366 6.168 609 HB3 SER 86 1HB SER 86 6.982 11.797 5.537 610 HG SER 86 HG SER 86 8.232 12.069 7.226 611 H ARG 87 H ARG 87 10.085 13.011 5.056 612 HA ARG 87 HA ARG 87 10.954 11.854 2.540 613 HB2 ARG 87 2HB ARG 87 12.447 11.815 5.189 614 HB3 ARG 87 1HB ARG 87 13.113 11.541 3.596 615 HG2 ARG 87 2HG ARG 87 12.605 13.878 3.002 616 HG3 ARG 87 1HG ARG 87 12.060 14.142 4.661 617 HD2 ARG 87 2HD ARG 87 14.281 13.478 5.474 618 HD3 ARG 87 1HD ARG 87 14.809 13.269 3.806 619 HE ARG 87 HE ARG 87 13.733 15.839 4.250 620 HH11 ARG 87 1HH1 ARG 87 16.642 13.890 4.618 621 HH12 ARG 87 2HH1 ARG 87 17.717 15.190 4.823 622 HH21 ARG 87 1HH2 ARG 87 15.182 17.703 4.477 623 HH22 ARG 87 2HH2 ARG 87 16.843 17.452 4.711 624 H ARG 88 H ARG 88 10.693 10.860 5.872 625 HA ARG 88 HA ARG 88 9.975 8.190 4.965 626 HB2 ARG 88 2HB ARG 88 10.428 7.472 7.328 627 HB3 ARG 88 1HB ARG 88 11.850 8.145 6.556 628 HG2 ARG 88 2HG ARG 88 11.474 10.259 7.763 629 HG3 ARG 88 1HG ARG 88 10.072 9.545 8.557 630 HD2 ARG 88 2HD ARG 88 12.946 8.654 8.789 631 HD3 ARG 88 1HD ARG 88 11.998 9.477 10.024 632 HE ARG 88 HE ARG 88 11.160 6.846 9.034 633 HH11 ARG 88 1HH1 ARG 88 12.165 8.865 11.769 634 HH12 ARG 88 2HH1 ARG 88 12.000 7.609 12.904 635 HH21 ARG 88 1HH2 ARG 88 10.910 5.169 10.618 636 HH22 ARG 88 2HH2 ARG 88 11.214 5.507 12.265 637 H HIS 89 H HIS 89 7.869 8.254 4.569 638 HA HIS 89 HA HIS 89 6.175 9.906 6.295 639 HB2 HIS 89 2HB HIS 89 6.247 10.195 3.761 640 HB3 HIS 89 1HB HIS 89 5.480 8.623 3.642 641 HD2 HIS 89 2HD HIS 89 2.778 8.574 4.589 642 HE1 HIS 89 1HE HIS 89 2.370 12.767 4.195 643 HE2 HIS 89 2HE HIS 89 1.160 10.561 4.204 644 H ALA 90 H ALA 90 6.047 6.755 4.631 645 HA ALA 90 HA ALA 90 4.884 5.612 7.046 646 HB1 ALA 90 1HB ALA 90 2.990 6.109 5.558 647 HB2 ALA 90 2HB ALA 90 3.241 4.369 5.690 648 HB3 ALA 90 3HB ALA 90 3.782 5.230 4.249 649 H GLU 91 H GLU 91 5.311 3.326 7.202 650 HA GLU 91 HA GLU 91 7.198 2.346 5.202 651 HB2 GLU 91 2HB GLU 91 8.397 3.282 7.178 652 HB3 GLU 91 1HB GLU 91 7.557 2.120 8.188 653 HG2 GLU 91 2HG GLU 91 8.619 0.293 6.945 654 HG3 GLU 91 1HG GLU 91 9.490 1.482 5.974 655 H PHE 92 H PHE 92 6.709 0.370 4.573 656 HA PHE 92 HA PHE 92 4.676 -1.127 6.049 657 HB2 PHE 92 2HB PHE 92 5.668 -1.534 3.212 658 HB3 PHE 92 1HB PHE 92 4.346 -2.374 3.975 659 HD1 PHE 92 2HD PHE 92 5.406 0.911 2.641 660 HD2 PHE 92 1HD PHE 92 2.161 -1.471 4.024 661 HE1 PHE 92 2HE PHE 92 3.810 2.583 1.789 662 HE2 PHE 92 1HE PHE 92 0.573 0.195 3.171 663 HZ PHE 92 HZ PHE 92 1.398 2.224 2.052 664 H ARG 93 H ARG 93 5.483 -2.664 7.309 665 HA ARG 93 HA ARG 93 8.054 -3.872 6.609 666 HB2 ARG 93 2HB ARG 93 6.597 -3.515 9.221 667 HB3 ARG 93 1HB ARG 93 7.923 -4.641 9.025 668 HG2 ARG 93 2HG ARG 93 8.217 -1.714 8.429 669 HG3 ARG 93 1HG ARG 93 8.443 -2.377 10.050 670 HD2 ARG 93 2HD ARG 93 10.158 -3.908 9.142 671 HD3 ARG 93 1HD ARG 93 9.971 -3.149 7.563 672 HE ARG 93 HE ARG 93 10.583 -1.021 8.849 673 HH11 ARG 93 1HH1 ARG 93 11.882 -4.185 9.824 674 HH12 ARG 93 2HH1 ARG 93 13.414 -3.600 10.223 675 HH21 ARG 93 1HH2 ARG 93 12.670 -0.214 9.416 676 HH22 ARG 93 2HH2 ARG 93 13.885 -1.236 10.012 677 H ILE 94 H ILE 94 8.102 -6.054 6.297 678 HA ILE 94 HA ILE 94 5.674 -7.421 7.034 679 HB ILE 94 HB ILE 94 6.055 -9.107 5.256 680 HG12 ILE 94 2HG1 ILE 94 7.659 -8.232 3.297 681 HG13 ILE 94 1HG1 ILE 94 8.480 -7.490 4.666 682 HG21 ILE 94 1HG2 ILE 94 5.888 -6.311 4.189 683 HG22 ILE 94 2HG2 ILE 94 4.563 -7.327 4.746 684 HG23 ILE 94 3HG2 ILE 94 5.459 -7.764 3.291 685 HD11 ILE 94 3HD1 ILE 94 8.820 -9.674 5.677 686 HD12 ILE 94 1HD1 ILE 94 9.486 -9.644 4.047 687 HD13 ILE 94 2HD1 ILE 94 7.945 -10.441 4.354 688 H ASN 95 H ASN 95 5.871 -8.734 8.658 689 HA ASN 95 HA ASN 95 8.589 -9.403 9.458 690 HB2 ASN 95 2HB ASN 95 7.156 -7.857 10.918 691 HB3 ASN 95 1HB ASN 95 6.099 -9.227 11.181 692 HD21 ASN 95 1HD2 ASN 95 7.482 -7.708 13.111 693 HD22 ASN 95 2HD2 ASN 95 8.556 -8.759 13.955 694 H GLU 96 H GLU 96 8.928 -11.474 10.119 695 HA GLU 96 HA GLU 96 7.693 -13.557 8.714 696 HB2 GLU 96 2HB GLU 96 9.125 -15.007 10.089 697 HB3 GLU 96 1HB GLU 96 9.997 -13.618 9.453 698 HG2 GLU 96 2HG GLU 96 9.494 -12.513 11.713 699 HG3 GLU 96 1HG GLU 96 9.092 -14.141 12.257 700 H GLY 97 H GLY 97 6.817 -12.061 11.640 701 HA2 GLY 97 2HA GLY 97 5.198 -14.275 12.583 702 HA3 GLY 97 1HA GLY 97 5.320 -12.682 13.324 703 H GLU 98 H GLU 98 4.667 -11.016 11.201 704 HA GLU 98 HA GLU 98 2.407 -11.656 9.757 705 HB2 GLU 98 2HB GLU 98 1.402 -11.742 12.103 706 HB3 GLU 98 1HB GLU 98 1.839 -10.053 12.284 707 HG2 GLU 98 2HG GLU 98 0.234 -9.360 10.733 708 HG3 GLU 98 1HG GLU 98 0.048 -10.979 10.064 709 H PHE 99 H PHE 99 1.470 -9.320 9.028 710 HA PHE 99 HA PHE 99 3.970 -7.840 8.558 711 HB2 PHE 99 2HB PHE 99 1.465 -7.700 6.900 712 HB3 PHE 99 1HB PHE 99 3.080 -7.182 6.463 713 HD1 PHE 99 2HD PHE 99 4.773 -9.460 6.977 714 HD2 PHE 99 1HD PHE 99 0.776 -9.376 5.519 715 HE1 PHE 99 2HE PHE 99 5.133 -11.629 5.876 716 HE2 PHE 99 1HE PHE 99 1.126 -11.549 4.422 717 HZ PHE 99 HZ PHE 99 3.305 -12.677 4.596 718 H GLU 100 H GLU 100 4.114 -5.685 9.190 719 HA GLU 100 HA GLU 100 1.625 -4.391 9.832 720 HB2 GLU 100 2HB GLU 100 2.342 -3.499 11.921 721 HB3 GLU 100 1HB GLU 100 2.559 -5.238 11.964 722 HG2 GLU 100 2HG GLU 100 4.719 -3.367 11.276 723 HG3 GLU 100 1HG GLU 100 4.358 -3.724 12.965 724 H VAL 101 H VAL 101 1.482 -2.343 9.603 725 HA VAL 101 HA VAL 101 3.527 -0.980 7.969 726 HB VAL 101 HB VAL 101 0.604 -0.271 8.306 727 HG11 VAL 101 1HG1 VAL 101 2.632 0.704 6.293 728 HG12 VAL 101 2HG1 VAL 101 1.967 1.620 7.643 729 HG13 VAL 101 3HG1 VAL 101 0.920 1.128 6.308 730 HG21 VAL 101 3HG2 VAL 101 1.899 -1.797 6.059 731 HG22 VAL 101 1HG2 VAL 101 0.241 -1.189 6.042 732 HG23 VAL 101 2HG2 VAL 101 0.720 -2.414 7.218 733 H VAL 102 H VAL 102 4.447 0.798 8.886 734 HA VAL 102 HA VAL 102 3.275 1.724 11.417 735 HB VAL 102 HB VAL 102 6.223 1.655 10.700 736 HG11 VAL 102 1HG1 VAL 102 5.695 3.476 12.212 737 HG12 VAL 102 2HG1 VAL 102 6.614 2.228 13.056 738 HG13 VAL 102 3HG1 VAL 102 4.872 2.361 13.302 739 HG21 VAL 102 3HG2 VAL 102 6.440 -0.117 12.394 740 HG22 VAL 102 1HG2 VAL 102 5.393 -0.610 11.064 741 HG23 VAL 102 2HG2 VAL 102 4.689 -0.119 12.604 742 H ASP 103 H ASP 103 2.872 3.884 11.571 743 HA ASP 103 HA ASP 103 3.661 5.627 9.431 744 HB2 ASP 103 2HB ASP 103 1.497 6.082 10.400 745 HB3 ASP 103 1HB ASP 103 2.154 6.038 12.030 746 H VAL 104 H VAL 104 5.591 6.323 9.384 747 HA VAL 104 HA VAL 104 7.174 6.329 11.830 748 HB VAL 104 HB VAL 104 9.157 6.307 10.324 749 HG11 VAL 104 1HG1 VAL 104 8.271 4.233 11.239 750 HG12 VAL 104 2HG1 VAL 104 8.879 3.970 9.603 751 HG13 VAL 104 3HG1 VAL 104 7.145 4.103 9.889 752 HG21 VAL 104 3HG2 VAL 104 8.158 7.355 8.351 753 HG22 VAL 104 1HG2 VAL 104 7.086 5.971 8.146 754 HG23 VAL 104 2HG2 VAL 104 8.824 5.775 7.937 755 H GLY 105 H GLY 105 5.392 8.466 10.311 756 HA2 GLY 105 2HA GLY 105 5.885 10.707 11.406 757 HA3 GLY 105 1HA GLY 105 7.398 10.593 10.516 758 H SER 106 H SER 106 4.042 9.870 9.674 759 HA SER 106 HA SER 106 4.148 10.879 7.087 760 HB2 SER 106 2HB SER 106 1.799 10.725 8.978 761 HB3 SER 106 1HB SER 106 1.697 10.904 7.226 762 HG SER 106 HG SER 106 2.893 8.748 8.621 763 H LEU 107 H LEU 107 4.172 12.890 6.326 764 HA LEU 107 HA LEU 107 4.440 15.117 8.043 765 HB2 LEU 107 2HB LEU 107 5.047 14.647 5.431 766 HB3 LEU 107 1HB LEU 107 3.600 15.602 5.246 767 HG LEU 107 HG LEU 107 6.130 16.479 6.644 768 HD11 LEU 107 1HD1 LEU 107 6.336 18.075 4.820 769 HD12 LEU 107 2HD1 LEU 107 4.918 17.369 4.046 770 HD13 LEU 107 3HD1 LEU 107 6.380 16.406 4.253 771 HD21 LEU 107 3HD2 LEU 107 5.080 18.696 6.793 772 HD22 LEU 107 1HD2 LEU 107 4.196 17.489 7.728 773 HD23 LEU 107 2HD2 LEU 107 3.576 18.017 6.166 774 H ASN 108 H ASN 108 1.796 14.149 5.859 775 HA ASN 108 HA ASN 108 0.086 15.968 7.301 776 HB2 ASN 108 2HB ASN 108 -1.688 15.244 5.548 777 HB3 ASN 108 1HB ASN 108 -0.375 16.288 5.043 778 HD21 ASN 108 1HD2 ASN 108 -0.714 15.652 2.918 779 HD22 ASN 108 2HD2 ASN 108 -0.127 14.163 2.317 780 H GLY 109 H GLY 109 0.122 12.467 6.610 781 HA2 GLY 109 2HA GLY 109 -0.235 11.505 9.043 782 HA3 GLY 109 1HA GLY 109 -1.823 12.199 8.776 783 H THR 110 H THR 110 -0.645 9.389 9.074 784 HA THR 110 HA THR 110 -1.965 8.238 6.747 785 HB THR 110 HB THR 110 0.024 6.946 8.694 786 HG1 THR 110 1HG THR 110 1.225 7.996 7.230 787 HG21 THR 110 3HG2 THR 110 -0.133 4.954 7.269 788 HG22 THR 110 1HG2 THR 110 -1.382 5.730 6.295 789 HG23 THR 110 2HG2 THR 110 -1.707 5.322 7.977 790 H TYR 111 H TYR 111 -3.898 7.448 6.984 791 HA TYR 111 HA TYR 111 -4.960 7.017 9.711 792 HB2 TYR 111 2HB TYR 111 -6.448 8.148 7.332 793 HB3 TYR 111 1HB TYR 111 -7.086 7.913 8.952 794 HD1 TYR 111 1HD TYR 111 -6.385 9.408 10.775 795 HD2 TYR 111 2HD TYR 111 -5.080 10.026 6.779 796 HE1 TYR 111 1HE TYR 111 -5.704 11.698 11.351 797 HE2 TYR 111 2HE TYR 111 -4.397 12.310 7.347 798 HH TYR 111 HH TYR 111 -4.814 13.959 8.921 799 H VAL 112 H VAL 112 -6.130 5.191 9.952 800 HA VAL 112 HA VAL 112 -6.381 3.466 7.612 801 HB VAL 112 HB VAL 112 -6.632 2.827 10.571 802 HG11 VAL 112 1HG1 VAL 112 -6.594 0.475 9.866 803 HG12 VAL 112 2HG1 VAL 112 -6.570 0.979 8.175 804 HG13 VAL 112 3HG1 VAL 112 -7.980 1.322 9.175 805 HG21 VAL 112 3HG2 VAL 112 -4.493 1.787 10.374 806 HG22 VAL 112 1HG2 VAL 112 -4.375 3.457 9.850 807 HG23 VAL 112 2HG2 VAL 112 -4.409 2.161 8.646 808 H ASN 113 H ASN 113 -8.269 3.391 6.691 809 HA ASN 113 HA ASN 113 -10.354 3.762 6.134 810 HB2 ASN 113 2HB ASN 113 -10.847 2.242 8.139 811 HB3 ASN 113 1HB ASN 113 -11.135 3.708 9.069 812 HD21 ASN 113 1HD2 ASN 113 -12.280 1.618 6.619 813 HD22 ASN 113 2HD2 ASN 113 -13.850 2.273 6.420 814 H ARG 114 H ARG 114 -10.326 5.476 9.211 815 HA ARG 114 HA ARG 114 -9.772 7.989 7.900 816 HB2 ARG 114 2HB ARG 114 -12.313 7.615 7.747 817 HB3 ARG 114 1HB ARG 114 -12.339 7.825 9.493 818 HG2 ARG 114 2HG ARG 114 -11.313 10.048 9.202 819 HG3 ARG 114 1HG ARG 114 -11.419 9.837 7.457 820 HD2 ARG 114 2HD ARG 114 -13.266 11.157 8.165 821 HD3 ARG 114 1HD ARG 114 -13.872 9.565 7.713 822 HE ARG 114 HE ARG 114 -14.344 9.106 9.925 823 HH11 ARG 114 1HH1 ARG 114 -12.729 12.269 9.654 824 HH12 ARG 114 2HH1 ARG 114 -13.291 12.827 11.159 825 HH21 ARG 114 1HH2 ARG 114 -15.095 9.927 12.032 826 HH22 ARG 114 2HH2 ARG 114 -14.657 11.500 12.503 827 H GLU 115 H GLU 115 -9.060 5.972 10.313 828 HA GLU 115 HA GLU 115 -8.937 8.003 12.408 829 HB2 GLU 115 2HB GLU 115 -9.175 4.998 12.614 830 HB3 GLU 115 1HB GLU 115 -8.975 6.084 13.981 831 HG2 GLU 115 2HG GLU 115 -11.077 7.138 13.530 832 HG3 GLU 115 1HG GLU 115 -11.256 6.217 12.041 833 HA PRO 116 HA PRO 116 -4.578 7.518 11.783 834 HB2 PRO 116 2HB PRO 116 -3.708 8.778 14.034 835 HB3 PRO 116 1HB PRO 116 -4.301 9.641 12.612 836 HG2 PRO 116 2HG PRO 116 -5.699 9.015 15.170 837 HG3 PRO 116 1HG PRO 116 -5.762 10.493 14.191 838 HD2 PRO 116 2HD PRO 116 -7.709 8.589 14.178 839 HD3 PRO 116 1HD PRO 116 -7.353 9.627 12.781 840 H ARG 117 H ARG 117 -3.292 5.879 12.180 841 HA ARG 117 HA ARG 117 -3.408 4.559 14.797 842 HB2 ARG 117 2HB ARG 117 -2.925 3.267 12.091 843 HB3 ARG 117 1HB ARG 117 -2.748 2.458 13.632 844 HG2 ARG 117 2HG ARG 117 -5.332 3.512 12.473 845 HG3 ARG 117 1HG ARG 117 -4.805 1.832 12.476 846 HD2 ARG 117 2HD ARG 117 -4.750 2.004 15.001 847 HD3 ARG 117 1HD ARG 117 -5.580 3.551 14.801 848 HE ARG 117 HE ARG 117 -6.904 1.479 13.385 849 HH11 ARG 117 1HH1 ARG 117 -6.605 2.907 16.615 850 HH12 ARG 117 2HH1 ARG 117 -8.042 2.191 17.196 851 HH21 ARG 117 1HH2 ARG 117 -8.878 0.537 14.193 852 HH22 ARG 117 2HH2 ARG 117 -9.365 0.835 15.796 853 H ASN 118 H ASN 118 -1.406 4.017 15.596 854 HA ASN 118 HA ASN 118 0.816 5.546 14.561 855 HB2 ASN 118 2HB ASN 118 0.422 5.297 16.990 856 HB3 ASN 118 1HB ASN 118 0.614 3.562 16.839 857 HD21 ASN 118 1HD2 ASN 118 2.641 5.955 15.211 858 HD22 ASN 118 2HD2 ASN 118 4.066 5.551 16.075 859 H ALA 119 H ALA 119 -0.037 2.167 15.063 860 HA ALA 119 HA ALA 119 1.552 1.443 12.766 861 HB1 ALA 119 1HB ALA 119 2.340 -0.589 13.954 862 HB2 ALA 119 2HB ALA 119 1.599 0.023 15.433 863 HB3 ALA 119 3HB ALA 119 2.952 0.888 14.704 864 H GLN 120 H GLN 120 0.604 -0.235 11.660 865 HA GLN 120 HA GLN 120 -2.049 -1.038 12.587 866 HB2 GLN 120 2HB GLN 120 -2.046 0.882 10.925 867 HB3 GLN 120 1HB GLN 120 -1.285 -0.195 9.779 868 HG2 GLN 120 2HG GLN 120 -3.985 -0.759 10.990 869 HG3 GLN 120 1HG GLN 120 -3.768 0.202 9.544 870 HE21 GLN 120 1HE2 GLN 120 -5.178 -2.232 9.962 871 HE22 GLN 120 2HE2 GLN 120 -4.494 -3.407 8.901 872 H VAL 121 H VAL 121 -2.505 -3.138 12.035 873 HA VAL 121 HA VAL 121 -0.258 -4.577 10.857 874 HB VAL 121 HB VAL 121 -0.745 -5.379 13.112 875 HG11 VAL 121 1HG1 VAL 121 -2.846 -6.503 13.694 876 HG12 VAL 121 2HG1 VAL 121 -3.531 -5.993 12.151 877 HG13 VAL 121 3HG1 VAL 121 -3.062 -4.789 13.350 878 HG21 VAL 121 3HG2 VAL 121 0.064 -6.993 11.520 879 HG22 VAL 121 1HG2 VAL 121 -1.583 -7.355 11.017 880 HG23 VAL 121 2HG2 VAL 121 -1.053 -7.765 12.646 881 H MET 122 H MET 122 -0.449 -5.380 8.936 882 HA MET 122 HA MET 122 -2.307 -4.448 7.175 883 HB2 MET 122 2HB MET 122 -0.640 -6.946 6.876 884 HB3 MET 122 1HB MET 122 -1.516 -6.183 5.558 885 HG2 MET 122 2HG MET 122 -0.196 -4.124 5.897 886 HG3 MET 122 1HG MET 122 0.719 -4.946 7.157 887 HE1 MET 122 3HE MET 122 3.027 -4.406 5.978 888 HE2 MET 122 1HE MET 122 2.175 -3.527 4.708 889 HE3 MET 122 2HE MET 122 3.369 -4.751 4.282 890 H GLN 123 H GLN 123 -4.354 -4.700 6.875 891 HA GLN 123 HA GLN 123 -5.606 -7.125 7.915 892 HB2 GLN 123 2HB GLN 123 -5.895 -5.012 9.234 893 HB3 GLN 123 1HB GLN 123 -6.715 -4.326 7.845 894 HG2 GLN 123 2HG GLN 123 -8.471 -5.964 8.031 895 HG3 GLN 123 1HG GLN 123 -7.618 -6.761 9.353 896 HE21 GLN 123 1HE2 GLN 123 -10.216 -5.632 9.330 897 HE22 GLN 123 2HE2 GLN 123 -10.287 -4.410 10.538 898 H THR 124 H THR 124 -7.055 -8.104 6.617 899 HA THR 124 HA THR 124 -6.985 -7.377 3.875 900 HB THR 124 HB THR 124 -6.771 -9.700 4.595 901 HG1 THR 124 1HG THR 124 -8.812 -10.340 3.148 902 HG21 THR 124 3HG2 THR 124 -8.763 -11.009 5.288 903 HG22 THR 124 1HG2 THR 124 -9.697 -9.515 5.352 904 HG23 THR 124 2HG2 THR 124 -8.356 -9.762 6.467 905 H GLY 125 H GLY 125 -8.355 -6.205 2.790 906 HA2 GLY 125 2HA GLY 125 -10.376 -5.627 1.892 907 HA3 GLY 125 1HA GLY 125 -11.190 -6.478 3.196 908 H ASP 126 H ASP 126 -8.694 -4.052 3.651 909 HA ASP 126 HA ASP 126 -10.791 -2.200 4.422 910 HB2 ASP 126 2HB ASP 126 -9.871 -3.511 6.447 911 HB3 ASP 126 1HB ASP 126 -8.379 -2.609 6.196 912 H GLU 127 H GLU 127 -9.923 0.093 4.543 913 HA GLU 127 HA GLU 127 -7.612 0.225 2.792 914 HB2 GLU 127 2HB GLU 127 -8.627 2.191 1.662 915 HB3 GLU 127 1HB GLU 127 -9.465 0.674 1.398 916 HG2 GLU 127 2HG GLU 127 -11.119 1.341 3.098 917 HG3 GLU 127 1HG GLU 127 -10.300 2.895 3.238 918 H ILE 128 H ILE 128 -6.143 1.631 3.060 919 HA ILE 128 HA ILE 128 -6.179 3.221 5.526 920 HB ILE 128 HB ILE 128 -3.821 2.028 4.026 921 HG12 ILE 128 2HG1 ILE 128 -5.039 1.152 6.660 922 HG13 ILE 128 1HG1 ILE 128 -5.236 0.308 5.131 923 HG21 ILE 128 1HG2 ILE 128 -3.928 3.443 6.692 924 HG22 ILE 128 2HG2 ILE 128 -3.225 4.076 5.206 925 HG23 ILE 128 3HG2 ILE 128 -2.499 2.677 5.997 926 HD11 ILE 128 3HD1 ILE 128 -3.569 -0.764 6.542 927 HD12 ILE 128 1HD1 ILE 128 -2.638 0.733 6.601 928 HD13 ILE 128 2HD1 ILE 128 -2.828 -0.127 5.072 929 H GLN 129 H GLN 129 -5.910 5.364 5.251 930 HA GLN 129 HA GLN 129 -5.347 6.358 2.584 931 HB2 GLN 129 2HB GLN 129 -7.257 7.314 3.925 932 HB3 GLN 129 1HB GLN 129 -6.075 7.905 5.084 933 HG2 GLN 129 2HG GLN 129 -5.035 9.252 3.308 934 HG3 GLN 129 1HG GLN 129 -6.273 8.707 2.185 935 HE21 GLN 129 1HE2 GLN 129 -5.504 10.805 4.777 936 HE22 GLN 129 2HE2 GLN 129 -6.986 11.684 4.805 937 H ILE 130 H ILE 130 -3.334 6.544 2.158 938 HA ILE 130 HA ILE 130 -1.418 7.134 4.240 939 HB ILE 130 HB ILE 130 0.295 6.662 2.393 940 HG12 ILE 130 2HG1 ILE 130 -2.158 5.528 0.992 941 HG13 ILE 130 1HG1 ILE 130 -1.206 6.903 0.448 942 HG21 ILE 130 1HG2 ILE 130 -1.526 4.431 3.286 943 HG22 ILE 130 2HG2 ILE 130 -0.143 5.078 4.167 944 HG23 ILE 130 3HG2 ILE 130 0.104 4.223 2.643 945 HD11 ILE 130 3HD1 ILE 130 -0.695 4.897 -0.827 946 HD12 ILE 130 1HD1 ILE 130 -0.242 4.059 0.657 947 HD13 ILE 130 2HD1 ILE 130 0.709 5.433 0.097 948 H GLY 131 H GLY 131 -1.491 9.162 4.646 949 HA2 GLY 131 2HA GLY 131 -1.057 11.380 4.315 950 HA3 GLY 131 1HA GLY 131 -0.772 11.053 2.603 951 H LYS 132 H LYS 132 -2.303 11.420 1.214 952 HA LYS 132 HA LYS 132 -5.004 11.972 2.224 953 HB2 LYS 132 2HB LYS 132 -3.533 13.410 0.009 954 HB3 LYS 132 1HB LYS 132 -5.219 13.668 0.417 955 HG2 LYS 132 2HG LYS 132 -2.898 14.182 2.278 956 HG3 LYS 132 1HG LYS 132 -3.698 15.418 1.319 957 HD2 LYS 132 2HD LYS 132 -5.018 13.735 3.462 958 HD3 LYS 132 1HD LYS 132 -4.472 15.397 3.655 959 HE2 LYS 132 2HE LYS 132 -6.032 16.075 1.850 960 HE3 LYS 132 1HE LYS 132 -6.626 14.417 1.777 961 HZ1 LYS 132 3HZ LYS 132 -7.291 14.669 4.147 962 HZ2 LYS 132 1HZ LYS 132 -8.078 15.781 3.140 963 HZ3 LYS 132 2HZ LYS 132 -6.793 16.265 4.078 964 H PHE 133 H PHE 133 -3.327 9.748 0.665 965 HA PHE 133 HA PHE 133 -5.355 9.373 -1.400 966 HB2 PHE 133 2HB PHE 133 -2.445 8.571 -1.434 967 HB3 PHE 133 1HB PHE 133 -3.627 8.039 -2.632 968 HD1 PHE 133 2HD PHE 133 -5.187 10.247 -3.346 969 HD2 PHE 133 1HD PHE 133 -1.064 10.216 -2.289 970 HE1 PHE 133 2HE PHE 133 -4.859 12.323 -4.601 971 HE2 PHE 133 1HE PHE 133 -0.738 12.302 -3.555 972 HZ PHE 133 HZ PHE 133 -2.627 13.353 -4.708 973 H ARG 134 H ARG 134 -5.905 7.107 -1.891 974 HA ARG 134 HA ARG 134 -5.932 5.721 0.693 975 HB2 ARG 134 2HB ARG 134 -8.216 5.818 -1.280 976 HB3 ARG 134 1HB ARG 134 -8.233 5.023 0.290 977 HG2 ARG 134 2HG ARG 134 -7.835 7.221 1.368 978 HG3 ARG 134 1HG ARG 134 -7.951 7.980 -0.215 979 HD2 ARG 134 2HD ARG 134 -10.053 8.238 0.903 980 HD3 ARG 134 1HD ARG 134 -10.266 7.061 -0.389 981 HE ARG 134 HE ARG 134 -10.545 5.374 1.186 982 HH11 ARG 134 1HH1 ARG 134 -9.783 8.445 2.835 983 HH12 ARG 134 2HH1 ARG 134 -10.357 7.905 4.345 984 HH21 ARG 134 1HH2 ARG 134 -11.341 4.707 3.206 985 HH22 ARG 134 2HH2 ARG 134 -11.241 5.747 4.571 986 H LEU 135 H LEU 135 -5.373 3.754 0.830 987 HA LEU 135 HA LEU 135 -4.808 2.155 -1.582 988 HB2 LEU 135 2HB LEU 135 -2.841 3.017 -0.377 989 HB3 LEU 135 1HB LEU 135 -3.456 2.349 1.112 990 HG LEU 135 HG LEU 135 -3.217 0.072 0.065 991 HD11 LEU 135 1HD1 LEU 135 -3.177 0.813 -2.264 992 HD12 LEU 135 2HD1 LEU 135 -1.765 -0.142 -1.845 993 HD13 LEU 135 3HD1 LEU 135 -1.629 1.613 -1.970 994 HD21 LEU 135 3HD2 LEU 135 -0.829 -0.020 0.466 995 HD22 LEU 135 1HD2 LEU 135 -1.627 0.974 1.678 996 HD23 LEU 135 2HD2 LEU 135 -0.723 1.739 0.372 997 H VAL 136 H VAL 136 -5.800 0.087 -1.517 998 HA VAL 136 HA VAL 136 -7.100 -0.595 1.003 999 HB VAL 136 HB VAL 136 -8.730 -0.226 -0.827 1000 HG11 VAL 136 1HG1 VAL 136 -7.413 -0.782 -2.756 1001 HG12 VAL 136 2HG1 VAL 136 -8.894 -1.744 -2.739 1002 HG13 VAL 136 3HG1 VAL 136 -7.361 -2.475 -2.264 1003 HG21 VAL 136 3HG2 VAL 136 -9.331 -1.823 0.897 1004 HG22 VAL 136 1HG2 VAL 136 -8.543 -3.120 -0.001 1005 HG23 VAL 136 2HG2 VAL 136 -9.982 -2.339 -0.659 1006 H PHE 137 H PHE 137 -6.636 -2.502 1.942 1007 HA PHE 137 HA PHE 137 -4.462 -3.981 0.640 1008 HB2 PHE 137 2HB PHE 137 -3.917 -2.766 2.792 1009 HB3 PHE 137 1HB PHE 137 -5.021 -3.875 3.604 1010 HD1 PHE 137 1HD PHE 137 -4.449 -6.230 3.871 1011 HD2 PHE 137 2HD PHE 137 -1.837 -3.511 1.924 1012 HE1 PHE 137 1HE PHE 137 -2.649 -7.891 3.985 1013 HE2 PHE 137 2HE PHE 137 -0.026 -5.163 2.030 1014 HZ PHE 137 HZ PHE 137 -0.430 -7.348 3.059 1015 H LEU 138 H LEU 138 -4.696 -6.102 0.228 1016 HA LEU 138 HA LEU 138 -6.918 -7.471 1.547 1017 HB2 LEU 138 2HB LEU 138 -6.064 -7.821 -1.330 1018 HB3 LEU 138 1HB LEU 138 -7.210 -8.848 -0.505 1019 HG LEU 138 HG LEU 138 -8.595 -6.690 -0.187 1020 HD11 LEU 138 1HD1 LEU 138 -6.897 -5.088 -0.854 1021 HD12 LEU 138 2HD1 LEU 138 -8.317 -4.987 -1.888 1022 HD13 LEU 138 3HD1 LEU 138 -6.856 -5.788 -2.473 1023 HD21 LEU 138 3HD2 LEU 138 -9.644 -6.993 -2.350 1024 HD22 LEU 138 1HD2 LEU 138 -9.249 -8.537 -1.597 1025 HD23 LEU 138 2HD2 LEU 138 -8.243 -7.909 -2.908 1026 H ALA 139 H ALA 139 -6.352 -9.253 2.601 1027 HA ALA 139 HA ALA 139 -3.596 -10.087 2.238 1028 HB1 ALA 139 1HB ALA 139 -3.601 -11.032 4.407 1029 HB2 ALA 139 2HB ALA 139 -5.338 -10.968 4.519 1030 HB3 ALA 139 3HB ALA 139 -4.403 -9.462 4.565 1031 H GLY 140 H GLY 140 -3.939 -11.158 0.381 1032 HA2 GLY 140 2HA GLY 140 -5.071 -13.836 0.798 1033 HA3 GLY 140 1HA GLY 140 -5.242 -12.966 -0.730 1034 HA PRO 141 HA PRO 141 -0.560 -14.319 0.341 1035 HB2 PRO 141 2HB PRO 141 -1.360 -17.097 0.498 1036 HB3 PRO 141 1HB PRO 141 -0.101 -16.254 1.394 1037 HG2 PRO 141 2HG PRO 141 -2.450 -16.912 2.594 1038 HG3 PRO 141 1HG PRO 141 -1.554 -15.443 3.011 1039 HD2 PRO 141 2HD PRO 141 -4.059 -15.752 1.467 1040 HD3 PRO 141 1HD PRO 141 -3.467 -14.364 2.393 1041 H ALA 142 H ALA 142 0.139 -14.182 -1.497 1042 HA ALA 142 HA ALA 142 -0.723 -15.958 -3.674 1043 HB1 ALA 142 1HB ALA 142 0.037 -14.258 -5.245 1044 HB2 ALA 142 2HB ALA 142 0.606 -13.258 -3.913 1045 HB3 ALA 142 3HB ALA 142 -1.121 -13.561 -4.109 1046 H GLU 143 H GLU 143 0.608 -17.613 -3.717 1047 HA GLU 143 HA GLU 143 3.468 -17.066 -3.783 1048 HB2 GLU 143 2HB GLU 143 2.658 -18.302 -1.703 1049 HB3 GLU 143 1HB GLU 143 2.080 -19.572 -2.752 1050 HG2 GLU 143 2HG GLU 143 4.976 -18.792 -2.729 1051 HG3 GLU 143 1HG GLU 143 4.318 -19.875 -1.511 Start of MODEL 11 1 H1 MET 1 1HT MET 1 17.929 -11.433 41.940 2 H2 MET 1 2HT MET 1 18.453 -11.087 43.483 3 H3 MET 1 3HT MET 1 16.836 -11.463 43.207 4 HA MET 1 HA MET 1 19.202 -13.220 42.796 5 HB2 MET 1 2HB MET 1 16.928 -13.441 44.803 6 HB3 MET 1 1HB MET 1 18.209 -14.620 44.603 7 HG2 MET 1 2HG MET 1 19.850 -12.996 45.334 8 HG3 MET 1 1HG MET 1 18.600 -11.760 45.446 9 HE1 MET 1 2HE MET 1 19.478 -12.382 49.197 10 HE2 MET 1 3HE MET 1 19.320 -11.187 47.911 11 HE3 MET 1 1HE MET 1 20.597 -12.404 47.832 12 H SER 2 H SER 2 15.796 -14.088 43.424 13 HA SER 2 HA SER 2 15.741 -15.493 40.918 14 HB2 SER 2 2HB SER 2 14.588 -16.381 42.980 15 HB3 SER 2 1HB SER 2 13.509 -14.996 42.936 16 HG SER 2 HG SER 2 13.614 -16.275 40.554 17 H ASP 3 H ASP 3 14.652 -12.536 42.357 18 HA ASP 3 HA ASP 3 13.069 -11.561 40.217 19 HB2 ASP 3 2HB ASP 3 13.216 -9.432 41.361 20 HB3 ASP 3 1HB ASP 3 13.021 -10.688 42.578 21 H ASN 4 H ASN 4 13.719 -10.124 38.619 22 HA ASN 4 HA ASN 4 16.557 -10.191 38.020 23 HB2 ASN 4 2HB ASN 4 15.935 -9.398 35.772 24 HB3 ASN 4 1HB ASN 4 15.055 -10.857 36.194 25 HD21 ASN 4 1HD2 ASN 4 14.846 -7.529 35.372 26 HD22 ASN 4 2HD2 ASN 4 13.137 -7.425 35.285 27 H ASN 5 H ASN 5 17.833 -8.504 38.285 28 HA ASN 5 HA ASN 5 16.747 -5.829 38.375 29 HB2 ASN 5 2HB ASN 5 17.779 -5.255 40.541 30 HB3 ASN 5 1HB ASN 5 16.549 -6.493 40.732 31 HD21 ASN 5 1HD2 ASN 5 17.130 -8.468 41.483 32 HD22 ASN 5 2HD2 ASN 5 18.715 -8.858 42.037 33 H GLY 6 H GLY 6 18.538 -4.190 38.599 34 HA2 GLY 6 2HA GLY 6 21.197 -4.592 38.412 35 HA3 GLY 6 1HA GLY 6 20.616 -4.892 36.776 36 H THR 7 H THR 7 22.248 -2.878 36.858 37 HA THR 7 HA THR 7 20.800 -0.464 37.417 38 HB THR 7 HB THR 7 23.094 0.504 36.681 39 HG1 THR 7 1HG THR 7 24.188 -1.157 35.806 40 HG21 THR 7 3HG2 THR 7 24.045 0.074 38.912 41 HG22 THR 7 1HG2 THR 7 22.889 -1.237 39.151 42 HG23 THR 7 2HG2 THR 7 22.320 0.425 39.024 43 HA PRO 8 HA PRO 8 19.630 -0.187 33.066 44 HB2 PRO 8 2HB PRO 8 18.793 2.449 33.202 45 HB3 PRO 8 1HB PRO 8 17.776 1.064 33.619 46 HG2 PRO 8 2HG PRO 8 19.294 2.911 35.399 47 HG3 PRO 8 1HG PRO 8 17.707 2.167 35.648 48 HD2 PRO 8 2HD PRO 8 19.947 1.291 36.858 49 HD3 PRO 8 1HD PRO 8 18.617 0.205 36.419 50 H GLU 9 H GLU 9 20.909 0.318 31.408 51 HA GLU 9 HA GLU 9 23.309 1.800 32.011 52 HB2 GLU 9 2HB GLU 9 24.091 0.912 29.800 53 HB3 GLU 9 1HB GLU 9 23.673 -0.314 30.984 54 HG2 GLU 9 2HG GLU 9 21.507 -0.617 29.892 55 HG3 GLU 9 1HG GLU 9 21.960 0.590 28.686 56 HA PRO 10 HA PRO 10 21.880 5.516 30.029 57 HB2 PRO 10 2HB PRO 10 24.348 6.695 29.731 58 HB3 PRO 10 1HB PRO 10 23.429 6.725 31.234 59 HG2 PRO 10 2HG PRO 10 25.691 4.956 30.428 60 HG3 PRO 10 1HG PRO 10 25.358 5.702 32.002 61 HD2 PRO 10 2HD PRO 10 24.841 3.108 31.495 62 HD3 PRO 10 1HD PRO 10 23.828 4.075 32.588 63 H GLN 11 H GLN 11 21.753 6.298 27.977 64 HA GLN 11 HA GLN 11 22.208 4.600 25.838 65 HB2 GLN 11 2HB GLN 11 21.594 7.534 25.942 66 HB3 GLN 11 1HB GLN 11 21.702 6.631 24.443 67 HG2 GLN 11 2HG GLN 11 19.813 5.951 26.680 68 HG3 GLN 11 1HG GLN 11 19.399 6.973 25.304 69 HE21 GLN 11 1HE2 GLN 11 17.824 5.598 24.569 70 HE22 GLN 11 2HE2 GLN 11 18.178 4.061 23.857 71 H VAL 12 H VAL 12 23.878 4.191 24.662 72 HA VAL 12 HA VAL 12 26.258 5.704 24.840 73 HB VAL 12 HB VAL 12 27.057 4.196 22.938 74 HG11 VAL 12 1HG1 VAL 12 26.006 2.920 25.457 75 HG12 VAL 12 2HG1 VAL 12 27.585 3.681 25.247 76 HG13 VAL 12 3HG1 VAL 12 27.204 2.191 24.391 77 HG21 VAL 12 3HG2 VAL 12 24.873 3.634 21.971 78 HG22 VAL 12 1HG2 VAL 12 24.418 2.801 23.458 79 HG23 VAL 12 2HG2 VAL 12 25.731 2.176 22.463 80 H GLU 13 H GLU 13 25.460 7.684 24.366 81 HA GLU 13 HA GLU 13 24.400 8.229 21.749 82 HB2 GLU 13 2HB GLU 13 23.368 9.235 23.715 83 HB3 GLU 13 1HB GLU 13 24.891 10.018 24.107 84 HG2 GLU 13 2HG GLU 13 24.765 11.348 22.084 85 HG3 GLU 13 1HG GLU 13 23.274 10.534 21.620 86 H THR 14 H THR 14 25.592 8.751 20.161 87 HA THR 14 HA THR 14 27.731 10.573 20.521 88 HB THR 14 HB THR 14 28.963 8.484 20.622 89 HG1 THR 14 1HG THR 14 29.957 10.094 19.444 90 HG21 THR 14 3HG2 THR 14 27.668 7.715 17.997 91 HG22 THR 14 1HG2 THR 14 27.343 6.974 19.564 92 HG23 THR 14 2HG2 THR 14 28.929 6.796 18.821 93 H THR 15 H THR 15 26.510 12.075 19.587 94 HA THR 15 HA THR 15 25.273 11.536 17.040 95 HB THR 15 HB THR 15 25.142 14.038 18.745 96 HG1 THR 15 1HG THR 15 23.912 11.575 18.925 97 HG21 THR 15 3HG2 THR 15 23.414 13.031 16.467 98 HG22 THR 15 1HG2 THR 15 24.545 14.378 16.382 99 HG23 THR 15 2HG2 THR 15 23.111 14.492 17.402 100 H SER 16 H SER 16 26.679 11.660 15.454 101 HA SER 16 HA SER 16 28.924 13.338 15.369 102 HB2 SER 16 2HB SER 16 27.482 11.815 13.191 103 HB3 SER 16 1HB SER 16 29.125 12.450 13.110 104 HG SER 16 HG SER 16 29.632 10.585 13.823 105 H VAL 17 H VAL 17 28.729 15.452 15.115 106 HA VAL 17 HA VAL 17 26.410 16.727 14.157 107 HB VAL 17 HB VAL 17 27.727 18.852 14.177 108 HG11 VAL 17 1HG1 VAL 17 26.589 18.117 16.184 109 HG12 VAL 17 2HG1 VAL 17 28.114 18.899 16.600 110 HG13 VAL 17 3HG1 VAL 17 27.985 17.141 16.634 111 HG21 VAL 17 3HG2 VAL 17 30.009 17.079 15.070 112 HG22 VAL 17 1HG2 VAL 17 30.014 18.841 15.087 113 HG23 VAL 17 2HG2 VAL 17 29.924 17.972 13.555 114 H PHE 18 H PHE 18 25.855 17.445 12.312 115 HA PHE 18 HA PHE 18 27.320 16.490 9.995 116 HB2 PHE 18 2HB PHE 18 24.866 16.081 10.222 117 HB3 PHE 18 1HB PHE 18 24.603 17.817 10.116 118 HD1 PHE 18 2HD PHE 18 25.865 14.872 8.270 119 HD2 PHE 18 1HD PHE 18 24.462 18.887 8.012 120 HE1 PHE 18 2HE PHE 18 25.755 14.671 5.820 121 HE2 PHE 18 1HE PHE 18 24.348 18.690 5.566 122 HZ PHE 18 HZ PHE 18 24.994 16.580 4.466 123 H ARG 19 H ARG 19 28.422 17.708 8.672 124 HA ARG 19 HA ARG 19 28.797 20.504 9.302 125 HB2 ARG 19 2HB ARG 19 30.289 18.485 7.697 126 HB3 ARG 19 1HB ARG 19 30.593 20.194 7.459 127 HG2 ARG 19 2HG ARG 19 30.822 18.786 10.113 128 HG3 ARG 19 1HG ARG 19 32.178 19.103 9.027 129 HD2 ARG 19 2HD ARG 19 30.425 21.130 10.420 130 HD3 ARG 19 1HD ARG 19 32.155 20.851 10.634 131 HE ARG 19 HE ARG 19 32.047 21.427 8.046 132 HH11 ARG 19 1HH1 ARG 19 30.803 23.158 10.864 133 HH12 ARG 19 2HH1 ARG 19 30.686 24.654 10.103 134 HH21 ARG 19 1HH2 ARG 19 31.949 23.433 6.971 135 HH22 ARG 19 2HH2 ARG 19 31.388 24.834 7.749 136 H ALA 20 H ALA 20 28.490 22.187 7.966 137 HA ALA 20 HA ALA 20 26.615 21.949 5.811 138 HB1 ALA 20 1HB ALA 20 28.211 24.321 6.768 139 HB2 ALA 20 2HB ALA 20 26.597 23.864 7.316 140 HB3 ALA 20 3HB ALA 20 26.851 24.375 5.646 141 H ASP 21 H ASP 21 29.519 20.898 5.688 142 HA ASP 21 HA ASP 21 30.461 22.222 3.285 143 HB2 ASP 21 2HB ASP 21 31.557 19.779 4.715 144 HB3 ASP 21 1HB ASP 21 32.343 20.667 3.415 145 H LEU 22 H LEU 22 28.469 19.723 4.317 146 HA LEU 22 HA LEU 22 27.243 18.164 3.406 147 HB2 LEU 22 2HB LEU 22 27.752 19.711 0.880 148 HB3 LEU 22 1HB LEU 22 26.857 18.216 0.840 149 HG LEU 22 HG LEU 22 25.332 20.061 0.811 150 HD11 LEU 22 1HD1 LEU 22 24.589 18.106 1.986 151 HD12 LEU 22 2HD1 LEU 22 23.914 19.570 2.696 152 HD13 LEU 22 3HD1 LEU 22 25.238 18.738 3.502 153 HD21 LEU 22 3HD2 LEU 22 25.140 21.664 2.666 154 HD22 LEU 22 1HD2 LEU 22 26.693 21.791 1.837 155 HD23 LEU 22 2HD2 LEU 22 26.588 20.971 3.395 156 H LEU 23 H LEU 23 28.852 16.823 4.191 157 HA LEU 23 HA LEU 23 30.020 15.211 2.043 158 HB2 LEU 23 2HB LEU 23 31.593 16.307 3.790 159 HB3 LEU 23 1HB LEU 23 30.846 15.265 4.968 160 HG LEU 23 HG LEU 23 32.430 14.274 2.580 161 HD11 LEU 23 1HD1 LEU 23 33.254 14.584 5.456 162 HD12 LEU 23 2HD1 LEU 23 33.853 15.513 4.082 163 HD13 LEU 23 3HD1 LEU 23 34.197 13.788 4.197 164 HD21 LEU 23 3HD2 LEU 23 31.473 12.810 5.056 165 HD22 LEU 23 1HD2 LEU 23 32.488 12.132 3.782 166 HD23 LEU 23 2HD2 LEU 23 30.829 12.607 3.426 167 H LYS 24 H LYS 24 28.768 13.504 1.742 168 HA LYS 24 HA LYS 24 27.125 12.650 3.971 169 HB2 LYS 24 2HB LYS 24 25.683 11.471 2.208 170 HB3 LYS 24 1HB LYS 24 25.574 13.210 2.297 171 HG2 LYS 24 2HG LYS 24 27.301 11.820 0.248 172 HG3 LYS 24 1HG LYS 24 25.586 12.120 -0.022 173 HD2 LYS 24 2HD LYS 24 26.017 14.557 0.357 174 HD3 LYS 24 1HD LYS 24 27.737 14.215 0.462 175 HE2 LYS 24 2HE LYS 24 25.956 13.734 -1.929 176 HE3 LYS 24 1HE LYS 24 27.123 15.033 -1.749 177 HZ1 LYS 24 3HZ LYS 24 27.696 12.130 -2.030 178 HZ2 LYS 24 1HZ LYS 24 28.881 13.273 -1.617 179 HZ3 LYS 24 2HZ LYS 24 28.092 13.382 -3.070 180 H GLU 25 H GLU 25 28.110 11.236 5.046 181 HA GLU 25 HA GLU 25 30.063 9.492 4.169 182 HB2 GLU 25 2HB GLU 25 29.639 8.233 6.279 183 HB3 GLU 25 1HB GLU 25 29.854 9.961 6.507 184 HG2 GLU 25 2HG GLU 25 27.481 10.266 6.788 185 HG3 GLU 25 1HG GLU 25 27.186 8.571 6.407 186 H MET 26 H MET 26 29.991 7.806 2.916 187 HA MET 26 HA MET 26 27.472 6.429 2.538 188 HB2 MET 26 2HB MET 26 30.089 6.225 1.056 189 HB3 MET 26 1HB MET 26 28.738 5.141 0.761 190 HG2 MET 26 2HG MET 26 27.340 7.062 0.183 191 HG3 MET 26 1HG MET 26 28.719 8.129 0.421 192 HE1 MET 26 3HE MET 26 28.258 8.149 -3.455 193 HE2 MET 26 1HE MET 26 28.365 9.126 -1.991 194 HE3 MET 26 2HE MET 26 26.983 8.060 -2.238 195 H GLU 27 H GLU 27 29.906 6.313 4.595 196 HA GLU 27 HA GLU 27 30.374 3.547 4.879 197 HB2 GLU 27 2HB GLU 27 30.697 5.894 6.749 198 HB3 GLU 27 1HB GLU 27 31.020 4.250 7.272 199 HG2 GLU 27 2HG GLU 27 33.059 5.473 6.625 200 HG3 GLU 27 1HG GLU 27 32.794 4.024 5.666 201 H SER 28 H SER 28 29.471 2.128 6.433 202 HA SER 28 HA SER 28 26.668 2.386 6.427 203 HB2 SER 28 2HB SER 28 27.986 0.236 6.159 204 HB3 SER 28 1HB SER 28 28.273 0.287 7.896 205 HG SER 28 HG SER 28 25.755 0.197 6.585 206 H SER 29 H SER 29 25.455 1.737 8.518 207 HA SER 29 HA SER 29 25.601 4.016 10.117 208 HB2 SER 29 2HB SER 29 23.736 2.855 11.351 209 HB3 SER 29 1HB SER 29 23.479 3.106 9.621 210 HG SER 29 HG SER 29 24.648 0.725 10.534 211 H THR 30 H THR 30 26.187 4.287 12.214 212 HA THR 30 HA THR 30 27.221 1.994 13.610 213 HB THR 30 HB THR 30 29.204 3.043 12.661 214 HG1 THR 30 1HG THR 30 29.600 2.270 14.628 215 HG21 THR 30 3HG2 THR 30 29.877 5.361 13.190 216 HG22 THR 30 1HG2 THR 30 28.342 5.607 14.027 217 HG23 THR 30 2HG2 THR 30 28.363 5.324 12.287 218 H GLY 31 H GLY 31 26.058 1.789 15.334 219 HA2 GLY 31 2HA GLY 31 25.683 2.909 17.549 220 HA3 GLY 31 1HA GLY 31 24.928 4.186 16.594 221 H THR 32 H THR 32 23.363 3.089 14.868 222 HA THR 32 HA THR 32 21.401 1.697 16.489 223 HB THR 32 HB THR 32 21.151 2.722 13.652 224 HG1 THR 32 1HG THR 32 21.340 4.625 14.566 225 HG21 THR 32 3HG2 THR 32 18.747 2.834 14.193 226 HG22 THR 32 1HG2 THR 32 19.086 2.238 15.818 227 HG23 THR 32 2HG2 THR 32 19.357 1.192 14.424 228 H ALA 33 H ALA 33 20.748 -0.365 16.067 229 HA ALA 33 HA ALA 33 22.411 -1.966 14.309 230 HB1 ALA 33 1HB ALA 33 22.017 -2.779 16.580 231 HB2 ALA 33 2HB ALA 33 21.311 -3.882 15.398 232 HB3 ALA 33 3HB ALA 33 20.278 -2.769 16.292 233 HA PRO 34 HA PRO 34 19.176 -1.647 11.159 234 HB2 PRO 34 2HB PRO 34 20.848 -3.672 9.815 235 HB3 PRO 34 1HB PRO 34 20.344 -2.085 9.238 236 HG2 PRO 34 2HG PRO 34 22.873 -2.557 9.967 237 HG3 PRO 34 1HG PRO 34 22.098 -1.001 10.300 238 HD2 PRO 34 2HD PRO 34 22.606 -3.294 12.155 239 HD3 PRO 34 1HD PRO 34 22.759 -1.541 12.422 240 H ALA 35 H ALA 35 17.352 -2.753 11.448 241 HA ALA 35 HA ALA 35 17.477 -5.570 12.147 242 HB1 ALA 35 1HB ALA 35 15.112 -3.696 12.046 243 HB2 ALA 35 2HB ALA 35 16.028 -4.104 13.497 244 HB3 ALA 35 3HB ALA 35 15.094 -5.348 12.662 245 H SER 36 H SER 36 17.816 -6.715 10.387 246 HA SER 36 HA SER 36 16.320 -6.145 7.938 247 HB2 SER 36 2HB SER 36 18.611 -8.060 8.395 248 HB3 SER 36 1HB SER 36 17.994 -7.496 6.843 249 HG SER 36 HG SER 36 18.688 -5.418 7.371 250 H THR 37 H THR 37 15.460 -8.129 6.804 251 HA THR 37 HA THR 37 15.102 -10.498 8.314 252 HB THR 37 HB THR 37 13.313 -9.089 9.314 253 HG1 THR 37 1HG THR 37 11.755 -10.532 9.203 254 HG21 THR 37 3HG2 THR 37 12.167 -8.922 6.524 255 HG22 THR 37 1HG2 THR 37 12.888 -7.581 7.421 256 HG23 THR 37 2HG2 THR 37 11.395 -8.329 7.993 257 H GLY 38 H GLY 38 13.209 -11.762 6.801 258 HA2 GLY 38 2HA GLY 38 14.054 -11.317 4.047 259 HA3 GLY 38 1HA GLY 38 14.389 -12.880 4.781 260 H ALA 39 H ALA 39 12.188 -11.030 3.134 261 HA ALA 39 HA ALA 39 9.805 -12.412 3.921 262 HB1 ALA 39 1HB ALA 39 9.729 -10.125 3.012 263 HB2 ALA 39 2HB ALA 39 8.735 -11.237 2.074 264 HB3 ALA 39 3HB ALA 39 10.310 -10.731 1.461 265 H GLU 40 H GLU 40 12.238 -12.747 1.440 266 HA GLU 40 HA GLU 40 10.850 -14.747 -0.089 267 HB2 GLU 40 2HB GLU 40 12.910 -15.039 -1.306 268 HB3 GLU 40 1HB GLU 40 12.628 -13.319 -1.070 269 HG2 GLU 40 2HG GLU 40 14.266 -13.289 0.737 270 HG3 GLU 40 1HG GLU 40 14.504 -15.020 0.553 271 H ASN 41 H ASN 41 12.393 -14.765 2.823 272 HA ASN 41 HA ASN 41 13.520 -17.404 2.797 273 HB2 ASN 41 2HB ASN 41 14.443 -15.690 4.253 274 HB3 ASN 41 1HB ASN 41 12.893 -15.472 5.037 275 HD21 ASN 41 1HD2 ASN 41 15.625 -17.603 4.683 276 HD22 ASN 41 2HD2 ASN 41 15.320 -18.530 6.109 277 H LEU 42 H LEU 42 10.474 -15.956 3.450 278 HA LEU 42 HA LEU 42 9.469 -18.400 4.630 279 HB2 LEU 42 2HB LEU 42 8.347 -15.619 4.454 280 HB3 LEU 42 1HB LEU 42 7.539 -16.977 5.205 281 HG LEU 42 HG LEU 42 10.157 -15.782 6.129 282 HD11 LEU 42 1HD1 LEU 42 8.872 -14.940 8.016 283 HD12 LEU 42 2HD1 LEU 42 7.394 -15.567 7.290 284 HD13 LEU 42 3HD1 LEU 42 8.289 -14.272 6.492 285 HD21 LEU 42 3HD2 LEU 42 9.818 -17.191 8.126 286 HD22 LEU 42 1HD2 LEU 42 9.999 -18.159 6.661 287 HD23 LEU 42 2HD2 LEU 42 8.400 -17.908 7.359 288 HA PRO 43 HA PRO 43 7.282 -19.342 0.819 289 HB2 PRO 43 2HB PRO 43 5.105 -20.290 2.603 290 HB3 PRO 43 1HB PRO 43 5.978 -21.172 1.341 291 HG2 PRO 43 2HG PRO 43 6.435 -21.671 3.903 292 HG3 PRO 43 1HG PRO 43 7.768 -21.637 2.736 293 HD2 PRO 43 2HD PRO 43 6.942 -19.551 4.721 294 HD3 PRO 43 1HD PRO 43 8.565 -20.121 4.276 295 H ALA 44 H ALA 44 5.276 -18.842 -0.261 296 HA ALA 44 HA ALA 44 4.597 -16.204 -0.269 297 HB1 ALA 44 1HB ALA 44 2.774 -16.745 -1.735 298 HB2 ALA 44 2HB ALA 44 2.770 -18.408 -1.160 299 HB3 ALA 44 3HB ALA 44 4.141 -17.807 -2.096 300 H GLY 45 H GLY 45 3.894 -15.119 1.323 301 HA2 GLY 45 2HA GLY 45 1.238 -15.622 2.376 302 HA3 GLY 45 1HA GLY 45 2.565 -15.470 3.539 303 H SER 46 H SER 46 1.907 -13.954 0.503 304 HA SER 46 HA SER 46 2.776 -11.409 1.568 305 HB2 SER 46 2HB SER 46 2.066 -12.249 -1.239 306 HB3 SER 46 1HB SER 46 2.885 -10.760 -0.756 307 HG SER 46 HG SER 46 4.660 -11.801 -0.737 308 H ALA 47 H ALA 47 1.536 -9.488 0.826 309 HA ALA 47 HA ALA 47 -1.350 -9.943 0.683 310 HB1 ALA 47 1HB ALA 47 -1.617 -7.910 2.077 311 HB2 ALA 47 2HB ALA 47 0.134 -7.832 2.267 312 HB3 ALA 47 3HB ALA 47 -0.767 -9.190 2.943 313 H LEU 48 H LEU 48 -2.349 -7.737 -0.180 314 HA LEU 48 HA LEU 48 -0.424 -6.519 -1.977 315 HB2 LEU 48 2HB LEU 48 -1.804 -6.630 -3.926 316 HB3 LEU 48 1HB LEU 48 -1.579 -8.246 -3.314 317 HG LEU 48 HG LEU 48 -4.108 -6.664 -2.830 318 HD11 LEU 48 1HD1 LEU 48 -5.067 -7.952 -4.684 319 HD12 LEU 48 2HD1 LEU 48 -3.472 -8.628 -5.023 320 HD13 LEU 48 3HD1 LEU 48 -3.761 -6.901 -5.227 321 HD21 LEU 48 3HD2 LEU 48 -3.501 -9.619 -2.733 322 HD22 LEU 48 1HD2 LEU 48 -5.070 -8.871 -2.440 323 HD23 LEU 48 2HD2 LEU 48 -3.730 -8.571 -1.333 324 H LEU 49 H LEU 49 -0.800 -4.497 -2.557 325 HA LEU 49 HA LEU 49 -2.976 -3.191 -1.130 326 HB2 LEU 49 2HB LEU 49 -1.547 -1.129 -1.218 327 HB3 LEU 49 1HB LEU 49 -0.912 -2.407 -0.207 328 HG LEU 49 HG LEU 49 0.583 -2.932 -2.287 329 HD11 LEU 49 1HD1 LEU 49 -0.487 -1.470 -3.881 330 HD12 LEU 49 2HD1 LEU 49 1.183 -0.960 -3.608 331 HD13 LEU 49 3HD1 LEU 49 -0.144 -0.070 -2.866 332 HD21 LEU 49 3HD2 LEU 49 1.030 -0.495 -0.571 333 HD22 LEU 49 1HD2 LEU 49 2.275 -1.354 -1.476 334 HD23 LEU 49 2HD2 LEU 49 1.435 -2.157 -0.151 335 H VAL 50 H VAL 50 -4.427 -2.076 -2.274 336 HA VAL 50 HA VAL 50 -3.926 -1.799 -5.160 337 HB VAL 50 HB VAL 50 -6.609 -2.076 -3.759 338 HG11 VAL 50 1HG1 VAL 50 -5.923 -2.043 -6.698 339 HG12 VAL 50 2HG1 VAL 50 -6.764 -0.782 -5.801 340 HG13 VAL 50 3HG1 VAL 50 -7.522 -2.357 -6.024 341 HG21 VAL 50 3HG2 VAL 50 -5.117 -4.127 -5.400 342 HG22 VAL 50 1HG2 VAL 50 -6.749 -4.311 -4.762 343 HG23 VAL 50 2HG2 VAL 50 -5.380 -4.189 -3.658 344 H VAL 51 H VAL 51 -3.548 0.247 -5.625 345 HA VAL 51 HA VAL 51 -4.650 2.320 -3.892 346 HB VAL 51 HB VAL 51 -2.638 2.610 -6.140 347 HG11 VAL 51 1HG1 VAL 51 -3.365 4.463 -3.879 348 HG12 VAL 51 2HG1 VAL 51 -3.790 4.676 -5.576 349 HG13 VAL 51 3HG1 VAL 51 -2.098 4.745 -5.074 350 HG21 VAL 51 3HG2 VAL 51 -1.694 1.160 -4.456 351 HG22 VAL 51 1HG2 VAL 51 -2.167 2.288 -3.183 352 HG23 VAL 51 2HG2 VAL 51 -0.930 2.749 -4.350 353 H LYS 52 H LYS 52 -6.494 3.161 -4.457 354 HA LYS 52 HA LYS 52 -7.454 2.885 -7.181 355 HB2 LYS 52 2HB LYS 52 -8.786 4.001 -4.708 356 HB3 LYS 52 1HB LYS 52 -9.559 3.915 -6.281 357 HG2 LYS 52 2HG LYS 52 -9.332 1.468 -6.248 358 HG3 LYS 52 1HG LYS 52 -8.590 1.573 -4.650 359 HD2 LYS 52 2HD LYS 52 -10.617 2.553 -3.740 360 HD3 LYS 52 1HD LYS 52 -11.355 2.558 -5.340 361 HE2 LYS 52 2HE LYS 52 -10.465 0.089 -3.853 362 HE3 LYS 52 1HE LYS 52 -12.122 0.682 -3.910 363 HZ1 LYS 52 3HZ LYS 52 -10.518 -0.295 -6.231 364 HZ2 LYS 52 1HZ LYS 52 -12.081 0.348 -6.344 365 HZ3 LYS 52 2HZ LYS 52 -11.788 -1.068 -5.500 366 H ARG 53 H ARG 53 -6.297 5.330 -5.018 367 HA ARG 53 HA ARG 53 -6.067 7.184 -7.227 368 HB2 ARG 53 2HB ARG 53 -8.271 7.610 -5.993 369 HB3 ARG 53 1HB ARG 53 -7.301 8.002 -4.584 370 HG2 ARG 53 2HG ARG 53 -7.882 10.059 -5.605 371 HG3 ARG 53 1HG ARG 53 -6.184 9.768 -5.986 372 HD2 ARG 53 2HD ARG 53 -6.802 8.921 -8.189 373 HD3 ARG 53 1HD ARG 53 -8.502 9.182 -7.807 374 HE ARG 53 HE ARG 53 -6.725 11.477 -7.677 375 HH11 ARG 53 1HH1 ARG 53 -9.150 9.698 -9.540 376 HH12 ARG 53 2HH1 ARG 53 -9.619 11.038 -10.477 377 HH21 ARG 53 1HH2 ARG 53 -7.348 13.307 -9.002 378 HH22 ARG 53 2HH2 ARG 53 -8.565 13.119 -10.179 379 H GLY 54 H GLY 54 -4.093 8.136 -7.023 380 HA2 GLY 54 2HA GLY 54 -2.718 9.186 -5.091 381 HA3 GLY 54 1HA GLY 54 -2.550 7.494 -4.651 382 HA PRO 55 HA PRO 55 -0.106 8.713 -8.802 383 HB2 PRO 55 2HB PRO 55 1.738 10.608 -7.945 384 HB3 PRO 55 1HB PRO 55 0.294 10.943 -8.907 385 HG2 PRO 55 2HG PRO 55 0.728 11.216 -5.976 386 HG3 PRO 55 1HG PRO 55 -0.178 12.267 -7.077 387 HD2 PRO 55 2HD PRO 55 -1.395 10.575 -5.425 388 HD3 PRO 55 1HD PRO 55 -2.044 10.892 -7.048 389 H ASN 56 H ASN 56 0.855 8.437 -5.474 390 HA ASN 56 HA ASN 56 3.453 7.546 -5.490 391 HB2 ASN 56 2HB ASN 56 2.872 6.151 -3.511 392 HB3 ASN 56 1HB ASN 56 2.215 7.784 -3.449 393 HD21 ASN 56 1HD2 ASN 56 -0.003 8.098 -3.463 394 HD22 ASN 56 2HD2 ASN 56 -1.102 6.780 -3.280 395 H ALA 57 H ALA 57 0.628 5.736 -6.484 396 HA ALA 57 HA ALA 57 2.325 3.967 -7.992 397 HB1 ALA 57 1HB ALA 57 2.180 2.786 -5.830 398 HB2 ALA 57 2HB ALA 57 1.347 1.895 -7.103 399 HB3 ALA 57 3HB ALA 57 0.420 2.827 -5.930 400 H GLY 58 H GLY 58 -1.013 3.883 -6.829 401 HA2 GLY 58 2HA GLY 58 -3.007 4.160 -7.954 402 HA3 GLY 58 1HA GLY 58 -2.096 4.744 -9.338 403 H ALA 59 H ALA 59 -1.709 1.642 -7.711 404 HA ALA 59 HA ALA 59 -3.063 0.154 -9.732 405 HB1 ALA 59 1HB ALA 59 -0.041 0.023 -9.495 406 HB2 ALA 59 2HB ALA 59 -0.942 0.618 -10.889 407 HB3 ALA 59 3HB ALA 59 -1.034 -1.083 -10.443 408 H ARG 60 H ARG 60 -2.033 -2.318 -9.183 409 HA ARG 60 HA ARG 60 -2.218 -2.456 -6.271 410 HB2 ARG 60 2HB ARG 60 -3.227 -4.696 -6.533 411 HB3 ARG 60 1HB ARG 60 -4.188 -3.438 -7.296 412 HG2 ARG 60 2HG ARG 60 -3.330 -4.073 -9.465 413 HG3 ARG 60 1HG ARG 60 -2.333 -5.321 -8.721 414 HD2 ARG 60 2HD ARG 60 -4.355 -6.434 -7.918 415 HD3 ARG 60 1HD ARG 60 -5.344 -5.178 -8.667 416 HE ARG 60 HE ARG 60 -3.754 -6.131 -10.663 417 HH11 ARG 60 1HH1 ARG 60 -6.198 -7.522 -8.520 418 HH12 ARG 60 2HH1 ARG 60 -6.662 -8.739 -9.609 419 HH21 ARG 60 1HH2 ARG 60 -4.405 -7.809 -12.157 420 HH22 ARG 60 2HH2 ARG 60 -5.606 -8.932 -11.684 421 H PHE 61 H PHE 61 -0.687 -3.527 -5.206 422 HA PHE 61 HA PHE 61 1.357 -4.914 -6.777 423 HB2 PHE 61 2HB PHE 61 2.121 -2.609 -6.513 424 HB3 PHE 61 1HB PHE 61 1.866 -2.699 -4.779 425 HD1 PHE 61 2HD PHE 61 3.862 -4.122 -7.556 426 HD2 PHE 61 1HD PHE 61 3.577 -3.429 -3.367 427 HE1 PHE 61 2HE PHE 61 6.183 -4.884 -7.272 428 HE2 PHE 61 1HE PHE 61 5.887 -4.187 -3.079 429 HZ PHE 61 HZ PHE 61 7.195 -4.922 -5.035 430 H LEU 62 H LEU 62 2.140 -6.689 -5.828 431 HA LEU 62 HA LEU 62 1.091 -7.459 -3.231 432 HB2 LEU 62 2HB LEU 62 2.537 -8.995 -5.390 433 HB3 LEU 62 1HB LEU 62 2.229 -9.673 -3.812 434 HG LEU 62 HG LEU 62 -0.215 -9.482 -4.248 435 HD11 LEU 62 1HD1 LEU 62 -1.035 -9.109 -6.502 436 HD12 LEU 62 2HD1 LEU 62 0.599 -8.763 -7.059 437 HD13 LEU 62 3HD1 LEU 62 -0.190 -7.679 -5.911 438 HD21 LEU 62 3HD2 LEU 62 0.941 -11.561 -4.613 439 HD22 LEU 62 1HD2 LEU 62 1.371 -11.064 -6.251 440 HD23 LEU 62 2HD2 LEU 62 -0.318 -11.335 -5.826 441 H LEU 63 H LEU 63 2.284 -7.559 -1.468 442 HA LEU 63 HA LEU 63 4.852 -6.325 -1.491 443 HB2 LEU 63 2HB LEU 63 3.274 -7.585 0.757 444 HB3 LEU 63 1HB LEU 63 4.855 -6.887 0.995 445 HG LEU 63 HG LEU 63 3.242 -5.325 1.764 446 HD11 LEU 63 1HD1 LEU 63 4.280 -4.377 -0.881 447 HD12 LEU 63 2HD1 LEU 63 5.119 -4.331 0.669 448 HD13 LEU 63 3HD1 LEU 63 3.672 -3.357 0.420 449 HD21 LEU 63 3HD2 LEU 63 1.899 -5.479 -0.937 450 HD22 LEU 63 1HD2 LEU 63 1.462 -4.374 0.362 451 HD23 LEU 63 2HD2 LEU 63 1.255 -6.113 0.574 452 H ASP 64 H ASP 64 6.659 -7.130 -1.708 453 HA ASP 64 HA ASP 64 7.141 -10.060 -1.544 454 HB2 ASP 64 2HB ASP 64 7.015 -9.466 -3.845 455 HB3 ASP 64 1HB ASP 64 7.988 -8.028 -3.597 456 H GLN 65 H GLN 65 8.195 -6.893 -0.831 457 HA GLN 65 HA GLN 65 10.895 -7.711 -0.249 458 HB2 GLN 65 2HB GLN 65 11.322 -5.254 0.047 459 HB3 GLN 65 1HB GLN 65 10.824 -5.714 -1.570 460 HG2 GLN 65 2HG GLN 65 8.970 -4.540 0.496 461 HG3 GLN 65 1HG GLN 65 9.848 -3.575 -0.682 462 HE21 GLN 65 1HE2 GLN 65 9.213 -3.686 -2.864 463 HE22 GLN 65 2HE2 GLN 65 7.692 -4.323 -3.309 464 HA PRO 66 HA PRO 66 10.210 -8.208 3.984 465 HB2 PRO 66 2HB PRO 66 12.706 -7.606 4.947 466 HB3 PRO 66 1HB PRO 66 12.303 -9.129 4.150 467 HG2 PRO 66 2HG PRO 66 13.620 -6.691 3.049 468 HG3 PRO 66 1HG PRO 66 14.019 -8.397 2.781 469 HD2 PRO 66 2HD PRO 66 12.652 -6.942 0.970 470 HD3 PRO 66 1HD PRO 66 12.339 -8.669 1.208 471 H THR 67 H THR 67 11.763 -5.265 2.968 472 HA THR 67 HA THR 67 10.388 -3.810 5.090 473 HB THR 67 HB THR 67 13.214 -3.300 4.120 474 HG1 THR 67 1HG THR 67 13.875 -4.513 5.665 475 HG21 THR 67 3HG2 THR 67 13.333 -1.699 5.978 476 HG22 THR 67 1HG2 THR 67 11.649 -2.035 6.381 477 HG23 THR 67 2HG2 THR 67 12.056 -1.270 4.845 478 H THR 68 H THR 68 8.856 -2.960 3.765 479 HA THR 68 HA THR 68 9.631 -1.851 1.161 480 HB THR 68 HB THR 68 6.938 -1.625 2.467 481 HG1 THR 68 1HG THR 68 8.056 -3.920 2.106 482 HG21 THR 68 3HG2 THR 68 6.134 -1.650 0.133 483 HG22 THR 68 1HG2 THR 68 7.797 -1.809 -0.426 484 HG23 THR 68 2HG2 THR 68 7.289 -0.347 0.418 485 H THR 69 H THR 69 10.528 0.175 1.287 486 HA THR 69 HA THR 69 9.598 1.947 3.384 487 HB THR 69 HB THR 69 11.810 2.354 1.347 488 HG1 THR 69 1HG THR 69 11.946 1.584 4.112 489 HG21 THR 69 3HG2 THR 69 12.540 4.152 2.877 490 HG22 THR 69 1HG2 THR 69 11.130 3.851 3.892 491 HG23 THR 69 2HG2 THR 69 10.919 4.463 2.253 492 H ALA 70 H ALA 70 7.988 3.310 3.000 493 HA ALA 70 HA ALA 70 7.426 4.067 0.240 494 HB1 ALA 70 1HB ALA 70 5.610 2.827 1.330 495 HB2 ALA 70 2HB ALA 70 5.137 4.501 1.042 496 HB3 ALA 70 3HB ALA 70 5.611 3.985 2.660 497 H GLY 71 H GLY 71 7.951 6.072 -0.221 498 HA2 GLY 71 2HA GLY 71 7.319 8.310 1.263 499 HA3 GLY 71 1HA GLY 71 8.978 7.870 1.670 500 H ARG 72 H ARG 72 9.904 9.603 0.640 501 HA ARG 72 HA ARG 72 9.892 9.324 -2.256 502 HB2 ARG 72 2HB ARG 72 8.396 11.227 -1.572 503 HB3 ARG 72 1HB ARG 72 9.779 11.993 -0.826 504 HG2 ARG 72 2HG ARG 72 9.202 12.950 -3.022 505 HG3 ARG 72 1HG ARG 72 10.838 12.286 -2.984 506 HD2 ARG 72 2HD ARG 72 10.243 10.461 -4.319 507 HD3 ARG 72 1HD ARG 72 8.540 10.620 -3.932 508 HE ARG 72 HE ARG 72 8.622 12.718 -5.264 509 HH11 ARG 72 1HH1 ARG 72 11.034 10.219 -6.004 510 HH12 ARG 72 2HH1 ARG 72 10.954 10.483 -7.690 511 HH21 ARG 72 1HH2 ARG 72 8.511 13.029 -7.521 512 HH22 ARG 72 2HH2 ARG 72 9.520 12.138 -8.587 513 H HIS 73 H HIS 73 11.712 8.060 -1.368 514 HA HIS 73 HA HIS 73 14.128 9.719 -1.148 515 HB2 HIS 73 2HB HIS 73 13.572 7.034 0.161 516 HB3 HIS 73 1HB HIS 73 15.094 7.904 0.200 517 HD1 HIS 73 1HD HIS 73 13.063 6.998 2.621 518 HD2 HIS 73 2HD HIS 73 13.902 10.812 1.214 519 HE1 HIS 73 1HE HIS 73 12.541 8.573 4.507 520 HA PRO 74 HA PRO 74 15.606 7.124 -4.552 521 HB2 PRO 74 2HB PRO 74 18.002 6.479 -2.892 522 HB3 PRO 74 1HB PRO 74 17.931 7.128 -4.536 523 HG2 PRO 74 2HG PRO 74 18.595 8.715 -2.525 524 HG3 PRO 74 1HG PRO 74 17.504 9.298 -3.798 525 HD2 PRO 74 2HD PRO 74 16.854 8.348 -1.035 526 HD3 PRO 74 1HD PRO 74 16.198 9.735 -1.940 527 H GLU 75 H GLU 75 15.894 5.984 -1.251 528 HA GLU 75 HA GLU 75 15.527 3.239 -2.090 529 HB2 GLU 75 2HB GLU 75 16.283 4.388 0.593 530 HB3 GLU 75 1HB GLU 75 15.941 2.693 0.309 531 HG2 GLU 75 2HG GLU 75 18.135 4.275 -0.995 532 HG3 GLU 75 1HG GLU 75 18.334 3.123 0.327 533 H SER 76 H SER 76 13.489 3.966 -2.750 534 HA SER 76 HA SER 76 11.530 3.256 -0.721 535 HB2 SER 76 2HB SER 76 11.188 5.568 -2.663 536 HB3 SER 76 1HB SER 76 9.962 4.981 -1.538 537 HG SER 76 HG SER 76 12.208 5.415 -0.219 538 H ASP 77 H ASP 77 10.345 1.624 -1.469 539 HA ASP 77 HA ASP 77 10.782 0.588 -4.098 540 HB2 ASP 77 2HB ASP 77 10.119 -0.778 -2.034 541 HB3 ASP 77 1HB ASP 77 8.489 -0.165 -2.281 542 H ILE 78 H ILE 78 8.044 1.981 -2.437 543 HA ILE 78 HA ILE 78 7.057 2.882 -5.013 544 HB ILE 78 HB ILE 78 4.871 3.297 -3.852 545 HG12 ILE 78 2HG1 ILE 78 6.033 1.619 -1.607 546 HG13 ILE 78 1HG1 ILE 78 5.764 3.354 -1.520 547 HG21 ILE 78 1HG2 ILE 78 4.131 0.950 -3.828 548 HG22 ILE 78 2HG2 ILE 78 5.819 0.441 -3.884 549 HG23 ILE 78 3HG2 ILE 78 5.125 1.348 -5.231 550 HD11 ILE 78 3HD1 ILE 78 3.382 2.998 -1.816 551 HD12 ILE 78 1HD1 ILE 78 3.992 2.132 -0.402 552 HD13 ILE 78 2HD1 ILE 78 3.653 1.255 -1.902 553 H PHE 79 H PHE 79 7.223 4.927 -5.386 554 HA PHE 79 HA PHE 79 7.961 6.558 -3.123 555 HB2 PHE 79 2HB PHE 79 9.153 8.066 -4.829 556 HB3 PHE 79 1HB PHE 79 9.901 6.539 -4.422 557 HD1 PHE 79 1HD PHE 79 9.738 4.632 -6.058 558 HD2 PHE 79 2HD PHE 79 8.581 8.603 -7.049 559 HE1 PHE 79 1HE PHE 79 9.924 4.080 -8.445 560 HE2 PHE 79 2HE PHE 79 8.758 8.052 -9.443 561 HZ PHE 79 HZ PHE 79 9.427 5.791 -10.141 562 H LEU 80 H LEU 80 6.743 7.913 -2.491 563 HA LEU 80 HA LEU 80 4.304 8.559 -3.832 564 HB2 LEU 80 2HB LEU 80 5.435 9.375 -1.148 565 HB3 LEU 80 1HB LEU 80 3.889 9.920 -1.744 566 HG LEU 80 HG LEU 80 3.095 7.540 -1.713 567 HD11 LEU 80 1HD1 LEU 80 5.669 6.987 -0.269 568 HD12 LEU 80 2HD1 LEU 80 5.228 6.397 -1.870 569 HD13 LEU 80 3HD1 LEU 80 4.310 5.874 -0.458 570 HD21 LEU 80 3HD2 LEU 80 2.849 7.427 0.714 571 HD22 LEU 80 1HD2 LEU 80 2.568 9.054 0.092 572 HD23 LEU 80 2HD2 LEU 80 4.092 8.668 0.889 573 H ASP 81 H ASP 81 3.824 10.425 -4.738 574 HA ASP 81 HA ASP 81 5.704 12.702 -4.567 575 HB2 ASP 81 2HB ASP 81 6.106 11.347 -6.701 576 HB3 ASP 81 1HB ASP 81 4.460 11.738 -7.183 577 H ASP 82 H ASP 82 3.315 11.772 -3.488 578 HA ASP 82 HA ASP 82 0.981 13.048 -4.513 579 HB2 ASP 82 2HB ASP 82 1.528 11.737 -1.836 580 HB3 ASP 82 1HB ASP 82 -0.052 12.064 -2.530 581 H VAL 83 H VAL 83 -0.312 14.276 -2.652 582 HA VAL 83 HA VAL 83 1.271 16.628 -2.056 583 HB VAL 83 HB VAL 83 -1.068 16.759 -2.978 584 HG11 VAL 83 1HG1 VAL 83 -2.156 14.990 -1.803 585 HG12 VAL 83 2HG1 VAL 83 -2.992 16.505 -1.476 586 HG13 VAL 83 3HG1 VAL 83 -1.916 15.814 -0.262 587 HG21 VAL 83 3HG2 VAL 83 -1.856 18.618 -1.574 588 HG22 VAL 83 1HG2 VAL 83 -0.125 18.729 -1.904 589 HG23 VAL 83 2HG2 VAL 83 -0.688 18.164 -0.333 590 H THR 84 H THR 84 1.029 13.793 -0.533 591 HA THR 84 HA THR 84 0.813 14.869 2.167 592 HB THR 84 HB THR 84 0.488 12.379 2.650 593 HG1 THR 84 1HG THR 84 0.713 11.161 0.933 594 HG21 THR 84 3HG2 THR 84 -1.332 14.034 2.690 595 HG22 THR 84 1HG2 THR 84 -1.886 12.504 2.014 596 HG23 THR 84 2HG2 THR 84 -1.526 13.860 0.944 597 H VAL 85 H VAL 85 3.235 14.608 0.168 598 HA VAL 85 HA VAL 85 4.805 12.621 1.463 599 HB VAL 85 HB VAL 85 6.529 13.212 -0.127 600 HG11 VAL 85 1HG1 VAL 85 3.819 12.902 -1.348 601 HG12 VAL 85 2HG1 VAL 85 4.859 11.617 -0.736 602 HG13 VAL 85 3HG1 VAL 85 5.346 12.550 -2.153 603 HG21 VAL 85 3HG2 VAL 85 6.168 15.627 -0.326 604 HG22 VAL 85 1HG2 VAL 85 4.625 15.339 -1.132 605 HG23 VAL 85 2HG2 VAL 85 6.131 14.859 -1.913 606 H SER 86 H SER 86 6.469 12.882 2.770 607 HA SER 86 HA SER 86 7.128 15.597 3.613 608 HB2 SER 86 2HB SER 86 7.245 14.609 5.968 609 HB3 SER 86 1HB SER 86 5.632 14.841 5.282 610 HG SER 86 HG SER 86 5.473 12.673 4.891 611 H ARG 87 H ARG 87 8.262 12.491 4.857 612 HA ARG 87 HA ARG 87 10.726 12.584 3.385 613 HB2 ARG 87 2HB ARG 87 11.065 14.170 5.342 614 HB3 ARG 87 1HB ARG 87 10.861 12.805 6.415 615 HG2 ARG 87 2HG ARG 87 13.205 13.230 6.166 616 HG3 ARG 87 1HG ARG 87 12.823 11.743 5.297 617 HD2 ARG 87 2HD ARG 87 14.336 13.256 4.045 618 HD3 ARG 87 1HD ARG 87 12.844 12.868 3.196 619 HE ARG 87 HE ARG 87 12.108 15.023 3.469 620 HH11 ARG 87 1HH1 ARG 87 15.267 14.620 5.009 621 HH12 ARG 87 2HH1 ARG 87 15.534 16.279 5.245 622 HH21 ARG 87 1HH2 ARG 87 12.456 17.266 3.757 623 HH22 ARG 87 2HH2 ARG 87 13.866 17.858 4.505 624 H ARG 88 H ARG 88 10.494 11.096 6.616 625 HA ARG 88 HA ARG 88 10.302 8.500 5.338 626 HB2 ARG 88 2HB ARG 88 10.535 9.257 8.292 627 HB3 ARG 88 1HB ARG 88 10.318 7.620 7.727 628 HG2 ARG 88 2HG ARG 88 12.582 7.821 8.264 629 HG3 ARG 88 1HG ARG 88 12.509 7.865 6.508 630 HD2 ARG 88 2HD ARG 88 12.736 10.283 6.559 631 HD3 ARG 88 1HD ARG 88 12.751 10.255 8.325 632 HE ARG 88 HE ARG 88 14.771 8.786 6.814 633 HH11 ARG 88 1HH1 ARG 88 13.976 11.411 9.121 634 HH12 ARG 88 2HH1 ARG 88 15.583 11.631 9.596 635 HH21 ARG 88 1HH2 ARG 88 16.982 9.138 7.527 636 HH22 ARG 88 2HH2 ARG 88 17.331 10.297 8.713 637 H HIS 89 H HIS 89 8.345 7.984 4.702 638 HA HIS 89 HA HIS 89 6.132 9.289 6.025 639 HB2 HIS 89 2HB HIS 89 6.435 9.292 3.512 640 HB3 HIS 89 1HB HIS 89 6.062 7.575 3.534 641 HD2 HIS 89 2HD HIS 89 3.385 7.011 4.436 642 HE1 HIS 89 1HE HIS 89 2.101 10.918 3.458 643 HE2 HIS 89 2HE HIS 89 1.518 8.731 4.611 644 H ALA 90 H ALA 90 6.419 6.004 4.648 645 HA ALA 90 HA ALA 90 5.564 4.907 7.189 646 HB1 ALA 90 1HB ALA 90 3.459 5.382 6.027 647 HB2 ALA 90 2HB ALA 90 3.744 3.647 6.137 648 HB3 ALA 90 3HB ALA 90 4.034 4.492 4.615 649 H GLU 91 H GLU 91 5.932 2.643 7.269 650 HA GLU 91 HA GLU 91 7.384 1.591 4.996 651 HB2 GLU 91 2HB GLU 91 9.015 2.658 6.575 652 HB3 GLU 91 1HB GLU 91 8.494 1.533 7.814 653 HG2 GLU 91 2HG GLU 91 9.477 -0.289 6.727 654 HG3 GLU 91 1HG GLU 91 9.606 0.583 5.200 655 H PHE 92 H PHE 92 6.839 -0.388 4.575 656 HA PHE 92 HA PHE 92 5.059 -1.789 6.440 657 HB2 PHE 92 2HB PHE 92 5.656 -2.483 3.529 658 HB3 PHE 92 1HB PHE 92 4.476 -3.233 4.562 659 HD1 PHE 92 1HD PHE 92 5.287 0.042 2.973 660 HD2 PHE 92 2HD PHE 92 2.279 -2.522 4.556 661 HE1 PHE 92 1HE PHE 92 3.549 1.547 2.108 662 HE2 PHE 92 2HE PHE 92 0.537 -1.010 3.698 663 HZ PHE 92 HZ PHE 92 1.172 1.025 2.474 664 H ARG 93 H ARG 93 6.116 -3.145 7.694 665 HA ARG 93 HA ARG 93 8.432 -4.480 6.534 666 HB2 ARG 93 2HB ARG 93 7.928 -3.658 9.387 667 HB3 ARG 93 1HB ARG 93 9.148 -4.846 8.947 668 HG2 ARG 93 2HG ARG 93 10.210 -3.153 7.493 669 HG3 ARG 93 1HG ARG 93 9.036 -1.968 8.080 670 HD2 ARG 93 2HD ARG 93 9.878 -2.086 10.281 671 HD3 ARG 93 1HD ARG 93 10.818 -3.531 9.924 672 HE ARG 93 HE ARG 93 11.415 -0.858 8.802 673 HH11 ARG 93 1HH1 ARG 93 12.508 -3.964 10.152 674 HH12 ARG 93 2HH1 ARG 93 14.160 -3.637 9.917 675 HH21 ARG 93 1HH2 ARG 93 13.682 -0.411 8.551 676 HH22 ARG 93 2HH2 ARG 93 14.861 -1.528 9.040 677 H ILE 94 H ILE 94 8.711 -6.627 6.989 678 HA ILE 94 HA ILE 94 6.225 -7.864 7.914 679 HB ILE 94 HB ILE 94 6.620 -8.326 5.549 680 HG12 ILE 94 2HG1 ILE 94 5.611 -10.185 6.989 681 HG13 ILE 94 1HG1 ILE 94 6.248 -10.668 5.430 682 HG21 ILE 94 1HG2 ILE 94 8.946 -8.049 5.429 683 HG22 ILE 94 2HG2 ILE 94 8.484 -9.581 4.686 684 HG23 ILE 94 3HG2 ILE 94 9.237 -9.562 6.288 685 HD11 ILE 94 3HD1 ILE 94 6.757 -12.292 7.162 686 HD12 ILE 94 1HD1 ILE 94 7.595 -11.053 8.097 687 HD13 ILE 94 2HD1 ILE 94 8.238 -11.569 6.536 688 H ASN 95 H ASN 95 6.253 -8.745 9.672 689 HA ASN 95 HA ASN 95 8.752 -9.128 11.111 690 HB2 ASN 95 2HB ASN 95 6.837 -7.668 11.920 691 HB3 ASN 95 1HB ASN 95 5.940 -9.135 12.112 692 HD21 ASN 95 1HD2 ASN 95 5.759 -8.766 14.321 693 HD22 ASN 95 2HD2 ASN 95 7.028 -9.126 15.411 694 H GLU 96 H GLU 96 9.353 -11.098 10.430 695 HA GLU 96 HA GLU 96 9.524 -13.323 10.174 696 HB2 GLU 96 2HB GLU 96 9.260 -14.587 12.259 697 HB3 GLU 96 1HB GLU 96 10.109 -13.063 12.455 698 HG2 GLU 96 2HG GLU 96 8.079 -12.060 13.364 699 HG3 GLU 96 1HG GLU 96 7.237 -13.594 13.163 700 H GLY 97 H GLY 97 6.677 -12.352 9.508 701 HA2 GLY 97 2HA GLY 97 5.732 -14.564 8.323 702 HA3 GLY 97 1HA GLY 97 5.165 -14.745 9.972 703 H GLU 98 H GLU 98 5.004 -11.483 9.866 704 HA GLU 98 HA GLU 98 2.726 -11.420 8.084 705 HB2 GLU 98 2HB GLU 98 1.944 -12.218 10.325 706 HB3 GLU 98 1HB GLU 98 2.454 -10.680 10.995 707 HG2 GLU 98 2HG GLU 98 0.817 -9.499 9.796 708 HG3 GLU 98 1HG GLU 98 0.501 -10.876 8.740 709 H PHE 99 H PHE 99 1.998 -9.282 7.649 710 HA PHE 99 HA PHE 99 4.265 -7.461 7.661 711 HB2 PHE 99 2HB PHE 99 1.663 -7.397 6.114 712 HB3 PHE 99 1HB PHE 99 2.906 -6.160 6.008 713 HD1 PHE 99 1HD PHE 99 2.109 -9.683 5.276 714 HD2 PHE 99 2HD PHE 99 4.863 -6.491 4.711 715 HE1 PHE 99 1HE PHE 99 3.229 -10.970 3.517 716 HE2 PHE 99 2HE PHE 99 5.995 -7.776 2.944 717 HZ PHE 99 HZ PHE 99 5.178 -10.020 2.343 718 H GLU 100 H GLU 100 4.285 -5.535 8.564 719 HA GLU 100 HA GLU 100 1.938 -4.661 10.061 720 HB2 GLU 100 2HB GLU 100 3.610 -5.721 11.536 721 HB3 GLU 100 1HB GLU 100 4.844 -4.642 10.914 722 HG2 GLU 100 2HG GLU 100 3.685 -2.743 11.891 723 HG3 GLU 100 1HG GLU 100 2.415 -3.816 12.477 724 H VAL 101 H VAL 101 1.412 -2.623 9.513 725 HA VAL 101 HA VAL 101 3.404 -1.140 7.987 726 HB VAL 101 HB VAL 101 1.423 -1.485 6.634 727 HG11 VAL 101 1HG1 VAL 101 -0.183 -0.247 8.860 728 HG12 VAL 101 2HG1 VAL 101 -0.221 -1.935 8.353 729 HG13 VAL 101 3HG1 VAL 101 -0.802 -0.675 7.265 730 HG21 VAL 101 3HG2 VAL 101 1.480 1.356 7.653 731 HG22 VAL 101 1HG2 VAL 101 0.748 0.829 6.137 732 HG23 VAL 101 2HG2 VAL 101 2.490 0.684 6.372 733 H VAL 102 H VAL 102 4.371 0.412 8.915 734 HA VAL 102 HA VAL 102 3.050 1.757 11.137 735 HB VAL 102 HB VAL 102 5.312 2.118 12.138 736 HG11 VAL 102 1HG1 VAL 102 4.552 -0.763 11.700 737 HG12 VAL 102 2HG1 VAL 102 3.865 0.308 12.913 738 HG13 VAL 102 3HG1 VAL 102 5.563 -0.156 13.011 739 HG21 VAL 102 3HG2 VAL 102 7.200 0.777 11.383 740 HG22 VAL 102 1HG2 VAL 102 6.638 1.822 10.081 741 HG23 VAL 102 2HG2 VAL 102 6.227 0.108 10.074 742 H ASP 103 H ASP 103 3.017 3.917 11.150 743 HA ASP 103 HA ASP 103 4.174 5.346 8.883 744 HB2 ASP 103 2HB ASP 103 1.933 6.070 9.857 745 HB3 ASP 103 1HB ASP 103 2.766 6.487 11.348 746 H VAL 104 H VAL 104 6.144 6.208 8.990 747 HA VAL 104 HA VAL 104 7.528 5.874 11.559 748 HB VAL 104 HB VAL 104 9.649 5.712 10.187 749 HG11 VAL 104 1HG1 VAL 104 8.527 3.737 11.112 750 HG12 VAL 104 2HG1 VAL 104 9.233 3.379 9.535 751 HG13 VAL 104 3HG1 VAL 104 7.499 3.663 9.680 752 HG21 VAL 104 3HG2 VAL 104 8.642 6.772 8.161 753 HG22 VAL 104 1HG2 VAL 104 7.722 5.302 7.908 754 HG23 VAL 104 2HG2 VAL 104 9.487 5.257 7.823 755 H GLY 105 H GLY 105 6.165 8.293 10.101 756 HA2 GLY 105 2HA GLY 105 8.421 10.081 10.748 757 HA3 GLY 105 1HA GLY 105 7.364 10.370 9.373 758 H SER 106 H SER 106 4.898 9.791 10.515 759 HA SER 106 HA SER 106 3.185 10.795 11.475 760 HB2 SER 106 2HB SER 106 5.166 11.666 13.598 761 HB3 SER 106 1HB SER 106 3.403 11.627 13.772 762 HG SER 106 HG SER 106 4.604 9.312 12.885 763 H LEU 107 H LEU 107 5.337 12.239 9.874 764 HA LEU 107 HA LEU 107 4.966 15.021 10.387 765 HB2 LEU 107 2HB LEU 107 6.007 13.560 7.976 766 HB3 LEU 107 1HB LEU 107 6.060 15.294 8.186 767 HG LEU 107 HG LEU 107 7.519 13.242 9.869 768 HD11 LEU 107 1HD1 LEU 107 9.538 14.185 8.864 769 HD12 LEU 107 2HD1 LEU 107 8.539 15.211 7.836 770 HD13 LEU 107 3HD1 LEU 107 8.478 13.458 7.658 771 HD21 LEU 107 3HD2 LEU 107 8.648 15.175 10.891 772 HD22 LEU 107 1HD2 LEU 107 6.915 15.179 11.218 773 HD23 LEU 107 2HD2 LEU 107 7.580 16.259 9.997 774 H ASN 108 H ASN 108 3.847 12.775 7.916 775 HA ASN 108 HA ASN 108 1.852 14.653 6.986 776 HB2 ASN 108 2HB ASN 108 2.819 13.079 5.369 777 HB3 ASN 108 1HB ASN 108 2.256 11.718 6.336 778 HD21 ASN 108 1HD2 ASN 108 0.465 14.707 5.557 779 HD22 ASN 108 2HD2 ASN 108 -0.782 13.908 4.701 780 H GLY 109 H GLY 109 1.969 11.558 8.666 781 HA2 GLY 109 2HA GLY 109 0.542 10.833 10.362 782 HA3 GLY 109 1HA GLY 109 -0.538 12.185 10.000 783 H THR 110 H THR 110 0.652 9.107 8.744 784 HA THR 110 HA THR 110 -1.291 8.899 6.689 785 HB THR 110 HB THR 110 0.404 6.779 8.022 786 HG1 THR 110 1HG THR 110 1.827 8.122 7.307 787 HG21 THR 110 3HG2 THR 110 -0.826 6.888 5.251 788 HG22 THR 110 1HG2 THR 110 -1.382 5.872 6.580 789 HG23 THR 110 2HG2 THR 110 0.211 5.603 5.873 790 H TYR 111 H TYR 111 -3.313 7.953 6.795 791 HA TYR 111 HA TYR 111 -4.115 7.015 9.445 792 HB2 TYR 111 2HB TYR 111 -5.909 7.614 7.079 793 HB3 TYR 111 1HB TYR 111 -6.365 7.486 8.777 794 HD1 TYR 111 2HD TYR 111 -5.254 9.268 10.383 795 HD2 TYR 111 1HD TYR 111 -5.559 9.706 6.161 796 HE1 TYR 111 2HE TYR 111 -4.928 11.698 10.610 797 HE2 TYR 111 1HE TYR 111 -5.230 12.125 6.377 798 HH TYR 111 HH TYR 111 -4.108 13.594 9.188 799 H VAL 112 H VAL 112 -4.685 4.935 9.672 800 HA VAL 112 HA VAL 112 -4.673 3.252 7.302 801 HB VAL 112 HB VAL 112 -2.446 3.089 8.321 802 HG11 VAL 112 1HG1 VAL 112 -2.969 3.781 10.575 803 HG12 VAL 112 2HG1 VAL 112 -2.083 2.259 10.578 804 HG13 VAL 112 3HG1 VAL 112 -3.830 2.266 10.859 805 HG21 VAL 112 3HG2 VAL 112 -2.354 0.658 8.773 806 HG22 VAL 112 1HG2 VAL 112 -3.301 1.040 7.337 807 HG23 VAL 112 2HG2 VAL 112 -4.113 0.635 8.840 808 H ASN 113 H ASN 113 -6.096 1.521 7.392 809 HA ASN 113 HA ASN 113 -8.148 0.690 7.764 810 HB2 ASN 113 2HB ASN 113 -6.734 0.035 9.941 811 HB3 ASN 113 1HB ASN 113 -7.857 1.136 10.730 812 HD21 ASN 113 1HD2 ASN 113 -7.455 -1.837 9.112 813 HD22 ASN 113 2HD2 ASN 113 -8.983 -2.555 9.528 814 H ARG 114 H ARG 114 -7.668 3.526 7.508 815 HA ARG 114 HA ARG 114 -8.437 5.612 7.777 816 HB2 ARG 114 2HB ARG 114 -10.931 3.995 7.565 817 HB3 ARG 114 1HB ARG 114 -11.065 5.725 7.879 818 HG2 ARG 114 2HG ARG 114 -9.899 6.264 5.886 819 HG3 ARG 114 1HG ARG 114 -9.457 4.582 5.618 820 HD2 ARG 114 2HD ARG 114 -11.277 5.305 4.154 821 HD3 ARG 114 1HD ARG 114 -11.768 4.007 5.231 822 HE ARG 114 HE ARG 114 -12.417 6.595 6.249 823 HH11 ARG 114 1HH1 ARG 114 -13.413 3.998 4.074 824 HH12 ARG 114 2HH1 ARG 114 -15.060 4.440 4.056 825 HH21 ARG 114 1HH2 ARG 114 -14.705 7.168 6.299 826 HH22 ARG 114 2HH2 ARG 114 -15.817 6.290 5.368 827 H GLU 115 H GLU 115 -7.475 4.541 10.086 828 HA GLU 115 HA GLU 115 -8.824 6.290 11.996 829 HB2 GLU 115 2HB GLU 115 -7.573 3.581 12.512 830 HB3 GLU 115 1HB GLU 115 -8.006 4.717 13.774 831 HG2 GLU 115 2HG GLU 115 -10.359 4.547 13.089 832 HG3 GLU 115 1HG GLU 115 -9.892 3.382 11.854 833 HA PRO 116 HA PRO 116 -4.632 7.772 12.267 834 HB2 PRO 116 2HB PRO 116 -4.739 9.109 14.654 835 HB3 PRO 116 1HB PRO 116 -5.400 9.764 13.156 836 HG2 PRO 116 2HG PRO 116 -6.803 8.542 15.466 837 HG3 PRO 116 1HG PRO 116 -7.355 9.797 14.347 838 HD2 PRO 116 2HD PRO 116 -8.100 7.109 14.270 839 HD3 PRO 116 1HD PRO 116 -8.276 8.267 12.940 840 H ARG 117 H ARG 117 -3.771 5.701 12.478 841 HA ARG 117 HA ARG 117 -3.018 4.944 15.213 842 HB2 ARG 117 2HB ARG 117 -3.290 3.119 12.811 843 HB3 ARG 117 1HB ARG 117 -2.805 2.633 14.421 844 HG2 ARG 117 2HG ARG 117 -5.077 3.237 15.237 845 HG3 ARG 117 1HG ARG 117 -5.529 3.612 13.574 846 HD2 ARG 117 2HD ARG 117 -4.952 1.312 12.912 847 HD3 ARG 117 1HD ARG 117 -4.560 0.945 14.590 848 HE ARG 117 HE ARG 117 -7.231 1.919 14.309 849 HH11 ARG 117 1HH1 ARG 117 -5.267 -1.059 14.079 850 HH12 ARG 117 2HH1 ARG 117 -6.648 -2.063 14.074 851 HH21 ARG 117 1HH2 ARG 117 -9.041 0.470 14.328 852 HH22 ARG 117 2HH2 ARG 117 -8.759 -1.228 14.239 853 H ASN 118 H ASN 118 -0.848 4.296 15.433 854 HA ASN 118 HA ASN 118 0.920 5.471 13.434 855 HB2 ASN 118 2HB ASN 118 1.476 4.331 16.186 856 HB3 ASN 118 1HB ASN 118 2.722 4.976 15.125 857 HD21 ASN 118 1HD2 ASN 118 1.782 5.812 17.772 858 HD22 ASN 118 2HD2 ASN 118 1.344 7.468 17.630 859 H ALA 119 H ALA 119 -0.094 2.417 14.670 860 HA ALA 119 HA ALA 119 1.470 1.075 12.614 861 HB1 ALA 119 1HB ALA 119 2.755 0.883 14.700 862 HB2 ALA 119 2HB ALA 119 2.121 -0.680 14.183 863 HB3 ALA 119 3HB ALA 119 1.343 0.195 15.502 864 H GLN 120 H GLN 120 0.350 -0.566 11.678 865 HA GLN 120 HA GLN 120 -1.973 -1.642 13.061 866 HB2 GLN 120 2HB GLN 120 -2.323 0.215 11.082 867 HB3 GLN 120 1HB GLN 120 -2.324 -1.275 10.152 868 HG2 GLN 120 2HG GLN 120 -4.161 -0.653 12.468 869 HG3 GLN 120 1HG GLN 120 -4.584 -0.550 10.765 870 HE21 GLN 120 1HE2 GLN 120 -5.086 -2.394 9.666 871 HE22 GLN 120 2HE2 GLN 120 -5.201 -3.935 10.417 872 H VAL 121 H VAL 121 -2.321 -3.752 12.564 873 HA VAL 121 HA VAL 121 -0.056 -5.023 11.263 874 HB VAL 121 HB VAL 121 -0.534 -5.616 13.638 875 HG11 VAL 121 1HG1 VAL 121 -3.017 -6.908 12.567 876 HG12 VAL 121 2HG1 VAL 121 -2.944 -5.507 13.628 877 HG13 VAL 121 3HG1 VAL 121 -2.392 -7.081 14.210 878 HG21 VAL 121 3HG2 VAL 121 -0.306 -8.043 13.358 879 HG22 VAL 121 1HG2 VAL 121 0.736 -7.133 12.267 880 HG23 VAL 121 2HG2 VAL 121 -0.745 -7.869 11.659 881 H MET 122 H MET 122 -0.257 -6.341 9.563 882 HA MET 122 HA MET 122 -1.832 -6.017 7.469 883 HB2 MET 122 2HB MET 122 0.071 -7.647 7.663 884 HB3 MET 122 1HB MET 122 -1.068 -8.796 8.345 885 HG2 MET 122 2HG MET 122 -2.398 -8.583 6.213 886 HG3 MET 122 1HG MET 122 -1.056 -7.646 5.568 887 HE1 MET 122 3HE MET 122 -1.327 -10.886 7.808 888 HE2 MET 122 1HE MET 122 -0.984 -12.129 6.602 889 HE3 MET 122 2HE MET 122 -2.432 -11.138 6.463 890 H GLN 123 H GLN 123 -3.981 -5.808 7.392 891 HA GLN 123 HA GLN 123 -5.598 -8.034 8.322 892 HB2 GLN 123 2HB GLN 123 -5.653 -5.995 9.853 893 HB3 GLN 123 1HB GLN 123 -6.380 -5.124 8.511 894 HG2 GLN 123 2HG GLN 123 -8.248 -6.716 8.521 895 HG3 GLN 123 1HG GLN 123 -7.520 -7.534 9.905 896 HE21 GLN 123 1HE2 GLN 123 -10.076 -6.279 9.766 897 HE22 GLN 123 2HE2 GLN 123 -10.088 -5.022 10.941 898 H THR 124 H THR 124 -7.162 -8.555 6.808 899 HA THR 124 HA THR 124 -6.767 -7.349 4.247 900 HB THR 124 HB THR 124 -7.056 -9.832 4.495 901 HG1 THR 124 1HG THR 124 -8.820 -9.888 2.780 902 HG21 THR 124 3HG2 THR 124 -9.962 -9.162 5.029 903 HG22 THR 124 1HG2 THR 124 -8.851 -9.867 6.203 904 HG23 THR 124 2HG2 THR 124 -9.314 -10.781 4.773 905 H GLY 125 H GLY 125 -8.012 -5.841 3.317 906 HA2 GLY 125 2HA GLY 125 -10.038 -4.740 2.858 907 HA3 GLY 125 1HA GLY 125 -10.722 -5.429 4.326 908 H ASP 126 H ASP 126 -7.589 -4.152 4.580 909 HA ASP 126 HA ASP 126 -8.514 -2.057 6.343 910 HB2 ASP 126 2HB ASP 126 -6.434 -3.460 6.773 911 HB3 ASP 126 1HB ASP 126 -5.687 -2.648 5.404 912 H GLU 127 H GLU 127 -8.358 0.102 5.817 913 HA GLU 127 HA GLU 127 -7.508 0.606 3.103 914 HB2 GLU 127 2HB GLU 127 -9.408 2.223 2.829 915 HB3 GLU 127 1HB GLU 127 -9.875 0.535 2.922 916 HG2 GLU 127 2HG GLU 127 -10.240 1.007 5.409 917 HG3 GLU 127 1HG GLU 127 -10.192 2.698 4.924 918 H ILE 128 H ILE 128 -6.160 2.010 2.883 919 HA ILE 128 HA ILE 128 -5.326 3.650 5.172 920 HB ILE 128 HB ILE 128 -3.745 2.704 2.756 921 HG12 ILE 128 2HG1 ILE 128 -3.654 1.844 5.642 922 HG13 ILE 128 1HG1 ILE 128 -4.291 0.892 4.309 923 HG21 ILE 128 1HG2 ILE 128 -1.764 3.580 3.913 924 HG22 ILE 128 2HG2 ILE 128 -2.801 4.216 5.194 925 HG23 ILE 128 3HG2 ILE 128 -2.928 4.861 3.557 926 HD11 ILE 128 3HD1 ILE 128 -1.412 1.707 4.695 927 HD12 ILE 128 1HD1 ILE 128 -2.033 0.775 3.334 928 HD13 ILE 128 2HD1 ILE 128 -2.088 0.101 4.960 929 H GLN 129 H GLN 129 -5.428 5.784 4.974 930 HA GLN 129 HA GLN 129 -5.850 6.858 2.286 931 HB2 GLN 129 2HB GLN 129 -7.926 6.928 3.676 932 HB3 GLN 129 1HB GLN 129 -7.076 7.954 4.824 933 HG2 GLN 129 2HG GLN 129 -6.768 9.645 3.078 934 HG3 GLN 129 1HG GLN 129 -7.631 8.621 1.936 935 HE21 GLN 129 1HE2 GLN 129 -7.913 10.764 4.643 936 HE22 GLN 129 2HE2 GLN 129 -9.624 10.873 4.602 937 H ILE 130 H ILE 130 -4.346 8.192 1.696 938 HA ILE 130 HA ILE 130 -2.940 9.629 3.792 939 HB ILE 130 HB ILE 130 -1.093 10.042 2.101 940 HG12 ILE 130 2HG1 ILE 130 -2.487 7.827 0.555 941 HG13 ILE 130 1HG1 ILE 130 -2.358 9.521 0.077 942 HG21 ILE 130 1HG2 ILE 130 -1.607 7.205 2.950 943 HG22 ILE 130 2HG2 ILE 130 -0.782 8.467 3.868 944 HG23 ILE 130 3HG2 ILE 130 -0.056 7.833 2.392 945 HD11 ILE 130 3HD1 ILE 130 -0.048 7.624 0.405 946 HD12 ILE 130 1HD1 ILE 130 0.047 9.302 -0.127 947 HD13 ILE 130 2HD1 ILE 130 -0.774 8.105 -1.131 948 H GLY 131 H GLY 131 -3.992 11.378 4.071 949 HA2 GLY 131 2HA GLY 131 -4.885 13.468 3.688 950 HA3 GLY 131 1HA GLY 131 -4.148 13.421 2.091 951 H LYS 132 H LYS 132 -5.251 12.361 0.432 952 HA LYS 132 HA LYS 132 -8.145 11.975 0.822 953 HB2 LYS 132 2HB LYS 132 -7.788 14.188 -0.155 954 HB3 LYS 132 1HB LYS 132 -6.819 13.489 -1.442 955 HG2 LYS 132 2HG LYS 132 -8.809 12.304 -2.278 956 HG3 LYS 132 1HG LYS 132 -9.768 13.032 -0.991 957 HD2 LYS 132 2HD LYS 132 -8.275 14.582 -3.111 958 HD3 LYS 132 1HD LYS 132 -9.992 14.182 -3.183 959 HE2 LYS 132 2HE LYS 132 -10.387 15.445 -1.148 960 HE3 LYS 132 1HE LYS 132 -8.668 15.817 -1.012 961 HZ1 LYS 132 3HZ LYS 132 -10.452 16.664 -3.221 962 HZ2 LYS 132 1HZ LYS 132 -8.824 17.056 -3.091 963 HZ3 LYS 132 2HZ LYS 132 -9.928 17.643 -1.971 964 H PHE 133 H PHE 133 -5.204 10.737 -0.315 965 HA PHE 133 HA PHE 133 -6.346 9.247 -2.518 966 HB2 PHE 133 2HB PHE 133 -3.565 9.062 -1.351 967 HB3 PHE 133 1HB PHE 133 -4.102 8.476 -2.910 968 HD1 PHE 133 1HD PHE 133 -5.205 10.358 -4.429 969 HD2 PHE 133 2HD PHE 133 -2.392 11.048 -1.328 970 HE1 PHE 133 1HE PHE 133 -4.565 12.490 -5.487 971 HE2 PHE 133 2HE PHE 133 -1.751 13.160 -2.362 972 HZ PHE 133 HZ PHE 133 -2.833 13.896 -4.437 973 H ARG 134 H ARG 134 -6.906 7.118 -2.380 974 HA ARG 134 HA ARG 134 -6.488 5.934 0.246 975 HB2 ARG 134 2HB ARG 134 -8.669 4.818 0.141 976 HB3 ARG 134 1HB ARG 134 -8.801 6.562 0.172 977 HG2 ARG 134 2HG ARG 134 -9.319 6.596 -2.195 978 HG3 ARG 134 1HG ARG 134 -9.071 4.851 -2.297 979 HD2 ARG 134 2HD ARG 134 -10.888 4.504 -0.696 980 HD3 ARG 134 1HD ARG 134 -11.153 6.242 -0.610 981 HE ARG 134 HE ARG 134 -11.520 5.950 -3.142 982 HH11 ARG 134 1HH1 ARG 134 -12.516 3.596 -0.635 983 HH12 ARG 134 2HH1 ARG 134 -13.916 3.134 -1.449 984 HH21 ARG 134 1HH2 ARG 134 -13.513 5.229 -4.267 985 HH22 ARG 134 2HH2 ARG 134 -14.485 4.033 -3.557 986 H LEU 135 H LEU 135 -5.887 4.017 0.459 987 HA LEU 135 HA LEU 135 -5.396 2.322 -1.873 988 HB2 LEU 135 2HB LEU 135 -3.354 3.347 -0.993 989 HB3 LEU 135 1HB LEU 135 -3.769 2.876 0.630 990 HG LEU 135 HG LEU 135 -3.068 0.849 -1.520 991 HD11 LEU 135 1HD1 LEU 135 -1.212 2.440 -1.234 992 HD12 LEU 135 2HD1 LEU 135 -0.810 0.861 -0.563 993 HD13 LEU 135 3HD1 LEU 135 -1.269 2.184 0.511 994 HD21 LEU 135 3HD2 LEU 135 -4.200 -0.053 0.465 995 HD22 LEU 135 1HD2 LEU 135 -3.027 0.751 1.505 996 HD23 LEU 135 2HD2 LEU 135 -2.508 -0.550 0.446 997 H VAL 136 H VAL 136 -6.221 0.301 -1.650 998 HA VAL 136 HA VAL 136 -7.405 -0.388 0.940 999 HB VAL 136 HB VAL 136 -8.096 -1.553 -1.786 1000 HG11 VAL 136 1HG1 VAL 136 -8.537 -3.068 0.082 1001 HG12 VAL 136 2HG1 VAL 136 -10.043 -2.509 -0.648 1002 HG13 VAL 136 3HG1 VAL 136 -9.495 -1.819 0.878 1003 HG21 VAL 136 3HG2 VAL 136 -9.600 0.509 -0.171 1004 HG22 VAL 136 1HG2 VAL 136 -10.189 -0.263 -1.643 1005 HG23 VAL 136 2HG2 VAL 136 -8.771 0.786 -1.702 1006 H PHE 137 H PHE 137 -6.410 -1.905 1.991 1007 HA PHE 137 HA PHE 137 -4.295 -3.429 0.680 1008 HB2 PHE 137 2HB PHE 137 -3.694 -1.901 2.522 1009 HB3 PHE 137 1HB PHE 137 -4.805 -2.748 3.580 1010 HD1 PHE 137 2HD PHE 137 -1.673 -3.054 1.669 1011 HD2 PHE 137 1HD PHE 137 -4.138 -4.681 4.720 1012 HE1 PHE 137 2HE PHE 137 0.167 -4.530 2.358 1013 HE2 PHE 137 1HE PHE 137 -2.329 -6.146 5.421 1014 HZ PHE 137 HZ PHE 137 -0.152 -6.085 4.241 1015 H LEU 138 H LEU 138 -4.654 -5.536 0.361 1016 HA LEU 138 HA LEU 138 -6.726 -6.884 1.974 1017 HB2 LEU 138 2HB LEU 138 -6.061 -7.402 -0.937 1018 HB3 LEU 138 1HB LEU 138 -7.162 -8.351 0.019 1019 HG LEU 138 HG LEU 138 -8.486 -7.065 -1.385 1020 HD11 LEU 138 1HD1 LEU 138 -9.375 -7.113 0.808 1021 HD12 LEU 138 2HD1 LEU 138 -9.769 -5.581 0.029 1022 HD13 LEU 138 3HD1 LEU 138 -8.490 -5.650 1.243 1023 HD21 LEU 138 3HD2 LEU 138 -6.857 -5.463 -2.187 1024 HD22 LEU 138 1HD2 LEU 138 -6.891 -4.618 -0.639 1025 HD23 LEU 138 2HD2 LEU 138 -8.324 -4.631 -1.668 1026 H ALA 139 H ALA 139 -6.384 -9.161 2.250 1027 HA ALA 139 HA ALA 139 -3.638 -9.911 2.589 1028 HB1 ALA 139 1HB ALA 139 -5.327 -10.856 4.086 1029 HB2 ALA 139 2HB ALA 139 -4.609 -12.162 3.146 1030 HB3 ALA 139 3HB ALA 139 -6.198 -11.533 2.713 1031 H GLY 140 H GLY 140 -2.583 -11.603 1.332 1032 HA2 GLY 140 2HA GLY 140 -3.626 -11.512 -1.414 1033 HA3 GLY 140 1HA GLY 140 -1.917 -11.424 -0.998 1034 HA PRO 141 HA PRO 141 -2.543 -15.761 -1.980 1035 HB2 PRO 141 2HB PRO 141 0.184 -15.915 -2.688 1036 HB3 PRO 141 1HB PRO 141 -1.225 -15.976 -3.740 1037 HG2 PRO 141 2HG PRO 141 0.630 -13.897 -3.684 1038 HG3 PRO 141 1HG PRO 141 -1.015 -13.783 -4.332 1039 HD2 PRO 141 2HD PRO 141 0.064 -12.861 -1.720 1040 HD3 PRO 141 1HD PRO 141 -1.227 -12.175 -2.733 1041 H ALA 142 H ALA 142 -2.561 -16.940 -0.381 1042 HA ALA 142 HA ALA 142 -0.181 -17.321 1.304 1043 HB1 ALA 142 1HB ALA 142 -3.087 -17.976 1.877 1044 HB2 ALA 142 2HB ALA 142 -2.165 -16.661 2.602 1045 HB3 ALA 142 3HB ALA 142 -1.738 -18.341 2.953 1046 H GLU 143 H GLU 143 0.925 -18.928 0.377 1047 HA GLU 143 HA GLU 143 -0.599 -21.230 -0.632 1048 HB2 GLU 143 2HB GLU 143 0.275 -19.708 -2.443 1049 HB3 GLU 143 1HB GLU 143 1.896 -20.087 -1.887 1050 HG2 GLU 143 2HG GLU 143 1.489 -22.458 -2.394 1051 HG3 GLU 143 1HG GLU 143 -0.099 -22.022 -3.029 Start of MODEL 12 1 H1 MET 1 1HT MET 1 -9.744 -20.132 64.175 2 H2 MET 1 2HT MET 1 -9.782 -19.163 62.804 3 H3 MET 1 3HT MET 1 -8.429 -20.108 63.105 4 HA MET 1 HA MET 1 -9.732 -20.993 61.357 5 HB2 MET 1 2HB MET 1 -10.093 -23.307 62.299 6 HB3 MET 1 1HB MET 1 -8.501 -22.635 62.612 7 HG2 MET 1 2HG MET 1 -9.090 -22.158 64.896 8 HG3 MET 1 1HG MET 1 -10.765 -22.614 64.601 9 HE1 MET 1 2HE MET 1 -10.532 -26.470 64.161 10 HE2 MET 1 3HE MET 1 -10.477 -25.282 62.863 11 HE3 MET 1 1HE MET 1 -11.587 -25.060 64.218 12 H SER 2 H SER 2 -11.536 -19.434 61.251 13 HA SER 2 HA SER 2 -13.961 -20.176 62.605 14 HB2 SER 2 2HB SER 2 -13.539 -18.181 60.386 15 HB3 SER 2 1HB SER 2 -14.893 -18.263 61.511 16 HG SER 2 HG SER 2 -13.256 -17.975 63.200 17 H ASP 3 H ASP 3 -12.497 -20.557 59.431 18 HA ASP 3 HA ASP 3 -15.009 -21.642 58.373 19 HB2 ASP 3 2HB ASP 3 -12.537 -20.648 56.978 20 HB3 ASP 3 1HB ASP 3 -13.830 -21.502 56.157 21 H ASN 4 H ASN 4 -15.229 -23.717 58.147 22 HA ASN 4 HA ASN 4 -12.938 -25.481 58.211 23 HB2 ASN 4 2HB ASN 4 -15.893 -26.088 57.758 24 HB3 ASN 4 1HB ASN 4 -14.632 -27.308 57.883 25 HD21 ASN 4 1HD2 ASN 4 -13.676 -27.677 59.907 26 HD22 ASN 4 2HD2 ASN 4 -14.423 -27.144 61.372 27 H ASN 5 H ASN 5 -11.809 -25.121 56.488 28 HA ASN 5 HA ASN 5 -13.181 -24.709 53.938 29 HB2 ASN 5 2HB ASN 5 -11.124 -23.558 53.222 30 HB3 ASN 5 1HB ASN 5 -11.873 -22.807 54.627 31 HD21 ASN 5 1HD2 ASN 5 -10.827 -22.951 56.643 32 HD22 ASN 5 2HD2 ASN 5 -9.174 -23.385 56.769 33 H GLY 6 H GLY 6 -12.031 -25.392 52.016 34 HA2 GLY 6 2HA GLY 6 -10.020 -27.285 51.945 35 HA3 GLY 6 1HA GLY 6 -11.586 -28.116 51.938 36 H THR 7 H THR 7 -10.903 -28.692 49.660 37 HA THR 7 HA THR 7 -10.901 -26.507 47.839 38 HB THR 7 HB THR 7 -11.002 -28.459 46.125 39 HG1 THR 7 1HG THR 7 -10.952 -30.424 46.873 40 HG21 THR 7 3HG2 THR 7 -8.949 -27.229 46.626 41 HG22 THR 7 1HG2 THR 7 -8.608 -28.949 46.435 42 HG23 THR 7 2HG2 THR 7 -8.680 -28.238 48.048 43 HA PRO 8 HA PRO 8 -15.298 -26.072 47.806 44 HB2 PRO 8 2HB PRO 8 -15.506 -24.684 45.443 45 HB3 PRO 8 1HB PRO 8 -15.069 -23.950 46.986 46 HG2 PRO 8 2HG PRO 8 -13.309 -24.833 44.744 47 HG3 PRO 8 1HG PRO 8 -13.198 -23.384 45.760 48 HD2 PRO 8 2HD PRO 8 -11.616 -25.505 46.149 49 HD3 PRO 8 1HD PRO 8 -12.215 -24.534 47.513 50 H GLU 9 H GLU 9 -17.081 -26.974 46.890 51 HA GLU 9 HA GLU 9 -16.698 -29.250 45.246 52 HB2 GLU 9 2HB GLU 9 -19.201 -27.820 46.141 53 HB3 GLU 9 1HB GLU 9 -19.212 -29.324 45.234 54 HG2 GLU 9 2HG GLU 9 -17.994 -28.918 47.959 55 HG3 GLU 9 1HG GLU 9 -19.536 -29.705 47.619 56 HA PRO 10 HA PRO 10 -16.853 -26.864 41.517 57 HB2 PRO 10 2HB PRO 10 -15.998 -28.773 39.849 58 HB3 PRO 10 1HB PRO 10 -14.905 -27.989 40.993 59 HG2 PRO 10 2HG PRO 10 -16.164 -30.684 41.115 60 HG3 PRO 10 1HG PRO 10 -14.570 -30.159 41.678 61 HD2 PRO 10 2HD PRO 10 -16.843 -30.504 43.273 62 HD3 PRO 10 1HD PRO 10 -15.374 -29.609 43.723 63 H GLN 11 H GLN 11 -18.287 -26.558 39.934 64 HA GLN 11 HA GLN 11 -20.696 -28.033 39.945 65 HB2 GLN 11 2HB GLN 11 -21.365 -26.490 38.111 66 HB3 GLN 11 1HB GLN 11 -20.770 -25.651 39.531 67 HG2 GLN 11 2HG GLN 11 -18.561 -25.422 38.381 68 HG3 GLN 11 1HG GLN 11 -19.310 -26.102 36.941 69 HE21 GLN 11 1HE2 GLN 11 -19.214 -23.405 39.092 70 HE22 GLN 11 2HE2 GLN 11 -20.025 -22.277 38.079 71 H VAL 12 H VAL 12 -21.380 -29.528 38.646 72 HA VAL 12 HA VAL 12 -19.472 -30.949 37.086 73 HB VAL 12 HB VAL 12 -22.461 -31.458 37.366 74 HG11 VAL 12 1HG1 VAL 12 -21.966 -33.724 36.609 75 HG12 VAL 12 2HG1 VAL 12 -20.274 -33.282 36.392 76 HG13 VAL 12 3HG1 VAL 12 -21.517 -32.528 35.393 77 HG21 VAL 12 3HG2 VAL 12 -20.144 -32.700 38.840 78 HG22 VAL 12 1HG2 VAL 12 -21.837 -33.157 39.009 79 HG23 VAL 12 2HG2 VAL 12 -21.300 -31.556 39.521 80 H GLU 13 H GLU 13 -18.871 -29.614 35.516 81 HA GLU 13 HA GLU 13 -20.629 -28.316 33.707 82 HB2 GLU 13 2HB GLU 13 -18.361 -27.480 34.207 83 HB3 GLU 13 1HB GLU 13 -17.674 -28.928 33.492 84 HG2 GLU 13 2HG GLU 13 -18.587 -28.289 31.317 85 HG3 GLU 13 1HG GLU 13 -19.285 -26.844 32.042 86 H THR 14 H THR 14 -21.605 -29.171 32.043 87 HA THR 14 HA THR 14 -21.443 -31.908 31.443 88 HB THR 14 HB THR 14 -22.697 -29.695 29.801 89 HG1 THR 14 1HG THR 14 -23.521 -31.086 32.123 90 HG21 THR 14 3HG2 THR 14 -22.592 -31.922 28.714 91 HG22 THR 14 1HG2 THR 14 -24.251 -31.464 29.104 92 HG23 THR 14 2HG2 THR 14 -23.396 -32.627 30.116 93 H THR 15 H THR 15 -19.478 -32.520 30.744 94 HA THR 15 HA THR 15 -18.125 -31.066 28.714 95 HB THR 15 HB THR 15 -16.736 -32.065 30.407 96 HG1 THR 15 1HG THR 15 -15.245 -33.077 29.187 97 HG21 THR 15 3HG2 THR 15 -16.521 -34.516 30.723 98 HG22 THR 15 1HG2 THR 15 -17.858 -34.756 29.595 99 HG23 THR 15 2HG2 THR 15 -18.135 -33.927 31.127 100 H SER 16 H SER 16 -19.780 -31.079 27.238 101 HA SER 16 HA SER 16 -19.601 -33.154 25.257 102 HB2 SER 16 2HB SER 16 -22.286 -32.314 26.422 103 HB3 SER 16 1HB SER 16 -22.016 -33.479 25.126 104 HG SER 16 HG SER 16 -20.620 -34.443 26.996 105 H VAL 17 H VAL 17 -20.662 -32.253 23.251 106 HA VAL 17 HA VAL 17 -20.279 -29.455 23.081 107 HB VAL 17 HB VAL 17 -21.037 -29.658 20.734 108 HG11 VAL 17 1HG1 VAL 17 -18.713 -30.152 21.247 109 HG12 VAL 17 2HG1 VAL 17 -19.294 -31.142 19.910 110 HG13 VAL 17 3HG1 VAL 17 -19.125 -31.845 21.518 111 HG21 VAL 17 3HG2 VAL 17 -21.603 -31.849 19.790 112 HG22 VAL 17 1HG2 VAL 17 -22.771 -31.334 21.006 113 HG23 VAL 17 2HG2 VAL 17 -21.557 -32.549 21.408 114 H PHE 18 H PHE 18 -21.721 -27.920 23.037 115 HA PHE 18 HA PHE 18 -24.540 -28.602 23.423 116 HB2 PHE 18 2HB PHE 18 -23.358 -28.042 25.609 117 HB3 PHE 18 1HB PHE 18 -23.018 -26.450 24.957 118 HD1 PHE 18 1HD PHE 18 -25.901 -28.725 25.611 119 HD2 PHE 18 2HD PHE 18 -24.463 -24.722 25.492 120 HE1 PHE 18 1HE PHE 18 -28.042 -27.934 26.521 121 HE2 PHE 18 2HE PHE 18 -26.605 -23.918 26.399 122 HZ PHE 18 HZ PHE 18 -28.400 -25.527 26.915 123 H ARG 19 H ARG 19 -25.657 -26.201 23.281 124 HA ARG 19 HA ARG 19 -25.044 -25.353 20.584 125 HB2 ARG 19 2HB ARG 19 -27.156 -24.434 22.549 126 HB3 ARG 19 1HB ARG 19 -27.046 -23.928 20.870 127 HG2 ARG 19 2HG ARG 19 -27.456 -26.781 21.758 128 HG3 ARG 19 1HG ARG 19 -28.754 -25.678 21.304 129 HD2 ARG 19 2HD ARG 19 -26.465 -26.490 19.501 130 HD3 ARG 19 1HD ARG 19 -28.075 -27.203 19.464 131 HE ARG 19 HE ARG 19 -28.394 -24.475 19.241 132 HH11 ARG 19 1HH1 ARG 19 -26.837 -27.006 17.306 133 HH12 ARG 19 2HH1 ARG 19 -27.164 -26.282 15.806 134 HH21 ARG 19 1HH2 ARG 19 -28.866 -23.484 17.186 135 HH22 ARG 19 2HH2 ARG 19 -28.393 -24.248 15.736 136 H ALA 20 H ALA 20 -24.808 -23.048 20.086 137 HA ALA 20 HA ALA 20 -22.958 -21.762 21.926 138 HB1 ALA 20 1HB ALA 20 -22.355 -21.942 19.557 139 HB2 ALA 20 2HB ALA 20 -22.536 -20.250 20.023 140 HB3 ALA 20 3HB ALA 20 -23.814 -21.056 19.113 141 H ASP 21 H ASP 21 -25.759 -21.999 22.431 142 HA ASP 21 HA ASP 21 -27.327 -19.710 22.057 143 HB2 ASP 21 2HB ASP 21 -28.188 -21.886 22.827 144 HB3 ASP 21 1HB ASP 21 -27.340 -21.682 24.351 145 H LEU 22 H LEU 22 -25.306 -20.657 24.814 146 HA LEU 22 HA LEU 22 -24.542 -17.949 25.286 147 HB2 LEU 22 2HB LEU 22 -26.684 -18.042 26.503 148 HB3 LEU 22 1HB LEU 22 -26.125 -19.442 27.391 149 HG LEU 22 HG LEU 22 -24.363 -18.038 28.435 150 HD11 LEU 22 1HD1 LEU 22 -25.761 -15.770 27.028 151 HD12 LEU 22 2HD1 LEU 22 -24.122 -16.341 26.721 152 HD13 LEU 22 3HD1 LEU 22 -24.524 -15.601 28.268 153 HD21 LEU 22 3HD2 LEU 22 -27.185 -17.029 28.777 154 HD22 LEU 22 1HD2 LEU 22 -25.867 -16.801 29.926 155 HD23 LEU 22 2HD2 LEU 22 -26.477 -18.423 29.591 156 H LEU 23 H LEU 23 -22.460 -18.467 25.145 157 HA LEU 23 HA LEU 23 -21.390 -20.705 26.672 158 HB2 LEU 23 2HB LEU 23 -20.048 -18.789 24.755 159 HB3 LEU 23 1HB LEU 23 -19.274 -20.169 25.507 160 HG LEU 23 HG LEU 23 -21.543 -20.285 23.510 161 HD11 LEU 23 1HD1 LEU 23 -18.626 -20.980 23.227 162 HD12 LEU 23 2HD1 LEU 23 -19.458 -19.611 22.483 163 HD13 LEU 23 3HD1 LEU 23 -19.875 -21.258 22.010 164 HD21 LEU 23 3HD2 LEU 23 -19.975 -22.512 24.824 165 HD22 LEU 23 1HD2 LEU 23 -21.129 -22.715 23.505 166 HD23 LEU 23 2HD2 LEU 23 -21.682 -22.142 25.076 167 H LYS 24 H LYS 24 -19.454 -20.281 28.053 168 HA LYS 24 HA LYS 24 -20.011 -17.857 29.529 169 HB2 LYS 24 2HB LYS 24 -18.492 -20.344 30.389 170 HB3 LYS 24 1HB LYS 24 -18.676 -18.910 31.380 171 HG2 LYS 24 2HG LYS 24 -20.270 -20.500 32.165 172 HG3 LYS 24 1HG LYS 24 -21.177 -19.278 31.278 173 HD2 LYS 24 2HD LYS 24 -21.148 -20.819 29.296 174 HD3 LYS 24 1HD LYS 24 -20.403 -22.039 30.322 175 HE2 LYS 24 2HE LYS 24 -23.104 -20.766 30.784 176 HE3 LYS 24 1HE LYS 24 -22.840 -22.348 30.067 177 HZ1 LYS 24 3HZ LYS 24 -23.424 -22.569 32.362 178 HZ2 LYS 24 1HZ LYS 24 -22.164 -21.564 32.865 179 HZ3 LYS 24 2HZ LYS 24 -21.845 -23.069 32.172 180 H GLU 25 H GLU 25 -18.535 -16.395 30.039 181 HA GLU 25 HA GLU 25 -16.662 -15.713 28.107 182 HB2 GLU 25 2HB GLU 25 -17.246 -14.681 30.836 183 HB3 GLU 25 1HB GLU 25 -15.966 -14.003 29.839 184 HG2 GLU 25 2HG GLU 25 -18.800 -14.264 28.936 185 HG3 GLU 25 1HG GLU 25 -18.151 -12.823 29.721 186 H MET 26 H MET 26 -14.733 -16.416 27.738 187 HA MET 26 HA MET 26 -13.093 -17.509 29.872 188 HB2 MET 26 2HB MET 26 -13.211 -18.511 27.508 189 HB3 MET 26 1HB MET 26 -12.372 -17.087 26.945 190 HG2 MET 26 2HG MET 26 -11.254 -19.037 28.969 191 HG3 MET 26 1HG MET 26 -10.924 -19.098 27.247 192 HE1 MET 26 3HE MET 26 -10.515 -16.004 26.506 193 HE2 MET 26 1HE MET 26 -9.430 -17.285 25.966 194 HE3 MET 26 2HE MET 26 -8.775 -15.838 26.732 195 H GLU 27 H GLU 27 -11.705 -16.251 30.936 196 HA GLU 27 HA GLU 27 -10.714 -13.815 29.726 197 HB2 GLU 27 2HB GLU 27 -12.690 -13.135 31.043 198 HB3 GLU 27 1HB GLU 27 -12.064 -13.988 32.441 199 HG2 GLU 27 2HG GLU 27 -11.752 -11.579 32.651 200 HG3 GLU 27 1HG GLU 27 -10.211 -12.426 32.600 201 H SER 28 H SER 28 -8.780 -13.204 30.648 202 HA SER 28 HA SER 28 -7.557 -14.908 32.658 203 HB2 SER 28 2HB SER 28 -5.525 -15.177 31.207 204 HB3 SER 28 1HB SER 28 -6.945 -16.034 30.603 205 HG SER 28 HG SER 28 -6.573 -14.983 28.845 206 H SER 29 H SER 29 -7.463 -12.095 30.536 207 HA SER 29 HA SER 29 -6.641 -10.017 30.675 208 HB2 SER 29 2HB SER 29 -6.577 -10.551 33.656 209 HB3 SER 29 1HB SER 29 -6.600 -8.964 32.879 210 HG SER 29 HG SER 29 -8.578 -10.446 31.904 211 H THR 30 H THR 30 -4.929 -12.359 30.521 212 HA THR 30 HA THR 30 -2.442 -11.488 31.729 213 HB THR 30 HB THR 30 -3.160 -14.006 30.223 214 HG1 THR 30 1HG THR 30 -3.857 -13.166 32.644 215 HG21 THR 30 3HG2 THR 30 -1.125 -14.929 31.260 216 HG22 THR 30 1HG2 THR 30 -0.823 -13.383 32.053 217 HG23 THR 30 2HG2 THR 30 -0.723 -13.508 30.299 218 H GLY 31 H GLY 31 -1.303 -10.116 30.487 219 HA2 GLY 31 2HA GLY 31 -1.645 -9.998 27.633 220 HA3 GLY 31 1HA GLY 31 -0.555 -9.013 28.611 221 H THR 32 H THR 32 -1.069 -12.234 27.433 222 HA THR 32 HA THR 32 1.534 -13.134 28.019 223 HB THR 32 HB THR 32 -0.331 -14.696 27.923 224 HG1 THR 32 1HG THR 32 1.208 -15.603 25.769 225 HG21 THR 32 3HG2 THR 32 -1.667 -13.712 26.128 226 HG22 THR 32 1HG2 THR 32 -1.335 -15.407 25.780 227 HG23 THR 32 2HG2 THR 32 -0.428 -14.140 24.949 228 H ALA 33 H ALA 33 3.232 -13.404 26.765 229 HA ALA 33 HA ALA 33 3.581 -11.539 24.612 230 HB1 ALA 33 1HB ALA 33 5.901 -12.340 24.616 231 HB2 ALA 33 2HB ALA 33 5.456 -13.620 25.742 232 HB3 ALA 33 3HB ALA 33 5.368 -11.936 26.249 233 HA PRO 34 HA PRO 34 2.719 -14.517 21.419 234 HB2 PRO 34 2HB PRO 34 4.005 -13.240 19.356 235 HB3 PRO 34 1HB PRO 34 2.391 -12.788 19.917 236 HG2 PRO 34 2HG PRO 34 5.029 -11.525 20.512 237 HG3 PRO 34 1HG PRO 34 3.455 -10.766 20.223 238 HD2 PRO 34 2HD PRO 34 4.515 -11.084 22.701 239 HD3 PRO 34 1HD PRO 34 2.767 -11.073 22.394 240 H ALA 35 H ALA 35 3.835 -16.288 20.806 241 HA ALA 35 HA ALA 35 6.427 -16.766 21.762 242 HB1 ALA 35 1HB ALA 35 4.793 -18.559 21.380 243 HB2 ALA 35 2HB ALA 35 6.306 -18.882 20.536 244 HB3 ALA 35 3HB ALA 35 4.907 -18.293 19.640 245 H SER 36 H SER 36 5.224 -16.173 18.509 246 HA SER 36 HA SER 36 6.114 -15.377 16.598 247 HB2 SER 36 2HB SER 36 8.437 -14.417 18.297 248 HB3 SER 36 1HB SER 36 8.008 -13.832 16.692 249 HG SER 36 HG SER 36 5.878 -13.374 17.788 250 H THR 37 H THR 37 7.390 -17.930 18.168 251 HA THR 37 HA THR 37 9.635 -18.315 16.421 252 HB THR 37 HB THR 37 9.888 -20.391 17.911 253 HG1 THR 37 1HG THR 37 8.070 -20.622 18.997 254 HG21 THR 37 3HG2 THR 37 10.919 -19.054 19.698 255 HG22 THR 37 1HG2 THR 37 10.025 -17.632 19.154 256 HG23 THR 37 2HG2 THR 37 11.258 -18.347 18.119 257 H GLY 38 H GLY 38 9.767 -19.896 14.929 258 HA2 GLY 38 2HA GLY 38 9.101 -21.864 13.835 259 HA3 GLY 38 1HA GLY 38 7.509 -21.728 14.583 260 H ALA 39 H ALA 39 8.080 -18.723 13.689 261 HA ALA 39 HA ALA 39 6.289 -18.862 11.474 262 HB1 ALA 39 1HB ALA 39 6.526 -16.421 11.386 263 HB2 ALA 39 2HB ALA 39 7.867 -16.509 12.526 264 HB3 ALA 39 3HB ALA 39 6.246 -16.977 13.035 265 H GLU 40 H GLU 40 9.666 -18.906 11.847 266 HA GLU 40 HA GLU 40 10.418 -17.993 9.278 267 HB2 GLU 40 2HB GLU 40 12.619 -19.027 9.759 268 HB3 GLU 40 1HB GLU 40 12.054 -17.944 11.018 269 HG2 GLU 40 2HG GLU 40 11.374 -19.878 12.364 270 HG3 GLU 40 1HG GLU 40 11.932 -20.943 11.080 271 H ASN 41 H ASN 41 8.913 -20.820 10.223 272 HA ASN 41 HA ASN 41 9.845 -22.701 8.320 273 HB2 ASN 41 2HB ASN 41 8.310 -23.345 10.143 274 HB3 ASN 41 1HB ASN 41 7.045 -22.347 9.441 275 HD21 ASN 41 1HD2 ASN 41 5.841 -23.163 7.683 276 HD22 ASN 41 2HD2 ASN 41 6.046 -24.757 7.099 277 H LEU 42 H LEU 42 7.790 -19.943 8.131 278 HA LEU 42 HA LEU 42 7.351 -20.469 5.306 279 HB2 LEU 42 2HB LEU 42 5.305 -20.549 6.698 280 HB3 LEU 42 1HB LEU 42 5.632 -18.920 7.245 281 HG LEU 42 HG LEU 42 5.343 -18.106 4.939 282 HD11 LEU 42 1HD1 LEU 42 4.574 -20.953 4.355 283 HD12 LEU 42 2HD1 LEU 42 5.965 -20.080 3.705 284 HD13 LEU 42 3HD1 LEU 42 4.330 -19.586 3.270 285 HD21 LEU 42 3HD2 LEU 42 3.033 -19.708 6.024 286 HD22 LEU 42 1HD2 LEU 42 2.917 -18.398 4.852 287 HD23 LEU 42 2HD2 LEU 42 3.472 -18.066 6.493 288 HA PRO 43 HA PRO 43 9.713 -16.552 5.410 289 HB2 PRO 43 2HB PRO 43 11.613 -17.249 3.669 290 HB3 PRO 43 1HB PRO 43 11.653 -17.858 5.326 291 HG2 PRO 43 2HG PRO 43 10.973 -19.282 2.816 292 HG3 PRO 43 1HG PRO 43 11.610 -19.925 4.337 293 HD2 PRO 43 2HD PRO 43 8.881 -19.901 3.422 294 HD3 PRO 43 1HD PRO 43 9.514 -20.530 4.957 295 H ALA 44 H ALA 44 7.433 -17.549 3.765 296 HA ALA 44 HA ALA 44 7.614 -15.718 1.534 297 HB1 ALA 44 1HB ALA 44 8.248 -17.888 0.578 298 HB2 ALA 44 2HB ALA 44 6.637 -17.429 0.029 299 HB3 ALA 44 3HB ALA 44 6.825 -18.637 1.301 300 H GLY 45 H GLY 45 5.206 -15.705 0.625 301 HA2 GLY 45 2HA GLY 45 2.906 -15.989 1.297 302 HA3 GLY 45 1HA GLY 45 3.444 -15.936 2.982 303 H SER 46 H SER 46 3.883 -14.047 0.072 304 HA SER 46 HA SER 46 3.880 -11.615 1.601 305 HB2 SER 46 2HB SER 46 4.096 -11.994 -1.373 306 HB3 SER 46 1HB SER 46 4.705 -10.658 -0.399 307 HG SER 46 HG SER 46 5.635 -13.301 -0.578 308 H ALA 47 H ALA 47 2.454 -9.908 0.996 309 HA ALA 47 HA ALA 47 -0.148 -10.789 -0.074 310 HB1 ALA 47 1HB ALA 47 -1.156 -9.138 1.444 311 HB2 ALA 47 2HB ALA 47 0.446 -8.757 2.081 312 HB3 ALA 47 3HB ALA 47 -0.244 -10.356 2.337 313 H LEU 48 H LEU 48 -1.394 -8.564 -0.678 314 HA LEU 48 HA LEU 48 0.537 -7.020 -2.200 315 HB2 LEU 48 2HB LEU 48 -0.825 -7.088 -4.201 316 HB3 LEU 48 1HB LEU 48 -0.318 -8.692 -3.743 317 HG LEU 48 HG LEU 48 -3.096 -7.647 -3.148 318 HD11 LEU 48 1HD1 LEU 48 -3.810 -8.832 -5.157 319 HD12 LEU 48 2HD1 LEU 48 -2.131 -9.208 -5.543 320 HD13 LEU 48 3HD1 LEU 48 -2.686 -7.534 -5.553 321 HD21 LEU 48 3HD2 LEU 48 -2.394 -9.635 -1.882 322 HD22 LEU 48 1HD2 LEU 48 -1.975 -10.450 -3.393 323 HD23 LEU 48 2HD2 LEU 48 -3.654 -10.033 -3.048 324 H LEU 49 H LEU 49 -0.307 -5.042 -3.021 325 HA LEU 49 HA LEU 49 -2.539 -4.073 -1.444 326 HB2 LEU 49 2HB LEU 49 -1.392 -1.839 -1.393 327 HB3 LEU 49 1HB LEU 49 -0.687 -3.075 -0.398 328 HG LEU 49 HG LEU 49 1.135 -3.363 -2.113 329 HD11 LEU 49 1HD1 LEU 49 1.512 -1.619 -3.770 330 HD12 LEU 49 2HD1 LEU 49 -0.034 -0.876 -3.363 331 HD13 LEU 49 3HD1 LEU 49 0.009 -2.481 -4.087 332 HD21 LEU 49 3HD2 LEU 49 1.383 -1.961 -0.105 333 HD22 LEU 49 1HD2 LEU 49 0.864 -0.568 -1.043 334 HD23 LEU 49 2HD2 LEU 49 2.363 -1.394 -1.463 335 H VAL 50 H VAL 50 -3.885 -2.613 -2.411 336 HA VAL 50 HA VAL 50 -3.386 -2.212 -5.258 337 HB VAL 50 HB VAL 50 -5.786 -2.350 -5.754 338 HG11 VAL 50 1HG1 VAL 50 -4.844 -4.770 -4.243 339 HG12 VAL 50 2HG1 VAL 50 -4.620 -4.431 -5.962 340 HG13 VAL 50 3HG1 VAL 50 -6.231 -4.728 -5.325 341 HG21 VAL 50 3HG2 VAL 50 -6.183 -3.100 -2.881 342 HG22 VAL 50 1HG2 VAL 50 -7.443 -3.081 -4.114 343 HG23 VAL 50 2HG2 VAL 50 -6.677 -1.565 -3.613 344 H VAL 51 H VAL 51 -3.531 -0.156 -5.943 345 HA VAL 51 HA VAL 51 -4.246 1.858 -3.928 346 HB VAL 51 HB VAL 51 -3.156 2.256 -6.737 347 HG11 VAL 51 1HG1 VAL 51 -2.577 4.503 -5.943 348 HG12 VAL 51 2HG1 VAL 51 -3.306 4.132 -4.379 349 HG13 VAL 51 3HG1 VAL 51 -4.313 4.202 -5.825 350 HG21 VAL 51 3HG2 VAL 51 -1.657 2.173 -4.119 351 HG22 VAL 51 1HG2 VAL 51 -0.995 2.707 -5.663 352 HG23 VAL 51 2HG2 VAL 51 -1.510 1.031 -5.458 353 H LYS 52 H LYS 52 -6.136 2.439 -3.791 354 HA LYS 52 HA LYS 52 -8.120 1.684 -5.693 355 HB2 LYS 52 2HB LYS 52 -8.305 1.878 -3.140 356 HB3 LYS 52 1HB LYS 52 -8.420 3.608 -3.417 357 HG2 LYS 52 2HG LYS 52 -10.448 3.304 -4.689 358 HG3 LYS 52 1HG LYS 52 -10.327 1.545 -4.497 359 HD2 LYS 52 2HD LYS 52 -10.326 1.955 -2.011 360 HD3 LYS 52 1HD LYS 52 -10.749 3.625 -2.367 361 HE2 LYS 52 2HE LYS 52 -12.775 2.870 -3.500 362 HE3 LYS 52 1HE LYS 52 -12.331 1.193 -3.159 363 HZ1 LYS 52 3HZ LYS 52 -13.095 3.294 -1.229 364 HZ2 LYS 52 1HZ LYS 52 -12.288 1.889 -0.761 365 HZ3 LYS 52 2HZ LYS 52 -13.817 1.790 -1.468 366 H ARG 53 H ARG 53 -6.513 4.650 -4.668 367 HA ARG 53 HA ARG 53 -6.731 5.829 -7.218 368 HB2 ARG 53 2HB ARG 53 -9.055 6.259 -6.348 369 HB3 ARG 53 1HB ARG 53 -8.348 7.109 -4.985 370 HG2 ARG 53 2HG ARG 53 -9.151 8.689 -6.637 371 HG3 ARG 53 1HG ARG 53 -7.393 8.763 -6.541 372 HD2 ARG 53 2HD ARG 53 -7.226 7.357 -8.547 373 HD3 ARG 53 1HD ARG 53 -8.983 7.277 -8.635 374 HE ARG 53 HE ARG 53 -8.312 9.940 -8.580 375 HH11 ARG 53 1HH1 ARG 53 -7.728 7.201 -10.792 376 HH12 ARG 53 2HH1 ARG 53 -7.591 8.182 -12.162 377 HH21 ARG 53 1HH2 ARG 53 -8.117 11.266 -10.506 378 HH22 ARG 53 2HH2 ARG 53 -7.802 10.526 -12.001 379 H GLY 54 H GLY 54 -5.078 7.383 -7.352 380 HA2 GLY 54 2HA GLY 54 -4.115 9.162 -5.793 381 HA3 GLY 54 1HA GLY 54 -3.657 7.768 -4.849 382 HA PRO 55 HA PRO 55 -0.660 8.826 -8.711 383 HB2 PRO 55 2HB PRO 55 0.186 11.012 -6.853 384 HB3 PRO 55 1HB PRO 55 0.260 10.959 -8.621 385 HG2 PRO 55 2HG PRO 55 -1.638 12.342 -7.472 386 HG3 PRO 55 1HG PRO 55 -2.047 11.280 -8.833 387 HD2 PRO 55 2HD PRO 55 -2.486 10.847 -5.906 388 HD3 PRO 55 1HD PRO 55 -3.551 10.484 -7.278 389 H ASN 56 H ASN 56 -0.635 8.321 -5.354 390 HA ASN 56 HA ASN 56 1.870 7.726 -4.421 391 HB2 ASN 56 2HB ASN 56 0.061 7.163 -3.003 392 HB3 ASN 56 1HB ASN 56 -0.748 6.227 -4.248 393 HD21 ASN 56 1HD2 ASN 56 1.645 6.153 -1.715 394 HD22 ASN 56 2HD2 ASN 56 1.876 4.436 -1.765 395 H ALA 57 H ALA 57 -0.064 5.731 -6.651 396 HA ALA 57 HA ALA 57 2.228 4.846 -8.074 397 HB1 ALA 57 1HB ALA 57 0.742 2.715 -6.511 398 HB2 ALA 57 2HB ALA 57 2.374 3.273 -6.165 399 HB3 ALA 57 3HB ALA 57 2.031 2.437 -7.678 400 H GLY 58 H GLY 58 -1.146 4.131 -7.307 401 HA2 GLY 58 2HA GLY 58 -2.993 3.952 -8.680 402 HA3 GLY 58 1HA GLY 58 -2.034 4.714 -9.948 403 H ALA 59 H ALA 59 -1.681 1.661 -8.171 404 HA ALA 59 HA ALA 59 -2.231 0.028 -10.441 405 HB1 ALA 59 1HB ALA 59 0.053 0.740 -11.009 406 HB2 ALA 59 2HB ALA 59 0.038 -0.964 -10.543 407 HB3 ALA 59 3HB ALA 59 0.612 0.255 -9.407 408 H ARG 60 H ARG 60 -1.217 -2.311 -9.639 409 HA ARG 60 HA ARG 60 -1.451 -2.516 -6.763 410 HB2 ARG 60 2HB ARG 60 -2.928 -4.461 -6.937 411 HB3 ARG 60 1HB ARG 60 -3.722 -3.010 -7.536 412 HG2 ARG 60 2HG ARG 60 -3.116 -3.828 -9.852 413 HG3 ARG 60 1HG ARG 60 -2.644 -5.350 -9.088 414 HD2 ARG 60 2HD ARG 60 -4.904 -5.546 -9.887 415 HD3 ARG 60 1HD ARG 60 -4.921 -5.515 -8.124 416 HE ARG 60 HE ARG 60 -5.287 -2.975 -9.448 417 HH11 ARG 60 1HH1 ARG 60 -6.945 -5.752 -7.916 418 HH12 ARG 60 2HH1 ARG 60 -8.403 -4.910 -7.705 419 HH21 ARG 60 1HH2 ARG 60 -7.357 -1.863 -9.122 420 HH22 ARG 60 2HH2 ARG 60 -8.665 -2.682 -8.435 421 H PHE 61 H PHE 61 -0.106 -4.032 -5.906 422 HA PHE 61 HA PHE 61 1.149 -5.957 -7.559 423 HB2 PHE 61 2HB PHE 61 3.492 -5.111 -7.247 424 HB3 PHE 61 1HB PHE 61 2.513 -4.146 -8.336 425 HD1 PHE 61 1HD PHE 61 1.830 -1.880 -7.695 426 HD2 PHE 61 2HD PHE 61 4.310 -4.238 -5.161 427 HE1 PHE 61 1HE PHE 61 2.470 0.141 -6.445 428 HE2 PHE 61 2HE PHE 61 4.947 -2.222 -3.906 429 HZ PHE 61 HZ PHE 61 4.025 -0.030 -4.547 430 H LEU 62 H LEU 62 2.620 -7.300 -6.464 431 HA LEU 62 HA LEU 62 1.732 -7.929 -3.793 432 HB2 LEU 62 2HB LEU 62 2.157 -9.618 -5.564 433 HB3 LEU 62 1HB LEU 62 3.846 -9.161 -5.567 434 HG LEU 62 HG LEU 62 3.759 -9.813 -3.063 435 HD11 LEU 62 1HD1 LEU 62 2.192 -11.622 -2.575 436 HD12 LEU 62 2HD1 LEU 62 1.389 -11.323 -4.117 437 HD13 LEU 62 3HD1 LEU 62 1.386 -10.081 -2.863 438 HD21 LEU 62 3HD2 LEU 62 3.663 -11.885 -5.244 439 HD22 LEU 62 1HD2 LEU 62 4.357 -12.107 -3.638 440 HD23 LEU 62 2HD2 LEU 62 5.081 -10.954 -4.761 441 H LEU 63 H LEU 63 2.996 -7.639 -1.937 442 HA LEU 63 HA LEU 63 5.442 -6.093 -2.321 443 HB2 LEU 63 2HB LEU 63 3.854 -6.724 0.160 444 HB3 LEU 63 1HB LEU 63 5.353 -5.817 0.140 445 HG LEU 63 HG LEU 63 2.779 -4.950 -1.177 446 HD11 LEU 63 1HD1 LEU 63 4.142 -4.030 1.351 447 HD12 LEU 63 2HD1 LEU 63 2.613 -4.909 1.251 448 HD13 LEU 63 3HD1 LEU 63 2.737 -3.269 0.616 449 HD21 LEU 63 3HD2 LEU 63 3.950 -2.806 -1.454 450 HD22 LEU 63 1HD2 LEU 63 4.754 -4.102 -2.337 451 HD23 LEU 63 2HD2 LEU 63 5.421 -3.533 -0.809 452 H ASP 64 H ASP 64 7.188 -7.228 -2.538 453 HA ASP 64 HA ASP 64 7.492 -9.830 -1.225 454 HB2 ASP 64 2HB ASP 64 8.111 -9.900 -3.523 455 HB3 ASP 64 1HB ASP 64 9.008 -8.397 -3.411 456 H GLN 65 H GLN 65 8.545 -6.619 -1.151 457 HA GLN 65 HA GLN 65 10.973 -6.928 0.317 458 HB2 GLN 65 2HB GLN 65 9.246 -4.484 -0.099 459 HB3 GLN 65 1HB GLN 65 10.936 -4.501 0.389 460 HG2 GLN 65 2HG GLN 65 11.612 -5.345 -1.752 461 HG3 GLN 65 1HG GLN 65 9.937 -5.587 -2.233 462 HE21 GLN 65 1HE2 GLN 65 11.070 -2.732 -0.530 463 HE22 GLN 65 2HE2 GLN 65 10.833 -1.652 -1.866 464 HA PRO 66 HA PRO 66 8.718 -7.704 4.167 465 HB2 PRO 66 2HB PRO 66 10.931 -7.426 5.820 466 HB3 PRO 66 1HB PRO 66 10.449 -8.925 5.022 467 HG2 PRO 66 2HG PRO 66 12.524 -6.937 4.221 468 HG3 PRO 66 1HG PRO 66 12.552 -8.703 4.102 469 HD2 PRO 66 2HD PRO 66 12.111 -7.151 1.971 470 HD3 PRO 66 1HD PRO 66 11.294 -8.718 2.151 471 H THR 67 H THR 67 10.842 -4.994 3.657 472 HA THR 67 HA THR 67 8.934 -3.393 5.129 473 HB THR 67 HB THR 67 11.945 -3.103 5.398 474 HG1 THR 67 1HG THR 67 10.210 -4.646 6.667 475 HG21 THR 67 3HG2 THR 67 11.407 -1.322 7.017 476 HG22 THR 67 1HG2 THR 67 9.684 -1.559 6.710 477 HG23 THR 67 2HG2 THR 67 10.733 -0.937 5.436 478 H THR 68 H THR 68 8.079 -2.197 3.627 479 HA THR 68 HA THR 68 9.770 -1.207 1.449 480 HB THR 68 HB THR 68 6.735 -1.290 1.589 481 HG1 THR 68 1HG THR 68 7.840 -3.439 1.609 482 HG21 THR 68 3HG2 THR 68 8.655 -0.985 -0.734 483 HG22 THR 68 1HG2 THR 68 7.686 0.308 -0.026 484 HG23 THR 68 2HG2 THR 68 6.895 -1.035 -0.849 485 H THR 69 H THR 69 10.460 0.861 1.810 486 HA THR 69 HA THR 69 8.983 2.528 3.658 487 HB THR 69 HB THR 69 11.004 4.006 3.493 488 HG1 THR 69 1HG THR 69 12.719 2.374 2.342 489 HG21 THR 69 3HG2 THR 69 11.695 1.104 3.992 490 HG22 THR 69 1HG2 THR 69 10.952 2.168 5.182 491 HG23 THR 69 2HG2 THR 69 12.577 2.501 4.598 492 H ALA 70 H ALA 70 7.811 4.331 3.005 493 HA ALA 70 HA ALA 70 7.990 5.054 0.163 494 HB1 ALA 70 1HB ALA 70 5.964 3.747 0.589 495 HB2 ALA 70 2HB ALA 70 5.578 5.411 0.150 496 HB3 ALA 70 3HB ALA 70 5.488 4.900 1.836 497 H GLY 71 H GLY 71 8.249 7.183 -0.224 498 HA2 GLY 71 2HA GLY 71 6.956 9.255 0.944 499 HA3 GLY 71 1HA GLY 71 8.317 9.007 2.008 500 H ARG 72 H ARG 72 10.296 9.723 1.398 501 HA ARG 72 HA ARG 72 10.249 11.625 -0.767 502 HB2 ARG 72 2HB ARG 72 10.896 12.461 1.465 503 HB3 ARG 72 1HB ARG 72 12.185 11.270 1.536 504 HG2 ARG 72 2HG ARG 72 13.241 12.342 -0.424 505 HG3 ARG 72 1HG ARG 72 11.979 13.571 -0.406 506 HD2 ARG 72 2HD ARG 72 12.679 14.250 1.835 507 HD3 ARG 72 1HD ARG 72 13.910 12.991 1.835 508 HE ARG 72 HE ARG 72 14.076 14.881 -0.354 509 HH11 ARG 72 1HH1 ARG 72 15.303 13.947 2.833 510 HH12 ARG 72 2HH1 ARG 72 16.603 15.024 2.795 511 HH21 ARG 72 1HH2 ARG 72 15.888 16.311 -0.428 512 HH22 ARG 72 2HH2 ARG 72 16.959 16.403 0.891 513 H HIS 73 H HIS 73 10.601 10.537 -2.345 514 HA HIS 73 HA HIS 73 11.601 8.464 -3.416 515 HB2 HIS 73 2HB HIS 73 12.734 11.082 -4.452 516 HB3 HIS 73 1HB HIS 73 12.708 9.575 -5.345 517 HD1 HIS 73 1HD HIS 73 10.829 9.544 -7.028 518 HD2 HIS 73 2HD HIS 73 9.926 11.875 -3.709 519 HE1 HIS 73 1HE HIS 73 8.635 10.680 -7.540 520 HA PRO 74 HA PRO 74 16.441 8.711 -3.180 521 HB2 PRO 74 2HB PRO 74 17.622 10.642 -1.669 522 HB3 PRO 74 1HB PRO 74 17.283 10.835 -3.390 523 HG2 PRO 74 2HG PRO 74 15.690 11.783 -1.036 524 HG3 PRO 74 1HG PRO 74 16.147 12.679 -2.498 525 HD2 PRO 74 2HD PRO 74 13.698 11.639 -2.264 526 HD3 PRO 74 1HD PRO 74 14.578 11.601 -3.806 527 H GLU 75 H GLU 75 14.513 9.412 -0.372 528 HA GLU 75 HA GLU 75 16.394 7.917 1.335 529 HB2 GLU 75 2HB GLU 75 14.311 9.922 2.170 530 HB3 GLU 75 1HB GLU 75 15.432 9.089 3.231 531 HG2 GLU 75 2HG GLU 75 17.286 10.224 1.976 532 HG3 GLU 75 1HG GLU 75 16.044 11.190 1.177 533 H SER 76 H SER 76 14.037 7.125 -0.452 534 HA SER 76 HA SER 76 12.889 5.301 1.479 535 HB2 SER 76 2HB SER 76 11.225 6.983 -0.423 536 HB3 SER 76 1HB SER 76 10.615 5.724 0.652 537 HG SER 76 HG SER 76 12.145 7.501 1.938 538 H ASP 77 H ASP 77 11.799 3.523 0.289 539 HA ASP 77 HA ASP 77 13.315 2.863 -2.049 540 HB2 ASP 77 2HB ASP 77 12.787 1.143 -0.370 541 HB3 ASP 77 1HB ASP 77 11.068 1.360 -0.692 542 H ILE 78 H ILE 78 9.854 3.174 -1.320 543 HA ILE 78 HA ILE 78 9.512 3.796 -4.144 544 HB ILE 78 HB ILE 78 7.122 3.272 -3.939 545 HG12 ILE 78 2HG1 ILE 78 7.767 2.266 -1.156 546 HG13 ILE 78 1HG1 ILE 78 6.914 3.765 -1.508 547 HG21 ILE 78 1HG2 ILE 78 7.322 0.830 -3.755 548 HG22 ILE 78 2HG2 ILE 78 8.929 1.028 -3.056 549 HG23 ILE 78 3HG2 ILE 78 8.621 1.541 -4.715 550 HD11 ILE 78 3HD1 ILE 78 5.112 2.512 -2.546 551 HD12 ILE 78 1HD1 ILE 78 5.372 1.987 -0.885 552 HD13 ILE 78 2HD1 ILE 78 5.961 0.997 -2.224 553 H PHE 79 H PHE 79 7.606 5.247 -4.537 554 HA PHE 79 HA PHE 79 7.824 7.560 -2.772 555 HB2 PHE 79 2HB PHE 79 7.866 8.965 -4.764 556 HB3 PHE 79 1HB PHE 79 9.186 7.806 -4.837 557 HD1 PHE 79 2HD PHE 79 8.887 5.754 -6.320 558 HD2 PHE 79 1HD PHE 79 6.275 9.109 -6.491 559 HE1 PHE 79 2HE PHE 79 8.093 5.018 -8.529 560 HE2 PHE 79 1HE PHE 79 5.472 8.378 -8.693 561 HZ PHE 79 HZ PHE 79 6.384 6.325 -9.712 562 H LEU 80 H LEU 80 5.844 8.489 -2.300 563 HA LEU 80 HA LEU 80 3.683 7.633 -3.965 564 HB2 LEU 80 2HB LEU 80 2.106 7.972 -2.169 565 HB3 LEU 80 1HB LEU 80 3.376 6.940 -1.569 566 HG LEU 80 HG LEU 80 3.117 9.884 -0.918 567 HD11 LEU 80 1HD1 LEU 80 1.214 8.648 -0.067 568 HD12 LEU 80 2HD1 LEU 80 2.275 9.128 1.258 569 HD13 LEU 80 3HD1 LEU 80 2.288 7.464 0.676 570 HD21 LEU 80 3HD2 LEU 80 4.641 9.342 0.928 571 HD22 LEU 80 1HD2 LEU 80 5.392 9.054 -0.637 572 HD23 LEU 80 2HD2 LEU 80 4.796 7.696 0.318 573 H ASP 81 H ASP 81 2.955 9.249 -5.220 574 HA ASP 81 HA ASP 81 4.083 11.831 -4.735 575 HB2 ASP 81 2HB ASP 81 3.960 10.982 -7.044 576 HB3 ASP 81 1HB ASP 81 2.206 11.001 -6.962 577 H ASP 82 H ASP 82 3.156 12.123 -2.799 578 HA ASP 82 HA ASP 82 0.425 13.219 -2.903 579 HB2 ASP 82 2HB ASP 82 0.781 11.217 -1.361 580 HB3 ASP 82 1HB ASP 82 1.867 12.229 -0.412 581 H VAL 83 H VAL 83 0.592 14.730 -0.514 582 HA VAL 83 HA VAL 83 2.716 16.637 -1.132 583 HB VAL 83 HB VAL 83 0.568 17.329 -2.194 584 HG11 VAL 83 1HG1 VAL 83 -1.008 16.465 -0.590 585 HG12 VAL 83 2HG1 VAL 83 -1.264 18.190 -0.845 586 HG13 VAL 83 3HG1 VAL 83 -0.452 17.627 0.614 587 HG21 VAL 83 3HG2 VAL 83 2.219 19.023 -1.671 588 HG22 VAL 83 1HG2 VAL 83 1.585 19.176 -0.033 589 HG23 VAL 83 2HG2 VAL 83 0.600 19.669 -1.411 590 H THR 84 H THR 84 0.870 14.925 1.279 591 HA THR 84 HA THR 84 1.829 16.750 3.349 592 HB THR 84 HB THR 84 -0.621 16.147 3.365 593 HG1 THR 84 1HG THR 84 1.064 15.557 5.550 594 HG21 THR 84 3HG2 THR 84 -0.442 13.802 2.661 595 HG22 THR 84 1HG2 THR 84 -1.301 13.937 4.197 596 HG23 THR 84 2HG2 THR 84 0.385 13.412 4.170 597 H VAL 85 H VAL 85 3.380 14.770 1.828 598 HA VAL 85 HA VAL 85 4.210 12.859 3.811 599 HB VAL 85 HB VAL 85 4.316 12.078 1.523 600 HG11 VAL 85 1HG1 VAL 85 5.717 13.113 -0.209 601 HG12 VAL 85 2HG1 VAL 85 6.091 14.436 0.897 602 HG13 VAL 85 3HG1 VAL 85 4.436 14.191 0.341 603 HG21 VAL 85 3HG2 VAL 85 6.128 11.279 2.944 604 HG22 VAL 85 1HG2 VAL 85 7.122 12.652 2.462 605 HG23 VAL 85 2HG2 VAL 85 6.669 11.437 1.269 606 H SER 86 H SER 86 5.370 13.431 5.415 607 HA SER 86 HA SER 86 6.580 16.018 5.513 608 HB2 SER 86 2HB SER 86 6.646 13.884 7.642 609 HB3 SER 86 1HB SER 86 6.774 15.633 7.855 610 HG SER 86 HG SER 86 4.525 14.094 7.071 611 H ARG 87 H ARG 87 8.282 13.336 7.028 612 HA ARG 87 HA ARG 87 10.832 14.215 5.912 613 HB2 ARG 87 2HB ARG 87 10.661 13.546 8.248 614 HB3 ARG 87 1HB ARG 87 9.997 11.988 7.798 615 HG2 ARG 87 2HG ARG 87 12.282 11.764 8.517 616 HG3 ARG 87 1HG ARG 87 12.144 11.385 6.805 617 HD2 ARG 87 2HD ARG 87 13.085 13.480 6.197 618 HD3 ARG 87 1HD ARG 87 13.005 14.068 7.861 619 HE ARG 87 HE ARG 87 14.496 11.819 8.007 620 HH11 ARG 87 1HH1 ARG 87 14.800 14.765 6.053 621 HH12 ARG 87 2HH1 ARG 87 16.507 14.754 6.092 622 HH21 ARG 87 1HH2 ARG 87 16.841 11.907 8.105 623 HH22 ARG 87 2HH2 ARG 87 17.679 13.156 7.288 624 H ARG 88 H ARG 88 8.847 11.412 6.068 625 HA ARG 88 HA ARG 88 8.786 10.909 3.398 626 HB2 ARG 88 2HB ARG 88 9.652 8.581 3.415 627 HB3 ARG 88 1HB ARG 88 10.941 9.673 3.850 628 HG2 ARG 88 2HG ARG 88 10.679 8.994 6.193 629 HG3 ARG 88 1HG ARG 88 9.385 7.880 5.703 630 HD2 ARG 88 2HD ARG 88 10.969 6.787 4.150 631 HD3 ARG 88 1HD ARG 88 12.246 7.837 4.747 632 HE ARG 88 HE ARG 88 10.892 6.174 6.713 633 HH11 ARG 88 1HH1 ARG 88 13.746 6.635 4.651 634 HH12 ARG 88 2HH1 ARG 88 14.662 5.457 5.432 635 HH21 ARG 88 1HH2 ARG 88 12.168 4.483 7.757 636 HH22 ARG 88 2HH2 ARG 88 13.756 4.223 7.223 637 H HIS 89 H HIS 89 7.240 8.575 3.623 638 HA HIS 89 HA HIS 89 5.416 9.908 5.436 639 HB2 HIS 89 2HB HIS 89 4.829 9.589 2.977 640 HB3 HIS 89 1HB HIS 89 4.568 7.889 3.377 641 HD2 HIS 89 2HD HIS 89 2.226 7.334 4.678 642 HE1 HIS 89 1HE HIS 89 1.002 11.360 5.095 643 HE2 HIS 89 2HE HIS 89 0.736 8.984 5.912 644 H ALA 90 H ALA 90 5.742 6.507 4.424 645 HA ALA 90 HA ALA 90 5.674 5.808 7.227 646 HB1 ALA 90 1HB ALA 90 3.306 6.004 6.639 647 HB2 ALA 90 2HB ALA 90 3.747 4.330 6.972 648 HB3 ALA 90 3HB ALA 90 3.540 4.869 5.308 649 H GLU 91 H GLU 91 5.973 3.533 7.526 650 HA GLU 91 HA GLU 91 7.351 2.279 5.260 651 HB2 GLU 91 2HB GLU 91 7.881 1.956 8.223 652 HB3 GLU 91 1HB GLU 91 8.667 1.025 6.957 653 HG2 GLU 91 2HG GLU 91 9.580 3.138 6.038 654 HG3 GLU 91 1HG GLU 91 8.830 3.985 7.370 655 H PHE 92 H PHE 92 6.500 0.479 4.575 656 HA PHE 92 HA PHE 92 4.314 -0.705 6.115 657 HB2 PHE 92 2HB PHE 92 5.101 -1.130 3.213 658 HB3 PHE 92 1HB PHE 92 3.661 -1.758 4.001 659 HD1 PHE 92 1HD PHE 92 1.829 -0.226 4.632 660 HD2 PHE 92 2HD PHE 92 5.204 1.109 2.409 661 HE1 PHE 92 1HE PHE 92 0.592 1.798 3.967 662 HE2 PHE 92 2HE PHE 92 3.976 3.131 1.744 663 HZ PHE 92 HZ PHE 92 1.668 3.478 2.522 664 H ARG 93 H ARG 93 4.936 -2.383 7.321 665 HA ARG 93 HA ARG 93 7.279 -3.898 6.442 666 HB2 ARG 93 2HB ARG 93 5.911 -3.982 9.141 667 HB3 ARG 93 1HB ARG 93 7.520 -4.551 8.728 668 HG2 ARG 93 2HG ARG 93 8.301 -2.277 8.454 669 HG3 ARG 93 1HG ARG 93 6.677 -1.658 8.747 670 HD2 ARG 93 2HD ARG 93 7.862 -1.397 10.787 671 HD3 ARG 93 1HD ARG 93 6.795 -2.778 11.010 672 HE ARG 93 HE ARG 93 9.488 -3.365 10.145 673 HH11 ARG 93 1HH1 ARG 93 7.285 -3.155 12.895 674 HH12 ARG 93 2HH1 ARG 93 8.279 -4.043 13.952 675 HH21 ARG 93 1HH2 ARG 93 10.897 -4.517 11.597 676 HH22 ARG 93 2HH2 ARG 93 10.400 -4.834 13.195 677 H ILE 94 H ILE 94 6.675 -5.669 5.374 678 HA ILE 94 HA ILE 94 4.227 -6.979 6.269 679 HB ILE 94 HB ILE 94 3.826 -5.897 4.128 680 HG12 ILE 94 2HG1 ILE 94 2.767 -8.177 4.352 681 HG13 ILE 94 1HG1 ILE 94 3.008 -7.664 2.704 682 HG21 ILE 94 1HG2 ILE 94 5.030 -6.391 2.073 683 HG22 ILE 94 2HG2 ILE 94 6.228 -7.265 3.029 684 HG23 ILE 94 3HG2 ILE 94 5.975 -5.540 3.297 685 HD11 ILE 94 3HD1 ILE 94 4.914 -9.169 2.504 686 HD12 ILE 94 1HD1 ILE 94 3.461 -10.034 3.006 687 HD13 ILE 94 2HD1 ILE 94 4.713 -9.653 4.189 688 H ASN 95 H ASN 95 4.869 -8.644 7.345 689 HA ASN 95 HA ASN 95 6.897 -10.264 6.171 690 HB2 ASN 95 2HB ASN 95 6.521 -9.518 9.028 691 HB3 ASN 95 1HB ASN 95 7.280 -11.043 8.590 692 HD21 ASN 95 1HD2 ASN 95 9.252 -10.975 7.412 693 HD22 ASN 95 2HD2 ASN 95 10.263 -9.580 7.461 694 H GLU 96 H GLU 96 6.683 -12.337 6.284 695 HA GLU 96 HA GLU 96 4.121 -13.498 6.046 696 HB2 GLU 96 2HB GLU 96 6.374 -15.202 6.959 697 HB3 GLU 96 1HB GLU 96 5.268 -15.448 5.618 698 HG2 GLU 96 2HG GLU 96 7.209 -15.059 4.443 699 HG3 GLU 96 1HG GLU 96 6.549 -13.420 4.659 700 H GLY 97 H GLY 97 6.336 -13.013 8.531 701 HA2 GLY 97 2HA GLY 97 5.128 -14.541 10.618 702 HA3 GLY 97 1HA GLY 97 6.284 -13.233 10.855 703 H GLU 98 H GLU 98 5.180 -10.943 10.155 704 HA GLU 98 HA GLU 98 2.466 -10.839 11.022 705 HB2 GLU 98 2HB GLU 98 4.707 -9.533 12.554 706 HB3 GLU 98 1HB GLU 98 3.061 -8.941 12.628 707 HG2 GLU 98 2HG GLU 98 2.331 -11.085 13.549 708 HG3 GLU 98 1HG GLU 98 3.975 -11.703 13.416 709 H PHE 99 H PHE 99 1.425 -8.907 10.427 710 HA PHE 99 HA PHE 99 2.808 -7.396 8.318 711 HB2 PHE 99 2HB PHE 99 -0.163 -7.626 8.871 712 HB3 PHE 99 1HB PHE 99 0.600 -6.936 7.448 713 HD1 PHE 99 2HD PHE 99 1.784 -8.416 5.895 714 HD2 PHE 99 1HD PHE 99 -0.626 -9.933 9.020 715 HE1 PHE 99 2HE PHE 99 1.667 -10.600 4.723 716 HE2 PHE 99 1HE PHE 99 -0.763 -12.110 7.885 717 HZ PHE 99 HZ PHE 99 0.384 -12.447 5.730 718 H GLU 100 H GLU 100 3.430 -5.356 8.948 719 HA GLU 100 HA GLU 100 1.718 -3.946 10.831 720 HB2 GLU 100 2HB GLU 100 4.649 -4.411 11.170 721 HB3 GLU 100 1HB GLU 100 3.844 -3.031 11.904 722 HG2 GLU 100 2HG GLU 100 2.377 -4.425 13.079 723 HG3 GLU 100 1HG GLU 100 2.991 -5.876 12.289 724 H VAL 101 H VAL 101 1.435 -1.915 10.492 725 HA VAL 101 HA VAL 101 3.096 -0.665 8.415 726 HB VAL 101 HB VAL 101 0.839 -0.970 7.501 727 HG11 VAL 101 1HG1 VAL 101 -1.138 0.110 8.447 728 HG12 VAL 101 2HG1 VAL 101 -0.178 0.632 9.829 729 HG13 VAL 101 3HG1 VAL 101 -0.451 -1.087 9.549 730 HG21 VAL 101 3HG2 VAL 101 2.014 1.031 6.803 731 HG22 VAL 101 1HG2 VAL 101 1.360 1.925 8.178 732 HG23 VAL 101 2HG2 VAL 101 0.284 1.353 6.903 733 H VAL 102 H VAL 102 4.302 0.957 9.103 734 HA VAL 102 HA VAL 102 3.400 2.312 11.516 735 HB VAL 102 HB VAL 102 5.203 0.766 12.093 736 HG11 VAL 102 1HG1 VAL 102 6.394 0.627 10.004 737 HG12 VAL 102 2HG1 VAL 102 7.495 1.085 11.305 738 HG13 VAL 102 3HG1 VAL 102 6.921 2.303 10.167 739 HG21 VAL 102 3HG2 VAL 102 5.007 2.829 13.368 740 HG22 VAL 102 1HG2 VAL 102 6.089 3.640 12.237 741 HG23 VAL 102 2HG2 VAL 102 6.689 2.317 13.244 742 H ASP 103 H ASP 103 3.293 4.468 11.469 743 HA ASP 103 HA ASP 103 4.233 5.926 9.193 744 HB2 ASP 103 2HB ASP 103 2.129 6.513 10.288 745 HB3 ASP 103 1HB ASP 103 2.976 6.769 11.810 746 H VAL 104 H VAL 104 6.030 7.193 9.153 747 HA VAL 104 HA VAL 104 7.956 6.739 11.304 748 HB VAL 104 HB VAL 104 9.657 7.568 9.857 749 HG11 VAL 104 1HG1 VAL 104 7.717 5.940 8.254 750 HG12 VAL 104 2HG1 VAL 104 8.923 5.328 9.387 751 HG13 VAL 104 3HG1 VAL 104 9.432 6.135 7.903 752 HG21 VAL 104 3HG2 VAL 104 8.491 9.523 8.959 753 HG22 VAL 104 1HG2 VAL 104 7.491 8.474 7.957 754 HG23 VAL 104 2HG2 VAL 104 9.231 8.574 7.671 755 H GLY 105 H GLY 105 5.785 9.138 10.441 756 HA2 GLY 105 2HA GLY 105 5.916 10.999 12.228 757 HA3 GLY 105 1HA GLY 105 7.457 11.305 11.433 758 H SER 106 H SER 106 4.267 10.423 10.230 759 HA SER 106 HA SER 106 3.986 12.970 8.905 760 HB2 SER 106 2HB SER 106 5.434 11.262 7.493 761 HB3 SER 106 1HB SER 106 3.885 10.472 7.213 762 HG SER 106 HG SER 106 3.493 11.885 5.792 763 H LEU 107 H LEU 107 2.823 11.376 11.037 764 HA LEU 107 HA LEU 107 0.611 9.826 10.382 765 HB2 LEU 107 2HB LEU 107 1.844 9.877 12.528 766 HB3 LEU 107 1HB LEU 107 1.105 11.419 12.882 767 HG LEU 107 HG LEU 107 -1.103 10.325 12.856 768 HD11 LEU 107 1HD1 LEU 107 0.530 7.799 12.622 769 HD12 LEU 107 2HD1 LEU 107 -0.638 8.416 11.449 770 HD13 LEU 107 3HD1 LEU 107 -1.181 7.857 13.029 771 HD21 LEU 107 3HD2 LEU 107 -0.837 9.204 15.027 772 HD22 LEU 107 1HD2 LEU 107 0.057 10.722 14.955 773 HD23 LEU 107 2HD2 LEU 107 0.907 9.186 14.793 774 H ASN 108 H ASN 108 1.048 13.091 10.216 775 HA ASN 108 HA ASN 108 -1.519 14.163 10.613 776 HB2 ASN 108 2HB ASN 108 0.508 15.525 10.283 777 HB3 ASN 108 1HB ASN 108 0.597 14.977 8.614 778 HD21 ASN 108 1HD2 ASN 108 -0.703 15.984 7.058 779 HD22 ASN 108 2HD2 ASN 108 -1.718 17.310 7.459 780 H GLY 109 H GLY 109 -0.137 12.226 8.050 781 HA2 GLY 109 2HA GLY 109 -2.714 12.371 6.651 782 HA3 GLY 109 1HA GLY 109 -1.177 12.242 5.811 783 H THR 110 H THR 110 -0.997 10.280 8.576 784 HA THR 110 HA THR 110 -1.667 7.997 6.865 785 HB THR 110 HB THR 110 0.021 7.855 9.444 786 HG1 THR 110 1HG THR 110 1.720 8.423 8.248 787 HG21 THR 110 3HG2 THR 110 -0.189 6.080 6.994 788 HG22 THR 110 1HG2 THR 110 -0.954 5.741 8.548 789 HG23 THR 110 2HG2 THR 110 0.804 5.794 8.423 790 H TYR 111 H TYR 111 -3.571 7.004 7.234 791 HA TYR 111 HA TYR 111 -4.604 6.907 9.998 792 HB2 TYR 111 2HB TYR 111 -6.475 7.306 7.684 793 HB3 TYR 111 1HB TYR 111 -6.750 7.594 9.388 794 HD1 TYR 111 2HD TYR 111 -5.719 9.708 10.416 795 HD2 TYR 111 1HD TYR 111 -5.818 8.968 6.237 796 HE1 TYR 111 2HE TYR 111 -5.376 12.118 9.971 797 HE2 TYR 111 1HE TYR 111 -5.485 11.331 5.783 798 HH TYR 111 HH TYR 111 -4.460 13.507 8.092 799 H VAL 112 H VAL 112 -5.422 4.907 10.449 800 HA VAL 112 HA VAL 112 -5.944 3.140 8.180 801 HB VAL 112 HB VAL 112 -4.363 2.123 9.795 802 HG11 VAL 112 1HG1 VAL 112 -5.036 1.583 12.103 803 HG12 VAL 112 2HG1 VAL 112 -6.502 2.535 11.864 804 HG13 VAL 112 3HG1 VAL 112 -4.925 3.315 11.799 805 HG21 VAL 112 3HG2 VAL 112 -7.084 0.837 9.946 806 HG22 VAL 112 1HG2 VAL 112 -5.559 0.029 10.302 807 HG23 VAL 112 2HG2 VAL 112 -5.891 0.606 8.670 808 H ASN 113 H ASN 113 -7.970 2.823 7.625 809 HA ASN 113 HA ASN 113 -10.196 3.066 7.514 810 HB2 ASN 113 2HB ASN 113 -10.143 3.103 10.567 811 HB3 ASN 113 1HB ASN 113 -11.609 3.029 9.605 812 HD21 ASN 113 1HD2 ASN 113 -12.100 1.133 8.552 813 HD22 ASN 113 2HD2 ASN 113 -11.280 -0.365 8.890 814 H ARG 114 H ARG 114 -9.745 4.924 10.375 815 HA ARG 114 HA ARG 114 -9.566 7.428 8.899 816 HB2 ARG 114 2HB ARG 114 -12.029 6.965 9.268 817 HB3 ARG 114 1HB ARG 114 -11.718 7.021 10.997 818 HG2 ARG 114 2HG ARG 114 -10.925 9.353 10.738 819 HG3 ARG 114 1HG ARG 114 -11.377 9.277 9.036 820 HD2 ARG 114 2HD ARG 114 -13.132 10.357 10.247 821 HD3 ARG 114 1HD ARG 114 -13.693 8.775 9.722 822 HE ARG 114 HE ARG 114 -12.683 8.463 12.291 823 HH11 ARG 114 1HH1 ARG 114 -15.313 10.231 10.709 824 HH12 ARG 114 2HH1 ARG 114 -16.332 10.212 12.064 825 HH21 ARG 114 1HH2 ARG 114 -14.163 8.447 14.218 826 HH22 ARG 114 2HH2 ARG 114 -15.679 9.195 14.038 827 H GLU 115 H GLU 115 -8.329 5.461 11.199 828 HA GLU 115 HA GLU 115 -8.131 7.432 13.319 829 HB2 GLU 115 2HB GLU 115 -7.569 4.474 13.332 830 HB3 GLU 115 1HB GLU 115 -7.486 5.543 14.724 831 HG2 GLU 115 2HG GLU 115 -9.953 4.823 13.151 832 HG3 GLU 115 1HG GLU 115 -9.528 4.270 14.771 833 HA PRO 116 HA PRO 116 -3.832 7.572 12.047 834 HB2 PRO 116 2HB PRO 116 -3.350 9.805 13.712 835 HB3 PRO 116 1HB PRO 116 -3.653 9.849 11.979 836 HG2 PRO 116 2HG PRO 116 -5.343 10.829 14.022 837 HG3 PRO 116 1HG PRO 116 -5.736 10.678 12.305 838 HD2 PRO 116 2HD PRO 116 -6.506 8.957 14.582 839 HD3 PRO 116 1HD PRO 116 -7.288 9.187 13.001 840 H ARG 117 H ARG 117 -3.413 5.694 13.160 841 HA ARG 117 HA ARG 117 -3.126 5.584 16.020 842 HB2 ARG 117 2HB ARG 117 -2.196 3.659 13.864 843 HB3 ARG 117 1HB ARG 117 -2.119 3.322 15.583 844 HG2 ARG 117 2HG ARG 117 -4.755 4.057 14.451 845 HG3 ARG 117 1HG ARG 117 -4.095 2.491 14.001 846 HD2 ARG 117 2HD ARG 117 -5.577 2.341 15.939 847 HD3 ARG 117 1HD ARG 117 -3.940 1.847 16.327 848 HE ARG 117 HE ARG 117 -3.693 4.107 17.344 849 HH11 ARG 117 1HH1 ARG 117 -6.924 2.684 17.028 850 HH12 ARG 117 2HH1 ARG 117 -7.518 3.370 18.468 851 HH21 ARG 117 1HH2 ARG 117 -4.519 5.037 19.339 852 HH22 ARG 117 2HH2 ARG 117 -6.121 4.727 19.805 853 H ASN 118 H ASN 118 -0.555 4.285 14.157 854 HA ASN 118 HA ASN 118 1.318 6.164 13.783 855 HB2 ASN 118 2HB ASN 118 1.308 6.470 16.350 856 HB3 ASN 118 1HB ASN 118 1.895 4.812 16.461 857 HD21 ASN 118 1HD2 ASN 118 4.053 4.352 15.844 858 HD22 ASN 118 2HD2 ASN 118 5.166 5.623 15.532 859 H ALA 119 H ALA 119 1.207 3.105 15.583 860 HA ALA 119 HA ALA 119 2.179 1.817 13.150 861 HB1 ALA 119 1HB ALA 119 3.913 1.754 14.921 862 HB2 ALA 119 2HB ALA 119 3.272 0.152 14.589 863 HB3 ALA 119 3HB ALA 119 2.744 1.028 16.027 864 H GLN 120 H GLN 120 0.996 0.069 12.582 865 HA GLN 120 HA GLN 120 -1.196 -0.731 14.317 866 HB2 GLN 120 2HB GLN 120 -2.139 1.029 12.944 867 HB3 GLN 120 1HB GLN 120 -1.484 0.309 11.490 868 HG2 GLN 120 2HG GLN 120 -3.872 -0.061 11.631 869 HG3 GLN 120 1HG GLN 120 -3.005 -1.583 11.732 870 HE21 GLN 120 1HE2 GLN 120 -4.665 -2.638 12.713 871 HE22 GLN 120 2HE2 GLN 120 -5.179 -2.363 14.330 872 H VAL 121 H VAL 121 -1.904 -2.845 13.929 873 HA VAL 121 HA VAL 121 -0.170 -4.514 12.352 874 HB VAL 121 HB VAL 121 -2.869 -5.166 13.634 875 HG11 VAL 121 1HG1 VAL 121 -0.734 -7.031 12.575 876 HG12 VAL 121 2HG1 VAL 121 -2.302 -6.727 11.834 877 HG13 VAL 121 3HG1 VAL 121 -2.211 -7.522 13.405 878 HG21 VAL 121 3HG2 VAL 121 -1.571 -6.250 15.405 879 HG22 VAL 121 1HG2 VAL 121 -1.219 -4.527 15.309 880 HG23 VAL 121 2HG2 VAL 121 -0.077 -5.695 14.649 881 H MET 122 H MET 122 -0.375 -4.773 10.301 882 HA MET 122 HA MET 122 -2.359 -3.278 8.853 883 HB2 MET 122 2HB MET 122 0.140 -3.479 8.324 884 HB3 MET 122 1HB MET 122 -0.212 -5.087 7.737 885 HG2 MET 122 2HG MET 122 -1.624 -4.202 6.005 886 HG3 MET 122 1HG MET 122 -1.447 -2.569 6.652 887 HE1 MET 122 3HE MET 122 -0.599 -1.481 4.430 888 HE2 MET 122 1HE MET 122 -0.893 -3.024 3.629 889 HE3 MET 122 2HE MET 122 0.643 -2.190 3.400 890 H GLN 123 H GLN 123 -4.272 -4.094 8.377 891 HA GLN 123 HA GLN 123 -4.589 -6.981 8.575 892 HB2 GLN 123 2HB GLN 123 -5.749 -5.600 10.247 893 HB3 GLN 123 1HB GLN 123 -6.603 -4.767 8.965 894 HG2 GLN 123 2HG GLN 123 -8.032 -6.394 10.051 895 HG3 GLN 123 1HG GLN 123 -7.748 -6.843 8.374 896 HE21 GLN 123 1HE2 GLN 123 -8.530 -8.402 10.750 897 HE22 GLN 123 2HE2 GLN 123 -7.419 -9.704 10.856 898 H THR 124 H THR 124 -5.570 -8.100 7.071 899 HA THR 124 HA THR 124 -5.707 -6.992 4.438 900 HB THR 124 HB THR 124 -4.754 -9.171 4.568 901 HG1 THR 124 1HG THR 124 -7.297 -9.865 3.634 902 HG21 THR 124 3HG2 THR 124 -5.988 -11.152 5.418 903 HG22 THR 124 1HG2 THR 124 -7.290 -10.090 5.948 904 HG23 THR 124 2HG2 THR 124 -5.690 -9.961 6.682 905 H GLY 125 H GLY 125 -7.418 -6.388 3.363 906 HA2 GLY 125 2HA GLY 125 -9.680 -6.579 2.681 907 HA3 GLY 125 1HA GLY 125 -10.065 -7.291 4.242 908 H ASP 126 H ASP 126 -8.043 -4.601 4.540 909 HA ASP 126 HA ASP 126 -10.382 -2.885 4.914 910 HB2 ASP 126 2HB ASP 126 -9.150 -3.786 7.078 911 HB3 ASP 126 1HB ASP 126 -7.941 -2.575 6.658 912 H GLU 127 H GLU 127 -9.397 -0.521 5.187 913 HA GLU 127 HA GLU 127 -7.687 -0.135 2.832 914 HB2 GLU 127 2HB GLU 127 -10.087 0.145 2.299 915 HB3 GLU 127 1HB GLU 127 -10.207 1.376 3.535 916 HG2 GLU 127 2HG GLU 127 -8.693 2.787 2.291 917 HG3 GLU 127 1HG GLU 127 -8.543 1.559 1.033 918 H ILE 128 H ILE 128 -6.054 1.130 3.237 919 HA ILE 128 HA ILE 128 -5.977 2.669 5.729 920 HB ILE 128 HB ILE 128 -3.687 1.611 4.031 921 HG12 ILE 128 2HG1 ILE 128 -4.683 0.660 6.731 922 HG13 ILE 128 1HG1 ILE 128 -4.968 -0.165 5.202 923 HG21 ILE 128 1HG2 ILE 128 -2.240 2.291 5.899 924 HG22 ILE 128 2HG2 ILE 128 -3.640 2.953 6.743 925 HG23 ILE 128 3HG2 ILE 128 -3.103 3.677 5.229 926 HD11 ILE 128 3HD1 ILE 128 -2.570 -0.536 4.962 927 HD12 ILE 128 1HD1 ILE 128 -3.180 -1.207 6.474 928 HD13 ILE 128 2HD1 ILE 128 -2.284 0.315 6.479 929 H GLN 129 H GLN 129 -5.732 4.833 5.568 930 HA GLN 129 HA GLN 129 -5.562 5.899 2.872 931 HB2 GLN 129 2HB GLN 129 -7.543 6.560 4.130 932 HB3 GLN 129 1HB GLN 129 -6.537 7.173 5.434 933 HG2 GLN 129 2HG GLN 129 -5.693 8.926 4.018 934 HG3 GLN 129 1HG GLN 129 -6.534 8.252 2.627 935 HE21 GLN 129 1HE2 GLN 129 -7.663 10.118 2.282 936 HE22 GLN 129 2HE2 GLN 129 -8.960 10.639 3.295 937 H ILE 130 H ILE 130 -3.758 6.725 2.241 938 HA ILE 130 HA ILE 130 -1.828 7.608 4.229 939 HB ILE 130 HB ILE 130 -0.026 6.852 2.603 940 HG12 ILE 130 2HG1 ILE 130 -2.313 5.238 1.418 941 HG13 ILE 130 1HG1 ILE 130 -1.472 6.554 0.615 942 HG21 ILE 130 1HG2 ILE 130 -0.060 4.519 3.386 943 HG22 ILE 130 2HG2 ILE 130 -1.727 4.738 3.902 944 HG23 ILE 130 3HG2 ILE 130 -0.440 5.668 4.671 945 HD11 ILE 130 3HD1 ILE 130 -0.272 3.919 1.441 946 HD12 ILE 130 1HD1 ILE 130 0.590 5.230 0.633 947 HD13 ILE 130 2HD1 ILE 130 -0.723 4.395 -0.197 948 H GLY 131 H GLY 131 -1.764 9.649 4.124 949 HA2 GLY 131 2HA GLY 131 -1.197 11.700 3.238 950 HA3 GLY 131 1HA GLY 131 -1.154 10.970 1.630 951 H LYS 132 H LYS 132 -2.586 11.875 0.410 952 HA LYS 132 HA LYS 132 -5.207 12.562 1.525 953 HB2 LYS 132 2HB LYS 132 -3.853 14.238 0.192 954 HB3 LYS 132 1HB LYS 132 -4.019 13.180 -1.192 955 HG2 LYS 132 2HG LYS 132 -5.606 14.952 -1.412 956 HG3 LYS 132 1HG LYS 132 -6.487 13.467 -1.061 957 HD2 LYS 132 2HD LYS 132 -7.444 15.244 0.236 958 HD3 LYS 132 1HD LYS 132 -6.588 14.169 1.334 959 HE2 LYS 132 2HE LYS 132 -4.676 15.711 1.375 960 HE3 LYS 132 1HE LYS 132 -5.508 16.776 0.242 961 HZ1 LYS 132 3HZ LYS 132 -7.241 17.101 1.957 962 HZ2 LYS 132 1HZ LYS 132 -5.718 17.578 2.487 963 HZ3 LYS 132 2HZ LYS 132 -6.357 16.132 3.015 964 H PHE 133 H PHE 133 -3.727 9.951 0.171 965 HA PHE 133 HA PHE 133 -6.038 9.198 -1.511 966 HB2 PHE 133 2HB PHE 133 -3.158 8.380 -1.883 967 HB3 PHE 133 1HB PHE 133 -4.522 8.000 -2.942 968 HD1 PHE 133 2HD PHE 133 -5.908 10.162 -3.692 969 HD2 PHE 133 1HD PHE 133 -1.817 10.138 -2.517 970 HE1 PHE 133 2HE PHE 133 -5.562 12.295 -4.868 971 HE2 PHE 133 1HE PHE 133 -1.467 12.258 -3.674 972 HZ PHE 133 HZ PHE 133 -3.339 13.352 -4.858 973 H ARG 134 H ARG 134 -5.749 6.597 -1.912 974 HA ARG 134 HA ARG 134 -5.537 5.504 0.768 975 HB2 ARG 134 2HB ARG 134 -7.779 4.482 0.632 976 HB3 ARG 134 1HB ARG 134 -7.789 6.234 0.727 977 HG2 ARG 134 2HG ARG 134 -8.062 6.241 -1.791 978 HG3 ARG 134 1HG ARG 134 -8.360 4.505 -1.648 979 HD2 ARG 134 2HD ARG 134 -10.456 5.715 -1.661 980 HD3 ARG 134 1HD ARG 134 -10.196 4.956 -0.088 981 HE ARG 134 HE ARG 134 -9.809 7.792 -0.714 982 HH11 ARG 134 1HH1 ARG 134 -10.534 5.254 1.678 983 HH12 ARG 134 2HH1 ARG 134 -10.833 6.348 2.949 984 HH21 ARG 134 1HH2 ARG 134 -10.297 9.272 1.039 985 HH22 ARG 134 2HH2 ARG 134 -10.775 8.658 2.559 986 H LEU 135 H LEU 135 -5.185 3.417 0.989 987 HA LEU 135 HA LEU 135 -4.498 1.879 -1.421 988 HB2 LEU 135 2HB LEU 135 -2.598 2.883 -0.172 989 HB3 LEU 135 1HB LEU 135 -3.134 2.050 1.265 990 HG LEU 135 HG LEU 135 -2.761 -0.103 -0.015 991 HD11 LEU 135 1HD1 LEU 135 -1.159 0.060 -1.886 992 HD12 LEU 135 2HD1 LEU 135 -1.353 1.811 -1.861 993 HD13 LEU 135 3HD1 LEU 135 -2.726 0.776 -2.249 994 HD21 LEU 135 3HD2 LEU 135 -1.273 0.760 1.739 995 HD22 LEU 135 1HD2 LEU 135 -0.376 1.669 0.526 996 HD23 LEU 135 2HD2 LEU 135 -0.387 -0.101 0.485 997 H VAL 136 H VAL 136 -5.380 -0.198 -1.348 998 HA VAL 136 HA VAL 136 -6.638 -0.998 1.192 999 HB VAL 136 HB VAL 136 -7.262 -2.123 -1.563 1000 HG11 VAL 136 1HG1 VAL 136 -8.752 -2.376 1.039 1001 HG12 VAL 136 2HG1 VAL 136 -7.806 -3.632 0.246 1002 HG13 VAL 136 3HG1 VAL 136 -9.279 -3.023 -0.514 1003 HG21 VAL 136 3HG2 VAL 136 -9.299 -0.801 -1.590 1004 HG22 VAL 136 1HG2 VAL 136 -7.892 0.255 -1.482 1005 HG23 VAL 136 2HG2 VAL 136 -8.875 -0.074 -0.046 1006 H PHE 137 H PHE 137 -5.947 -2.849 2.137 1007 HA PHE 137 HA PHE 137 -3.645 -4.140 0.844 1008 HB2 PHE 137 2HB PHE 137 -3.116 -3.056 2.961 1009 HB3 PHE 137 1HB PHE 137 -4.402 -3.944 3.765 1010 HD1 PHE 137 1HD PHE 137 -1.299 -4.569 1.779 1011 HD2 PHE 137 2HD PHE 137 -3.827 -5.823 4.963 1012 HE1 PHE 137 1HE PHE 137 0.323 -6.311 2.383 1013 HE2 PHE 137 2HE PHE 137 -2.210 -7.570 5.570 1014 HZ PHE 137 HZ PHE 137 -0.132 -7.816 4.281 1015 H LEU 138 H LEU 138 -3.846 -6.179 0.152 1016 HA LEU 138 HA LEU 138 -5.960 -7.799 1.364 1017 HB2 LEU 138 2HB LEU 138 -5.235 -7.721 -1.558 1018 HB3 LEU 138 1HB LEU 138 -6.252 -8.929 -0.826 1019 HG LEU 138 HG LEU 138 -7.675 -7.550 -1.907 1020 HD11 LEU 138 1HD1 LEU 138 -8.534 -8.022 0.231 1021 HD12 LEU 138 2HD1 LEU 138 -9.049 -6.406 -0.251 1022 HD13 LEU 138 3HD1 LEU 138 -7.746 -6.602 0.926 1023 HD21 LEU 138 3HD2 LEU 138 -6.238 -5.135 -0.816 1024 HD22 LEU 138 1HD2 LEU 138 -7.718 -5.076 -1.777 1025 HD23 LEU 138 2HD2 LEU 138 -6.234 -5.711 -2.485 1026 H ALA 139 H ALA 139 -5.453 -9.743 1.863 1027 HA ALA 139 HA ALA 139 -2.841 -10.764 1.036 1028 HB1 ALA 139 1HB ALA 139 -3.136 -10.672 3.479 1029 HB2 ALA 139 2HB ALA 139 -3.027 -12.345 2.930 1030 HB3 ALA 139 3HB ALA 139 -4.596 -11.653 3.344 1031 H GLY 140 H GLY 140 -3.350 -11.533 -0.912 1032 HA2 GLY 140 2HA GLY 140 -5.722 -13.225 -1.210 1033 HA3 GLY 140 1HA GLY 140 -4.727 -12.584 -2.518 1034 HA PRO 141 HA PRO 141 -3.175 -16.811 -2.401 1035 HB2 PRO 141 2HB PRO 141 -1.530 -15.954 -4.625 1036 HB3 PRO 141 1HB PRO 141 -2.741 -17.233 -4.582 1037 HG2 PRO 141 2HG PRO 141 -3.105 -14.884 -5.946 1038 HG3 PRO 141 1HG PRO 141 -4.434 -15.845 -5.281 1039 HD2 PRO 141 2HD PRO 141 -3.233 -13.319 -4.275 1040 HD3 PRO 141 1HD PRO 141 -4.895 -13.924 -4.146 1041 H ALA 142 H ALA 142 -1.615 -17.235 -1.100 1042 HA ALA 142 HA ALA 142 0.274 -15.236 -0.343 1043 HB1 ALA 142 1HB ALA 142 0.994 -16.808 1.362 1044 HB2 ALA 142 2HB ALA 142 0.073 -18.090 0.586 1045 HB3 ALA 142 3HB ALA 142 -0.768 -16.726 1.323 1046 H GLU 143 H GLU 143 1.850 -14.830 -1.687 1047 HA GLU 143 HA GLU 143 3.228 -16.996 -2.943 1048 HB2 GLU 143 2HB GLU 143 3.321 -14.009 -3.209 1049 HB3 GLU 143 1HB GLU 143 4.398 -15.114 -4.046 1050 HG2 GLU 143 2HG GLU 143 2.447 -16.169 -5.118 1051 HG3 GLU 143 1HG GLU 143 1.404 -15.002 -4.310 Start of MODEL 13 1 H1 MET 1 1HT MET 1 -31.853 4.863 -69.988 2 H2 MET 1 2HT MET 1 -32.017 4.712 -68.306 3 H3 MET 1 3HT MET 1 -33.371 4.950 -69.254 4 HA MET 1 HA MET 1 -33.174 2.687 -68.489 5 HB2 MET 1 2HB MET 1 -33.531 1.554 -70.615 6 HB3 MET 1 1HB MET 1 -34.339 3.108 -70.620 7 HG2 MET 1 2HG MET 1 -31.676 2.573 -71.914 8 HG3 MET 1 1HG MET 1 -33.221 2.486 -72.754 9 HE1 MET 1 2HE MET 1 -34.755 4.553 -73.251 10 HE2 MET 1 3HE MET 1 -34.417 6.194 -72.712 11 HE3 MET 1 1HE MET 1 -34.843 4.950 -71.537 12 H SER 2 H SER 2 -30.262 3.924 -68.583 13 HA SER 2 HA SER 2 -28.661 1.852 -69.595 14 HB2 SER 2 2HB SER 2 -28.097 3.802 -67.342 15 HB3 SER 2 1HB SER 2 -26.903 2.962 -68.337 16 HG SER 2 HG SER 2 -27.011 4.693 -69.484 17 H ASP 3 H ASP 3 -30.061 2.669 -66.485 18 HA ASP 3 HA ASP 3 -30.405 1.629 -64.582 19 HB2 ASP 3 2HB ASP 3 -31.109 -0.518 -66.551 20 HB3 ASP 3 1HB ASP 3 -31.243 -0.821 -64.827 21 H ASN 4 H ASN 4 -28.144 2.001 -64.283 22 HA ASN 4 HA ASN 4 -26.917 -0.463 -63.317 23 HB2 ASN 4 2HB ASN 4 -25.649 0.087 -65.322 24 HB3 ASN 4 1HB ASN 4 -25.473 1.755 -64.792 25 HD21 ASN 4 1HD2 ASN 4 -23.229 1.653 -64.827 26 HD22 ASN 4 2HD2 ASN 4 -22.309 0.771 -63.665 27 H ASN 5 H ASN 5 -27.326 -0.144 -61.243 28 HA ASN 5 HA ASN 5 -27.004 2.479 -60.083 29 HB2 ASN 5 2HB ASN 5 -28.794 0.942 -59.264 30 HB3 ASN 5 1HB ASN 5 -27.549 -0.161 -58.692 31 HD21 ASN 5 1HD2 ASN 5 -26.375 0.378 -56.831 32 HD22 ASN 5 2HD2 ASN 5 -26.877 1.656 -55.788 33 H GLY 6 H GLY 6 -24.925 2.988 -60.302 34 HA2 GLY 6 2HA GLY 6 -22.949 1.132 -59.173 35 HA3 GLY 6 1HA GLY 6 -22.601 2.368 -60.374 36 H THR 7 H THR 7 -24.147 2.303 -57.174 37 HA THR 7 HA THR 7 -22.764 4.780 -56.538 38 HB THR 7 HB THR 7 -24.763 3.187 -54.916 39 HG1 THR 7 1HG THR 7 -25.031 4.683 -57.147 40 HG21 THR 7 3HG2 THR 7 -23.443 4.816 -53.608 41 HG22 THR 7 1HG2 THR 7 -25.126 5.332 -53.744 42 HG23 THR 7 2HG2 THR 7 -23.887 6.086 -54.746 43 HA PRO 8 HA PRO 8 -19.658 2.283 -54.355 44 HB2 PRO 8 2HB PRO 8 -18.767 4.937 -53.400 45 HB3 PRO 8 1HB PRO 8 -17.849 3.701 -54.269 46 HG2 PRO 8 2HG PRO 8 -18.591 5.950 -55.486 47 HG3 PRO 8 1HG PRO 8 -18.623 4.396 -56.335 48 HD2 PRO 8 2HD PRO 8 -20.899 5.910 -55.094 49 HD3 PRO 8 1HD PRO 8 -20.803 5.094 -56.675 50 H GLU 9 H GLU 9 -19.949 1.421 -52.430 51 HA GLU 9 HA GLU 9 -21.690 2.726 -50.538 52 HB2 GLU 9 2HB GLU 9 -20.441 -0.024 -50.537 53 HB3 GLU 9 1HB GLU 9 -21.604 0.557 -49.345 54 HG2 GLU 9 2HG GLU 9 -23.266 0.843 -51.067 55 HG3 GLU 9 1HG GLU 9 -22.108 0.364 -52.296 56 HA PRO 10 HA PRO 10 -18.432 4.258 -48.094 57 HB2 PRO 10 2HB PRO 10 -19.649 4.496 -45.691 58 HB3 PRO 10 1HB PRO 10 -19.910 5.587 -47.057 59 HG2 PRO 10 2HG PRO 10 -21.626 3.374 -46.030 60 HG3 PRO 10 1HG PRO 10 -22.114 4.914 -46.757 61 HD2 PRO 10 2HD PRO 10 -22.084 2.475 -48.070 62 HD3 PRO 10 1HD PRO 10 -22.036 4.054 -48.867 63 H GLN 11 H GLN 11 -16.821 3.171 -47.520 64 HA GLN 11 HA GLN 11 -17.145 0.748 -45.920 65 HB2 GLN 11 2HB GLN 11 -14.828 0.201 -46.660 66 HB3 GLN 11 1HB GLN 11 -15.958 0.353 -47.994 67 HG2 GLN 11 2HG GLN 11 -15.098 2.540 -48.532 68 HG3 GLN 11 1HG GLN 11 -14.049 2.513 -47.118 69 HE21 GLN 11 1HE2 GLN 11 -14.536 1.360 -50.352 70 HE22 GLN 11 2HE2 GLN 11 -12.973 0.662 -50.530 71 H VAL 12 H VAL 12 -16.249 0.635 -43.921 72 HA VAL 12 HA VAL 12 -14.571 2.872 -43.161 73 HB VAL 12 HB VAL 12 -16.772 3.332 -42.220 74 HG11 VAL 12 1HG1 VAL 12 -17.815 1.902 -40.530 75 HG12 VAL 12 2HG1 VAL 12 -16.588 0.670 -40.839 76 HG13 VAL 12 3HG1 VAL 12 -17.717 1.131 -42.113 77 HG21 VAL 12 3HG2 VAL 12 -14.868 4.042 -40.897 78 HG22 VAL 12 1HG2 VAL 12 -14.815 2.476 -40.087 79 HG23 VAL 12 2HG2 VAL 12 -16.187 3.555 -39.835 80 H GLU 13 H GLU 13 -12.722 2.333 -42.422 81 HA GLU 13 HA GLU 13 -12.398 -0.275 -41.161 82 HB2 GLU 13 2HB GLU 13 -11.335 -0.301 -43.377 83 HB3 GLU 13 1HB GLU 13 -10.455 1.168 -42.990 84 HG2 GLU 13 2HG GLU 13 -9.020 -0.803 -42.829 85 HG3 GLU 13 1HG GLU 13 -9.202 -0.005 -41.268 86 H THR 14 H THR 14 -11.396 -0.242 -39.291 87 HA THR 14 HA THR 14 -9.758 1.813 -38.396 88 HB THR 14 HB THR 14 -11.746 3.154 -38.137 89 HG1 THR 14 1HG THR 14 -11.233 2.317 -35.472 90 HG21 THR 14 3HG2 THR 14 -13.476 1.420 -38.066 91 HG22 THR 14 1HG2 THR 14 -13.653 2.515 -36.692 92 HG23 THR 14 2HG2 THR 14 -12.927 0.924 -36.465 93 H THR 15 H THR 15 -8.363 0.403 -37.724 94 HA THR 15 HA THR 15 -9.177 -1.851 -36.142 95 HB THR 15 HB THR 15 -6.373 -0.924 -36.843 96 HG1 THR 15 1HG THR 15 -8.311 -2.440 -38.243 97 HG21 THR 15 3HG2 THR 15 -5.791 -3.281 -36.497 98 HG22 THR 15 1HG2 THR 15 -7.478 -3.659 -36.138 99 HG23 THR 15 2HG2 THR 15 -6.553 -2.625 -35.049 100 H SER 16 H SER 16 -10.098 -0.617 -34.456 101 HA SER 16 HA SER 16 -8.140 0.559 -32.645 102 HB2 SER 16 2HB SER 16 -10.095 2.085 -31.969 103 HB3 SER 16 1HB SER 16 -9.293 2.417 -33.508 104 HG SER 16 HG SER 16 -11.558 0.748 -33.329 105 H VAL 17 H VAL 17 -7.961 -1.400 -31.547 106 HA VAL 17 HA VAL 17 -10.242 -2.080 -29.838 107 HB VAL 17 HB VAL 17 -8.231 -4.033 -31.018 108 HG11 VAL 17 1HG1 VAL 17 -10.697 -4.579 -29.374 109 HG12 VAL 17 2HG1 VAL 17 -9.029 -4.721 -28.828 110 HG13 VAL 17 3HG1 VAL 17 -9.639 -5.798 -30.085 111 HG21 VAL 17 3HG2 VAL 17 -10.080 -4.952 -32.337 112 HG22 VAL 17 1HG2 VAL 17 -9.755 -3.271 -32.758 113 HG23 VAL 17 2HG2 VAL 17 -11.139 -3.674 -31.738 114 H PHE 18 H PHE 18 -9.630 -2.398 -27.698 115 HA PHE 18 HA PHE 18 -6.811 -1.932 -27.139 116 HB2 PHE 18 2HB PHE 18 -9.228 -1.651 -25.342 117 HB3 PHE 18 1HB PHE 18 -7.575 -1.543 -24.754 118 HD1 PHE 18 1HD PHE 18 -6.133 0.317 -25.456 119 HD2 PHE 18 2HD PHE 18 -10.247 0.154 -26.535 120 HE1 PHE 18 1HE PHE 18 -6.077 2.712 -26.003 121 HE2 PHE 18 2HE PHE 18 -10.194 2.548 -27.085 122 HZ PHE 18 HZ PHE 18 -8.109 3.829 -26.821 123 H ARG 19 H ARG 19 -6.298 -4.015 -27.814 124 HA ARG 19 HA ARG 19 -7.033 -6.118 -25.899 125 HB2 ARG 19 2HB ARG 19 -7.658 -6.491 -28.278 126 HB3 ARG 19 1HB ARG 19 -5.978 -6.292 -28.733 127 HG2 ARG 19 2HG ARG 19 -5.419 -8.335 -27.470 128 HG3 ARG 19 1HG ARG 19 -7.127 -8.529 -27.069 129 HD2 ARG 19 2HD ARG 19 -6.434 -9.917 -28.989 130 HD3 ARG 19 1HD ARG 19 -7.693 -8.754 -29.404 131 HE ARG 19 HE ARG 19 -5.601 -7.356 -30.151 132 HH11 ARG 19 1HH1 ARG 19 -6.063 -10.828 -30.684 133 HH12 ARG 19 2HH1 ARG 19 -5.170 -10.805 -32.134 134 HH21 ARG 19 1HH2 ARG 19 -4.466 -7.356 -31.995 135 HH22 ARG 19 2HH2 ARG 19 -4.197 -8.780 -32.927 136 H ALA 20 H ALA 20 -4.896 -3.887 -26.164 137 HA ALA 20 HA ALA 20 -2.722 -3.463 -25.602 138 HB1 ALA 20 1HB ALA 20 -2.829 -6.217 -24.323 139 HB2 ALA 20 2HB ALA 20 -3.309 -4.715 -23.536 140 HB3 ALA 20 3HB ALA 20 -1.624 -4.974 -23.987 141 H ASP 21 H ASP 21 -3.373 -4.518 -28.068 142 HA ASP 21 HA ASP 21 -2.035 -6.597 -29.231 143 HB2 ASP 21 2HB ASP 21 -2.435 -3.855 -30.434 144 HB3 ASP 21 1HB ASP 21 -2.322 -5.374 -31.306 145 H LEU 22 H LEU 22 -0.975 -3.310 -28.791 146 HA LEU 22 HA LEU 22 1.748 -4.162 -28.458 147 HB2 LEU 22 2HB LEU 22 1.599 -3.563 -30.873 148 HB3 LEU 22 1HB LEU 22 0.983 -1.984 -30.425 149 HG LEU 22 HG LEU 22 3.127 -1.530 -29.255 150 HD11 LEU 22 1HD1 LEU 22 3.860 -3.783 -28.812 151 HD12 LEU 22 2HD1 LEU 22 5.069 -2.933 -29.780 152 HD13 LEU 22 3HD1 LEU 22 3.996 -4.103 -30.542 153 HD21 LEU 22 3HD2 LEU 22 2.747 -0.676 -31.491 154 HD22 LEU 22 1HD2 LEU 22 3.321 -2.190 -32.190 155 HD23 LEU 22 2HD2 LEU 22 4.434 -1.154 -31.299 156 H LEU 23 H LEU 23 1.298 -3.648 -26.320 157 HA LEU 23 HA LEU 23 1.173 -0.804 -25.803 158 HB2 LEU 23 2HB LEU 23 -1.162 -1.675 -25.706 159 HB3 LEU 23 1HB LEU 23 -0.669 -2.831 -24.498 160 HG LEU 23 HG LEU 23 -1.987 -0.815 -23.686 161 HD11 LEU 23 1HD1 LEU 23 -0.721 -0.515 -21.639 162 HD12 LEU 23 2HD1 LEU 23 0.696 -1.239 -22.396 163 HD13 LEU 23 3HD1 LEU 23 -0.749 -2.211 -22.120 164 HD21 LEU 23 3HD2 LEU 23 -0.882 0.877 -25.043 165 HD22 LEU 23 1HD2 LEU 23 0.627 0.597 -24.174 166 HD23 LEU 23 2HD2 LEU 23 -0.768 1.262 -23.325 167 H LYS 24 H LYS 24 3.101 -0.634 -25.003 168 HA LYS 24 HA LYS 24 3.849 -2.509 -22.918 169 HB2 LYS 24 2HB LYS 24 5.593 -0.756 -24.656 170 HB3 LYS 24 1HB LYS 24 6.185 -1.678 -23.277 171 HG2 LYS 24 2HG LYS 24 5.385 -3.759 -24.366 172 HG3 LYS 24 1HG LYS 24 4.903 -2.802 -25.761 173 HD2 LYS 24 2HD LYS 24 7.050 -3.897 -26.126 174 HD3 LYS 24 1HD LYS 24 7.232 -2.151 -26.124 175 HE2 LYS 24 2HE LYS 24 9.041 -3.278 -24.894 176 HE3 LYS 24 1HE LYS 24 8.102 -2.220 -23.852 177 HZ1 LYS 24 3HZ LYS 24 7.792 -5.180 -24.002 178 HZ2 LYS 24 1HZ LYS 24 6.968 -4.148 -22.950 179 HZ3 LYS 24 2HZ LYS 24 8.627 -4.323 -22.813 180 H GLU 25 H GLU 25 5.266 -1.466 -21.232 181 HA GLU 25 HA GLU 25 5.350 -0.179 -19.394 182 HB2 GLU 25 2HB GLU 25 4.096 2.015 -21.051 183 HB3 GLU 25 1HB GLU 25 4.888 2.214 -19.503 184 HG2 GLU 25 2HG GLU 25 7.012 1.758 -20.438 185 HG3 GLU 25 1HG GLU 25 6.295 1.233 -21.968 186 H MET 26 H MET 26 3.796 -1.645 -18.645 187 HA MET 26 HA MET 26 1.158 -0.423 -18.289 188 HB2 MET 26 2HB MET 26 0.174 -2.666 -18.128 189 HB3 MET 26 1HB MET 26 0.947 -2.435 -19.688 190 HG2 MET 26 2HG MET 26 2.841 -3.771 -18.972 191 HG3 MET 26 1HG MET 26 2.153 -3.922 -17.358 192 HE1 MET 26 3HE MET 26 2.449 -6.567 -17.505 193 HE2 MET 26 1HE MET 26 3.129 -6.395 -19.122 194 HE3 MET 26 2HE MET 26 1.828 -7.547 -18.832 195 H GLU 27 H GLU 27 0.181 -0.819 -16.281 196 HA GLU 27 HA GLU 27 2.003 -0.634 -14.121 197 HB2 GLU 27 2HB GLU 27 -0.997 -1.015 -14.099 198 HB3 GLU 27 1HB GLU 27 -0.016 -0.558 -12.713 199 HG2 GLU 27 2HG GLU 27 0.630 1.511 -13.866 200 HG3 GLU 27 1HG GLU 27 -0.378 1.054 -15.233 201 H SER 28 H SER 28 3.106 -2.324 -13.398 202 HA SER 28 HA SER 28 1.696 -4.797 -12.782 203 HB2 SER 28 2HB SER 28 4.345 -4.683 -14.260 204 HB3 SER 28 1HB SER 28 3.460 -6.136 -13.798 205 HG SER 28 HG SER 28 1.783 -4.658 -15.118 206 H SER 29 H SER 29 2.711 -5.905 -11.025 207 HA SER 29 HA SER 29 4.615 -4.219 -9.613 208 HB2 SER 29 2HB SER 29 3.792 -5.355 -7.566 209 HB3 SER 29 1HB SER 29 2.560 -4.447 -8.458 210 HG SER 29 HG SER 29 2.661 -7.026 -9.290 211 H THR 30 H THR 30 6.566 -4.923 -9.227 212 HA THR 30 HA THR 30 7.194 -7.691 -8.954 213 HB THR 30 HB THR 30 8.523 -6.065 -11.169 214 HG1 THR 30 1HG THR 30 6.256 -7.513 -11.165 215 HG21 THR 30 3HG2 THR 30 8.770 -8.997 -10.446 216 HG22 THR 30 1HG2 THR 30 9.975 -7.756 -10.099 217 HG23 THR 30 2HG2 THR 30 9.605 -8.184 -11.769 218 H GLY 31 H GLY 31 8.073 -7.337 -6.992 219 HA2 GLY 31 2HA GLY 31 9.609 -4.933 -6.444 220 HA3 GLY 31 1HA GLY 31 9.165 -6.182 -5.281 221 H THR 32 H THR 32 11.637 -5.340 -5.052 222 HA THR 32 HA THR 32 13.330 -7.220 -6.564 223 HB THR 32 HB THR 32 14.286 -5.011 -4.835 224 HG1 THR 32 1HG THR 32 12.908 -4.874 -7.235 225 HG21 THR 32 3HG2 THR 32 16.212 -5.034 -6.382 226 HG22 THR 32 1HG2 THR 32 15.407 -6.280 -7.338 227 HG23 THR 32 2HG2 THR 32 15.912 -6.630 -5.689 228 H ALA 33 H ALA 33 13.747 -8.958 -5.438 229 HA ALA 33 HA ALA 33 13.204 -9.274 -2.660 230 HB1 ALA 33 1HB ALA 33 14.098 -11.547 -2.934 231 HB2 ALA 33 2HB ALA 33 14.668 -11.121 -4.547 232 HB3 ALA 33 3HB ALA 33 12.939 -11.148 -4.198 233 HA PRO 34 HA PRO 34 17.274 -7.797 -1.308 234 HB2 PRO 34 2HB PRO 34 16.194 -8.657 1.310 235 HB3 PRO 34 1HB PRO 34 16.828 -7.077 0.845 236 HG2 PRO 34 2HG PRO 34 14.230 -7.429 1.232 237 HG3 PRO 34 1HG PRO 34 14.808 -6.415 -0.104 238 HD2 PRO 34 2HD PRO 34 13.823 -9.239 -0.169 239 HD3 PRO 34 1HD PRO 34 13.449 -7.884 -1.264 240 H ALA 35 H ALA 35 19.053 -9.025 -1.175 241 HA ALA 35 HA ALA 35 18.821 -11.868 -0.830 242 HB1 ALA 35 1HB ALA 35 21.253 -10.104 -1.206 243 HB2 ALA 35 2HB ALA 35 20.392 -10.953 -2.490 244 HB3 ALA 35 3HB ALA 35 21.255 -11.867 -1.251 245 H SER 36 H SER 36 18.440 -12.449 1.202 246 HA SER 36 HA SER 36 20.264 -11.561 3.268 247 HB2 SER 36 2HB SER 36 17.261 -11.222 3.406 248 HB3 SER 36 1HB SER 36 18.350 -10.994 4.769 249 HG SER 36 HG SER 36 19.266 -9.587 2.711 250 H THR 37 H THR 37 20.194 -12.956 5.115 251 HA THR 37 HA THR 37 19.396 -15.660 4.479 252 HB THR 37 HB THR 37 20.812 -14.563 6.931 253 HG1 THR 37 1HG THR 37 21.615 -14.780 4.316 254 HG21 THR 37 3HG2 THR 37 21.771 -16.838 7.049 255 HG22 THR 37 1HG2 THR 37 20.834 -17.303 5.629 256 HG23 THR 37 2HG2 THR 37 20.013 -16.888 7.136 257 H GLY 38 H GLY 38 18.147 -12.925 5.976 258 HA2 GLY 38 2HA GLY 38 16.700 -13.538 8.117 259 HA3 GLY 38 1HA GLY 38 16.214 -12.423 6.854 260 H ALA 39 H ALA 39 15.599 -15.001 8.415 261 HA ALA 39 HA ALA 39 14.281 -16.842 6.771 262 HB1 ALA 39 1HB ALA 39 13.121 -17.681 8.723 263 HB2 ALA 39 2HB ALA 39 13.495 -16.197 9.603 264 HB3 ALA 39 3HB ALA 39 14.794 -17.288 9.121 265 H GLU 40 H GLU 40 13.129 -13.769 7.830 266 HA GLU 40 HA GLU 40 10.362 -14.139 7.355 267 HB2 GLU 40 2HB GLU 40 10.256 -11.666 7.340 268 HB3 GLU 40 1HB GLU 40 11.134 -12.310 8.718 269 HG2 GLU 40 2HG GLU 40 13.230 -11.915 7.257 270 HG3 GLU 40 1HG GLU 40 12.173 -10.861 6.325 271 H ASN 41 H ASN 41 12.939 -13.899 5.180 272 HA ASN 41 HA ASN 41 11.374 -12.972 2.940 273 HB2 ASN 41 2HB ASN 41 14.191 -14.021 3.207 274 HB3 ASN 41 1HB ASN 41 13.475 -13.707 1.638 275 HD21 ASN 41 1HD2 ASN 41 13.138 -11.558 0.990 276 HD22 ASN 41 2HD2 ASN 41 13.876 -10.248 1.829 277 H LEU 42 H LEU 42 11.742 -15.869 4.565 278 HA LEU 42 HA LEU 42 11.534 -17.621 2.319 279 HB2 LEU 42 2HB LEU 42 12.835 -18.292 4.245 280 HB3 LEU 42 1HB LEU 42 11.461 -18.166 5.297 281 HG LEU 42 HG LEU 42 12.258 -20.496 4.763 282 HD11 LEU 42 1HD1 LEU 42 10.073 -20.186 5.693 283 HD12 LEU 42 2HD1 LEU 42 10.045 -21.479 4.495 284 HD13 LEU 42 3HD1 LEU 42 9.399 -19.886 4.089 285 HD21 LEU 42 3HD2 LEU 42 11.060 -19.911 2.058 286 HD22 LEU 42 1HD2 LEU 42 11.576 -21.498 2.633 287 HD23 LEU 42 2HD2 LEU 42 12.762 -20.214 2.407 288 HA PRO 43 HA PRO 43 7.014 -18.397 3.749 289 HB2 PRO 43 2HB PRO 43 6.143 -16.103 5.339 290 HB3 PRO 43 1HB PRO 43 6.055 -17.816 5.745 291 HG2 PRO 43 2HG PRO 43 7.737 -16.131 7.014 292 HG3 PRO 43 1HG PRO 43 8.149 -17.828 6.709 293 HD2 PRO 43 2HD PRO 43 8.982 -15.384 5.180 294 HD3 PRO 43 1HD PRO 43 9.970 -16.758 5.724 295 H ALA 44 H ALA 44 6.656 -17.909 1.577 296 HA ALA 44 HA ALA 44 6.081 -15.170 0.913 297 HB1 ALA 44 1HB ALA 44 6.020 -15.811 -1.387 298 HB2 ALA 44 2HB ALA 44 5.963 -17.516 -0.972 299 HB3 ALA 44 3HB ALA 44 7.427 -16.581 -0.649 300 H GLY 45 H GLY 45 4.402 -15.316 2.460 301 HA2 GLY 45 2HA GLY 45 1.837 -16.084 1.221 302 HA3 GLY 45 1HA GLY 45 2.092 -15.905 2.970 303 H SER 46 H SER 46 2.314 -14.193 -0.042 304 HA SER 46 HA SER 46 2.720 -11.708 1.332 305 HB2 SER 46 2HB SER 46 2.615 -12.384 -1.594 306 HB3 SER 46 1HB SER 46 3.196 -10.878 -0.886 307 HG SER 46 HG SER 46 5.007 -11.777 -0.544 308 H ALA 47 H ALA 47 1.592 -9.816 0.612 309 HA ALA 47 HA ALA 47 -1.175 -10.251 -0.160 310 HB1 ALA 47 1HB ALA 47 -1.814 -8.532 1.479 311 HB2 ALA 47 2HB ALA 47 -0.146 -8.466 2.047 312 HB3 ALA 47 3HB ALA 47 -1.094 -9.937 2.266 313 H LEU 48 H LEU 48 -2.067 -7.915 -0.728 314 HA LEU 48 HA LEU 48 0.050 -6.509 -2.082 315 HB2 LEU 48 2HB LEU 48 -1.390 -6.421 -4.171 316 HB3 LEU 48 1HB LEU 48 -0.554 -7.914 -3.831 317 HG LEU 48 HG LEU 48 -2.778 -8.760 -2.880 318 HD11 LEU 48 1HD1 LEU 48 -3.855 -6.405 -4.401 319 HD12 LEU 48 2HD1 LEU 48 -3.944 -6.664 -2.657 320 HD13 LEU 48 3HD1 LEU 48 -4.804 -7.745 -3.756 321 HD21 LEU 48 3HD2 LEU 48 -1.862 -9.550 -4.970 322 HD22 LEU 48 1HD2 LEU 48 -2.532 -8.156 -5.818 323 HD23 LEU 48 2HD2 LEU 48 -3.607 -9.362 -5.104 324 H LEU 49 H LEU 49 -0.277 -4.423 -2.508 325 HA LEU 49 HA LEU 49 -2.634 -3.275 -1.213 326 HB2 LEU 49 2HB LEU 49 -1.374 -1.273 -0.649 327 HB3 LEU 49 1HB LEU 49 -0.521 -2.658 -0.059 328 HG LEU 49 HG LEU 49 0.322 -1.209 -2.597 329 HD11 LEU 49 1HD1 LEU 49 0.481 0.375 -0.780 330 HD12 LEU 49 2HD1 LEU 49 2.094 -0.202 -1.193 331 HD13 LEU 49 3HD1 LEU 49 1.275 -0.827 0.235 332 HD21 LEU 49 3HD2 LEU 49 1.765 -3.116 -0.766 333 HD22 LEU 49 1HD2 LEU 49 2.489 -2.253 -2.118 334 HD23 LEU 49 2HD2 LEU 49 1.237 -3.446 -2.419 335 H VAL 50 H VAL 50 -3.918 -1.987 -2.375 336 HA VAL 50 HA VAL 50 -3.195 -1.562 -5.208 337 HB VAL 50 HB VAL 50 -5.983 -1.918 -4.105 338 HG11 VAL 50 1HG1 VAL 50 -4.961 -1.998 -6.930 339 HG12 VAL 50 2HG1 VAL 50 -5.915 -0.717 -6.185 340 HG13 VAL 50 3HG1 VAL 50 -6.624 -2.313 -6.435 341 HG21 VAL 50 3HG2 VAL 50 -5.987 -4.201 -5.046 342 HG22 VAL 50 1HG2 VAL 50 -4.828 -4.015 -3.729 343 HG23 VAL 50 2HG2 VAL 50 -4.266 -4.039 -5.398 344 H VAL 51 H VAL 51 -3.173 0.524 -5.765 345 HA VAL 51 HA VAL 51 -4.394 2.472 -3.931 346 HB VAL 51 HB VAL 51 -2.875 3.118 -6.462 347 HG11 VAL 51 1HG1 VAL 51 -4.188 4.910 -5.495 348 HG12 VAL 51 2HG1 VAL 51 -2.467 5.252 -5.328 349 HG13 VAL 51 3HG1 VAL 51 -3.392 4.681 -3.939 350 HG21 VAL 51 3HG2 VAL 51 -1.705 2.779 -3.708 351 HG22 VAL 51 1HG2 VAL 51 -0.849 3.432 -5.101 352 HG23 VAL 51 2HG2 VAL 51 -1.380 1.746 -5.101 353 H LYS 52 H LYS 52 -6.344 3.055 -4.249 354 HA LYS 52 HA LYS 52 -7.791 2.303 -6.595 355 HB2 LYS 52 2HB LYS 52 -8.603 4.273 -4.468 356 HB3 LYS 52 1HB LYS 52 -9.667 3.477 -5.599 357 HG2 LYS 52 2HG LYS 52 -8.092 2.076 -3.433 358 HG3 LYS 52 1HG LYS 52 -9.805 2.474 -3.352 359 HD2 LYS 52 2HD LYS 52 -8.536 0.652 -5.406 360 HD3 LYS 52 1HD LYS 52 -9.383 0.111 -3.963 361 HE2 LYS 52 2HE LYS 52 -11.441 1.195 -4.768 362 HE3 LYS 52 1HE LYS 52 -10.575 1.742 -6.202 363 HZ1 LYS 52 3HZ LYS 52 -11.053 -1.080 -5.445 364 HZ2 LYS 52 1HZ LYS 52 -10.214 -0.560 -6.818 365 HZ3 LYS 52 2HZ LYS 52 -11.863 -0.240 -6.648 366 H ARG 53 H ARG 53 -6.363 5.217 -5.326 367 HA ARG 53 HA ARG 53 -5.857 6.346 -7.819 368 HB2 ARG 53 2HB ARG 53 -8.342 6.809 -7.748 369 HB3 ARG 53 1HB ARG 53 -8.069 7.752 -6.292 370 HG2 ARG 53 2HG ARG 53 -8.156 9.375 -7.941 371 HG3 ARG 53 1HG ARG 53 -6.428 9.118 -7.739 372 HD2 ARG 53 2HD ARG 53 -8.200 8.059 -9.954 373 HD3 ARG 53 1HD ARG 53 -6.949 9.282 -10.092 374 HE ARG 53 HE ARG 53 -6.358 6.454 -9.474 375 HH11 ARG 53 1HH1 ARG 53 -5.642 9.384 -11.377 376 HH12 ARG 53 2HH1 ARG 53 -4.424 8.635 -12.286 377 HH21 ARG 53 1HH2 ARG 53 -4.684 5.461 -10.771 378 HH22 ARG 53 2HH2 ARG 53 -3.823 6.364 -11.921 379 H GLY 54 H GLY 54 -4.217 7.683 -7.535 380 HA2 GLY 54 2HA GLY 54 -3.992 9.610 -5.539 381 HA3 GLY 54 1HA GLY 54 -2.977 8.215 -5.151 382 HA PRO 55 HA PRO 55 -0.994 10.841 -8.674 383 HB2 PRO 55 2HB PRO 55 0.693 12.043 -6.552 384 HB3 PRO 55 1HB PRO 55 -0.101 12.829 -7.919 385 HG2 PRO 55 2HG PRO 55 -1.020 13.196 -5.444 386 HG3 PRO 55 1HG PRO 55 -2.131 13.010 -6.811 387 HD2 PRO 55 2HD PRO 55 -1.291 10.960 -4.780 388 HD3 PRO 55 1HD PRO 55 -2.921 11.357 -5.368 389 H ASN 56 H ASN 56 -0.043 9.335 -5.791 390 HA ASN 56 HA ASN 56 2.618 8.563 -6.262 391 HB2 ASN 56 2HB ASN 56 2.038 6.742 -4.543 392 HB3 ASN 56 1HB ASN 56 1.871 8.422 -4.054 393 HD21 ASN 56 1HD2 ASN 56 0.499 7.908 -2.391 394 HD22 ASN 56 2HD2 ASN 56 -1.132 7.390 -2.644 395 H ALA 57 H ALA 57 -0.326 6.576 -6.698 396 HA ALA 57 HA ALA 57 0.681 5.410 -9.085 397 HB1 ALA 57 1HB ALA 57 0.715 3.088 -8.182 398 HB2 ALA 57 2HB ALA 57 0.531 3.748 -6.555 399 HB3 ALA 57 3HB ALA 57 1.979 4.103 -7.490 400 H GLY 58 H GLY 58 -0.923 3.448 -9.517 401 HA2 GLY 58 2HA GLY 58 -3.550 3.823 -8.341 402 HA3 GLY 58 1HA GLY 58 -3.397 4.238 -10.045 403 H ALA 59 H ALA 59 -1.689 1.693 -8.325 404 HA ALA 59 HA ALA 59 -3.105 -0.308 -9.844 405 HB1 ALA 59 1HB ALA 59 -0.108 0.056 -9.857 406 HB2 ALA 59 2HB ALA 59 -1.190 0.346 -11.216 407 HB3 ALA 59 3HB ALA 59 -0.988 -1.290 -10.585 408 H ARG 60 H ARG 60 -1.630 -2.415 -9.145 409 HA ARG 60 HA ARG 60 -1.704 -2.332 -6.228 410 HB2 ARG 60 2HB ARG 60 -2.331 -4.681 -6.301 411 HB3 ARG 60 1HB ARG 60 -3.438 -3.643 -7.207 412 HG2 ARG 60 2HG ARG 60 -2.565 -4.372 -9.294 413 HG3 ARG 60 1HG ARG 60 -1.266 -5.264 -8.505 414 HD2 ARG 60 2HD ARG 60 -2.908 -6.753 -7.483 415 HD3 ARG 60 1HD ARG 60 -4.212 -5.850 -8.253 416 HE ARG 60 HE ARG 60 -2.848 -6.505 -10.366 417 HH11 ARG 60 1HH1 ARG 60 -3.624 -8.564 -7.607 418 HH12 ARG 60 2HH1 ARG 60 -3.640 -10.011 -8.509 419 HH21 ARG 60 1HH2 ARG 60 -2.838 -8.468 -11.584 420 HH22 ARG 60 2HH2 ARG 60 -3.139 -9.968 -10.815 421 H PHE 61 H PHE 61 -0.126 -3.316 -5.091 422 HA PHE 61 HA PHE 61 2.160 -4.346 -6.600 423 HB2 PHE 61 2HB PHE 61 2.298 -2.500 -4.205 424 HB3 PHE 61 1HB PHE 61 3.681 -3.265 -4.973 425 HD1 PHE 61 2HD PHE 61 4.258 -2.615 -7.325 426 HD2 PHE 61 1HD PHE 61 1.398 -0.484 -5.011 427 HE1 PHE 61 2HE PHE 61 4.467 -0.691 -8.845 428 HE2 PHE 61 1HE PHE 61 1.598 1.440 -6.526 429 HZ PHE 61 HZ PHE 61 3.133 1.338 -8.446 430 H LEU 62 H LEU 62 2.896 -6.220 -5.888 431 HA LEU 62 HA LEU 62 1.641 -7.430 -3.571 432 HB2 LEU 62 2HB LEU 62 1.843 -8.653 -5.718 433 HB3 LEU 62 1HB LEU 62 3.584 -8.535 -5.608 434 HG LEU 62 HG LEU 62 3.500 -9.920 -3.540 435 HD11 LEU 62 1HD1 LEU 62 1.461 -11.152 -3.044 436 HD12 LEU 62 2HD1 LEU 62 0.601 -10.225 -4.277 437 HD13 LEU 62 3HD1 LEU 62 1.238 -9.416 -2.847 438 HD21 LEU 62 3HD2 LEU 62 3.043 -12.033 -4.696 439 HD22 LEU 62 1HD2 LEU 62 3.989 -10.936 -5.699 440 HD23 LEU 62 2HD2 LEU 62 2.266 -11.144 -6.005 441 H LEU 63 H LEU 63 2.690 -7.618 -1.623 442 HA LEU 63 HA LEU 63 5.329 -6.463 -1.418 443 HB2 LEU 63 2HB LEU 63 3.617 -7.759 0.716 444 HB3 LEU 63 1HB LEU 63 5.188 -7.067 1.014 445 HG LEU 63 HG LEU 63 3.627 -5.532 1.817 446 HD11 LEU 63 1HD1 LEU 63 3.942 -3.527 0.490 447 HD12 LEU 63 2HD1 LEU 63 4.515 -4.515 -0.854 448 HD13 LEU 63 3HD1 LEU 63 5.424 -4.470 0.658 449 HD21 LEU 63 3HD2 LEU 63 2.164 -5.597 -0.815 450 HD22 LEU 63 1HD2 LEU 63 1.730 -4.650 0.604 451 HD23 LEU 63 2HD2 LEU 63 1.641 -6.415 0.656 452 H ASP 64 H ASP 64 6.973 -7.574 -1.997 453 HA ASP 64 HA ASP 64 7.219 -10.424 -1.230 454 HB2 ASP 64 2HB ASP 64 7.473 -10.035 -3.640 455 HB3 ASP 64 1HB ASP 64 8.692 -8.804 -3.336 456 H GLN 65 H GLN 65 8.336 -7.274 -0.802 457 HA GLN 65 HA GLN 65 10.923 -7.995 0.274 458 HB2 GLN 65 2HB GLN 65 9.631 -5.309 -0.167 459 HB3 GLN 65 1HB GLN 65 11.310 -5.599 0.280 460 HG2 GLN 65 2HG GLN 65 11.742 -6.677 -1.816 461 HG3 GLN 65 1HG GLN 65 10.042 -6.566 -2.267 462 HE21 GLN 65 1HE2 GLN 65 11.736 -4.013 -0.634 463 HE22 GLN 65 2HE2 GLN 65 11.740 -2.912 -1.950 464 HA PRO 66 HA PRO 66 9.195 -8.047 4.406 465 HB2 PRO 66 2HB PRO 66 11.629 -7.629 5.697 466 HB3 PRO 66 1HB PRO 66 10.940 -9.196 5.277 467 HG2 PRO 66 2HG PRO 66 13.044 -7.622 3.904 468 HG3 PRO 66 1HG PRO 66 12.845 -9.376 4.017 469 HD2 PRO 66 2HD PRO 66 12.274 -7.976 1.779 470 HD3 PRO 66 1HD PRO 66 11.410 -9.458 2.227 471 H THR 67 H THR 67 11.594 -5.536 3.553 472 HA THR 67 HA THR 67 9.973 -3.700 5.160 473 HB THR 67 HB THR 67 12.946 -3.445 4.573 474 HG1 THR 67 1HG THR 67 13.218 -4.648 6.233 475 HG21 THR 67 3HG2 THR 67 11.785 -1.298 4.929 476 HG22 THR 67 1HG2 THR 67 12.869 -1.664 6.273 477 HG23 THR 67 2HG2 THR 67 11.133 -1.905 6.453 478 H THR 68 H THR 68 8.766 -2.580 3.816 479 HA THR 68 HA THR 68 9.850 -1.789 1.223 480 HB THR 68 HB THR 68 6.993 -1.944 2.210 481 HG1 THR 68 1HG THR 68 8.062 -4.000 1.891 482 HG21 THR 68 3HG2 THR 68 6.379 -1.648 -0.159 483 HG22 THR 68 1HG2 THR 68 8.083 -1.466 -0.576 484 HG23 THR 68 2HG2 THR 68 7.289 -0.260 0.437 485 H THR 69 H THR 69 10.587 0.255 1.177 486 HA THR 69 HA THR 69 9.870 2.151 3.228 487 HB THR 69 HB THR 69 11.635 2.697 0.844 488 HG1 THR 69 1HG THR 69 12.341 0.759 1.619 489 HG21 THR 69 3HG2 THR 69 11.124 4.515 2.440 490 HG22 THR 69 1HG2 THR 69 12.836 4.086 2.461 491 HG23 THR 69 2HG2 THR 69 11.771 3.529 3.749 492 H ALA 70 H ALA 70 8.177 3.547 2.956 493 HA ALA 70 HA ALA 70 7.239 4.092 0.250 494 HB1 ALA 70 1HB ALA 70 5.597 3.189 1.823 495 HB2 ALA 70 2HB ALA 70 5.170 4.828 1.316 496 HB3 ALA 70 3HB ALA 70 5.886 4.551 2.902 497 H GLY 71 H GLY 71 8.021 5.892 -0.629 498 HA2 GLY 71 2HA GLY 71 7.617 8.413 0.323 499 HA3 GLY 71 1HA GLY 71 9.230 7.947 0.866 500 H ARG 72 H ARG 72 9.634 9.856 -0.674 501 HA ARG 72 HA ARG 72 10.089 8.752 -3.322 502 HB2 ARG 72 2HB ARG 72 8.349 10.613 -3.271 503 HB3 ARG 72 1HB ARG 72 9.578 11.679 -2.630 504 HG2 ARG 72 2HG ARG 72 9.773 10.339 -5.335 505 HG3 ARG 72 1HG ARG 72 9.080 11.933 -5.089 506 HD2 ARG 72 2HD ARG 72 11.231 12.737 -4.226 507 HD3 ARG 72 1HD ARG 72 11.911 11.124 -4.424 508 HE ARG 72 HE ARG 72 10.930 11.863 -6.883 509 HH11 ARG 72 1HH1 ARG 72 13.372 13.138 -4.652 510 HH12 ARG 72 2HH1 ARG 72 14.360 13.774 -5.874 511 HH21 ARG 72 1HH2 ARG 72 12.278 12.771 -8.548 512 HH22 ARG 72 2HH2 ARG 72 13.736 13.577 -8.128 513 H HIS 73 H HIS 73 12.022 8.064 -2.953 514 HA HIS 73 HA HIS 73 14.126 9.965 -2.102 515 HB2 HIS 73 2HB HIS 73 14.229 7.013 -1.414 516 HB3 HIS 73 1HB HIS 73 15.130 8.335 -0.699 517 HD1 HIS 73 1HD HIS 73 12.687 6.013 0.131 518 HD2 HIS 73 2HD HIS 73 13.094 10.084 0.809 519 HE1 HIS 73 1HE HIS 73 11.153 6.564 2.075 520 HA PRO 74 HA PRO 74 16.323 7.820 -5.560 521 HB2 PRO 74 2HB PRO 74 18.464 7.003 -3.649 522 HB3 PRO 74 1HB PRO 74 18.613 7.875 -5.179 523 HG2 PRO 74 2HG PRO 74 18.928 9.153 -2.874 524 HG3 PRO 74 1HG PRO 74 18.058 9.915 -4.216 525 HD2 PRO 74 2HD PRO 74 16.966 8.615 -1.753 526 HD3 PRO 74 1HD PRO 74 16.442 10.105 -2.565 527 H GLU 75 H GLU 75 15.747 6.392 -2.471 528 HA GLU 75 HA GLU 75 15.669 3.701 -3.603 529 HB2 GLU 75 2HB GLU 75 16.098 4.528 -0.731 530 HB3 GLU 75 1HB GLU 75 16.008 2.885 -1.325 531 HG2 GLU 75 2HG GLU 75 18.052 3.097 -2.506 532 HG3 GLU 75 1HG GLU 75 18.085 4.841 -2.248 533 H SER 76 H SER 76 13.543 4.407 -4.296 534 HA SER 76 HA SER 76 11.562 4.204 -2.156 535 HB2 SER 76 2HB SER 76 11.269 5.036 -5.053 536 HB3 SER 76 1HB SER 76 9.914 4.844 -3.943 537 HG SER 76 HG SER 76 10.370 6.625 -3.025 538 H ASP 77 H ASP 77 10.803 2.242 -1.729 539 HA ASP 77 HA ASP 77 11.177 0.094 -3.608 540 HB2 ASP 77 2HB ASP 77 9.763 0.126 -0.920 541 HB3 ASP 77 1HB ASP 77 10.005 -1.316 -1.896 542 H ILE 78 H ILE 78 8.471 1.881 -2.259 543 HA ILE 78 HA ILE 78 7.104 1.222 -4.716 544 HB ILE 78 HB ILE 78 4.873 1.528 -3.575 545 HG12 ILE 78 2HG1 ILE 78 4.894 0.968 -1.035 546 HG13 ILE 78 1HG1 ILE 78 6.555 1.537 -1.073 547 HG21 ILE 78 1HG2 ILE 78 5.591 -0.668 -4.135 548 HG22 ILE 78 2HG2 ILE 78 4.750 -0.709 -2.588 549 HG23 ILE 78 3HG2 ILE 78 6.511 -0.796 -2.636 550 HD11 ILE 78 3HD1 ILE 78 5.792 3.707 -1.853 551 HD12 ILE 78 1HD1 ILE 78 5.031 3.262 -0.327 552 HD13 ILE 78 2HD1 ILE 78 4.126 3.132 -1.836 553 H PHE 79 H PHE 79 5.316 3.060 -5.140 554 HA PHE 79 HA PHE 79 7.114 5.355 -5.083 555 HB2 PHE 79 2HB PHE 79 5.167 4.572 -7.240 556 HB3 PHE 79 1HB PHE 79 6.167 6.019 -7.251 557 HD1 PHE 79 1HD PHE 79 8.671 5.749 -7.275 558 HD2 PHE 79 2HD PHE 79 6.008 2.506 -7.972 559 HE1 PHE 79 1HE PHE 79 10.496 4.481 -8.314 560 HE2 PHE 79 2HE PHE 79 7.832 1.227 -9.015 561 HZ PHE 79 HZ PHE 79 10.081 2.214 -9.187 562 H LEU 80 H LEU 80 6.570 7.267 -4.561 563 HA LEU 80 HA LEU 80 3.795 8.065 -4.229 564 HB2 LEU 80 2HB LEU 80 6.200 8.737 -2.506 565 HB3 LEU 80 1HB LEU 80 4.790 9.759 -2.553 566 HG LEU 80 HG LEU 80 4.775 8.484 -0.560 567 HD11 LEU 80 1HD1 LEU 80 2.639 7.363 -0.649 568 HD12 LEU 80 2HD1 LEU 80 2.709 7.355 -2.405 569 HD13 LEU 80 3HD1 LEU 80 2.614 8.889 -1.535 570 HD21 LEU 80 3HD2 LEU 80 4.646 6.032 -0.517 571 HD22 LEU 80 1HD2 LEU 80 6.176 6.621 -1.169 572 HD23 LEU 80 2HD2 LEU 80 4.932 6.011 -2.257 573 H ASP 81 H ASP 81 3.610 10.354 -4.793 574 HA ASP 81 HA ASP 81 5.923 11.373 -6.309 575 HB2 ASP 81 2HB ASP 81 4.588 9.871 -7.835 576 HB3 ASP 81 1HB ASP 81 3.279 11.041 -7.728 577 H ASP 82 H ASP 82 3.092 12.000 -4.532 578 HA ASP 82 HA ASP 82 2.594 14.629 -5.406 579 HB2 ASP 82 2HB ASP 82 1.187 14.640 -3.295 580 HB3 ASP 82 1HB ASP 82 0.786 13.398 -4.477 581 H VAL 83 H VAL 83 2.752 16.463 -3.899 582 HA VAL 83 HA VAL 83 5.487 16.702 -3.034 583 HB VAL 83 HB VAL 83 4.257 18.523 -4.217 584 HG11 VAL 83 1HG1 VAL 83 2.094 18.320 -3.189 585 HG12 VAL 83 2HG1 VAL 83 2.705 19.964 -3.005 586 HG13 VAL 83 3HG1 VAL 83 2.750 18.847 -1.639 587 HG21 VAL 83 3HG2 VAL 83 5.117 20.394 -2.893 588 HG22 VAL 83 1HG2 VAL 83 6.268 19.061 -2.966 589 HG23 VAL 83 2HG2 VAL 83 5.312 19.323 -1.506 590 H THR 84 H THR 84 2.582 15.823 -1.582 591 HA THR 84 HA THR 84 3.154 16.649 1.061 592 HB THR 84 HB THR 84 1.046 14.965 1.161 593 HG1 THR 84 1HG THR 84 1.097 14.475 -1.028 594 HG21 THR 84 3HG2 THR 84 1.041 17.841 0.204 595 HG22 THR 84 1HG2 THR 84 1.084 17.329 1.891 596 HG23 THR 84 2HG2 THR 84 -0.337 16.993 0.904 597 H VAL 85 H VAL 85 4.735 14.460 -0.613 598 HA VAL 85 HA VAL 85 4.595 12.251 1.226 599 HB VAL 85 HB VAL 85 5.051 11.840 -1.191 600 HG11 VAL 85 1HG1 VAL 85 7.265 12.302 -2.136 601 HG12 VAL 85 2HG1 VAL 85 7.688 13.195 -0.673 602 HG13 VAL 85 3HG1 VAL 85 6.393 13.778 -1.721 603 HG21 VAL 85 3HG2 VAL 85 7.289 10.997 0.639 604 HG22 VAL 85 1HG2 VAL 85 6.886 10.242 -0.901 605 HG23 VAL 85 2HG2 VAL 85 5.740 10.180 0.445 606 H SER 86 H SER 86 6.050 11.745 2.765 607 HA SER 86 HA SER 86 7.954 13.835 3.536 608 HB2 SER 86 2HB SER 86 6.098 13.216 5.112 609 HB3 SER 86 1HB SER 86 6.717 11.580 5.132 610 HG SER 86 HG SER 86 7.711 12.263 6.755 611 H ARG 87 H ARG 87 10.091 13.085 4.264 612 HA ARG 87 HA ARG 87 11.123 10.847 2.822 613 HB2 ARG 87 2HB ARG 87 12.372 12.427 5.093 614 HB3 ARG 87 1HB ARG 87 13.221 11.236 4.123 615 HG2 ARG 87 2HG ARG 87 12.873 12.667 2.144 616 HG3 ARG 87 1HG ARG 87 12.080 13.856 3.183 617 HD2 ARG 87 2HD ARG 87 14.128 14.028 4.532 618 HD3 ARG 87 1HD ARG 87 14.906 12.862 3.467 619 HE ARG 87 HE ARG 87 13.912 15.059 2.003 620 HH11 ARG 87 1HH1 ARG 87 16.538 14.145 4.182 621 HH12 ARG 87 2HH1 ARG 87 17.636 15.311 3.611 622 HH21 ARG 87 1HH2 ARG 87 15.423 16.689 1.191 623 HH22 ARG 87 2HH2 ARG 87 16.992 16.759 1.840 624 H ARG 88 H ARG 88 10.783 8.892 3.332 625 HA ARG 88 HA ARG 88 9.814 7.148 4.260 626 HB2 ARG 88 2HB ARG 88 11.179 8.075 6.813 627 HB3 ARG 88 1HB ARG 88 10.389 6.518 6.626 628 HG2 ARG 88 2HG ARG 88 12.011 6.075 4.724 629 HG3 ARG 88 1HG ARG 88 12.889 7.505 5.274 630 HD2 ARG 88 2HD ARG 88 13.065 6.473 7.525 631 HD3 ARG 88 1HD ARG 88 12.269 5.038 6.876 632 HE ARG 88 HE ARG 88 14.774 5.994 5.722 633 HH11 ARG 88 1HH1 ARG 88 12.894 3.259 7.166 634 HH12 ARG 88 2HH1 ARG 88 14.212 2.256 7.273 635 HH21 ARG 88 1HH2 ARG 88 16.602 4.460 5.856 636 HH22 ARG 88 2HH2 ARG 88 16.360 2.913 6.512 637 H HIS 89 H HIS 89 7.953 7.942 3.750 638 HA HIS 89 HA HIS 89 6.377 9.619 5.457 639 HB2 HIS 89 2HB HIS 89 6.301 9.692 2.984 640 HB3 HIS 89 1HB HIS 89 5.737 8.034 2.957 641 HD2 HIS 89 2HD HIS 89 3.039 7.680 3.561 642 HE1 HIS 89 1HE HIS 89 2.164 11.802 3.378 643 HE2 HIS 89 2HE HIS 89 1.259 9.476 3.062 644 H ALA 90 H ALA 90 6.515 6.277 4.461 645 HA ALA 90 HA ALA 90 5.242 5.448 6.895 646 HB1 ALA 90 1HB ALA 90 3.603 4.034 5.708 647 HB2 ALA 90 2HB ALA 90 4.114 4.735 4.174 648 HB3 ALA 90 3HB ALA 90 3.321 5.745 5.379 649 H GLU 91 H GLU 91 5.606 3.127 7.159 650 HA GLU 91 HA GLU 91 7.449 2.034 5.200 651 HB2 GLU 91 2HB GLU 91 8.704 3.048 7.157 652 HB3 GLU 91 1HB GLU 91 7.895 1.876 8.183 653 HG2 GLU 91 2HG GLU 91 9.023 0.067 7.162 654 HG3 GLU 91 1HG GLU 91 9.636 1.099 5.865 655 H PHE 92 H PHE 92 6.920 0.043 4.692 656 HA PHE 92 HA PHE 92 4.796 -1.221 6.272 657 HB2 PHE 92 2HB PHE 92 5.447 -1.576 3.332 658 HB3 PHE 92 1HB PHE 92 4.151 -2.377 4.201 659 HD1 PHE 92 1HD PHE 92 2.213 -1.039 4.996 660 HD2 PHE 92 2HD PHE 92 5.200 0.604 2.452 661 HE1 PHE 92 1HE PHE 92 0.678 0.778 4.370 662 HE2 PHE 92 2HE PHE 92 3.666 2.429 1.828 663 HZ PHE 92 HZ PHE 92 1.407 2.514 2.788 664 H ARG 93 H ARG 93 5.383 -3.014 7.283 665 HA ARG 93 HA ARG 93 7.578 -4.511 6.096 666 HB2 ARG 93 2HB ARG 93 7.102 -3.872 8.955 667 HB3 ARG 93 1HB ARG 93 7.798 -5.435 8.555 668 HG2 ARG 93 2HG ARG 93 9.553 -4.212 7.254 669 HG3 ARG 93 1HG ARG 93 8.913 -2.714 7.934 670 HD2 ARG 93 2HD ARG 93 10.876 -3.665 9.161 671 HD3 ARG 93 1HD ARG 93 9.443 -3.416 10.153 672 HE ARG 93 HE ARG 93 9.314 -5.631 10.524 673 HH11 ARG 93 1HH1 ARG 93 11.511 -5.305 7.660 674 HH12 ARG 93 2HH1 ARG 93 11.976 -6.947 7.793 675 HH21 ARG 93 1HH2 ARG 93 10.135 -7.860 10.556 676 HH22 ARG 93 2HH2 ARG 93 11.246 -8.325 9.325 677 H ILE 94 H ILE 94 7.402 -6.561 5.787 678 HA ILE 94 HA ILE 94 5.040 -7.814 6.862 679 HB ILE 94 HB ILE 94 4.993 -9.397 4.910 680 HG12 ILE 94 2HG1 ILE 94 6.129 -8.430 2.736 681 HG13 ILE 94 1HG1 ILE 94 7.251 -7.695 3.864 682 HG21 ILE 94 1HG2 ILE 94 4.032 -7.856 3.260 683 HG22 ILE 94 2HG2 ILE 94 4.695 -6.505 4.179 684 HG23 ILE 94 3HG2 ILE 94 3.483 -7.554 4.908 685 HD11 ILE 94 3HD1 ILE 94 8.133 -9.774 2.974 686 HD12 ILE 94 1HD1 ILE 94 6.709 -10.649 3.539 687 HD13 ILE 94 2HD1 ILE 94 7.828 -9.940 4.702 688 H ASN 95 H ASN 95 5.421 -9.271 8.292 689 HA ASN 95 HA ASN 95 8.144 -10.292 8.444 690 HB2 ASN 95 2HB ASN 95 7.670 -8.514 10.145 691 HB3 ASN 95 1HB ASN 95 6.407 -9.551 10.801 692 HD21 ASN 95 1HD2 ASN 95 7.455 -9.702 12.787 693 HD22 ASN 95 2HD2 ASN 95 8.868 -10.646 13.031 694 H GLU 96 H GLU 96 8.460 -12.257 9.189 695 HA GLU 96 HA GLU 96 6.885 -14.332 8.395 696 HB2 GLU 96 2HB GLU 96 8.251 -15.726 9.962 697 HB3 GLU 96 1HB GLU 96 9.208 -14.660 8.952 698 HG2 GLU 96 2HG GLU 96 9.300 -13.048 10.861 699 HG3 GLU 96 1HG GLU 96 8.502 -14.265 11.852 700 H GLY 97 H GLY 97 6.682 -12.643 11.440 701 HA2 GLY 97 2HA GLY 97 4.741 -14.424 12.586 702 HA3 GLY 97 1HA GLY 97 5.200 -12.841 13.210 703 H GLU 98 H GLU 98 4.544 -11.041 11.319 704 HA GLU 98 HA GLU 98 1.952 -11.410 10.284 705 HB2 GLU 98 2HB GLU 98 2.292 -9.858 12.856 706 HB3 GLU 98 1HB GLU 98 1.038 -9.457 11.699 707 HG2 GLU 98 2HG GLU 98 0.110 -11.734 11.959 708 HG3 GLU 98 1HG GLU 98 1.367 -12.097 13.133 709 H PHE 99 H PHE 99 1.144 -9.074 9.641 710 HA PHE 99 HA PHE 99 3.471 -7.793 8.367 711 HB2 PHE 99 2HB PHE 99 0.550 -7.445 7.673 712 HB3 PHE 99 1HB PHE 99 1.937 -7.025 6.679 713 HD1 PHE 99 2HD PHE 99 3.539 -9.332 6.463 714 HD2 PHE 99 1HD PHE 99 -0.696 -9.122 6.797 715 HE1 PHE 99 2HE PHE 99 3.347 -11.524 5.358 716 HE2 PHE 99 1HE PHE 99 -0.895 -11.315 5.704 717 HZ PHE 99 HZ PHE 99 1.132 -12.517 4.984 718 H GLU 100 H GLU 100 3.863 -5.604 8.820 719 HA GLU 100 HA GLU 100 1.872 -4.256 10.436 720 HB2 GLU 100 2HB GLU 100 4.725 -4.614 11.243 721 HB3 GLU 100 1HB GLU 100 3.734 -3.301 11.873 722 HG2 GLU 100 2HG GLU 100 2.127 -4.900 12.669 723 HG3 GLU 100 1HG GLU 100 3.138 -6.237 12.105 724 H VAL 101 H VAL 101 1.593 -2.247 10.206 725 HA VAL 101 HA VAL 101 3.287 -0.828 8.286 726 HB VAL 101 HB VAL 101 1.032 -1.083 7.345 727 HG11 VAL 101 1HG1 VAL 101 -0.260 -1.406 9.383 728 HG12 VAL 101 2HG1 VAL 101 -0.961 -0.112 8.406 729 HG13 VAL 101 3HG1 VAL 101 -0.003 0.279 9.832 730 HG21 VAL 101 3HG2 VAL 101 1.517 1.737 8.303 731 HG22 VAL 101 1HG2 VAL 101 0.438 1.281 6.983 732 HG23 VAL 101 2HG2 VAL 101 2.174 0.995 6.845 733 H VAL 102 H VAL 102 4.299 0.885 9.025 734 HA VAL 102 HA VAL 102 3.382 1.899 11.593 735 HB VAL 102 HB VAL 102 5.409 0.641 11.962 736 HG11 VAL 102 1HG1 VAL 102 7.561 1.255 10.963 737 HG12 VAL 102 2HG1 VAL 102 6.708 2.374 9.892 738 HG13 VAL 102 3HG1 VAL 102 6.391 0.644 9.794 739 HG21 VAL 102 3HG2 VAL 102 5.977 3.600 12.113 740 HG22 VAL 102 1HG2 VAL 102 6.861 2.348 12.984 741 HG23 VAL 102 2HG2 VAL 102 5.156 2.629 13.333 742 H ASP 103 H ASP 103 2.870 3.971 11.727 743 HA ASP 103 HA ASP 103 3.257 5.810 9.589 744 HB2 ASP 103 2HB ASP 103 2.473 6.296 12.483 745 HB3 ASP 103 1HB ASP 103 2.197 7.375 11.133 746 H VAL 104 H VAL 104 5.383 6.427 9.350 747 HA VAL 104 HA VAL 104 6.949 6.841 11.784 748 HB VAL 104 HB VAL 104 8.981 6.752 10.276 749 HG11 VAL 104 1HG1 VAL 104 8.288 4.847 11.621 750 HG12 VAL 104 2HG1 VAL 104 8.889 4.294 10.052 751 HG13 VAL 104 3HG1 VAL 104 7.158 4.362 10.363 752 HG21 VAL 104 3HG2 VAL 104 6.951 5.750 8.280 753 HG22 VAL 104 1HG2 VAL 104 8.701 5.710 8.082 754 HG23 VAL 104 2HG2 VAL 104 7.860 7.258 8.156 755 H GLY 105 H GLY 105 5.115 8.697 10.238 756 HA2 GLY 105 2HA GLY 105 5.312 11.081 10.848 757 HA3 GLY 105 1HA GLY 105 6.997 10.969 10.350 758 H SER 106 H SER 106 3.696 10.659 9.155 759 HA SER 106 HA SER 106 4.602 11.011 6.455 760 HB2 SER 106 2HB SER 106 2.130 10.589 6.081 761 HB3 SER 106 1HB SER 106 3.048 9.269 6.814 762 HG SER 106 HG SER 106 1.547 9.373 8.296 763 H LEU 107 H LEU 107 4.193 12.870 5.298 764 HA LEU 107 HA LEU 107 3.417 15.195 6.814 765 HB2 LEU 107 2HB LEU 107 5.305 15.059 5.087 766 HB3 LEU 107 1HB LEU 107 4.066 15.005 3.859 767 HG LEU 107 HG LEU 107 4.462 17.293 5.776 768 HD11 LEU 107 1HD1 LEU 107 5.454 16.956 2.949 769 HD12 LEU 107 2HD1 LEU 107 6.442 17.017 4.407 770 HD13 LEU 107 3HD1 LEU 107 5.552 18.446 3.888 771 HD21 LEU 107 3HD2 LEU 107 2.939 17.141 3.163 772 HD22 LEU 107 1HD2 LEU 107 3.146 18.592 4.146 773 HD23 LEU 107 2HD2 LEU 107 2.218 17.228 4.770 774 H ASN 108 H ASN 108 2.294 13.437 3.968 775 HA ASN 108 HA ASN 108 -0.123 14.852 3.599 776 HB2 ASN 108 2HB ASN 108 1.178 13.127 2.056 777 HB3 ASN 108 1HB ASN 108 0.125 11.966 2.848 778 HD21 ASN 108 1HD2 ASN 108 0.323 12.869 0.046 779 HD22 ASN 108 2HD2 ASN 108 -1.258 13.373 -0.353 780 H GLY 109 H GLY 109 0.748 12.088 5.579 781 HA2 GLY 109 2HA GLY 109 -0.474 11.773 7.650 782 HA3 GLY 109 1HA GLY 109 -1.946 12.147 6.765 783 H THR 110 H THR 110 -0.599 9.697 8.270 784 HA THR 110 HA THR 110 -1.370 7.702 6.301 785 HB THR 110 HB THR 110 -0.096 6.228 8.215 786 HG1 THR 110 1HG THR 110 0.476 7.482 9.605 787 HG21 THR 110 3HG2 THR 110 1.329 7.955 6.177 788 HG22 THR 110 1HG2 THR 110 0.587 6.391 5.837 789 HG23 THR 110 2HG2 THR 110 1.969 6.494 6.933 790 H TYR 111 H TYR 111 -3.280 6.788 6.603 791 HA TYR 111 HA TYR 111 -4.388 6.724 9.347 792 HB2 TYR 111 2HB TYR 111 -5.960 6.856 6.764 793 HB3 TYR 111 1HB TYR 111 -6.595 6.924 8.395 794 HD1 TYR 111 1HD TYR 111 -4.609 8.792 5.892 795 HD2 TYR 111 2HD TYR 111 -6.816 9.009 9.515 796 HE1 TYR 111 1HE TYR 111 -4.549 11.235 5.768 797 HE2 TYR 111 2HE TYR 111 -6.755 11.468 9.402 798 HH TYR 111 HH TYR 111 -5.500 13.206 8.393 799 H VAL 112 H VAL 112 -4.921 4.735 10.011 800 HA VAL 112 HA VAL 112 -5.160 2.576 8.021 801 HB VAL 112 HB VAL 112 -4.214 2.311 10.892 802 HG11 VAL 112 1HG1 VAL 112 -5.299 0.310 10.055 803 HG12 VAL 112 2HG1 VAL 112 -3.569 0.023 10.241 804 HG13 VAL 112 3HG1 VAL 112 -4.249 0.302 8.638 805 HG21 VAL 112 3HG2 VAL 112 -2.544 2.237 8.373 806 HG22 VAL 112 1HG2 VAL 112 -1.958 1.867 9.995 807 HG23 VAL 112 2HG2 VAL 112 -2.514 3.495 9.606 808 H ASN 113 H ASN 113 -7.190 1.826 7.957 809 HA ASN 113 HA ASN 113 -9.363 1.523 8.402 810 HB2 ASN 113 2HB ASN 113 -8.497 1.646 11.314 811 HB3 ASN 113 1HB ASN 113 -10.127 1.231 10.809 812 HD21 ASN 113 1HD2 ASN 113 -10.464 -0.765 9.796 813 HD22 ASN 113 2HD2 ASN 113 -9.342 -2.053 9.887 814 H ARG 114 H ARG 114 -8.085 4.056 8.112 815 HA ARG 114 HA ARG 114 -8.566 6.211 7.854 816 HB2 ARG 114 2HB ARG 114 -11.241 5.563 9.086 817 HB3 ARG 114 1HB ARG 114 -10.813 7.143 8.444 818 HG2 ARG 114 2HG ARG 114 -10.455 6.115 6.240 819 HG3 ARG 114 1HG ARG 114 -10.961 4.562 6.910 820 HD2 ARG 114 2HD ARG 114 -13.133 5.470 7.442 821 HD3 ARG 114 1HD ARG 114 -12.633 7.060 6.864 822 HE ARG 114 HE ARG 114 -12.221 5.543 4.718 823 HH11 ARG 114 1HH1 ARG 114 -15.014 5.835 6.857 824 HH12 ARG 114 2HH1 ARG 114 -16.146 5.447 5.646 825 HH21 ARG 114 1HH2 ARG 114 -13.759 5.083 3.071 826 HH22 ARG 114 2HH2 ARG 114 -15.428 5.055 3.441 827 H GLU 115 H GLU 115 -7.887 4.861 10.636 828 HA GLU 115 HA GLU 115 -8.006 7.344 12.192 829 HB2 GLU 115 2HB GLU 115 -7.264 4.542 13.057 830 HB3 GLU 115 1HB GLU 115 -7.411 5.938 14.106 831 HG2 GLU 115 2HG GLU 115 -9.655 4.638 12.578 832 HG3 GLU 115 1HG GLU 115 -9.318 4.448 14.294 833 HA PRO 116 HA PRO 116 -3.537 7.609 11.287 834 HB2 PRO 116 2HB PRO 116 -3.444 9.725 13.309 835 HB3 PRO 116 1HB PRO 116 -3.175 9.859 11.572 836 HG2 PRO 116 2HG PRO 116 -5.343 10.917 12.822 837 HG3 PRO 116 1HG PRO 116 -5.368 10.369 11.140 838 HD2 PRO 116 2HD PRO 116 -6.411 9.014 13.592 839 HD3 PRO 116 1HD PRO 116 -7.087 9.081 11.949 840 H ARG 117 H ARG 117 -2.025 6.304 12.304 841 HA ARG 117 HA ARG 117 -2.485 5.820 15.171 842 HB2 ARG 117 2HB ARG 117 -1.662 3.804 13.072 843 HB3 ARG 117 1HB ARG 117 -1.916 3.470 14.781 844 HG2 ARG 117 2HG ARG 117 -4.288 4.202 14.500 845 HG3 ARG 117 1HG ARG 117 -3.978 4.334 12.777 846 HD2 ARG 117 2HD ARG 117 -3.418 1.985 12.672 847 HD3 ARG 117 1HD ARG 117 -3.673 1.817 14.396 848 HE ARG 117 HE ARG 117 -5.792 2.554 12.495 849 HH11 ARG 117 1HH1 ARG 117 -4.770 0.882 15.473 850 HH12 ARG 117 2HH1 ARG 117 -6.238 0.089 15.712 851 HH21 ARG 117 1HH2 ARG 117 -7.846 1.494 12.874 852 HH22 ARG 117 2HH2 ARG 117 -8.042 0.458 14.210 853 H ASN 118 H ASN 118 -0.285 4.061 15.467 854 HA ASN 118 HA ASN 118 1.981 5.782 14.768 855 HB2 ASN 118 2HB ASN 118 1.484 5.865 17.223 856 HB3 ASN 118 1HB ASN 118 1.722 4.124 17.302 857 HD21 ASN 118 1HD2 ASN 118 3.796 3.320 17.358 858 HD22 ASN 118 2HD2 ASN 118 5.186 4.343 17.442 859 H ALA 119 H ALA 119 0.939 2.487 15.599 860 HA ALA 119 HA ALA 119 2.189 1.496 13.219 861 HB1 ALA 119 1HB ALA 119 2.992 0.439 15.951 862 HB2 ALA 119 2HB ALA 119 4.049 1.282 14.822 863 HB3 ALA 119 3HB ALA 119 3.405 -0.306 14.409 864 H GLN 120 H GLN 120 1.016 -0.226 12.496 865 HA GLN 120 HA GLN 120 -0.851 -1.482 14.333 866 HB2 GLN 120 2HB GLN 120 -2.032 0.433 13.246 867 HB3 GLN 120 1HB GLN 120 -1.756 -0.332 11.686 868 HG2 GLN 120 2HG GLN 120 -4.022 -0.753 12.497 869 HG3 GLN 120 1HG GLN 120 -3.095 -2.250 12.375 870 HE21 GLN 120 1HE2 GLN 120 -4.376 -3.321 13.871 871 HE22 GLN 120 2HE2 GLN 120 -4.346 -2.967 15.553 872 H VAL 121 H VAL 121 -1.505 -3.572 13.674 873 HA VAL 121 HA VAL 121 0.251 -4.833 11.781 874 HB VAL 121 HB VAL 121 -2.145 -5.898 13.336 875 HG11 VAL 121 1HG1 VAL 121 -1.365 -8.152 12.712 876 HG12 VAL 121 2HG1 VAL 121 -0.122 -7.430 11.692 877 HG13 VAL 121 3HG1 VAL 121 -1.828 -7.208 11.295 878 HG21 VAL 121 3HG2 VAL 121 0.814 -6.269 13.754 879 HG22 VAL 121 1HG2 VAL 121 -0.454 -7.033 14.706 880 HG23 VAL 121 2HG2 VAL 121 -0.257 -5.280 14.742 881 H MET 122 H MET 122 -0.185 -5.199 9.740 882 HA MET 122 HA MET 122 -2.340 -3.775 8.499 883 HB2 MET 122 2HB MET 122 -0.361 -5.677 7.216 884 HB3 MET 122 1HB MET 122 -1.397 -4.529 6.388 885 HG2 MET 122 2HG MET 122 -0.237 -2.697 7.478 886 HG3 MET 122 1HG MET 122 0.825 -3.843 8.284 887 HE1 MET 122 3HE MET 122 0.805 -2.935 3.763 888 HE2 MET 122 1HE MET 122 -0.141 -2.066 4.970 889 HE3 MET 122 2HE MET 122 -0.548 -3.733 4.559 890 H GLN 123 H GLN 123 -4.286 -4.530 8.162 891 HA GLN 123 HA GLN 123 -4.650 -7.408 8.380 892 HB2 GLN 123 2HB GLN 123 -5.826 -5.482 9.839 893 HB3 GLN 123 1HB GLN 123 -6.954 -5.546 8.489 894 HG2 GLN 123 2HG GLN 123 -7.704 -7.011 10.238 895 HG3 GLN 123 1HG GLN 123 -7.186 -7.964 8.841 896 HE21 GLN 123 1HE2 GLN 123 -6.742 -9.794 10.053 897 HE22 GLN 123 2HE2 GLN 123 -5.396 -9.887 11.139 898 H THR 124 H THR 124 -5.388 -8.483 6.628 899 HA THR 124 HA THR 124 -5.505 -7.041 4.185 900 HB THR 124 HB THR 124 -5.950 -9.378 3.274 901 HG1 THR 124 1HG THR 124 -6.761 -10.371 5.118 902 HG21 THR 124 3HG2 THR 124 -3.714 -8.372 3.307 903 HG22 THR 124 1HG2 THR 124 -3.630 -10.099 3.655 904 HG23 THR 124 2HG2 THR 124 -3.484 -8.931 4.967 905 H GLY 125 H GLY 125 -7.231 -6.241 3.279 906 HA2 GLY 125 2HA GLY 125 -9.495 -6.816 2.510 907 HA3 GLY 125 1HA GLY 125 -9.828 -7.214 4.193 908 H ASP 126 H ASP 126 -7.945 -4.792 4.797 909 HA ASP 126 HA ASP 126 -10.205 -2.927 4.661 910 HB2 ASP 126 2HB ASP 126 -9.242 -3.704 6.947 911 HB3 ASP 126 1HB ASP 126 -7.920 -2.592 6.597 912 H GLU 127 H GLU 127 -8.800 -0.524 5.294 913 HA GLU 127 HA GLU 127 -7.209 -0.168 2.885 914 HB2 GLU 127 2HB GLU 127 -9.499 0.168 2.165 915 HB3 GLU 127 1HB GLU 127 -9.777 1.303 3.466 916 HG2 GLU 127 2HG GLU 127 -8.307 2.907 2.444 917 HG3 GLU 127 1HG GLU 127 -7.838 1.736 1.210 918 H ILE 128 H ILE 128 -5.744 1.359 2.975 919 HA ILE 128 HA ILE 128 -5.353 2.876 5.451 920 HB ILE 128 HB ILE 128 -3.326 1.800 3.447 921 HG12 ILE 128 2HG1 ILE 128 -3.828 1.005 6.331 922 HG13 ILE 128 1HG1 ILE 128 -4.293 0.068 4.919 923 HG21 ILE 128 1HG2 ILE 128 -2.570 3.940 4.340 924 HG22 ILE 128 2HG2 ILE 128 -1.586 2.625 4.984 925 HG23 ILE 128 3HG2 ILE 128 -2.834 3.368 5.986 926 HD11 ILE 128 3HD1 ILE 128 -1.933 -0.218 4.338 927 HD12 ILE 128 1HD1 ILE 128 -2.286 -0.823 5.957 928 HD13 ILE 128 2HD1 ILE 128 -1.478 0.730 5.754 929 H GLN 129 H GLN 129 -5.213 5.048 5.184 930 HA GLN 129 HA GLN 129 -5.334 6.013 2.413 931 HB2 GLN 129 2HB GLN 129 -6.431 7.375 4.871 932 HB3 GLN 129 1HB GLN 129 -6.461 8.021 3.245 933 HG2 GLN 129 2HG GLN 129 -7.885 6.146 2.551 934 HG3 GLN 129 1HG GLN 129 -7.892 5.565 4.218 935 HE21 GLN 129 1HE2 GLN 129 -9.048 7.995 2.029 936 HE22 GLN 129 2HE2 GLN 129 -10.216 8.660 3.108 937 H ILE 130 H ILE 130 -3.883 7.360 1.732 938 HA ILE 130 HA ILE 130 -2.184 8.565 3.739 939 HB ILE 130 HB ILE 130 -0.448 8.971 1.983 940 HG12 ILE 130 2HG1 ILE 130 -1.904 8.641 -0.068 941 HG13 ILE 130 1HG1 ILE 130 -0.362 7.817 -0.137 942 HG21 ILE 130 1HG2 ILE 130 -0.092 7.244 3.548 943 HG22 ILE 130 2HG2 ILE 130 0.510 6.712 1.978 944 HG23 ILE 130 3HG2 ILE 130 -1.027 6.098 2.586 945 HD11 ILE 130 3HD1 ILE 130 -3.061 6.540 0.378 946 HD12 ILE 130 1HD1 ILE 130 -1.509 5.697 0.421 947 HD13 ILE 130 2HD1 ILE 130 -2.081 6.423 -1.075 948 H GLY 131 H GLY 131 -3.024 10.315 4.215 949 HA2 GLY 131 2HA GLY 131 -3.991 12.396 4.052 950 HA3 GLY 131 1HA GLY 131 -3.544 12.402 2.346 951 H LYS 132 H LYS 132 -5.169 12.403 0.997 952 HA LYS 132 HA LYS 132 -7.629 11.045 1.827 953 HB2 LYS 132 2HB LYS 132 -7.253 13.389 -0.026 954 HB3 LYS 132 1HB LYS 132 -8.773 12.511 0.115 955 HG2 LYS 132 2HG LYS 132 -7.381 13.814 2.440 956 HG3 LYS 132 1HG LYS 132 -8.627 14.606 1.473 957 HD2 LYS 132 2HD LYS 132 -10.281 13.045 2.157 958 HD3 LYS 132 1HD LYS 132 -9.085 11.944 2.833 959 HE2 LYS 132 2HE LYS 132 -10.338 13.217 4.534 960 HE3 LYS 132 1HE LYS 132 -8.602 13.472 4.616 961 HZ1 LYS 132 3HZ LYS 132 -8.952 15.579 3.384 962 HZ2 LYS 132 1HZ LYS 132 -9.737 15.536 4.874 963 HZ3 LYS 132 2HZ LYS 132 -10.615 15.330 3.451 964 H PHE 133 H PHE 133 -5.009 10.477 0.125 965 HA PHE 133 HA PHE 133 -6.312 9.322 -2.195 966 HB2 PHE 133 2HB PHE 133 -3.406 9.093 -1.338 967 HB3 PHE 133 1HB PHE 133 -4.067 8.730 -2.930 968 HD1 PHE 133 2HD PHE 133 -5.647 10.940 -3.703 969 HD2 PHE 133 1HD PHE 133 -2.061 10.962 -1.408 970 HE1 PHE 133 2HE PHE 133 -5.231 13.266 -4.384 971 HE2 PHE 133 1HE PHE 133 -1.639 13.285 -2.086 972 HZ PHE 133 HZ PHE 133 -3.228 14.444 -3.572 973 H ARG 134 H ARG 134 -6.443 7.040 -2.465 974 HA ARG 134 HA ARG 134 -6.387 5.800 0.186 975 HB2 ARG 134 2HB ARG 134 -8.517 4.653 -0.305 976 HB3 ARG 134 1HB ARG 134 -8.650 6.406 -0.247 977 HG2 ARG 134 2HG ARG 134 -8.516 6.386 -2.756 978 HG3 ARG 134 1HG ARG 134 -8.623 4.625 -2.629 979 HD2 ARG 134 2HD ARG 134 -10.668 6.565 -1.579 980 HD3 ARG 134 1HD ARG 134 -10.806 5.679 -3.094 981 HE ARG 134 HE ARG 134 -10.386 3.897 -0.924 982 HH11 ARG 134 1HH1 ARG 134 -12.882 5.896 -2.412 983 HH12 ARG 134 2HH1 ARG 134 -14.184 4.992 -1.767 984 HH21 ARG 134 1HH2 ARG 134 -12.070 2.746 -0.034 985 HH22 ARG 134 2HH2 ARG 134 -13.719 3.108 -0.387 986 H LEU 135 H LEU 135 -5.658 3.892 0.501 987 HA LEU 135 HA LEU 135 -4.715 2.281 -1.759 988 HB2 LEU 135 2HB LEU 135 -2.942 3.469 -0.588 989 HB3 LEU 135 1HB LEU 135 -3.547 2.899 0.949 990 HG LEU 135 HG LEU 135 -3.002 0.563 0.128 991 HD11 LEU 135 1HD1 LEU 135 -1.374 0.386 -1.668 992 HD12 LEU 135 2HD1 LEU 135 -1.415 2.125 -1.869 993 HD13 LEU 135 3HD1 LEU 135 -2.847 1.166 -2.250 994 HD21 LEU 135 3HD2 LEU 135 -0.735 2.522 0.471 995 HD22 LEU 135 1HD2 LEU 135 -0.676 0.787 0.783 996 HD23 LEU 135 2HD2 LEU 135 -1.685 1.827 1.785 997 H VAL 136 H VAL 136 -5.727 0.291 -1.668 998 HA VAL 136 HA VAL 136 -6.823 -0.496 0.930 999 HB VAL 136 HB VAL 136 -8.520 -0.193 -0.840 1000 HG11 VAL 136 1HG1 VAL 136 -7.271 -0.705 -2.806 1001 HG12 VAL 136 2HG1 VAL 136 -8.692 -1.753 -2.725 1002 HG13 VAL 136 3HG1 VAL 136 -7.102 -2.388 -2.303 1003 HG21 VAL 136 3HG2 VAL 136 -9.694 -2.354 -0.615 1004 HG22 VAL 136 1HG2 VAL 136 -9.020 -1.788 0.915 1005 HG23 VAL 136 2HG2 VAL 136 -8.211 -3.071 0.015 1006 H PHE 137 H PHE 137 -6.347 -2.499 1.764 1007 HA PHE 137 HA PHE 137 -4.053 -3.778 0.450 1008 HB2 PHE 137 2HB PHE 137 -3.440 -2.523 2.448 1009 HB3 PHE 137 1HB PHE 137 -4.640 -3.387 3.388 1010 HD1 PHE 137 2HD PHE 137 -1.677 -4.076 1.239 1011 HD2 PHE 137 1HD PHE 137 -3.933 -5.133 4.680 1012 HE1 PHE 137 2HE PHE 137 0.028 -5.735 1.844 1013 HE2 PHE 137 1HE PHE 137 -2.235 -6.792 5.292 1014 HZ PHE 137 HZ PHE 137 -0.252 -7.099 3.876 1015 H LEU 138 H LEU 138 -4.517 -5.746 -0.252 1016 HA LEU 138 HA LEU 138 -6.516 -7.338 1.216 1017 HB2 LEU 138 2HB LEU 138 -6.013 -7.430 -1.772 1018 HB3 LEU 138 1HB LEU 138 -7.140 -8.428 -0.896 1019 HG LEU 138 HG LEU 138 -8.439 -6.891 -2.034 1020 HD11 LEU 138 1HD1 LEU 138 -9.213 -7.149 0.199 1021 HD12 LEU 138 2HD1 LEU 138 -9.535 -5.514 -0.372 1022 HD13 LEU 138 3HD1 LEU 138 -8.202 -5.811 0.742 1023 HD21 LEU 138 3HD2 LEU 138 -6.733 -5.324 -2.729 1024 HD22 LEU 138 1HD2 LEU 138 -6.630 -4.674 -1.092 1025 HD23 LEU 138 2HD2 LEU 138 -8.105 -4.462 -2.038 1026 H ALA 139 H ALA 139 -6.193 -9.682 0.880 1027 HA ALA 139 HA ALA 139 -3.431 -10.353 1.217 1028 HB1 ALA 139 1HB ALA 139 -4.235 -12.644 1.531 1029 HB2 ALA 139 2HB ALA 139 -5.848 -12.150 1.013 1030 HB3 ALA 139 3HB ALA 139 -5.167 -11.510 2.507 1031 H GLY 140 H GLY 140 -2.202 -11.736 -0.134 1032 HA2 GLY 140 2HA GLY 140 -3.014 -11.427 -2.927 1033 HA3 GLY 140 1HA GLY 140 -1.357 -11.520 -2.334 1034 HA PRO 141 HA PRO 141 -2.336 -15.766 -3.405 1035 HB2 PRO 141 2HB PRO 141 -0.340 -16.162 -5.164 1036 HB3 PRO 141 1HB PRO 141 -1.851 -15.374 -5.616 1037 HG2 PRO 141 2HG PRO 141 0.827 -14.218 -5.307 1038 HG3 PRO 141 1HG PRO 141 -0.590 -13.552 -6.131 1039 HD2 PRO 141 2HD PRO 141 0.411 -12.977 -3.470 1040 HD3 PRO 141 1HD PRO 141 -0.902 -12.180 -4.361 1041 H ALA 142 H ALA 142 -1.134 -17.716 -3.083 1042 HA ALA 142 HA ALA 142 1.059 -17.475 -1.183 1043 HB1 ALA 142 1HB ALA 142 -0.769 -19.012 -0.602 1044 HB2 ALA 142 2HB ALA 142 0.721 -19.919 -0.877 1045 HB3 ALA 142 3HB ALA 142 -0.531 -19.881 -2.119 1046 H GLU 143 H GLU 143 3.024 -17.409 -2.056 1047 HA GLU 143 HA GLU 143 3.319 -18.346 -4.778 1048 HB2 GLU 143 2HB GLU 143 4.100 -16.046 -3.961 1049 HB3 GLU 143 1HB GLU 143 5.395 -16.904 -3.141 1050 HG2 GLU 143 2HG GLU 143 6.155 -16.025 -5.268 1051 HG3 GLU 143 1HG GLU 143 6.167 -17.789 -5.283 Start of MODEL 14 1 H1 MET 1 1HT MET 1-114.855 12.094 -23.282 2 H2 MET 1 2HT MET 1-114.273 10.584 -22.768 3 H3 MET 1 3HT MET 1-115.014 10.738 -24.271 4 HA MET 1 HA MET 1-113.310 12.074 -25.122 5 HB2 MET 1 2HB MET 1-112.140 11.795 -22.344 6 HB3 MET 1 1HB MET 1-111.198 12.331 -23.719 7 HG2 MET 1 2HG MET 1-111.912 14.226 -22.379 8 HG3 MET 1 1HG MET 1-112.653 14.278 -23.971 9 HE1 MET 1 2HE MET 1-114.316 16.155 -22.990 10 HE2 MET 1 3HE MET 1-113.596 15.994 -21.387 11 HE3 MET 1 1HE MET 1-115.346 15.896 -21.580 12 H SER 2 H SER 2-111.020 11.152 -25.662 13 HA SER 2 HA SER 2-111.366 8.410 -26.264 14 HB2 SER 2 2HB SER 2-108.840 10.072 -26.364 15 HB3 SER 2 1HB SER 2-109.164 8.590 -27.260 16 HG SER 2 HG SER 2-110.954 9.722 -28.203 17 H ASP 3 H ASP 3-109.264 10.192 -24.077 18 HA ASP 3 HA ASP 3-108.211 9.768 -22.164 19 HB2 ASP 3 2HB ASP 3-110.483 8.814 -21.515 20 HB3 ASP 3 1HB ASP 3-109.860 7.225 -21.926 21 H ASN 4 H ASN 4-106.821 7.913 -21.028 22 HA ASN 4 HA ASN 4-105.494 6.384 -23.173 23 HB2 ASN 4 2HB ASN 4-103.294 6.969 -22.330 24 HB3 ASN 4 1HB ASN 4-104.176 8.443 -22.698 25 HD21 ASN 4 1HD2 ASN 4-104.837 9.776 -20.974 26 HD22 ASN 4 2HD2 ASN 4-104.165 9.614 -19.390 27 H ASN 5 H ASN 5-107.062 6.291 -20.284 28 HA ASN 5 HA ASN 5-107.262 4.980 -18.533 29 HB2 ASN 5 2HB ASN 5-107.436 3.166 -20.248 30 HB3 ASN 5 1HB ASN 5-105.696 2.927 -20.122 31 HD21 ASN 5 1HD2 ASN 5-105.800 0.869 -19.368 32 HD22 ASN 5 2HD2 ASN 5-106.384 0.458 -17.802 33 H GLY 6 H GLY 6-106.150 6.058 -17.022 34 HA2 GLY 6 2HA GLY 6-103.401 6.391 -16.825 35 HA3 GLY 6 1HA GLY 6-104.531 6.503 -15.492 36 H THR 7 H THR 7-102.097 4.691 -16.969 37 HA THR 7 HA THR 7-102.477 2.478 -15.077 38 HB THR 7 HB THR 7-101.119 2.403 -17.789 39 HG1 THR 7 1HG THR 7-103.329 2.716 -18.044 40 HG21 THR 7 3HG2 THR 7-101.979 0.174 -15.916 41 HG22 THR 7 1HG2 THR 7-100.318 0.691 -16.204 42 HG23 THR 7 2HG2 THR 7-101.247 -0.048 -17.506 43 HA PRO 8 HA PRO 8 -98.450 3.920 -13.617 44 HB2 PRO 8 2HB PRO 8 -97.866 1.741 -12.059 45 HB3 PRO 8 1HB PRO 8 -98.928 3.051 -11.534 46 HG2 PRO 8 2HG PRO 8 -99.638 0.375 -12.654 47 HG3 PRO 8 1HG PRO 8-100.386 1.251 -11.304 48 HD2 PRO 8 2HD PRO 8-101.486 1.177 -13.759 49 HD3 PRO 8 1HD PRO 8-101.622 2.604 -12.710 50 H GLU 9 H GLU 9 -96.637 3.723 -14.796 51 HA GLU 9 HA GLU 9 -96.210 1.263 -16.287 52 HB2 GLU 9 2HB GLU 9 -94.911 3.984 -16.537 53 HB3 GLU 9 1HB GLU 9 -94.578 2.612 -17.592 54 HG2 GLU 9 2HG GLU 9 -96.841 2.628 -18.408 55 HG3 GLU 9 1HG GLU 9 -97.288 3.883 -17.262 56 HA PRO 10 HA PRO 10 -93.505 0.113 -12.946 57 HB2 PRO 10 2HB PRO 10 -92.487 -2.148 -14.120 58 HB3 PRO 10 1HB PRO 10 -94.069 -2.065 -13.336 59 HG2 PRO 10 2HG PRO 10 -93.382 -1.880 -16.231 60 HG3 PRO 10 1HG PRO 10 -94.708 -2.762 -15.450 61 HD2 PRO 10 2HD PRO 10 -95.086 -0.411 -16.673 62 HD3 PRO 10 1HD PRO 10 -95.993 -0.849 -15.212 63 H GLN 11 H GLN 11 -91.513 0.607 -12.400 64 HA GLN 11 HA GLN 11 -89.438 0.816 -14.470 65 HB2 GLN 11 2HB GLN 11 -90.379 3.062 -13.642 66 HB3 GLN 11 1HB GLN 11 -89.713 2.664 -12.075 67 HG2 GLN 11 2HG GLN 11 -88.025 2.906 -14.568 68 HG3 GLN 11 1HG GLN 11 -88.380 4.264 -13.521 69 HE21 GLN 11 1HE2 GLN 11 -85.840 3.142 -14.236 70 HE22 GLN 11 2HE2 GLN 11 -85.049 2.663 -12.780 71 H VAL 12 H VAL 12 -88.148 -0.868 -14.014 72 HA VAL 12 HA VAL 12 -87.770 -1.569 -11.225 73 HB VAL 12 HB VAL 12 -88.302 -3.434 -12.767 74 HG11 VAL 12 1HG1 VAL 12 -85.698 -2.814 -14.116 75 HG12 VAL 12 2HG1 VAL 12 -87.309 -2.640 -14.809 76 HG13 VAL 12 3HG1 VAL 12 -86.688 -4.243 -14.413 77 HG21 VAL 12 3HG2 VAL 12 -86.503 -4.991 -12.113 78 HG22 VAL 12 1HG2 VAL 12 -87.018 -3.964 -10.775 79 HG23 VAL 12 2HG2 VAL 12 -85.513 -3.616 -11.628 80 H GLU 13 H GLU 13 -85.924 -1.271 -10.165 81 HA GLU 13 HA GLU 13 -83.777 0.041 -11.652 82 HB2 GLU 13 2HB GLU 13 -85.043 1.473 -10.013 83 HB3 GLU 13 1HB GLU 13 -84.464 0.417 -8.732 84 HG2 GLU 13 2HG GLU 13 -83.154 2.489 -8.946 85 HG3 GLU 13 1HG GLU 13 -82.182 1.036 -9.212 86 H THR 14 H THR 14 -81.732 -0.644 -11.301 87 HA THR 14 HA THR 14 -81.483 -3.252 -9.984 88 HB THR 14 HB THR 14 -79.579 -1.895 -11.905 89 HG1 THR 14 1HG THR 14 -81.425 -2.181 -13.024 90 HG21 THR 14 3HG2 THR 14 -79.923 -4.779 -11.075 91 HG22 THR 14 1HG2 THR 14 -78.613 -3.711 -10.575 92 HG23 THR 14 2HG2 THR 14 -78.760 -4.192 -12.266 93 H THR 15 H THR 15 -80.514 -3.170 -7.962 94 HA THR 15 HA THR 15 -78.691 -0.938 -7.517 95 HB THR 15 HB THR 15 -79.315 -1.145 -5.088 96 HG1 THR 15 1HG THR 15 -80.224 -3.064 -4.895 97 HG21 THR 15 3HG2 THR 15 -80.282 0.604 -6.501 98 HG22 THR 15 1HG2 THR 15 -81.468 0.024 -5.329 99 HG23 THR 15 2HG2 THR 15 -81.556 -0.501 -7.011 100 H SER 16 H SER 16 -76.667 -1.754 -7.767 101 HA SER 16 HA SER 16 -75.981 -4.144 -6.294 102 HB2 SER 16 2HB SER 16 -73.991 -4.038 -7.932 103 HB3 SER 16 1HB SER 16 -75.554 -4.517 -8.611 104 HG SER 16 HG SER 16 -75.125 -2.968 -9.958 105 H VAL 17 H VAL 17 -74.313 -3.904 -4.824 106 HA VAL 17 HA VAL 17 -73.351 -1.169 -4.519 107 HB VAL 17 HB VAL 17 -73.283 -1.516 -2.071 108 HG11 VAL 17 1HG1 VAL 17 -75.164 -0.337 -3.057 109 HG12 VAL 17 2HG1 VAL 17 -75.713 -1.306 -1.690 110 HG13 VAL 17 3HG1 VAL 17 -75.996 -1.865 -3.339 111 HG21 VAL 17 3HG2 VAL 17 -74.830 -4.039 -2.662 112 HG22 VAL 17 1HG2 VAL 17 -74.564 -3.341 -1.061 113 HG23 VAL 17 2HG2 VAL 17 -73.197 -3.946 -2.000 114 H PHE 18 H PHE 18 -71.266 -0.836 -4.212 115 HA PHE 18 HA PHE 18 -69.505 -2.881 -3.284 116 HB2 PHE 18 2HB PHE 18 -69.690 -3.349 -5.764 117 HB3 PHE 18 1HB PHE 18 -69.103 -1.717 -6.068 118 HD1 PHE 18 2HD PHE 18 -68.110 -4.677 -4.014 119 HD2 PHE 18 1HD PHE 18 -66.896 -1.547 -6.623 120 HE1 PHE 18 2HE PHE 18 -65.799 -5.502 -3.915 121 HE2 PHE 18 1HE PHE 18 -64.584 -2.361 -6.530 122 HZ PHE 18 HZ PHE 18 -64.031 -4.346 -5.170 123 H ARG 19 H ARG 19 -67.700 -1.870 -2.299 124 HA ARG 19 HA ARG 19 -67.878 1.061 -2.350 125 HB2 ARG 19 2HB ARG 19 -67.148 -0.765 -0.051 126 HB3 ARG 19 1HB ARG 19 -67.141 0.977 -0.002 127 HG2 ARG 19 2HG ARG 19 -69.083 0.321 1.146 128 HG3 ARG 19 1HG ARG 19 -69.663 0.826 -0.437 129 HD2 ARG 19 2HD ARG 19 -70.719 -1.289 0.354 130 HD3 ARG 19 1HD ARG 19 -69.834 -1.473 -1.158 131 HE ARG 19 HE ARG 19 -68.077 -2.561 0.011 132 HH11 ARG 19 1HH1 ARG 19 -70.977 -2.057 2.008 133 HH12 ARG 19 2HH1 ARG 19 -70.590 -3.277 3.127 134 HH21 ARG 19 1HH2 ARG 19 -67.542 -4.160 1.513 135 HH22 ARG 19 2HH2 ARG 19 -68.559 -4.523 2.852 136 H ALA 20 H ALA 20 -65.648 1.570 -0.879 137 HA ALA 20 HA ALA 20 -63.471 0.618 -2.499 138 HB1 ALA 20 1HB ALA 20 -63.493 2.390 -0.030 139 HB2 ALA 20 2HB ALA 20 -63.481 2.950 -1.701 140 HB3 ALA 20 3HB ALA 20 -62.087 2.087 -1.054 141 H ASP 21 H ASP 21 -63.687 -1.517 -2.089 142 HA ASP 21 HA ASP 21 -63.661 -2.498 0.632 143 HB2 ASP 21 2HB ASP 21 -64.422 -3.739 -1.978 144 HB3 ASP 21 1HB ASP 21 -64.008 -4.775 -0.623 145 H LEU 22 H LEU 22 -61.279 -1.801 -1.476 146 HA LEU 22 HA LEU 22 -59.698 -4.139 -0.738 147 HB2 LEU 22 2HB LEU 22 -59.472 -3.407 -3.061 148 HB3 LEU 22 1HB LEU 22 -58.937 -1.826 -2.521 149 HG LEU 22 HG LEU 22 -56.952 -2.920 -1.464 150 HD11 LEU 22 1HD1 LEU 22 -56.321 -5.170 -2.160 151 HD12 LEU 22 2HD1 LEU 22 -57.895 -5.368 -2.926 152 HD13 LEU 22 3HD1 LEU 22 -57.786 -5.155 -1.178 153 HD21 LEU 22 3HD2 LEU 22 -55.725 -3.280 -3.555 154 HD22 LEU 22 1HD2 LEU 22 -56.747 -1.847 -3.627 155 HD23 LEU 22 2HD2 LEU 22 -57.252 -3.326 -4.435 156 H LEU 23 H LEU 23 -59.143 -3.982 1.317 157 HA LEU 23 HA LEU 23 -57.849 -1.546 2.257 158 HB2 LEU 23 2HB LEU 23 -59.600 -2.559 3.673 159 HB3 LEU 23 1HB LEU 23 -58.690 -4.052 3.732 160 HG LEU 23 HG LEU 23 -56.928 -2.928 5.033 161 HD11 LEU 23 1HD1 LEU 23 -57.183 -0.662 4.165 162 HD12 LEU 23 2HD1 LEU 23 -57.298 -0.690 5.925 163 HD13 LEU 23 3HD1 LEU 23 -58.759 -0.535 4.947 164 HD21 LEU 23 3HD2 LEU 23 -59.712 -2.583 6.130 165 HD22 LEU 23 1HD2 LEU 23 -58.229 -2.634 7.083 166 HD23 LEU 23 2HD2 LEU 23 -58.746 -4.056 6.174 167 H LYS 24 H LYS 24 -55.694 -1.618 3.040 168 HA LYS 24 HA LYS 24 -54.186 -4.043 2.573 169 HB2 LYS 24 2HB LYS 24 -52.524 -3.032 1.155 170 HB3 LYS 24 1HB LYS 24 -54.082 -2.755 0.403 171 HG2 LYS 24 2HG LYS 24 -52.614 -0.693 2.056 172 HG3 LYS 24 1HG LYS 24 -52.454 -0.834 0.314 173 HD2 LYS 24 2HD LYS 24 -55.041 -0.271 1.785 174 HD3 LYS 24 1HD LYS 24 -54.019 0.950 1.030 175 HE2 LYS 24 2HE LYS 24 -54.316 -0.247 -1.136 176 HE3 LYS 24 1HE LYS 24 -55.466 -1.313 -0.335 177 HZ1 LYS 24 3HZ LYS 24 -56.903 0.547 0.096 178 HZ2 LYS 24 1HZ LYS 24 -56.503 0.522 -1.543 179 HZ3 LYS 24 2HZ LYS 24 -55.757 1.632 -0.524 180 H GLU 25 H GLU 25 -51.749 -3.428 3.180 181 HA GLU 25 HA GLU 25 -51.796 -1.606 5.434 182 HB2 GLU 25 2HB GLU 25 -50.549 -3.180 6.823 183 HB3 GLU 25 1HB GLU 25 -52.062 -3.904 6.330 184 HG2 GLU 25 2HG GLU 25 -49.368 -4.502 5.093 185 HG3 GLU 25 1HG GLU 25 -50.155 -5.482 6.320 186 H MET 26 H MET 26 -49.306 -1.615 6.227 187 HA MET 26 HA MET 26 -47.657 -1.203 3.835 188 HB2 MET 26 2HB MET 26 -46.531 0.627 4.994 189 HB3 MET 26 1HB MET 26 -48.255 0.953 4.961 190 HG2 MET 26 2HG MET 26 -46.785 -0.194 7.332 191 HG3 MET 26 1HG MET 26 -47.124 1.516 7.121 192 HE1 MET 26 3HE MET 26 -47.930 -0.277 9.692 193 HE2 MET 26 1HE MET 26 -49.536 0.364 10.033 194 HE3 MET 26 2HE MET 26 -48.226 1.456 9.581 195 H GLU 27 H GLU 27 -45.359 -1.652 4.231 196 HA GLU 27 HA GLU 27 -45.078 -3.768 6.188 197 HB2 GLU 27 2HB GLU 27 -43.334 -2.876 3.909 198 HB3 GLU 27 1HB GLU 27 -42.829 -4.078 5.083 199 HG2 GLU 27 2HG GLU 27 -44.728 -5.480 4.444 200 HG3 GLU 27 1HG GLU 27 -45.203 -4.269 3.256 201 H SER 28 H SER 28 -42.794 -3.880 7.118 202 HA SER 28 HA SER 28 -42.207 -1.335 8.437 203 HB2 SER 28 2HB SER 28 -41.517 -4.165 9.297 204 HB3 SER 28 1HB SER 28 -41.407 -2.700 10.273 205 HG SER 28 HG SER 28 -43.855 -3.255 9.136 206 H SER 29 H SER 29 -39.595 -1.709 9.175 207 HA SER 29 HA SER 29 -38.295 -2.502 6.695 208 HB2 SER 29 2HB SER 29 -38.496 -0.004 6.939 209 HB3 SER 29 1HB SER 29 -37.509 -0.120 8.389 210 HG SER 29 HG SER 29 -36.824 -0.432 5.714 211 H THR 30 H THR 30 -36.423 -3.659 6.964 212 HA THR 30 HA THR 30 -35.334 -3.861 9.648 213 HB THR 30 HB THR 30 -36.776 -5.850 9.321 214 HG1 THR 30 1HG THR 30 -35.417 -7.101 10.242 215 HG21 THR 30 3HG2 THR 30 -36.715 -6.058 6.888 216 HG22 THR 30 1HG2 THR 30 -36.207 -7.572 7.638 217 HG23 THR 30 2HG2 THR 30 -35.005 -6.484 6.948 218 H GLY 31 H GLY 31 -33.193 -3.633 9.704 219 HA2 GLY 31 2HA GLY 31 -31.756 -3.721 7.142 220 HA3 GLY 31 1HA GLY 31 -31.498 -2.461 8.345 221 H THR 32 H THR 32 -30.349 -5.298 7.163 222 HA THR 32 HA THR 32 -29.549 -6.641 9.481 223 HB THR 32 HB THR 32 -27.968 -7.748 7.752 224 HG1 THR 32 1HG THR 32 -27.927 -6.251 6.158 225 HG21 THR 32 3HG2 THR 32 -29.842 -9.021 6.795 226 HG22 THR 32 1HG2 THR 32 -30.969 -7.773 7.320 227 HG23 THR 32 2HG2 THR 32 -30.105 -8.736 8.514 228 H ALA 33 H ALA 33 -27.381 -6.940 10.240 229 HA ALA 33 HA ALA 33 -25.941 -4.463 10.403 230 HB1 ALA 33 1HB ALA 33 -25.454 -7.136 11.715 231 HB2 ALA 33 2HB ALA 33 -26.306 -5.763 12.423 232 HB3 ALA 33 3HB ALA 33 -24.580 -5.649 12.083 233 HA PRO 34 HA PRO 34 -23.043 -5.866 7.283 234 HB2 PRO 34 2HB PRO 34 -21.340 -3.626 7.921 235 HB3 PRO 34 1HB PRO 34 -22.335 -3.877 6.486 236 HG2 PRO 34 2HG PRO 34 -22.846 -1.956 8.384 237 HG3 PRO 34 1HG PRO 34 -24.080 -2.662 7.331 238 HD2 PRO 34 2HD PRO 34 -23.435 -3.279 10.181 239 HD3 PRO 34 1HD PRO 34 -25.006 -3.191 9.351 240 H ALA 35 H ALA 35 -21.966 -7.546 7.972 241 HA ALA 35 HA ALA 35 -20.093 -7.280 10.201 242 HB1 ALA 35 1HB ALA 35 -21.239 -9.737 8.888 243 HB2 ALA 35 2HB ALA 35 -21.765 -9.044 10.424 244 HB3 ALA 35 3HB ALA 35 -20.142 -9.724 10.265 245 H SER 36 H SER 36 -18.030 -6.963 9.630 246 HA SER 36 HA SER 36 -17.046 -8.360 7.284 247 HB2 SER 36 2HB SER 36 -17.665 -6.017 6.646 248 HB3 SER 36 1HB SER 36 -16.491 -5.430 7.824 249 HG SER 36 HG SER 36 -14.845 -6.458 6.621 250 H THR 37 H THR 37 -15.293 -9.423 7.779 251 HA THR 37 HA THR 37 -13.573 -8.473 9.934 252 HB THR 37 HB THR 37 -14.423 -11.314 9.265 253 HG1 THR 37 1HG THR 37 -15.086 -9.490 11.322 254 HG21 THR 37 3HG2 THR 37 -12.114 -11.244 10.154 255 HG22 THR 37 1HG2 THR 37 -13.226 -11.985 11.304 256 HG23 THR 37 2HG2 THR 37 -12.686 -10.325 11.547 257 H GLY 38 H GLY 38 -11.260 -9.166 9.547 258 HA2 GLY 38 2HA GLY 38 -10.621 -9.150 6.734 259 HA3 GLY 38 1HA GLY 38 -9.478 -9.169 8.074 260 H ALA 39 H ALA 39 -10.173 -11.314 9.435 261 HA ALA 39 HA ALA 39 -8.831 -13.396 8.217 262 HB1 ALA 39 1HB ALA 39 -9.085 -13.110 10.635 263 HB2 ALA 39 2HB ALA 39 -9.485 -14.747 10.108 264 HB3 ALA 39 3HB ALA 39 -10.768 -13.608 10.504 265 H GLU 40 H GLU 40 -12.086 -12.564 7.742 266 HA GLU 40 HA GLU 40 -13.193 -15.138 7.391 267 HB2 GLU 40 2HB GLU 40 -15.138 -14.056 6.436 268 HB3 GLU 40 1HB GLU 40 -14.612 -13.198 7.872 269 HG2 GLU 40 2HG GLU 40 -13.666 -11.453 6.535 270 HG3 GLU 40 1HG GLU 40 -13.986 -12.362 5.057 271 H ASN 41 H ASN 41 -11.421 -13.028 5.148 272 HA ASN 41 HA ASN 41 -12.296 -14.657 2.908 273 HB2 ASN 41 2HB ASN 41 -10.954 -13.359 1.471 274 HB3 ASN 41 1HB ASN 41 -11.715 -12.208 2.570 275 HD21 ASN 41 1HD2 ASN 41 -8.757 -13.673 1.487 276 HD22 ASN 41 2HD2 ASN 41 -7.663 -12.646 2.329 277 H LEU 42 H LEU 42 -10.038 -14.744 5.235 278 HA LEU 42 HA LEU 42 -8.471 -16.173 5.896 279 HB2 LEU 42 2HB LEU 42 -9.878 -17.904 4.969 280 HB3 LEU 42 1HB LEU 42 -9.203 -17.672 3.383 281 HG LEU 42 HG LEU 42 -8.489 -19.796 4.552 282 HD11 LEU 42 1HD1 LEU 42 -6.119 -19.699 4.039 283 HD12 LEU 42 2HD1 LEU 42 -6.218 -17.942 3.893 284 HD13 LEU 42 3HD1 LEU 42 -7.098 -18.972 2.766 285 HD21 LEU 42 3HD2 LEU 42 -6.990 -17.929 6.371 286 HD22 LEU 42 1HD2 LEU 42 -6.846 -19.683 6.344 287 HD23 LEU 42 2HD2 LEU 42 -8.370 -18.936 6.824 288 HA PRO 43 HA PRO 43 -5.250 -13.978 3.722 289 HB2 PRO 43 2HB PRO 43 -3.668 -13.630 5.847 290 HB3 PRO 43 1HB PRO 43 -5.142 -12.678 5.633 291 HG2 PRO 43 2HG PRO 43 -4.642 -15.042 7.390 292 HG3 PRO 43 1HG PRO 43 -5.576 -13.575 7.728 293 HD2 PRO 43 2HD PRO 43 -6.675 -15.982 6.988 294 HD3 PRO 43 1HD PRO 43 -7.456 -14.410 6.750 295 H ALA 44 H ALA 44 -2.790 -14.270 3.689 296 HA ALA 44 HA ALA 44 -1.971 -17.036 4.093 297 HB1 ALA 44 1HB ALA 44 -2.833 -16.930 1.798 298 HB2 ALA 44 2HB ALA 44 -1.086 -17.170 1.803 299 HB3 ALA 44 3HB ALA 44 -1.757 -15.576 1.453 300 H GLY 45 H GLY 45 0.516 -16.880 2.857 301 HA2 GLY 45 2HA GLY 45 1.949 -15.159 4.692 302 HA3 GLY 45 1HA GLY 45 2.641 -16.321 3.563 303 H SER 46 H SER 46 0.737 -14.934 1.591 304 HA SER 46 HA SER 46 2.530 -12.715 0.939 305 HB2 SER 46 2HB SER 46 0.687 -14.204 -0.913 306 HB3 SER 46 1HB SER 46 1.925 -13.047 -1.353 307 HG SER 46 HG SER 46 3.428 -14.477 -1.142 308 H ALA 47 H ALA 47 1.510 -10.854 0.080 309 HA ALA 47 HA ALA 47 -1.321 -10.528 0.376 310 HB1 ALA 47 1HB ALA 47 -0.535 -10.208 2.661 311 HB2 ALA 47 2HB ALA 47 -1.086 -8.683 1.964 312 HB3 ALA 47 3HB ALA 47 0.640 -9.023 2.095 313 H LEU 48 H LEU 48 -2.013 -8.678 -0.706 314 HA LEU 48 HA LEU 48 0.063 -7.189 -2.093 315 HB2 LEU 48 2HB LEU 48 -1.060 -7.284 -4.213 316 HB3 LEU 48 1HB LEU 48 -0.787 -8.917 -3.668 317 HG LEU 48 HG LEU 48 -3.458 -7.493 -3.505 318 HD11 LEU 48 1HD1 LEU 48 -4.095 -8.855 -5.430 319 HD12 LEU 48 2HD1 LEU 48 -2.445 -9.471 -5.539 320 HD13 LEU 48 3HD1 LEU 48 -2.770 -7.759 -5.818 321 HD21 LEU 48 3HD2 LEU 48 -2.733 -10.415 -3.217 322 HD22 LEU 48 1HD2 LEU 48 -4.369 -9.750 -3.203 323 HD23 LEU 48 2HD2 LEU 48 -3.243 -9.339 -1.911 324 H LEU 49 H LEU 49 -0.753 -5.169 -2.984 325 HA LEU 49 HA LEU 49 -3.127 -4.283 -1.607 326 HB2 LEU 49 2HB LEU 49 -1.978 -2.172 -0.966 327 HB3 LEU 49 1HB LEU 49 -1.453 -3.587 -0.088 328 HG LEU 49 HG LEU 49 0.536 -3.621 -1.725 329 HD11 LEU 49 1HD1 LEU 49 -0.354 -0.781 -2.146 330 HD12 LEU 49 2HD1 LEU 49 -0.299 -2.057 -3.359 331 HD13 LEU 49 3HD1 LEU 49 1.197 -1.467 -2.637 332 HD21 LEU 49 3HD2 LEU 49 0.240 -1.458 0.355 333 HD22 LEU 49 1HD2 LEU 49 1.769 -1.994 -0.345 334 HD23 LEU 49 2HD2 LEU 49 0.785 -3.111 0.602 335 H VAL 50 H VAL 50 -4.187 -2.593 -2.509 336 HA VAL 50 HA VAL 50 -3.380 -2.025 -5.268 337 HB VAL 50 HB VAL 50 -5.760 -1.856 -5.897 338 HG11 VAL 50 1HG1 VAL 50 -5.207 -4.453 -4.477 339 HG12 VAL 50 2HG1 VAL 50 -4.707 -4.050 -6.110 340 HG13 VAL 50 3HG1 VAL 50 -6.423 -4.205 -5.727 341 HG21 VAL 50 3HG2 VAL 50 -7.561 -2.537 -4.383 342 HG22 VAL 50 1HG2 VAL 50 -6.695 -1.136 -3.745 343 HG23 VAL 50 2HG2 VAL 50 -6.382 -2.744 -3.087 344 H VAL 51 H VAL 51 -3.104 0.059 -5.750 345 HA VAL 51 HA VAL 51 -3.935 2.011 -3.735 346 HB VAL 51 HB VAL 51 -2.075 2.460 -6.107 347 HG11 VAL 51 1HG1 VAL 51 -3.162 4.504 -5.312 348 HG12 VAL 51 2HG1 VAL 51 -1.444 4.516 -4.915 349 HG13 VAL 51 3HG1 VAL 51 -2.635 4.155 -3.665 350 HG21 VAL 51 3HG2 VAL 51 -1.082 0.865 -4.537 351 HG22 VAL 51 1HG2 VAL 51 -1.404 1.971 -3.203 352 HG23 VAL 51 2HG2 VAL 51 -0.243 2.414 -4.450 353 H LYS 52 H LYS 52 -5.681 3.129 -4.046 354 HA LYS 52 HA LYS 52 -6.895 3.027 -6.724 355 HB2 LYS 52 2HB LYS 52 -8.136 3.111 -3.999 356 HB3 LYS 52 1HB LYS 52 -9.029 3.220 -5.514 357 HG2 LYS 52 2HG LYS 52 -8.302 0.994 -6.139 358 HG3 LYS 52 1HG LYS 52 -7.252 0.911 -4.729 359 HD2 LYS 52 2HD LYS 52 -9.276 -0.372 -4.355 360 HD3 LYS 52 1HD LYS 52 -9.223 1.013 -3.272 361 HE2 LYS 52 2HE LYS 52 -10.732 2.231 -4.739 362 HE3 LYS 52 1HE LYS 52 -10.778 0.864 -5.853 363 HZ1 LYS 52 3HZ LYS 52 -11.797 -0.467 -4.110 364 HZ2 LYS 52 1HZ LYS 52 -12.697 0.919 -4.417 365 HZ3 LYS 52 2HZ LYS 52 -11.735 0.827 -3.037 366 H ARG 53 H ARG 53 -5.693 5.100 -4.389 367 HA ARG 53 HA ARG 53 -6.426 7.399 -6.018 368 HB2 ARG 53 2HB ARG 53 -8.207 7.339 -4.310 369 HB3 ARG 53 1HB ARG 53 -6.996 7.281 -3.038 370 HG2 ARG 53 2HG ARG 53 -7.819 9.516 -3.136 371 HG3 ARG 53 1HG ARG 53 -6.196 9.524 -3.819 372 HD2 ARG 53 2HD ARG 53 -7.615 10.898 -5.197 373 HD3 ARG 53 1HD ARG 53 -7.223 9.433 -6.095 374 HE ARG 53 HE ARG 53 -9.570 8.842 -4.863 375 HH11 ARG 53 1HH1 ARG 53 -8.587 11.442 -7.111 376 HH12 ARG 53 2HH1 ARG 53 -10.143 11.688 -7.707 377 HH21 ARG 53 1HH2 ARG 53 -11.689 9.218 -5.677 378 HH22 ARG 53 2HH2 ARG 53 -11.968 10.411 -6.867 379 H GLY 54 H GLY 54 -4.583 8.526 -6.324 380 HA2 GLY 54 2HA GLY 54 -3.001 9.806 -4.729 381 HA3 GLY 54 1HA GLY 54 -2.440 8.183 -4.387 382 HA PRO 55 HA PRO 55 -0.632 9.835 -8.601 383 HB2 PRO 55 2HB PRO 55 1.193 11.563 -7.036 384 HB3 PRO 55 1HB PRO 55 0.389 11.887 -8.577 385 HG2 PRO 55 2HG PRO 55 -0.428 13.085 -6.359 386 HG3 PRO 55 1HG PRO 55 -1.604 12.492 -7.546 387 HD2 PRO 55 2HD PRO 55 -0.735 11.243 -4.958 388 HD3 PRO 55 1HD PRO 55 -2.374 11.452 -5.624 389 H ASN 56 H ASN 56 0.323 8.672 -5.601 390 HA ASN 56 HA ASN 56 3.080 8.098 -6.050 391 HB2 ASN 56 2HB ASN 56 2.915 6.592 -4.105 392 HB3 ASN 56 1HB ASN 56 2.174 8.152 -3.783 393 HD21 ASN 56 1HD2 ASN 56 1.791 5.551 -2.488 394 HD22 ASN 56 2HD2 ASN 56 0.091 5.237 -2.603 395 H ALA 57 H ALA 57 0.074 6.283 -6.618 396 HA ALA 57 HA ALA 57 1.223 4.774 -8.699 397 HB1 ALA 57 1HB ALA 57 1.019 2.543 -7.682 398 HB2 ALA 57 2HB ALA 57 0.612 3.285 -6.136 399 HB3 ALA 57 3HB ALA 57 2.216 3.517 -6.825 400 H GLY 58 H GLY 58 -0.443 3.022 -9.322 401 HA2 GLY 58 2HA GLY 58 -3.134 3.440 -8.394 402 HA3 GLY 58 1HA GLY 58 -2.826 4.057 -10.020 403 H ALA 59 H ALA 59 -1.576 1.263 -8.315 404 HA ALA 59 HA ALA 59 -2.772 -0.529 -10.243 405 HB1 ALA 59 1HB ALA 59 -0.571 -1.502 -10.813 406 HB2 ALA 59 2HB ALA 59 0.214 -0.209 -9.909 407 HB3 ALA 59 3HB ALA 59 -0.717 0.170 -11.358 408 H ARG 60 H ARG 60 -1.506 -2.798 -9.613 409 HA ARG 60 HA ARG 60 -1.623 -2.936 -6.699 410 HB2 ARG 60 2HB ARG 60 -2.602 -5.203 -6.931 411 HB3 ARG 60 1HB ARG 60 -3.605 -3.929 -7.610 412 HG2 ARG 60 2HG ARG 60 -3.082 -4.544 -9.827 413 HG3 ARG 60 1HG ARG 60 -1.826 -5.664 -9.293 414 HD2 ARG 60 2HD ARG 60 -3.454 -7.118 -8.315 415 HD3 ARG 60 1HD ARG 60 -4.731 -5.935 -8.560 416 HE ARG 60 HE ARG 60 -4.491 -6.294 -10.940 417 HH11 ARG 60 1HH1 ARG 60 -2.931 -8.777 -8.945 418 HH12 ARG 60 2HH1 ARG 60 -3.290 -10.066 -9.986 419 HH21 ARG 60 1HH2 ARG 60 -5.015 -8.064 -12.378 420 HH22 ARG 60 2HH2 ARG 60 -4.495 -9.642 -12.013 421 H PHE 61 H PHE 61 -0.087 -4.130 -5.712 422 HA PHE 61 HA PHE 61 1.540 -5.889 -7.251 423 HB2 PHE 61 2HB PHE 61 3.712 -4.901 -6.529 424 HB3 PHE 61 1HB PHE 61 2.822 -3.840 -7.598 425 HD1 PHE 61 1HD PHE 61 4.085 -4.351 -4.201 426 HD2 PHE 61 2HD PHE 61 1.981 -1.707 -6.799 427 HE1 PHE 61 1HE PHE 61 4.410 -2.515 -2.595 428 HE2 PHE 61 2HE PHE 61 2.300 0.128 -5.191 429 HZ PHE 61 HZ PHE 61 3.518 -0.277 -3.089 430 H LEU 62 H LEU 62 2.805 -7.271 -5.938 431 HA LEU 62 HA LEU 62 1.480 -7.626 -3.385 432 HB2 LEU 62 2HB LEU 62 1.298 -9.408 -5.122 433 HB3 LEU 62 1HB LEU 62 3.026 -9.627 -5.038 434 HG LEU 62 HG LEU 62 1.355 -10.036 -2.567 435 HD11 LEU 62 1HD1 LEU 62 0.259 -11.322 -4.312 436 HD12 LEU 62 2HD1 LEU 62 1.123 -12.400 -3.218 437 HD13 LEU 62 3HD1 LEU 62 1.809 -12.002 -4.793 438 HD21 LEU 62 3HD2 LEU 62 3.829 -10.048 -2.435 439 HD22 LEU 62 1HD2 LEU 62 3.864 -11.375 -3.588 440 HD23 LEU 62 2HD2 LEU 62 3.127 -11.603 -2.001 441 H LEU 63 H LEU 63 2.605 -7.930 -1.512 442 HA LEU 63 HA LEU 63 5.131 -6.538 -1.464 443 HB2 LEU 63 2HB LEU 63 3.547 -7.760 0.787 444 HB3 LEU 63 1HB LEU 63 4.917 -6.687 0.957 445 HG LEU 63 HG LEU 63 2.231 -5.935 -0.207 446 HD11 LEU 63 1HD1 LEU 63 1.980 -4.603 1.819 447 HD12 LEU 63 2HD1 LEU 63 3.517 -5.216 2.423 448 HD13 LEU 63 3HD1 LEU 63 2.158 -6.317 2.200 449 HD21 LEU 63 3HD2 LEU 63 4.034 -4.654 -1.230 450 HD22 LEU 63 1HD2 LEU 63 4.672 -4.253 0.366 451 HD23 LEU 63 2HD2 LEU 63 3.097 -3.641 -0.134 452 H ASP 64 H ASP 64 6.873 -7.609 -1.889 453 HA ASP 64 HA ASP 64 7.348 -10.206 -0.565 454 HB2 ASP 64 2HB ASP 64 8.454 -9.221 -3.209 455 HB3 ASP 64 1HB ASP 64 9.072 -10.625 -2.357 456 H GLN 65 H GLN 65 8.607 -7.136 -1.615 457 HA GLN 65 HA GLN 65 11.066 -7.302 -0.342 458 HB2 GLN 65 2HB GLN 65 11.186 -4.854 -0.612 459 HB3 GLN 65 1HB GLN 65 10.661 -5.637 -2.085 460 HG2 GLN 65 2HG GLN 65 8.874 -4.154 -0.145 461 HG3 GLN 65 1HG GLN 65 9.499 -3.505 -1.653 462 HE21 GLN 65 1HE2 GLN 65 6.769 -3.795 -0.792 463 HE22 GLN 65 2HE2 GLN 65 5.980 -4.770 -1.977 464 HA PRO 66 HA PRO 66 9.935 -7.424 3.867 465 HB2 PRO 66 2HB PRO 66 12.241 -6.377 4.948 466 HB3 PRO 66 1HB PRO 66 12.050 -8.050 4.419 467 HG2 PRO 66 2HG PRO 66 13.275 -5.736 2.983 468 HG3 PRO 66 1HG PRO 66 13.821 -7.428 3.064 469 HD2 PRO 66 2HD PRO 66 12.569 -6.444 0.917 470 HD3 PRO 66 1HD PRO 66 12.293 -8.109 1.467 471 H THR 67 H THR 67 11.175 -4.427 2.599 472 HA THR 67 HA THR 67 9.368 -3.014 4.370 473 HB THR 67 HB THR 67 12.265 -2.275 3.859 474 HG1 THR 67 1HG THR 67 11.151 -3.781 5.662 475 HG21 THR 67 3HG2 THR 67 10.136 -0.779 5.404 476 HG22 THR 67 1HG2 THR 67 10.810 -0.284 3.853 477 HG23 THR 67 2HG2 THR 67 11.839 -0.326 5.283 478 H THR 68 H THR 68 7.990 -2.017 3.123 479 HA THR 68 HA THR 68 8.839 -1.093 0.469 480 HB THR 68 HB THR 68 6.034 -1.167 1.607 481 HG1 THR 68 1HG THR 68 7.444 -3.231 1.342 482 HG21 THR 68 3HG2 THR 68 7.075 -1.171 -1.235 483 HG22 THR 68 1HG2 THR 68 6.364 0.213 -0.403 484 HG23 THR 68 2HG2 THR 68 5.377 -1.208 -0.759 485 H THR 69 H THR 69 9.467 1.010 0.447 486 HA THR 69 HA THR 69 8.648 2.656 2.667 487 HB THR 69 HB THR 69 10.488 4.165 1.821 488 HG1 THR 69 1HG THR 69 11.769 2.149 0.503 489 HG21 THR 69 3HG2 THR 69 11.251 1.341 2.577 490 HG22 THR 69 1HG2 THR 69 10.821 2.621 3.713 491 HG23 THR 69 2HG2 THR 69 12.284 2.762 2.736 492 H ALA 70 H ALA 70 6.821 3.764 2.312 493 HA ALA 70 HA ALA 70 6.506 5.039 -0.277 494 HB1 ALA 70 1HB ALA 70 4.167 5.464 0.500 495 HB2 ALA 70 2HB ALA 70 4.537 4.578 1.980 496 HB3 ALA 70 3HB ALA 70 4.577 3.753 0.421 497 H GLY 71 H GLY 71 7.893 6.679 -0.064 498 HA2 GLY 71 2HA GLY 71 8.036 9.012 0.420 499 HA3 GLY 71 1HA GLY 71 7.156 8.709 1.919 500 H ARG 72 H ARG 72 10.145 8.919 0.424 501 HA ARG 72 HA ARG 72 11.611 8.769 2.923 502 HB2 ARG 72 2HB ARG 72 11.991 6.807 0.668 503 HB3 ARG 72 1HB ARG 72 13.364 7.303 1.626 504 HG2 ARG 72 2HG ARG 72 10.895 6.047 2.799 505 HG3 ARG 72 1HG ARG 72 12.309 5.131 2.265 506 HD2 ARG 72 2HD ARG 72 13.677 6.550 3.794 507 HD3 ARG 72 1HD ARG 72 12.173 7.204 4.443 508 HE ARG 72 HE ARG 72 11.626 5.013 5.247 509 HH11 ARG 72 1HH1 ARG 72 14.996 5.406 4.220 510 HH12 ARG 72 2HH1 ARG 72 15.564 4.088 5.146 511 HH21 ARG 72 1HH2 ARG 72 12.403 3.176 6.403 512 HH22 ARG 72 2HH2 ARG 72 14.073 2.791 6.419 513 H HIS 73 H HIS 73 12.066 8.634 -0.545 514 HA HIS 73 HA HIS 73 13.392 11.225 -0.586 515 HB2 HIS 73 2HB HIS 73 14.643 8.597 -1.493 516 HB3 HIS 73 1HB HIS 73 15.264 10.142 -2.024 517 HD1 HIS 73 1HD HIS 73 16.323 11.670 -0.003 518 HD2 HIS 73 2HD HIS 73 15.583 7.666 0.842 519 HE1 HIS 73 1HE HIS 73 17.655 11.131 2.057 520 HA PRO 74 HA PRO 74 11.496 11.326 -4.764 521 HB2 PRO 74 2HB PRO 74 13.798 11.314 -6.401 522 HB3 PRO 74 1HB PRO 74 12.930 12.752 -5.856 523 HG2 PRO 74 2HG PRO 74 15.386 11.490 -4.736 524 HG3 PRO 74 1HG PRO 74 14.953 13.210 -4.840 525 HD2 PRO 74 2HD PRO 74 14.824 11.940 -2.522 526 HD3 PRO 74 1HD PRO 74 13.553 13.080 -2.989 527 H GLU 75 H GLU 75 14.178 9.217 -4.124 528 HA GLU 75 HA GLU 75 13.106 7.163 -5.891 529 HB2 GLU 75 2HB GLU 75 15.854 7.501 -4.696 530 HB3 GLU 75 1HB GLU 75 15.343 6.106 -5.629 531 HG2 GLU 75 2HG GLU 75 15.347 8.914 -6.684 532 HG3 GLU 75 1HG GLU 75 16.694 7.797 -6.873 533 H SER 76 H SER 76 11.530 6.997 -4.100 534 HA SER 76 HA SER 76 12.478 5.418 -1.817 535 HB2 SER 76 2HB SER 76 9.637 6.189 -2.595 536 HB3 SER 76 1HB SER 76 10.127 5.457 -1.066 537 HG SER 76 HG SER 76 10.776 8.019 -2.072 538 H ASP 77 H ASP 77 10.692 3.360 -1.501 539 HA ASP 77 HA ASP 77 11.360 1.521 -3.532 540 HB2 ASP 77 2HB ASP 77 10.648 0.868 -1.224 541 HB3 ASP 77 1HB ASP 77 9.008 1.376 -1.618 542 H ILE 78 H ILE 78 8.440 3.333 -2.871 543 HA ILE 78 HA ILE 78 7.815 3.319 -5.723 544 HB ILE 78 HB ILE 78 5.395 3.557 -5.120 545 HG12 ILE 78 2HG1 ILE 78 6.240 2.746 -2.315 546 HG13 ILE 78 1HG1 ILE 78 5.747 4.366 -2.783 547 HG21 ILE 78 1HG2 ILE 78 6.193 1.392 -5.815 548 HG22 ILE 78 2HG2 ILE 78 4.949 1.202 -4.581 549 HG23 ILE 78 3HG2 ILE 78 6.652 0.999 -4.158 550 HD11 ILE 78 3HD1 ILE 78 4.017 1.898 -2.872 551 HD12 ILE 78 1HD1 ILE 78 3.521 3.527 -3.327 552 HD13 ILE 78 2HD1 ILE 78 3.951 3.176 -1.655 553 H PHE 79 H PHE 79 7.143 5.452 -6.444 554 HA PHE 79 HA PHE 79 8.013 7.363 -4.453 555 HB2 PHE 79 2HB PHE 79 8.595 8.935 -6.198 556 HB3 PHE 79 1HB PHE 79 9.377 7.399 -6.489 557 HD1 PHE 79 1HD PHE 79 8.625 5.982 -8.383 558 HD2 PHE 79 2HD PHE 79 7.055 9.877 -7.725 559 HE1 PHE 79 1HE PHE 79 7.802 6.045 -10.700 560 HE2 PHE 79 2HE PHE 79 6.222 9.944 -10.034 561 HZ PHE 79 HZ PHE 79 6.599 8.023 -11.526 562 H LEU 80 H LEU 80 6.795 8.704 -3.604 563 HA LEU 80 HA LEU 80 4.054 8.998 -4.432 564 HB2 LEU 80 2HB LEU 80 5.623 10.065 -2.062 565 HB3 LEU 80 1HB LEU 80 3.971 10.531 -2.380 566 HG LEU 80 HG LEU 80 3.227 8.205 -2.014 567 HD11 LEU 80 1HD1 LEU 80 5.219 7.030 -2.759 568 HD12 LEU 80 2HD1 LEU 80 4.706 6.505 -1.159 569 HD13 LEU 80 3HD1 LEU 80 6.086 7.587 -1.329 570 HD21 LEU 80 3HD2 LEU 80 3.648 8.075 0.385 571 HD22 LEU 80 1HD2 LEU 80 3.286 9.727 -0.116 572 HD23 LEU 80 2HD2 LEU 80 4.951 9.255 0.223 573 H ASP 81 H ASP 81 4.224 9.993 -6.290 574 HA ASP 81 HA ASP 81 5.980 11.842 -7.201 575 HB2 ASP 81 2HB ASP 81 4.388 10.732 -8.645 576 HB3 ASP 81 1HB ASP 81 3.070 11.668 -7.955 577 H ASP 82 H ASP 82 2.809 12.818 -5.872 578 HA ASP 82 HA ASP 82 3.975 15.100 -4.614 579 HB2 ASP 82 2HB ASP 82 3.607 15.598 -7.176 580 HB3 ASP 82 1HB ASP 82 1.922 15.800 -6.706 581 H VAL 83 H VAL 83 1.668 16.557 -4.290 582 HA VAL 83 HA VAL 83 -0.283 16.729 -3.236 583 HB VAL 83 HB VAL 83 -0.724 13.841 -4.053 584 HG11 VAL 83 1HG1 VAL 83 -3.082 14.149 -3.464 585 HG12 VAL 83 2HG1 VAL 83 -2.714 15.755 -2.829 586 HG13 VAL 83 3HG1 VAL 83 -2.049 14.323 -2.045 587 HG21 VAL 83 3HG2 VAL 83 -2.271 14.815 -5.686 588 HG22 VAL 83 1HG2 VAL 83 -0.629 15.422 -5.900 589 HG23 VAL 83 2HG2 VAL 83 -1.849 16.431 -5.118 590 H THR 84 H THR 84 1.504 13.871 -2.335 591 HA THR 84 HA THR 84 1.423 14.737 0.421 592 HB THR 84 HB THR 84 0.261 11.999 -0.278 593 HG1 THR 84 1HG THR 84 -0.855 14.409 -0.048 594 HG21 THR 84 3HG2 THR 84 -0.212 11.781 2.111 595 HG22 THR 84 1HG2 THR 84 0.533 13.355 2.411 596 HG23 THR 84 2HG2 THR 84 1.516 12.008 1.841 597 H VAL 85 H VAL 85 3.687 14.926 -0.418 598 HA VAL 85 HA VAL 85 4.997 12.365 0.007 599 HB VAL 85 HB VAL 85 5.434 13.082 -2.285 600 HG11 VAL 85 1HG1 VAL 85 6.694 15.539 -1.117 601 HG12 VAL 85 2HG1 VAL 85 5.229 15.469 -2.107 602 HG13 VAL 85 3HG1 VAL 85 6.797 15.038 -2.803 603 HG21 VAL 85 3HG2 VAL 85 7.164 11.791 -1.215 604 HG22 VAL 85 1HG2 VAL 85 7.879 13.254 -0.535 605 HG23 VAL 85 2HG2 VAL 85 7.905 12.991 -2.279 606 H SER 86 H SER 86 5.695 12.209 1.995 607 HA SER 86 HA SER 86 6.955 14.526 3.249 608 HB2 SER 86 2HB SER 86 5.248 13.256 4.544 609 HB3 SER 86 1HB SER 86 6.224 11.804 4.397 610 HG SER 86 HG SER 86 7.008 12.430 6.182 611 H ARG 87 H ARG 87 9.053 13.895 4.584 612 HA ARG 87 HA ARG 87 10.957 12.793 2.686 613 HB2 ARG 87 2HB ARG 87 11.486 14.806 4.072 614 HB3 ARG 87 1HB ARG 87 11.402 13.818 5.517 615 HG2 ARG 87 2HG ARG 87 13.349 12.551 4.800 616 HG3 ARG 87 1HG ARG 87 13.395 13.446 3.280 617 HD2 ARG 87 2HD ARG 87 13.838 15.511 4.480 618 HD3 ARG 87 1HD ARG 87 13.723 14.669 6.025 619 HE ARG 87 HE ARG 87 15.664 13.300 4.816 620 HH11 ARG 87 1HH1 ARG 87 15.250 16.800 5.153 621 HH12 ARG 87 2HH1 ARG 87 16.928 17.118 5.135 622 HH21 ARG 87 1HH2 ARG 87 17.909 13.750 4.829 623 HH22 ARG 87 2HH2 ARG 87 18.485 15.349 4.940 624 H ARG 88 H ARG 88 9.024 11.617 5.005 625 HA ARG 88 HA ARG 88 9.621 9.005 4.504 626 HB2 ARG 88 2HB ARG 88 10.224 8.177 6.765 627 HB3 ARG 88 1HB ARG 88 11.475 9.225 6.151 628 HG2 ARG 88 2HG ARG 88 9.465 9.858 8.329 629 HG3 ARG 88 1HG ARG 88 11.181 9.525 8.535 630 HD2 ARG 88 2HD ARG 88 11.454 11.582 6.942 631 HD3 ARG 88 1HD ARG 88 9.819 11.955 7.470 632 HE ARG 88 HE ARG 88 12.254 12.092 8.956 633 HH11 ARG 88 1HH1 ARG 88 8.736 11.770 9.434 634 HH12 ARG 88 2HH1 ARG 88 8.687 12.762 10.804 635 HH21 ARG 88 1HH2 ARG 88 12.181 13.406 10.870 636 HH22 ARG 88 2HH2 ARG 88 10.702 13.729 11.647 637 H HIS 89 H HIS 89 7.702 8.008 4.658 638 HA HIS 89 HA HIS 89 5.713 9.573 6.137 639 HB2 HIS 89 2HB HIS 89 5.730 10.055 3.631 640 HB3 HIS 89 1HB HIS 89 5.137 8.425 3.419 641 HD2 HIS 89 2HD HIS 89 2.513 7.952 4.383 642 HE1 HIS 89 1HE HIS 89 1.662 12.088 4.676 643 HE2 HIS 89 2HE HIS 89 0.768 9.718 5.052 644 H ALA 90 H ALA 90 5.429 6.632 4.134 645 HA ALA 90 HA ALA 90 4.387 5.326 6.531 646 HB1 ALA 90 1HB ALA 90 3.230 5.186 3.749 647 HB2 ALA 90 2HB ALA 90 2.496 5.978 5.146 648 HB3 ALA 90 3HB ALA 90 2.703 4.230 5.130 649 H GLU 91 H GLU 91 5.536 3.633 6.953 650 HA GLU 91 HA GLU 91 6.802 2.338 4.682 651 HB2 GLU 91 2HB GLU 91 7.800 2.619 7.496 652 HB3 GLU 91 1HB GLU 91 8.521 1.541 6.307 653 HG2 GLU 91 2HG GLU 91 8.929 3.475 4.839 654 HG3 GLU 91 1HG GLU 91 8.279 4.531 6.090 655 H PHE 92 H PHE 92 6.364 0.388 4.292 656 HA PHE 92 HA PHE 92 4.510 -0.997 6.066 657 HB2 PHE 92 2HB PHE 92 5.338 -1.715 3.249 658 HB3 PHE 92 1HB PHE 92 4.010 -2.397 4.153 659 HD1 PHE 92 1HD PHE 92 5.136 0.559 2.271 660 HD2 PHE 92 2HD PHE 92 1.910 -1.228 4.381 661 HE1 PHE 92 1HE PHE 92 3.599 2.226 1.332 662 HE2 PHE 92 2HE PHE 92 0.370 0.441 3.452 663 HZ PHE 92 HZ PHE 92 1.218 2.176 1.922 664 H ARG 93 H ARG 93 5.285 -2.534 7.329 665 HA ARG 93 HA ARG 93 7.920 -3.675 6.753 666 HB2 ARG 93 2HB ARG 93 6.293 -3.581 9.298 667 HB3 ARG 93 1HB ARG 93 7.825 -4.406 9.114 668 HG2 ARG 93 2HG ARG 93 7.361 -1.442 8.926 669 HG3 ARG 93 1HG ARG 93 8.086 -2.309 10.281 670 HD2 ARG 93 2HD ARG 93 9.785 -3.153 8.534 671 HD3 ARG 93 1HD ARG 93 9.192 -1.818 7.543 672 HE ARG 93 HE ARG 93 10.422 -1.568 10.188 673 HH11 ARG 93 1HH1 ARG 93 9.615 -0.095 7.111 674 HH12 ARG 93 2HH1 ARG 93 10.625 1.259 7.303 675 HH21 ARG 93 1HH2 ARG 93 11.829 0.222 10.476 676 HH22 ARG 93 2HH2 ARG 93 11.948 1.438 9.286 677 H ILE 94 H ILE 94 7.922 -5.777 6.120 678 HA ILE 94 HA ILE 94 5.561 -7.238 6.942 679 HB ILE 94 HB ILE 94 5.646 -8.711 5.056 680 HG12 ILE 94 2HG1 ILE 94 7.977 -7.258 3.875 681 HG13 ILE 94 1HG1 ILE 94 8.240 -8.636 4.954 682 HG21 ILE 94 1HG2 ILE 94 4.563 -6.550 4.644 683 HG22 ILE 94 2HG2 ILE 94 5.269 -7.217 3.174 684 HG23 ILE 94 3HG2 ILE 94 6.086 -5.909 4.026 685 HD11 ILE 94 3HD1 ILE 94 8.284 -9.350 2.643 686 HD12 ILE 94 1HD1 ILE 94 6.670 -8.650 2.390 687 HD13 ILE 94 2HD1 ILE 94 6.886 -9.998 3.513 688 H ASN 95 H ASN 95 5.799 -8.978 7.996 689 HA ASN 95 HA ASN 95 8.506 -9.749 8.826 690 HB2 ASN 95 2HB ASN 95 7.171 -8.396 10.491 691 HB3 ASN 95 1HB ASN 95 5.940 -9.639 10.441 692 HD21 ASN 95 1HD2 ASN 95 7.184 -8.728 12.708 693 HD22 ASN 95 2HD2 ASN 95 8.120 -9.991 13.421 694 H GLU 96 H GLU 96 8.764 -12.004 8.924 695 HA GLU 96 HA GLU 96 7.031 -13.715 7.541 696 HB2 GLU 96 2HB GLU 96 8.303 -15.579 8.596 697 HB3 GLU 96 1HB GLU 96 9.348 -14.346 7.911 698 HG2 GLU 96 2HG GLU 96 9.805 -13.443 10.098 699 HG3 GLU 96 1HG GLU 96 8.633 -14.540 10.827 700 H GLY 97 H GLY 97 6.905 -12.521 10.733 701 HA2 GLY 97 2HA GLY 97 5.037 -14.418 11.761 702 HA3 GLY 97 1HA GLY 97 5.453 -12.850 12.459 703 H GLU 98 H GLU 98 4.641 -10.919 10.834 704 HA GLU 98 HA GLU 98 2.110 -11.463 9.667 705 HB2 GLU 98 2HB GLU 98 1.622 -11.522 12.146 706 HB3 GLU 98 1HB GLU 98 2.181 -9.869 12.260 707 HG2 GLU 98 2HG GLU 98 0.306 -9.042 11.123 708 HG3 GLU 98 1HG GLU 98 -0.117 -10.633 10.480 709 H PHE 99 H PHE 99 1.065 -8.970 9.421 710 HA PHE 99 HA PHE 99 3.248 -7.511 8.102 711 HB2 PHE 99 2HB PHE 99 0.310 -7.755 7.445 712 HB3 PHE 99 1HB PHE 99 1.404 -6.657 6.609 713 HD1 PHE 99 2HD PHE 99 0.587 -10.216 7.244 714 HD2 PHE 99 1HD PHE 99 2.813 -7.465 4.890 715 HE1 PHE 99 2HE PHE 99 1.146 -12.022 5.668 716 HE2 PHE 99 1HE PHE 99 3.375 -9.268 3.309 717 HZ PHE 99 HZ PHE 99 2.540 -11.547 3.700 718 H GLU 100 H GLU 100 3.614 -5.380 8.680 719 HA GLU 100 HA GLU 100 1.649 -4.066 10.428 720 HB2 GLU 100 2HB GLU 100 3.413 -5.124 11.795 721 HB3 GLU 100 1HB GLU 100 4.627 -4.220 10.910 722 HG2 GLU 100 2HG GLU 100 3.675 -2.125 11.764 723 HG3 GLU 100 1HG GLU 100 2.482 -3.054 12.673 724 H VAL 101 H VAL 101 1.384 -1.887 10.005 725 HA VAL 101 HA VAL 101 3.324 -0.685 8.165 726 HB VAL 101 HB VAL 101 1.151 -0.912 7.031 727 HG11 VAL 101 1HG1 VAL 101 0.019 0.826 9.205 728 HG12 VAL 101 2HG1 VAL 101 -0.350 -0.875 8.917 729 HG13 VAL 101 3HG1 VAL 101 -0.822 0.343 7.734 730 HG21 VAL 101 3HG2 VAL 101 2.537 0.974 6.401 731 HG22 VAL 101 1HG2 VAL 101 1.815 1.960 7.671 732 HG23 VAL 101 2HG2 VAL 101 0.834 1.422 6.308 733 H VAL 102 H VAL 102 4.338 1.128 8.760 734 HA VAL 102 HA VAL 102 3.471 2.335 11.293 735 HB VAL 102 HB VAL 102 6.324 1.984 10.319 736 HG11 VAL 102 1HG1 VAL 102 5.292 3.126 12.914 737 HG12 VAL 102 2HG1 VAL 102 6.063 4.032 11.612 738 HG13 VAL 102 3HG1 VAL 102 6.987 2.836 12.525 739 HG21 VAL 102 3HG2 VAL 102 4.857 0.616 12.575 740 HG22 VAL 102 1HG2 VAL 102 6.576 0.445 12.219 741 HG23 VAL 102 2HG2 VAL 102 5.373 -0.130 11.064 742 H ASP 103 H ASP 103 3.053 4.421 11.240 743 HA ASP 103 HA ASP 103 3.669 6.054 8.941 744 HB2 ASP 103 2HB ASP 103 1.510 6.450 9.898 745 HB3 ASP 103 1HB ASP 103 2.178 6.569 11.521 746 H VAL 104 H VAL 104 5.495 6.976 8.765 747 HA VAL 104 HA VAL 104 6.852 7.981 11.165 748 HB VAL 104 HB VAL 104 9.012 7.818 9.848 749 HG11 VAL 104 1HG1 VAL 104 8.453 6.112 11.500 750 HG12 VAL 104 2HG1 VAL 104 9.304 5.401 10.131 751 HG13 VAL 104 3HG1 VAL 104 7.559 5.207 10.278 752 HG21 VAL 104 3HG2 VAL 104 8.054 7.748 7.599 753 HG22 VAL 104 1HG2 VAL 104 7.323 6.182 7.950 754 HG23 VAL 104 2HG2 VAL 104 9.078 6.338 7.888 755 H GLY 105 H GLY 105 4.907 8.851 8.941 756 HA2 GLY 105 2HA GLY 105 6.309 11.179 7.951 757 HA3 GLY 105 1HA GLY 105 4.683 10.653 7.520 758 H SER 106 H SER 106 3.177 10.564 9.447 759 HA SER 106 HA SER 106 1.861 11.744 10.822 760 HB2 SER 106 2HB SER 106 4.456 12.833 11.944 761 HB3 SER 106 1HB SER 106 2.913 12.699 12.790 762 HG SER 106 HG SER 106 3.335 10.284 11.970 763 H LEU 107 H LEU 107 3.483 13.243 8.472 764 HA LEU 107 HA LEU 107 3.213 16.016 9.018 765 HB2 LEU 107 2HB LEU 107 4.831 15.047 7.425 766 HB3 LEU 107 1HB LEU 107 3.510 14.544 6.398 767 HG LEU 107 HG LEU 107 2.913 16.937 6.087 768 HD11 LEU 107 1HD1 LEU 107 3.931 17.875 8.073 769 HD12 LEU 107 2HD1 LEU 107 4.605 18.630 6.628 770 HD13 LEU 107 3HD1 LEU 107 5.532 17.409 7.498 771 HD21 LEU 107 3HD2 LEU 107 4.754 17.409 4.522 772 HD22 LEU 107 1HD2 LEU 107 4.195 15.741 4.405 773 HD23 LEU 107 2HD2 LEU 107 5.691 16.110 5.258 774 H ASN 108 H ASN 108 1.499 13.784 6.930 775 HA ASN 108 HA ASN 108 -0.805 15.590 6.772 776 HB2 ASN 108 2HB ASN 108 -0.066 13.083 5.261 777 HB3 ASN 108 1HB ASN 108 -1.625 13.867 5.095 778 HD21 ASN 108 1HD2 ASN 108 -1.790 15.691 3.920 779 HD22 ASN 108 2HD2 ASN 108 -0.504 16.366 2.986 780 H GLY 109 H GLY 109 0.208 12.453 7.874 781 HA2 GLY 109 2HA GLY 109 -0.731 11.504 9.837 782 HA3 GLY 109 1HA GLY 109 -2.270 12.263 9.415 783 H THR 110 H THR 110 -1.132 9.389 9.753 784 HA THR 110 HA THR 110 -2.162 8.352 7.257 785 HB THR 110 HB THR 110 -0.530 7.080 9.468 786 HG1 THR 110 1HG THR 110 1.069 7.973 8.307 787 HG21 THR 110 3HG2 THR 110 -1.977 5.393 8.430 788 HG22 THR 110 1HG2 THR 110 -0.317 5.147 7.897 789 HG23 THR 110 2HG2 THR 110 -1.489 5.925 6.824 790 H TYR 111 H TYR 111 -4.180 7.624 7.231 791 HA TYR 111 HA TYR 111 -5.523 7.142 9.809 792 HB2 TYR 111 2HB TYR 111 -6.977 7.679 7.239 793 HB3 TYR 111 1HB TYR 111 -7.472 8.030 8.887 794 HD1 TYR 111 1HD TYR 111 -6.161 9.979 10.081 795 HD2 TYR 111 2HD TYR 111 -6.203 9.379 5.874 796 HE1 TYR 111 1HE TYR 111 -5.485 12.337 9.736 797 HE2 TYR 111 2HE TYR 111 -5.531 11.707 5.523 798 HH TYR 111 HH TYR 111 -4.280 13.663 7.889 799 H VAL 112 H VAL 112 -6.295 5.094 10.016 800 HA VAL 112 HA VAL 112 -6.541 3.592 7.567 801 HB VAL 112 HB VAL 112 -4.401 2.939 8.438 802 HG11 VAL 112 1HG1 VAL 112 -4.744 3.589 10.733 803 HG12 VAL 112 2HG1 VAL 112 -4.053 1.985 10.591 804 HG13 VAL 112 3HG1 VAL 112 -5.768 2.174 10.996 805 HG21 VAL 112 3HG2 VAL 112 -5.710 1.188 7.391 806 HG22 VAL 112 1HG2 VAL 112 -6.450 0.793 8.939 807 HG23 VAL 112 2HG2 VAL 112 -4.725 0.513 8.694 808 H ASN 113 H ASN 113 -8.219 2.385 7.358 809 HA ASN 113 HA ASN 113 -10.279 1.568 7.608 810 HB2 ASN 113 2HB ASN 113 -9.297 0.150 9.376 811 HB3 ASN 113 1HB ASN 113 -9.648 1.394 10.575 812 HD21 ASN 113 1HD2 ASN 113 -10.892 -1.060 8.571 813 HD22 ASN 113 2HD2 ASN 113 -12.481 -1.153 9.222 814 H ARG 114 H ARG 114 -9.997 3.340 10.595 815 HA ARG 114 HA ARG 114 -11.756 5.455 9.640 816 HB2 ARG 114 2HB ARG 114 -13.168 3.485 10.491 817 HB3 ARG 114 1HB ARG 114 -12.549 3.868 12.083 818 HG2 ARG 114 2HG ARG 114 -14.716 4.839 11.857 819 HG3 ARG 114 1HG ARG 114 -13.527 6.147 11.847 820 HD2 ARG 114 2HD ARG 114 -13.649 6.263 9.419 821 HD3 ARG 114 1HD ARG 114 -14.771 4.906 9.399 822 HE ARG 114 HE ARG 114 -15.369 7.499 10.648 823 HH11 ARG 114 1HH1 ARG 114 -16.331 4.765 8.604 824 HH12 ARG 114 2HH1 ARG 114 -17.922 5.308 8.388 825 HH21 ARG 114 1HH2 ARG 114 -17.539 8.230 10.346 826 HH22 ARG 114 2HH2 ARG 114 -18.646 7.319 9.392 827 H GLU 115 H GLU 115 -8.979 4.615 11.238 828 HA GLU 115 HA GLU 115 -9.264 6.789 13.154 829 HB2 GLU 115 2HB GLU 115 -8.047 4.109 13.754 830 HB3 GLU 115 1HB GLU 115 -7.950 5.519 14.792 831 HG2 GLU 115 2HG GLU 115 -10.431 5.488 14.951 832 HG3 GLU 115 1HG GLU 115 -10.411 3.971 14.050 833 HA PRO 116 HA PRO 116 -5.110 7.688 11.601 834 HB2 PRO 116 2HB PRO 116 -5.023 9.783 13.605 835 HB3 PRO 116 1HB PRO 116 -5.099 9.971 11.854 836 HG2 PRO 116 2HG PRO 116 -7.129 10.658 13.547 837 HG3 PRO 116 1HG PRO 116 -7.392 10.174 11.864 838 HD2 PRO 116 2HD PRO 116 -7.742 8.589 14.374 839 HD3 PRO 116 1HD PRO 116 -8.716 8.616 12.883 840 H ARG 117 H ARG 117 -3.567 6.349 12.359 841 HA ARG 117 HA ARG 117 -2.842 6.495 15.151 842 HB2 ARG 117 2HB ARG 117 -2.889 4.055 15.475 843 HB3 ARG 117 1HB ARG 117 -4.496 4.642 15.084 844 HG2 ARG 117 2HG ARG 117 -4.184 3.911 12.769 845 HG3 ARG 117 1HG ARG 117 -2.591 3.290 13.190 846 HD2 ARG 117 2HD ARG 117 -4.073 1.438 13.190 847 HD3 ARG 117 1HD ARG 117 -3.724 1.812 14.869 848 HE ARG 117 HE ARG 117 -5.935 2.945 14.914 849 HH11 ARG 117 1HH1 ARG 117 -5.340 0.455 12.470 850 HH12 ARG 117 2HH1 ARG 117 -6.931 -0.114 12.395 851 HH21 ARG 117 1HH2 ARG 117 -8.249 2.077 14.846 852 HH22 ARG 117 2HH2 ARG 117 -8.570 0.807 13.788 853 H ASN 118 H ASN 118 -0.700 5.698 15.493 854 HA ASN 118 HA ASN 118 0.939 6.352 13.249 855 HB2 ASN 118 2HB ASN 118 1.475 7.099 15.521 856 HB3 ASN 118 1HB ASN 118 1.758 5.428 16.001 857 HD21 ASN 118 1HD2 ASN 118 2.919 8.105 14.145 858 HD22 ASN 118 2HD2 ASN 118 4.508 7.492 13.893 859 H ALA 119 H ALA 119 0.360 3.374 15.059 860 HA ALA 119 HA ALA 119 1.703 1.975 12.857 861 HB1 ALA 119 1HB ALA 119 3.118 1.883 14.852 862 HB2 ALA 119 2HB ALA 119 2.487 0.290 14.440 863 HB3 ALA 119 3HB ALA 119 1.776 1.202 15.775 864 H GLN 120 H GLN 120 0.682 0.199 12.107 865 HA GLN 120 HA GLN 120 -1.735 -0.611 13.461 866 HB2 GLN 120 2HB GLN 120 -2.421 1.142 11.863 867 HB3 GLN 120 1HB GLN 120 -1.671 0.247 10.557 868 HG2 GLN 120 2HG GLN 120 -3.693 -1.217 12.118 869 HG3 GLN 120 1HG GLN 120 -4.291 0.109 11.137 870 HE21 GLN 120 1HE2 GLN 120 -5.430 -1.514 9.990 871 HE22 GLN 120 2HE2 GLN 120 -4.556 -2.466 8.847 872 H VAL 121 H VAL 121 -2.525 -2.674 12.821 873 HA VAL 121 HA VAL 121 -0.391 -4.387 11.785 874 HB VAL 121 HB VAL 121 -2.720 -5.108 13.613 875 HG11 VAL 121 1HG1 VAL 121 -0.416 -6.776 12.615 876 HG12 VAL 121 2HG1 VAL 121 -2.104 -6.935 12.125 877 HG13 VAL 121 3HG1 VAL 121 -1.629 -7.300 13.782 878 HG21 VAL 121 3HG2 VAL 121 -1.014 -5.497 15.338 879 HG22 VAL 121 1HG2 VAL 121 -1.007 -3.818 14.798 880 HG23 VAL 121 2HG2 VAL 121 0.235 -4.932 14.231 881 H MET 122 H MET 122 -0.809 -5.168 9.885 882 HA MET 122 HA MET 122 -2.953 -4.121 8.449 883 HB2 MET 122 2HB MET 122 -1.007 -6.254 7.682 884 HB3 MET 122 1HB MET 122 -2.151 -5.518 6.571 885 HG2 MET 122 2HG MET 122 -1.123 -3.344 6.941 886 HG3 MET 122 1HG MET 122 0.011 -4.071 8.082 887 HE1 MET 122 3HE MET 122 0.937 -2.346 5.640 888 HE2 MET 122 1HE MET 122 2.295 -3.294 5.031 889 HE3 MET 122 2HE MET 122 2.063 -3.104 6.772 890 H GLN 123 H GLN 123 -4.832 -4.724 7.946 891 HA GLN 123 HA GLN 123 -5.703 -7.408 8.636 892 HB2 GLN 123 2HB GLN 123 -6.782 -5.578 9.919 893 HB3 GLN 123 1HB GLN 123 -7.309 -4.853 8.408 894 HG2 GLN 123 2HG GLN 123 -8.640 -6.869 7.933 895 HG3 GLN 123 1HG GLN 123 -8.157 -7.533 9.491 896 HE21 GLN 123 1HE2 GLN 123 -10.129 -5.245 7.849 897 HE22 GLN 123 2HE2 GLN 123 -11.070 -4.763 9.205 898 H THR 124 H THR 124 -6.672 -8.536 6.979 899 HA THR 124 HA THR 124 -6.263 -7.434 4.382 900 HB THR 124 HB THR 124 -5.626 -9.652 4.476 901 HG1 THR 124 1HG THR 124 -8.029 -10.386 3.414 902 HG21 THR 124 3HG2 THR 124 -6.665 -10.378 6.516 903 HG22 THR 124 1HG2 THR 124 -7.066 -11.525 5.244 904 HG23 THR 124 2HG2 THR 124 -8.263 -10.340 5.772 905 H GLY 125 H GLY 125 -7.643 -6.586 3.067 906 HA2 GLY 125 2HA GLY 125 -9.671 -6.044 2.114 907 HA3 GLY 125 1HA GLY 125 -10.489 -6.970 3.376 908 H ASP 126 H ASP 126 -8.062 -4.446 3.787 909 HA ASP 126 HA ASP 126 -10.150 -2.869 5.092 910 HB2 ASP 126 2HB ASP 126 -8.709 -4.079 6.763 911 HB3 ASP 126 1HB ASP 126 -7.336 -3.144 6.182 912 H GLU 127 H GLU 127 -9.332 -0.560 5.532 913 HA GLU 127 HA GLU 127 -8.423 0.486 2.907 914 HB2 GLU 127 2HB GLU 127 -10.741 0.892 3.715 915 HB3 GLU 127 1HB GLU 127 -10.086 1.677 5.135 916 HG2 GLU 127 2HG GLU 127 -10.765 3.426 3.784 917 HG3 GLU 127 1HG GLU 127 -9.039 3.331 3.482 918 H ILE 128 H ILE 128 -6.358 1.364 3.008 919 HA ILE 128 HA ILE 128 -5.447 2.559 5.539 920 HB ILE 128 HB ILE 128 -3.764 1.402 3.279 921 HG12 ILE 128 2HG1 ILE 128 -4.255 0.303 6.068 922 HG13 ILE 128 1HG1 ILE 128 -4.908 -0.363 4.576 923 HG21 ILE 128 1HG2 ILE 128 -1.851 1.739 4.798 924 HG22 ILE 128 2HG2 ILE 128 -2.925 2.504 5.968 925 HG23 ILE 128 3HG2 ILE 128 -2.650 3.261 4.398 926 HD11 ILE 128 3HD1 ILE 128 -1.994 -0.217 5.326 927 HD12 ILE 128 1HD1 ILE 128 -2.640 -0.911 3.840 928 HD13 ILE 128 2HD1 ILE 128 -3.012 -1.658 5.394 929 H GLN 129 H GLN 129 -5.354 4.741 5.433 930 HA GLN 129 HA GLN 129 -5.197 5.935 2.760 931 HB2 GLN 129 2HB GLN 129 -6.506 7.101 5.217 932 HB3 GLN 129 1HB GLN 129 -6.632 7.679 3.562 933 HG2 GLN 129 2HG GLN 129 -7.886 5.677 2.936 934 HG3 GLN 129 1HG GLN 129 -7.707 5.048 4.567 935 HE21 GLN 129 1HE2 GLN 129 -10.113 5.558 3.111 936 HE22 GLN 129 2HE2 GLN 129 -11.018 6.727 4.010 937 H ILE 130 H ILE 130 -3.239 6.798 2.527 938 HA ILE 130 HA ILE 130 -1.971 7.930 4.892 939 HB ILE 130 HB ILE 130 0.198 7.886 3.617 940 HG12 ILE 130 2HG1 ILE 130 -1.367 6.226 1.599 941 HG13 ILE 130 1HG1 ILE 130 -0.681 7.830 1.340 942 HG21 ILE 130 1HG2 ILE 130 0.537 5.442 3.811 943 HG22 ILE 130 2HG2 ILE 130 -1.200 5.265 4.084 944 HG23 ILE 130 3HG2 ILE 130 -0.210 6.192 5.215 945 HD11 ILE 130 3HD1 ILE 130 0.678 6.079 0.311 946 HD12 ILE 130 1HD1 ILE 130 0.913 5.332 1.892 947 HD13 ILE 130 2HD1 ILE 130 1.563 6.939 1.567 948 H GLY 131 H GLY 131 -2.663 9.888 5.106 949 HA2 GLY 131 2HA GLY 131 -2.939 12.110 4.689 950 HA3 GLY 131 1HA GLY 131 -1.949 11.919 3.241 951 H LYS 132 H LYS 132 -2.910 11.708 1.301 952 HA LYS 132 HA LYS 132 -5.854 11.759 1.297 953 HB2 LYS 132 2HB LYS 132 -3.931 13.027 -0.660 954 HB3 LYS 132 1HB LYS 132 -5.683 13.014 -0.830 955 HG2 LYS 132 2HG LYS 132 -5.902 14.281 1.228 956 HG3 LYS 132 1HG LYS 132 -4.154 14.282 1.431 957 HD2 LYS 132 2HD LYS 132 -3.927 15.532 -0.672 958 HD3 LYS 132 1HD LYS 132 -5.686 15.521 -0.850 959 HE2 LYS 132 2HE LYS 132 -4.159 16.753 1.430 960 HE3 LYS 132 1HE LYS 132 -4.857 17.648 0.085 961 HZ1 LYS 132 3HZ LYS 132 -7.074 16.863 0.812 962 HZ2 LYS 132 1HZ LYS 132 -6.279 17.723 2.021 963 HZ3 LYS 132 2HZ LYS 132 -6.358 16.064 2.112 964 H PHE 133 H PHE 133 -3.375 9.738 0.774 965 HA PHE 133 HA PHE 133 -4.314 8.686 -1.792 966 HB2 PHE 133 2HB PHE 133 -2.036 7.698 -0.069 967 HB3 PHE 133 1HB PHE 133 -2.385 7.218 -1.713 968 HD1 PHE 133 1HD PHE 133 -2.995 10.427 -2.225 969 HD2 PHE 133 2HD PHE 133 0.273 8.036 -0.942 970 HE1 PHE 133 1HE PHE 133 -1.439 12.117 -3.046 971 HE2 PHE 133 2HE PHE 133 1.837 9.738 -1.769 972 HZ PHE 133 HZ PHE 133 0.985 11.775 -2.819 973 H ARG 134 H ARG 134 -5.250 6.672 -1.966 974 HA ARG 134 HA ARG 134 -5.761 5.367 0.581 975 HB2 ARG 134 2HB ARG 134 -7.823 5.716 -1.596 976 HB3 ARG 134 1HB ARG 134 -8.027 4.677 -0.193 977 HG2 ARG 134 2HG ARG 134 -7.542 6.816 1.177 978 HG3 ARG 134 1HG ARG 134 -7.903 7.661 -0.325 979 HD2 ARG 134 2HD ARG 134 -9.741 5.692 1.019 980 HD3 ARG 134 1HD ARG 134 -9.845 7.433 1.203 981 HE ARG 134 HE ARG 134 -10.156 7.405 -1.302 982 HH11 ARG 134 1HH1 ARG 134 -11.056 4.526 0.542 983 HH12 ARG 134 2HH1 ARG 134 -12.568 4.308 -0.184 984 HH21 ARG 134 1HH2 ARG 134 -12.253 7.091 -2.393 985 HH22 ARG 134 2HH2 ARG 134 -13.262 5.813 -1.919 986 H LEU 135 H LEU 135 -5.234 3.457 0.761 987 HA LEU 135 HA LEU 135 -4.653 1.834 -1.590 988 HB2 LEU 135 2HB LEU 135 -2.643 2.830 -0.658 989 HB3 LEU 135 1HB LEU 135 -3.085 2.318 0.944 990 HG LEU 135 HG LEU 135 -2.424 0.306 -1.209 991 HD11 LEU 135 1HD1 LEU 135 -0.587 1.955 -1.038 992 HD12 LEU 135 2HD1 LEU 135 -0.108 0.399 -0.366 993 HD13 LEU 135 3HD1 LEU 135 -0.555 1.724 0.705 994 HD21 LEU 135 3HD2 LEU 135 -3.465 -0.512 0.882 995 HD22 LEU 135 1HD2 LEU 135 -2.202 0.287 1.815 996 HD23 LEU 135 2HD2 LEU 135 -1.786 -1.048 0.755 997 H VAL 136 H VAL 136 -5.558 -0.143 -1.468 998 HA VAL 136 HA VAL 136 -6.773 -0.922 1.093 999 HB VAL 136 HB VAL 136 -7.558 -1.845 -1.701 1000 HG11 VAL 136 1HG1 VAL 136 -8.868 -2.421 0.960 1001 HG12 VAL 136 2HG1 VAL 136 -7.964 -3.574 -0.023 1002 HG13 VAL 136 3HG1 VAL 136 -9.483 -2.909 -0.620 1003 HG21 VAL 136 3HG2 VAL 136 -8.179 0.474 -1.289 1004 HG22 VAL 136 1HG2 VAL 136 -8.992 0.001 0.203 1005 HG23 VAL 136 2HG2 VAL 136 -9.605 -0.566 -1.353 1006 H PHE 137 H PHE 137 -6.086 -2.673 2.038 1007 HA PHE 137 HA PHE 137 -3.895 -4.168 0.777 1008 HB2 PHE 137 2HB PHE 137 -3.342 -3.049 2.864 1009 HB3 PHE 137 1HB PHE 137 -4.693 -3.823 3.675 1010 HD1 PHE 137 2HD PHE 137 -1.407 -4.430 2.106 1011 HD2 PHE 137 1HD PHE 137 -4.473 -5.967 4.618 1012 HE1 PHE 137 2HE PHE 137 0.064 -6.269 2.784 1013 HE2 PHE 137 1HE PHE 137 -3.006 -7.810 5.300 1014 HZ PHE 137 HZ PHE 137 -0.735 -7.961 4.384 1015 H LEU 138 H LEU 138 -4.145 -6.303 0.264 1016 HA LEU 138 HA LEU 138 -6.367 -7.765 1.501 1017 HB2 LEU 138 2HB LEU 138 -5.582 -7.955 -1.424 1018 HB3 LEU 138 1HB LEU 138 -6.782 -8.938 -0.632 1019 HG LEU 138 HG LEU 138 -8.054 -6.711 -0.247 1020 HD11 LEU 138 1HD1 LEU 138 -6.277 -5.182 -0.856 1021 HD12 LEU 138 2HD1 LEU 138 -7.662 -4.990 -1.927 1022 HD13 LEU 138 3HD1 LEU 138 -6.231 -5.857 -2.484 1023 HD21 LEU 138 3HD2 LEU 138 -9.101 -6.877 -2.450 1024 HD22 LEU 138 1HD2 LEU 138 -8.831 -8.464 -1.733 1025 HD23 LEU 138 2HD2 LEU 138 -7.764 -7.879 -3.012 1026 H ALA 139 H ALA 139 -5.759 -9.704 2.281 1027 HA ALA 139 HA ALA 139 -3.233 -10.820 1.314 1028 HB1 ALA 139 1HB ALA 139 -2.755 -11.653 3.539 1029 HB2 ALA 139 2HB ALA 139 -4.277 -11.038 4.145 1030 HB3 ALA 139 3HB ALA 139 -3.009 -9.908 3.647 1031 H GLY 140 H GLY 140 -3.578 -12.654 0.336 1032 HA2 GLY 140 2HA GLY 140 -5.302 -14.661 1.333 1033 HA3 GLY 140 1HA GLY 140 -6.095 -13.756 0.049 1034 HA PRO 141 HA PRO 141 -3.896 -15.988 -3.101 1035 HB2 PRO 141 2HB PRO 141 -2.320 -13.697 -3.994 1036 HB3 PRO 141 1HB PRO 141 -3.471 -14.673 -4.903 1037 HG2 PRO 141 2HG PRO 141 -4.107 -12.164 -4.171 1038 HG3 PRO 141 1HG PRO 141 -5.312 -13.463 -4.204 1039 HD2 PRO 141 2HD PRO 141 -3.902 -12.249 -1.873 1040 HD3 PRO 141 1HD PRO 141 -5.577 -12.817 -2.009 1041 H ALA 142 H ALA 142 -2.327 -17.284 -2.766 1042 HA ALA 142 HA ALA 142 -0.072 -16.475 -1.106 1043 HB1 ALA 142 1HB ALA 142 -1.426 -18.358 -0.313 1044 HB2 ALA 142 2HB ALA 142 0.231 -18.853 -0.657 1045 HB3 ALA 142 3HB ALA 142 -1.058 -19.243 -1.792 1046 H GLU 143 H GLU 143 1.631 -15.828 -2.237 1047 HA GLU 143 HA GLU 143 2.406 -17.295 -4.604 1048 HB2 GLU 143 2HB GLU 143 2.849 -14.500 -3.609 1049 HB3 GLU 143 1HB GLU 143 3.839 -15.211 -4.861 1050 HG2 GLU 143 2HG GLU 143 0.857 -14.843 -4.995 1051 HG3 GLU 143 1HG GLU 143 2.045 -13.773 -5.740 Start of MODEL 15 1 H1 MET 1 1HT MET 1 10.090 -5.213 55.029 2 H2 MET 1 2HT MET 1 10.356 -5.755 56.579 3 H3 MET 1 3HT MET 1 11.491 -4.740 55.848 4 HA MET 1 HA MET 1 10.201 -3.612 57.482 5 HB2 MET 1 2HB MET 1 9.438 -1.679 56.052 6 HB3 MET 1 1HB MET 1 11.060 -2.232 55.688 7 HG2 MET 1 2HG MET 1 10.204 -3.402 53.715 8 HG3 MET 1 1HG MET 1 8.575 -2.853 54.105 9 HE1 MET 1 2HE MET 1 8.307 -1.850 51.677 10 HE2 MET 1 3HE MET 1 9.932 -2.408 51.271 11 HE3 MET 1 1HE MET 1 9.462 -0.741 50.936 12 H SER 2 H SER 2 8.637 -4.354 58.634 13 HA SER 2 HA SER 2 6.281 -5.439 57.431 14 HB2 SER 2 2HB SER 2 7.374 -6.576 59.299 15 HB3 SER 2 1HB SER 2 7.086 -5.177 60.328 16 HG SER 2 HG SER 2 5.436 -7.213 59.652 17 H ASP 3 H ASP 3 6.997 -2.714 59.648 18 HA ASP 3 HA ASP 3 4.226 -1.835 59.218 19 HB2 ASP 3 2HB ASP 3 4.948 -2.283 61.584 20 HB3 ASP 3 1HB ASP 3 6.114 -0.974 61.420 21 H ASN 4 H ASN 4 3.814 0.244 58.468 22 HA ASN 4 HA ASN 4 6.142 1.465 57.199 23 HB2 ASN 4 2HB ASN 4 4.324 0.931 55.664 24 HB3 ASN 4 1HB ASN 4 3.200 1.879 56.630 25 HD21 ASN 4 1HD2 ASN 4 5.901 2.034 54.433 26 HD22 ASN 4 2HD2 ASN 4 5.743 3.703 54.021 27 H ASN 5 H ASN 5 7.037 3.137 58.012 28 HA ASN 5 HA ASN 5 5.426 5.063 59.516 29 HB2 ASN 5 2HB ASN 5 8.293 4.178 59.934 30 HB3 ASN 5 1HB ASN 5 7.681 5.707 60.550 31 HD21 ASN 5 1HD2 ASN 5 8.674 3.291 61.913 32 HD22 ASN 5 2HD2 ASN 5 7.445 2.843 63.024 33 H GLY 6 H GLY 6 5.849 7.242 59.015 34 HA2 GLY 6 2HA GLY 6 6.795 8.929 57.704 35 HA3 GLY 6 1HA GLY 6 7.610 7.697 56.733 36 H THR 7 H THR 7 4.275 8.009 57.711 37 HA THR 7 HA THR 7 3.408 7.649 54.976 38 HB THR 7 HB THR 7 1.893 7.866 57.588 39 HG1 THR 7 1HG THR 7 3.194 5.740 56.319 40 HG21 THR 7 3HG2 THR 7 0.498 8.347 55.604 41 HG22 THR 7 1HG2 THR 7 0.028 6.825 56.370 42 HG23 THR 7 2HG2 THR 7 1.000 6.808 54.905 43 HA PRO 8 HA PRO 8 3.002 12.168 54.849 44 HB2 PRO 8 2HB PRO 8 1.799 12.293 52.400 45 HB3 PRO 8 1HB PRO 8 3.544 12.120 52.612 46 HG2 PRO 8 2HG PRO 8 1.497 10.034 51.993 47 HG3 PRO 8 1HG PRO 8 3.134 10.221 51.345 48 HD2 PRO 8 2HD PRO 8 2.527 8.429 53.275 49 HD3 PRO 8 1HD PRO 8 4.110 9.237 53.172 50 H GLU 9 H GLU 9 1.417 13.245 55.851 51 HA GLU 9 HA GLU 9 -1.247 12.230 55.981 52 HB2 GLU 9 2HB GLU 9 -0.057 14.897 56.808 53 HB3 GLU 9 1HB GLU 9 -1.727 14.435 57.104 54 HG2 GLU 9 2HG GLU 9 -0.980 12.572 58.481 55 HG3 GLU 9 1HG GLU 9 0.697 13.006 58.167 56 HA PRO 10 HA PRO 10 -1.827 13.798 51.905 57 HB2 PRO 10 2HB PRO 10 -4.265 12.774 51.423 58 HB3 PRO 10 1HB PRO 10 -2.800 11.787 51.441 59 HG2 PRO 10 2HG PRO 10 -4.887 12.117 53.547 60 HG3 PRO 10 1HG PRO 10 -4.030 10.649 53.038 61 HD2 PRO 10 2HD PRO 10 -3.386 12.126 55.265 62 HD3 PRO 10 1HD PRO 10 -2.234 11.099 54.388 63 H GLN 11 H GLN 11 -2.469 15.663 51.233 64 HA GLN 11 HA GLN 11 -4.769 16.879 52.540 65 HB2 GLN 11 2HB GLN 11 -3.855 19.072 51.749 66 HB3 GLN 11 1HB GLN 11 -2.865 18.266 52.949 67 HG2 GLN 11 2HG GLN 11 -1.315 17.558 51.234 68 HG3 GLN 11 1HG GLN 11 -2.341 18.256 49.981 69 HE21 GLN 11 1HE2 GLN 11 -2.942 20.648 51.584 70 HE22 GLN 11 2HE2 GLN 11 -1.505 21.590 51.550 71 H VAL 12 H VAL 12 -6.532 16.839 51.387 72 HA VAL 12 HA VAL 12 -6.244 16.517 48.552 73 HB VAL 12 HB VAL 12 -7.889 15.064 49.633 74 HG11 VAL 12 1HG1 VAL 12 -9.387 17.552 50.398 75 HG12 VAL 12 2HG1 VAL 12 -8.630 16.386 51.485 76 HG13 VAL 12 3HG1 VAL 12 -10.017 15.909 50.514 77 HG21 VAL 12 3HG2 VAL 12 -8.294 15.599 47.319 78 HG22 VAL 12 1HG2 VAL 12 -9.171 17.059 47.777 79 HG23 VAL 12 2HG2 VAL 12 -9.832 15.471 48.169 80 H GLU 13 H GLU 13 -5.475 18.348 47.857 81 HA GLU 13 HA GLU 13 -7.293 20.657 47.916 82 HB2 GLU 13 2HB GLU 13 -5.187 20.956 49.282 83 HB3 GLU 13 1HB GLU 13 -4.268 20.711 47.806 84 HG2 GLU 13 2HG GLU 13 -5.405 22.691 46.838 85 HG3 GLU 13 1HG GLU 13 -6.174 22.951 48.405 86 H THR 14 H THR 14 -7.994 21.030 45.895 87 HA THR 14 HA THR 14 -6.406 19.895 43.731 88 HB THR 14 HB THR 14 -9.401 20.333 43.748 89 HG1 THR 14 1HG THR 14 -7.788 18.364 44.790 90 HG21 THR 14 3HG2 THR 14 -8.358 20.244 41.501 91 HG22 THR 14 1HG2 THR 14 -9.359 18.822 41.805 92 HG23 THR 14 2HG2 THR 14 -7.602 18.707 41.923 93 H THR 15 H THR 15 -5.233 21.621 43.141 94 HA THR 15 HA THR 15 -6.646 23.998 42.214 95 HB THR 15 HB THR 15 -3.662 23.566 42.562 96 HG1 THR 15 1HG THR 15 -4.154 23.655 44.581 97 HG21 THR 15 3HG2 THR 15 -4.234 25.443 41.065 98 HG22 THR 15 1HG2 THR 15 -3.550 26.040 42.577 99 HG23 THR 15 2HG2 THR 15 -5.291 26.119 42.305 100 H SER 16 H SER 16 -5.347 21.169 41.290 101 HA SER 16 HA SER 16 -4.624 21.858 38.582 102 HB2 SER 16 2HB SER 16 -3.432 20.018 39.729 103 HB3 SER 16 1HB SER 16 -4.950 19.151 39.932 104 HG SER 16 HG SER 16 -3.297 19.374 37.759 105 H VAL 17 H VAL 17 -6.474 22.726 37.684 106 HA VAL 17 HA VAL 17 -8.697 20.872 37.247 107 HB VAL 17 HB VAL 17 -9.008 23.837 37.885 108 HG11 VAL 17 1HG1 VAL 17 -10.666 23.081 36.283 109 HG12 VAL 17 2HG1 VAL 17 -11.425 23.411 37.839 110 HG13 VAL 17 3HG1 VAL 17 -11.117 21.748 37.348 111 HG21 VAL 17 3HG2 VAL 17 -9.807 21.445 39.559 112 HG22 VAL 17 1HG2 VAL 17 -10.193 23.126 39.929 113 HG23 VAL 17 2HG2 VAL 17 -8.515 22.588 39.926 114 H PHE 18 H PHE 18 -9.210 20.801 35.093 115 HA PHE 18 HA PHE 18 -8.306 23.049 33.547 116 HB2 PHE 18 2HB PHE 18 -7.470 21.671 31.730 117 HB3 PHE 18 1HB PHE 18 -6.618 21.321 33.218 118 HD1 PHE 18 1HD PHE 18 -7.390 19.204 34.507 119 HD2 PHE 18 2HD PHE 18 -8.332 19.996 30.441 120 HE1 PHE 18 1HE PHE 18 -7.759 16.810 34.122 121 HE2 PHE 18 2HE PHE 18 -8.718 17.596 30.061 122 HZ PHE 18 HZ PHE 18 -8.425 16.008 31.896 123 H ARG 19 H ARG 19 -9.367 23.551 31.760 124 HA ARG 19 HA ARG 19 -12.217 22.807 31.767 125 HB2 ARG 19 2HB ARG 19 -10.791 25.087 30.397 126 HB3 ARG 19 1HB ARG 19 -12.512 24.941 30.690 127 HG2 ARG 19 2HG ARG 19 -12.150 25.218 33.087 128 HG3 ARG 19 1HG ARG 19 -10.407 25.265 32.824 129 HD2 ARG 19 2HD ARG 19 -10.791 27.240 31.336 130 HD3 ARG 19 1HD ARG 19 -12.464 27.246 31.892 131 HE ARG 19 HE ARG 19 -10.985 27.249 34.165 132 HH11 ARG 19 1HH1 ARG 19 -11.266 29.367 31.339 133 HH12 ARG 19 2HH1 ARG 19 -10.698 30.754 32.154 134 HH21 ARG 19 1HH2 ARG 19 -10.162 29.180 35.261 135 HH22 ARG 19 2HH2 ARG 19 -10.052 30.643 34.382 136 H ALA 20 H ALA 20 -10.477 20.981 30.713 137 HA ALA 20 HA ALA 20 -9.891 19.704 28.953 138 HB1 ALA 20 1HB ALA 20 -11.812 21.401 27.326 139 HB2 ALA 20 2HB ALA 20 -12.253 19.948 28.223 140 HB3 ALA 20 3HB ALA 20 -11.150 19.836 26.850 141 H ASP 21 H ASP 21 -8.692 22.345 29.600 142 HA ASP 21 HA ASP 21 -7.653 23.812 27.537 143 HB2 ASP 21 2HB ASP 21 -6.179 22.965 30.040 144 HB3 ASP 21 1HB ASP 21 -5.694 24.266 28.970 145 H LEU 22 H LEU 22 -6.267 20.873 28.898 146 HA LEU 22 HA LEU 22 -4.470 20.750 26.586 147 HB2 LEU 22 2HB LEU 22 -2.914 19.392 27.933 148 HB3 LEU 22 1HB LEU 22 -3.166 20.978 28.613 149 HG LEU 22 HG LEU 22 -4.563 18.526 29.709 150 HD11 LEU 22 1HD1 LEU 22 -2.148 18.137 29.764 151 HD12 LEU 22 2HD1 LEU 22 -2.774 18.431 31.385 152 HD13 LEU 22 3HD1 LEU 22 -1.907 19.706 30.532 153 HD21 LEU 22 3HD2 LEU 22 -4.657 19.884 31.756 154 HD22 LEU 22 1HD2 LEU 22 -5.480 20.690 30.421 155 HD23 LEU 22 2HD2 LEU 22 -3.869 21.213 30.906 156 H LEU 23 H LEU 23 -7.186 19.799 26.706 157 HA LEU 23 HA LEU 23 -6.713 16.926 26.324 158 HB2 LEU 23 2HB LEU 23 -8.417 17.697 28.077 159 HB3 LEU 23 1HB LEU 23 -9.384 18.298 26.758 160 HG LEU 23 HG LEU 23 -8.663 15.376 27.147 161 HD11 LEU 23 1HD1 LEU 23 -10.026 16.147 28.991 162 HD12 LEU 23 2HD1 LEU 23 -10.966 15.100 27.927 163 HD13 LEU 23 3HD1 LEU 23 -11.190 16.849 27.865 164 HD21 LEU 23 3HD2 LEU 23 -10.500 14.946 25.569 165 HD22 LEU 23 1HD2 LEU 23 -9.246 15.939 24.819 166 HD23 LEU 23 2HD2 LEU 23 -10.745 16.678 25.381 167 H LYS 24 H LYS 24 -6.088 16.883 24.254 168 HA LYS 24 HA LYS 24 -7.925 17.981 22.290 169 HB2 LYS 24 2HB LYS 24 -5.824 18.463 20.843 170 HB3 LYS 24 1HB LYS 24 -6.265 19.580 22.121 171 HG2 LYS 24 2HG LYS 24 -4.522 18.754 23.541 172 HG3 LYS 24 1HG LYS 24 -4.172 17.430 22.446 173 HD2 LYS 24 2HD LYS 24 -2.455 19.081 22.208 174 HD3 LYS 24 1HD LYS 24 -3.423 19.081 20.750 175 HE2 LYS 24 2HE LYS 24 -3.740 21.088 23.002 176 HE3 LYS 24 1HE LYS 24 -2.713 21.343 21.604 177 HZ1 LYS 24 3HZ LYS 24 -5.690 21.115 21.610 178 HZ2 LYS 24 1HZ LYS 24 -4.746 21.186 20.200 179 HZ3 LYS 24 2HZ LYS 24 -4.764 22.447 21.292 180 H GLU 25 H GLU 25 -4.941 15.987 22.151 181 HA GLU 25 HA GLU 25 -6.507 14.017 20.668 182 HB2 GLU 25 2HB GLU 25 -3.680 14.933 20.041 183 HB3 GLU 25 1HB GLU 25 -4.534 13.625 19.237 184 HG2 GLU 25 2HG GLU 25 -6.119 15.165 18.287 185 HG3 GLU 25 1HG GLU 25 -5.446 16.497 19.221 186 H MET 26 H MET 26 -6.701 12.688 22.433 187 HA MET 26 HA MET 26 -4.275 12.024 23.881 188 HB2 MET 26 2HB MET 26 -7.153 11.392 24.469 189 HB3 MET 26 1HB MET 26 -5.815 10.788 25.431 190 HG2 MET 26 2HG MET 26 -5.166 13.086 25.963 191 HG3 MET 26 1HG MET 26 -6.516 13.682 24.999 192 HE1 MET 26 3HE MET 26 -9.592 12.429 27.034 193 HE2 MET 26 1HE MET 26 -8.797 11.539 25.736 194 HE3 MET 26 2HE MET 26 -9.033 13.280 25.591 195 H GLU 27 H GLU 27 -3.295 10.178 23.777 196 HA GLU 27 HA GLU 27 -4.010 8.343 21.697 197 HB2 GLU 27 2HB GLU 27 -1.791 8.241 23.744 198 HB3 GLU 27 1HB GLU 27 -1.947 7.176 22.356 199 HG2 GLU 27 2HG GLU 27 -1.590 10.160 22.207 200 HG3 GLU 27 1HG GLU 27 -0.303 8.971 22.015 201 H SER 28 H SER 28 -5.734 7.094 22.134 202 HA SER 28 HA SER 28 -6.216 6.075 24.722 203 HB2 SER 28 2HB SER 28 -8.081 4.888 23.325 204 HB3 SER 28 1HB SER 28 -8.157 6.636 23.572 205 HG SER 28 HG SER 28 -7.769 5.202 21.266 206 H SER 29 H SER 29 -4.492 4.819 25.205 207 HA SER 29 HA SER 29 -3.308 2.951 25.477 208 HB2 SER 29 2HB SER 29 -5.463 1.710 25.277 209 HB3 SER 29 1HB SER 29 -5.245 1.634 23.531 210 HG SER 29 HG SER 29 -3.843 0.083 23.761 211 H THR 30 H THR 30 -1.415 3.627 24.699 212 HA THR 30 HA THR 30 -0.877 2.932 21.935 213 HB THR 30 HB THR 30 -0.786 5.347 22.054 214 HG1 THR 30 1HG THR 30 0.854 5.055 20.785 215 HG21 THR 30 3HG2 THR 30 1.139 5.027 24.368 216 HG22 THR 30 1HG2 THR 30 -0.499 5.671 24.460 217 HG23 THR 30 2HG2 THR 30 0.748 6.557 23.580 218 H GLY 31 H GLY 31 0.656 1.489 21.649 219 HA2 GLY 31 2HA GLY 31 2.728 1.166 23.622 220 HA3 GLY 31 1HA GLY 31 1.625 -0.192 23.413 221 H THR 32 H THR 32 2.933 -1.611 22.469 222 HA THR 32 HA THR 32 4.268 -0.748 20.021 223 HB THR 32 HB THR 32 5.843 -1.514 21.740 224 HG1 THR 32 1HG THR 32 5.994 -2.147 19.370 225 HG21 THR 32 3HG2 THR 32 4.406 -3.043 22.994 226 HG22 THR 32 1HG2 THR 32 5.883 -3.868 22.493 227 HG23 THR 32 2HG2 THR 32 4.375 -4.156 21.627 228 H ALA 33 H ALA 33 4.167 -2.151 18.224 229 HA ALA 33 HA ALA 33 1.688 -3.600 18.002 230 HB1 ALA 33 1HB ALA 33 3.917 -3.175 16.000 231 HB2 ALA 33 2HB ALA 33 2.457 -2.193 16.148 232 HB3 ALA 33 3HB ALA 33 2.339 -3.878 15.643 233 HA PRO 34 HA PRO 34 4.000 -7.284 19.120 234 HB2 PRO 34 2HB PRO 34 1.698 -8.844 19.420 235 HB3 PRO 34 1HB PRO 34 2.554 -7.975 20.692 236 HG2 PRO 34 2HG PRO 34 -0.040 -7.415 19.625 237 HG3 PRO 34 1HG PRO 34 0.835 -6.507 20.863 238 HD2 PRO 34 2HD PRO 34 0.463 -5.898 18.012 239 HD3 PRO 34 1HD PRO 34 0.953 -4.842 19.352 240 H ALA 35 H ALA 35 4.958 -8.237 17.519 241 HA ALA 35 HA ALA 35 3.429 -9.206 15.241 242 HB1 ALA 35 1HB ALA 35 5.406 -7.835 14.798 243 HB2 ALA 35 2HB ALA 35 5.591 -9.470 14.162 244 HB3 ALA 35 3HB ALA 35 6.407 -9.007 15.654 245 H SER 36 H SER 36 2.697 -11.152 15.451 246 HA SER 36 HA SER 36 3.785 -13.050 17.282 247 HB2 SER 36 2HB SER 36 1.735 -13.536 15.125 248 HB3 SER 36 1HB SER 36 1.921 -14.387 16.662 249 HG SER 36 HG SER 36 1.078 -11.739 16.187 250 H THR 37 H THR 37 5.729 -13.917 16.706 251 HA THR 37 HA THR 37 6.193 -14.480 13.919 252 HB THR 37 HB THR 37 8.076 -15.035 16.236 253 HG1 THR 37 1HG THR 37 7.428 -12.829 16.030 254 HG21 THR 37 3HG2 THR 37 8.548 -14.653 13.265 255 HG22 THR 37 1HG2 THR 37 8.625 -16.193 14.122 256 HG23 THR 37 2HG2 THR 37 9.802 -14.928 14.474 257 H GLY 38 H GLY 38 4.591 -15.926 13.688 258 HA2 GLY 38 2HA GLY 38 5.301 -18.666 14.489 259 HA3 GLY 38 1HA GLY 38 3.629 -18.098 14.574 260 H ALA 39 H ALA 39 6.158 -17.497 12.288 261 HA ALA 39 HA ALA 39 4.436 -17.418 10.047 262 HB1 ALA 39 1HB ALA 39 6.510 -16.157 10.126 263 HB2 ALA 39 2HB ALA 39 6.468 -17.258 8.738 264 HB3 ALA 39 3HB ALA 39 7.428 -17.664 10.155 265 H GLU 40 H GLU 40 6.084 -19.955 11.611 266 HA GLU 40 HA GLU 40 6.315 -21.865 9.563 267 HB2 GLU 40 2HB GLU 40 5.614 -22.398 12.443 268 HB3 GLU 40 1HB GLU 40 6.386 -23.502 11.321 269 HG2 GLU 40 2HG GLU 40 7.571 -20.954 12.366 270 HG3 GLU 40 1HG GLU 40 7.937 -22.583 12.928 271 H ASN 41 H ASN 41 3.699 -20.915 11.637 272 HA ASN 41 HA ASN 41 1.885 -22.993 10.913 273 HB2 ASN 41 2HB ASN 41 1.348 -20.330 12.253 274 HB3 ASN 41 1HB ASN 41 0.143 -21.583 12.039 275 HD21 ASN 41 1HD2 ASN 41 -0.206 -21.872 14.222 276 HD22 ASN 41 2HD2 ASN 41 0.958 -22.558 15.278 277 H LEU 42 H LEU 42 2.654 -19.883 9.585 278 HA LEU 42 HA LEU 42 0.234 -19.786 8.008 279 HB2 LEU 42 2HB LEU 42 2.580 -17.923 8.305 280 HB3 LEU 42 1HB LEU 42 1.358 -17.693 7.082 281 HG LEU 42 HG LEU 42 0.914 -16.188 8.864 282 HD11 LEU 42 1HD1 LEU 42 -1.317 -16.764 9.558 283 HD12 LEU 42 2HD1 LEU 42 -1.033 -18.437 9.100 284 HD13 LEU 42 3HD1 LEU 42 -1.047 -17.177 7.861 285 HD21 LEU 42 3HD2 LEU 42 0.941 -18.531 10.758 286 HD22 LEU 42 1HD2 LEU 42 0.493 -16.878 11.180 287 HD23 LEU 42 2HD2 LEU 42 2.142 -17.243 10.672 288 HA PRO 43 HA PRO 43 2.676 -21.833 4.748 289 HB2 PRO 43 2HB PRO 43 0.205 -22.371 3.381 290 HB3 PRO 43 1HB PRO 43 1.242 -23.520 4.228 291 HG2 PRO 43 2HG PRO 43 -1.276 -22.832 5.077 292 HG3 PRO 43 1HG PRO 43 0.009 -23.404 6.144 293 HD2 PRO 43 2HD PRO 43 -0.911 -20.605 5.631 294 HD3 PRO 43 1HD PRO 43 -0.458 -21.396 7.164 295 H ALA 44 H ALA 44 0.854 -19.094 4.780 296 HA ALA 44 HA ALA 44 1.887 -18.241 2.214 297 HB1 ALA 44 1HB ALA 44 -0.259 -17.185 1.612 298 HB2 ALA 44 2HB ALA 44 -1.007 -17.904 3.039 299 HB3 ALA 44 3HB ALA 44 -0.421 -18.938 1.734 300 H GLY 45 H GLY 45 3.151 -16.647 2.857 301 HA2 GLY 45 2HA GLY 45 2.109 -14.763 4.863 302 HA3 GLY 45 1HA GLY 45 3.804 -15.244 4.789 303 H SER 46 H SER 46 1.487 -14.354 2.290 304 HA SER 46 HA SER 46 3.177 -12.092 1.619 305 HB2 SER 46 2HB SER 46 2.025 -14.030 -0.393 306 HB3 SER 46 1HB SER 46 3.010 -12.616 -0.741 307 HG SER 46 HG SER 46 4.419 -13.860 0.962 308 H ALA 47 H ALA 47 2.025 -10.522 0.320 309 HA ALA 47 HA ALA 47 -0.832 -10.522 0.175 310 HB1 ALA 47 1HB ALA 47 -1.094 -8.637 1.738 311 HB2 ALA 47 2HB ALA 47 0.599 -8.781 2.204 312 HB3 ALA 47 3HB ALA 47 -0.534 -10.081 2.582 313 H LEU 48 H LEU 48 -1.449 -8.290 -0.639 314 HA LEU 48 HA LEU 48 0.827 -6.934 -1.827 315 HB2 LEU 48 2HB LEU 48 -0.043 -6.849 -3.997 316 HB3 LEU 48 1HB LEU 48 -0.248 -8.515 -3.520 317 HG LEU 48 HG LEU 48 -2.453 -6.441 -3.597 318 HD11 LEU 48 1HD1 LEU 48 -1.605 -6.982 -5.792 319 HD12 LEU 48 2HD1 LEU 48 -3.216 -7.663 -5.543 320 HD13 LEU 48 3HD1 LEU 48 -1.800 -8.703 -5.459 321 HD21 LEU 48 3HD2 LEU 48 -3.971 -8.325 -3.352 322 HD22 LEU 48 1HD2 LEU 48 -2.874 -8.244 -1.969 323 HD23 LEU 48 2HD2 LEU 48 -2.595 -9.424 -3.255 324 H LEU 49 H LEU 49 0.322 -4.785 -2.470 325 HA LEU 49 HA LEU 49 -2.033 -3.778 -1.120 326 HB2 LEU 49 2HB LEU 49 -0.841 -1.648 -0.765 327 HB3 LEU 49 1HB LEU 49 -0.089 -2.974 0.084 328 HG LEU 49 HG LEU 49 1.578 -2.965 -1.931 329 HD11 LEU 49 1HD1 LEU 49 1.925 -0.767 -2.940 330 HD12 LEU 49 2HD1 LEU 49 0.468 -0.171 -2.150 331 HD13 LEU 49 3HD1 LEU 49 0.352 -1.443 -3.365 332 HD21 LEU 49 3HD2 LEU 49 1.560 -0.761 0.129 333 HD22 LEU 49 1HD2 LEU 49 2.968 -1.293 -0.793 334 HD23 LEU 49 2HD2 LEU 49 2.194 -2.392 0.344 335 H VAL 50 H VAL 50 -3.331 -2.487 -2.218 336 HA VAL 50 HA VAL 50 -2.662 -2.063 -5.051 337 HB VAL 50 HB VAL 50 -5.404 -2.651 -3.878 338 HG11 VAL 50 1HG1 VAL 50 -4.539 -2.353 -6.751 339 HG12 VAL 50 2HG1 VAL 50 -5.504 -1.204 -5.824 340 HG13 VAL 50 3HG1 VAL 50 -6.156 -2.799 -6.200 341 HG21 VAL 50 3HG2 VAL 50 -5.294 -4.801 -5.067 342 HG22 VAL 50 1HG2 VAL 50 -4.029 -4.667 -3.846 343 HG23 VAL 50 2HG2 VAL 50 -3.635 -4.444 -5.551 344 H VAL 51 H VAL 51 -2.678 0.043 -5.540 345 HA VAL 51 HA VAL 51 -3.966 1.828 -3.608 346 HB VAL 51 HB VAL 51 -2.294 2.642 -6.018 347 HG11 VAL 51 1HG1 VAL 51 -3.865 4.330 -5.212 348 HG12 VAL 51 2HG1 VAL 51 -2.200 4.803 -4.866 349 HG13 VAL 51 3HG1 VAL 51 -3.222 4.167 -3.577 350 HG21 VAL 51 3HG2 VAL 51 -0.905 1.367 -4.460 351 HG22 VAL 51 1HG2 VAL 51 -1.483 2.354 -3.118 352 HG23 VAL 51 2HG2 VAL 51 -0.496 3.086 -4.371 353 H LYS 52 H LYS 52 -5.856 2.359 -3.860 354 HA LYS 52 HA LYS 52 -7.199 1.739 -6.322 355 HB2 LYS 52 2HB LYS 52 -8.164 0.991 -4.243 356 HB3 LYS 52 1HB LYS 52 -8.178 2.624 -3.621 357 HG2 LYS 52 2HG LYS 52 -9.958 3.273 -4.992 358 HG3 LYS 52 1HG LYS 52 -9.750 1.893 -6.068 359 HD2 LYS 52 2HD LYS 52 -11.724 1.654 -4.602 360 HD3 LYS 52 1HD LYS 52 -10.531 0.386 -4.363 361 HE2 LYS 52 2HE LYS 52 -9.714 1.533 -2.346 362 HE3 LYS 52 1HE LYS 52 -10.904 2.808 -2.590 363 HZ1 LYS 52 3HZ LYS 52 -12.655 1.307 -2.183 364 HZ2 LYS 52 1HZ LYS 52 -11.557 1.055 -0.934 365 HZ3 LYS 52 2HZ LYS 52 -11.653 -0.045 -2.213 366 H ARG 53 H ARG 53 -6.308 4.501 -4.430 367 HA ARG 53 HA ARG 53 -6.805 6.182 -6.712 368 HB2 ARG 53 2HB ARG 53 -9.042 6.054 -5.655 369 HB3 ARG 53 1HB ARG 53 -8.364 6.710 -4.175 370 HG2 ARG 53 2HG ARG 53 -9.581 8.392 -5.518 371 HG3 ARG 53 1HG ARG 53 -7.881 8.810 -5.282 372 HD2 ARG 53 2HD ARG 53 -8.701 9.188 -7.615 373 HD3 ARG 53 1HD ARG 53 -7.327 8.091 -7.499 374 HE ARG 53 HE ARG 53 -9.907 6.813 -7.499 375 HH11 ARG 53 1HH1 ARG 53 -7.233 7.940 -9.557 376 HH12 ARG 53 2HH1 ARG 53 -7.581 6.855 -10.814 377 HH21 ARG 53 1HH2 ARG 53 -10.359 5.372 -9.194 378 HH22 ARG 53 2HH2 ARG 53 -9.459 5.361 -10.641 379 H GLY 54 H GLY 54 -5.109 7.425 -6.841 380 HA2 GLY 54 2HA GLY 54 -4.417 9.407 -5.132 381 HA3 GLY 54 1HA GLY 54 -3.462 8.027 -4.612 382 HA PRO 55 HA PRO 55 -1.754 9.911 -8.728 383 HB2 PRO 55 2HB PRO 55 -0.311 11.979 -7.214 384 HB3 PRO 55 1HB PRO 55 -1.250 12.143 -8.699 385 HG2 PRO 55 2HG PRO 55 -2.127 13.113 -6.362 386 HG3 PRO 55 1HG PRO 55 -3.236 12.440 -7.570 387 HD2 PRO 55 2HD PRO 55 -2.161 11.201 -5.068 388 HD3 PRO 55 1HD PRO 55 -3.810 11.180 -5.730 389 H ASN 56 H ASN 56 -0.776 9.124 -5.636 390 HA ASN 56 HA ASN 56 1.976 8.879 -5.814 391 HB2 ASN 56 2HB ASN 56 1.687 7.026 -4.047 392 HB3 ASN 56 1HB ASN 56 1.057 8.619 -3.636 393 HD21 ASN 56 1HD2 ASN 56 -1.149 8.848 -3.335 394 HD22 ASN 56 2HD2 ASN 56 -2.179 7.457 -3.225 395 H ALA 57 H ALA 57 -0.601 6.428 -6.433 396 HA ALA 57 HA ALA 57 0.766 5.283 -8.598 397 HB1 ALA 57 1HB ALA 57 2.042 4.241 -6.768 398 HB2 ALA 57 2HB ALA 57 1.067 3.058 -7.639 399 HB3 ALA 57 3HB ALA 57 0.534 3.645 -6.063 400 H GLY 58 H GLY 58 -0.501 3.228 -9.175 401 HA2 GLY 58 2HA GLY 58 -3.199 3.029 -8.242 402 HA3 GLY 58 1HA GLY 58 -3.062 3.758 -9.849 403 H ALA 59 H ALA 59 -1.480 1.135 -8.081 404 HA ALA 59 HA ALA 59 -2.119 -0.729 -10.150 405 HB1 ALA 59 1HB ALA 59 0.734 0.024 -9.479 406 HB2 ALA 59 2HB ALA 59 -0.082 0.336 -11.008 407 HB3 ALA 59 3HB ALA 59 0.243 -1.324 -10.506 408 H ARG 60 H ARG 60 -0.878 -2.806 -9.436 409 HA ARG 60 HA ARG 60 -1.349 -3.113 -6.577 410 HB2 ARG 60 2HB ARG 60 -1.756 -5.436 -7.051 411 HB3 ARG 60 1HB ARG 60 -2.613 -4.473 -8.246 412 HG2 ARG 60 2HG ARG 60 -0.671 -4.892 -9.817 413 HG3 ARG 60 1HG ARG 60 -0.075 -6.053 -8.650 414 HD2 ARG 60 2HD ARG 60 -2.692 -6.168 -10.157 415 HD3 ARG 60 1HD ARG 60 -1.289 -7.198 -10.401 416 HE ARG 60 HE ARG 60 -3.005 -7.225 -8.007 417 HH11 ARG 60 1HH1 ARG 60 -0.863 -8.988 -10.243 418 HH12 ARG 60 2HH1 ARG 60 -1.270 -10.521 -9.637 419 HH21 ARG 60 1HH2 ARG 60 -3.582 -9.355 -7.225 420 HH22 ARG 60 2HH2 ARG 60 -2.846 -10.747 -7.879 421 H PHE 61 H PHE 61 0.296 -3.770 -5.263 422 HA PHE 61 HA PHE 61 2.871 -4.431 -6.495 423 HB2 PHE 61 2HB PHE 61 2.458 -2.508 -4.184 424 HB3 PHE 61 1HB PHE 61 4.023 -3.102 -4.724 425 HD1 PHE 61 1HD PHE 61 4.947 -2.351 -6.881 426 HD2 PHE 61 2HD PHE 61 1.295 -0.780 -5.362 427 HE1 PHE 61 1HE PHE 61 5.103 -0.472 -8.459 428 HE2 PHE 61 2HE PHE 61 1.438 1.098 -6.934 429 HZ PHE 61 HZ PHE 61 3.346 1.258 -8.491 430 H LEU 62 H LEU 62 3.832 -6.117 -5.589 431 HA LEU 62 HA LEU 62 2.334 -7.575 -3.574 432 HB2 LEU 62 2HB LEU 62 3.036 -8.703 -5.629 433 HB3 LEU 62 1HB LEU 62 4.709 -8.350 -5.264 434 HG LEU 62 HG LEU 62 4.492 -9.783 -3.223 435 HD11 LEU 62 1HD1 LEU 62 2.633 -11.365 -3.111 436 HD12 LEU 62 2HD1 LEU 62 1.855 -10.546 -4.465 437 HD13 LEU 62 3HD1 LEU 62 2.087 -9.698 -2.934 438 HD21 LEU 62 3HD2 LEU 62 5.529 -10.618 -5.249 439 HD22 LEU 62 1HD2 LEU 62 3.953 -11.092 -5.884 440 HD23 LEU 62 2HD2 LEU 62 4.605 -11.897 -4.457 441 H LEU 63 H LEU 63 2.951 -7.702 -1.500 442 HA LEU 63 HA LEU 63 5.394 -6.472 -0.638 443 HB2 LEU 63 2HB LEU 63 3.196 -7.921 0.852 444 HB3 LEU 63 1HB LEU 63 4.670 -7.413 1.639 445 HG LEU 63 HG LEU 63 2.919 -5.873 2.164 446 HD11 LEU 63 1HD1 LEU 63 3.876 -3.769 1.448 447 HD12 LEU 63 2HD1 LEU 63 4.810 -4.605 0.213 448 HD13 LEU 63 3HD1 LEU 63 5.120 -4.928 1.920 449 HD21 LEU 63 3HD2 LEU 63 1.778 -4.521 0.469 450 HD22 LEU 63 1HD2 LEU 63 1.438 -6.240 0.279 451 HD23 LEU 63 2HD2 LEU 63 2.584 -5.449 -0.799 452 H ASP 64 H ASP 64 7.169 -7.432 -0.701 453 HA ASP 64 HA ASP 64 7.429 -10.297 -0.166 454 HB2 ASP 64 2HB ASP 64 7.244 -10.272 -2.553 455 HB3 ASP 64 1HB ASP 64 8.336 -8.900 -2.681 456 H GLN 65 H GLN 65 9.181 -7.397 -1.158 457 HA GLN 65 HA GLN 65 11.559 -8.059 0.189 458 HB2 GLN 65 2HB GLN 65 11.369 -6.471 -1.709 459 HB3 GLN 65 1HB GLN 65 10.489 -5.368 -0.664 460 HG2 GLN 65 2HG GLN 65 12.491 -5.207 0.771 461 HG3 GLN 65 1HG GLN 65 13.356 -6.216 -0.391 462 HE21 GLN 65 1HE2 GLN 65 11.906 -3.148 0.191 463 HE22 GLN 65 2HE2 GLN 65 12.506 -2.357 -1.209 464 HA PRO 66 HA PRO 66 10.079 -7.694 4.415 465 HB2 PRO 66 2HB PRO 66 12.562 -6.645 5.352 466 HB3 PRO 66 1HB PRO 66 11.991 -8.310 5.442 467 HG2 PRO 66 2HG PRO 66 13.799 -7.035 3.473 468 HG3 PRO 66 1HG PRO 66 13.736 -8.718 4.015 469 HD2 PRO 66 2HD PRO 66 12.880 -8.000 1.607 470 HD3 PRO 66 1HD PRO 66 12.022 -9.259 2.527 471 H THR 67 H THR 67 12.197 -5.009 3.440 472 HA THR 67 HA THR 67 10.451 -3.224 4.928 473 HB THR 67 HB THR 67 13.160 -2.659 3.720 474 HG1 THR 67 1HG THR 67 12.408 -3.595 6.304 475 HG21 THR 67 3HG2 THR 67 13.171 -0.805 5.316 476 HG22 THR 67 1HG2 THR 67 11.555 -1.252 5.859 477 HG23 THR 67 2HG2 THR 67 11.802 -0.676 4.210 478 H THR 68 H THR 68 8.770 -2.785 3.512 479 HA THR 68 HA THR 68 9.450 -1.859 0.834 480 HB THR 68 HB THR 68 6.775 -2.480 2.145 481 HG1 THR 68 1HG THR 68 8.428 -4.230 1.472 482 HG21 THR 68 3HG2 THR 68 6.557 -0.786 0.356 483 HG22 THR 68 1HG2 THR 68 5.830 -2.321 -0.126 484 HG23 THR 68 2HG2 THR 68 7.411 -1.860 -0.754 485 H THR 69 H THR 69 9.780 0.277 0.665 486 HA THR 69 HA THR 69 8.865 1.976 2.876 487 HB THR 69 HB THR 69 11.045 2.570 0.891 488 HG1 THR 69 1HG THR 69 11.240 0.551 2.056 489 HG21 THR 69 3HG2 THR 69 10.527 3.495 3.734 490 HG22 THR 69 1HG2 THR 69 10.218 4.452 2.285 491 HG23 THR 69 2HG2 THR 69 11.867 4.004 2.707 492 H ALA 70 H ALA 70 7.525 3.650 2.558 493 HA ALA 70 HA ALA 70 6.868 4.502 -0.171 494 HB1 ALA 70 1HB ALA 70 4.799 5.379 0.820 495 HB2 ALA 70 2HB ALA 70 5.345 4.872 2.418 496 HB3 ALA 70 3HB ALA 70 4.982 3.661 1.189 497 H GLY 71 H GLY 71 7.799 6.426 -0.754 498 HA2 GLY 71 2HA GLY 71 8.020 8.540 1.163 499 HA3 GLY 71 1HA GLY 71 9.568 7.839 0.696 500 H ARG 72 H ARG 72 9.537 10.275 0.055 501 HA ARG 72 HA ARG 72 8.241 10.788 -2.513 502 HB2 ARG 72 2HB ARG 72 8.334 12.463 -0.610 503 HB3 ARG 72 1HB ARG 72 10.061 12.576 -0.890 504 HG2 ARG 72 2HG ARG 72 8.949 13.050 -3.385 505 HG3 ARG 72 1HG ARG 72 7.874 13.890 -2.264 506 HD2 ARG 72 2HD ARG 72 9.674 15.364 -2.978 507 HD3 ARG 72 1HD ARG 72 9.832 15.000 -1.254 508 HE ARG 72 HE ARG 72 11.297 13.374 -3.163 509 HH11 ARG 72 1HH1 ARG 72 11.432 15.978 -0.780 510 HH12 ARG 72 2HH1 ARG 72 13.107 15.864 -0.522 511 HH21 ARG 72 1HH2 ARG 72 13.636 13.218 -2.828 512 HH22 ARG 72 2HH2 ARG 72 14.375 14.220 -1.678 513 H HIS 73 H HIS 73 10.789 9.083 -1.789 514 HA HIS 73 HA HIS 73 12.760 10.261 -3.591 515 HB2 HIS 73 2HB HIS 73 12.824 7.693 -1.972 516 HB3 HIS 73 1HB HIS 73 14.146 8.274 -2.970 517 HD1 HIS 73 1HD HIS 73 15.780 9.867 -1.846 518 HD2 HIS 73 2HD HIS 73 12.273 9.329 0.316 519 HE1 HIS 73 1HE HIS 73 16.154 10.968 0.378 520 HA PRO 74 HA PRO 74 11.363 7.681 -7.007 521 HB2 PRO 74 2HB PRO 74 13.751 7.433 -8.357 522 HB3 PRO 74 1HB PRO 74 12.712 8.854 -8.484 523 HG2 PRO 74 2HG PRO 74 15.169 8.446 -6.832 524 HG3 PRO 74 1HG PRO 74 14.646 9.879 -7.735 525 HD2 PRO 74 2HD PRO 74 14.364 9.682 -5.050 526 HD3 PRO 74 1HD PRO 74 13.204 10.562 -6.066 527 H GLU 75 H GLU 75 14.154 7.058 -5.098 528 HA GLU 75 HA GLU 75 14.140 4.228 -5.656 529 HB2 GLU 75 2HB GLU 75 15.953 5.885 -3.904 530 HB3 GLU 75 1HB GLU 75 16.121 4.158 -4.184 531 HG2 GLU 75 2HG GLU 75 16.488 4.582 -6.565 532 HG3 GLU 75 1HG GLU 75 16.309 6.312 -6.273 533 H SER 76 H SER 76 11.935 4.472 -4.805 534 HA SER 76 HA SER 76 11.907 3.742 -1.979 535 HB2 SER 76 2HB SER 76 9.504 4.473 -2.088 536 HB3 SER 76 1HB SER 76 10.633 5.798 -2.357 537 HG SER 76 HG SER 76 8.680 5.038 -3.924 538 H ASP 77 H ASP 77 9.609 2.325 -1.908 539 HA ASP 77 HA ASP 77 10.112 0.330 -3.974 540 HB2 ASP 77 2HB ASP 77 8.677 0.028 -1.332 541 HB3 ASP 77 1HB ASP 77 8.911 -1.268 -2.511 542 H ILE 78 H ILE 78 7.559 2.148 -2.422 543 HA ILE 78 HA ILE 78 6.096 1.749 -4.912 544 HB ILE 78 HB ILE 78 4.021 2.368 -3.780 545 HG12 ILE 78 2HG1 ILE 78 5.509 2.331 -1.146 546 HG13 ILE 78 1HG1 ILE 78 5.156 3.812 -2.026 547 HG21 ILE 78 1HG2 ILE 78 4.528 0.012 -3.855 548 HG22 ILE 78 2HG2 ILE 78 3.711 0.394 -2.336 549 HG23 ILE 78 3HG2 ILE 78 5.454 0.132 -2.358 550 HD11 ILE 78 3HD1 ILE 78 3.533 3.446 -0.280 551 HD12 ILE 78 1HD1 ILE 78 3.125 1.860 -0.954 552 HD13 ILE 78 2HD1 ILE 78 2.782 3.339 -1.865 553 H PHE 79 H PHE 79 5.159 3.639 -5.780 554 HA PHE 79 HA PHE 79 6.817 5.922 -5.206 555 HB2 PHE 79 2HB PHE 79 4.836 5.458 -7.452 556 HB3 PHE 79 1HB PHE 79 5.882 6.868 -7.300 557 HD1 PHE 79 2HD PHE 79 8.391 6.503 -7.334 558 HD2 PHE 79 1HD PHE 79 5.603 3.501 -8.489 559 HE1 PHE 79 2HE PHE 79 10.177 5.307 -8.528 560 HE2 PHE 79 1HE PHE 79 7.386 2.298 -9.681 561 HZ PHE 79 HZ PHE 79 9.678 3.200 -9.701 562 H LEU 80 H LEU 80 6.116 7.803 -4.486 563 HA LEU 80 HA LEU 80 3.370 7.876 -3.542 564 HB2 LEU 80 2HB LEU 80 4.871 7.261 -1.736 565 HB3 LEU 80 1HB LEU 80 5.846 8.680 -2.049 566 HG LEU 80 HG LEU 80 3.860 10.083 -1.460 567 HD11 LEU 80 1HD1 LEU 80 2.098 8.464 -1.835 568 HD12 LEU 80 2HD1 LEU 80 2.063 9.052 -0.172 569 HD13 LEU 80 3HD1 LEU 80 2.725 7.456 -0.531 570 HD21 LEU 80 3HD2 LEU 80 4.900 8.193 0.622 571 HD22 LEU 80 1HD2 LEU 80 4.117 9.739 0.936 572 HD23 LEU 80 2HD2 LEU 80 5.665 9.691 0.091 573 H ASP 81 H ASP 81 2.361 9.529 -4.230 574 HA ASP 81 HA ASP 81 3.614 12.085 -4.352 575 HB2 ASP 81 2HB ASP 81 3.780 11.354 -6.683 576 HB3 ASP 81 1HB ASP 81 2.060 10.959 -6.693 577 H ASP 82 H ASP 82 2.592 13.014 -3.087 578 HA ASP 82 HA ASP 82 -0.340 13.200 -3.048 579 HB2 ASP 82 2HB ASP 82 0.182 11.662 -1.215 580 HB3 ASP 82 1HB ASP 82 1.435 12.736 -0.615 581 H VAL 83 H VAL 83 -1.021 15.224 -1.868 582 HA VAL 83 HA VAL 83 0.650 17.390 -2.796 583 HB VAL 83 HB VAL 83 -1.230 18.872 -2.119 584 HG11 VAL 83 1HG1 VAL 83 -1.195 17.887 -4.345 585 HG12 VAL 83 2HG1 VAL 83 -2.852 18.011 -3.754 586 HG13 VAL 83 3HG1 VAL 83 -2.028 16.455 -3.742 587 HG21 VAL 83 3HG2 VAL 83 -2.562 16.293 -1.264 588 HG22 VAL 83 1HG2 VAL 83 -3.344 17.870 -1.350 589 HG23 VAL 83 2HG2 VAL 83 -2.046 17.590 -0.190 590 H THR 84 H THR 84 0.268 15.764 0.111 591 HA THR 84 HA THR 84 1.694 17.843 1.586 592 HB THR 84 HB THR 84 0.425 16.781 3.597 593 HG1 THR 84 1HG THR 84 -0.560 15.353 1.678 594 HG21 THR 84 3HG2 THR 84 -1.451 18.351 3.327 595 HG22 THR 84 1HG2 THR 84 -1.029 18.549 1.627 596 HG23 THR 84 2HG2 THR 84 0.088 19.086 2.880 597 H VAL 85 H VAL 85 2.969 16.107 0.162 598 HA VAL 85 HA VAL 85 3.403 13.592 1.463 599 HB VAL 85 HB VAL 85 3.366 13.802 -1.004 600 HG11 VAL 85 1HG1 VAL 85 5.912 15.374 -0.714 601 HG12 VAL 85 2HG1 VAL 85 4.362 15.963 -1.314 602 HG13 VAL 85 3HG1 VAL 85 5.259 14.756 -2.234 603 HG21 VAL 85 3HG2 VAL 85 4.539 11.909 -0.042 604 HG22 VAL 85 1HG2 VAL 85 6.019 12.860 0.077 605 HG23 VAL 85 2HG2 VAL 85 5.361 12.452 -1.507 606 H SER 86 H SER 86 5.135 12.978 2.590 607 HA SER 86 HA SER 86 7.022 15.029 3.466 608 HB2 SER 86 2HB SER 86 5.637 13.768 5.161 609 HB3 SER 86 1HB SER 86 6.400 12.288 4.605 610 HG SER 86 HG SER 86 7.438 13.008 6.412 611 H ARG 87 H ARG 87 9.290 14.213 3.685 612 HA ARG 87 HA ARG 87 10.262 13.078 1.296 613 HB2 ARG 87 2HB ARG 87 11.618 14.524 2.807 614 HB3 ARG 87 1HB ARG 87 11.670 13.208 3.970 615 HG2 ARG 87 2HG ARG 87 12.863 11.822 2.343 616 HG3 ARG 87 1HG ARG 87 12.826 13.151 1.193 617 HD2 ARG 87 2HD ARG 87 14.163 13.205 3.893 618 HD3 ARG 87 1HD ARG 87 14.982 12.971 2.353 619 HE ARG 87 HE ARG 87 13.423 15.386 2.526 620 HH11 ARG 87 1HH1 ARG 87 16.606 13.932 3.049 621 HH12 ARG 87 2HH1 ARG 87 17.458 15.397 2.968 622 HH21 ARG 87 1HH2 ARG 87 14.599 17.432 2.447 623 HH22 ARG 87 2HH2 ARG 87 16.288 17.432 2.613 624 H ARG 88 H ARG 88 9.715 11.759 4.468 625 HA ARG 88 HA ARG 88 9.697 9.081 3.311 626 HB2 ARG 88 2HB ARG 88 10.684 8.092 5.272 627 HB3 ARG 88 1HB ARG 88 11.692 9.476 4.921 628 HG2 ARG 88 2HG ARG 88 9.533 9.426 7.034 629 HG3 ARG 88 1HG ARG 88 11.234 9.109 7.343 630 HD2 ARG 88 2HD ARG 88 11.786 11.382 6.750 631 HD3 ARG 88 1HD ARG 88 10.128 11.684 6.221 632 HE ARG 88 HE ARG 88 10.217 10.782 8.904 633 HH11 ARG 88 1HH1 ARG 88 10.880 13.695 7.006 634 HH12 ARG 88 2HH1 ARG 88 10.346 14.789 8.179 635 HH21 ARG 88 1HH2 ARG 88 9.534 12.250 10.567 636 HH22 ARG 88 2HH2 ARG 88 9.531 13.925 10.288 637 H HIS 89 H HIS 89 7.789 7.960 3.788 638 HA HIS 89 HA HIS 89 5.895 9.632 5.290 639 HB2 HIS 89 2HB HIS 89 5.493 9.477 2.851 640 HB3 HIS 89 1HB HIS 89 5.313 7.739 3.015 641 HD2 HIS 89 2HD HIS 89 2.963 6.934 4.408 642 HE1 HIS 89 1HE HIS 89 1.088 10.665 3.834 643 HE2 HIS 89 2HE HIS 89 1.016 8.441 5.027 644 H ALA 90 H ALA 90 6.075 6.232 4.230 645 HA ALA 90 HA ALA 90 5.640 5.406 6.969 646 HB1 ALA 90 1HB ALA 90 3.716 4.689 4.752 647 HB2 ALA 90 2HB ALA 90 3.366 5.718 6.147 648 HB3 ALA 90 3HB ALA 90 3.711 4.008 6.377 649 H GLU 91 H GLU 91 6.060 3.226 7.266 650 HA GLU 91 HA GLU 91 7.533 1.996 5.051 651 HB2 GLU 91 2HB GLU 91 8.938 2.767 6.971 652 HB3 GLU 91 1HB GLU 91 8.027 1.696 8.019 653 HG2 GLU 91 2HG GLU 91 8.842 -0.231 6.779 654 HG3 GLU 91 1HG GLU 91 9.721 0.840 5.687 655 H PHE 92 H PHE 92 6.765 0.127 4.420 656 HA PHE 92 HA PHE 92 4.677 -1.179 5.973 657 HB2 PHE 92 2HB PHE 92 5.438 -1.355 3.043 658 HB3 PHE 92 1HB PHE 92 4.222 -2.381 3.798 659 HD1 PHE 92 1HD PHE 92 5.059 1.023 2.685 660 HD2 PHE 92 2HD PHE 92 2.048 -1.513 4.303 661 HE1 PHE 92 1HE PHE 92 3.353 2.729 2.192 662 HE2 PHE 92 2HE PHE 92 0.343 0.189 3.814 663 HZ PHE 92 HZ PHE 92 0.997 2.315 2.761 664 H ARG 93 H ARG 93 5.296 -2.825 7.091 665 HA ARG 93 HA ARG 93 7.796 -4.143 6.388 666 HB2 ARG 93 2HB ARG 93 6.366 -3.889 9.043 667 HB3 ARG 93 1HB ARG 93 7.911 -4.705 8.793 668 HG2 ARG 93 2HG ARG 93 8.976 -2.652 8.178 669 HG3 ARG 93 1HG ARG 93 7.437 -1.800 8.166 670 HD2 ARG 93 2HD ARG 93 8.666 -1.238 10.159 671 HD3 ARG 93 1HD ARG 93 7.251 -2.185 10.593 672 HE ARG 93 HE ARG 93 8.623 -3.972 11.158 673 HH11 ARG 93 1HH1 ARG 93 10.614 -1.305 9.878 674 HH12 ARG 93 2HH1 ARG 93 11.983 -1.731 10.769 675 HH21 ARG 93 1HH2 ARG 93 10.508 -4.546 12.375 676 HH22 ARG 93 2HH2 ARG 93 11.930 -3.623 12.254 677 H ILE 94 H ILE 94 7.639 -6.129 5.714 678 HA ILE 94 HA ILE 94 5.098 -7.515 6.139 679 HB ILE 94 HB ILE 94 5.185 -7.008 3.832 680 HG12 ILE 94 2HG1 ILE 94 5.519 -9.217 2.656 681 HG13 ILE 94 1HG1 ILE 94 6.165 -9.850 4.163 682 HG21 ILE 94 1HG2 ILE 94 8.020 -7.964 3.722 683 HG22 ILE 94 2HG2 ILE 94 7.455 -6.300 3.612 684 HG23 ILE 94 3HG2 ILE 94 7.056 -7.453 2.336 685 HD11 ILE 94 3HD1 ILE 94 4.039 -9.443 5.248 686 HD12 ILE 94 1HD1 ILE 94 3.851 -10.484 3.834 687 HD13 ILE 94 2HD1 ILE 94 3.394 -8.782 3.739 688 H ASN 95 H ASN 95 5.275 -9.127 7.488 689 HA ASN 95 HA ASN 95 7.685 -10.748 7.432 690 HB2 ASN 95 2HB ASN 95 7.294 -9.442 9.572 691 HB3 ASN 95 1HB ASN 95 5.720 -10.201 9.700 692 HD21 ASN 95 1HD2 ASN 95 7.923 -10.220 11.559 693 HD22 ASN 95 2HD2 ASN 95 8.362 -11.866 11.806 694 H GLU 96 H GLU 96 7.169 -12.940 7.260 695 HA GLU 96 HA GLU 96 4.635 -13.439 6.103 696 HB2 GLU 96 2HB GLU 96 5.464 -15.875 6.106 697 HB3 GLU 96 1HB GLU 96 6.304 -14.699 5.111 698 HG2 GLU 96 2HG GLU 96 8.029 -14.511 6.824 699 HG3 GLU 96 1HG GLU 96 7.200 -15.721 7.798 700 H GLY 97 H GLY 97 5.637 -13.302 9.228 701 HA2 GLY 97 2HA GLY 97 3.618 -15.026 10.342 702 HA3 GLY 97 1HA GLY 97 4.581 -13.845 11.224 703 H GLU 98 H GLU 98 4.004 -11.385 10.106 704 HA GLU 98 HA GLU 98 1.189 -11.111 9.846 705 HB2 GLU 98 2HB GLU 98 2.653 -10.031 12.250 706 HB3 GLU 98 1HB GLU 98 1.169 -9.317 11.648 707 HG2 GLU 98 2HG GLU 98 0.058 -11.515 11.971 708 HG3 GLU 98 1HG GLU 98 1.540 -12.106 12.713 709 H PHE 99 H PHE 99 0.683 -8.736 9.609 710 HA PHE 99 HA PHE 99 2.765 -7.590 7.879 711 HB2 PHE 99 2HB PHE 99 -0.198 -7.031 7.695 712 HB3 PHE 99 1HB PHE 99 1.028 -6.828 6.455 713 HD1 PHE 99 1HD PHE 99 1.958 -8.892 5.357 714 HD2 PHE 99 2HD PHE 99 -1.413 -9.018 7.935 715 HE1 PHE 99 1HE PHE 99 1.337 -11.094 4.435 716 HE2 PHE 99 2HE PHE 99 -2.042 -11.211 7.028 717 HZ PHE 99 HZ PHE 99 -0.664 -12.255 5.273 718 H GLU 100 H GLU 100 3.455 -5.515 8.442 719 HA GLU 100 HA GLU 100 1.943 -4.122 10.550 720 HB2 GLU 100 2HB GLU 100 3.835 -5.406 11.471 721 HB3 GLU 100 1HB GLU 100 4.938 -4.521 10.433 722 HG2 GLU 100 2HG GLU 100 4.230 -2.432 11.605 723 HG3 GLU 100 1HG GLU 100 3.295 -3.438 12.713 724 H VAL 101 H VAL 101 1.771 -1.927 10.225 725 HA VAL 101 HA VAL 101 3.600 -0.751 8.279 726 HB VAL 101 HB VAL 101 1.470 -0.956 7.139 727 HG11 VAL 101 1HG1 VAL 101 0.283 0.639 9.398 728 HG12 VAL 101 2HG1 VAL 101 -0.031 -1.062 9.047 729 HG13 VAL 101 3HG1 VAL 101 -0.564 0.186 7.919 730 HG21 VAL 101 3HG2 VAL 101 2.771 1.021 6.617 731 HG22 VAL 101 1HG2 VAL 101 2.007 1.902 7.942 732 HG23 VAL 101 2HG2 VAL 101 1.050 1.401 6.545 733 H VAL 102 H VAL 102 4.656 0.948 8.928 734 HA VAL 102 HA VAL 102 3.811 2.247 11.433 735 HB VAL 102 HB VAL 102 6.645 1.811 10.441 736 HG11 VAL 102 1HG1 VAL 102 7.339 2.601 12.658 737 HG12 VAL 102 2HG1 VAL 102 5.655 2.930 13.057 738 HG13 VAL 102 3HG1 VAL 102 6.446 3.834 11.766 739 HG21 VAL 102 3HG2 VAL 102 5.175 0.420 12.676 740 HG22 VAL 102 1HG2 VAL 102 6.890 0.234 12.310 741 HG23 VAL 102 2HG2 VAL 102 5.672 -0.299 11.148 742 H ASP 103 H ASP 103 3.545 4.435 11.272 743 HA ASP 103 HA ASP 103 4.272 5.811 8.839 744 HB2 ASP 103 2HB ASP 103 2.217 6.420 10.136 745 HB3 ASP 103 1HB ASP 103 3.255 6.892 11.478 746 H VAL 104 H VAL 104 6.096 6.985 8.570 747 HA VAL 104 HA VAL 104 7.853 7.116 10.897 748 HB VAL 104 HB VAL 104 9.803 7.107 9.278 749 HG11 VAL 104 1HG1 VAL 104 9.732 4.673 8.924 750 HG12 VAL 104 2HG1 VAL 104 8.009 4.679 9.302 751 HG13 VAL 104 3HG1 VAL 104 9.184 5.118 10.542 752 HG21 VAL 104 3HG2 VAL 104 8.529 7.718 7.248 753 HG22 VAL 104 1HG2 VAL 104 7.703 6.168 7.321 754 HG23 VAL 104 2HG2 VAL 104 9.443 6.224 7.033 755 H GLY 105 H GLY 105 5.861 9.101 9.786 756 HA2 GLY 105 2HA GLY 105 6.287 11.341 10.693 757 HA3 GLY 105 1HA GLY 105 7.798 11.308 9.803 758 H SER 106 H SER 106 4.391 10.649 8.974 759 HA SER 106 HA SER 106 4.760 12.027 6.491 760 HB2 SER 106 2HB SER 106 2.355 11.553 6.162 761 HB3 SER 106 1HB SER 106 3.264 10.105 6.600 762 HG SER 106 HG SER 106 2.309 9.994 8.418 763 H LEU 107 H LEU 107 3.860 14.027 5.929 764 HA LEU 107 HA LEU 107 3.494 15.862 8.112 765 HB2 LEU 107 2HB LEU 107 3.252 16.261 5.136 766 HB3 LEU 107 1HB LEU 107 3.189 17.535 6.333 767 HG LEU 107 HG LEU 107 5.585 15.786 5.741 768 HD11 LEU 107 1HD1 LEU 107 5.061 18.679 5.093 769 HD12 LEU 107 2HD1 LEU 107 5.119 17.343 3.944 770 HD13 LEU 107 3HD1 LEU 107 6.574 17.814 4.820 771 HD21 LEU 107 3HD2 LEU 107 5.299 18.147 7.608 772 HD22 LEU 107 1HD2 LEU 107 6.812 17.333 7.203 773 HD23 LEU 107 2HD2 LEU 107 5.554 16.468 8.081 774 H ASN 108 H ASN 108 1.561 14.165 5.836 775 HA ASN 108 HA ASN 108 -0.810 15.698 6.384 776 HB2 ASN 108 2HB ASN 108 -1.896 14.088 4.789 777 HB3 ASN 108 1HB ASN 108 -0.591 15.045 4.122 778 HD21 ASN 108 1HD2 ASN 108 -0.109 13.599 2.442 779 HD22 ASN 108 2HD2 ASN 108 0.571 12.064 2.747 780 H GLY 109 H GLY 109 0.608 12.772 7.510 781 HA2 GLY 109 2HA GLY 109 -0.034 11.667 9.450 782 HA3 GLY 109 1HA GLY 109 -1.593 12.482 9.375 783 H THR 110 H THR 110 0.135 9.652 8.628 784 HA THR 110 HA THR 110 -1.722 8.528 6.788 785 HB THR 110 HB THR 110 0.242 7.129 8.631 786 HG1 THR 110 1HG THR 110 1.666 8.105 7.531 787 HG21 THR 110 3HG2 THR 110 0.265 5.416 6.862 788 HG22 THR 110 1HG2 THR 110 -0.935 6.338 5.953 789 HG23 THR 110 2HG2 THR 110 -1.360 5.637 7.513 790 H TYR 111 H TYR 111 -3.717 7.692 7.306 791 HA TYR 111 HA TYR 111 -4.124 6.701 10.013 792 HB2 TYR 111 2HB TYR 111 -5.969 8.652 8.610 793 HB3 TYR 111 1HB TYR 111 -6.384 7.761 10.066 794 HD1 TYR 111 1HD TYR 111 -4.688 8.116 12.076 795 HD2 TYR 111 2HD TYR 111 -5.156 10.803 8.823 796 HE1 TYR 111 1HE TYR 111 -3.787 9.929 13.460 797 HE2 TYR 111 2HE TYR 111 -4.243 12.631 10.196 798 HH TYR 111 HH TYR 111 -2.718 12.106 13.223 799 H VAL 112 H VAL 112 -5.862 5.213 10.156 800 HA VAL 112 HA VAL 112 -6.343 3.823 7.644 801 HB VAL 112 HB VAL 112 -6.909 2.926 10.482 802 HG11 VAL 112 1HG1 VAL 112 -6.692 1.356 7.924 803 HG12 VAL 112 2HG1 VAL 112 -8.171 1.717 8.814 804 HG13 VAL 112 3HG1 VAL 112 -6.945 0.671 9.529 805 HG21 VAL 112 3HG2 VAL 112 -4.458 2.348 8.819 806 HG22 VAL 112 1HG2 VAL 112 -4.848 1.615 10.376 807 HG23 VAL 112 2HG2 VAL 112 -4.530 3.345 10.269 808 H ASN 113 H ASN 113 -8.514 3.424 7.018 809 HA ASN 113 HA ASN 113 -10.282 5.531 7.483 810 HB2 ASN 113 2HB ASN 113 -11.905 4.334 6.141 811 HB3 ASN 113 1HB ASN 113 -10.309 4.091 5.454 812 HD21 ASN 113 1HD2 ASN 113 -12.607 2.522 4.973 813 HD22 ASN 113 2HD2 ASN 113 -12.264 0.921 5.527 814 H ARG 114 H ARG 114 -9.918 2.618 9.241 815 HA ARG 114 HA ARG 114 -12.363 3.086 10.810 816 HB2 ARG 114 2HB ARG 114 -10.339 0.882 10.940 817 HB3 ARG 114 1HB ARG 114 -11.792 0.986 11.909 818 HG2 ARG 114 2HG ARG 114 -13.168 0.590 10.031 819 HG3 ARG 114 1HG ARG 114 -11.812 0.819 8.912 820 HD2 ARG 114 2HD ARG 114 -11.943 -1.330 11.021 821 HD3 ARG 114 1HD ARG 114 -12.347 -1.570 9.316 822 HE ARG 114 HE ARG 114 -10.128 -1.221 8.725 823 HH11 ARG 114 1HH1 ARG 114 -10.483 -1.456 12.283 824 HH12 ARG 114 2HH1 ARG 114 -8.808 -1.487 12.569 825 HH21 ARG 114 1HH2 ARG 114 -7.915 -1.393 9.138 826 HH22 ARG 114 2HH2 ARG 114 -7.274 -1.550 10.738 827 H GLU 115 H GLU 115 -8.860 3.324 11.066 828 HA GLU 115 HA GLU 115 -9.145 3.919 13.917 829 HB2 GLU 115 2HB GLU 115 -7.028 2.112 12.730 830 HB3 GLU 115 1HB GLU 115 -7.101 2.639 14.401 831 HG2 GLU 115 2HG GLU 115 -9.258 1.462 14.645 832 HG3 GLU 115 1HG GLU 115 -9.100 0.888 12.990 833 HA PRO 116 HA PRO 116 -6.551 7.316 12.512 834 HB2 PRO 116 2HB PRO 116 -6.505 8.693 14.835 835 HB3 PRO 116 1HB PRO 116 -7.947 8.633 13.816 836 HG2 PRO 116 2HG PRO 116 -7.302 7.069 16.274 837 HG3 PRO 116 1HG PRO 116 -8.823 7.857 15.824 838 HD2 PRO 116 2HD PRO 116 -8.365 5.186 15.513 839 HD3 PRO 116 1HD PRO 116 -9.466 6.114 14.474 840 H ARG 117 H ARG 117 -5.291 4.896 13.191 841 HA ARG 117 HA ARG 117 -3.195 5.414 15.160 842 HB2 ARG 117 2HB ARG 117 -3.823 2.983 13.487 843 HB3 ARG 117 1HB ARG 117 -2.544 3.080 14.687 844 HG2 ARG 117 2HG ARG 117 -5.459 3.448 15.288 845 HG3 ARG 117 1HG ARG 117 -4.598 1.913 15.451 846 HD2 ARG 117 2HD ARG 117 -3.120 2.924 17.099 847 HD3 ARG 117 1HD ARG 117 -3.926 4.479 16.888 848 HE ARG 117 HE ARG 117 -5.946 2.857 17.526 849 HH11 ARG 117 1HH1 ARG 117 -2.783 3.251 19.086 850 HH12 ARG 117 2HH1 ARG 117 -3.407 3.049 20.651 851 HH21 ARG 117 1HH2 ARG 117 -6.767 2.670 19.663 852 HH22 ARG 117 2HH2 ARG 117 -5.709 2.821 21.003 853 H ASN 118 H ASN 118 -1.218 6.070 14.586 854 HA ASN 118 HA ASN 118 -0.515 6.359 11.809 855 HB2 ASN 118 2HB ASN 118 0.866 7.031 14.384 856 HB3 ASN 118 1HB ASN 118 1.785 7.037 12.888 857 HD21 ASN 118 1HD2 ASN 118 -1.569 7.949 12.926 858 HD22 ASN 118 2HD2 ASN 118 -1.312 9.640 12.688 859 H ALA 119 H ALA 119 0.468 4.242 14.466 860 HA ALA 119 HA ALA 119 1.721 2.550 12.430 861 HB1 ALA 119 1HB ALA 119 1.859 2.432 15.461 862 HB2 ALA 119 2HB ALA 119 3.147 2.983 14.389 863 HB3 ALA 119 3HB ALA 119 2.644 1.293 14.369 864 H GLN 120 H GLN 120 0.783 0.545 12.085 865 HA GLN 120 HA GLN 120 -1.720 0.076 13.512 866 HB2 GLN 120 2HB GLN 120 -2.335 1.424 11.617 867 HB3 GLN 120 1HB GLN 120 -1.436 0.387 10.530 868 HG2 GLN 120 2HG GLN 120 -3.734 -0.120 10.237 869 HG3 GLN 120 1HG GLN 120 -3.006 -1.455 11.110 870 HE21 GLN 120 1HE2 GLN 120 -4.875 -2.165 12.025 871 HE22 GLN 120 2HE2 GLN 120 -5.785 -1.250 13.182 872 H VAL 121 H VAL 121 -2.189 -1.988 13.787 873 HA VAL 121 HA VAL 121 -0.522 -4.033 12.591 874 HB VAL 121 HB VAL 121 -3.013 -4.356 14.326 875 HG11 VAL 121 1HG1 VAL 121 -2.457 -6.352 13.042 876 HG12 VAL 121 2HG1 VAL 121 -2.175 -6.618 14.762 877 HG13 VAL 121 3HG1 VAL 121 -0.813 -6.321 13.682 878 HG21 VAL 121 3HG2 VAL 121 -1.491 -4.756 16.219 879 HG22 VAL 121 1HG2 VAL 121 -1.311 -3.124 15.571 880 HG23 VAL 121 2HG2 VAL 121 -0.116 -4.365 15.189 881 H MET 122 H MET 122 -1.050 -4.808 10.645 882 HA MET 122 HA MET 122 -3.085 -3.681 9.101 883 HB2 MET 122 2HB MET 122 -1.273 -5.951 8.766 884 HB3 MET 122 1HB MET 122 -2.574 -5.748 7.598 885 HG2 MET 122 2HG MET 122 -0.469 -3.698 8.259 886 HG3 MET 122 1HG MET 122 -0.446 -4.763 6.852 887 HE1 MET 122 3HE MET 122 -0.141 -1.737 6.361 888 HE2 MET 122 1HE MET 122 -1.289 -1.478 5.049 889 HE3 MET 122 2HE MET 122 -0.298 -2.936 5.077 890 H GLN 123 H GLN 123 -4.916 -4.415 8.199 891 HA GLN 123 HA GLN 123 -6.027 -6.917 9.168 892 HB2 GLN 123 2HB GLN 123 -7.247 -4.972 10.193 893 HB3 GLN 123 1HB GLN 123 -7.568 -4.354 8.576 894 HG2 GLN 123 2HG GLN 123 -8.889 -6.336 8.062 895 HG3 GLN 123 1HG GLN 123 -8.544 -6.997 9.658 896 HE21 GLN 123 1HE2 GLN 123 -11.110 -6.391 8.437 897 HE22 GLN 123 2HE2 GLN 123 -11.876 -5.272 9.497 898 H THR 124 H THR 124 -6.627 -8.183 7.491 899 HA THR 124 HA THR 124 -5.776 -7.252 4.921 900 HB THR 124 HB THR 124 -6.133 -9.631 4.284 901 HG1 THR 124 1HG THR 124 -7.823 -9.835 6.014 902 HG21 THR 124 3HG2 THR 124 -4.557 -9.150 6.813 903 HG22 THR 124 1HG2 THR 124 -3.981 -8.886 5.169 904 HG23 THR 124 2HG2 THR 124 -4.344 -10.521 5.729 905 H GLY 125 H GLY 125 -7.076 -6.494 3.382 906 HA2 GLY 125 2HA GLY 125 -9.049 -6.347 2.108 907 HA3 GLY 125 1HA GLY 125 -9.905 -7.228 3.376 908 H ASP 126 H ASP 126 -7.774 -4.459 3.703 909 HA ASP 126 HA ASP 126 -10.009 -2.794 4.528 910 HB2 ASP 126 2HB ASP 126 -9.038 -4.013 6.522 911 HB3 ASP 126 1HB ASP 126 -7.503 -3.230 6.178 912 H GLU 127 H GLU 127 -8.923 -0.423 4.926 913 HA GLU 127 HA GLU 127 -6.779 -0.104 3.064 914 HB2 GLU 127 2HB GLU 127 -8.048 1.630 1.762 915 HB3 GLU 127 1HB GLU 127 -8.536 -0.039 1.522 916 HG2 GLU 127 2HG GLU 127 -10.393 0.386 3.155 917 HG3 GLU 127 1HG GLU 127 -9.957 2.092 3.079 918 H ILE 128 H ILE 128 -5.620 1.656 3.215 919 HA ILE 128 HA ILE 128 -5.992 3.245 5.652 920 HB ILE 128 HB ILE 128 -3.404 2.378 4.314 921 HG12 ILE 128 2HG1 ILE 128 -4.685 1.493 6.913 922 HG13 ILE 128 1HG1 ILE 128 -4.556 0.536 5.447 923 HG21 ILE 128 1HG2 ILE 128 -2.281 3.345 6.281 924 HG22 ILE 128 2HG2 ILE 128 -3.835 3.928 6.874 925 HG23 ILE 128 3HG2 ILE 128 -3.169 4.569 5.369 926 HD11 ILE 128 3HD1 ILE 128 -2.124 0.554 5.658 927 HD12 ILE 128 1HD1 ILE 128 -2.905 -0.139 7.080 928 HD13 ILE 128 2HD1 ILE 128 -2.265 1.505 7.133 929 H GLN 129 H GLN 129 -5.912 5.442 5.484 930 HA GLN 129 HA GLN 129 -5.746 6.464 2.780 931 HB2 GLN 129 2HB GLN 129 -7.801 7.042 3.946 932 HB3 GLN 129 1HB GLN 129 -6.887 7.690 5.300 933 HG2 GLN 129 2HG GLN 129 -6.048 9.490 3.925 934 HG3 GLN 129 1HG GLN 129 -6.824 8.804 2.505 935 HE21 GLN 129 1HE2 GLN 129 -7.096 11.402 3.827 936 HE22 GLN 129 2HE2 GLN 129 -8.780 11.608 4.156 937 H ILE 130 H ILE 130 -3.928 7.153 2.206 938 HA ILE 130 HA ILE 130 -2.073 8.316 4.104 939 HB ILE 130 HB ILE 130 -0.436 8.213 2.150 940 HG12 ILE 130 2HG1 ILE 130 -2.597 6.473 0.898 941 HG13 ILE 130 1HG1 ILE 130 -2.097 8.050 0.310 942 HG21 ILE 130 1HG2 ILE 130 -0.340 6.588 3.921 943 HG22 ILE 130 2HG2 ILE 130 -0.016 5.796 2.377 944 HG23 ILE 130 3HG2 ILE 130 -1.594 5.620 3.144 945 HD11 ILE 130 3HD1 ILE 130 -0.387 5.569 0.403 946 HD12 ILE 130 1HD1 ILE 130 0.125 7.151 -0.185 947 HD13 ILE 130 2HD1 ILE 130 -1.143 6.266 -1.031 948 H GLY 131 H GLY 131 -2.703 10.295 4.448 949 HA2 GLY 131 2HA GLY 131 -2.947 12.529 4.043 950 HA3 GLY 131 1HA GLY 131 -2.556 12.233 2.346 951 H LYS 132 H LYS 132 -4.130 12.001 0.925 952 HA LYS 132 HA LYS 132 -6.915 11.986 1.903 953 HB2 LYS 132 2HB LYS 132 -5.756 13.601 -0.369 954 HB3 LYS 132 1HB LYS 132 -7.474 13.451 -0.056 955 HG2 LYS 132 2HG LYS 132 -5.490 14.577 1.906 956 HG3 LYS 132 1HG LYS 132 -6.428 15.561 0.782 957 HD2 LYS 132 2HD LYS 132 -7.598 13.724 2.885 958 HD3 LYS 132 1HD LYS 132 -7.364 15.457 3.091 959 HE2 LYS 132 2HE LYS 132 -9.119 14.128 1.016 960 HE3 LYS 132 1HE LYS 132 -9.658 14.959 2.469 961 HZ1 LYS 132 3HZ LYS 132 -8.677 17.000 1.623 962 HZ2 LYS 132 1HZ LYS 132 -9.831 16.415 0.551 963 HZ3 LYS 132 2HZ LYS 132 -8.199 16.228 0.210 964 H PHE 133 H PHE 133 -4.805 10.086 0.626 965 HA PHE 133 HA PHE 133 -6.548 9.137 -1.517 966 HB2 PHE 133 2HB PHE 133 -3.526 9.039 -1.424 967 HB3 PHE 133 1HB PHE 133 -4.547 8.426 -2.732 968 HD1 PHE 133 1HD PHE 133 -6.288 10.190 -3.666 969 HD2 PHE 133 2HD PHE 133 -2.659 11.179 -1.675 970 HE1 PHE 133 1HE PHE 133 -6.359 12.430 -4.665 971 HE2 PHE 133 2HE PHE 133 -2.718 13.422 -2.678 972 HZ PHE 133 HZ PHE 133 -4.575 14.056 -4.170 973 H ARG 134 H ARG 134 -6.318 6.717 -1.889 974 HA ARG 134 HA ARG 134 -5.926 5.532 0.753 975 HB2 ARG 134 2HB ARG 134 -8.028 4.274 0.570 976 HB3 ARG 134 1HB ARG 134 -8.261 6.010 0.637 977 HG2 ARG 134 2HG ARG 134 -8.534 5.996 -1.846 978 HG3 ARG 134 1HG ARG 134 -8.500 4.231 -1.778 979 HD2 ARG 134 2HD ARG 134 -10.790 4.950 -1.806 980 HD3 ARG 134 1HD ARG 134 -10.428 4.319 -0.204 981 HE ARG 134 HE ARG 134 -10.052 7.139 -0.432 982 HH11 ARG 134 1HH1 ARG 134 -12.457 4.607 0.284 983 HH12 ARG 134 2HH1 ARG 134 -13.504 5.664 1.112 984 HH21 ARG 134 1HH2 ARG 134 -11.593 8.592 0.691 985 HH22 ARG 134 2HH2 ARG 134 -13.027 7.923 1.304 986 H LEU 135 H LEU 135 -5.031 3.705 0.930 987 HA LEU 135 HA LEU 135 -4.412 2.118 -1.455 988 HB2 LEU 135 2HB LEU 135 -2.462 3.259 -0.522 989 HB3 LEU 135 1HB LEU 135 -2.845 2.686 1.076 990 HG LEU 135 HG LEU 135 -2.051 0.748 -1.109 991 HD11 LEU 135 1HD1 LEU 135 -0.245 2.294 0.755 992 HD12 LEU 135 2HD1 LEU 135 -0.317 2.473 -1.000 993 HD13 LEU 135 3HD1 LEU 135 0.257 0.965 -0.288 994 HD21 LEU 135 3HD2 LEU 135 -2.966 -0.218 0.958 995 HD22 LEU 135 1HD2 LEU 135 -1.813 0.718 1.912 996 HD23 LEU 135 2HD2 LEU 135 -1.236 -0.549 0.843 997 H VAL 136 H VAL 136 -4.909 -0.038 -1.347 998 HA VAL 136 HA VAL 136 -6.413 -0.941 1.020 999 HB VAL 136 HB VAL 136 -6.486 -2.039 -1.801 1000 HG11 VAL 136 1HG1 VAL 136 -7.189 -3.635 -0.128 1001 HG12 VAL 136 2HG1 VAL 136 -8.562 -3.127 -1.105 1002 HG13 VAL 136 3HG1 VAL 136 -8.348 -2.475 0.521 1003 HG21 VAL 136 3HG2 VAL 136 -8.425 -0.102 -0.532 1004 HG22 VAL 136 1HG2 VAL 136 -8.621 -0.872 -2.105 1005 HG23 VAL 136 2HG2 VAL 136 -7.296 0.262 -1.835 1006 H PHE 137 H PHE 137 -5.793 -2.852 1.973 1007 HA PHE 137 HA PHE 137 -3.370 -4.123 0.882 1008 HB2 PHE 137 2HB PHE 137 -3.098 -2.867 3.036 1009 HB3 PHE 137 1HB PHE 137 -4.237 -3.984 3.774 1010 HD1 PHE 137 1HD PHE 137 -0.916 -3.657 2.244 1011 HD2 PHE 137 2HD PHE 137 -3.550 -6.155 4.461 1012 HE1 PHE 137 1HE PHE 137 0.952 -5.149 2.761 1013 HE2 PHE 137 2HE PHE 137 -1.677 -7.661 4.983 1014 HZ PHE 137 HZ PHE 137 0.574 -7.156 4.134 1015 H LEU 138 H LEU 138 -3.547 -6.225 0.348 1016 HA LEU 138 HA LEU 138 -5.787 -7.806 1.445 1017 HB2 LEU 138 2HB LEU 138 -4.949 -7.572 -1.440 1018 HB3 LEU 138 1HB LEU 138 -6.048 -8.796 -0.841 1019 HG LEU 138 HG LEU 138 -6.581 -5.863 -0.558 1020 HD11 LEU 138 1HD1 LEU 138 -7.474 -7.749 -2.759 1021 HD12 LEU 138 2HD1 LEU 138 -6.362 -6.394 -2.954 1022 HD13 LEU 138 3HD1 LEU 138 -8.050 -6.097 -2.548 1023 HD21 LEU 138 3HD2 LEU 138 -8.406 -8.258 -0.518 1024 HD22 LEU 138 1HD2 LEU 138 -8.888 -6.582 -0.267 1025 HD23 LEU 138 2HD2 LEU 138 -7.831 -7.389 0.902 1026 H ALA 139 H ALA 139 -5.295 -9.880 1.883 1027 HA ALA 139 HA ALA 139 -2.494 -10.756 1.459 1028 HB1 ALA 139 1HB ALA 139 -4.556 -11.739 3.450 1029 HB2 ALA 139 2HB ALA 139 -3.189 -10.678 3.805 1030 HB3 ALA 139 3HB ALA 139 -2.905 -12.345 3.308 1031 H GLY 140 H GLY 140 -4.130 -10.840 -0.590 1032 HA2 GLY 140 2HA GLY 140 -5.637 -13.250 -0.856 1033 HA3 GLY 140 1HA GLY 140 -5.349 -12.064 -2.103 1034 HA PRO 141 HA PRO 141 -2.484 -14.492 -4.156 1035 HB2 PRO 141 2HB PRO 141 0.059 -13.258 -3.808 1036 HB3 PRO 141 1HB PRO 141 -1.041 -13.171 -5.183 1037 HG2 PRO 141 2HG PRO 141 -0.521 -11.033 -3.536 1038 HG3 PRO 141 1HG PRO 141 -2.024 -11.231 -4.450 1039 HD2 PRO 141 2HD PRO 141 -1.465 -11.837 -1.573 1040 HD3 PRO 141 1HD PRO 141 -2.910 -11.098 -2.289 1041 H ALA 142 H ALA 142 -1.999 -16.379 -3.738 1042 HA ALA 142 HA ALA 142 0.093 -17.082 -1.814 1043 HB1 ALA 142 1HB ALA 142 -2.176 -18.740 -2.949 1044 HB2 ALA 142 2HB ALA 142 -2.071 -18.128 -1.296 1045 HB3 ALA 142 3HB ALA 142 -0.924 -19.343 -1.864 1046 H GLU 143 H GLU 143 1.965 -17.825 -2.778 1047 HA GLU 143 HA GLU 143 2.161 -17.675 -5.510 1048 HB2 GLU 143 2HB GLU 143 4.454 -18.339 -5.223 1049 HB3 GLU 143 1HB GLU 143 4.014 -17.118 -4.062 1050 HG2 GLU 143 2HG GLU 143 4.472 -20.052 -3.544 1051 HG3 GLU 143 1HG GLU 143 5.519 -18.732 -3.070 Start of MODEL 16 1 H1 MET 1 1HT MET 1 -41.953 -21.198 -62.897 2 H2 MET 1 2HT MET 1 -41.280 -20.231 -64.067 3 H3 MET 1 3HT MET 1 -41.955 -19.514 -62.704 4 HA MET 1 HA MET 1 -39.515 -19.548 -62.605 5 HB2 MET 1 2HB MET 1 -40.808 -21.570 -60.746 6 HB3 MET 1 1HB MET 1 -39.216 -20.878 -60.516 7 HG2 MET 1 2HG MET 1 -41.803 -19.348 -60.519 8 HG3 MET 1 1HG MET 1 -40.895 -19.834 -59.089 9 HE1 MET 1 2HE MET 1 -41.811 -16.859 -59.622 10 HE2 MET 1 3HE MET 1 -40.353 -15.966 -59.180 11 HE3 MET 1 1HE MET 1 -40.873 -17.346 -58.209 12 H SER 2 H SER 2 -37.600 -21.147 -62.229 13 HA SER 2 HA SER 2 -37.652 -22.994 -64.350 14 HB2 SER 2 2HB SER 2 -35.390 -23.672 -63.450 15 HB3 SER 2 1HB SER 2 -35.538 -21.957 -63.793 16 HG SER 2 HG SER 2 -35.282 -21.522 -61.747 17 H ASP 3 H ASP 3 -38.103 -23.141 -60.933 18 HA ASP 3 HA ASP 3 -39.399 -24.416 -59.656 19 HB2 ASP 3 2HB ASP 3 -40.769 -24.663 -61.824 20 HB3 ASP 3 1HB ASP 3 -40.040 -26.256 -61.946 21 H ASN 4 H ASN 4 -37.591 -26.445 -61.891 22 HA ASN 4 HA ASN 4 -37.000 -28.297 -59.742 23 HB2 ASN 4 2HB ASN 4 -36.113 -28.264 -62.624 24 HB3 ASN 4 1HB ASN 4 -35.587 -29.473 -61.462 25 HD21 ASN 4 1HD2 ASN 4 -37.074 -30.991 -60.728 26 HD22 ASN 4 2HD2 ASN 4 -38.578 -31.263 -61.518 27 H ASN 5 H ASN 5 -35.674 -27.563 -58.321 28 HA ASN 5 HA ASN 5 -32.972 -27.062 -58.995 29 HB2 ASN 5 2HB ASN 5 -32.779 -24.837 -57.999 30 HB3 ASN 5 1HB ASN 5 -33.930 -24.755 -59.319 31 HD21 ASN 5 1HD2 ASN 5 -33.484 -24.525 -55.868 32 HD22 ASN 5 2HD2 ASN 5 -35.049 -23.915 -55.519 33 H GLY 6 H GLY 6 -31.716 -27.210 -57.095 34 HA2 GLY 6 2HA GLY 6 -33.142 -28.606 -54.983 35 HA3 GLY 6 1HA GLY 6 -31.392 -28.503 -55.168 36 H THR 7 H THR 7 -32.534 -28.078 -52.704 37 HA THR 7 HA THR 7 -32.793 -25.274 -52.303 38 HB THR 7 HB THR 7 -32.833 -26.072 -49.876 39 HG1 THR 7 1HG THR 7 -31.976 -28.031 -49.787 40 HG21 THR 7 3HG2 THR 7 -34.891 -25.625 -51.154 41 HG22 THR 7 1HG2 THR 7 -35.104 -27.004 -50.077 42 HG23 THR 7 2HG2 THR 7 -34.843 -27.262 -51.804 43 HA PRO 8 HA PRO 8 -28.343 -24.853 -51.631 44 HB2 PRO 8 2HB PRO 8 -29.111 -22.415 -50.137 45 HB3 PRO 8 1HB PRO 8 -28.045 -22.563 -51.539 46 HG2 PRO 8 2HG PRO 8 -30.468 -21.455 -51.776 47 HG3 PRO 8 1HG PRO 8 -29.798 -22.488 -53.047 48 HD2 PRO 8 2HD PRO 8 -31.825 -23.167 -50.947 49 HD3 PRO 8 1HD PRO 8 -31.789 -23.588 -52.677 50 H GLU 9 H GLU 9 -27.332 -25.798 -49.998 51 HA GLU 9 HA GLU 9 -28.846 -26.158 -47.565 52 HB2 GLU 9 2HB GLU 9 -26.527 -27.660 -48.711 53 HB3 GLU 9 1HB GLU 9 -27.169 -27.965 -47.103 54 HG2 GLU 9 2HG GLU 9 -28.682 -28.188 -49.691 55 HG3 GLU 9 1HG GLU 9 -28.099 -29.530 -48.701 56 HA PRO 10 HA PRO 10 -26.132 -23.347 -45.368 57 HB2 PRO 10 2HB PRO 10 -27.742 -24.329 -43.090 58 HB3 PRO 10 1HB PRO 10 -27.503 -22.669 -43.641 59 HG2 PRO 10 2HG PRO 10 -29.849 -23.916 -43.972 60 HG3 PRO 10 1HG PRO 10 -29.211 -22.793 -45.188 61 HD2 PRO 10 2HD PRO 10 -29.220 -25.784 -45.192 62 HD3 PRO 10 1HD PRO 10 -29.533 -24.637 -46.515 63 H GLN 11 H GLN 11 -24.358 -23.827 -44.164 64 HA GLN 11 HA GLN 11 -24.108 -26.322 -42.835 65 HB2 GLN 11 2HB GLN 11 -22.023 -26.922 -44.194 66 HB3 GLN 11 1HB GLN 11 -23.565 -27.152 -44.997 67 HG2 GLN 11 2HG GLN 11 -23.132 -24.792 -45.970 68 HG3 GLN 11 1HG GLN 11 -21.460 -25.091 -45.496 69 HE21 GLN 11 1HE2 GLN 11 -24.035 -25.967 -47.601 70 HE22 GLN 11 2HE2 GLN 11 -23.114 -26.938 -48.695 71 H VAL 12 H VAL 12 -23.591 -25.534 -41.019 72 HA VAL 12 HA VAL 12 -22.349 -23.030 -40.638 73 HB VAL 12 HB VAL 12 -22.961 -25.169 -38.598 74 HG11 VAL 12 1HG1 VAL 12 -22.443 -22.216 -38.232 75 HG12 VAL 12 2HG1 VAL 12 -21.374 -23.536 -37.745 76 HG13 VAL 12 3HG1 VAL 12 -22.942 -23.339 -36.967 77 HG21 VAL 12 3HG2 VAL 12 -24.610 -22.810 -39.491 78 HG22 VAL 12 1HG2 VAL 12 -25.006 -23.895 -38.160 79 HG23 VAL 12 2HG2 VAL 12 -24.958 -24.511 -39.812 80 H GLU 13 H GLU 13 -20.342 -22.651 -40.760 81 HA GLU 13 HA GLU 13 -18.368 -24.666 -40.065 82 HB2 GLU 13 2HB GLU 13 -16.760 -22.964 -40.959 83 HB3 GLU 13 1HB GLU 13 -17.937 -23.515 -42.146 84 HG2 GLU 13 2HG GLU 13 -19.260 -21.483 -41.713 85 HG3 GLU 13 1HG GLU 13 -17.998 -20.930 -40.615 86 H THR 14 H THR 14 -17.112 -24.447 -38.226 87 HA THR 14 HA THR 14 -17.340 -22.059 -36.651 88 HB THR 14 HB THR 14 -19.363 -23.136 -35.938 89 HG1 THR 14 1HG THR 14 -18.884 -22.707 -33.972 90 HG21 THR 14 3HG2 THR 14 -19.427 -25.431 -35.052 91 HG22 THR 14 1HG2 THR 14 -17.727 -25.636 -35.479 92 HG23 THR 14 2HG2 THR 14 -18.931 -25.398 -36.745 93 H THR 15 H THR 15 -15.810 -21.951 -35.048 94 HA THR 15 HA THR 15 -13.914 -24.156 -34.905 95 HB THR 15 HB THR 15 -13.289 -21.199 -34.588 96 HG1 THR 15 1HG THR 15 -13.847 -22.422 -36.724 97 HG21 THR 15 3HG2 THR 15 -11.776 -22.728 -33.365 98 HG22 THR 15 1HG2 THR 15 -10.949 -21.957 -34.718 99 HG23 THR 15 2HG2 THR 15 -11.494 -23.628 -34.855 100 H SER 16 H SER 16 -15.229 -24.963 -33.222 101 HA SER 16 HA SER 16 -15.625 -23.364 -30.871 102 HB2 SER 16 2HB SER 16 -16.159 -26.319 -31.301 103 HB3 SER 16 1HB SER 16 -16.774 -25.325 -29.981 104 HG SER 16 HG SER 16 -17.346 -24.298 -32.470 105 H VAL 17 H VAL 17 -13.753 -22.897 -29.911 106 HA VAL 17 HA VAL 17 -12.203 -25.096 -28.851 107 HB VAL 17 HB VAL 17 -10.975 -24.335 -30.856 108 HG11 VAL 17 1HG1 VAL 17 -11.771 -22.069 -31.044 109 HG12 VAL 17 2HG1 VAL 17 -10.007 -22.090 -31.012 110 HG13 VAL 17 3HG1 VAL 17 -10.909 -21.611 -29.577 111 HG21 VAL 17 3HG2 VAL 17 -8.791 -23.811 -29.820 112 HG22 VAL 17 1HG2 VAL 17 -9.630 -25.132 -29.005 113 HG23 VAL 17 2HG2 VAL 17 -9.613 -23.520 -28.287 114 H PHE 18 H PHE 18 -11.541 -24.743 -26.801 115 HA PHE 18 HA PHE 18 -12.669 -22.395 -25.502 116 HB2 PHE 18 2HB PHE 18 -11.499 -24.921 -24.308 117 HB3 PHE 18 1HB PHE 18 -12.366 -23.672 -23.428 118 HD1 PHE 18 2HD PHE 18 -14.796 -23.168 -24.441 119 HD2 PHE 18 1HD PHE 18 -12.657 -26.817 -24.898 120 HE1 PHE 18 2HE PHE 18 -16.903 -24.345 -24.908 121 HE2 PHE 18 1HE PHE 18 -14.758 -27.994 -25.372 122 HZ PHE 18 HZ PHE 18 -16.890 -26.754 -25.371 123 H ARG 19 H ARG 19 -11.300 -21.418 -23.737 124 HA ARG 19 HA ARG 19 -8.546 -21.197 -24.740 125 HB2 ARG 19 2HB ARG 19 -9.938 -19.409 -22.772 126 HB3 ARG 19 1HB ARG 19 -8.386 -19.142 -23.523 127 HG2 ARG 19 2HG ARG 19 -9.528 -18.933 -25.696 128 HG3 ARG 19 1HG ARG 19 -11.077 -19.079 -24.856 129 HD2 ARG 19 2HD ARG 19 -9.025 -16.894 -24.690 130 HD3 ARG 19 1HD ARG 19 -10.748 -16.783 -25.061 131 HE ARG 19 HE ARG 19 -9.773 -17.528 -22.387 132 HH11 ARG 19 1HH1 ARG 19 -11.957 -15.562 -24.389 133 HH12 ARG 19 2HH1 ARG 19 -12.614 -14.758 -23.034 134 HH21 ARG 19 1HH2 ARG 19 -10.631 -16.438 -20.654 135 HH22 ARG 19 2HH2 ARG 19 -11.855 -15.235 -20.867 136 H ALA 20 H ALA 20 -6.941 -21.954 -23.537 137 HA ALA 20 HA ALA 20 -7.518 -22.950 -20.901 138 HB1 ALA 20 1HB ALA 20 -5.958 -24.196 -22.353 139 HB2 ALA 20 2HB ALA 20 -5.145 -23.642 -20.890 140 HB3 ALA 20 3HB ALA 20 -4.893 -22.790 -22.414 141 H ASP 21 H ASP 21 -8.016 -21.216 -19.652 142 HA ASP 21 HA ASP 21 -6.499 -18.775 -19.796 143 HB2 ASP 21 2HB ASP 21 -8.688 -19.594 -17.860 144 HB3 ASP 21 1HB ASP 21 -7.958 -18.007 -17.948 145 H LEU 22 H LEU 22 -7.120 -21.245 -17.359 146 HA LEU 22 HA LEU 22 -6.137 -21.822 -15.454 147 HB2 LEU 22 2HB LEU 22 -3.624 -21.113 -16.978 148 HB3 LEU 22 1HB LEU 22 -3.591 -21.787 -15.368 149 HG LEU 22 HG LEU 22 -3.124 -23.544 -16.854 150 HD11 LEU 22 1HD1 LEU 22 -4.912 -25.124 -16.499 151 HD12 LEU 22 2HD1 LEU 22 -5.991 -23.809 -16.049 152 HD13 LEU 22 3HD1 LEU 22 -4.573 -24.167 -15.057 153 HD21 LEU 22 3HD2 LEU 22 -4.571 -24.204 -18.717 154 HD22 LEU 22 1HD2 LEU 22 -3.920 -22.579 -18.933 155 HD23 LEU 22 2HD2 LEU 22 -5.590 -22.795 -18.409 156 H LEU 23 H LEU 23 -7.318 -19.898 -14.765 157 HA LEU 23 HA LEU 23 -5.620 -17.742 -13.899 158 HB2 LEU 23 2HB LEU 23 -8.569 -18.208 -13.460 159 HB3 LEU 23 1HB LEU 23 -7.703 -16.739 -13.067 160 HG LEU 23 HG LEU 23 -8.102 -17.827 -15.855 161 HD11 LEU 23 1HD1 LEU 23 -9.385 -15.475 -14.482 162 HD12 LEU 23 2HD1 LEU 23 -10.171 -16.996 -14.884 163 HD13 LEU 23 3HD1 LEU 23 -9.599 -15.930 -16.170 164 HD21 LEU 23 3HD2 LEU 23 -6.866 -15.241 -14.912 165 HD22 LEU 23 1HD2 LEU 23 -7.207 -15.660 -16.591 166 HD23 LEU 23 2HD2 LEU 23 -6.025 -16.591 -15.678 167 H LYS 24 H LYS 24 -5.092 -17.345 -11.789 168 HA LYS 24 HA LYS 24 -5.912 -19.382 -9.847 169 HB2 LYS 24 2HB LYS 24 -3.699 -19.463 -8.821 170 HB3 LYS 24 1HB LYS 24 -3.549 -19.864 -10.512 171 HG2 LYS 24 2HG LYS 24 -2.840 -17.190 -9.281 172 HG3 LYS 24 1HG LYS 24 -1.689 -18.473 -9.612 173 HD2 LYS 24 2HD LYS 24 -3.341 -16.987 -11.640 174 HD3 LYS 24 1HD LYS 24 -1.632 -16.717 -11.312 175 HE2 LYS 24 2HE LYS 24 -1.126 -19.002 -12.067 176 HE3 LYS 24 1HE LYS 24 -2.841 -19.275 -12.373 177 HZ1 LYS 24 3HZ LYS 24 -2.786 -17.536 -14.040 178 HZ2 LYS 24 1HZ LYS 24 -1.675 -18.750 -14.397 179 HZ3 LYS 24 2HZ LYS 24 -1.149 -17.268 -13.760 180 H GLU 25 H GLU 25 -7.092 -16.957 -10.358 181 HA GLU 25 HA GLU 25 -6.230 -14.961 -8.509 182 HB2 GLU 25 2HB GLU 25 -7.504 -14.485 -10.625 183 HB3 GLU 25 1HB GLU 25 -8.899 -15.265 -9.904 184 HG2 GLU 25 2HG GLU 25 -8.870 -13.571 -8.106 185 HG3 GLU 25 1HG GLU 25 -7.543 -12.763 -8.939 186 H MET 26 H MET 26 -6.270 -15.548 -6.455 187 HA MET 26 HA MET 26 -8.747 -16.690 -5.343 188 HB2 MET 26 2HB MET 26 -5.937 -17.003 -4.283 189 HB3 MET 26 1HB MET 26 -7.390 -17.706 -3.612 190 HG2 MET 26 2HG MET 26 -7.602 -19.165 -5.522 191 HG3 MET 26 1HG MET 26 -6.201 -18.402 -6.281 192 HE1 MET 26 3HE MET 26 -4.746 -21.884 -5.294 193 HE2 MET 26 1HE MET 26 -4.976 -20.710 -6.588 194 HE3 MET 26 2HE MET 26 -6.369 -21.533 -5.890 195 H GLU 27 H GLU 27 -9.702 -15.126 -4.132 196 HA GLU 27 HA GLU 27 -7.926 -13.660 -2.399 197 HB2 GLU 27 2HB GLU 27 -9.214 -11.533 -2.717 198 HB3 GLU 27 1HB GLU 27 -8.241 -12.017 -4.086 199 HG2 GLU 27 2HG GLU 27 -10.330 -11.076 -4.839 200 HG3 GLU 27 1HG GLU 27 -10.280 -12.781 -5.241 201 H SER 28 H SER 28 -8.916 -12.693 -0.602 202 HA SER 28 HA SER 28 -11.582 -13.593 0.001 203 HB2 SER 28 2HB SER 28 -10.018 -15.237 1.084 204 HB3 SER 28 1HB SER 28 -9.233 -13.898 1.915 205 HG SER 28 HG SER 28 -11.787 -15.002 2.283 206 H SER 29 H SER 29 -11.756 -11.360 -0.741 207 HA SER 29 HA SER 29 -10.670 -9.342 0.910 208 HB2 SER 29 2HB SER 29 -11.348 -8.941 -1.468 209 HB3 SER 29 1HB SER 29 -13.033 -9.121 -0.982 210 HG SER 29 HG SER 29 -13.010 -7.194 -0.182 211 H THR 30 H THR 30 -11.122 -9.921 2.931 212 HA THR 30 HA THR 30 -13.826 -9.437 3.878 213 HB THR 30 HB THR 30 -13.066 -11.132 5.711 214 HG1 THR 30 1HG THR 30 -11.586 -12.333 3.638 215 HG21 THR 30 3HG2 THR 30 -13.925 -13.041 4.425 216 HG22 THR 30 1HG2 THR 30 -13.720 -12.124 2.937 217 HG23 THR 30 2HG2 THR 30 -14.903 -11.599 4.142 218 H GLY 31 H GLY 31 -13.772 -7.813 5.353 219 HA2 GLY 31 2HA GLY 31 -11.256 -6.671 6.190 220 HA3 GLY 31 1HA GLY 31 -12.865 -6.094 6.612 221 H THR 32 H THR 32 -10.779 -8.841 7.182 222 HA THR 32 HA THR 32 -11.954 -9.276 9.835 223 HB THR 32 HB THR 32 -9.934 -10.976 8.370 224 HG1 THR 32 1HG THR 32 -12.702 -10.696 8.095 225 HG21 THR 32 3HG2 THR 32 -10.279 -11.486 10.764 226 HG22 THR 32 1HG2 THR 32 -10.892 -12.787 9.740 227 HG23 THR 32 2HG2 THR 32 -12.013 -11.643 10.476 228 H ALA 33 H ALA 33 -10.699 -9.064 11.693 229 HA ALA 33 HA ALA 33 -8.219 -7.684 11.572 230 HB1 ALA 33 1HB ALA 33 -9.629 -9.111 13.843 231 HB2 ALA 33 2HB ALA 33 -9.735 -7.390 13.472 232 HB3 ALA 33 3HB ALA 33 -8.211 -8.079 14.032 233 HA PRO 34 HA PRO 34 -6.388 -11.719 10.864 234 HB2 PRO 34 2HB PRO 34 -3.935 -10.606 10.080 235 HB3 PRO 34 1HB PRO 34 -5.242 -11.131 9.024 236 HG2 PRO 34 2HG PRO 34 -4.419 -8.475 9.329 237 HG3 PRO 34 1HG PRO 34 -5.977 -9.002 8.678 238 HD2 PRO 34 2HD PRO 34 -5.293 -8.062 11.429 239 HD3 PRO 34 1HD PRO 34 -6.742 -7.765 10.438 240 H ALA 35 H ALA 35 -4.274 -12.742 11.271 241 HA ALA 35 HA ALA 35 -2.648 -11.761 13.389 242 HB1 ALA 35 1HB ALA 35 -4.460 -12.862 14.664 243 HB2 ALA 35 2HB ALA 35 -2.961 -13.768 14.781 244 HB3 ALA 35 3HB ALA 35 -4.240 -14.325 13.702 245 H SER 36 H SER 36 -0.921 -13.544 13.676 246 HA SER 36 HA SER 36 0.137 -14.111 11.134 247 HB2 SER 36 2HB SER 36 0.961 -15.303 13.783 248 HB3 SER 36 1HB SER 36 1.948 -15.076 12.337 249 HG SER 36 HG SER 36 1.110 -12.695 12.802 250 H THR 37 H THR 37 -1.123 -15.428 9.940 251 HA THR 37 HA THR 37 -2.492 -17.683 10.980 252 HB THR 37 HB THR 37 -2.071 -16.817 8.114 253 HG1 THR 37 1HG THR 37 -3.189 -15.513 10.054 254 HG21 THR 37 3HG2 THR 37 -4.255 -18.458 9.421 255 HG22 THR 37 1HG2 THR 37 -2.988 -19.104 8.379 256 HG23 THR 37 2HG2 THR 37 -4.198 -18.000 7.719 257 H GLY 38 H GLY 38 -1.182 -19.262 11.661 258 HA2 GLY 38 2HA GLY 38 0.244 -21.063 11.582 259 HA3 GLY 38 1HA GLY 38 0.063 -21.000 9.834 260 H ALA 39 H ALA 39 1.588 -18.984 12.319 261 HA ALA 39 HA ALA 39 3.551 -17.890 10.610 262 HB1 ALA 39 1HB ALA 39 3.648 -18.146 13.613 263 HB2 ALA 39 2HB ALA 39 2.832 -16.860 12.732 264 HB3 ALA 39 3HB ALA 39 4.587 -17.026 12.622 265 H GLU 40 H GLU 40 3.579 -20.690 12.720 266 HA GLU 40 HA GLU 40 6.375 -21.159 12.225 267 HB2 GLU 40 2HB GLU 40 6.101 -23.151 13.620 268 HB3 GLU 40 1HB GLU 40 5.472 -21.712 14.400 269 HG2 GLU 40 2HG GLU 40 3.195 -22.402 13.730 270 HG3 GLU 40 1HG GLU 40 3.882 -23.893 13.085 271 H ASN 41 H ASN 41 3.442 -22.036 10.763 272 HA ASN 41 HA ASN 41 4.510 -24.355 9.354 273 HB2 ASN 41 2HB ASN 41 1.939 -22.815 8.833 274 HB3 ASN 41 1HB ASN 41 2.365 -24.357 8.117 275 HD21 ASN 41 1HD2 ASN 41 0.025 -23.680 9.655 276 HD22 ASN 41 2HD2 ASN 41 0.017 -24.729 11.014 277 H LEU 42 H LEU 42 3.856 -21.023 8.904 278 HA LEU 42 HA LEU 42 4.135 -19.479 7.422 279 HB2 LEU 42 2HB LEU 42 6.488 -20.266 8.156 280 HB3 LEU 42 1HB LEU 42 6.594 -20.887 6.527 281 HG LEU 42 HG LEU 42 7.737 -18.720 6.691 282 HD11 LEU 42 1HD1 LEU 42 6.626 -17.383 4.996 283 HD12 LEU 42 2HD1 LEU 42 5.181 -18.382 5.154 284 HD13 LEU 42 3HD1 LEU 42 6.682 -19.091 4.560 285 HD21 LEU 42 3HD2 LEU 42 5.112 -17.636 7.674 286 HD22 LEU 42 1HD2 LEU 42 6.549 -16.686 7.307 287 HD23 LEU 42 2HD2 LEU 42 6.581 -17.858 8.623 288 HA PRO 43 HA PRO 43 2.639 -21.599 3.690 289 HB2 PRO 43 2HB PRO 43 0.099 -20.288 4.013 290 HB3 PRO 43 1HB PRO 43 0.441 -22.006 4.202 291 HG2 PRO 43 2HG PRO 43 -0.306 -20.324 6.273 292 HG3 PRO 43 1HG PRO 43 0.568 -21.852 6.481 293 HD2 PRO 43 2HD PRO 43 1.633 -19.052 6.426 294 HD3 PRO 43 1HD PRO 43 2.094 -20.413 7.476 295 H ALA 44 H ALA 44 1.005 -18.563 4.411 296 HA ALA 44 HA ALA 44 2.719 -17.041 2.701 297 HB1 ALA 44 1HB ALA 44 0.827 -16.176 1.365 298 HB2 ALA 44 2HB ALA 44 -0.248 -17.330 2.151 299 HB3 ALA 44 3HB ALA 44 1.049 -17.908 1.106 300 H GLY 45 H GLY 45 3.228 -15.636 4.296 301 HA2 GLY 45 2HA GLY 45 1.041 -14.593 5.963 302 HA3 GLY 45 1HA GLY 45 2.758 -14.521 6.358 303 H SER 46 H SER 46 1.384 -13.825 3.274 304 HA SER 46 HA SER 46 1.909 -10.987 3.610 305 HB2 SER 46 2HB SER 46 2.778 -12.679 1.259 306 HB3 SER 46 1HB SER 46 3.073 -10.951 1.480 307 HG SER 46 HG SER 46 3.927 -12.084 3.647 308 H ALA 47 H ALA 47 0.828 -9.790 1.726 309 HA ALA 47 HA ALA 47 -1.280 -11.189 0.388 310 HB1 ALA 47 1HB ALA 47 -2.325 -10.648 2.549 311 HB2 ALA 47 2HB ALA 47 -3.038 -9.685 1.254 312 HB3 ALA 47 3HB ALA 47 -1.865 -8.956 2.350 313 H LEU 48 H LEU 48 -2.640 -8.913 -0.578 314 HA LEU 48 HA LEU 48 -0.422 -7.460 -1.739 315 HB2 LEU 48 2HB LEU 48 -1.396 -7.496 -3.982 316 HB3 LEU 48 1HB LEU 48 -1.038 -9.100 -3.418 317 HG LEU 48 HG LEU 48 -3.000 -9.216 -4.714 318 HD11 LEU 48 1HD1 LEU 48 -4.720 -10.075 -3.265 319 HD12 LEU 48 2HD1 LEU 48 -3.871 -9.414 -1.872 320 HD13 LEU 48 3HD1 LEU 48 -3.110 -10.666 -2.855 321 HD21 LEU 48 3HD2 LEU 48 -5.065 -7.938 -4.291 322 HD22 LEU 48 1HD2 LEU 48 -3.707 -6.908 -4.744 323 HD23 LEU 48 2HD2 LEU 48 -4.212 -7.013 -3.057 324 H LEU 49 H LEU 49 -0.849 -5.421 -2.550 325 HA LEU 49 HA LEU 49 -3.310 -4.268 -1.552 326 HB2 LEU 49 2HB LEU 49 -1.928 -2.208 -1.020 327 HB3 LEU 49 1HB LEU 49 -1.878 -3.521 0.125 328 HG LEU 49 HG LEU 49 0.354 -4.156 -1.011 329 HD11 LEU 49 1HD1 LEU 49 0.094 -1.356 -2.075 330 HD12 LEU 49 2HD1 LEU 49 0.199 -2.847 -3.009 331 HD13 LEU 49 3HD1 LEU 49 1.575 -2.309 -2.045 332 HD21 LEU 49 3HD2 LEU 49 1.606 -2.532 0.344 333 HD22 LEU 49 1HD2 LEU 49 0.242 -3.225 1.220 334 HD23 LEU 49 2HD2 LEU 49 0.134 -1.594 0.561 335 H VAL 50 H VAL 50 -4.162 -2.601 -2.679 336 HA VAL 50 HA VAL 50 -2.811 -1.904 -5.166 337 HB VAL 50 HB VAL 50 -4.916 -1.962 -6.442 338 HG11 VAL 50 1HG1 VAL 50 -3.538 -3.948 -6.505 339 HG12 VAL 50 2HG1 VAL 50 -5.246 -4.365 -6.638 340 HG13 VAL 50 3HG1 VAL 50 -4.395 -4.609 -5.113 341 HG21 VAL 50 3HG2 VAL 50 -6.172 -3.157 -3.974 342 HG22 VAL 50 1HG2 VAL 50 -6.943 -3.027 -5.553 343 HG23 VAL 50 2HG2 VAL 50 -6.521 -1.569 -4.654 344 H VAL 51 H VAL 51 -3.082 0.155 -5.809 345 HA VAL 51 HA VAL 51 -4.344 1.968 -3.849 346 HB VAL 51 HB VAL 51 -2.528 2.632 -6.201 347 HG11 VAL 51 1HG1 VAL 51 -2.400 4.871 -5.196 348 HG12 VAL 51 2HG1 VAL 51 -3.546 4.377 -3.951 349 HG13 VAL 51 3HG1 VAL 51 -4.060 4.465 -5.634 350 HG21 VAL 51 3HG2 VAL 51 -1.964 2.464 -3.249 351 HG22 VAL 51 1HG2 VAL 51 -0.869 3.177 -4.430 352 HG23 VAL 51 2HG2 VAL 51 -1.271 1.464 -4.526 353 H LYS 52 H LYS 52 -6.251 2.546 -4.114 354 HA LYS 52 HA LYS 52 -7.600 1.949 -6.592 355 HB2 LYS 52 2HB LYS 52 -8.364 1.819 -3.993 356 HB3 LYS 52 1HB LYS 52 -9.000 3.400 -4.412 357 HG2 LYS 52 2HG LYS 52 -9.641 0.819 -5.820 358 HG3 LYS 52 1HG LYS 52 -10.673 1.621 -4.640 359 HD2 LYS 52 2HD LYS 52 -10.905 3.527 -6.161 360 HD3 LYS 52 1HD LYS 52 -9.824 2.745 -7.314 361 HE2 LYS 52 2HE LYS 52 -12.483 1.671 -6.383 362 HE3 LYS 52 1HE LYS 52 -12.189 2.462 -7.925 363 HZ1 LYS 52 3HZ LYS 52 -10.627 0.659 -8.462 364 HZ2 LYS 52 1HZ LYS 52 -12.191 0.089 -8.203 365 HZ3 LYS 52 2HZ LYS 52 -11.016 -0.123 -7.020 366 H ARG 53 H ARG 53 -6.593 4.736 -4.706 367 HA ARG 53 HA ARG 53 -7.084 6.429 -7.015 368 HB2 ARG 53 2HB ARG 53 -9.093 6.602 -5.552 369 HB3 ARG 53 1HB ARG 53 -8.060 7.070 -4.215 370 HG2 ARG 53 2HG ARG 53 -9.152 9.018 -5.175 371 HG3 ARG 53 1HG ARG 53 -7.411 9.101 -5.440 372 HD2 ARG 53 2HD ARG 53 -8.677 9.755 -7.438 373 HD3 ARG 53 1HD ARG 53 -7.689 8.322 -7.719 374 HE ARG 53 HE ARG 53 -10.486 8.002 -6.988 375 HH11 ARG 53 1HH1 ARG 53 -7.947 7.647 -9.438 376 HH12 ARG 53 2HH1 ARG 53 -8.921 6.718 -10.481 377 HH21 ARG 53 1HH2 ARG 53 -11.787 6.727 -8.422 378 HH22 ARG 53 2HH2 ARG 53 -11.159 6.209 -9.915 379 H GLY 54 H GLY 54 -5.125 7.314 -7.362 380 HA2 GLY 54 2HA GLY 54 -3.831 9.086 -5.894 381 HA3 GLY 54 1HA GLY 54 -3.350 7.608 -5.100 382 HA PRO 55 HA PRO 55 -0.924 8.297 -9.319 383 HB2 PRO 55 2HB PRO 55 0.322 10.754 -8.221 384 HB3 PRO 55 1HB PRO 55 -0.270 10.451 -9.858 385 HG2 PRO 55 2HG PRO 55 -1.575 12.090 -8.216 386 HG3 PRO 55 1HG PRO 55 -2.457 11.001 -9.301 387 HD2 PRO 55 2HD PRO 55 -1.904 10.711 -6.366 388 HD3 PRO 55 1HD PRO 55 -3.405 10.427 -7.275 389 H ASN 56 H ASN 56 -0.554 8.533 -6.049 390 HA ASN 56 HA ASN 56 2.047 8.361 -5.279 391 HB2 ASN 56 2HB ASN 56 -0.297 6.772 -4.206 392 HB3 ASN 56 1HB ASN 56 1.217 7.010 -3.352 393 HD21 ASN 56 1HD2 ASN 56 0.079 8.018 -1.623 394 HD22 ASN 56 2HD2 ASN 56 -0.542 9.618 -1.780 395 H ALA 57 H ALA 57 0.114 5.953 -6.921 396 HA ALA 57 HA ALA 57 2.343 4.426 -7.727 397 HB1 ALA 57 1HB ALA 57 0.451 2.988 -5.855 398 HB2 ALA 57 2HB ALA 57 2.092 3.479 -5.430 399 HB3 ALA 57 3HB ALA 57 1.830 2.282 -6.700 400 H GLY 58 H GLY 58 -1.107 3.907 -7.049 401 HA2 GLY 58 2HA GLY 58 -2.872 3.346 -8.417 402 HA3 GLY 58 1HA GLY 58 -1.986 4.157 -9.704 403 H ALA 59 H ALA 59 -1.233 1.230 -7.822 404 HA ALA 59 HA ALA 59 -1.450 -0.433 -10.151 405 HB1 ALA 59 1HB ALA 59 0.878 -1.158 -10.042 406 HB2 ALA 59 2HB ALA 59 1.187 -0.012 -8.740 407 HB3 ALA 59 3HB ALA 59 0.797 0.578 -10.351 408 H ARG 60 H ARG 60 -0.188 -2.610 -9.227 409 HA ARG 60 HA ARG 60 -1.396 -3.125 -6.609 410 HB2 ARG 60 2HB ARG 60 -1.805 -5.440 -7.387 411 HB3 ARG 60 1HB ARG 60 -2.671 -4.235 -8.331 412 HG2 ARG 60 2HG ARG 60 -1.172 -4.465 -10.166 413 HG3 ARG 60 1HG ARG 60 -0.081 -5.482 -9.225 414 HD2 ARG 60 2HD ARG 60 -1.758 -7.220 -9.099 415 HD3 ARG 60 1HD ARG 60 -2.918 -6.188 -9.934 416 HE ARG 60 HE ARG 60 -1.308 -6.281 -11.849 417 HH11 ARG 60 1HH1 ARG 60 -1.405 -8.974 -9.531 418 HH12 ARG 60 2HH1 ARG 60 -0.980 -10.146 -10.693 419 HH21 ARG 60 1HH2 ARG 60 -0.801 -7.887 -13.403 420 HH22 ARG 60 2HH2 ARG 60 -0.637 -9.525 -12.964 421 H PHE 61 H PHE 61 -0.105 -4.179 -5.153 422 HA PHE 61 HA PHE 61 2.429 -5.219 -6.131 423 HB2 PHE 61 2HB PHE 61 2.921 -2.932 -5.435 424 HB3 PHE 61 1HB PHE 61 2.167 -3.219 -3.877 425 HD1 PHE 61 2HD PHE 61 4.935 -4.450 -6.032 426 HD2 PHE 61 1HD PHE 61 3.484 -3.868 -2.075 427 HE1 PHE 61 2HE PHE 61 7.097 -5.179 -5.137 428 HE2 PHE 61 1HE PHE 61 5.656 -4.599 -1.170 429 HZ PHE 61 HZ PHE 61 7.460 -5.257 -2.702 430 H LEU 62 H LEU 62 2.916 -7.094 -5.286 431 HA LEU 62 HA LEU 62 1.341 -8.167 -3.091 432 HB2 LEU 62 2HB LEU 62 1.672 -9.526 -5.128 433 HB3 LEU 62 1HB LEU 62 3.404 -9.420 -4.928 434 HG LEU 62 HG LEU 62 3.215 -10.739 -2.832 435 HD11 LEU 62 1HD1 LEU 62 0.931 -10.173 -2.213 436 HD12 LEU 62 2HD1 LEU 62 1.140 -11.917 -2.338 437 HD13 LEU 62 3HD1 LEU 62 0.323 -11.035 -3.628 438 HD21 LEU 62 3HD2 LEU 62 2.008 -12.033 -5.273 439 HD22 LEU 62 1HD2 LEU 62 2.755 -12.877 -3.917 440 HD23 LEU 62 2HD2 LEU 62 3.729 -11.830 -4.950 441 H LEU 63 H LEU 63 2.194 -8.360 -1.075 442 HA LEU 63 HA LEU 63 4.637 -7.005 -0.555 443 HB2 LEU 63 2HB LEU 63 2.813 -8.537 1.266 444 HB3 LEU 63 1HB LEU 63 4.227 -7.670 1.811 445 HG LEU 63 HG LEU 63 1.769 -6.464 0.539 446 HD11 LEU 63 1HD1 LEU 63 1.432 -5.478 2.730 447 HD12 LEU 63 2HD1 LEU 63 2.876 -6.289 3.326 448 HD13 LEU 63 3HD1 LEU 63 1.473 -7.238 2.841 449 HD21 LEU 63 3HD2 LEU 63 4.282 -5.138 1.572 450 HD22 LEU 63 1HD2 LEU 63 2.811 -4.301 1.078 451 HD23 LEU 63 2HD2 LEU 63 3.748 -5.199 -0.109 452 H ASP 64 H ASP 64 6.527 -7.723 -0.648 453 HA ASP 64 HA ASP 64 7.211 -10.265 0.486 454 HB2 ASP 64 2HB ASP 64 8.778 -10.827 -1.458 455 HB3 ASP 64 1HB ASP 64 7.066 -11.088 -1.729 456 H GLN 65 H GLN 65 8.339 -7.330 -0.992 457 HA GLN 65 HA GLN 65 10.883 -7.139 0.101 458 HB2 GLN 65 2HB GLN 65 8.878 -4.940 -0.432 459 HB3 GLN 65 1HB GLN 65 10.594 -4.692 -0.141 460 HG2 GLN 65 2HG GLN 65 11.151 -5.912 -2.103 461 HG3 GLN 65 1HG GLN 65 9.458 -6.296 -2.415 462 HE21 GLN 65 1HE2 GLN 65 10.627 -3.182 -1.319 463 HE22 GLN 65 2HE2 GLN 65 10.301 -2.316 -2.773 464 HA PRO 66 HA PRO 66 9.679 -7.244 4.444 465 HB2 PRO 66 2HB PRO 66 12.200 -6.398 5.362 466 HB3 PRO 66 1HB PRO 66 11.653 -8.065 5.186 467 HG2 PRO 66 2HG PRO 66 13.377 -6.444 3.403 468 HG3 PRO 66 1HG PRO 66 13.354 -8.190 3.665 469 HD2 PRO 66 2HD PRO 66 12.375 -7.014 1.439 470 HD3 PRO 66 1HD PRO 66 11.716 -8.530 2.085 471 H THR 67 H THR 67 11.551 -4.505 3.182 472 HA THR 67 HA THR 67 9.908 -2.831 4.914 473 HB THR 67 HB THR 67 12.735 -2.193 3.997 474 HG1 THR 67 1HG THR 67 12.866 -3.726 5.591 475 HG21 THR 67 3HG2 THR 67 12.541 -0.308 5.571 476 HG22 THR 67 1HG2 THR 67 10.874 -0.775 5.913 477 HG23 THR 67 2HG2 THR 67 11.317 -0.219 4.302 478 H THR 68 H THR 68 8.382 -2.096 3.603 479 HA THR 68 HA THR 68 9.230 -0.979 1.038 480 HB THR 68 HB THR 68 6.416 -1.687 1.975 481 HG1 THR 68 1HG THR 68 7.917 -3.514 1.581 482 HG21 THR 68 3HG2 THR 68 6.494 0.093 0.257 483 HG22 THR 68 1HG2 THR 68 5.811 -1.400 -0.390 484 HG23 THR 68 2HG2 THR 68 7.475 -0.958 -0.767 485 H THR 69 H THR 69 9.592 1.145 1.179 486 HA THR 69 HA THR 69 8.451 2.648 3.363 487 HB THR 69 HB THR 69 10.202 4.300 2.339 488 HG1 THR 69 1HG THR 69 11.864 3.084 1.267 489 HG21 THR 69 3HG2 THR 69 10.389 3.218 4.558 490 HG22 THR 69 1HG2 THR 69 11.945 3.243 3.730 491 HG23 THR 69 2HG2 THR 69 10.998 1.757 3.785 492 H ALA 70 H ALA 70 6.991 4.226 3.082 493 HA ALA 70 HA ALA 70 6.422 5.136 0.365 494 HB1 ALA 70 1HB ALA 70 4.168 5.663 1.228 495 HB2 ALA 70 2HB ALA 70 4.636 4.977 2.788 496 HB3 ALA 70 3HB ALA 70 4.558 3.948 1.359 497 H GLY 71 H GLY 71 7.086 7.137 0.002 498 HA2 GLY 71 2HA GLY 71 6.453 9.350 1.446 499 HA3 GLY 71 1HA GLY 71 8.013 8.822 2.070 500 H ARG 72 H ARG 72 8.736 10.880 1.168 501 HA ARG 72 HA ARG 72 9.630 10.318 -1.528 502 HB2 ARG 72 2HB ARG 72 7.920 12.096 -1.716 503 HB3 ARG 72 1HB ARG 72 8.802 13.073 -0.551 504 HG2 ARG 72 2HG ARG 72 9.239 13.882 -2.787 505 HG3 ARG 72 1HG ARG 72 10.708 13.181 -2.101 506 HD2 ARG 72 2HD ARG 72 10.040 11.030 -3.295 507 HD3 ARG 72 1HD ARG 72 8.870 12.009 -4.177 508 HE ARG 72 HE ARG 72 11.546 13.029 -4.249 509 HH11 ARG 72 1HH1 ARG 72 9.165 11.024 -5.937 510 HH12 ARG 72 2HH1 ARG 72 10.149 10.769 -7.309 511 HH21 ARG 72 1HH2 ARG 72 12.873 12.694 -6.167 512 HH22 ARG 72 2HH2 ARG 72 12.299 11.727 -7.444 513 H HIS 73 H HIS 73 11.535 9.524 -0.734 514 HA HIS 73 HA HIS 73 13.555 11.432 -0.330 515 HB2 HIS 73 2HB HIS 73 14.397 10.427 1.895 516 HB3 HIS 73 1HB HIS 73 12.924 11.364 2.033 517 HD1 HIS 73 1HD HIS 73 14.423 8.393 3.259 518 HD2 HIS 73 2HD HIS 73 10.606 9.461 2.038 519 HE1 HIS 73 1HE HIS 73 12.856 6.717 4.296 520 HA PRO 74 HA PRO 74 16.141 8.661 -2.503 521 HB2 PRO 74 2HB PRO 74 18.020 7.781 -0.569 522 HB3 PRO 74 1HB PRO 74 18.208 9.101 -1.724 523 HG2 PRO 74 2HG PRO 74 17.356 9.186 1.131 524 HG3 PRO 74 1HG PRO 74 18.301 10.363 0.202 525 HD2 PRO 74 2HD PRO 74 15.798 10.906 0.781 526 HD3 PRO 74 1HD PRO 74 16.401 11.237 -0.842 527 H GLU 75 H GLU 75 15.260 7.257 0.659 528 HA GLU 75 HA GLU 75 15.631 4.654 -0.594 529 HB2 GLU 75 2HB GLU 75 15.636 3.641 1.598 530 HB3 GLU 75 1HB GLU 75 16.804 4.950 1.506 531 HG2 GLU 75 2HG GLU 75 15.249 6.392 2.717 532 HG3 GLU 75 1HG GLU 75 14.108 5.053 2.821 533 H SER 76 H SER 76 13.138 6.549 -0.744 534 HA SER 76 HA SER 76 11.019 4.936 0.300 535 HB2 SER 76 2HB SER 76 10.955 6.980 -1.930 536 HB3 SER 76 1HB SER 76 9.568 6.370 -1.024 537 HG SER 76 HG SER 76 10.839 7.184 0.860 538 H ASP 77 H ASP 77 10.058 3.197 -0.649 539 HA ASP 77 HA ASP 77 11.160 2.260 -3.143 540 HB2 ASP 77 2HB ASP 77 10.507 0.634 -1.352 541 HB3 ASP 77 1HB ASP 77 8.823 1.091 -1.608 542 H ILE 78 H ILE 78 7.939 3.139 -1.977 543 HA ILE 78 HA ILE 78 7.214 3.650 -4.744 544 HB ILE 78 HB ILE 78 4.866 3.868 -3.924 545 HG12 ILE 78 2HG1 ILE 78 5.971 2.866 -1.280 546 HG13 ILE 78 1HG1 ILE 78 5.362 4.490 -1.576 547 HG21 ILE 78 1HG2 ILE 78 4.490 1.467 -3.507 548 HG22 ILE 78 2HG2 ILE 78 6.230 1.257 -3.310 549 HG23 ILE 78 3HG2 ILE 78 5.572 1.782 -4.861 550 HD11 ILE 78 3HD1 ILE 78 3.712 3.129 -0.411 551 HD12 ILE 78 1HD1 ILE 78 3.754 1.944 -1.718 552 HD13 ILE 78 2HD1 ILE 78 3.137 3.568 -2.018 553 H PHE 79 H PHE 79 6.745 5.626 -5.463 554 HA PHE 79 HA PHE 79 7.409 7.766 -3.601 555 HB2 PHE 79 2HB PHE 79 7.651 7.651 -6.610 556 HB3 PHE 79 1HB PHE 79 7.948 9.094 -5.651 557 HD1 PHE 79 1HD PHE 79 9.841 9.191 -4.112 558 HD2 PHE 79 2HD PHE 79 9.258 5.895 -6.727 559 HE1 PHE 79 1HE PHE 79 12.184 8.526 -3.772 560 HE2 PHE 79 2HE PHE 79 11.600 5.212 -6.395 561 HZ PHE 79 HZ PHE 79 13.067 6.532 -4.916 562 H LEU 80 H LEU 80 5.856 8.891 -2.917 563 HA LEU 80 HA LEU 80 3.301 8.723 -4.086 564 HB2 LEU 80 2HB LEU 80 4.298 10.065 -1.595 565 HB3 LEU 80 1HB LEU 80 2.653 10.260 -2.140 566 HG LEU 80 HG LEU 80 2.334 7.788 -1.923 567 HD11 LEU 80 1HD1 LEU 80 5.020 7.812 -0.578 568 HD12 LEU 80 2HD1 LEU 80 4.637 7.069 -2.131 569 HD13 LEU 80 3HD1 LEU 80 3.890 6.456 -0.656 570 HD21 LEU 80 3HD2 LEU 80 2.207 7.769 0.519 571 HD22 LEU 80 1HD2 LEU 80 1.596 9.276 -0.163 572 HD23 LEU 80 2HD2 LEU 80 3.197 9.227 0.575 573 H ASP 81 H ASP 81 2.949 9.955 -5.863 574 HA ASP 81 HA ASP 81 4.085 12.599 -5.974 575 HB2 ASP 81 2HB ASP 81 4.001 11.239 -8.056 576 HB3 ASP 81 1HB ASP 81 2.243 11.285 -8.001 577 H ASP 82 H ASP 82 2.967 13.009 -4.037 578 HA ASP 82 HA ASP 82 0.671 14.692 -4.624 579 HB2 ASP 82 2HB ASP 82 -0.381 12.617 -3.792 580 HB3 ASP 82 1HB ASP 82 0.652 12.646 -2.372 581 H VAL 83 H VAL 83 0.293 16.187 -2.718 582 HA VAL 83 HA VAL 83 2.943 17.046 -1.862 583 HB VAL 83 HB VAL 83 1.425 18.587 -3.122 584 HG11 VAL 83 1HG1 VAL 83 -0.383 19.745 -1.938 585 HG12 VAL 83 2HG1 VAL 83 -0.207 18.592 -0.615 586 HG13 VAL 83 3HG1 VAL 83 -0.690 18.031 -2.216 587 HG21 VAL 83 3HG2 VAL 83 3.264 19.542 -1.882 588 HG22 VAL 83 1HG2 VAL 83 2.307 19.541 -0.400 589 HG23 VAL 83 2HG2 VAL 83 1.855 20.593 -1.737 590 H THR 84 H THR 84 0.413 15.274 -0.517 591 HA THR 84 HA THR 84 0.623 16.420 2.151 592 HB THR 84 HB THR 84 -0.903 13.916 1.448 593 HG1 THR 84 1HG THR 84 -1.591 15.107 -0.066 594 HG21 THR 84 3HG2 THR 84 -1.486 16.252 3.275 595 HG22 THR 84 1HG2 THR 84 -0.871 14.681 3.789 596 HG23 THR 84 2HG2 THR 84 -2.492 14.814 3.096 597 H VAL 85 H VAL 85 2.751 14.734 0.577 598 HA VAL 85 HA VAL 85 3.054 12.623 2.568 599 HB VAL 85 HB VAL 85 3.013 11.805 0.258 600 HG11 VAL 85 1HG1 VAL 85 5.475 13.480 -0.168 601 HG12 VAL 85 2HG1 VAL 85 3.892 13.729 -0.911 602 HG13 VAL 85 3HG1 VAL 85 4.833 12.290 -1.301 603 HG21 VAL 85 3HG2 VAL 85 4.307 10.569 1.885 604 HG22 VAL 85 1HG2 VAL 85 5.718 11.566 1.542 605 HG23 VAL 85 2HG2 VAL 85 5.079 10.489 0.300 606 H SER 86 H SER 86 4.661 12.601 3.956 607 HA SER 86 HA SER 86 6.647 14.733 3.835 608 HB2 SER 86 2HB SER 86 5.903 12.843 6.086 609 HB3 SER 86 1HB SER 86 6.917 14.282 6.206 610 HG SER 86 HG SER 86 5.209 15.533 6.147 611 H ARG 87 H ARG 87 8.881 13.980 4.643 612 HA ARG 87 HA ARG 87 9.736 11.623 3.252 613 HB2 ARG 87 2HB ARG 87 11.163 13.409 5.235 614 HB3 ARG 87 1HB ARG 87 11.934 12.154 4.272 615 HG2 ARG 87 2HG ARG 87 11.416 13.327 2.244 616 HG3 ARG 87 1HG ARG 87 10.511 14.546 3.141 617 HD2 ARG 87 2HD ARG 87 13.438 13.956 3.461 618 HD3 ARG 87 1HD ARG 87 12.778 15.299 2.531 619 HE ARG 87 HE ARG 87 11.669 15.850 4.749 620 HH11 ARG 87 1HH1 ARG 87 14.900 14.403 4.498 621 HH12 ARG 87 2HH1 ARG 87 15.549 15.249 5.813 622 HH21 ARG 87 1HH2 ARG 87 12.581 17.011 6.596 623 HH22 ARG 87 2HH2 ARG 87 14.208 16.756 7.028 624 H ARG 88 H ARG 88 10.132 9.624 4.162 625 HA ARG 88 HA ARG 88 9.344 7.976 5.318 626 HB2 ARG 88 2HB ARG 88 10.275 7.758 7.721 627 HB3 ARG 88 1HB ARG 88 11.436 7.941 6.430 628 HG2 ARG 88 2HG ARG 88 12.339 9.329 8.033 629 HG3 ARG 88 1HG ARG 88 11.359 10.475 7.135 630 HD2 ARG 88 2HD ARG 88 11.047 10.853 9.495 631 HD3 ARG 88 1HD ARG 88 9.558 10.191 8.821 632 HE ARG 88 HE ARG 88 10.901 8.012 9.679 633 HH11 ARG 88 1HH1 ARG 88 9.895 11.006 11.296 634 HH12 ARG 88 2HH1 ARG 88 9.691 10.286 12.814 635 HH21 ARG 88 1HH2 ARG 88 10.665 7.032 11.822 636 HH22 ARG 88 2HH2 ARG 88 10.149 7.999 13.125 637 H HIS 89 H HIS 89 7.339 8.361 4.860 638 HA HIS 89 HA HIS 89 5.709 9.728 6.825 639 HB2 HIS 89 2HB HIS 89 5.596 10.322 4.391 640 HB3 HIS 89 1HB HIS 89 5.005 8.705 4.059 641 HD2 HIS 89 2HD HIS 89 2.404 8.205 5.281 642 HE1 HIS 89 1HE HIS 89 1.441 12.310 5.173 643 HE2 HIS 89 2HE HIS 89 0.683 10.003 5.870 644 H ALA 90 H ALA 90 5.540 6.744 4.877 645 HA ALA 90 HA ALA 90 4.328 5.462 7.194 646 HB1 ALA 90 1HB ALA 90 2.515 6.015 5.657 647 HB2 ALA 90 2HB ALA 90 2.771 4.271 5.709 648 HB3 ALA 90 3HB ALA 90 3.363 5.209 4.339 649 H GLU 91 H GLU 91 5.306 3.676 7.688 650 HA GLU 91 HA GLU 91 7.053 2.520 5.637 651 HB2 GLU 91 2HB GLU 91 7.260 2.271 8.642 652 HB3 GLU 91 1HB GLU 91 8.342 1.529 7.475 653 HG2 GLU 91 2HG GLU 91 8.968 3.799 6.692 654 HG3 GLU 91 1HG GLU 91 7.989 4.467 7.999 655 H PHE 92 H PHE 92 6.534 0.609 4.891 656 HA PHE 92 HA PHE 92 4.515 -0.912 6.333 657 HB2 PHE 92 2HB PHE 92 5.423 -1.014 3.452 658 HB3 PHE 92 1HB PHE 92 4.239 -2.119 4.145 659 HD1 PHE 92 2HD PHE 92 4.879 1.270 2.922 660 HD2 PHE 92 1HD PHE 92 1.986 -1.330 4.651 661 HE1 PHE 92 2HE PHE 92 3.087 2.852 2.322 662 HE2 PHE 92 1HE PHE 92 0.203 0.243 4.052 663 HZ PHE 92 HZ PHE 92 0.753 2.338 2.882 664 H ARG 93 H ARG 93 5.324 -2.421 7.526 665 HA ARG 93 HA ARG 93 7.918 -3.591 6.849 666 HB2 ARG 93 2HB ARG 93 6.472 -3.038 9.418 667 HB3 ARG 93 1HB ARG 93 7.745 -4.243 9.343 668 HG2 ARG 93 2HG ARG 93 9.392 -2.673 8.926 669 HG3 ARG 93 1HG ARG 93 8.240 -1.471 8.348 670 HD2 ARG 93 2HD ARG 93 9.307 -1.148 10.680 671 HD3 ARG 93 1HD ARG 93 7.583 -0.882 10.492 672 HE ARG 93 HE ARG 93 7.152 -2.699 11.829 673 HH11 ARG 93 1HH1 ARG 93 10.628 -2.715 11.145 674 HH12 ARG 93 2HH1 ARG 93 10.991 -3.777 12.418 675 HH21 ARG 93 1HH2 ARG 93 7.621 -4.052 13.528 676 HH22 ARG 93 2HH2 ARG 93 9.223 -4.572 13.854 677 H ILE 94 H ILE 94 7.676 -5.501 5.974 678 HA ILE 94 HA ILE 94 5.586 -7.175 7.052 679 HB ILE 94 HB ILE 94 4.659 -6.318 5.017 680 HG12 ILE 94 2HG1 ILE 94 4.353 -8.836 5.482 681 HG13 ILE 94 1HG1 ILE 94 3.952 -8.278 3.873 682 HG21 ILE 94 1HG2 ILE 94 6.582 -5.546 3.898 683 HG22 ILE 94 2HG2 ILE 94 5.645 -6.566 2.809 684 HG23 ILE 94 3HG2 ILE 94 7.111 -7.193 3.562 685 HD11 ILE 94 3HD1 ILE 94 5.106 -10.420 3.812 686 HD12 ILE 94 1HD1 ILE 94 6.469 -9.726 4.693 687 HD13 ILE 94 2HD1 ILE 94 6.101 -9.173 3.059 688 H ASN 95 H ASN 95 6.175 -8.924 7.673 689 HA ASN 95 HA ASN 95 8.778 -10.047 6.914 690 HB2 ASN 95 2HB ASN 95 8.523 -9.422 9.341 691 HB3 ASN 95 1HB ASN 95 7.170 -10.547 9.445 692 HD21 ASN 95 1HD2 ASN 95 8.130 -11.918 10.909 693 HD22 ASN 95 2HD2 ASN 95 9.504 -12.887 10.527 694 H GLU 96 H GLU 96 8.776 -12.270 6.439 695 HA GLU 96 HA GLU 96 6.838 -13.340 4.883 696 HB2 GLU 96 2HB GLU 96 7.852 -15.560 5.338 697 HB3 GLU 96 1HB GLU 96 9.018 -14.304 4.971 698 HG2 GLU 96 2HG GLU 96 9.328 -14.052 7.475 699 HG3 GLU 96 1HG GLU 96 8.399 -15.540 7.638 700 H GLY 97 H GLY 97 6.682 -13.343 8.385 701 HA2 GLY 97 2HA GLY 97 4.131 -14.796 8.163 702 HA3 GLY 97 1HA GLY 97 5.255 -15.112 9.474 703 H GLU 98 H GLU 98 4.797 -11.784 8.364 704 HA GLU 98 HA GLU 98 2.699 -11.149 10.162 705 HB2 GLU 98 2HB GLU 98 4.466 -11.492 11.851 706 HB3 GLU 98 1HB GLU 98 5.480 -10.302 11.040 707 HG2 GLU 98 2HG GLU 98 4.419 -9.373 13.037 708 HG3 GLU 98 1HG GLU 98 3.860 -8.557 11.579 709 H PHE 99 H PHE 99 1.999 -9.055 9.926 710 HA PHE 99 HA PHE 99 3.442 -7.419 8.014 711 HB2 PHE 99 2HB PHE 99 1.038 -6.939 6.965 712 HB3 PHE 99 1HB PHE 99 2.062 -8.244 6.394 713 HD1 PHE 99 1HD PHE 99 -0.702 -7.575 8.816 714 HD2 PHE 99 2HD PHE 99 1.216 -10.378 6.262 715 HE1 PHE 99 1HE PHE 99 -2.499 -9.185 9.232 716 HE2 PHE 99 2HE PHE 99 -0.581 -11.998 6.678 717 HZ PHE 99 HZ PHE 99 -2.446 -11.403 8.168 718 H GLU 100 H GLU 100 3.740 -5.494 8.687 719 HA GLU 100 HA GLU 100 1.875 -4.330 10.662 720 HB2 GLU 100 2HB GLU 100 3.851 -5.398 11.676 721 HB3 GLU 100 1HB GLU 100 4.881 -4.350 10.727 722 HG2 GLU 100 2HG GLU 100 3.964 -2.414 11.913 723 HG3 GLU 100 1HG GLU 100 2.969 -3.506 12.884 724 H VAL 101 H VAL 101 1.434 -2.167 10.356 725 HA VAL 101 HA VAL 101 3.023 -0.728 8.368 726 HB VAL 101 HB VAL 101 0.801 -1.151 7.428 727 HG11 VAL 101 1HG1 VAL 101 -0.487 -1.480 9.446 728 HG12 VAL 101 2HG1 VAL 101 -1.252 -0.259 8.426 729 HG13 VAL 101 3HG1 VAL 101 -0.333 0.230 9.849 730 HG21 VAL 101 3HG2 VAL 101 1.815 0.970 6.834 731 HG22 VAL 101 1HG2 VAL 101 1.109 1.735 8.259 732 HG23 VAL 101 2HG2 VAL 101 0.066 1.158 6.961 733 H VAL 102 H VAL 102 3.905 1.136 8.992 734 HA VAL 102 HA VAL 102 3.224 2.101 11.686 735 HB VAL 102 HB VAL 102 5.945 2.050 10.340 736 HG11 VAL 102 1HG1 VAL 102 6.831 2.814 12.480 737 HG12 VAL 102 2HG1 VAL 102 5.190 2.900 13.119 738 HG13 VAL 102 3HG1 VAL 102 5.678 3.971 11.804 739 HG21 VAL 102 3HG2 VAL 102 4.894 0.426 12.655 740 HG22 VAL 102 1HG2 VAL 102 6.555 0.417 12.067 741 HG23 VAL 102 2HG2 VAL 102 5.252 -0.178 11.038 742 H ASP 103 H ASP 103 2.713 4.224 11.855 743 HA ASP 103 HA ASP 103 3.092 5.943 9.506 744 HB2 ASP 103 2HB ASP 103 0.779 5.910 10.229 745 HB3 ASP 103 1HB ASP 103 1.253 6.251 11.886 746 H VAL 104 H VAL 104 4.770 7.137 9.568 747 HA VAL 104 HA VAL 104 5.512 8.325 12.125 748 HB VAL 104 HB VAL 104 7.926 8.370 11.216 749 HG11 VAL 104 1HG1 VAL 104 7.202 6.959 13.066 750 HG12 VAL 104 2HG1 VAL 104 8.320 6.076 12.023 751 HG13 VAL 104 3HG1 VAL 104 6.586 5.767 11.922 752 HG21 VAL 104 3HG2 VAL 104 8.474 6.561 9.644 753 HG22 VAL 104 1HG2 VAL 104 7.400 7.746 8.899 754 HG23 VAL 104 2HG2 VAL 104 6.760 6.202 9.462 755 H GLY 105 H GLY 105 4.279 8.936 9.242 756 HA2 GLY 105 2HA GLY 105 5.453 11.606 8.989 757 HA3 GLY 105 1HA GLY 105 4.413 10.808 7.806 758 H SER 106 H SER 106 3.993 11.017 11.244 759 HA SER 106 HA SER 106 1.266 11.506 11.215 760 HB2 SER 106 2HB SER 106 3.228 12.004 13.433 761 HB3 SER 106 1HB SER 106 1.509 11.626 13.590 762 HG SER 106 HG SER 106 2.071 9.619 12.382 763 H LEU 107 H LEU 107 3.505 13.679 10.309 764 HA LEU 107 HA LEU 107 2.528 16.116 11.431 765 HB2 LEU 107 2HB LEU 107 3.866 15.573 8.757 766 HB3 LEU 107 1HB LEU 107 3.538 17.166 9.385 767 HG LEU 107 HG LEU 107 5.836 16.771 9.651 768 HD11 LEU 107 1HD1 LEU 107 4.866 17.897 11.510 769 HD12 LEU 107 2HD1 LEU 107 6.214 16.892 12.041 770 HD13 LEU 107 3HD1 LEU 107 4.554 16.360 12.318 771 HD21 LEU 107 3HD2 LEU 107 5.214 14.159 11.033 772 HD22 LEU 107 1HD2 LEU 107 6.819 14.857 10.827 773 HD23 LEU 107 2HD2 LEU 107 5.897 14.341 9.417 774 H ASN 108 H ASN 108 1.880 14.140 8.659 775 HA ASN 108 HA ASN 108 -0.585 15.633 8.106 776 HB2 ASN 108 2HB ASN 108 1.110 13.886 6.322 777 HB3 ASN 108 1HB ASN 108 -0.470 14.516 5.846 778 HD21 ASN 108 1HD2 ASN 108 2.247 14.951 4.779 779 HD22 ASN 108 2HD2 ASN 108 2.513 16.657 4.809 780 H GLY 109 H GLY 109 0.878 12.425 8.408 781 HA2 GLY 109 2HA GLY 109 -0.002 10.760 9.747 782 HA3 GLY 109 1HA GLY 109 -1.564 11.542 9.683 783 H THR 110 H THR 110 -0.102 8.845 8.999 784 HA THR 110 HA THR 110 -1.621 8.195 6.611 785 HB THR 110 HB THR 110 -0.060 6.381 8.472 786 HG1 THR 110 1HG THR 110 1.421 7.778 7.827 787 HG21 THR 110 3HG2 THR 110 -1.537 5.234 6.888 788 HG22 THR 110 1HG2 THR 110 0.151 4.957 6.463 789 HG23 THR 110 2HG2 THR 110 -0.812 6.124 5.551 790 H TYR 111 H TYR 111 -3.573 7.093 6.811 791 HA TYR 111 HA TYR 111 -4.471 6.610 9.584 792 HB2 TYR 111 2HB TYR 111 -6.216 7.311 7.216 793 HB3 TYR 111 1HB TYR 111 -6.726 7.104 8.877 794 HD1 TYR 111 2HD TYR 111 -6.255 8.826 10.541 795 HD2 TYR 111 1HD TYR 111 -5.166 9.348 6.468 796 HE1 TYR 111 2HE TYR 111 -5.981 11.233 10.927 797 HE2 TYR 111 1HE TYR 111 -4.890 11.756 6.841 798 HH TYR 111 HH TYR 111 -5.694 13.436 8.369 799 H VAL 112 H VAL 112 -5.146 4.600 10.003 800 HA VAL 112 HA VAL 112 -5.603 2.898 7.688 801 HB VAL 112 HB VAL 112 -5.472 0.943 9.284 802 HG11 VAL 112 1HG1 VAL 112 -3.048 2.732 9.250 803 HG12 VAL 112 2HG1 VAL 112 -3.511 1.577 8.004 804 HG13 VAL 112 3HG1 VAL 112 -3.039 1.005 9.605 805 HG21 VAL 112 3HG2 VAL 112 -6.037 1.941 11.391 806 HG22 VAL 112 1HG2 VAL 112 -4.684 3.076 11.278 807 HG23 VAL 112 2HG2 VAL 112 -4.374 1.366 11.506 808 H ASN 113 H ASN 113 -7.487 2.745 7.035 809 HA ASN 113 HA ASN 113 -9.634 2.947 6.763 810 HB2 ASN 113 2HB ASN 113 -9.710 1.167 8.626 811 HB3 ASN 113 1HB ASN 113 -10.121 2.476 9.723 812 HD21 ASN 113 1HD2 ASN 113 -11.073 0.534 7.155 813 HD22 ASN 113 2HD2 ASN 113 -12.759 0.937 7.074 814 H ARG 114 H ARG 114 -9.565 4.154 10.020 815 HA ARG 114 HA ARG 114 -9.633 6.946 9.188 816 HB2 ARG 114 2HB ARG 114 -11.862 5.670 10.782 817 HB3 ARG 114 1HB ARG 114 -11.574 7.393 10.782 818 HG2 ARG 114 2HG ARG 114 -11.887 7.293 8.271 819 HG3 ARG 114 1HG ARG 114 -12.479 5.649 8.517 820 HD2 ARG 114 2HD ARG 114 -14.338 7.232 8.460 821 HD3 ARG 114 1HD ARG 114 -14.185 6.492 10.051 822 HE ARG 114 HE ARG 114 -12.712 8.773 10.244 823 HH11 ARG 114 1HH1 ARG 114 -16.075 8.189 9.257 824 HH12 ARG 114 2HH1 ARG 114 -16.665 9.635 9.922 825 HH21 ARG 114 1HH2 ARG 114 -13.525 10.756 11.153 826 HH22 ARG 114 2HH2 ARG 114 -15.174 11.139 11.023 827 H GLU 115 H GLU 115 -8.096 4.812 10.777 828 HA GLU 115 HA GLU 115 -8.066 6.000 13.436 829 HB2 GLU 115 2HB GLU 115 -6.893 3.458 12.341 830 HB3 GLU 115 1HB GLU 115 -6.820 3.954 14.015 831 HG2 GLU 115 2HG GLU 115 -9.326 3.304 12.482 832 HG3 GLU 115 1HG GLU 115 -8.502 2.234 13.612 833 HA PRO 116 HA PRO 116 -3.987 7.501 12.047 834 HB2 PRO 116 2HB PRO 116 -4.050 9.413 14.178 835 HB3 PRO 116 1HB PRO 116 -4.291 9.740 12.459 836 HG2 PRO 116 2HG PRO 116 -6.248 9.999 14.414 837 HG3 PRO 116 1HG PRO 116 -6.565 9.800 12.685 838 HD2 PRO 116 2HD PRO 116 -6.647 7.764 14.874 839 HD3 PRO 116 1HD PRO 116 -7.698 7.953 13.451 840 H ARG 117 H ARG 117 -2.847 5.692 12.797 841 HA ARG 117 HA ARG 117 -2.302 5.618 15.684 842 HB2 ARG 117 2HB ARG 117 -2.615 3.245 13.844 843 HB3 ARG 117 1HB ARG 117 -2.168 3.165 15.540 844 HG2 ARG 117 2HG ARG 117 -4.337 4.197 16.116 845 HG3 ARG 117 1HG ARG 117 -4.761 4.159 14.406 846 HD2 ARG 117 2HD ARG 117 -4.542 1.716 14.424 847 HD3 ARG 117 1HD ARG 117 -4.138 1.790 16.140 848 HE ARG 117 HE ARG 117 -6.562 3.117 15.634 849 HH11 ARG 117 1HH1 ARG 117 -5.244 -0.135 16.104 850 HH12 ARG 117 2HH1 ARG 117 -6.755 -0.837 16.468 851 HH21 ARG 117 1HH2 ARG 117 -8.601 2.154 16.142 852 HH22 ARG 117 2HH2 ARG 117 -8.705 0.479 16.497 853 H ASN 118 H ASN 118 -0.303 5.053 16.333 854 HA ASN 118 HA ASN 118 1.833 5.925 14.702 855 HB2 ASN 118 2HB ASN 118 1.871 4.463 17.352 856 HB3 ASN 118 1HB ASN 118 3.292 5.148 16.583 857 HD21 ASN 118 1HD2 ASN 118 3.677 6.494 18.309 858 HD22 ASN 118 2HD2 ASN 118 2.717 7.873 18.679 859 H ALA 119 H ALA 119 0.804 2.710 15.762 860 HA ALA 119 HA ALA 119 2.019 1.598 13.390 861 HB1 ALA 119 1HB ALA 119 3.154 -0.199 14.622 862 HB2 ALA 119 2HB ALA 119 2.686 0.545 16.148 863 HB3 ALA 119 3HB ALA 119 3.814 1.374 15.075 864 H GLN 120 H GLN 120 0.865 -0.090 12.670 865 HA GLN 120 HA GLN 120 -1.161 -1.253 14.380 866 HB2 GLN 120 2HB GLN 120 -2.322 0.598 13.302 867 HB3 GLN 120 1HB GLN 120 -1.742 0.091 11.726 868 HG2 GLN 120 2HG GLN 120 -4.085 -0.515 11.989 869 HG3 GLN 120 1HG GLN 120 -3.080 -1.946 11.890 870 HE21 GLN 120 1HE2 GLN 120 -5.739 -1.606 12.971 871 HE22 GLN 120 2HE2 GLN 120 -5.667 -2.166 14.597 872 H VAL 121 H VAL 121 -1.823 -3.294 13.694 873 HA VAL 121 HA VAL 121 0.041 -4.691 11.962 874 HB VAL 121 HB VAL 121 -2.554 -5.677 13.234 875 HG11 VAL 121 1HG1 VAL 121 -0.267 -7.246 12.046 876 HG12 VAL 121 2HG1 VAL 121 -1.873 -7.054 11.340 877 HG13 VAL 121 3HG1 VAL 121 -1.676 -7.934 12.857 878 HG21 VAL 121 3HG2 VAL 121 -1.143 -6.739 14.932 879 HG22 VAL 121 1HG2 VAL 121 -0.963 -4.984 14.938 880 HG23 VAL 121 2HG2 VAL 121 0.280 -5.996 14.202 881 H MET 122 H MET 122 -0.404 -5.216 9.836 882 HA MET 122 HA MET 122 -2.254 -3.557 8.465 883 HB2 MET 122 2HB MET 122 -0.906 -6.062 7.424 884 HB3 MET 122 1HB MET 122 -1.746 -4.879 6.451 885 HG2 MET 122 2HG MET 122 -0.067 -3.201 7.068 886 HG3 MET 122 1HG MET 122 0.788 -4.423 8.008 887 HE1 MET 122 3HE MET 122 3.088 -4.220 6.693 888 HE2 MET 122 1HE MET 122 2.356 -2.834 5.886 889 HE3 MET 122 2HE MET 122 3.171 -4.079 4.937 890 H GLN 123 H GLN 123 -4.338 -3.829 8.057 891 HA GLN 123 HA GLN 123 -5.418 -6.424 8.754 892 HB2 GLN 123 2HB GLN 123 -6.253 -4.611 10.156 893 HB3 GLN 123 1HB GLN 123 -6.790 -3.732 8.733 894 HG2 GLN 123 2HG GLN 123 -8.498 -5.261 8.286 895 HG3 GLN 123 1HG GLN 123 -7.825 -6.479 9.359 896 HE21 GLN 123 1HE2 GLN 123 -9.649 -3.494 9.186 897 HE22 GLN 123 2HE2 GLN 123 -10.203 -3.610 10.803 898 H THR 124 H THR 124 -6.438 -7.592 7.360 899 HA THR 124 HA THR 124 -6.220 -6.952 4.612 900 HB THR 124 HB THR 124 -7.321 -9.230 4.462 901 HG1 THR 124 1HG THR 124 -8.194 -8.915 6.696 902 HG21 THR 124 3HG2 THR 124 -5.299 -10.422 5.216 903 HG22 THR 124 1HG2 THR 124 -4.800 -8.991 6.120 904 HG23 THR 124 2HG2 THR 124 -4.870 -8.937 4.360 905 H GLY 125 H GLY 125 -7.815 -6.169 3.366 906 HA2 GLY 125 2HA GLY 125 -9.965 -5.882 2.596 907 HA3 GLY 125 1HA GLY 125 -10.585 -6.589 4.086 908 H ASP 126 H ASP 126 -8.153 -4.136 4.249 909 HA ASP 126 HA ASP 126 -10.248 -2.270 5.048 910 HB2 ASP 126 2HB ASP 126 -8.698 -3.407 6.906 911 HB3 ASP 126 1HB ASP 126 -7.610 -2.103 6.427 912 H GLU 127 H GLU 127 -9.124 -0.021 5.303 913 HA GLU 127 HA GLU 127 -7.903 0.479 2.662 914 HB2 GLU 127 2HB GLU 127 -10.306 0.930 2.780 915 HB3 GLU 127 1HB GLU 127 -10.047 1.979 4.152 916 HG2 GLU 127 2HG GLU 127 -8.838 3.532 2.748 917 HG3 GLU 127 1HG GLU 127 -9.043 2.453 1.361 918 H ILE 128 H ILE 128 -6.012 1.511 2.843 919 HA ILE 128 HA ILE 128 -5.374 2.934 5.328 920 HB ILE 128 HB ILE 128 -3.494 1.780 3.236 921 HG12 ILE 128 2HG1 ILE 128 -4.137 0.782 6.029 922 HG13 ILE 128 1HG1 ILE 128 -4.686 0.040 4.536 923 HG21 ILE 128 1HG2 ILE 128 -2.899 3.009 5.937 924 HG22 ILE 128 2HG2 ILE 128 -2.544 3.732 4.370 925 HG23 ILE 128 3HG2 ILE 128 -1.713 2.259 4.869 926 HD11 ILE 128 3HD1 ILE 128 -2.370 -0.466 3.935 927 HD12 ILE 128 1HD1 ILE 128 -2.819 -1.178 5.486 928 HD13 ILE 128 2HD1 ILE 128 -1.826 0.280 5.439 929 H GLN 129 H GLN 129 -5.400 5.052 5.174 930 HA GLN 129 HA GLN 129 -5.254 6.320 2.548 931 HB2 GLN 129 2HB GLN 129 -7.161 6.967 3.968 932 HB3 GLN 129 1HB GLN 129 -6.049 7.473 5.230 933 HG2 GLN 129 2HG GLN 129 -5.150 9.202 3.723 934 HG3 GLN 129 1HG GLN 129 -6.315 8.712 2.497 935 HE21 GLN 129 1HE2 GLN 129 -5.932 11.270 3.880 936 HE22 GLN 129 2HE2 GLN 129 -7.455 11.650 4.587 937 H ILE 130 H ILE 130 -3.357 6.956 1.927 938 HA ILE 130 HA ILE 130 -1.375 7.703 3.918 939 HB ILE 130 HB ILE 130 0.260 7.547 1.946 940 HG12 ILE 130 2HG1 ILE 130 -2.074 6.062 0.679 941 HG13 ILE 130 1HG1 ILE 130 -1.386 7.575 0.109 942 HG21 ILE 130 1HG2 ILE 130 -1.118 5.049 2.909 943 HG22 ILE 130 2HG2 ILE 130 0.237 5.883 3.682 944 HG23 ILE 130 3HG2 ILE 130 0.459 5.092 2.123 945 HD11 ILE 130 3HD1 ILE 130 -0.664 5.700 -1.254 946 HD12 ILE 130 1HD1 ILE 130 0.002 4.898 0.169 947 HD13 ILE 130 2HD1 ILE 130 0.709 6.410 -0.406 948 H GLY 131 H GLY 131 -1.768 9.696 4.412 949 HA2 GLY 131 2HA GLY 131 -1.697 11.968 4.234 950 HA3 GLY 131 1HA GLY 131 -1.202 11.789 2.553 951 H LYS 132 H LYS 132 -2.760 11.511 0.991 952 HA LYS 132 HA LYS 132 -5.477 12.393 1.744 953 HB2 LYS 132 2HB LYS 132 -4.277 14.170 0.580 954 HB3 LYS 132 1HB LYS 132 -3.889 13.076 -0.736 955 HG2 LYS 132 2HG LYS 132 -6.328 12.862 -1.196 956 HG3 LYS 132 1HG LYS 132 -6.617 14.101 0.030 957 HD2 LYS 132 2HD LYS 132 -5.273 15.676 -1.232 958 HD3 LYS 132 1HD LYS 132 -4.911 14.436 -2.430 959 HE2 LYS 132 2HE LYS 132 -7.310 14.276 -2.952 960 HE3 LYS 132 1HE LYS 132 -7.627 15.557 -1.784 961 HZ1 LYS 132 3HZ LYS 132 -7.505 16.420 -4.056 962 HZ2 LYS 132 1HZ LYS 132 -5.945 15.830 -4.213 963 HZ3 LYS 132 2HZ LYS 132 -6.274 17.060 -3.126 964 H PHE 133 H PHE 133 -3.499 10.250 -0.182 965 HA PHE 133 HA PHE 133 -5.856 9.294 -1.634 966 HB2 PHE 133 2HB PHE 133 -2.912 8.951 -2.158 967 HB3 PHE 133 1HB PHE 133 -4.188 8.165 -3.090 968 HD1 PHE 133 1HD PHE 133 -5.982 9.687 -4.101 969 HD2 PHE 133 2HD PHE 133 -2.183 11.076 -2.810 970 HE1 PHE 133 1HE PHE 133 -6.226 11.676 -5.534 971 HE2 PHE 133 2HE PHE 133 -2.424 13.062 -4.236 972 HZ PHE 133 HZ PHE 133 -4.441 13.363 -5.596 973 H ARG 134 H ARG 134 -5.938 6.878 -2.027 974 HA ARG 134 HA ARG 134 -5.164 5.665 0.469 975 HB2 ARG 134 2HB ARG 134 -7.375 4.766 0.904 976 HB3 ARG 134 1HB ARG 134 -7.348 6.517 0.919 977 HG2 ARG 134 2HG ARG 134 -8.277 6.426 -1.429 978 HG3 ARG 134 1HG ARG 134 -8.525 4.694 -1.166 979 HD2 ARG 134 2HD ARG 134 -9.756 5.326 0.944 980 HD3 ARG 134 1HD ARG 134 -9.691 6.989 0.373 981 HE ARG 134 HE ARG 134 -10.846 5.040 -1.419 982 HH11 ARG 134 1HH1 ARG 134 -11.418 7.619 0.964 983 HH12 ARG 134 2HH1 ARG 134 -13.080 7.714 0.679 984 HH21 ARG 134 1HH2 ARG 134 -13.196 5.144 -1.763 985 HH22 ARG 134 2HH2 ARG 134 -14.110 6.272 -0.860 986 H LEU 135 H LEU 135 -4.932 3.633 0.611 987 HA LEU 135 HA LEU 135 -4.751 2.066 -1.846 988 HB2 LEU 135 2HB LEU 135 -2.577 2.777 -1.105 989 HB3 LEU 135 1HB LEU 135 -2.959 2.438 0.555 990 HG LEU 135 HG LEU 135 -2.658 0.193 -1.449 991 HD11 LEU 135 1HD1 LEU 135 -0.639 1.584 -1.570 992 HD12 LEU 135 2HD1 LEU 135 -0.298 0.085 -0.701 993 HD13 LEU 135 3HD1 LEU 135 -0.531 1.586 0.188 994 HD21 LEU 135 3HD2 LEU 135 -3.625 -0.346 0.754 995 HD22 LEU 135 1HD2 LEU 135 -2.246 0.413 1.545 996 HD23 LEU 135 2HD2 LEU 135 -2.014 -1.047 0.594 997 H VAL 136 H VAL 136 -5.583 -0.035 -1.637 998 HA VAL 136 HA VAL 136 -6.687 -0.621 0.991 999 HB VAL 136 HB VAL 136 -8.538 -0.124 -0.516 1000 HG11 VAL 136 1HG1 VAL 136 -9.030 -1.456 -2.508 1001 HG12 VAL 136 2HG1 VAL 136 -7.468 -2.260 -2.322 1002 HG13 VAL 136 3HG1 VAL 136 -7.535 -0.528 -2.643 1003 HG21 VAL 136 3HG2 VAL 136 -8.956 -1.865 1.125 1004 HG22 VAL 136 1HG2 VAL 136 -8.369 -3.087 -0.002 1005 HG23 VAL 136 2HG2 VAL 136 -9.849 -2.199 -0.358 1006 H PHE 137 H PHE 137 -6.286 -2.501 1.874 1007 HA PHE 137 HA PHE 137 -4.271 -4.176 0.542 1008 HB2 PHE 137 2HB PHE 137 -3.586 -3.036 2.611 1009 HB3 PHE 137 1HB PHE 137 -4.951 -3.730 3.461 1010 HD1 PHE 137 1HD PHE 137 -1.960 -4.835 1.510 1011 HD2 PHE 137 2HD PHE 137 -4.551 -5.540 4.799 1012 HE1 PHE 137 1HE PHE 137 -0.525 -6.673 2.240 1013 HE2 PHE 137 2HE PHE 137 -3.119 -7.389 5.537 1014 HZ PHE 137 HZ PHE 137 -1.097 -7.959 4.260 1015 H LEU 138 H LEU 138 -4.954 -6.146 -0.132 1016 HA LEU 138 HA LEU 138 -7.444 -7.178 1.060 1017 HB2 LEU 138 2HB LEU 138 -6.458 -7.601 -1.766 1018 HB3 LEU 138 1HB LEU 138 -7.859 -8.360 -1.068 1019 HG LEU 138 HG LEU 138 -8.704 -6.715 -2.427 1020 HD11 LEU 138 1HD1 LEU 138 -9.773 -5.060 -1.010 1021 HD12 LEU 138 2HD1 LEU 138 -8.688 -5.503 0.307 1022 HD13 LEU 138 3HD1 LEU 138 -9.826 -6.688 -0.336 1023 HD21 LEU 138 3HD2 LEU 138 -7.971 -4.376 -2.494 1024 HD22 LEU 138 1HD2 LEU 138 -6.669 -5.485 -2.922 1025 HD23 LEU 138 2HD2 LEU 138 -6.705 -4.743 -1.321 1026 H ALA 139 H ALA 139 -7.607 -9.336 1.476 1027 HA ALA 139 HA ALA 139 -5.122 -10.759 1.821 1028 HB1 ALA 139 1HB ALA 139 -7.982 -11.571 2.404 1029 HB2 ALA 139 2HB ALA 139 -6.806 -10.970 3.580 1030 HB3 ALA 139 3HB ALA 139 -6.561 -12.527 2.803 1031 H GLY 140 H GLY 140 -4.307 -11.920 0.269 1032 HA2 GLY 140 2HA GLY 140 -5.960 -12.547 -2.037 1033 HA3 GLY 140 1HA GLY 140 -4.200 -12.591 -1.946 1034 HA PRO 141 HA PRO 141 -5.282 -16.956 -1.696 1035 HB2 PRO 141 2HB PRO 141 -2.635 -17.482 -2.663 1036 HB3 PRO 141 1HB PRO 141 -4.174 -17.756 -3.474 1037 HG2 PRO 141 2HG PRO 141 -2.350 -15.870 -4.290 1038 HG3 PRO 141 1HG PRO 141 -4.092 -15.744 -4.583 1039 HD2 PRO 141 2HD PRO 141 -2.422 -14.424 -2.485 1040 HD3 PRO 141 1HD PRO 141 -3.779 -13.784 -3.445 1041 H ALA 142 H ALA 142 -5.028 -18.055 0.101 1042 HA ALA 142 HA ALA 142 -2.598 -17.692 1.668 1043 HB1 ALA 142 1HB ALA 142 -3.794 -19.078 3.378 1044 HB2 ALA 142 2HB ALA 142 -5.166 -19.207 2.276 1045 HB3 ALA 142 3HB ALA 142 -4.715 -17.638 2.939 1046 H GLU 143 H GLU 143 -1.056 -18.859 0.823 1047 HA GLU 143 HA GLU 143 -1.681 -21.538 -0.136 1048 HB2 GLU 143 2HB GLU 143 -1.708 -19.927 -1.983 1049 HB3 GLU 143 1HB GLU 143 -0.109 -19.379 -1.540 1050 HG2 GLU 143 2HG GLU 143 0.763 -21.621 -2.078 1051 HG3 GLU 143 1HG GLU 143 -0.863 -22.087 -2.591 Start of MODEL 17 1 H1 MET 1 1HT MET 1 -19.111 32.289 -17.360 2 H2 MET 1 2HT MET 1 -20.769 32.528 -17.284 3 H3 MET 1 3HT MET 1 -20.055 31.203 -16.498 4 HA MET 1 HA MET 1 -19.500 34.015 -15.844 5 HB2 MET 1 2HB MET 1 -20.823 33.741 -13.849 6 HB3 MET 1 1HB MET 1 -21.816 33.270 -15.211 7 HG2 MET 1 2HG MET 1 -20.426 31.400 -13.298 8 HG3 MET 1 1HG MET 1 -22.137 31.812 -13.279 9 HE1 MET 1 2HE MET 1 -22.746 29.245 -13.225 10 HE2 MET 1 3HE MET 1 -21.027 28.849 -13.226 11 HE3 MET 1 1HE MET 1 -22.115 28.061 -14.371 12 H SER 2 H SER 2 -17.918 34.281 -14.315 13 HA SER 2 HA SER 2 -16.119 32.054 -14.088 14 HB2 SER 2 2HB SER 2 -15.335 34.374 -14.632 15 HB3 SER 2 1HB SER 2 -15.805 34.862 -13.003 16 HG SER 2 HG SER 2 -13.779 33.160 -13.873 17 H ASP 3 H ASP 3 -18.227 33.969 -11.989 18 HA ASP 3 HA ASP 3 -18.824 33.833 -9.823 19 HB2 ASP 3 2HB ASP 3 -18.635 31.001 -10.643 20 HB3 ASP 3 1HB ASP 3 -18.594 31.281 -8.904 21 H ASN 4 H ASN 4 -16.352 34.720 -10.164 22 HA ASN 4 HA ASN 4 -14.840 33.411 -8.035 23 HB2 ASN 4 2HB ASN 4 -12.847 34.490 -8.833 24 HB3 ASN 4 1HB ASN 4 -13.644 33.744 -10.207 25 HD21 ASN 4 1HD2 ASN 4 -11.667 35.797 -10.218 26 HD22 ASN 4 2HD2 ASN 4 -12.363 37.177 -10.977 27 H ASN 5 H ASN 5 -16.975 35.796 -8.491 28 HA ASN 5 HA ASN 5 -15.888 37.401 -6.304 29 HB2 ASN 5 2HB ASN 5 -16.488 38.676 -8.368 30 HB3 ASN 5 1HB ASN 5 -18.133 38.083 -8.230 31 HD21 ASN 5 1HD2 ASN 5 -19.486 38.997 -6.752 32 HD22 ASN 5 2HD2 ASN 5 -19.103 40.419 -5.851 33 H GLY 6 H GLY 6 -16.415 35.944 -4.721 34 HA2 GLY 6 2HA GLY 6 -19.214 35.950 -3.963 35 HA3 GLY 6 1HA GLY 6 -18.376 34.399 -4.077 36 H THR 7 H THR 7 -19.099 36.964 -2.102 37 HA THR 7 HA THR 7 -16.745 36.612 -0.461 38 HB THR 7 HB THR 7 -17.370 38.933 -0.903 39 HG1 THR 7 1HG THR 7 -18.127 39.047 1.677 40 HG21 THR 7 3HG2 THR 7 -19.442 39.933 -0.021 41 HG22 THR 7 1HG2 THR 7 -19.972 38.342 0.525 42 HG23 THR 7 2HG2 THR 7 -19.805 38.666 -1.196 43 HA PRO 8 HA PRO 8 -19.017 33.831 2.262 44 HB2 PRO 8 2HB PRO 8 -16.737 34.319 4.074 45 HB3 PRO 8 1HB PRO 8 -17.311 32.791 3.405 46 HG2 PRO 8 2HG PRO 8 -15.020 33.916 2.582 47 HG3 PRO 8 1HG PRO 8 -16.074 33.017 1.474 48 HD2 PRO 8 2HD PRO 8 -15.746 35.969 1.800 49 HD3 PRO 8 1HD PRO 8 -15.949 34.996 0.323 50 H GLU 9 H GLU 9 -20.241 34.216 4.084 51 HA GLU 9 HA GLU 9 -20.407 37.007 4.847 52 HB2 GLU 9 2HB GLU 9 -22.551 36.340 5.897 53 HB3 GLU 9 1HB GLU 9 -22.467 35.953 4.186 54 HG2 GLU 9 2HG GLU 9 -21.961 33.628 4.737 55 HG3 GLU 9 1HG GLU 9 -22.056 34.015 6.455 56 HA PRO 10 HA PRO 10 -18.606 36.043 8.831 57 HB2 PRO 10 2HB PRO 10 -19.637 38.506 9.890 58 HB3 PRO 10 1HB PRO 10 -17.959 38.063 9.547 59 HG2 PRO 10 2HG PRO 10 -19.357 39.971 8.109 60 HG3 PRO 10 1HG PRO 10 -17.982 39.054 7.475 61 HD2 PRO 10 2HD PRO 10 -20.900 38.652 7.013 62 HD3 PRO 10 1HD PRO 10 -19.523 38.417 5.913 63 H GLN 11 H GLN 11 -19.797 34.589 9.696 64 HA GLN 11 HA GLN 11 -22.584 35.140 10.322 65 HB2 GLN 11 2HB GLN 11 -22.871 32.699 10.626 66 HB3 GLN 11 1HB GLN 11 -22.318 33.155 9.028 67 HG2 GLN 11 2HG GLN 11 -20.033 32.470 9.653 68 HG3 GLN 11 1HG GLN 11 -20.639 31.959 11.230 69 HE21 GLN 11 1HE2 GLN 11 -20.091 29.805 10.894 70 HE22 GLN 11 2HE2 GLN 11 -20.948 28.798 9.786 71 H VAL 12 H VAL 12 -23.224 35.666 12.224 72 HA VAL 12 HA VAL 12 -21.402 35.326 14.431 73 HB VAL 12 HB VAL 12 -22.507 37.529 14.100 74 HG11 VAL 12 1HG1 VAL 12 -24.645 36.826 13.254 75 HG12 VAL 12 2HG1 VAL 12 -24.844 37.880 14.655 76 HG13 VAL 12 3HG1 VAL 12 -25.071 36.139 14.823 77 HG21 VAL 12 3HG2 VAL 12 -21.701 36.987 16.319 78 HG22 VAL 12 1HG2 VAL 12 -23.219 36.170 16.693 79 HG23 VAL 12 2HG2 VAL 12 -23.196 37.915 16.439 80 H GLU 13 H GLU 13 -21.766 34.008 16.160 81 HA GLU 13 HA GLU 13 -23.704 31.948 15.759 82 HB2 GLU 13 2HB GLU 13 -22.753 30.946 17.778 83 HB3 GLU 13 1HB GLU 13 -21.492 31.364 16.634 84 HG2 GLU 13 2HG GLU 13 -20.975 33.355 17.975 85 HG3 GLU 13 1HG GLU 13 -22.243 32.890 19.109 86 H THR 14 H THR 14 -25.606 31.707 16.817 87 HA THR 14 HA THR 14 -26.193 33.674 18.869 88 HB THR 14 HB THR 14 -28.123 33.063 16.610 89 HG1 THR 14 1HG THR 14 -25.948 34.393 16.433 90 HG21 THR 14 3HG2 THR 14 -29.298 35.055 17.459 91 HG22 THR 14 1HG2 THR 14 -28.073 35.253 18.714 92 HG23 THR 14 2HG2 THR 14 -29.143 33.850 18.737 93 H THR 15 H THR 15 -25.657 31.745 20.014 94 HA THR 15 HA THR 15 -27.611 30.766 21.493 95 HB THR 15 HB THR 15 -28.516 29.376 19.607 96 HG1 THR 15 1HG THR 15 -28.708 27.535 20.839 97 HG21 THR 15 3HG2 THR 15 -27.198 27.482 18.711 98 HG22 THR 15 1HG2 THR 15 -25.795 28.041 19.623 99 HG23 THR 15 2HG2 THR 15 -26.453 29.033 18.320 100 H SER 16 H SER 16 -26.691 29.856 23.224 101 HA SER 16 HA SER 16 -24.069 28.666 23.087 102 HB2 SER 16 2HB SER 16 -24.621 31.195 24.665 103 HB3 SER 16 1HB SER 16 -23.138 30.241 24.759 104 HG SER 16 HG SER 16 -23.755 30.797 22.226 105 H VAL 17 H VAL 17 -26.636 27.742 23.589 106 HA VAL 17 HA VAL 17 -27.299 27.585 26.323 107 HB VAL 17 HB VAL 17 -27.914 25.631 24.090 108 HG11 VAL 17 1HG1 VAL 17 -28.303 24.689 26.319 109 HG12 VAL 17 2HG1 VAL 17 -29.802 24.915 25.426 110 HG13 VAL 17 3HG1 VAL 17 -29.367 26.048 26.696 111 HG21 VAL 17 3HG2 VAL 17 -29.518 27.991 25.063 112 HG22 VAL 17 1HG2 VAL 17 -30.063 26.811 23.874 113 HG23 VAL 17 2HG2 VAL 17 -28.691 27.862 23.511 114 H PHE 18 H PHE 18 -26.188 26.586 27.819 115 HA PHE 18 HA PHE 18 -24.046 24.861 27.083 116 HB2 PHE 18 2HB PHE 18 -23.569 24.670 29.577 117 HB3 PHE 18 1HB PHE 18 -23.477 26.288 28.910 118 HD1 PHE 18 1HD PHE 18 -25.194 27.955 29.487 119 HD2 PHE 18 2HD PHE 18 -25.183 24.078 31.238 120 HE1 PHE 18 1HE PHE 18 -26.682 28.759 31.267 121 HE2 PHE 18 2HE PHE 18 -26.679 24.871 33.016 122 HZ PHE 18 HZ PHE 18 -27.431 27.217 33.036 123 H ARG 19 H ARG 19 -24.449 23.068 26.345 124 HA ARG 19 HA ARG 19 -26.542 21.399 27.541 125 HB2 ARG 19 2HB ARG 19 -25.413 21.497 24.757 126 HB3 ARG 19 1HB ARG 19 -26.498 20.246 25.324 127 HG2 ARG 19 2HG ARG 19 -28.261 21.825 25.647 128 HG3 ARG 19 1HG ARG 19 -27.169 23.174 25.306 129 HD2 ARG 19 2HD ARG 19 -28.632 22.588 23.398 130 HD3 ARG 19 1HD ARG 19 -26.914 22.456 23.032 131 HE ARG 19 HE ARG 19 -27.823 19.953 23.867 132 HH11 ARG 19 1HH1 ARG 19 -28.356 22.160 21.146 133 HH12 ARG 19 2HH1 ARG 19 -28.598 20.917 20.009 134 HH21 ARG 19 1HH2 ARG 19 -28.121 18.272 22.347 135 HH22 ARG 19 2HH2 ARG 19 -28.460 18.615 20.706 136 H ALA 20 H ALA 20 -26.142 19.259 27.783 137 HA ALA 20 HA ALA 20 -23.563 18.134 27.175 138 HB1 ALA 20 1HB ALA 20 -23.395 17.148 29.455 139 HB2 ALA 20 2HB ALA 20 -24.779 18.114 29.961 140 HB3 ALA 20 3HB ALA 20 -23.273 18.907 29.502 141 H ASP 21 H ASP 21 -24.634 16.928 25.660 142 HA ASP 21 HA ASP 21 -27.245 15.991 26.151 143 HB2 ASP 21 2HB ASP 21 -25.344 15.272 23.911 144 HB3 ASP 21 1HB ASP 21 -27.037 14.800 23.988 145 H LEU 22 H LEU 22 -24.172 14.230 25.806 146 HA LEU 22 HA LEU 22 -24.583 12.636 28.048 147 HB2 LEU 22 2HB LEU 22 -26.444 11.753 26.457 148 HB3 LEU 22 1HB LEU 22 -25.143 11.020 25.553 149 HG LEU 22 HG LEU 22 -26.317 9.427 27.017 150 HD11 LEU 22 1HD1 LEU 22 -24.414 8.424 28.163 151 HD12 LEU 22 2HD1 LEU 22 -23.472 9.887 27.850 152 HD13 LEU 22 3HD1 LEU 22 -24.044 8.895 26.510 153 HD21 LEU 22 3HD2 LEU 22 -26.984 10.919 28.794 154 HD22 LEU 22 1HD2 LEU 22 -25.305 11.113 29.297 155 HD23 LEU 22 2HD2 LEU 22 -26.092 9.543 29.443 156 H LEU 23 H LEU 23 -22.475 12.604 28.480 157 HA LEU 23 HA LEU 23 -20.940 10.897 26.850 158 HB2 LEU 23 2HB LEU 23 -18.891 12.314 26.693 159 HB3 LEU 23 1HB LEU 23 -20.221 12.958 25.791 160 HG LEU 23 HG LEU 23 -19.161 14.805 26.581 161 HD11 LEU 23 1HD1 LEU 23 -21.275 14.424 28.618 162 HD12 LEU 23 2HD1 LEU 23 -21.416 15.153 27.018 163 HD13 LEU 23 3HD1 LEU 23 -20.457 15.945 28.269 164 HD21 LEU 23 3HD2 LEU 23 -18.279 15.188 28.845 165 HD22 LEU 23 1HD2 LEU 23 -17.527 13.819 28.030 166 HD23 LEU 23 2HD2 LEU 23 -18.741 13.542 29.278 167 H LYS 24 H LYS 24 -20.888 9.388 28.202 168 HA LYS 24 HA LYS 24 -20.390 9.996 31.004 169 HB2 LYS 24 2HB LYS 24 -21.137 7.555 31.354 170 HB3 LYS 24 1HB LYS 24 -22.341 8.740 30.891 171 HG2 LYS 24 2HG LYS 24 -22.742 6.695 29.697 172 HG3 LYS 24 1HG LYS 24 -22.201 7.915 28.558 173 HD2 LYS 24 2HD LYS 24 -19.931 6.926 28.655 174 HD3 LYS 24 1HD LYS 24 -20.553 5.659 29.713 175 HE2 LYS 24 2HE LYS 24 -21.437 6.217 26.872 176 HE3 LYS 24 1HE LYS 24 -20.439 4.873 27.410 177 HZ1 LYS 24 3HZ LYS 24 -22.336 4.065 28.708 178 HZ2 LYS 24 1HZ LYS 24 -22.692 4.193 27.074 179 HZ3 LYS 24 2HZ LYS 24 -23.288 5.336 28.141 180 H GLU 25 H GLU 25 -19.294 8.066 32.244 181 HA GLU 25 HA GLU 25 -16.614 8.019 31.217 182 HB2 GLU 25 2HB GLU 25 -17.738 6.826 33.760 183 HB3 GLU 25 1HB GLU 25 -16.037 7.014 33.362 184 HG2 GLU 25 2HG GLU 25 -18.017 9.224 33.838 185 HG3 GLU 25 1HG GLU 25 -16.720 8.721 34.915 186 H MET 26 H MET 26 -16.221 6.599 29.708 187 HA MET 26 HA MET 26 -17.030 3.822 30.147 188 HB2 MET 26 2HB MET 26 -18.455 4.744 28.402 189 HB3 MET 26 1HB MET 26 -17.063 5.378 27.550 190 HG2 MET 26 2HG MET 26 -17.945 3.392 26.454 191 HG3 MET 26 1HG MET 26 -16.309 3.121 27.043 192 HE1 MET 26 3HE MET 26 -20.111 1.378 29.038 193 HE2 MET 26 1HE MET 26 -20.145 2.380 27.588 194 HE3 MET 26 2HE MET 26 -19.696 3.087 29.142 195 H GLU 27 H GLU 27 -15.385 2.406 29.978 196 HA GLU 27 HA GLU 27 -12.759 3.443 29.384 197 HB2 GLU 27 2HB GLU 27 -13.686 0.672 30.193 198 HB3 GLU 27 1HB GLU 27 -12.013 1.160 30.006 199 HG2 GLU 27 2HG GLU 27 -12.253 2.758 31.822 200 HG3 GLU 27 1HG GLU 27 -13.950 2.313 31.997 201 H SER 28 H SER 28 -11.558 2.767 27.635 202 HA SER 28 HA SER 28 -13.149 1.648 25.467 203 HB2 SER 28 2HB SER 28 -12.001 3.858 25.133 204 HB3 SER 28 1HB SER 28 -10.456 3.046 25.369 205 HG SER 28 HG SER 28 -11.907 3.285 23.166 206 H SER 29 H SER 29 -12.318 -0.161 24.295 207 HA SER 29 HA SER 29 -10.673 -1.852 25.932 208 HB2 SER 29 2HB SER 29 -11.993 -2.422 23.270 209 HB3 SER 29 1HB SER 29 -11.248 -3.614 24.341 210 HG SER 29 HG SER 29 -12.801 -2.869 25.955 211 H THR 30 H THR 30 -8.685 -0.915 25.832 212 HA THR 30 HA THR 30 -7.327 -1.115 23.259 213 HB THR 30 HB THR 30 -6.689 0.750 25.572 214 HG1 THR 30 1HG THR 30 -8.475 0.971 23.596 215 HG21 THR 30 3HG2 THR 30 -5.486 0.550 22.792 216 HG22 THR 30 1HG2 THR 30 -4.693 0.075 24.294 217 HG23 THR 30 2HG2 THR 30 -5.080 1.771 23.997 218 H GLY 31 H GLY 31 -6.444 -3.066 23.407 219 HA2 GLY 31 2HA GLY 31 -5.146 -3.831 25.915 220 HA3 GLY 31 1HA GLY 31 -5.655 -4.936 24.641 221 H THR 32 H THR 32 -3.696 -5.874 24.353 222 HA THR 32 HA THR 32 -1.520 -4.150 23.404 223 HB THR 32 HB THR 32 -1.403 -7.003 24.434 224 HG1 THR 32 1HG THR 32 -2.006 -5.015 25.845 225 HG21 THR 32 3HG2 THR 32 0.740 -4.911 24.037 226 HG22 THR 32 1HG2 THR 32 0.487 -6.319 23.007 227 HG23 THR 32 2HG2 THR 32 0.992 -6.531 24.686 228 H ALA 33 H ALA 33 -0.541 -4.777 21.363 229 HA ALA 33 HA ALA 33 -2.231 -6.473 19.734 230 HB1 ALA 33 1HB ALA 33 0.214 -4.841 19.007 231 HB2 ALA 33 2HB ALA 33 -1.460 -4.327 18.803 232 HB3 ALA 33 3HB ALA 33 -0.832 -5.682 17.868 233 HA PRO 34 HA PRO 34 0.796 -9.715 20.721 234 HB2 PRO 34 2HB PRO 34 -1.046 -11.563 19.454 235 HB3 PRO 34 1HB PRO 34 -0.619 -11.446 21.161 236 HG2 PRO 34 2HG PRO 34 -3.091 -10.823 20.203 237 HG3 PRO 34 1HG PRO 34 -2.386 -10.057 21.638 238 HD2 PRO 34 2HD PRO 34 -2.556 -9.015 18.834 239 HD3 PRO 34 1HD PRO 34 -2.828 -8.185 20.389 240 H ALA 35 H ALA 35 2.419 -10.429 19.433 241 HA ALA 35 HA ALA 35 1.888 -10.546 16.554 242 HB1 ALA 35 1HB ALA 35 4.516 -10.031 17.960 243 HB2 ALA 35 2HB ALA 35 3.535 -8.814 17.148 244 HB3 ALA 35 3HB ALA 35 4.281 -10.112 16.214 245 H SER 36 H SER 36 1.962 -12.496 15.690 246 HA SER 36 HA SER 36 3.059 -14.637 17.330 247 HB2 SER 36 2HB SER 36 0.634 -14.770 16.787 248 HB3 SER 36 1HB SER 36 1.030 -14.781 15.072 249 HG SER 36 HG SER 36 1.303 -16.803 15.232 250 H THR 37 H THR 37 5.131 -14.678 16.740 251 HA THR 37 HA THR 37 5.854 -14.784 13.899 252 HB THR 37 HB THR 37 7.703 -14.494 16.272 253 HG1 THR 37 1HG THR 37 6.295 -12.437 14.834 254 HG21 THR 37 3HG2 THR 37 8.724 -14.999 14.080 255 HG22 THR 37 1HG2 THR 37 9.144 -13.377 14.630 256 HG23 THR 37 2HG2 THR 37 7.915 -13.592 13.387 257 H GLY 38 H GLY 38 7.071 -16.625 13.138 258 HA2 GLY 38 2HA GLY 38 7.753 -18.710 15.034 259 HA3 GLY 38 1HA GLY 38 6.623 -19.106 13.739 260 H ALA 39 H ALA 39 9.679 -17.487 14.252 261 HA ALA 39 HA ALA 39 10.485 -17.259 11.610 262 HB1 ALA 39 1HB ALA 39 11.444 -15.977 13.460 263 HB2 ALA 39 2HB ALA 39 12.678 -16.738 12.457 264 HB3 ALA 39 3HB ALA 39 12.265 -17.431 14.023 265 H GLU 40 H GLU 40 10.855 -19.981 13.740 266 HA GLU 40 HA GLU 40 12.909 -21.273 12.288 267 HB2 GLU 40 2HB GLU 40 12.351 -23.254 13.585 268 HB3 GLU 40 1HB GLU 40 12.350 -21.834 14.618 269 HG2 GLU 40 2HG GLU 40 9.853 -21.771 14.367 270 HG3 GLU 40 1HG GLU 40 9.974 -23.314 13.544 271 H ASN 41 H ASN 41 9.432 -21.258 11.979 272 HA ASN 41 HA ASN 41 9.412 -23.317 9.931 273 HB2 ASN 41 2HB ASN 41 7.227 -21.594 11.104 274 HB3 ASN 41 1HB ASN 41 6.955 -22.615 9.704 275 HD21 ASN 41 1HD2 ASN 41 5.451 -23.848 10.777 276 HD22 ASN 41 2HD2 ASN 41 5.854 -24.978 11.993 277 H LEU 42 H LEU 42 9.028 -19.882 10.239 278 HA LEU 42 HA LEU 42 8.792 -18.185 8.864 279 HB2 LEU 42 2HB LEU 42 11.102 -18.705 8.274 280 HB3 LEU 42 1HB LEU 42 10.571 -19.850 7.066 281 HG LEU 42 HG LEU 42 9.619 -17.975 5.735 282 HD11 LEU 42 1HD1 LEU 42 10.117 -15.685 6.302 283 HD12 LEU 42 2HD1 LEU 42 10.891 -16.214 7.794 284 HD13 LEU 42 3HD1 LEU 42 9.159 -16.457 7.568 285 HD21 LEU 42 3HD2 LEU 42 12.522 -17.628 6.474 286 HD22 LEU 42 1HD2 LEU 42 11.747 -17.007 5.018 287 HD23 LEU 42 2HD2 LEU 42 11.879 -18.744 5.267 288 HA PRO 43 HA PRO 43 5.220 -20.114 6.656 289 HB2 PRO 43 2HB PRO 43 3.952 -17.749 7.923 290 HB3 PRO 43 1HB PRO 43 3.392 -19.425 7.884 291 HG2 PRO 43 2HG PRO 43 4.358 -18.411 10.131 292 HG3 PRO 43 1HG PRO 43 4.780 -20.061 9.644 293 HD2 PRO 43 2HD PRO 43 6.391 -17.548 9.376 294 HD3 PRO 43 1HD PRO 43 6.903 -19.153 9.934 295 H ALA 44 H ALA 44 4.617 -19.457 4.657 296 HA ALA 44 HA ALA 44 5.774 -17.010 3.659 297 HB1 ALA 44 1HB ALA 44 5.972 -19.071 2.339 298 HB2 ALA 44 2HB ALA 44 5.062 -17.842 1.457 299 HB3 ALA 44 3HB ALA 44 4.214 -19.174 2.236 300 H GLY 45 H GLY 45 4.603 -15.302 2.838 301 HA2 GLY 45 2HA GLY 45 1.883 -15.194 2.462 302 HA3 GLY 45 1HA GLY 45 2.228 -14.676 4.113 303 H SER 46 H SER 46 2.087 -13.743 0.965 304 HA SER 46 HA SER 46 3.843 -11.454 1.395 305 HB2 SER 46 2HB SER 46 2.423 -12.358 -1.122 306 HB3 SER 46 1HB SER 46 3.699 -11.138 -1.015 307 HG SER 46 HG SER 46 5.179 -12.775 -0.450 308 H ALA 47 H ALA 47 2.900 -9.312 0.604 309 HA ALA 47 HA ALA 47 0.028 -9.193 1.208 310 HB1 ALA 47 1HB ALA 47 1.323 -8.354 3.112 311 HB2 ALA 47 2HB ALA 47 0.416 -7.057 2.334 312 HB3 ALA 47 3HB ALA 47 2.149 -7.217 2.047 313 H LEU 48 H LEU 48 -1.127 -8.069 -0.193 314 HA LEU 48 HA LEU 48 0.401 -6.546 -2.182 315 HB2 LEU 48 2HB LEU 48 -1.226 -7.015 -3.928 316 HB3 LEU 48 1HB LEU 48 -0.524 -8.491 -3.318 317 HG LEU 48 HG LEU 48 -3.265 -7.535 -2.470 318 HD11 LEU 48 1HD1 LEU 48 -2.531 -9.381 -4.741 319 HD12 LEU 48 2HD1 LEU 48 -3.212 -7.763 -4.906 320 HD13 LEU 48 3HD1 LEU 48 -4.165 -9.048 -4.164 321 HD21 LEU 48 3HD2 LEU 48 -1.955 -10.256 -2.487 322 HD22 LEU 48 1HD2 LEU 48 -3.596 -9.901 -1.947 323 HD23 LEU 48 2HD2 LEU 48 -2.220 -9.255 -1.059 324 H LEU 49 H LEU 49 -0.264 -4.631 -2.815 325 HA LEU 49 HA LEU 49 -2.589 -3.594 -1.424 326 HB2 LEU 49 2HB LEU 49 -1.430 -1.374 -1.267 327 HB3 LEU 49 1HB LEU 49 -0.771 -2.628 -0.261 328 HG LEU 49 HG LEU 49 1.069 -2.900 -1.996 329 HD11 LEU 49 1HD1 LEU 49 1.570 -1.016 -3.445 330 HD12 LEU 49 2HD1 LEU 49 0.050 -0.247 -2.995 331 HD13 LEU 49 3HD1 LEU 49 0.038 -1.768 -3.882 332 HD21 LEU 49 3HD2 LEU 49 2.356 -1.033 -1.136 333 HD22 LEU 49 1HD2 LEU 49 1.415 -1.797 0.144 334 HD23 LEU 49 2HD2 LEU 49 0.884 -0.259 -0.558 335 H VAL 50 H VAL 50 -3.925 -2.300 -2.486 336 HA VAL 50 HA VAL 50 -3.428 -1.987 -5.380 337 HB VAL 50 HB VAL 50 -6.131 -2.263 -4.031 338 HG11 VAL 50 1HG1 VAL 50 -5.407 -2.244 -6.952 339 HG12 VAL 50 2HG1 VAL 50 -6.211 -0.956 -6.060 340 HG13 VAL 50 3HG1 VAL 50 -7.022 -2.504 -6.292 341 HG21 VAL 50 3HG2 VAL 50 -4.617 -4.335 -5.628 342 HG22 VAL 50 1HG2 VAL 50 -6.276 -4.493 -5.052 343 HG23 VAL 50 2HG2 VAL 50 -4.943 -4.395 -3.898 344 H VAL 51 H VAL 51 -3.391 0.058 -6.045 345 HA VAL 51 HA VAL 51 -4.173 2.169 -4.168 346 HB VAL 51 HB VAL 51 -2.780 2.357 -6.855 347 HG11 VAL 51 1HG1 VAL 51 -3.034 4.385 -4.635 348 HG12 VAL 51 2HG1 VAL 51 -3.872 4.434 -6.181 349 HG13 VAL 51 3HG1 VAL 51 -2.115 4.598 -6.127 350 HG21 VAL 51 3HG2 VAL 51 -0.696 2.663 -5.590 351 HG22 VAL 51 1HG2 VAL 51 -1.411 1.077 -5.311 352 HG23 VAL 51 2HG2 VAL 51 -1.569 2.344 -4.092 353 H LYS 52 H LYS 52 -6.141 2.805 -4.242 354 HA LYS 52 HA LYS 52 -7.772 2.599 -6.622 355 HB2 LYS 52 2HB LYS 52 -8.245 3.733 -3.872 356 HB3 LYS 52 1HB LYS 52 -9.459 3.821 -5.131 357 HG2 LYS 52 2HG LYS 52 -8.301 1.260 -4.043 358 HG3 LYS 52 1HG LYS 52 -9.817 1.983 -3.506 359 HD2 LYS 52 2HD LYS 52 -10.666 1.817 -5.833 360 HD3 LYS 52 1HD LYS 52 -9.177 0.990 -6.288 361 HE2 LYS 52 2HE LYS 52 -9.688 -0.802 -4.702 362 HE3 LYS 52 1HE LYS 52 -11.168 0.029 -4.232 363 HZ1 LYS 52 3HZ LYS 52 -11.581 -1.736 -5.827 364 HZ2 LYS 52 1HZ LYS 52 -10.551 -1.026 -6.935 365 HZ3 LYS 52 2HZ LYS 52 -11.980 -0.248 -6.521 366 H ARG 53 H ARG 53 -6.327 5.085 -4.609 367 HA ARG 53 HA ARG 53 -6.153 6.912 -6.839 368 HB2 ARG 53 2HB ARG 53 -7.539 7.695 -4.242 369 HB3 ARG 53 1HB ARG 53 -7.058 8.818 -5.501 370 HG2 ARG 53 2HG ARG 53 -8.627 7.724 -7.044 371 HG3 ARG 53 1HG ARG 53 -9.104 6.631 -5.751 372 HD2 ARG 53 2HD ARG 53 -10.739 8.364 -5.886 373 HD3 ARG 53 1HD ARG 53 -9.797 8.620 -4.421 374 HE ARG 53 HE ARG 53 -8.683 10.100 -6.519 375 HH11 ARG 53 1HH1 ARG 53 -11.505 10.033 -4.397 376 HH12 ARG 53 2HH1 ARG 53 -11.920 11.663 -4.585 377 HH21 ARG 53 1HH2 ARG 53 -9.198 12.447 -6.764 378 HH22 ARG 53 2HH2 ARG 53 -10.544 13.079 -5.952 379 H GLY 54 H GLY 54 -4.501 8.431 -6.449 380 HA2 GLY 54 2HA GLY 54 -3.120 9.183 -4.400 381 HA3 GLY 54 1HA GLY 54 -2.653 7.487 -4.416 382 HA PRO 55 HA PRO 55 -0.461 10.190 -7.791 383 HB2 PRO 55 2HB PRO 55 1.685 10.800 -5.912 384 HB3 PRO 55 1HB PRO 55 0.794 11.898 -6.972 385 HG2 PRO 55 2HG PRO 55 0.466 11.914 -4.302 386 HG3 PRO 55 1HG PRO 55 -0.873 12.248 -5.414 387 HD2 PRO 55 2HD PRO 55 -0.235 9.739 -3.914 388 HD3 PRO 55 1HD PRO 55 -1.795 10.543 -4.196 389 H ASN 56 H ASN 56 0.350 7.767 -5.581 390 HA ASN 56 HA ASN 56 2.759 6.749 -6.078 391 HB2 ASN 56 2HB ASN 56 1.409 5.471 -4.651 392 HB3 ASN 56 1HB ASN 56 0.103 5.401 -5.803 393 HD21 ASN 56 1HD2 ASN 56 3.330 4.092 -5.157 394 HD22 ASN 56 2HD2 ASN 56 3.072 2.621 -6.023 395 H ALA 57 H ALA 57 -0.122 5.913 -8.010 396 HA ALA 57 HA ALA 57 0.786 6.121 -10.599 397 HB1 ALA 57 1HB ALA 57 1.095 3.293 -9.524 398 HB2 ALA 57 2HB ALA 57 2.400 4.326 -10.115 399 HB3 ALA 57 3HB ALA 57 1.161 3.750 -11.229 400 H GLY 58 H GLY 58 -0.753 3.568 -8.742 401 HA2 GLY 58 2HA GLY 58 -3.231 3.565 -8.553 402 HA3 GLY 58 1HA GLY 58 -3.245 4.102 -10.234 403 H ALA 59 H ALA 59 -1.558 1.531 -8.449 404 HA ALA 59 HA ALA 59 -2.593 -0.413 -10.335 405 HB1 ALA 59 1HB ALA 59 -0.331 -1.317 -10.676 406 HB2 ALA 59 2HB ALA 59 0.336 0.002 -9.716 407 HB3 ALA 59 3HB ALA 59 -0.448 0.345 -11.257 408 H ARG 60 H ARG 60 -1.355 -2.602 -9.472 409 HA ARG 60 HA ARG 60 -1.635 -2.556 -6.580 410 HB2 ARG 60 2HB ARG 60 -2.572 -4.852 -6.709 411 HB3 ARG 60 1HB ARG 60 -3.587 -3.652 -7.498 412 HG2 ARG 60 2HG ARG 60 -2.760 -4.372 -9.675 413 HG3 ARG 60 1HG ARG 60 -1.729 -5.568 -8.883 414 HD2 ARG 60 2HD ARG 60 -3.706 -6.677 -7.982 415 HD3 ARG 60 1HD ARG 60 -4.738 -5.458 -8.728 416 HE ARG 60 HE ARG 60 -3.044 -6.776 -10.607 417 HH11 ARG 60 1HH1 ARG 60 -6.091 -7.107 -8.839 418 HH12 ARG 60 2HH1 ARG 60 -6.798 -8.168 -9.972 419 HH21 ARG 60 1HH2 ARG 60 -4.074 -8.256 -12.183 420 HH22 ARG 60 2HH2 ARG 60 -5.653 -8.830 -11.850 421 H PHE 61 H PHE 61 -0.054 -3.547 -5.485 422 HA PHE 61 HA PHE 61 2.048 -4.823 -7.088 423 HB2 PHE 61 2HB PHE 61 2.473 -2.840 -4.833 424 HB3 PHE 61 1HB PHE 61 3.744 -3.736 -5.647 425 HD1 PHE 61 1HD PHE 61 4.282 -3.241 -8.010 426 HD2 PHE 61 2HD PHE 61 1.527 -0.872 -5.798 427 HE1 PHE 61 1HE PHE 61 4.495 -1.444 -9.674 428 HE2 PHE 61 2HE PHE 61 1.732 0.930 -7.458 429 HZ PHE 61 HZ PHE 61 3.219 0.646 -9.402 430 H LEU 62 H LEU 62 2.974 -6.565 -6.196 431 HA LEU 62 HA LEU 62 1.828 -7.533 -3.680 432 HB2 LEU 62 2HB LEU 62 1.549 -8.983 -5.680 433 HB3 LEU 62 1HB LEU 62 3.287 -9.027 -5.874 434 HG LEU 62 HG LEU 62 3.480 -10.243 -3.724 435 HD11 LEU 62 1HD1 LEU 62 1.467 -9.421 -2.622 436 HD12 LEU 62 2HD1 LEU 62 1.491 -11.182 -2.685 437 HD13 LEU 62 3HD1 LEU 62 0.470 -10.280 -3.803 438 HD21 LEU 62 3HD2 LEU 62 3.376 -11.484 -5.808 439 HD22 LEU 62 1HD2 LEU 62 1.615 -11.505 -5.732 440 HD23 LEU 62 2HD2 LEU 62 2.558 -12.365 -4.517 441 H LEU 63 H LEU 63 3.066 -7.155 -1.989 442 HA LEU 63 HA LEU 63 5.908 -6.725 -2.386 443 HB2 LEU 63 2HB LEU 63 4.171 -6.138 0.016 444 HB3 LEU 63 1HB LEU 63 5.887 -5.840 -0.069 445 HG LEU 63 HG LEU 63 4.845 -3.765 -0.333 446 HD11 LEU 63 1HD1 LEU 63 6.690 -4.064 -1.830 447 HD12 LEU 63 2HD1 LEU 63 5.478 -2.996 -2.531 448 HD13 LEU 63 3HD1 LEU 63 5.608 -4.664 -3.090 449 HD21 LEU 63 3HD2 LEU 63 2.582 -4.455 -0.837 450 HD22 LEU 63 1HD2 LEU 63 3.078 -4.975 -2.449 451 HD23 LEU 63 2HD2 LEU 63 3.137 -3.268 -2.019 452 H ASP 64 H ASP 64 7.165 -8.312 -2.123 453 HA ASP 64 HA ASP 64 6.657 -10.237 0.043 454 HB2 ASP 64 2HB ASP 64 6.452 -11.175 -2.313 455 HB3 ASP 64 1HB ASP 64 8.143 -10.760 -2.561 456 H GLN 65 H GLN 65 8.178 -7.631 -0.620 457 HA GLN 65 HA GLN 65 10.871 -8.322 0.195 458 HB2 GLN 65 2HB GLN 65 11.212 -5.781 -0.136 459 HB3 GLN 65 1HB GLN 65 10.949 -6.753 -1.574 460 HG2 GLN 65 2HG GLN 65 8.603 -6.041 -1.631 461 HG3 GLN 65 1HG GLN 65 8.847 -5.120 -0.157 462 HE21 GLN 65 1HE2 GLN 65 11.459 -4.082 -0.939 463 HE22 GLN 65 2HE2 GLN 65 11.106 -2.889 -2.150 464 HA PRO 66 HA PRO 66 9.563 -7.924 4.442 465 HB2 PRO 66 2HB PRO 66 12.164 -7.480 5.431 466 HB3 PRO 66 1HB PRO 66 11.330 -9.032 5.306 467 HG2 PRO 66 2HG PRO 66 13.352 -7.822 3.509 468 HG3 PRO 66 1HG PRO 66 13.038 -9.523 3.867 469 HD2 PRO 66 2HD PRO 66 12.325 -8.379 1.542 470 HD3 PRO 66 1HD PRO 66 11.362 -9.677 2.278 471 H THR 67 H THR 67 11.984 -5.585 3.281 472 HA THR 67 HA THR 67 10.674 -3.609 4.977 473 HB THR 67 HB THR 67 13.383 -3.442 3.624 474 HG1 THR 67 1HG THR 67 12.489 -4.524 6.010 475 HG21 THR 67 3HG2 THR 67 13.740 -1.545 5.163 476 HG22 THR 67 1HG2 THR 67 12.098 -1.734 5.781 477 HG23 THR 67 2HG2 THR 67 12.362 -1.246 4.106 478 H THR 68 H THR 68 9.025 -2.793 3.786 479 HA THR 68 HA THR 68 9.632 -1.897 1.069 480 HB THR 68 HB THR 68 6.957 -2.360 2.438 481 HG1 THR 68 1HG THR 68 8.355 -4.270 1.767 482 HG21 THR 68 3HG2 THR 68 6.002 -2.059 0.203 483 HG22 THR 68 1HG2 THR 68 7.612 -1.744 -0.447 484 HG23 THR 68 2HG2 THR 68 6.893 -0.621 0.704 485 H THR 69 H THR 69 10.106 0.277 1.068 486 HA THR 69 HA THR 69 8.821 1.810 3.171 487 HB THR 69 HB THR 69 11.214 1.497 3.634 488 HG1 THR 69 1HG THR 69 11.084 3.282 4.517 489 HG21 THR 69 3HG2 THR 69 12.107 1.343 1.371 490 HG22 THR 69 1HG2 THR 69 12.928 2.626 2.264 491 HG23 THR 69 2HG2 THR 69 11.693 3.030 1.071 492 H ALA 70 H ALA 70 7.734 3.588 2.647 493 HA ALA 70 HA ALA 70 7.671 4.315 -0.189 494 HB1 ALA 70 1HB ALA 70 5.405 4.316 1.805 495 HB2 ALA 70 2HB ALA 70 5.634 3.145 0.507 496 HB3 ALA 70 3HB ALA 70 5.300 4.833 0.123 497 H GLY 71 H GLY 71 8.702 6.150 -0.345 498 HA2 GLY 71 2HA GLY 71 8.968 8.485 -0.020 499 HA3 GLY 71 1HA GLY 71 7.953 8.349 1.412 500 H ARG 72 H ARG 72 11.073 7.413 0.126 501 HA ARG 72 HA ARG 72 12.251 7.984 2.706 502 HB2 ARG 72 2HB ARG 72 11.592 5.444 2.396 503 HB3 ARG 72 1HB ARG 72 12.988 5.413 1.341 504 HG2 ARG 72 2HG ARG 72 13.010 6.154 4.264 505 HG3 ARG 72 1HG ARG 72 13.485 4.597 3.600 506 HD2 ARG 72 2HD ARG 72 14.839 7.258 3.132 507 HD3 ARG 72 1HD ARG 72 15.423 5.957 4.169 508 HE ARG 72 HE ARG 72 15.102 4.877 1.666 509 HH11 ARG 72 1HH1 ARG 72 17.163 7.283 3.237 510 HH12 ARG 72 2HH1 ARG 72 18.362 7.268 2.030 511 HH21 ARG 72 1HH2 ARG 72 16.752 4.860 0.000 512 HH22 ARG 72 2HH2 ARG 72 18.080 5.928 0.106 513 H HIS 73 H HIS 73 12.987 9.715 1.533 514 HA HIS 73 HA HIS 73 14.663 10.938 0.526 515 HB2 HIS 73 2HB HIS 73 15.918 8.753 1.510 516 HB3 HIS 73 1HB HIS 73 16.179 8.449 -0.194 517 HD1 HIS 73 1HD HIS 73 18.403 9.234 -0.905 518 HD2 HIS 73 2HD HIS 73 16.832 11.565 2.151 519 HE1 HIS 73 1HE HIS 73 20.177 10.937 -0.331 520 HA PRO 74 HA PRO 74 13.891 10.995 -3.982 521 HB2 PRO 74 2HB PRO 74 16.804 10.480 -4.413 522 HB3 PRO 74 1HB PRO 74 15.743 11.639 -5.224 523 HG2 PRO 74 2HG PRO 74 17.418 12.425 -3.314 524 HG3 PRO 74 1HG PRO 74 15.796 13.126 -3.462 525 HD2 PRO 74 2HD PRO 74 16.865 11.250 -1.440 526 HD3 PRO 74 1HD PRO 74 15.539 12.420 -1.306 527 H GLU 75 H GLU 75 16.282 8.501 -2.984 528 HA GLU 75 HA GLU 75 15.153 6.780 -4.984 529 HB2 GLU 75 2HB GLU 75 17.018 5.273 -4.671 530 HB3 GLU 75 1HB GLU 75 17.624 6.900 -4.854 531 HG2 GLU 75 2HG GLU 75 17.435 5.373 -2.246 532 HG3 GLU 75 1HG GLU 75 18.878 5.541 -3.217 533 H SER 76 H SER 76 13.215 7.107 -3.542 534 HA SER 76 HA SER 76 12.841 5.443 -1.282 535 HB2 SER 76 2HB SER 76 10.839 6.428 -3.333 536 HB3 SER 76 1HB SER 76 10.414 5.655 -1.807 537 HG SER 76 HG SER 76 12.089 7.936 -1.794 538 H ASP 77 H ASP 77 11.858 3.316 -1.180 539 HA ASP 77 HA ASP 77 12.705 1.637 -3.327 540 HB2 ASP 77 2HB ASP 77 12.374 1.002 -0.803 541 HB3 ASP 77 1HB ASP 77 10.696 0.737 -1.270 542 H ILE 78 H ILE 78 9.580 2.734 -2.101 543 HA ILE 78 HA ILE 78 8.630 2.748 -4.831 544 HB ILE 78 HB ILE 78 6.347 2.050 -4.116 545 HG12 ILE 78 2HG1 ILE 78 7.619 1.179 -1.509 546 HG13 ILE 78 1HG1 ILE 78 6.624 2.616 -1.694 547 HG21 ILE 78 1HG2 ILE 78 6.742 -0.361 -3.918 548 HG22 ILE 78 2HG2 ILE 78 8.452 -0.042 -3.622 549 HG23 ILE 78 3HG2 ILE 78 7.729 0.394 -5.171 550 HD11 ILE 78 3HD1 ILE 78 5.727 -0.227 -2.139 551 HD12 ILE 78 1HD1 ILE 78 4.723 1.211 -2.323 552 HD13 ILE 78 2HD1 ILE 78 5.356 0.780 -0.738 553 H PHE 79 H PHE 79 7.322 4.603 -5.238 554 HA PHE 79 HA PHE 79 6.967 6.249 -2.873 555 HB2 PHE 79 2HB PHE 79 6.724 8.242 -4.280 556 HB3 PHE 79 1HB PHE 79 8.210 7.418 -4.692 557 HD1 PHE 79 1HD PHE 79 8.407 6.289 -6.877 558 HD2 PHE 79 2HD PHE 79 4.956 8.538 -5.835 559 HE1 PHE 79 1HE PHE 79 7.782 6.414 -9.249 560 HE2 PHE 79 2HE PHE 79 4.315 8.665 -8.205 561 HZ PHE 79 HZ PHE 79 5.727 7.601 -9.917 562 H LEU 80 H LEU 80 5.069 6.803 -2.174 563 HA LEU 80 HA LEU 80 2.862 5.386 -3.428 564 HB2 LEU 80 2HB LEU 80 3.624 4.587 -1.194 565 HB3 LEU 80 1HB LEU 80 3.165 6.143 -0.539 566 HG LEU 80 HG LEU 80 0.808 5.663 -1.067 567 HD11 LEU 80 1HD1 LEU 80 1.110 4.179 -2.982 568 HD12 LEU 80 2HD1 LEU 80 0.154 3.387 -1.726 569 HD13 LEU 80 3HD1 LEU 80 1.849 2.966 -1.937 570 HD21 LEU 80 3HD2 LEU 80 2.199 3.527 0.543 571 HD22 LEU 80 1HD2 LEU 80 0.485 3.930 0.632 572 HD23 LEU 80 2HD2 LEU 80 1.698 5.111 1.130 573 H ASP 81 H ASP 81 3.993 8.229 -2.261 574 HA ASP 81 HA ASP 81 1.735 9.703 -3.298 575 HB2 ASP 81 2HB ASP 81 1.568 9.554 -0.746 576 HB3 ASP 81 1HB ASP 81 3.084 10.447 -0.684 577 H ASP 82 H ASP 82 2.413 11.313 -4.410 578 HA ASP 82 HA ASP 82 5.307 11.892 -4.564 579 HB2 ASP 82 2HB ASP 82 4.494 10.673 -6.439 580 HB3 ASP 82 1HB ASP 82 3.239 11.855 -6.749 581 H VAL 83 H VAL 83 2.224 13.195 -3.950 582 HA VAL 83 HA VAL 83 3.052 15.873 -4.749 583 HB VAL 83 HB VAL 83 0.793 16.631 -4.290 584 HG11 VAL 83 1HG1 VAL 83 -0.505 15.317 -5.894 585 HG12 VAL 83 2HG1 VAL 83 0.748 14.077 -5.860 586 HG13 VAL 83 3HG1 VAL 83 1.122 15.689 -6.461 587 HG21 VAL 83 3HG2 VAL 83 0.260 15.285 -2.326 588 HG22 VAL 83 1HG2 VAL 83 0.166 13.836 -3.324 589 HG23 VAL 83 2HG2 VAL 83 -1.011 15.132 -3.541 590 H THR 84 H THR 84 2.731 13.763 -2.153 591 HA THR 84 HA THR 84 3.977 15.742 -0.448 592 HB THR 84 HB THR 84 1.807 13.895 0.579 593 HG1 THR 84 1HG THR 84 1.724 16.267 -0.724 594 HG21 THR 84 3HG2 THR 84 3.552 14.630 2.196 595 HG22 THR 84 1HG2 THR 84 1.974 15.322 2.573 596 HG23 THR 84 2HG2 THR 84 3.201 16.306 1.782 597 H VAL 85 H VAL 85 5.853 14.729 -1.039 598 HA VAL 85 HA VAL 85 6.180 12.033 0.033 599 HB VAL 85 HB VAL 85 6.564 12.156 -2.415 600 HG11 VAL 85 1HG1 VAL 85 7.264 14.423 -2.687 601 HG12 VAL 85 2HG1 VAL 85 8.495 13.350 -3.351 602 HG13 VAL 85 3HG1 VAL 85 8.747 14.119 -1.779 603 HG21 VAL 85 3HG2 VAL 85 8.796 11.104 -2.500 604 HG22 VAL 85 1HG2 VAL 85 7.810 10.483 -1.176 605 HG23 VAL 85 2HG2 VAL 85 9.092 11.650 -0.851 606 H SER 86 H SER 86 7.861 11.686 1.450 607 HA SER 86 HA SER 86 9.260 14.102 2.360 608 HB2 SER 86 2HB SER 86 8.196 11.851 4.078 609 HB3 SER 86 1HB SER 86 8.921 13.354 4.640 610 HG SER 86 HG SER 86 6.408 12.885 3.517 611 H ARG 87 H ARG 87 11.289 13.466 3.691 612 HA ARG 87 HA ARG 87 12.839 11.555 2.263 613 HB2 ARG 87 2HB ARG 87 13.371 13.088 4.789 614 HB3 ARG 87 1HB ARG 87 14.486 11.873 4.193 615 HG2 ARG 87 2HG ARG 87 14.719 13.142 2.107 616 HG3 ARG 87 1HG ARG 87 13.645 14.380 2.759 617 HD2 ARG 87 2HD ARG 87 16.023 14.951 3.001 618 HD3 ARG 87 1HD ARG 87 15.204 14.829 4.557 619 HE ARG 87 HE ARG 87 16.201 12.426 4.452 620 HH11 ARG 87 1HH1 ARG 87 17.867 15.363 3.316 621 HH12 ARG 87 2HH1 ARG 87 19.411 14.798 3.760 622 HH21 ARG 87 1HH2 ARG 87 18.329 11.694 5.059 623 HH22 ARG 87 2HH2 ARG 87 19.682 12.681 4.762 624 H ARG 88 H ARG 88 11.051 11.511 5.196 625 HA ARG 88 HA ARG 88 10.962 8.683 4.913 626 HB2 ARG 88 2HB ARG 88 11.411 8.094 7.241 627 HB3 ARG 88 1HB ARG 88 12.782 8.986 6.633 628 HG2 ARG 88 2HG ARG 88 10.653 10.030 8.512 629 HG3 ARG 88 1HG ARG 88 12.285 9.534 8.950 630 HD2 ARG 88 2HD ARG 88 13.154 11.366 7.533 631 HD3 ARG 88 1HD ARG 88 11.489 11.853 7.207 632 HE ARG 88 HE ARG 88 12.975 12.138 9.677 633 HH11 ARG 88 1HH1 ARG 88 9.796 12.434 8.103 634 HH12 ARG 88 2HH1 ARG 88 9.187 13.512 9.289 635 HH21 ARG 88 1HH2 ARG 88 12.105 13.593 11.252 636 HH22 ARG 88 2HH2 ARG 88 10.514 14.205 11.094 637 H HIS 89 H HIS 89 9.037 8.519 4.397 638 HA HIS 89 HA HIS 89 7.026 10.291 5.543 639 HB2 HIS 89 2HB HIS 89 7.433 10.054 3.072 640 HB3 HIS 89 1HB HIS 89 6.864 8.402 3.207 641 HD2 HIS 89 2HD HIS 89 4.107 8.125 3.624 642 HE1 HIS 89 1HE HIS 89 3.329 12.136 2.575 643 HE2 HIS 89 2HE HIS 89 2.423 9.777 2.614 644 H ALA 90 H ALA 90 6.884 6.883 4.407 645 HA ALA 90 HA ALA 90 5.826 6.123 6.979 646 HB1 ALA 90 1HB ALA 90 3.925 4.943 5.891 647 HB2 ALA 90 2HB ALA 90 4.385 5.667 4.349 648 HB3 ALA 90 3HB ALA 90 3.836 6.693 5.676 649 H GLU 91 H GLU 91 5.801 3.641 7.050 650 HA GLU 91 HA GLU 91 7.438 2.442 4.998 651 HB2 GLU 91 2HB GLU 91 8.954 3.516 6.705 652 HB3 GLU 91 1HB GLU 91 8.309 2.387 7.882 653 HG2 GLU 91 2HG GLU 91 9.360 0.573 6.901 654 HG3 GLU 91 1HG GLU 91 9.568 1.406 5.359 655 H PHE 92 H PHE 92 7.146 0.277 4.799 656 HA PHE 92 HA PHE 92 5.082 -0.914 6.504 657 HB2 PHE 92 2HB PHE 92 5.679 -1.416 3.575 658 HB3 PHE 92 1HB PHE 92 4.459 -2.246 4.523 659 HD1 PHE 92 1HD PHE 92 5.415 0.949 2.957 660 HD2 PHE 92 2HD PHE 92 2.324 -1.255 4.877 661 HE1 PHE 92 1HE PHE 92 3.775 2.633 2.239 662 HE2 PHE 92 2HE PHE 92 0.678 0.431 4.167 663 HZ PHE 92 HZ PHE 92 1.404 2.378 2.848 664 H ARG 93 H ARG 93 5.806 -2.582 7.587 665 HA ARG 93 HA ARG 93 8.209 -3.968 6.609 666 HB2 ARG 93 2HB ARG 93 7.068 -3.885 9.412 667 HB3 ARG 93 1HB ARG 93 8.438 -4.859 8.912 668 HG2 ARG 93 2HG ARG 93 9.665 -2.810 8.369 669 HG3 ARG 93 1HG ARG 93 8.294 -1.858 8.938 670 HD2 ARG 93 2HD ARG 93 9.864 -3.828 10.595 671 HD3 ARG 93 1HD ARG 93 10.061 -2.087 10.654 672 HE ARG 93 HE ARG 93 7.698 -3.596 11.569 673 HH11 ARG 93 1HH1 ARG 93 9.540 -0.558 11.491 674 HH12 ARG 93 2HH1 ARG 93 8.788 0.095 12.872 675 HH21 ARG 93 1HH2 ARG 93 6.662 -2.702 13.455 676 HH22 ARG 93 2HH2 ARG 93 7.102 -1.149 13.998 677 H ILE 94 H ILE 94 7.834 -5.927 5.792 678 HA ILE 94 HA ILE 94 5.426 -7.167 6.811 679 HB ILE 94 HB ILE 94 5.010 -8.329 4.698 680 HG12 ILE 94 2HG1 ILE 94 6.279 -7.300 2.597 681 HG13 ILE 94 1HG1 ILE 94 7.560 -7.048 3.770 682 HG21 ILE 94 1HG2 ILE 94 5.305 -5.373 4.270 683 HG22 ILE 94 2HG2 ILE 94 3.938 -6.192 5.008 684 HG23 ILE 94 3HG2 ILE 94 4.300 -6.449 3.297 685 HD11 ILE 94 3HD1 ILE 94 7.881 -9.116 2.534 686 HD12 ILE 94 1HD1 ILE 94 6.302 -9.700 3.059 687 HD13 ILE 94 2HD1 ILE 94 7.589 -9.454 4.238 688 H ASN 95 H ASN 95 5.711 -8.735 7.980 689 HA ASN 95 HA ASN 95 8.073 -10.429 7.658 690 HB2 ASN 95 2HB ASN 95 8.006 -8.782 9.685 691 HB3 ASN 95 1HB ASN 95 6.764 -9.871 10.303 692 HD21 ASN 95 1HD2 ASN 95 7.374 -11.839 11.072 693 HD22 ASN 95 2HD2 ASN 95 9.032 -12.354 11.217 694 H GLU 96 H GLU 96 7.831 -12.486 8.021 695 HA GLU 96 HA GLU 96 6.079 -13.981 6.802 696 HB2 GLU 96 2HB GLU 96 6.545 -15.792 8.420 697 HB3 GLU 96 1HB GLU 96 7.958 -14.902 7.848 698 HG2 GLU 96 2HG GLU 96 8.080 -13.640 9.870 699 HG3 GLU 96 1HG GLU 96 6.565 -14.313 10.438 700 H GLY 97 H GLY 97 5.271 -12.676 10.019 701 HA2 GLY 97 2HA GLY 97 2.601 -13.913 9.683 702 HA3 GLY 97 1HA GLY 97 3.457 -14.068 11.209 703 H GLU 98 H GLU 98 4.172 -11.102 9.950 704 HA GLU 98 HA GLU 98 1.855 -9.800 10.949 705 HB2 GLU 98 2HB GLU 98 3.176 -8.358 12.434 706 HB3 GLU 98 1HB GLU 98 2.985 -10.013 12.995 707 HG2 GLU 98 2HG GLU 98 5.413 -9.001 11.569 708 HG3 GLU 98 1HG GLU 98 5.257 -8.863 13.316 709 H PHE 99 H PHE 99 1.417 -8.363 9.686 710 HA PHE 99 HA PHE 99 3.477 -7.125 7.995 711 HB2 PHE 99 2HB PHE 99 0.484 -7.346 7.469 712 HB3 PHE 99 1HB PHE 99 1.674 -6.646 6.378 713 HD1 PHE 99 2HD PHE 99 0.423 -9.768 7.876 714 HD2 PHE 99 1HD PHE 99 3.022 -8.043 5.002 715 HE1 PHE 99 2HE PHE 99 0.736 -11.978 6.855 716 HE2 PHE 99 1HE PHE 99 3.345 -10.252 3.973 717 HZ PHE 99 HZ PHE 99 2.199 -12.219 4.897 718 H GLU 100 H GLU 100 3.974 -5.136 8.554 719 HA GLU 100 HA GLU 100 2.140 -3.698 10.321 720 HB2 GLU 100 2HB GLU 100 5.109 -3.712 10.159 721 HB3 GLU 100 1HB GLU 100 4.195 -2.526 11.078 722 HG2 GLU 100 2HG GLU 100 3.241 -4.172 12.375 723 HG3 GLU 100 1HG GLU 100 4.018 -5.484 11.466 724 H VAL 101 H VAL 101 1.567 -1.814 9.931 725 HA VAL 101 HA VAL 101 2.877 -0.341 7.754 726 HB VAL 101 HB VAL 101 0.616 -0.818 6.984 727 HG11 VAL 101 1HG1 VAL 101 -1.407 -0.130 8.197 728 HG12 VAL 101 2HG1 VAL 101 -0.406 0.392 9.551 729 HG13 VAL 101 3HG1 VAL 101 -0.468 -1.312 9.111 730 HG21 VAL 101 3HG2 VAL 101 -0.316 1.453 6.697 731 HG22 VAL 101 1HG2 VAL 101 1.424 1.396 6.423 732 HG23 VAL 101 2HG2 VAL 101 0.794 2.040 7.937 733 H VAL 102 H VAL 102 4.009 1.306 8.468 734 HA VAL 102 HA VAL 102 3.224 2.530 11.010 735 HB VAL 102 HB VAL 102 6.033 2.231 9.932 736 HG11 VAL 102 1HG1 VAL 102 5.788 4.165 11.364 737 HG12 VAL 102 2HG1 VAL 102 6.744 2.925 12.176 738 HG13 VAL 102 3HG1 VAL 102 5.055 3.169 12.621 739 HG21 VAL 102 3HG2 VAL 102 5.177 0.035 10.535 740 HG22 VAL 102 1HG2 VAL 102 4.675 0.644 12.112 741 HG23 VAL 102 2HG2 VAL 102 6.392 0.554 11.703 742 H ASP 103 H ASP 103 2.706 4.639 10.788 743 HA ASP 103 HA ASP 103 3.869 6.156 8.546 744 HB2 ASP 103 2HB ASP 103 1.417 6.525 9.267 745 HB3 ASP 103 1HB ASP 103 2.043 7.187 10.766 746 H VAL 104 H VAL 104 5.796 7.057 8.971 747 HA VAL 104 HA VAL 104 7.028 6.362 11.400 748 HB VAL 104 HB VAL 104 9.031 7.486 10.698 749 HG11 VAL 104 1HG1 VAL 104 7.691 6.097 8.394 750 HG12 VAL 104 2HG1 VAL 104 8.604 5.343 9.701 751 HG13 VAL 104 3HG1 VAL 104 9.422 6.392 8.543 752 HG21 VAL 104 3HG2 VAL 104 8.158 9.562 9.846 753 HG22 VAL 104 1HG2 VAL 104 7.361 8.717 8.516 754 HG23 VAL 104 2HG2 VAL 104 9.118 8.768 8.594 755 H GLY 105 H GLY 105 5.319 9.181 10.583 756 HA2 GLY 105 2HA GLY 105 5.785 10.044 13.351 757 HA3 GLY 105 1HA GLY 105 6.306 11.171 12.113 758 H SER 106 H SER 106 3.515 9.333 11.336 759 HA SER 106 HA SER 106 1.398 9.929 10.870 760 HB2 SER 106 2HB SER 106 1.720 11.548 13.427 761 HB3 SER 106 1HB SER 106 0.167 11.130 12.682 762 HG SER 106 HG SER 106 0.496 9.037 13.115 763 H LEU 107 H LEU 107 3.342 11.111 9.584 764 HA LEU 107 HA LEU 107 3.432 13.948 9.777 765 HB2 LEU 107 2HB LEU 107 5.407 12.660 9.296 766 HB3 LEU 107 1HB LEU 107 4.688 12.049 7.824 767 HG LEU 107 HG LEU 107 4.793 14.277 6.835 768 HD11 LEU 107 1HD1 LEU 107 5.979 16.099 7.985 769 HD12 LEU 107 2HD1 LEU 107 6.081 15.103 9.443 770 HD13 LEU 107 3HD1 LEU 107 4.514 15.634 8.842 771 HD21 LEU 107 3HD2 LEU 107 7.378 13.358 8.072 772 HD22 LEU 107 1HD2 LEU 107 7.239 14.451 6.696 773 HD23 LEU 107 2HD2 LEU 107 6.674 12.788 6.557 774 H ASN 108 H ASN 108 2.211 11.723 7.296 775 HA ASN 108 HA ASN 108 0.878 14.096 6.191 776 HB2 ASN 108 2HB ASN 108 2.432 12.863 4.633 777 HB3 ASN 108 1HB ASN 108 1.345 11.486 4.717 778 HD21 ASN 108 1HD2 ASN 108 1.387 11.858 2.305 779 HD22 ASN 108 2HD2 ASN 108 0.303 12.955 1.621 780 H GLY 109 H GLY 109 0.366 11.305 7.934 781 HA2 GLY 109 2HA GLY 109 -1.639 11.119 9.158 782 HA3 GLY 109 1HA GLY 109 -2.479 11.926 7.847 783 H THR 110 H THR 110 -0.539 8.948 8.298 784 HA THR 110 HA THR 110 -2.324 7.580 6.514 785 HB THR 110 HB THR 110 -0.175 6.425 8.290 786 HG1 THR 110 1HG THR 110 0.864 7.901 7.076 787 HG21 THR 110 3HG2 THR 110 -0.066 4.678 6.547 788 HG22 THR 110 1HG2 THR 110 -1.379 5.475 5.682 789 HG23 THR 110 2HG2 THR 110 -1.670 4.776 7.273 790 H TYR 111 H TYR 111 -4.155 6.769 7.170 791 HA TYR 111 HA TYR 111 -4.606 6.081 10.003 792 HB2 TYR 111 2HB TYR 111 -6.506 7.172 7.910 793 HB3 TYR 111 1HB TYR 111 -7.060 6.414 9.390 794 HD1 TYR 111 2HD TYR 111 -4.277 8.871 8.882 795 HD2 TYR 111 1HD TYR 111 -8.126 8.126 10.514 796 HE1 TYR 111 2HE TYR 111 -4.225 11.062 9.979 797 HE2 TYR 111 1HE TYR 111 -8.091 10.311 11.613 798 HH TYR 111 HH TYR 111 -5.784 12.702 10.848 799 H VAL 112 H VAL 112 -5.481 4.073 10.366 800 HA VAL 112 HA VAL 112 -5.747 2.403 7.990 801 HB VAL 112 HB VAL 112 -4.135 1.508 9.615 802 HG11 VAL 112 1HG1 VAL 112 -4.759 0.819 11.877 803 HG12 VAL 112 2HG1 VAL 112 -6.377 1.466 11.626 804 HG13 VAL 112 3HG1 VAL 112 -4.992 2.553 11.648 805 HG21 VAL 112 3HG2 VAL 112 -5.439 -0.107 8.345 806 HG22 VAL 112 1HG2 VAL 112 -6.683 -0.110 9.592 807 HG23 VAL 112 2HG2 VAL 112 -5.074 -0.746 9.943 808 H ASN 113 H ASN 113 -7.702 2.033 7.243 809 HA ASN 113 HA ASN 113 -9.894 1.839 7.041 810 HB2 ASN 113 2HB ASN 113 -9.795 0.189 8.932 811 HB3 ASN 113 1HB ASN 113 -9.995 1.512 10.072 812 HD21 ASN 113 1HD2 ASN 113 -11.475 -0.482 7.722 813 HD22 ASN 113 2HD2 ASN 113 -13.112 -0.084 8.040 814 H ARG 114 H ARG 114 -9.845 3.439 10.143 815 HA ARG 114 HA ARG 114 -10.021 6.112 9.061 816 HB2 ARG 114 2HB ARG 114 -12.421 5.254 9.000 817 HB3 ARG 114 1HB ARG 114 -12.338 5.079 10.745 818 HG2 ARG 114 2HG ARG 114 -11.862 7.538 10.876 819 HG3 ARG 114 1HG ARG 114 -12.222 7.634 9.152 820 HD2 ARG 114 2HD ARG 114 -14.177 8.229 10.464 821 HD3 ARG 114 1HD ARG 114 -14.462 6.719 9.596 822 HE ARG 114 HE ARG 114 -13.466 6.034 12.076 823 HH11 ARG 114 1HH1 ARG 114 -16.326 7.769 10.934 824 HH12 ARG 114 2HH1 ARG 114 -17.329 7.216 12.205 825 HH21 ARG 114 1HH2 ARG 114 -14.819 5.288 13.771 826 HH22 ARG 114 2HH2 ARG 114 -16.456 5.749 13.855 827 H GLU 115 H GLU 115 -8.519 4.184 10.968 828 HA GLU 115 HA GLU 115 -8.924 5.480 13.530 829 HB2 GLU 115 2HB GLU 115 -9.217 3.007 13.276 830 HB3 GLU 115 1HB GLU 115 -7.541 2.902 12.776 831 HG2 GLU 115 2HG GLU 115 -7.754 2.221 15.060 832 HG3 GLU 115 1HG GLU 115 -6.861 3.735 14.971 833 HA PRO 116 HA PRO 116 -4.971 7.375 12.451 834 HB2 PRO 116 2HB PRO 116 -4.918 9.094 14.566 835 HB3 PRO 116 1HB PRO 116 -5.859 9.404 13.104 836 HG2 PRO 116 2HG PRO 116 -6.752 8.458 15.779 837 HG3 PRO 116 1HG PRO 116 -7.594 9.478 14.602 838 HD2 PRO 116 2HD PRO 116 -8.066 6.782 15.020 839 HD3 PRO 116 1HD PRO 116 -8.528 7.690 13.569 840 H ARG 117 H ARG 117 -3.431 5.815 12.863 841 HA ARG 117 HA ARG 117 -2.577 5.543 15.649 842 HB2 ARG 117 2HB ARG 117 -2.822 3.296 13.622 843 HB3 ARG 117 1HB ARG 117 -2.056 3.137 15.197 844 HG2 ARG 117 2HG ARG 117 -4.919 3.902 14.751 845 HG3 ARG 117 1HG ARG 117 -4.374 2.258 15.114 846 HD2 ARG 117 2HD ARG 117 -3.705 2.847 17.281 847 HD3 ARG 117 1HD ARG 117 -3.690 4.571 16.920 848 HE ARG 117 HE ARG 117 -6.236 4.085 16.605 849 HH11 ARG 117 1HH1 ARG 117 -4.180 2.713 19.146 850 HH12 ARG 117 2HH1 ARG 117 -5.390 2.860 20.336 851 HH21 ARG 117 1HH2 ARG 117 -7.819 4.246 18.182 852 HH22 ARG 117 2HH2 ARG 117 -7.516 3.724 19.799 853 H ASN 118 H ASN 118 -0.357 4.969 15.865 854 HA ASN 118 HA ASN 118 1.269 6.336 13.917 855 HB2 ASN 118 2HB ASN 118 2.186 4.651 16.276 856 HB3 ASN 118 1HB ASN 118 3.168 5.784 15.375 857 HD21 ASN 118 1HD2 ASN 118 2.770 5.725 18.147 858 HD22 ASN 118 2HD2 ASN 118 2.022 7.200 18.632 859 H ALA 119 H ALA 119 0.693 3.087 15.051 860 HA ALA 119 HA ALA 119 1.615 2.014 12.538 861 HB1 ALA 119 1HB ALA 119 2.717 1.120 15.202 862 HB2 ALA 119 2HB ALA 119 3.611 1.984 13.953 863 HB3 ALA 119 3HB ALA 119 3.022 0.347 13.646 864 H GLN 120 H GLN 120 0.624 0.092 12.093 865 HA GLN 120 HA GLN 120 -1.165 -1.067 14.098 866 HB2 GLN 120 2HB GLN 120 -2.558 0.435 12.766 867 HB3 GLN 120 1HB GLN 120 -1.952 -0.277 11.282 868 HG2 GLN 120 2HG GLN 120 -4.195 -1.098 11.749 869 HG3 GLN 120 1HG GLN 120 -3.028 -2.400 11.869 870 HE21 GLN 120 1HE2 GLN 120 -4.481 -3.608 13.126 871 HE22 GLN 120 2HE2 GLN 120 -4.781 -3.217 14.768 872 H VAL 121 H VAL 121 -1.214 -3.290 13.975 873 HA VAL 121 HA VAL 121 0.515 -4.412 11.924 874 HB VAL 121 HB VAL 121 -0.736 -5.846 14.290 875 HG11 VAL 121 1HG1 VAL 121 0.991 -7.541 13.900 876 HG12 VAL 121 2HG1 VAL 121 1.534 -6.646 12.479 877 HG13 VAL 121 3HG1 VAL 121 -0.081 -7.352 12.514 878 HG21 VAL 121 3HG2 VAL 121 2.032 -4.657 14.072 879 HG22 VAL 121 1HG2 VAL 121 1.449 -5.654 15.402 880 HG23 VAL 121 2HG2 VAL 121 0.729 -4.074 15.106 881 H MET 122 H MET 122 -0.647 -4.391 10.212 882 HA MET 122 HA MET 122 -2.154 -4.692 8.624 883 HB2 MET 122 2HB MET 122 -2.611 -7.022 8.057 884 HB3 MET 122 1HB MET 122 -0.944 -6.675 8.483 885 HG2 MET 122 2HG MET 122 -1.275 -7.695 10.670 886 HG3 MET 122 1HG MET 122 -2.962 -8.018 10.268 887 HE1 MET 122 3HE MET 122 -1.184 -11.556 10.221 888 HE2 MET 122 1HE MET 122 -2.404 -10.565 11.019 889 HE3 MET 122 2HE MET 122 -0.689 -10.202 11.235 890 H GLN 123 H GLN 123 -4.136 -4.523 7.818 891 HA GLN 123 HA GLN 123 -6.304 -5.724 9.263 892 HB2 GLN 123 2HB GLN 123 -6.114 -3.105 9.402 893 HB3 GLN 123 1HB GLN 123 -6.379 -3.131 7.669 894 HG2 GLN 123 2HG GLN 123 -8.456 -2.676 8.716 895 HG3 GLN 123 1HG GLN 123 -8.520 -4.325 8.090 896 HE21 GLN 123 1HE2 GLN 123 -8.385 -2.346 10.931 897 HE22 GLN 123 2HE2 GLN 123 -8.772 -3.603 12.043 898 H THR 124 H THR 124 -7.123 -7.157 7.683 899 HA THR 124 HA THR 124 -5.869 -6.745 5.090 900 HB THR 124 HB THR 124 -4.997 -8.749 6.182 901 HG1 THR 124 1HG THR 124 -5.845 -10.294 4.459 902 HG21 THR 124 3HG2 THR 124 -6.936 -9.379 7.528 903 HG22 THR 124 1HG2 THR 124 -6.404 -10.733 6.535 904 HG23 THR 124 2HG2 THR 124 -7.828 -9.802 6.066 905 H GLY 125 H GLY 125 -6.945 -6.469 3.371 906 HA2 GLY 125 2HA GLY 125 -8.691 -6.620 1.864 907 HA3 GLY 125 1HA GLY 125 -9.647 -7.459 3.087 908 H ASP 126 H ASP 126 -7.976 -4.591 3.940 909 HA ASP 126 HA ASP 126 -10.535 -3.155 3.945 910 HB2 ASP 126 2HB ASP 126 -9.576 -4.042 6.201 911 HB3 ASP 126 1HB ASP 126 -8.403 -2.755 6.059 912 H GLU 127 H GLU 127 -9.652 -0.669 4.660 913 HA GLU 127 HA GLU 127 -7.827 -0.065 2.452 914 HB2 GLU 127 2HB GLU 127 -10.310 1.428 3.296 915 HB3 GLU 127 1HB GLU 127 -9.118 2.069 2.179 916 HG2 GLU 127 2HG GLU 127 -9.589 0.387 0.578 917 HG3 GLU 127 1HG GLU 127 -10.573 -0.526 1.719 918 H ILE 128 H ILE 128 -6.204 1.133 2.870 919 HA ILE 128 HA ILE 128 -5.915 2.361 5.504 920 HB ILE 128 HB ILE 128 -3.807 1.733 3.394 921 HG12 ILE 128 2HG1 ILE 128 -4.345 0.425 6.072 922 HG13 ILE 128 1HG1 ILE 128 -4.690 -0.283 4.499 923 HG21 ILE 128 1HG2 ILE 128 -3.467 2.832 6.187 924 HG22 ILE 128 2HG2 ILE 128 -3.208 3.716 4.685 925 HG23 ILE 128 3HG2 ILE 128 -2.156 2.363 5.104 926 HD11 ILE 128 3HD1 ILE 128 -1.961 0.398 5.580 927 HD12 ILE 128 1HD1 ILE 128 -2.294 -0.305 3.995 928 HD13 ILE 128 2HD1 ILE 128 -2.662 -1.213 5.461 929 H GLN 129 H GLN 129 -5.967 4.490 5.617 930 HA GLN 129 HA GLN 129 -6.380 5.990 3.164 931 HB2 GLN 129 2HB GLN 129 -8.022 6.170 4.989 932 HB3 GLN 129 1HB GLN 129 -6.748 6.706 6.069 933 HG2 GLN 129 2HG GLN 129 -6.429 8.692 4.635 934 HG3 GLN 129 1HG GLN 129 -7.800 8.164 3.661 935 HE21 GLN 129 1HE2 GLN 129 -9.843 8.184 4.579 936 HE22 GLN 129 2HE2 GLN 129 -10.215 9.129 5.976 937 H ILE 130 H ILE 130 -4.599 6.827 2.360 938 HA ILE 130 HA ILE 130 -2.460 7.576 4.197 939 HB ILE 130 HB ILE 130 -1.014 7.687 2.098 940 HG12 ILE 130 2HG1 ILE 130 -3.372 6.214 0.865 941 HG13 ILE 130 1HG1 ILE 130 -2.855 7.860 0.506 942 HG21 ILE 130 1HG2 ILE 130 -0.840 5.832 3.632 943 HG22 ILE 130 2HG2 ILE 130 -0.696 5.242 1.980 944 HG23 ILE 130 3HG2 ILE 130 -2.208 5.026 2.866 945 HD11 ILE 130 3HD1 ILE 130 -0.781 7.028 -0.422 946 HD12 ILE 130 1HD1 ILE 130 -2.163 6.277 -1.219 947 HD13 ILE 130 2HD1 ILE 130 -1.246 5.374 -0.011 948 H GLY 131 H GLY 131 -2.973 9.543 4.874 949 HA2 GLY 131 2HA GLY 131 -3.183 11.805 4.797 950 HA3 GLY 131 1HA GLY 131 -2.775 11.742 3.080 951 H LYS 132 H LYS 132 -4.325 11.799 1.615 952 HA LYS 132 HA LYS 132 -7.114 11.721 2.540 953 HB2 LYS 132 2HB LYS 132 -5.913 13.482 0.405 954 HB3 LYS 132 1HB LYS 132 -7.633 13.371 0.755 955 HG2 LYS 132 2HG LYS 132 -7.233 14.220 3.011 956 HG3 LYS 132 1HG LYS 132 -5.508 14.317 2.679 957 HD2 LYS 132 2HD LYS 132 -7.669 15.829 1.216 958 HD3 LYS 132 1HD LYS 132 -6.640 16.498 2.480 959 HE2 LYS 132 2HE LYS 132 -4.660 16.039 1.054 960 HE3 LYS 132 1HE LYS 132 -5.741 15.458 -0.215 961 HZ1 LYS 132 3HZ LYS 132 -5.104 17.749 -0.592 962 HZ2 LYS 132 1HZ LYS 132 -5.699 18.192 0.921 963 HZ3 LYS 132 2HZ LYS 132 -6.757 17.657 -0.279 964 H PHE 133 H PHE 133 -4.973 9.926 0.948 965 HA PHE 133 HA PHE 133 -6.814 9.253 -1.236 966 HB2 PHE 133 2HB PHE 133 -3.969 8.255 -0.964 967 HB3 PHE 133 1HB PHE 133 -4.996 8.227 -2.377 968 HD1 PHE 133 2HD PHE 133 -5.798 10.610 -3.209 969 HD2 PHE 133 1HD PHE 133 -2.361 9.865 -0.822 970 HE1 PHE 133 2HE PHE 133 -4.826 12.748 -3.947 971 HE2 PHE 133 1HE PHE 133 -1.378 11.969 -1.545 972 HZ PHE 133 HZ PHE 133 -2.611 13.439 -3.113 973 H ARG 134 H ARG 134 -6.698 6.738 -1.700 974 HA ARG 134 HA ARG 134 -6.641 5.363 0.852 975 HB2 ARG 134 2HB ARG 134 -8.713 4.153 0.347 976 HB3 ARG 134 1HB ARG 134 -8.972 5.882 0.507 977 HG2 ARG 134 2HG ARG 134 -9.114 6.100 -1.914 978 HG3 ARG 134 1HG ARG 134 -8.772 4.378 -2.086 979 HD2 ARG 134 2HD ARG 134 -11.154 4.777 -2.287 980 HD3 ARG 134 1HD ARG 134 -10.796 3.843 -0.840 981 HE ARG 134 HE ARG 134 -11.139 6.738 -0.640 982 HH11 ARG 134 1HH1 ARG 134 -12.228 3.461 0.262 983 HH12 ARG 134 2HH1 ARG 134 -13.450 4.028 1.295 984 HH21 ARG 134 1HH2 ARG 134 -12.792 7.474 0.837 985 HH22 ARG 134 2HH2 ARG 134 -13.763 6.346 1.661 986 H LEU 135 H LEU 135 -5.827 3.486 0.896 987 HA LEU 135 HA LEU 135 -4.921 2.187 -1.576 988 HB2 LEU 135 2HB LEU 135 -3.175 3.211 -0.136 989 HB3 LEU 135 1HB LEU 135 -3.763 2.272 1.214 990 HG LEU 135 HG LEU 135 -3.117 0.208 -0.050 991 HD11 LEU 135 1HD1 LEU 135 -3.112 1.089 -2.286 992 HD12 LEU 135 2HD1 LEU 135 -1.490 0.513 -1.890 993 HD13 LEU 135 3HD1 LEU 135 -1.847 2.236 -1.865 994 HD21 LEU 135 3HD2 LEU 135 -0.748 0.427 0.461 995 HD22 LEU 135 1HD2 LEU 135 -1.726 1.164 1.725 996 HD23 LEU 135 2HD2 LEU 135 -0.910 2.183 0.535 997 H VAL 136 H VAL 136 -5.362 -0.062 -1.616 998 HA VAL 136 HA VAL 136 -7.008 -1.070 0.614 999 HB VAL 136 HB VAL 136 -6.701 -2.273 -2.153 1000 HG11 VAL 136 1HG1 VAL 136 -8.709 -3.540 -1.606 1001 HG12 VAL 136 2HG1 VAL 136 -8.766 -2.776 -0.018 1002 HG13 VAL 136 3HG1 VAL 136 -7.424 -3.840 -0.435 1003 HG21 VAL 136 3HG2 VAL 136 -8.865 -1.326 -2.739 1004 HG22 VAL 136 1HG2 VAL 136 -7.711 -0.052 -2.346 1005 HG23 VAL 136 2HG2 VAL 136 -8.953 -0.514 -1.177 1006 H PHE 137 H PHE 137 -6.176 -2.730 1.789 1007 HA PHE 137 HA PHE 137 -3.568 -3.736 0.873 1008 HB2 PHE 137 2HB PHE 137 -3.379 -2.047 2.658 1009 HB3 PHE 137 1HB PHE 137 -4.390 -3.037 3.691 1010 HD1 PHE 137 2HD PHE 137 -1.207 -3.152 1.777 1011 HD2 PHE 137 1HD PHE 137 -3.381 -4.508 5.171 1012 HE1 PHE 137 2HE PHE 137 0.819 -4.258 2.624 1013 HE2 PHE 137 1HE PHE 137 -1.362 -5.614 6.031 1014 HZ PHE 137 HZ PHE 137 0.746 -5.487 4.756 1015 H LEU 138 H LEU 138 -3.584 -5.852 0.557 1016 HA LEU 138 HA LEU 138 -5.312 -7.508 2.255 1017 HB2 LEU 138 2HB LEU 138 -4.380 -8.103 -0.575 1018 HB3 LEU 138 1HB LEU 138 -5.319 -9.184 0.421 1019 HG LEU 138 HG LEU 138 -7.151 -7.381 0.351 1020 HD11 LEU 138 1HD1 LEU 138 -5.816 -5.532 -0.474 1021 HD12 LEU 138 2HD1 LEU 138 -7.137 -5.901 -1.584 1022 HD13 LEU 138 3HD1 LEU 138 -5.493 -6.410 -1.969 1023 HD21 LEU 138 3HD2 LEU 138 -6.378 -8.833 -2.173 1024 HD22 LEU 138 1HD2 LEU 138 -7.974 -8.181 -1.805 1025 HD23 LEU 138 2HD2 LEU 138 -7.313 -9.493 -0.830 1026 H ALA 139 H ALA 139 -4.154 -8.711 3.617 1027 HA ALA 139 HA ALA 139 -1.361 -9.283 2.885 1028 HB1 ALA 139 1HB ALA 139 -1.467 -7.527 4.576 1029 HB2 ALA 139 2HB ALA 139 -0.759 -9.006 5.229 1030 HB3 ALA 139 3HB ALA 139 -2.428 -8.580 5.612 1031 H GLY 140 H GLY 140 -0.991 -11.396 2.770 1032 HA2 GLY 140 2HA GLY 140 -1.303 -13.251 4.684 1033 HA3 GLY 140 1HA GLY 140 -2.928 -13.162 4.044 1034 HA PRO 141 HA PRO 141 -2.351 -15.779 0.524 1035 HB2 PRO 141 2HB PRO 141 -1.433 -14.211 -1.624 1036 HB3 PRO 141 1HB PRO 141 -3.096 -14.692 -1.282 1037 HG2 PRO 141 2HG PRO 141 -1.677 -12.156 -0.608 1038 HG3 PRO 141 1HG PRO 141 -3.379 -12.401 -1.046 1039 HD2 PRO 141 2HD PRO 141 -2.699 -11.927 1.473 1040 HD3 PRO 141 1HD PRO 141 -3.940 -13.142 1.099 1041 H ALA 142 H ALA 142 -0.867 -17.188 0.376 1042 HA ALA 142 HA ALA 142 1.925 -16.437 0.490 1043 HB1 ALA 142 1HB ALA 142 1.135 -18.189 2.005 1044 HB2 ALA 142 2HB ALA 142 2.322 -18.822 0.868 1045 HB3 ALA 142 3HB ALA 142 0.606 -19.150 0.623 1046 H GLU 143 H GLU 143 3.030 -16.293 -1.288 1047 HA GLU 143 HA GLU 143 2.312 -17.916 -3.601 1048 HB2 GLU 143 2HB GLU 143 1.573 -15.312 -3.517 1049 HB3 GLU 143 1HB GLU 143 3.233 -15.103 -4.031 1050 HG2 GLU 143 2HG GLU 143 1.141 -16.723 -5.475 1051 HG3 GLU 143 1HG GLU 143 1.649 -15.100 -5.901 Start of MODEL 18 1 H1 MET 1 1HT MET 1 86.824 -24.413 31.556 2 H2 MET 1 2HT MET 1 85.984 -25.500 32.539 3 H3 MET 1 3HT MET 1 87.075 -24.424 33.228 4 HA MET 1 HA MET 1 84.827 -23.710 33.593 5 HB2 MET 1 2HB MET 1 86.569 -21.986 33.335 6 HB3 MET 1 1HB MET 1 86.328 -22.028 31.601 7 HG2 MET 1 2HG MET 1 84.132 -21.099 31.822 8 HG3 MET 1 1HG MET 1 84.241 -21.155 33.579 9 HE1 MET 1 2HE MET 1 83.530 -18.528 31.791 10 HE2 MET 1 3HE MET 1 84.437 -17.300 32.674 11 HE3 MET 1 1HE MET 1 83.534 -18.533 33.555 12 H SER 2 H SER 2 83.133 -24.799 32.804 13 HA SER 2 HA SER 2 82.443 -24.671 30.015 14 HB2 SER 2 2HB SER 2 81.930 -26.683 31.347 15 HB3 SER 2 1HB SER 2 80.963 -25.718 32.455 16 HG SER 2 HG SER 2 80.282 -25.517 29.807 17 H ASP 3 H ASP 3 81.207 -23.535 33.112 18 HA ASP 3 HA ASP 3 80.018 -21.819 33.858 19 HB2 ASP 3 2HB ASP 3 82.030 -20.671 32.745 20 HB3 ASP 3 1HB ASP 3 80.925 -20.247 31.448 21 H ASN 4 H ASN 4 78.862 -23.632 31.819 22 HA ASN 4 HA ASN 4 76.533 -21.993 31.048 23 HB2 ASN 4 2HB ASN 4 77.725 -24.312 29.502 24 HB3 ASN 4 1HB ASN 4 76.174 -23.585 29.151 25 HD21 ASN 4 1HD2 ASN 4 77.236 -20.810 29.604 26 HD22 ASN 4 2HD2 ASN 4 78.193 -20.509 28.210 27 H ASN 5 H ASN 5 74.572 -22.941 31.406 28 HA ASN 5 HA ASN 5 74.575 -25.629 32.567 29 HB2 ASN 5 2HB ASN 5 73.034 -23.165 33.403 30 HB3 ASN 5 1HB ASN 5 72.377 -24.761 33.702 31 HD21 ASN 5 1HD2 ASN 5 75.855 -24.249 33.938 32 HD22 ASN 5 2HD2 ASN 5 75.911 -24.316 35.661 33 H GLY 6 H GLY 6 73.897 -26.841 30.942 34 HA2 GLY 6 2HA GLY 6 72.113 -25.769 28.944 35 HA3 GLY 6 1HA GLY 6 72.848 -27.368 28.955 36 H THR 7 H THR 7 70.063 -25.603 29.539 37 HA THR 7 HA THR 7 68.910 -27.546 31.324 38 HB THR 7 HB THR 7 68.364 -25.130 31.591 39 HG1 THR 7 1HG THR 7 66.584 -25.786 32.389 40 HG21 THR 7 3HG2 THR 7 68.355 -24.397 29.271 41 HG22 THR 7 1HG2 THR 7 66.803 -24.024 30.018 42 HG23 THR 7 2HG2 THR 7 66.951 -25.406 28.928 43 HA PRO 8 HA PRO 8 67.527 -30.189 28.035 44 HB2 PRO 8 2HB PRO 8 65.537 -31.512 29.338 45 HB3 PRO 8 1HB PRO 8 67.252 -31.848 29.615 46 HG2 PRO 8 2HG PRO 8 65.368 -30.165 31.221 47 HG3 PRO 8 1HG PRO 8 66.589 -31.326 31.783 48 HD2 PRO 8 2HD PRO 8 67.017 -28.666 31.805 49 HD3 PRO 8 1HD PRO 8 68.323 -29.830 31.494 50 H GLU 9 H GLU 9 65.874 -30.338 26.502 51 HA GLU 9 HA GLU 9 63.976 -28.209 26.615 52 HB2 GLU 9 2HB GLU 9 63.250 -29.001 24.327 53 HB3 GLU 9 1HB GLU 9 64.922 -28.510 24.435 54 HG2 GLU 9 2HG GLU 9 64.023 -31.389 24.503 55 HG3 GLU 9 1HG GLU 9 64.459 -30.538 23.027 56 HA PRO 10 HA PRO 10 61.142 -30.812 28.815 57 HB2 PRO 10 2HB PRO 10 59.217 -28.673 28.393 58 HB3 PRO 10 1HB PRO 10 59.862 -29.304 29.902 59 HG2 PRO 10 2HG PRO 10 60.529 -26.859 28.958 60 HG3 PRO 10 1HG PRO 10 61.651 -27.850 29.905 61 HD2 PRO 10 2HD PRO 10 61.564 -27.360 26.969 62 HD3 PRO 10 1HD PRO 10 62.952 -27.559 28.070 63 H GLN 11 H GLN 11 60.220 -32.407 27.771 64 HA GLN 11 HA GLN 11 58.675 -31.779 25.413 65 HB2 GLN 11 2HB GLN 11 60.286 -33.626 25.171 66 HB3 GLN 11 1HB GLN 11 59.474 -34.484 26.470 67 HG2 GLN 11 2HG GLN 11 58.885 -35.382 24.250 68 HG3 GLN 11 1HG GLN 11 57.486 -34.763 25.115 69 HE21 GLN 11 1HE2 GLN 11 57.919 -35.202 22.243 70 HE22 GLN 11 2HE2 GLN 11 57.619 -33.677 21.497 71 H VAL 12 H VAL 12 57.122 -30.750 26.480 72 HA VAL 12 HA VAL 12 55.253 -32.416 27.993 73 HB VAL 12 HB VAL 12 55.252 -29.396 27.618 74 HG11 VAL 12 1HG1 VAL 12 53.635 -29.363 29.453 75 HG12 VAL 12 2HG1 VAL 12 53.680 -31.123 29.525 76 HG13 VAL 12 3HG1 VAL 12 53.043 -30.318 28.091 77 HG21 VAL 12 3HG2 VAL 12 56.189 -30.999 30.003 78 HG22 VAL 12 1HG2 VAL 12 56.044 -29.242 29.940 79 HG23 VAL 12 2HG2 VAL 12 57.212 -30.070 28.908 80 H GLU 13 H GLU 13 53.627 -33.209 26.822 81 HA GLU 13 HA GLU 13 53.287 -32.352 24.163 82 HB2 GLU 13 2HB GLU 13 51.380 -34.006 24.120 83 HB3 GLU 13 1HB GLU 13 52.959 -34.656 24.492 84 HG2 GLU 13 2HG GLU 13 51.446 -35.761 25.885 85 HG3 GLU 13 1HG GLU 13 52.273 -34.605 26.924 86 H THR 14 H THR 14 51.669 -31.285 23.214 87 HA THR 14 HA THR 14 50.020 -29.761 25.078 88 HB THR 14 HB THR 14 50.936 -28.860 22.332 89 HG1 THR 14 1HG THR 14 51.995 -28.433 24.937 90 HG21 THR 14 3HG2 THR 14 50.199 -26.639 23.124 91 HG22 THR 14 1HG2 THR 14 49.673 -27.361 24.645 92 HG23 THR 14 2HG2 THR 14 48.866 -27.795 23.138 93 H THR 15 H THR 15 48.365 -31.253 25.046 94 HA THR 15 HA THR 15 47.112 -31.631 22.473 95 HB THR 15 HB THR 15 46.518 -32.966 25.123 96 HG1 THR 15 1HG THR 15 48.322 -34.011 24.613 97 HG21 THR 15 3HG2 THR 15 44.612 -32.973 23.583 98 HG22 THR 15 1HG2 THR 15 45.289 -34.593 23.732 99 HG23 THR 15 2HG2 THR 15 45.638 -33.618 22.303 100 H SER 16 H SER 16 46.080 -29.790 22.106 101 HA SER 16 HA SER 16 44.367 -28.665 24.175 102 HB2 SER 16 2HB SER 16 46.006 -27.127 23.151 103 HB3 SER 16 1HB SER 16 45.357 -27.509 21.559 104 HG SER 16 HG SER 16 44.224 -25.826 21.954 105 H VAL 17 H VAL 17 42.553 -29.858 24.049 106 HA VAL 17 HA VAL 17 41.451 -30.443 21.420 107 HB VAL 17 HB VAL 17 40.376 -31.279 24.089 108 HG11 VAL 17 1HG1 VAL 17 38.756 -31.438 22.304 109 HG12 VAL 17 2HG1 VAL 17 39.232 -33.059 22.814 110 HG13 VAL 17 3HG1 VAL 17 39.884 -32.376 21.326 111 HG21 VAL 17 3HG2 VAL 17 41.452 -33.474 23.743 112 HG22 VAL 17 1HG2 VAL 17 42.624 -32.166 23.905 113 HG23 VAL 17 2HG2 VAL 17 42.260 -32.833 22.313 114 H PHE 18 H PHE 18 40.593 -28.598 20.785 115 HA PHE 18 HA PHE 18 38.738 -27.249 22.549 116 HB2 PHE 18 2HB PHE 18 38.466 -25.563 20.677 117 HB3 PHE 18 1HB PHE 18 40.092 -25.690 21.321 118 HD1 PHE 18 2HD PHE 18 41.896 -26.574 19.973 119 HD2 PHE 18 1HD PHE 18 37.951 -26.247 18.419 120 HE1 PHE 18 2HE PHE 18 42.775 -26.864 17.699 121 HE2 PHE 18 1HE PHE 18 38.822 -26.530 16.142 122 HZ PHE 18 HZ PHE 18 41.236 -26.841 15.776 123 H ARG 19 H ARG 19 36.631 -27.396 22.443 124 HA ARG 19 HA ARG 19 35.613 -29.462 20.610 125 HB2 ARG 19 2HB ARG 19 34.432 -28.590 23.233 126 HB3 ARG 19 1HB ARG 19 34.017 -30.007 22.290 127 HG2 ARG 19 2HG ARG 19 36.226 -30.960 22.792 128 HG3 ARG 19 1HG ARG 19 36.599 -29.535 23.762 129 HD2 ARG 19 2HD ARG 19 34.485 -31.628 24.275 130 HD3 ARG 19 1HD ARG 19 35.885 -31.235 25.270 131 HE ARG 19 HE ARG 19 33.807 -29.197 24.859 132 HH11 ARG 19 1HH1 ARG 19 35.512 -31.299 27.146 133 HH12 ARG 19 2HH1 ARG 19 34.683 -30.694 28.502 134 HH21 ARG 19 1HH2 ARG 19 32.697 -28.457 26.598 135 HH22 ARG 19 2HH2 ARG 19 32.988 -28.976 28.199 136 H ALA 20 H ALA 20 33.412 -29.143 19.914 137 HA ALA 20 HA ALA 20 32.680 -26.326 19.804 138 HB1 ALA 20 1HB ALA 20 31.598 -28.645 18.188 139 HB2 ALA 20 2HB ALA 20 32.829 -27.516 17.631 140 HB3 ALA 20 3HB ALA 20 31.193 -26.944 17.956 141 H ASP 21 H ASP 21 31.932 -26.207 21.889 142 HA ASP 21 HA ASP 21 29.754 -27.948 22.700 143 HB2 ASP 21 2HB ASP 21 31.304 -25.828 24.183 144 HB3 ASP 21 1HB ASP 21 29.902 -26.646 24.850 145 H LEU 22 H LEU 22 30.435 -24.592 21.998 146 HA LEU 22 HA LEU 22 27.819 -23.814 22.712 147 HB2 LEU 22 2HB LEU 22 28.390 -21.573 21.848 148 HB3 LEU 22 1HB LEU 22 29.534 -22.174 23.013 149 HG LEU 22 HG LEU 22 31.012 -22.770 21.008 150 HD11 LEU 22 1HD1 LEU 22 30.682 -21.424 18.985 151 HD12 LEU 22 2HD1 LEU 22 29.120 -20.888 19.604 152 HD13 LEU 22 3HD1 LEU 22 29.383 -22.591 19.229 153 HD21 LEU 22 3HD2 LEU 22 30.424 -19.886 21.645 154 HD22 LEU 22 1HD2 LEU 22 31.884 -20.482 20.854 155 HD23 LEU 22 2HD2 LEU 22 31.527 -20.960 22.511 156 H LEU 23 H LEU 23 26.287 -22.844 21.380 157 HA LEU 23 HA LEU 23 26.231 -23.687 18.585 158 HB2 LEU 23 2HB LEU 23 24.051 -24.075 20.650 159 HB3 LEU 23 1HB LEU 23 23.806 -24.257 18.932 160 HG LEU 23 HG LEU 23 25.659 -25.987 20.574 161 HD11 LEU 23 1HD1 LEU 23 23.329 -26.283 21.261 162 HD12 LEU 23 2HD1 LEU 23 23.909 -27.692 20.373 163 HD13 LEU 23 3HD1 LEU 23 22.860 -26.515 19.577 164 HD21 LEU 23 3HD2 LEU 23 25.597 -27.442 18.606 165 HD22 LEU 23 1HD2 LEU 23 26.245 -25.853 18.207 166 HD23 LEU 23 2HD2 LEU 23 24.590 -26.262 17.765 167 H LYS 24 H LYS 24 23.995 -22.550 17.770 168 HA LYS 24 HA LYS 24 24.435 -19.772 18.299 169 HB2 LYS 24 2HB LYS 24 22.363 -21.157 16.582 170 HB3 LYS 24 1HB LYS 24 22.568 -19.415 16.675 171 HG2 LYS 24 2HG LYS 24 24.827 -19.617 15.790 172 HG3 LYS 24 1HG LYS 24 24.649 -21.369 15.711 173 HD2 LYS 24 2HD LYS 24 22.802 -21.105 14.117 174 HD3 LYS 24 1HD LYS 24 22.981 -19.352 14.205 175 HE2 LYS 24 2HE LYS 24 25.123 -21.263 13.271 176 HE3 LYS 24 1HE LYS 24 24.058 -20.352 12.206 177 HZ1 LYS 24 3HZ LYS 24 24.995 -18.324 12.995 178 HZ2 LYS 24 1HZ LYS 24 26.223 -19.331 12.480 179 HZ3 LYS 24 2HZ LYS 24 25.966 -19.108 14.137 180 H GLU 25 H GLU 25 23.808 -19.060 20.180 181 HA GLU 25 HA GLU 25 21.396 -20.006 21.429 182 HB2 GLU 25 2HB GLU 25 23.463 -17.973 22.251 183 HB3 GLU 25 1HB GLU 25 22.048 -18.366 23.219 184 HG2 GLU 25 2HG GLU 25 22.777 -20.625 23.481 185 HG3 GLU 25 1HG GLU 25 24.103 -20.373 22.352 186 H MET 26 H MET 26 19.627 -19.326 20.588 187 HA MET 26 HA MET 26 19.489 -16.770 19.253 188 HB2 MET 26 2HB MET 26 17.326 -18.833 19.645 189 HB3 MET 26 1HB MET 26 17.321 -17.496 18.509 190 HG2 MET 26 2HG MET 26 19.094 -18.485 17.242 191 HG3 MET 26 1HG MET 26 19.283 -19.770 18.438 192 HE1 MET 26 3HE MET 26 19.117 -21.654 16.768 193 HE2 MET 26 1HE MET 26 19.014 -20.514 15.428 194 HE3 MET 26 2HE MET 26 17.852 -21.840 15.558 195 H GLU 27 H GLU 27 19.520 -15.233 20.868 196 HA GLU 27 HA GLU 27 17.199 -15.393 22.620 197 HB2 GLU 27 2HB GLU 27 19.304 -15.270 23.918 198 HB3 GLU 27 1HB GLU 27 19.707 -13.761 23.101 199 HG2 GLU 27 2HG GLU 27 17.798 -12.656 24.069 200 HG3 GLU 27 1HG GLU 27 17.236 -14.165 24.772 201 H SER 28 H SER 28 15.618 -14.211 22.070 202 HA SER 28 HA SER 28 16.139 -11.662 20.763 203 HB2 SER 28 2HB SER 28 15.058 -13.500 19.331 204 HB3 SER 28 1HB SER 28 13.692 -13.428 20.439 205 HG SER 28 HG SER 28 13.022 -11.915 19.211 206 H SER 29 H SER 29 15.276 -9.976 21.942 207 HA SER 29 HA SER 29 13.346 -10.649 24.003 208 HB2 SER 29 2HB SER 29 14.718 -9.411 25.688 209 HB3 SER 29 1HB SER 29 15.462 -10.905 25.130 210 HG SER 29 HG SER 29 16.382 -9.168 23.475 211 H THR 30 H THR 30 12.928 -8.469 25.247 212 HA THR 30 HA THR 30 11.855 -6.630 23.364 213 HB THR 30 HB THR 30 12.142 -6.361 26.370 214 HG1 THR 30 1HG THR 30 11.097 -8.340 25.867 215 HG21 THR 30 3HG2 THR 30 11.422 -4.319 25.196 216 HG22 THR 30 1HG2 THR 30 10.107 -4.986 26.164 217 HG23 THR 30 2HG2 THR 30 10.121 -5.223 24.416 218 H GLY 31 H GLY 31 12.888 -4.851 22.572 219 HA2 GLY 31 2HA GLY 31 14.208 -2.895 22.896 220 HA3 GLY 31 1HA GLY 31 15.196 -3.798 24.045 221 H THR 32 H THR 32 15.554 -6.123 22.601 222 HA THR 32 HA THR 32 17.669 -5.334 20.833 223 HB THR 32 HB THR 32 17.860 -7.854 20.530 224 HG1 THR 32 1HG THR 32 15.505 -7.907 21.378 225 HG21 THR 32 3HG2 THR 32 18.750 -8.216 22.798 226 HG22 THR 32 1HG2 THR 32 17.943 -6.743 23.337 227 HG23 THR 32 2HG2 THR 32 19.238 -6.651 22.146 228 H ALA 33 H ALA 33 17.858 -6.151 18.642 229 HA ALA 33 HA ALA 33 15.490 -5.934 17.100 230 HB1 ALA 33 1HB ALA 33 17.685 -5.302 16.182 231 HB2 ALA 33 2HB ALA 33 16.960 -6.589 15.218 232 HB3 ALA 33 3HB ALA 33 18.248 -6.965 16.363 233 HA PRO 34 HA PRO 34 14.117 -10.026 18.000 234 HB2 PRO 34 2HB PRO 34 12.342 -10.281 15.915 235 HB3 PRO 34 1HB PRO 34 11.987 -9.430 17.420 236 HG2 PRO 34 2HG PRO 34 12.826 -8.327 14.776 237 HG3 PRO 34 1HG PRO 34 11.635 -7.695 15.925 238 HD2 PRO 34 2HD PRO 34 14.092 -6.655 15.709 239 HD3 PRO 34 1HD PRO 34 13.250 -6.737 17.270 240 H ALA 35 H ALA 35 15.142 -11.801 17.621 241 HA ALA 35 HA ALA 35 16.590 -12.370 15.220 242 HB1 ALA 35 1HB ALA 35 16.989 -14.600 16.209 243 HB2 ALA 35 2HB ALA 35 15.793 -14.268 17.451 244 HB3 ALA 35 3HB ALA 35 17.291 -13.337 17.407 245 H SER 36 H SER 36 15.338 -12.417 13.502 246 HA SER 36 HA SER 36 12.928 -14.034 13.609 247 HB2 SER 36 2HB SER 36 12.096 -12.283 11.931 248 HB3 SER 36 1HB SER 36 12.190 -11.825 13.635 249 HG SER 36 HG SER 36 14.023 -10.695 13.239 250 H THR 37 H THR 37 12.322 -15.050 11.723 251 HA THR 37 HA THR 37 14.479 -15.866 10.051 252 HB THR 37 HB THR 37 12.622 -17.379 10.921 253 HG1 THR 37 1HG THR 37 13.950 -17.737 8.936 254 HG21 THR 37 3HG2 THR 37 10.980 -15.999 8.793 255 HG22 THR 37 1HG2 THR 37 10.724 -15.882 10.532 256 HG23 THR 37 2HG2 THR 37 10.484 -17.420 9.712 257 H GLY 38 H GLY 38 13.727 -16.002 7.528 258 HA2 GLY 38 2HA GLY 38 13.509 -13.271 6.691 259 HA3 GLY 38 1HA GLY 38 13.871 -14.675 5.685 260 H ALA 39 H ALA 39 11.594 -12.708 6.952 261 HA ALA 39 HA ALA 39 9.168 -14.086 6.756 262 HB1 ALA 39 1HB ALA 39 9.565 -11.134 6.334 263 HB2 ALA 39 2HB ALA 39 9.426 -11.936 7.897 264 HB3 ALA 39 3HB ALA 39 8.061 -11.937 6.782 265 H GLU 40 H GLU 40 10.958 -12.354 4.324 266 HA GLU 40 HA GLU 40 8.986 -12.346 2.328 267 HB2 GLU 40 2HB GLU 40 10.814 -11.734 0.815 268 HB3 GLU 40 1HB GLU 40 10.822 -10.796 2.300 269 HG2 GLU 40 2HG GLU 40 12.611 -13.175 1.855 270 HG3 GLU 40 1HG GLU 40 13.096 -11.538 1.404 271 H ASN 41 H ASN 41 10.818 -14.906 3.541 272 HA ASN 41 HA ASN 41 10.957 -16.374 1.052 273 HB2 ASN 41 2HB ASN 41 11.658 -17.227 3.855 274 HB3 ASN 41 1HB ASN 41 11.827 -18.254 2.438 275 HD21 ASN 41 1HD2 ASN 41 13.073 -15.658 4.233 276 HD22 ASN 41 2HD2 ASN 41 14.529 -15.407 3.331 277 H LEU 42 H LEU 42 8.671 -15.882 3.418 278 HA LEU 42 HA LEU 42 7.335 -18.373 3.400 279 HB2 LEU 42 2HB LEU 42 6.521 -15.577 4.130 280 HB3 LEU 42 1HB LEU 42 5.335 -16.855 4.100 281 HG LEU 42 HG LEU 42 6.579 -18.030 5.894 282 HD11 LEU 42 1HD1 LEU 42 8.374 -15.630 5.836 283 HD12 LEU 42 2HD1 LEU 42 8.831 -17.295 5.478 284 HD13 LEU 42 3HD1 LEU 42 8.354 -16.840 7.116 285 HD21 LEU 42 3HD2 LEU 42 4.783 -16.523 6.490 286 HD22 LEU 42 1HD2 LEU 42 5.905 -15.160 6.505 287 HD23 LEU 42 2HD2 LEU 42 6.071 -16.451 7.692 288 HA PRO 43 HA PRO 43 5.880 -17.867 -0.826 289 HB2 PRO 43 2HB PRO 43 4.488 -20.191 -0.969 290 HB3 PRO 43 1HB PRO 43 6.250 -20.122 -1.095 291 HG2 PRO 43 2HG PRO 43 4.549 -20.776 1.283 292 HG3 PRO 43 1HG PRO 43 6.002 -21.608 0.700 293 HD2 PRO 43 2HD PRO 43 6.091 -19.890 2.748 294 HD3 PRO 43 1HD PRO 43 7.422 -20.010 1.582 295 H ALA 44 H ALA 44 3.861 -18.550 1.939 296 HA ALA 44 HA ALA 44 1.532 -17.458 0.531 297 HB1 ALA 44 1HB ALA 44 0.189 -18.476 2.325 298 HB2 ALA 44 2HB ALA 44 1.661 -19.030 3.118 299 HB3 ALA 44 3HB ALA 44 1.209 -19.684 1.544 300 H GLY 45 H GLY 45 3.823 -16.075 1.602 301 HA2 GLY 45 2HA GLY 45 2.579 -14.507 3.756 302 HA3 GLY 45 1HA GLY 45 4.311 -14.618 3.478 303 H SER 46 H SER 46 2.711 -14.372 0.553 304 HA SER 46 HA SER 46 3.594 -11.638 0.324 305 HB2 SER 46 2HB SER 46 2.352 -13.385 -1.789 306 HB3 SER 46 1HB SER 46 3.354 -11.960 -2.023 307 HG SER 46 HG SER 46 4.685 -13.687 -2.330 308 H ALA 47 H ALA 47 2.220 -10.041 -0.519 309 HA ALA 47 HA ALA 47 -0.650 -10.389 -0.453 310 HB1 ALA 47 1HB ALA 47 -0.116 -10.073 1.908 311 HB2 ALA 47 2HB ALA 47 -0.946 -8.651 1.268 312 HB3 ALA 47 3HB ALA 47 0.799 -8.619 1.516 313 H LEU 48 H LEU 48 -1.678 -8.234 -1.085 314 HA LEU 48 HA LEU 48 0.261 -6.586 -2.487 315 HB2 LEU 48 2HB LEU 48 -0.978 -6.462 -4.511 316 HB3 LEU 48 1HB LEU 48 -0.760 -8.152 -4.143 317 HG LEU 48 HG LEU 48 -3.339 -6.632 -3.676 318 HD11 LEU 48 1HD1 LEU 48 -2.800 -6.704 -6.039 319 HD12 LEU 48 2HD1 LEU 48 -4.153 -7.774 -5.677 320 HD13 LEU 48 3HD1 LEU 48 -2.545 -8.446 -5.947 321 HD21 LEU 48 3HD2 LEU 48 -3.109 -8.637 -2.279 322 HD22 LEU 48 1HD2 LEU 48 -2.753 -9.595 -3.717 323 HD23 LEU 48 2HD2 LEU 48 -4.343 -8.860 -3.520 324 H LEU 49 H LEU 49 -0.121 -4.518 -2.629 325 HA LEU 49 HA LEU 49 -2.482 -3.532 -1.252 326 HB2 LEU 49 2HB LEU 49 -1.142 -1.463 -0.821 327 HB3 LEU 49 1HB LEU 49 -0.537 -2.877 0.009 328 HG LEU 49 HG LEU 49 1.168 -2.953 -1.979 329 HD11 LEU 49 1HD1 LEU 49 0.185 -1.261 -3.381 330 HD12 LEU 49 2HD1 LEU 49 1.775 -0.719 -2.827 331 HD13 LEU 49 3HD1 LEU 49 0.316 -0.066 -2.092 332 HD21 LEU 49 3HD2 LEU 49 2.690 -1.505 -0.729 333 HD22 LEU 49 1HD2 LEU 49 1.774 -2.570 0.334 334 HD23 LEU 49 2HD2 LEU 49 1.326 -0.871 0.192 335 H VAL 50 H VAL 50 -3.785 -2.194 -2.323 336 HA VAL 50 HA VAL 50 -3.048 -1.644 -5.127 337 HB VAL 50 HB VAL 50 -5.831 -2.169 -4.042 338 HG11 VAL 50 1HG1 VAL 50 -5.849 -0.706 -5.974 339 HG12 VAL 50 2HG1 VAL 50 -6.509 -2.285 -6.398 340 HG13 VAL 50 3HG1 VAL 50 -4.870 -1.856 -6.882 341 HG21 VAL 50 3HG2 VAL 50 -4.527 -4.233 -3.983 342 HG22 VAL 50 1HG2 VAL 50 -4.063 -4.006 -5.669 343 HG23 VAL 50 2HG2 VAL 50 -5.747 -4.315 -5.254 344 H VAL 51 H VAL 51 -2.788 0.500 -5.423 345 HA VAL 51 HA VAL 51 -4.302 2.333 -3.704 346 HB VAL 51 HB VAL 51 -2.249 2.962 -5.864 347 HG11 VAL 51 1HG1 VAL 51 -3.399 4.697 -3.677 348 HG12 VAL 51 2HG1 VAL 51 -3.749 4.820 -5.397 349 HG13 VAL 51 3HG1 VAL 51 -2.126 5.175 -4.801 350 HG21 VAL 51 3HG2 VAL 51 -1.853 2.809 -2.881 351 HG22 VAL 51 1HG2 VAL 51 -0.649 3.374 -4.040 352 HG23 VAL 51 2HG2 VAL 51 -1.191 1.691 -4.073 353 H LYS 52 H LYS 52 -6.212 2.817 -4.365 354 HA LYS 52 HA LYS 52 -6.861 2.379 -7.166 355 HB2 LYS 52 2HB LYS 52 -8.264 1.380 -5.342 356 HB3 LYS 52 1HB LYS 52 -8.730 3.008 -4.877 357 HG2 LYS 52 2HG LYS 52 -10.446 1.895 -6.199 358 HG3 LYS 52 1HG LYS 52 -9.831 3.332 -7.022 359 HD2 LYS 52 2HD LYS 52 -8.455 1.949 -8.476 360 HD3 LYS 52 1HD LYS 52 -8.928 0.500 -7.584 361 HE2 LYS 52 2HE LYS 52 -10.836 2.284 -9.099 362 HE3 LYS 52 1HE LYS 52 -10.121 0.810 -9.751 363 HZ1 LYS 52 3HZ LYS 52 -11.857 0.939 -7.338 364 HZ2 LYS 52 1HZ LYS 52 -11.193 -0.442 -8.008 365 HZ3 LYS 52 2HZ LYS 52 -12.351 0.422 -8.855 366 H ARG 53 H ARG 53 -6.638 4.903 -4.765 367 HA ARG 53 HA ARG 53 -6.825 6.837 -6.909 368 HB2 ARG 53 2HB ARG 53 -8.373 6.979 -4.312 369 HB3 ARG 53 1HB ARG 53 -8.079 8.376 -5.337 370 HG2 ARG 53 2HG ARG 53 -9.264 7.224 -7.177 371 HG3 ARG 53 1HG ARG 53 -9.629 5.901 -6.069 372 HD2 ARG 53 2HD ARG 53 -10.919 7.362 -4.670 373 HD3 ARG 53 1HD ARG 53 -10.426 8.770 -5.611 374 HE ARG 53 HE ARG 53 -11.883 6.614 -6.924 375 HH11 ARG 53 1HH1 ARG 53 -11.861 9.978 -5.749 376 HH12 ARG 53 2HH1 ARG 53 -13.253 10.422 -6.623 377 HH21 ARG 53 1HH2 ARG 53 -13.748 7.277 -8.143 378 HH22 ARG 53 2HH2 ARG 53 -14.339 8.872 -8.002 379 H GLY 54 H GLY 54 -5.098 8.043 -6.860 380 HA2 GLY 54 2HA GLY 54 -4.022 9.514 -5.025 381 HA3 GLY 54 1HA GLY 54 -3.460 7.944 -4.489 382 HA PRO 55 HA PRO 55 -1.165 9.576 -8.599 383 HB2 PRO 55 2HB PRO 55 0.189 11.794 -7.608 384 HB3 PRO 55 1HB PRO 55 -1.200 11.857 -8.691 385 HG2 PRO 55 2HG PRO 55 -1.069 12.182 -5.733 386 HG3 PRO 55 1HG PRO 55 -2.091 13.025 -6.909 387 HD2 PRO 55 2HD PRO 55 -3.040 11.128 -5.323 388 HD3 PRO 55 1HD PRO 55 -3.621 11.302 -6.992 389 H ASN 56 H ASN 56 -0.620 9.233 -5.316 390 HA ASN 56 HA ASN 56 2.034 8.909 -4.756 391 HB2 ASN 56 2HB ASN 56 -0.219 6.981 -4.095 392 HB3 ASN 56 1HB ASN 56 1.338 6.981 -3.293 393 HD21 ASN 56 1HD2 ASN 56 0.507 7.452 -1.247 394 HD22 ASN 56 2HD2 ASN 56 -0.206 8.977 -0.875 395 H ALA 57 H ALA 57 -0.120 6.634 -6.382 396 HA ALA 57 HA ALA 57 2.084 5.506 -7.867 397 HB1 ALA 57 1HB ALA 57 0.412 3.749 -6.058 398 HB2 ALA 57 2HB ALA 57 2.112 4.145 -5.813 399 HB3 ALA 57 3HB ALA 57 1.622 3.189 -7.212 400 H GLY 58 H GLY 58 -1.303 4.899 -6.959 401 HA2 GLY 58 2HA GLY 58 -3.188 4.681 -8.257 402 HA3 GLY 58 1HA GLY 58 -2.274 5.356 -9.604 403 H ALA 59 H ALA 59 -1.334 2.549 -7.728 404 HA ALA 59 HA ALA 59 -2.033 0.724 -9.796 405 HB1 ALA 59 1HB ALA 59 0.853 1.317 -9.122 406 HB2 ALA 59 2HB ALA 59 0.060 1.671 -10.655 407 HB3 ALA 59 3HB ALA 59 0.299 -0.005 -10.152 408 H ARG 60 H ARG 60 -0.998 -1.438 -9.094 409 HA ARG 60 HA ARG 60 -1.213 -1.642 -6.193 410 HB2 ARG 60 2HB ARG 60 -1.852 -4.004 -6.565 411 HB3 ARG 60 1HB ARG 60 -2.965 -2.860 -7.301 412 HG2 ARG 60 2HG ARG 60 -1.960 -3.285 -9.490 413 HG3 ARG 60 1HG ARG 60 -0.840 -4.429 -8.753 414 HD2 ARG 60 2HD ARG 60 -2.665 -5.855 -8.093 415 HD3 ARG 60 1HD ARG 60 -3.839 -4.669 -8.658 416 HE ARG 60 HE ARG 60 -2.333 -5.210 -10.846 417 HH11 ARG 60 1HH1 ARG 60 -4.204 -7.256 -8.622 418 HH12 ARG 60 2HH1 ARG 60 -4.653 -8.376 -9.827 419 HH21 ARG 60 1HH2 ARG 60 -2.993 -6.760 -12.476 420 HH22 ARG 60 2HH2 ARG 60 -3.942 -8.103 -12.029 421 H PHE 61 H PHE 61 0.184 -3.098 -5.137 422 HA PHE 61 HA PHE 61 2.593 -3.908 -6.579 423 HB2 PHE 61 2HB PHE 61 3.004 -1.614 -5.688 424 HB3 PHE 61 1HB PHE 61 2.566 -2.179 -4.088 425 HD1 PHE 61 1HD PHE 61 5.108 -2.283 -6.717 426 HD2 PHE 61 2HD PHE 61 4.122 -3.426 -2.740 427 HE1 PHE 61 1HE PHE 61 7.462 -2.818 -6.291 428 HE2 PHE 61 2HE PHE 61 6.484 -3.971 -2.309 429 HZ PHE 61 HZ PHE 61 8.158 -3.664 -4.085 430 H LEU 62 H LEU 62 3.297 -5.869 -5.784 431 HA LEU 62 HA LEU 62 1.957 -6.787 -3.392 432 HB2 LEU 62 2HB LEU 62 2.588 -9.082 -4.118 433 HB3 LEU 62 1HB LEU 62 1.378 -8.300 -5.106 434 HG LEU 62 HG LEU 62 4.274 -8.387 -5.964 435 HD11 LEU 62 1HD1 LEU 62 3.550 -10.698 -5.470 436 HD12 LEU 62 2HD1 LEU 62 3.735 -10.425 -7.200 437 HD13 LEU 62 3HD1 LEU 62 2.124 -10.454 -6.481 438 HD21 LEU 62 3HD2 LEU 62 3.285 -8.203 -8.180 439 HD22 LEU 62 1HD2 LEU 62 2.697 -6.889 -7.161 440 HD23 LEU 62 2HD2 LEU 62 1.667 -8.279 -7.487 441 H LEU 63 H LEU 63 3.005 -7.524 -1.719 442 HA LEU 63 HA LEU 63 5.742 -6.631 -1.460 443 HB2 LEU 63 2HB LEU 63 3.934 -7.983 0.553 444 HB3 LEU 63 1HB LEU 63 5.462 -7.206 0.900 445 HG LEU 63 HG LEU 63 2.945 -5.808 -0.033 446 HD11 LEU 63 1HD1 LEU 63 2.756 -6.641 2.240 447 HD12 LEU 63 2HD1 LEU 63 2.889 -4.882 2.227 448 HD13 LEU 63 3HD1 LEU 63 4.282 -5.868 2.667 449 HD21 LEU 63 3HD2 LEU 63 5.611 -4.680 0.830 450 HD22 LEU 63 1HD2 LEU 63 4.160 -3.742 0.476 451 HD23 LEU 63 2HD2 LEU 63 4.955 -4.655 -0.806 452 H ASP 64 H ASP 64 7.297 -7.948 -2.129 453 HA ASP 64 HA ASP 64 7.183 -10.810 -1.393 454 HB2 ASP 64 2HB ASP 64 8.332 -11.378 -3.415 455 HB3 ASP 64 1HB ASP 64 7.037 -10.293 -3.905 456 H GLN 65 H GLN 65 8.230 -8.129 -0.437 457 HA GLN 65 HA GLN 65 10.965 -8.893 0.186 458 HB2 GLN 65 2HB GLN 65 11.487 -6.396 -0.035 459 HB3 GLN 65 1HB GLN 65 11.246 -7.269 -1.544 460 HG2 GLN 65 2HG GLN 65 9.003 -6.404 -1.737 461 HG3 GLN 65 1HG GLN 65 9.134 -5.627 -0.164 462 HE21 GLN 65 1HE2 GLN 65 10.105 -5.533 -3.501 463 HE22 GLN 65 2HE2 GLN 65 10.693 -3.906 -3.450 464 HA PRO 66 HA PRO 66 9.622 -8.301 4.278 465 HB2 PRO 66 2HB PRO 66 11.826 -7.019 5.396 466 HB3 PRO 66 1HB PRO 66 11.608 -8.762 5.231 467 HG2 PRO 66 2HG PRO 66 13.184 -6.880 3.557 468 HG3 PRO 66 1HG PRO 66 13.500 -8.580 3.934 469 HD2 PRO 66 2HD PRO 66 12.544 -7.747 1.538 470 HD3 PRO 66 1HD PRO 66 12.162 -9.328 2.233 471 H THR 67 H THR 67 11.334 -5.274 3.299 472 HA THR 67 HA THR 67 9.068 -3.849 4.472 473 HB THR 67 HB THR 67 11.981 -3.160 4.909 474 HG1 THR 67 1HG THR 67 10.610 -4.878 6.161 475 HG21 THR 67 3HG2 THR 67 11.109 -1.357 6.354 476 HG22 THR 67 1HG2 THR 67 9.465 -1.763 5.856 477 HG23 THR 67 2HG2 THR 67 10.617 -1.147 4.676 478 H THR 68 H THR 68 8.131 -2.888 2.798 479 HA THR 68 HA THR 68 9.739 -1.610 0.734 480 HB THR 68 HB THR 68 6.742 -1.994 0.986 481 HG1 THR 68 1HG THR 68 8.806 -3.514 -0.194 482 HG21 THR 68 3HG2 THR 68 8.460 -1.301 -1.409 483 HG22 THR 68 1HG2 THR 68 7.418 -0.171 -0.540 484 HG23 THR 68 2HG2 THR 68 6.714 -1.527 -1.421 485 H THR 69 H THR 69 10.215 0.555 1.115 486 HA THR 69 HA THR 69 8.353 1.939 2.863 487 HB THR 69 HB THR 69 10.755 1.935 3.597 488 HG1 THR 69 1HG THR 69 9.176 3.666 4.052 489 HG21 THR 69 3HG2 THR 69 12.354 3.415 2.443 490 HG22 THR 69 1HG2 THR 69 11.151 3.733 1.194 491 HG23 THR 69 2HG2 THR 69 11.821 2.115 1.377 492 H ALA 70 H ALA 70 7.580 3.947 2.368 493 HA ALA 70 HA ALA 70 7.461 4.546 -0.494 494 HB1 ALA 70 1HB ALA 70 5.313 3.951 0.515 495 HB2 ALA 70 2HB ALA 70 5.333 5.637 0.006 496 HB3 ALA 70 3HB ALA 70 5.519 5.230 1.715 497 H GLY 71 H GLY 71 8.191 6.404 -1.161 498 HA2 GLY 71 2HA GLY 71 8.238 8.752 0.475 499 HA3 GLY 71 1HA GLY 71 9.839 8.108 0.091 500 H ARG 72 H ARG 72 10.370 9.787 -1.240 501 HA ARG 72 HA ARG 72 9.770 9.271 -3.939 502 HB2 ARG 72 2HB ARG 72 7.839 10.839 -3.280 503 HB3 ARG 72 1HB ARG 72 9.067 12.097 -3.117 504 HG2 ARG 72 2HG ARG 72 9.729 11.271 -5.535 505 HG3 ARG 72 1HG ARG 72 8.045 10.749 -5.563 506 HD2 ARG 72 2HD ARG 72 8.177 12.947 -6.485 507 HD3 ARG 72 1HD ARG 72 7.398 13.038 -4.905 508 HE ARG 72 HE ARG 72 9.373 13.952 -3.991 509 HH11 ARG 72 1HH1 ARG 72 9.510 13.668 -7.531 510 HH12 ARG 72 2HH1 ARG 72 10.838 14.728 -7.674 511 HH21 ARG 72 1HH2 ARG 72 11.168 15.385 -4.225 512 HH22 ARG 72 2HH2 ARG 72 11.802 15.713 -5.778 513 H HIS 73 H HIS 73 11.950 8.886 -2.977 514 HA HIS 73 HA HIS 73 13.661 11.038 -3.883 515 HB2 HIS 73 2HB HIS 73 13.817 9.593 -1.212 516 HB3 HIS 73 1HB HIS 73 15.226 10.369 -1.917 517 HD1 HIS 73 1HD HIS 73 11.898 11.205 -0.261 518 HD2 HIS 73 2HD HIS 73 15.256 13.141 -1.772 519 HE1 HIS 73 1HE HIS 73 11.745 13.576 0.518 520 HA PRO 74 HA PRO 74 15.848 7.829 -6.100 521 HB2 PRO 74 2HB PRO 74 18.185 8.335 -4.308 522 HB3 PRO 74 1HB PRO 74 18.152 8.165 -6.068 523 HG2 PRO 74 2HG PRO 74 18.334 10.575 -4.996 524 HG3 PRO 74 1HG PRO 74 17.269 10.301 -6.389 525 HD2 PRO 74 2HD PRO 74 16.573 10.703 -3.522 526 HD3 PRO 74 1HD PRO 74 15.686 11.189 -4.979 527 H GLU 75 H GLU 75 16.249 7.780 -2.580 528 HA GLU 75 HA GLU 75 16.196 4.882 -2.749 529 HB2 GLU 75 2HB GLU 75 17.175 6.598 -0.455 530 HB3 GLU 75 1HB GLU 75 17.071 4.843 -0.414 531 HG2 GLU 75 2HG GLU 75 18.639 4.738 -2.317 532 HG3 GLU 75 1HG GLU 75 18.788 6.489 -2.253 533 H SER 76 H SER 76 14.049 5.199 -3.246 534 HA SER 76 HA SER 76 12.404 4.781 -0.871 535 HB2 SER 76 2HB SER 76 11.555 6.566 -3.184 536 HB3 SER 76 1HB SER 76 10.567 6.147 -1.782 537 HG SER 76 HG SER 76 12.838 7.064 -0.880 538 H ASP 77 H ASP 77 11.389 2.877 -1.127 539 HA ASP 77 HA ASP 77 11.655 1.360 -3.503 540 HB2 ASP 77 2HB ASP 77 9.923 0.853 -1.074 541 HB3 ASP 77 1HB ASP 77 10.105 -0.276 -2.409 542 H ILE 78 H ILE 78 8.795 2.798 -1.999 543 HA ILE 78 HA ILE 78 7.724 2.965 -4.704 544 HB ILE 78 HB ILE 78 5.405 2.802 -3.832 545 HG12 ILE 78 2HG1 ILE 78 6.637 1.801 -1.261 546 HG13 ILE 78 1HG1 ILE 78 6.001 3.426 -1.480 547 HG21 ILE 78 1HG2 ILE 78 6.406 0.857 -4.844 548 HG22 ILE 78 2HG2 ILE 78 5.365 0.365 -3.506 549 HG23 ILE 78 3HG2 ILE 78 7.115 0.382 -3.302 550 HD11 ILE 78 3HD1 ILE 78 3.821 2.588 -1.873 551 HD12 ILE 78 1HD1 ILE 78 4.427 1.944 -0.355 552 HD13 ILE 78 2HD1 ILE 78 4.385 0.912 -1.795 553 H PHE 79 H PHE 79 5.649 4.598 -4.446 554 HA PHE 79 HA PHE 79 6.930 6.998 -3.403 555 HB2 PHE 79 2HB PHE 79 5.528 6.641 -6.047 556 HB3 PHE 79 1HB PHE 79 6.067 8.185 -5.399 557 HD1 PHE 79 1HD PHE 79 8.436 8.664 -5.205 558 HD2 PHE 79 2HD PHE 79 7.061 5.097 -7.036 559 HE1 PHE 79 1HE PHE 79 10.666 8.335 -6.214 560 HE2 PHE 79 2HE PHE 79 9.267 4.751 -8.050 561 HZ PHE 79 HZ PHE 79 11.080 6.373 -7.641 562 H LEU 80 H LEU 80 5.701 8.334 -2.296 563 HA LEU 80 HA LEU 80 2.834 8.171 -2.734 564 HB2 LEU 80 2HB LEU 80 2.284 8.871 -0.506 565 HB3 LEU 80 1HB LEU 80 3.391 7.537 -0.349 566 HG LEU 80 HG LEU 80 4.191 10.437 0.010 567 HD11 LEU 80 1HD1 LEU 80 3.442 8.360 2.069 568 HD12 LEU 80 2HD1 LEU 80 2.510 9.801 1.663 569 HD13 LEU 80 3HD1 LEU 80 4.097 9.959 2.413 570 HD21 LEU 80 3HD2 LEU 80 5.519 7.859 0.816 571 HD22 LEU 80 1HD2 LEU 80 6.105 9.481 1.168 572 HD23 LEU 80 2HD2 LEU 80 6.029 8.917 -0.501 573 H ASP 81 H ASP 81 1.798 10.030 -3.288 574 HA ASP 81 HA ASP 81 3.515 12.339 -3.524 575 HB2 ASP 81 2HB ASP 81 3.533 11.185 -5.723 576 HB3 ASP 81 1HB ASP 81 1.780 11.283 -5.772 577 H ASP 82 H ASP 82 2.309 12.636 -1.641 578 HA ASP 82 HA ASP 82 -0.174 14.063 -2.257 579 HB2 ASP 82 2HB ASP 82 -1.057 13.541 -0.057 580 HB3 ASP 82 1HB ASP 82 -0.548 12.034 -0.797 581 H VAL 83 H VAL 83 -0.319 15.280 0.255 582 HA VAL 83 HA VAL 83 1.208 17.588 -0.271 583 HB VAL 83 HB VAL 83 -0.294 16.886 2.256 584 HG11 VAL 83 1HG1 VAL 83 1.195 18.752 2.559 585 HG12 VAL 83 2HG1 VAL 83 -0.483 19.297 2.570 586 HG13 VAL 83 3HG1 VAL 83 0.521 19.555 1.142 587 HG21 VAL 83 3HG2 VAL 83 -1.772 16.682 0.359 588 HG22 VAL 83 1HG2 VAL 83 -1.261 18.257 -0.249 589 HG23 VAL 83 2HG2 VAL 83 -2.167 18.148 1.258 590 H THR 84 H THR 84 1.701 14.885 2.032 591 HA THR 84 HA THR 84 4.150 16.271 2.804 592 HB THR 84 HB THR 84 2.442 14.632 4.677 593 HG1 THR 84 1HG THR 84 2.272 17.114 3.783 594 HG21 THR 84 3HG2 THR 84 4.849 14.624 5.261 595 HG22 THR 84 1HG2 THR 84 3.925 15.577 6.421 596 HG23 THR 84 2HG2 THR 84 4.875 16.385 5.175 597 H VAL 85 H VAL 85 5.516 15.251 1.564 598 HA VAL 85 HA VAL 85 5.712 12.342 1.805 599 HB VAL 85 HB VAL 85 5.211 12.980 -0.477 600 HG11 VAL 85 1HG1 VAL 85 5.930 15.275 -0.494 601 HG12 VAL 85 2HG1 VAL 85 6.742 14.411 -1.805 602 HG13 VAL 85 3HG1 VAL 85 7.612 14.787 -0.324 603 HG21 VAL 85 3HG2 VAL 85 7.144 12.049 -1.670 604 HG22 VAL 85 1HG2 VAL 85 6.744 11.120 -0.223 605 HG23 VAL 85 2HG2 VAL 85 8.117 12.225 -0.207 606 H SER 86 H SER 86 7.479 11.521 2.707 607 HA SER 86 HA SER 86 9.761 13.310 3.136 608 HB2 SER 86 2HB SER 86 9.047 10.850 4.773 609 HB3 SER 86 1HB SER 86 10.207 12.110 5.171 610 HG SER 86 HG SER 86 7.482 12.062 5.413 611 H ARG 87 H ARG 87 11.739 11.486 3.722 612 HA ARG 87 HA ARG 87 12.220 10.218 1.200 613 HB2 ARG 87 2HB ARG 87 14.085 11.314 2.220 614 HB3 ARG 87 1HB ARG 87 13.861 10.449 3.727 615 HG2 ARG 87 2HG ARG 87 14.593 8.393 2.706 616 HG3 ARG 87 1HG ARG 87 14.683 9.172 1.124 617 HD2 ARG 87 2HD ARG 87 16.865 8.907 2.247 618 HD3 ARG 87 1HD ARG 87 16.471 10.580 1.850 619 HE ARG 87 HE ARG 87 15.650 10.313 4.424 620 HH11 ARG 87 1HH1 ARG 87 18.723 9.491 2.869 621 HH12 ARG 87 2HH1 ARG 87 19.677 9.956 4.187 622 HH21 ARG 87 1HH2 ARG 87 16.981 10.986 6.236 623 HH22 ARG 87 2HH2 ARG 87 18.673 10.832 6.126 624 H ARG 88 H ARG 88 12.720 8.746 4.422 625 HA ARG 88 HA ARG 88 11.362 6.400 3.352 626 HB2 ARG 88 2HB ARG 88 13.725 6.161 4.327 627 HB3 ARG 88 1HB ARG 88 13.065 6.637 5.878 628 HG2 ARG 88 2HG ARG 88 11.690 4.363 4.645 629 HG3 ARG 88 1HG ARG 88 13.388 4.071 5.010 630 HD2 ARG 88 2HD ARG 88 11.395 5.144 6.997 631 HD3 ARG 88 1HD ARG 88 11.766 3.426 6.813 632 HE ARG 88 HE ARG 88 14.005 5.196 7.289 633 HH11 ARG 88 1HH1 ARG 88 11.696 2.845 8.788 634 HH12 ARG 88 2HH1 ARG 88 12.661 2.642 10.156 635 HH21 ARG 88 1HH2 ARG 88 15.280 4.808 9.237 636 HH22 ARG 88 2HH2 ARG 88 14.704 3.728 10.416 637 H HIS 89 H HIS 89 9.328 7.233 3.518 638 HA HIS 89 HA HIS 89 8.520 8.538 5.978 639 HB2 HIS 89 2HB HIS 89 7.924 9.591 3.804 640 HB3 HIS 89 1HB HIS 89 6.993 8.166 3.398 641 HD2 HIS 89 2HD HIS 89 4.515 7.963 4.506 642 HE1 HIS 89 1HE HIS 89 4.691 11.593 6.644 643 HE2 HIS 89 2HE HIS 89 3.486 9.338 6.338 644 H ALA 90 H ALA 90 6.858 6.156 3.950 645 HA ALA 90 HA ALA 90 5.769 5.049 6.454 646 HB1 ALA 90 1HB ALA 90 3.865 4.248 5.106 647 HB2 ALA 90 2HB ALA 90 4.560 5.020 3.681 648 HB3 ALA 90 3HB ALA 90 4.019 6.001 5.045 649 H GLU 91 H GLU 91 5.741 2.799 6.680 650 HA GLU 91 HA GLU 91 7.216 1.399 4.588 651 HB2 GLU 91 2HB GLU 91 7.581 1.028 7.559 652 HB3 GLU 91 1HB GLU 91 8.360 0.084 6.297 653 HG2 GLU 91 2HG GLU 91 9.442 2.149 5.481 654 HG3 GLU 91 1HG GLU 91 8.737 3.010 6.845 655 H PHE 92 H PHE 92 6.300 -0.287 3.884 656 HA PHE 92 HA PHE 92 4.038 -1.434 5.331 657 HB2 PHE 92 2HB PHE 92 4.817 -1.628 2.391 658 HB3 PHE 92 1HB PHE 92 3.357 -2.294 3.114 659 HD1 PHE 92 1HD PHE 92 1.536 -0.818 3.812 660 HD2 PHE 92 2HD PHE 92 5.000 0.740 1.900 661 HE1 PHE 92 1HE PHE 92 0.349 1.286 3.387 662 HE2 PHE 92 2HE PHE 92 3.805 2.859 1.478 663 HZ PHE 92 HZ PHE 92 1.485 3.128 2.220 664 H ARG 93 H ARG 93 4.605 -3.234 6.391 665 HA ARG 93 HA ARG 93 6.993 -4.629 5.425 666 HB2 ARG 93 2HB ARG 93 6.046 -4.271 8.245 667 HB3 ARG 93 1HB ARG 93 7.427 -5.224 7.750 668 HG2 ARG 93 2HG ARG 93 8.467 -3.162 6.883 669 HG3 ARG 93 1HG ARG 93 7.114 -2.240 7.555 670 HD2 ARG 93 2HD ARG 93 8.999 -2.236 9.103 671 HD3 ARG 93 1HD ARG 93 7.640 -3.138 9.783 672 HE ARG 93 HE ARG 93 9.622 -4.670 8.323 673 HH11 ARG 93 1HH1 ARG 93 8.338 -3.763 11.524 674 HH12 ARG 93 2HH1 ARG 93 9.296 -4.897 12.361 675 HH21 ARG 93 1HH2 ARG 93 10.840 -6.287 9.484 676 HH22 ARG 93 2HH2 ARG 93 10.725 -6.392 11.180 677 H ILE 94 H ILE 94 7.030 -6.725 5.445 678 HA ILE 94 HA ILE 94 4.721 -8.156 6.478 679 HB ILE 94 HB ILE 94 5.012 -8.398 3.984 680 HG12 ILE 94 2HG1 ILE 94 4.000 -10.284 5.257 681 HG13 ILE 94 1HG1 ILE 94 4.763 -10.779 3.762 682 HG21 ILE 94 1HG2 ILE 94 7.349 -8.119 3.713 683 HG22 ILE 94 2HG2 ILE 94 6.855 -9.655 3.001 684 HG23 ILE 94 3HG2 ILE 94 7.670 -9.631 4.564 685 HD11 ILE 94 3HD1 ILE 94 5.138 -12.392 5.530 686 HD12 ILE 94 1HD1 ILE 94 5.875 -11.144 6.538 687 HD13 ILE 94 2HD1 ILE 94 6.662 -11.651 5.040 688 H ASN 95 H ASN 95 5.199 -9.167 8.275 689 HA ASN 95 HA ASN 95 8.021 -9.552 8.911 690 HB2 ASN 95 2HB ASN 95 6.708 -7.657 10.093 691 HB3 ASN 95 1HB ASN 95 5.831 -8.941 10.908 692 HD21 ASN 95 1HD2 ASN 95 7.456 -6.901 12.050 693 HD22 ASN 95 2HD2 ASN 95 8.743 -7.655 12.904 694 H GLU 96 H GLU 96 8.484 -11.427 10.108 695 HA GLU 96 HA GLU 96 6.977 -13.673 9.389 696 HB2 GLU 96 2HB GLU 96 8.523 -14.899 11.023 697 HB3 GLU 96 1HB GLU 96 9.232 -14.119 9.628 698 HG2 GLU 96 2HG GLU 96 10.655 -13.722 11.472 699 HG3 GLU 96 1HG GLU 96 9.854 -12.201 11.115 700 H GLY 97 H GLY 97 6.679 -11.652 12.076 701 HA2 GLY 97 2HA GLY 97 5.076 -13.450 13.608 702 HA3 GLY 97 1HA GLY 97 5.207 -11.709 13.849 703 H GLU 98 H GLU 98 4.373 -10.666 11.459 704 HA GLU 98 HA GLU 98 2.020 -11.658 10.366 705 HB2 GLU 98 2HB GLU 98 1.280 -11.346 12.781 706 HB3 GLU 98 1HB GLU 98 1.609 -9.640 12.599 707 HG2 GLU 98 2HG GLU 98 -0.225 -9.335 11.170 708 HG3 GLU 98 1HG GLU 98 -0.392 -11.080 10.880 709 H PHE 99 H PHE 99 0.751 -9.277 9.652 710 HA PHE 99 HA PHE 99 2.879 -7.946 8.194 711 HB2 PHE 99 2HB PHE 99 -0.137 -7.679 7.976 712 HB3 PHE 99 1HB PHE 99 1.044 -6.908 6.920 713 HD1 PHE 99 2HD PHE 99 -0.563 -10.079 7.832 714 HD2 PHE 99 1HD PHE 99 2.134 -8.130 5.182 715 HE1 PHE 99 2HE PHE 99 -0.658 -12.015 6.315 716 HE2 PHE 99 1HE PHE 99 2.035 -10.060 3.661 717 HZ PHE 99 HZ PHE 99 0.639 -12.004 4.227 718 H GLU 100 H GLU 100 3.336 -5.760 8.384 719 HA GLU 100 HA GLU 100 2.083 -4.331 10.628 720 HB2 GLU 100 2HB GLU 100 4.124 -5.377 11.457 721 HB3 GLU 100 1HB GLU 100 5.048 -4.712 10.125 722 HG2 GLU 100 2HG GLU 100 4.610 -2.449 10.988 723 HG3 GLU 100 1HG GLU 100 3.740 -3.155 12.350 724 H VAL 101 H VAL 101 1.701 -2.135 10.151 725 HA VAL 101 HA VAL 101 3.290 -1.072 7.980 726 HB VAL 101 HB VAL 101 1.097 -1.527 6.976 727 HG11 VAL 101 1HG1 VAL 101 -0.107 0.161 9.155 728 HG12 VAL 101 2HG1 VAL 101 -0.298 -1.580 8.950 729 HG13 VAL 101 3HG1 VAL 101 -0.970 -0.471 7.750 730 HG21 VAL 101 3HG2 VAL 101 1.484 1.419 7.496 731 HG22 VAL 101 1HG2 VAL 101 0.480 0.733 6.218 732 HG23 VAL 101 2HG2 VAL 101 2.221 0.469 6.205 733 H VAL 102 H VAL 102 4.393 0.543 8.620 734 HA VAL 102 HA VAL 102 3.390 2.116 10.869 735 HB VAL 102 HB VAL 102 5.768 2.488 11.587 736 HG11 VAL 102 1HG1 VAL 102 6.017 0.314 12.707 737 HG12 VAL 102 2HG1 VAL 102 4.788 -0.364 11.639 738 HG13 VAL 102 3HG1 VAL 102 4.361 0.910 12.780 739 HG21 VAL 102 3HG2 VAL 102 6.344 0.212 9.685 740 HG22 VAL 102 1HG2 VAL 102 7.484 0.891 10.848 741 HG23 VAL 102 2HG2 VAL 102 6.897 1.876 9.508 742 H ASP 103 H ASP 103 3.342 4.264 10.626 743 HA ASP 103 HA ASP 103 4.741 5.389 8.319 744 HB2 ASP 103 2HB ASP 103 2.329 6.023 8.763 745 HB3 ASP 103 1HB ASP 103 2.867 6.769 10.264 746 H VAL 104 H VAL 104 6.774 5.844 8.789 747 HA VAL 104 HA VAL 104 7.399 6.532 11.542 748 HB VAL 104 HB VAL 104 9.793 6.156 10.993 749 HG11 VAL 104 1HG1 VAL 104 8.502 4.353 11.947 750 HG12 VAL 104 2HG1 VAL 104 9.666 3.713 10.786 751 HG13 VAL 104 3HG1 VAL 104 7.966 3.858 10.342 752 HG21 VAL 104 3HG2 VAL 104 8.749 5.231 8.316 753 HG22 VAL 104 1HG2 VAL 104 10.400 5.035 8.901 754 HG23 VAL 104 2HG2 VAL 104 9.757 6.650 8.606 755 H GLY 105 H GLY 105 6.409 8.193 9.106 756 HA2 GLY 105 2HA GLY 105 8.236 10.437 9.404 757 HA3 GLY 105 1HA GLY 105 6.776 10.389 8.408 758 H SER 106 H SER 106 4.962 9.446 10.110 759 HA SER 106 HA SER 106 3.550 9.742 11.767 760 HB2 SER 106 2HB SER 106 5.818 11.067 13.235 761 HB3 SER 106 1HB SER 106 4.286 10.542 13.955 762 HG SER 106 HG SER 106 5.500 8.623 12.440 763 H LEU 107 H LEU 107 5.247 12.667 10.948 764 HA LEU 107 HA LEU 107 3.390 14.565 11.801 765 HB2 LEU 107 2HB LEU 107 5.351 14.532 9.553 766 HB3 LEU 107 1HB LEU 107 4.237 15.860 9.709 767 HG LEU 107 HG LEU 107 6.402 16.470 10.632 768 HD11 LEU 107 1HD1 LEU 107 4.497 17.429 11.734 769 HD12 LEU 107 2HD1 LEU 107 5.819 17.160 12.865 770 HD13 LEU 107 3HD1 LEU 107 4.434 16.073 12.861 771 HD21 LEU 107 3HD2 LEU 107 6.104 14.121 12.497 772 HD22 LEU 107 1HD2 LEU 107 7.381 15.336 12.568 773 HD23 LEU 107 2HD2 LEU 107 7.263 14.253 11.177 774 H ASN 108 H ASN 108 3.504 12.771 8.795 775 HA ASN 108 HA ASN 108 1.073 14.049 7.842 776 HB2 ASN 108 2HB ASN 108 2.925 13.499 6.254 777 HB3 ASN 108 1HB ASN 108 2.678 11.802 6.610 778 HD21 ASN 108 1HD2 ASN 108 2.490 11.835 4.175 779 HD22 ASN 108 2HD2 ASN 108 0.964 12.098 3.488 780 H GLY 109 H GLY 109 2.171 10.803 8.626 781 HA2 GLY 109 2HA GLY 109 1.073 9.162 9.779 782 HA3 GLY 109 1HA GLY 109 -0.270 10.272 9.994 783 H THR 110 H THR 110 1.002 7.687 8.179 784 HA THR 110 HA THR 110 -1.135 7.491 6.318 785 HB THR 110 HB THR 110 0.765 5.383 7.420 786 HG1 THR 110 1HG THR 110 1.840 7.134 6.373 787 HG21 THR 110 3HG2 THR 110 0.267 4.158 5.333 788 HG22 THR 110 1HG2 THR 110 -0.904 5.404 4.895 789 HG23 THR 110 2HG2 THR 110 -1.184 4.384 6.309 790 H TYR 111 H TYR 111 -3.169 6.836 6.846 791 HA TYR 111 HA TYR 111 -3.535 5.827 9.582 792 HB2 TYR 111 2HB TYR 111 -5.461 7.499 7.989 793 HB3 TYR 111 1HB TYR 111 -5.676 6.922 9.628 794 HD1 TYR 111 2HD TYR 111 -3.574 7.692 11.224 795 HD2 TYR 111 1HD TYR 111 -4.972 9.669 7.739 796 HE1 TYR 111 2HE TYR 111 -2.642 9.808 12.055 797 HE2 TYR 111 1HE TYR 111 -4.044 11.787 8.566 798 HH TYR 111 HH TYR 111 -1.915 11.963 11.159 799 H VAL 112 H VAL 112 -5.661 4.777 9.845 800 HA VAL 112 HA VAL 112 -6.240 2.963 7.642 801 HB VAL 112 HB VAL 112 -7.324 2.966 10.460 802 HG11 VAL 112 1HG1 VAL 112 -7.160 0.764 8.411 803 HG12 VAL 112 2HG1 VAL 112 -8.608 1.649 8.885 804 HG13 VAL 112 3HG1 VAL 112 -7.803 0.592 10.046 805 HG21 VAL 112 3HG2 VAL 112 -4.923 2.801 10.637 806 HG22 VAL 112 1HG2 VAL 112 -4.902 1.498 9.453 807 HG23 VAL 112 2HG2 VAL 112 -5.657 1.246 11.027 808 H ASN 113 H ASN 113 -8.345 3.008 6.796 809 HA ASN 113 HA ASN 113 -9.585 5.346 6.273 810 HB2 ASN 113 2HB ASN 113 -11.539 4.147 5.525 811 HB3 ASN 113 1HB ASN 113 -10.109 3.195 5.166 812 HD21 ASN 113 1HD2 ASN 113 -9.712 1.287 6.420 813 HD22 ASN 113 2HD2 ASN 113 -10.974 0.540 7.297 814 H ARG 114 H ARG 114 -10.353 3.421 9.157 815 HA ARG 114 HA ARG 114 -12.044 5.665 10.016 816 HB2 ARG 114 2HB ARG 114 -13.270 4.048 11.463 817 HB3 ARG 114 1HB ARG 114 -13.450 3.753 9.742 818 HG2 ARG 114 2HG ARG 114 -11.780 1.975 9.884 819 HG3 ARG 114 1HG ARG 114 -11.632 2.261 11.617 820 HD2 ARG 114 2HD ARG 114 -13.945 1.644 11.951 821 HD3 ARG 114 1HD ARG 114 -14.178 1.474 10.208 822 HE ARG 114 HE ARG 114 -12.070 -0.145 10.914 823 HH11 ARG 114 1HH1 ARG 114 -15.536 0.003 11.664 824 HH12 ARG 114 2HH1 ARG 114 -15.695 -1.687 11.799 825 HH21 ARG 114 1HH2 ARG 114 -12.322 -2.477 11.123 826 HH22 ARG 114 2HH2 ARG 114 -13.852 -3.105 11.507 827 H GLU 115 H GLU 115 -9.175 4.072 10.677 828 HA GLU 115 HA GLU 115 -9.208 5.005 13.454 829 HB2 GLU 115 2HB GLU 115 -7.876 2.591 12.262 830 HB3 GLU 115 1HB GLU 115 -7.269 3.325 13.737 831 HG2 GLU 115 2HG GLU 115 -10.058 2.296 13.329 832 HG3 GLU 115 1HG GLU 115 -8.755 1.431 14.145 833 HA PRO 116 HA PRO 116 -5.905 7.544 11.793 834 HB2 PRO 116 2HB PRO 116 -6.315 9.456 13.843 835 HB3 PRO 116 1HB PRO 116 -6.884 9.559 12.176 836 HG2 PRO 116 2HG PRO 116 -8.488 9.276 14.465 837 HG3 PRO 116 1HG PRO 116 -9.005 9.064 12.788 838 HD2 PRO 116 2HD PRO 116 -8.308 7.019 14.828 839 HD3 PRO 116 1HD PRO 116 -9.449 6.940 13.464 840 H ARG 117 H ARG 117 -4.147 6.341 12.371 841 HA ARG 117 HA ARG 117 -2.877 6.970 14.850 842 HB2 ARG 117 2HB ARG 117 -2.489 4.597 15.447 843 HB3 ARG 117 1HB ARG 117 -4.189 5.022 15.512 844 HG2 ARG 117 2HG ARG 117 -4.529 3.954 13.327 845 HG3 ARG 117 1HG ARG 117 -2.824 3.497 13.299 846 HD2 ARG 117 2HD ARG 117 -4.119 1.626 14.058 847 HD3 ARG 117 1HD ARG 117 -3.177 2.260 15.406 848 HE ARG 117 HE ARG 117 -5.967 3.091 15.091 849 HH11 ARG 117 1HH1 ARG 117 -3.515 1.348 17.008 850 HH12 ARG 117 2HH1 ARG 117 -4.559 1.077 18.307 851 HH21 ARG 117 1HH2 ARG 117 -7.394 2.673 16.868 852 HH22 ARG 117 2HH2 ARG 117 -6.826 1.850 18.238 853 H ASN 118 H ASN 118 -0.628 6.428 14.718 854 HA ASN 118 HA ASN 118 0.328 6.712 12.003 855 HB2 ASN 118 2HB ASN 118 2.494 7.164 12.938 856 HB3 ASN 118 1HB ASN 118 1.275 8.019 13.889 857 HD21 ASN 118 1HD2 ASN 118 0.897 7.360 16.035 858 HD22 ASN 118 2HD2 ASN 118 1.991 6.295 16.836 859 H ALA 119 H ALA 119 0.229 4.153 14.329 860 HA ALA 119 HA ALA 119 1.493 2.410 12.312 861 HB1 ALA 119 1HB ALA 119 2.508 1.112 14.103 862 HB2 ALA 119 2HB ALA 119 1.832 2.208 15.305 863 HB3 ALA 119 3HB ALA 119 3.060 2.786 14.176 864 H GLN 120 H GLN 120 0.542 0.532 11.966 865 HA GLN 120 HA GLN 120 -1.813 -0.186 13.529 866 HB2 GLN 120 2HB GLN 120 -2.704 1.188 11.777 867 HB3 GLN 120 1HB GLN 120 -1.709 0.408 10.567 868 HG2 GLN 120 2HG GLN 120 -3.986 -0.311 10.316 869 HG3 GLN 120 1HG GLN 120 -3.004 -1.660 10.867 870 HE21 GLN 120 1HE2 GLN 120 -4.680 -2.771 11.697 871 HE22 GLN 120 2HE2 GLN 120 -5.577 -2.291 13.095 872 H VAL 121 H VAL 121 -2.220 -2.414 13.472 873 HA VAL 121 HA VAL 121 -0.205 -4.051 12.247 874 HB VAL 121 HB VAL 121 -1.221 -4.835 14.390 875 HG11 VAL 121 1HG1 VAL 121 -3.800 -5.141 12.862 876 HG12 VAL 121 2HG1 VAL 121 -3.489 -3.955 14.121 877 HG13 VAL 121 3HG1 VAL 121 -3.506 -5.673 14.517 878 HG21 VAL 121 3HG2 VAL 121 -1.721 -7.149 13.747 879 HG22 VAL 121 1HG2 VAL 121 -0.310 -6.509 12.902 880 HG23 VAL 121 2HG2 VAL 121 -1.860 -6.639 12.068 881 H MET 122 H MET 122 -0.293 -4.805 10.259 882 HA MET 122 HA MET 122 -2.223 -3.559 8.577 883 HB2 MET 122 2HB MET 122 0.329 -4.044 8.217 884 HB3 MET 122 1HB MET 122 -0.250 -5.596 7.648 885 HG2 MET 122 2HG MET 122 -1.475 -4.561 5.883 886 HG3 MET 122 1HG MET 122 -1.119 -2.955 6.525 887 HE1 MET 122 3HE MET 122 1.045 -2.840 3.327 888 HE2 MET 122 1HE MET 122 -0.116 -1.989 4.353 889 HE3 MET 122 2HE MET 122 -0.583 -3.482 3.540 890 H GLN 123 H GLN 123 -4.116 -4.339 8.125 891 HA GLN 123 HA GLN 123 -4.698 -7.142 8.731 892 HB2 GLN 123 2HB GLN 123 -5.829 -5.162 9.899 893 HB3 GLN 123 1HB GLN 123 -6.634 -4.867 8.372 894 HG2 GLN 123 2HG GLN 123 -8.142 -6.063 9.760 895 HG3 GLN 123 1HG GLN 123 -7.573 -7.190 8.529 896 HE21 GLN 123 1HE2 GLN 123 -6.349 -8.968 9.161 897 HE22 GLN 123 2HE2 GLN 123 -6.046 -9.333 10.802 898 H THR 124 H THR 124 -5.434 -8.420 7.089 899 HA THR 124 HA THR 124 -5.411 -7.341 4.453 900 HB THR 124 HB THR 124 -4.482 -9.535 4.682 901 HG1 THR 124 1HG THR 124 -6.992 -9.976 3.430 902 HG21 THR 124 3HG2 THR 124 -5.810 -11.498 5.372 903 HG22 THR 124 1HG2 THR 124 -7.158 -10.433 5.766 904 HG23 THR 124 2HG2 THR 124 -5.646 -10.323 6.674 905 H GLY 125 H GLY 125 -7.053 -6.756 3.238 906 HA2 GLY 125 2HA GLY 125 -9.233 -6.693 2.475 907 HA3 GLY 125 1HA GLY 125 -9.750 -7.563 3.916 908 H ASP 126 H ASP 126 -7.646 -4.822 4.188 909 HA ASP 126 HA ASP 126 -9.940 -3.343 5.269 910 HB2 ASP 126 2HB ASP 126 -7.954 -4.193 6.847 911 HB3 ASP 126 1HB ASP 126 -7.179 -2.728 6.251 912 H GLU 127 H GLU 127 -9.327 -0.942 5.402 913 HA GLU 127 HA GLU 127 -8.430 -0.170 2.699 914 HB2 GLU 127 2HB GLU 127 -10.907 -0.043 3.366 915 HB3 GLU 127 1HB GLU 127 -10.437 1.239 4.459 916 HG2 GLU 127 2HG GLU 127 -11.273 2.295 2.556 917 HG3 GLU 127 1HG GLU 127 -9.522 2.425 2.415 918 H ILE 128 H ILE 128 -6.683 1.113 2.773 919 HA ILE 128 HA ILE 128 -5.870 2.341 5.299 920 HB ILE 128 HB ILE 128 -4.168 1.377 2.983 921 HG12 ILE 128 2HG1 ILE 128 -4.460 0.316 5.811 922 HG13 ILE 128 1HG1 ILE 128 -5.082 -0.441 4.354 923 HG21 ILE 128 1HG2 ILE 128 -3.169 3.362 4.003 924 HG22 ILE 128 2HG2 ILE 128 -2.219 1.928 4.388 925 HG23 ILE 128 3HG2 ILE 128 -3.294 2.623 5.599 926 HD11 ILE 128 3HD1 ILE 128 -2.797 -0.802 3.566 927 HD12 ILE 128 1HD1 ILE 128 -3.061 -1.542 5.143 928 HD13 ILE 128 2HD1 ILE 128 -2.174 -0.022 5.020 929 H GLN 129 H GLN 129 -5.460 4.460 5.380 930 HA GLN 129 HA GLN 129 -6.109 6.030 3.006 931 HB2 GLN 129 2HB GLN 129 -7.528 6.306 5.002 932 HB3 GLN 129 1HB GLN 129 -6.107 6.709 5.948 933 HG2 GLN 129 2HG GLN 129 -5.787 8.717 4.582 934 HG3 GLN 129 1HG GLN 129 -7.238 8.310 3.667 935 HE21 GLN 129 1HE2 GLN 129 -8.341 10.129 4.286 936 HE22 GLN 129 2HE2 GLN 129 -8.907 10.378 5.897 937 H ILE 130 H ILE 130 -4.343 6.688 2.005 938 HA ILE 130 HA ILE 130 -1.945 7.289 3.563 939 HB ILE 130 HB ILE 130 -0.816 7.286 1.218 940 HG12 ILE 130 2HG1 ILE 130 -3.310 5.669 0.596 941 HG13 ILE 130 1HG1 ILE 130 -2.899 7.222 -0.110 942 HG21 ILE 130 1HG2 ILE 130 -0.447 4.850 1.328 943 HG22 ILE 130 2HG2 ILE 130 -1.741 4.739 2.526 944 HG23 ILE 130 3HG2 ILE 130 -0.283 5.669 2.877 945 HD11 ILE 130 3HD1 ILE 130 -2.452 5.392 -1.645 946 HD12 ILE 130 1HD1 ILE 130 -1.368 4.651 -0.467 947 HD13 ILE 130 2HD1 ILE 130 -0.955 6.207 -1.193 948 H GLY 131 H GLY 131 -2.116 9.285 4.203 949 HA2 GLY 131 2HA GLY 131 -2.142 11.582 4.089 950 HA3 GLY 131 1HA GLY 131 -2.041 11.443 2.330 951 H LYS 132 H LYS 132 -3.800 11.657 1.146 952 HA LYS 132 HA LYS 132 -6.431 11.664 2.476 953 HB2 LYS 132 2HB LYS 132 -5.507 13.441 0.206 954 HB3 LYS 132 1HB LYS 132 -7.165 13.347 0.772 955 HG2 LYS 132 2HG LYS 132 -6.395 14.152 2.992 956 HG3 LYS 132 1HG LYS 132 -4.781 14.360 2.307 957 HD2 LYS 132 2HD LYS 132 -7.277 15.706 1.278 958 HD3 LYS 132 1HD LYS 132 -6.123 16.458 2.376 959 HE2 LYS 132 2HE LYS 132 -4.386 16.263 0.663 960 HE3 LYS 132 1HE LYS 132 -5.527 15.448 -0.404 961 HZ1 LYS 132 3HZ LYS 132 -5.812 18.253 0.570 962 HZ2 LYS 132 1HZ LYS 132 -6.873 17.456 -0.453 963 HZ3 LYS 132 2HZ LYS 132 -5.325 17.804 -0.966 964 H PHE 133 H PHE 133 -4.555 9.892 0.676 965 HA PHE 133 HA PHE 133 -6.487 9.331 -1.438 966 HB2 PHE 133 2HB PHE 133 -3.528 8.752 -1.286 967 HB3 PHE 133 1HB PHE 133 -4.591 8.324 -2.636 968 HD1 PHE 133 2HD PHE 133 -6.034 10.363 -3.545 969 HD2 PHE 133 1HD PHE 133 -2.350 10.720 -1.448 970 HE1 PHE 133 2HE PHE 133 -5.724 12.611 -4.486 971 HE2 PHE 133 1HE PHE 133 -2.041 12.974 -2.379 972 HZ PHE 133 HZ PHE 133 -3.721 13.921 -3.901 973 H ARG 134 H ARG 134 -6.108 6.818 -2.138 974 HA ARG 134 HA ARG 134 -6.787 5.475 0.380 975 HB2 ARG 134 2HB ARG 134 -8.727 6.577 -0.717 976 HB3 ARG 134 1HB ARG 134 -8.510 5.482 -2.069 977 HG2 ARG 134 2HG ARG 134 -8.922 3.594 -0.586 978 HG3 ARG 134 1HG ARG 134 -9.124 4.716 0.752 979 HD2 ARG 134 2HD ARG 134 -10.987 5.778 -0.322 980 HD3 ARG 134 1HD ARG 134 -10.789 4.766 -1.752 981 HE ARG 134 HE ARG 134 -11.109 2.912 -0.036 982 HH11 ARG 134 1HH1 ARG 134 -12.837 6.025 -0.075 983 HH12 ARG 134 2HH1 ARG 134 -14.249 5.423 0.640 984 HH21 ARG 134 1HH2 ARG 134 -13.152 2.074 0.964 985 HH22 ARG 134 2HH2 ARG 134 -14.428 3.158 1.205 986 H LEU 135 H LEU 135 -5.963 3.534 0.555 987 HA LEU 135 HA LEU 135 -5.170 1.978 -1.800 988 HB2 LEU 135 2HB LEU 135 -3.235 3.040 -0.759 989 HB3 LEU 135 1HB LEU 135 -3.731 2.499 0.815 990 HG LEU 135 HG LEU 135 -2.855 0.525 -1.315 991 HD11 LEU 135 1HD1 LEU 135 -0.622 0.650 -0.285 992 HD12 LEU 135 2HD1 LEU 135 -1.167 1.978 0.736 993 HD13 LEU 135 3HD1 LEU 135 -1.069 2.192 -1.009 994 HD21 LEU 135 3HD2 LEU 135 -4.011 -0.334 0.715 995 HD22 LEU 135 1HD2 LEU 135 -2.784 0.446 1.709 996 HD23 LEU 135 2HD2 LEU 135 -2.334 -0.871 0.629 997 H VAL 136 H VAL 136 -5.724 -0.205 -1.685 998 HA VAL 136 HA VAL 136 -7.155 -1.119 0.748 999 HB VAL 136 HB VAL 136 -7.241 -2.509 -1.932 1000 HG11 VAL 136 1HG1 VAL 136 -9.357 -3.427 -1.111 1001 HG12 VAL 136 2HG1 VAL 136 -9.149 -2.531 0.397 1002 HG13 VAL 136 3HG1 VAL 136 -8.003 -3.798 -0.041 1003 HG21 VAL 136 3HG2 VAL 136 -9.372 -1.397 -2.433 1004 HG22 VAL 136 1HG2 VAL 136 -8.018 -0.269 -2.381 1005 HG23 VAL 136 2HG2 VAL 136 -9.138 -0.363 -1.021 1006 H PHE 137 H PHE 137 -6.299 -2.932 1.773 1007 HA PHE 137 HA PHE 137 -3.929 -4.086 0.461 1008 HB2 PHE 137 2HB PHE 137 -3.219 -2.883 2.418 1009 HB3 PHE 137 1HB PHE 137 -4.441 -3.670 3.412 1010 HD1 PHE 137 1HD PHE 137 -1.500 -4.475 1.266 1011 HD2 PHE 137 2HD PHE 137 -3.842 -5.518 4.660 1012 HE1 PHE 137 1HE PHE 137 0.116 -6.232 1.841 1013 HE2 PHE 137 2HE PHE 137 -2.231 -7.276 5.241 1014 HZ PHE 137 HZ PHE 137 -0.250 -7.637 3.834 1015 H LEU 138 H LEU 138 -3.982 -6.194 -0.015 1016 HA LEU 138 HA LEU 138 -5.811 -7.881 1.528 1017 HB2 LEU 138 2HB LEU 138 -5.467 -8.083 -1.473 1018 HB3 LEU 138 1HB LEU 138 -6.439 -9.128 -0.476 1019 HG LEU 138 HG LEU 138 -7.801 -6.961 0.024 1020 HD11 LEU 138 1HD1 LEU 138 -6.445 -6.182 -2.549 1021 HD12 LEU 138 2HD1 LEU 138 -6.268 -5.382 -0.988 1022 HD13 LEU 138 3HD1 LEU 138 -7.826 -5.363 -1.818 1023 HD21 LEU 138 3HD2 LEU 138 -7.886 -8.330 -2.660 1024 HD22 LEU 138 1HD2 LEU 138 -9.189 -7.379 -1.947 1025 HD23 LEU 138 2HD2 LEU 138 -8.671 -8.877 -1.176 1026 H ALA 139 H ALA 139 -4.877 -9.698 2.186 1027 HA ALA 139 HA ALA 139 -2.301 -10.475 1.069 1028 HB1 ALA 139 1HB ALA 139 -2.486 -10.494 3.527 1029 HB2 ALA 139 2HB ALA 139 -2.315 -12.143 2.924 1030 HB3 ALA 139 3HB ALA 139 -3.898 -11.546 3.420 1031 H GLY 140 H GLY 140 -2.156 -12.472 -0.054 1032 HA2 GLY 140 2HA GLY 140 -4.290 -14.237 -0.325 1033 HA3 GLY 140 1HA GLY 140 -4.495 -12.986 -1.531 1034 HA PRO 141 HA PRO 141 -1.538 -14.754 -4.292 1035 HB2 PRO 141 2HB PRO 141 0.745 -13.138 -3.625 1036 HB3 PRO 141 1HB PRO 141 -0.042 -13.351 -5.186 1037 HG2 PRO 141 2HG PRO 141 -0.316 -11.026 -3.797 1038 HG3 PRO 141 1HG PRO 141 -1.612 -11.681 -4.812 1039 HD2 PRO 141 2HD PRO 141 -1.341 -11.674 -1.855 1040 HD3 PRO 141 1HD PRO 141 -2.805 -11.622 -2.853 1041 H ALA 142 H ALA 142 -0.982 -16.550 -3.688 1042 HA ALA 142 HA ALA 142 1.197 -16.988 -1.761 1043 HB1 ALA 142 1HB ALA 142 -1.003 -18.901 -2.575 1044 HB2 ALA 142 2HB ALA 142 -0.897 -18.053 -1.034 1045 HB3 ALA 142 3HB ALA 142 0.305 -19.275 -1.455 1046 H GLU 143 H GLU 143 2.964 -17.161 -2.870 1047 HA GLU 143 HA GLU 143 2.879 -17.760 -5.624 1048 HB2 GLU 143 2HB GLU 143 5.110 -17.014 -3.762 1049 HB3 GLU 143 1HB GLU 143 5.215 -17.106 -5.514 1050 HG2 GLU 143 2HG GLU 143 3.487 -15.365 -5.703 1051 HG3 GLU 143 1HG GLU 143 3.439 -15.249 -3.949 Start of MODEL 19 1 H1 MET 1 1HT MET 1 -3.469 51.379 62.127 2 H2 MET 1 2HT MET 1 -1.980 51.155 61.385 3 H3 MET 1 3HT MET 1 -2.665 49.887 62.277 4 HA MET 1 HA MET 1 -2.823 49.531 59.929 5 HB2 MET 1 2HB MET 1 -5.477 50.149 61.253 6 HB3 MET 1 1HB MET 1 -5.318 49.312 59.723 7 HG2 MET 1 2HG MET 1 -5.733 47.697 61.418 8 HG3 MET 1 1HG MET 1 -4.061 47.524 60.906 9 HE1 MET 1 2HE MET 1 -4.054 46.536 64.718 10 HE2 MET 1 3HE MET 1 -3.693 45.997 63.078 11 HE3 MET 1 1HE MET 1 -5.363 46.274 63.566 12 H SER 2 H SER 2 -2.039 50.993 58.524 13 HA SER 2 HA SER 2 -3.362 53.497 58.060 14 HB2 SER 2 2HB SER 2 -1.260 52.054 56.428 15 HB3 SER 2 1HB SER 2 -1.673 53.767 56.330 16 HG SER 2 HG SER 2 -1.094 52.924 58.860 17 H ASP 3 H ASP 3 -3.251 50.310 56.782 18 HA ASP 3 HA ASP 3 -5.339 50.924 54.827 19 HB2 ASP 3 2HB ASP 3 -3.381 49.918 53.807 20 HB3 ASP 3 1HB ASP 3 -3.355 48.644 55.020 21 H ASN 4 H ASN 4 -7.232 49.742 54.946 22 HA ASN 4 HA ASN 4 -7.914 48.746 57.528 23 HB2 ASN 4 2HB ASN 4 -9.459 48.794 54.917 24 HB3 ASN 4 1HB ASN 4 -10.108 48.061 56.375 25 HD21 ASN 4 1HD2 ASN 4 -9.287 51.065 54.792 26 HD22 ASN 4 2HD2 ASN 4 -10.038 52.103 55.939 27 H ASN 5 H ASN 5 -7.178 46.979 58.255 28 HA ASN 5 HA ASN 5 -6.033 44.886 56.721 29 HB2 ASN 5 2HB ASN 5 -5.247 45.484 58.977 30 HB3 ASN 5 1HB ASN 5 -6.793 45.001 59.650 31 HD21 ASN 5 1HD2 ASN 5 -5.937 43.466 60.991 32 HD22 ASN 5 2HD2 ASN 5 -5.235 41.996 60.440 33 H GLY 6 H GLY 6 -7.239 43.520 55.555 34 HA2 GLY 6 2HA GLY 6 -9.901 42.797 56.483 35 HA3 GLY 6 1HA GLY 6 -9.235 42.467 54.888 36 H THR 7 H THR 7 -9.849 41.232 57.953 37 HA THR 7 HA THR 7 -7.980 39.026 57.579 38 HB THR 7 HB THR 7 -9.674 39.764 59.985 39 HG1 THR 7 1HG THR 7 -7.947 40.827 60.717 40 HG21 THR 7 3HG2 THR 7 -9.059 37.387 59.926 41 HG22 THR 7 1HG2 THR 7 -8.185 38.228 61.206 42 HG23 THR 7 2HG2 THR 7 -7.368 37.825 59.696 43 HA PRO 8 HA PRO 8 -11.590 36.646 56.229 44 HB2 PRO 8 2HB PRO 8 -10.328 34.212 56.171 45 HB3 PRO 8 1HB PRO 8 -10.235 35.380 54.849 46 HG2 PRO 8 2HG PRO 8 -8.258 34.803 57.004 47 HG3 PRO 8 1HG PRO 8 -7.979 35.174 55.296 48 HD2 PRO 8 2HD PRO 8 -7.649 36.998 57.277 49 HD3 PRO 8 1HD PRO 8 -8.151 37.451 55.634 50 H GLU 9 H GLU 9 -13.005 35.316 57.301 51 HA GLU 9 HA GLU 9 -12.779 35.422 60.127 52 HB2 GLU 9 2HB GLU 9 -14.838 34.070 58.387 53 HB3 GLU 9 1HB GLU 9 -14.999 34.357 60.114 54 HG2 GLU 9 2HG GLU 9 -14.892 36.774 59.720 55 HG3 GLU 9 1HG GLU 9 -14.746 36.478 57.990 56 HA PRO 10 HA PRO 10 -10.603 31.808 60.878 57 HB2 PRO 10 2HB PRO 10 -11.660 31.051 63.318 58 HB3 PRO 10 1HB PRO 10 -10.399 32.256 63.083 59 HG2 PRO 10 2HG PRO 10 -13.312 32.638 63.510 60 HG3 PRO 10 1HG PRO 10 -11.943 33.607 64.083 61 HD2 PRO 10 2HD PRO 10 -13.497 34.370 62.001 62 HD3 PRO 10 1HD PRO 10 -11.774 34.777 62.114 63 H GLN 11 H GLN 11 -10.676 29.832 60.343 64 HA GLN 11 HA GLN 11 -11.253 27.833 59.666 65 HB2 GLN 11 2HB GLN 11 -12.479 27.510 61.825 66 HB3 GLN 11 1HB GLN 11 -13.929 28.150 61.059 67 HG2 GLN 11 2HG GLN 11 -13.996 25.730 61.100 68 HG3 GLN 11 1HG GLN 11 -13.883 26.316 59.440 69 HE21 GLN 11 1HE2 GLN 11 -12.954 24.520 58.606 70 HE22 GLN 11 2HE2 GLN 11 -11.350 24.008 58.960 71 H VAL 12 H VAL 12 -11.083 28.641 57.673 72 HA VAL 12 HA VAL 12 -13.588 29.191 56.288 73 HB VAL 12 HB VAL 12 -11.857 30.943 56.070 74 HG11 VAL 12 1HG1 VAL 12 -9.851 29.655 56.335 75 HG12 VAL 12 2HG1 VAL 12 -9.789 30.564 54.828 76 HG13 VAL 12 3HG1 VAL 12 -10.137 28.831 54.801 77 HG21 VAL 12 3HG2 VAL 12 -12.350 29.456 53.490 78 HG22 VAL 12 1HG2 VAL 12 -11.809 31.132 53.614 79 HG23 VAL 12 2HG2 VAL 12 -13.399 30.673 54.219 80 H GLU 13 H GLU 13 -14.285 27.860 54.661 81 HA GLU 13 HA GLU 13 -12.865 25.371 54.443 82 HB2 GLU 13 2HB GLU 13 -14.873 24.569 53.253 83 HB3 GLU 13 1HB GLU 13 -15.240 25.158 54.864 84 HG2 GLU 13 2HG GLU 13 -15.659 26.827 52.389 85 HG3 GLU 13 1HG GLU 13 -16.874 25.711 52.987 86 H THR 14 H THR 14 -11.761 24.786 52.718 87 HA THR 14 HA THR 14 -11.490 26.667 50.579 88 HB THR 14 HB THR 14 -9.460 25.545 51.388 89 HG1 THR 14 1HG THR 14 -8.786 25.659 49.432 90 HG21 THR 14 3HG2 THR 14 -10.450 23.405 52.105 91 HG22 THR 14 1HG2 THR 14 -9.090 23.135 51.015 92 HG23 THR 14 2HG2 THR 14 -10.741 22.976 50.421 93 H THR 15 H THR 15 -11.981 26.232 48.433 94 HA THR 15 HA THR 15 -14.213 24.478 48.148 95 HB THR 15 HB THR 15 -14.600 26.611 47.176 96 HG1 THR 15 1HG THR 15 -15.474 25.799 45.516 97 HG21 THR 15 3HG2 THR 15 -12.052 26.263 45.586 98 HG22 THR 15 1HG2 THR 15 -12.306 27.412 46.898 99 HG23 THR 15 2HG2 THR 15 -13.194 27.595 45.388 100 H SER 16 H SER 16 -13.871 22.525 47.717 101 HA SER 16 HA SER 16 -12.050 21.833 45.565 102 HB2 SER 16 2HB SER 16 -12.164 20.339 48.206 103 HB3 SER 16 1HB SER 16 -11.184 19.896 46.803 104 HG SER 16 HG SER 16 -10.739 22.420 47.313 105 H VAL 17 H VAL 17 -13.803 21.666 44.266 106 HA VAL 17 HA VAL 17 -15.445 19.310 44.576 107 HB VAL 17 HB VAL 17 -16.700 21.197 45.651 108 HG11 VAL 17 1HG1 VAL 17 -16.577 22.516 42.955 109 HG12 VAL 17 2HG1 VAL 17 -15.816 23.074 44.444 110 HG13 VAL 17 3HG1 VAL 17 -17.574 23.052 44.310 111 HG21 VAL 17 3HG2 VAL 17 -17.973 19.411 44.598 112 HG22 VAL 17 1HG2 VAL 17 -17.911 20.261 43.057 113 HG23 VAL 17 2HG2 VAL 17 -18.808 20.955 44.409 114 H PHE 18 H PHE 18 -16.417 18.798 42.417 115 HA PHE 18 HA PHE 18 -14.563 19.493 40.400 116 HB2 PHE 18 2HB PHE 18 -16.988 17.723 40.378 117 HB3 PHE 18 1HB PHE 18 -16.102 18.110 38.897 118 HD1 PHE 18 1HD PHE 18 -13.868 17.340 38.541 119 HD2 PHE 18 2HD PHE 18 -15.992 16.334 42.078 120 HE1 PHE 18 1HE PHE 18 -12.202 15.619 39.041 121 HE2 PHE 18 2HE PHE 18 -14.322 14.600 42.585 122 HZ PHE 18 HZ PHE 18 -12.420 14.246 41.063 123 H ARG 19 H ARG 19 -14.717 20.657 38.712 124 HA ARG 19 HA ARG 19 -16.836 22.706 38.672 125 HB2 ARG 19 2HB ARG 19 -13.910 22.799 37.903 126 HB3 ARG 19 1HB ARG 19 -15.019 24.159 37.921 127 HG2 ARG 19 2HG ARG 19 -14.768 24.491 40.113 128 HG3 ARG 19 1HG ARG 19 -14.818 22.762 40.472 129 HD2 ARG 19 2HD ARG 19 -12.451 24.244 39.343 130 HD3 ARG 19 1HD ARG 19 -12.645 23.780 41.031 131 HE ARG 19 HE ARG 19 -12.502 21.802 38.822 132 HH11 ARG 19 1HH1 ARG 19 -11.745 22.711 42.148 133 HH12 ARG 19 2HH1 ARG 19 -10.659 21.433 42.407 134 HH21 ARG 19 1HH2 ARG 19 -11.050 20.089 39.129 135 HH22 ARG 19 2HH2 ARG 19 -10.264 19.843 40.637 136 H ALA 20 H ALA 20 -15.867 23.731 36.171 137 HA ALA 20 HA ALA 20 -16.584 21.607 34.372 138 HB1 ALA 20 1HB ALA 20 -16.299 23.309 32.606 139 HB2 ALA 20 2HB ALA 20 -15.667 24.441 33.802 140 HB3 ALA 20 3HB ALA 20 -17.346 23.904 33.895 141 H ASP 21 H ASP 21 -14.858 20.348 35.237 142 HA ASP 21 HA ASP 21 -12.142 21.057 34.695 143 HB2 ASP 21 2HB ASP 21 -13.457 18.627 35.857 144 HB3 ASP 21 1HB ASP 21 -11.753 18.594 35.422 145 H LEU 22 H LEU 22 -14.591 19.338 33.155 146 HA LEU 22 HA LEU 22 -14.885 18.448 31.165 147 HB2 LEU 22 2HB LEU 22 -13.861 20.616 30.400 148 HB3 LEU 22 1HB LEU 22 -12.313 19.820 30.324 149 HG LEU 22 HG LEU 22 -13.501 20.206 28.107 150 HD11 LEU 22 1HD1 LEU 22 -12.806 17.349 28.731 151 HD12 LEU 22 2HD1 LEU 22 -11.678 18.609 28.231 152 HD13 LEU 22 3HD1 LEU 22 -12.931 18.058 27.121 153 HD21 LEU 22 3HD2 LEU 22 -15.260 17.978 29.099 154 HD22 LEU 22 1HD2 LEU 22 -15.260 18.646 27.469 155 HD23 LEU 22 2HD2 LEU 22 -15.754 19.651 28.834 156 H LEU 23 H LEU 23 -14.835 16.431 31.659 157 HA LEU 23 HA LEU 23 -12.367 14.969 31.137 158 HB2 LEU 23 2HB LEU 23 -13.156 14.670 33.428 159 HB3 LEU 23 1HB LEU 23 -14.753 14.254 32.859 160 HG LEU 23 HG LEU 23 -13.828 12.182 31.867 161 HD11 LEU 23 1HD1 LEU 23 -11.275 13.031 33.222 162 HD12 LEU 23 2HD1 LEU 23 -11.545 12.911 31.478 163 HD13 LEU 23 3HD1 LEU 23 -11.574 11.462 32.481 164 HD21 LEU 23 3HD2 LEU 23 -14.811 12.131 34.086 165 HD22 LEU 23 1HD2 LEU 23 -13.264 12.591 34.801 166 HD23 LEU 23 2HD2 LEU 23 -13.437 11.029 34.003 167 H LYS 24 H LYS 24 -12.600 14.820 28.987 168 HA LYS 24 HA LYS 24 -14.656 13.043 27.996 169 HB2 LYS 24 2HB LYS 24 -14.569 15.904 27.435 170 HB3 LYS 24 1HB LYS 24 -14.436 14.942 25.978 171 HG2 LYS 24 2HG LYS 24 -16.651 14.717 28.007 172 HG3 LYS 24 1HG LYS 24 -16.749 15.597 26.481 173 HD2 LYS 24 2HD LYS 24 -16.206 13.436 25.311 174 HD3 LYS 24 1HD LYS 24 -16.366 12.624 26.866 175 HE2 LYS 24 2HE LYS 24 -18.514 14.195 25.443 176 HE3 LYS 24 1HE LYS 24 -18.411 12.444 25.547 177 HZ1 LYS 24 3HZ LYS 24 -19.978 13.350 27.122 178 HZ2 LYS 24 1HZ LYS 24 -18.781 14.291 27.849 179 HZ3 LYS 24 2HZ LYS 24 -18.706 12.606 27.937 180 H GLU 25 H GLU 25 -13.173 11.530 27.502 181 HA GLU 25 HA GLU 25 -11.453 12.209 25.266 182 HB2 GLU 25 2HB GLU 25 -9.618 10.778 26.198 183 HB3 GLU 25 1HB GLU 25 -9.896 12.259 27.096 184 HG2 GLU 25 2HG GLU 25 -11.124 10.998 28.792 185 HG3 GLU 25 1HG GLU 25 -10.852 9.513 27.885 186 H MET 26 H MET 26 -10.685 10.242 24.151 187 HA MET 26 HA MET 26 -12.818 8.673 23.296 188 HB2 MET 26 2HB MET 26 -10.880 9.027 21.901 189 HB3 MET 26 1HB MET 26 -9.841 8.221 23.062 190 HG2 MET 26 2HG MET 26 -10.244 6.768 21.195 191 HG3 MET 26 1HG MET 26 -11.012 6.125 22.646 192 HE1 MET 26 3HE MET 26 -11.521 7.798 19.170 193 HE2 MET 26 1HE MET 26 -12.234 9.018 20.225 194 HE3 MET 26 2HE MET 26 -13.259 8.087 19.131 195 H GLU 27 H GLU 27 -13.797 6.972 24.135 196 HA GLU 27 HA GLU 27 -12.443 5.504 26.261 197 HB2 GLU 27 2HB GLU 27 -14.685 4.773 26.984 198 HB3 GLU 27 1HB GLU 27 -14.569 6.518 26.963 199 HG2 GLU 27 2HG GLU 27 -15.892 4.877 24.798 200 HG3 GLU 27 1HG GLU 27 -16.743 5.581 26.164 201 H SER 28 H SER 28 -13.974 3.191 26.176 202 HA SER 28 HA SER 28 -12.715 1.676 24.186 203 HB2 SER 28 2HB SER 28 -13.523 0.795 26.372 204 HB3 SER 28 1HB SER 28 -15.181 1.035 25.824 205 HG SER 28 HG SER 28 -15.005 -0.881 25.085 206 H SER 29 H SER 29 -13.205 1.652 22.082 207 HA SER 29 HA SER 29 -15.731 2.685 21.149 208 HB2 SER 29 2HB SER 29 -13.355 1.575 19.634 209 HB3 SER 29 1HB SER 29 -14.720 2.440 18.922 210 HG SER 29 HG SER 29 -13.885 3.924 20.869 211 H THR 30 H THR 30 -17.219 1.465 19.904 212 HA THR 30 HA THR 30 -17.770 -1.097 20.813 213 HB THR 30 HB THR 30 -18.673 0.140 18.194 214 HG1 THR 30 1HG THR 30 -19.130 0.824 20.833 215 HG21 THR 30 3HG2 THR 30 -20.718 -1.178 18.590 216 HG22 THR 30 1HG2 THR 30 -20.022 -1.820 20.075 217 HG23 THR 30 2HG2 THR 30 -19.307 -2.235 18.521 218 H GLY 31 H GLY 31 -16.934 -3.031 20.299 219 HA2 GLY 31 2HA GLY 31 -14.738 -3.265 18.543 220 HA3 GLY 31 1HA GLY 31 -15.557 -4.584 19.365 221 H THR 32 H THR 32 -14.807 -3.353 16.449 222 HA THR 32 HA THR 32 -17.224 -3.995 15.054 223 HB THR 32 HB THR 32 -14.517 -3.593 13.813 224 HG1 THR 32 1HG THR 32 -16.245 -1.549 14.891 225 HG21 THR 32 3HG2 THR 32 -15.868 -2.496 12.064 226 HG22 THR 32 1HG2 THR 32 -17.322 -2.774 13.023 227 HG23 THR 32 2HG2 THR 32 -16.424 -4.142 12.362 228 H ALA 33 H ALA 33 -17.644 -5.950 14.162 229 HA ALA 33 HA ALA 33 -16.022 -8.215 14.574 230 HB1 ALA 33 1HB ALA 33 -18.442 -8.424 14.282 231 HB2 ALA 33 2HB ALA 33 -17.607 -9.338 13.025 232 HB3 ALA 33 3HB ALA 33 -18.317 -7.771 12.649 233 HA PRO 34 HA PRO 34 -13.118 -7.283 11.320 234 HB2 PRO 34 2HB PRO 34 -12.505 -10.179 11.375 235 HB3 PRO 34 1HB PRO 34 -11.443 -8.801 11.668 236 HG2 PRO 34 2HG PRO 34 -12.246 -10.382 13.664 237 HG3 PRO 34 1HG PRO 34 -12.019 -8.640 13.884 238 HD2 PRO 34 2HD PRO 34 -14.550 -10.190 13.542 239 HD3 PRO 34 1HD PRO 34 -14.186 -8.805 14.597 240 H ALA 35 H ALA 35 -13.176 -7.347 9.126 241 HA ALA 35 HA ALA 35 -15.304 -8.906 7.928 242 HB1 ALA 35 1HB ALA 35 -15.138 -6.503 7.403 243 HB2 ALA 35 2HB ALA 35 -14.949 -7.492 5.957 244 HB3 ALA 35 3HB ALA 35 -13.537 -6.771 6.720 245 H SER 36 H SER 36 -13.814 -10.808 8.553 246 HA SER 36 HA SER 36 -12.425 -12.496 8.026 247 HB2 SER 36 2HB SER 36 -13.034 -11.662 5.175 248 HB3 SER 36 1HB SER 36 -12.396 -13.231 5.677 249 HG SER 36 HG SER 36 -14.694 -12.332 6.925 250 H THR 37 H THR 37 -10.688 -11.346 8.997 251 HA THR 37 HA THR 37 -8.675 -10.627 7.075 252 HB THR 37 HB THR 37 -9.941 -8.567 7.519 253 HG1 THR 37 1HG THR 37 -8.073 -8.017 7.077 254 HG21 THR 37 3HG2 THR 37 -9.857 -7.497 9.736 255 HG22 THR 37 1HG2 THR 37 -9.089 -8.947 10.392 256 HG23 THR 37 2HG2 THR 37 -10.734 -9.027 9.759 257 H GLY 38 H GLY 38 -6.568 -10.440 8.112 258 HA2 GLY 38 2HA GLY 38 -5.442 -10.708 10.360 259 HA3 GLY 38 1HA GLY 38 -6.432 -12.159 10.494 260 H ALA 39 H ALA 39 -3.452 -11.450 10.120 261 HA ALA 39 HA ALA 39 -2.730 -12.626 7.596 262 HB1 ALA 39 1HB ALA 39 -0.999 -11.981 9.982 263 HB2 ALA 39 2HB ALA 39 -1.352 -10.886 8.650 264 HB3 ALA 39 3HB ALA 39 -0.423 -12.358 8.359 265 H GLU 40 H GLU 40 -3.299 -13.699 10.752 266 HA GLU 40 HA GLU 40 -1.855 -16.172 10.467 267 HB2 GLU 40 2HB GLU 40 -2.528 -16.644 12.757 268 HB3 GLU 40 1HB GLU 40 -1.921 -15.011 12.650 269 HG2 GLU 40 2HG GLU 40 -4.787 -15.896 12.988 270 HG3 GLU 40 1HG GLU 40 -3.786 -15.009 14.134 271 H ASN 41 H ASN 41 -5.191 -15.105 10.426 272 HA ASN 41 HA ASN 41 -6.191 -17.790 10.176 273 HB2 ASN 41 2HB ASN 41 -7.460 -16.034 11.353 274 HB3 ASN 41 1HB ASN 41 -7.644 -15.165 9.834 275 HD21 ASN 41 1HD2 ASN 41 -9.888 -15.301 9.849 276 HD22 ASN 41 2HD2 ASN 41 -10.726 -16.781 9.614 277 H LEU 42 H LEU 42 -5.565 -15.081 7.956 278 HA LEU 42 HA LEU 42 -6.886 -16.527 5.893 279 HB2 LEU 42 2HB LEU 42 -5.700 -13.798 6.051 280 HB3 LEU 42 1HB LEU 42 -5.962 -14.516 4.475 281 HG LEU 42 HG LEU 42 -8.378 -14.747 5.020 282 HD11 LEU 42 1HD1 LEU 42 -8.275 -14.873 7.429 283 HD12 LEU 42 2HD1 LEU 42 -9.334 -13.563 6.918 284 HD13 LEU 42 3HD1 LEU 42 -7.713 -13.205 7.511 285 HD21 LEU 42 3HD2 LEU 42 -8.932 -12.358 4.865 286 HD22 LEU 42 1HD2 LEU 42 -7.635 -12.832 3.766 287 HD23 LEU 42 2HD2 LEU 42 -7.256 -11.969 5.254 288 HA PRO 43 HA PRO 43 -3.376 -18.661 4.346 289 HB2 PRO 43 2HB PRO 43 -4.494 -18.837 1.695 290 HB3 PRO 43 1HB PRO 43 -4.503 -20.057 2.967 291 HG2 PRO 43 2HG PRO 43 -6.749 -18.789 2.055 292 HG3 PRO 43 1HG PRO 43 -6.586 -19.474 3.684 293 HD2 PRO 43 2HD PRO 43 -6.300 -16.647 2.771 294 HD3 PRO 43 1HD PRO 43 -7.121 -17.295 4.205 295 H ALA 44 H ALA 44 -2.974 -15.832 4.167 296 HA ALA 44 HA ALA 44 -1.539 -15.661 1.611 297 HB1 ALA 44 1HB ALA 44 -3.350 -14.041 1.732 298 HB2 ALA 44 2HB ALA 44 -1.779 -13.233 1.741 299 HB3 ALA 44 3HB ALA 44 -2.693 -13.404 3.241 300 H GLY 45 H GLY 45 0.519 -16.082 2.002 301 HA2 GLY 45 2HA GLY 45 1.825 -15.259 4.459 302 HA3 GLY 45 1HA GLY 45 2.592 -16.059 3.083 303 H SER 46 H SER 46 1.338 -14.155 1.262 304 HA SER 46 HA SER 46 2.714 -11.662 1.844 305 HB2 SER 46 2HB SER 46 2.549 -12.895 -0.911 306 HB3 SER 46 1HB SER 46 3.568 -11.569 -0.378 307 HG SER 46 HG SER 46 5.056 -13.068 -0.151 308 H ALA 47 H ALA 47 1.518 -9.914 0.786 309 HA ALA 47 HA ALA 47 -1.056 -10.625 -0.338 310 HB1 ALA 47 1HB ALA 47 -2.280 -9.141 1.192 311 HB2 ALA 47 2HB ALA 47 -0.791 -8.835 2.084 312 HB3 ALA 47 3HB ALA 47 -1.497 -10.452 2.079 313 H LEU 48 H LEU 48 -2.152 -8.501 -1.112 314 HA LEU 48 HA LEU 48 0.024 -6.826 -2.034 315 HB2 LEU 48 2HB LEU 48 -0.930 -6.639 -4.278 316 HB3 LEU 48 1HB LEU 48 -0.508 -8.276 -3.899 317 HG LEU 48 HG LEU 48 -2.448 -8.305 -5.239 318 HD11 LEU 48 1HD1 LEU 48 -3.372 -8.865 -2.465 319 HD12 LEU 48 2HD1 LEU 48 -2.429 -9.924 -3.505 320 HD13 LEU 48 3HD1 LEU 48 -4.079 -9.479 -3.969 321 HD21 LEU 48 3HD2 LEU 48 -3.264 -6.056 -4.960 322 HD22 LEU 48 1HD2 LEU 48 -3.781 -6.417 -3.312 323 HD23 LEU 48 2HD2 LEU 48 -4.569 -7.210 -4.677 324 H LEU 49 H LEU 49 -0.407 -4.739 -2.542 325 HA LEU 49 HA LEU 49 -2.860 -3.781 -1.327 326 HB2 LEU 49 2HB LEU 49 -1.639 -1.610 -0.976 327 HB3 LEU 49 1HB LEU 49 -1.081 -2.937 -0.005 328 HG LEU 49 HG LEU 49 0.849 -3.187 -1.638 329 HD11 LEU 49 1HD1 LEU 49 -0.020 -0.449 -2.554 330 HD12 LEU 49 2HD1 LEU 49 -0.052 -1.927 -3.512 331 HD13 LEU 49 3HD1 LEU 49 1.485 -1.265 -2.972 332 HD21 LEU 49 3HD2 LEU 49 0.642 -0.617 -0.089 333 HD22 LEU 49 1HD2 LEU 49 2.134 -1.393 -0.608 334 HD23 LEU 49 2HD2 LEU 49 1.089 -2.184 0.573 335 H VAL 50 H VAL 50 -4.134 -2.435 -2.414 336 HA VAL 50 HA VAL 50 -3.327 -1.905 -5.176 337 HB VAL 50 HB VAL 50 -5.692 -1.845 -5.843 338 HG11 VAL 50 1HG1 VAL 50 -5.071 -4.367 -4.342 339 HG12 VAL 50 2HG1 VAL 50 -4.646 -4.002 -6.013 340 HG13 VAL 50 3HG1 VAL 50 -6.337 -4.187 -5.552 341 HG21 VAL 50 3HG2 VAL 50 -6.704 -1.046 -3.767 342 HG22 VAL 50 1HG2 VAL 50 -6.361 -2.598 -3.003 343 HG23 VAL 50 2HG2 VAL 50 -7.511 -2.512 -4.336 344 H VAL 51 H VAL 51 -3.211 0.169 -5.761 345 HA VAL 51 HA VAL 51 -4.051 2.144 -3.762 346 HB VAL 51 HB VAL 51 -2.665 2.695 -6.446 347 HG11 VAL 51 1HG1 VAL 51 -2.890 4.356 -3.962 348 HG12 VAL 51 2HG1 VAL 51 -3.780 4.591 -5.465 349 HG13 VAL 51 3HG1 VAL 51 -2.026 4.784 -5.439 350 HG21 VAL 51 3HG2 VAL 51 -1.240 1.208 -5.130 351 HG22 VAL 51 1HG2 VAL 51 -1.367 2.300 -3.750 352 HG23 VAL 51 2HG2 VAL 51 -0.562 2.834 -5.224 353 H LYS 52 H LYS 52 -6.027 2.804 -3.874 354 HA LYS 52 HA LYS 52 -7.521 2.105 -6.243 355 HB2 LYS 52 2HB LYS 52 -8.307 1.722 -3.823 356 HB3 LYS 52 1HB LYS 52 -8.623 3.453 -3.780 357 HG2 LYS 52 2HG LYS 52 -10.175 3.241 -5.624 358 HG3 LYS 52 1HG LYS 52 -9.843 1.511 -5.726 359 HD2 LYS 52 2HD LYS 52 -10.695 1.266 -3.416 360 HD3 LYS 52 1HD LYS 52 -11.110 2.982 -3.419 361 HE2 LYS 52 2HE LYS 52 -13.088 1.708 -3.952 362 HE3 LYS 52 1HE LYS 52 -12.553 2.586 -5.383 363 HZ1 LYS 52 3HZ LYS 52 -12.112 -0.304 -4.843 364 HZ2 LYS 52 1HZ LYS 52 -11.524 0.513 -6.197 365 HZ3 LYS 52 2HZ LYS 52 -13.178 0.348 -5.963 366 H ARG 53 H ARG 53 -6.349 4.851 -4.524 367 HA ARG 53 HA ARG 53 -6.212 6.399 -6.860 368 HB2 ARG 53 2HB ARG 53 -8.675 6.676 -6.277 369 HB3 ARG 53 1HB ARG 53 -8.152 7.462 -4.792 370 HG2 ARG 53 2HG ARG 53 -8.578 9.243 -6.209 371 HG3 ARG 53 1HG ARG 53 -6.835 9.037 -6.339 372 HD2 ARG 53 2HD ARG 53 -8.945 8.144 -8.311 373 HD3 ARG 53 1HD ARG 53 -7.743 9.396 -8.545 374 HE ARG 53 HE ARG 53 -7.192 6.500 -8.426 375 HH11 ARG 53 1HH1 ARG 53 -6.255 9.713 -9.553 376 HH12 ARG 53 2HH1 ARG 53 -5.134 9.132 -10.687 377 HH21 ARG 53 1HH2 ARG 53 -5.629 5.740 -9.911 378 HH22 ARG 53 2HH2 ARG 53 -4.730 6.810 -10.895 379 H GLY 54 H GLY 54 -4.232 7.078 -6.459 380 HA2 GLY 54 2HA GLY 54 -3.740 8.807 -4.265 381 HA3 GLY 54 1HA GLY 54 -2.988 7.232 -4.050 382 HA PRO 55 HA PRO 55 -1.070 10.169 -7.643 383 HB2 PRO 55 2HB PRO 55 -0.043 11.739 -5.345 384 HB3 PRO 55 1HB PRO 55 -0.420 12.274 -6.982 385 HG2 PRO 55 2HG PRO 55 -2.103 12.784 -5.022 386 HG3 PRO 55 1HG PRO 55 -2.709 12.252 -6.602 387 HD2 PRO 55 2HD PRO 55 -2.494 10.745 -4.041 388 HD3 PRO 55 1HD PRO 55 -3.726 10.642 -5.315 389 H ASN 56 H ASN 56 -0.012 8.588 -4.792 390 HA ASN 56 HA ASN 56 2.805 8.832 -5.255 391 HB2 ASN 56 2HB ASN 56 3.070 7.007 -3.536 392 HB3 ASN 56 1HB ASN 56 2.161 8.404 -2.996 393 HD21 ASN 56 1HD2 ASN 56 1.317 7.123 -1.291 394 HD22 ASN 56 2HD2 ASN 56 0.058 5.983 -1.593 395 H ALA 57 H ALA 57 0.311 6.598 -6.376 396 HA ALA 57 HA ALA 57 2.070 5.484 -8.319 397 HB1 ALA 57 1HB ALA 57 2.706 4.124 -6.373 398 HB2 ALA 57 2HB ALA 57 1.816 3.136 -7.528 399 HB3 ALA 57 3HB ALA 57 1.014 3.732 -6.073 400 H GLY 58 H GLY 58 0.287 3.112 -8.537 401 HA2 GLY 58 2HA GLY 58 -2.400 3.650 -8.449 402 HA3 GLY 58 1HA GLY 58 -1.841 4.267 -10.004 403 H ALA 59 H ALA 59 -1.160 1.430 -8.013 404 HA ALA 59 HA ALA 59 -1.981 -0.332 -10.118 405 HB1 ALA 59 1HB ALA 59 0.278 0.234 -10.847 406 HB2 ALA 59 2HB ALA 59 0.249 -1.419 -10.226 407 HB3 ALA 59 3HB ALA 59 0.897 -0.119 -9.236 408 H ARG 60 H ARG 60 -0.934 -2.598 -9.205 409 HA ARG 60 HA ARG 60 -1.291 -2.620 -6.324 410 HB2 ARG 60 2HB ARG 60 -2.557 -4.695 -6.451 411 HB3 ARG 60 1HB ARG 60 -3.361 -3.444 -7.391 412 HG2 ARG 60 2HG ARG 60 -2.524 -4.394 -9.440 413 HG3 ARG 60 1HG ARG 60 -1.628 -5.610 -8.537 414 HD2 ARG 60 2HD ARG 60 -3.726 -6.515 -7.684 415 HD3 ARG 60 1HD ARG 60 -4.622 -5.281 -8.579 416 HE ARG 60 HE ARG 60 -2.836 -6.905 -10.139 417 HH11 ARG 60 1HH1 ARG 60 -6.140 -6.680 -8.890 418 HH12 ARG 60 2HH1 ARG 60 -6.834 -7.504 -10.200 419 HH21 ARG 60 1HH2 ARG 60 -3.749 -8.070 -11.866 420 HH22 ARG 60 2HH2 ARG 60 -5.442 -8.339 -11.936 421 H PHE 61 H PHE 61 0.208 -3.820 -5.314 422 HA PHE 61 HA PHE 61 1.669 -5.714 -6.866 423 HB2 PHE 61 2HB PHE 61 3.922 -4.854 -6.171 424 HB3 PHE 61 1HB PHE 61 3.069 -3.849 -7.323 425 HD1 PHE 61 1HD PHE 61 4.317 -4.110 -3.892 426 HD2 PHE 61 2HD PHE 61 2.384 -1.608 -6.744 427 HE1 PHE 61 1HE PHE 61 4.772 -2.153 -2.479 428 HE2 PHE 61 2HE PHE 61 2.832 0.353 -5.327 429 HZ PHE 61 HZ PHE 61 4.032 0.085 -3.196 430 H LEU 62 H LEU 62 2.602 -7.299 -5.821 431 HA LEU 62 HA LEU 62 1.455 -7.960 -3.297 432 HB2 LEU 62 2HB LEU 62 1.848 -9.541 -5.180 433 HB3 LEU 62 1HB LEU 62 3.568 -9.349 -4.945 434 HG LEU 62 HG LEU 62 3.216 -10.265 -2.612 435 HD11 LEU 62 1HD1 LEU 62 1.226 -11.641 -2.286 436 HD12 LEU 62 2HD1 LEU 62 0.559 -11.025 -3.799 437 HD13 LEU 62 3HD1 LEU 62 0.830 -9.929 -2.443 438 HD21 LEU 62 3HD2 LEU 62 3.201 -12.571 -3.399 439 HD22 LEU 62 1HD2 LEU 62 4.214 -11.551 -4.417 440 HD23 LEU 62 2HD2 LEU 62 2.610 -12.037 -4.974 441 H LEU 63 H LEU 63 2.375 -7.653 -1.353 442 HA LEU 63 HA LEU 63 5.066 -6.617 -1.237 443 HB2 LEU 63 2HB LEU 63 3.068 -7.161 0.958 444 HB3 LEU 63 1HB LEU 63 4.634 -6.420 1.188 445 HG LEU 63 HG LEU 63 2.296 -5.241 -0.313 446 HD11 LEU 63 1HD1 LEU 63 2.082 -5.219 2.117 447 HD12 LEU 63 2HD1 LEU 63 2.318 -3.590 1.483 448 HD13 LEU 63 3HD1 LEU 63 3.656 -4.441 2.250 449 HD21 LEU 63 3HD2 LEU 63 3.705 -3.232 -0.514 450 HD22 LEU 63 1HD2 LEU 63 4.376 -4.597 -1.400 451 HD23 LEU 63 2HD2 LEU 63 5.068 -4.132 0.152 452 H ASP 64 H ASP 64 6.610 -7.926 -1.252 453 HA ASP 64 HA ASP 64 6.716 -10.284 0.444 454 HB2 ASP 64 2HB ASP 64 5.845 -10.917 -1.927 455 HB3 ASP 64 1HB ASP 64 7.413 -10.397 -2.525 456 H GLN 65 H GLN 65 7.661 -7.749 0.619 457 HA GLN 65 HA GLN 65 10.510 -7.950 0.076 458 HB2 GLN 65 2HB GLN 65 9.643 -6.582 -1.684 459 HB3 GLN 65 1HB GLN 65 8.608 -5.709 -0.575 460 HG2 GLN 65 2HG GLN 65 10.492 -4.562 0.337 461 HG3 GLN 65 1HG GLN 65 11.604 -5.567 -0.603 462 HE21 GLN 65 1HE2 GLN 65 9.078 -3.151 -0.828 463 HE22 GLN 65 2HE2 GLN 65 9.521 -2.580 -2.401 464 HA PRO 66 HA PRO 66 10.626 -7.448 4.442 465 HB2 PRO 66 2HB PRO 66 13.005 -5.838 4.350 466 HB3 PRO 66 1HB PRO 66 12.845 -7.528 4.815 467 HG2 PRO 66 2HG PRO 66 13.782 -6.386 2.303 468 HG3 PRO 66 1HG PRO 66 13.923 -8.035 2.900 469 HD2 PRO 66 2HD PRO 66 12.302 -7.258 0.825 470 HD3 PRO 66 1HD PRO 66 12.055 -8.718 1.796 471 H THR 67 H THR 67 11.700 -4.446 2.790 472 HA THR 67 HA THR 67 9.664 -3.122 4.355 473 HB THR 67 HB THR 67 12.514 -2.129 4.276 474 HG1 THR 67 1HG THR 67 11.123 -3.807 5.860 475 HG21 THR 67 3HG2 THR 67 11.661 -0.454 5.904 476 HG22 THR 67 1HG2 THR 67 10.022 -1.024 5.619 477 HG23 THR 67 2HG2 THR 67 10.928 -0.262 4.313 478 H THR 68 H THR 68 8.384 -2.603 2.768 479 HA THR 68 HA THR 68 9.355 -1.320 0.380 480 HB THR 68 HB THR 68 6.555 -1.730 1.477 481 HG1 THR 68 1HG THR 68 7.013 -3.707 0.940 482 HG21 THR 68 3HG2 THR 68 5.789 -1.309 -0.814 483 HG22 THR 68 1HG2 THR 68 7.452 -1.027 -1.331 484 HG23 THR 68 2HG2 THR 68 6.674 0.087 -0.207 485 H THR 69 H THR 69 9.976 0.746 0.551 486 HA THR 69 HA THR 69 8.829 2.356 2.712 487 HB THR 69 HB THR 69 11.466 2.717 1.269 488 HG1 THR 69 1HG THR 69 11.181 0.776 2.627 489 HG21 THR 69 3HG2 THR 69 10.376 3.968 3.805 490 HG22 THR 69 1HG2 THR 69 10.587 4.788 2.261 491 HG23 THR 69 2HG2 THR 69 11.996 4.214 3.154 492 H ALA 70 H ALA 70 7.633 4.061 2.189 493 HA ALA 70 HA ALA 70 7.623 4.965 -0.590 494 HB1 ALA 70 1HB ALA 70 5.417 5.899 -0.073 495 HB2 ALA 70 2HB ALA 70 5.564 5.337 1.592 496 HB3 ALA 70 3HB ALA 70 5.465 4.170 0.272 497 H GLY 71 H GLY 71 8.663 6.791 -0.965 498 HA2 GLY 71 2HA GLY 71 8.380 9.206 0.151 499 HA3 GLY 71 1HA GLY 71 9.572 8.442 1.199 500 H ARG 72 H ARG 72 11.496 9.107 0.682 501 HA ARG 72 HA ARG 72 12.501 8.731 -1.972 502 HB2 ARG 72 2HB ARG 72 11.591 11.003 -2.194 503 HB3 ARG 72 1HB ARG 72 12.498 11.514 -0.777 504 HG2 ARG 72 2HG ARG 72 14.598 10.992 -1.994 505 HG3 ARG 72 1HG ARG 72 13.632 10.633 -3.427 506 HD2 ARG 72 2HD ARG 72 13.667 13.257 -1.956 507 HD3 ARG 72 1HD ARG 72 14.568 12.921 -3.432 508 HE ARG 72 HE ARG 72 12.140 12.332 -4.220 509 HH11 ARG 72 1HH1 ARG 72 13.209 15.124 -2.308 510 HH12 ARG 72 2HH1 ARG 72 12.051 16.188 -2.965 511 HH21 ARG 72 1HH2 ARG 72 10.552 13.827 -5.119 512 HH22 ARG 72 2HH2 ARG 72 10.506 15.430 -4.560 513 H HIS 73 H HIS 73 13.670 7.216 -0.805 514 HA HIS 73 HA HIS 73 16.124 8.315 0.313 515 HB2 HIS 73 2HB HIS 73 14.342 6.183 1.509 516 HB3 HIS 73 1HB HIS 73 16.075 6.085 1.760 517 HD1 HIS 73 1HD HIS 73 13.488 6.899 3.833 518 HD2 HIS 73 2HD HIS 73 16.710 9.157 2.487 519 HE1 HIS 73 1HE HIS 73 13.891 8.685 5.553 520 HA PRO 74 HA PRO 74 18.080 5.400 -2.507 521 HB2 PRO 74 2HB PRO 74 19.773 3.968 -0.814 522 HB3 PRO 74 1HB PRO 74 20.172 5.514 -1.569 523 HG2 PRO 74 2HG PRO 74 19.163 4.956 1.189 524 HG3 PRO 74 1HG PRO 74 20.386 6.126 0.659 525 HD2 PRO 74 2HD PRO 74 17.920 6.921 1.280 526 HD3 PRO 74 1HD PRO 74 18.786 7.641 -0.088 527 H GLU 75 H GLU 75 16.574 4.334 0.377 528 HA GLU 75 HA GLU 75 16.015 1.720 -0.774 529 HB2 GLU 75 2HB GLU 75 16.073 2.584 2.133 530 HB3 GLU 75 1HB GLU 75 15.493 1.021 1.579 531 HG2 GLU 75 2HG GLU 75 18.290 2.048 1.154 532 HG3 GLU 75 1HG GLU 75 17.802 0.985 2.472 533 H SER 76 H SER 76 14.475 2.862 -1.985 534 HA SER 76 HA SER 76 11.937 3.031 -0.550 535 HB2 SER 76 2HB SER 76 12.900 5.091 -2.542 536 HB3 SER 76 1HB SER 76 11.275 5.027 -1.845 537 HG SER 76 HG SER 76 13.072 4.866 0.099 538 H ASP 77 H ASP 77 10.114 2.623 -1.798 539 HA ASP 77 HA ASP 77 10.725 0.915 -4.121 540 HB2 ASP 77 2HB ASP 77 9.561 -0.082 -2.109 541 HB3 ASP 77 1HB ASP 77 8.204 0.980 -2.461 542 H ILE 78 H ILE 78 8.452 3.328 -2.884 543 HA ILE 78 HA ILE 78 7.979 4.226 -5.612 544 HB ILE 78 HB ILE 78 5.601 4.710 -5.029 545 HG12 ILE 78 2HG1 ILE 78 6.099 2.926 -2.626 546 HG13 ILE 78 1HG1 ILE 78 5.857 4.667 -2.560 547 HG21 ILE 78 1HG2 ILE 78 4.752 2.419 -5.311 548 HG22 ILE 78 2HG2 ILE 78 6.362 1.798 -4.952 549 HG23 ILE 78 3HG2 ILE 78 6.099 2.783 -6.389 550 HD11 ILE 78 3HD1 ILE 78 3.591 4.391 -3.410 551 HD12 ILE 78 1HD1 ILE 78 3.840 3.452 -1.936 552 HD13 ILE 78 2HD1 ILE 78 3.830 2.645 -3.507 553 H PHE 79 H PHE 79 7.302 6.428 -5.724 554 HA PHE 79 HA PHE 79 7.994 7.997 -3.362 555 HB2 PHE 79 2HB PHE 79 8.936 9.729 -4.836 556 HB3 PHE 79 1HB PHE 79 9.764 8.204 -5.086 557 HD1 PHE 79 1HD PHE 79 9.274 6.879 -7.161 558 HD2 PHE 79 2HD PHE 79 7.805 10.830 -6.590 559 HE1 PHE 79 1HE PHE 79 8.859 7.066 -9.575 560 HE2 PHE 79 2HE PHE 79 7.378 11.025 -9.001 561 HZ PHE 79 HZ PHE 79 7.901 9.144 -10.497 562 H LEU 80 H LEU 80 6.573 9.549 -2.826 563 HA LEU 80 HA LEU 80 3.994 9.406 -3.947 564 HB2 LEU 80 2HB LEU 80 5.075 11.253 -1.818 565 HB3 LEU 80 1HB LEU 80 3.395 11.134 -2.270 566 HG LEU 80 HG LEU 80 3.478 8.713 -1.481 567 HD11 LEU 80 1HD1 LEU 80 5.881 8.373 -1.483 568 HD12 LEU 80 2HD1 LEU 80 5.201 8.115 0.123 569 HD13 LEU 80 3HD1 LEU 80 6.064 9.607 -0.237 570 HD21 LEU 80 3HD2 LEU 80 3.981 10.903 0.503 571 HD22 LEU 80 1HD2 LEU 80 3.252 9.336 0.856 572 HD23 LEU 80 2HD2 LEU 80 2.430 10.470 -0.217 573 H ASP 81 H ASP 81 3.674 10.356 -5.894 574 HA ASP 81 HA ASP 81 4.934 12.889 -6.469 575 HB2 ASP 81 2HB ASP 81 4.884 11.267 -8.291 576 HB3 ASP 81 1HB ASP 81 3.137 11.145 -8.180 577 H ASP 82 H ASP 82 3.775 13.573 -4.581 578 HA ASP 82 HA ASP 82 1.440 15.172 -5.347 579 HB2 ASP 82 2HB ASP 82 0.520 13.196 -4.135 580 HB3 ASP 82 1HB ASP 82 1.633 13.508 -2.809 581 H VAL 83 H VAL 83 1.174 16.959 -3.630 582 HA VAL 83 HA VAL 83 3.677 18.150 -3.160 583 HB VAL 83 HB VAL 83 2.431 19.926 -1.937 584 HG11 VAL 83 1HG1 VAL 83 1.214 19.094 -4.563 585 HG12 VAL 83 2HG1 VAL 83 2.661 20.079 -4.339 586 HG13 VAL 83 3HG1 VAL 83 1.086 20.695 -3.839 587 HG21 VAL 83 3HG2 VAL 83 -0.031 19.850 -1.845 588 HG22 VAL 83 1HG2 VAL 83 0.694 18.556 -0.892 589 HG23 VAL 83 2HG2 VAL 83 0.004 18.200 -2.473 590 H THR 84 H THR 84 1.576 16.216 -1.135 591 HA THR 84 HA THR 84 3.311 16.780 1.104 592 HB THR 84 HB THR 84 1.697 15.223 2.391 593 HG1 THR 84 1HG THR 84 0.582 15.159 -0.089 594 HG21 THR 84 3HG2 THR 84 1.792 17.638 2.688 595 HG22 THR 84 1HG2 THR 84 0.121 17.075 2.725 596 HG23 THR 84 2HG2 THR 84 0.755 17.860 1.278 597 H VAL 85 H VAL 85 5.067 15.866 0.017 598 HA VAL 85 HA VAL 85 5.191 12.991 0.450 599 HB VAL 85 HB VAL 85 5.545 13.415 -1.915 600 HG11 VAL 85 1HG1 VAL 85 7.402 14.767 -2.757 601 HG12 VAL 85 2HG1 VAL 85 7.772 15.261 -1.106 602 HG13 VAL 85 3HG1 VAL 85 6.240 15.735 -1.843 603 HG21 VAL 85 3HG2 VAL 85 7.752 12.404 -2.251 604 HG22 VAL 85 1HG2 VAL 85 6.898 11.628 -0.917 605 HG23 VAL 85 2HG2 VAL 85 8.186 12.787 -0.587 606 H SER 86 H SER 86 6.125 12.540 2.283 607 HA SER 86 HA SER 86 8.368 14.145 3.218 608 HB2 SER 86 2HB SER 86 7.202 11.616 4.424 609 HB3 SER 86 1HB SER 86 8.147 12.862 5.239 610 HG SER 86 HG SER 86 5.486 12.858 4.424 611 H ARG 87 H ARG 87 10.544 13.104 3.323 612 HA ARG 87 HA ARG 87 10.738 11.164 1.249 613 HB2 ARG 87 2HB ARG 87 13.151 11.219 1.449 614 HB3 ARG 87 1HB ARG 87 12.516 12.851 1.431 615 HG2 ARG 87 2HG ARG 87 12.855 12.981 3.841 616 HG3 ARG 87 1HG ARG 87 13.532 11.342 3.825 617 HD2 ARG 87 2HD ARG 87 14.571 13.755 2.358 618 HD3 ARG 87 1HD ARG 87 15.312 13.030 3.777 619 HE ARG 87 HE ARG 87 14.995 11.350 1.403 620 HH11 ARG 87 1HH1 ARG 87 17.216 13.222 3.451 621 HH12 ARG 87 2HH1 ARG 87 18.614 12.625 2.690 622 HH21 ARG 87 1HH2 ARG 87 16.929 10.599 0.324 623 HH22 ARG 87 2HH2 ARG 87 18.445 11.128 0.876 624 H ARG 88 H ARG 88 10.534 11.039 4.608 625 HA ARG 88 HA ARG 88 10.246 8.168 4.245 626 HB2 ARG 88 2HB ARG 88 10.619 7.871 6.706 627 HB3 ARG 88 1HB ARG 88 12.048 8.372 5.844 628 HG2 ARG 88 2HG ARG 88 11.876 10.595 6.754 629 HG3 ARG 88 1HG ARG 88 10.290 10.226 7.448 630 HD2 ARG 88 2HD ARG 88 11.287 8.522 8.846 631 HD3 ARG 88 1HD ARG 88 12.872 8.853 8.159 632 HE ARG 88 HE ARG 88 12.172 11.233 9.157 633 HH11 ARG 88 1HH1 ARG 88 12.034 7.983 10.582 634 HH12 ARG 88 2HH1 ARG 88 12.426 8.506 12.151 635 HH21 ARG 88 1HH2 ARG 88 12.711 11.938 11.381 636 HH22 ARG 88 2HH2 ARG 88 12.816 10.761 12.605 637 H HIS 89 H HIS 89 8.172 8.047 3.806 638 HA HIS 89 HA HIS 89 6.404 9.725 5.427 639 HB2 HIS 89 2HB HIS 89 6.566 10.053 2.903 640 HB3 HIS 89 1HB HIS 89 5.749 8.504 2.754 641 HD2 HIS 89 2HD HIS 89 3.091 8.494 3.737 642 HE1 HIS 89 1HE HIS 89 2.775 12.708 3.535 643 HE2 HIS 89 2HE HIS 89 1.542 10.553 3.997 644 H ALA 90 H ALA 90 6.501 6.515 3.854 645 HA ALA 90 HA ALA 90 5.127 5.481 6.194 646 HB1 ALA 90 1HB ALA 90 4.080 5.050 3.393 647 HB2 ALA 90 2HB ALA 90 3.312 6.035 4.636 648 HB3 ALA 90 3HB ALA 90 3.456 4.293 4.855 649 H GLU 91 H GLU 91 5.931 3.542 6.774 650 HA GLU 91 HA GLU 91 7.505 2.162 4.726 651 HB2 GLU 91 2HB GLU 91 7.917 2.201 7.734 652 HB3 GLU 91 1HB GLU 91 8.827 1.196 6.625 653 HG2 GLU 91 2HG GLU 91 9.792 3.138 5.573 654 HG3 GLU 91 1HG GLU 91 8.790 4.213 6.546 655 H PHE 92 H PHE 92 6.818 0.230 4.173 656 HA PHE 92 HA PHE 92 4.763 -1.095 5.810 657 HB2 PHE 92 2HB PHE 92 5.264 -1.315 2.824 658 HB3 PHE 92 1HB PHE 92 3.991 -2.132 3.710 659 HD1 PHE 92 1HD PHE 92 5.141 1.053 2.314 660 HD2 PHE 92 2HD PHE 92 2.000 -0.944 4.373 661 HE1 PHE 92 1HE PHE 92 3.637 2.936 1.828 662 HE2 PHE 92 2HE PHE 92 0.488 0.939 3.894 663 HZ PHE 92 HZ PHE 92 1.304 2.880 2.623 664 H ARG 93 H ARG 93 5.585 -2.813 6.802 665 HA ARG 93 HA ARG 93 7.868 -4.134 5.547 666 HB2 ARG 93 2HB ARG 93 7.346 -3.876 8.514 667 HB3 ARG 93 1HB ARG 93 8.703 -4.712 7.770 668 HG2 ARG 93 2HG ARG 93 9.311 -2.500 6.730 669 HG3 ARG 93 1HG ARG 93 8.149 -1.760 7.829 670 HD2 ARG 93 2HD ARG 93 10.611 -3.349 8.548 671 HD3 ARG 93 1HD ARG 93 10.362 -1.622 8.776 672 HE ARG 93 HE ARG 93 8.424 -3.210 10.170 673 HH11 ARG 93 1HH1 ARG 93 11.701 -1.813 10.441 674 HH12 ARG 93 2HH1 ARG 93 11.755 -2.027 12.123 675 HH21 ARG 93 1HH2 ARG 93 8.548 -3.486 12.390 676 HH22 ARG 93 2HH2 ARG 93 9.944 -3.006 13.288 677 H ILE 94 H ILE 94 8.040 -6.351 5.795 678 HA ILE 94 HA ILE 94 5.543 -7.558 6.643 679 HB ILE 94 HB ILE 94 5.989 -9.503 5.096 680 HG12 ILE 94 2HG1 ILE 94 7.449 -8.823 3.004 681 HG13 ILE 94 1HG1 ILE 94 8.260 -7.765 4.141 682 HG21 ILE 94 1HG2 ILE 94 4.383 -7.842 4.502 683 HG22 ILE 94 2HG2 ILE 94 5.220 -8.403 3.054 684 HG23 ILE 94 3HG2 ILE 94 5.631 -6.842 3.764 685 HD11 ILE 94 3HD1 ILE 94 8.876 -9.711 5.487 686 HD12 ILE 94 1HD1 ILE 94 9.473 -9.839 3.833 687 HD13 ILE 94 2HD1 ILE 94 8.055 -10.763 4.332 688 H ASN 95 H ASN 95 5.565 -8.724 8.316 689 HA ASN 95 HA ASN 95 8.145 -9.326 9.473 690 HB2 ASN 95 2HB ASN 95 6.508 -7.665 10.572 691 HB3 ASN 95 1HB ASN 95 5.463 -9.043 10.854 692 HD21 ASN 95 1HD2 ASN 95 6.785 -7.211 12.709 693 HD22 ASN 95 2HD2 ASN 95 7.710 -8.201 13.778 694 H GLU 96 H GLU 96 8.373 -11.351 10.413 695 HA GLU 96 HA GLU 96 7.523 -13.492 8.916 696 HB2 GLU 96 2HB GLU 96 8.349 -14.936 10.714 697 HB3 GLU 96 1HB GLU 96 9.451 -13.612 10.374 698 HG2 GLU 96 2HG GLU 96 8.568 -12.413 12.333 699 HG3 GLU 96 1HG GLU 96 7.524 -13.793 12.673 700 H GLY 97 H GLY 97 5.909 -12.081 11.670 701 HA2 GLY 97 2HA GLY 97 4.000 -14.266 11.735 702 HA3 GLY 97 1HA GLY 97 4.105 -12.944 12.884 703 H GLU 98 H GLU 98 4.037 -10.737 10.952 704 HA GLU 98 HA GLU 98 1.479 -11.111 9.710 705 HB2 GLU 98 2HB GLU 98 0.483 -9.263 10.913 706 HB3 GLU 98 1HB GLU 98 0.839 -10.607 11.988 707 HG2 GLU 98 2HG GLU 98 2.527 -8.101 11.744 708 HG3 GLU 98 1HG GLU 98 1.268 -8.323 12.950 709 H PHE 99 H PHE 99 0.738 -8.816 8.954 710 HA PHE 99 HA PHE 99 2.939 -7.664 7.438 711 HB2 PHE 99 2HB PHE 99 -0.059 -7.202 7.257 712 HB3 PHE 99 1HB PHE 99 1.160 -6.588 6.148 713 HD1 PHE 99 2HD PHE 99 2.437 -8.190 4.732 714 HD2 PHE 99 1HD PHE 99 -0.961 -9.369 6.996 715 HE1 PHE 99 2HE PHE 99 2.227 -10.210 3.348 716 HE2 PHE 99 1HE PHE 99 -1.185 -11.396 5.614 717 HZ PHE 99 HZ PHE 99 0.410 -11.821 3.789 718 H GLU 100 H GLU 100 3.735 -5.625 7.982 719 HA GLU 100 HA GLU 100 2.364 -4.315 10.226 720 HB2 GLU 100 2HB GLU 100 4.260 -5.586 11.012 721 HB3 GLU 100 1HB GLU 100 5.293 -4.864 9.795 722 HG2 GLU 100 2HG GLU 100 5.092 -2.708 10.898 723 HG3 GLU 100 1HG GLU 100 4.016 -3.417 12.102 724 H VAL 101 H VAL 101 2.001 -2.179 9.964 725 HA VAL 101 HA VAL 101 3.637 -0.759 8.000 726 HB VAL 101 HB VAL 101 1.335 -0.973 7.108 727 HG11 VAL 101 1HG1 VAL 101 -0.569 0.144 8.173 728 HG12 VAL 101 2HG1 VAL 101 0.435 0.506 9.575 729 HG13 VAL 101 3HG1 VAL 101 0.067 -1.168 9.165 730 HG21 VAL 101 3HG2 VAL 101 0.877 1.405 6.676 731 HG22 VAL 101 1HG2 VAL 101 2.591 1.019 6.525 732 HG23 VAL 101 2HG2 VAL 101 1.997 1.843 7.966 733 H VAL 102 H VAL 102 4.642 1.012 8.716 734 HA VAL 102 HA VAL 102 3.815 1.967 11.333 735 HB VAL 102 HB VAL 102 6.171 2.622 11.812 736 HG11 VAL 102 1HG1 VAL 102 5.304 0.567 12.749 737 HG12 VAL 102 2HG1 VAL 102 7.002 0.360 12.321 738 HG13 VAL 102 3HG1 VAL 102 5.743 -0.312 11.285 739 HG21 VAL 102 3HG2 VAL 102 7.996 1.601 10.501 740 HG22 VAL 102 1HG2 VAL 102 7.046 2.751 9.559 741 HG23 VAL 102 2HG2 VAL 102 6.804 1.016 9.339 742 H ASP 103 H ASP 103 3.323 3.962 11.566 743 HA ASP 103 HA ASP 103 3.346 5.725 9.283 744 HB2 ASP 103 2HB ASP 103 1.332 5.683 10.614 745 HB3 ASP 103 1HB ASP 103 2.242 6.020 12.081 746 H VAL 104 H VAL 104 5.101 6.791 8.880 747 HA VAL 104 HA VAL 104 6.337 8.223 11.106 748 HB VAL 104 HB VAL 104 8.476 8.275 9.784 749 HG11 VAL 104 1HG1 VAL 104 7.434 5.536 10.487 750 HG12 VAL 104 2HG1 VAL 104 8.227 6.673 11.580 751 HG13 VAL 104 3HG1 VAL 104 9.130 5.943 10.255 752 HG21 VAL 104 3HG2 VAL 104 7.560 7.853 7.550 753 HG22 VAL 104 1HG2 VAL 104 7.081 6.229 8.047 754 HG23 VAL 104 2HG2 VAL 104 8.789 6.654 7.955 755 H GLY 105 H GLY 105 4.280 8.508 8.769 756 HA2 GLY 105 2HA GLY 105 5.209 11.108 7.807 757 HA3 GLY 105 1HA GLY 105 4.059 10.067 6.971 758 H SER 106 H SER 106 4.399 11.228 10.284 759 HA SER 106 HA SER 106 1.669 11.460 10.790 760 HB2 SER 106 2HB SER 106 2.577 12.789 12.797 761 HB3 SER 106 1HB SER 106 3.084 11.108 12.625 762 HG SER 106 HG SER 106 4.537 13.478 12.232 763 H LEU 107 H LEU 107 3.513 13.304 8.857 764 HA LEU 107 HA LEU 107 2.607 15.947 9.211 765 HB2 LEU 107 2HB LEU 107 3.370 14.456 6.698 766 HB3 LEU 107 1HB LEU 107 3.096 16.171 6.761 767 HG LEU 107 HG LEU 107 5.433 15.867 6.688 768 HD11 LEU 107 1HD1 LEU 107 4.730 16.397 9.542 769 HD12 LEU 107 2HD1 LEU 107 4.784 17.569 8.225 770 HD13 LEU 107 3HD1 LEU 107 6.266 16.778 8.767 771 HD21 LEU 107 3HD2 LEU 107 5.533 13.492 7.294 772 HD22 LEU 107 1HD2 LEU 107 5.253 13.912 8.984 773 HD23 LEU 107 2HD2 LEU 107 6.729 14.439 8.172 774 H ASN 108 H ASN 108 1.348 13.138 7.626 775 HA ASN 108 HA ASN 108 -1.192 14.542 7.109 776 HB2 ASN 108 2HB ASN 108 -0.064 12.080 5.734 777 HB3 ASN 108 1HB ASN 108 -1.649 12.771 5.418 778 HD21 ASN 108 1HD2 ASN 108 -1.794 14.673 4.203 779 HD22 ASN 108 2HD2 ASN 108 -0.433 15.276 3.327 780 H GLY 109 H GLY 109 0.354 11.539 8.105 781 HA2 GLY 109 2HA GLY 109 -0.262 10.269 9.958 782 HA3 GLY 109 1HA GLY 109 -1.838 11.046 9.952 783 H THR 110 H THR 110 -0.306 8.236 9.366 784 HA THR 110 HA THR 110 -1.881 7.313 7.160 785 HB THR 110 HB THR 110 -0.441 5.632 9.235 786 HG1 THR 110 1HG THR 110 1.020 7.166 8.443 787 HG21 THR 110 3HG2 THR 110 -1.001 5.196 6.293 788 HG22 THR 110 1HG2 THR 110 -1.884 4.432 7.621 789 HG23 THR 110 2HG2 THR 110 -0.171 4.069 7.366 790 H TYR 111 H TYR 111 -4.026 6.830 7.351 791 HA TYR 111 HA TYR 111 -5.067 6.133 9.992 792 HB2 TYR 111 2HB TYR 111 -6.550 6.891 7.461 793 HB3 TYR 111 1HB TYR 111 -7.268 6.583 9.032 794 HD1 TYR 111 2HD TYR 111 -7.100 8.258 10.805 795 HD2 TYR 111 1HD TYR 111 -5.473 8.985 6.949 796 HE1 TYR 111 2HE TYR 111 -6.979 10.660 11.308 797 HE2 TYR 111 1HE TYR 111 -5.350 11.389 7.443 798 HH TYR 111 HH TYR 111 -5.837 12.601 10.617 799 H VAL 112 H VAL 112 -5.804 4.160 10.321 800 HA VAL 112 HA VAL 112 -6.105 2.370 8.011 801 HB VAL 112 HB VAL 112 -5.464 1.615 10.888 802 HG11 VAL 112 1HG1 VAL 112 -5.668 -0.100 8.404 803 HG12 VAL 112 2HG1 VAL 112 -6.821 -0.062 9.729 804 HG13 VAL 112 3HG1 VAL 112 -5.199 -0.687 9.998 805 HG21 VAL 112 3HG2 VAL 112 -3.242 0.942 10.014 806 HG22 VAL 112 1HG2 VAL 112 -3.547 2.665 9.797 807 HG23 VAL 112 2HG2 VAL 112 -3.700 1.564 8.432 808 H ASN 113 H ASN 113 -8.155 1.903 7.636 809 HA ASN 113 HA ASN 113 -10.422 1.892 7.820 810 HB2 ASN 113 2HB ASN 113 -9.737 0.036 9.484 811 HB3 ASN 113 1HB ASN 113 -9.971 1.226 10.757 812 HD21 ASN 113 1HD2 ASN 113 -11.494 -0.699 8.334 813 HD22 ASN 113 2HD2 ASN 113 -13.103 -0.609 8.922 814 H ARG 114 H ARG 114 -8.988 4.285 8.187 815 HA ARG 114 HA ARG 114 -9.290 6.463 8.519 816 HB2 ARG 114 2HB ARG 114 -12.027 5.667 9.451 817 HB3 ARG 114 1HB ARG 114 -11.477 7.338 9.473 818 HG2 ARG 114 2HG ARG 114 -11.081 7.199 7.041 819 HG3 ARG 114 1HG ARG 114 -11.714 5.553 7.062 820 HD2 ARG 114 2HD ARG 114 -13.377 7.244 6.366 821 HD3 ARG 114 1HD ARG 114 -13.868 6.332 7.793 822 HE ARG 114 HE ARG 114 -12.708 8.504 8.864 823 HH11 ARG 114 1HH1 ARG 114 -15.135 8.292 6.274 824 HH12 ARG 114 2HH1 ARG 114 -15.964 9.689 6.776 825 HH21 ARG 114 1HH2 ARG 114 -13.808 10.415 9.504 826 HH22 ARG 114 2HH2 ARG 114 -15.194 10.929 8.651 827 H GLU 115 H GLU 115 -8.660 4.463 10.931 828 HA GLU 115 HA GLU 115 -8.726 6.593 12.933 829 HB2 GLU 115 2HB GLU 115 -8.025 3.682 13.250 830 HB3 GLU 115 1HB GLU 115 -8.101 4.858 14.550 831 HG2 GLU 115 2HG GLU 115 -10.499 5.161 14.102 832 HG3 GLU 115 1HG GLU 115 -10.395 3.913 12.859 833 HA PRO 116 HA PRO 116 -4.365 7.214 12.109 834 HB2 PRO 116 2HB PRO 116 -4.147 8.479 14.737 835 HB3 PRO 116 1HB PRO 116 -3.988 9.215 13.143 836 HG2 PRO 116 2HG PRO 116 -6.083 9.713 14.799 837 HG3 PRO 116 1HG PRO 116 -6.207 9.772 13.036 838 HD2 PRO 116 2HD PRO 116 -7.095 7.639 14.922 839 HD3 PRO 116 1HD PRO 116 -7.852 8.241 13.429 840 H ARG 117 H ARG 117 -2.983 5.582 12.378 841 HA ARG 117 HA ARG 117 -2.690 4.414 15.062 842 HB2 ARG 117 2HB ARG 117 -2.528 2.967 12.403 843 HB3 ARG 117 1HB ARG 117 -2.203 2.250 13.973 844 HG2 ARG 117 2HG ARG 117 -4.874 3.330 13.068 845 HG3 ARG 117 1HG ARG 117 -4.417 1.628 13.105 846 HD2 ARG 117 2HD ARG 117 -4.094 1.795 15.548 847 HD3 ARG 117 1HD ARG 117 -4.604 3.479 15.481 848 HE ARG 117 HE ARG 117 -6.650 2.059 14.330 849 HH11 ARG 117 1HH1 ARG 117 -5.047 2.011 17.469 850 HH12 ARG 117 2HH1 ARG 117 -6.418 1.501 18.340 851 HH21 ARG 117 1HH2 ARG 117 -8.605 1.441 15.552 852 HH22 ARG 117 2HH2 ARG 117 -8.484 1.219 17.224 853 H ASN 118 H ASN 118 -0.651 4.497 15.804 854 HA ASN 118 HA ASN 118 1.411 5.679 14.226 855 HB2 ASN 118 2HB ASN 118 2.923 5.350 16.142 856 HB3 ASN 118 1HB ASN 118 1.378 5.974 16.689 857 HD21 ASN 118 1HD2 ASN 118 0.052 4.639 17.966 858 HD22 ASN 118 2HD2 ASN 118 0.636 3.178 18.670 859 H ALA 119 H ALA 119 0.801 2.391 15.293 860 HA ALA 119 HA ALA 119 2.199 1.441 12.952 861 HB1 ALA 119 1HB ALA 119 3.266 -0.357 14.296 862 HB2 ALA 119 2HB ALA 119 2.689 0.421 15.768 863 HB3 ALA 119 3HB ALA 119 3.873 1.237 14.745 864 H GLN 120 H GLN 120 1.111 -0.292 12.148 865 HA GLN 120 HA GLN 120 -1.043 -1.385 13.756 866 HB2 GLN 120 2HB GLN 120 -2.043 0.503 12.590 867 HB3 GLN 120 1HB GLN 120 -1.417 -0.075 11.060 868 HG2 GLN 120 2HG GLN 120 -3.789 -0.488 11.288 869 HG3 GLN 120 1HG GLN 120 -2.904 -2.008 11.164 870 HE21 GLN 120 1HE2 GLN 120 -4.470 -3.209 12.117 871 HE22 GLN 120 2HE2 GLN 120 -4.942 -3.072 13.769 872 H VAL 121 H VAL 121 -1.623 -3.438 13.173 873 HA VAL 121 HA VAL 121 0.059 -4.854 11.321 874 HB VAL 121 HB VAL 121 -2.475 -5.704 12.795 875 HG11 VAL 121 1HG1 VAL 121 -2.101 -7.075 10.825 876 HG12 VAL 121 2HG1 VAL 121 -1.779 -8.010 12.288 877 HG13 VAL 121 3HG1 VAL 121 -0.440 -7.374 11.332 878 HG21 VAL 121 3HG2 VAL 121 -0.688 -5.174 14.357 879 HG22 VAL 121 1HG2 VAL 121 0.421 -6.217 13.469 880 HG23 VAL 121 2HG2 VAL 121 -0.957 -6.917 14.311 881 H MET 122 H MET 122 -0.393 -4.885 9.210 882 HA MET 122 HA MET 122 -2.532 -3.338 8.221 883 HB2 MET 122 2HB MET 122 -0.631 -5.146 6.727 884 HB3 MET 122 1HB MET 122 -1.907 -4.242 5.916 885 HG2 MET 122 2HG MET 122 -0.962 -2.162 6.893 886 HG3 MET 122 1HG MET 122 0.377 -3.117 7.511 887 HE1 MET 122 3HE MET 122 2.152 -4.291 6.053 888 HE2 MET 122 1HE MET 122 2.289 -4.131 4.293 889 HE3 MET 122 2HE MET 122 1.001 -5.097 4.967 890 H GLN 123 H GLN 123 -4.366 -3.800 7.155 891 HA GLN 123 HA GLN 123 -5.556 -6.212 8.297 892 HB2 GLN 123 2HB GLN 123 -6.165 -3.683 8.743 893 HB3 GLN 123 1HB GLN 123 -7.029 -3.856 7.230 894 HG2 GLN 123 2HG GLN 123 -8.567 -4.207 8.999 895 HG3 GLN 123 1HG GLN 123 -8.254 -5.780 8.259 896 HE21 GLN 123 1HE2 GLN 123 -7.186 -7.326 9.412 897 HE22 GLN 123 2HE2 GLN 123 -6.831 -7.169 11.098 898 H THR 124 H THR 124 -6.090 -7.729 6.854 899 HA THR 124 HA THR 124 -5.958 -7.219 4.041 900 HB THR 124 HB THR 124 -6.500 -9.713 3.978 901 HG1 THR 124 1HG THR 124 -7.415 -10.187 5.824 902 HG21 THR 124 3HG2 THR 124 -4.115 -8.818 5.615 903 HG22 THR 124 1HG2 THR 124 -4.184 -8.892 3.856 904 HG23 THR 124 2HG2 THR 124 -4.262 -10.377 4.808 905 H GLY 125 H GLY 125 -7.666 -6.487 2.964 906 HA2 GLY 125 2HA GLY 125 -9.845 -6.738 2.109 907 HA3 GLY 125 1HA GLY 125 -10.312 -7.550 3.599 908 H ASP 126 H ASP 126 -8.441 -4.740 4.072 909 HA ASP 126 HA ASP 126 -10.871 -3.171 4.494 910 HB2 ASP 126 2HB ASP 126 -9.819 -4.366 6.620 911 HB3 ASP 126 1HB ASP 126 -8.686 -3.019 6.523 912 H GLU 127 H GLU 127 -9.727 -0.845 5.459 913 HA GLU 127 HA GLU 127 -8.206 -0.140 3.040 914 HB2 GLU 127 2HB GLU 127 -9.246 2.099 3.190 915 HB3 GLU 127 1HB GLU 127 -10.362 0.782 2.856 916 HG2 GLU 127 2HG GLU 127 -11.209 0.823 5.074 917 HG3 GLU 127 1HG GLU 127 -9.924 1.911 5.599 918 H ILE 128 H ILE 128 -6.675 1.370 3.032 919 HA ILE 128 HA ILE 128 -5.632 2.398 5.578 920 HB ILE 128 HB ILE 128 -4.094 1.694 3.052 921 HG12 ILE 128 2HG1 ILE 128 -4.872 -0.289 4.270 922 HG13 ILE 128 1HG1 ILE 128 -3.107 -0.176 4.227 923 HG21 ILE 128 1HG2 ILE 128 -3.093 3.563 4.230 924 HG22 ILE 128 2HG2 ILE 128 -2.065 2.137 4.371 925 HG23 ILE 128 3HG2 ILE 128 -3.073 2.633 5.730 926 HD11 ILE 128 3HD1 ILE 128 -4.920 0.492 6.540 927 HD12 ILE 128 1HD1 ILE 128 -3.162 0.629 6.545 928 HD13 ILE 128 2HD1 ILE 128 -3.921 -0.958 6.389 929 H GLN 129 H GLN 129 -5.861 4.509 5.559 930 HA GLN 129 HA GLN 129 -6.051 5.927 2.964 931 HB2 GLN 129 2HB GLN 129 -8.205 5.630 4.456 932 HB3 GLN 129 1HB GLN 129 -7.464 6.852 5.464 933 HG2 GLN 129 2HG GLN 129 -8.284 7.168 2.574 934 HG3 GLN 129 1HG GLN 129 -9.120 7.818 3.975 935 HE21 GLN 129 1HE2 GLN 129 -8.180 9.579 5.077 936 HE22 GLN 129 2HE2 GLN 129 -7.012 10.581 4.281 937 H ILE 130 H ILE 130 -4.301 7.226 2.805 938 HA ILE 130 HA ILE 130 -3.449 8.517 5.257 939 HB ILE 130 HB ILE 130 -1.857 6.755 4.984 940 HG12 ILE 130 2HG1 ILE 130 -0.581 9.322 4.014 941 HG13 ILE 130 1HG1 ILE 130 -0.946 8.938 5.691 942 HG21 ILE 130 1HG2 ILE 130 -1.352 7.683 2.172 943 HG22 ILE 130 2HG2 ILE 130 -2.214 6.220 2.645 944 HG23 ILE 130 3HG2 ILE 130 -0.495 6.384 3.003 945 HD11 ILE 130 3HD1 ILE 130 1.403 8.605 5.187 946 HD12 ILE 130 1HD1 ILE 130 0.977 7.463 3.913 947 HD13 ILE 130 2HD1 ILE 130 0.625 7.077 5.598 948 H GLY 131 H GLY 131 -3.836 10.541 5.046 949 HA2 GLY 131 2HA GLY 131 -3.841 12.685 4.188 950 HA3 GLY 131 1HA GLY 131 -2.750 12.122 2.920 951 H LYS 132 H LYS 132 -3.553 11.848 0.920 952 HA LYS 132 HA LYS 132 -6.483 11.621 0.629 953 HB2 LYS 132 2HB LYS 132 -4.613 12.787 -1.464 954 HB3 LYS 132 1HB LYS 132 -6.341 12.615 -1.598 955 HG2 LYS 132 2HG LYS 132 -6.177 14.851 -1.142 956 HG3 LYS 132 1HG LYS 132 -6.399 14.201 0.476 957 HD2 LYS 132 2HD LYS 132 -4.637 15.881 0.465 958 HD3 LYS 132 1HD LYS 132 -3.965 14.289 0.834 959 HE2 LYS 132 2HE LYS 132 -3.149 14.067 -1.460 960 HE3 LYS 132 1HE LYS 132 -3.939 15.577 -1.906 961 HZ1 LYS 132 3HZ LYS 132 -2.432 16.782 -0.607 962 HZ2 LYS 132 1HZ LYS 132 -1.508 15.698 -1.497 963 HZ3 LYS 132 2HZ LYS 132 -1.791 15.409 0.139 964 H PHE 133 H PHE 133 -3.923 9.798 0.729 965 HA PHE 133 HA PHE 133 -4.215 8.448 -1.838 966 HB2 PHE 133 2HB PHE 133 -2.363 7.739 0.445 967 HB3 PHE 133 1HB PHE 133 -2.290 7.130 -1.192 968 HD1 PHE 133 1HD PHE 133 -1.698 8.798 -3.044 969 HD2 PHE 133 2HD PHE 133 -1.148 9.615 1.079 970 HE1 PHE 133 1HE PHE 133 -0.066 10.541 -3.602 971 HE2 PHE 133 2HE PHE 133 0.471 11.360 0.528 972 HZ PHE 133 HZ PHE 133 1.019 11.829 -1.811 973 H ARG 134 H ARG 134 -5.953 7.167 -1.844 974 HA ARG 134 HA ARG 134 -6.435 5.617 0.558 975 HB2 ARG 134 2HB ARG 134 -8.627 4.952 -0.685 976 HB3 ARG 134 1HB ARG 134 -8.496 6.555 0.014 977 HG2 ARG 134 2HG ARG 134 -7.921 7.436 -2.224 978 HG3 ARG 134 1HG ARG 134 -8.171 5.822 -2.890 979 HD2 ARG 134 2HD ARG 134 -10.482 5.851 -2.334 980 HD3 ARG 134 1HD ARG 134 -10.298 7.293 -1.336 981 HE ARG 134 HE ARG 134 -9.562 8.287 -3.612 982 HH11 ARG 134 1HH1 ARG 134 -12.278 6.027 -3.112 983 HH12 ARG 134 2HH1 ARG 134 -13.200 6.678 -4.383 984 HH21 ARG 134 1HH2 ARG 134 -10.936 9.171 -5.369 985 HH22 ARG 134 2HH2 ARG 134 -12.450 8.460 -5.661 986 H LEU 135 H LEU 135 -5.898 3.702 0.771 987 HA LEU 135 HA LEU 135 -4.985 2.111 -1.516 988 HB2 LEU 135 2HB LEU 135 -3.220 3.171 -0.156 989 HB3 LEU 135 1HB LEU 135 -3.874 2.433 1.275 990 HG LEU 135 HG LEU 135 -3.354 0.193 0.137 991 HD11 LEU 135 1HD1 LEU 135 -1.725 2.051 -1.572 992 HD12 LEU 135 2HD1 LEU 135 -3.036 0.990 -2.105 993 HD13 LEU 135 3HD1 LEU 135 -1.531 0.304 -1.497 994 HD21 LEU 135 3HD2 LEU 135 -1.035 0.264 0.882 995 HD22 LEU 135 1HD2 LEU 135 -2.089 1.088 2.027 996 HD23 LEU 135 2HD2 LEU 135 -1.087 2.027 0.918 997 H VAL 136 H VAL 136 -5.623 -0.069 -1.357 998 HA VAL 136 HA VAL 136 -7.025 -0.850 1.099 999 HB VAL 136 HB VAL 136 -7.774 -1.831 -1.691 1000 HG11 VAL 136 1HG1 VAL 136 -8.268 -3.427 0.061 1001 HG12 VAL 136 2HG1 VAL 136 -9.764 -2.756 -0.590 1002 HG13 VAL 136 3HG1 VAL 136 -9.148 -2.194 0.962 1003 HG21 VAL 136 3HG2 VAL 136 -9.234 0.197 0.009 1004 HG22 VAL 136 1HG2 VAL 136 -9.825 -0.487 -1.506 1005 HG23 VAL 136 2HG2 VAL 136 -8.382 0.531 -1.496 1006 H PHE 137 H PHE 137 -6.409 -2.820 1.906 1007 HA PHE 137 HA PHE 137 -4.128 -4.061 0.517 1008 HB2 PHE 137 2HB PHE 137 -3.683 -2.963 2.715 1009 HB3 PHE 137 1HB PHE 137 -4.824 -4.066 3.466 1010 HD1 PHE 137 1HD PHE 137 -1.748 -4.091 1.400 1011 HD2 PHE 137 2HD PHE 137 -3.998 -5.977 4.460 1012 HE1 PHE 137 1HE PHE 137 0.110 -5.641 1.792 1013 HE2 PHE 137 2HE PHE 137 -2.145 -7.538 4.864 1014 HZ PHE 137 HZ PHE 137 -0.085 -7.370 3.532 1015 H LEU 138 H LEU 138 -4.502 -6.089 -0.276 1016 HA LEU 138 HA LEU 138 -6.783 -7.554 0.874 1017 HB2 LEU 138 2HB LEU 138 -5.987 -7.473 -2.034 1018 HB3 LEU 138 1HB LEU 138 -7.169 -8.556 -1.358 1019 HG LEU 138 HG LEU 138 -8.360 -6.925 -2.460 1020 HD11 LEU 138 1HD1 LEU 138 -9.650 -5.740 -0.778 1021 HD12 LEU 138 2HD1 LEU 138 -8.422 -6.139 0.425 1022 HD13 LEU 138 3HD1 LEU 138 -9.347 -7.426 -0.353 1023 HD21 LEU 138 3HD2 LEU 138 -8.077 -4.492 -2.154 1024 HD22 LEU 138 1HD2 LEU 138 -6.642 -5.271 -2.820 1025 HD23 LEU 138 2HD2 LEU 138 -6.684 -4.813 -1.119 1026 H ALA 139 H ALA 139 -6.615 -9.650 1.145 1027 HA ALA 139 HA ALA 139 -4.024 -10.922 0.765 1028 HB1 ALA 139 1HB ALA 139 -6.551 -11.899 2.115 1029 HB2 ALA 139 2HB ALA 139 -5.119 -11.267 2.937 1030 HB3 ALA 139 3HB ALA 139 -5.033 -12.792 2.055 1031 H GLY 140 H GLY 140 -4.166 -10.885 -1.459 1032 HA2 GLY 140 2HA GLY 140 -6.411 -11.984 -2.842 1033 HA3 GLY 140 1HA GLY 140 -4.933 -11.400 -3.582 1034 HA PRO 141 HA PRO 141 -3.585 -15.448 -4.392 1035 HB2 PRO 141 2HB PRO 141 -1.055 -15.192 -2.953 1036 HB3 PRO 141 1HB PRO 141 -1.336 -15.426 -4.675 1037 HG2 PRO 141 2HG PRO 141 -0.460 -13.084 -3.702 1038 HG3 PRO 141 1HG PRO 141 -1.553 -13.169 -5.091 1039 HD2 PRO 141 2HD PRO 141 -2.167 -12.509 -2.240 1040 HD3 PRO 141 1HD PRO 141 -2.818 -11.812 -3.742 1041 H ALA 142 H ALA 142 -4.114 -17.257 -3.575 1042 HA ALA 142 HA ALA 142 -3.552 -17.846 -0.760 1043 HB1 ALA 142 1HB ALA 142 -5.230 -19.673 -1.047 1044 HB2 ALA 142 2HB ALA 142 -5.514 -19.123 -2.696 1045 HB3 ALA 142 3HB ALA 142 -5.937 -18.083 -1.338 1046 H GLU 143 H GLU 143 -1.605 -18.741 -0.757 1047 HA GLU 143 HA GLU 143 -1.003 -20.713 -2.828 1048 HB2 GLU 143 2HB GLU 143 -0.081 -18.438 -3.392 1049 HB3 GLU 143 1HB GLU 143 0.877 -18.519 -1.927 1050 HG2 GLU 143 2HG GLU 143 1.965 -20.559 -2.835 1051 HG3 GLU 143 1HG GLU 143 1.089 -20.292 -4.341 Start of MODEL 20 1 H1 MET 1 1HT MET 1 72.473 44.492 -3.082 2 H2 MET 1 2HT MET 1 72.015 43.067 -3.903 3 H3 MET 1 3HT MET 1 72.279 43.062 -2.245 4 HA MET 1 HA MET 1 70.163 44.652 -3.499 5 HB2 MET 1 2HB MET 1 70.054 41.976 -2.084 6 HB3 MET 1 1HB MET 1 68.651 43.003 -2.293 7 HG2 MET 1 2HG MET 1 68.645 41.259 -3.936 8 HG3 MET 1 1HG MET 1 68.896 42.807 -4.730 9 HE1 MET 1 2HE MET 1 69.688 41.661 -6.941 10 HE2 MET 1 3HE MET 1 69.332 40.112 -6.180 11 HE3 MET 1 1HE MET 1 70.878 40.359 -6.991 12 H SER 2 H SER 2 70.029 46.423 -2.269 13 HA SER 2 HA SER 2 70.713 46.267 0.513 14 HB2 SER 2 2HB SER 2 71.174 48.292 -0.953 15 HB3 SER 2 1HB SER 2 69.439 48.563 -1.021 16 HG SER 2 HG SER 2 69.436 49.253 0.969 17 H ASP 3 H ASP 3 67.917 46.509 -1.547 18 HA ASP 3 HA ASP 3 66.051 46.296 0.659 19 HB2 ASP 3 2HB ASP 3 64.300 46.485 -1.008 20 HB3 ASP 3 1HB ASP 3 65.524 47.674 -1.420 21 H ASN 4 H ASN 4 64.587 44.404 0.729 22 HA ASN 4 HA ASN 4 65.347 42.101 -0.808 23 HB2 ASN 4 2HB ASN 4 66.097 40.651 0.960 24 HB3 ASN 4 1HB ASN 4 67.095 42.090 0.981 25 HD21 ASN 4 1HD2 ASN 4 65.158 43.740 2.496 26 HD22 ASN 4 2HD2 ASN 4 65.123 43.079 4.086 27 H ASN 5 H ASN 5 63.963 40.331 -0.584 28 HA ASN 5 HA ASN 5 61.568 40.746 1.042 29 HB2 ASN 5 2HB ASN 5 61.029 41.321 -1.331 30 HB3 ASN 5 1HB ASN 5 61.631 39.744 -1.831 31 HD21 ASN 5 1HD2 ASN 5 59.664 39.145 -2.699 32 HD22 ASN 5 2HD2 ASN 5 58.292 38.750 -1.723 33 H GLY 6 H GLY 6 60.719 38.781 1.831 34 HA2 GLY 6 2HA GLY 6 62.396 36.443 1.311 35 HA3 GLY 6 1HA GLY 6 62.170 37.012 2.960 36 H THR 7 H THR 7 60.954 35.598 3.919 37 HA THR 7 HA THR 7 58.943 34.137 2.484 38 HB THR 7 HB THR 7 60.446 32.960 4.055 39 HG1 THR 7 1HG THR 7 57.688 32.990 4.733 40 HG21 THR 7 3HG2 THR 7 60.173 33.215 6.496 41 HG22 THR 7 1HG2 THR 7 59.034 34.532 6.225 42 HG23 THR 7 2HG2 THR 7 60.720 34.722 5.761 43 HA PRO 8 HA PRO 8 55.454 36.560 3.998 44 HB2 PRO 8 2HB PRO 8 53.578 34.562 3.810 45 HB3 PRO 8 1HB PRO 8 54.105 35.521 2.427 46 HG2 PRO 8 2HG PRO 8 54.974 32.791 3.277 47 HG3 PRO 8 1HG PRO 8 54.623 33.404 1.651 48 HD2 PRO 8 2HD PRO 8 57.129 33.110 2.549 49 HD3 PRO 8 1HD PRO 8 56.681 34.440 1.457 50 H GLU 9 H GLU 9 54.295 36.678 5.947 51 HA GLU 9 HA GLU 9 55.366 35.143 8.125 52 HB2 GLU 9 2HB GLU 9 53.057 37.104 8.146 53 HB3 GLU 9 1HB GLU 9 53.817 36.421 9.566 54 HG2 GLU 9 2HG GLU 9 54.607 38.619 9.369 55 HG3 GLU 9 1HG GLU 9 55.931 37.587 8.840 56 HA PRO 10 HA PRO 10 52.205 31.910 7.901 57 HB2 PRO 10 2HB PRO 10 53.090 31.411 10.689 58 HB3 PRO 10 1HB PRO 10 53.032 30.302 9.313 59 HG2 PRO 10 2HG PRO 10 55.361 31.227 10.219 60 HG3 PRO 10 1HG PRO 10 55.074 31.002 8.485 61 HD2 PRO 10 2HD PRO 10 55.042 33.517 10.100 62 HD3 PRO 10 1HD PRO 10 55.704 33.215 8.475 63 H GLN 11 H GLN 11 50.142 31.566 8.860 64 HA GLN 11 HA GLN 11 49.196 33.901 10.282 65 HB2 GLN 11 2HB GLN 11 47.601 31.685 8.990 66 HB3 GLN 11 1HB GLN 11 46.953 33.173 9.647 67 HG2 GLN 11 2HG GLN 11 46.961 33.652 7.401 68 HG3 GLN 11 1HG GLN 11 48.527 34.285 7.878 69 HE21 GLN 11 1HE2 GLN 11 46.881 31.774 6.207 70 HE22 GLN 11 2HE2 GLN 11 48.232 31.102 5.381 71 H VAL 12 H VAL 12 47.242 33.337 11.764 72 HA VAL 12 HA VAL 12 48.064 31.217 13.585 73 HB VAL 12 HB VAL 12 47.157 32.681 15.366 74 HG11 VAL 12 1HG1 VAL 12 49.117 34.197 15.459 75 HG12 VAL 12 2HG1 VAL 12 49.452 33.833 13.766 76 HG13 VAL 12 3HG1 VAL 12 49.574 32.560 14.980 77 HG21 VAL 12 3HG2 VAL 12 46.892 35.089 14.938 78 HG22 VAL 12 1HG2 VAL 12 45.738 34.125 14.017 79 HG23 VAL 12 2HG2 VAL 12 47.159 34.801 13.218 80 H GLU 13 H GLU 13 46.205 30.648 15.085 81 HA GLU 13 HA GLU 13 43.882 29.981 13.537 82 HB2 GLU 13 2HB GLU 13 44.902 28.454 15.244 83 HB3 GLU 13 1HB GLU 13 44.398 29.582 16.486 84 HG2 GLU 13 2HG GLU 13 42.873 27.673 16.299 85 HG3 GLU 13 1HG GLU 13 42.069 29.204 15.964 86 H THR 14 H THR 14 41.815 30.792 13.818 87 HA THR 14 HA THR 14 41.728 33.215 15.432 88 HB THR 14 HB THR 14 41.550 33.715 13.021 89 HG1 THR 14 1HG THR 14 39.103 34.493 13.364 90 HG21 THR 14 3HG2 THR 14 40.509 31.605 12.278 91 HG22 THR 14 1HG2 THR 14 39.573 33.003 11.742 92 HG23 THR 14 2HG2 THR 14 39.024 32.048 13.118 93 H THR 15 H THR 15 39.851 33.636 16.658 94 HA THR 15 HA THR 15 38.310 31.252 17.223 95 HB THR 15 HB THR 15 37.621 32.696 19.251 96 HG1 THR 15 1HG THR 15 38.390 34.644 18.936 97 HG21 THR 15 3HG2 THR 15 39.658 31.997 20.468 98 HG22 THR 15 1HG2 THR 15 40.453 31.676 18.928 99 HG23 THR 15 2HG2 THR 15 39.055 30.717 19.414 100 H SER 16 H SER 16 37.921 33.540 15.085 101 HA SER 16 HA SER 16 35.373 34.669 15.745 102 HB2 SER 16 2HB SER 16 35.588 35.534 13.367 103 HB3 SER 16 1HB SER 16 36.874 36.001 14.482 104 HG SER 16 HG SER 16 37.021 34.545 12.190 105 H VAL 17 H VAL 17 35.375 31.765 15.674 106 HA VAL 17 HA VAL 17 33.566 31.302 13.433 107 HB VAL 17 HB VAL 17 34.071 28.881 13.644 108 HG11 VAL 17 1HG1 VAL 17 36.546 30.562 13.267 109 HG12 VAL 17 2HG1 VAL 17 35.342 30.200 12.036 110 HG13 VAL 17 3HG1 VAL 17 36.337 28.904 12.702 111 HG21 VAL 17 3HG2 VAL 17 35.987 28.102 14.980 112 HG22 VAL 17 1HG2 VAL 17 34.723 28.790 16.000 113 HG23 VAL 17 2HG2 VAL 17 36.177 29.726 15.641 114 H PHE 18 H PHE 18 31.491 30.734 13.961 115 HA PHE 18 HA PHE 18 30.978 30.799 16.793 116 HB2 PHE 18 2HB PHE 18 28.635 31.093 16.311 117 HB3 PHE 18 1HB PHE 18 29.545 32.168 15.267 118 HD1 PHE 18 2HD PHE 18 29.772 31.582 12.846 119 HD2 PHE 18 1HD PHE 18 27.168 29.478 15.466 120 HE1 PHE 18 2HE PHE 18 28.520 30.723 10.912 121 HE2 PHE 18 1HE PHE 18 25.909 28.615 13.540 122 HZ PHE 18 HZ PHE 18 26.587 29.239 11.257 123 H ARG 19 H ARG 19 30.133 29.228 17.961 124 HA ARG 19 HA ARG 19 30.356 26.565 16.858 125 HB2 ARG 19 2HB ARG 19 29.865 27.601 19.657 126 HB3 ARG 19 1HB ARG 19 29.733 25.906 19.253 127 HG2 ARG 19 2HG ARG 19 31.911 26.319 20.253 128 HG3 ARG 19 1HG ARG 19 32.097 25.859 18.571 129 HD2 ARG 19 2HD ARG 19 32.425 28.242 17.986 130 HD3 ARG 19 1HD ARG 19 32.271 28.659 19.694 131 HE ARG 19 HE ARG 19 34.243 26.714 19.458 132 HH11 ARG 19 1HH1 ARG 19 33.839 30.087 18.373 133 HH12 ARG 19 2HH1 ARG 19 35.474 30.475 18.589 134 HH21 ARG 19 1HH2 ARG 19 36.468 27.235 19.619 135 HH22 ARG 19 2HH2 ARG 19 37.041 28.796 19.240 136 H ALA 20 H ALA 20 28.664 25.324 16.352 137 HA ALA 20 HA ALA 20 26.213 26.674 15.950 138 HB1 ALA 20 1HB ALA 20 25.444 24.630 14.884 139 HB2 ALA 20 2HB ALA 20 26.834 23.754 15.522 140 HB3 ALA 20 3HB ALA 20 27.070 25.039 14.344 141 H ASP 21 H ASP 21 25.464 27.232 17.909 142 HA ASP 21 HA ASP 21 24.475 25.084 19.604 143 HB2 ASP 21 2HB ASP 21 24.820 28.031 20.069 144 HB3 ASP 21 1HB ASP 21 23.779 27.067 21.108 145 H LEU 22 H LEU 22 23.410 27.652 17.538 146 HA LEU 22 HA LEU 22 20.656 27.238 18.198 147 HB2 LEU 22 2HB LEU 22 21.445 29.441 17.469 148 HB3 LEU 22 1HB LEU 22 21.946 28.772 15.933 149 HG LEU 22 HG LEU 22 19.572 28.299 15.394 150 HD11 LEU 22 1HD1 LEU 22 19.008 29.774 17.960 151 HD12 LEU 22 2HD1 LEU 22 18.674 28.073 17.633 152 HD13 LEU 22 3HD1 LEU 22 17.808 29.327 16.748 153 HD21 LEU 22 3HD2 LEU 22 20.179 31.164 16.119 154 HD22 LEU 22 1HD2 LEU 22 18.923 30.632 15.002 155 HD23 LEU 22 2HD2 LEU 22 20.621 30.357 14.616 156 H LEU 23 H LEU 23 20.320 25.090 17.839 157 HA LEU 23 HA LEU 23 20.437 24.193 15.040 158 HB2 LEU 23 2HB LEU 23 20.430 22.543 17.575 159 HB3 LEU 23 1HB LEU 23 20.454 21.897 15.948 160 HG LEU 23 HG LEU 23 22.654 23.538 17.213 161 HD11 LEU 23 1HD1 LEU 23 22.477 21.335 18.210 162 HD12 LEU 23 2HD1 LEU 23 23.921 21.450 17.207 163 HD13 LEU 23 3HD1 LEU 23 22.498 20.592 16.612 164 HD21 LEU 23 3HD2 LEU 23 22.531 22.121 14.549 165 HD22 LEU 23 1HD2 LEU 23 23.960 22.892 15.236 166 HD23 LEU 23 2HD2 LEU 23 22.561 23.868 14.799 167 H LYS 24 H LYS 24 18.560 23.719 14.089 168 HA LYS 24 HA LYS 24 16.182 23.956 15.798 169 HB2 LYS 24 2HB LYS 24 16.329 24.342 12.814 170 HB3 LYS 24 1HB LYS 24 14.882 24.527 13.785 171 HG2 LYS 24 2HG LYS 24 15.540 26.725 13.479 172 HG3 LYS 24 1HG LYS 24 16.262 26.343 15.032 173 HD2 LYS 24 2HD LYS 24 17.942 27.491 13.838 174 HD3 LYS 24 1HD LYS 24 18.393 25.795 13.740 175 HE2 LYS 24 2HE LYS 24 16.960 27.351 11.562 176 HE3 LYS 24 1HE LYS 24 18.683 27.027 11.588 177 HZ1 LYS 24 3HZ LYS 24 17.603 25.539 10.131 178 HZ2 LYS 24 1HZ LYS 24 16.506 25.017 11.280 179 HZ3 LYS 24 2HZ LYS 24 18.165 24.643 11.403 180 H GLU 25 H GLU 25 17.909 21.582 14.171 181 HA GLU 25 HA GLU 25 15.526 20.212 13.404 182 HB2 GLU 25 2HB GLU 25 17.410 19.900 11.897 183 HB3 GLU 25 1HB GLU 25 18.372 19.209 13.199 184 HG2 GLU 25 2HG GLU 25 17.108 17.239 13.261 185 HG3 GLU 25 1HG GLU 25 15.764 17.961 12.394 186 H MET 26 H MET 26 14.365 19.034 14.509 187 HA MET 26 HA MET 26 15.359 17.871 16.998 188 HB2 MET 26 2HB MET 26 12.903 17.593 17.545 189 HB3 MET 26 1HB MET 26 13.404 19.267 17.375 190 HG2 MET 26 2HG MET 26 12.466 19.312 15.117 191 HG3 MET 26 1HG MET 26 11.958 17.635 15.295 192 HE1 MET 26 3HE MET 26 10.084 20.112 14.426 193 HE2 MET 26 1HE MET 26 8.614 19.666 15.287 194 HE3 MET 26 2HE MET 26 9.585 18.427 14.484 195 H GLU 27 H GLU 27 15.755 15.773 16.976 196 HA GLU 27 HA GLU 27 15.434 14.349 14.543 197 HB2 GLU 27 2HB GLU 27 17.444 13.933 15.726 198 HB3 GLU 27 1HB GLU 27 16.587 13.553 17.214 199 HG2 GLU 27 2HG GLU 27 15.738 11.509 16.260 200 HG3 GLU 27 1HG GLU 27 16.415 11.926 14.696 201 H SER 28 H SER 28 14.033 12.865 13.933 202 HA SER 28 HA SER 28 11.964 12.049 15.782 203 HB2 SER 28 2HB SER 28 12.335 11.381 12.834 204 HB3 SER 28 1HB SER 28 10.875 11.133 13.793 205 HG SER 28 HG SER 28 10.525 13.295 13.869 206 H SER 29 H SER 29 13.131 10.758 17.140 207 HA SER 29 HA SER 29 15.243 9.090 16.425 208 HB2 SER 29 2HB SER 29 14.825 10.064 18.679 209 HB3 SER 29 1HB SER 29 13.474 8.956 18.880 210 HG SER 29 HG SER 29 15.584 8.451 19.787 211 H THR 30 H THR 30 15.308 7.056 15.716 212 HA THR 30 HA THR 30 12.818 5.556 15.744 213 HB THR 30 HB THR 30 13.089 6.381 13.487 214 HG1 THR 30 1HG THR 30 13.446 4.348 12.350 215 HG21 THR 30 3HG2 THR 30 15.834 5.112 13.500 216 HG22 THR 30 1HG2 THR 30 15.482 6.839 13.440 217 HG23 THR 30 2HG2 THR 30 15.050 5.803 12.080 218 H GLY 31 H GLY 31 12.968 3.792 16.834 219 HA2 GLY 31 2HA GLY 31 15.550 2.419 17.112 220 HA3 GLY 31 1HA GLY 31 14.146 2.214 18.167 221 H THR 32 H THR 32 15.249 1.747 14.914 222 HA THR 32 HA THR 32 12.972 0.382 13.956 223 HB THR 32 HB THR 32 15.749 0.259 12.833 224 HG1 THR 32 1HG THR 32 14.022 2.403 13.223 225 HG21 THR 32 3HG2 THR 32 14.017 -1.096 11.709 226 HG22 THR 32 1HG2 THR 32 14.544 0.244 10.691 227 HG23 THR 32 2HG2 THR 32 13.005 0.339 11.548 228 H ALA 33 H ALA 33 12.532 -1.770 13.861 229 HA ALA 33 HA ALA 33 14.251 -3.598 15.277 230 HB1 ALA 33 1HB ALA 33 12.426 -5.217 14.931 231 HB2 ALA 33 2HB ALA 33 11.594 -4.053 13.904 232 HB3 ALA 33 3HB ALA 33 11.814 -3.710 15.622 233 HA PRO 34 HA PRO 34 16.127 -4.882 11.457 234 HB2 PRO 34 2HB PRO 34 16.863 -7.426 12.568 235 HB3 PRO 34 1HB PRO 34 17.898 -6.044 12.191 236 HG2 PRO 34 2HG PRO 34 17.365 -6.882 14.754 237 HG3 PRO 34 1HG PRO 34 17.788 -5.219 14.327 238 HD2 PRO 34 2HD PRO 34 15.114 -6.398 14.922 239 HD3 PRO 34 1HD PRO 34 15.774 -4.798 15.325 240 H ALA 35 H ALA 35 14.619 -5.295 10.046 241 HA ALA 35 HA ALA 35 13.102 -7.774 10.201 242 HB1 ALA 35 1HB ALA 35 11.847 -5.740 9.599 243 HB2 ALA 35 2HB ALA 35 11.808 -6.915 8.284 244 HB3 ALA 35 3HB ALA 35 12.882 -5.519 8.188 245 H SER 36 H SER 36 15.162 -8.888 10.006 246 HA SER 36 HA SER 36 15.759 -9.456 7.237 247 HB2 SER 36 2HB SER 36 17.396 -7.709 8.001 248 HB3 SER 36 1HB SER 36 17.895 -8.788 9.299 249 HG SER 36 HG SER 36 18.203 -9.068 6.517 250 H THR 37 H THR 37 16.356 -11.547 6.969 251 HA THR 37 HA THR 37 16.505 -13.710 7.299 252 HB THR 37 HB THR 37 17.344 -13.178 10.170 253 HG1 THR 37 1HG THR 37 18.542 -12.692 7.730 254 HG21 THR 37 3HG2 THR 37 16.894 -15.536 9.599 255 HG22 THR 37 1HG2 THR 37 18.619 -15.271 9.849 256 HG23 THR 37 2HG2 THR 37 17.978 -15.409 8.213 257 H GLY 38 H GLY 38 14.309 -13.566 6.980 258 HA2 GLY 38 2HA GLY 38 12.641 -15.260 8.012 259 HA3 GLY 38 1HA GLY 38 12.617 -14.080 9.323 260 H ALA 39 H ALA 39 12.973 -11.864 7.654 261 HA ALA 39 HA ALA 39 10.229 -11.317 7.019 262 HB1 ALA 39 1HB ALA 39 11.665 -9.622 8.008 263 HB2 ALA 39 2HB ALA 39 11.086 -9.082 6.430 264 HB3 ALA 39 3HB ALA 39 12.734 -9.690 6.611 265 H GLU 40 H GLU 40 13.233 -11.664 5.205 266 HA GLU 40 HA GLU 40 11.920 -11.330 2.657 267 HB2 GLU 40 2HB GLU 40 14.149 -11.487 1.689 268 HB3 GLU 40 1HB GLU 40 14.174 -10.366 3.032 269 HG2 GLU 40 2HG GLU 40 15.129 -13.219 3.188 270 HG3 GLU 40 1HG GLU 40 16.167 -11.833 2.856 271 H ASN 41 H ASN 41 12.481 -13.716 4.830 272 HA ASN 41 HA ASN 41 13.080 -16.002 3.297 273 HB2 ASN 41 2HB ASN 41 13.288 -15.910 5.744 274 HB3 ASN 41 1HB ASN 41 11.550 -15.780 5.896 275 HD21 ASN 41 1HD2 ASN 41 11.502 -17.609 7.196 276 HD22 ASN 41 2HD2 ASN 41 11.673 -19.200 6.575 277 H LEU 42 H LEU 42 10.060 -14.314 3.887 278 HA LEU 42 HA LEU 42 8.641 -16.344 2.360 279 HB2 LEU 42 2HB LEU 42 7.678 -14.205 4.249 280 HB3 LEU 42 1HB LEU 42 6.607 -15.080 3.196 281 HG LEU 42 HG LEU 42 6.390 -16.010 5.365 282 HD11 LEU 42 1HD1 LEU 42 8.099 -17.877 3.767 283 HD12 LEU 42 2HD1 LEU 42 6.355 -17.655 3.640 284 HD13 LEU 42 3HD1 LEU 42 7.053 -18.325 5.115 285 HD21 LEU 42 3HD2 LEU 42 8.255 -16.912 6.688 286 HD22 LEU 42 1HD2 LEU 42 8.435 -15.180 6.400 287 HD23 LEU 42 2HD2 LEU 42 9.388 -16.333 5.468 288 HA PRO 43 HA PRO 43 8.634 -12.838 -0.580 289 HB2 PRO 43 2HB PRO 43 9.851 -14.067 -2.648 290 HB3 PRO 43 1HB PRO 43 10.764 -13.396 -1.295 291 HG2 PRO 43 2HG PRO 43 10.337 -16.204 -2.011 292 HG3 PRO 43 1HG PRO 43 11.507 -15.510 -0.884 293 HD2 PRO 43 2HD PRO 43 8.899 -16.724 -0.331 294 HD3 PRO 43 1HD PRO 43 10.203 -16.304 0.803 295 H ALA 44 H ALA 44 6.788 -15.334 -0.138 296 HA ALA 44 HA ALA 44 5.099 -14.906 -2.417 297 HB1 ALA 44 1HB ALA 44 6.189 -17.654 -1.781 298 HB2 ALA 44 2HB ALA 44 6.546 -16.721 -3.234 299 HB3 ALA 44 3HB ALA 44 4.908 -17.309 -2.943 300 H GLY 45 H GLY 45 2.976 -15.778 -1.980 301 HA2 GLY 45 2HA GLY 45 1.211 -16.259 -0.561 302 HA3 GLY 45 1HA GLY 45 2.380 -16.778 0.660 303 H SER 46 H SER 46 2.512 -13.763 -0.980 304 HA SER 46 HA SER 46 2.580 -12.366 1.535 305 HB2 SER 46 2HB SER 46 3.028 -11.409 -1.285 306 HB3 SER 46 1HB SER 46 3.448 -10.555 0.198 307 HG SER 46 HG SER 46 5.268 -11.486 -0.267 308 H ALA 47 H ALA 47 1.473 -10.282 1.658 309 HA ALA 47 HA ALA 47 -1.241 -10.396 0.653 310 HB1 ALA 47 1HB ALA 47 -1.603 -8.517 2.203 311 HB2 ALA 47 2HB ALA 47 0.116 -8.513 2.591 312 HB3 ALA 47 3HB ALA 47 -0.883 -9.899 3.026 313 H LEU 48 H LEU 48 -2.117 -8.230 -0.209 314 HA LEU 48 HA LEU 48 -0.036 -6.846 -1.694 315 HB2 LEU 48 2HB LEU 48 -1.058 -7.030 -3.797 316 HB3 LEU 48 1HB LEU 48 -1.065 -8.647 -3.143 317 HG LEU 48 HG LEU 48 -3.487 -6.844 -3.152 318 HD11 LEU 48 1HD1 LEU 48 -4.250 -8.190 -5.049 319 HD12 LEU 48 2HD1 LEU 48 -2.685 -9.007 -5.082 320 HD13 LEU 48 3HD1 LEU 48 -2.785 -7.280 -5.421 321 HD21 LEU 48 3HD2 LEU 48 -3.191 -9.818 -2.738 322 HD22 LEU 48 1HD2 LEU 48 -4.716 -8.936 -2.800 323 HD23 LEU 48 2HD2 LEU 48 -3.576 -8.633 -1.489 324 H LEU 49 H LEU 49 -0.739 -4.891 -2.593 325 HA LEU 49 HA LEU 49 -3.079 -3.784 -1.263 326 HB2 LEU 49 2HB LEU 49 -1.926 -1.596 -1.222 327 HB3 LEU 49 1HB LEU 49 -1.208 -2.779 -0.150 328 HG LEU 49 HG LEU 49 -0.015 -2.164 -2.866 329 HD11 LEU 49 1HD1 LEU 49 1.496 -0.625 -1.695 330 HD12 LEU 49 2HD1 LEU 49 0.545 -0.821 -0.219 331 HD13 LEU 49 3HD1 LEU 49 -0.175 -0.074 -1.649 332 HD21 LEU 49 3HD2 LEU 49 1.163 -3.226 -0.296 333 HD22 LEU 49 1HD2 LEU 49 2.028 -2.978 -1.813 334 HD23 LEU 49 2HD2 LEU 49 0.757 -4.195 -1.713 335 H VAL 50 H VAL 50 -4.456 -2.820 -2.508 336 HA VAL 50 HA VAL 50 -3.626 -2.338 -5.248 337 HB VAL 50 HB VAL 50 -5.990 -2.552 -5.965 338 HG11 VAL 50 1HG1 VAL 50 -4.646 -4.553 -6.047 339 HG12 VAL 50 2HG1 VAL 50 -6.313 -4.956 -5.648 340 HG13 VAL 50 3HG1 VAL 50 -5.081 -4.943 -4.386 341 HG21 VAL 50 3HG2 VAL 50 -6.597 -3.319 -3.109 342 HG22 VAL 50 1HG2 VAL 50 -7.728 -3.421 -4.458 343 HG23 VAL 50 2HG2 VAL 50 -7.131 -1.848 -3.923 344 H VAL 51 H VAL 51 -3.365 -0.320 -5.705 345 HA VAL 51 HA VAL 51 -4.397 1.620 -3.786 346 HB VAL 51 HB VAL 51 -2.487 2.182 -6.082 347 HG11 VAL 51 1HG1 VAL 51 -2.959 3.522 -3.437 348 HG12 VAL 51 2HG1 VAL 51 -3.536 4.078 -5.009 349 HG13 VAL 51 3HG1 VAL 51 -1.806 4.022 -4.671 350 HG21 VAL 51 3HG2 VAL 51 -1.504 0.369 -4.751 351 HG22 VAL 51 1HG2 VAL 51 -1.731 1.322 -3.284 352 HG23 VAL 51 2HG2 VAL 51 -0.620 1.878 -4.535 353 H LYS 52 H LYS 52 -6.222 2.525 -4.182 354 HA LYS 52 HA LYS 52 -7.536 2.240 -6.705 355 HB2 LYS 52 2HB LYS 52 -8.555 2.383 -4.307 356 HB3 LYS 52 1HB LYS 52 -8.379 4.118 -4.496 357 HG2 LYS 52 2HG LYS 52 -10.626 3.504 -5.042 358 HG3 LYS 52 1HG LYS 52 -9.804 3.982 -6.530 359 HD2 LYS 52 2HD LYS 52 -9.426 1.634 -7.103 360 HD3 LYS 52 1HD LYS 52 -10.179 1.134 -5.590 361 HE2 LYS 52 2HE LYS 52 -11.723 0.875 -7.412 362 HE3 LYS 52 1HE LYS 52 -12.282 2.155 -6.344 363 HZ1 LYS 52 3HZ LYS 52 -12.508 2.762 -8.669 364 HZ2 LYS 52 1HZ LYS 52 -10.862 2.539 -8.918 365 HZ3 LYS 52 2HZ LYS 52 -11.393 3.785 -7.930 366 H ARG 53 H ARG 53 -5.981 4.717 -4.883 367 HA ARG 53 HA ARG 53 -4.808 6.016 -7.022 368 HB2 ARG 53 2HB ARG 53 -7.115 6.974 -7.397 369 HB3 ARG 53 1HB ARG 53 -7.060 7.636 -5.763 370 HG2 ARG 53 2HG ARG 53 -5.081 8.964 -6.381 371 HG3 ARG 53 1HG ARG 53 -5.178 8.328 -8.016 372 HD2 ARG 53 2HD ARG 53 -7.380 9.359 -8.288 373 HD3 ARG 53 1HD ARG 53 -7.290 9.988 -6.641 374 HE ARG 53 HE ARG 53 -5.180 10.706 -8.526 375 HH11 ARG 53 1HH1 ARG 53 -8.083 11.756 -6.754 376 HH12 ARG 53 2HH1 ARG 53 -7.731 13.407 -6.926 377 HH21 ARG 53 1HH2 ARG 53 -4.743 12.996 -8.772 378 HH22 ARG 53 2HH2 ARG 53 -5.815 14.127 -8.112 379 H GLY 54 H GLY 54 -2.961 6.361 -6.016 380 HA2 GLY 54 2HA GLY 54 -3.093 7.299 -3.253 381 HA3 GLY 54 1HA GLY 54 -1.931 6.121 -3.832 382 HA PRO 55 HA PRO 55 -0.406 10.572 -4.365 383 HB2 PRO 55 2HB PRO 55 1.430 10.560 -2.378 384 HB3 PRO 55 1HB PRO 55 -0.235 11.098 -2.140 385 HG2 PRO 55 2HG PRO 55 1.021 8.470 -1.481 386 HG3 PRO 55 1HG PRO 55 -0.093 9.455 -0.513 387 HD2 PRO 55 2HD PRO 55 -0.903 7.307 -1.927 388 HD3 PRO 55 1HD PRO 55 -1.935 8.730 -1.685 389 H ASN 56 H ASN 56 0.882 7.473 -3.804 390 HA ASN 56 HA ASN 56 3.390 8.140 -5.040 391 HB2 ASN 56 2HB ASN 56 4.135 5.864 -4.270 392 HB3 ASN 56 1HB ASN 56 3.642 6.937 -2.975 393 HD21 ASN 56 1HD2 ASN 56 3.839 4.045 -3.024 394 HD22 ASN 56 2HD2 ASN 56 2.273 3.443 -2.611 395 H ALA 57 H ALA 57 0.740 5.734 -5.310 396 HA ALA 57 HA ALA 57 1.376 5.337 -8.115 397 HB1 ALA 57 1HB ALA 57 2.702 3.664 -6.931 398 HB2 ALA 57 2HB ALA 57 1.385 2.882 -7.808 399 HB3 ALA 57 3HB ALA 57 1.267 3.120 -6.068 400 H GLY 58 H GLY 58 -0.298 3.422 -8.761 401 HA2 GLY 58 2HA GLY 58 -2.863 3.579 -7.463 402 HA3 GLY 58 1HA GLY 58 -2.787 4.352 -9.038 403 H ALA 59 H ALA 59 -1.239 1.437 -7.764 404 HA ALA 59 HA ALA 59 -2.433 -0.130 -9.909 405 HB1 ALA 59 1HB ALA 59 0.507 -0.023 -9.194 406 HB2 ALA 59 2HB ALA 59 -0.215 0.582 -10.684 407 HB3 ALA 59 3HB ALA 59 -0.216 -1.150 -10.342 408 H ARG 60 H ARG 60 -1.237 -2.528 -9.324 409 HA ARG 60 HA ARG 60 -1.800 -2.925 -6.473 410 HB2 ARG 60 2HB ARG 60 -2.865 -5.077 -7.056 411 HB3 ARG 60 1HB ARG 60 -3.696 -3.673 -7.730 412 HG2 ARG 60 2HG ARG 60 -2.682 -4.123 -9.910 413 HG3 ARG 60 1HG ARG 60 -1.865 -5.533 -9.244 414 HD2 ARG 60 2HD ARG 60 -4.851 -5.139 -9.341 415 HD3 ARG 60 1HD ARG 60 -3.933 -6.078 -10.513 416 HE ARG 60 HE ARG 60 -3.255 -7.230 -8.192 417 HH11 ARG 60 1HH1 ARG 60 -6.390 -6.445 -9.628 418 HH12 ARG 60 2HH1 ARG 60 -7.228 -7.730 -8.902 419 HH21 ARG 60 1HH2 ARG 60 -4.410 -9.089 -7.216 420 HH22 ARG 60 2HH2 ARG 60 -6.060 -9.275 -7.517 421 H PHE 61 H PHE 61 -0.354 -4.179 -5.371 422 HA PHE 61 HA PHE 61 1.343 -5.979 -6.771 423 HB2 PHE 61 2HB PHE 61 3.504 -4.922 -6.038 424 HB3 PHE 61 1HB PHE 61 2.651 -4.072 -7.313 425 HD1 PHE 61 1HD PHE 61 1.587 -1.888 -6.834 426 HD2 PHE 61 2HD PHE 61 3.916 -3.929 -3.910 427 HE1 PHE 61 1HE PHE 61 1.815 0.203 -5.560 428 HE2 PHE 61 2HE PHE 61 4.141 -1.838 -2.631 429 HZ PHE 61 HZ PHE 61 3.091 0.229 -3.456 430 H LEU 62 H LEU 62 2.517 -7.362 -5.553 431 HA LEU 62 HA LEU 62 1.586 -7.740 -2.819 432 HB2 LEU 62 2HB LEU 62 3.132 -9.557 -4.688 433 HB3 LEU 62 1HB LEU 62 2.810 -9.949 -3.022 434 HG LEU 62 HG LEU 62 0.349 -9.873 -3.585 435 HD11 LEU 62 1HD1 LEU 62 1.358 -9.862 -6.425 436 HD12 LEU 62 2HD1 LEU 62 0.446 -8.577 -5.636 437 HD13 LEU 62 3HD1 LEU 62 -0.308 -10.146 -5.920 438 HD21 LEU 62 3HD2 LEU 62 0.351 -12.102 -4.614 439 HD22 LEU 62 1HD2 LEU 62 1.532 -11.966 -3.311 440 HD23 LEU 62 2HD2 LEU 62 2.064 -11.908 -4.990 441 H LEU 63 H LEU 63 2.958 -7.770 -1.051 442 HA LEU 63 HA LEU 63 5.479 -6.418 -1.375 443 HB2 LEU 63 2HB LEU 63 4.304 -7.750 1.081 444 HB3 LEU 63 1HB LEU 63 5.804 -6.860 1.078 445 HG LEU 63 HG LEU 63 4.217 -5.449 2.045 446 HD11 LEU 63 1HD1 LEU 63 5.650 -4.285 0.524 447 HD12 LEU 63 2HD1 LEU 63 4.058 -3.530 0.573 448 HD13 LEU 63 3HD1 LEU 63 4.510 -4.543 -0.797 449 HD21 LEU 63 3HD2 LEU 63 2.054 -4.857 1.047 450 HD22 LEU 63 1HD2 LEU 63 2.172 -6.586 1.373 451 HD23 LEU 63 2HD2 LEU 63 2.358 -5.984 -0.273 452 H ASP 64 H ASP 64 7.236 -7.368 -2.076 453 HA ASP 64 HA ASP 64 7.708 -10.273 -1.584 454 HB2 ASP 64 2HB ASP 64 9.108 -8.505 -3.600 455 HB3 ASP 64 1HB ASP 64 9.168 -10.247 -3.493 456 H GLN 65 H GLN 65 8.379 -7.590 -0.088 457 HA GLN 65 HA GLN 65 11.259 -8.003 0.052 458 HB2 GLN 65 2HB GLN 65 10.957 -6.397 -1.642 459 HB3 GLN 65 1HB GLN 65 9.811 -5.491 -0.684 460 HG2 GLN 65 2HG GLN 65 11.579 -4.751 0.774 461 HG3 GLN 65 1HG GLN 65 12.746 -5.749 -0.109 462 HE21 GLN 65 1HE2 GLN 65 10.563 -3.075 -0.361 463 HE22 GLN 65 2HE2 GLN 65 11.307 -2.346 -1.758 464 HA PRO 66 HA PRO 66 10.672 -7.830 4.458 465 HB2 PRO 66 2HB PRO 66 13.178 -6.728 5.038 466 HB3 PRO 66 1HB PRO 66 12.814 -8.449 4.877 467 HG2 PRO 66 2HG PRO 66 13.949 -6.554 2.872 468 HG3 PRO 66 1HG PRO 66 14.374 -8.246 3.173 469 HD2 PRO 66 2HD PRO 66 12.900 -7.591 1.092 470 HD3 PRO 66 1HD PRO 66 12.492 -9.040 2.035 471 H THR 67 H THR 67 12.608 -5.016 3.482 472 HA THR 67 HA THR 67 10.733 -3.341 4.951 473 HB THR 67 HB THR 67 13.707 -2.920 4.521 474 HG1 THR 67 1HG THR 67 13.907 -3.865 6.379 475 HG21 THR 67 3HG2 THR 67 11.685 -1.234 6.022 476 HG22 THR 67 1HG2 THR 67 12.473 -0.792 4.506 477 HG23 THR 67 2HG2 THR 67 13.424 -0.952 5.985 478 H THR 68 H THR 68 9.494 -2.393 3.526 479 HA THR 68 HA THR 68 10.705 -1.402 1.060 480 HB THR 68 HB THR 68 7.828 -1.955 1.790 481 HG1 THR 68 1HG THR 68 8.673 -3.903 1.457 482 HG21 THR 68 3HG2 THR 68 9.059 -1.220 -0.877 483 HG22 THR 68 1HG2 THR 68 8.058 -0.155 0.112 484 HG23 THR 68 2HG2 THR 68 7.359 -1.608 -0.586 485 H THR 69 H THR 69 11.220 0.718 1.224 486 HA THR 69 HA THR 69 9.748 2.342 3.106 487 HB THR 69 HB THR 69 12.205 2.371 3.323 488 HG1 THR 69 1HG THR 69 11.097 4.231 3.861 489 HG21 THR 69 3HG2 THR 69 12.237 3.535 0.529 490 HG22 THR 69 1HG2 THR 69 12.850 1.949 0.996 491 HG23 THR 69 2HG2 THR 69 13.636 3.409 1.597 492 H ALA 70 H ALA 70 8.464 3.966 2.510 493 HA ALA 70 HA ALA 70 8.206 4.541 -0.346 494 HB1 ALA 70 1HB ALA 70 6.437 3.023 0.402 495 HB2 ALA 70 2HB ALA 70 5.799 4.607 -0.033 496 HB3 ALA 70 3HB ALA 70 5.994 4.171 1.666 497 H GLY 71 H GLY 71 8.430 6.622 -0.718 498 HA2 GLY 71 2HA GLY 71 7.898 8.916 -0.427 499 HA3 GLY 71 1HA GLY 71 7.247 8.515 1.147 500 H ARG 72 H ARG 72 10.379 7.521 0.085 501 HA ARG 72 HA ARG 72 11.563 9.546 1.839 502 HB2 ARG 72 2HB ARG 72 11.605 7.077 2.704 503 HB3 ARG 72 1HB ARG 72 12.753 6.790 1.414 504 HG2 ARG 72 2HG ARG 72 13.167 8.821 3.605 505 HG3 ARG 72 1HG ARG 72 13.772 7.174 3.670 506 HD2 ARG 72 2HD ARG 72 15.152 7.586 1.748 507 HD3 ARG 72 1HD ARG 72 14.497 9.217 1.568 508 HE ARG 72 HE ARG 72 15.480 9.112 4.110 509 HH11 ARG 72 1HH1 ARG 72 16.911 8.616 0.917 510 HH12 ARG 72 2HH1 ARG 72 18.444 9.203 1.338 511 HH21 ARG 72 1HH2 ARG 72 17.567 9.834 4.736 512 HH22 ARG 72 2HH2 ARG 72 18.849 9.862 3.619 513 H HIS 73 H HIS 73 11.882 10.891 0.115 514 HA HIS 73 HA HIS 73 12.858 11.802 -1.679 515 HB2 HIS 73 2HB HIS 73 14.771 9.452 -1.397 516 HB3 HIS 73 1HB HIS 73 14.936 10.753 -2.564 517 HD1 HIS 73 1HD HIS 73 17.288 11.155 -1.415 518 HD2 HIS 73 2HD HIS 73 13.976 11.937 0.962 519 HE1 HIS 73 1HE HIS 73 18.122 12.566 0.526 520 HA PRO 74 HA PRO 74 11.276 9.573 -5.332 521 HB2 PRO 74 2HB PRO 74 13.771 10.247 -6.821 522 HB3 PRO 74 1HB PRO 74 12.094 10.616 -7.236 523 HG2 PRO 74 2HG PRO 74 13.710 12.543 -6.387 524 HG3 PRO 74 1HG PRO 74 12.021 12.484 -5.854 525 HD2 PRO 74 2HD PRO 74 14.497 11.636 -4.406 526 HD3 PRO 74 1HD PRO 74 13.100 12.547 -3.791 527 H GLU 75 H GLU 75 14.345 9.143 -4.035 528 HA GLU 75 HA GLU 75 15.300 6.819 -5.392 529 HB2 GLU 75 2HB GLU 75 16.172 7.986 -2.749 530 HB3 GLU 75 1HB GLU 75 17.099 6.920 -3.792 531 HG2 GLU 75 2HG GLU 75 17.212 8.645 -5.497 532 HG3 GLU 75 1HG GLU 75 16.221 9.712 -4.505 533 H SER 76 H SER 76 12.695 6.962 -3.416 534 HA SER 76 HA SER 76 13.360 4.694 -1.765 535 HB2 SER 76 2HB SER 76 10.884 4.909 -1.063 536 HB3 SER 76 1HB SER 76 11.969 6.222 -0.614 537 HG SER 76 HG SER 76 11.110 7.484 -2.234 538 H ASP 77 H ASP 77 11.450 2.924 -1.723 539 HA ASP 77 HA ASP 77 11.806 1.461 -4.119 540 HB2 ASP 77 2HB ASP 77 11.350 0.468 -1.848 541 HB3 ASP 77 1HB ASP 77 9.692 1.035 -1.992 542 H ILE 78 H ILE 78 8.915 2.837 -2.690 543 HA ILE 78 HA ILE 78 8.065 3.586 -5.347 544 HB ILE 78 HB ILE 78 5.674 3.337 -4.763 545 HG12 ILE 78 2HG1 ILE 78 5.791 3.481 -2.274 546 HG13 ILE 78 1HG1 ILE 78 4.838 2.114 -2.821 547 HG21 ILE 78 1HG2 ILE 78 5.456 0.899 -4.866 548 HG22 ILE 78 2HG2 ILE 78 7.184 0.769 -4.544 549 HG23 ILE 78 3HG2 ILE 78 6.621 1.574 -6.005 550 HD11 ILE 78 3HD1 ILE 78 7.611 2.090 -1.678 551 HD12 ILE 78 1HD1 ILE 78 6.812 0.662 -2.359 552 HD13 ILE 78 2HD1 ILE 78 6.131 1.470 -0.947 553 H PHE 79 H PHE 79 7.679 5.682 -5.530 554 HA PHE 79 HA PHE 79 8.177 7.111 -3.048 555 HB2 PHE 79 2HB PHE 79 9.004 8.992 -4.405 556 HB3 PHE 79 1HB PHE 79 9.901 7.510 -4.678 557 HD1 PHE 79 2HD PHE 79 9.501 6.229 -6.808 558 HD2 PHE 79 1HD PHE 79 7.938 10.134 -6.167 559 HE1 PHE 79 2HE PHE 79 9.174 6.493 -9.230 560 HE2 PHE 79 1HE PHE 79 7.609 10.403 -8.589 561 HZ PHE 79 HZ PHE 79 8.228 8.583 -10.124 562 H LEU 80 H LEU 80 6.668 8.097 -2.096 563 HA LEU 80 HA LEU 80 4.205 8.854 -3.327 564 HB2 LEU 80 2HB LEU 80 5.476 9.651 -0.702 565 HB3 LEU 80 1HB LEU 80 3.965 10.342 -1.239 566 HG LEU 80 HG LEU 80 2.971 8.040 -1.172 567 HD11 LEU 80 1HD1 LEU 80 4.094 6.286 0.051 568 HD12 LEU 80 2HD1 LEU 80 5.534 7.289 0.196 569 HD13 LEU 80 3HD1 LEU 80 5.013 6.725 -1.389 570 HD21 LEU 80 3HD2 LEU 80 2.800 7.960 1.266 571 HD22 LEU 80 1HD2 LEU 80 2.640 9.600 0.641 572 HD23 LEU 80 2HD2 LEU 80 4.150 9.087 1.389 573 H ASP 81 H ASP 81 3.737 10.659 -4.433 574 HA ASP 81 HA ASP 81 5.939 12.594 -4.620 575 HB2 ASP 81 2HB ASP 81 5.632 11.179 -6.631 576 HB3 ASP 81 1HB ASP 81 3.977 11.752 -6.771 577 H ASP 82 H ASP 82 3.576 12.534 -2.856 578 HA ASP 82 HA ASP 82 2.240 14.937 -3.875 579 HB2 ASP 82 2HB ASP 82 0.324 14.424 -2.631 580 HB3 ASP 82 1HB ASP 82 0.889 12.841 -3.136 581 H VAL 83 H VAL 83 1.312 15.870 -1.320 582 HA VAL 83 HA VAL 83 3.759 17.254 -0.564 583 HB VAL 83 HB VAL 83 1.732 18.496 -1.300 584 HG11 VAL 83 1HG1 VAL 83 0.507 17.537 1.261 585 HG12 VAL 83 2HG1 VAL 83 -0.012 17.151 -0.379 586 HG13 VAL 83 3HG1 VAL 83 -0.159 18.803 0.228 587 HG21 VAL 83 3HG2 VAL 83 1.784 20.224 0.461 588 HG22 VAL 83 1HG2 VAL 83 3.397 19.663 0.013 589 HG23 VAL 83 2HG2 VAL 83 2.651 19.098 1.506 590 H THR 84 H THR 84 1.980 14.640 0.598 591 HA THR 84 HA THR 84 2.248 15.258 3.408 592 HB THR 84 HB THR 84 1.342 12.654 2.124 593 HG1 THR 84 1HG THR 84 0.110 14.129 1.251 594 HG21 THR 84 3HG2 THR 84 0.606 13.982 4.751 595 HG22 THR 84 1HG2 THR 84 1.687 12.601 4.584 596 HG23 THR 84 2HG2 THR 84 -0.019 12.441 4.166 597 H VAL 85 H VAL 85 4.537 14.680 1.382 598 HA VAL 85 HA VAL 85 5.744 12.295 2.445 599 HB VAL 85 HB VAL 85 6.780 14.320 0.431 600 HG11 VAL 85 1HG1 VAL 85 8.496 12.647 -0.127 601 HG12 VAL 85 2HG1 VAL 85 7.920 11.610 1.179 602 HG13 VAL 85 3HG1 VAL 85 8.658 13.170 1.547 603 HG21 VAL 85 3HG2 VAL 85 6.293 12.546 -1.188 604 HG22 VAL 85 1HG2 VAL 85 4.856 13.107 -0.329 605 HG23 VAL 85 2HG2 VAL 85 5.608 11.580 0.120 606 H SER 86 H SER 86 6.464 12.389 4.393 607 HA SER 86 HA SER 86 7.553 14.748 5.657 608 HB2 SER 86 2HB SER 86 7.219 11.922 6.675 609 HB3 SER 86 1HB SER 86 7.460 13.375 7.645 610 HG SER 86 HG SER 86 5.202 12.476 6.259 611 H ARG 87 H ARG 87 9.324 13.890 3.551 612 HA ARG 87 HA ARG 87 11.496 13.455 3.052 613 HB2 ARG 87 2HB ARG 87 11.986 13.244 6.053 614 HB3 ARG 87 1HB ARG 87 13.251 13.245 4.840 615 HG2 ARG 87 2HG ARG 87 12.555 15.536 4.186 616 HG3 ARG 87 1HG ARG 87 11.378 15.506 5.497 617 HD2 ARG 87 2HD ARG 87 14.376 15.236 5.811 618 HD3 ARG 87 1HD ARG 87 13.442 16.693 6.133 619 HE ARG 87 HE ARG 87 12.401 14.577 7.650 620 HH11 ARG 87 1HH1 ARG 87 15.275 16.650 7.563 621 HH12 ARG 87 2HH1 ARG 87 15.632 16.519 9.203 622 HH21 ARG 87 1HH2 ARG 87 12.892 14.346 9.913 623 HH22 ARG 87 2HH2 ARG 87 14.208 15.124 10.606 624 H ARG 88 H ARG 88 10.388 11.390 5.630 625 HA ARG 88 HA ARG 88 10.660 9.052 3.933 626 HB2 ARG 88 2HB ARG 88 12.579 9.077 5.614 627 HB3 ARG 88 1HB ARG 88 11.372 9.168 6.889 628 HG2 ARG 88 2HG ARG 88 10.457 7.017 6.200 629 HG3 ARG 88 1HG ARG 88 11.655 6.916 4.912 630 HD2 ARG 88 2HD ARG 88 13.426 7.048 6.648 631 HD3 ARG 88 1HD ARG 88 12.163 6.960 7.873 632 HE ARG 88 HE ARG 88 11.715 4.828 6.220 633 HH11 ARG 88 1HH1 ARG 88 14.290 5.920 8.375 634 HH12 ARG 88 2HH1 ARG 88 14.962 4.384 8.622 635 HH21 ARG 88 1HH2 ARG 88 12.617 2.695 6.521 636 HH22 ARG 88 2HH2 ARG 88 14.022 2.473 7.476 637 H HIS 89 H HIS 89 8.552 8.286 3.889 638 HA HIS 89 HA HIS 89 6.966 9.335 6.088 639 HB2 HIS 89 2HB HIS 89 6.451 10.264 3.833 640 HB3 HIS 89 1HB HIS 89 5.898 8.661 3.353 641 HD2 HIS 89 2HD HIS 89 3.384 8.042 4.061 642 HE1 HIS 89 1HE HIS 89 2.743 11.333 6.621 643 HE2 HIS 89 2HE HIS 89 2.112 8.969 6.039 644 H ALA 90 H ALA 90 6.556 6.527 3.854 645 HA ALA 90 HA ALA 90 5.489 5.174 6.229 646 HB1 ALA 90 1HB ALA 90 3.705 5.761 4.663 647 HB2 ALA 90 2HB ALA 90 3.903 4.014 4.804 648 HB3 ALA 90 3HB ALA 90 4.530 4.861 3.391 649 H GLU 91 H GLU 91 6.015 3.095 6.564 650 HA GLU 91 HA GLU 91 7.943 1.881 4.697 651 HB2 GLU 91 2HB GLU 91 7.764 1.514 7.695 652 HB3 GLU 91 1HB GLU 91 8.938 0.776 6.630 653 HG2 GLU 91 2HG GLU 91 8.721 3.734 7.115 654 HG3 GLU 91 1HG GLU 91 9.799 2.657 7.997 655 H PHE 92 H PHE 92 7.212 0.043 3.914 656 HA PHE 92 HA PHE 92 5.002 -1.360 5.242 657 HB2 PHE 92 2HB PHE 92 6.048 -1.566 2.391 658 HB3 PHE 92 1HB PHE 92 4.776 -2.580 3.048 659 HD1 PHE 92 2HD PHE 92 5.668 0.831 1.986 660 HD2 PHE 92 1HD PHE 92 2.543 -1.770 3.244 661 HE1 PHE 92 2HE PHE 92 4.002 2.487 1.263 662 HE2 PHE 92 1HE PHE 92 0.870 -0.117 2.516 663 HZ PHE 92 HZ PHE 92 1.601 2.012 1.524 664 H ARG 93 H ARG 93 5.675 -3.010 6.491 665 HA ARG 93 HA ARG 93 8.217 -4.253 5.745 666 HB2 ARG 93 2HB ARG 93 7.193 -3.797 8.550 667 HB3 ARG 93 1HB ARG 93 8.724 -4.530 8.103 668 HG2 ARG 93 2HG ARG 93 9.412 -2.371 7.095 669 HG3 ARG 93 1HG ARG 93 7.904 -1.664 7.673 670 HD2 ARG 93 2HD ARG 93 8.561 -2.297 9.989 671 HD3 ARG 93 1HD ARG 93 10.110 -2.851 9.355 672 HE ARG 93 HE ARG 93 9.174 -0.108 9.595 673 HH11 ARG 93 1HH1 ARG 93 11.801 -2.283 8.539 674 HH12 ARG 93 2HH1 ARG 93 12.949 -1.029 8.456 675 HH21 ARG 93 1HH2 ARG 93 10.815 1.567 9.488 676 HH22 ARG 93 2HH2 ARG 93 12.392 1.157 8.958 677 H ILE 94 H ILE 94 8.368 -6.396 5.987 678 HA ILE 94 HA ILE 94 5.923 -7.781 6.791 679 HB ILE 94 HB ILE 94 6.276 -8.243 4.436 680 HG12 ILE 94 2HG1 ILE 94 7.151 -10.597 6.131 681 HG13 ILE 94 1HG1 ILE 94 5.500 -10.151 5.728 682 HG21 ILE 94 1HG2 ILE 94 9.070 -9.080 5.140 683 HG22 ILE 94 2HG2 ILE 94 8.591 -7.637 4.237 684 HG23 ILE 94 3HG2 ILE 94 8.315 -9.241 3.552 685 HD11 ILE 94 3HD1 ILE 94 6.244 -12.056 4.425 686 HD12 ILE 94 1HD1 ILE 94 7.602 -11.122 3.802 687 HD13 ILE 94 2HD1 ILE 94 5.949 -10.670 3.373 688 H ASN 95 H ASN 95 6.046 -9.150 8.367 689 HA ASN 95 HA ASN 95 8.635 -9.877 9.460 690 HB2 ASN 95 2HB ASN 95 7.596 -8.306 10.965 691 HB3 ASN 95 1HB ASN 95 6.024 -9.051 10.758 692 HD21 ASN 95 1HD2 ASN 95 9.131 -9.308 12.305 693 HD22 ASN 95 2HD2 ASN 95 8.641 -10.443 13.500 694 H GLU 96 H GLU 96 8.694 -12.117 10.188 695 HA GLU 96 HA GLU 96 7.158 -13.742 8.481 696 HB2 GLU 96 2HB GLU 96 8.222 -15.713 9.564 697 HB3 GLU 96 1HB GLU 96 9.372 -14.521 9.010 698 HG2 GLU 96 2HG GLU 96 8.484 -14.744 11.876 699 HG3 GLU 96 1HG GLU 96 9.840 -15.641 11.223 700 H GLY 97 H GLY 97 6.292 -12.419 11.399 701 HA2 GLY 97 2HA GLY 97 4.250 -14.462 11.871 702 HA3 GLY 97 1HA GLY 97 4.716 -13.184 12.988 703 H GLU 98 H GLU 98 4.605 -10.963 11.160 704 HA GLU 98 HA GLU 98 1.788 -10.876 10.367 705 HB2 GLU 98 2HB GLU 98 3.116 -8.981 12.291 706 HB3 GLU 98 1HB GLU 98 1.601 -8.656 11.479 707 HG2 GLU 98 2HG GLU 98 2.123 -10.909 13.397 708 HG3 GLU 98 1HG GLU 98 1.323 -9.391 13.789 709 H PHE 99 H PHE 99 1.307 -8.990 9.127 710 HA PHE 99 HA PHE 99 3.636 -7.787 7.778 711 HB2 PHE 99 2HB PHE 99 0.754 -8.105 6.864 712 HB3 PHE 99 1HB PHE 99 1.928 -7.112 6.020 713 HD1 PHE 99 1HD PHE 99 1.540 -10.632 7.253 714 HD2 PHE 99 2HD PHE 99 2.959 -8.036 4.194 715 HE1 PHE 99 1HE PHE 99 2.149 -12.583 5.886 716 HE2 PHE 99 2HE PHE 99 3.576 -9.981 2.827 717 HZ PHE 99 HZ PHE 99 3.170 -12.261 3.671 718 H GLU 100 H GLU 100 4.006 -5.678 8.333 719 HA GLU 100 HA GLU 100 1.736 -4.253 9.452 720 HB2 GLU 100 2HB GLU 100 4.477 -4.361 10.657 721 HB3 GLU 100 1HB GLU 100 3.309 -3.107 11.048 722 HG2 GLU 100 2HG GLU 100 1.745 -4.833 11.707 723 HG3 GLU 100 1HG GLU 100 3.001 -6.060 11.493 724 H VAL 101 H VAL 101 1.453 -2.340 8.992 725 HA VAL 101 HA VAL 101 3.416 -1.043 7.241 726 HB VAL 101 HB VAL 101 1.330 -1.382 6.005 727 HG11 VAL 101 1HG1 VAL 101 -0.803 -0.376 6.679 728 HG12 VAL 101 2HG1 VAL 101 -0.069 0.130 8.201 729 HG13 VAL 101 3HG1 VAL 101 -0.244 -1.585 7.838 730 HG21 VAL 101 3HG2 VAL 101 0.789 0.936 5.368 731 HG22 VAL 101 1HG2 VAL 101 2.527 0.679 5.525 732 HG23 VAL 101 2HG2 VAL 101 1.640 1.515 6.797 733 H VAL 102 H VAL 102 4.458 0.603 8.087 734 HA VAL 102 HA VAL 102 3.205 1.902 10.376 735 HB VAL 102 HB VAL 102 5.409 2.217 11.408 736 HG11 VAL 102 1HG1 VAL 102 4.179 0.255 12.052 737 HG12 VAL 102 2HG1 VAL 102 5.905 -0.112 12.015 738 HG13 VAL 102 3HG1 VAL 102 4.858 -0.656 10.705 739 HG21 VAL 102 3HG2 VAL 102 6.822 2.263 9.422 740 HG22 VAL 102 1HG2 VAL 102 6.503 0.549 9.141 741 HG23 VAL 102 2HG2 VAL 102 7.405 1.055 10.569 742 H ASP 103 H ASP 103 3.031 4.086 10.271 743 HA ASP 103 HA ASP 103 4.436 5.329 8.044 744 HB2 ASP 103 2HB ASP 103 1.935 5.476 8.171 745 HB3 ASP 103 1HB ASP 103 2.106 6.348 9.682 746 H VAL 104 H VAL 104 6.172 6.446 8.596 747 HA VAL 104 HA VAL 104 6.619 6.888 11.436 748 HB VAL 104 HB VAL 104 8.978 7.237 10.936 749 HG11 VAL 104 1HG1 VAL 104 9.561 5.003 10.120 750 HG12 VAL 104 2HG1 VAL 104 7.896 4.779 9.589 751 HG13 VAL 104 3HG1 VAL 104 8.254 4.969 11.304 752 HG21 VAL 104 3HG2 VAL 104 8.819 8.333 8.761 753 HG22 VAL 104 1HG2 VAL 104 8.239 6.834 8.034 754 HG23 VAL 104 2HG2 VAL 104 9.884 6.931 8.665 755 H GLY 105 H GLY 105 5.255 8.557 9.036 756 HA2 GLY 105 2HA GLY 105 5.994 11.110 10.260 757 HA3 GLY 105 1HA GLY 105 5.678 10.925 8.528 758 H SER 106 H SER 106 4.061 9.260 11.113 759 HA SER 106 HA SER 106 1.518 9.717 10.024 760 HB2 SER 106 2HB SER 106 0.874 8.621 12.347 761 HB3 SER 106 1HB SER 106 1.586 7.678 11.040 762 HG SER 106 HG SER 106 3.421 7.577 12.046 763 H LEU 107 H LEU 107 3.215 11.930 11.445 764 HA LEU 107 HA LEU 107 1.431 13.117 13.320 765 HB2 LEU 107 2HB LEU 107 3.596 14.408 11.657 766 HB3 LEU 107 1HB LEU 107 2.859 15.084 13.092 767 HG LEU 107 HG LEU 107 4.605 12.621 13.007 768 HD11 LEU 107 1HD1 LEU 107 5.857 14.659 12.613 769 HD12 LEU 107 2HD1 LEU 107 6.222 13.991 14.204 770 HD13 LEU 107 3HD1 LEU 107 5.150 15.382 14.059 771 HD21 LEU 107 3HD2 LEU 107 4.536 12.746 15.458 772 HD22 LEU 107 1HD2 LEU 107 2.931 12.466 14.780 773 HD23 LEU 107 2HD2 LEU 107 3.379 14.072 15.354 774 H ASN 108 H ASN 108 1.665 12.955 9.903 775 HA ASN 108 HA ASN 108 0.003 15.241 9.321 776 HB2 ASN 108 2HB ASN 108 0.662 12.866 7.545 777 HB3 ASN 108 1HB ASN 108 -0.143 14.330 7.020 778 HD21 ASN 108 1HD2 ASN 108 2.857 12.844 7.847 779 HD22 ASN 108 2HD2 ASN 108 3.878 14.087 7.282 780 H GLY 109 H GLY 109 -0.600 12.256 10.648 781 HA2 GLY 109 2HA GLY 109 -2.669 11.494 11.394 782 HA3 GLY 109 1HA GLY 109 -3.458 12.572 10.248 783 H THR 110 H THR 110 -1.590 9.563 10.458 784 HA THR 110 HA THR 110 -2.405 8.743 7.845 785 HB THR 110 HB THR 110 -1.078 7.090 10.049 786 HG1 THR 110 1HG THR 110 0.586 8.127 8.223 787 HG21 THR 110 3HG2 THR 110 -0.986 6.958 7.017 788 HG22 THR 110 1HG2 THR 110 -1.953 5.885 8.029 789 HG23 THR 110 2HG2 THR 110 -0.194 5.857 8.143 790 H TYR 111 H TYR 111 -4.321 7.676 7.404 791 HA TYR 111 HA TYR 111 -5.796 6.750 9.759 792 HB2 TYR 111 2HB TYR 111 -6.906 7.760 7.137 793 HB3 TYR 111 1HB TYR 111 -7.826 7.228 8.536 794 HD1 TYR 111 2HD TYR 111 -7.434 8.565 10.724 795 HD2 TYR 111 1HD TYR 111 -6.406 10.011 6.867 796 HE1 TYR 111 2HE TYR 111 -7.433 10.852 11.594 797 HE2 TYR 111 1HE TYR 111 -6.400 12.319 7.729 798 HH TYR 111 HH TYR 111 -6.409 12.995 11.040 799 H VAL 112 H VAL 112 -6.372 4.675 9.756 800 HA VAL 112 HA VAL 112 -6.440 3.382 7.159 801 HB VAL 112 HB VAL 112 -6.212 1.175 8.326 802 HG11 VAL 112 1HG1 VAL 112 -3.963 3.103 8.872 803 HG12 VAL 112 2HG1 VAL 112 -4.243 2.218 7.373 804 HG13 VAL 112 3HG1 VAL 112 -3.819 1.345 8.847 805 HG21 VAL 112 3HG2 VAL 112 -5.641 2.842 10.778 806 HG22 VAL 112 1HG2 VAL 112 -5.425 1.095 10.663 807 HG23 VAL 112 2HG2 VAL 112 -7.040 1.796 10.542 808 H ASN 113 H ASN 113 -8.260 3.235 6.438 809 HA ASN 113 HA ASN 113 -10.478 3.320 6.108 810 HB2 ASN 113 2HB ASN 113 -10.059 1.037 7.153 811 HB3 ASN 113 1HB ASN 113 -10.659 1.725 8.654 812 HD21 ASN 113 1HD2 ASN 113 -12.232 0.180 8.612 813 HD22 ASN 113 2HD2 ASN 113 -13.606 0.312 7.582 814 H ARG 114 H ARG 114 -9.325 5.412 7.404 815 HA ARG 114 HA ARG 114 -9.813 7.433 8.161 816 HB2 ARG 114 2HB ARG 114 -12.570 6.412 8.840 817 HB3 ARG 114 1HB ARG 114 -12.060 8.078 9.063 818 HG2 ARG 114 2HG ARG 114 -11.594 8.175 6.604 819 HG3 ARG 114 1HG ARG 114 -12.323 6.574 6.465 820 HD2 ARG 114 2HD ARG 114 -14.006 8.207 5.944 821 HD3 ARG 114 1HD ARG 114 -14.372 7.492 7.517 822 HE ARG 114 HE ARG 114 -12.959 10.048 7.302 823 HH11 ARG 114 1HH1 ARG 114 -15.757 8.214 8.510 824 HH12 ARG 114 2HH1 ARG 114 -16.322 9.459 9.512 825 HH21 ARG 114 1HH2 ARG 114 -13.801 11.797 8.653 826 HH22 ARG 114 2HH2 ARG 114 -15.196 11.544 9.579 827 H GLU 115 H GLU 115 -9.350 4.844 9.999 828 HA GLU 115 HA GLU 115 -9.578 6.209 12.553 829 HB2 GLU 115 2HB GLU 115 -10.223 3.838 12.355 830 HB3 GLU 115 1HB GLU 115 -8.605 3.438 11.813 831 HG2 GLU 115 2HG GLU 115 -8.933 2.806 14.129 832 HG3 GLU 115 1HG GLU 115 -7.717 4.074 13.989 833 HA PRO 116 HA PRO 116 -5.357 7.718 11.832 834 HB2 PRO 116 2HB PRO 116 -5.082 8.987 14.238 835 HB3 PRO 116 1HB PRO 116 -5.931 9.690 12.859 836 HG2 PRO 116 2HG PRO 116 -7.038 8.315 15.268 837 HG3 PRO 116 1HG PRO 116 -7.640 9.749 14.418 838 HD2 PRO 116 2HD PRO 116 -8.736 7.296 14.108 839 HD3 PRO 116 1HD PRO 116 -8.709 8.502 12.806 840 H ARG 117 H ARG 117 -3.637 6.464 12.034 841 HA ARG 117 HA ARG 117 -3.096 5.146 14.603 842 HB2 ARG 117 2HB ARG 117 -2.976 3.760 11.910 843 HB3 ARG 117 1HB ARG 117 -2.496 3.057 13.447 844 HG2 ARG 117 2HG ARG 117 -5.288 3.980 12.812 845 HG3 ARG 117 1HG ARG 117 -4.713 2.331 12.599 846 HD2 ARG 117 2HD ARG 117 -4.500 3.719 15.248 847 HD3 ARG 117 1HD ARG 117 -5.996 2.941 14.739 848 HE ARG 117 HE ARG 117 -3.507 1.398 14.733 849 HH11 ARG 117 1HH1 ARG 117 -6.587 2.119 16.294 850 HH12 ARG 117 2HH1 ARG 117 -6.810 0.552 16.928 851 HH21 ARG 117 1HH2 ARG 117 -3.792 -0.764 15.673 852 HH22 ARG 117 2HH2 ARG 117 -5.218 -1.094 16.576 853 H ASN 118 H ASN 118 -0.922 4.366 14.717 854 HA ASN 118 HA ASN 118 1.027 6.082 13.337 855 HB2 ASN 118 2HB ASN 118 1.142 6.065 15.779 856 HB3 ASN 118 1HB ASN 118 1.198 4.313 15.797 857 HD21 ASN 118 1HD2 ASN 118 3.070 6.395 13.608 858 HD22 ASN 118 2HD2 ASN 118 4.593 5.979 14.280 859 H ALA 119 H ALA 119 0.302 2.750 14.203 860 HA ALA 119 HA ALA 119 1.731 1.756 11.872 861 HB1 ALA 119 1HB ALA 119 2.043 0.809 14.726 862 HB2 ALA 119 2HB ALA 119 3.305 1.530 13.725 863 HB3 ALA 119 3HB ALA 119 2.638 -0.054 13.313 864 H GLN 120 H GLN 120 0.663 -0.026 11.031 865 HA GLN 120 HA GLN 120 -1.589 -0.981 12.592 866 HB2 GLN 120 2HB GLN 120 -2.535 0.688 11.104 867 HB3 GLN 120 1HB GLN 120 -1.759 -0.061 9.719 868 HG2 GLN 120 2HG GLN 120 -4.119 -0.616 9.752 869 HG3 GLN 120 1HG GLN 120 -3.150 -2.056 10.025 870 HE21 GLN 120 1HE2 GLN 120 -5.873 -1.606 10.638 871 HE22 GLN 120 2HE2 GLN 120 -6.088 -1.831 12.340 872 H VAL 121 H VAL 121 -2.114 -3.021 12.318 873 HA VAL 121 HA VAL 121 -0.195 -4.676 10.901 874 HB VAL 121 HB VAL 121 -0.652 -5.278 13.272 875 HG11 VAL 121 1HG1 VAL 121 -3.500 -5.713 12.410 876 HG12 VAL 121 2HG1 VAL 121 -2.910 -4.480 13.523 877 HG13 VAL 121 3HG1 VAL 121 -2.826 -6.184 13.969 878 HG21 VAL 121 3HG2 VAL 121 -1.178 -7.665 12.969 879 HG22 VAL 121 1HG2 VAL 121 -0.030 -7.074 11.768 880 HG23 VAL 121 2HG2 VAL 121 -1.719 -7.317 11.325 881 H MET 122 H MET 122 -0.760 -5.809 9.146 882 HA MET 122 HA MET 122 -2.611 -4.931 7.396 883 HB2 MET 122 2HB MET 122 -2.453 -6.941 6.112 884 HB3 MET 122 1HB MET 122 -0.879 -6.604 6.807 885 HG2 MET 122 2HG MET 122 -1.138 -8.373 8.398 886 HG3 MET 122 1HG MET 122 -2.832 -8.588 7.961 887 HE1 MET 122 3HE MET 122 -1.312 -11.908 6.645 888 HE2 MET 122 1HE MET 122 -2.601 -11.156 7.588 889 HE3 MET 122 2HE MET 122 -0.928 -11.034 8.130 890 H GLN 123 H GLN 123 -4.670 -4.825 7.215 891 HA GLN 123 HA GLN 123 -6.309 -6.877 8.429 892 HB2 GLN 123 2HB GLN 123 -6.382 -4.796 9.790 893 HB3 GLN 123 1HB GLN 123 -6.846 -3.886 8.367 894 HG2 GLN 123 2HG GLN 123 -8.992 -4.855 8.326 895 HG3 GLN 123 1HG GLN 123 -8.509 -6.145 9.422 896 HE21 GLN 123 1HE2 GLN 123 -9.373 -2.724 9.215 897 HE22 GLN 123 2HE2 GLN 123 -9.633 -2.548 10.892 898 H THR 124 H THR 124 -7.599 -7.759 7.011 899 HA THR 124 HA THR 124 -7.187 -7.005 4.289 900 HB THR 124 HB THR 124 -8.583 -9.053 3.803 901 HG1 THR 124 1HG THR 124 -8.897 -8.928 6.584 902 HG21 THR 124 3HG2 THR 124 -6.836 -10.616 4.536 903 HG22 THR 124 1HG2 THR 124 -6.186 -9.380 5.613 904 HG23 THR 124 2HG2 THR 124 -6.141 -9.138 3.866 905 H GLY 125 H GLY 125 -8.384 -5.794 3.094 906 HA2 GLY 125 2HA GLY 125 -10.405 -5.060 2.139 907 HA3 GLY 125 1HA GLY 125 -11.262 -5.636 3.567 908 H ASP 126 H ASP 126 -8.559 -4.093 4.610 909 HA ASP 126 HA ASP 126 -10.171 -1.813 5.380 910 HB2 ASP 126 2HB ASP 126 -8.690 -3.208 6.987 911 HB3 ASP 126 1HB ASP 126 -7.344 -2.332 6.269 912 H GLU 127 H GLU 127 -9.337 0.303 5.119 913 HA GLU 127 HA GLU 127 -7.678 0.458 2.692 914 HB2 GLU 127 2HB GLU 127 -9.950 2.207 3.566 915 HB3 GLU 127 1HB GLU 127 -8.893 2.581 2.212 916 HG2 GLU 127 2HG GLU 127 -9.593 0.625 1.045 917 HG3 GLU 127 1HG GLU 127 -10.518 0.070 2.437 918 H ILE 128 H ILE 128 -5.921 1.606 2.746 919 HA ILE 128 HA ILE 128 -5.306 3.094 5.183 920 HB ILE 128 HB ILE 128 -3.469 2.333 2.871 921 HG12 ILE 128 2HG1 ILE 128 -3.745 1.036 5.605 922 HG13 ILE 128 1HG1 ILE 128 -4.314 0.347 4.089 923 HG21 ILE 128 1HG2 ILE 128 -2.701 4.305 4.098 924 HG22 ILE 128 2HG2 ILE 128 -1.644 2.928 4.419 925 HG23 ILE 128 3HG2 ILE 128 -2.832 3.425 5.621 926 HD11 ILE 128 3HD1 ILE 128 -1.449 0.910 4.812 927 HD12 ILE 128 1HD1 ILE 128 -2.002 0.208 3.292 928 HD13 ILE 128 2HD1 ILE 128 -2.231 -0.670 4.803 929 H GLN 129 H GLN 129 -5.621 5.180 5.115 930 HA GLN 129 HA GLN 129 -5.867 6.464 2.514 931 HB2 GLN 129 2HB GLN 129 -7.503 6.873 5.012 932 HB3 GLN 129 1HB GLN 129 -7.627 7.855 3.557 933 HG2 GLN 129 2HG GLN 129 -8.376 5.964 2.278 934 HG3 GLN 129 1HG GLN 129 -8.097 4.885 3.642 935 HE21 GLN 129 1HE2 GLN 129 -10.203 4.202 3.618 936 HE22 GLN 129 2HE2 GLN 129 -11.512 5.176 4.147 937 H ILE 130 H ILE 130 -4.483 7.930 2.249 938 HA ILE 130 HA ILE 130 -3.543 9.442 4.551 939 HB ILE 130 HB ILE 130 -1.305 9.713 3.324 940 HG12 ILE 130 2HG1 ILE 130 -2.346 7.268 1.859 941 HG13 ILE 130 1HG1 ILE 130 -1.950 8.821 1.138 942 HG21 ILE 130 1HG2 ILE 130 -2.039 7.034 4.486 943 HG22 ILE 130 2HG2 ILE 130 -1.502 8.460 5.371 944 HG23 ILE 130 3HG2 ILE 130 -0.393 7.636 4.273 945 HD11 ILE 130 3HD1 ILE 130 -0.008 6.923 2.441 946 HD12 ILE 130 1HD1 ILE 130 0.402 8.482 1.726 947 HD13 ILE 130 2HD1 ILE 130 -0.212 7.180 0.708 948 H GLY 131 H GLY 131 -3.669 11.537 4.411 949 HA2 GLY 131 2HA GLY 131 -4.369 13.562 3.596 950 HA3 GLY 131 1HA GLY 131 -3.904 12.993 1.986 951 H LYS 132 H LYS 132 -5.409 12.399 0.627 952 HA LYS 132 HA LYS 132 -8.039 11.568 1.607 953 HB2 LYS 132 2HB LYS 132 -7.541 13.526 -0.636 954 HB3 LYS 132 1HB LYS 132 -9.103 12.815 -0.271 955 HG2 LYS 132 2HG LYS 132 -9.041 13.889 1.950 956 HG3 LYS 132 1HG LYS 132 -7.503 14.633 1.515 957 HD2 LYS 132 2HD LYS 132 -10.156 15.067 0.144 958 HD3 LYS 132 1HD LYS 132 -9.342 16.200 1.223 959 HE2 LYS 132 2HE LYS 132 -8.342 15.246 -1.462 960 HE3 LYS 132 1HE LYS 132 -9.017 16.824 -1.103 961 HZ1 LYS 132 3HZ LYS 132 -7.144 17.240 0.395 962 HZ2 LYS 132 1HZ LYS 132 -6.642 16.911 -1.181 963 HZ3 LYS 132 2HZ LYS 132 -6.490 15.736 0.021 964 H PHE 133 H PHE 133 -5.505 10.386 0.458 965 HA PHE 133 HA PHE 133 -6.503 9.256 -2.023 966 HB2 PHE 133 2HB PHE 133 -3.843 9.057 -0.634 967 HB3 PHE 133 1HB PHE 133 -4.266 8.192 -2.107 968 HD1 PHE 133 2HD PHE 133 -4.979 9.621 -4.127 969 HD2 PHE 133 1HD PHE 133 -2.923 11.194 -0.747 970 HE1 PHE 133 2HE PHE 133 -4.236 11.542 -5.475 971 HE2 PHE 133 1HE PHE 133 -2.174 13.116 -2.097 972 HZ PHE 133 HZ PHE 133 -2.835 13.289 -4.458 973 H ARG 134 H ARG 134 -6.548 6.948 -2.333 974 HA ARG 134 HA ARG 134 -7.197 5.544 0.170 975 HB2 ARG 134 2HB ARG 134 -8.761 5.407 -2.414 976 HB3 ARG 134 1HB ARG 134 -9.131 4.540 -0.931 977 HG2 ARG 134 2HG ARG 134 -9.618 6.600 0.213 978 HG3 ARG 134 1HG ARG 134 -9.104 7.539 -1.186 979 HD2 ARG 134 2HD ARG 134 -10.928 6.416 -2.486 980 HD3 ARG 134 1HD ARG 134 -11.494 5.717 -0.966 981 HE ARG 134 HE ARG 134 -11.447 8.221 -0.284 982 HH11 ARG 134 1HH1 ARG 134 -12.783 6.728 -3.199 983 HH12 ARG 134 2HH1 ARG 134 -13.791 8.041 -3.614 984 HH21 ARG 134 1HH2 ARG 134 -12.888 10.043 -0.825 985 HH22 ARG 134 2HH2 ARG 134 -13.862 9.963 -2.216 986 H LEU 135 H LEU 135 -6.085 3.796 0.403 987 HA LEU 135 HA LEU 135 -5.209 2.190 -1.898 988 HB2 LEU 135 2HB LEU 135 -3.401 3.447 -0.758 989 HB3 LEU 135 1HB LEU 135 -3.897 2.786 0.771 990 HG LEU 135 HG LEU 135 -2.715 1.108 -1.460 991 HD11 LEU 135 1HD1 LEU 135 -0.611 1.286 -0.181 992 HD12 LEU 135 2HD1 LEU 135 -1.380 2.439 0.902 993 HD13 LEU 135 3HD1 LEU 135 -1.139 2.849 -0.797 994 HD21 LEU 135 3HD2 LEU 135 -2.176 -0.426 0.434 995 HD22 LEU 135 1HD2 LEU 135 -3.918 -0.199 0.224 996 HD23 LEU 135 2HD2 LEU 135 -3.066 0.651 1.505 997 H VAL 136 H VAL 136 -5.976 0.035 -1.738 998 HA VAL 136 HA VAL 136 -7.377 -0.621 0.774 999 HB VAL 136 HB VAL 136 -7.783 -2.004 -1.883 1000 HG11 VAL 136 1HG1 VAL 136 -8.563 -3.234 0.029 1001 HG12 VAL 136 2HG1 VAL 136 -9.933 -2.686 -0.936 1002 HG13 VAL 136 3HG1 VAL 136 -9.524 -1.855 0.564 1003 HG21 VAL 136 3HG2 VAL 136 -8.320 0.339 -2.277 1004 HG22 VAL 136 1HG2 VAL 136 -9.382 0.367 -0.872 1005 HG23 VAL 136 2HG2 VAL 136 -9.797 -0.623 -2.261 1006 H PHE 137 H PHE 137 -6.586 -2.339 1.936 1007 HA PHE 137 HA PHE 137 -4.343 -3.768 0.688 1008 HB2 PHE 137 2HB PHE 137 -4.048 -2.344 2.821 1009 HB3 PHE 137 1HB PHE 137 -4.914 -3.632 3.645 1010 HD1 PHE 137 2HD PHE 137 -3.887 -5.857 3.886 1011 HD2 PHE 137 1HD PHE 137 -1.818 -2.623 2.054 1012 HE1 PHE 137 2HE PHE 137 -1.765 -7.080 4.113 1013 HE2 PHE 137 1HE PHE 137 0.303 -3.841 2.280 1014 HZ PHE 137 HZ PHE 137 0.330 -6.074 3.315 1015 H LEU 138 H LEU 138 -4.454 -5.943 0.384 1016 HA LEU 138 HA LEU 138 -6.633 -7.457 1.658 1017 HB2 LEU 138 2HB LEU 138 -5.848 -7.581 -1.260 1018 HB3 LEU 138 1HB LEU 138 -6.925 -8.706 -0.484 1019 HG LEU 138 HG LEU 138 -8.258 -7.326 -1.751 1020 HD11 LEU 138 1HD1 LEU 138 -9.230 -7.680 0.380 1021 HD12 LEU 138 2HD1 LEU 138 -9.667 -6.077 -0.211 1022 HD13 LEU 138 3HD1 LEU 138 -8.427 -6.250 1.031 1023 HD21 LEU 138 3HD2 LEU 138 -6.829 -4.913 -0.656 1024 HD22 LEU 138 1HD2 LEU 138 -8.223 -4.867 -1.737 1025 HD23 LEU 138 2HD2 LEU 138 -6.701 -5.565 -2.292 1026 H ALA 139 H ALA 139 -6.256 -9.839 1.352 1027 HA ALA 139 HA ALA 139 -3.420 -10.470 1.696 1028 HB1 ALA 139 1HB ALA 139 -4.990 -11.438 3.325 1029 HB2 ALA 139 2HB ALA 139 -4.234 -12.710 2.366 1030 HB3 ALA 139 3HB ALA 139 -5.885 -12.204 2.013 1031 H GLY 140 H GLY 140 -2.302 -11.815 0.209 1032 HA2 GLY 140 2HA GLY 140 -3.679 -11.950 -2.364 1033 HA3 GLY 140 1HA GLY 140 -1.939 -11.835 -2.137 1034 HA PRO 141 HA PRO 141 -3.193 -16.325 -2.593 1035 HB2 PRO 141 2HB PRO 141 -2.527 -16.763 -5.144 1036 HB3 PRO 141 1HB PRO 141 -4.133 -16.150 -4.711 1037 HG2 PRO 141 2HG PRO 141 -1.757 -14.689 -5.785 1038 HG3 PRO 141 1HG PRO 141 -3.469 -14.476 -6.180 1039 HD2 PRO 141 2HD PRO 141 -2.068 -12.859 -4.451 1040 HD3 PRO 141 1HD PRO 141 -3.825 -13.092 -4.391 1041 H ALA 142 H ALA 142 -1.692 -18.073 -3.011 1042 HA ALA 142 HA ALA 142 1.092 -17.216 -2.881 1043 HB1 ALA 142 1HB ALA 142 0.300 -18.373 -0.867 1044 HB2 ALA 142 2HB ALA 142 1.516 -19.324 -1.717 1045 HB3 ALA 142 3HB ALA 142 -0.188 -19.749 -1.855 1046 H GLU 143 H GLU 143 2.299 -17.721 -4.603 1047 HA GLU 143 HA GLU 143 1.248 -19.226 -6.712 1048 HB2 GLU 143 2HB GLU 143 3.571 -18.871 -7.644 1049 HB3 GLU 143 1HB GLU 143 2.646 -17.413 -7.323 1050 HG2 GLU 143 2HG GLU 143 3.955 -17.102 -5.244 1051 HG3 GLU 143 1HG GLU 143 4.869 -18.559 -5.625 Start of MODEL 21 1 H1 MET 1 1HT MET 1 24.835 39.568 79.227 2 H2 MET 1 2HT MET 1 25.652 39.879 77.818 3 H3 MET 1 3HT MET 1 26.333 40.350 79.289 4 HA MET 1 HA MET 1 27.375 38.435 78.323 5 HB2 MET 1 2HB MET 1 27.213 36.912 80.310 6 HB3 MET 1 1HB MET 1 27.545 38.581 80.716 7 HG2 MET 1 2HG MET 1 25.160 38.872 81.327 8 HG3 MET 1 1HG MET 1 24.891 37.169 80.961 9 HE1 MET 1 2HE MET 1 24.685 37.245 84.885 10 HE2 MET 1 3HE MET 1 23.864 36.783 83.395 11 HE3 MET 1 1HE MET 1 24.112 38.488 83.773 12 H SER 2 H SER 2 26.739 37.502 76.507 13 HA SER 2 HA SER 2 24.359 35.909 76.387 14 HB2 SER 2 2HB SER 2 26.601 36.251 74.377 15 HB3 SER 2 1HB SER 2 25.009 35.555 74.061 16 HG SER 2 HG SER 2 24.109 37.581 74.669 17 H ASP 3 H ASP 3 27.633 35.593 77.136 18 HA ASP 3 HA ASP 3 28.607 33.208 76.427 19 HB2 ASP 3 2HB ASP 3 28.871 34.457 79.153 20 HB3 ASP 3 1HB ASP 3 29.933 33.231 78.478 21 H ASN 4 H ASN 4 28.160 31.168 76.710 22 HA ASN 4 HA ASN 4 26.946 30.283 79.191 23 HB2 ASN 4 2HB ASN 4 25.536 28.647 78.047 24 HB3 ASN 4 1HB ASN 4 25.143 30.240 77.426 25 HD21 ASN 4 1HD2 ASN 4 24.762 27.547 76.291 26 HD22 ASN 4 2HD2 ASN 4 25.526 27.577 74.753 27 H ASN 5 H ASN 5 27.759 28.275 79.844 28 HA ASN 5 HA ASN 5 30.320 27.712 78.623 29 HB2 ASN 5 2HB ASN 5 30.115 27.784 81.105 30 HB3 ASN 5 1HB ASN 5 29.018 26.411 81.025 31 HD21 ASN 5 1HD2 ASN 5 30.325 25.116 82.253 32 HD22 ASN 5 2HD2 ASN 5 31.808 24.452 81.699 33 H GLY 6 H GLY 6 29.854 26.814 76.711 34 HA2 GLY 6 2HA GLY 6 28.015 24.622 76.477 35 HA3 GLY 6 1HA GLY 6 29.071 25.240 75.208 36 H THR 7 H THR 7 28.664 22.512 75.690 37 HA THR 7 HA THR 7 30.771 21.455 77.288 38 HB THR 7 HB THR 7 29.134 20.096 75.134 39 HG1 THR 7 1HG THR 7 28.495 21.070 77.615 40 HG21 THR 7 3HG2 THR 7 29.572 18.066 76.470 41 HG22 THR 7 1HG2 THR 7 30.549 19.012 77.587 42 HG23 THR 7 2HG2 THR 7 31.083 18.798 75.924 43 HA PRO 8 HA PRO 8 33.893 21.950 74.036 44 HB2 PRO 8 2HB PRO 8 35.407 20.044 75.733 45 HB3 PRO 8 1HB PRO 8 35.878 21.655 75.189 46 HG2 PRO 8 2HG PRO 8 35.214 21.202 77.737 47 HG3 PRO 8 1HG PRO 8 34.768 22.711 76.922 48 HD2 PRO 8 2HD PRO 8 33.078 20.317 77.523 49 HD3 PRO 8 1HD PRO 8 32.681 22.048 77.632 50 H GLU 9 H GLU 9 33.922 20.722 72.237 51 HA GLU 9 HA GLU 9 32.914 18.075 72.497 52 HB2 GLU 9 2HB GLU 9 32.751 18.202 69.915 53 HB3 GLU 9 1HB GLU 9 31.632 19.124 70.894 54 HG2 GLU 9 2HG GLU 9 32.285 20.491 69.076 55 HG3 GLU 9 1HG GLU 9 33.063 21.131 70.510 56 HA PRO 10 HA PRO 10 36.787 16.124 71.756 57 HB2 PRO 10 2HB PRO 10 35.441 13.760 70.729 58 HB3 PRO 10 1HB PRO 10 36.263 13.973 72.275 59 HG2 PRO 10 2HG PRO 10 33.575 13.669 72.062 60 HG3 PRO 10 1HG PRO 10 34.343 14.599 73.358 61 HD2 PRO 10 2HD PRO 10 33.032 15.566 70.850 62 HD3 PRO 10 1HD PRO 10 32.939 16.202 72.510 63 H GLN 11 H GLN 11 38.170 15.843 70.137 64 HA GLN 11 HA GLN 11 37.376 16.519 67.444 65 HB2 GLN 11 2HB GLN 11 40.077 15.756 68.580 66 HB3 GLN 11 1HB GLN 11 39.782 16.462 66.996 67 HG2 GLN 11 2HG GLN 11 39.012 18.506 68.020 68 HG3 GLN 11 1HG GLN 11 39.208 17.799 69.626 69 HE21 GLN 11 1HE2 GLN 11 41.271 17.529 70.450 70 HE22 GLN 11 2HE2 GLN 11 42.641 18.323 69.774 71 H VAL 12 H VAL 12 36.705 14.953 66.097 72 HA VAL 12 HA VAL 12 37.196 12.211 66.711 73 HB VAL 12 HB VAL 12 35.045 12.840 65.703 74 HG11 VAL 12 1HG1 VAL 12 35.683 14.714 64.344 75 HG12 VAL 12 2HG1 VAL 12 34.846 13.523 63.347 76 HG13 VAL 12 3HG1 VAL 12 36.603 13.665 63.268 77 HG21 VAL 12 3HG2 VAL 12 35.794 10.574 65.309 78 HG22 VAL 12 1HG2 VAL 12 36.675 11.086 63.869 79 HG23 VAL 12 2HG2 VAL 12 34.915 11.165 63.896 80 H GLU 13 H GLU 13 38.950 11.129 66.211 81 HA GLU 13 HA GLU 13 40.878 12.327 64.454 82 HB2 GLU 13 2HB GLU 13 41.576 11.207 66.553 83 HB3 GLU 13 1HB GLU 13 40.999 9.677 65.905 84 HG2 GLU 13 2HG GLU 13 43.396 9.821 65.674 85 HG3 GLU 13 1HG GLU 13 42.634 9.854 64.081 86 H THR 14 H THR 14 40.989 11.970 62.409 87 HA THR 14 HA THR 14 39.967 9.474 61.366 88 HB THR 14 HB THR 14 38.203 11.008 60.944 89 HG1 THR 14 1HG THR 14 38.616 11.315 58.488 90 HG21 THR 14 3HG2 THR 14 40.232 12.894 59.738 91 HG22 THR 14 1HG2 THR 14 39.397 13.125 61.271 92 HG23 THR 14 2HG2 THR 14 38.486 13.157 59.766 93 H THR 15 H THR 15 41.501 8.443 60.352 94 HA THR 15 HA THR 15 43.766 9.928 59.383 95 HB THR 15 HB THR 15 44.731 7.523 59.126 96 HG1 THR 15 1HG THR 15 42.764 6.937 61.079 97 HG21 THR 15 3HG2 THR 15 45.455 9.095 60.863 98 HG22 THR 15 1HG2 THR 15 45.351 7.460 61.511 99 HG23 THR 15 2HG2 THR 15 44.083 8.633 61.866 100 H SER 16 H SER 16 43.385 10.688 57.413 101 HA SER 16 HA SER 16 41.949 9.131 55.474 102 HB2 SER 16 2HB SER 16 41.644 11.569 55.500 103 HB3 SER 16 1HB SER 16 43.363 11.802 55.196 104 HG SER 16 HG SER 16 41.700 11.810 53.369 105 H VAL 17 H VAL 17 43.015 7.438 54.786 106 HA VAL 17 HA VAL 17 45.856 7.554 54.218 107 HB VAL 17 HB VAL 17 43.914 5.234 53.959 108 HG11 VAL 17 1HG1 VAL 17 45.906 3.813 54.020 109 HG12 VAL 17 2HG1 VAL 17 46.928 5.248 54.093 110 HG13 VAL 17 3HG1 VAL 17 45.954 4.932 52.654 111 HG21 VAL 17 3HG2 VAL 17 44.791 4.448 56.113 112 HG22 VAL 17 1HG2 VAL 17 43.961 5.996 56.263 113 HG23 VAL 17 2HG2 VAL 17 45.720 5.941 56.266 114 H PHE 18 H PHE 18 46.605 7.581 52.192 115 HA PHE 18 HA PHE 18 44.873 8.288 50.051 116 HB2 PHE 18 2HB PHE 18 47.156 9.170 50.116 117 HB3 PHE 18 1HB PHE 18 47.814 7.544 50.045 118 HD1 PHE 18 2HD PHE 18 45.735 9.950 48.131 119 HD2 PHE 18 1HD PHE 18 48.322 6.575 47.978 120 HE1 PHE 18 2HE PHE 18 45.760 10.079 45.677 121 HE2 PHE 18 1HE PHE 18 48.348 6.698 45.524 122 HZ PHE 18 HZ PHE 18 47.065 8.451 44.372 123 H ARG 19 H ARG 19 43.551 6.855 49.275 124 HA ARG 19 HA ARG 19 44.234 4.061 49.244 125 HB2 ARG 19 2HB ARG 19 41.759 5.503 48.295 126 HB3 ARG 19 1HB ARG 19 41.936 3.761 48.409 127 HG2 ARG 19 2HG ARG 19 42.201 3.928 50.828 128 HG3 ARG 19 1HG ARG 19 42.064 5.681 50.724 129 HD2 ARG 19 2HD ARG 19 39.960 4.718 51.401 130 HD3 ARG 19 1HD ARG 19 39.805 5.437 49.800 131 HE ARG 19 HE ARG 19 40.357 2.586 50.003 132 HH11 ARG 19 1HH1 ARG 19 38.016 5.137 49.243 133 HH12 ARG 19 2HH1 ARG 19 36.853 4.088 48.571 134 HH21 ARG 19 1HH2 ARG 19 38.753 1.130 49.050 135 HH22 ARG 19 2HH2 ARG 19 37.298 1.757 48.445 136 H ALA 20 H ALA 20 44.975 2.995 47.536 137 HA ALA 20 HA ALA 20 45.560 4.403 45.102 138 HB1 ALA 20 1HB ALA 20 45.989 1.510 45.863 139 HB2 ALA 20 2HB ALA 20 47.164 2.816 46.064 140 HB3 ALA 20 3HB ALA 20 46.667 2.313 44.447 141 H ASP 21 H ASP 21 43.086 4.609 45.179 142 HA ASP 21 HA ASP 21 41.525 2.430 44.126 143 HB2 ASP 21 2HB ASP 21 40.488 3.970 45.652 144 HB3 ASP 21 1HB ASP 21 40.907 5.341 44.637 145 H LEU 22 H LEU 22 42.719 5.495 42.975 146 HA LEU 22 HA LEU 22 43.272 6.339 41.023 147 HB2 LEU 22 2HB LEU 22 44.681 4.377 40.804 148 HB3 LEU 22 1HB LEU 22 43.349 3.486 40.096 149 HG LEU 22 HG LEU 22 43.397 5.012 38.142 150 HD11 LEU 22 1HD1 LEU 22 44.310 6.999 39.197 151 HD12 LEU 22 2HD1 LEU 22 45.301 6.512 37.824 152 HD13 LEU 22 3HD1 LEU 22 45.841 6.168 39.468 153 HD21 LEU 22 3HD2 LEU 22 44.621 2.904 38.066 154 HD22 LEU 22 1HD2 LEU 22 46.030 3.682 38.784 155 HD23 LEU 22 2HD2 LEU 22 45.483 4.157 37.175 156 H LEU 23 H LEU 23 41.741 7.576 40.373 157 HA LEU 23 HA LEU 23 39.529 6.524 38.834 158 HB2 LEU 23 2HB LEU 23 39.143 8.391 40.411 159 HB3 LEU 23 1HB LEU 23 40.298 9.368 39.524 160 HG LEU 23 HG LEU 23 38.808 9.258 37.542 161 HD11 LEU 23 1HD1 LEU 23 37.632 7.204 38.009 162 HD12 LEU 23 2HD1 LEU 23 36.486 8.529 37.832 163 HD13 LEU 23 3HD1 LEU 23 36.895 7.918 39.441 164 HD21 LEU 23 3HD2 LEU 23 37.133 10.815 38.406 165 HD22 LEU 23 1HD2 LEU 23 38.738 11.171 39.041 166 HD23 LEU 23 2HD2 LEU 23 37.560 10.346 40.054 167 H LYS 24 H LYS 24 39.484 6.628 36.669 168 HA LYS 24 HA LYS 24 41.873 7.684 35.390 169 HB2 LYS 24 2HB LYS 24 41.545 5.959 33.584 170 HB3 LYS 24 1HB LYS 24 42.003 5.298 35.131 171 HG2 LYS 24 2HG LYS 24 39.137 5.368 34.207 172 HG3 LYS 24 1HG LYS 24 40.225 4.058 33.769 173 HD2 LYS 24 2HD LYS 24 39.549 4.855 36.623 174 HD3 LYS 24 1HD LYS 24 38.784 3.548 35.727 175 HE2 LYS 24 2HE LYS 24 40.964 2.418 35.536 176 HE3 LYS 24 1HE LYS 24 41.723 3.735 36.422 177 HZ1 LYS 24 3HZ LYS 24 39.569 2.009 37.511 178 HZ2 LYS 24 1HZ LYS 24 40.451 3.159 38.373 179 HZ3 LYS 24 2HZ LYS 24 41.189 1.755 37.797 180 H GLU 25 H GLU 25 41.308 7.949 32.856 181 HA GLU 25 HA GLU 25 39.487 10.123 32.958 182 HB2 GLU 25 2HB GLU 25 41.555 10.128 31.584 183 HB3 GLU 25 1HB GLU 25 40.838 8.899 30.551 184 HG2 GLU 25 2HG GLU 25 40.668 11.131 29.571 185 HG3 GLU 25 1HG GLU 25 39.081 10.433 29.900 186 H MET 26 H MET 26 37.465 10.250 32.354 187 HA MET 26 HA MET 26 36.036 7.806 31.802 188 HB2 MET 26 2HB MET 26 35.055 10.642 32.187 189 HB3 MET 26 1HB MET 26 34.017 9.242 31.964 190 HG2 MET 26 2HG MET 26 34.810 8.277 34.034 191 HG3 MET 26 1HG MET 26 35.959 9.596 34.239 192 HE1 MET 26 3HE MET 26 32.220 9.856 32.958 193 HE2 MET 26 1HE MET 26 31.360 10.123 34.474 194 HE3 MET 26 2HE MET 26 32.156 8.579 34.172 195 H GLU 27 H GLU 27 36.587 7.233 29.783 196 HA GLU 27 HA GLU 27 36.366 9.073 27.591 197 HB2 GLU 27 2HB GLU 27 37.003 7.125 26.210 198 HB3 GLU 27 1HB GLU 27 38.132 7.449 27.511 199 HG2 GLU 27 2HG GLU 27 37.155 5.634 28.820 200 HG3 GLU 27 1HG GLU 27 36.009 5.314 27.516 201 H SER 28 H SER 28 35.164 8.271 25.608 202 HA SER 28 HA SER 28 32.412 7.958 26.369 203 HB2 SER 28 2HB SER 28 33.704 8.377 23.673 204 HB3 SER 28 1HB SER 28 31.988 8.545 24.022 205 HG SER 28 HG SER 28 33.415 9.963 25.775 206 H SER 29 H SER 29 31.200 6.606 24.427 207 HA SER 29 HA SER 29 31.542 3.948 25.170 208 HB2 SER 29 2HB SER 29 29.998 5.049 22.830 209 HB3 SER 29 1HB SER 29 29.693 3.550 23.707 210 HG SER 29 HG SER 29 28.301 4.998 24.543 211 H THR 30 H THR 30 31.921 2.114 23.738 212 HA THR 30 HA THR 30 34.323 2.352 22.386 213 HB THR 30 HB THR 30 33.755 -0.064 21.621 214 HG1 THR 30 1HG THR 30 31.405 0.456 22.363 215 HG21 THR 30 3HG2 THR 30 35.342 0.485 23.391 216 HG22 THR 30 1HG2 THR 30 34.357 -0.897 23.865 217 HG23 THR 30 2HG2 THR 30 34.018 0.701 24.536 218 H GLY 31 H GLY 31 31.038 2.097 20.955 219 HA2 GLY 31 2HA GLY 31 32.053 3.275 18.568 220 HA3 GLY 31 1HA GLY 31 31.694 1.566 18.374 221 H THR 32 H THR 32 30.239 2.900 16.769 222 HA THR 32 HA THR 32 27.734 3.521 18.124 223 HB THR 32 HB THR 32 28.380 5.399 16.820 224 HG1 THR 32 1HG THR 32 26.201 4.950 16.576 225 HG21 THR 32 3HG2 THR 32 28.770 3.541 14.462 226 HG22 THR 32 1HG2 THR 32 30.050 4.361 15.354 227 HG23 THR 32 2HG2 THR 32 28.902 5.299 14.398 228 H ALA 33 H ALA 33 25.989 2.379 17.764 229 HA ALA 33 HA ALA 33 26.277 -0.077 16.223 230 HB1 ALA 33 1HB ALA 33 24.251 -0.817 17.404 231 HB2 ALA 33 2HB ALA 33 24.123 0.768 18.172 232 HB3 ALA 33 3HB ALA 33 25.493 -0.277 18.533 233 HA PRO 34 HA PRO 34 23.616 1.871 13.175 234 HB2 PRO 34 2HB PRO 34 23.861 0.047 11.232 235 HB3 PRO 34 1HB PRO 34 25.215 1.101 11.657 236 HG2 PRO 34 2HG PRO 34 24.746 -1.759 12.358 237 HG3 PRO 34 1HG PRO 34 26.265 -0.939 11.957 238 HD2 PRO 34 2HD PRO 34 25.356 -1.533 14.538 239 HD3 PRO 34 1HD PRO 34 26.626 -0.362 14.130 240 H ALA 35 H ALA 35 21.753 0.877 11.690 241 HA ALA 35 HA ALA 35 19.913 -0.407 13.472 242 HB1 ALA 35 1HB ALA 35 19.156 1.348 11.925 243 HB2 ALA 35 2HB ALA 35 18.300 -0.164 11.646 244 HB3 ALA 35 3HB ALA 35 19.596 0.328 10.556 245 H SER 36 H SER 36 20.275 -2.497 13.852 246 HA SER 36 HA SER 36 21.292 -4.211 11.778 247 HB2 SER 36 2HB SER 36 22.092 -4.329 14.171 248 HB3 SER 36 1HB SER 36 20.494 -4.896 14.625 249 HG SER 36 HG SER 36 20.861 -6.699 13.175 250 H THR 37 H THR 37 19.735 -4.514 10.308 251 HA THR 37 HA THR 37 17.155 -5.526 11.236 252 HB THR 37 HB THR 37 17.015 -3.390 9.968 253 HG1 THR 37 1HG THR 37 15.227 -4.451 9.642 254 HG21 THR 37 3HG2 THR 37 18.210 -4.959 7.670 255 HG22 THR 37 1HG2 THR 37 18.986 -3.631 8.533 256 HG23 THR 37 2HG2 THR 37 17.550 -3.328 7.556 257 H GLY 38 H GLY 38 16.277 -7.324 10.016 258 HA2 GLY 38 2HA GLY 38 18.430 -8.993 8.884 259 HA3 GLY 38 1HA GLY 38 17.030 -9.615 9.756 260 H ALA 39 H ALA 39 17.471 -7.336 7.090 261 HA ALA 39 HA ALA 39 15.066 -8.138 5.794 262 HB1 ALA 39 1HB ALA 39 15.744 -6.585 4.025 263 HB2 ALA 39 2HB ALA 39 17.352 -6.469 4.740 264 HB3 ALA 39 3HB ALA 39 15.949 -5.858 5.619 265 H GLU 40 H GLU 40 18.328 -9.113 5.650 266 HA GLU 40 HA GLU 40 18.415 -10.307 3.092 267 HB2 GLU 40 2HB GLU 40 20.406 -11.466 3.940 268 HB3 GLU 40 1HB GLU 40 20.437 -9.739 4.261 269 HG2 GLU 40 2HG GLU 40 19.815 -10.109 6.567 270 HG3 GLU 40 1HG GLU 40 19.616 -11.829 6.257 271 H ASN 41 H ASN 41 16.754 -11.278 5.865 272 HA ASN 41 HA ASN 41 17.063 -14.109 5.489 273 HB2 ASN 41 2HB ASN 41 16.532 -13.179 7.726 274 HB3 ASN 41 1HB ASN 41 14.958 -12.671 7.130 275 HD21 ASN 41 1HD2 ASN 41 13.829 -13.967 8.557 276 HD22 ASN 41 2HD2 ASN 41 13.789 -15.682 8.444 277 H LEU 42 H LEU 42 14.603 -11.707 4.710 278 HA LEU 42 HA LEU 42 12.961 -11.584 3.268 279 HB2 LEU 42 2HB LEU 42 14.703 -12.439 1.728 280 HB3 LEU 42 1HB LEU 42 14.154 -14.065 2.046 281 HG LEU 42 HG LEU 42 13.462 -13.198 -0.186 282 HD11 LEU 42 1HD1 LEU 42 11.074 -13.732 -0.118 283 HD12 LEU 42 2HD1 LEU 42 11.135 -13.706 1.644 284 HD13 LEU 42 3HD1 LEU 42 12.061 -14.908 0.747 285 HD21 LEU 42 3HD2 LEU 42 11.868 -11.188 1.381 286 HD22 LEU 42 1HD2 LEU 42 11.773 -11.445 -0.358 287 HD23 LEU 42 2HD2 LEU 42 13.269 -10.849 0.362 288 HA PRO 43 HA PRO 43 10.068 -14.472 5.217 289 HB2 PRO 43 2HB PRO 43 7.959 -12.653 5.093 290 HB3 PRO 43 1HB PRO 43 9.084 -12.825 6.440 291 HG2 PRO 43 2HG PRO 43 8.830 -10.600 4.685 292 HG3 PRO 43 1HG PRO 43 10.046 -10.843 5.944 293 HD2 PRO 43 2HD PRO 43 10.249 -11.250 3.019 294 HD3 PRO 43 1HD PRO 43 11.503 -10.863 4.221 295 H ALA 44 H ALA 44 9.322 -16.044 3.889 296 HA ALA 44 HA ALA 44 8.210 -15.350 1.325 297 HB1 ALA 44 1HB ALA 44 8.097 -17.702 0.866 298 HB2 ALA 44 2HB ALA 44 8.462 -18.093 2.547 299 HB3 ALA 44 3HB ALA 44 9.682 -17.310 1.534 300 H GLY 45 H GLY 45 6.493 -14.193 2.038 301 HA2 GLY 45 2HA GLY 45 4.038 -15.608 2.016 302 HA3 GLY 45 1HA GLY 45 4.355 -14.878 3.603 303 H SER 46 H SER 46 3.489 -14.303 0.377 304 HA SER 46 HA SER 46 4.361 -11.541 0.465 305 HB2 SER 46 2HB SER 46 2.991 -12.933 -1.797 306 HB3 SER 46 1HB SER 46 4.081 -11.556 -1.850 307 HG SER 46 HG SER 46 5.821 -12.861 -1.423 308 H ALA 47 H ALA 47 3.013 -9.849 -0.016 309 HA ALA 47 HA ALA 47 0.117 -10.228 0.256 310 HB1 ALA 47 1HB ALA 47 0.990 -9.537 2.441 311 HB2 ALA 47 2HB ALA 47 0.051 -8.233 1.712 312 HB3 ALA 47 3HB ALA 47 1.814 -8.172 1.688 313 H LEU 48 H LEU 48 -1.001 -8.108 -0.505 314 HA LEU 48 HA LEU 48 0.687 -6.737 -2.387 315 HB2 LEU 48 2HB LEU 48 -0.921 -6.911 -4.255 316 HB3 LEU 48 1HB LEU 48 -0.228 -8.443 -3.819 317 HG LEU 48 HG LEU 48 -2.465 -8.784 -4.482 318 HD11 LEU 48 1HD1 LEU 48 -3.557 -9.811 -2.568 319 HD12 LEU 48 2HD1 LEU 48 -2.350 -9.070 -1.517 320 HD13 LEU 48 3HD1 LEU 48 -1.857 -10.239 -2.740 321 HD21 LEU 48 3HD2 LEU 48 -4.428 -7.752 -3.415 322 HD22 LEU 48 1HD2 LEU 48 -3.395 -6.578 -4.233 323 HD23 LEU 48 2HD2 LEU 48 -3.344 -6.718 -2.478 324 H LEU 49 H LEU 49 0.064 -4.741 -3.038 325 HA LEU 49 HA LEU 49 -2.177 -3.626 -1.571 326 HB2 LEU 49 2HB LEU 49 -0.988 -1.518 -1.185 327 HB3 LEU 49 1HB LEU 49 -0.165 -2.844 -0.440 328 HG LEU 49 HG LEU 49 1.440 -1.336 -1.206 329 HD11 LEU 49 1HD1 LEU 49 2.860 -2.562 -2.710 330 HD12 LEU 49 2HD1 LEU 49 1.500 -3.613 -3.113 331 HD13 LEU 49 3HD1 LEU 49 2.123 -3.570 -1.463 332 HD21 LEU 49 3HD2 LEU 49 1.781 -0.707 -3.606 333 HD22 LEU 49 1HD2 LEU 49 0.363 0.011 -2.847 334 HD23 LEU 49 2HD2 LEU 49 0.178 -1.359 -3.935 335 H VAL 50 H VAL 50 -3.407 -2.211 -2.610 336 HA VAL 50 HA VAL 50 -2.836 -1.829 -5.489 337 HB VAL 50 HB VAL 50 -5.593 -2.281 -4.315 338 HG11 VAL 50 1HG1 VAL 50 -4.687 -2.222 -7.182 339 HG12 VAL 50 2HG1 VAL 50 -5.638 -0.999 -6.347 340 HG13 VAL 50 3HG1 VAL 50 -6.317 -2.601 -6.632 341 HG21 VAL 50 3HG2 VAL 50 -3.872 -4.314 -5.749 342 HG22 VAL 50 1HG2 VAL 50 -5.579 -4.523 -5.354 343 HG23 VAL 50 2HG2 VAL 50 -4.389 -4.366 -4.065 344 H VAL 51 H VAL 51 -3.086 0.270 -6.145 345 HA VAL 51 HA VAL 51 -4.083 2.170 -4.126 346 HB VAL 51 HB VAL 51 -2.847 2.831 -6.855 347 HG11 VAL 51 1HG1 VAL 51 -3.245 4.502 -4.366 348 HG12 VAL 51 2HG1 VAL 51 -4.222 4.583 -5.830 349 HG13 VAL 51 3HG1 VAL 51 -2.520 5.037 -5.885 350 HG21 VAL 51 3HG2 VAL 51 -0.776 3.340 -5.580 351 HG22 VAL 51 1HG2 VAL 51 -1.188 1.618 -5.556 352 HG23 VAL 51 2HG2 VAL 51 -1.523 2.625 -4.152 353 H LYS 52 H LYS 52 -6.051 2.636 -4.112 354 HA LYS 52 HA LYS 52 -7.698 1.725 -6.299 355 HB2 LYS 52 2HB LYS 52 -8.093 1.439 -3.728 356 HB3 LYS 52 1HB LYS 52 -8.741 3.068 -3.833 357 HG2 LYS 52 2HG LYS 52 -10.385 2.305 -5.479 358 HG3 LYS 52 1HG LYS 52 -9.728 0.679 -5.390 359 HD2 LYS 52 2HD LYS 52 -11.631 0.652 -3.987 360 HD3 LYS 52 1HD LYS 52 -10.251 0.746 -2.899 361 HE2 LYS 52 2HE LYS 52 -10.610 3.215 -2.768 362 HE3 LYS 52 1HE LYS 52 -12.066 3.001 -3.739 363 HZ1 LYS 52 3HZ LYS 52 -12.787 3.023 -1.518 364 HZ2 LYS 52 1HZ LYS 52 -11.516 2.050 -1.013 365 HZ3 LYS 52 2HZ LYS 52 -12.773 1.386 -1.904 366 H ARG 53 H ARG 53 -6.602 4.730 -4.864 367 HA ARG 53 HA ARG 53 -7.526 6.192 -7.144 368 HB2 ARG 53 2HB ARG 53 -9.588 6.148 -5.818 369 HB3 ARG 53 1HB ARG 53 -8.717 6.749 -4.416 370 HG2 ARG 53 2HG ARG 53 -8.348 8.880 -5.534 371 HG3 ARG 53 1HG ARG 53 -9.138 8.266 -6.987 372 HD2 ARG 53 2HD ARG 53 -11.220 7.980 -5.756 373 HD3 ARG 53 1HD ARG 53 -10.440 8.545 -4.282 374 HE ARG 53 HE ARG 53 -10.043 10.636 -5.828 375 HH11 ARG 53 1HH1 ARG 53 -13.011 8.698 -5.557 376 HH12 ARG 53 2HH1 ARG 53 -14.045 10.014 -5.807 377 HH21 ARG 53 1HH2 ARG 53 -11.509 12.436 -6.173 378 HH22 ARG 53 2HH2 ARG 53 -13.190 12.150 -6.188 379 H GLY 54 H GLY 54 -6.255 8.001 -7.439 380 HA2 GLY 54 2HA GLY 54 -5.216 9.837 -6.039 381 HA3 GLY 54 1HA GLY 54 -4.352 8.527 -5.279 382 HA PRO 55 HA PRO 55 -2.100 10.079 -9.294 383 HB2 PRO 55 2HB PRO 55 -0.781 12.017 -7.467 384 HB3 PRO 55 1HB PRO 55 -1.324 12.240 -9.138 385 HG2 PRO 55 2HG PRO 55 -2.683 13.343 -7.150 386 HG3 PRO 55 1HG PRO 55 -3.531 12.590 -8.512 387 HD2 PRO 55 2HD PRO 55 -3.010 11.493 -5.772 388 HD3 PRO 55 1HD PRO 55 -4.508 11.499 -6.732 389 H ASN 56 H ASN 56 -1.580 9.144 -6.126 390 HA ASN 56 HA ASN 56 1.110 8.585 -5.733 391 HB2 ASN 56 2HB ASN 56 -1.235 6.729 -5.161 392 HB3 ASN 56 1HB ASN 56 0.362 6.574 -4.454 393 HD21 ASN 56 1HD2 ASN 56 -2.235 6.948 -3.163 394 HD22 ASN 56 2HD2 ASN 56 -2.050 8.391 -2.226 395 H ALA 57 H ALA 57 -1.326 6.468 -7.287 396 HA ALA 57 HA ALA 57 0.106 5.706 -9.498 397 HB1 ALA 57 1HB ALA 57 1.613 4.516 -7.922 398 HB2 ALA 57 2HB ALA 57 0.714 3.383 -8.928 399 HB3 ALA 57 3HB ALA 57 0.225 3.648 -7.256 400 H GLY 58 H GLY 58 -0.945 3.299 -10.035 401 HA2 GLY 58 2HA GLY 58 -3.673 3.078 -9.120 402 HA3 GLY 58 1HA GLY 58 -3.462 3.494 -10.826 403 H ALA 59 H ALA 59 -1.276 1.668 -8.943 404 HA ALA 59 HA ALA 59 -1.716 -0.631 -10.683 405 HB1 ALA 59 1HB ALA 59 0.704 -1.056 -10.451 406 HB2 ALA 59 2HB ALA 59 0.864 0.433 -9.525 407 HB3 ALA 59 3HB ALA 59 0.379 0.498 -11.217 408 H ARG 60 H ARG 60 -0.454 -2.500 -9.525 409 HA ARG 60 HA ARG 60 -1.013 -2.506 -6.687 410 HB2 ARG 60 2HB ARG 60 -2.016 -4.879 -7.149 411 HB3 ARG 60 1HB ARG 60 -3.003 -3.440 -7.409 412 HG2 ARG 60 2HG ARG 60 -2.303 -3.543 -9.824 413 HG3 ARG 60 1HG ARG 60 -1.655 -5.144 -9.483 414 HD2 ARG 60 2HD ARG 60 -3.791 -6.006 -9.003 415 HD3 ARG 60 1HD ARG 60 -4.497 -4.395 -8.850 416 HE ARG 60 HE ARG 60 -3.358 -4.883 -11.412 417 HH11 ARG 60 1HH1 ARG 60 -6.273 -5.591 -9.565 418 HH12 ARG 60 2HH1 ARG 60 -7.333 -5.399 -10.880 419 HH21 ARG 60 1HH2 ARG 60 -4.794 -4.619 -13.217 420 HH22 ARG 60 2HH2 ARG 60 -6.467 -4.824 -13.024 421 H PHE 61 H PHE 61 0.491 -3.581 -5.590 422 HA PHE 61 HA PHE 61 2.614 -4.812 -7.219 423 HB2 PHE 61 2HB PHE 61 2.973 -3.000 -4.831 424 HB3 PHE 61 1HB PHE 61 4.271 -3.851 -5.650 425 HD1 PHE 61 2HD PHE 61 4.970 -3.146 -7.897 426 HD2 PHE 61 1HD PHE 61 1.989 -1.012 -5.731 427 HE1 PHE 61 2HE PHE 61 5.241 -1.226 -9.414 428 HE2 PHE 61 1HE PHE 61 2.255 0.908 -7.240 429 HZ PHE 61 HZ PHE 61 3.887 0.805 -9.089 430 H LEU 62 H LEU 62 3.743 -6.452 -6.320 431 HA LEU 62 HA LEU 62 2.435 -7.806 -4.102 432 HB2 LEU 62 2HB LEU 62 2.678 -8.985 -6.291 433 HB3 LEU 62 1HB LEU 62 4.407 -8.814 -6.173 434 HG LEU 62 HG LEU 62 2.829 -10.437 -4.157 435 HD11 LEU 62 1HD1 LEU 62 2.362 -11.302 -6.396 436 HD12 LEU 62 2HD1 LEU 62 3.395 -12.406 -5.485 437 HD13 LEU 62 3HD1 LEU 62 4.093 -11.373 -6.731 438 HD21 LEU 62 3HD2 LEU 62 5.142 -9.858 -3.529 439 HD22 LEU 62 1HD2 LEU 62 5.723 -10.540 -5.048 440 HD23 LEU 62 2HD2 LEU 62 4.975 -11.587 -3.847 441 H LEU 63 H LEU 63 3.326 -7.598 -2.215 442 HA LEU 63 HA LEU 63 6.048 -6.635 -1.937 443 HB2 LEU 63 2HB LEU 63 3.884 -7.090 0.110 444 HB3 LEU 63 1HB LEU 63 5.462 -6.403 0.439 445 HG LEU 63 HG LEU 63 3.364 -5.180 -1.332 446 HD11 LEU 63 1HD1 LEU 63 3.140 -3.526 0.478 447 HD12 LEU 63 2HD1 LEU 63 4.257 -4.479 1.458 448 HD13 LEU 63 3HD1 LEU 63 2.694 -5.151 0.997 449 HD21 LEU 63 3HD2 LEU 63 6.032 -4.128 -0.386 450 HD22 LEU 63 1HD2 LEU 63 4.821 -3.193 -1.264 451 HD23 LEU 63 2HD2 LEU 63 5.602 -4.564 -2.043 452 H ASP 64 H ASP 64 7.505 -8.015 -1.841 453 HA ASP 64 HA ASP 64 7.123 -10.590 -0.417 454 HB2 ASP 64 2HB ASP 64 7.475 -10.686 -2.939 455 HB3 ASP 64 1HB ASP 64 9.080 -10.028 -2.657 456 H GLN 65 H GLN 65 9.130 -7.872 -1.205 457 HA GLN 65 HA GLN 65 11.356 -8.357 0.389 458 HB2 GLN 65 2HB GLN 65 11.781 -5.913 0.110 459 HB3 GLN 65 1HB GLN 65 11.464 -6.727 -1.404 460 HG2 GLN 65 2HG GLN 65 9.268 -5.254 0.025 461 HG3 GLN 65 1HG GLN 65 10.439 -4.383 -0.947 462 HE21 GLN 65 1HE2 GLN 65 8.817 -3.697 -2.347 463 HE22 GLN 65 2HE2 GLN 65 8.077 -4.725 -3.501 464 HA PRO 66 HA PRO 66 9.543 -7.930 4.406 465 HB2 PRO 66 2HB PRO 66 11.835 -7.295 5.789 466 HB3 PRO 66 1HB PRO 66 11.360 -8.933 5.329 467 HG2 PRO 66 2HG PRO 66 13.265 -7.058 3.984 468 HG3 PRO 66 1HG PRO 66 13.428 -8.804 4.260 469 HD2 PRO 66 2HD PRO 66 12.742 -7.828 1.874 470 HD3 PRO 66 1HD PRO 66 12.025 -9.331 2.491 471 H THR 67 H THR 67 11.607 -5.314 3.198 472 HA THR 67 HA THR 67 10.236 -3.506 5.054 473 HB THR 67 HB THR 67 12.902 -3.089 3.676 474 HG1 THR 67 1HG THR 67 12.223 -4.570 5.822 475 HG21 THR 67 3HG2 THR 67 11.715 -1.012 4.298 476 HG22 THR 67 1HG2 THR 67 13.148 -1.243 5.301 477 HG23 THR 67 2HG2 THR 67 11.547 -1.604 5.949 478 H THR 68 H THR 68 8.728 -2.291 4.097 479 HA THR 68 HA THR 68 9.149 -1.420 1.320 480 HB THR 68 HB THR 68 6.575 -1.781 2.876 481 HG1 THR 68 1HG THR 68 7.938 -3.441 1.039 482 HG21 THR 68 3HG2 THR 68 6.429 -0.071 1.095 483 HG22 THR 68 1HG2 THR 68 5.455 -1.496 0.719 484 HG23 THR 68 2HG2 THR 68 7.009 -1.271 -0.067 485 H THR 69 H THR 69 9.795 0.737 1.365 486 HA THR 69 HA THR 69 8.840 2.390 3.583 487 HB THR 69 HB THR 69 11.076 2.966 1.616 488 HG1 THR 69 1HG THR 69 11.396 1.179 3.007 489 HG21 THR 69 3HG2 THR 69 10.088 4.991 2.657 490 HG22 THR 69 1HG2 THR 69 11.727 4.703 3.242 491 HG23 THR 69 2HG2 THR 69 10.348 4.282 4.251 492 H ALA 70 H ALA 70 7.367 3.916 3.298 493 HA ALA 70 HA ALA 70 6.577 4.692 0.584 494 HB1 ALA 70 1HB ALA 70 4.459 5.367 1.636 495 HB2 ALA 70 2HB ALA 70 5.098 4.906 3.212 496 HB3 ALA 70 3HB ALA 70 4.812 3.673 1.991 497 H GLY 71 H GLY 71 7.109 6.742 -0.046 498 HA2 GLY 71 2HA GLY 71 6.816 9.033 1.405 499 HA3 GLY 71 1HA GLY 71 8.454 8.482 1.756 500 H ARG 72 H ARG 72 9.374 10.233 0.686 501 HA ARG 72 HA ARG 72 9.282 9.881 -2.189 502 HB2 ARG 72 2HB ARG 72 9.372 12.323 -2.587 503 HB3 ARG 72 1HB ARG 72 7.879 11.824 -1.822 504 HG2 ARG 72 2HG ARG 72 8.695 12.629 0.311 505 HG3 ARG 72 1HG ARG 72 10.223 13.123 -0.433 506 HD2 ARG 72 2HD ARG 72 8.951 15.084 -0.316 507 HD3 ARG 72 1HD ARG 72 8.792 14.534 -1.982 508 HE ARG 72 HE ARG 72 6.741 14.004 0.062 509 HH11 ARG 72 1HH1 ARG 72 7.526 14.932 -3.272 510 HH12 ARG 72 2HH1 ARG 72 5.937 15.369 -3.658 511 HH21 ARG 72 1HH2 ARG 72 4.603 14.667 -0.472 512 HH22 ARG 72 2HH2 ARG 72 4.229 15.241 -2.048 513 H HIS 73 H HIS 73 11.079 8.722 -2.037 514 HA HIS 73 HA HIS 73 13.595 10.220 -1.994 515 HB2 HIS 73 2HB HIS 73 13.030 7.690 -0.399 516 HB3 HIS 73 1HB HIS 73 14.641 8.207 -0.825 517 HD1 HIS 73 1HD HIS 73 12.455 8.169 1.926 518 HD2 HIS 73 2HD HIS 73 15.055 10.987 0.332 519 HE1 HIS 73 1HE HIS 73 13.118 9.682 3.836 520 HA PRO 74 HA PRO 74 14.355 7.001 -5.218 521 HB2 PRO 74 2HB PRO 74 16.954 6.407 -3.870 522 HB3 PRO 74 1HB PRO 74 16.665 6.841 -5.558 523 HG2 PRO 74 2HG PRO 74 17.775 8.596 -3.896 524 HG3 PRO 74 1HG PRO 74 16.573 9.119 -5.090 525 HD2 PRO 74 2HD PRO 74 16.239 8.635 -2.155 526 HD3 PRO 74 1HD PRO 74 15.588 9.950 -3.157 527 H GLU 75 H GLU 75 14.813 6.689 -1.883 528 HA GLU 75 HA GLU 75 14.520 3.816 -1.692 529 HB2 GLU 75 2HB GLU 75 14.744 5.961 0.429 530 HB3 GLU 75 1HB GLU 75 14.713 4.228 0.729 531 HG2 GLU 75 2HG GLU 75 16.796 5.620 -0.913 532 HG3 GLU 75 1HG GLU 75 16.973 5.247 0.804 533 H SER 76 H SER 76 12.496 4.315 -2.871 534 HA SER 76 HA SER 76 10.360 4.258 -0.917 535 HB2 SER 76 2HB SER 76 10.262 5.849 -3.508 536 HB3 SER 76 1HB SER 76 8.898 5.598 -2.415 537 HG SER 76 HG SER 76 11.040 6.418 -1.069 538 H ASP 77 H ASP 77 9.524 2.408 -1.055 539 HA ASP 77 HA ASP 77 10.190 0.588 -3.165 540 HB2 ASP 77 2HB ASP 77 9.929 -0.018 -0.742 541 HB3 ASP 77 1HB ASP 77 8.197 0.213 -0.932 542 H ILE 78 H ILE 78 7.413 2.436 -2.198 543 HA ILE 78 HA ILE 78 6.241 1.889 -4.787 544 HB ILE 78 HB ILE 78 3.968 1.956 -3.957 545 HG12 ILE 78 2HG1 ILE 78 4.233 3.457 -2.004 546 HG13 ILE 78 1HG1 ILE 78 3.304 2.029 -1.602 547 HG21 ILE 78 1HG2 ILE 78 3.797 -0.132 -2.682 548 HG22 ILE 78 2HG2 ILE 78 5.542 -0.092 -2.437 549 HG23 ILE 78 3HG2 ILE 78 4.883 -0.233 -4.066 550 HD11 ILE 78 3HD1 ILE 78 4.778 2.615 0.200 551 HD12 ILE 78 1HD1 ILE 78 6.171 2.581 -0.884 552 HD13 ILE 78 2HD1 ILE 78 5.311 1.085 -0.514 553 H PHE 79 H PHE 79 4.750 3.732 -5.385 554 HA PHE 79 HA PHE 79 6.113 6.131 -4.458 555 HB2 PHE 79 2HB PHE 79 4.890 5.550 -7.153 556 HB3 PHE 79 1HB PHE 79 5.499 7.127 -6.664 557 HD1 PHE 79 1HD PHE 79 7.912 7.414 -6.186 558 HD2 PHE 79 2HD PHE 79 6.354 3.827 -7.862 559 HE1 PHE 79 1HE PHE 79 10.166 6.786 -6.918 560 HE2 PHE 79 2HE PHE 79 8.612 3.192 -8.600 561 HZ PHE 79 HZ PHE 79 10.519 4.677 -8.125 562 H LEU 80 H LEU 80 5.070 7.826 -3.808 563 HA LEU 80 HA LEU 80 2.159 7.781 -3.823 564 HB2 LEU 80 2HB LEU 80 3.960 8.688 -1.566 565 HB3 LEU 80 1HB LEU 80 2.232 8.919 -1.608 566 HG LEU 80 HG LEU 80 2.065 6.349 -1.606 567 HD11 LEU 80 1HD1 LEU 80 4.364 5.837 -2.182 568 HD12 LEU 80 2HD1 LEU 80 3.930 5.151 -0.616 569 HD13 LEU 80 3HD1 LEU 80 4.920 6.608 -0.697 570 HD21 LEU 80 3HD2 LEU 80 2.251 6.239 0.799 571 HD22 LEU 80 1HD2 LEU 80 1.517 7.762 0.304 572 HD23 LEU 80 2HD2 LEU 80 3.207 7.725 0.819 573 H ASP 81 H ASP 81 1.251 9.730 -4.291 574 HA ASP 81 HA ASP 81 2.934 12.061 -4.471 575 HB2 ASP 81 2HB ASP 81 2.962 10.994 -6.765 576 HB3 ASP 81 1HB ASP 81 1.217 11.213 -6.824 577 H ASP 82 H ASP 82 1.748 12.321 -2.685 578 HA ASP 82 HA ASP 82 -0.985 13.321 -3.098 579 HB2 ASP 82 2HB ASP 82 -0.997 11.341 -1.653 580 HB3 ASP 82 1HB ASP 82 0.259 12.041 -0.641 581 H VAL 83 H VAL 83 -1.481 15.155 -1.654 582 HA VAL 83 HA VAL 83 0.609 17.087 -1.800 583 HB VAL 83 HB VAL 83 -1.742 17.702 -2.219 584 HG11 VAL 83 1HG1 VAL 83 -2.206 17.168 0.708 585 HG12 VAL 83 2HG1 VAL 83 -2.889 16.282 -0.654 586 HG13 VAL 83 3HG1 VAL 83 -3.348 17.961 -0.376 587 HG21 VAL 83 3HG2 VAL 83 -0.560 19.154 0.150 588 HG22 VAL 83 1HG2 VAL 83 -1.830 19.785 -0.901 589 HG23 VAL 83 2HG2 VAL 83 -0.218 19.475 -1.549 590 H THR 84 H THR 84 -0.567 14.985 0.695 591 HA THR 84 HA THR 84 1.036 16.422 2.646 592 HB THR 84 HB THR 84 -0.466 15.058 4.286 593 HG1 THR 84 1HG THR 84 -1.579 14.304 2.021 594 HG21 THR 84 3HG2 THR 84 -2.059 16.944 4.337 595 HG22 THR 84 1HG2 THR 84 -1.444 17.477 2.772 596 HG23 THR 84 2HG2 THR 84 -0.386 17.479 4.185 597 H VAL 85 H VAL 85 1.612 14.027 0.708 598 HA VAL 85 HA VAL 85 2.529 12.194 2.745 599 HB VAL 85 HB VAL 85 1.871 11.128 0.608 600 HG11 VAL 85 1HG1 VAL 85 2.463 12.890 -0.956 601 HG12 VAL 85 2HG1 VAL 85 3.217 11.364 -1.420 602 HG13 VAL 85 3HG1 VAL 85 4.174 12.616 -0.634 603 HG21 VAL 85 3HG2 VAL 85 4.819 10.872 1.176 604 HG22 VAL 85 1HG2 VAL 85 3.860 9.728 0.243 605 HG23 VAL 85 2HG2 VAL 85 3.515 9.976 1.953 606 H SER 86 H SER 86 4.278 12.294 3.778 607 HA SER 86 HA SER 86 5.956 14.577 3.381 608 HB2 SER 86 2HB SER 86 5.039 13.788 5.602 609 HB3 SER 86 1HB SER 86 6.155 12.434 5.507 610 HG SER 86 HG SER 86 6.796 15.195 5.574 611 H ARG 87 H ARG 87 8.360 13.876 4.243 612 HA ARG 87 HA ARG 87 9.724 12.882 1.984 613 HB2 ARG 87 2HB ARG 87 10.761 14.498 3.453 614 HB3 ARG 87 1HB ARG 87 10.630 13.387 4.804 615 HG2 ARG 87 2HG ARG 87 12.279 11.953 3.894 616 HG3 ARG 87 1HG ARG 87 12.313 12.844 2.380 617 HD2 ARG 87 2HD ARG 87 14.238 13.373 3.802 618 HD3 ARG 87 1HD ARG 87 13.233 14.790 3.535 619 HE ARG 87 HE ARG 87 12.243 14.083 5.803 620 HH11 ARG 87 1HH1 ARG 87 15.645 13.627 4.971 621 HH12 ARG 87 2HH1 ARG 87 16.232 14.033 6.511 622 HH21 ARG 87 1HH2 ARG 87 13.050 14.623 7.963 623 HH22 ARG 87 2HH2 ARG 87 14.718 14.591 8.262 624 H ARG 88 H ARG 88 9.279 11.455 5.187 625 HA ARG 88 HA ARG 88 9.461 8.795 4.003 626 HB2 ARG 88 2HB ARG 88 11.620 9.483 5.168 627 HB3 ARG 88 1HB ARG 88 10.683 9.692 6.629 628 HG2 ARG 88 2HG ARG 88 10.169 7.304 6.649 629 HG3 ARG 88 1HG ARG 88 11.110 7.090 5.170 630 HD2 ARG 88 2HD ARG 88 13.115 7.887 6.279 631 HD3 ARG 88 1HD ARG 88 12.203 8.214 7.747 632 HE ARG 88 HE ARG 88 11.954 5.493 7.092 633 HH11 ARG 88 1HH1 ARG 88 14.502 7.735 8.099 634 HH12 ARG 88 2HH1 ARG 88 15.319 6.587 9.054 635 HH21 ARG 88 1HH2 ARG 88 13.090 3.935 8.362 636 HH22 ARG 88 2HH2 ARG 88 14.499 4.382 9.233 637 H HIS 89 H HIS 89 7.317 8.356 4.180 638 HA HIS 89 HA HIS 89 5.854 9.676 6.296 639 HB2 HIS 89 2HB HIS 89 5.216 9.652 3.802 640 HB3 HIS 89 1HB HIS 89 4.658 8.012 4.088 641 HD2 HIS 89 2HD HIS 89 2.443 7.849 5.926 642 HE1 HIS 89 1HE HIS 89 1.390 11.901 5.312 643 HE2 HIS 89 2HE HIS 89 0.837 9.778 6.551 644 H ALA 90 H ALA 90 6.105 6.359 4.992 645 HA ALA 90 HA ALA 90 5.645 5.374 7.679 646 HB1 ALA 90 1HB ALA 90 3.840 3.890 6.986 647 HB2 ALA 90 2HB ALA 90 3.868 4.594 5.368 648 HB3 ALA 90 3HB ALA 90 3.390 5.580 6.751 649 H GLU 91 H GLU 91 6.327 3.291 7.966 650 HA GLU 91 HA GLU 91 7.674 2.062 5.669 651 HB2 GLU 91 2HB GLU 91 8.436 1.785 8.577 652 HB3 GLU 91 1HB GLU 91 9.256 1.056 7.210 653 HG2 GLU 91 2HG GLU 91 9.848 3.321 6.420 654 HG3 GLU 91 1HG GLU 91 9.122 3.975 7.893 655 H PHE 92 H PHE 92 6.901 0.152 5.198 656 HA PHE 92 HA PHE 92 5.144 -1.087 7.142 657 HB2 PHE 92 2HB PHE 92 3.985 -0.596 5.091 658 HB3 PHE 92 1HB PHE 92 5.231 -1.351 4.122 659 HD1 PHE 92 1HD PHE 92 2.835 -2.136 6.848 660 HD2 PHE 92 2HD PHE 92 4.910 -3.520 3.417 661 HE1 PHE 92 1HE PHE 92 1.585 -4.247 6.955 662 HE2 PHE 92 2HE PHE 92 3.662 -5.636 3.514 663 HZ PHE 92 HZ PHE 92 2.004 -6.003 5.285 664 H ARG 93 H ARG 93 5.669 -2.884 8.006 665 HA ARG 93 HA ARG 93 8.098 -4.258 7.130 666 HB2 ARG 93 2HB ARG 93 6.736 -4.247 9.830 667 HB3 ARG 93 1HB ARG 93 8.284 -4.983 9.442 668 HG2 ARG 93 2HG ARG 93 9.261 -2.792 9.060 669 HG3 ARG 93 1HG ARG 93 7.696 -2.030 9.377 670 HD2 ARG 93 2HD ARG 93 9.090 -1.887 11.346 671 HD3 ARG 93 1HD ARG 93 7.730 -2.971 11.648 672 HE ARG 93 HE ARG 93 10.201 -4.191 10.759 673 HH11 ARG 93 1HH1 ARG 93 8.021 -3.557 13.483 674 HH12 ARG 93 2HH1 ARG 93 8.869 -4.597 14.539 675 HH21 ARG 93 1HH2 ARG 93 11.286 -5.646 12.212 676 HH22 ARG 93 2HH2 ARG 93 10.748 -5.778 13.822 677 H ILE 94 H ILE 94 7.688 -6.193 6.279 678 HA ILE 94 HA ILE 94 5.143 -7.404 6.972 679 HB ILE 94 HB ILE 94 4.939 -6.674 4.739 680 HG12 ILE 94 2HG1 ILE 94 4.185 -9.103 5.176 681 HG13 ILE 94 1HG1 ILE 94 4.300 -8.592 3.503 682 HG21 ILE 94 1HG2 ILE 94 7.189 -6.240 4.169 683 HG22 ILE 94 2HG2 ILE 94 6.426 -7.205 2.906 684 HG23 ILE 94 3HG2 ILE 94 7.529 -7.969 4.050 685 HD11 ILE 94 3HD1 ILE 94 6.438 -9.799 3.318 686 HD12 ILE 94 1HD1 ILE 94 5.122 -10.861 3.818 687 HD13 ILE 94 2HD1 ILE 94 6.293 -10.294 5.006 688 H ASN 95 H ASN 95 5.134 -9.220 7.880 689 HA ASN 95 HA ASN 95 7.425 -10.986 7.653 690 HB2 ASN 95 2HB ASN 95 7.278 -10.141 9.949 691 HB3 ASN 95 1HB ASN 95 5.543 -10.418 9.978 692 HD21 ASN 95 1HD2 ASN 95 8.690 -11.914 10.172 693 HD22 ASN 95 2HD2 ASN 95 8.134 -13.442 10.719 694 H GLU 96 H GLU 96 6.798 -13.211 7.359 695 HA GLU 96 HA GLU 96 4.622 -13.441 5.629 696 HB2 GLU 96 2HB GLU 96 5.202 -15.758 5.421 697 HB3 GLU 96 1HB GLU 96 6.676 -14.818 5.501 698 HG2 GLU 96 2HG GLU 96 5.484 -16.518 7.685 699 HG3 GLU 96 1HG GLU 96 6.912 -16.882 6.733 700 H GLY 97 H GLY 97 4.740 -13.672 9.029 701 HA2 GLY 97 2HA GLY 97 2.160 -15.055 9.063 702 HA3 GLY 97 1HA GLY 97 3.231 -14.874 10.447 703 H GLU 98 H GLU 98 3.644 -11.917 9.823 704 HA GLU 98 HA GLU 98 1.029 -10.900 10.464 705 HB2 GLU 98 2HB GLU 98 2.016 -9.731 12.472 706 HB3 GLU 98 1HB GLU 98 1.715 -11.458 12.648 707 HG2 GLU 98 2HG GLU 98 4.125 -11.835 12.166 708 HG3 GLU 98 1HG GLU 98 4.350 -10.085 12.195 709 H PHE 99 H PHE 99 0.977 -8.518 10.485 710 HA PHE 99 HA PHE 99 3.071 -7.417 8.727 711 HB2 PHE 99 2HB PHE 99 0.091 -6.978 8.472 712 HB3 PHE 99 1HB PHE 99 1.333 -6.341 7.395 713 HD1 PHE 99 2HD PHE 99 2.577 -7.996 5.927 714 HD2 PHE 99 1HD PHE 99 -0.867 -9.072 8.181 715 HE1 PHE 99 2HE PHE 99 2.277 -9.992 4.521 716 HE2 PHE 99 1HE PHE 99 -1.170 -11.067 6.781 717 HZ PHE 99 HZ PHE 99 0.407 -11.529 4.943 718 H GLU 100 H GLU 100 3.826 -5.457 9.424 719 HA GLU 100 HA GLU 100 2.192 -3.944 11.357 720 HB2 GLU 100 2HB GLU 100 3.979 -5.112 12.584 721 HB3 GLU 100 1HB GLU 100 5.182 -4.431 11.500 722 HG2 GLU 100 2HG GLU 100 4.560 -2.166 12.292 723 HG3 GLU 100 1HG GLU 100 3.446 -2.906 13.436 724 H VAL 101 H VAL 101 2.072 -1.785 10.936 725 HA VAL 101 HA VAL 101 4.021 -0.746 9.021 726 HB VAL 101 HB VAL 101 1.757 -0.882 7.956 727 HG11 VAL 101 1HG1 VAL 101 -0.044 0.597 8.637 728 HG12 VAL 101 2HG1 VAL 101 0.887 1.058 10.063 729 HG13 VAL 101 3HG1 VAL 101 0.345 -0.610 9.862 730 HG21 VAL 101 3HG2 VAL 101 3.305 0.809 7.170 731 HG22 VAL 101 1HG2 VAL 101 2.735 1.935 8.405 732 HG23 VAL 101 2HG2 VAL 101 1.650 1.421 7.111 733 H VAL 102 H VAL 102 5.144 0.970 9.663 734 HA VAL 102 HA VAL 102 4.228 2.255 12.114 735 HB VAL 102 HB VAL 102 6.617 2.744 12.683 736 HG11 VAL 102 1HG1 VAL 102 7.151 0.499 13.502 737 HG12 VAL 102 2HG1 VAL 102 5.904 -0.176 12.450 738 HG13 VAL 102 3HG1 VAL 102 5.454 0.907 13.762 739 HG21 VAL 102 3HG2 VAL 102 7.607 2.496 10.464 740 HG22 VAL 102 1HG2 VAL 102 7.227 0.774 10.473 741 HG23 VAL 102 2HG2 VAL 102 8.403 1.424 11.619 742 H ASP 103 H ASP 103 4.002 4.298 12.171 743 HA ASP 103 HA ASP 103 4.376 5.829 9.747 744 HB2 ASP 103 2HB ASP 103 2.256 6.099 10.853 745 HB3 ASP 103 1HB ASP 103 3.054 6.407 12.386 746 H VAL 104 H VAL 104 6.081 6.950 9.443 747 HA VAL 104 HA VAL 104 7.595 7.887 11.766 748 HB VAL 104 HB VAL 104 9.652 7.810 10.289 749 HG11 VAL 104 1HG1 VAL 104 9.971 5.388 10.505 750 HG12 VAL 104 2HG1 VAL 104 8.241 5.183 10.772 751 HG13 VAL 104 3HG1 VAL 104 9.220 6.068 11.950 752 HG21 VAL 104 3HG2 VAL 104 9.567 6.326 8.329 753 HG22 VAL 104 1HG2 VAL 104 8.564 7.767 8.112 754 HG23 VAL 104 2HG2 VAL 104 7.814 6.220 8.505 755 H GLY 105 H GLY 105 5.610 8.794 9.398 756 HA2 GLY 105 2HA GLY 105 6.849 11.425 9.060 757 HA3 GLY 105 1HA GLY 105 5.686 10.702 7.952 758 H SER 106 H SER 106 5.855 11.039 11.420 759 HA SER 106 HA SER 106 3.125 11.378 11.874 760 HB2 SER 106 2HB SER 106 5.407 12.270 13.623 761 HB3 SER 106 1HB SER 106 3.771 11.844 14.147 762 HG SER 106 HG SER 106 4.380 9.794 12.865 763 H LEU 107 H LEU 107 5.213 13.501 10.501 764 HA LEU 107 HA LEU 107 4.451 16.063 11.352 765 HB2 LEU 107 2HB LEU 107 5.185 15.076 8.617 766 HB3 LEU 107 1HB LEU 107 5.197 16.743 9.121 767 HG LEU 107 HG LEU 107 7.026 14.528 10.067 768 HD11 LEU 107 1HD1 LEU 107 8.782 15.841 9.008 769 HD12 LEU 107 2HD1 LEU 107 7.573 16.994 8.441 770 HD13 LEU 107 3HD1 LEU 107 7.553 15.333 7.851 771 HD21 LEU 107 3HD2 LEU 107 8.213 16.260 11.333 772 HD22 LEU 107 1HD2 LEU 107 6.565 16.035 11.923 773 HD23 LEU 107 2HD2 LEU 107 6.955 17.421 10.909 774 H ASN 108 H ASN 108 3.038 13.682 9.271 775 HA ASN 108 HA ASN 108 0.674 15.393 8.870 776 HB2 ASN 108 2HB ASN 108 1.784 13.352 6.925 777 HB3 ASN 108 1HB ASN 108 0.333 14.318 6.689 778 HD21 ASN 108 1HD2 ASN 108 0.567 16.530 6.209 779 HD22 ASN 108 2HD2 ASN 108 2.065 17.157 5.625 780 H GLY 109 H GLY 109 2.026 12.156 9.157 781 HA2 GLY 109 2HA GLY 109 1.209 10.473 10.545 782 HA3 GLY 109 1HA GLY 109 -0.325 11.322 10.652 783 H THR 110 H THR 110 0.877 8.564 9.706 784 HA THR 110 HA THR 110 -0.512 8.149 7.225 785 HB THR 110 HB THR 110 0.497 6.109 9.243 786 HG1 THR 110 1HG THR 110 2.196 7.511 8.583 787 HG21 THR 110 3HG2 THR 110 -0.996 5.195 7.503 788 HG22 THR 110 1HG2 THR 110 0.661 4.625 7.287 789 HG23 THR 110 2HG2 THR 110 0.027 5.907 6.256 790 H TYR 111 H TYR 111 -2.710 7.303 7.003 791 HA TYR 111 HA TYR 111 -4.087 7.036 9.576 792 HB2 TYR 111 2HB TYR 111 -5.357 7.757 6.937 793 HB3 TYR 111 1HB TYR 111 -6.035 7.947 8.547 794 HD1 TYR 111 2HD TYR 111 -4.819 9.670 10.096 795 HD2 TYR 111 1HD TYR 111 -4.348 9.551 5.872 796 HE1 TYR 111 2HE TYR 111 -3.985 11.984 10.125 797 HE2 TYR 111 1HE TYR 111 -3.510 11.856 5.891 798 HH TYR 111 HH TYR 111 -2.468 13.341 8.650 799 H VAL 112 H VAL 112 -5.127 5.131 9.865 800 HA VAL 112 HA VAL 112 -5.382 3.400 7.517 801 HB VAL 112 HB VAL 112 -4.887 2.473 10.381 802 HG11 VAL 112 1HG1 VAL 112 -6.297 0.927 9.129 803 HG12 VAL 112 2HG1 VAL 112 -4.705 0.223 9.403 804 HG13 VAL 112 3HG1 VAL 112 -5.113 0.888 7.822 805 HG21 VAL 112 3HG2 VAL 112 -2.851 3.420 9.382 806 HG22 VAL 112 1HG2 VAL 112 -3.038 2.359 7.986 807 HG23 VAL 112 2HG2 VAL 112 -2.700 1.673 9.575 808 H ASN 113 H ASN 113 -7.372 3.297 7.004 809 HA ASN 113 HA ASN 113 -9.558 3.737 6.998 810 HB2 ASN 113 2HB ASN 113 -9.317 1.312 7.649 811 HB3 ASN 113 1HB ASN 113 -9.577 1.815 9.311 812 HD21 ASN 113 1HD2 ASN 113 -11.041 0.078 7.533 813 HD22 ASN 113 2HD2 ASN 113 -12.681 0.635 7.491 814 H ARG 114 H ARG 114 -9.089 5.866 7.677 815 HA ARG 114 HA ARG 114 -9.857 7.769 8.575 816 HB2 ARG 114 2HB ARG 114 -11.571 6.057 10.376 817 HB3 ARG 114 1HB ARG 114 -11.732 7.788 10.151 818 HG2 ARG 114 2HG ARG 114 -12.372 7.454 7.831 819 HG3 ARG 114 1HG ARG 114 -12.101 5.721 7.990 820 HD2 ARG 114 2HD ARG 114 -13.838 5.604 9.708 821 HD3 ARG 114 1HD ARG 114 -14.147 7.328 9.509 822 HE ARG 114 HE ARG 114 -14.396 6.225 7.011 823 HH11 ARG 114 1HH1 ARG 114 -16.016 5.830 10.121 824 HH12 ARG 114 2HH1 ARG 114 -17.485 5.305 9.451 825 HH21 ARG 114 1HH2 ARG 114 -16.434 5.497 6.096 826 HH22 ARG 114 2HH2 ARG 114 -17.729 5.103 7.126 827 H GLU 115 H GLU 115 -8.540 5.371 10.688 828 HA GLU 115 HA GLU 115 -8.151 7.242 12.868 829 HB2 GLU 115 2HB GLU 115 -7.419 4.339 12.554 830 HB3 GLU 115 1HB GLU 115 -7.178 5.279 14.014 831 HG2 GLU 115 2HG GLU 115 -9.843 4.758 12.721 832 HG3 GLU 115 1HG GLU 115 -9.182 3.851 14.083 833 HA PRO 116 HA PRO 116 -3.935 8.226 11.365 834 HB2 PRO 116 2HB PRO 116 -3.914 9.640 13.982 835 HB3 PRO 116 1HB PRO 116 -3.539 10.275 12.380 836 HG2 PRO 116 2HG PRO 116 -5.805 10.949 13.614 837 HG3 PRO 116 1HG PRO 116 -5.771 10.665 11.865 838 HD2 PRO 116 2HD PRO 116 -6.736 8.874 14.058 839 HD3 PRO 116 1HD PRO 116 -7.444 9.187 12.457 840 H ARG 117 H ARG 117 -2.248 6.901 11.812 841 HA ARG 117 HA ARG 117 -2.209 5.558 14.440 842 HB2 ARG 117 2HB ARG 117 -1.549 4.382 11.741 843 HB3 ARG 117 1HB ARG 117 -1.365 3.562 13.280 844 HG2 ARG 117 2HG ARG 117 -4.014 4.535 12.223 845 HG3 ARG 117 1HG ARG 117 -3.374 2.926 11.914 846 HD2 ARG 117 2HD ARG 117 -4.928 2.805 13.746 847 HD3 ARG 117 1HD ARG 117 -3.306 2.532 14.359 848 HE ARG 117 HE ARG 117 -3.951 5.255 14.643 849 HH11 ARG 117 1HH1 ARG 117 -4.878 2.106 15.993 850 HH12 ARG 117 2HH1 ARG 117 -5.318 2.742 17.496 851 HH21 ARG 117 1HH2 ARG 117 -4.534 6.111 16.762 852 HH22 ARG 117 2HH2 ARG 117 -5.118 5.037 17.934 853 H ASN 118 H ASN 118 -0.265 5.319 15.374 854 HA ASN 118 HA ASN 118 2.076 6.509 14.094 855 HB2 ASN 118 2HB ASN 118 1.564 5.531 16.911 856 HB3 ASN 118 1HB ASN 118 3.160 6.013 16.352 857 HD21 ASN 118 1HD2 ASN 118 1.362 7.135 18.393 858 HD22 ASN 118 2HD2 ASN 118 1.185 8.796 17.981 859 H ALA 119 H ALA 119 0.817 3.533 15.354 860 HA ALA 119 HA ALA 119 2.489 2.031 13.558 861 HB1 ALA 119 1HB ALA 119 3.787 1.984 15.649 862 HB2 ALA 119 2HB ALA 119 3.054 0.407 15.357 863 HB3 ALA 119 3HB ALA 119 2.346 1.502 16.543 864 H GLN 120 H GLN 120 1.316 0.291 12.847 865 HA GLN 120 HA GLN 120 -1.219 -0.261 14.185 866 HB2 GLN 120 2HB GLN 120 -1.730 1.395 12.463 867 HB3 GLN 120 1HB GLN 120 -0.919 0.419 11.253 868 HG2 GLN 120 2HG GLN 120 -3.253 0.125 10.968 869 HG3 GLN 120 1HG GLN 120 -2.608 -1.362 11.648 870 HE21 GLN 120 1HE2 GLN 120 -5.268 -0.507 11.677 871 HE22 GLN 120 2HE2 GLN 120 -5.758 -0.305 13.318 872 H VAL 121 H VAL 121 -1.987 -2.344 13.844 873 HA VAL 121 HA VAL 121 -0.094 -4.206 12.640 874 HB VAL 121 HB VAL 121 -2.675 -4.741 14.180 875 HG11 VAL 121 1HG1 VAL 121 -2.119 -6.544 12.636 876 HG12 VAL 121 2HG1 VAL 121 -1.905 -7.057 14.310 877 HG13 VAL 121 3HG1 VAL 121 -0.496 -6.646 13.327 878 HG21 VAL 121 3HG2 VAL 121 0.188 -4.952 15.117 879 HG22 VAL 121 1HG2 VAL 121 -1.230 -5.440 16.043 880 HG23 VAL 121 2HG2 VAL 121 -0.986 -3.742 15.633 881 H MET 122 H MET 122 -0.510 -4.912 10.643 882 HA MET 122 HA MET 122 -2.744 -3.651 9.396 883 HB2 MET 122 2HB MET 122 -0.409 -5.081 8.219 884 HB3 MET 122 1HB MET 122 -1.795 -4.637 7.233 885 HG2 MET 122 2HG MET 122 -0.004 -2.804 8.801 886 HG3 MET 122 1HG MET 122 -0.113 -2.945 7.048 887 HE1 MET 122 3HE MET 122 -3.787 -1.591 6.427 888 HE2 MET 122 1HE MET 122 -3.375 -3.266 6.793 889 HE3 MET 122 2HE MET 122 -2.370 -2.337 5.682 890 H GLN 123 H GLN 123 -4.285 -4.440 8.196 891 HA GLN 123 HA GLN 123 -5.050 -7.194 8.769 892 HB2 GLN 123 2HB GLN 123 -6.322 -5.623 10.117 893 HB3 GLN 123 1HB GLN 123 -6.678 -4.657 8.697 894 HG2 GLN 123 2HG GLN 123 -8.011 -6.493 7.797 895 HG3 GLN 123 1HG GLN 123 -7.658 -7.442 9.242 896 HE21 GLN 123 1HE2 GLN 123 -9.815 -7.546 9.753 897 HE22 GLN 123 2HE2 GLN 123 -10.683 -6.211 10.403 898 H THR 124 H THR 124 -5.769 -8.306 7.043 899 HA THR 124 HA THR 124 -5.417 -7.120 4.462 900 HB THR 124 HB THR 124 -4.634 -9.398 4.753 901 HG1 THR 124 1HG THR 124 -6.612 -10.273 3.198 902 HG21 THR 124 3HG2 THR 124 -6.177 -11.284 5.191 903 HG22 THR 124 1HG2 THR 124 -7.485 -10.129 5.448 904 HG23 THR 124 2HG2 THR 124 -6.108 -10.153 6.548 905 H GLY 125 H GLY 125 -6.954 -6.259 3.251 906 HA2 GLY 125 2HA GLY 125 -9.124 -6.089 2.359 907 HA3 GLY 125 1HA GLY 125 -9.748 -6.957 3.757 908 H ASP 126 H ASP 126 -7.490 -4.452 4.386 909 HA ASP 126 HA ASP 126 -9.724 -2.697 5.058 910 HB2 ASP 126 2HB ASP 126 -8.552 -3.707 7.084 911 HB3 ASP 126 1HB ASP 126 -7.116 -2.806 6.606 912 H GLU 127 H GLU 127 -9.013 -0.356 5.176 913 HA GLU 127 HA GLU 127 -7.343 0.093 2.810 914 HB2 GLU 127 2HB GLU 127 -9.730 0.336 2.393 915 HB3 GLU 127 1HB GLU 127 -9.844 1.520 3.678 916 HG2 GLU 127 2HG GLU 127 -8.459 3.048 2.417 917 HG3 GLU 127 1HG GLU 127 -8.261 1.842 1.143 918 H ILE 128 H ILE 128 -5.837 1.545 2.908 919 HA ILE 128 HA ILE 128 -5.311 2.955 5.431 920 HB ILE 128 HB ILE 128 -3.360 2.349 3.178 921 HG12 ILE 128 2HG1 ILE 128 -2.333 0.702 4.910 922 HG13 ILE 128 1HG1 ILE 128 -3.913 0.750 5.671 923 HG21 ILE 128 1HG2 ILE 128 -2.683 4.233 4.499 924 HG22 ILE 128 2HG2 ILE 128 -1.609 2.872 4.811 925 HG23 ILE 128 3HG2 ILE 128 -2.859 3.302 5.981 926 HD11 ILE 128 3HD1 ILE 128 -3.671 -1.185 4.223 927 HD12 ILE 128 1HD1 ILE 128 -3.339 -0.130 2.849 928 HD13 ILE 128 2HD1 ILE 128 -4.924 -0.098 3.618 929 H GLN 129 H GLN 129 -5.226 5.235 5.325 930 HA GLN 129 HA GLN 129 -5.537 6.259 2.621 931 HB2 GLN 129 2HB GLN 129 -7.379 6.895 4.163 932 HB3 GLN 129 1HB GLN 129 -6.212 7.712 5.198 933 HG2 GLN 129 2HG GLN 129 -5.608 9.177 3.306 934 HG3 GLN 129 1HG GLN 129 -6.859 8.400 2.340 935 HE21 GLN 129 1HE2 GLN 129 -8.034 10.241 2.028 936 HE22 GLN 129 2HE2 GLN 129 -8.878 11.046 3.292 937 H ILE 130 H ILE 130 -3.826 6.952 1.813 938 HA ILE 130 HA ILE 130 -1.716 7.924 3.533 939 HB ILE 130 HB ILE 130 -0.272 7.629 1.420 940 HG12 ILE 130 2HG1 ILE 130 -2.667 5.954 0.585 941 HG13 ILE 130 1HG1 ILE 130 -2.082 7.393 -0.233 942 HG21 ILE 130 1HG2 ILE 130 0.075 5.232 1.863 943 HG22 ILE 130 2HG2 ILE 130 -1.436 5.198 2.771 944 HG23 ILE 130 3HG2 ILE 130 -0.084 6.172 3.347 945 HD11 ILE 130 3HD1 ILE 130 -0.019 6.221 -0.816 946 HD12 ILE 130 1HD1 ILE 130 -1.443 5.376 -1.426 947 HD13 ILE 130 2HD1 ILE 130 -0.607 4.775 0.006 948 H GLY 131 H GLY 131 -2.107 9.907 3.865 949 HA2 GLY 131 2HA GLY 131 -2.180 12.168 3.447 950 HA3 GLY 131 1HA GLY 131 -2.039 11.821 1.720 951 H LYS 132 H LYS 132 -3.778 12.177 0.545 952 HA LYS 132 HA LYS 132 -6.409 12.236 1.862 953 HB2 LYS 132 2HB LYS 132 -5.564 13.183 -0.869 954 HB3 LYS 132 1HB LYS 132 -7.177 13.311 -0.205 955 HG2 LYS 132 2HG LYS 132 -6.332 14.832 1.514 956 HG3 LYS 132 1HG LYS 132 -4.714 14.703 0.811 957 HD2 LYS 132 2HD LYS 132 -5.566 16.685 -0.115 958 HD3 LYS 132 1HD LYS 132 -5.788 15.486 -1.370 959 HE2 LYS 132 2HE LYS 132 -7.957 16.469 0.519 960 HE3 LYS 132 1HE LYS 132 -7.737 17.001 -1.131 961 HZ1 LYS 132 3HZ LYS 132 -9.489 15.410 -1.072 962 HZ2 LYS 132 1HZ LYS 132 -8.585 14.277 -0.236 963 HZ3 LYS 132 2HZ LYS 132 -8.211 14.652 -1.825 964 H PHE 133 H PHE 133 -4.435 10.351 -0.169 965 HA PHE 133 HA PHE 133 -6.740 9.210 -1.580 966 HB2 PHE 133 2HB PHE 133 -3.804 8.973 -2.222 967 HB3 PHE 133 1HB PHE 133 -5.152 8.409 -3.216 968 HD1 PHE 133 1HD PHE 133 -6.950 10.230 -3.804 969 HD2 PHE 133 2HD PHE 133 -2.948 11.086 -2.646 970 HE1 PHE 133 1HE PHE 133 -7.135 12.463 -4.811 971 HE2 PHE 133 2HE PHE 133 -3.134 13.327 -3.653 972 HZ PHE 133 HZ PHE 133 -5.232 14.015 -4.729 973 H ARG 134 H ARG 134 -6.574 6.823 -2.075 974 HA ARG 134 HA ARG 134 -5.995 5.638 0.526 975 HB2 ARG 134 2HB ARG 134 -8.534 5.334 -1.051 976 HB3 ARG 134 1HB ARG 134 -8.123 4.362 0.363 977 HG2 ARG 134 2HG ARG 134 -8.021 6.362 1.740 978 HG3 ARG 134 1HG ARG 134 -8.362 7.365 0.332 979 HD2 ARG 134 2HD ARG 134 -10.194 5.277 1.491 980 HD3 ARG 134 1HD ARG 134 -10.324 7.016 1.751 981 HE ARG 134 HE ARG 134 -10.339 6.256 -1.007 982 HH11 ARG 134 1HH1 ARG 134 -12.326 6.743 1.855 983 HH12 ARG 134 2HH1 ARG 134 -13.784 6.957 1.014 984 HH21 ARG 134 1HH2 ARG 134 -12.354 6.563 -2.219 985 HH22 ARG 134 2HH2 ARG 134 -13.789 6.853 -1.363 986 H LEU 135 H LEU 135 -5.400 3.640 0.702 987 HA LEU 135 HA LEU 135 -4.587 2.166 -1.713 988 HB2 LEU 135 2HB LEU 135 -2.760 3.275 -0.482 989 HB3 LEU 135 1HB LEU 135 -3.299 2.505 0.993 990 HG LEU 135 HG LEU 135 -2.758 0.294 -0.085 991 HD11 LEU 135 1HD1 LEU 135 -1.311 0.285 -1.991 992 HD12 LEU 135 2HD1 LEU 135 -1.381 2.044 -2.090 993 HD13 LEU 135 3HD1 LEU 135 -2.830 1.079 -2.393 994 HD21 LEU 135 3HD2 LEU 135 -0.348 0.513 0.288 995 HD22 LEU 135 1HD2 LEU 135 -1.269 1.340 1.543 996 HD23 LEU 135 2HD2 LEU 135 -0.500 2.268 0.258 997 H VAL 136 H VAL 136 -5.234 -0.021 -1.635 998 HA VAL 136 HA VAL 136 -6.391 -0.872 0.909 999 HB VAL 136 HB VAL 136 -8.104 -0.754 -0.873 1000 HG11 VAL 136 1HG1 VAL 136 -8.105 -2.286 -2.773 1001 HG12 VAL 136 2HG1 VAL 136 -6.480 -2.811 -2.330 1002 HG13 VAL 136 3HG1 VAL 136 -6.764 -1.141 -2.822 1003 HG21 VAL 136 3HG2 VAL 136 -8.430 -2.397 0.883 1004 HG22 VAL 136 1HG2 VAL 136 -7.495 -3.584 -0.030 1005 HG23 VAL 136 2HG2 VAL 136 -9.048 -3.023 -0.649 1006 H PHE 137 H PHE 137 -5.664 -2.671 1.878 1007 HA PHE 137 HA PHE 137 -3.347 -3.953 0.606 1008 HB2 PHE 137 2HB PHE 137 -2.719 -2.657 2.537 1009 HB3 PHE 137 1HB PHE 137 -3.969 -3.421 3.509 1010 HD1 PHE 137 1HD PHE 137 -0.797 -4.074 1.721 1011 HD2 PHE 137 2HD PHE 137 -3.531 -5.380 4.708 1012 HE1 PHE 137 1HE PHE 137 0.822 -5.758 2.466 1013 HE2 PHE 137 2HE PHE 137 -1.914 -7.072 5.457 1014 HZ PHE 137 HZ PHE 137 0.263 -7.260 4.340 1015 H LEU 138 H LEU 138 -3.407 -6.073 0.249 1016 HA LEU 138 HA LEU 138 -5.287 -7.736 1.775 1017 HB2 LEU 138 2HB LEU 138 -4.689 -7.930 -1.186 1018 HB3 LEU 138 1HB LEU 138 -5.496 -9.176 -0.276 1019 HG LEU 138 HG LEU 138 -7.106 -8.076 -1.530 1020 HD11 LEU 138 1HD1 LEU 138 -7.346 -7.073 1.274 1021 HD12 LEU 138 2HD1 LEU 138 -7.880 -8.629 0.643 1022 HD13 LEU 138 3HD1 LEU 138 -8.656 -7.142 0.097 1023 HD21 LEU 138 3HD2 LEU 138 -6.119 -5.430 -0.472 1024 HD22 LEU 138 1HD2 LEU 138 -7.565 -5.651 -1.457 1025 HD23 LEU 138 2HD2 LEU 138 -5.978 -6.027 -2.126 1026 H ALA 139 H ALA 139 -4.543 -9.786 2.204 1027 HA ALA 139 HA ALA 139 -1.652 -10.176 1.907 1028 HB1 ALA 139 1HB ALA 139 -1.957 -11.996 3.551 1029 HB2 ALA 139 2HB ALA 139 -3.694 -11.690 3.546 1030 HB3 ALA 139 3HB ALA 139 -2.581 -10.463 4.155 1031 H GLY 140 H GLY 140 -0.794 -11.934 0.719 1032 HA2 GLY 140 2HA GLY 140 -2.846 -13.268 -0.893 1033 HA3 GLY 140 1HA GLY 140 -1.362 -12.642 -1.575 1034 HA PRO 141 HA PRO 141 -0.443 -16.972 -1.303 1035 HB2 PRO 141 2HB PRO 141 1.899 -16.919 -2.635 1036 HB3 PRO 141 1HB PRO 141 0.319 -16.814 -3.414 1037 HG2 PRO 141 2HG PRO 141 2.269 -14.649 -2.776 1038 HG3 PRO 141 1HG PRO 141 1.262 -14.859 -4.219 1039 HD2 PRO 141 2HD PRO 141 0.651 -13.142 -2.186 1040 HD3 PRO 141 1HD PRO 141 -0.565 -13.891 -3.235 1041 H ALA 142 H ALA 142 0.465 -18.176 0.086 1042 HA ALA 142 HA ALA 142 2.795 -17.238 1.611 1043 HB1 ALA 142 1HB ALA 142 2.030 -18.810 3.373 1044 HB2 ALA 142 2HB ALA 142 0.633 -19.208 2.379 1045 HB3 ALA 142 3HB ALA 142 0.820 -17.577 3.023 1046 H GLU 143 H GLU 143 4.624 -18.278 0.975 1047 HA GLU 143 HA GLU 143 4.464 -20.557 -0.721 1048 HB2 GLU 143 2HB GLU 143 6.291 -18.829 -0.900 1049 HB3 GLU 143 1HB GLU 143 6.917 -19.415 0.632 1050 HG2 GLU 143 2HG GLU 143 7.348 -21.602 -0.345 1051 HG3 GLU 143 1HG GLU 143 6.681 -21.059 -1.884 Start of MODEL 22 1 H1 MET 1 1HT MET 1 45.241 -3.099 -69.862 2 H2 MET 1 2HT MET 1 45.582 -3.642 -71.402 3 H3 MET 1 3HT MET 1 46.195 -4.481 -70.039 4 HA MET 1 HA MET 1 44.251 -5.579 -71.064 5 HB2 MET 1 2HB MET 1 44.813 -5.524 -68.501 6 HB3 MET 1 1HB MET 1 43.536 -4.340 -68.380 7 HG2 MET 1 2HG MET 1 43.120 -7.146 -69.391 8 HG3 MET 1 1HG MET 1 42.917 -6.669 -67.715 9 HE1 MET 1 2HE MET 1 40.480 -7.646 -67.657 10 HE2 MET 1 3HE MET 1 40.649 -8.179 -69.335 11 HE3 MET 1 1HE MET 1 39.232 -7.254 -68.840 12 H SER 2 H SER 2 41.960 -5.320 -71.640 13 HA SER 2 HA SER 2 41.299 -3.006 -72.938 14 HB2 SER 2 2HB SER 2 39.481 -5.097 -71.764 15 HB3 SER 2 1HB SER 2 39.040 -3.956 -73.040 16 HG SER 2 HG SER 2 40.358 -4.917 -74.402 17 H ASP 3 H ASP 3 40.379 -3.949 -69.631 18 HA ASP 3 HA ASP 3 40.097 -1.197 -68.886 19 HB2 ASP 3 2HB ASP 3 37.828 -1.592 -69.738 20 HB3 ASP 3 1HB ASP 3 37.706 -3.061 -68.778 21 H ASN 4 H ASN 4 41.416 -1.298 -67.154 22 HA ASN 4 HA ASN 4 40.663 -3.202 -65.102 23 HB2 ASN 4 2HB ASN 4 42.602 -4.182 -66.396 24 HB3 ASN 4 1HB ASN 4 43.554 -2.788 -65.895 25 HD21 ASN 4 1HD2 ASN 4 44.274 -2.664 -63.725 26 HD22 ASN 4 2HD2 ASN 4 44.171 -4.023 -62.674 27 H ASN 5 H ASN 5 40.928 -2.426 -63.119 28 HA ASN 5 HA ASN 5 42.366 0.029 -62.620 29 HB2 ASN 5 2HB ASN 5 40.139 0.826 -63.394 30 HB3 ASN 5 1HB ASN 5 39.368 -0.204 -62.207 31 HD21 ASN 5 1HD2 ASN 5 38.342 1.537 -61.252 32 HD22 ASN 5 2HD2 ASN 5 39.172 2.666 -60.257 33 H GLY 6 H GLY 6 43.224 -0.179 -60.631 34 HA2 GLY 6 2HA GLY 6 42.619 -2.424 -58.963 35 HA3 GLY 6 1HA GLY 6 43.692 -1.082 -58.553 36 H THR 7 H THR 7 40.443 -2.180 -58.644 37 HA THR 7 HA THR 7 39.285 0.272 -57.782 38 HB THR 7 HB THR 7 38.099 -2.480 -58.118 39 HG1 THR 7 1HG THR 7 39.169 -1.447 -59.978 40 HG21 THR 7 3HG2 THR 7 36.796 0.258 -58.084 41 HG22 THR 7 1HG2 THR 7 36.671 -0.953 -56.808 42 HG23 THR 7 2HG2 THR 7 35.971 -1.267 -58.398 43 HA PRO 8 HA PRO 8 39.691 -0.758 -53.388 44 HB2 PRO 8 2HB PRO 8 37.843 1.514 -53.078 45 HB3 PRO 8 1HB PRO 8 39.464 1.307 -52.410 46 HG2 PRO 8 2HG PRO 8 38.960 3.066 -54.368 47 HG3 PRO 8 1HG PRO 8 40.486 2.170 -54.269 48 HD2 PRO 8 2HD PRO 8 38.123 1.687 -56.040 49 HD3 PRO 8 1HD PRO 8 39.862 1.578 -56.398 50 H GLU 9 H GLU 9 38.377 -2.107 -52.271 51 HA GLU 9 HA GLU 9 35.807 -2.550 -53.324 52 HB2 GLU 9 2HB GLU 9 35.625 -4.156 -51.240 53 HB3 GLU 9 1HB GLU 9 36.599 -4.580 -52.624 54 HG2 GLU 9 2HG GLU 9 37.743 -5.153 -50.587 55 HG3 GLU 9 1HG GLU 9 38.614 -3.871 -51.410 56 HA PRO 10 HA PRO 10 33.555 0.450 -51.157 57 HB2 PRO 10 2HB PRO 10 31.306 -1.455 -51.086 58 HB3 PRO 10 1HB PRO 10 31.375 0.163 -51.785 59 HG2 PRO 10 2HG PRO 10 31.366 -1.994 -53.357 60 HG3 PRO 10 1HG PRO 10 32.349 -0.574 -53.753 61 HD2 PRO 10 2HD PRO 10 33.189 -3.184 -52.567 62 HD3 PRO 10 1HD PRO 10 33.990 -2.165 -53.786 63 H GLN 11 H GLN 11 33.790 0.863 -49.164 64 HA GLN 11 HA GLN 11 33.861 -1.168 -47.133 65 HB2 GLN 11 2HB GLN 11 34.022 1.848 -46.900 66 HB3 GLN 11 1HB GLN 11 34.431 0.697 -45.636 67 HG2 GLN 11 2HG GLN 11 36.263 -0.165 -46.975 68 HG3 GLN 11 1HG GLN 11 35.842 0.929 -48.284 69 HE21 GLN 11 1HE2 GLN 11 38.289 0.638 -46.787 70 HE22 GLN 11 2HE2 GLN 11 38.656 2.181 -46.116 71 H VAL 12 H VAL 12 31.979 -1.937 -46.454 72 HA VAL 12 HA VAL 12 29.584 -0.665 -47.084 73 HB VAL 12 HB VAL 12 28.453 -2.458 -45.841 74 HG11 VAL 12 1HG1 VAL 12 29.218 -4.313 -47.245 75 HG12 VAL 12 2HG1 VAL 12 30.656 -3.380 -47.670 76 HG13 VAL 12 3HG1 VAL 12 29.057 -2.808 -48.149 77 HG21 VAL 12 3HG2 VAL 12 29.731 -4.308 -44.876 78 HG22 VAL 12 1HG2 VAL 12 30.062 -2.798 -44.027 79 HG23 VAL 12 2HG2 VAL 12 31.228 -3.441 -45.190 80 H GLU 13 H GLU 13 28.403 0.721 -46.133 81 HA GLU 13 HA GLU 13 29.188 1.689 -43.544 82 HB2 GLU 13 2HB GLU 13 28.706 3.301 -45.368 83 HB3 GLU 13 1HB GLU 13 27.058 2.702 -45.433 84 HG2 GLU 13 2HG GLU 13 27.204 4.801 -44.202 85 HG3 GLU 13 1HG GLU 13 26.649 3.482 -43.172 86 H THR 14 H THR 14 27.937 1.654 -41.779 87 HA THR 14 HA THR 14 25.377 0.326 -41.927 88 HB THR 14 HB THR 14 26.958 -1.502 -41.401 89 HG1 THR 14 1HG THR 14 26.038 -2.028 -39.251 90 HG21 THR 14 3HG2 THR 14 28.251 -1.502 -39.300 91 HG22 THR 14 1HG2 THR 14 27.724 0.150 -38.982 92 HG23 THR 14 2HG2 THR 14 28.764 -0.194 -40.364 93 H THR 15 H THR 15 23.949 1.065 -40.317 94 HA THR 15 HA THR 15 25.015 3.308 -38.873 95 HB THR 15 HB THR 15 23.266 3.942 -40.495 96 HG1 THR 15 1HG THR 15 23.306 4.631 -37.990 97 HG21 THR 15 3HG2 THR 15 20.916 3.235 -40.178 98 HG22 THR 15 1HG2 THR 15 21.439 2.125 -38.912 99 HG23 THR 15 2HG2 THR 15 21.963 1.872 -40.578 100 H SER 16 H SER 16 25.077 3.163 -36.805 101 HA SER 16 HA SER 16 23.367 1.294 -35.396 102 HB2 SER 16 2HB SER 16 26.381 1.254 -35.097 103 HB3 SER 16 1HB SER 16 25.235 0.240 -34.219 104 HG SER 16 HG SER 16 24.624 -0.065 -36.690 105 H VAL 17 H VAL 17 22.336 2.968 -34.403 106 HA VAL 17 HA VAL 17 23.654 4.117 -32.158 107 HB VAL 17 HB VAL 17 24.246 5.783 -33.886 108 HG11 VAL 17 1HG1 VAL 17 22.557 7.127 -35.032 109 HG12 VAL 17 2HG1 VAL 17 21.295 6.087 -34.370 110 HG13 VAL 17 3HG1 VAL 17 22.486 5.424 -35.491 111 HG21 VAL 17 3HG2 VAL 17 23.863 6.629 -31.648 112 HG22 VAL 17 1HG2 VAL 17 22.140 6.804 -31.981 113 HG23 VAL 17 2HG2 VAL 17 23.307 7.811 -32.836 114 H PHE 18 H PHE 18 22.193 4.488 -30.533 115 HA PHE 18 HA PHE 18 19.418 4.831 -30.939 116 HB2 PHE 18 2HB PHE 18 18.614 2.688 -30.013 117 HB3 PHE 18 1HB PHE 18 19.495 2.434 -31.506 118 HD1 PHE 18 1HD PHE 18 21.952 1.664 -31.291 119 HD2 PHE 18 2HD PHE 18 19.158 1.489 -28.093 120 HE1 PHE 18 1HE PHE 18 23.341 -0.032 -30.179 121 HE2 PHE 18 2HE PHE 18 20.540 -0.199 -26.974 122 HZ PHE 18 HZ PHE 18 22.637 -0.965 -28.012 123 H ARG 19 H ARG 19 18.277 4.470 -28.720 124 HA ARG 19 HA ARG 19 20.053 5.587 -26.675 125 HB2 ARG 19 2HB ARG 19 17.049 5.689 -26.965 126 HB3 ARG 19 1HB ARG 19 17.907 6.278 -25.548 127 HG2 ARG 19 2HG ARG 19 19.082 7.890 -26.899 128 HG3 ARG 19 1HG ARG 19 18.298 7.284 -28.357 129 HD2 ARG 19 2HD ARG 19 16.145 7.982 -27.526 130 HD3 ARG 19 1HD ARG 19 16.861 8.498 -25.995 131 HE ARG 19 HE ARG 19 18.256 9.927 -27.711 132 HH11 ARG 19 1HH1 ARG 19 14.736 9.446 -27.572 133 HH12 ARG 19 2HH1 ARG 19 14.359 10.955 -28.246 134 HH21 ARG 19 1HH2 ARG 19 17.735 12.033 -28.627 135 HH22 ARG 19 2HH2 ARG 19 16.105 12.449 -28.877 136 H ALA 20 H ALA 20 20.821 4.140 -25.315 137 HA ALA 20 HA ALA 20 19.131 1.848 -24.563 138 HB1 ALA 20 1HB ALA 20 21.219 0.715 -23.991 139 HB2 ALA 20 2HB ALA 20 22.131 2.170 -24.400 140 HB3 ALA 20 3HB ALA 20 21.271 1.288 -25.660 141 H ASP 21 H ASP 21 19.326 4.673 -23.555 142 HA ASP 21 HA ASP 21 20.587 4.710 -21.018 143 HB2 ASP 21 2HB ASP 21 18.408 6.475 -22.148 144 HB3 ASP 21 1HB ASP 21 19.299 6.801 -20.668 145 H LEU 22 H LEU 22 17.177 4.558 -21.981 146 HA LEU 22 HA LEU 22 15.273 4.187 -20.885 147 HB2 LEU 22 2HB LEU 22 16.249 1.844 -21.043 148 HB3 LEU 22 1HB LEU 22 16.844 2.042 -19.415 149 HG LEU 22 HG LEU 22 14.756 0.624 -19.686 150 HD11 LEU 22 1HD1 LEU 22 14.532 2.983 -17.843 151 HD12 LEU 22 2HD1 LEU 22 15.338 1.448 -17.505 152 HD13 LEU 22 3HD1 LEU 22 13.589 1.497 -17.732 153 HD21 LEU 22 3HD2 LEU 22 13.434 3.289 -20.153 154 HD22 LEU 22 1HD2 LEU 22 12.614 1.748 -19.926 155 HD23 LEU 22 2HD2 LEU 22 13.622 2.015 -21.353 156 H LEU 23 H LEU 23 14.881 5.969 -19.813 157 HA LEU 23 HA LEU 23 16.325 6.744 -17.491 158 HB2 LEU 23 2HB LEU 23 13.757 7.855 -18.610 159 HB3 LEU 23 1HB LEU 23 14.727 8.603 -17.360 160 HG LEU 23 HG LEU 23 15.572 8.160 -20.224 161 HD11 LEU 23 1HD1 LEU 23 15.474 10.584 -20.408 162 HD12 LEU 23 2HD1 LEU 23 14.887 10.687 -18.750 163 HD13 LEU 23 3HD1 LEU 23 13.899 9.909 -19.987 164 HD21 LEU 23 3HD2 LEU 23 17.532 9.519 -19.640 165 HD22 LEU 23 1HD2 LEU 23 17.492 8.009 -18.730 166 HD23 LEU 23 2HD2 LEU 23 17.021 9.518 -17.951 167 H LYS 24 H LYS 24 16.131 5.723 -15.650 168 HA LYS 24 HA LYS 24 13.523 5.525 -14.423 169 HB2 LYS 24 2HB LYS 24 13.658 3.226 -13.788 170 HB3 LYS 24 1HB LYS 24 14.091 3.218 -15.480 171 HG2 LYS 24 2HG LYS 24 16.030 3.003 -13.161 172 HG3 LYS 24 1HG LYS 24 15.443 1.661 -14.129 173 HD2 LYS 24 2HD LYS 24 16.537 2.680 -16.108 174 HD3 LYS 24 1HD LYS 24 17.129 3.967 -15.056 175 HE2 LYS 24 2HE LYS 24 17.761 1.033 -14.714 176 HE3 LYS 24 1HE LYS 24 18.820 2.198 -15.496 177 HZ1 LYS 24 3HZ LYS 24 19.064 3.368 -13.431 178 HZ2 LYS 24 1HZ LYS 24 19.403 1.749 -13.163 179 HZ3 LYS 24 2HZ LYS 24 17.928 2.405 -12.649 180 H GLU 25 H GLU 25 14.288 4.523 -11.971 181 HA GLU 25 HA GLU 25 16.091 6.615 -11.221 182 HB2 GLU 25 2HB GLU 25 14.109 6.084 -9.800 183 HB3 GLU 25 1HB GLU 25 14.828 4.526 -9.425 184 HG2 GLU 25 2HG GLU 25 15.167 6.186 -7.632 185 HG3 GLU 25 1HG GLU 25 16.687 5.591 -8.307 186 H MET 26 H MET 26 17.994 6.307 -10.093 187 HA MET 26 HA MET 26 19.730 4.407 -11.287 188 HB2 MET 26 2HB MET 26 21.461 5.387 -9.886 189 HB3 MET 26 1HB MET 26 20.461 6.646 -10.596 190 HG2 MET 26 2HG MET 26 19.220 6.820 -8.469 191 HG3 MET 26 1HG MET 26 20.306 5.625 -7.765 192 HE1 MET 26 3HE MET 26 21.418 8.894 -5.965 193 HE2 MET 26 1HE MET 26 20.913 7.215 -5.774 194 HE3 MET 26 2HE MET 26 19.785 8.408 -6.414 195 H GLU 27 H GLU 27 21.137 2.960 -10.051 196 HA GLU 27 HA GLU 27 19.642 1.353 -8.207 197 HB2 GLU 27 2HB GLU 27 20.982 0.308 -9.992 198 HB3 GLU 27 1HB GLU 27 22.429 1.061 -9.353 199 HG2 GLU 27 2HG GLU 27 22.321 -1.294 -8.791 200 HG3 GLU 27 1HG GLU 27 22.276 -0.286 -7.349 201 H SER 28 H SER 28 19.471 2.588 -6.369 202 HA SER 28 HA SER 28 21.780 3.726 -5.084 203 HB2 SER 28 2HB SER 28 18.984 3.276 -4.003 204 HB3 SER 28 1HB SER 28 20.206 4.356 -3.337 205 HG SER 28 HG SER 28 18.507 5.258 -4.715 206 H SER 29 H SER 29 19.805 0.892 -4.902 207 HA SER 29 HA SER 29 19.987 -1.142 -4.011 208 HB2 SER 29 2HB SER 29 22.822 -0.397 -3.296 209 HB3 SER 29 1HB SER 29 22.154 -2.023 -3.424 210 HG SER 29 HG SER 29 21.559 -1.034 -5.667 211 H THR 30 H THR 30 18.717 -1.421 -2.282 212 HA THR 30 HA THR 30 19.416 -0.129 0.175 213 HB THR 30 HB THR 30 16.993 -0.485 -0.574 214 HG1 THR 30 1HG THR 30 17.691 -0.087 1.587 215 HG21 THR 30 3HG2 THR 30 15.952 -2.666 -0.130 216 HG22 THR 30 1HG2 THR 30 17.526 -3.336 0.309 217 HG23 THR 30 2HG2 THR 30 17.218 -2.824 -1.347 218 H GLY 31 H GLY 31 20.095 -1.271 2.067 219 HA2 GLY 31 2HA GLY 31 21.594 -3.680 1.360 220 HA3 GLY 31 1HA GLY 31 21.963 -2.593 2.690 221 H THR 32 H THR 32 19.818 -5.117 1.574 222 HA THR 32 HA THR 32 18.356 -5.355 3.984 223 HB THR 32 HB THR 32 18.900 -7.555 2.046 224 HG1 THR 32 1HG THR 32 18.071 -6.227 0.545 225 HG21 THR 32 3HG2 THR 32 17.565 -8.104 4.008 226 HG22 THR 32 1HG2 THR 32 16.543 -8.153 2.573 227 HG23 THR 32 2HG2 THR 32 16.462 -6.774 3.665 228 H ALA 33 H ALA 33 19.138 -6.112 5.781 229 HA ALA 33 HA ALA 33 21.743 -7.350 5.895 230 HB1 ALA 33 1HB ALA 33 19.830 -6.699 8.134 231 HB2 ALA 33 2HB ALA 33 21.119 -5.640 7.550 232 HB3 ALA 33 3HB ALA 33 21.518 -7.176 8.321 233 HA PRO 34 HA PRO 34 20.486 -11.624 5.866 234 HB2 PRO 34 2HB PRO 34 22.499 -11.803 8.073 235 HB3 PRO 34 1HB PRO 34 22.317 -12.817 6.638 236 HG2 PRO 34 2HG PRO 34 24.215 -10.980 6.717 237 HG3 PRO 34 1HG PRO 34 23.283 -11.242 5.234 238 HD2 PRO 34 2HD PRO 34 23.099 -9.028 7.220 239 HD3 PRO 34 1HD PRO 34 22.886 -9.001 5.454 240 H ALA 35 H ALA 35 19.191 -12.946 7.011 241 HA ALA 35 HA ALA 35 17.796 -13.769 8.530 242 HB1 ALA 35 1HB ALA 35 19.503 -13.485 10.299 243 HB2 ALA 35 2HB ALA 35 17.867 -13.221 10.907 244 HB3 ALA 35 3HB ALA 35 18.918 -11.845 10.575 245 H SER 36 H SER 36 17.861 -10.524 7.643 246 HA SER 36 HA SER 36 15.100 -10.134 8.484 247 HB2 SER 36 2HB SER 36 16.901 -8.297 6.875 248 HB3 SER 36 1HB SER 36 15.402 -7.855 7.695 249 HG SER 36 HG SER 36 17.941 -8.288 8.693 250 H THR 37 H THR 37 13.651 -11.143 7.187 251 HA THR 37 HA THR 37 13.621 -10.801 4.382 252 HB THR 37 HB THR 37 15.508 -12.410 4.564 253 HG1 THR 37 1HG THR 37 13.536 -12.687 2.948 254 HG21 THR 37 3HG2 THR 37 14.945 -13.479 6.674 255 HG22 THR 37 1HG2 THR 37 15.130 -14.705 5.418 256 HG23 THR 37 2HG2 THR 37 13.522 -14.222 5.944 257 H GLY 38 H GLY 38 11.796 -12.260 3.481 258 HA2 GLY 38 2HA GLY 38 10.167 -13.890 4.922 259 HA3 GLY 38 1HA GLY 38 9.579 -12.267 5.273 260 H ALA 39 H ALA 39 9.788 -10.965 2.975 261 HA ALA 39 HA ALA 39 7.440 -11.932 1.680 262 HB1 ALA 39 1HB ALA 39 7.540 -9.901 0.362 263 HB2 ALA 39 2HB ALA 39 9.170 -9.581 0.957 264 HB3 ALA 39 3HB ALA 39 7.802 -9.566 2.069 265 H GLU 40 H GLU 40 10.818 -11.912 0.848 266 HA GLU 40 HA GLU 40 10.249 -12.791 -1.832 267 HB2 GLU 40 2HB GLU 40 12.713 -12.911 -2.132 268 HB3 GLU 40 1HB GLU 40 12.158 -11.333 -1.616 269 HG2 GLU 40 2HG GLU 40 13.357 -13.389 0.230 270 HG3 GLU 40 1HG GLU 40 14.285 -12.110 -0.552 271 H ASN 41 H ASN 41 10.468 -14.223 1.146 272 HA ASN 41 HA ASN 41 11.444 -16.779 0.173 273 HB2 ASN 41 2HB ASN 41 10.234 -16.075 2.860 274 HB3 ASN 41 1HB ASN 41 10.869 -17.659 2.430 275 HD21 ASN 41 1HD2 ASN 41 11.687 -15.963 4.552 276 HD22 ASN 41 2HD2 ASN 41 13.344 -15.551 4.271 277 H LEU 42 H LEU 42 8.515 -15.119 0.362 278 HA LEU 42 HA LEU 42 7.026 -17.563 -0.152 279 HB2 LEU 42 2HB LEU 42 6.241 -14.927 1.010 280 HB3 LEU 42 1HB LEU 42 5.042 -15.874 0.175 281 HG LEU 42 HG LEU 42 4.800 -16.232 2.508 282 HD11 LEU 42 1HD1 LEU 42 6.115 -18.645 1.297 283 HD12 LEU 42 2HD1 LEU 42 4.428 -18.164 1.131 284 HD13 LEU 42 3HD1 LEU 42 5.058 -18.631 2.706 285 HD21 LEU 42 3HD2 LEU 42 7.004 -15.562 3.299 286 HD22 LEU 42 1HD2 LEU 42 7.717 -17.009 2.593 287 HD23 LEU 42 2HD2 LEU 42 6.587 -17.152 3.937 288 HA PRO 43 HA PRO 43 7.157 -15.733 -4.329 289 HB2 PRO 43 2HB PRO 43 6.225 -18.046 -5.531 290 HB3 PRO 43 1HB PRO 43 7.932 -17.698 -5.259 291 HG2 PRO 43 2HG PRO 43 6.075 -19.437 -3.720 292 HG3 PRO 43 1HG PRO 43 7.797 -19.661 -4.064 293 HD2 PRO 43 2HD PRO 43 6.867 -18.822 -1.665 294 HD3 PRO 43 1HD PRO 43 8.450 -18.336 -2.300 295 H ALA 44 H ALA 44 4.727 -17.683 -2.781 296 HA ALA 44 HA ALA 44 2.684 -15.791 -3.550 297 HB1 ALA 44 1HB ALA 44 2.514 -17.630 -5.189 298 HB2 ALA 44 2HB ALA 44 1.120 -17.575 -4.125 299 HB3 ALA 44 3HB ALA 44 2.376 -18.791 -3.867 300 H GLY 45 H GLY 45 2.094 -15.092 -1.626 301 HA2 GLY 45 2HA GLY 45 0.934 -16.494 0.403 302 HA3 GLY 45 1HA GLY 45 2.656 -16.590 0.760 303 H SER 46 H SER 46 2.965 -13.893 -0.607 304 HA SER 46 HA SER 46 2.351 -12.284 1.691 305 HB2 SER 46 2HB SER 46 3.542 -11.426 -0.939 306 HB3 SER 46 1HB SER 46 3.757 -10.683 0.640 307 HG SER 46 HG SER 46 5.555 -12.005 -0.097 308 H ALA 47 H ALA 47 1.090 -10.346 1.415 309 HA ALA 47 HA ALA 47 -1.075 -10.756 -0.494 310 HB1 ALA 47 1HB ALA 47 -1.712 -10.660 1.856 311 HB2 ALA 47 2HB ALA 47 -2.382 -9.287 0.968 312 HB3 ALA 47 3HB ALA 47 -0.966 -9.068 1.994 313 H LEU 48 H LEU 48 -2.167 -8.370 -0.936 314 HA LEU 48 HA LEU 48 0.017 -6.687 -1.852 315 HB2 LEU 48 2HB LEU 48 -0.853 -6.483 -4.070 316 HB3 LEU 48 1HB LEU 48 -0.574 -8.173 -3.736 317 HG LEU 48 HG LEU 48 -3.320 -6.892 -3.649 318 HD11 LEU 48 1HD1 LEU 48 -3.668 -7.865 -5.855 319 HD12 LEU 48 2HD1 LEU 48 -1.994 -8.414 -5.882 320 HD13 LEU 48 3HD1 LEU 48 -2.356 -6.686 -5.877 321 HD21 LEU 48 3HD2 LEU 48 -4.116 -9.190 -3.861 322 HD22 LEU 48 1HD2 LEU 48 -3.116 -9.013 -2.421 323 HD23 LEU 48 2HD2 LEU 48 -2.452 -9.778 -3.862 324 H LEU 49 H LEU 49 -0.610 -4.606 -2.438 325 HA LEU 49 HA LEU 49 -3.212 -3.828 -1.437 326 HB2 LEU 49 2HB LEU 49 -2.155 -1.608 -0.787 327 HB3 LEU 49 1HB LEU 49 -1.767 -2.970 0.225 328 HG LEU 49 HG LEU 49 0.446 -3.108 -1.053 329 HD11 LEU 49 1HD1 LEU 49 -0.102 -1.759 -2.977 330 HD12 LEU 49 2HD1 LEU 49 1.259 -1.060 -2.097 331 HD13 LEU 49 3HD1 LEU 49 -0.349 -0.349 -1.949 332 HD21 LEU 49 3HD2 LEU 49 0.301 -2.294 1.218 333 HD22 LEU 49 1HD2 LEU 49 -0.135 -0.685 0.638 334 HD23 LEU 49 2HD2 LEU 49 1.467 -1.339 0.302 335 H VAL 50 H VAL 50 -4.340 -2.397 -2.622 336 HA VAL 50 HA VAL 50 -3.113 -1.773 -5.194 337 HB VAL 50 HB VAL 50 -5.327 -1.876 -6.275 338 HG11 VAL 50 1HG1 VAL 50 -5.678 -4.295 -6.217 339 HG12 VAL 50 2HG1 VAL 50 -4.683 -4.396 -4.765 340 HG13 VAL 50 3HG1 VAL 50 -3.965 -3.877 -6.288 341 HG21 VAL 50 3HG2 VAL 50 -7.259 -2.831 -5.119 342 HG22 VAL 50 1HG2 VAL 50 -6.732 -1.324 -4.365 343 HG23 VAL 50 2HG2 VAL 50 -6.329 -2.873 -3.621 344 H VAL 51 H VAL 51 -3.296 0.197 -5.992 345 HA VAL 51 HA VAL 51 -4.142 2.278 -4.107 346 HB VAL 51 HB VAL 51 -2.721 2.591 -6.762 347 HG11 VAL 51 1HG1 VAL 51 -3.779 4.620 -5.978 348 HG12 VAL 51 2HG1 VAL 51 -2.026 4.774 -5.887 349 HG13 VAL 51 3HG1 VAL 51 -2.961 4.474 -4.423 350 HG21 VAL 51 3HG2 VAL 51 -0.609 2.797 -5.536 351 HG22 VAL 51 1HG2 VAL 51 -1.325 1.204 -5.317 352 HG23 VAL 51 2HG2 VAL 51 -1.433 2.405 -4.031 353 H LYS 52 H LYS 52 -6.149 2.984 -4.315 354 HA LYS 52 HA LYS 52 -7.528 2.569 -6.836 355 HB2 LYS 52 2HB LYS 52 -8.490 3.575 -4.154 356 HB3 LYS 52 1HB LYS 52 -9.517 3.421 -5.571 357 HG2 LYS 52 2HG LYS 52 -8.066 1.141 -4.236 358 HG3 LYS 52 1HG LYS 52 -9.760 1.555 -3.973 359 HD2 LYS 52 2HD LYS 52 -10.175 1.201 -6.398 360 HD3 LYS 52 1HD LYS 52 -8.497 0.694 -6.584 361 HE2 LYS 52 2HE LYS 52 -8.875 -1.139 -5.005 362 HE3 LYS 52 1HE LYS 52 -10.545 -0.619 -4.807 363 HZ1 LYS 52 3HZ LYS 52 -10.352 -2.474 -6.337 364 HZ2 LYS 52 1HZ LYS 52 -9.337 -1.593 -7.343 365 HZ3 LYS 52 2HZ LYS 52 -10.942 -1.131 -7.149 366 H ARG 53 H ARG 53 -6.316 5.099 -4.801 367 HA ARG 53 HA ARG 53 -6.471 6.966 -6.999 368 HB2 ARG 53 2HB ARG 53 -8.610 7.276 -5.859 369 HB3 ARG 53 1HB ARG 53 -7.783 7.453 -4.323 370 HG2 ARG 53 2HG ARG 53 -6.920 9.569 -4.945 371 HG3 ARG 53 1HG ARG 53 -7.393 9.342 -6.635 372 HD2 ARG 53 2HD ARG 53 -9.287 9.544 -4.290 373 HD3 ARG 53 1HD ARG 53 -8.970 10.817 -5.474 374 HE ARG 53 HE ARG 53 -9.650 8.817 -7.045 375 HH11 ARG 53 1HH1 ARG 53 -11.342 9.968 -4.121 376 HH12 ARG 53 2HH1 ARG 53 -12.873 9.496 -4.708 377 HH21 ARG 53 1HH2 ARG 53 -11.739 8.183 -7.769 378 HH22 ARG 53 2HH2 ARG 53 -13.108 8.498 -6.798 379 H GLY 54 H GLY 54 -4.595 7.959 -7.047 380 HA2 GLY 54 2HA GLY 54 -3.280 9.321 -5.184 381 HA3 GLY 54 1HA GLY 54 -2.811 7.673 -4.814 382 HA PRO 55 HA PRO 55 -0.809 9.614 -8.973 383 HB2 PRO 55 2HB PRO 55 0.792 11.276 -7.075 384 HB3 PRO 55 1HB PRO 55 0.283 11.644 -8.728 385 HG2 PRO 55 2HG PRO 55 -1.010 12.771 -6.747 386 HG3 PRO 55 1HG PRO 55 -1.926 12.056 -8.083 387 HD2 PRO 55 2HD PRO 55 -1.424 10.945 -5.343 388 HD3 PRO 55 1HD PRO 55 -2.925 10.982 -6.296 389 H ASN 56 H ASN 56 0.092 8.332 -6.011 390 HA ASN 56 HA ASN 56 2.791 7.703 -6.137 391 HB2 ASN 56 2HB ASN 56 1.456 7.191 -4.178 392 HB3 ASN 56 1HB ASN 56 0.483 6.046 -5.092 393 HD21 ASN 56 1HD2 ASN 56 1.302 3.983 -5.485 394 HD22 ASN 56 2HD2 ASN 56 2.747 3.417 -4.722 395 H ALA 57 H ALA 57 0.037 6.165 -7.792 396 HA ALA 57 HA ALA 57 1.528 5.177 -9.926 397 HB1 ALA 57 1HB ALA 57 2.500 3.605 -8.299 398 HB2 ALA 57 2HB ALA 57 1.558 2.773 -9.539 399 HB3 ALA 57 3HB ALA 57 0.877 3.019 -7.930 400 H GLY 58 H GLY 58 -1.129 3.985 -7.873 401 HA2 GLY 58 2HA GLY 58 -3.373 3.644 -8.437 402 HA3 GLY 58 1HA GLY 58 -3.028 4.352 -10.015 403 H ALA 59 H ALA 59 -1.848 1.492 -8.210 404 HA ALA 59 HA ALA 59 -2.630 -0.287 -10.289 405 HB1 ALA 59 1HB ALA 59 -0.324 -1.079 -10.698 406 HB2 ALA 59 2HB ALA 59 0.301 0.226 -9.692 407 HB3 ALA 59 3HB ALA 59 -0.524 0.598 -11.206 408 H ARG 60 H ARG 60 -1.141 -2.454 -9.496 409 HA ARG 60 HA ARG 60 -1.898 -2.670 -6.673 410 HB2 ARG 60 2HB ARG 60 -2.320 -5.021 -7.050 411 HB3 ARG 60 1HB ARG 60 -3.211 -4.049 -8.217 412 HG2 ARG 60 2HG ARG 60 -1.603 -4.588 -9.946 413 HG3 ARG 60 1HG ARG 60 -0.636 -5.506 -8.792 414 HD2 ARG 60 2HD ARG 60 -1.963 -7.031 -10.110 415 HD3 ARG 60 1HD ARG 60 -2.567 -7.020 -8.454 416 HE ARG 60 HE ARG 60 -3.966 -5.141 -10.012 417 HH11 ARG 60 1HH1 ARG 60 -3.789 -8.645 -9.418 418 HH12 ARG 60 2HH1 ARG 60 -5.329 -8.980 -10.044 419 HH21 ARG 60 1HH2 ARG 60 -6.077 -5.600 -10.858 420 HH22 ARG 60 2HH2 ARG 60 -6.675 -7.193 -10.892 421 H PHE 61 H PHE 61 -0.421 -3.493 -5.228 422 HA PHE 61 HA PHE 61 2.148 -4.350 -6.325 423 HB2 PHE 61 2HB PHE 61 1.798 -2.327 -4.104 424 HB3 PHE 61 1HB PHE 61 3.320 -3.084 -4.546 425 HD1 PHE 61 1HD PHE 61 4.300 -2.636 -6.781 426 HD2 PHE 61 2HD PHE 61 0.965 -0.473 -5.279 427 HE1 PHE 61 1HE PHE 61 4.712 -0.869 -8.434 428 HE2 PHE 61 2HE PHE 61 1.362 1.294 -6.926 429 HZ PHE 61 HZ PHE 61 3.242 1.102 -8.513 430 H LEU 62 H LEU 62 2.565 -6.271 -5.592 431 HA LEU 62 HA LEU 62 1.456 -7.195 -3.081 432 HB2 LEU 62 2HB LEU 62 1.414 -8.708 -5.030 433 HB3 LEU 62 1HB LEU 62 3.144 -8.571 -5.200 434 HG LEU 62 HG LEU 62 2.053 -9.764 -2.662 435 HD11 LEU 62 1HD1 LEU 62 2.361 -11.229 -5.289 436 HD12 LEU 62 2HD1 LEU 62 0.828 -10.882 -4.485 437 HD13 LEU 62 3HD1 LEU 62 1.997 -11.960 -3.727 438 HD21 LEU 62 3HD2 LEU 62 4.458 -9.393 -2.874 439 HD22 LEU 62 1HD2 LEU 62 4.476 -10.304 -4.386 440 HD23 LEU 62 2HD2 LEU 62 4.101 -11.124 -2.882 441 H LEU 63 H LEU 63 2.709 -7.596 -1.254 442 HA LEU 63 HA LEU 63 4.992 -5.878 -1.101 443 HB2 LEU 63 2HB LEU 63 3.969 -7.875 0.929 444 HB3 LEU 63 1HB LEU 63 5.162 -6.628 1.236 445 HG LEU 63 HG LEU 63 2.264 -6.146 0.518 446 HD11 LEU 63 1HD1 LEU 63 2.514 -7.035 2.756 447 HD12 LEU 63 2HD1 LEU 63 2.055 -5.333 2.807 448 HD13 LEU 63 3HD1 LEU 63 3.724 -5.807 3.127 449 HD21 LEU 63 3HD2 LEU 63 4.454 -4.195 1.248 450 HD22 LEU 63 1HD2 LEU 63 2.748 -3.794 1.046 451 HD23 LEU 63 2HD2 LEU 63 3.685 -4.360 -0.331 452 H ASP 64 H ASP 64 6.872 -6.333 -1.762 453 HA ASP 64 HA ASP 64 7.720 -9.151 -2.037 454 HB2 ASP 64 2HB ASP 64 7.226 -8.117 -4.176 455 HB3 ASP 64 1HB ASP 64 8.269 -6.760 -3.792 456 H GLN 65 H GLN 65 8.643 -5.907 -1.171 457 HA GLN 65 HA GLN 65 11.304 -6.816 -0.429 458 HB2 GLN 65 2HB GLN 65 11.003 -4.684 -1.753 459 HB3 GLN 65 1HB GLN 65 10.135 -4.012 -0.383 460 HG2 GLN 65 2HG GLN 65 12.112 -4.105 0.980 461 HG3 GLN 65 1HG GLN 65 12.985 -4.959 -0.291 462 HE21 GLN 65 1HE2 GLN 65 11.783 -1.893 0.778 463 HE22 GLN 65 2HE2 GLN 65 12.629 -0.958 -0.415 464 HA PRO 66 HA PRO 66 9.942 -7.691 3.684 465 HB2 PRO 66 2HB PRO 66 12.303 -7.006 5.027 466 HB3 PRO 66 1HB PRO 66 11.923 -8.586 4.340 467 HG2 PRO 66 2HG PRO 66 13.531 -6.354 3.202 468 HG3 PRO 66 1HG PRO 66 13.796 -8.103 3.075 469 HD2 PRO 66 2HD PRO 66 12.805 -6.702 1.031 470 HD3 PRO 66 1HD PRO 66 12.212 -8.341 1.387 471 H THR 67 H THR 67 11.412 -4.645 3.001 472 HA THR 67 HA THR 67 9.533 -3.467 4.852 473 HB THR 67 HB THR 67 12.412 -2.546 4.522 474 HG1 THR 67 1HG THR 67 11.209 -4.400 6.046 475 HG21 THR 67 3HG2 THR 67 10.193 -1.619 6.370 476 HG22 THR 67 1HG2 THR 67 10.831 -0.709 5.003 477 HG23 THR 67 2HG2 THR 67 11.854 -1.033 6.403 478 H THR 68 H THR 68 8.144 -2.783 3.446 479 HA THR 68 HA THR 68 8.957 -1.593 0.935 480 HB THR 68 HB THR 68 6.260 -2.316 2.113 481 HG1 THR 68 1HG THR 68 7.827 -4.035 1.408 482 HG21 THR 68 3HG2 THR 68 6.062 -0.451 0.497 483 HG22 THR 68 1HG2 THR 68 5.352 -1.933 -0.147 484 HG23 THR 68 2HG2 THR 68 6.940 -1.407 -0.697 485 H THR 69 H THR 69 9.324 0.545 0.932 486 HA THR 69 HA THR 69 7.985 2.105 2.977 487 HB THR 69 HB THR 69 10.353 2.159 3.343 488 HG1 THR 69 1HG THR 69 9.955 4.138 3.822 489 HG21 THR 69 3HG2 THR 69 10.663 3.085 0.482 490 HG22 THR 69 1HG2 THR 69 11.154 1.517 1.120 491 HG23 THR 69 2HG2 THR 69 11.966 2.981 1.668 492 H ALA 70 H ALA 70 6.514 3.450 2.432 493 HA ALA 70 HA ALA 70 6.229 4.280 -0.364 494 HB1 ALA 70 1HB ALA 70 4.327 3.065 0.587 495 HB2 ALA 70 2HB ALA 70 3.893 4.736 0.222 496 HB3 ALA 70 3HB ALA 70 4.218 4.251 1.887 497 H GLY 71 H GLY 71 6.973 6.220 -0.731 498 HA2 GLY 71 2HA GLY 71 7.001 8.578 -0.459 499 HA3 GLY 71 1HA GLY 71 6.419 8.363 1.198 500 H ARG 72 H ARG 72 9.175 8.223 -0.921 501 HA ARG 72 HA ARG 72 11.122 8.666 0.955 502 HB2 ARG 72 2HB ARG 72 10.509 6.363 1.650 503 HB3 ARG 72 1HB ARG 72 10.573 5.840 -0.014 504 HG2 ARG 72 2HG ARG 72 12.485 5.000 0.965 505 HG3 ARG 72 1HG ARG 72 13.022 6.398 0.059 506 HD2 ARG 72 2HD ARG 72 13.361 7.651 2.034 507 HD3 ARG 72 1HD ARG 72 12.458 6.489 3.021 508 HE ARG 72 HE ARG 72 14.375 4.952 1.979 509 HH11 ARG 72 1HH1 ARG 72 14.654 8.033 3.727 510 HH12 ARG 72 2HH1 ARG 72 16.176 7.688 4.383 511 HH21 ARG 72 1HH2 ARG 72 16.528 4.446 2.963 512 HH22 ARG 72 2HH2 ARG 72 17.232 5.637 3.928 513 H HIS 73 H HIS 73 12.831 9.128 -0.441 514 HA HIS 73 HA HIS 73 12.211 8.691 -3.251 515 HB2 HIS 73 2HB HIS 73 13.648 11.052 -2.049 516 HB3 HIS 73 1HB HIS 73 13.654 10.723 -3.778 517 HD1 HIS 73 1HD HIS 73 11.507 12.094 -1.043 518 HD2 HIS 73 2HD HIS 73 11.137 11.006 -5.043 519 HE1 HIS 73 1HE HIS 73 9.340 13.052 -1.822 520 HA PRO 74 HA PRO 74 16.964 8.093 -3.563 521 HB2 PRO 74 2HB PRO 74 17.973 7.477 -0.892 522 HB3 PRO 74 1HB PRO 74 18.556 8.663 -2.058 523 HG2 PRO 74 2HG PRO 74 17.290 9.329 0.254 524 HG3 PRO 74 1HG PRO 74 17.246 10.337 -1.196 525 HD2 PRO 74 2HD PRO 74 15.178 8.515 -0.074 526 HD3 PRO 74 1HD PRO 74 14.989 10.063 -0.923 527 H GLU 75 H GLU 75 15.558 6.260 -0.863 528 HA GLU 75 HA GLU 75 16.312 3.782 -2.176 529 HB2 GLU 75 2HB GLU 75 17.825 4.247 -0.314 530 HB3 GLU 75 1HB GLU 75 16.457 4.555 0.739 531 HG2 GLU 75 2HG GLU 75 15.759 2.242 0.421 532 HG3 GLU 75 1HG GLU 75 17.243 1.989 -0.518 533 H SER 76 H SER 76 14.109 4.035 -2.998 534 HA SER 76 HA SER 76 11.981 3.927 -1.004 535 HB2 SER 76 2HB SER 76 10.732 4.761 -3.095 536 HB3 SER 76 1HB SER 76 11.788 5.872 -2.206 537 HG SER 76 HG SER 76 12.900 6.059 -4.003 538 H ASP 77 H ASP 77 9.997 2.843 -1.806 539 HA ASP 77 HA ASP 77 10.594 0.514 -3.483 540 HB2 ASP 77 2HB ASP 77 9.877 -0.025 -1.134 541 HB3 ASP 77 1HB ASP 77 8.368 0.828 -1.438 542 H ILE 78 H ILE 78 7.952 2.710 -2.526 543 HA ILE 78 HA ILE 78 7.292 2.991 -5.354 544 HB ILE 78 HB ILE 78 4.900 3.392 -4.672 545 HG12 ILE 78 2HG1 ILE 78 5.787 2.175 -2.038 546 HG13 ILE 78 1HG1 ILE 78 5.286 3.844 -2.285 547 HG21 ILE 78 1HG2 ILE 78 4.301 1.019 -4.472 548 HG22 ILE 78 2HG2 ILE 78 5.990 0.642 -4.125 549 HG23 ILE 78 3HG2 ILE 78 5.540 1.300 -5.698 550 HD11 ILE 78 3HD1 ILE 78 3.515 2.509 -1.269 551 HD12 ILE 78 1HD1 ILE 78 3.544 1.415 -2.655 552 HD13 ILE 78 2HD1 ILE 78 3.050 3.100 -2.860 553 H PHE 79 H PHE 79 6.365 5.098 -5.922 554 HA PHE 79 HA PHE 79 7.622 7.165 -4.246 555 HB2 PHE 79 2HB PHE 79 7.206 7.124 -7.233 556 HB3 PHE 79 1HB PHE 79 7.911 8.444 -6.322 557 HD1 PHE 79 2HD PHE 79 8.426 5.075 -7.652 558 HD2 PHE 79 1HD PHE 79 10.185 8.315 -5.533 559 HE1 PHE 79 2HE PHE 79 10.652 4.106 -8.035 560 HE2 PHE 79 1HE PHE 79 12.414 7.358 -5.918 561 HZ PHE 79 HZ PHE 79 12.653 5.252 -7.171 562 H LEU 80 H LEU 80 6.094 8.342 -3.248 563 HA LEU 80 HA LEU 80 3.557 8.897 -4.423 564 HB2 LEU 80 2HB LEU 80 4.989 10.060 -2.044 565 HB3 LEU 80 1HB LEU 80 3.530 10.802 -2.646 566 HG LEU 80 HG LEU 80 2.303 8.688 -2.167 567 HD11 LEU 80 1HD1 LEU 80 4.883 7.807 -0.896 568 HD12 LEU 80 2HD1 LEU 80 4.125 7.107 -2.322 569 HD13 LEU 80 3HD1 LEU 80 3.329 6.991 -0.752 570 HD21 LEU 80 3HD2 LEU 80 3.780 9.888 0.169 571 HD22 LEU 80 1HD2 LEU 80 2.293 8.946 0.268 572 HD23 LEU 80 2HD2 LEU 80 2.295 10.505 -0.556 573 H ASP 81 H ASP 81 3.461 9.945 -6.194 574 HA ASP 81 HA ASP 81 5.381 11.920 -7.048 575 HB2 ASP 81 2HB ASP 81 4.467 10.268 -8.595 576 HB3 ASP 81 1HB ASP 81 2.842 10.852 -8.294 577 H ASP 82 H ASP 82 2.969 12.146 -4.963 578 HA ASP 82 HA ASP 82 1.847 14.676 -5.929 579 HB2 ASP 82 2HB ASP 82 0.314 12.837 -5.148 580 HB3 ASP 82 1HB ASP 82 1.003 13.020 -3.544 581 H VAL 83 H VAL 83 1.583 16.409 -4.218 582 HA VAL 83 HA VAL 83 4.108 17.027 -3.084 583 HB VAL 83 HB VAL 83 2.539 18.709 -4.037 584 HG11 VAL 83 1HG1 VAL 83 0.428 17.890 -3.213 585 HG12 VAL 83 2HG1 VAL 83 0.664 19.564 -2.719 586 HG13 VAL 83 3HG1 VAL 83 0.900 18.260 -1.556 587 HG21 VAL 83 3HG2 VAL 83 2.892 20.469 -2.347 588 HG22 VAL 83 1HG2 VAL 83 4.329 19.481 -2.595 589 HG23 VAL 83 2HG2 VAL 83 3.327 19.232 -1.168 590 H THR 84 H THR 84 1.385 15.327 -1.859 591 HA THR 84 HA THR 84 1.699 15.948 0.893 592 HB THR 84 HB THR 84 0.237 13.843 1.162 593 HG1 THR 84 1HG THR 84 -0.185 14.201 -1.610 594 HG21 THR 84 3HG2 THR 84 -0.727 16.152 -0.545 595 HG22 THR 84 1HG2 THR 84 -0.655 16.136 1.218 596 HG23 THR 84 2HG2 THR 84 -1.760 15.056 0.366 597 H VAL 85 H VAL 85 4.002 14.623 -0.749 598 HA VAL 85 HA VAL 85 4.440 12.181 0.703 599 HB VAL 85 HB VAL 85 5.052 12.295 -1.675 600 HG11 VAL 85 1HG1 VAL 85 5.729 14.590 -1.891 601 HG12 VAL 85 2HG1 VAL 85 7.031 13.532 -2.434 602 HG13 VAL 85 3HG1 VAL 85 7.125 14.309 -0.850 603 HG21 VAL 85 3HG2 VAL 85 7.281 11.287 -1.538 604 HG22 VAL 85 1HG2 VAL 85 6.220 10.690 -0.261 605 HG23 VAL 85 2HG2 VAL 85 7.451 11.894 0.111 606 H SER 86 H SER 86 5.427 12.005 2.537 607 HA SER 86 HA SER 86 6.938 14.134 3.769 608 HB2 SER 86 2HB SER 86 5.386 12.752 5.100 609 HB3 SER 86 1HB SER 86 6.241 11.296 4.619 610 HG SER 86 HG SER 86 7.308 11.580 6.320 611 H ARG 87 H ARG 87 9.161 13.511 4.717 612 HA ARG 87 HA ARG 87 10.982 12.646 2.770 613 HB2 ARG 87 2HB ARG 87 11.342 12.610 5.784 614 HB3 ARG 87 1HB ARG 87 12.643 12.422 4.615 615 HG2 ARG 87 2HG ARG 87 12.209 14.658 3.751 616 HG3 ARG 87 1HG ARG 87 10.876 14.832 4.885 617 HD2 ARG 87 2HD ARG 87 13.769 14.455 5.605 618 HD3 ARG 87 1HD ARG 87 12.886 15.977 5.672 619 HE ARG 87 HE ARG 87 12.475 13.636 7.385 620 HH11 ARG 87 1HH1 ARG 87 11.909 17.123 6.829 621 HH12 ARG 87 2HH1 ARG 87 11.407 17.410 8.431 622 HH21 ARG 87 1HH2 ARG 87 11.804 14.087 9.549 623 HH22 ARG 87 2HH2 ARG 87 11.327 15.658 10.006 624 H ARG 88 H ARG 88 9.520 10.898 5.423 625 HA ARG 88 HA ARG 88 9.309 8.718 3.658 626 HB2 ARG 88 2HB ARG 88 10.075 6.931 5.131 627 HB3 ARG 88 1HB ARG 88 11.387 8.051 4.909 628 HG2 ARG 88 2HG ARG 88 9.640 7.866 7.352 629 HG3 ARG 88 1HG ARG 88 11.223 7.123 7.179 630 HD2 ARG 88 2HD ARG 88 12.122 9.446 6.813 631 HD3 ARG 88 1HD ARG 88 10.533 10.047 7.288 632 HE ARG 88 HE ARG 88 12.376 8.497 8.951 633 HH11 ARG 88 1HH1 ARG 88 9.526 10.607 8.756 634 HH12 ARG 88 2HH1 ARG 88 9.478 10.933 10.412 635 HH21 ARG 88 1HH2 ARG 88 12.305 8.969 11.254 636 HH22 ARG 88 2HH2 ARG 88 11.083 9.971 11.869 637 H HIS 89 H HIS 89 7.374 7.776 3.820 638 HA HIS 89 HA HIS 89 5.717 9.199 5.758 639 HB2 HIS 89 2HB HIS 89 5.371 9.797 3.368 640 HB3 HIS 89 1HB HIS 89 4.858 8.147 3.059 641 HD2 HIS 89 2HD HIS 89 2.323 7.489 4.007 642 HE1 HIS 89 1HE HIS 89 1.283 11.465 4.972 643 HE2 HIS 89 2HE HIS 89 0.668 9.016 5.193 644 H ALA 90 H ALA 90 5.149 6.210 3.871 645 HA ALA 90 HA ALA 90 4.184 5.080 6.401 646 HB1 ALA 90 1HB ALA 90 2.322 5.493 4.876 647 HB2 ALA 90 2HB ALA 90 2.570 3.764 5.099 648 HB3 ALA 90 3HB ALA 90 3.122 4.552 3.622 649 H GLU 91 H GLU 91 5.346 3.454 7.082 650 HA GLU 91 HA GLU 91 6.925 2.055 5.059 651 HB2 GLU 91 2HB GLU 91 8.217 3.310 6.792 652 HB3 GLU 91 1HB GLU 91 7.472 2.302 8.023 653 HG2 GLU 91 2HG GLU 91 8.517 0.334 7.069 654 HG3 GLU 91 1HG GLU 91 9.196 1.326 5.779 655 H PHE 92 H PHE 92 6.463 0.014 4.744 656 HA PHE 92 HA PHE 92 4.621 -1.290 6.612 657 HB2 PHE 92 2HB PHE 92 5.072 -2.017 3.710 658 HB3 PHE 92 1HB PHE 92 3.769 -2.545 4.755 659 HD1 PHE 92 1HD PHE 92 2.216 -0.557 5.638 660 HD2 PHE 92 2HD PHE 92 4.666 -0.381 2.171 661 HE1 PHE 92 1HE PHE 92 0.803 1.232 4.739 662 HE2 PHE 92 2HE PHE 92 3.258 1.412 1.264 663 HZ PHE 92 HZ PHE 92 1.322 2.228 2.551 664 H ARG 93 H ARG 93 5.717 -2.710 7.808 665 HA ARG 93 HA ARG 93 8.111 -3.951 6.680 666 HB2 ARG 93 2HB ARG 93 8.269 -2.765 8.911 667 HB3 ARG 93 1HB ARG 93 7.149 -3.959 9.553 668 HG2 ARG 93 2HG ARG 93 8.817 -5.714 8.763 669 HG3 ARG 93 1HG ARG 93 9.949 -4.383 8.559 670 HD2 ARG 93 2HD ARG 93 8.627 -5.309 11.106 671 HD3 ARG 93 1HD ARG 93 10.334 -5.396 10.700 672 HE ARG 93 HE ARG 93 8.797 -3.060 11.497 673 HH11 ARG 93 1HH1 ARG 93 11.976 -4.377 10.565 674 HH12 ARG 93 2HH1 ARG 93 12.857 -3.139 11.322 675 HH21 ARG 93 1HH2 ARG 93 10.049 -1.339 12.485 676 HH22 ARG 93 2HH2 ARG 93 11.744 -1.372 12.423 677 H ILE 94 H ILE 94 8.168 -6.158 6.534 678 HA ILE 94 HA ILE 94 5.738 -7.471 7.404 679 HB ILE 94 HB ILE 94 6.059 -9.189 5.641 680 HG12 ILE 94 2HG1 ILE 94 7.587 -8.416 3.654 681 HG13 ILE 94 1HG1 ILE 94 8.403 -7.492 4.904 682 HG21 ILE 94 1HG2 ILE 94 4.565 -7.366 5.178 683 HG22 ILE 94 2HG2 ILE 94 5.401 -7.847 3.699 684 HG23 ILE 94 3HG2 ILE 94 5.897 -6.393 4.555 685 HD11 ILE 94 3HD1 ILE 94 9.538 -9.617 4.465 686 HD12 ILE 94 1HD1 ILE 94 8.066 -10.485 4.898 687 HD13 ILE 94 2HD1 ILE 94 8.918 -9.538 6.115 688 H ASN 95 H ASN 95 5.926 -9.321 8.518 689 HA ASN 95 HA ASN 95 8.610 -9.925 9.445 690 HB2 ASN 95 2HB ASN 95 6.998 -8.694 11.055 691 HB3 ASN 95 1HB ASN 95 6.011 -10.141 11.006 692 HD21 ASN 95 1HD2 ASN 95 7.400 -8.802 13.219 693 HD22 ASN 95 2HD2 ASN 95 8.419 -10.007 13.914 694 H GLU 96 H GLU 96 8.905 -12.177 9.700 695 HA GLU 96 HA GLU 96 7.843 -13.831 7.699 696 HB2 GLU 96 2HB GLU 96 9.089 -15.626 8.829 697 HB3 GLU 96 1HB GLU 96 10.032 -14.153 8.629 698 HG2 GLU 96 2HG GLU 96 9.682 -13.559 10.933 699 HG3 GLU 96 1HG GLU 96 8.596 -14.927 11.141 700 H GLY 97 H GLY 97 5.729 -12.888 9.542 701 HA2 GLY 97 2HA GLY 97 4.138 -15.220 9.701 702 HA3 GLY 97 1HA GLY 97 4.679 -14.729 11.301 703 H GLU 98 H GLU 98 4.695 -11.871 10.789 704 HA GLU 98 HA GLU 98 1.811 -11.408 10.531 705 HB2 GLU 98 2HB GLU 98 3.654 -10.225 12.609 706 HB3 GLU 98 1HB GLU 98 1.948 -9.849 12.414 707 HG2 GLU 98 2HG GLU 98 1.371 -12.151 12.967 708 HG3 GLU 98 1HG GLU 98 3.081 -12.539 13.128 709 H PHE 99 H PHE 99 1.391 -8.983 10.403 710 HA PHE 99 HA PHE 99 3.378 -7.725 8.619 711 HB2 PHE 99 2HB PHE 99 0.370 -7.495 8.615 712 HB3 PHE 99 1HB PHE 99 1.438 -6.547 7.592 713 HD1 PHE 99 2HD PHE 99 2.588 -7.593 5.723 714 HD2 PHE 99 1HD PHE 99 -0.139 -9.787 8.137 715 HE1 PHE 99 2HE PHE 99 2.452 -9.327 3.981 716 HE2 PHE 99 1HE PHE 99 -0.290 -11.522 6.401 717 HZ PHE 99 HZ PHE 99 1.010 -11.291 4.318 718 H GLU 100 H GLU 100 4.106 -5.705 9.213 719 HA GLU 100 HA GLU 100 2.774 -4.378 11.489 720 HB2 GLU 100 2HB GLU 100 4.886 -5.430 12.162 721 HB3 GLU 100 1HB GLU 100 5.726 -4.598 10.866 722 HG2 GLU 100 2HG GLU 100 4.970 -2.435 11.976 723 HG3 GLU 100 1HG GLU 100 4.530 -3.427 13.360 724 H VAL 101 H VAL 101 2.015 -2.384 10.814 725 HA VAL 101 HA VAL 101 3.675 -1.033 8.830 726 HB VAL 101 HB VAL 101 1.705 0.015 7.808 727 HG11 VAL 101 1HG1 VAL 101 1.481 -2.981 7.964 728 HG12 VAL 101 2HG1 VAL 101 2.561 -2.096 6.906 729 HG13 VAL 101 3HG1 VAL 101 0.807 -1.971 6.686 730 HG21 VAL 101 3HG2 VAL 101 0.083 -1.726 9.677 731 HG22 VAL 101 1HG2 VAL 101 -0.568 -0.780 8.335 732 HG23 VAL 101 2HG2 VAL 101 0.184 0.037 9.704 733 H VAL 102 H VAL 102 4.345 0.954 9.256 734 HA VAL 102 HA VAL 102 3.217 2.241 11.622 735 HB VAL 102 HB VAL 102 5.429 3.167 12.172 736 HG11 VAL 102 1HG1 VAL 102 6.402 1.116 13.099 737 HG12 VAL 102 2HG1 VAL 102 5.355 0.158 12.054 738 HG13 VAL 102 3HG1 VAL 102 4.651 1.173 13.315 739 HG21 VAL 102 3HG2 VAL 102 6.458 1.308 10.025 740 HG22 VAL 102 1HG2 VAL 102 7.458 2.210 11.166 741 HG23 VAL 102 2HG2 VAL 102 6.480 3.071 9.979 742 H ASP 103 H ASP 103 2.784 4.306 11.584 743 HA ASP 103 HA ASP 103 3.121 5.755 9.070 744 HB2 ASP 103 2HB ASP 103 0.899 5.922 9.979 745 HB3 ASP 103 1HB ASP 103 1.530 6.404 11.547 746 H VAL 104 H VAL 104 4.975 6.691 8.857 747 HA VAL 104 HA VAL 104 6.017 8.239 11.116 748 HB VAL 104 HB VAL 104 8.293 8.066 9.996 749 HG11 VAL 104 1HG1 VAL 104 7.730 6.681 11.926 750 HG12 VAL 104 2HG1 VAL 104 8.748 5.784 10.796 751 HG13 VAL 104 3HG1 VAL 104 7.013 5.471 10.863 752 HG21 VAL 104 3HG2 VAL 104 6.909 5.923 8.378 753 HG22 VAL 104 1HG2 VAL 104 8.645 6.233 8.392 754 HG23 VAL 104 2HG2 VAL 104 7.531 7.446 7.749 755 H GLY 105 H GLY 105 4.252 8.575 8.562 756 HA2 GLY 105 2HA GLY 105 5.492 11.043 7.571 757 HA3 GLY 105 1HA GLY 105 4.246 10.103 6.743 758 H SER 106 H SER 106 4.342 10.845 10.097 759 HA SER 106 HA SER 106 1.678 11.597 10.315 760 HB2 SER 106 2HB SER 106 3.945 12.093 12.226 761 HB3 SER 106 1HB SER 106 2.228 11.953 12.620 762 HG SER 106 HG SER 106 2.448 9.815 11.497 763 H LEU 107 H LEU 107 3.949 13.363 8.870 764 HA LEU 107 HA LEU 107 3.439 16.003 9.791 765 HB2 LEU 107 2HB LEU 107 4.385 14.968 7.109 766 HB3 LEU 107 1HB LEU 107 4.262 16.664 7.495 767 HG LEU 107 HG LEU 107 5.991 16.295 9.292 768 HD11 LEU 107 1HD1 LEU 107 7.391 14.320 9.158 769 HD12 LEU 107 2HD1 LEU 107 6.288 13.600 7.983 770 HD13 LEU 107 3HD1 LEU 107 5.745 13.912 9.634 771 HD21 LEU 107 3HD2 LEU 107 6.787 15.627 6.473 772 HD22 LEU 107 1HD2 LEU 107 7.870 16.196 7.742 773 HD23 LEU 107 2HD2 LEU 107 6.582 17.243 7.151 774 H ASN 108 H ASN 108 2.034 13.797 7.502 775 HA ASN 108 HA ASN 108 -0.292 15.592 7.282 776 HB2 ASN 108 2HB ASN 108 0.959 15.055 5.082 777 HB3 ASN 108 1HB ASN 108 0.360 13.411 5.282 778 HD21 ASN 108 1HD2 ASN 108 -0.422 16.635 4.430 779 HD22 ASN 108 2HD2 ASN 108 -2.053 16.348 3.944 780 H GLY 109 H GLY 109 0.921 12.263 7.536 781 HA2 GLY 109 2HA GLY 109 0.072 10.874 9.278 782 HA3 GLY 109 1HA GLY 109 -1.490 11.643 9.073 783 H THR 110 H THR 110 -0.382 8.828 8.927 784 HA THR 110 HA THR 110 -1.688 8.124 6.416 785 HB THR 110 HB THR 110 -0.011 6.373 8.248 786 HG1 THR 110 1HG THR 110 1.417 7.734 7.455 787 HG21 THR 110 3HG2 THR 110 0.111 4.877 6.293 788 HG22 THR 110 1HG2 THR 110 -0.909 5.989 5.380 789 HG23 THR 110 2HG2 THR 110 -1.565 5.139 6.779 790 H TYR 111 H TYR 111 -3.634 7.286 6.556 791 HA TYR 111 HA TYR 111 -4.747 6.808 9.235 792 HB2 TYR 111 2HB TYR 111 -6.131 7.443 6.616 793 HB3 TYR 111 1HB TYR 111 -6.943 7.138 8.138 794 HD1 TYR 111 1HD TYR 111 -4.559 9.481 6.478 795 HD2 TYR 111 2HD TYR 111 -7.331 8.875 9.638 796 HE1 TYR 111 1HE TYR 111 -4.424 11.868 7.041 797 HE2 TYR 111 2HE TYR 111 -7.205 11.251 10.213 798 HH TYR 111 HH TYR 111 -5.711 13.572 8.194 799 H VAL 112 H VAL 112 -5.462 4.814 9.731 800 HA VAL 112 HA VAL 112 -5.894 2.978 7.526 801 HB VAL 112 HB VAL 112 -3.783 2.334 8.634 802 HG11 VAL 112 1HG1 VAL 112 -3.718 1.579 10.969 803 HG12 VAL 112 2HG1 VAL 112 -5.376 2.147 11.179 804 HG13 VAL 112 3HG1 VAL 112 -4.093 3.297 10.819 805 HG21 VAL 112 3HG2 VAL 112 -4.285 0.014 9.118 806 HG22 VAL 112 1HG2 VAL 112 -5.252 0.573 7.759 807 HG23 VAL 112 2HG2 VAL 112 -5.989 0.404 9.351 808 H ASN 113 H ASN 113 -7.798 2.049 7.545 809 HA ASN 113 HA ASN 113 -10.017 1.699 8.064 810 HB2 ASN 113 2HB ASN 113 -9.090 1.884 10.969 811 HB3 ASN 113 1HB ASN 113 -10.673 1.333 10.457 812 HD21 ASN 113 1HD2 ASN 113 -10.857 -0.689 9.507 813 HD22 ASN 113 2HD2 ASN 113 -9.617 -1.879 9.635 814 H ARG 114 H ARG 114 -8.772 4.325 7.809 815 HA ARG 114 HA ARG 114 -9.320 6.499 7.734 816 HB2 ARG 114 2HB ARG 114 -11.933 5.512 8.834 817 HB3 ARG 114 1HB ARG 114 -11.605 7.236 8.792 818 HG2 ARG 114 2HG ARG 114 -11.507 5.437 6.378 819 HG3 ARG 114 1HG ARG 114 -12.910 6.402 6.849 820 HD2 ARG 114 2HD ARG 114 -10.161 7.448 6.119 821 HD3 ARG 114 1HD ARG 114 -11.636 7.593 5.170 822 HE ARG 114 HE ARG 114 -12.476 8.788 7.269 823 HH11 ARG 114 1HH1 ARG 114 -9.241 9.169 5.776 824 HH12 ARG 114 2HH1 ARG 114 -8.976 10.705 6.447 825 HH21 ARG 114 1HH2 ARG 114 -12.025 10.927 8.232 826 HH22 ARG 114 2HH2 ARG 114 -10.556 11.706 7.863 827 H GLU 115 H GLU 115 -8.339 4.981 10.328 828 HA GLU 115 HA GLU 115 -8.492 7.356 12.024 829 HB2 GLU 115 2HB GLU 115 -9.508 5.368 13.030 830 HB3 GLU 115 1HB GLU 115 -8.033 4.454 12.756 831 HG2 GLU 115 2HG GLU 115 -6.841 5.847 14.321 832 HG3 GLU 115 1HG GLU 115 -8.265 6.861 14.531 833 HA PRO 116 HA PRO 116 -4.071 7.566 11.253 834 HB2 PRO 116 2HB PRO 116 -3.522 9.651 12.919 835 HB3 PRO 116 1HB PRO 116 -4.273 9.884 11.338 836 HG2 PRO 116 2HG PRO 116 -5.520 9.890 14.047 837 HG3 PRO 116 1HG PRO 116 -5.907 10.880 12.631 838 HD2 PRO 116 2HD PRO 116 -7.349 8.672 13.432 839 HD3 PRO 116 1HD PRO 116 -7.325 9.308 11.778 840 H ARG 117 H ARG 117 -2.991 5.911 12.161 841 HA ARG 117 HA ARG 117 -2.830 5.808 15.096 842 HB2 ARG 117 2HB ARG 117 -4.358 4.080 13.820 843 HB3 ARG 117 1HB ARG 117 -2.833 3.321 13.397 844 HG2 ARG 117 2HG ARG 117 -2.307 2.967 15.699 845 HG3 ARG 117 1HG ARG 117 -3.737 3.874 16.211 846 HD2 ARG 117 2HD ARG 117 -5.087 2.152 14.914 847 HD3 ARG 117 1HD ARG 117 -3.602 1.203 14.825 848 HE ARG 117 HE ARG 117 -4.059 1.966 17.467 849 HH11 ARG 117 1HH1 ARG 117 -5.215 -0.383 15.069 850 HH12 ARG 117 2HH1 ARG 117 -6.030 -1.364 16.191 851 HH21 ARG 117 1HH2 ARG 117 -5.171 0.572 19.049 852 HH22 ARG 117 2HH2 ARG 117 -5.993 -0.796 18.511 853 H ASN 118 H ASN 118 -0.737 4.779 15.837 854 HA ASN 118 HA ASN 118 1.339 5.749 14.075 855 HB2 ASN 118 2HB ASN 118 1.443 6.216 16.512 856 HB3 ASN 118 1HB ASN 118 1.608 4.493 16.820 857 HD21 ASN 118 1HD2 ASN 118 3.178 6.334 14.217 858 HD22 ASN 118 2HD2 ASN 118 4.779 6.071 14.787 859 H ALA 119 H ALA 119 0.536 2.672 15.624 860 HA ALA 119 HA ALA 119 1.952 1.323 13.459 861 HB1 ALA 119 1HB ALA 119 3.350 1.216 15.479 862 HB2 ALA 119 2HB ALA 119 2.699 -0.374 15.077 863 HB3 ALA 119 3HB ALA 119 1.985 0.565 16.388 864 H GLN 120 H GLN 120 0.872 -0.396 12.674 865 HA GLN 120 HA GLN 120 -1.591 -1.271 14.019 866 HB2 GLN 120 2HB GLN 120 -2.285 0.405 12.407 867 HB3 GLN 120 1HB GLN 120 -1.316 -0.339 11.150 868 HG2 GLN 120 2HG GLN 120 -3.569 -0.910 10.723 869 HG3 GLN 120 1HG GLN 120 -2.782 -2.357 11.341 870 HE21 GLN 120 1HE2 GLN 120 -4.573 -3.322 12.079 871 HE22 GLN 120 2HE2 GLN 120 -5.551 -2.711 13.370 872 H VAL 121 H VAL 121 -2.039 -3.497 13.663 873 HA VAL 121 HA VAL 121 -0.112 -4.958 12.069 874 HB VAL 121 HB VAL 121 -2.556 -5.980 13.611 875 HG11 VAL 121 1HG1 VAL 121 -1.590 -8.220 13.288 876 HG12 VAL 121 2HG1 VAL 121 -0.302 -7.520 12.311 877 HG13 VAL 121 3HG1 VAL 121 -1.972 -7.452 11.746 878 HG21 VAL 121 3HG2 VAL 121 -0.959 -6.846 15.242 879 HG22 VAL 121 1HG2 VAL 121 -0.803 -5.096 15.095 880 HG23 VAL 121 2HG2 VAL 121 0.375 -6.159 14.324 881 H MET 122 H MET 122 -0.437 -5.236 10.052 882 HA MET 122 HA MET 122 -2.368 -3.835 8.600 883 HB2 MET 122 2HB MET 122 -0.043 -4.674 7.931 884 HB3 MET 122 1HB MET 122 -0.843 -6.181 7.540 885 HG2 MET 122 2HG MET 122 -0.480 -4.842 5.573 886 HG3 MET 122 1HG MET 122 -2.205 -5.036 5.888 887 HE1 MET 122 3HE MET 122 -1.864 -3.016 3.891 888 HE2 MET 122 1HE MET 122 -0.165 -2.746 4.255 889 HE3 MET 122 2HE MET 122 -1.298 -1.394 4.301 890 H GLN 123 H GLN 123 -4.435 -4.252 8.261 891 HA GLN 123 HA GLN 123 -5.432 -6.968 8.675 892 HB2 GLN 123 2HB GLN 123 -6.154 -5.143 10.235 893 HB3 GLN 123 1HB GLN 123 -6.883 -4.318 8.873 894 HG2 GLN 123 2HG GLN 123 -8.508 -6.027 8.608 895 HG3 GLN 123 1HG GLN 123 -7.661 -7.072 9.753 896 HE21 GLN 123 1HE2 GLN 123 -9.754 -4.329 9.410 897 HE22 GLN 123 2HE2 GLN 123 -10.194 -4.256 11.083 898 H THR 124 H THR 124 -6.478 -7.988 7.025 899 HA THR 124 HA THR 124 -6.268 -6.733 4.450 900 HB THR 124 HB THR 124 -5.516 -9.018 4.545 901 HG1 THR 124 1HG THR 124 -7.794 -9.614 3.179 902 HG21 THR 124 3HG2 THR 124 -8.311 -9.737 5.450 903 HG22 THR 124 1HG2 THR 124 -6.828 -9.888 6.390 904 HG23 THR 124 2HG2 THR 124 -7.081 -10.908 4.974 905 H GLY 125 H GLY 125 -7.732 -5.876 3.254 906 HA2 GLY 125 2HA GLY 125 -9.935 -5.901 2.327 907 HA3 GLY 125 1HA GLY 125 -10.537 -6.368 3.913 908 H ASP 126 H ASP 126 -8.350 -4.297 4.777 909 HA ASP 126 HA ASP 126 -10.306 -2.154 4.719 910 HB2 ASP 126 2HB ASP 126 -8.236 -2.840 6.750 911 HB3 ASP 126 1HB ASP 126 -8.958 -1.229 6.697 912 H GLU 127 H GLU 127 -9.220 0.030 5.196 913 HA GLU 127 HA GLU 127 -7.515 0.368 2.853 914 HB2 GLU 127 2HB GLU 127 -8.503 2.566 2.605 915 HB3 GLU 127 1HB GLU 127 -9.728 1.306 2.598 916 HG2 GLU 127 2HG GLU 127 -10.245 1.823 4.945 917 HG3 GLU 127 1HG GLU 127 -9.046 3.115 4.903 918 H ILE 128 H ILE 128 -5.848 1.631 2.877 919 HA ILE 128 HA ILE 128 -4.951 2.864 5.357 920 HB ILE 128 HB ILE 128 -3.235 1.440 3.268 921 HG12 ILE 128 2HG1 ILE 128 -2.514 0.003 5.287 922 HG13 ILE 128 1HG1 ILE 128 -3.924 0.645 6.105 923 HG21 ILE 128 1HG2 ILE 128 -2.382 2.854 5.784 924 HG22 ILE 128 2HG2 ILE 128 -2.102 3.388 4.128 925 HG23 ILE 128 3HG2 ILE 128 -1.324 1.922 4.725 926 HD11 ILE 128 3HD1 ILE 128 -4.335 -1.574 5.202 927 HD12 ILE 128 1HD1 ILE 128 -3.935 -1.003 3.581 928 HD13 ILE 128 2HD1 ILE 128 -5.362 -0.377 4.410 929 H GLN 129 H GLN 129 -4.972 4.946 4.979 930 HA GLN 129 HA GLN 129 -4.799 5.900 2.222 931 HB2 GLN 129 2HB GLN 129 -5.741 7.427 4.637 932 HB3 GLN 129 1HB GLN 129 -5.904 7.882 2.952 933 HG2 GLN 129 2HG GLN 129 -7.397 5.944 2.608 934 HG3 GLN 129 1HG GLN 129 -7.302 5.608 4.337 935 HE21 GLN 129 1HE2 GLN 129 -9.619 6.200 2.855 936 HE22 GLN 129 2HE2 GLN 129 -10.296 7.657 3.432 937 H ILE 130 H ILE 130 -2.965 6.722 1.664 938 HA ILE 130 HA ILE 130 -1.133 7.683 3.703 939 HB ILE 130 HB ILE 130 0.541 7.869 1.809 940 HG12 ILE 130 2HG1 ILE 130 -1.615 6.436 0.220 941 HG13 ILE 130 1HG1 ILE 130 -1.057 8.077 -0.064 942 HG21 ILE 130 1HG2 ILE 130 0.938 5.449 1.618 943 HG22 ILE 130 2HG2 ILE 130 -0.671 5.145 2.272 944 HG23 ILE 130 3HG2 ILE 130 0.550 5.941 3.265 945 HD11 ILE 130 3HD1 ILE 130 1.139 7.233 -0.686 946 HD12 ILE 130 1HD1 ILE 130 -0.126 6.515 -1.681 947 HD13 ILE 130 2HD1 ILE 130 0.604 5.581 -0.372 948 H GLY 131 H GLY 131 -1.709 9.610 4.355 949 HA2 GLY 131 2HA GLY 131 -1.950 11.878 4.243 950 HA3 GLY 131 1HA GLY 131 -1.741 11.788 2.490 951 H LYS 132 H LYS 132 -3.437 11.496 1.192 952 HA LYS 132 HA LYS 132 -6.078 11.092 2.385 953 HB2 LYS 132 2HB LYS 132 -5.382 13.323 0.470 954 HB3 LYS 132 1HB LYS 132 -7.026 12.838 0.846 955 HG2 LYS 132 2HG LYS 132 -6.659 13.411 3.192 956 HG3 LYS 132 1HG LYS 132 -5.009 13.902 2.805 957 HD2 LYS 132 2HD LYS 132 -5.887 15.605 1.284 958 HD3 LYS 132 1HD LYS 132 -7.528 15.106 1.691 959 HE2 LYS 132 2HE LYS 132 -7.197 15.736 3.995 960 HE3 LYS 132 1HE LYS 132 -5.511 16.129 3.678 961 HZ1 LYS 132 3HZ LYS 132 -6.238 17.875 2.191 962 HZ2 LYS 132 1HZ LYS 132 -6.893 18.094 3.732 963 HZ3 LYS 132 2HZ LYS 132 -7.848 17.488 2.473 964 H PHE 133 H PHE 133 -4.015 9.673 0.627 965 HA PHE 133 HA PHE 133 -5.776 9.144 -1.641 966 HB2 PHE 133 2HB PHE 133 -2.832 8.538 -1.309 967 HB3 PHE 133 1HB PHE 133 -3.800 8.144 -2.732 968 HD1 PHE 133 2HD PHE 133 -5.253 10.244 -3.581 969 HD2 PHE 133 1HD PHE 133 -1.565 10.443 -1.475 970 HE1 PHE 133 2HE PHE 133 -4.878 12.502 -4.469 971 HE2 PHE 133 1HE PHE 133 -1.188 12.698 -2.355 972 HZ PHE 133 HZ PHE 133 -2.844 13.732 -3.848 973 H ARG 134 H ARG 134 -6.608 7.177 -1.980 974 HA ARG 134 HA ARG 134 -6.646 5.587 0.458 975 HB2 ARG 134 2HB ARG 134 -8.676 6.653 -0.632 976 HB3 ARG 134 1HB ARG 134 -8.516 5.432 -1.878 977 HG2 ARG 134 2HG ARG 134 -8.859 3.686 -0.219 978 HG3 ARG 134 1HG ARG 134 -8.971 4.907 1.052 979 HD2 ARG 134 2HD ARG 134 -10.855 5.940 -0.330 980 HD3 ARG 134 1HD ARG 134 -10.861 4.433 -1.244 981 HE ARG 134 HE ARG 134 -11.005 4.110 1.599 982 HH11 ARG 134 1HH1 ARG 134 -13.007 4.737 -1.252 983 HH12 ARG 134 2HH1 ARG 134 -14.413 4.038 -0.566 984 HH21 ARG 134 1HH2 ARG 134 -12.924 3.241 2.531 985 HH22 ARG 134 2HH2 ARG 134 -14.373 3.165 1.623 986 H LEU 135 H LEU 135 -5.555 3.779 0.524 987 HA LEU 135 HA LEU 135 -5.273 2.120 -1.860 988 HB2 LEU 135 2HB LEU 135 -3.364 2.598 0.433 989 HB3 LEU 135 1HB LEU 135 -3.281 1.147 -0.535 990 HG LEU 135 HG LEU 135 -2.845 2.540 -2.510 991 HD11 LEU 135 1HD1 LEU 135 -3.797 4.663 -1.822 992 HD12 LEU 135 2HD1 LEU 135 -2.080 4.888 -2.180 993 HD13 LEU 135 3HD1 LEU 135 -2.632 4.783 -0.509 994 HD21 LEU 135 3HD2 LEU 135 -1.034 1.486 -1.318 995 HD22 LEU 135 1HD2 LEU 135 -0.910 2.865 -0.229 996 HD23 LEU 135 2HD2 LEU 135 -0.511 3.056 -1.934 997 H VAL 136 H VAL 136 -5.678 -0.016 -1.518 998 HA VAL 136 HA VAL 136 -6.619 -0.690 1.156 999 HB VAL 136 HB VAL 136 -8.661 -0.272 -0.085 1000 HG11 VAL 136 1HG1 VAL 136 -7.869 -0.528 -2.333 1001 HG12 VAL 136 2HG1 VAL 136 -9.302 -1.524 -2.075 1002 HG13 VAL 136 3HG1 VAL 136 -7.703 -2.268 -2.102 1003 HG21 VAL 136 3HG2 VAL 136 -9.812 -2.455 0.079 1004 HG22 VAL 136 1HG2 VAL 136 -8.806 -2.107 1.489 1005 HG23 VAL 136 2HG2 VAL 136 -8.245 -3.239 0.260 1006 H PHE 137 H PHE 137 -6.012 -2.535 1.970 1007 HA PHE 137 HA PHE 137 -4.061 -4.087 0.438 1008 HB2 PHE 137 2HB PHE 137 -3.329 -3.086 2.508 1009 HB3 PHE 137 1HB PHE 137 -4.649 -3.831 3.385 1010 HD1 PHE 137 2HD PHE 137 -1.480 -4.515 1.596 1011 HD2 PHE 137 1HD PHE 137 -4.429 -6.006 4.276 1012 HE1 PHE 137 2HE PHE 137 -0.003 -6.388 2.183 1013 HE2 PHE 137 1HE PHE 137 -2.959 -7.880 4.866 1014 HZ PHE 137 HZ PHE 137 -0.738 -8.072 3.823 1015 H LEU 138 H LEU 138 -4.570 -6.088 -0.248 1016 HA LEU 138 HA LEU 138 -6.762 -7.505 1.092 1017 HB2 LEU 138 2HB LEU 138 -6.252 -7.436 -1.881 1018 HB3 LEU 138 1HB LEU 138 -7.363 -8.513 -1.084 1019 HG LEU 138 HG LEU 138 -8.667 -6.940 -2.065 1020 HD11 LEU 138 1HD1 LEU 138 -9.424 -7.336 0.141 1021 HD12 LEU 138 2HD1 LEU 138 -9.763 -5.662 -0.309 1022 HD13 LEU 138 3HD1 LEU 138 -8.416 -6.030 0.767 1023 HD21 LEU 138 3HD2 LEU 138 -8.382 -4.495 -1.916 1024 HD22 LEU 138 1HD2 LEU 138 -7.030 -5.300 -2.712 1025 HD23 LEU 138 2HD2 LEU 138 -6.869 -4.752 -1.042 1026 H ALA 139 H ALA 139 -6.463 -9.596 1.370 1027 HA ALA 139 HA ALA 139 -3.897 -10.768 0.684 1028 HB1 ALA 139 1HB ALA 139 -4.674 -12.729 1.973 1029 HB2 ALA 139 2HB ALA 139 -6.260 -11.981 2.152 1030 HB3 ALA 139 3HB ALA 139 -4.852 -11.252 2.921 1031 H GLY 140 H GLY 140 -4.017 -10.797 -1.480 1032 HA2 GLY 140 2HA GLY 140 -6.294 -11.755 -2.908 1033 HA3 GLY 140 1HA GLY 140 -4.748 -11.286 -3.592 1034 HA PRO 141 HA PRO 141 -5.342 -15.882 -3.897 1035 HB2 PRO 141 2HB PRO 141 -4.975 -16.063 -6.573 1036 HB3 PRO 141 1HB PRO 141 -6.552 -15.785 -5.826 1037 HG2 PRO 141 2HG PRO 141 -4.682 -13.837 -7.108 1038 HG3 PRO 141 1HG PRO 141 -6.449 -13.920 -7.212 1039 HD2 PRO 141 2HD PRO 141 -5.127 -12.176 -5.592 1040 HD3 PRO 141 1HD PRO 141 -6.737 -12.818 -5.216 1041 H ALA 142 H ALA 142 -3.748 -17.230 -3.809 1042 HA ALA 142 HA ALA 142 -1.043 -16.346 -4.468 1043 HB1 ALA 142 1HB ALA 142 -2.084 -18.635 -2.785 1044 HB2 ALA 142 2HB ALA 142 -1.378 -17.141 -2.179 1045 HB3 ALA 142 3HB ALA 142 -0.378 -18.304 -3.051 1046 H GLU 143 H GLU 143 -0.669 -16.833 -6.590 1047 HA GLU 143 HA GLU 143 -1.727 -19.349 -7.611 1048 HB2 GLU 143 2HB GLU 143 -2.128 -17.228 -8.898 1049 HB3 GLU 143 1HB GLU 143 -0.396 -17.092 -9.141 1050 HG2 GLU 143 2HG GLU 143 -0.390 -19.173 -10.411 1051 HG3 GLU 143 1HG GLU 143 -2.122 -19.354 -10.133 Start of MODEL 23 1 H1 MET 1 1HT MET 1 59.999 69.350 32.168 2 H2 MET 1 2HT MET 1 58.342 69.171 32.108 3 H3 MET 1 3HT MET 1 59.180 69.437 30.684 4 HA MET 1 HA MET 1 58.491 67.135 30.947 5 HB2 MET 1 2HB MET 1 60.613 67.562 29.730 6 HB3 MET 1 1HB MET 1 61.477 67.506 31.259 7 HG2 MET 1 2HG MET 1 60.783 65.154 31.538 8 HG3 MET 1 1HG MET 1 59.987 65.225 29.973 9 HE1 MET 1 2HE MET 1 63.424 65.390 31.885 10 HE2 MET 1 3HE MET 1 63.444 66.899 30.973 11 HE3 MET 1 1HE MET 1 64.559 65.606 30.553 12 H SER 2 H SER 2 57.568 66.181 32.634 13 HA SER 2 HA SER 2 58.833 66.109 35.212 14 HB2 SER 2 2HB SER 2 56.463 64.549 34.186 15 HB3 SER 2 1HB SER 2 56.876 64.873 35.873 16 HG SER 2 HG SER 2 56.709 67.210 34.550 17 H ASP 3 H ASP 3 58.018 63.817 32.605 18 HA ASP 3 HA ASP 3 60.327 62.193 33.133 19 HB2 ASP 3 2HB ASP 3 58.693 61.290 34.770 20 HB3 ASP 3 1HB ASP 3 57.514 61.086 33.485 21 H ASN 4 H ASN 4 60.946 61.312 31.167 22 HA ASN 4 HA ASN 4 59.058 61.731 28.961 23 HB2 ASN 4 2HB ASN 4 60.948 61.783 27.408 24 HB3 ASN 4 1HB ASN 4 61.222 62.949 28.690 25 HD21 ASN 4 1HD2 ASN 4 62.952 62.639 30.087 26 HD22 ASN 4 2HD2 ASN 4 64.148 61.429 29.818 27 H ASN 5 H ASN 5 58.803 60.091 27.386 28 HA ASN 5 HA ASN 5 59.484 57.461 28.486 29 HB2 ASN 5 2HB ASN 5 56.928 58.224 27.058 30 HB3 ASN 5 1HB ASN 5 57.365 56.588 27.524 31 HD21 ASN 5 1HD2 ASN 5 58.530 57.474 30.103 32 HD22 ASN 5 2HD2 ASN 5 57.215 57.888 31.106 33 H GLY 6 H GLY 6 61.107 56.781 27.310 34 HA2 GLY 6 2HA GLY 6 60.653 56.514 24.433 35 HA3 GLY 6 1HA GLY 6 62.171 57.197 25.016 36 H THR 7 H THR 7 60.081 54.507 25.918 37 HA THR 7 HA THR 7 62.193 52.926 26.855 38 HB THR 7 HB THR 7 59.901 52.643 27.687 39 HG1 THR 7 1HG THR 7 60.540 50.199 26.416 40 HG21 THR 7 3HG2 THR 7 58.630 53.024 25.635 41 HG22 THR 7 1HG2 THR 7 58.167 51.484 26.360 42 HG23 THR 7 2HG2 THR 7 59.242 51.518 24.958 43 HA PRO 8 HA PRO 8 63.825 51.564 22.930 44 HB2 PRO 8 2HB PRO 8 64.831 49.271 24.516 45 HB3 PRO 8 1HB PRO 8 65.733 50.405 23.503 46 HG2 PRO 8 2HG PRO 8 65.873 50.543 26.160 47 HG3 PRO 8 1HG PRO 8 65.825 52.016 25.172 48 HD2 PRO 8 2HD PRO 8 63.649 50.729 26.766 49 HD3 PRO 8 1HD PRO 8 64.059 52.450 26.557 50 H GLU 9 H GLU 9 62.733 50.436 21.426 51 HA GLU 9 HA GLU 9 61.097 48.207 22.319 52 HB2 GLU 9 2HB GLU 9 60.935 49.832 19.768 53 HB3 GLU 9 1HB GLU 9 59.871 48.496 20.178 54 HG2 GLU 9 2HG GLU 9 59.129 49.752 22.183 55 HG3 GLU 9 1HG GLU 9 60.117 51.111 21.653 56 HA PRO 10 HA PRO 10 64.295 45.741 20.497 57 HB2 PRO 10 2HB PRO 10 63.277 43.330 21.174 58 HB3 PRO 10 1HB PRO 10 64.126 44.389 22.310 59 HG2 PRO 10 2HG PRO 10 61.199 43.921 21.978 60 HG3 PRO 10 1HG PRO 10 62.129 44.173 23.461 61 HD2 PRO 10 2HD PRO 10 60.622 46.109 22.238 62 HD3 PRO 10 1HD PRO 10 62.015 46.444 23.285 63 H GLN 11 H GLN 11 64.552 45.207 18.514 64 HA GLN 11 HA GLN 11 62.292 44.168 16.958 65 HB2 GLN 11 2HB GLN 11 63.580 46.310 16.245 66 HB3 GLN 11 1HB GLN 11 64.923 45.243 15.900 67 HG2 GLN 11 2HG GLN 11 62.212 45.100 14.577 68 HG3 GLN 11 1HG GLN 11 63.630 45.877 13.895 69 HE21 GLN 11 1HE2 GLN 11 65.311 44.576 13.160 70 HE22 GLN 11 2HE2 GLN 11 65.084 42.909 12.780 71 H VAL 12 H VAL 12 62.379 42.003 17.047 72 HA VAL 12 HA VAL 12 64.984 40.744 16.731 73 HB VAL 12 HB VAL 12 64.280 40.459 19.066 74 HG11 VAL 12 1HG1 VAL 12 61.794 39.143 17.992 75 HG12 VAL 12 2HG1 VAL 12 61.883 40.679 18.854 76 HG13 VAL 12 3HG1 VAL 12 62.288 39.177 19.686 77 HG21 VAL 12 3HG2 VAL 12 65.547 38.642 18.112 78 HG22 VAL 12 1HG2 VAL 12 64.074 37.913 17.466 79 HG23 VAL 12 2HG2 VAL 12 64.323 37.991 19.205 80 H GLU 13 H GLU 13 65.089 39.148 15.234 81 HA GLU 13 HA GLU 13 62.611 38.720 13.769 82 HB2 GLU 13 2HB GLU 13 64.393 39.761 12.462 83 HB3 GLU 13 1HB GLU 13 65.461 38.408 12.819 84 HG2 GLU 13 2HG GLU 13 63.921 36.902 11.631 85 HG3 GLU 13 1HG GLU 13 62.902 38.282 11.241 86 H THR 14 H THR 14 61.766 36.801 13.685 87 HA THR 14 HA THR 14 63.352 34.412 13.796 88 HB THR 14 HB THR 14 61.116 34.883 15.813 89 HG1 THR 14 1HG THR 14 63.702 35.380 15.896 90 HG21 THR 14 3HG2 THR 14 61.150 32.560 14.918 91 HG22 THR 14 1HG2 THR 14 61.617 32.624 16.618 92 HG23 THR 14 2HG2 THR 14 62.847 32.433 15.373 93 H THR 15 H THR 15 62.718 33.567 11.900 94 HA THR 15 HA THR 15 60.007 33.907 11.088 95 HB THR 15 HB THR 15 61.010 33.056 8.881 96 HG1 THR 15 1HG THR 15 63.156 33.061 8.707 97 HG21 THR 15 3HG2 THR 15 61.996 35.646 10.091 98 HG22 THR 15 1HG2 THR 15 60.458 35.410 9.261 99 HG23 THR 15 2HG2 THR 15 61.977 35.278 8.367 100 H SER 16 H SER 16 58.705 32.359 11.166 101 HA SER 16 HA SER 16 59.439 29.784 12.231 102 HB2 SER 16 2HB SER 16 57.403 30.986 13.038 103 HB3 SER 16 1HB SER 16 56.699 30.813 11.437 104 HG SER 16 HG SER 16 55.919 29.202 12.705 105 H VAL 17 H VAL 17 60.239 28.371 10.910 106 HA VAL 17 HA VAL 17 59.554 28.195 8.121 107 HB VAL 17 HB VAL 17 61.340 26.457 9.860 108 HG11 VAL 17 1HG1 VAL 17 60.545 25.246 7.871 109 HG12 VAL 17 2HG1 VAL 17 62.277 25.563 7.804 110 HG13 VAL 17 3HG1 VAL 17 61.171 26.541 6.846 111 HG21 VAL 17 3HG2 VAL 17 62.137 28.747 9.674 112 HG22 VAL 17 1HG2 VAL 17 62.057 28.645 7.918 113 HG23 VAL 17 2HG2 VAL 17 63.202 27.638 8.806 114 H PHE 18 H PHE 18 58.140 26.810 7.311 115 HA PHE 18 HA PHE 18 56.732 25.046 9.170 116 HB2 PHE 18 2HB PHE 18 54.954 24.922 7.425 117 HB3 PHE 18 1HB PHE 18 55.238 26.548 8.013 118 HD1 PHE 18 1HD PHE 18 55.549 24.275 5.162 119 HD2 PHE 18 2HD PHE 18 56.177 28.234 6.570 120 HE1 PHE 18 1HE PHE 18 55.864 25.042 2.858 121 HE2 PHE 18 2HE PHE 18 56.497 29.011 4.271 122 HZ PHE 18 HZ PHE 18 56.345 27.422 2.409 123 H ARG 19 H ARG 19 56.084 22.931 8.379 124 HA ARG 19 HA ARG 19 58.084 21.790 6.581 125 HB2 ARG 19 2HB ARG 19 56.934 20.597 9.104 126 HB3 ARG 19 1HB ARG 19 58.027 19.792 7.997 127 HG2 ARG 19 2HG ARG 19 59.782 21.381 8.535 128 HG3 ARG 19 1HG ARG 19 58.672 22.260 9.587 129 HD2 ARG 19 2HD ARG 19 58.440 20.253 10.989 130 HD3 ARG 19 1HD ARG 19 59.590 19.406 9.956 131 HE ARG 19 HE ARG 19 60.992 21.528 10.646 132 HH11 ARG 19 1HH1 ARG 19 59.043 19.385 12.684 133 HH12 ARG 19 2HH1 ARG 19 60.029 19.581 14.053 134 HH21 ARG 19 1HH2 ARG 19 62.306 21.829 12.566 135 HH22 ARG 19 2HH2 ARG 19 61.901 20.991 13.992 136 H ALA 20 H ALA 20 57.262 19.862 5.502 137 HA ALA 20 HA ALA 20 54.403 19.955 5.090 138 HB1 ALA 20 1HB ALA 20 55.892 19.625 3.151 139 HB2 ALA 20 2HB ALA 20 54.778 18.275 3.352 140 HB3 ALA 20 3HB ALA 20 56.461 18.115 3.862 141 H ASP 21 H ASP 21 53.721 19.389 7.082 142 HA ASP 21 HA ASP 21 54.596 17.028 8.443 143 HB2 ASP 21 2HB ASP 21 52.312 18.906 9.026 144 HB3 ASP 21 1HB ASP 21 52.779 17.557 10.048 145 H LEU 22 H LEU 22 52.054 17.850 6.298 146 HA LEU 22 HA LEU 22 51.147 15.115 6.460 147 HB2 LEU 22 2HB LEU 22 48.802 15.726 6.339 148 HB3 LEU 22 1HB LEU 22 49.529 16.375 7.785 149 HG LEU 22 HG LEU 22 48.952 18.036 5.314 150 HD11 LEU 22 1HD1 LEU 22 47.339 17.674 7.828 151 HD12 LEU 22 2HD1 LEU 22 46.880 17.153 6.203 152 HD13 LEU 22 3HD1 LEU 22 47.025 18.870 6.575 153 HD21 LEU 22 3HD2 LEU 22 50.653 18.982 6.815 154 HD22 LEU 22 1HD2 LEU 22 49.540 18.832 8.174 155 HD23 LEU 22 2HD2 LEU 22 49.167 19.934 6.849 156 H LEU 23 H LEU 23 50.601 14.229 4.583 157 HA LEU 23 HA LEU 23 49.968 15.640 2.287 158 HB2 LEU 23 2HB LEU 23 51.971 15.043 0.899 159 HB3 LEU 23 1HB LEU 23 52.248 16.305 2.067 160 HG LEU 23 HG LEU 23 53.318 14.428 3.508 161 HD11 LEU 23 1HD1 LEU 23 53.474 13.112 0.806 162 HD12 LEU 23 2HD1 LEU 23 52.567 12.524 2.199 163 HD13 LEU 23 3HD1 LEU 23 54.327 12.605 2.264 164 HD21 LEU 23 3HD2 LEU 23 54.565 16.250 2.543 165 HD22 LEU 23 1HD2 LEU 23 54.612 15.419 0.985 166 HD23 LEU 23 2HD2 LEU 23 55.456 14.738 2.371 167 H LYS 24 H LYS 24 48.917 14.398 0.948 168 HA LYS 24 HA LYS 24 49.410 11.643 0.632 169 HB2 LYS 24 2HB LYS 24 47.356 10.732 1.528 170 HB3 LYS 24 1HB LYS 24 48.062 11.687 2.804 171 HG2 LYS 24 2HG LYS 24 45.785 12.598 1.037 172 HG3 LYS 24 1HG LYS 24 45.604 11.916 2.648 173 HD2 LYS 24 2HD LYS 24 46.895 13.793 3.569 174 HD3 LYS 24 1HD LYS 24 47.078 14.444 1.948 175 HE2 LYS 24 2HE LYS 24 44.658 14.678 1.759 176 HE3 LYS 24 1HE LYS 24 44.462 14.023 3.380 177 HZ1 LYS 24 3HZ LYS 24 45.654 15.877 4.277 178 HZ2 LYS 24 1HZ LYS 24 44.381 16.456 3.334 179 HZ3 LYS 24 2HZ LYS 24 45.958 16.500 2.735 180 H GLU 25 H GLU 25 47.792 10.843 -1.048 181 HA GLU 25 HA GLU 25 46.488 13.031 -2.365 182 HB2 GLU 25 2HB GLU 25 47.536 12.420 -4.565 183 HB3 GLU 25 1HB GLU 25 48.566 13.248 -3.415 184 HG2 GLU 25 2HG GLU 25 49.476 10.987 -2.792 185 HG3 GLU 25 1HG GLU 25 48.613 10.359 -4.202 186 H MET 26 H MET 26 44.985 12.526 -3.864 187 HA MET 26 HA MET 26 43.158 11.511 -4.585 188 HB2 MET 26 2HB MET 26 44.697 9.961 -5.749 189 HB3 MET 26 1HB MET 26 44.716 8.920 -4.334 190 HG2 MET 26 2HG MET 26 42.305 8.518 -4.619 191 HG3 MET 26 1HG MET 26 42.323 9.536 -6.058 192 HE1 MET 26 3HE MET 26 45.181 8.697 -7.318 193 HE2 MET 26 1HE MET 26 43.718 8.930 -8.270 194 HE3 MET 26 2HE MET 26 44.669 7.458 -8.453 195 H GLU 27 H GLU 27 42.019 12.171 -2.865 196 HA GLU 27 HA GLU 27 41.208 10.051 -1.075 197 HB2 GLU 27 2HB GLU 27 42.880 11.365 0.190 198 HB3 GLU 27 1HB GLU 27 41.973 12.833 -0.131 199 HG2 GLU 27 2HG GLU 27 40.143 12.087 1.213 200 HG3 GLU 27 1HG GLU 27 40.853 10.486 1.373 201 H SER 28 H SER 28 39.218 9.806 -1.727 202 HA SER 28 HA SER 28 37.451 12.097 -1.596 203 HB2 SER 28 2HB SER 28 36.276 11.079 -3.639 204 HB3 SER 28 1HB SER 28 37.782 11.944 -3.934 205 HG SER 28 HG SER 28 37.530 9.138 -3.609 206 H SER 29 H SER 29 35.560 11.672 -0.603 207 HA SER 29 HA SER 29 35.184 9.361 0.887 208 HB2 SER 29 2HB SER 29 33.116 11.356 -0.061 209 HB3 SER 29 1HB SER 29 33.015 10.320 1.367 210 HG SER 29 HG SER 29 34.364 11.538 2.401 211 H THR 30 H THR 30 34.591 7.424 0.211 212 HA THR 30 HA THR 30 33.616 7.049 -2.487 213 HB THR 30 HB THR 30 34.329 4.973 -0.389 214 HG1 THR 30 1HG THR 30 36.121 6.344 -0.774 215 HG21 THR 30 3HG2 THR 30 33.063 4.138 -2.341 216 HG22 THR 30 1HG2 THR 30 34.717 3.528 -2.354 217 HG23 THR 30 2HG2 THR 30 34.256 4.852 -3.423 218 H GLY 31 H GLY 31 31.431 7.259 -2.676 219 HA2 GLY 31 2HA GLY 31 29.756 6.901 -0.366 220 HA3 GLY 31 1HA GLY 31 29.260 7.503 -1.938 221 H THR 32 H THR 32 30.527 4.479 -0.580 222 HA THR 32 HA THR 32 28.600 3.002 -2.196 223 HB THR 32 HB THR 32 30.538 1.966 -0.185 224 HG1 THR 32 1HG THR 32 30.852 2.261 -3.033 225 HG21 THR 32 3HG2 THR 32 28.793 0.396 -0.795 226 HG22 THR 32 1HG2 THR 32 30.325 -0.159 -1.468 227 HG23 THR 32 2HG2 THR 32 29.136 0.630 -2.505 228 H ALA 33 H ALA 33 26.733 2.687 -1.351 229 HA ALA 33 HA ALA 33 26.285 3.055 1.503 230 HB1 ALA 33 1HB ALA 33 24.281 2.692 -0.724 231 HB2 ALA 33 2HB ALA 33 24.797 4.235 -0.044 232 HB3 ALA 33 3HB ALA 33 23.895 3.091 0.951 233 HA PRO 34 HA PRO 34 26.329 -1.434 1.804 234 HB2 PRO 34 2HB PRO 34 25.876 -1.503 4.501 235 HB3 PRO 34 1HB PRO 34 27.480 -1.383 3.768 236 HG2 PRO 34 2HG PRO 34 25.808 0.728 5.040 237 HG3 PRO 34 1HG PRO 34 27.571 0.588 4.968 238 HD2 PRO 34 2HD PRO 34 26.079 2.299 3.422 239 HD3 PRO 34 1HD PRO 34 27.686 1.702 2.970 240 H ALA 35 H ALA 35 24.597 -2.494 1.243 241 HA ALA 35 HA ALA 35 22.066 -1.855 2.538 242 HB1 ALA 35 1HB ALA 35 20.940 -2.233 0.397 243 HB2 ALA 35 2HB ALA 35 22.504 -2.498 -0.373 244 HB3 ALA 35 3HB ALA 35 22.101 -0.909 0.282 245 H SER 36 H SER 36 20.958 -3.567 3.215 246 HA SER 36 HA SER 36 22.079 -6.070 3.492 247 HB2 SER 36 2HB SER 36 19.137 -5.378 3.482 248 HB3 SER 36 1HB SER 36 19.886 -6.771 4.257 249 HG SER 36 HG SER 36 21.138 -5.177 5.469 250 H THR 37 H THR 37 19.754 -4.894 1.118 251 HA THR 37 HA THR 37 18.949 -5.737 -0.835 252 HB THR 37 HB THR 37 21.645 -7.164 -0.945 253 HG1 THR 37 1HG THR 37 22.526 -5.251 -1.257 254 HG21 THR 37 3HG2 THR 37 20.046 -7.702 -2.786 255 HG22 THR 37 1HG2 THR 37 21.457 -6.816 -3.366 256 HG23 THR 37 2HG2 THR 37 19.923 -5.979 -3.141 257 H GLY 38 H GLY 38 18.092 -7.000 1.395 258 HA2 GLY 38 2HA GLY 38 18.168 -9.879 0.794 259 HA3 GLY 38 1HA GLY 38 17.928 -9.209 2.402 260 H ALA 39 H ALA 39 16.437 -7.952 -0.485 261 HA ALA 39 HA ALA 39 13.860 -7.963 0.619 262 HB1 ALA 39 1HB ALA 39 14.523 -6.474 -1.226 263 HB2 ALA 39 2HB ALA 39 13.073 -7.398 -1.624 264 HB3 ALA 39 3HB ALA 39 14.628 -7.869 -2.302 265 H GLU 40 H GLU 40 15.464 -10.095 -1.615 266 HA GLU 40 HA GLU 40 13.258 -11.825 -2.058 267 HB2 GLU 40 2HB GLU 40 14.856 -13.218 -3.238 268 HB3 GLU 40 1HB GLU 40 14.987 -11.530 -3.705 269 HG2 GLU 40 2HG GLU 40 16.926 -11.313 -2.168 270 HG3 GLU 40 1HG GLU 40 16.828 -13.049 -1.880 271 H ASN 41 H ASN 41 15.267 -11.524 0.595 272 HA ASN 41 HA ASN 41 15.582 -14.297 1.290 273 HB2 ASN 41 2HB ASN 41 17.009 -12.279 2.078 274 HB3 ASN 41 1HB ASN 41 15.708 -11.948 3.200 275 HD21 ASN 41 1HD2 ASN 41 15.266 -14.877 3.766 276 HD22 ASN 41 2HD2 ASN 41 16.617 -15.331 4.740 277 H LEU 42 H LEU 42 13.090 -12.003 1.448 278 HA LEU 42 HA LEU 42 11.576 -12.818 3.646 279 HB2 LEU 42 2HB LEU 42 11.195 -10.772 2.293 280 HB3 LEU 42 1HB LEU 42 10.665 -11.771 0.963 281 HG LEU 42 HG LEU 42 8.742 -12.527 2.356 282 HD11 LEU 42 1HD1 LEU 42 9.684 -12.146 4.569 283 HD12 LEU 42 2HD1 LEU 42 8.180 -11.249 4.372 284 HD13 LEU 42 3HD1 LEU 42 9.723 -10.411 4.266 285 HD21 LEU 42 3HD2 LEU 42 7.487 -10.445 2.149 286 HD22 LEU 42 1HD2 LEU 42 8.507 -10.717 0.738 287 HD23 LEU 42 2HD2 LEU 42 8.993 -9.547 1.964 288 HA PRO 43 HA PRO 43 10.478 -16.953 2.118 289 HB2 PRO 43 2HB PRO 43 8.491 -16.886 4.305 290 HB3 PRO 43 1HB PRO 43 9.805 -18.032 4.023 291 HG2 PRO 43 2HG PRO 43 9.944 -16.248 6.003 292 HG3 PRO 43 1HG PRO 43 11.379 -16.687 5.061 293 HD2 PRO 43 2HD PRO 43 9.641 -14.260 4.836 294 HD3 PRO 43 1HD PRO 43 11.416 -14.397 4.798 295 H ALA 44 H ALA 44 8.424 -18.119 1.595 296 HA ALA 44 HA ALA 44 6.813 -16.513 -0.079 297 HB1 ALA 44 1HB ALA 44 7.430 -18.826 -0.623 298 HB2 ALA 44 2HB ALA 44 5.683 -18.604 -0.622 299 HB3 ALA 44 3HB ALA 44 6.469 -19.398 0.738 300 H GLY 45 H GLY 45 4.520 -16.286 0.024 301 HA2 GLY 45 2HA GLY 45 2.468 -16.340 1.251 302 HA3 GLY 45 1HA GLY 45 3.404 -16.467 2.738 303 H SER 46 H SER 46 3.964 -14.247 0.063 304 HA SER 46 HA SER 46 3.929 -12.038 1.946 305 HB2 SER 46 2HB SER 46 4.579 -12.044 -1.004 306 HB3 SER 46 1HB SER 46 5.044 -10.838 0.196 307 HG SER 46 HG SER 46 5.958 -13.088 1.149 308 H ALA 47 H ALA 47 2.732 -10.000 1.248 309 HA ALA 47 HA ALA 47 0.178 -10.754 -0.002 310 HB1 ALA 47 1HB ALA 47 -0.927 -9.139 1.452 311 HB2 ALA 47 2HB ALA 47 0.625 -8.735 2.188 312 HB3 ALA 47 3HB ALA 47 -0.057 -10.347 2.396 313 H LEU 48 H LEU 48 -1.055 -8.418 -0.519 314 HA LEU 48 HA LEU 48 0.887 -6.949 -2.089 315 HB2 LEU 48 2HB LEU 48 -0.679 -7.060 -4.067 316 HB3 LEU 48 1HB LEU 48 0.196 -8.519 -3.687 317 HG LEU 48 HG LEU 48 -1.921 -9.374 -2.581 318 HD11 LEU 48 1HD1 LEU 48 -4.046 -8.401 -3.266 319 HD12 LEU 48 2HD1 LEU 48 -3.195 -7.058 -4.022 320 HD13 LEU 48 3HD1 LEU 48 -3.108 -7.284 -2.274 321 HD21 LEU 48 3HD2 LEU 48 -1.189 -10.158 -4.749 322 HD22 LEU 48 1HD2 LEU 48 -1.981 -8.792 -5.535 323 HD23 LEU 48 2HD2 LEU 48 -2.944 -10.016 -4.711 324 H LEU 49 H LEU 49 0.116 -4.947 -2.972 325 HA LEU 49 HA LEU 49 -2.127 -3.867 -1.472 326 HB2 LEU 49 2HB LEU 49 -0.985 -1.653 -1.452 327 HB3 LEU 49 1HB LEU 49 -0.182 -2.867 -0.498 328 HG LEU 49 HG LEU 49 1.471 -3.105 -2.437 329 HD11 LEU 49 1HD1 LEU 49 1.703 -1.220 -3.949 330 HD12 LEU 49 2HD1 LEU 49 0.230 -0.499 -3.308 331 HD13 LEU 49 3HD1 LEU 49 0.154 -2.028 -4.183 332 HD21 LEU 49 3HD2 LEU 49 1.307 -0.480 -0.973 333 HD22 LEU 49 1HD2 LEU 49 2.749 -1.139 -1.744 334 HD23 LEU 49 2HD2 LEU 49 2.026 -1.968 -0.364 335 H VAL 50 H VAL 50 -3.406 -2.321 -2.501 336 HA VAL 50 HA VAL 50 -3.237 -2.313 -5.436 337 HB VAL 50 HB VAL 50 -5.815 -2.724 -3.862 338 HG11 VAL 50 1HG1 VAL 50 -6.829 -3.284 -5.998 339 HG12 VAL 50 2HG1 VAL 50 -5.295 -3.000 -6.815 340 HG13 VAL 50 3HG1 VAL 50 -6.132 -1.663 -6.028 341 HG21 VAL 50 3HG2 VAL 50 -4.425 -4.716 -3.608 342 HG22 VAL 50 1HG2 VAL 50 -4.231 -4.816 -5.358 343 HG23 VAL 50 2HG2 VAL 50 -5.819 -5.052 -4.631 344 H VAL 51 H VAL 51 -4.108 -0.469 -6.409 345 HA VAL 51 HA VAL 51 -4.230 1.887 -4.714 346 HB VAL 51 HB VAL 51 -2.976 2.100 -6.789 347 HG11 VAL 51 1HG1 VAL 51 -5.525 1.308 -8.213 348 HG12 VAL 51 2HG1 VAL 51 -4.054 0.340 -8.097 349 HG13 VAL 51 3HG1 VAL 51 -4.042 1.855 -8.996 350 HG21 VAL 51 3HG2 VAL 51 -4.258 4.086 -6.105 351 HG22 VAL 51 1HG2 VAL 51 -5.615 3.516 -7.061 352 HG23 VAL 51 2HG2 VAL 51 -4.126 3.986 -7.866 353 H LYS 52 H LYS 52 -6.052 2.464 -3.789 354 HA LYS 52 HA LYS 52 -8.528 1.970 -5.199 355 HB2 LYS 52 2HB LYS 52 -8.468 1.363 -2.815 356 HB3 LYS 52 1HB LYS 52 -8.101 3.031 -2.389 357 HG2 LYS 52 2HG LYS 52 -10.241 3.777 -3.143 358 HG3 LYS 52 1HG LYS 52 -10.605 2.199 -3.833 359 HD2 LYS 52 2HD LYS 52 -10.194 2.731 -0.890 360 HD3 LYS 52 1HD LYS 52 -11.768 2.654 -1.682 361 HE2 LYS 52 2HE LYS 52 -11.209 0.333 -2.410 362 HE3 LYS 52 1HE LYS 52 -9.735 0.424 -1.446 363 HZ1 LYS 52 3HZ LYS 52 -11.260 0.910 0.496 364 HZ2 LYS 52 1HZ LYS 52 -11.407 -0.657 -0.140 365 HZ3 LYS 52 2HZ LYS 52 -12.532 0.495 -0.530 366 H ARG 53 H ARG 53 -6.533 4.589 -3.982 367 HA ARG 53 HA ARG 53 -7.545 6.288 -6.095 368 HB2 ARG 53 2HB ARG 53 -9.125 6.750 -4.214 369 HB3 ARG 53 1HB ARG 53 -7.763 7.197 -3.201 370 HG2 ARG 53 2HG ARG 53 -8.780 9.216 -3.955 371 HG3 ARG 53 1HG ARG 53 -7.271 9.038 -4.846 372 HD2 ARG 53 2HD ARG 53 -8.547 8.121 -6.757 373 HD3 ARG 53 1HD ARG 53 -10.042 8.390 -5.863 374 HE ARG 53 HE ARG 53 -8.223 10.620 -6.414 375 HH11 ARG 53 1HH1 ARG 53 -11.469 9.256 -6.731 376 HH12 ARG 53 2HH1 ARG 53 -12.100 10.569 -7.619 377 HH21 ARG 53 1HH2 ARG 53 -9.071 12.420 -7.603 378 HH22 ARG 53 2HH2 ARG 53 -10.690 12.440 -8.114 379 H GLY 54 H GLY 54 -5.542 6.120 -6.871 380 HA2 GLY 54 2HA GLY 54 -3.176 6.238 -7.010 381 HA3 GLY 54 1HA GLY 54 -3.721 7.887 -7.095 382 HA PRO 55 HA PRO 55 -1.851 7.749 -2.723 383 HB2 PRO 55 2HB PRO 55 -1.001 5.468 -1.579 384 HB3 PRO 55 1HB PRO 55 -2.687 6.001 -1.491 385 HG2 PRO 55 2HG PRO 55 -1.436 3.975 -3.290 386 HG3 PRO 55 1HG PRO 55 -2.988 3.906 -2.438 387 HD2 PRO 55 2HD PRO 55 -2.694 4.548 -5.067 388 HD3 PRO 55 1HD PRO 55 -4.066 5.096 -4.069 389 H ASN 56 H ASN 56 -0.342 5.301 -4.789 390 HA ASN 56 HA ASN 56 2.271 6.536 -4.264 391 HB2 ASN 56 2HB ASN 56 1.677 3.564 -4.187 392 HB3 ASN 56 1HB ASN 56 3.286 4.249 -4.237 393 HD21 ASN 56 1HD2 ASN 56 4.162 4.994 -2.350 394 HD22 ASN 56 2HD2 ASN 56 3.375 4.818 -0.814 395 H ALA 57 H ALA 57 1.540 3.568 -6.008 396 HA ALA 57 HA ALA 57 2.909 4.697 -8.326 397 HB1 ALA 57 1HB ALA 57 2.262 1.836 -7.667 398 HB2 ALA 57 2HB ALA 57 3.790 2.650 -7.327 399 HB3 ALA 57 3HB ALA 57 3.272 2.403 -8.996 400 H GLY 58 H GLY 58 -0.200 4.211 -7.351 401 HA2 GLY 58 2HA GLY 58 -2.233 4.168 -8.447 402 HA3 GLY 58 1HA GLY 58 -1.357 4.735 -9.861 403 H ALA 59 H ALA 59 -1.007 1.646 -8.094 404 HA ALA 59 HA ALA 59 -2.188 0.112 -10.199 405 HB1 ALA 59 1HB ALA 59 -0.102 -1.111 -10.707 406 HB2 ALA 59 2HB ALA 59 0.794 0.007 -9.680 407 HB3 ALA 59 3HB ALA 59 0.027 0.590 -11.157 408 H ARG 60 H ARG 60 -0.994 -2.319 -9.528 409 HA ARG 60 HA ARG 60 -1.216 -2.527 -6.638 410 HB2 ARG 60 2HB ARG 60 -2.474 -4.631 -6.883 411 HB3 ARG 60 1HB ARG 60 -3.362 -3.286 -7.574 412 HG2 ARG 60 2HG ARG 60 -2.703 -3.984 -9.810 413 HG3 ARG 60 1HG ARG 60 -1.770 -5.315 -9.124 414 HD2 ARG 60 2HD ARG 60 -3.830 -6.225 -8.144 415 HD3 ARG 60 1HD ARG 60 -4.750 -4.914 -8.883 416 HE ARG 60 HE ARG 60 -3.262 -6.229 -10.851 417 HH11 ARG 60 1HH1 ARG 60 -6.008 -6.872 -8.741 418 HH12 ARG 60 2HH1 ARG 60 -6.807 -7.918 -9.817 419 HH21 ARG 60 1HH2 ARG 60 -4.314 -7.718 -12.332 420 HH22 ARG 60 2HH2 ARG 60 -5.803 -8.427 -11.899 421 H PHE 61 H PHE 61 0.252 -3.945 -5.752 422 HA PHE 61 HA PHE 61 1.642 -5.759 -7.402 423 HB2 PHE 61 2HB PHE 61 3.921 -4.878 -7.035 424 HB3 PHE 61 1HB PHE 61 2.947 -3.859 -8.070 425 HD1 PHE 61 1HD PHE 61 4.523 -4.158 -4.748 426 HD2 PHE 61 2HD PHE 61 2.463 -1.597 -7.457 427 HE1 PHE 61 1HE PHE 61 5.171 -2.208 -3.394 428 HE2 PHE 61 2HE PHE 61 3.102 0.353 -6.102 429 HZ PHE 61 HZ PHE 61 4.459 0.051 -4.070 430 H LEU 62 H LEU 62 3.071 -7.094 -6.340 431 HA LEU 62 HA LEU 62 2.184 -7.822 -3.711 432 HB2 LEU 62 2HB LEU 62 2.677 -9.427 -5.542 433 HB3 LEU 62 1HB LEU 62 4.350 -8.923 -5.493 434 HG LEU 62 HG LEU 62 4.394 -9.737 -3.102 435 HD11 LEU 62 1HD1 LEU 62 2.722 -11.407 -2.490 436 HD12 LEU 62 2HD1 LEU 62 1.808 -11.018 -3.947 437 HD13 LEU 62 3HD1 LEU 62 2.022 -9.803 -2.687 438 HD21 LEU 62 3HD2 LEU 62 3.906 -11.720 -5.319 439 HD22 LEU 62 1HD2 LEU 62 4.691 -12.075 -3.780 440 HD23 LEU 62 2HD2 LEU 62 5.442 -10.954 -4.917 441 H LEU 63 H LEU 63 3.366 -7.535 -1.819 442 HA LEU 63 HA LEU 63 5.761 -5.928 -1.991 443 HB2 LEU 63 2HB LEU 63 4.301 -7.125 0.390 444 HB3 LEU 63 1HB LEU 63 5.801 -6.240 0.536 445 HG LEU 63 HG LEU 63 4.590 -4.226 -0.395 446 HD11 LEU 63 1HD1 LEU 63 2.151 -4.191 -0.271 447 HD12 LEU 63 2HD1 LEU 63 2.147 -5.929 0.036 448 HD13 LEU 63 3HD1 LEU 63 2.742 -5.307 -1.499 449 HD21 LEU 63 3HD2 LEU 63 5.035 -4.446 1.970 450 HD22 LEU 63 1HD2 LEU 63 3.574 -5.415 2.182 451 HD23 LEU 63 2HD2 LEU 63 3.450 -3.719 1.714 452 H ASP 64 H ASP 64 7.595 -6.867 -2.401 453 HA ASP 64 HA ASP 64 7.863 -9.731 -1.788 454 HB2 ASP 64 2HB ASP 64 9.313 -9.940 -3.698 455 HB3 ASP 64 1HB ASP 64 7.854 -9.114 -4.211 456 H GLN 65 H GLN 65 8.667 -6.929 -0.580 457 HA GLN 65 HA GLN 65 11.342 -7.803 0.212 458 HB2 GLN 65 2HB GLN 65 12.017 -5.458 0.338 459 HB3 GLN 65 1HB GLN 65 11.410 -5.803 -1.274 460 HG2 GLN 65 2HG GLN 65 9.220 -4.833 -0.542 461 HG3 GLN 65 1HG GLN 65 10.030 -4.317 0.932 462 HE21 GLN 65 1HE2 GLN 65 9.567 -3.773 -2.399 463 HE22 GLN 65 2HE2 GLN 65 10.449 -2.297 -2.521 464 HA PRO 66 HA PRO 66 9.643 -8.102 4.317 465 HB2 PRO 66 2HB PRO 66 12.165 -6.798 5.203 466 HB3 PRO 66 1HB PRO 66 11.446 -8.321 5.736 467 HG2 PRO 66 2HG PRO 66 13.559 -8.341 4.140 468 HG3 PRO 66 1HG PRO 66 12.210 -9.475 3.923 469 HD2 PRO 66 2HD PRO 66 12.891 -7.055 2.331 470 HD3 PRO 66 1HD PRO 66 12.257 -8.633 1.811 471 H THR 67 H THR 67 11.554 -5.224 3.843 472 HA THR 67 HA THR 67 9.367 -3.700 5.075 473 HB THR 67 HB THR 67 12.319 -3.048 5.270 474 HG1 THR 67 1HG THR 67 10.723 -4.729 6.605 475 HG21 THR 67 3HG2 THR 67 9.902 -1.814 6.634 476 HG22 THR 67 1HG2 THR 67 10.831 -1.063 5.336 477 HG23 THR 67 2HG2 THR 67 11.585 -1.361 6.899 478 H THR 68 H THR 68 8.352 -2.696 3.536 479 HA THR 68 HA THR 68 9.756 -1.738 1.174 480 HB THR 68 HB THR 68 6.806 -1.470 1.768 481 HG1 THR 68 1HG THR 68 8.256 -3.753 1.501 482 HG21 THR 68 3HG2 THR 68 8.380 -1.813 -0.792 483 HG22 THR 68 1HG2 THR 68 7.690 -0.304 -0.198 484 HG23 THR 68 2HG2 THR 68 6.631 -1.629 -0.676 485 H THR 69 H THR 69 10.600 0.285 1.341 486 HA THR 69 HA THR 69 9.516 2.121 3.289 487 HB THR 69 HB THR 69 11.501 3.531 2.496 488 HG1 THR 69 1HG THR 69 12.729 1.210 1.570 489 HG21 THR 69 3HG2 THR 69 12.008 0.821 3.741 490 HG22 THR 69 1HG2 THR 69 11.546 2.287 4.601 491 HG23 THR 69 2HG2 THR 69 13.119 2.190 3.811 492 H ALA 70 H ALA 70 8.069 3.630 2.746 493 HA ALA 70 HA ALA 70 7.858 4.383 -0.072 494 HB1 ALA 70 1HB ALA 70 5.802 4.579 2.131 495 HB2 ALA 70 2HB ALA 70 5.835 3.366 0.846 496 HB3 ALA 70 3HB ALA 70 5.563 5.061 0.451 497 H GLY 71 H GLY 71 8.583 6.298 -0.564 498 HA2 GLY 71 2HA GLY 71 8.033 8.579 1.089 499 HA3 GLY 71 1HA GLY 71 9.738 8.135 1.071 500 H ARG 72 H ARG 72 10.614 9.684 -0.087 501 HA ARG 72 HA ARG 72 10.266 9.642 -2.906 502 HB2 ARG 72 2HB ARG 72 8.552 11.313 -2.230 503 HB3 ARG 72 1HB ARG 72 9.802 12.230 -1.400 504 HG2 ARG 72 2HG ARG 72 9.351 13.287 -3.485 505 HG3 ARG 72 1HG ARG 72 10.934 12.525 -3.599 506 HD2 ARG 72 2HD ARG 72 9.645 12.170 -5.627 507 HD3 ARG 72 1HD ARG 72 9.933 10.636 -4.807 508 HE ARG 72 HE ARG 72 7.602 10.978 -3.896 509 HH11 ARG 72 1HH1 ARG 72 8.576 12.208 -7.074 510 HH12 ARG 72 2HH1 ARG 72 7.016 12.129 -7.746 511 HH21 ARG 72 1HH2 ARG 72 5.452 10.829 -4.851 512 HH22 ARG 72 2HH2 ARG 72 5.204 11.277 -6.480 513 H HIS 73 H HIS 73 12.339 8.871 -2.673 514 HA HIS 73 HA HIS 73 14.453 10.666 -2.773 515 HB2 HIS 73 2HB HIS 73 13.670 10.377 -0.152 516 HB3 HIS 73 1HB HIS 73 14.781 9.018 -0.300 517 HD1 HIS 73 1HD HIS 73 16.679 9.983 1.109 518 HD2 HIS 73 2HD HIS 73 15.402 12.540 -1.895 519 HE1 HIS 73 1HE HIS 73 18.327 11.906 1.058 520 HA PRO 74 HA PRO 74 15.798 6.876 -4.719 521 HB2 PRO 74 2HB PRO 74 18.542 7.368 -3.718 522 HB3 PRO 74 1HB PRO 74 17.969 7.166 -5.377 523 HG2 PRO 74 2HG PRO 74 18.675 9.570 -4.476 524 HG3 PRO 74 1HG PRO 74 17.284 9.361 -5.555 525 HD2 PRO 74 2HD PRO 74 17.336 9.805 -2.598 526 HD3 PRO 74 1HD PRO 74 16.249 10.488 -3.821 527 H GLU 75 H GLU 75 16.600 7.417 -1.398 528 HA GLU 75 HA GLU 75 17.503 4.733 -0.904 529 HB2 GLU 75 2HB GLU 75 16.720 6.847 1.093 530 HB3 GLU 75 1HB GLU 75 17.632 5.380 1.430 531 HG2 GLU 75 2HG GLU 75 18.507 7.715 -0.237 532 HG3 GLU 75 1HG GLU 75 19.123 7.267 1.348 533 H SER 76 H SER 76 14.475 6.292 -1.075 534 HA SER 76 HA SER 76 13.108 4.269 0.490 535 HB2 SER 76 2HB SER 76 12.013 6.541 -1.210 536 HB3 SER 76 1HB SER 76 11.103 5.575 -0.048 537 HG SER 76 HG SER 76 13.143 6.499 1.268 538 H ASP 77 H ASP 77 12.186 2.512 -0.468 539 HA ASP 77 HA ASP 77 12.976 1.921 -3.137 540 HB2 ASP 77 2HB ASP 77 12.799 0.171 -1.410 541 HB3 ASP 77 1HB ASP 77 11.049 0.376 -1.404 542 H ILE 78 H ILE 78 9.781 2.513 -1.681 543 HA ILE 78 HA ILE 78 8.884 2.965 -4.427 544 HB ILE 78 HB ILE 78 6.582 2.453 -3.797 545 HG12 ILE 78 2HG1 ILE 78 7.638 1.741 -1.043 546 HG13 ILE 78 1HG1 ILE 78 6.728 3.195 -1.425 547 HG21 ILE 78 1HG2 ILE 78 8.472 0.269 -2.948 548 HG22 ILE 78 2HG2 ILE 78 7.946 0.615 -4.590 549 HG23 ILE 78 3HG2 ILE 78 6.781 0.039 -3.396 550 HD11 ILE 78 3HD1 ILE 78 4.794 1.847 -2.034 551 HD12 ILE 78 1HD1 ILE 78 5.316 1.501 -0.386 552 HD13 ILE 78 2HD1 ILE 78 5.700 0.375 -1.686 553 H PHE 79 H PHE 79 7.350 4.672 -4.744 554 HA PHE 79 HA PHE 79 7.728 6.754 -2.743 555 HB2 PHE 79 2HB PHE 79 7.695 8.431 -4.550 556 HB3 PHE 79 1HB PHE 79 9.021 7.297 -4.738 557 HD1 PHE 79 2HD PHE 79 5.857 8.502 -6.125 558 HD2 PHE 79 1HD PHE 79 9.062 5.746 -6.620 559 HE1 PHE 79 2HE PHE 79 5.147 8.102 -8.442 560 HE2 PHE 79 1HE PHE 79 8.360 5.350 -8.943 561 HZ PHE 79 HZ PHE 79 6.401 6.525 -9.853 562 H LEU 80 H LEU 80 5.980 7.802 -2.028 563 HA LEU 80 HA LEU 80 3.513 6.943 -3.112 564 HB2 LEU 80 2HB LEU 80 2.330 8.300 -1.388 565 HB3 LEU 80 1HB LEU 80 3.433 7.140 -0.702 566 HG LEU 80 HG LEU 80 4.233 10.014 -1.008 567 HD11 LEU 80 1HD1 LEU 80 3.379 10.389 1.267 568 HD12 LEU 80 2HD1 LEU 80 2.694 8.765 1.272 569 HD13 LEU 80 3HD1 LEU 80 2.072 9.982 0.155 570 HD21 LEU 80 3HD2 LEU 80 5.009 7.772 0.866 571 HD22 LEU 80 1HD2 LEU 80 5.548 9.442 1.024 572 HD23 LEU 80 2HD2 LEU 80 6.020 8.516 -0.378 573 H ASP 81 H ASP 81 2.027 8.453 -4.212 574 HA ASP 81 HA ASP 81 3.703 10.582 -5.258 575 HB2 ASP 81 2HB ASP 81 3.157 8.731 -6.891 576 HB3 ASP 81 1HB ASP 81 1.504 9.352 -6.889 577 H ASP 82 H ASP 82 2.706 11.323 -3.267 578 HA ASP 82 HA ASP 82 0.433 13.069 -3.991 579 HB2 ASP 82 2HB ASP 82 0.349 11.913 -1.722 580 HB3 ASP 82 1HB ASP 82 1.774 12.841 -1.267 581 H VAL 83 H VAL 83 0.736 15.345 -3.788 582 HA VAL 83 HA VAL 83 3.342 16.148 -4.645 583 HB VAL 83 HB VAL 83 2.390 18.460 -4.760 584 HG11 VAL 83 1HG1 VAL 83 2.264 16.961 -6.676 585 HG12 VAL 83 2HG1 VAL 83 0.844 17.997 -6.589 586 HG13 VAL 83 3HG1 VAL 83 0.737 16.312 -6.076 587 HG21 VAL 83 3HG2 VAL 83 -0.007 18.784 -4.399 588 HG22 VAL 83 1HG2 VAL 83 0.790 18.266 -2.912 589 HG23 VAL 83 2HG2 VAL 83 -0.155 17.112 -3.856 590 H THR 84 H THR 84 1.979 15.809 -1.593 591 HA THR 84 HA THR 84 3.908 17.668 -0.354 592 HB THR 84 HB THR 84 1.660 16.343 1.131 593 HG1 THR 84 1HG THR 84 0.735 17.036 -0.749 594 HG21 THR 84 3HG2 THR 84 2.815 19.148 1.165 595 HG22 THR 84 1HG2 THR 84 3.245 17.855 2.283 596 HG23 THR 84 2HG2 THR 84 1.613 18.519 2.291 597 H VAL 85 H VAL 85 5.023 15.468 -1.296 598 HA VAL 85 HA VAL 85 4.655 13.176 0.389 599 HB VAL 85 HB VAL 85 4.890 12.831 -1.977 600 HG11 VAL 85 1HG1 VAL 85 6.222 14.748 -2.584 601 HG12 VAL 85 2HG1 VAL 85 6.978 13.272 -3.184 602 HG13 VAL 85 3HG1 VAL 85 7.620 14.071 -1.751 603 HG21 VAL 85 3HG2 VAL 85 6.553 11.108 -2.011 604 HG22 VAL 85 1HG2 VAL 85 5.754 11.116 -0.445 605 HG23 VAL 85 2HG2 VAL 85 7.363 11.814 -0.602 606 H SER 86 H SER 86 5.970 12.358 1.911 607 HA SER 86 HA SER 86 8.114 14.080 2.880 608 HB2 SER 86 2HB SER 86 6.743 11.781 4.275 609 HB3 SER 86 1HB SER 86 7.718 13.057 5.005 610 HG SER 86 HG SER 86 5.105 13.010 4.379 611 H ARG 87 H ARG 87 10.210 13.278 3.117 612 HA ARG 87 HA ARG 87 11.066 10.823 1.947 613 HB2 ARG 87 2HB ARG 87 12.447 12.454 4.111 614 HB3 ARG 87 1HB ARG 87 13.205 11.223 3.119 615 HG2 ARG 87 2HG ARG 87 12.886 12.612 1.143 616 HG3 ARG 87 1HG ARG 87 12.097 13.838 2.135 617 HD2 ARG 87 2HD ARG 87 14.177 14.033 3.471 618 HD3 ARG 87 1HD ARG 87 14.955 12.902 2.360 619 HE ARG 87 HE ARG 87 13.822 14.967 0.884 620 HH11 ARG 87 1HH1 ARG 87 16.542 14.501 3.137 621 HH12 ARG 87 2HH1 ARG 87 17.431 15.805 2.531 622 HH21 ARG 87 1HH2 ARG 87 15.062 16.768 0.076 623 HH22 ARG 87 2HH2 ARG 87 16.584 17.119 0.745 624 H ARG 88 H ARG 88 10.808 8.832 2.781 625 HA ARG 88 HA ARG 88 10.023 7.192 4.105 626 HB2 ARG 88 2HB ARG 88 11.438 8.803 6.228 627 HB3 ARG 88 1HB ARG 88 10.668 7.264 6.558 628 HG2 ARG 88 2HG ARG 88 12.188 6.188 4.970 629 HG3 ARG 88 1HG ARG 88 12.971 7.750 4.686 630 HD2 ARG 88 2HD ARG 88 13.664 7.900 6.958 631 HD3 ARG 88 1HD ARG 88 12.687 6.506 7.407 632 HE ARG 88 HE ARG 88 14.691 5.971 5.434 633 HH11 ARG 88 1HH1 ARG 88 14.038 6.247 8.913 634 HH12 ARG 88 2HH1 ARG 88 15.210 5.095 9.368 635 HH21 ARG 88 1HH2 ARG 88 16.363 4.418 6.103 636 HH22 ARG 88 2HH2 ARG 88 16.574 4.060 7.753 637 H HIS 89 H HIS 89 7.908 7.742 3.663 638 HA HIS 89 HA HIS 89 6.551 9.333 5.702 639 HB2 HIS 89 2HB HIS 89 6.188 9.913 3.303 640 HB3 HIS 89 1HB HIS 89 5.529 8.306 3.048 641 HD2 HIS 89 2HD HIS 89 3.035 7.838 4.380 642 HE1 HIS 89 1HE HIS 89 2.200 11.959 4.681 643 HE2 HIS 89 2HE HIS 89 1.481 9.609 5.329 644 H ALA 90 H ALA 90 6.705 6.122 4.288 645 HA ALA 90 HA ALA 90 5.305 5.138 6.609 646 HB1 ALA 90 1HB ALA 90 4.305 4.555 3.818 647 HB2 ALA 90 2HB ALA 90 3.483 5.555 5.013 648 HB3 ALA 90 3HB ALA 90 3.707 3.831 5.309 649 H GLU 91 H GLU 91 6.083 3.275 7.217 650 HA GLU 91 HA GLU 91 7.762 1.818 5.298 651 HB2 GLU 91 2HB GLU 91 7.906 1.861 8.327 652 HB3 GLU 91 1HB GLU 91 8.860 0.796 7.308 653 HG2 GLU 91 2HG GLU 91 9.930 2.751 6.283 654 HG3 GLU 91 1HG GLU 91 8.976 3.805 7.326 655 H PHE 92 H PHE 92 7.050 -0.084 4.695 656 HA PHE 92 HA PHE 92 4.780 -1.260 6.141 657 HB2 PHE 92 2HB PHE 92 5.779 -1.802 3.338 658 HB3 PHE 92 1HB PHE 92 4.383 -2.544 4.080 659 HD1 PHE 92 2HD PHE 92 5.724 0.572 2.662 660 HD2 PHE 92 1HD PHE 92 2.298 -1.409 4.214 661 HE1 PHE 92 2HE PHE 92 4.288 2.359 1.769 662 HE2 PHE 92 1HE PHE 92 0.859 0.369 3.319 663 HZ PHE 92 HZ PHE 92 1.855 2.259 2.098 664 H ARG 93 H ARG 93 5.223 -3.003 7.305 665 HA ARG 93 HA ARG 93 7.668 -4.459 6.655 666 HB2 ARG 93 2HB ARG 93 7.762 -3.330 8.813 667 HB3 ARG 93 1HB ARG 93 6.274 -4.106 9.321 668 HG2 ARG 93 2HG ARG 93 7.452 -6.301 9.133 669 HG3 ARG 93 1HG ARG 93 8.933 -5.412 8.773 670 HD2 ARG 93 2HD ARG 93 8.734 -4.251 10.931 671 HD3 ARG 93 1HD ARG 93 7.296 -5.202 11.295 672 HE ARG 93 HE ARG 93 9.796 -6.570 10.705 673 HH11 ARG 93 1HH1 ARG 93 7.280 -5.731 13.143 674 HH12 ARG 93 2HH1 ARG 93 7.896 -6.799 14.298 675 HH21 ARG 93 1HH2 ARG 93 10.594 -8.054 12.390 676 HH22 ARG 93 2HH2 ARG 93 9.797 -8.114 13.887 677 H ILE 94 H ILE 94 7.266 -6.351 5.824 678 HA ILE 94 HA ILE 94 4.768 -7.633 6.572 679 HB ILE 94 HB ILE 94 4.714 -6.930 4.211 680 HG12 ILE 94 2HG1 ILE 94 3.601 -9.129 4.831 681 HG13 ILE 94 1HG1 ILE 94 3.953 -8.931 3.124 682 HG21 ILE 94 1HG2 ILE 94 7.000 -6.810 3.658 683 HG22 ILE 94 2HG2 ILE 94 6.178 -7.852 2.496 684 HG23 ILE 94 3HG2 ILE 94 7.170 -8.561 3.772 685 HD11 ILE 94 3HD1 ILE 94 5.864 -10.443 3.377 686 HD12 ILE 94 1HD1 ILE 94 4.359 -11.203 3.899 687 HD13 ILE 94 2HD1 ILE 94 5.509 -10.601 5.095 688 H ASN 95 H ASN 95 5.016 -9.227 7.734 689 HA ASN 95 HA ASN 95 7.562 -10.622 7.926 690 HB2 ASN 95 2HB ASN 95 6.785 -9.593 10.003 691 HB3 ASN 95 1HB ASN 95 5.199 -10.312 9.802 692 HD21 ASN 95 1HD2 ASN 95 5.330 -11.224 11.824 693 HD22 ASN 95 2HD2 ASN 95 6.300 -12.602 12.185 694 H GLU 96 H GLU 96 7.528 -12.813 7.777 695 HA GLU 96 HA GLU 96 6.157 -14.087 5.820 696 HB2 GLU 96 2HB GLU 96 6.859 -16.201 6.938 697 HB3 GLU 96 1HB GLU 96 8.135 -15.003 6.744 698 HG2 GLU 96 2HG GLU 96 7.667 -14.287 9.106 699 HG3 GLU 96 1HG GLU 96 6.635 -15.705 9.246 700 H GLY 97 H GLY 97 4.988 -13.696 9.106 701 HA2 GLY 97 2HA GLY 97 2.442 -14.823 8.194 702 HA3 GLY 97 1HA GLY 97 3.133 -15.356 9.717 703 H GLU 98 H GLU 98 3.353 -11.981 8.613 704 HA GLU 98 HA GLU 98 1.071 -11.124 10.042 705 HB2 GLU 98 2HB GLU 98 2.546 -11.727 11.983 706 HB3 GLU 98 1HB GLU 98 3.705 -10.530 11.425 707 HG2 GLU 98 2HG GLU 98 2.287 -9.729 13.276 708 HG3 GLU 98 1HG GLU 98 2.126 -8.751 11.818 709 H PHE 99 H PHE 99 0.781 -8.819 9.974 710 HA PHE 99 HA PHE 99 2.500 -7.520 7.960 711 HB2 PHE 99 2HB PHE 99 -0.514 -7.272 8.137 712 HB3 PHE 99 1HB PHE 99 0.530 -6.616 6.877 713 HD1 PHE 99 1HD PHE 99 1.903 -8.353 5.536 714 HD2 PHE 99 2HD PHE 99 -1.540 -9.317 7.824 715 HE1 PHE 99 1HE PHE 99 1.635 -10.441 4.246 716 HE2 PHE 99 2HE PHE 99 -1.820 -11.399 6.544 717 HZ PHE 99 HZ PHE 99 -0.232 -11.965 4.758 718 H GLU 100 H GLU 100 3.222 -5.544 8.564 719 HA GLU 100 HA GLU 100 1.896 -4.152 10.793 720 HB2 GLU 100 2HB GLU 100 3.796 -5.460 11.599 721 HB3 GLU 100 1HB GLU 100 4.848 -4.709 10.427 722 HG2 GLU 100 2HG GLU 100 4.368 -2.518 11.576 723 HG3 GLU 100 1HG GLU 100 3.552 -3.456 12.829 724 H VAL 101 H VAL 101 1.719 -1.927 10.436 725 HA VAL 101 HA VAL 101 3.426 -0.794 8.346 726 HB VAL 101 HB VAL 101 1.194 -1.112 7.359 727 HG11 VAL 101 1HG1 VAL 101 -0.204 -0.984 9.323 728 HG12 VAL 101 2HG1 VAL 101 -0.746 0.202 8.130 729 HG13 VAL 101 3HG1 VAL 101 0.196 0.719 9.528 730 HG21 VAL 101 3HG2 VAL 101 2.527 0.746 6.550 731 HG22 VAL 101 1HG2 VAL 101 1.888 1.787 7.822 732 HG23 VAL 101 2HG2 VAL 101 0.820 1.195 6.553 733 H VAL 102 H VAL 102 4.464 1.001 8.850 734 HA VAL 102 HA VAL 102 3.632 2.420 11.279 735 HB VAL 102 HB VAL 102 6.464 1.939 10.294 736 HG11 VAL 102 1HG1 VAL 102 7.191 3.058 12.345 737 HG12 VAL 102 2HG1 VAL 102 5.512 3.419 12.748 738 HG13 VAL 102 3HG1 VAL 102 6.252 4.147 11.323 739 HG21 VAL 102 3HG2 VAL 102 5.038 0.918 12.753 740 HG22 VAL 102 1HG2 VAL 102 6.737 0.653 12.358 741 HG23 VAL 102 2HG2 VAL 102 5.473 -0.034 11.336 742 H ASP 103 H ASP 103 3.075 4.452 10.946 743 HA ASP 103 HA ASP 103 3.701 5.845 8.511 744 HB2 ASP 103 2HB ASP 103 1.526 6.285 9.320 745 HB3 ASP 103 1HB ASP 103 2.106 6.513 10.969 746 H VAL 104 H VAL 104 5.345 7.069 8.234 747 HA VAL 104 HA VAL 104 6.763 8.157 10.572 748 HB VAL 104 HB VAL 104 8.012 7.584 7.864 749 HG11 VAL 104 1HG1 VAL 104 9.275 7.965 10.570 750 HG12 VAL 104 2HG1 VAL 104 9.213 9.160 9.276 751 HG13 VAL 104 3HG1 VAL 104 10.129 7.667 9.054 752 HG21 VAL 104 3HG2 VAL 104 7.215 5.455 8.713 753 HG22 VAL 104 1HG2 VAL 104 7.999 5.756 10.263 754 HG23 VAL 104 2HG2 VAL 104 8.975 5.523 8.815 755 H GLY 105 H GLY 105 4.562 8.978 8.392 756 HA2 GLY 105 2HA GLY 105 5.759 11.571 7.694 757 HA3 GLY 105 1HA GLY 105 4.572 10.721 6.706 758 H SER 106 H SER 106 4.736 11.225 10.178 759 HA SER 106 HA SER 106 2.010 11.668 10.526 760 HB2 SER 106 2HB SER 106 4.274 12.476 12.341 761 HB3 SER 106 1HB SER 106 2.615 12.090 12.808 762 HG SER 106 HG SER 106 3.224 10.002 11.549 763 H LEU 107 H LEU 107 4.425 13.727 9.417 764 HA LEU 107 HA LEU 107 3.586 16.301 10.158 765 HB2 LEU 107 2HB LEU 107 4.773 15.356 7.560 766 HB3 LEU 107 1HB LEU 107 4.688 17.021 8.092 767 HG LEU 107 HG LEU 107 6.295 14.829 9.417 768 HD11 LEU 107 1HD1 LEU 107 8.234 16.015 8.543 769 HD12 LEU 107 2HD1 LEU 107 7.172 17.152 7.713 770 HD13 LEU 107 3HD1 LEU 107 7.189 15.454 7.239 771 HD21 LEU 107 3HD2 LEU 107 5.565 16.511 11.024 772 HD22 LEU 107 1HD2 LEU 107 6.164 17.796 9.972 773 HD23 LEU 107 2HD2 LEU 107 7.291 16.658 10.709 774 H ASN 108 H ASN 108 2.530 14.089 7.657 775 HA ASN 108 HA ASN 108 0.536 15.985 6.657 776 HB2 ASN 108 2HB ASN 108 1.228 13.181 5.788 777 HB3 ASN 108 1HB ASN 108 -0.016 14.158 5.038 778 HD21 ASN 108 1HD2 ASN 108 0.978 14.046 3.038 779 HD22 ASN 108 2HD2 ASN 108 2.438 14.885 2.668 780 H GLY 109 H GLY 109 0.924 12.967 8.320 781 HA2 GLY 109 2HA GLY 109 -0.513 12.206 10.024 782 HA3 GLY 109 1HA GLY 109 -1.777 13.254 9.388 783 H THR 110 H THR 110 -0.112 10.202 8.977 784 HA THR 110 HA THR 110 -1.856 9.371 6.880 785 HB THR 110 HB THR 110 0.153 7.810 8.544 786 HG1 THR 110 1HG THR 110 1.552 8.731 7.397 787 HG21 THR 110 3HG2 THR 110 -1.499 6.378 7.395 788 HG22 THR 110 1HG2 THR 110 0.109 6.211 6.687 789 HG23 THR 110 2HG2 THR 110 -1.117 7.175 5.866 790 H TYR 111 H TYR 111 -3.833 8.604 7.225 791 HA TYR 111 HA TYR 111 -4.527 7.696 9.931 792 HB2 TYR 111 2HB TYR 111 -6.429 8.433 7.691 793 HB3 TYR 111 1HB TYR 111 -6.804 8.214 9.392 794 HD1 TYR 111 1HD TYR 111 -5.655 9.897 11.015 795 HD2 TYR 111 2HD TYR 111 -6.110 10.552 6.847 796 HE1 TYR 111 1HE TYR 111 -5.396 12.307 11.376 797 HE2 TYR 111 2HE TYR 111 -5.852 12.970 7.193 798 HH TYR 111 HH TYR 111 -4.713 14.233 10.112 799 H VAL 112 H VAL 112 -5.178 5.578 10.144 800 HA VAL 112 HA VAL 112 -5.287 4.074 7.640 801 HB VAL 112 HB VAL 112 -4.845 2.912 10.423 802 HG11 VAL 112 1HG1 VAL 112 -4.552 1.720 7.665 803 HG12 VAL 112 2HG1 VAL 112 -5.792 1.315 8.846 804 HG13 VAL 112 3HG1 VAL 112 -4.100 0.911 9.158 805 HG21 VAL 112 3HG2 VAL 112 -2.787 3.493 8.286 806 HG22 VAL 112 1HG2 VAL 112 -2.484 2.622 9.790 807 HG23 VAL 112 2HG2 VAL 112 -2.940 4.327 9.830 808 H ASN 113 H ASN 113 -7.162 3.380 7.045 809 HA ASN 113 HA ASN 113 -9.384 3.143 6.868 810 HB2 ASN 113 2HB ASN 113 -9.211 2.261 9.777 811 HB3 ASN 113 1HB ASN 113 -10.634 2.053 8.763 812 HD21 ASN 113 1HD2 ASN 113 -7.554 0.821 9.626 813 HD22 ASN 113 2HD2 ASN 113 -7.562 -0.563 8.608 814 H ARG 114 H ARG 114 -8.211 5.580 7.660 815 HA ARG 114 HA ARG 114 -8.724 7.714 7.941 816 HB2 ARG 114 2HB ARG 114 -11.609 6.884 8.349 817 HB3 ARG 114 1HB ARG 114 -11.046 8.534 8.153 818 HG2 ARG 114 2HG ARG 114 -10.123 7.758 5.888 819 HG3 ARG 114 1HG ARG 114 -11.128 6.326 6.121 820 HD2 ARG 114 2HD ARG 114 -12.339 7.956 4.813 821 HD3 ARG 114 1HD ARG 114 -13.093 7.799 6.404 822 HE ARG 114 HE ARG 114 -11.122 9.862 6.259 823 HH11 ARG 114 1HH1 ARG 114 -14.569 9.234 5.648 824 HH12 ARG 114 2HH1 ARG 114 -15.015 10.854 5.897 825 HH21 ARG 114 1HH2 ARG 114 -11.763 12.029 6.574 826 HH22 ARG 114 2HH2 ARG 114 -13.403 12.487 6.430 827 H GLU 115 H GLU 115 -8.303 5.710 10.217 828 HA GLU 115 HA GLU 115 -8.912 7.632 12.317 829 HB2 GLU 115 2HB GLU 115 -9.827 5.379 12.723 830 HB3 GLU 115 1HB GLU 115 -8.241 4.679 12.471 831 HG2 GLU 115 2HG GLU 115 -8.894 4.797 14.854 832 HG3 GLU 115 1HG GLU 115 -7.411 5.680 14.500 833 HA PRO 116 HA PRO 116 -4.515 8.577 12.045 834 HB2 PRO 116 2HB PRO 116 -4.438 9.769 14.579 835 HB3 PRO 116 1HB PRO 116 -4.716 10.618 13.056 836 HG2 PRO 116 2HG PRO 116 -6.652 9.742 15.120 837 HG3 PRO 116 1HG PRO 116 -6.731 11.124 14.017 838 HD2 PRO 116 2HD PRO 116 -8.208 8.880 13.701 839 HD3 PRO 116 1HD PRO 116 -7.676 9.872 12.330 840 H ARG 117 H ARG 117 -3.479 6.744 12.211 841 HA ARG 117 HA ARG 117 -2.929 5.661 14.842 842 HB2 ARG 117 2HB ARG 117 -4.890 4.455 13.659 843 HB3 ARG 117 1HB ARG 117 -3.701 3.938 12.477 844 HG2 ARG 117 2HG ARG 117 -3.787 2.128 13.865 845 HG3 ARG 117 1HG ARG 117 -2.439 3.022 14.558 846 HD2 ARG 117 2HD ARG 117 -5.295 3.029 15.562 847 HD3 ARG 117 1HD ARG 117 -3.947 2.159 16.278 848 HE ARG 117 HE ARG 117 -3.113 4.713 16.342 849 HH11 ARG 117 1HH1 ARG 117 -6.008 3.047 17.535 850 HH12 ARG 117 2HH1 ARG 117 -6.370 4.185 18.735 851 HH21 ARG 117 1HH2 ARG 117 -3.623 6.340 18.024 852 HH22 ARG 117 2HH2 ARG 117 -4.986 6.086 19.002 853 H ASN 118 H ASN 118 -0.761 5.839 14.819 854 HA ASN 118 HA ASN 118 0.557 6.118 12.283 855 HB2 ASN 118 2HB ASN 118 1.764 6.279 15.041 856 HB3 ASN 118 1HB ASN 118 2.583 6.682 13.537 857 HD21 ASN 118 1HD2 ASN 118 1.818 8.596 12.347 858 HD22 ASN 118 2HD2 ASN 118 0.966 9.800 13.204 859 H ALA 119 H ALA 119 0.207 3.644 14.638 860 HA ALA 119 HA ALA 119 1.751 1.979 12.780 861 HB1 ALA 119 1HB ALA 119 2.483 0.594 14.698 862 HB2 ALA 119 2HB ALA 119 1.707 1.729 15.800 863 HB3 ALA 119 3HB ALA 119 3.086 2.247 14.833 864 H GLN 120 H GLN 120 0.679 0.161 12.211 865 HA GLN 120 HA GLN 120 -1.753 -0.512 13.692 866 HB2 GLN 120 2HB GLN 120 -1.935 1.030 11.455 867 HB3 GLN 120 1HB GLN 120 -1.954 -0.560 10.721 868 HG2 GLN 120 2HG GLN 120 -3.921 0.526 12.743 869 HG3 GLN 120 1HG GLN 120 -4.222 0.229 11.039 870 HE21 GLN 120 1HE2 GLN 120 -4.533 -1.955 10.335 871 HE22 GLN 120 2HE2 GLN 120 -4.781 -3.190 11.478 872 H VAL 121 H VAL 121 -2.255 -2.675 13.543 873 HA VAL 121 HA VAL 121 -0.222 -4.396 12.341 874 HB VAL 121 HB VAL 121 -2.553 -5.143 14.159 875 HG11 VAL 121 1HG1 VAL 121 -0.098 -6.707 13.364 876 HG12 VAL 121 2HG1 VAL 121 -1.742 -6.992 12.797 877 HG13 VAL 121 3HG1 VAL 121 -1.339 -7.252 14.493 878 HG21 VAL 121 3HG2 VAL 121 0.341 -4.717 14.911 879 HG22 VAL 121 1HG2 VAL 121 -0.922 -5.310 15.986 880 HG23 VAL 121 2HG2 VAL 121 -1.004 -3.667 15.350 881 H MET 122 H MET 122 -0.691 -4.781 10.320 882 HA MET 122 HA MET 122 -3.082 -3.923 9.196 883 HB2 MET 122 2HB MET 122 -0.629 -5.064 8.104 884 HB3 MET 122 1HB MET 122 -2.073 -5.267 7.119 885 HG2 MET 122 2HG MET 122 -2.440 -2.872 7.138 886 HG3 MET 122 1HG MET 122 -1.040 -2.655 8.189 887 HE1 MET 122 3HE MET 122 -1.792 -1.408 5.139 888 HE2 MET 122 1HE MET 122 -0.150 -1.277 4.516 889 HE3 MET 122 2HE MET 122 -0.514 -0.780 6.172 890 H GLN 123 H GLN 123 -4.766 -4.623 8.627 891 HA GLN 123 HA GLN 123 -5.479 -7.452 8.855 892 HB2 GLN 123 2HB GLN 123 -6.724 -4.978 9.673 893 HB3 GLN 123 1HB GLN 123 -7.753 -5.801 8.518 894 HG2 GLN 123 2HG GLN 123 -8.438 -6.413 10.711 895 HG3 GLN 123 1HG GLN 123 -7.698 -7.811 9.956 896 HE21 GLN 123 1HE2 GLN 123 -4.925 -6.883 10.544 897 HE22 GLN 123 2HE2 GLN 123 -4.737 -7.099 12.231 898 H THR 124 H THR 124 -6.784 -8.274 7.089 899 HA THR 124 HA THR 124 -5.903 -7.157 4.623 900 HB THR 124 HB THR 124 -6.006 -9.587 4.865 901 HG1 THR 124 1HG THR 124 -7.712 -9.796 2.956 902 HG21 THR 124 3HG2 THR 124 -8.164 -10.804 4.885 903 HG22 THR 124 1HG2 THR 124 -9.014 -9.269 5.049 904 HG23 THR 124 2HG2 THR 124 -7.956 -9.828 6.341 905 H GLY 125 H GLY 125 -6.810 -5.572 3.607 906 HA2 GLY 125 2HA GLY 125 -8.763 -4.675 2.526 907 HA3 GLY 125 1HA GLY 125 -9.684 -5.105 3.964 908 H ASP 126 H ASP 126 -6.693 -4.082 4.959 909 HA ASP 126 HA ASP 126 -7.665 -1.715 6.153 910 HB2 ASP 126 2HB ASP 126 -4.954 -2.924 5.972 911 HB3 ASP 126 1HB ASP 126 -5.027 -1.206 6.310 912 H GLU 127 H GLU 127 -7.628 0.266 5.648 913 HA GLU 127 HA GLU 127 -6.647 0.980 2.975 914 HB2 GLU 127 2HB GLU 127 -8.963 2.135 4.519 915 HB3 GLU 127 1HB GLU 127 -8.436 2.652 2.922 916 HG2 GLU 127 2HG GLU 127 -8.942 0.449 2.033 917 HG3 GLU 127 1HG GLU 127 -9.444 -0.087 3.634 918 H ILE 128 H ILE 128 -5.177 2.464 2.896 919 HA ILE 128 HA ILE 128 -4.570 4.018 5.295 920 HB ILE 128 HB ILE 128 -2.959 3.632 2.760 921 HG12 ILE 128 2HG1 ILE 128 -2.538 2.560 5.559 922 HG13 ILE 128 1HG1 ILE 128 -3.057 1.624 4.165 923 HG21 ILE 128 1HG2 ILE 128 -2.218 5.116 5.278 924 HG22 ILE 128 2HG2 ILE 128 -2.540 5.832 3.699 925 HG23 ILE 128 3HG2 ILE 128 -1.133 4.793 3.925 926 HD11 ILE 128 3HD1 ILE 128 -0.897 2.053 3.092 927 HD12 ILE 128 1HD1 ILE 128 -0.719 1.253 4.654 928 HD13 ILE 128 2HD1 ILE 128 -0.395 2.980 4.507 929 H GLN 129 H GLN 129 -5.280 5.970 5.409 930 HA GLN 129 HA GLN 129 -6.349 7.283 3.031 931 HB2 GLN 129 2HB GLN 129 -7.883 6.831 4.915 932 HB3 GLN 129 1HB GLN 129 -6.840 7.762 5.971 933 HG2 GLN 129 2HG GLN 129 -8.564 9.225 5.430 934 HG3 GLN 129 1HG GLN 129 -7.250 9.703 4.359 935 HE21 GLN 129 1HE2 GLN 129 -8.614 10.597 2.804 936 HE22 GLN 129 2HE2 GLN 129 -9.644 9.596 1.850 937 H ILE 130 H ILE 130 -4.879 8.650 2.236 938 HA ILE 130 HA ILE 130 -3.648 10.485 4.125 939 HB ILE 130 HB ILE 130 -1.743 10.770 2.438 940 HG12 ILE 130 2HG1 ILE 130 -2.786 8.104 1.409 941 HG13 ILE 130 1HG1 ILE 130 -2.788 9.638 0.547 942 HG21 ILE 130 1HG2 ILE 130 -0.457 8.868 3.302 943 HG22 ILE 130 2HG2 ILE 130 -1.952 8.159 3.914 944 HG23 ILE 130 3HG2 ILE 130 -1.376 9.696 4.557 945 HD11 ILE 130 3HD1 ILE 130 -0.995 8.173 -0.222 946 HD12 ILE 130 1HD1 ILE 130 -0.337 8.124 1.413 947 HD13 ILE 130 2HD1 ILE 130 -0.355 9.642 0.517 948 H GLY 131 H GLY 131 -4.944 12.093 3.993 949 HA2 GLY 131 2HA GLY 131 -6.033 13.906 3.173 950 HA3 GLY 131 1HA GLY 131 -5.108 13.733 1.682 951 H LYS 132 H LYS 132 -6.152 13.070 -0.068 952 HA LYS 132 HA LYS 132 -8.828 11.921 0.289 953 HB2 LYS 132 2HB LYS 132 -7.678 13.584 -1.952 954 HB3 LYS 132 1HB LYS 132 -9.103 12.600 -2.199 955 HG2 LYS 132 2HG LYS 132 -9.771 14.876 -1.773 956 HG3 LYS 132 1HG LYS 132 -10.255 13.871 -0.413 957 HD2 LYS 132 2HD LYS 132 -8.296 14.675 0.844 958 HD3 LYS 132 1HD LYS 132 -7.855 15.698 -0.520 959 HE2 LYS 132 2HE LYS 132 -9.966 16.911 -0.303 960 HE3 LYS 132 1HE LYS 132 -10.433 15.863 1.035 961 HZ1 LYS 132 3HZ LYS 132 -8.505 16.689 2.267 962 HZ2 LYS 132 1HZ LYS 132 -9.558 17.934 1.880 963 HZ3 LYS 132 2HZ LYS 132 -8.120 17.735 1.027 964 H PHE 133 H PHE 133 -5.790 10.917 -0.267 965 HA PHE 133 HA PHE 133 -6.474 9.047 -2.386 966 HB2 PHE 133 2HB PHE 133 -3.826 9.631 -1.061 967 HB3 PHE 133 1HB PHE 133 -4.065 8.435 -2.333 968 HD1 PHE 133 1HD PHE 133 -5.237 9.421 -4.493 969 HD2 PHE 133 2HD PHE 133 -3.067 11.684 -1.641 970 HE1 PHE 133 1HE PHE 133 -4.840 11.156 -6.184 971 HE2 PHE 133 2HE PHE 133 -2.666 13.427 -3.321 972 HZ PHE 133 HZ PHE 133 -3.552 13.164 -5.596 973 H ARG 134 H ARG 134 -6.248 6.837 -2.162 974 HA ARG 134 HA ARG 134 -6.110 5.809 0.569 975 HB2 ARG 134 2HB ARG 134 -8.320 5.176 -1.379 976 HB3 ARG 134 1HB ARG 134 -7.938 4.159 -0.006 977 HG2 ARG 134 2HG ARG 134 -8.403 6.155 1.457 978 HG3 ARG 134 1HG ARG 134 -9.021 6.959 0.006 979 HD2 ARG 134 2HD ARG 134 -10.633 5.156 -0.327 980 HD3 ARG 134 1HD ARG 134 -10.005 4.314 1.080 981 HE ARG 134 HE ARG 134 -10.963 6.982 1.554 982 HH11 ARG 134 1HH1 ARG 134 -11.688 3.460 1.801 983 HH12 ARG 134 2HH1 ARG 134 -13.116 3.700 2.660 984 HH21 ARG 134 1HH2 ARG 134 -13.007 7.222 2.777 985 HH22 ARG 134 2HH2 ARG 134 -13.896 5.861 3.229 986 H LEU 135 H LEU 135 -4.895 4.192 0.757 987 HA LEU 135 HA LEU 135 -4.261 2.474 -1.542 988 HB2 LEU 135 2HB LEU 135 -2.299 3.628 -0.446 989 HB3 LEU 135 1HB LEU 135 -2.737 2.856 1.051 990 HG LEU 135 HG LEU 135 -0.768 1.898 -0.155 991 HD11 LEU 135 1HD1 LEU 135 -1.231 -0.428 0.289 992 HD12 LEU 135 2HD1 LEU 135 -2.941 -0.038 0.479 993 HD13 LEU 135 3HD1 LEU 135 -1.752 0.639 1.592 994 HD21 LEU 135 3HD2 LEU 135 -1.547 1.992 -2.425 995 HD22 LEU 135 1HD2 LEU 135 -2.828 0.833 -2.066 996 HD23 LEU 135 2HD2 LEU 135 -1.139 0.337 -1.987 997 H VAL 136 H VAL 136 -4.419 0.296 -1.182 998 HA VAL 136 HA VAL 136 -5.797 -0.437 1.259 999 HB VAL 136 HB VAL 136 -7.621 -0.054 -0.372 1000 HG11 VAL 136 1HG1 VAL 136 -6.396 -2.259 -1.986 1001 HG12 VAL 136 2HG1 VAL 136 -6.492 -0.559 -2.444 1002 HG13 VAL 136 3HG1 VAL 136 -7.967 -1.518 -2.292 1003 HG21 VAL 136 3HG2 VAL 136 -8.000 -1.684 1.371 1004 HG22 VAL 136 1HG2 VAL 136 -7.277 -2.951 0.380 1005 HG23 VAL 136 2HG2 VAL 136 -8.796 -2.204 -0.116 1006 H PHE 137 H PHE 137 -5.130 -2.208 2.130 1007 HA PHE 137 HA PHE 137 -3.140 -3.775 0.631 1008 HB2 PHE 137 2HB PHE 137 -2.270 -2.474 2.542 1009 HB3 PHE 137 1HB PHE 137 -3.403 -3.294 3.608 1010 HD1 PHE 137 2HD PHE 137 -0.347 -3.635 1.628 1011 HD2 PHE 137 1HD PHE 137 -2.989 -5.543 4.362 1012 HE1 PHE 137 2HE PHE 137 1.340 -5.364 2.045 1013 HE2 PHE 137 1HE PHE 137 -1.301 -7.275 4.786 1014 HZ PHE 137 HZ PHE 137 0.866 -7.188 3.628 1015 H LEU 138 H LEU 138 -3.532 -5.922 0.380 1016 HA LEU 138 HA LEU 138 -5.611 -7.068 2.070 1017 HB2 LEU 138 2HB LEU 138 -5.364 -7.541 -0.904 1018 HB3 LEU 138 1HB LEU 138 -6.425 -8.428 0.165 1019 HG LEU 138 HG LEU 138 -7.421 -6.064 0.665 1020 HD11 LEU 138 1HD1 LEU 138 -5.813 -4.745 -0.540 1021 HD12 LEU 138 2HD1 LEU 138 -7.413 -4.576 -1.267 1022 HD13 LEU 138 3HD1 LEU 138 -6.199 -5.598 -2.035 1023 HD21 LEU 138 3HD2 LEU 138 -7.947 -7.555 -1.892 1024 HD22 LEU 138 1HD2 LEU 138 -9.020 -6.366 -1.146 1025 HD23 LEU 138 2HD2 LEU 138 -8.660 -7.870 -0.301 1026 H ALA 139 H ALA 139 -5.353 -9.108 2.692 1027 HA ALA 139 HA ALA 139 -2.677 -10.140 2.401 1028 HB1 ALA 139 1HB ALA 139 -3.711 -10.042 4.655 1029 HB2 ALA 139 2HB ALA 139 -3.231 -11.668 4.186 1030 HB3 ALA 139 3HB ALA 139 -4.928 -11.203 4.113 1031 H GLY 140 H GLY 140 -2.762 -10.728 0.317 1032 HA2 GLY 140 2HA GLY 140 -4.245 -13.222 -0.189 1033 HA3 GLY 140 1HA GLY 140 -3.815 -12.067 -1.459 1034 HA PRO 141 HA PRO 141 0.215 -13.906 0.481 1035 HB2 PRO 141 2HB PRO 141 -0.002 -16.585 1.000 1036 HB3 PRO 141 1HB PRO 141 -0.001 -15.268 2.184 1037 HG2 PRO 141 2HG PRO 141 -2.293 -16.828 1.068 1038 HG3 PRO 141 1HG PRO 141 -2.098 -16.127 2.684 1039 HD2 PRO 141 2HD PRO 141 -3.656 -15.040 0.730 1040 HD3 PRO 141 1HD PRO 141 -2.898 -14.085 2.018 1041 H ALA 142 H ALA 142 1.351 -13.973 -1.104 1042 HA ALA 142 HA ALA 142 0.963 -15.770 -3.360 1043 HB1 ALA 142 1HB ALA 142 3.150 -13.755 -2.811 1044 HB2 ALA 142 2HB ALA 142 1.730 -13.473 -3.816 1045 HB3 ALA 142 3HB ALA 142 2.943 -14.654 -4.311 1046 H GLU 143 H GLU 143 1.500 -17.758 -2.933 1047 HA GLU 143 HA GLU 143 4.066 -18.313 -1.732 1048 HB2 GLU 143 2HB GLU 143 2.387 -18.298 0.101 1049 HB3 GLU 143 1HB GLU 143 1.432 -19.472 -0.780 1050 HG2 GLU 143 2HG GLU 143 3.319 -21.072 -0.592 1051 HG3 GLU 143 1HG GLU 143 4.164 -19.884 0.405 Start of MODEL 24 1 H1 MET 1 1HT MET 1 27.729 -39.554 -48.700 2 H2 MET 1 2HT MET 1 28.898 -39.057 -49.775 3 H3 MET 1 3HT MET 1 29.054 -40.551 -49.056 4 HA MET 1 HA MET 1 28.444 -40.610 -51.351 5 HB2 MET 1 2HB MET 1 26.424 -42.143 -51.182 6 HB3 MET 1 1HB MET 1 27.770 -42.564 -50.147 7 HG2 MET 1 2HG MET 1 26.534 -41.479 -48.256 8 HG3 MET 1 1HG MET 1 25.191 -41.254 -49.382 9 HE1 MET 1 2HE MET 1 23.920 -44.121 -47.014 10 HE2 MET 1 3HE MET 1 23.599 -42.503 -47.635 11 HE3 MET 1 1HE MET 1 24.965 -42.777 -46.552 12 H SER 2 H SER 2 25.234 -39.588 -49.886 13 HA SER 2 HA SER 2 24.753 -38.015 -52.236 14 HB2 SER 2 2HB SER 2 23.392 -37.844 -49.516 15 HB3 SER 2 1HB SER 2 22.739 -37.326 -51.064 16 HG SER 2 HG SER 2 21.920 -39.217 -51.188 17 H ASP 3 H ASP 3 25.777 -37.715 -48.966 18 HA ASP 3 HA ASP 3 26.346 -34.931 -48.893 19 HB2 ASP 3 2HB ASP 3 27.525 -35.509 -46.806 20 HB3 ASP 3 1HB ASP 3 25.944 -36.285 -46.848 21 H ASN 4 H ASN 4 28.377 -34.009 -49.136 22 HA ASN 4 HA ASN 4 30.149 -35.380 -50.969 23 HB2 ASN 4 2HB ASN 4 29.620 -32.905 -51.131 24 HB3 ASN 4 1HB ASN 4 30.526 -32.683 -49.642 25 HD21 ASN 4 1HD2 ASN 4 30.744 -33.332 -53.045 26 HD22 ASN 4 2HD2 ASN 4 32.447 -33.136 -53.160 27 H ASN 5 H ASN 5 29.944 -34.547 -47.665 28 HA ASN 5 HA ASN 5 30.953 -35.241 -45.793 29 HB2 ASN 5 2HB ASN 5 30.842 -37.514 -46.751 30 HB3 ASN 5 1HB ASN 5 32.399 -37.262 -47.526 31 HD21 ASN 5 1HD2 ASN 5 33.374 -38.932 -46.451 32 HD22 ASN 5 2HD2 ASN 5 33.745 -38.890 -44.771 33 H GLY 6 H GLY 6 31.966 -33.325 -45.445 34 HA2 GLY 6 2HA GLY 6 33.917 -32.337 -44.638 35 HA3 GLY 6 1HA GLY 6 34.863 -33.521 -45.536 36 H THR 7 H THR 7 34.505 -30.391 -45.336 37 HA THR 7 HA THR 7 34.544 -29.979 -48.228 38 HB THR 7 HB THR 7 34.063 -27.902 -46.064 39 HG1 THR 7 1HG THR 7 32.444 -29.793 -47.118 40 HG21 THR 7 3HG2 THR 7 33.623 -27.835 -49.054 41 HG22 THR 7 1HG2 THR 7 34.920 -27.000 -48.196 42 HG23 THR 7 2HG2 THR 7 33.237 -26.540 -47.923 43 HA PRO 8 HA PRO 8 38.941 -29.234 -47.584 44 HB2 PRO 8 2HB PRO 8 39.447 -28.281 -50.104 45 HB3 PRO 8 1HB PRO 8 39.352 -30.001 -49.708 46 HG2 PRO 8 2HG PRO 8 37.301 -28.219 -50.939 47 HG3 PRO 8 1HG PRO 8 37.695 -29.901 -51.322 48 HD2 PRO 8 2HD PRO 8 35.553 -29.202 -49.835 49 HD3 PRO 8 1HD PRO 8 36.428 -30.729 -49.580 50 H GLU 9 H GLU 9 40.120 -27.499 -47.046 51 HA GLU 9 HA GLU 9 39.047 -24.836 -47.576 52 HB2 GLU 9 2HB GLU 9 40.472 -25.829 -45.100 53 HB3 GLU 9 1HB GLU 9 40.028 -24.158 -45.405 54 HG2 GLU 9 2HG GLU 9 37.663 -24.810 -45.415 55 HG3 GLU 9 1HG GLU 9 38.141 -26.474 -45.067 56 HA PRO 10 HA PRO 10 43.027 -24.094 -49.443 57 HB2 PRO 10 2HB PRO 10 42.915 -21.392 -48.220 58 HB3 PRO 10 1HB PRO 10 43.072 -21.845 -49.920 59 HG2 PRO 10 2HG PRO 10 40.781 -20.860 -48.980 60 HG3 PRO 10 1HG PRO 10 40.785 -22.168 -50.176 61 HD2 PRO 10 2HD PRO 10 40.321 -22.306 -47.225 62 HD3 PRO 10 1HD PRO 10 39.489 -23.154 -48.546 63 H GLN 11 H GLN 11 45.219 -23.806 -48.900 64 HA GLN 11 HA GLN 11 45.989 -24.630 -46.324 65 HB2 GLN 11 2HB GLN 11 48.278 -24.341 -47.159 66 HB3 GLN 11 1HB GLN 11 47.279 -25.203 -48.319 67 HG2 GLN 11 2HG GLN 11 47.024 -23.108 -49.608 68 HG3 GLN 11 1HG GLN 11 48.068 -22.304 -48.446 69 HE21 GLN 11 1HE2 GLN 11 49.571 -21.790 -50.004 70 HE22 GLN 11 2HE2 GLN 11 50.604 -22.946 -50.736 71 H VAL 12 H VAL 12 47.186 -23.497 -44.847 72 HA VAL 12 HA VAL 12 46.476 -20.698 -44.730 73 HB VAL 12 HB VAL 12 46.013 -22.000 -42.717 74 HG11 VAL 12 1HG1 VAL 12 47.723 -23.689 -42.847 75 HG12 VAL 12 2HG1 VAL 12 47.781 -22.894 -41.277 76 HG13 VAL 12 3HG1 VAL 12 48.972 -22.487 -42.517 77 HG21 VAL 12 3HG2 VAL 12 46.483 -19.643 -42.389 78 HG22 VAL 12 1HG2 VAL 12 48.207 -19.988 -42.255 79 HG23 VAL 12 2HG2 VAL 12 47.093 -20.572 -41.019 80 H GLU 13 H GLU 13 47.812 -19.050 -45.005 81 HA GLU 13 HA GLU 13 50.435 -19.577 -46.036 82 HB2 GLU 13 2HB GLU 13 50.515 -17.170 -46.478 83 HB3 GLU 13 1HB GLU 13 49.010 -17.859 -47.071 84 HG2 GLU 13 2HG GLU 13 47.881 -16.982 -45.044 85 HG3 GLU 13 1HG GLU 13 49.399 -16.246 -44.559 86 H THR 14 H THR 14 52.382 -19.079 -45.093 87 HA THR 14 HA THR 14 52.206 -18.340 -42.287 88 HB THR 14 HB THR 14 53.372 -20.488 -42.728 89 HG1 THR 14 1HG THR 14 54.148 -19.590 -40.975 90 HG21 THR 14 3HG2 THR 14 55.592 -20.490 -43.829 91 HG22 THR 14 1HG2 THR 14 55.331 -18.812 -44.302 92 HG23 THR 14 2HG2 THR 14 54.281 -20.089 -44.933 93 H THR 15 H THR 15 53.399 -16.568 -41.504 94 HA THR 15 HA THR 15 55.025 -15.059 -43.248 95 HB THR 15 HB THR 15 52.778 -14.307 -44.005 96 HG1 THR 15 1HG THR 15 53.580 -12.394 -44.168 97 HG21 THR 15 3HG2 THR 15 52.344 -13.477 -41.121 98 HG22 THR 15 1HG2 THR 15 51.492 -14.769 -41.966 99 HG23 THR 15 2HG2 THR 15 51.272 -13.090 -42.466 100 H SER 16 H SER 16 55.953 -13.288 -41.998 101 HA SER 16 HA SER 16 56.051 -14.001 -39.178 102 HB2 SER 16 2HB SER 16 58.187 -13.919 -40.563 103 HB3 SER 16 1HB SER 16 57.945 -12.180 -40.689 104 HG SER 16 HG SER 16 58.318 -13.722 -38.365 105 H VAL 17 H VAL 17 54.475 -12.926 -38.150 106 HA VAL 17 HA VAL 17 54.386 -10.063 -38.620 107 HB VAL 17 HB VAL 17 52.535 -10.889 -39.802 108 HG11 VAL 17 1HG1 VAL 17 51.595 -12.256 -37.276 109 HG12 VAL 17 2HG1 VAL 17 52.179 -13.044 -38.740 110 HG13 VAL 17 3HG1 VAL 17 50.658 -12.148 -38.768 111 HG21 VAL 17 3HG2 VAL 17 52.149 -8.788 -38.691 112 HG22 VAL 17 1HG2 VAL 17 51.594 -9.616 -37.236 113 HG23 VAL 17 2HG2 VAL 17 50.646 -9.709 -38.723 114 H PHE 18 H PHE 18 55.339 -9.342 -37.003 115 HA PHE 18 HA PHE 18 53.986 -9.105 -34.558 116 HB2 PHE 18 2HB PHE 18 55.910 -9.898 -33.090 117 HB3 PHE 18 1HB PHE 18 54.971 -11.167 -33.852 118 HD1 PHE 18 2HD PHE 18 58.188 -9.339 -33.933 119 HD2 PHE 18 1HD PHE 18 55.991 -12.711 -35.311 120 HE1 PHE 18 2HE PHE 18 60.266 -10.346 -34.780 121 HE2 PHE 18 1HE PHE 18 58.059 -13.723 -36.152 122 HZ PHE 18 HZ PHE 18 60.198 -12.546 -35.888 123 H ARG 19 H ARG 19 54.694 -7.380 -33.320 124 HA ARG 19 HA ARG 19 56.900 -5.774 -34.300 125 HB2 ARG 19 2HB ARG 19 54.027 -4.867 -34.079 126 HB3 ARG 19 1HB ARG 19 55.400 -3.822 -34.345 127 HG2 ARG 19 2HG ARG 19 55.763 -4.796 -36.530 128 HG3 ARG 19 1HG ARG 19 54.494 -5.986 -36.223 129 HD2 ARG 19 2HD ARG 19 54.112 -3.004 -36.379 130 HD3 ARG 19 1HD ARG 19 53.704 -4.158 -37.647 131 HE ARG 19 HE ARG 19 52.460 -4.584 -35.054 132 HH11 ARG 19 1HH1 ARG 19 52.087 -3.505 -38.387 133 HH12 ARG 19 2HH1 ARG 19 50.406 -3.299 -38.289 134 HH21 ARG 19 1HH2 ARG 19 50.129 -4.226 -34.865 135 HH22 ARG 19 2HH2 ARG 19 49.286 -3.669 -36.235 136 H ALA 20 H ALA 20 56.664 -3.646 -32.752 137 HA ALA 20 HA ALA 20 56.326 -4.531 -30.016 138 HB1 ALA 20 1HB ALA 20 57.011 -1.797 -31.161 139 HB2 ALA 20 2HB ALA 20 58.176 -2.990 -30.588 140 HB3 ALA 20 3HB ALA 20 57.065 -2.227 -29.451 141 H ASP 21 H ASP 21 54.135 -5.028 -30.916 142 HA ASP 21 HA ASP 21 52.222 -2.894 -31.352 143 HB2 ASP 21 2HB ASP 21 52.251 -5.013 -32.643 144 HB3 ASP 21 1HB ASP 21 51.846 -5.889 -31.179 145 H LEU 22 H LEU 22 53.291 -4.873 -28.797 146 HA LEU 22 HA LEU 22 50.941 -4.832 -27.181 147 HB2 LEU 22 2HB LEU 22 52.702 -6.614 -27.160 148 HB3 LEU 22 1HB LEU 22 53.821 -5.467 -26.482 149 HG LEU 22 HG LEU 22 51.312 -6.253 -24.996 150 HD11 LEU 22 1HD1 LEU 22 52.467 -8.310 -25.583 151 HD12 LEU 22 2HD1 LEU 22 52.674 -7.952 -23.867 152 HD13 LEU 22 3HD1 LEU 22 53.986 -7.633 -25.000 153 HD21 LEU 22 3HD2 LEU 22 54.036 -5.307 -24.110 154 HD22 LEU 22 1HD2 LEU 22 52.672 -5.697 -23.056 155 HD23 LEU 22 2HD2 LEU 22 52.575 -4.324 -24.160 156 H LEU 23 H LEU 23 50.493 -3.526 -25.430 157 HA LEU 23 HA LEU 23 52.120 -1.107 -25.239 158 HB2 LEU 23 2HB LEU 23 49.990 0.103 -24.674 159 HB3 LEU 23 1HB LEU 23 50.128 -0.449 -26.321 160 HG LEU 23 HG LEU 23 48.637 -2.405 -25.648 161 HD11 LEU 23 1HD1 LEU 23 48.096 -0.674 -23.247 162 HD12 LEU 23 2HD1 LEU 23 48.853 -2.270 -23.244 163 HD13 LEU 23 3HD1 LEU 23 47.168 -2.096 -23.736 164 HD21 LEU 23 3HD2 LEU 23 47.517 0.383 -25.533 165 HD22 LEU 23 1HD2 LEU 23 46.595 -1.083 -25.862 166 HD23 LEU 23 2HD2 LEU 23 47.846 -0.556 -26.989 167 H LYS 24 H LYS 24 51.775 0.116 -23.169 168 HA LYS 24 HA LYS 24 52.329 -1.695 -20.993 169 HB2 LYS 24 2HB LYS 24 52.218 1.353 -21.050 170 HB3 LYS 24 1HB LYS 24 52.735 0.400 -19.681 171 HG2 LYS 24 2HG LYS 24 54.684 1.300 -20.733 172 HG3 LYS 24 1HG LYS 24 54.655 -0.424 -21.076 173 HD2 LYS 24 2HD LYS 24 53.789 0.026 -23.321 174 HD3 LYS 24 1HD LYS 24 53.740 1.750 -22.971 175 HE2 LYS 24 2HE LYS 24 55.697 1.153 -24.320 176 HE3 LYS 24 1HE LYS 24 56.177 1.779 -22.746 177 HZ1 LYS 24 3HZ LYS 24 56.675 -0.391 -22.000 178 HZ2 LYS 24 1HZ LYS 24 57.420 -0.196 -23.490 179 HZ3 LYS 24 2HZ LYS 24 56.013 -1.117 -23.369 180 H GLU 25 H GLU 25 50.906 -2.243 -19.430 181 HA GLU 25 HA GLU 25 48.205 -1.214 -19.741 182 HB2 GLU 25 2HB GLU 25 47.451 -3.252 -18.591 183 HB3 GLU 25 1HB GLU 25 48.397 -3.625 -20.015 184 HG2 GLU 25 2HG GLU 25 49.430 -3.752 -17.173 185 HG3 GLU 25 1HG GLU 25 48.841 -5.125 -18.092 186 H MET 26 H MET 26 46.898 -1.276 -17.642 187 HA MET 26 HA MET 26 48.468 -0.085 -15.484 188 HB2 MET 26 2HB MET 26 45.759 0.740 -16.545 189 HB3 MET 26 1HB MET 26 46.373 1.254 -14.984 190 HG2 MET 26 2HG MET 26 48.247 2.361 -16.074 191 HG3 MET 26 1HG MET 26 47.658 1.826 -17.646 192 HE1 MET 26 3HE MET 26 46.823 4.013 -14.458 193 HE2 MET 26 1HE MET 26 45.351 3.064 -14.653 194 HE3 MET 26 2HE MET 26 45.326 4.801 -14.951 195 H GLU 27 H GLU 27 46.983 -0.063 -13.437 196 HA GLU 27 HA GLU 27 46.140 -2.798 -13.025 197 HB2 GLU 27 2HB GLU 27 47.620 -1.581 -11.401 198 HB3 GLU 27 1HB GLU 27 46.302 -0.465 -11.091 199 HG2 GLU 27 2HG GLU 27 46.591 -2.206 -9.354 200 HG3 GLU 27 1HG GLU 27 44.993 -2.197 -10.094 201 H SER 28 H SER 28 43.990 -3.255 -12.132 202 HA SER 28 HA SER 28 42.033 -1.372 -13.226 203 HB2 SER 28 2HB SER 28 41.685 -4.308 -12.569 204 HB3 SER 28 1HB SER 28 40.526 -3.271 -13.399 205 HG SER 28 HG SER 28 42.586 -4.625 -14.411 206 H SER 29 H SER 29 39.995 -1.119 -12.027 207 HA SER 29 HA SER 29 40.455 -0.529 -9.317 208 HB2 SER 29 2HB SER 29 37.821 -0.770 -10.767 209 HB3 SER 29 1HB SER 29 38.164 0.184 -9.322 210 HG SER 29 HG SER 29 39.749 1.298 -10.664 211 H THR 30 H THR 30 40.078 -1.760 -7.528 212 HA THR 30 HA THR 30 39.034 -4.396 -7.986 213 HB THR 30 HB THR 30 41.088 -4.341 -6.686 214 HG1 THR 30 1HG THR 30 40.418 -5.885 -5.500 215 HG21 THR 30 3HG2 THR 30 39.623 -2.617 -4.673 216 HG22 THR 30 1HG2 THR 30 40.970 -2.114 -5.696 217 HG23 THR 30 2HG2 THR 30 41.223 -3.320 -4.435 218 H GLY 31 H GLY 31 36.959 -4.605 -7.988 219 HA2 GLY 31 2HA GLY 31 35.281 -2.714 -6.543 220 HA3 GLY 31 1HA GLY 31 34.749 -3.870 -7.757 221 H THR 32 H THR 32 33.911 -3.244 -4.905 222 HA THR 32 HA THR 32 34.432 -5.750 -3.595 223 HB THR 32 HB THR 32 32.815 -4.648 -1.888 224 HG1 THR 32 1HG THR 32 32.057 -2.780 -2.452 225 HG21 THR 32 3HG2 THR 32 35.496 -3.386 -2.528 226 HG22 THR 32 1HG2 THR 32 35.249 -4.831 -1.552 227 HG23 THR 32 2HG2 THR 32 34.661 -3.266 -0.983 228 H ALA 33 H ALA 33 32.623 -7.082 -2.836 229 HA ALA 33 HA ALA 33 30.788 -7.550 -4.984 230 HB1 ALA 33 1HB ALA 33 31.903 -9.398 -3.823 231 HB2 ALA 33 2HB ALA 33 30.147 -9.530 -3.710 232 HB3 ALA 33 3HB ALA 33 31.077 -8.954 -2.331 233 HA PRO 34 HA PRO 34 27.508 -5.203 -2.897 234 HB2 PRO 34 2HB PRO 34 25.966 -5.678 -5.319 235 HB3 PRO 34 1HB PRO 34 26.588 -4.138 -4.718 236 HG2 PRO 34 2HG PRO 34 27.506 -5.344 -6.980 237 HG3 PRO 34 1HG PRO 34 28.507 -4.296 -5.963 238 HD2 PRO 34 2HD PRO 34 28.443 -7.283 -6.094 239 HD3 PRO 34 1HD PRO 34 29.816 -6.165 -5.933 240 H ALA 35 H ALA 35 26.275 -6.387 -1.479 241 HA ALA 35 HA ALA 35 25.067 -8.833 -2.540 242 HB1 ALA 35 1HB ALA 35 25.138 -9.755 -0.298 243 HB2 ALA 35 2HB ALA 35 25.829 -8.258 0.318 244 HB3 ALA 35 3HB ALA 35 26.751 -9.257 -0.805 245 H SER 36 H SER 36 23.008 -8.482 -3.000 246 HA SER 36 HA SER 36 21.453 -6.613 -1.507 247 HB2 SER 36 2HB SER 36 20.689 -8.633 -3.626 248 HB3 SER 36 1HB SER 36 19.586 -7.440 -2.946 249 HG SER 36 HG SER 36 20.339 -6.111 -4.325 250 H THR 37 H THR 37 20.063 -7.018 0.094 251 HA THR 37 HA THR 37 20.410 -9.269 1.699 252 HB THR 37 HB THR 37 18.142 -7.256 1.789 253 HG1 THR 37 1HG THR 37 19.598 -5.792 2.398 254 HG21 THR 37 3HG2 THR 37 18.352 -7.573 4.231 255 HG22 THR 37 1HG2 THR 37 19.662 -8.722 3.976 256 HG23 THR 37 2HG2 THR 37 18.033 -9.116 3.437 257 H GLY 38 H GLY 38 18.662 -10.770 2.367 258 HA2 GLY 38 2HA GLY 38 17.573 -12.106 0.132 259 HA3 GLY 38 1HA GLY 38 17.394 -12.553 1.815 260 H ALA 39 H ALA 39 16.216 -10.524 -0.681 261 HA ALA 39 HA ALA 39 13.799 -9.715 0.594 262 HB1 ALA 39 1HB ALA 39 13.038 -9.055 -1.657 263 HB2 ALA 39 2HB ALA 39 14.397 -9.923 -2.366 264 HB3 ALA 39 3HB ALA 39 14.688 -8.509 -1.353 265 H GLU 40 H GLU 40 14.501 -12.128 -1.853 266 HA GLU 40 HA GLU 40 11.997 -13.409 -1.975 267 HB2 GLU 40 2HB GLU 40 13.160 -15.179 -3.201 268 HB3 GLU 40 1HB GLU 40 13.644 -13.600 -3.775 269 HG2 GLU 40 2HG GLU 40 15.250 -15.448 -1.994 270 HG3 GLU 40 1HG GLU 40 15.548 -15.097 -3.691 271 H ASN 41 H ASN 41 14.257 -13.446 0.398 272 HA ASN 41 HA ASN 41 13.945 -16.093 1.395 273 HB2 ASN 41 2HB ASN 41 15.329 -13.649 2.332 274 HB3 ASN 41 1HB ASN 41 14.891 -14.834 3.552 275 HD21 ASN 41 1HD2 ASN 41 16.781 -14.337 0.567 276 HD22 ASN 41 2HD2 ASN 41 17.829 -15.646 0.875 277 H LEU 42 H LEU 42 11.930 -13.371 1.484 278 HA LEU 42 HA LEU 42 10.789 -13.561 4.010 279 HB2 LEU 42 2HB LEU 42 9.085 -12.196 3.242 280 HB3 LEU 42 1HB LEU 42 10.403 -11.777 2.181 281 HG LEU 42 HG LEU 42 8.086 -13.585 1.437 282 HD11 LEU 42 1HD1 LEU 42 7.348 -11.315 1.837 283 HD12 LEU 42 2HD1 LEU 42 7.271 -11.706 0.124 284 HD13 LEU 42 3HD1 LEU 42 8.583 -10.700 0.740 285 HD21 LEU 42 3HD2 LEU 42 10.214 -12.325 -0.306 286 HD22 LEU 42 1HD2 LEU 42 8.850 -13.292 -0.871 287 HD23 LEU 42 2HD2 LEU 42 10.115 -14.032 0.113 288 HA PRO 43 HA PRO 43 8.382 -17.317 3.996 289 HB2 PRO 43 2HB PRO 43 6.085 -15.773 5.077 290 HB3 PRO 43 1HB PRO 43 6.921 -17.167 5.767 291 HG2 PRO 43 2HG PRO 43 7.268 -14.731 6.791 292 HG3 PRO 43 1HG PRO 43 8.625 -15.870 6.667 293 HD2 PRO 43 2HD PRO 43 7.951 -13.532 4.926 294 HD3 PRO 43 1HD PRO 43 9.532 -14.067 5.534 295 H ALA 44 H ALA 44 6.334 -18.258 3.159 296 HA ALA 44 HA ALA 44 5.697 -16.986 0.652 297 HB1 ALA 44 1HB ALA 44 4.943 -19.686 1.750 298 HB2 ALA 44 2HB ALA 44 6.275 -19.344 0.646 299 HB3 ALA 44 3HB ALA 44 4.606 -19.113 0.116 300 H GLY 45 H GLY 45 3.523 -16.630 -0.030 301 HA2 GLY 45 2HA GLY 45 1.244 -16.302 0.349 302 HA3 GLY 45 1HA GLY 45 1.516 -16.503 2.081 303 H SER 46 H SER 46 2.213 -14.384 -0.617 304 HA SER 46 HA SER 46 2.950 -12.239 1.190 305 HB2 SER 46 2HB SER 46 2.885 -12.368 -1.822 306 HB3 SER 46 1HB SER 46 3.485 -11.010 -0.880 307 HG SER 46 HG SER 46 5.266 -11.973 -0.867 308 H ALA 47 H ALA 47 2.082 -10.063 0.743 309 HA ALA 47 HA ALA 47 -0.787 -10.116 0.145 310 HB1 ALA 47 1HB ALA 47 -0.363 -9.815 2.536 311 HB2 ALA 47 2HB ALA 47 -1.013 -8.335 1.825 312 HB3 ALA 47 3HB ALA 47 0.711 -8.460 2.181 313 H LEU 48 H LEU 48 -1.545 -7.858 -0.558 314 HA LEU 48 HA LEU 48 0.589 -6.461 -1.958 315 HB2 LEU 48 2HB LEU 48 -0.490 -6.438 -4.057 316 HB3 LEU 48 1HB LEU 48 -0.450 -8.101 -3.537 317 HG LEU 48 HG LEU 48 -2.897 -6.318 -3.430 318 HD11 LEU 48 1HD1 LEU 48 -2.162 -8.495 -5.362 319 HD12 LEU 48 2HD1 LEU 48 -2.169 -6.765 -5.691 320 HD13 LEU 48 3HD1 LEU 48 -3.684 -7.599 -5.329 321 HD21 LEU 48 3HD2 LEU 48 -4.126 -8.409 -3.091 322 HD22 LEU 48 1HD2 LEU 48 -2.982 -8.122 -1.779 323 HD23 LEU 48 2HD2 LEU 48 -2.602 -9.295 -3.038 324 H LEU 49 H LEU 49 0.057 -4.347 -2.589 325 HA LEU 49 HA LEU 49 -2.302 -3.258 -1.234 326 HB2 LEU 49 2HB LEU 49 -1.141 -1.080 -1.084 327 HB3 LEU 49 1HB LEU 49 -0.327 -2.323 -0.178 328 HG LEU 49 HG LEU 49 0.653 -1.532 -2.930 329 HD11 LEU 49 1HD1 LEU 49 2.213 -0.017 -1.816 330 HD12 LEU 49 2HD1 LEU 49 1.390 -0.285 -0.278 331 HD13 LEU 49 3HD1 LEU 49 0.551 0.515 -1.613 332 HD21 LEU 49 3HD2 LEU 49 1.570 -3.580 -1.948 333 HD22 LEU 49 1HD2 LEU 49 2.010 -2.682 -0.496 334 HD23 LEU 49 2HD2 LEU 49 2.788 -2.306 -2.029 335 H VAL 50 H VAL 50 -3.712 -2.150 -2.418 336 HA VAL 50 HA VAL 50 -3.105 -1.805 -5.282 337 HB VAL 50 HB VAL 50 -5.851 -2.204 -4.058 338 HG11 VAL 50 1HG1 VAL 50 -5.888 -1.051 -6.167 339 HG12 VAL 50 2HG1 VAL 50 -6.573 -2.666 -6.341 340 HG13 VAL 50 3HG1 VAL 50 -4.939 -2.333 -6.919 341 HG21 VAL 50 3HG2 VAL 50 -4.134 -4.300 -5.403 342 HG22 VAL 50 1HG2 VAL 50 -5.816 -4.506 -4.922 343 HG23 VAL 50 2HG2 VAL 50 -4.578 -4.254 -3.697 344 H VAL 51 H VAL 51 -3.438 0.210 -6.091 345 HA VAL 51 HA VAL 51 -4.140 2.323 -4.162 346 HB VAL 51 HB VAL 51 -3.062 2.667 -6.988 347 HG11 VAL 51 1HG1 VAL 51 -2.427 4.876 -6.187 348 HG12 VAL 51 2HG1 VAL 51 -3.133 4.521 -4.612 349 HG13 VAL 51 3HG1 VAL 51 -4.164 4.624 -6.040 350 HG21 VAL 51 3HG2 VAL 51 -1.471 1.351 -5.707 351 HG22 VAL 51 1HG2 VAL 51 -1.549 2.520 -4.384 352 HG23 VAL 51 2HG2 VAL 51 -0.873 2.999 -5.934 353 H LYS 52 H LYS 52 -6.028 3.106 -4.059 354 HA LYS 52 HA LYS 52 -7.877 2.711 -6.278 355 HB2 LYS 52 2HB LYS 52 -8.302 3.641 -3.443 356 HB3 LYS 52 1HB LYS 52 -9.568 3.650 -4.656 357 HG2 LYS 52 2HG LYS 52 -9.319 1.214 -4.882 358 HG3 LYS 52 1HG LYS 52 -8.119 1.242 -3.584 359 HD2 LYS 52 2HD LYS 52 -9.740 2.098 -2.024 360 HD3 LYS 52 1HD LYS 52 -10.942 2.273 -3.304 361 HE2 LYS 52 2HE LYS 52 -9.756 -0.331 -2.341 362 HE3 LYS 52 1HE LYS 52 -11.344 0.293 -1.907 363 HZ1 LYS 52 3HZ LYS 52 -11.934 0.195 -4.286 364 HZ2 LYS 52 1HZ LYS 52 -11.538 -1.316 -3.662 365 HZ3 LYS 52 2HZ LYS 52 -10.448 -0.495 -4.635 366 H ARG 53 H ARG 53 -6.381 5.230 -4.371 367 HA ARG 53 HA ARG 53 -6.906 7.178 -6.441 368 HB2 ARG 53 2HB ARG 53 -8.969 7.335 -5.130 369 HB3 ARG 53 1HB ARG 53 -8.039 7.482 -3.649 370 HG2 ARG 53 2HG ARG 53 -7.130 9.637 -4.481 371 HG3 ARG 53 1HG ARG 53 -8.163 9.489 -5.900 372 HD2 ARG 53 2HD ARG 53 -10.148 9.514 -4.495 373 HD3 ARG 53 1HD ARG 53 -9.145 9.566 -3.048 374 HE ARG 53 HE ARG 53 -8.650 11.725 -4.874 375 HH11 ARG 53 1HH1 ARG 53 -10.668 10.699 -2.119 376 HH12 ARG 53 2HH1 ARG 53 -10.989 12.282 -1.616 377 HH21 ARG 53 1HH2 ARG 53 -9.172 13.871 -4.202 378 HH22 ARG 53 2HH2 ARG 53 -10.155 14.144 -2.835 379 H GLY 54 H GLY 54 -5.053 8.276 -6.625 380 HA2 GLY 54 2HA GLY 54 -3.791 9.809 -4.882 381 HA3 GLY 54 1HA GLY 54 -3.171 8.223 -4.454 382 HA PRO 55 HA PRO 55 -1.358 9.991 -8.679 383 HB2 PRO 55 2HB PRO 55 0.305 11.785 -6.991 384 HB3 PRO 55 1HB PRO 55 -0.366 12.067 -8.602 385 HG2 PRO 55 2HG PRO 55 -1.467 13.240 -6.522 386 HG3 PRO 55 1HG PRO 55 -2.501 12.499 -7.761 387 HD2 PRO 55 2HD PRO 55 -1.715 11.426 -5.068 388 HD3 PRO 55 1HD PRO 55 -3.311 11.465 -5.852 389 H ASN 56 H ASN 56 -0.356 8.861 -5.693 390 HA ASN 56 HA ASN 56 2.386 8.368 -5.941 391 HB2 ASN 56 2HB ASN 56 2.024 6.521 -4.340 392 HB3 ASN 56 1HB ASN 56 1.213 8.007 -3.833 393 HD21 ASN 56 1HD2 ASN 56 0.963 4.715 -4.577 394 HD22 ASN 56 2HD2 ASN 56 -0.745 4.566 -4.323 395 H ALA 57 H ALA 57 -0.437 6.491 -7.174 396 HA ALA 57 HA ALA 57 0.836 5.365 -9.370 397 HB1 ALA 57 1HB ALA 57 2.117 3.996 -7.839 398 HB2 ALA 57 2HB ALA 57 0.913 2.962 -8.617 399 HB3 ALA 57 3HB ALA 57 0.667 3.529 -6.966 400 H GLY 58 H GLY 58 -0.626 3.079 -9.760 401 HA2 GLY 58 2HA GLY 58 -3.363 3.462 -8.915 402 HA3 GLY 58 1HA GLY 58 -3.055 3.803 -10.613 403 H ALA 59 H ALA 59 -1.296 1.424 -8.786 404 HA ALA 59 HA ALA 59 -2.538 -0.706 -10.342 405 HB1 ALA 59 1HB ALA 59 -0.463 -0.074 -11.464 406 HB2 ALA 59 2HB ALA 59 -0.264 -1.642 -10.680 407 HB3 ALA 59 3HB ALA 59 0.416 -0.194 -9.942 408 H ARG 60 H ARG 60 -0.968 -2.749 -9.283 409 HA ARG 60 HA ARG 60 -1.335 -2.407 -6.446 410 HB2 ARG 60 2HB ARG 60 -2.208 -4.595 -6.177 411 HB3 ARG 60 1HB ARG 60 -3.135 -3.810 -7.434 412 HG2 ARG 60 2HG ARG 60 -0.908 -5.710 -8.135 413 HG3 ARG 60 1HG ARG 60 -2.473 -6.328 -7.660 414 HD2 ARG 60 2HD ARG 60 -2.444 -6.325 -10.023 415 HD3 ARG 60 1HD ARG 60 -3.452 -4.970 -9.555 416 HE ARG 60 HE ARG 60 -2.054 -3.611 -10.638 417 HH11 ARG 60 1HH1 ARG 60 -0.286 -6.687 -10.088 418 HH12 ARG 60 2HH1 ARG 60 1.054 -6.210 -11.026 419 HH21 ARG 60 1HH2 ARG 60 -0.173 -3.075 -12.006 420 HH22 ARG 60 2HH2 ARG 60 1.108 -4.189 -12.137 421 H PHE 61 H PHE 61 0.212 -3.268 -5.189 422 HA PHE 61 HA PHE 61 2.570 -4.262 -6.639 423 HB2 PHE 61 2HB PHE 61 2.496 -2.495 -4.186 424 HB3 PHE 61 1HB PHE 61 3.957 -3.166 -4.898 425 HD1 PHE 61 1HD PHE 61 4.817 -2.300 -7.003 426 HD2 PHE 61 2HD PHE 61 1.330 -0.651 -5.202 427 HE1 PHE 61 1HE PHE 61 4.999 -0.327 -8.465 428 HE2 PHE 61 2HE PHE 61 1.506 1.320 -6.661 429 HZ PHE 61 HZ PHE 61 3.335 1.483 -8.293 430 H LEU 62 H LEU 62 3.102 -6.229 -6.111 431 HA LEU 62 HA LEU 62 2.025 -7.447 -3.694 432 HB2 LEU 62 2HB LEU 62 1.895 -8.618 -5.888 433 HB3 LEU 62 1HB LEU 62 3.643 -8.639 -5.959 434 HG LEU 62 HG LEU 62 3.652 -10.074 -3.913 435 HD11 LEU 62 1HD1 LEU 62 0.674 -10.145 -4.374 436 HD12 LEU 62 2HD1 LEU 62 1.504 -9.457 -2.977 437 HD13 LEU 62 3HD1 LEU 62 1.564 -11.192 -3.272 438 HD21 LEU 62 3HD2 LEU 62 3.860 -11.058 -6.141 439 HD22 LEU 62 1HD2 LEU 62 2.104 -11.142 -6.275 440 HD23 LEU 62 2HD2 LEU 62 2.943 -12.116 -5.068 441 H LEU 63 H LEU 63 3.297 -7.916 -1.931 442 HA LEU 63 HA LEU 63 5.969 -6.833 -1.975 443 HB2 LEU 63 2HB LEU 63 4.361 -8.047 0.275 444 HB3 LEU 63 1HB LEU 63 6.026 -7.555 0.465 445 HG LEU 63 HG LEU 63 5.296 -5.206 -0.117 446 HD11 LEU 63 1HD1 LEU 63 3.204 -5.686 -1.235 447 HD12 LEU 63 2HD1 LEU 63 2.946 -4.631 0.155 448 HD13 LEU 63 3HD1 LEU 63 2.542 -6.344 0.262 449 HD21 LEU 63 3HD2 LEU 63 5.736 -5.881 2.172 450 HD22 LEU 63 1HD2 LEU 63 4.085 -6.478 2.328 451 HD23 LEU 63 2HD2 LEU 63 4.383 -4.754 2.104 452 H ASP 64 H ASP 64 7.601 -7.955 -2.708 453 HA ASP 64 HA ASP 64 7.808 -10.754 -1.882 454 HB2 ASP 64 2HB ASP 64 9.108 -11.255 -3.903 455 HB3 ASP 64 1HB ASP 64 7.557 -10.580 -4.362 456 H GLN 65 H GLN 65 8.531 -8.153 -0.771 457 HA GLN 65 HA GLN 65 11.261 -8.795 -0.052 458 HB2 GLN 65 2HB GLN 65 11.889 -6.399 0.001 459 HB3 GLN 65 1HB GLN 65 11.467 -6.901 -1.618 460 HG2 GLN 65 2HG GLN 65 9.587 -5.404 0.210 461 HG3 GLN 65 1HG GLN 65 10.674 -4.616 -0.926 462 HE21 GLN 65 1HE2 GLN 65 7.772 -4.577 -0.759 463 HE22 GLN 65 2HE2 GLN 65 7.198 -5.105 -2.299 464 HA PRO 66 HA PRO 66 9.545 -8.700 3.982 465 HB2 PRO 66 2HB PRO 66 11.728 -7.920 5.469 466 HB3 PRO 66 1HB PRO 66 11.461 -9.556 4.866 467 HG2 PRO 66 2HG PRO 66 13.148 -7.373 3.729 468 HG3 PRO 66 1HG PRO 66 13.509 -9.105 3.861 469 HD2 PRO 66 2HD PRO 66 12.729 -8.011 1.534 470 HD3 PRO 66 1HD PRO 66 12.216 -9.642 2.013 471 H THR 67 H THR 67 11.258 -5.823 2.956 472 HA THR 67 HA THR 67 9.329 -4.252 4.469 473 HB THR 67 HB THR 67 12.299 -3.634 4.403 474 HG1 THR 67 1HG THR 67 10.832 -5.237 5.948 475 HG21 THR 67 3HG2 THR 67 10.866 -1.622 4.508 476 HG22 THR 67 1HG2 THR 67 11.714 -1.874 6.036 477 HG23 THR 67 2HG2 THR 67 10.010 -2.304 5.887 478 H THR 68 H THR 68 8.316 -2.986 3.113 479 HA THR 68 HA THR 68 9.593 -2.149 0.609 480 HB THR 68 HB THR 68 6.727 -1.839 1.485 481 HG1 THR 68 1HG THR 68 6.817 -3.977 1.477 482 HG21 THR 68 3HG2 THR 68 6.267 -1.803 -0.935 483 HG22 THR 68 1HG2 THR 68 7.991 -2.009 -1.257 484 HG23 THR 68 2HG2 THR 68 7.409 -0.537 -0.478 485 H THR 69 H THR 69 10.383 -0.045 0.667 486 HA THR 69 HA THR 69 9.398 1.587 2.872 487 HB THR 69 HB THR 69 11.868 1.054 2.812 488 HG1 THR 69 1HG THR 69 12.544 3.091 3.301 489 HG21 THR 69 3HG2 THR 69 13.331 2.247 1.239 490 HG22 THR 69 1HG2 THR 69 11.902 2.890 0.432 491 HG23 THR 69 2HG2 THR 69 12.237 1.155 0.385 492 H ALA 70 H ALA 70 8.370 3.519 2.499 493 HA ALA 70 HA ALA 70 8.018 4.257 -0.321 494 HB1 ALA 70 1HB ALA 70 5.668 4.622 0.120 495 HB2 ALA 70 2HB ALA 70 5.892 4.136 1.799 496 HB3 ALA 70 3HB ALA 70 6.116 2.959 0.505 497 H GLY 71 H GLY 71 8.662 6.251 -0.666 498 HA2 GLY 71 2HA GLY 71 9.024 8.524 -0.422 499 HA3 GLY 71 1HA GLY 71 7.670 8.503 0.696 500 H ARG 72 H ARG 72 10.802 6.965 0.822 501 HA ARG 72 HA ARG 72 11.363 8.478 3.287 502 HB2 ARG 72 2HB ARG 72 10.197 6.403 3.878 503 HB3 ARG 72 1HB ARG 72 11.426 5.473 3.048 504 HG2 ARG 72 2HG ARG 72 13.087 6.248 4.692 505 HG3 ARG 72 1HG ARG 72 11.809 7.146 5.523 506 HD2 ARG 72 2HD ARG 72 10.571 5.085 5.878 507 HD3 ARG 72 1HD ARG 72 11.827 4.179 5.041 508 HE ARG 72 HE ARG 72 12.450 5.693 7.466 509 HH11 ARG 72 1HH1 ARG 72 12.374 2.605 5.704 510 HH12 ARG 72 2HH1 ARG 72 13.048 1.725 6.985 511 HH21 ARG 72 1HH2 ARG 72 13.389 4.416 9.234 512 HH22 ARG 72 2HH2 ARG 72 13.609 2.742 8.995 513 H HIS 73 H HIS 73 12.553 6.544 0.630 514 HA HIS 73 HA HIS 73 15.251 7.574 1.165 515 HB2 HIS 73 2HB HIS 73 14.479 4.809 0.140 516 HB3 HIS 73 1HB HIS 73 16.115 5.436 0.129 517 HD1 HIS 73 1HD HIS 73 17.491 4.665 2.119 518 HD2 HIS 73 2HD HIS 73 13.412 4.654 2.885 519 HE1 HIS 73 1HE HIS 73 17.215 3.730 4.429 520 HA PRO 74 HA PRO 74 14.921 8.796 -3.160 521 HB2 PRO 74 2HB PRO 74 17.462 8.156 -4.060 522 HB3 PRO 74 1HB PRO 74 17.058 9.665 -3.236 523 HG2 PRO 74 2HG PRO 74 18.315 7.184 -2.156 524 HG3 PRO 74 1HG PRO 74 18.667 8.876 -1.769 525 HD2 PRO 74 2HD PRO 74 17.226 7.311 -0.123 526 HD3 PRO 74 1HD PRO 74 16.884 9.043 -0.304 527 H GLU 75 H GLU 75 16.115 5.703 -2.186 528 HA GLU 75 HA GLU 75 15.431 4.482 -4.741 529 HB2 GLU 75 2HB GLU 75 16.537 2.472 -3.839 530 HB3 GLU 75 1HB GLU 75 17.601 3.866 -3.862 531 HG2 GLU 75 2HG GLU 75 17.284 4.156 -1.469 532 HG3 GLU 75 1HG GLU 75 16.153 2.805 -1.445 533 H SER 76 H SER 76 13.343 5.446 -2.868 534 HA SER 76 HA SER 76 12.163 3.383 -1.419 535 HB2 SER 76 2HB SER 76 10.777 5.654 -2.867 536 HB3 SER 76 1HB SER 76 9.996 4.597 -1.691 537 HG SER 76 HG SER 76 11.837 6.630 -1.384 538 H ASP 77 H ASP 77 10.839 1.746 -1.828 539 HA ASP 77 HA ASP 77 11.040 0.392 -4.278 540 HB2 ASP 77 2HB ASP 77 9.126 -0.013 -1.973 541 HB3 ASP 77 1HB ASP 77 9.385 -1.177 -3.259 542 H ILE 78 H ILE 78 8.458 2.210 -2.787 543 HA ILE 78 HA ILE 78 7.216 2.429 -5.418 544 HB ILE 78 HB ILE 78 4.995 2.607 -4.346 545 HG12 ILE 78 2HG1 ILE 78 6.364 1.709 -1.799 546 HG13 ILE 78 1HG1 ILE 78 5.835 3.358 -2.119 547 HG21 ILE 78 1HG2 ILE 78 6.432 0.034 -3.706 548 HG22 ILE 78 2HG2 ILE 78 5.657 0.452 -5.234 549 HG23 ILE 78 3HG2 ILE 78 4.682 0.237 -3.780 550 HD11 ILE 78 3HD1 ILE 78 3.541 2.600 -2.262 551 HD12 ILE 78 1HD1 ILE 78 4.261 2.168 -0.712 552 HD13 ILE 78 2HD1 ILE 78 4.064 0.937 -1.962 553 H PHE 79 H PHE 79 6.041 4.399 -5.683 554 HA PHE 79 HA PHE 79 7.262 6.541 -4.148 555 HB2 PHE 79 2HB PHE 79 6.265 6.523 -6.999 556 HB3 PHE 79 1HB PHE 79 6.757 7.976 -6.141 557 HD1 PHE 79 2HD PHE 79 9.137 8.131 -5.301 558 HD2 PHE 79 1HD PHE 79 7.854 5.148 -8.043 559 HE1 PHE 79 2HE PHE 79 11.475 7.737 -5.961 560 HE2 PHE 79 1HE PHE 79 10.182 4.744 -8.707 561 HZ PHE 79 HZ PHE 79 11.999 6.044 -7.666 562 H LEU 80 H LEU 80 6.046 8.032 -3.279 563 HA LEU 80 HA LEU 80 3.179 7.557 -3.268 564 HB2 LEU 80 2HB LEU 80 4.955 8.739 -1.142 565 HB3 LEU 80 1HB LEU 80 3.202 8.726 -1.062 566 HG LEU 80 HG LEU 80 4.967 6.286 -1.125 567 HD11 LEU 80 1HD1 LEU 80 4.260 6.019 1.209 568 HD12 LEU 80 2HD1 LEU 80 3.410 7.563 1.117 569 HD13 LEU 80 3HD1 LEU 80 5.167 7.508 0.957 570 HD21 LEU 80 3HD2 LEU 80 2.811 5.825 -2.143 571 HD22 LEU 80 1HD2 LEU 80 1.983 6.565 -0.768 572 HD23 LEU 80 2HD2 LEU 80 2.896 5.075 -0.552 573 H ASP 81 H ASP 81 2.020 9.684 -2.623 574 HA ASP 81 HA ASP 81 2.531 11.420 -4.754 575 HB2 ASP 81 2HB ASP 81 0.268 11.167 -4.073 576 HB3 ASP 81 1HB ASP 81 0.648 11.642 -2.419 577 H ASP 82 H ASP 82 3.681 12.945 -4.860 578 HA ASP 82 HA ASP 82 5.615 13.581 -2.895 579 HB2 ASP 82 2HB ASP 82 5.102 14.836 -5.551 580 HB3 ASP 82 1HB ASP 82 6.387 15.375 -4.478 581 H VAL 83 H VAL 83 2.549 14.958 -3.364 582 HA VAL 83 HA VAL 83 3.370 17.481 -2.173 583 HB VAL 83 HB VAL 83 0.588 16.560 -2.980 584 HG11 VAL 83 1HG1 VAL 83 0.033 18.956 -2.969 585 HG12 VAL 83 2HG1 VAL 83 1.651 19.318 -2.375 586 HG13 VAL 83 3HG1 VAL 83 0.534 18.385 -1.378 587 HG21 VAL 83 3HG2 VAL 83 0.897 17.933 -5.006 588 HG22 VAL 83 1HG2 VAL 83 2.038 16.586 -4.925 589 HG23 VAL 83 2HG2 VAL 83 2.572 18.219 -4.529 590 H THR 84 H THR 84 1.982 14.456 -1.374 591 HA THR 84 HA THR 84 1.264 15.458 1.264 592 HB THR 84 HB THR 84 0.152 13.146 1.493 593 HG1 THR 84 1HG THR 84 0.406 13.331 -1.339 594 HG21 THR 84 3HG2 THR 84 -0.883 15.159 -0.512 595 HG22 THR 84 1HG2 THR 84 -1.102 15.243 1.236 596 HG23 THR 84 2HG2 THR 84 -1.861 13.946 0.312 597 H VAL 85 H VAL 85 3.854 14.035 -0.150 598 HA VAL 85 HA VAL 85 4.504 12.287 2.036 599 HB VAL 85 HB VAL 85 5.321 11.866 -0.357 600 HG11 VAL 85 1HG1 VAL 85 7.247 14.093 0.164 601 HG12 VAL 85 2HG1 VAL 85 5.917 14.109 -0.981 602 HG13 VAL 85 3HG1 VAL 85 7.272 12.990 -1.213 603 HG21 VAL 85 3HG2 VAL 85 6.361 10.662 1.464 604 HG22 VAL 85 1HG2 VAL 85 7.453 12.013 1.773 605 HG23 VAL 85 2HG2 VAL 85 7.581 11.106 0.272 606 H SER 86 H SER 86 5.356 12.914 3.892 607 HA SER 86 HA SER 86 6.421 15.642 4.058 608 HB2 SER 86 2HB SER 86 5.572 15.493 6.436 609 HB3 SER 86 1HB SER 86 4.331 15.475 5.182 610 HG SER 86 HG SER 86 5.357 13.341 6.700 611 H ARG 87 H ARG 87 8.245 13.706 3.354 612 HA ARG 87 HA ARG 87 10.332 12.915 3.838 613 HB2 ARG 87 2HB ARG 87 9.981 14.329 6.485 614 HB3 ARG 87 1HB ARG 87 11.472 13.592 5.938 615 HG2 ARG 87 2HG ARG 87 11.648 15.208 4.164 616 HG3 ARG 87 1HG ARG 87 10.072 15.886 4.605 617 HD2 ARG 87 2HD ARG 87 10.913 16.491 6.776 618 HD3 ARG 87 1HD ARG 87 12.480 15.782 6.403 619 HE ARG 87 HE ARG 87 12.524 17.471 4.550 620 HH11 ARG 87 1HH1 ARG 87 10.777 18.084 7.572 621 HH12 ARG 87 2HH1 ARG 87 11.032 19.758 7.547 622 HH21 ARG 87 1HH2 ARG 87 12.887 19.735 4.507 623 HH22 ARG 87 2HH2 ARG 87 12.268 20.751 5.727 624 H ARG 88 H ARG 88 10.247 10.759 3.951 625 HA ARG 88 HA ARG 88 10.184 8.648 4.790 626 HB2 ARG 88 2HB ARG 88 10.262 9.953 7.531 627 HB3 ARG 88 1HB ARG 88 10.675 8.282 7.154 628 HG2 ARG 88 2HG ARG 88 12.612 9.002 5.914 629 HG3 ARG 88 1HG ARG 88 12.148 10.687 6.108 630 HD2 ARG 88 2HD ARG 88 12.424 10.457 8.542 631 HD3 ARG 88 1HD ARG 88 12.934 8.783 8.303 632 HE ARG 88 HE ARG 88 14.452 10.538 6.738 633 HH11 ARG 88 1HH1 ARG 88 14.121 9.312 10.042 634 HH12 ARG 88 2HH1 ARG 88 15.706 9.709 10.513 635 HH21 ARG 88 1HH2 ARG 88 16.618 11.088 7.361 636 HH22 ARG 88 2HH2 ARG 88 17.188 10.750 8.926 637 H HIS 89 H HIS 89 8.076 8.544 3.896 638 HA HIS 89 HA HIS 89 6.008 9.278 5.725 639 HB2 HIS 89 2HB HIS 89 5.848 9.914 3.351 640 HB3 HIS 89 1HB HIS 89 5.644 8.216 2.926 641 HD2 HIS 89 2HD HIS 89 3.202 7.118 3.516 642 HE1 HIS 89 1HE HIS 89 1.460 10.671 4.961 643 HE2 HIS 89 2HE HIS 89 1.389 8.127 4.912 644 H ALA 90 H ALA 90 6.485 6.147 3.917 645 HA ALA 90 HA ALA 90 5.292 4.963 6.305 646 HB1 ALA 90 1HB ALA 90 3.439 5.408 4.794 647 HB2 ALA 90 2HB ALA 90 3.682 3.676 5.028 648 HB3 ALA 90 3HB ALA 90 4.222 4.449 3.539 649 H GLU 91 H GLU 91 5.508 2.767 6.552 650 HA GLU 91 HA GLU 91 7.500 1.413 4.874 651 HB2 GLU 91 2HB GLU 91 7.098 1.245 7.865 652 HB3 GLU 91 1HB GLU 91 8.144 0.189 6.936 653 HG2 GLU 91 2HG GLU 91 9.562 2.085 6.375 654 HG3 GLU 91 1HG GLU 91 8.483 3.160 7.271 655 H PHE 92 H PHE 92 6.646 -0.395 4.053 656 HA PHE 92 HA PHE 92 4.325 -1.568 5.424 657 HB2 PHE 92 2HB PHE 92 5.207 -1.977 2.534 658 HB3 PHE 92 1HB PHE 92 3.795 -2.682 3.286 659 HD1 PHE 92 1HD PHE 92 5.277 0.475 2.086 660 HD2 PHE 92 2HD PHE 92 1.781 -1.466 3.534 661 HE1 PHE 92 1HE PHE 92 3.928 2.420 1.424 662 HE2 PHE 92 2HE PHE 92 0.427 0.475 2.871 663 HZ PHE 92 HZ PHE 92 1.501 2.421 1.814 664 H ARG 93 H ARG 93 4.878 -3.238 6.639 665 HA ARG 93 HA ARG 93 7.373 -4.609 5.919 666 HB2 ARG 93 2HB ARG 93 6.205 -4.120 8.649 667 HB3 ARG 93 1HB ARG 93 7.641 -5.058 8.310 668 HG2 ARG 93 2HG ARG 93 8.766 -3.045 7.510 669 HG3 ARG 93 1HG ARG 93 7.304 -2.100 7.836 670 HD2 ARG 93 2HD ARG 93 7.421 -2.717 10.194 671 HD3 ARG 93 1HD ARG 93 8.865 -3.672 9.885 672 HE ARG 93 HE ARG 93 9.246 -0.985 9.061 673 HH11 ARG 93 1HH1 ARG 93 9.098 -2.990 11.995 674 HH12 ARG 93 2HH1 ARG 93 10.061 -1.950 12.921 675 HH21 ARG 93 1HH2 ARG 93 10.459 0.433 10.270 676 HH22 ARG 93 2HH2 ARG 93 10.907 0.127 11.891 677 H ILE 94 H ILE 94 7.370 -6.750 5.944 678 HA ILE 94 HA ILE 94 5.071 -7.998 7.157 679 HB ILE 94 HB ILE 94 5.429 -10.001 5.703 680 HG12 ILE 94 2HG1 ILE 94 6.773 -9.458 3.465 681 HG13 ILE 94 1HG1 ILE 94 7.661 -8.387 4.540 682 HG21 ILE 94 1HG2 ILE 94 4.935 -7.488 4.162 683 HG22 ILE 94 2HG2 ILE 94 3.755 -8.481 5.017 684 HG23 ILE 94 3HG2 ILE 94 4.570 -9.110 3.584 685 HD11 ILE 94 3HD1 ILE 94 8.218 -10.305 5.965 686 HD12 ILE 94 1HD1 ILE 94 8.791 -10.532 4.313 687 HD13 ILE 94 2HD1 ILE 94 7.339 -11.367 4.865 688 H ASN 95 H ASN 95 5.562 -8.953 9.018 689 HA ASN 95 HA ASN 95 8.413 -9.157 9.552 690 HB2 ASN 95 2HB ASN 95 7.044 -7.412 10.795 691 HB3 ASN 95 1HB ASN 95 6.137 -8.731 11.506 692 HD21 ASN 95 1HD2 ASN 95 7.717 -6.649 12.718 693 HD22 ASN 95 2HD2 ASN 95 8.907 -7.415 13.686 694 H GLU 96 H GLU 96 9.133 -10.961 10.527 695 HA GLU 96 HA GLU 96 7.955 -13.375 9.898 696 HB2 GLU 96 2HB GLU 96 9.623 -14.352 11.496 697 HB3 GLU 96 1HB GLU 96 10.305 -13.262 10.303 698 HG2 GLU 96 2HG GLU 96 10.306 -11.470 12.002 699 HG3 GLU 96 1HG GLU 96 9.727 -12.636 13.188 700 H GLY 97 H GLY 97 7.479 -11.352 12.659 701 HA2 GLY 97 2HA GLY 97 6.035 -13.260 14.198 702 HA3 GLY 97 1HA GLY 97 5.991 -11.510 14.422 703 H GLU 98 H GLU 98 4.884 -10.373 12.331 704 HA GLU 98 HA GLU 98 2.669 -11.701 11.218 705 HB2 GLU 98 2HB GLU 98 2.269 -9.619 13.390 706 HB3 GLU 98 1HB GLU 98 1.063 -9.986 12.179 707 HG2 GLU 98 2HG GLU 98 0.932 -12.290 13.027 708 HG3 GLU 98 1HG GLU 98 2.146 -11.901 14.239 709 H PHE 99 H PHE 99 1.471 -9.830 9.913 710 HA PHE 99 HA PHE 99 3.693 -8.265 8.877 711 HB2 PHE 99 2HB PHE 99 0.918 -8.501 7.684 712 HB3 PHE 99 1HB PHE 99 2.375 -7.943 6.881 713 HD1 PHE 99 1HD PHE 99 4.309 -10.072 7.647 714 HD2 PHE 99 2HD PHE 99 0.233 -10.337 6.454 715 HE1 PHE 99 1HE PHE 99 4.704 -12.348 6.819 716 HE2 PHE 99 2HE PHE 99 0.628 -12.618 5.626 717 HZ PHE 99 HZ PHE 99 2.860 -13.626 5.807 718 H GLU 100 H GLU 100 3.766 -6.019 8.909 719 HA GLU 100 HA GLU 100 1.566 -4.660 10.239 720 HB2 GLU 100 2HB GLU 100 4.423 -4.601 11.135 721 HB3 GLU 100 1HB GLU 100 3.302 -3.301 11.509 722 HG2 GLU 100 2HG GLU 100 1.847 -4.860 12.577 723 HG3 GLU 100 1HG GLU 100 2.967 -6.189 12.262 724 H VAL 101 H VAL 101 1.130 -2.745 9.627 725 HA VAL 101 HA VAL 101 2.875 -1.526 7.586 726 HB VAL 101 HB VAL 101 -0.105 -1.155 7.954 727 HG11 VAL 101 1HG1 VAL 101 1.744 -0.033 5.842 728 HG12 VAL 101 2HG1 VAL 101 0.967 0.882 7.132 729 HG13 VAL 101 3HG1 VAL 101 -0.011 0.151 5.858 730 HG21 VAL 101 3HG2 VAL 101 1.409 -2.576 5.764 731 HG22 VAL 101 1HG2 VAL 101 -0.330 -2.290 5.774 732 HG23 VAL 101 2HG2 VAL 101 0.398 -3.334 6.997 733 H VAL 102 H VAL 102 3.878 0.262 8.226 734 HA VAL 102 HA VAL 102 2.796 1.708 10.554 735 HB VAL 102 HB VAL 102 5.720 1.415 9.819 736 HG11 VAL 102 1HG1 VAL 102 6.154 2.320 12.047 737 HG12 VAL 102 2HG1 VAL 102 4.420 2.502 12.309 738 HG13 VAL 102 3HG1 VAL 102 5.222 3.438 11.050 739 HG21 VAL 102 3HG2 VAL 102 4.194 -0.062 11.972 740 HG22 VAL 102 1HG2 VAL 102 5.941 -0.111 11.741 741 HG23 VAL 102 2HG2 VAL 102 4.869 -0.770 10.504 742 H ASP 103 H ASP 103 2.087 3.763 9.890 743 HA ASP 103 HA ASP 103 3.565 4.985 7.717 744 HB2 ASP 103 2HB ASP 103 1.100 4.725 7.493 745 HB3 ASP 103 1HB ASP 103 0.901 5.682 8.960 746 H VAL 104 H VAL 104 5.135 6.190 8.489 747 HA VAL 104 HA VAL 104 4.856 7.325 11.150 748 HB VAL 104 HB VAL 104 7.307 7.880 11.023 749 HG11 VAL 104 1HG1 VAL 104 6.537 5.843 12.113 750 HG12 VAL 104 2HG1 VAL 104 8.079 5.573 11.301 751 HG13 VAL 104 3HG1 VAL 104 6.583 4.993 10.565 752 HG21 VAL 104 3HG2 VAL 104 8.670 6.814 9.289 753 HG22 VAL 104 1HG2 VAL 104 7.553 7.986 8.590 754 HG23 VAL 104 2HG2 VAL 104 7.205 6.261 8.475 755 H GLY 105 H GLY 105 4.393 8.210 8.019 756 HA2 GLY 105 2HA GLY 105 4.905 11.046 8.423 757 HA3 GLY 105 1HA GLY 105 4.330 10.273 6.944 758 H SER 106 H SER 106 3.008 9.490 9.985 759 HA SER 106 HA SER 106 0.366 9.980 9.230 760 HB2 SER 106 2HB SER 106 0.160 9.427 11.834 761 HB3 SER 106 1HB SER 106 0.502 8.193 10.617 762 HG SER 106 HG SER 106 2.385 7.952 11.335 763 H LEU 107 H LEU 107 2.449 12.227 9.829 764 HA LEU 107 HA LEU 107 1.177 14.072 11.570 765 HB2 LEU 107 2HB LEU 107 3.591 14.063 10.698 766 HB3 LEU 107 1HB LEU 107 2.968 14.604 9.165 767 HG LEU 107 HG LEU 107 2.760 16.212 11.729 768 HD11 LEU 107 1HD1 LEU 107 5.090 15.854 11.139 769 HD12 LEU 107 2HD1 LEU 107 4.629 17.526 10.824 770 HD13 LEU 107 3HD1 LEU 107 4.767 16.382 9.490 771 HD21 LEU 107 3HD2 LEU 107 2.446 17.030 8.834 772 HD22 LEU 107 1HD2 LEU 107 2.355 18.108 10.229 773 HD23 LEU 107 2HD2 LEU 107 1.128 16.857 9.992 774 H ASN 108 H ASN 108 0.767 12.936 8.337 775 HA ASN 108 HA ASN 108 -0.966 15.036 7.411 776 HB2 ASN 108 2HB ASN 108 -0.450 12.259 6.296 777 HB3 ASN 108 1HB ASN 108 -1.460 13.465 5.517 778 HD21 ASN 108 1HD2 ASN 108 1.777 12.432 6.195 779 HD22 ASN 108 2HD2 ASN 108 2.560 13.549 5.172 780 H GLY 109 H GLY 109 -1.387 12.738 9.704 781 HA2 GLY 109 2HA GLY 109 -3.276 12.061 10.823 782 HA3 GLY 109 1HA GLY 109 -4.246 12.929 9.632 783 H THR 110 H THR 110 -1.976 10.178 9.561 784 HA THR 110 HA THR 110 -3.402 9.000 7.443 785 HB THR 110 HB THR 110 -1.244 7.649 9.154 786 HG1 THR 110 1HG THR 110 0.148 8.547 7.588 787 HG21 THR 110 3HG2 THR 110 -2.244 7.296 6.314 788 HG22 THR 110 1HG2 THR 110 -2.560 6.201 7.654 789 HG23 THR 110 2HG2 THR 110 -0.910 6.411 7.060 790 H TYR 111 H TYR 111 -5.122 7.871 7.540 791 HA TYR 111 HA TYR 111 -5.842 6.550 10.053 792 HB2 TYR 111 2HB TYR 111 -7.557 6.936 7.574 793 HB3 TYR 111 1HB TYR 111 -8.096 6.411 9.161 794 HD1 TYR 111 2HD TYR 111 -7.441 8.214 11.091 795 HD2 TYR 111 1HD TYR 111 -8.074 9.109 6.986 796 HE1 TYR 111 2HE TYR 111 -7.926 10.560 11.677 797 HE2 TYR 111 1HE TYR 111 -8.566 11.455 7.580 798 HH TYR 111 HH TYR 111 -7.931 12.716 10.680 799 H VAL 112 H VAL 112 -5.795 4.353 10.091 800 HA VAL 112 HA VAL 112 -5.333 2.954 7.563 801 HB VAL 112 HB VAL 112 -4.124 2.192 10.248 802 HG11 VAL 112 1HG1 VAL 112 -2.734 0.673 8.906 803 HG12 VAL 112 2HG1 VAL 112 -3.618 1.170 7.463 804 HG13 VAL 112 3HG1 VAL 112 -4.456 0.329 8.761 805 HG21 VAL 112 3HG2 VAL 112 -1.944 2.932 9.387 806 HG22 VAL 112 1HG2 VAL 112 -3.078 4.278 9.504 807 HG23 VAL 112 2HG2 VAL 112 -2.728 3.553 7.935 808 H ASN 113 H ASN 113 -6.685 1.294 7.323 809 HA ASN 113 HA ASN 113 -8.583 0.050 7.573 810 HB2 ASN 113 2HB ASN 113 -7.076 -0.811 9.571 811 HB3 ASN 113 1HB ASN 113 -8.200 0.098 10.575 812 HD21 ASN 113 1HD2 ASN 113 -7.678 -2.637 8.684 813 HD22 ASN 113 2HD2 ASN 113 -9.168 -3.475 8.986 814 H ARG 114 H ARG 114 -8.556 2.922 7.690 815 HA ARG 114 HA ARG 114 -9.851 4.765 7.974 816 HB2 ARG 114 2HB ARG 114 -11.996 2.773 8.736 817 HB3 ARG 114 1HB ARG 114 -12.294 4.495 8.631 818 HG2 ARG 114 2HG ARG 114 -11.691 4.437 6.249 819 HG3 ARG 114 1HG ARG 114 -11.425 2.695 6.379 820 HD2 ARG 114 2HD ARG 114 -13.758 2.368 7.002 821 HD3 ARG 114 1HD ARG 114 -14.033 4.109 6.927 822 HE ARG 114 HE ARG 114 -13.015 3.308 4.465 823 HH11 ARG 114 1HH1 ARG 114 -15.889 2.500 6.348 824 HH12 ARG 114 2HH1 ARG 114 -16.915 2.401 4.993 825 HH21 ARG 114 1HH2 ARG 114 -14.422 3.178 2.634 826 HH22 ARG 114 2HH2 ARG 114 -16.072 2.758 2.836 827 H GLU 115 H GLU 115 -8.491 3.299 10.344 828 HA GLU 115 HA GLU 115 -9.716 4.846 12.518 829 HB2 GLU 115 2HB GLU 115 -9.667 2.395 12.800 830 HB3 GLU 115 1HB GLU 115 -7.943 2.383 12.495 831 HG2 GLU 115 2HG GLU 115 -8.304 2.113 14.831 832 HG3 GLU 115 1HG GLU 115 -7.627 3.716 14.561 833 HA PRO 116 HA PRO 116 -5.884 7.389 12.182 834 HB2 PRO 116 2HB PRO 116 -6.560 7.941 15.017 835 HB3 PRO 116 1HB PRO 116 -6.243 9.082 13.708 836 HG2 PRO 116 2HG PRO 116 -8.728 8.637 14.678 837 HG3 PRO 116 1HG PRO 116 -8.421 9.092 13.001 838 HD2 PRO 116 2HD PRO 116 -9.235 6.478 14.123 839 HD3 PRO 116 1HD PRO 116 -9.475 7.135 12.494 840 H ARG 117 H ARG 117 -4.066 6.174 12.306 841 HA ARG 117 HA ARG 117 -3.276 5.024 14.806 842 HB2 ARG 117 2HB ARG 117 -4.992 3.469 13.764 843 HB3 ARG 117 1HB ARG 117 -3.864 3.234 12.447 844 HG2 ARG 117 2HG ARG 117 -3.821 1.411 14.056 845 HG3 ARG 117 1HG ARG 117 -2.270 2.238 13.955 846 HD2 ARG 117 2HD ARG 117 -3.004 1.677 16.273 847 HD3 ARG 117 1HD ARG 117 -2.649 3.375 16.012 848 HE ARG 117 HE ARG 117 -4.940 3.861 16.084 849 HH11 ARG 117 1HH1 ARG 117 -4.351 0.420 16.834 850 HH12 ARG 117 2HH1 ARG 117 -5.761 0.252 17.745 851 HH21 ARG 117 1HH2 ARG 117 -6.859 3.595 17.370 852 HH22 ARG 117 2HH2 ARG 117 -7.262 2.079 18.016 853 H ASN 118 H ASN 118 -1.029 4.641 14.741 854 HA ASN 118 HA ASN 118 0.295 5.751 12.405 855 HB2 ASN 118 2HB ASN 118 1.574 4.788 14.991 856 HB3 ASN 118 1HB ASN 118 2.336 5.741 13.729 857 HD21 ASN 118 1HD2 ASN 118 1.794 7.970 13.541 858 HD22 ASN 118 2HD2 ASN 118 1.020 8.790 14.829 859 H ALA 119 H ALA 119 0.143 2.730 14.223 860 HA ALA 119 HA ALA 119 1.168 1.368 11.837 861 HB1 ALA 119 1HB ALA 119 2.980 1.445 13.502 862 HB2 ALA 119 2HB ALA 119 2.379 -0.202 13.292 863 HB3 ALA 119 3HB ALA 119 1.899 0.738 14.703 864 H GLN 120 H GLN 120 0.077 -0.488 11.380 865 HA GLN 120 HA GLN 120 -2.048 -1.303 13.244 866 HB2 GLN 120 2HB GLN 120 -2.578 0.352 11.169 867 HB3 GLN 120 1HB GLN 120 -2.639 -1.178 10.322 868 HG2 GLN 120 2HG GLN 120 -4.366 -0.405 12.681 869 HG3 GLN 120 1HG GLN 120 -4.856 -0.372 10.998 870 HE21 GLN 120 1HE2 GLN 120 -5.333 -2.355 9.935 871 HE22 GLN 120 2HE2 GLN 120 -5.482 -3.797 10.825 872 H VAL 121 H VAL 121 -2.611 -3.502 12.929 873 HA VAL 121 HA VAL 121 -0.486 -5.052 11.736 874 HB VAL 121 HB VAL 121 -1.233 -5.686 14.009 875 HG11 VAL 121 1HG1 VAL 121 -3.897 -6.318 12.759 876 HG12 VAL 121 2HG1 VAL 121 -3.555 -5.045 13.933 877 HG13 VAL 121 3HG1 VAL 121 -3.413 -6.738 14.402 878 HG21 VAL 121 3HG2 VAL 121 -0.283 -7.428 12.598 879 HG22 VAL 121 1HG2 VAL 121 -1.880 -7.800 11.952 880 HG23 VAL 121 2HG2 VAL 121 -1.522 -8.103 13.652 881 H MET 122 H MET 122 -0.696 -6.300 9.994 882 HA MET 122 HA MET 122 -2.321 -5.467 7.944 883 HB2 MET 122 2HB MET 122 -0.244 -6.681 7.620 884 HB3 MET 122 1HB MET 122 -0.972 -8.120 8.311 885 HG2 MET 122 2HG MET 122 -2.045 -6.851 5.819 886 HG3 MET 122 1HG MET 122 -0.697 -7.982 5.775 887 HE1 MET 122 3HE MET 122 -3.767 -9.993 4.332 888 HE2 MET 122 1HE MET 122 -2.142 -9.398 4.006 889 HE3 MET 122 2HE MET 122 -3.482 -8.263 4.151 890 H GLN 123 H GLN 123 -4.359 -5.682 7.495 891 HA GLN 123 HA GLN 123 -5.657 -8.187 8.146 892 HB2 GLN 123 2HB GLN 123 -6.876 -5.426 8.400 893 HB3 GLN 123 1HB GLN 123 -7.799 -6.918 8.431 894 HG2 GLN 123 2HG GLN 123 -6.412 -7.593 10.421 895 HG3 GLN 123 1HG GLN 123 -5.784 -5.948 10.438 896 HE21 GLN 123 1HE2 GLN 123 -8.546 -7.949 10.895 897 HE22 GLN 123 2HE2 GLN 123 -9.522 -6.825 11.735 898 H THR 124 H THR 124 -7.171 -8.826 6.659 899 HA THR 124 HA THR 124 -6.654 -8.033 3.983 900 HB THR 124 HB THR 124 -8.552 -9.757 3.631 901 HG1 THR 124 1HG THR 124 -9.513 -9.920 5.547 902 HG21 THR 124 3HG2 THR 124 -6.176 -10.287 3.335 903 HG22 THR 124 1HG2 THR 124 -7.021 -11.635 4.097 904 HG23 THR 124 2HG2 THR 124 -6.014 -10.562 5.068 905 H GLY 125 H GLY 125 -7.588 -6.258 3.134 906 HA2 GLY 125 2HA GLY 125 -9.484 -5.091 2.349 907 HA3 GLY 125 1HA GLY 125 -10.420 -5.779 3.676 908 H ASP 126 H ASP 126 -7.248 -4.373 4.000 909 HA ASP 126 HA ASP 126 -8.339 -2.480 5.930 910 HB2 ASP 126 2HB ASP 126 -6.241 -3.944 6.330 911 HB3 ASP 126 1HB ASP 126 -5.431 -2.870 5.197 912 H GLU 127 H GLU 127 -7.800 -0.228 5.674 913 HA GLU 127 HA GLU 127 -6.985 0.517 3.017 914 HB2 GLU 127 2HB GLU 127 -8.903 2.056 2.732 915 HB3 GLU 127 1HB GLU 127 -9.358 0.357 2.736 916 HG2 GLU 127 2HG GLU 127 -9.955 0.656 5.156 917 HG3 GLU 127 1HG GLU 127 -9.731 2.383 4.897 918 H ILE 128 H ILE 128 -5.703 2.036 3.016 919 HA ILE 128 HA ILE 128 -5.147 3.557 5.456 920 HB ILE 128 HB ILE 128 -3.437 3.122 2.989 921 HG12 ILE 128 2HG1 ILE 128 -3.213 1.759 5.672 922 HG13 ILE 128 1HG1 ILE 128 -3.947 1.011 4.257 923 HG21 ILE 128 1HG2 ILE 128 -2.860 5.139 4.238 924 HG22 ILE 128 2HG2 ILE 128 -1.594 3.922 4.411 925 HG23 ILE 128 3HG2 ILE 128 -2.735 4.203 5.727 926 HD11 ILE 128 3HD1 ILE 128 -1.081 1.875 4.568 927 HD12 ILE 128 1HD1 ILE 128 -1.790 1.183 3.103 928 HD13 ILE 128 2HD1 ILE 128 -1.704 0.220 4.575 929 H GLN 129 H GLN 129 -5.639 5.655 5.416 930 HA GLN 129 HA GLN 129 -5.899 6.929 2.802 931 HB2 GLN 129 2HB GLN 129 -8.116 6.678 3.865 932 HB3 GLN 129 1HB GLN 129 -7.539 7.575 5.261 933 HG2 GLN 129 2HG GLN 129 -7.298 9.575 3.976 934 HG3 GLN 129 1HG GLN 129 -7.622 8.712 2.475 935 HE21 GLN 129 1HE2 GLN 129 -9.000 10.097 5.319 936 HE22 GLN 129 2HE2 GLN 129 -10.644 9.960 4.820 937 H ILE 130 H ILE 130 -4.362 8.225 2.489 938 HA ILE 130 HA ILE 130 -3.098 9.551 4.767 939 HB ILE 130 HB ILE 130 -1.123 9.893 3.233 940 HG12 ILE 130 2HG1 ILE 130 -2.585 7.919 1.436 941 HG13 ILE 130 1HG1 ILE 130 -2.297 9.617 1.070 942 HG21 ILE 130 1HG2 ILE 130 -1.073 8.157 4.877 943 HG22 ILE 130 2HG2 ILE 130 -0.324 7.563 3.391 944 HG23 ILE 130 3HG2 ILE 130 -1.965 7.070 3.813 945 HD11 ILE 130 3HD1 ILE 130 -0.183 7.496 1.408 946 HD12 ILE 130 1HD1 ILE 130 0.109 9.194 1.023 947 HD13 ILE 130 2HD1 ILE 130 -0.748 8.162 -0.124 948 H GLY 131 H GLY 131 -4.269 11.343 5.010 949 HA2 GLY 131 2HA GLY 131 -4.786 13.546 4.698 950 HA3 GLY 131 1HA GLY 131 -3.755 13.526 3.280 951 H LYS 132 H LYS 132 -4.711 12.428 1.397 952 HA LYS 132 HA LYS 132 -7.594 13.019 1.094 953 HB2 LYS 132 2HB LYS 132 -6.155 14.900 0.305 954 HB3 LYS 132 1HB LYS 132 -5.381 13.807 -0.824 955 HG2 LYS 132 2HG LYS 132 -7.624 13.466 -1.888 956 HG3 LYS 132 1HG LYS 132 -8.242 14.737 -0.837 957 HD2 LYS 132 2HD LYS 132 -6.014 15.042 -2.867 958 HD3 LYS 132 1HD LYS 132 -7.670 15.596 -3.072 959 HE2 LYS 132 2HE LYS 132 -5.717 16.577 -0.985 960 HE3 LYS 132 1HE LYS 132 -6.155 17.425 -2.460 961 HZ1 LYS 132 3HZ LYS 132 -8.050 16.752 -0.275 962 HZ2 LYS 132 1HZ LYS 132 -8.410 17.633 -1.660 963 HZ3 LYS 132 2HZ LYS 132 -7.354 18.256 -0.516 964 H PHE 133 H PHE 133 -5.017 10.818 0.660 965 HA PHE 133 HA PHE 133 -6.288 9.646 -1.713 966 HB2 PHE 133 2HB PHE 133 -3.444 9.259 -0.790 967 HB3 PHE 133 1HB PHE 133 -4.146 8.749 -2.329 968 HD1 PHE 133 1HD PHE 133 -5.575 10.912 -3.385 969 HD2 PHE 133 2HD PHE 133 -2.003 11.019 -1.074 970 HE1 PHE 133 1HE PHE 133 -5.031 13.107 -4.331 971 HE2 PHE 133 2HE PHE 133 -1.455 13.209 -2.037 972 HZ PHE 133 HZ PHE 133 -2.978 14.256 -3.640 973 H ARG 134 H ARG 134 -6.201 7.284 -1.929 974 HA ARG 134 HA ARG 134 -6.435 5.960 0.671 975 HB2 ARG 134 2HB ARG 134 -8.530 5.869 -1.497 976 HB3 ARG 134 1HB ARG 134 -8.500 4.808 -0.100 977 HG2 ARG 134 2HG ARG 134 -8.743 6.761 1.370 978 HG3 ARG 134 1HG ARG 134 -8.800 7.804 -0.053 979 HD2 ARG 134 2HD ARG 134 -11.038 7.364 0.737 980 HD3 ARG 134 1HD ARG 134 -10.797 6.597 -0.829 981 HE ARG 134 HE ARG 134 -10.686 5.142 1.737 982 HH11 ARG 134 1HH1 ARG 134 -11.600 5.266 -1.701 983 HH12 ARG 134 2HH1 ARG 134 -12.457 3.815 -1.675 984 HH21 ARG 134 1HH2 ARG 134 -11.873 3.086 1.768 985 HH22 ARG 134 2HH2 ARG 134 -12.613 2.532 0.341 986 H LEU 135 H LEU 135 -5.505 4.141 0.755 987 HA LEU 135 HA LEU 135 -4.784 2.643 -1.676 988 HB2 LEU 135 2HB LEU 135 -2.903 3.794 -0.611 989 HB3 LEU 135 1HB LEU 135 -3.325 3.092 0.933 990 HG LEU 135 HG LEU 135 -2.754 0.849 -0.013 991 HD11 LEU 135 1HD1 LEU 135 -3.067 1.398 -2.380 992 HD12 LEU 135 2HD1 LEU 135 -1.451 0.770 -2.072 993 HD13 LEU 135 3HD1 LEU 135 -1.695 2.501 -2.292 994 HD21 LEU 135 3HD2 LEU 135 -0.372 1.189 0.154 995 HD22 LEU 135 1HD2 LEU 135 -1.211 2.162 1.355 996 HD23 LEU 135 2HD2 LEU 135 -0.572 2.922 -0.104 997 H VAL 136 H VAL 136 -5.361 0.433 -1.539 998 HA VAL 136 HA VAL 136 -6.521 -0.375 1.030 999 HB VAL 136 HB VAL 136 -8.228 -0.209 -0.784 1000 HG11 VAL 136 1HG1 VAL 136 -6.664 -2.376 -2.130 1001 HG12 VAL 136 2HG1 VAL 136 -6.922 -0.732 -2.723 1002 HG13 VAL 136 3HG1 VAL 136 -8.277 -1.858 -2.611 1003 HG21 VAL 136 3HG2 VAL 136 -9.278 -2.414 -0.477 1004 HG22 VAL 136 1HG2 VAL 136 -8.626 -1.775 1.033 1005 HG23 VAL 136 2HG2 VAL 136 -7.754 -3.036 0.162 1006 H PHE 137 H PHE 137 -5.920 -2.307 1.890 1007 HA PHE 137 HA PHE 137 -3.670 -3.603 0.528 1008 HB2 PHE 137 2HB PHE 137 -3.210 -2.231 2.624 1009 HB3 PHE 137 1HB PHE 137 -4.127 -3.446 3.506 1010 HD1 PHE 137 2HD PHE 137 -3.266 -5.728 3.691 1011 HD2 PHE 137 1HD PHE 137 -1.014 -2.629 1.862 1012 HE1 PHE 137 2HE PHE 137 -1.267 -7.081 3.898 1013 HE2 PHE 137 1HE PHE 137 1.032 -3.983 2.058 1014 HZ PHE 137 HZ PHE 137 0.915 -6.218 3.084 1015 H LEU 138 H LEU 138 -3.841 -5.750 0.203 1016 HA LEU 138 HA LEU 138 -5.984 -7.267 1.543 1017 HB2 LEU 138 2HB LEU 138 -5.398 -7.334 -1.422 1018 HB3 LEU 138 1HB LEU 138 -6.597 -8.288 -0.586 1019 HG LEU 138 HG LEU 138 -6.687 -5.292 -0.826 1020 HD11 LEU 138 1HD1 LEU 138 -8.433 -5.670 -2.504 1021 HD12 LEU 138 2HD1 LEU 138 -8.152 -7.406 -2.401 1022 HD13 LEU 138 3HD1 LEU 138 -6.885 -6.342 -3.016 1023 HD21 LEU 138 3HD2 LEU 138 -8.801 -7.275 -0.008 1024 HD22 LEU 138 1HD2 LEU 138 -9.008 -5.531 -0.133 1025 HD23 LEU 138 2HD2 LEU 138 -7.930 -6.202 1.091 1026 H ALA 139 H ALA 139 -5.650 -9.680 0.952 1027 HA ALA 139 HA ALA 139 -2.799 -10.269 1.173 1028 HB1 ALA 139 1HB ALA 139 -4.318 -11.418 2.757 1029 HB2 ALA 139 2HB ALA 139 -3.503 -12.566 1.697 1030 HB3 ALA 139 3HB ALA 139 -5.182 -12.137 1.397 1031 H GLY 140 H GLY 140 -1.768 -11.685 -0.353 1032 HA2 GLY 140 2HA GLY 140 -3.030 -11.405 -2.955 1033 HA3 GLY 140 1HA GLY 140 -1.313 -11.658 -2.632 1034 HA PRO 141 HA PRO 141 -2.562 -15.782 -3.850 1035 HB2 PRO 141 2HB PRO 141 0.252 -16.453 -3.771 1036 HB3 PRO 141 1HB PRO 141 -0.844 -16.386 -5.152 1037 HG2 PRO 141 2HG PRO 141 1.191 -14.601 -4.767 1038 HG3 PRO 141 1HG PRO 141 -0.295 -14.232 -5.659 1039 HD2 PRO 141 2HD PRO 141 0.471 -13.500 -2.869 1040 HD3 PRO 141 1HD PRO 141 -0.427 -12.578 -4.095 1041 H ALA 142 H ALA 142 -3.162 -17.262 -2.507 1042 HA ALA 142 HA ALA 142 -2.064 -17.478 0.133 1043 HB1 ALA 142 1HB ALA 142 -4.470 -17.756 -0.232 1044 HB2 ALA 142 2HB ALA 142 -3.767 -19.238 0.420 1045 HB3 ALA 142 3HB ALA 142 -4.160 -19.127 -1.296 1046 H GLU 143 H GLU 143 -0.272 -18.558 0.428 1047 HA GLU 143 HA GLU 143 0.333 -20.735 -1.431 1048 HB2 GLU 143 2HB GLU 143 1.760 -18.618 -1.548 1049 HB3 GLU 143 1HB GLU 143 2.392 -19.099 0.023 1050 HG2 GLU 143 2HG GLU 143 3.912 -19.839 -1.671 1051 HG3 GLU 143 1HG GLU 143 3.098 -21.254 -0.994 Start of MODEL 25 1 H1 MET 1 1HT MET 1 50.186 41.765 43.648 2 H2 MET 1 2HT MET 1 49.747 41.076 42.201 3 H3 MET 1 3HT MET 1 51.345 40.950 42.733 4 HA MET 1 HA MET 1 50.128 38.893 43.078 5 HB2 MET 1 2HB MET 1 51.892 39.578 44.704 6 HB3 MET 1 1HB MET 1 50.675 40.396 45.659 7 HG2 MET 1 2HG MET 1 49.584 38.244 46.090 8 HG3 MET 1 1HG MET 1 50.859 37.433 45.180 9 HE1 MET 1 2HE MET 1 51.478 35.867 47.242 10 HE2 MET 1 3HE MET 1 50.161 36.604 48.157 11 HE3 MET 1 1HE MET 1 51.768 36.464 48.874 12 H SER 2 H SER 2 48.003 38.680 42.559 13 HA SER 2 HA SER 2 45.991 40.263 43.857 14 HB2 SER 2 2HB SER 2 44.469 38.960 42.350 15 HB3 SER 2 1HB SER 2 45.740 39.855 41.514 16 HG SER 2 HG SER 2 45.541 37.057 41.978 17 H ASP 3 H ASP 3 47.157 36.976 43.949 18 HA ASP 3 HA ASP 3 45.083 36.299 45.926 19 HB2 ASP 3 2HB ASP 3 46.276 34.495 43.805 20 HB3 ASP 3 1HB ASP 3 45.152 33.983 45.056 21 H ASN 4 H ASN 4 45.811 34.186 47.104 22 HA ASN 4 HA ASN 4 48.665 34.413 47.763 23 HB2 ASN 4 2HB ASN 4 46.408 33.842 49.714 24 HB3 ASN 4 1HB ASN 4 48.114 33.893 50.105 25 HD21 ASN 4 1HD2 ASN 4 48.387 36.383 48.354 26 HD22 ASN 4 2HD2 ASN 4 47.719 37.622 49.357 27 H ASN 5 H ASN 5 49.326 32.348 48.930 28 HA ASN 5 HA ASN 5 47.893 30.080 47.765 29 HB2 ASN 5 2HB ASN 5 50.771 30.279 48.742 30 HB3 ASN 5 1HB ASN 5 49.994 28.755 48.347 31 HD21 ASN 5 1HD2 ASN 5 51.371 28.249 46.693 32 HD22 ASN 5 2HD2 ASN 5 51.412 29.101 45.192 33 H GLY 6 H GLY 6 48.003 28.094 49.288 34 HA2 GLY 6 2HA GLY 6 47.644 29.058 52.024 35 HA3 GLY 6 1HA GLY 6 46.397 28.100 51.234 36 H THR 7 H THR 7 46.795 26.735 53.094 37 HA THR 7 HA THR 7 49.198 25.139 52.817 38 HB THR 7 HB THR 7 48.739 26.085 55.082 39 HG1 THR 7 1HG THR 7 48.370 23.544 55.835 40 HG21 THR 7 3HG2 THR 7 46.886 25.187 56.445 41 HG22 THR 7 1HG2 THR 7 46.288 24.311 55.034 42 HG23 THR 7 2HG2 THR 7 46.287 26.079 55.047 43 HA PRO 8 HA PRO 8 46.868 21.889 50.862 44 HB2 PRO 8 2HB PRO 8 48.497 20.081 52.568 45 HB3 PRO 8 1HB PRO 8 48.263 20.044 50.814 46 HG2 PRO 8 2HG PRO 8 50.530 20.929 51.803 47 HG3 PRO 8 1HG PRO 8 49.760 21.797 50.462 48 HD2 PRO 8 2HD PRO 8 49.803 22.475 53.375 49 HD3 PRO 8 1HD PRO 8 50.002 23.526 51.952 50 H GLU 9 H GLU 9 44.946 21.156 51.406 51 HA GLU 9 HA GLU 9 44.177 21.163 54.171 52 HB2 GLU 9 2HB GLU 9 42.558 20.648 51.681 53 HB3 GLU 9 1HB GLU 9 41.903 20.846 53.302 54 HG2 GLU 9 2HG GLU 9 42.838 23.129 53.370 55 HG3 GLU 9 1HG GLU 9 43.410 22.910 51.721 56 HA PRO 10 HA PRO 10 44.701 16.749 54.489 57 HB2 PRO 10 2HB PRO 10 43.888 16.483 57.035 58 HB3 PRO 10 1HB PRO 10 45.453 17.209 56.642 59 HG2 PRO 10 2HG PRO 10 42.878 18.538 57.389 60 HG3 PRO 10 1HG PRO 10 44.525 18.932 57.899 61 HD2 PRO 10 2HD PRO 10 43.184 20.270 55.930 62 HD3 PRO 10 1HD PRO 10 44.952 20.141 55.998 63 H GLN 11 H GLN 11 43.344 14.953 54.511 64 HA GLN 11 HA GLN 11 40.498 15.562 54.634 65 HB2 GLN 11 2HB GLN 11 40.149 13.769 52.916 66 HB3 GLN 11 1HB GLN 11 40.990 15.193 52.332 67 HG2 GLN 11 2HG GLN 11 43.127 13.975 52.531 68 HG3 GLN 11 1HG GLN 11 42.234 12.546 53.053 69 HE21 GLN 11 1HE2 GLN 11 42.989 14.627 50.419 70 HE22 GLN 11 2HE2 GLN 11 42.355 13.617 49.164 71 H VAL 12 H VAL 12 39.663 14.760 56.364 72 HA VAL 12 HA VAL 12 40.703 12.295 57.499 73 HB VAL 12 HB VAL 12 40.113 14.376 58.885 74 HG11 VAL 12 1HG1 VAL 12 37.300 13.486 58.367 75 HG12 VAL 12 2HG1 VAL 12 38.037 15.020 57.897 76 HG13 VAL 12 3HG1 VAL 12 37.784 14.649 59.603 77 HG21 VAL 12 3HG2 VAL 12 40.522 12.261 59.964 78 HG22 VAL 12 1HG2 VAL 12 38.861 11.756 59.662 79 HG23 VAL 12 2HG2 VAL 12 39.192 13.085 60.775 80 H GLU 13 H GLU 13 39.102 10.510 58.002 81 HA GLU 13 HA GLU 13 37.311 10.325 55.751 82 HB2 GLU 13 2HB GLU 13 37.074 7.962 56.368 83 HB3 GLU 13 1HB GLU 13 38.731 8.408 56.010 84 HG2 GLU 13 2HG GLU 13 37.676 8.253 58.812 85 HG3 GLU 13 1HG GLU 13 38.291 6.834 57.983 86 H THR 14 H THR 14 35.209 10.392 55.881 87 HA THR 14 HA THR 14 33.983 10.317 58.521 88 HB THR 14 HB THR 14 32.648 11.143 55.919 89 HG1 THR 14 1HG THR 14 33.959 12.797 55.961 90 HG21 THR 14 3HG2 THR 14 31.171 12.403 57.456 91 HG22 THR 14 1HG2 THR 14 32.115 11.818 58.825 92 HG23 THR 14 2HG2 THR 14 31.187 10.681 57.849 93 H THR 15 H THR 15 33.818 8.111 58.815 94 HA THR 15 HA THR 15 33.447 6.459 56.531 95 HB THR 15 HB THR 15 35.217 5.956 58.167 96 HG1 THR 15 1HG THR 15 34.810 3.738 58.306 97 HG21 THR 15 3HG2 THR 15 34.147 6.697 60.224 98 HG22 THR 15 1HG2 THR 15 34.628 5.012 60.386 99 HG23 THR 15 2HG2 THR 15 32.937 5.425 60.089 100 H SER 16 H SER 16 32.234 4.381 57.510 101 HA SER 16 HA SER 16 29.438 5.119 57.127 102 HB2 SER 16 2HB SER 16 30.713 2.392 57.364 103 HB3 SER 16 1HB SER 16 29.116 2.758 56.709 104 HG SER 16 HG SER 16 31.005 4.245 55.505 105 H VAL 17 H VAL 17 30.405 5.879 59.655 106 HA VAL 17 HA VAL 17 29.661 3.923 61.631 107 HB VAL 17 HB VAL 17 31.520 5.546 61.988 108 HG11 VAL 17 1HG1 VAL 17 30.594 7.490 60.929 109 HG12 VAL 17 2HG1 VAL 17 31.079 7.855 62.581 110 HG13 VAL 17 3HG1 VAL 17 29.371 7.628 62.195 111 HG21 VAL 17 3HG2 VAL 17 30.542 4.498 63.961 112 HG22 VAL 17 1HG2 VAL 17 29.329 5.773 64.053 113 HG23 VAL 17 2HG2 VAL 17 31.028 6.154 64.329 114 H PHE 18 H PHE 18 27.984 5.583 59.726 115 HA PHE 18 HA PHE 18 25.802 6.311 61.558 116 HB2 PHE 18 2HB PHE 18 26.155 6.986 58.627 117 HB3 PHE 18 1HB PHE 18 24.768 7.454 59.603 118 HD1 PHE 18 1HD PHE 18 25.023 9.113 61.397 119 HD2 PHE 18 2HD PHE 18 28.238 8.136 58.793 120 HE1 PHE 18 1HE PHE 18 26.196 11.155 62.086 121 HE2 PHE 18 2HE PHE 18 29.421 10.183 59.478 122 HZ PHE 18 HZ PHE 18 28.399 11.697 61.127 123 H ARG 19 H ARG 19 23.684 5.573 61.115 124 HA ARG 19 HA ARG 19 23.672 2.855 60.084 125 HB2 ARG 19 2HB ARG 19 21.715 4.465 61.701 126 HB3 ARG 19 1HB ARG 19 21.340 2.874 61.067 127 HG2 ARG 19 2HG ARG 19 23.656 3.429 62.892 128 HG3 ARG 19 1HG ARG 19 22.060 2.946 63.463 129 HD2 ARG 19 2HD ARG 19 22.242 0.912 62.047 130 HD3 ARG 19 1HD ARG 19 23.894 1.381 61.648 131 HE ARG 19 HE ARG 19 24.269 1.304 64.124 132 HH11 ARG 19 1HH1 ARG 19 21.926 -0.847 62.513 133 HH12 ARG 19 2HH1 ARG 19 22.021 -2.035 63.733 134 HH21 ARG 19 1HH2 ARG 19 24.354 -0.401 65.767 135 HH22 ARG 19 2HH2 ARG 19 23.393 -1.785 65.565 136 H ALA 20 H ALA 20 22.400 2.194 58.421 137 HA ALA 20 HA ALA 20 21.172 4.279 56.812 138 HB1 ALA 20 1HB ALA 20 22.531 2.581 55.631 139 HB2 ALA 20 2HB ALA 20 20.838 2.473 55.150 140 HB3 ALA 20 3HB ALA 20 21.502 1.304 56.290 141 H ASP 21 H ASP 21 19.378 4.849 57.876 142 HA ASP 21 HA ASP 21 17.808 2.904 59.303 143 HB2 ASP 21 2HB ASP 21 18.173 5.290 60.076 144 HB3 ASP 21 1HB ASP 21 17.111 5.798 58.769 145 H LEU 22 H LEU 22 17.486 4.875 56.439 146 HA LEU 22 HA LEU 22 15.012 3.545 55.748 147 HB2 LEU 22 2HB LEU 22 15.397 6.038 55.390 148 HB3 LEU 22 1HB LEU 22 16.574 5.615 54.178 149 HG LEU 22 HG LEU 22 14.405 6.400 53.252 150 HD11 LEU 22 1HD1 LEU 22 15.751 5.011 51.826 151 HD12 LEU 22 2HD1 LEU 22 14.040 4.654 51.581 152 HD13 LEU 22 3HD1 LEU 22 15.044 3.556 52.526 153 HD21 LEU 22 3HD2 LEU 22 12.437 4.965 53.336 154 HD22 LEU 22 1HD2 LEU 22 12.910 5.526 54.939 155 HD23 LEU 22 2HD2 LEU 22 13.278 3.874 54.434 156 H LEU 23 H LEU 23 15.617 1.499 55.395 157 HA LEU 23 HA LEU 23 17.749 0.840 53.569 158 HB2 LEU 23 2HB LEU 23 15.643 -0.880 54.898 159 HB3 LEU 23 1HB LEU 23 16.934 -1.508 53.900 160 HG LEU 23 HG LEU 23 17.327 -0.052 56.523 161 HD11 LEU 23 1HD1 LEU 23 17.581 -2.979 55.846 162 HD12 LEU 23 2HD1 LEU 23 16.321 -2.251 56.843 163 HD13 LEU 23 3HD1 LEU 23 18.000 -2.230 57.384 164 HD21 LEU 23 3HD2 LEU 23 19.203 0.280 55.005 165 HD22 LEU 23 1HD2 LEU 23 19.294 -1.459 54.713 166 HD23 LEU 23 2HD2 LEU 23 19.650 -0.811 56.313 167 H LYS 24 H LYS 24 17.446 1.076 51.477 168 HA LYS 24 HA LYS 24 14.819 1.565 50.555 169 HB2 LYS 24 2HB LYS 24 15.889 1.902 48.273 170 HB3 LYS 24 1HB LYS 24 16.367 2.989 49.557 171 HG2 LYS 24 2HG LYS 24 18.355 2.533 48.459 172 HG3 LYS 24 1HG LYS 24 18.398 1.448 49.841 173 HD2 LYS 24 2HD LYS 24 17.659 -0.390 48.386 174 HD3 LYS 24 1HD LYS 24 17.655 0.714 47.008 175 HE2 LYS 24 2HE LYS 24 20.067 1.187 47.467 176 HE3 LYS 24 1HE LYS 24 20.026 -0.070 48.691 177 HZ1 LYS 24 3HZ LYS 24 19.656 -0.424 45.761 178 HZ2 LYS 24 1HZ LYS 24 19.409 -1.662 46.882 179 HZ3 LYS 24 2HZ LYS 24 20.906 -0.978 46.723 180 H GLU 25 H GLU 25 16.649 -1.243 50.709 181 HA GLU 25 HA GLU 25 16.486 -3.283 49.732 182 HB2 GLU 25 2HB GLU 25 14.348 -4.436 50.433 183 HB3 GLU 25 1HB GLU 25 15.213 -3.606 51.710 184 HG2 GLU 25 2HG GLU 25 13.625 -1.759 51.590 185 HG3 GLU 25 1HG GLU 25 12.781 -2.562 50.269 186 H MET 26 H MET 26 16.833 -2.630 47.621 187 HA MET 26 HA MET 26 14.401 -2.776 46.031 188 HB2 MET 26 2HB MET 26 15.389 -0.538 46.011 189 HB3 MET 26 1HB MET 26 16.879 -1.205 45.362 190 HG2 MET 26 2HG MET 26 15.756 -1.867 43.340 191 HG3 MET 26 1HG MET 26 14.206 -1.334 43.993 192 HE1 MET 26 3HE MET 26 15.125 1.440 45.471 193 HE2 MET 26 1HE MET 26 13.642 1.207 44.546 194 HE3 MET 26 2HE MET 26 14.710 2.553 44.171 195 H GLU 27 H GLU 27 14.446 -4.890 45.760 196 HA GLU 27 HA GLU 27 16.238 -5.740 43.649 197 HB2 GLU 27 2HB GLU 27 17.008 -6.777 45.796 198 HB3 GLU 27 1HB GLU 27 15.396 -7.451 46.007 199 HG2 GLU 27 2HG GLU 27 15.670 -8.719 43.922 200 HG3 GLU 27 1HG GLU 27 17.305 -8.086 43.771 201 H SER 28 H SER 28 14.933 -6.204 41.994 202 HA SER 28 HA SER 28 12.388 -7.473 42.551 203 HB2 SER 28 2HB SER 28 12.666 -4.951 40.884 204 HB3 SER 28 1HB SER 28 11.182 -5.887 41.106 205 HG SER 28 HG SER 28 12.179 -5.460 43.466 206 H SER 29 H SER 29 11.583 -8.665 40.795 207 HA SER 29 HA SER 29 13.664 -9.731 39.209 208 HB2 SER 29 2HB SER 29 10.704 -10.333 39.256 209 HB3 SER 29 1HB SER 29 11.946 -11.322 38.480 210 HG SER 29 HG SER 29 11.312 -11.993 40.627 211 H THR 30 H THR 30 14.116 -9.345 37.161 212 HA THR 30 HA THR 30 12.275 -7.823 35.502 213 HB THR 30 HB THR 30 13.941 -6.227 36.422 214 HG1 THR 30 1HG THR 30 15.113 -5.977 34.193 215 HG21 THR 30 3HG2 THR 30 16.337 -6.476 35.958 216 HG22 THR 30 1HG2 THR 30 16.029 -8.033 35.182 217 HG23 THR 30 2HG2 THR 30 15.732 -7.837 36.906 218 H GLY 31 H GLY 31 12.973 -8.078 33.156 219 HA2 GLY 31 2HA GLY 31 14.738 -10.241 32.574 220 HA3 GLY 31 1HA GLY 31 13.039 -10.651 32.366 221 H THR 32 H THR 32 15.356 -10.171 30.464 222 HA THR 32 HA THR 32 13.945 -8.225 28.792 223 HB THR 32 HB THR 32 16.745 -9.274 28.460 224 HG1 THR 32 1HG THR 32 16.558 -7.947 30.337 225 HG21 THR 32 3HG2 THR 32 15.729 -8.475 26.398 226 HG22 THR 32 1HG2 THR 32 17.001 -7.367 26.913 227 HG23 THR 32 2HG2 THR 32 15.306 -6.951 27.175 228 H ALA 33 H ALA 33 13.022 -8.985 27.037 229 HA ALA 33 HA ALA 33 13.122 -11.842 26.565 230 HB1 ALA 33 1HB ALA 33 11.291 -9.742 25.386 231 HB2 ALA 33 2HB ALA 33 10.919 -10.772 26.763 232 HB3 ALA 33 3HB ALA 33 11.141 -11.485 25.163 233 HA PRO 34 HA PRO 34 15.914 -11.172 23.111 234 HB2 PRO 34 2HB PRO 34 14.890 -13.812 22.257 235 HB3 PRO 34 1HB PRO 34 16.560 -13.309 22.549 236 HG2 PRO 34 2HG PRO 34 15.297 -14.931 24.243 237 HG3 PRO 34 1HG PRO 34 16.397 -13.675 24.837 238 HD2 PRO 34 2HD PRO 34 13.408 -13.703 24.786 239 HD3 PRO 34 1HD PRO 34 14.530 -13.109 26.034 240 H ALA 35 H ALA 35 15.297 -9.952 21.458 241 HA ALA 35 HA ALA 35 12.623 -10.173 20.351 242 HB1 ALA 35 1HB ALA 35 13.192 -8.071 19.216 243 HB2 ALA 35 2HB ALA 35 14.844 -8.201 19.820 244 HB3 ALA 35 3HB ALA 35 13.510 -7.982 20.947 245 H SER 36 H SER 36 12.138 -10.985 18.370 246 HA SER 36 HA SER 36 14.250 -11.350 16.433 247 HB2 SER 36 2HB SER 36 13.715 -13.753 16.128 248 HB3 SER 36 1HB SER 36 14.388 -13.416 17.721 249 HG SER 36 HG SER 36 11.685 -13.854 17.015 250 H THR 37 H THR 37 13.519 -11.290 14.359 251 HA THR 37 HA THR 37 11.042 -12.184 13.558 252 HB THR 37 HB THR 37 10.104 -10.115 14.443 253 HG1 THR 37 1HG THR 37 9.617 -11.000 12.239 254 HG21 THR 37 3HG2 THR 37 12.064 -8.648 12.661 255 HG22 THR 37 1HG2 THR 37 12.088 -8.685 14.422 256 HG23 THR 37 2HG2 THR 37 10.756 -7.895 13.575 257 H GLY 38 H GLY 38 11.424 -13.061 11.753 258 HA2 GLY 38 2HA GLY 38 13.315 -11.833 9.886 259 HA3 GLY 38 1HA GLY 38 13.434 -13.536 10.322 260 H ALA 39 H ALA 39 12.002 -11.293 8.346 261 HA ALA 39 HA ALA 39 9.582 -12.482 7.584 262 HB1 ALA 39 1HB ALA 39 9.735 -11.133 5.574 263 HB2 ALA 39 2HB ALA 39 11.439 -10.815 5.905 264 HB3 ALA 39 3HB ALA 39 10.197 -10.206 7.002 265 H GLU 40 H GLU 40 12.832 -13.294 6.727 266 HA GLU 40 HA GLU 40 12.329 -14.651 4.267 267 HB2 GLU 40 2HB GLU 40 14.626 -15.098 6.157 268 HB3 GLU 40 1HB GLU 40 14.588 -15.399 4.427 269 HG2 GLU 40 2HG GLU 40 14.284 -13.075 4.009 270 HG3 GLU 40 1HG GLU 40 14.303 -12.721 5.714 271 H ASN 41 H ASN 41 11.788 -15.396 7.410 272 HA ASN 41 HA ASN 41 11.974 -18.282 7.304 273 HB2 ASN 41 2HB ASN 41 12.040 -17.095 9.470 274 HB3 ASN 41 1HB ASN 41 10.395 -16.539 9.214 275 HD21 ASN 41 1HD2 ASN 41 8.670 -17.989 9.549 276 HD22 ASN 41 2HD2 ASN 41 8.891 -19.505 10.317 277 H LEU 42 H LEU 42 9.673 -15.935 6.387 278 HA LEU 42 HA LEU 42 7.505 -17.867 6.039 279 HB2 LEU 42 2HB LEU 42 7.020 -15.748 7.199 280 HB3 LEU 42 1HB LEU 42 7.609 -14.852 5.822 281 HG LEU 42 HG LEU 42 5.723 -15.740 4.477 282 HD11 LEU 42 1HD1 LEU 42 5.322 -17.801 5.706 283 HD12 LEU 42 2HD1 LEU 42 3.862 -16.816 5.616 284 HD13 LEU 42 3HD1 LEU 42 4.795 -16.866 7.109 285 HD21 LEU 42 3HD2 LEU 42 4.004 -14.370 5.522 286 HD22 LEU 42 1HD2 LEU 42 5.573 -13.569 5.569 287 HD23 LEU 42 2HD2 LEU 42 4.928 -14.335 7.022 288 HA PRO 43 HA PRO 43 9.049 -18.256 1.766 289 HB2 PRO 43 2HB PRO 43 6.302 -19.375 1.428 290 HB3 PRO 43 1HB PRO 43 7.856 -20.045 0.918 291 HG2 PRO 43 2HG PRO 43 6.628 -21.051 3.030 292 HG3 PRO 43 1HG PRO 43 8.382 -20.797 3.049 293 HD2 PRO 43 2HD PRO 43 6.226 -19.182 4.344 294 HD3 PRO 43 1HD PRO 43 7.838 -19.621 4.954 295 H ALA 44 H ALA 44 5.534 -17.614 1.935 296 HA ALA 44 HA ALA 44 5.924 -15.565 -0.078 297 HB1 ALA 44 1HB ALA 44 4.130 -17.221 -0.478 298 HB2 ALA 44 2HB ALA 44 3.509 -15.575 -0.367 299 HB3 ALA 44 3HB ALA 44 3.328 -16.678 0.994 300 H GLY 45 H GLY 45 6.976 -14.161 1.329 301 HA2 GLY 45 2HA GLY 45 5.323 -12.931 3.410 302 HA3 GLY 45 1HA GLY 45 7.054 -12.664 3.172 303 H SER 46 H SER 46 4.511 -12.646 0.819 304 HA SER 46 HA SER 46 5.313 -9.994 -0.060 305 HB2 SER 46 2HB SER 46 3.459 -11.938 -1.413 306 HB3 SER 46 1HB SER 46 4.345 -10.601 -2.134 307 HG SER 46 HG SER 46 6.301 -11.863 -1.368 308 H ALA 47 H ALA 47 3.635 -8.507 -0.525 309 HA ALA 47 HA ALA 47 0.957 -9.024 0.511 310 HB1 ALA 47 1HB ALA 47 0.939 -6.901 1.634 311 HB2 ALA 47 2HB ALA 47 2.616 -6.583 1.170 312 HB3 ALA 47 3HB ALA 47 2.239 -7.877 2.312 313 H LEU 48 H LEU 48 -0.552 -7.254 -0.487 314 HA LEU 48 HA LEU 48 0.836 -6.072 -2.716 315 HB2 LEU 48 2HB LEU 48 -0.802 -6.764 -4.368 316 HB3 LEU 48 1HB LEU 48 -0.035 -8.142 -3.622 317 HG LEU 48 HG LEU 48 -2.231 -8.130 -2.145 318 HD11 LEU 48 1HD1 LEU 48 -4.193 -7.499 -3.505 319 HD12 LEU 48 2HD1 LEU 48 -3.107 -6.746 -4.672 320 HD13 LEU 48 3HD1 LEU 48 -3.200 -6.120 -3.029 321 HD21 LEU 48 3HD2 LEU 48 -1.498 -9.974 -3.528 322 HD22 LEU 48 1HD2 LEU 48 -2.081 -9.150 -4.975 323 HD23 LEU 48 2HD2 LEU 48 -3.223 -9.695 -3.746 324 H LEU 49 H LEU 49 0.070 -4.224 -3.532 325 HA LEU 49 HA LEU 49 -1.962 -3.016 -1.843 326 HB2 LEU 49 2HB LEU 49 -0.936 -0.804 -2.400 327 HB3 LEU 49 1HB LEU 49 0.057 -1.840 -1.417 328 HG LEU 49 HG LEU 49 1.441 -2.335 -3.465 329 HD11 LEU 49 1HD1 LEU 49 1.314 -0.830 -5.384 330 HD12 LEU 49 2HD1 LEU 49 -0.132 -0.078 -4.704 331 HD13 LEU 49 3HD1 LEU 49 -0.172 -1.766 -5.218 332 HD21 LEU 49 3HD2 LEU 49 1.233 0.568 -2.732 333 HD22 LEU 49 1HD2 LEU 49 2.637 -0.229 -3.421 334 HD23 LEU 49 2HD2 LEU 49 2.089 -0.643 -1.790 335 H VAL 50 H VAL 50 -3.604 -2.010 -2.697 336 HA VAL 50 HA VAL 50 -3.763 -1.857 -5.638 337 HB VAL 50 HB VAL 50 -6.091 -2.203 -3.718 338 HG11 VAL 50 1HG1 VAL 50 -6.004 -2.347 -6.728 339 HG12 VAL 50 2HG1 VAL 50 -6.698 -1.054 -5.754 340 HG13 VAL 50 3HG1 VAL 50 -7.416 -2.663 -5.723 341 HG21 VAL 50 3HG2 VAL 50 -6.322 -4.500 -4.502 342 HG22 VAL 50 1HG2 VAL 50 -4.757 -4.254 -3.730 343 HG23 VAL 50 2HG2 VAL 50 -4.875 -4.326 -5.492 344 H VAL 51 H VAL 51 -3.616 0.293 -6.096 345 HA VAL 51 HA VAL 51 -4.657 2.133 -4.054 346 HB VAL 51 HB VAL 51 -2.943 2.841 -6.475 347 HG11 VAL 51 1HG1 VAL 51 -3.715 4.436 -4.020 348 HG12 VAL 51 2HG1 VAL 51 -4.371 4.672 -5.639 349 HG13 VAL 51 3HG1 VAL 51 -2.663 4.988 -5.325 350 HG21 VAL 51 3HG2 VAL 51 -2.210 2.421 -3.581 351 HG22 VAL 51 1HG2 VAL 51 -1.145 3.147 -4.786 352 HG23 VAL 51 2HG2 VAL 51 -1.666 1.471 -4.963 353 H LYS 52 H LYS 52 -6.508 2.778 -4.171 354 HA LYS 52 HA LYS 52 -8.168 2.226 -6.386 355 HB2 LYS 52 2HB LYS 52 -8.937 2.267 -4.003 356 HB3 LYS 52 1HB LYS 52 -8.730 4.009 -4.006 357 HG2 LYS 52 2HG LYS 52 -11.069 3.442 -4.284 358 HG3 LYS 52 1HG LYS 52 -10.458 4.191 -5.759 359 HD2 LYS 52 2HD LYS 52 -10.190 1.969 -6.775 360 HD3 LYS 52 1HD LYS 52 -10.800 1.225 -5.297 361 HE2 LYS 52 2HE LYS 52 -12.944 2.320 -5.612 362 HE3 LYS 52 1HE LYS 52 -12.332 3.147 -7.049 363 HZ1 LYS 52 3HZ LYS 52 -12.040 0.971 -8.095 364 HZ2 LYS 52 1HZ LYS 52 -13.635 1.246 -7.657 365 HZ3 LYS 52 2HZ LYS 52 -12.693 0.206 -6.736 366 H ARG 53 H ARG 53 -6.560 5.082 -5.134 367 HA ARG 53 HA ARG 53 -6.399 6.366 -7.595 368 HB2 ARG 53 2HB ARG 53 -8.877 6.607 -7.256 369 HB3 ARG 53 1HB ARG 53 -8.545 7.551 -5.817 370 HG2 ARG 53 2HG ARG 53 -7.585 9.309 -7.094 371 HG3 ARG 53 1HG ARG 53 -7.584 8.317 -8.554 372 HD2 ARG 53 2HD ARG 53 -10.044 9.196 -7.060 373 HD3 ARG 53 1HD ARG 53 -9.438 9.951 -8.532 374 HE ARG 53 HE ARG 53 -9.877 7.125 -8.791 375 HH11 ARG 53 1HH1 ARG 53 -11.490 10.268 -8.998 376 HH12 ARG 53 2HH1 ARG 53 -12.712 9.721 -10.049 377 HH21 ARG 53 1HH2 ARG 53 -11.536 6.372 -10.190 378 HH22 ARG 53 2HH2 ARG 53 -12.740 7.454 -10.755 379 H GLY 54 H GLY 54 -4.996 8.066 -7.467 380 HA2 GLY 54 2HA GLY 54 -4.499 10.008 -5.809 381 HA3 GLY 54 1HA GLY 54 -3.916 8.667 -4.833 382 HA PRO 55 HA PRO 55 -0.581 10.237 -7.905 383 HB2 PRO 55 2HB PRO 55 1.019 11.502 -6.084 384 HB3 PRO 55 1HB PRO 55 -0.233 12.330 -7.012 385 HG2 PRO 55 2HG PRO 55 -0.347 11.278 -4.210 386 HG3 PRO 55 1HG PRO 55 -0.920 12.828 -4.843 387 HD2 PRO 55 2HD PRO 55 -2.601 10.795 -4.382 388 HD3 PRO 55 1HD PRO 55 -2.837 11.887 -5.762 389 H ASN 56 H ASN 56 -0.899 8.423 -5.115 390 HA ASN 56 HA ASN 56 1.743 7.504 -4.693 391 HB2 ASN 56 2HB ASN 56 0.003 7.161 -2.987 392 HB3 ASN 56 1HB ASN 56 -0.896 6.120 -4.079 393 HD21 ASN 56 1HD2 ASN 56 1.798 6.325 -1.886 394 HD22 ASN 56 2HD2 ASN 56 2.173 4.637 -1.927 395 H ALA 57 H ALA 57 -1.030 6.019 -6.460 396 HA ALA 57 HA ALA 57 0.474 5.077 -8.592 397 HB1 ALA 57 1HB ALA 57 -0.342 2.927 -6.600 398 HB2 ALA 57 2HB ALA 57 1.314 3.426 -6.926 399 HB3 ALA 57 3HB ALA 57 0.365 2.655 -8.192 400 H GLY 58 H GLY 58 -1.051 3.188 -9.615 401 HA2 GLY 58 2HA GLY 58 -3.856 3.634 -9.093 402 HA3 GLY 58 1HA GLY 58 -3.285 4.302 -10.622 403 H ALA 59 H ALA 59 -2.449 1.391 -8.856 404 HA ALA 59 HA ALA 59 -3.637 -0.406 -10.710 405 HB1 ALA 59 1HB ALA 59 -1.669 0.231 -12.041 406 HB2 ALA 59 2HB ALA 59 -1.470 -1.416 -11.437 407 HB3 ALA 59 3HB ALA 59 -0.619 -0.085 -10.660 408 H ARG 60 H ARG 60 -2.327 -2.687 -10.047 409 HA ARG 60 HA ARG 60 -1.809 -2.545 -7.211 410 HB2 ARG 60 2HB ARG 60 -3.147 -4.510 -6.668 411 HB3 ARG 60 1HB ARG 60 -4.151 -3.212 -7.271 412 HG2 ARG 60 2HG ARG 60 -3.305 -5.598 -8.903 413 HG3 ARG 60 1HG ARG 60 -4.810 -5.503 -7.994 414 HD2 ARG 60 2HD ARG 60 -5.395 -3.493 -9.307 415 HD3 ARG 60 1HD ARG 60 -3.947 -3.731 -10.268 416 HE ARG 60 HE ARG 60 -5.747 -5.974 -10.093 417 HH11 ARG 60 1HH1 ARG 60 -4.554 -3.293 -12.052 418 HH12 ARG 60 2HH1 ARG 60 -5.486 -3.703 -13.415 419 HH21 ARG 60 1HH2 ARG 60 -6.982 -6.564 -11.991 420 HH22 ARG 60 2HH2 ARG 60 -6.863 -5.617 -13.394 421 H PHE 61 H PHE 61 -0.241 -3.775 -6.520 422 HA PHE 61 HA PHE 61 0.679 -6.000 -7.989 423 HB2 PHE 61 2HB PHE 61 3.016 -5.084 -8.371 424 HB3 PHE 61 1HB PHE 61 1.770 -4.448 -9.430 425 HD1 PHE 61 2HD PHE 61 4.087 -3.702 -6.715 426 HD2 PHE 61 1HD PHE 61 1.082 -2.133 -9.284 427 HE1 PHE 61 2HE PHE 61 4.764 -1.428 -6.118 428 HE2 PHE 61 1HE PHE 61 1.757 0.155 -8.695 429 HZ PHE 61 HZ PHE 61 3.600 0.510 -7.106 430 H LEU 62 H LEU 62 2.395 -7.104 -6.942 431 HA LEU 62 HA LEU 62 2.045 -6.931 -4.124 432 HB2 LEU 62 2HB LEU 62 3.174 -8.984 -3.912 433 HB3 LEU 62 1HB LEU 62 2.121 -9.107 -5.298 434 HG LEU 62 HG LEU 62 5.101 -8.623 -5.516 435 HD11 LEU 62 1HD1 LEU 62 3.589 -11.218 -5.673 436 HD12 LEU 62 2HD1 LEU 62 4.693 -10.732 -4.389 437 HD13 LEU 62 3HD1 LEU 62 5.302 -11.000 -6.019 438 HD21 LEU 62 3HD2 LEU 62 3.042 -9.549 -7.534 439 HD22 LEU 62 1HD2 LEU 62 4.781 -9.472 -7.815 440 HD23 LEU 62 2HD2 LEU 62 3.884 -7.993 -7.526 441 H LEU 63 H LEU 63 3.382 -6.413 -2.625 442 HA LEU 63 HA LEU 63 5.979 -5.210 -3.222 443 HB2 LEU 63 2HB LEU 63 4.387 -5.362 -0.659 444 HB3 LEU 63 1HB LEU 63 5.828 -4.413 -0.929 445 HG LEU 63 HG LEU 63 3.149 -3.927 -2.229 446 HD11 LEU 63 1HD1 LEU 63 3.041 -1.976 -0.750 447 HD12 LEU 63 2HD1 LEU 63 4.544 -2.477 0.017 448 HD13 LEU 63 3HD1 LEU 63 3.106 -3.483 0.156 449 HD21 LEU 63 3HD2 LEU 63 4.995 -3.188 -3.638 450 HD22 LEU 63 1HD2 LEU 63 5.709 -2.318 -2.281 451 HD23 LEU 63 2HD2 LEU 63 4.158 -1.801 -2.945 452 H ASP 64 H ASP 64 7.780 -6.411 -2.551 453 HA ASP 64 HA ASP 64 7.344 -8.530 -0.661 454 HB2 ASP 64 2HB ASP 64 6.833 -9.640 -2.780 455 HB3 ASP 64 1HB ASP 64 8.392 -9.142 -3.428 456 H GLN 65 H GLN 65 8.575 -7.057 0.502 457 HA GLN 65 HA GLN 65 11.354 -7.788 0.458 458 HB2 GLN 65 2HB GLN 65 10.402 -4.896 0.428 459 HB3 GLN 65 1HB GLN 65 11.953 -5.352 1.102 460 HG2 GLN 65 2HG GLN 65 12.534 -6.303 -1.151 461 HG3 GLN 65 1HG GLN 65 11.054 -5.571 -1.761 462 HE21 GLN 65 1HE2 GLN 65 10.979 -3.308 -2.075 463 HE22 GLN 65 2HE2 GLN 65 12.383 -2.347 -1.915 464 HA PRO 66 HA PRO 66 10.469 -8.344 4.783 465 HB2 PRO 66 2HB PRO 66 13.082 -7.009 5.326 466 HB3 PRO 66 1HB PRO 66 12.503 -8.589 5.873 467 HG2 PRO 66 2HG PRO 66 14.305 -8.514 3.957 468 HG3 PRO 66 1HG PRO 66 12.892 -9.584 3.826 469 HD2 PRO 66 2HD PRO 66 13.342 -6.937 2.507 470 HD3 PRO 66 1HD PRO 66 12.755 -8.459 1.803 471 H THR 67 H THR 67 12.039 -5.391 3.927 472 HA THR 67 HA THR 67 10.045 -3.931 5.479 473 HB THR 67 HB THR 67 12.960 -3.123 5.196 474 HG1 THR 67 1HG THR 67 11.700 -4.834 6.865 475 HG21 THR 67 3HG2 THR 67 11.382 -1.232 5.454 476 HG22 THR 67 1HG2 THR 67 12.383 -1.435 6.894 477 HG23 THR 67 2HG2 THR 67 10.711 -1.997 6.896 478 H THR 68 H THR 68 8.775 -3.296 3.873 479 HA THR 68 HA THR 68 9.927 -2.275 1.408 480 HB THR 68 HB THR 68 7.044 -2.834 2.195 481 HG1 THR 68 1HG THR 68 8.198 -4.791 2.081 482 HG21 THR 68 3HG2 THR 68 8.298 -2.337 -0.512 483 HG22 THR 68 1HG2 THR 68 7.294 -1.191 0.374 484 HG23 THR 68 2HG2 THR 68 6.601 -2.700 -0.212 485 H THR 69 H THR 69 10.268 -0.097 1.433 486 HA THR 69 HA THR 69 8.675 1.394 3.334 487 HB THR 69 HB THR 69 10.954 1.384 4.035 488 HG1 THR 69 1HG THR 69 10.878 3.344 4.525 489 HG21 THR 69 3HG2 THR 69 12.817 2.202 2.655 490 HG22 THR 69 1HG2 THR 69 11.714 2.384 1.292 491 HG23 THR 69 2HG2 THR 69 12.049 0.782 1.947 492 H ALA 70 H ALA 70 7.584 3.151 2.725 493 HA ALA 70 HA ALA 70 7.731 3.885 -0.106 494 HB1 ALA 70 1HB ALA 70 5.656 2.697 0.417 495 HB2 ALA 70 2HB ALA 70 5.341 4.385 0.014 496 HB3 ALA 70 3HB ALA 70 5.307 3.859 1.697 497 H GLY 71 H GLY 71 8.089 5.963 -0.473 498 HA2 GLY 71 2HA GLY 71 7.168 8.049 1.094 499 HA3 GLY 71 1HA GLY 71 8.821 7.681 1.579 500 H ARG 72 H ARG 72 10.210 8.879 0.654 501 HA ARG 72 HA ARG 72 9.968 9.502 -2.185 502 HB2 ARG 72 2HB ARG 72 8.810 11.231 -0.653 503 HB3 ARG 72 1HB ARG 72 10.422 11.689 -0.160 504 HG2 ARG 72 2HG ARG 72 9.582 13.189 -1.848 505 HG3 ARG 72 1HG ARG 72 10.953 12.268 -2.478 506 HD2 ARG 72 2HD ARG 72 9.553 10.867 -3.756 507 HD3 ARG 72 1HD ARG 72 8.107 11.394 -2.900 508 HE ARG 72 HE ARG 72 9.162 13.626 -4.028 509 HH11 ARG 72 1HH1 ARG 72 8.085 10.516 -5.284 510 HH12 ARG 72 2HH1 ARG 72 7.440 11.154 -6.726 511 HH21 ARG 72 1HH2 ARG 72 8.191 14.517 -5.964 512 HH22 ARG 72 2HH2 ARG 72 7.453 13.459 -7.094 513 H HIS 73 H HIS 73 11.783 8.086 -0.050 514 HA HIS 73 HA HIS 73 14.248 9.550 -0.656 515 HB2 HIS 73 2HB HIS 73 15.314 8.447 1.223 516 HB3 HIS 73 1HB HIS 73 13.723 8.904 1.768 517 HD1 HIS 73 1HD HIS 73 12.016 6.917 2.222 518 HD2 HIS 73 2HD HIS 73 15.888 5.790 1.245 519 HE1 HIS 73 1HE HIS 73 12.224 4.502 2.870 520 HA PRO 74 HA PRO 74 15.698 6.997 -3.865 521 HB2 PRO 74 2HB PRO 74 18.096 5.941 -2.834 522 HB3 PRO 74 1HB PRO 74 17.903 7.442 -3.742 523 HG2 PRO 74 2HG PRO 74 18.026 7.016 -0.790 524 HG3 PRO 74 1HG PRO 74 18.695 8.341 -1.761 525 HD2 PRO 74 2HD PRO 74 16.501 8.727 -0.330 526 HD3 PRO 74 1HD PRO 74 16.616 9.385 -1.969 527 H GLU 75 H GLU 75 15.698 5.311 -0.757 528 HA GLU 75 HA GLU 75 15.740 2.756 -2.158 529 HB2 GLU 75 2HB GLU 75 15.845 3.363 0.778 530 HB3 GLU 75 1HB GLU 75 15.842 1.740 0.101 531 HG2 GLU 75 2HG GLU 75 17.908 2.254 -1.094 532 HG3 GLU 75 1HG GLU 75 17.920 3.857 -0.360 533 H SER 76 H SER 76 13.330 4.744 -1.812 534 HA SER 76 HA SER 76 11.327 3.209 -0.492 535 HB2 SER 76 2HB SER 76 10.974 5.188 -2.769 536 HB3 SER 76 1HB SER 76 9.720 4.653 -1.649 537 HG SER 76 HG SER 76 11.996 6.213 -1.169 538 H ASP 77 H ASP 77 10.098 1.545 -1.233 539 HA ASP 77 HA ASP 77 10.964 0.072 -3.547 540 HB2 ASP 77 2HB ASP 77 9.901 -1.031 -1.565 541 HB3 ASP 77 1HB ASP 77 8.385 -0.233 -1.971 542 H ILE 78 H ILE 78 8.214 1.963 -2.688 543 HA ILE 78 HA ILE 78 7.748 2.498 -5.497 544 HB ILE 78 HB ILE 78 5.334 2.725 -5.153 545 HG12 ILE 78 2HG1 ILE 78 5.294 3.186 -2.680 546 HG13 ILE 78 1HG1 ILE 78 4.128 1.977 -3.183 547 HG21 ILE 78 1HG2 ILE 78 6.097 0.684 -6.045 548 HG22 ILE 78 2HG2 ILE 78 4.736 0.369 -4.967 549 HG23 ILE 78 3HG2 ILE 78 6.382 0.026 -4.434 550 HD11 ILE 78 3HD1 ILE 78 5.108 1.333 -1.098 551 HD12 ILE 78 1HD1 ILE 78 6.739 1.497 -1.760 552 HD13 ILE 78 2HD1 ILE 78 5.670 0.224 -2.351 553 H PHE 79 H PHE 79 7.482 4.543 -6.024 554 HA PHE 79 HA PHE 79 7.765 6.491 -3.868 555 HB2 PHE 79 2HB PHE 79 8.380 6.680 -6.815 556 HB3 PHE 79 1HB PHE 79 8.449 8.044 -5.718 557 HD1 PHE 79 2HD PHE 79 9.962 4.752 -6.505 558 HD2 PHE 79 1HD PHE 79 10.359 8.441 -4.417 559 HE1 PHE 79 2HE PHE 79 12.319 4.230 -6.039 560 HE2 PHE 79 1HE PHE 79 12.716 7.926 -3.955 561 HZ PHE 79 HZ PHE 79 13.699 5.821 -4.765 562 H LEU 80 H LEU 80 5.984 7.420 -3.342 563 HA LEU 80 HA LEU 80 3.843 7.668 -5.248 564 HB2 LEU 80 2HB LEU 80 2.575 8.750 -3.368 565 HB3 LEU 80 1HB LEU 80 3.032 7.088 -3.076 566 HG LEU 80 HG LEU 80 4.611 9.371 -1.901 567 HD11 LEU 80 1HD1 LEU 80 2.124 8.059 -0.782 568 HD12 LEU 80 2HD1 LEU 80 2.248 9.731 -1.337 569 HD13 LEU 80 3HD1 LEU 80 3.153 9.203 0.079 570 HD21 LEU 80 3HD2 LEU 80 4.970 7.696 -0.095 571 HD22 LEU 80 1HD2 LEU 80 5.610 7.114 -1.629 572 HD23 LEU 80 2HD2 LEU 80 4.071 6.520 -1.036 573 H ASP 81 H ASP 81 3.648 9.380 -6.513 574 HA ASP 81 HA ASP 81 5.547 11.486 -6.009 575 HB2 ASP 81 2HB ASP 81 5.449 10.600 -8.303 576 HB3 ASP 81 1HB ASP 81 3.774 11.131 -8.421 577 H ASP 82 H ASP 82 4.102 11.755 -4.113 578 HA ASP 82 HA ASP 82 2.169 13.861 -4.685 579 HB2 ASP 82 2HB ASP 82 1.761 12.146 -2.818 580 HB3 ASP 82 1HB ASP 82 3.071 12.932 -1.937 581 H VAL 83 H VAL 83 2.692 15.759 -2.766 582 HA VAL 83 HA VAL 83 5.501 16.424 -3.245 583 HB VAL 83 HB VAL 83 3.997 17.628 -4.814 584 HG11 VAL 83 1HG1 VAL 83 2.617 19.486 -4.000 585 HG12 VAL 83 2HG1 VAL 83 2.874 18.898 -2.350 586 HG13 VAL 83 3HG1 VAL 83 2.031 17.893 -3.527 587 HG21 VAL 83 3HG2 VAL 83 4.939 19.879 -4.486 588 HG22 VAL 83 1HG2 VAL 83 6.148 18.610 -4.279 589 HG23 VAL 83 2HG2 VAL 83 5.455 19.408 -2.867 590 H THR 84 H THR 84 3.070 15.905 -1.015 591 HA THR 84 HA THR 84 4.434 17.522 1.007 592 HB THR 84 HB THR 84 1.622 16.368 1.151 593 HG1 THR 84 1HG THR 84 1.150 17.800 -0.351 594 HG21 THR 84 3HG2 THR 84 2.942 18.741 2.512 595 HG22 THR 84 1HG2 THR 84 2.642 17.176 3.266 596 HG23 THR 84 2HG2 THR 84 1.289 18.195 2.779 597 H VAL 85 H VAL 85 4.816 14.754 -0.249 598 HA VAL 85 HA VAL 85 4.388 12.936 1.952 599 HB VAL 85 HB VAL 85 4.039 12.064 -0.300 600 HG11 VAL 85 1HG1 VAL 85 5.552 13.470 -1.570 601 HG12 VAL 85 2HG1 VAL 85 5.889 11.769 -1.897 602 HG13 VAL 85 3HG1 VAL 85 6.941 12.688 -0.821 603 HG21 VAL 85 3HG2 VAL 85 5.506 10.059 -0.223 604 HG22 VAL 85 1HG2 VAL 85 4.803 10.460 1.345 605 HG23 VAL 85 2HG2 VAL 85 6.480 10.866 0.999 606 H SER 86 H SER 86 5.900 12.135 3.306 607 HA SER 86 HA SER 86 8.325 13.582 3.634 608 HB2 SER 86 2HB SER 86 7.313 11.092 5.020 609 HB3 SER 86 1HB SER 86 8.576 12.187 5.591 610 HG SER 86 HG SER 86 6.797 12.792 6.621 611 H ARG 87 H ARG 87 10.417 12.327 3.932 612 HA ARG 87 HA ARG 87 11.066 10.876 1.590 613 HB2 ARG 87 2HB ARG 87 12.610 11.286 4.164 614 HB3 ARG 87 1HB ARG 87 13.288 10.496 2.750 615 HG2 ARG 87 2HG ARG 87 12.190 13.296 2.745 616 HG3 ARG 87 1HG ARG 87 13.896 12.891 2.951 617 HD2 ARG 87 2HD ARG 87 14.060 12.004 0.784 618 HD3 ARG 87 1HD ARG 87 12.325 11.907 0.572 619 HE ARG 87 HE ARG 87 12.610 14.486 0.843 620 HH11 ARG 87 1HH1 ARG 87 14.740 12.315 -0.959 621 HH12 ARG 87 2HH1 ARG 87 14.945 13.365 -2.280 622 HH21 ARG 87 1HH2 ARG 87 12.855 15.911 -1.002 623 HH22 ARG 87 2HH2 ARG 87 13.865 15.461 -2.300 624 H ARG 88 H ARG 88 10.400 9.898 4.837 625 HA ARG 88 HA ARG 88 9.663 7.342 3.694 626 HB2 ARG 88 2HB ARG 88 10.040 6.293 5.995 627 HB3 ARG 88 1HB ARG 88 11.486 6.678 5.096 628 HG2 ARG 88 2HG ARG 88 10.462 8.610 7.144 629 HG3 ARG 88 1HG ARG 88 11.346 7.172 7.652 630 HD2 ARG 88 2HD ARG 88 12.345 9.258 5.712 631 HD3 ARG 88 1HD ARG 88 12.844 9.098 7.400 632 HE ARG 88 HE ARG 88 13.203 6.668 6.003 633 HH11 ARG 88 1HH1 ARG 88 14.727 9.842 6.379 634 HH12 ARG 88 2HH1 ARG 88 16.283 9.261 6.023 635 HH21 ARG 88 1HH2 ARG 88 15.298 5.901 5.499 636 HH22 ARG 88 2HH2 ARG 88 16.634 6.960 5.488 637 H HIS 89 H HIS 89 7.579 7.021 3.795 638 HA HIS 89 HA HIS 89 6.067 8.861 5.506 639 HB2 HIS 89 2HB HIS 89 5.760 9.088 3.040 640 HB3 HIS 89 1HB HIS 89 5.202 7.427 2.976 641 HD2 HIS 89 2HD HIS 89 2.767 7.078 4.648 642 HE1 HIS 89 1HE HIS 89 1.553 11.000 3.713 643 HE2 HIS 89 2HE HIS 89 1.055 8.905 5.061 644 H ALA 90 H ALA 90 5.673 5.635 4.046 645 HA ALA 90 HA ALA 90 4.767 4.688 6.647 646 HB1 ALA 90 1HB ALA 90 2.732 5.127 5.378 647 HB2 ALA 90 2HB ALA 90 2.977 3.388 5.535 648 HB3 ALA 90 3HB ALA 90 3.360 4.199 4.015 649 H GLU 91 H GLU 91 6.002 3.076 7.167 650 HA GLU 91 HA GLU 91 7.222 1.606 4.963 651 HB2 GLU 91 2HB GLU 91 8.161 1.677 7.838 652 HB3 GLU 91 1HB GLU 91 9.008 0.968 6.466 653 HG2 GLU 91 2HG GLU 91 9.044 3.274 5.440 654 HG3 GLU 91 1HG GLU 91 8.485 3.880 6.991 655 H PHE 92 H PHE 92 6.780 -0.409 4.646 656 HA PHE 92 HA PHE 92 4.817 -1.700 6.402 657 HB2 PHE 92 2HB PHE 92 5.500 -2.504 3.573 658 HB3 PHE 92 1HB PHE 92 4.036 -2.839 4.486 659 HD1 PHE 92 1HD PHE 92 2.681 -0.663 5.172 660 HD2 PHE 92 2HD PHE 92 5.428 -0.904 1.943 661 HE1 PHE 92 1HE PHE 92 1.584 1.263 4.098 662 HE2 PHE 92 2HE PHE 92 4.340 1.014 0.861 663 HZ PHE 92 HZ PHE 92 2.415 2.102 1.937 664 H ARG 93 H ARG 93 5.657 -3.336 7.575 665 HA ARG 93 HA ARG 93 8.044 -4.636 6.497 666 HB2 ARG 93 2HB ARG 93 8.464 -3.199 8.508 667 HB3 ARG 93 1HB ARG 93 7.374 -4.229 9.420 668 HG2 ARG 93 2HG ARG 93 8.821 -6.138 9.026 669 HG3 ARG 93 1HG ARG 93 9.905 -5.129 8.073 670 HD2 ARG 93 2HD ARG 93 10.288 -3.733 10.077 671 HD3 ARG 93 1HD ARG 93 9.267 -4.853 10.991 672 HE ARG 93 HE ARG 93 11.281 -6.258 9.651 673 HH11 ARG 93 1HH1 ARG 93 10.782 -4.200 12.496 674 HH12 ARG 93 2HH1 ARG 93 12.147 -4.780 13.326 675 HH21 ARG 93 1HH2 ARG 93 13.203 -7.049 10.815 676 HH22 ARG 93 2HH2 ARG 93 13.546 -6.441 12.349 677 H ILE 94 H ILE 94 8.182 -6.860 6.818 678 HA ILE 94 HA ILE 94 5.636 -8.072 7.539 679 HB ILE 94 HB ILE 94 5.881 -8.401 5.193 680 HG12 ILE 94 2HG1 ILE 94 6.174 -10.873 4.913 681 HG13 ILE 94 1HG1 ILE 94 6.748 -10.950 6.572 682 HG21 ILE 94 1HG2 ILE 94 7.825 -9.404 4.108 683 HG22 ILE 94 2HG2 ILE 94 8.688 -9.322 5.648 684 HG23 ILE 94 3HG2 ILE 94 8.157 -7.842 4.858 685 HD11 ILE 94 3HD1 ILE 94 4.015 -10.056 5.687 686 HD12 ILE 94 1HD1 ILE 94 4.583 -10.139 7.355 687 HD13 ILE 94 2HD1 ILE 94 4.424 -11.615 6.404 688 H ASN 95 H ASN 95 5.591 -9.482 9.051 689 HA ASN 95 HA ASN 95 8.042 -10.365 10.339 690 HB2 ASN 95 2HB ASN 95 6.758 -8.947 11.799 691 HB3 ASN 95 1HB ASN 95 5.246 -9.669 11.280 692 HD21 ASN 95 1HD2 ASN 95 8.060 -10.050 13.270 693 HD22 ASN 95 2HD2 ASN 95 7.416 -11.267 14.297 694 H GLU 96 H GLU 96 8.060 -12.612 10.887 695 HA GLU 96 HA GLU 96 7.010 -14.268 8.928 696 HB2 GLU 96 2HB GLU 96 7.669 -16.185 10.453 697 HB3 GLU 96 1HB GLU 96 8.940 -15.056 10.015 698 HG2 GLU 96 2HG GLU 96 7.468 -14.689 12.589 699 HG3 GLU 96 1HG GLU 96 8.709 -15.932 12.467 700 H GLY 97 H GLY 97 5.397 -13.086 11.683 701 HA2 GLY 97 2HA GLY 97 3.321 -15.130 11.388 702 HA3 GLY 97 1HA GLY 97 3.545 -14.108 12.800 703 H GLU 98 H GLU 98 3.779 -11.542 11.472 704 HA GLU 98 HA GLU 98 1.115 -11.283 10.289 705 HB2 GLU 98 2HB GLU 98 2.167 -9.554 12.525 706 HB3 GLU 98 1HB GLU 98 0.686 -9.291 11.640 707 HG2 GLU 98 2HG GLU 98 -0.069 -10.210 13.610 708 HG3 GLU 98 1HG GLU 98 0.034 -11.629 12.574 709 H PHE 99 H PHE 99 0.801 -8.918 9.634 710 HA PHE 99 HA PHE 99 3.207 -7.903 8.296 711 HB2 PHE 99 2HB PHE 99 0.250 -7.373 7.821 712 HB3 PHE 99 1HB PHE 99 1.552 -6.612 6.913 713 HD1 PHE 99 2HD PHE 99 -0.290 -9.739 7.535 714 HD2 PHE 99 1HD PHE 99 2.618 -7.786 5.119 715 HE1 PHE 99 2HE PHE 99 -0.432 -11.566 5.895 716 HE2 PHE 99 1HE PHE 99 2.475 -9.614 3.469 717 HZ PHE 99 HZ PHE 99 0.954 -11.506 3.859 718 H GLU 100 H GLU 100 3.874 -5.771 8.882 719 HA GLU 100 HA GLU 100 2.163 -4.413 10.834 720 HB2 GLU 100 2HB GLU 100 3.956 -5.640 12.024 721 HB3 GLU 100 1HB GLU 100 5.160 -4.784 11.082 722 HG2 GLU 100 2HG GLU 100 4.533 -2.688 12.117 723 HG3 GLU 100 1HG GLU 100 3.210 -3.478 12.978 724 H VAL 101 H VAL 101 1.907 -2.299 10.445 725 HA VAL 101 HA VAL 101 3.673 -1.097 8.440 726 HB VAL 101 HB VAL 101 1.482 -1.413 7.403 727 HG11 VAL 101 1HG1 VAL 101 0.330 0.150 9.702 728 HG12 VAL 101 2HG1 VAL 101 0.087 -1.568 9.384 729 HG13 VAL 101 3HG1 VAL 101 -0.553 -0.364 8.264 730 HG21 VAL 101 3HG2 VAL 101 0.930 0.893 6.783 731 HG22 VAL 101 1HG2 VAL 101 2.676 0.646 6.823 732 HG23 VAL 101 2HG2 VAL 101 1.870 1.487 8.148 733 H VAL 102 H VAL 102 4.718 0.666 9.012 734 HA VAL 102 HA VAL 102 3.723 2.079 11.355 735 HB VAL 102 HB VAL 102 6.077 2.694 11.932 736 HG11 VAL 102 1HG1 VAL 102 5.490 -0.261 11.881 737 HG12 VAL 102 2HG1 VAL 102 4.971 0.887 13.112 738 HG13 VAL 102 3HG1 VAL 102 6.686 0.525 12.912 739 HG21 VAL 102 3HG2 VAL 102 7.937 1.371 10.997 740 HG22 VAL 102 1HG2 VAL 102 7.141 2.350 9.763 741 HG23 VAL 102 2HG2 VAL 102 6.814 0.619 9.858 742 H ASP 103 H ASP 103 3.096 4.033 11.023 743 HA ASP 103 HA ASP 103 3.795 5.509 8.676 744 HB2 ASP 103 2HB ASP 103 1.562 5.791 9.336 745 HB3 ASP 103 1HB ASP 103 1.996 5.983 11.030 746 H VAL 104 H VAL 104 5.374 6.788 8.525 747 HA VAL 104 HA VAL 104 6.413 8.129 10.891 748 HB VAL 104 HB VAL 104 8.711 8.067 9.700 749 HG11 VAL 104 1HG1 VAL 104 9.233 5.829 10.569 750 HG12 VAL 104 2HG1 VAL 104 7.512 5.476 10.694 751 HG13 VAL 104 3HG1 VAL 104 8.230 6.738 11.698 752 HG21 VAL 104 3HG2 VAL 104 7.913 7.340 7.505 753 HG22 VAL 104 1HG2 VAL 104 7.333 5.832 8.214 754 HG23 VAL 104 2HG2 VAL 104 9.061 6.177 8.174 755 H GLY 105 H GLY 105 4.484 8.729 8.610 756 HA2 GLY 105 2HA GLY 105 5.636 11.330 7.884 757 HA3 GLY 105 1HA GLY 105 4.674 10.367 6.757 758 H SER 106 H SER 106 4.370 11.024 10.180 759 HA SER 106 HA SER 106 1.604 10.885 10.281 760 HB2 SER 106 2HB SER 106 3.445 12.268 12.222 761 HB3 SER 106 1HB SER 106 1.836 11.626 12.554 762 HG SER 106 HG SER 106 2.871 9.587 11.630 763 H LEU 107 H LEU 107 3.596 13.611 9.431 764 HA LEU 107 HA LEU 107 1.555 15.509 10.111 765 HB2 LEU 107 2HB LEU 107 4.070 15.891 8.503 766 HB3 LEU 107 1HB LEU 107 2.936 17.152 8.939 767 HG LEU 107 HG LEU 107 4.597 15.516 10.868 768 HD11 LEU 107 1HD1 LEU 107 5.764 17.612 11.302 769 HD12 LEU 107 2HD1 LEU 107 4.802 18.408 10.055 770 HD13 LEU 107 3HD1 LEU 107 5.920 17.116 9.618 771 HD21 LEU 107 3HD2 LEU 107 3.762 17.081 12.582 772 HD22 LEU 107 1HD2 LEU 107 2.463 16.119 11.880 773 HD23 LEU 107 2HD2 LEU 107 2.680 17.796 11.388 774 H ASN 108 H ASN 108 2.233 13.577 7.366 775 HA ASN 108 HA ASN 108 0.587 15.180 5.604 776 HB2 ASN 108 2HB ASN 108 2.442 13.648 4.785 777 HB3 ASN 108 1HB ASN 108 1.425 12.291 5.262 778 HD21 ASN 108 1HD2 ASN 108 1.996 14.740 2.956 779 HD22 ASN 108 2HD2 ASN 108 0.796 14.281 1.801 780 H GLY 109 H GLY 109 0.380 12.393 7.635 781 HA2 GLY 109 2HA GLY 109 -1.611 11.963 8.907 782 HA3 GLY 109 1HA GLY 109 -2.552 12.624 7.580 783 H THR 110 H THR 110 -0.771 9.805 8.725 784 HA THR 110 HA THR 110 -2.004 8.220 6.632 785 HB THR 110 HB THR 110 0.044 7.374 8.735 786 HG1 THR 110 1HG THR 110 1.480 8.200 7.495 787 HG21 THR 110 3HG2 THR 110 -1.254 5.515 7.752 788 HG22 THR 110 1HG2 THR 110 0.422 5.481 7.204 789 HG23 THR 110 2HG2 THR 110 -0.846 6.084 6.136 790 H TYR 111 H TYR 111 -3.846 7.223 7.078 791 HA TYR 111 HA TYR 111 -4.564 6.665 9.882 792 HB2 TYR 111 2HB TYR 111 -6.556 7.465 7.744 793 HB3 TYR 111 1HB TYR 111 -6.818 7.325 9.469 794 HD1 TYR 111 2HD TYR 111 -5.682 9.018 10.987 795 HD2 TYR 111 1HD TYR 111 -5.939 9.504 6.776 796 HE1 TYR 111 2HE TYR 111 -5.232 11.413 11.239 797 HE2 TYR 111 1HE TYR 111 -5.494 11.905 7.016 798 HH TYR 111 HH TYR 111 -4.398 13.278 9.948 799 H VAL 112 H VAL 112 -5.855 4.799 10.117 800 HA VAL 112 HA VAL 112 -5.878 3.058 7.770 801 HB VAL 112 HB VAL 112 -5.996 2.279 10.717 802 HG11 VAL 112 1HG1 VAL 112 -5.850 -0.038 9.915 803 HG12 VAL 112 2HG1 VAL 112 -5.871 0.538 8.248 804 HG13 VAL 112 3HG1 VAL 112 -7.288 0.757 9.270 805 HG21 VAL 112 3HG2 VAL 112 -3.782 1.323 10.359 806 HG22 VAL 112 1HG2 VAL 112 -3.778 3.045 9.984 807 HG23 VAL 112 2HG2 VAL 112 -3.807 1.862 8.677 808 H ASN 113 H ASN 113 -7.680 2.947 6.831 809 HA ASN 113 HA ASN 113 -9.777 3.080 6.220 810 HB2 ASN 113 2HB ASN 113 -10.136 1.289 7.981 811 HB3 ASN 113 1HB ASN 113 -10.597 2.570 9.100 812 HD21 ASN 113 1HD2 ASN 113 -11.483 0.723 6.357 813 HD22 ASN 113 2HD2 ASN 113 -13.128 1.212 6.229 814 H ARG 114 H ARG 114 -10.100 4.411 9.434 815 HA ARG 114 HA ARG 114 -10.417 7.112 8.316 816 HB2 ARG 114 2HB ARG 114 -12.400 5.752 10.139 817 HB3 ARG 114 1HB ARG 114 -12.318 7.490 9.965 818 HG2 ARG 114 2HG ARG 114 -12.859 5.601 7.676 819 HG3 ARG 114 1HG ARG 114 -14.120 6.350 8.651 820 HD2 ARG 114 2HD ARG 114 -13.908 7.678 6.699 821 HD3 ARG 114 1HD ARG 114 -13.141 8.578 8.000 822 HE ARG 114 HE ARG 114 -11.479 6.924 6.262 823 HH11 ARG 114 1HH1 ARG 114 -12.353 10.172 7.351 824 HH12 ARG 114 2HH1 ARG 114 -11.217 10.967 6.379 825 HH21 ARG 114 1HH2 ARG 114 -9.974 8.001 4.904 826 HH22 ARG 114 2HH2 ARG 114 -9.789 9.701 4.963 827 H GLU 115 H GLU 115 -9.014 5.094 10.649 828 HA GLU 115 HA GLU 115 -9.012 7.215 12.674 829 HB2 GLU 115 2HB GLU 115 -8.690 4.240 12.982 830 HB3 GLU 115 1HB GLU 115 -8.482 5.397 14.284 831 HG2 GLU 115 2HG GLU 115 -11.016 4.978 12.720 832 HG3 GLU 115 1HG GLU 115 -10.686 4.338 14.331 833 HA PRO 116 HA PRO 116 -4.661 7.596 12.083 834 HB2 PRO 116 2HB PRO 116 -4.026 8.880 14.393 835 HB3 PRO 116 1HB PRO 116 -4.807 9.683 13.029 836 HG2 PRO 116 2HG PRO 116 -6.008 8.673 15.565 837 HG3 PRO 116 1HG PRO 116 -6.391 10.137 14.647 838 HD2 PRO 116 2HD PRO 116 -7.897 7.856 14.555 839 HD3 PRO 116 1HD PRO 116 -7.797 9.025 13.222 840 H ARG 117 H ARG 117 -4.113 5.485 12.150 841 HA ARG 117 HA ARG 117 -3.131 4.420 14.704 842 HB2 ARG 117 2HB ARG 117 -3.860 3.065 12.088 843 HB3 ARG 117 1HB ARG 117 -3.030 2.251 13.398 844 HG2 ARG 117 2HG ARG 117 -5.716 3.539 13.761 845 HG3 ARG 117 1HG ARG 117 -5.538 1.878 13.190 846 HD2 ARG 117 2HD ARG 117 -4.264 1.331 15.206 847 HD3 ARG 117 1HD ARG 117 -4.462 2.984 15.784 848 HE ARG 117 HE ARG 117 -6.810 2.573 15.942 849 HH11 ARG 117 1HH1 ARG 117 -4.876 -0.373 15.481 850 HH12 ARG 117 2HH1 ARG 117 -5.896 -1.368 16.412 851 HH21 ARG 117 1HH2 ARG 117 -8.234 1.160 17.209 852 HH22 ARG 117 2HH2 ARG 117 -7.827 -0.491 17.397 853 H ASN 118 H ASN 118 -1.080 5.272 14.809 854 HA ASN 118 HA ASN 118 0.339 5.683 12.373 855 HB2 ASN 118 2HB ASN 118 1.309 6.085 15.210 856 HB3 ASN 118 1HB ASN 118 2.195 6.568 13.763 857 HD21 ASN 118 1HD2 ASN 118 1.286 8.296 12.436 858 HD22 ASN 118 2HD2 ASN 118 0.181 9.394 13.155 859 H ALA 119 H ALA 119 0.432 3.305 14.917 860 HA ALA 119 HA ALA 119 2.000 1.749 12.986 861 HB1 ALA 119 1HB ALA 119 2.806 0.404 14.918 862 HB2 ALA 119 2HB ALA 119 1.997 1.527 16.014 863 HB3 ALA 119 3HB ALA 119 3.345 2.081 15.018 864 H GLN 120 H GLN 120 1.001 -0.117 12.438 865 HA GLN 120 HA GLN 120 -1.350 -0.897 13.959 866 HB2 GLN 120 2HB GLN 120 -2.192 0.664 12.298 867 HB3 GLN 120 1HB GLN 120 -1.380 -0.213 11.014 868 HG2 GLN 120 2HG GLN 120 -3.783 -0.654 11.032 869 HG3 GLN 120 1HG GLN 120 -2.852 -2.110 11.357 870 HE21 GLN 120 1HE2 GLN 120 -4.497 -3.146 12.367 871 HE22 GLN 120 2HE2 GLN 120 -5.135 -2.690 13.902 872 H VAL 121 H VAL 121 -1.841 -3.077 13.810 873 HA VAL 121 HA VAL 121 0.017 -4.722 12.375 874 HB VAL 121 HB VAL 121 -0.916 -5.607 14.514 875 HG11 VAL 121 1HG1 VAL 121 -3.619 -5.522 13.192 876 HG12 VAL 121 2HG1 VAL 121 -3.080 -4.536 14.549 877 HG13 VAL 121 3HG1 VAL 121 -3.265 -6.278 14.746 878 HG21 VAL 121 3HG2 VAL 121 -0.268 -7.246 12.854 879 HG22 VAL 121 1HG2 VAL 121 -1.875 -7.180 12.129 880 HG23 VAL 121 2HG2 VAL 121 -1.667 -7.828 13.757 881 H MET 122 H MET 122 -0.194 -5.111 10.333 882 HA MET 122 HA MET 122 -2.084 -3.521 8.943 883 HB2 MET 122 2HB MET 122 0.414 -4.098 8.444 884 HB3 MET 122 1HB MET 122 -0.278 -5.470 7.597 885 HG2 MET 122 2HG MET 122 -1.466 -4.032 6.108 886 HG3 MET 122 1HG MET 122 -0.982 -2.610 7.038 887 HE1 MET 122 3HE MET 122 -0.538 -2.601 3.989 888 HE2 MET 122 1HE MET 122 1.131 -2.052 3.851 889 HE3 MET 122 2HE MET 122 0.060 -1.320 5.045 890 H GLN 123 H GLN 123 -3.977 -4.041 8.212 891 HA GLN 123 HA GLN 123 -4.847 -6.826 8.423 892 HB2 GLN 123 2HB GLN 123 -5.950 -5.224 9.900 893 HB3 GLN 123 1HB GLN 123 -6.361 -4.214 8.533 894 HG2 GLN 123 2HG GLN 123 -8.301 -5.437 9.357 895 HG3 GLN 123 1HG GLN 123 -7.899 -5.922 7.714 896 HE21 GLN 123 1HE2 GLN 123 -7.443 -8.049 7.320 897 HE22 GLN 123 2HE2 GLN 123 -7.460 -9.267 8.548 898 H THR 124 H THR 124 -5.253 -7.843 6.674 899 HA THR 124 HA THR 124 -5.341 -6.557 4.122 900 HB THR 124 HB THR 124 -4.227 -8.706 4.256 901 HG1 THR 124 1HG THR 124 -6.683 -9.160 2.907 902 HG21 THR 124 3HG2 THR 124 -5.362 -9.690 6.171 903 HG22 THR 124 1HG2 THR 124 -5.416 -10.802 4.804 904 HG23 THR 124 2HG2 THR 124 -6.847 -9.861 5.236 905 H GLY 125 H GLY 125 -7.085 -5.987 3.019 906 HA2 GLY 125 2HA GLY 125 -9.344 -6.448 2.314 907 HA3 GLY 125 1HA GLY 125 -9.700 -6.944 3.964 908 H ASP 126 H ASP 126 -7.834 -4.394 4.477 909 HA ASP 126 HA ASP 126 -10.157 -2.581 4.481 910 HB2 ASP 126 2HB ASP 126 -9.214 -3.449 6.743 911 HB3 ASP 126 1HB ASP 126 -7.836 -2.406 6.416 912 H GLU 127 H GLU 127 -9.328 -0.223 4.638 913 HA GLU 127 HA GLU 127 -7.211 0.037 2.637 914 HB2 GLU 127 2HB GLU 127 -8.284 2.148 1.897 915 HB3 GLU 127 1HB GLU 127 -9.289 0.735 1.648 916 HG2 GLU 127 2HG GLU 127 -10.658 1.318 3.544 917 HG3 GLU 127 1HG GLU 127 -9.584 2.655 3.950 918 H ILE 128 H ILE 128 -5.733 1.587 2.804 919 HA ILE 128 HA ILE 128 -5.440 2.842 5.421 920 HB ILE 128 HB ILE 128 -3.321 2.214 3.327 921 HG12 ILE 128 2HG1 ILE 128 -3.851 0.926 6.019 922 HG13 ILE 128 1HG1 ILE 128 -4.193 0.200 4.459 923 HG21 ILE 128 1HG2 ILE 128 -2.785 4.229 4.616 924 HG22 ILE 128 2HG2 ILE 128 -1.702 2.905 5.042 925 HG23 ILE 128 3HG2 ILE 128 -3.031 3.340 6.120 926 HD11 ILE 128 3HD1 ILE 128 -1.798 0.203 3.947 927 HD12 ILE 128 1HD1 ILE 128 -2.163 -0.699 5.418 928 HD13 ILE 128 2HD1 ILE 128 -1.475 0.919 5.526 929 H GLN 129 H GLN 129 -5.581 4.941 5.464 930 HA GLN 129 HA GLN 129 -6.027 6.375 2.962 931 HB2 GLN 129 2HB GLN 129 -7.774 6.440 4.695 932 HB3 GLN 129 1HB GLN 129 -6.602 7.097 5.828 933 HG2 GLN 129 2HG GLN 129 -7.919 8.888 5.050 934 HG3 GLN 129 1HG GLN 129 -6.331 9.045 4.301 935 HE21 GLN 129 1HE2 GLN 129 -7.132 10.269 2.628 936 HE22 GLN 129 2HE2 GLN 129 -8.095 9.578 1.362 937 H ILE 130 H ILE 130 -4.300 7.454 2.258 938 HA ILE 130 HA ILE 130 -2.546 8.579 4.272 939 HB ILE 130 HB ILE 130 -0.763 8.536 2.382 940 HG12 ILE 130 2HG1 ILE 130 -2.668 6.389 1.374 941 HG13 ILE 130 1HG1 ILE 130 -2.210 7.859 0.528 942 HG21 ILE 130 1HG2 ILE 130 -0.044 6.269 3.045 943 HG22 ILE 130 2HG2 ILE 130 -1.624 6.017 3.794 944 HG23 ILE 130 3HG2 ILE 130 -0.547 7.273 4.405 945 HD11 ILE 130 3HD1 ILE 130 -0.387 5.559 1.205 946 HD12 ILE 130 1HD1 ILE 130 0.095 7.030 0.361 947 HD13 ILE 130 2HD1 ILE 130 -1.062 5.923 -0.384 948 H GLY 131 H GLY 131 -3.230 10.485 4.519 949 HA2 GLY 131 2HA GLY 131 -3.703 12.682 4.092 950 HA3 GLY 131 1HA GLY 131 -2.987 12.441 2.499 951 H LYS 132 H LYS 132 -4.267 12.745 0.896 952 HA LYS 132 HA LYS 132 -7.162 12.662 1.238 953 HB2 LYS 132 2HB LYS 132 -6.343 14.685 0.234 954 HB3 LYS 132 1HB LYS 132 -5.358 13.791 -0.904 955 HG2 LYS 132 2HG LYS 132 -7.278 14.801 -2.013 956 HG3 LYS 132 1HG LYS 132 -7.358 13.046 -2.083 957 HD2 LYS 132 2HD LYS 132 -9.552 13.914 -1.640 958 HD3 LYS 132 1HD LYS 132 -8.979 13.099 -0.192 959 HE2 LYS 132 2HE LYS 132 -8.440 15.234 0.824 960 HE3 LYS 132 1HE LYS 132 -8.900 16.083 -0.654 961 HZ1 LYS 132 3HZ LYS 132 -10.690 16.167 0.954 962 HZ2 LYS 132 1HZ LYS 132 -10.717 14.499 1.095 963 HZ3 LYS 132 2HZ LYS 132 -11.169 15.212 -0.345 964 H PHE 133 H PHE 133 -4.637 10.782 -0.059 965 HA PHE 133 HA PHE 133 -6.488 9.442 -1.839 966 HB2 PHE 133 2HB PHE 133 -4.345 8.450 -2.851 967 HB3 PHE 133 1HB PHE 133 -4.742 10.124 -3.209 968 HD1 PHE 133 2HD PHE 133 -3.537 11.929 -1.817 969 HD2 PHE 133 1HD PHE 133 -2.256 7.881 -2.021 970 HE1 PHE 133 2HE PHE 133 -1.298 12.612 -1.092 971 HE2 PHE 133 1HE PHE 133 -0.005 8.571 -1.300 972 HZ PHE 133 HZ PHE 133 0.472 10.933 -0.833 973 H ARG 134 H ARG 134 -6.113 7.021 -2.124 974 HA ARG 134 HA ARG 134 -5.561 5.894 0.500 975 HB2 ARG 134 2HB ARG 134 -7.706 4.619 0.469 976 HB3 ARG 134 1HB ARG 134 -7.864 6.344 0.742 977 HG2 ARG 134 2HG ARG 134 -8.545 6.668 -1.562 978 HG3 ARG 134 1HG ARG 134 -8.339 4.944 -1.879 979 HD2 ARG 134 2HD ARG 134 -10.700 5.590 -1.477 980 HD3 ARG 134 1HD ARG 134 -10.098 4.399 -0.333 981 HE ARG 134 HE ARG 134 -10.143 5.948 1.349 982 HH11 ARG 134 1HH1 ARG 134 -11.075 7.527 -1.683 983 HH12 ARG 134 2HH1 ARG 134 -11.913 8.812 -0.922 984 HH21 ARG 134 1HH2 ARG 134 -11.235 7.756 2.372 985 HH22 ARG 134 2HH2 ARG 134 -11.992 8.965 1.419 986 H LEU 135 H LEU 135 -5.111 3.838 0.631 987 HA LEU 135 HA LEU 135 -4.639 2.354 -1.853 988 HB2 LEU 135 2HB LEU 135 -2.584 3.341 -0.869 989 HB3 LEU 135 1HB LEU 135 -2.963 2.609 0.663 990 HG LEU 135 HG LEU 135 -2.327 0.933 -1.775 991 HD11 LEU 135 1HD1 LEU 135 -0.447 2.073 0.295 992 HD12 LEU 135 2HD1 LEU 135 -0.481 2.492 -1.419 993 HD13 LEU 135 3HD1 LEU 135 -0.017 0.865 -0.914 994 HD21 LEU 135 3HD2 LEU 135 -1.653 -0.710 -0.080 995 HD22 LEU 135 1HD2 LEU 135 -3.331 -0.228 0.165 996 HD23 LEU 135 2HD2 LEU 135 -2.064 0.430 1.200 997 H VAL 136 H VAL 136 -5.338 0.218 -1.715 998 HA VAL 136 HA VAL 136 -6.682 -0.553 0.779 999 HB VAL 136 HB VAL 136 -7.049 -1.762 -1.983 1000 HG11 VAL 136 1HG1 VAL 136 -7.685 -3.242 -0.173 1001 HG12 VAL 136 2HG1 VAL 136 -9.115 -2.706 -1.055 1002 HG13 VAL 136 3HG1 VAL 136 -8.728 -1.997 0.512 1003 HG21 VAL 136 3HG2 VAL 136 -8.766 0.322 -0.639 1004 HG22 VAL 136 1HG2 VAL 136 -9.154 -0.501 -2.149 1005 HG23 VAL 136 2HG2 VAL 136 -7.755 0.567 -2.063 1006 H PHE 137 H PHE 137 -5.919 -2.324 1.822 1007 HA PHE 137 HA PHE 137 -3.508 -3.466 0.650 1008 HB2 PHE 137 2HB PHE 137 -3.133 -2.285 2.736 1009 HB3 PHE 137 1HB PHE 137 -4.357 -3.268 3.534 1010 HD1 PHE 137 2HD PHE 137 -1.153 -3.533 1.706 1011 HD2 PHE 137 1HD PHE 137 -3.749 -5.247 4.601 1012 HE1 PHE 137 2HE PHE 137 0.549 -5.174 2.247 1013 HE2 PHE 137 1HE PHE 137 -2.045 -6.933 5.143 1014 HZ PHE 137 HZ PHE 137 0.113 -6.910 3.962 1015 H LEU 138 H LEU 138 -3.467 -5.495 0.081 1016 HA LEU 138 HA LEU 138 -5.225 -7.373 1.442 1017 HB2 LEU 138 2HB LEU 138 -4.547 -7.308 -1.505 1018 HB3 LEU 138 1HB LEU 138 -5.230 -8.703 -0.716 1019 HG LEU 138 HG LEU 138 -6.941 -7.675 -1.930 1020 HD11 LEU 138 1HD1 LEU 138 -7.334 -6.932 0.947 1021 HD12 LEU 138 2HD1 LEU 138 -7.693 -8.477 0.180 1022 HD13 LEU 138 3HD1 LEU 138 -8.605 -7.039 -0.270 1023 HD21 LEU 138 3HD2 LEU 138 -6.258 -5.050 -0.621 1024 HD22 LEU 138 1HD2 LEU 138 -7.642 -5.325 -1.680 1025 HD23 LEU 138 2HD2 LEU 138 -6.002 -5.484 -2.311 1026 H ALA 139 H ALA 139 -4.330 -9.378 1.741 1027 HA ALA 139 HA ALA 139 -1.557 -9.535 2.167 1028 HB1 ALA 139 1HB ALA 139 -3.553 -11.788 1.873 1029 HB2 ALA 139 2HB ALA 139 -3.164 -10.950 3.374 1030 HB3 ALA 139 3HB ALA 139 -1.938 -11.931 2.568 1031 H GLY 140 H GLY 140 0.026 -10.769 1.027 1032 HA2 GLY 140 2HA GLY 140 -0.119 -10.270 -1.749 1033 HA3 GLY 140 1HA GLY 140 1.191 -11.068 -0.893 1034 HA PRO 141 HA PRO 141 -1.338 -13.925 -3.780 1035 HB2 PRO 141 2HB PRO 141 0.985 -14.708 -5.090 1036 HB3 PRO 141 1HB PRO 141 -0.181 -13.521 -5.694 1037 HG2 PRO 141 2HG PRO 141 2.407 -13.088 -4.278 1038 HG3 PRO 141 1HG PRO 141 1.692 -12.187 -5.629 1039 HD2 PRO 141 2HD PRO 141 1.623 -11.224 -3.151 1040 HD3 PRO 141 1HD PRO 141 0.237 -11.029 -4.249 1041 H ALA 142 H ALA 142 -1.496 -16.038 -3.281 1042 HA ALA 142 HA ALA 142 0.242 -17.030 -1.208 1043 HB1 ALA 142 1HB ALA 142 -2.172 -17.444 -1.062 1044 HB2 ALA 142 2HB ALA 142 -1.278 -18.961 -1.160 1045 HB3 ALA 142 3HB ALA 142 -2.114 -18.338 -2.581 1046 H GLU 143 H GLU 143 2.141 -17.618 -1.916 1047 HA GLU 143 HA GLU 143 2.506 -18.805 -4.510 1048 HB2 GLU 143 2HB GLU 143 4.075 -17.092 -3.522 1049 HB3 GLU 143 1HB GLU 143 4.543 -18.296 -2.328 1050 HG2 GLU 143 2HG GLU 143 6.183 -18.173 -4.101 1051 HG3 GLU 143 1HG GLU 143 5.374 -19.737 -4.114 Start of MODEL 26 1 H1 MET 1 1HT MET 1 75.228 56.250 42.803 2 H2 MET 1 2HT MET 1 74.495 56.331 41.295 3 H3 MET 1 3HT MET 1 73.923 55.264 42.435 4 HA MET 1 HA MET 1 72.476 57.136 42.176 5 HB2 MET 1 2HB MET 1 72.225 57.797 44.530 6 HB3 MET 1 1HB MET 1 72.502 56.075 44.384 7 HG2 MET 1 2HG MET 1 74.830 56.397 45.095 8 HG3 MET 1 1HG MET 1 74.559 58.133 45.192 9 HE1 MET 1 2HE MET 1 75.486 58.168 47.679 10 HE2 MET 1 3HE MET 1 75.786 56.432 47.569 11 HE3 MET 1 1HE MET 1 74.908 57.093 48.949 12 H SER 2 H SER 2 75.662 58.307 43.427 13 HA SER 2 HA SER 2 74.984 61.019 42.870 14 HB2 SER 2 2HB SER 2 77.689 59.722 43.311 15 HB3 SER 2 1HB SER 2 77.273 61.421 43.567 16 HG SER 2 HG SER 2 75.780 60.700 45.143 17 H ASP 3 H ASP 3 77.116 58.561 41.543 18 HA ASP 3 HA ASP 3 77.042 59.819 38.929 19 HB2 ASP 3 2HB ASP 3 78.747 58.142 38.334 20 HB3 ASP 3 1HB ASP 3 79.253 59.007 39.777 21 H ASN 4 H ASN 4 76.054 58.677 37.258 22 HA ASN 4 HA ASN 4 74.535 56.321 38.069 23 HB2 ASN 4 2HB ASN 4 73.352 58.747 36.698 24 HB3 ASN 4 1HB ASN 4 72.550 57.187 36.803 25 HD21 ASN 4 1HD2 ASN 4 73.456 60.059 38.489 26 HD22 ASN 4 2HD2 ASN 4 72.552 59.736 39.929 27 H ASN 5 H ASN 5 74.827 54.784 36.750 28 HA ASN 5 HA ASN 5 76.119 55.023 34.248 29 HB2 ASN 5 2HB ASN 5 75.572 52.640 33.936 30 HB3 ASN 5 1HB ASN 5 76.182 52.921 35.558 31 HD21 ASN 5 1HD2 ASN 5 74.802 52.656 37.303 32 HD22 ASN 5 2HD2 ASN 5 73.268 51.905 37.193 33 H GLY 6 H GLY 6 75.199 54.603 32.163 34 HA2 GLY 6 2HA GLY 6 72.645 55.877 31.887 35 HA3 GLY 6 1HA GLY 6 73.701 55.345 30.581 36 H THR 7 H THR 7 70.837 54.957 30.975 37 HA THR 7 HA THR 7 70.246 52.282 31.607 38 HB THR 7 HB THR 7 68.893 54.046 29.535 39 HG1 THR 7 1HG THR 7 69.200 54.438 32.233 40 HG21 THR 7 3HG2 THR 7 68.049 51.737 29.685 41 HG22 THR 7 1HG2 THR 7 66.851 52.882 30.284 42 HG23 THR 7 2HG2 THR 7 67.808 51.937 31.420 43 HA PRO 8 HA PRO 8 72.278 50.161 28.130 44 HB2 PRO 8 2HB PRO 8 69.745 48.577 28.102 45 HB3 PRO 8 1HB PRO 8 71.420 48.010 28.105 46 HG2 PRO 8 2HG PRO 8 69.931 47.912 30.315 47 HG3 PRO 8 1HG PRO 8 71.658 48.300 30.382 48 HD2 PRO 8 2HD PRO 8 69.297 50.070 30.720 49 HD3 PRO 8 1HD PRO 8 70.922 50.187 31.429 50 H GLU 9 H GLU 9 72.210 50.511 25.993 51 HA GLU 9 HA GLU 9 70.329 52.373 25.017 52 HB2 GLU 9 2HB GLU 9 71.564 52.092 22.869 53 HB3 GLU 9 1HB GLU 9 72.597 52.480 24.237 54 HG2 GLU 9 2HG GLU 9 73.187 50.084 24.419 55 HG3 GLU 9 1HG GLU 9 72.216 49.767 22.982 56 HA PRO 10 HA PRO 10 66.806 50.229 23.553 57 HB2 PRO 10 2HB PRO 10 67.163 51.105 20.832 58 HB3 PRO 10 1HB PRO 10 65.954 51.624 22.004 59 HG2 PRO 10 2HG PRO 10 68.480 52.922 21.256 60 HG3 PRO 10 1HG PRO 10 67.091 53.600 22.112 61 HD2 PRO 10 2HD PRO 10 69.461 53.130 23.307 62 HD3 PRO 10 1HD PRO 10 67.920 52.988 24.179 63 H GLN 11 H GLN 11 66.868 48.173 23.397 64 HA GLN 11 HA GLN 11 68.627 46.790 21.513 65 HB2 GLN 11 2HB GLN 11 66.977 45.683 23.803 66 HB3 GLN 11 1HB GLN 11 68.241 44.859 22.912 67 HG2 GLN 11 2HG GLN 11 69.920 46.276 23.846 68 HG3 GLN 11 1HG GLN 11 68.703 47.282 24.625 69 HE21 GLN 11 1HE2 GLN 11 70.894 45.890 25.799 70 HE22 GLN 11 2HE2 GLN 11 70.257 44.776 26.956 71 H VAL 12 H VAL 12 67.593 45.092 20.253 72 HA VAL 12 HA VAL 12 64.860 45.751 19.630 73 HB VAL 12 HB VAL 12 65.119 44.174 17.755 74 HG11 VAL 12 1HG1 VAL 12 66.656 45.532 16.432 75 HG12 VAL 12 2HG1 VAL 12 67.281 46.264 17.911 76 HG13 VAL 12 3HG1 VAL 12 65.604 46.537 17.430 77 HG21 VAL 12 3HG2 VAL 12 67.363 43.329 17.171 78 HG22 VAL 12 1HG2 VAL 12 66.761 42.650 18.686 79 HG23 VAL 12 2HG2 VAL 12 67.965 43.938 18.708 80 H GLU 13 H GLU 13 63.211 44.269 19.662 81 HA GLU 13 HA GLU 13 63.623 42.011 21.462 82 HB2 GLU 13 2HB GLU 13 61.926 43.678 22.166 83 HB3 GLU 13 1HB GLU 13 61.066 43.431 20.654 84 HG2 GLU 13 2HG GLU 13 59.969 42.249 22.465 85 HG3 GLU 13 1HG GLU 13 60.624 41.110 21.289 86 H THR 14 H THR 14 63.029 40.004 20.810 87 HA THR 14 HA THR 14 63.094 39.460 18.024 88 HB THR 14 HB THR 14 64.072 37.914 19.688 89 HG1 THR 14 1HG THR 14 61.939 36.474 18.478 90 HG21 THR 14 3HG2 THR 14 62.648 36.512 21.108 91 HG22 THR 14 1HG2 THR 14 61.229 37.384 20.528 92 HG23 THR 14 2HG2 THR 14 62.445 38.225 21.482 93 H THR 15 H THR 15 61.341 38.430 16.790 94 HA THR 15 HA THR 15 58.726 38.727 17.934 95 HB THR 15 HB THR 15 59.048 40.948 17.129 96 HG1 THR 15 1HG THR 15 57.004 40.155 16.697 97 HG21 THR 15 3HG2 THR 15 59.587 41.508 14.783 98 HG22 THR 15 1HG2 THR 15 59.801 39.790 14.437 99 HG23 THR 15 2HG2 THR 15 60.891 40.605 15.558 100 H SER 16 H SER 16 58.013 36.743 17.672 101 HA SER 16 HA SER 16 58.314 35.384 15.121 102 HB2 SER 16 2HB SER 16 58.700 34.150 17.321 103 HB3 SER 16 1HB SER 16 57.011 34.436 17.717 104 HG SER 16 HG SER 16 57.523 33.242 15.259 105 H VAL 17 H VAL 17 56.903 36.385 13.753 106 HA VAL 17 HA VAL 17 54.299 37.029 14.858 107 HB VAL 17 HB VAL 17 55.511 38.990 14.082 108 HG11 VAL 17 1HG1 VAL 17 55.980 39.387 11.706 109 HG12 VAL 17 2HG1 VAL 17 55.544 37.712 11.361 110 HG13 VAL 17 3HG1 VAL 17 56.931 38.070 12.391 111 HG21 VAL 17 3HG2 VAL 17 53.148 38.337 12.331 112 HG22 VAL 17 1HG2 VAL 17 53.795 39.952 12.600 113 HG23 VAL 17 2HG2 VAL 17 53.095 39.047 13.942 114 H PHE 18 H PHE 18 52.553 36.131 14.211 115 HA PHE 18 HA PHE 18 52.614 34.461 11.814 116 HB2 PHE 18 2HB PHE 18 50.868 34.185 14.288 117 HB3 PHE 18 1HB PHE 18 50.889 33.102 12.904 118 HD1 PHE 18 1HD PHE 18 52.866 31.651 12.505 119 HD2 PHE 18 2HD PHE 18 52.471 34.005 16.032 120 HE1 PHE 18 1HE PHE 18 54.608 30.303 13.602 121 HE2 PHE 18 2HE PHE 18 54.206 32.666 17.129 122 HZ PHE 18 HZ PHE 18 55.279 30.817 15.918 123 H ARG 19 H ARG 19 51.186 35.044 10.291 124 HA ARG 19 HA ARG 19 49.479 37.346 10.880 125 HB2 ARG 19 2HB ARG 19 50.101 36.022 8.228 126 HB3 ARG 19 1HB ARG 19 49.210 37.519 8.450 127 HG2 ARG 19 2HG ARG 19 52.100 37.078 9.146 128 HG3 ARG 19 1HG ARG 19 51.509 37.913 7.709 129 HD2 ARG 19 2HD ARG 19 50.488 39.616 9.133 130 HD3 ARG 19 1HD ARG 19 51.041 38.748 10.564 131 HE ARG 19 HE ARG 19 53.208 39.273 8.877 132 HH11 ARG 19 1HH1 ARG 19 50.995 41.012 11.037 133 HH12 ARG 19 2HH1 ARG 19 52.134 42.182 11.474 134 HH21 ARG 19 1HH2 ARG 19 54.774 40.887 9.507 135 HH22 ARG 19 2HH2 ARG 19 54.344 42.105 10.594 136 H ALA 20 H ALA 20 47.317 37.258 9.697 137 HA ALA 20 HA ALA 20 45.958 34.890 10.508 138 HB1 ALA 20 1HB ALA 20 44.911 37.285 8.971 139 HB2 ALA 20 2HB ALA 20 44.878 37.099 10.724 140 HB3 ALA 20 3HB ALA 20 43.925 36.021 9.707 141 H ASP 21 H ASP 21 47.124 33.454 9.248 142 HA ASP 21 HA ASP 21 46.846 33.543 6.352 143 HB2 ASP 21 2HB ASP 21 48.357 31.641 8.153 144 HB3 ASP 21 1HB ASP 21 48.308 31.517 6.406 145 H LEU 22 H LEU 22 45.529 32.034 9.110 146 HA LEU 22 HA LEU 22 44.571 29.688 7.844 147 HB2 LEU 22 2HB LEU 22 45.021 29.912 10.292 148 HB3 LEU 22 1HB LEU 22 43.683 31.020 10.425 149 HG LEU 22 HG LEU 22 43.293 28.686 11.300 150 HD11 LEU 22 1HD1 LEU 22 41.407 29.593 9.142 151 HD12 LEU 22 2HD1 LEU 22 41.407 30.125 10.820 152 HD13 LEU 22 3HD1 LEU 22 41.032 28.445 10.430 153 HD21 LEU 22 3HD2 LEU 22 43.285 27.976 8.373 154 HD22 LEU 22 1HD2 LEU 22 42.784 26.918 9.692 155 HD23 LEU 22 2HD2 LEU 22 44.464 27.445 9.577 156 H LEU 23 H LEU 23 42.641 29.285 6.917 157 HA LEU 23 HA LEU 23 40.650 31.377 6.798 158 HB2 LEU 23 2HB LEU 23 40.370 31.172 4.400 159 HB3 LEU 23 1HB LEU 23 42.018 31.628 4.741 160 HG LEU 23 HG LEU 23 41.152 28.816 4.007 161 HD11 LEU 23 1HD1 LEU 23 42.318 31.001 2.291 162 HD12 LEU 23 2HD1 LEU 23 40.692 30.326 2.178 163 HD13 LEU 23 3HD1 LEU 23 42.095 29.323 1.800 164 HD21 LEU 23 3HD2 LEU 23 43.893 30.109 4.074 165 HD22 LEU 23 1HD2 LEU 23 43.542 28.468 3.529 166 HD23 LEU 23 2HD2 LEU 23 43.292 28.904 5.217 167 H LYS 24 H LYS 24 38.687 30.281 5.499 168 HA LYS 24 HA LYS 24 38.076 28.054 7.186 169 HB2 LYS 24 2HB LYS 24 36.390 29.482 5.154 170 HB3 LYS 24 1HB LYS 24 35.814 28.155 6.156 171 HG2 LYS 24 2HG LYS 24 36.899 30.758 7.183 172 HG3 LYS 24 1HG LYS 24 35.186 30.370 7.043 173 HD2 LYS 24 2HD LYS 24 35.505 28.500 8.630 174 HD3 LYS 24 1HD LYS 24 37.215 28.905 8.756 175 HE2 LYS 24 2HE LYS 24 35.945 29.778 10.650 176 HE3 LYS 24 1HE LYS 24 36.657 31.073 9.697 177 HZ1 LYS 24 3HZ LYS 24 34.367 31.528 10.343 178 HZ2 LYS 24 1HZ LYS 24 33.834 30.175 9.486 179 HZ3 LYS 24 2HZ LYS 24 34.540 31.482 8.678 180 H GLU 25 H GLU 25 37.851 26.055 6.803 181 HA GLU 25 HA GLU 25 38.054 24.962 4.092 182 HB2 GLU 25 2HB GLU 25 40.207 24.711 5.249 183 HB3 GLU 25 1HB GLU 25 39.378 24.076 6.658 184 HG2 GLU 25 2HG GLU 25 38.702 22.111 5.341 185 HG3 GLU 25 1HG GLU 25 39.619 22.746 3.975 186 H MET 26 H MET 26 36.692 23.104 3.861 187 HA MET 26 HA MET 26 34.606 23.004 5.922 188 HB2 MET 26 2HB MET 26 33.106 22.119 4.297 189 HB3 MET 26 1HB MET 26 33.967 23.421 3.500 190 HG2 MET 26 2HG MET 26 35.362 21.825 2.333 191 HG3 MET 26 1HG MET 26 34.612 20.489 3.203 192 HE1 MET 26 3HE MET 26 34.785 20.295 0.137 193 HE2 MET 26 1HE MET 26 33.140 19.837 -0.299 194 HE3 MET 26 2HE MET 26 33.906 19.135 1.131 195 H GLU 27 H GLU 27 33.519 20.776 6.051 196 HA GLU 27 HA GLU 27 35.494 18.900 6.981 197 HB2 GLU 27 2HB GLU 27 32.482 18.837 6.968 198 HB3 GLU 27 1HB GLU 27 33.502 17.625 7.730 199 HG2 GLU 27 2HG GLU 27 34.372 19.286 9.256 200 HG3 GLU 27 1HG GLU 27 33.417 20.540 8.463 201 H SER 28 H SER 28 35.035 16.545 6.494 202 HA SER 28 HA SER 28 35.006 16.191 3.631 203 HB2 SER 28 2HB SER 28 35.434 14.199 5.864 204 HB3 SER 28 1HB SER 28 35.780 13.926 4.153 205 HG SER 28 HG SER 28 36.924 16.198 5.210 206 H SER 29 H SER 29 33.499 14.926 2.520 207 HA SER 29 HA SER 29 30.858 15.077 3.531 208 HB2 SER 29 2HB SER 29 31.869 13.718 1.038 209 HB3 SER 29 1HB SER 29 30.217 14.242 1.363 210 HG SER 29 HG SER 29 31.545 16.391 1.741 211 H THR 30 H THR 30 29.342 13.273 3.546 212 HA THR 30 HA THR 30 30.403 10.609 3.790 213 HB THR 30 HB THR 30 28.815 11.943 6.012 214 HG1 THR 30 1HG THR 30 31.448 11.737 5.493 215 HG21 THR 30 3HG2 THR 30 29.139 9.822 7.218 216 HG22 THR 30 1HG2 THR 30 29.994 9.162 5.825 217 HG23 THR 30 2HG2 THR 30 28.277 9.546 5.705 218 H GLY 31 H GLY 31 29.016 9.315 2.716 219 HA2 GLY 31 2HA GLY 31 26.458 10.379 1.904 220 HA3 GLY 31 1HA GLY 31 27.210 8.885 1.360 221 H THR 32 H THR 32 24.704 8.616 1.843 222 HA THR 32 HA THR 32 24.332 7.802 4.618 223 HB THR 32 HB THR 32 22.610 9.313 3.668 224 HG1 THR 32 1HG THR 32 22.036 7.496 5.169 225 HG21 THR 32 3HG2 THR 32 22.739 8.689 1.322 226 HG22 THR 32 1HG2 THR 32 21.082 8.519 1.901 227 HG23 THR 32 2HG2 THR 32 22.090 7.088 1.691 228 H ALA 33 H ALA 33 23.332 5.684 4.984 229 HA ALA 33 HA ALA 33 24.545 3.693 3.305 230 HB1 ALA 33 1HB ALA 33 24.619 3.453 5.743 231 HB2 ALA 33 2HB ALA 33 23.756 2.107 5.002 232 HB3 ALA 33 3HB ALA 33 22.857 3.399 5.796 233 HA PRO 34 HA PRO 34 20.796 3.185 0.989 234 HB2 PRO 34 2HB PRO 34 21.563 1.123 -0.556 235 HB3 PRO 34 1HB PRO 34 22.247 2.738 -0.766 236 HG2 PRO 34 2HG PRO 34 23.403 0.352 0.609 237 HG3 PRO 34 1HG PRO 34 24.207 1.538 -0.433 238 HD2 PRO 34 2HD PRO 34 24.299 1.573 2.323 239 HD3 PRO 34 1HD PRO 34 24.541 2.996 1.291 240 H ALA 35 H ALA 35 19.105 1.640 0.658 241 HA ALA 35 HA ALA 35 18.479 0.060 2.892 242 HB1 ALA 35 1HB ALA 35 16.556 -0.711 1.569 243 HB2 ALA 35 2HB ALA 35 17.279 -0.012 0.117 244 HB3 ALA 35 3HB ALA 35 16.760 1.036 1.437 245 H SER 36 H SER 36 19.277 -1.804 3.424 246 HA SER 36 HA SER 36 20.229 -3.645 1.351 247 HB2 SER 36 2HB SER 36 21.488 -3.164 4.059 248 HB3 SER 36 1HB SER 36 22.123 -4.164 2.747 249 HG SER 36 HG SER 36 21.672 -1.362 2.535 250 H THR 37 H THR 37 18.769 -5.300 1.458 251 HA THR 37 HA THR 37 18.280 -6.564 3.985 252 HB THR 37 HB THR 37 16.574 -4.739 3.895 253 HG1 THR 37 1HG THR 37 16.033 -6.716 4.925 254 HG21 THR 37 3HG2 THR 37 14.735 -4.853 2.261 255 HG22 THR 37 1HG2 THR 37 15.571 -6.165 1.428 256 HG23 THR 37 2HG2 THR 37 16.290 -4.556 1.482 257 H GLY 38 H GLY 38 16.424 -8.398 3.326 258 HA2 GLY 38 2HA GLY 38 16.807 -9.472 0.701 259 HA3 GLY 38 1HA GLY 38 17.710 -10.338 1.940 260 H ALA 39 H ALA 39 14.919 -10.285 0.305 261 HA ALA 39 HA ALA 39 12.913 -10.806 2.219 262 HB1 ALA 39 1HB ALA 39 12.439 -10.114 -0.089 263 HB2 ALA 39 2HB ALA 39 11.576 -11.589 0.351 264 HB3 ALA 39 3HB ALA 39 13.015 -11.679 -0.659 265 H GLU 40 H GLU 40 15.313 -12.847 0.807 266 HA GLU 40 HA GLU 40 14.087 -15.355 1.171 267 HB2 GLU 40 2HB GLU 40 16.293 -16.325 0.936 268 HB3 GLU 40 1HB GLU 40 16.021 -15.061 -0.255 269 HG2 GLU 40 2HG GLU 40 17.401 -13.532 0.963 270 HG3 GLU 40 1HG GLU 40 17.558 -14.674 2.297 271 H ASN 41 H ASN 41 15.252 -13.247 3.507 272 HA ASN 41 HA ASN 41 16.089 -15.199 5.460 273 HB2 ASN 41 2HB ASN 41 15.418 -12.270 5.756 274 HB3 ASN 41 1HB ASN 41 15.947 -13.282 7.089 275 HD21 ASN 41 1HD2 ASN 41 16.869 -11.539 4.280 276 HD22 ASN 41 2HD2 ASN 41 18.569 -11.730 4.473 277 H LEU 42 H LEU 42 13.103 -14.092 4.321 278 HA LEU 42 HA LEU 42 11.752 -14.969 6.746 279 HB2 LEU 42 2HB LEU 42 10.903 -13.021 4.624 280 HB3 LEU 42 1HB LEU 42 10.009 -13.464 6.058 281 HG LEU 42 HG LEU 42 12.646 -11.994 6.061 282 HD11 LEU 42 1HD1 LEU 42 10.889 -10.641 5.106 283 HD12 LEU 42 2HD1 LEU 42 11.310 -10.061 6.723 284 HD13 LEU 42 3HD1 LEU 42 9.840 -10.998 6.477 285 HD21 LEU 42 3HD2 LEU 42 12.170 -11.578 8.410 286 HD22 LEU 42 1HD2 LEU 42 12.261 -13.311 8.095 287 HD23 LEU 42 2HD2 LEU 42 10.689 -12.524 8.296 288 HA PRO 43 HA PRO 43 9.922 -17.993 3.943 289 HB2 PRO 43 2HB PRO 43 7.549 -18.352 5.297 290 HB3 PRO 43 1HB PRO 43 9.048 -19.164 5.746 291 HG2 PRO 43 2HG PRO 43 7.783 -16.731 6.932 292 HG3 PRO 43 1HG PRO 43 8.615 -18.065 7.743 293 HD2 PRO 43 2HD PRO 43 9.790 -15.681 7.317 294 HD3 PRO 43 1HD PRO 43 10.704 -17.204 7.290 295 H ALA 44 H ALA 44 8.798 -17.616 2.125 296 HA ALA 44 HA ALA 44 7.867 -15.108 1.478 297 HB1 ALA 44 1HB ALA 44 7.124 -17.682 0.112 298 HB2 ALA 44 2HB ALA 44 8.602 -16.761 -0.175 299 HB3 ALA 44 3HB ALA 44 7.035 -16.067 -0.586 300 H GLY 45 H GLY 45 6.060 -14.043 1.558 301 HA2 GLY 45 2HA GLY 45 3.479 -15.159 1.854 302 HA3 GLY 45 1HA GLY 45 4.090 -14.401 3.334 303 H SER 46 H SER 46 2.820 -13.861 0.268 304 HA SER 46 HA SER 46 3.686 -11.065 0.273 305 HB2 SER 46 2HB SER 46 2.272 -12.523 -1.932 306 HB3 SER 46 1HB SER 46 3.260 -11.071 -2.035 307 HG SER 46 HG SER 46 4.156 -13.667 -1.360 308 H ALA 47 H ALA 47 2.153 -9.429 -0.154 309 HA ALA 47 HA ALA 47 -0.676 -10.005 0.012 310 HB1 ALA 47 1HB ALA 47 0.734 -8.151 1.951 311 HB2 ALA 47 2HB ALA 47 -0.024 -9.688 2.365 312 HB3 ALA 47 3HB ALA 47 -1.013 -8.342 1.793 313 H LEU 48 H LEU 48 -1.918 -8.095 -0.766 314 HA LEU 48 HA LEU 48 -0.146 -6.350 -2.298 315 HB2 LEU 48 2HB LEU 48 -1.508 -6.433 -4.244 316 HB3 LEU 48 1HB LEU 48 -1.112 -8.074 -3.814 317 HG LEU 48 HG LEU 48 -3.788 -6.799 -3.215 318 HD11 LEU 48 1HD1 LEU 48 -3.415 -6.848 -5.616 319 HD12 LEU 48 2HD1 LEU 48 -4.615 -8.050 -5.150 320 HD13 LEU 48 3HD1 LEU 48 -2.965 -8.552 -5.523 321 HD21 LEU 48 3HD2 LEU 48 -4.538 -9.112 -2.968 322 HD22 LEU 48 1HD2 LEU 48 -3.232 -8.763 -1.835 323 HD23 LEU 48 2HD2 LEU 48 -2.904 -9.679 -3.308 324 H LEU 49 H LEU 49 -0.890 -4.359 -2.768 325 HA LEU 49 HA LEU 49 -3.373 -3.626 -1.503 326 HB2 LEU 49 2HB LEU 49 -2.389 -1.440 -0.793 327 HB3 LEU 49 1HB LEU 49 -1.782 -2.815 0.083 328 HG LEU 49 HG LEU 49 -0.235 -1.386 -2.111 329 HD11 LEU 49 1HD1 LEU 49 1.030 -0.379 -0.283 330 HD12 LEU 49 2HD1 LEU 49 -0.031 -1.159 0.888 331 HD13 LEU 49 3HD1 LEU 49 -0.672 0.076 -0.188 332 HD21 LEU 49 3HD2 LEU 49 1.699 -2.549 -1.159 333 HD22 LEU 49 1HD2 LEU 49 0.495 -3.713 -1.706 334 HD23 LEU 49 2HD2 LEU 49 0.655 -3.350 0.013 335 H VAL 50 H VAL 50 -4.632 -2.371 -2.626 336 HA VAL 50 HA VAL 50 -3.693 -1.745 -5.327 337 HB VAL 50 HB VAL 50 -6.027 -1.788 -6.061 338 HG11 VAL 50 1HG1 VAL 50 -6.590 -4.146 -5.715 339 HG12 VAL 50 2HG1 VAL 50 -5.391 -4.234 -4.429 340 HG13 VAL 50 3HG1 VAL 50 -4.882 -3.925 -6.086 341 HG21 VAL 50 3HG2 VAL 50 -6.756 -2.475 -3.217 342 HG22 VAL 50 1HG2 VAL 50 -7.873 -2.433 -4.582 343 HG23 VAL 50 2HG2 VAL 50 -7.106 -0.943 -4.023 344 H VAL 51 H VAL 51 -3.918 0.302 -6.096 345 HA VAL 51 HA VAL 51 -4.514 2.340 -4.067 346 HB VAL 51 HB VAL 51 -3.503 2.726 -6.896 347 HG11 VAL 51 1HG1 VAL 51 -2.751 4.900 -6.066 348 HG12 VAL 51 2HG1 VAL 51 -3.435 4.526 -4.486 349 HG13 VAL 51 3HG1 VAL 51 -4.493 4.697 -5.884 350 HG21 VAL 51 3HG2 VAL 51 -1.869 2.497 -4.369 351 HG22 VAL 51 1HG2 VAL 51 -1.249 2.964 -5.949 352 HG23 VAL 51 2HG2 VAL 51 -1.898 1.343 -5.703 353 H LYS 52 H LYS 52 -6.450 2.962 -3.875 354 HA LYS 52 HA LYS 52 -8.444 2.446 -5.858 355 HB2 LYS 52 2HB LYS 52 -8.628 2.649 -3.221 356 HB3 LYS 52 1HB LYS 52 -8.772 4.365 -3.550 357 HG2 LYS 52 2HG LYS 52 -10.623 2.209 -4.567 358 HG3 LYS 52 1HG LYS 52 -10.954 3.303 -3.235 359 HD2 LYS 52 2HD LYS 52 -10.940 5.194 -4.745 360 HD3 LYS 52 1HD LYS 52 -10.460 4.154 -6.085 361 HE2 LYS 52 2HE LYS 52 -13.039 4.015 -4.542 362 HE3 LYS 52 1HE LYS 52 -12.831 4.637 -6.178 363 HZ1 LYS 52 3HZ LYS 52 -12.092 2.396 -6.848 364 HZ2 LYS 52 1HZ LYS 52 -13.670 2.379 -6.246 365 HZ3 LYS 52 2HZ LYS 52 -12.409 1.836 -5.302 366 H ARG 53 H ARG 53 -6.717 5.208 -4.556 367 HA ARG 53 HA ARG 53 -6.607 6.516 -7.053 368 HB2 ARG 53 2HB ARG 53 -8.943 7.112 -6.208 369 HB3 ARG 53 1HB ARG 53 -8.147 7.930 -4.872 370 HG2 ARG 53 2HG ARG 53 -7.018 9.422 -6.429 371 HG3 ARG 53 1HG ARG 53 -7.778 8.593 -7.785 372 HD2 ARG 53 2HD ARG 53 -9.173 10.120 -5.599 373 HD3 ARG 53 1HD ARG 53 -8.974 10.628 -7.277 374 HE ARG 53 HE ARG 53 -10.252 8.168 -7.312 375 HH11 ARG 53 1HH1 ARG 53 -10.912 11.465 -6.241 376 HH12 ARG 53 2HH1 ARG 53 -12.604 11.304 -6.315 377 HH21 ARG 53 1HH2 ARG 53 -12.554 7.914 -7.434 378 HH22 ARG 53 2HH2 ARG 53 -13.574 9.201 -7.012 379 H GLY 54 H GLY 54 -4.694 7.526 -7.000 380 HA2 GLY 54 2HA GLY 54 -3.699 9.174 -5.131 381 HA3 GLY 54 1HA GLY 54 -3.315 7.585 -4.509 382 HA PRO 55 HA PRO 55 -0.527 9.050 -8.294 383 HB2 PRO 55 2HB PRO 55 0.967 10.617 -6.276 384 HB3 PRO 55 1HB PRO 55 0.644 10.995 -7.965 385 HG2 PRO 55 2HG PRO 55 -0.711 12.273 -6.100 386 HG3 PRO 55 1HG PRO 55 -1.550 11.676 -7.542 387 HD2 PRO 55 2HD PRO 55 -1.477 10.506 -4.783 388 HD3 PRO 55 1HD PRO 55 -2.847 10.723 -5.903 389 H ASN 56 H ASN 56 -0.254 7.752 -5.222 390 HA ASN 56 HA ASN 56 2.310 6.845 -4.759 391 HB2 ASN 56 2HB ASN 56 0.613 6.236 -3.204 392 HB3 ASN 56 1HB ASN 56 -0.360 5.458 -4.441 393 HD21 ASN 56 1HD2 ASN 56 2.269 5.057 -2.182 394 HD22 ASN 56 2HD2 ASN 56 2.464 3.365 -2.476 395 H ALA 57 H ALA 57 -0.036 5.371 -6.978 396 HA ALA 57 HA ALA 57 1.995 4.447 -8.746 397 HB1 ALA 57 1HB ALA 57 0.544 2.314 -7.157 398 HB2 ALA 57 2HB ALA 57 2.252 2.715 -7.006 399 HB3 ALA 57 3HB ALA 57 1.637 2.029 -8.513 400 H GLY 58 H GLY 58 -1.294 3.886 -7.597 401 HA2 GLY 58 2HA GLY 58 -3.304 4.088 -8.769 402 HA3 GLY 58 1HA GLY 58 -2.370 4.525 -10.201 403 H ALA 59 H ALA 59 -1.602 1.717 -8.381 404 HA ALA 59 HA ALA 59 -2.918 -0.113 -10.216 405 HB1 ALA 59 1HB ALA 59 -0.760 -1.234 -10.696 406 HB2 ALA 59 2HB ALA 59 0.084 0.048 -9.829 407 HB3 ALA 59 3HB ALA 59 -0.781 0.417 -11.315 408 H ARG 60 H ARG 60 -1.323 -2.272 -9.295 409 HA ARG 60 HA ARG 60 -1.732 -2.180 -6.404 410 HB2 ARG 60 2HB ARG 60 -2.702 -4.387 -6.331 411 HB3 ARG 60 1HB ARG 60 -3.607 -3.442 -7.503 412 HG2 ARG 60 2HG ARG 60 -1.449 -5.384 -8.301 413 HG3 ARG 60 1HG ARG 60 -3.132 -5.857 -8.107 414 HD2 ARG 60 2HD ARG 60 -3.790 -4.301 -9.860 415 HD3 ARG 60 1HD ARG 60 -2.136 -3.717 -9.992 416 HE ARG 60 HE ARG 60 -1.486 -5.844 -10.806 417 HH11 ARG 60 1HH1 ARG 60 -4.997 -5.346 -10.702 418 HH12 ARG 60 2HH1 ARG 60 -5.327 -6.459 -11.949 419 HH21 ARG 60 1HH2 ARG 60 -1.973 -7.391 -12.509 420 HH22 ARG 60 2HH2 ARG 60 -3.590 -7.668 -12.967 421 H PHE 61 H PHE 61 -0.160 -3.225 -5.240 422 HA PHE 61 HA PHE 61 1.746 -4.774 -6.748 423 HB2 PHE 61 2HB PHE 61 3.709 -3.602 -5.824 424 HB3 PHE 61 1HB PHE 61 2.743 -2.550 -6.834 425 HD1 PHE 61 1HD PHE 61 1.285 -0.809 -5.707 426 HD2 PHE 61 2HD PHE 61 4.216 -3.068 -3.603 427 HE1 PHE 61 1HE PHE 61 1.300 0.883 -3.919 428 HE2 PHE 61 2HE PHE 61 4.229 -1.388 -1.808 429 HZ PHE 61 HZ PHE 61 2.770 0.591 -1.966 430 H LEU 62 H LEU 62 3.107 -6.066 -5.460 431 HA LEU 62 HA LEU 62 1.773 -6.799 -2.978 432 HB2 LEU 62 2HB LEU 62 3.396 -8.413 -4.938 433 HB3 LEU 62 1HB LEU 62 3.087 -8.986 -3.317 434 HG LEU 62 HG LEU 62 0.641 -8.901 -3.830 435 HD11 LEU 62 1HD1 LEU 62 1.553 -8.484 -6.673 436 HD12 LEU 62 2HD1 LEU 62 0.646 -7.335 -5.691 437 HD13 LEU 62 3HD1 LEU 62 -0.091 -8.866 -6.162 438 HD21 LEU 62 3HD2 LEU 62 2.311 -10.696 -5.571 439 HD22 LEU 62 1HD2 LEU 62 0.626 -10.963 -5.137 440 HD23 LEU 62 2HD2 LEU 62 1.869 -10.984 -3.888 441 H LEU 63 H LEU 63 2.910 -6.952 -1.137 442 HA LEU 63 HA LEU 63 5.439 -5.622 -1.054 443 HB2 LEU 63 2HB LEU 63 4.079 -7.295 1.069 444 HB3 LEU 63 1HB LEU 63 5.470 -6.267 1.327 445 HG LEU 63 HG LEU 63 2.696 -5.336 0.601 446 HD11 LEU 63 1HD1 LEU 63 2.862 -6.138 2.881 447 HD12 LEU 63 2HD1 LEU 63 2.697 -4.381 2.849 448 HD13 LEU 63 3HD1 LEU 63 4.270 -5.113 3.160 449 HD21 LEU 63 3HD2 LEU 63 3.590 -3.072 0.990 450 HD22 LEU 63 1HD2 LEU 63 4.386 -3.863 -0.373 451 HD23 LEU 63 2HD2 LEU 63 5.204 -3.752 1.184 452 H ASP 64 H ASP 64 7.182 -6.517 -1.792 453 HA ASP 64 HA ASP 64 7.606 -9.422 -1.477 454 HB2 ASP 64 2HB ASP 64 8.730 -7.531 -3.567 455 HB3 ASP 64 1HB ASP 64 9.156 -9.223 -3.415 456 H GLN 65 H GLN 65 8.299 -6.674 -0.050 457 HA GLN 65 HA GLN 65 11.150 -7.281 0.264 458 HB2 GLN 65 2HB GLN 65 9.948 -4.505 0.445 459 HB3 GLN 65 1HB GLN 65 11.639 -4.927 0.579 460 HG2 GLN 65 2HG GLN 65 11.420 -4.000 -1.547 461 HG3 GLN 65 1HG GLN 65 11.481 -5.734 -1.826 462 HE21 GLN 65 1HE2 GLN 65 8.606 -4.023 -0.665 463 HE22 GLN 65 2HE2 GLN 65 7.703 -4.194 -2.123 464 HA PRO 66 HA PRO 66 10.121 -7.905 4.573 465 HB2 PRO 66 2HB PRO 66 12.778 -7.021 5.282 466 HB3 PRO 66 1HB PRO 66 12.110 -8.646 5.363 467 HG2 PRO 66 2HG PRO 66 13.962 -7.592 3.478 468 HG3 PRO 66 1HG PRO 66 13.284 -9.218 3.545 469 HD2 PRO 66 2HD PRO 66 12.778 -7.186 1.638 470 HD3 PRO 66 1HD PRO 66 11.995 -8.770 1.755 471 H THR 67 H THR 67 12.014 -5.174 3.541 472 HA THR 67 HA THR 67 10.400 -3.472 5.263 473 HB THR 67 HB THR 67 13.372 -3.182 4.682 474 HG1 THR 67 1HG THR 67 13.020 -4.676 6.313 475 HG21 THR 67 3HG2 THR 67 11.552 -1.411 6.334 476 HG22 THR 67 1HG2 THR 67 12.238 -0.990 4.764 477 HG23 THR 67 2HG2 THR 67 13.297 -1.222 6.152 478 H THR 68 H THR 68 9.022 -2.602 3.813 479 HA THR 68 HA THR 68 10.076 -1.608 1.265 480 HB THR 68 HB THR 68 7.224 -2.129 2.165 481 HG1 THR 68 1HG THR 68 8.373 -4.079 1.972 482 HG21 THR 68 3HG2 THR 68 8.359 -1.586 -0.586 483 HG22 THR 68 1HG2 THR 68 7.399 -0.461 0.373 484 HG23 THR 68 2HG2 THR 68 6.670 -1.950 -0.228 485 H THR 69 H THR 69 10.540 0.572 1.462 486 HA THR 69 HA THR 69 8.930 2.126 3.345 487 HB THR 69 HB THR 69 11.503 3.009 2.048 488 HG1 THR 69 1HG THR 69 11.455 1.947 4.688 489 HG21 THR 69 3HG2 THR 69 10.142 4.735 3.143 490 HG22 THR 69 1HG2 THR 69 11.639 4.458 4.037 491 HG23 THR 69 2HG2 THR 69 10.119 3.784 4.625 492 H ALA 70 H ALA 70 7.433 3.417 2.536 493 HA ALA 70 HA ALA 70 7.407 4.031 -0.314 494 HB1 ALA 70 1HB ALA 70 5.066 4.733 0.202 495 HB2 ALA 70 2HB ALA 70 5.346 4.276 1.877 496 HB3 ALA 70 3HB ALA 70 5.394 3.050 0.612 497 H GLY 71 H GLY 71 8.070 6.034 -0.969 498 HA2 GLY 71 2HA GLY 71 7.511 8.324 0.673 499 HA3 GLY 71 1HA GLY 71 9.218 7.933 0.537 500 H ARG 72 H ARG 72 8.777 10.249 -0.335 501 HA ARG 72 HA ARG 72 8.510 10.104 -3.249 502 HB2 ARG 72 2HB ARG 72 6.854 11.578 -2.310 503 HB3 ARG 72 1HB ARG 72 8.045 12.401 -1.321 504 HG2 ARG 72 2HG ARG 72 7.337 13.788 -3.195 505 HG3 ARG 72 1HG ARG 72 9.037 13.358 -3.368 506 HD2 ARG 72 2HD ARG 72 8.486 11.671 -4.989 507 HD3 ARG 72 1HD ARG 72 6.766 11.932 -4.730 508 HE ARG 72 HE ARG 72 8.011 14.339 -5.519 509 HH11 ARG 72 1HH1 ARG 72 7.143 11.219 -6.876 510 HH12 ARG 72 2HH1 ARG 72 6.763 11.815 -8.433 511 HH21 ARG 72 1HH2 ARG 72 7.554 15.176 -7.641 512 HH22 ARG 72 2HH2 ARG 72 7.046 14.132 -8.885 513 H HIS 73 H HIS 73 10.594 9.366 -3.424 514 HA HIS 73 HA HIS 73 12.558 11.256 -3.980 515 HB2 HIS 73 2HB HIS 73 12.592 10.254 -1.250 516 HB3 HIS 73 1HB HIS 73 14.021 9.699 -2.111 517 HD1 HIS 73 1HD HIS 73 12.305 12.904 -1.037 518 HD2 HIS 73 2HD HIS 73 15.923 11.594 -2.581 519 HE1 HIS 73 1HE HIS 73 13.888 14.856 -0.856 520 HA PRO 74 HA PRO 74 13.581 7.777 -6.564 521 HB2 PRO 74 2HB PRO 74 16.428 8.542 -6.158 522 HB3 PRO 74 1HB PRO 74 15.535 8.305 -7.666 523 HG2 PRO 74 2HG PRO 74 16.123 10.751 -6.833 524 HG3 PRO 74 1HG PRO 74 14.549 10.406 -7.568 525 HD2 PRO 74 2HD PRO 74 15.259 10.798 -4.689 526 HD3 PRO 74 1HD PRO 74 13.822 11.328 -5.590 527 H GLU 75 H GLU 75 15.725 8.239 -3.740 528 HA GLU 75 HA GLU 75 16.029 5.395 -3.663 529 HB2 GLU 75 2HB GLU 75 17.568 5.778 -1.682 530 HB3 GLU 75 1HB GLU 75 18.119 6.342 -3.244 531 HG2 GLU 75 2HG GLU 75 16.785 8.190 -1.300 532 HG3 GLU 75 1HG GLU 75 18.503 7.821 -1.181 533 H SER 76 H SER 76 13.820 5.379 -3.437 534 HA SER 76 HA SER 76 13.170 4.679 -0.663 535 HB2 SER 76 2HB SER 76 11.208 5.768 -2.724 536 HB3 SER 76 1HB SER 76 10.846 5.370 -1.045 537 HG SER 76 HG SER 76 12.196 7.512 -2.153 538 H ASP 77 H ASP 77 11.598 2.742 -0.729 539 HA ASP 77 HA ASP 77 12.554 0.906 -2.673 540 HB2 ASP 77 2HB ASP 77 11.744 0.191 -0.415 541 HB3 ASP 77 1HB ASP 77 10.099 0.567 -0.930 542 H ILE 78 H ILE 78 9.524 2.619 -2.312 543 HA ILE 78 HA ILE 78 9.260 2.578 -5.186 544 HB ILE 78 HB ILE 78 6.819 2.370 -5.142 545 HG12 ILE 78 2HG1 ILE 78 6.350 3.202 -2.838 546 HG13 ILE 78 1HG1 ILE 78 5.483 1.723 -3.208 547 HG21 ILE 78 1HG2 ILE 78 7.980 0.357 -5.586 548 HG22 ILE 78 2HG2 ILE 78 6.532 -0.009 -4.649 549 HG23 ILE 78 3HG2 ILE 78 8.111 -0.004 -3.865 550 HD11 ILE 78 3HD1 ILE 78 7.958 1.967 -1.512 551 HD12 ILE 78 1HD1 ILE 78 7.113 0.463 -1.875 552 HD13 ILE 78 2HD1 ILE 78 6.309 1.721 -0.936 553 H PHE 79 H PHE 79 8.560 4.559 -5.986 554 HA PHE 79 HA PHE 79 8.283 6.529 -3.868 555 HB2 PHE 79 2HB PHE 79 9.165 8.275 -5.395 556 HB3 PHE 79 1HB PHE 79 10.325 7.003 -5.078 557 HD1 PHE 79 2HD PHE 79 8.191 8.591 -7.591 558 HD2 PHE 79 1HD PHE 79 11.060 5.536 -6.856 559 HE1 PHE 79 2HE PHE 79 8.543 8.346 -10.010 560 HE2 PHE 79 1HE PHE 79 11.422 5.291 -9.273 561 HZ PHE 79 HZ PHE 79 10.160 6.699 -10.857 562 H LEU 80 H LEU 80 6.605 7.596 -3.631 563 HA LEU 80 HA LEU 80 4.334 7.226 -5.329 564 HB2 LEU 80 2HB LEU 80 4.772 8.843 -2.807 565 HB3 LEU 80 1HB LEU 80 3.229 8.707 -3.618 566 HG LEU 80 HG LEU 80 3.229 6.256 -3.124 567 HD11 LEU 80 1HD1 LEU 80 5.655 5.940 -2.907 568 HD12 LEU 80 2HD1 LEU 80 4.708 5.270 -1.599 569 HD13 LEU 80 3HD1 LEU 80 5.593 6.786 -1.352 570 HD21 LEU 80 3HD2 LEU 80 3.476 8.087 -0.756 571 HD22 LEU 80 1HD2 LEU 80 2.767 6.469 -0.733 572 HD23 LEU 80 2HD2 LEU 80 2.026 7.737 -1.701 573 H ASP 81 H ASP 81 3.516 8.770 -6.721 574 HA ASP 81 HA ASP 81 5.391 10.908 -7.294 575 HB2 ASP 81 2HB ASP 81 4.558 9.269 -9.024 576 HB3 ASP 81 1HB ASP 81 3.001 10.089 -8.945 577 H ASP 82 H ASP 82 3.946 11.367 -4.996 578 HA ASP 82 HA ASP 82 2.303 13.677 -5.824 579 HB2 ASP 82 2HB ASP 82 0.921 11.803 -4.719 580 HB3 ASP 82 1HB ASP 82 1.809 12.148 -3.250 581 H VAL 83 H VAL 83 2.421 15.500 -4.391 582 HA VAL 83 HA VAL 83 5.131 15.757 -3.372 583 HB VAL 83 HB VAL 83 4.760 18.175 -3.386 584 HG11 VAL 83 1HG1 VAL 83 5.586 17.126 -5.408 585 HG12 VAL 83 2HG1 VAL 83 4.532 18.483 -5.811 586 HG13 VAL 83 3HG1 VAL 83 3.933 16.831 -5.950 587 HG21 VAL 83 3HG2 VAL 83 2.380 18.209 -2.829 588 HG22 VAL 83 1HG2 VAL 83 1.995 17.517 -4.403 589 HG23 VAL 83 2HG2 VAL 83 2.694 19.133 -4.298 590 H THR 84 H THR 84 2.119 15.111 -2.012 591 HA THR 84 HA THR 84 2.582 16.606 0.435 592 HB THR 84 HB THR 84 0.269 15.924 -0.606 593 HG1 THR 84 1HG THR 84 -0.381 15.362 1.773 594 HG21 THR 84 3HG2 THR 84 0.703 13.518 -0.823 595 HG22 THR 84 1HG2 THR 84 -0.649 13.806 0.275 596 HG23 THR 84 2HG2 THR 84 0.939 13.391 0.920 597 H VAL 85 H VAL 85 3.732 13.829 -0.945 598 HA VAL 85 HA VAL 85 3.971 12.174 1.400 599 HB VAL 85 HB VAL 85 5.120 11.863 -1.382 600 HG11 VAL 85 1HG1 VAL 85 5.385 9.512 -0.848 601 HG12 VAL 85 2HG1 VAL 85 4.701 9.782 0.748 602 HG13 VAL 85 3HG1 VAL 85 6.267 10.493 0.331 603 HG21 VAL 85 3HG2 VAL 85 2.696 11.993 -1.387 604 HG22 VAL 85 1HG2 VAL 85 2.614 10.694 -0.201 605 HG23 VAL 85 2HG2 VAL 85 3.249 10.373 -1.820 606 H SER 86 H SER 86 5.738 12.001 2.643 607 HA SER 86 HA SER 86 7.875 13.926 2.386 608 HB2 SER 86 2HB SER 86 7.313 11.775 4.429 609 HB3 SER 86 1HB SER 86 8.566 13.003 4.576 610 HG SER 86 HG SER 86 6.346 14.253 3.993 611 H ARG 87 H ARG 87 10.134 12.829 3.234 612 HA ARG 87 HA ARG 87 11.335 11.361 1.185 613 HB2 ARG 87 2HB ARG 87 12.597 12.604 2.890 614 HB3 ARG 87 1HB ARG 87 12.003 11.530 4.133 615 HG2 ARG 87 2HG ARG 87 14.263 10.961 3.666 616 HG3 ARG 87 1HG ARG 87 13.231 9.666 3.065 617 HD2 ARG 87 2HD ARG 87 13.431 10.608 0.801 618 HD3 ARG 87 1HD ARG 87 14.517 11.848 1.433 619 HE ARG 87 HE ARG 87 15.063 8.980 1.627 620 HH11 ARG 87 1HH1 ARG 87 16.133 12.247 0.728 621 HH12 ARG 87 2HH1 ARG 87 17.754 11.833 0.491 622 HH21 ARG 87 1HH2 ARG 87 17.340 8.379 1.285 623 HH22 ARG 87 2HH2 ARG 87 18.460 9.572 0.799 624 H ARG 88 H ARG 88 10.182 10.339 4.344 625 HA ARG 88 HA ARG 88 9.563 7.693 3.282 626 HB2 ARG 88 2HB ARG 88 10.506 8.400 6.091 627 HB3 ARG 88 1HB ARG 88 10.037 6.804 5.539 628 HG2 ARG 88 2HG ARG 88 11.965 6.766 4.011 629 HG3 ARG 88 1HG ARG 88 12.427 8.370 4.574 630 HD2 ARG 88 2HD ARG 88 12.724 7.522 6.833 631 HD3 ARG 88 1HD ARG 88 12.187 5.926 6.320 632 HE ARG 88 HE ARG 88 14.574 7.105 5.082 633 HH11 ARG 88 1HH1 ARG 88 13.212 4.636 7.250 634 HH12 ARG 88 2HH1 ARG 88 14.571 3.627 7.179 635 HH21 ARG 88 1HH2 ARG 88 16.468 5.782 5.088 636 HH22 ARG 88 2HH2 ARG 88 16.506 4.315 5.949 637 H HIS 89 H HIS 89 7.391 7.576 3.258 638 HA HIS 89 HA HIS 89 5.872 9.398 4.993 639 HB2 HIS 89 2HB HIS 89 5.513 9.470 2.546 640 HB3 HIS 89 1HB HIS 89 4.972 7.798 2.580 641 HD2 HIS 89 2HD HIS 89 2.516 7.504 4.222 642 HE1 HIS 89 1HE HIS 89 1.341 11.441 3.243 643 HE2 HIS 89 2HE HIS 89 0.770 9.351 4.543 644 H ALA 90 H ALA 90 5.868 6.033 3.869 645 HA ALA 90 HA ALA 90 4.905 5.213 6.473 646 HB1 ALA 90 1HB ALA 90 3.479 4.502 3.898 647 HB2 ALA 90 2HB ALA 90 2.837 5.515 5.193 648 HB3 ALA 90 3HB ALA 90 3.139 3.804 5.481 649 H GLU 91 H GLU 91 5.557 3.138 6.951 650 HA GLU 91 HA GLU 91 7.103 1.897 4.817 651 HB2 GLU 91 2HB GLU 91 8.573 2.922 6.547 652 HB3 GLU 91 1HB GLU 91 7.839 1.873 7.749 653 HG2 GLU 91 2HG GLU 91 8.770 -0.064 6.759 654 HG3 GLU 91 1HG GLU 91 9.252 0.822 5.316 655 H PHE 92 H PHE 92 6.678 -0.056 4.373 656 HA PHE 92 HA PHE 92 4.669 -1.497 5.947 657 HB2 PHE 92 2HB PHE 92 5.401 -1.707 3.007 658 HB3 PHE 92 1HB PHE 92 4.191 -2.686 3.817 659 HD1 PHE 92 1HD PHE 92 5.019 0.722 2.655 660 HD2 PHE 92 2HD PHE 92 1.991 -1.873 4.139 661 HE1 PHE 92 1HE PHE 92 3.307 2.381 2.045 662 HE2 PHE 92 2HE PHE 92 0.273 -0.216 3.538 663 HZ PHE 92 HZ PHE 92 0.931 1.912 2.488 664 H ARG 93 H ARG 93 5.638 -3.072 7.093 665 HA ARG 93 HA ARG 93 7.970 -4.314 5.848 666 HB2 ARG 93 2HB ARG 93 7.458 -3.978 8.803 667 HB3 ARG 93 1HB ARG 93 8.836 -4.794 8.083 668 HG2 ARG 93 2HG ARG 93 9.429 -2.593 6.996 669 HG3 ARG 93 1HG ARG 93 8.179 -1.864 8.009 670 HD2 ARG 93 2HD ARG 93 10.293 -1.602 9.109 671 HD3 ARG 93 1HD ARG 93 9.338 -2.786 10.003 672 HE ARG 93 HE ARG 93 11.491 -3.486 8.116 673 HH11 ARG 93 1HH1 ARG 93 9.647 -4.248 11.083 674 HH12 ARG 93 2HH1 ARG 93 10.720 -5.432 11.603 675 HH21 ARG 93 1HH2 ARG 93 12.978 -5.165 8.866 676 HH22 ARG 93 2HH2 ARG 93 12.661 -5.967 10.323 677 H ILE 94 H ILE 94 8.179 -6.484 6.031 678 HA ILE 94 HA ILE 94 5.841 -7.843 7.064 679 HB ILE 94 HB ILE 94 5.833 -8.045 4.615 680 HG12 ILE 94 2HG1 ILE 94 5.139 -10.077 5.997 681 HG13 ILE 94 1HG1 ILE 94 5.506 -10.376 4.312 682 HG21 ILE 94 1HG2 ILE 94 8.107 -7.671 4.082 683 HG22 ILE 94 2HG2 ILE 94 7.566 -9.177 3.337 684 HG23 ILE 94 3HG2 ILE 94 8.572 -9.224 4.785 685 HD11 ILE 94 3HD1 ILE 94 7.294 -10.987 6.665 686 HD12 ILE 94 1HD1 ILE 94 7.681 -11.310 4.973 687 HD13 ILE 94 2HD1 ILE 94 6.340 -12.153 5.746 688 H ASN 95 H ASN 95 6.189 -9.076 8.606 689 HA ASN 95 HA ASN 95 8.921 -9.747 9.367 690 HB2 ASN 95 2HB ASN 95 7.769 -8.242 10.940 691 HB3 ASN 95 1HB ASN 95 6.402 -9.339 11.013 692 HD21 ASN 95 1HD2 ASN 95 6.584 -9.485 13.226 693 HD22 ASN 95 2HD2 ASN 95 7.823 -10.384 14.013 694 H GLU 96 H GLU 96 9.283 -11.848 10.027 695 HA GLU 96 HA GLU 96 8.077 -13.894 8.633 696 HB2 GLU 96 2HB GLU 96 9.293 -15.412 10.229 697 HB3 GLU 96 1HB GLU 96 10.292 -14.181 9.478 698 HG2 GLU 96 2HG GLU 96 9.747 -12.834 11.659 699 HG3 GLU 96 1HG GLU 96 9.404 -14.436 12.309 700 H GLY 97 H GLY 97 7.014 -12.484 11.582 701 HA2 GLY 97 2HA GLY 97 5.118 -14.625 12.067 702 HA3 GLY 97 1HA GLY 97 5.335 -13.187 13.057 703 H GLU 98 H GLU 98 4.945 -11.086 11.223 704 HA GLU 98 HA GLU 98 2.357 -11.493 9.960 705 HB2 GLU 98 2HB GLU 98 2.803 -9.717 12.336 706 HB3 GLU 98 1HB GLU 98 1.449 -9.530 11.241 707 HG2 GLU 98 2HG GLU 98 0.671 -11.758 11.822 708 HG3 GLU 98 1HG GLU 98 2.074 -11.962 12.873 709 H PHE 99 H PHE 99 1.541 -9.272 9.145 710 HA PHE 99 HA PHE 99 3.753 -7.792 7.902 711 HB2 PHE 99 2HB PHE 99 0.787 -7.850 7.357 712 HB3 PHE 99 1HB PHE 99 1.920 -6.834 6.475 713 HD1 PHE 99 2HD PHE 99 0.907 -10.321 7.191 714 HD2 PHE 99 1HD PHE 99 3.045 -7.709 4.606 715 HE1 PHE 99 2HE PHE 99 1.132 -12.130 5.562 716 HE2 PHE 99 1HE PHE 99 3.266 -9.520 2.960 717 HZ PHE 99 HZ PHE 99 2.309 -11.736 3.439 718 H GLU 100 H GLU 100 4.104 -5.657 8.474 719 HA GLU 100 HA GLU 100 2.145 -4.436 10.279 720 HB2 GLU 100 2HB GLU 100 3.934 -5.473 11.595 721 HB3 GLU 100 1HB GLU 100 5.129 -4.557 10.699 722 HG2 GLU 100 2HG GLU 100 4.315 -2.494 11.626 723 HG3 GLU 100 1HG GLU 100 2.990 -3.337 12.429 724 H VAL 101 H VAL 101 1.658 -2.427 9.752 725 HA VAL 101 HA VAL 101 3.525 -0.978 8.031 726 HB VAL 101 HB VAL 101 1.555 -1.456 6.694 727 HG11 VAL 101 1HG1 VAL 101 -0.090 -0.184 8.877 728 HG12 VAL 101 2HG1 VAL 101 -0.063 -1.896 8.457 729 HG13 VAL 101 3HG1 VAL 101 -0.700 -0.714 7.307 730 HG21 VAL 101 3HG2 VAL 101 1.510 1.420 7.614 731 HG22 VAL 101 1HG2 VAL 101 0.790 0.814 6.121 732 HG23 VAL 101 2HG2 VAL 101 2.537 0.744 6.354 733 H VAL 102 H VAL 102 4.373 0.747 8.842 734 HA VAL 102 HA VAL 102 2.970 2.148 11.006 735 HB VAL 102 HB VAL 102 5.190 2.825 11.918 736 HG11 VAL 102 1HG1 VAL 102 5.794 0.671 12.923 737 HG12 VAL 102 2HG1 VAL 102 4.800 -0.155 11.722 738 HG13 VAL 102 3HG1 VAL 102 4.049 0.925 12.898 739 HG21 VAL 102 3HG2 VAL 102 6.548 2.604 9.895 740 HG22 VAL 102 1HG2 VAL 102 6.316 0.854 9.917 741 HG23 VAL 102 2HG2 VAL 102 7.228 1.636 11.205 742 H ASP 103 H ASP 103 2.724 4.376 10.769 743 HA ASP 103 HA ASP 103 3.714 5.416 8.245 744 HB2 ASP 103 2HB ASP 103 2.346 7.326 8.535 745 HB3 ASP 103 1HB ASP 103 1.383 6.017 9.196 746 H VAL 104 H VAL 104 5.217 6.962 8.042 747 HA VAL 104 HA VAL 104 6.529 7.866 10.493 748 HB VAL 104 HB VAL 104 8.737 7.800 9.220 749 HG11 VAL 104 1HG1 VAL 104 8.199 6.109 10.908 750 HG12 VAL 104 2HG1 VAL 104 9.122 5.404 9.582 751 HG13 VAL 104 3HG1 VAL 104 7.381 5.141 9.681 752 HG21 VAL 104 3HG2 VAL 104 7.856 7.623 6.958 753 HG22 VAL 104 1HG2 VAL 104 7.144 6.057 7.345 754 HG23 VAL 104 2HG2 VAL 104 8.896 6.241 7.325 755 H GLY 105 H GLY 105 4.596 8.805 8.349 756 HA2 GLY 105 2HA GLY 105 5.464 11.531 8.357 757 HA3 GLY 105 1HA GLY 105 5.438 10.798 6.755 758 H SER 106 H SER 106 3.385 11.067 9.630 759 HA SER 106 HA SER 106 1.075 10.956 7.904 760 HB2 SER 106 2HB SER 106 1.094 9.742 10.089 761 HB3 SER 106 1HB SER 106 1.166 11.302 10.907 762 HG SER 106 HG SER 106 -0.874 11.475 10.663 763 H LEU 107 H LEU 107 1.603 12.891 6.786 764 HA LEU 107 HA LEU 107 1.544 15.389 8.229 765 HB2 LEU 107 2HB LEU 107 1.257 14.976 5.247 766 HB3 LEU 107 1HB LEU 107 1.531 16.502 6.044 767 HG LEU 107 HG LEU 107 3.565 15.983 5.117 768 HD11 LEU 107 1HD1 LEU 107 3.760 14.990 7.930 769 HD12 LEU 107 2HD1 LEU 107 3.848 16.663 7.380 770 HD13 LEU 107 3HD1 LEU 107 5.107 15.521 6.925 771 HD21 LEU 107 3HD2 LEU 107 3.111 13.708 4.429 772 HD22 LEU 107 1HD2 LEU 107 3.290 13.145 6.090 773 HD23 LEU 107 2HD2 LEU 107 4.677 13.808 5.232 774 H ASN 108 H ASN 108 -0.577 13.760 5.946 775 HA ASN 108 HA ASN 108 -2.722 15.671 6.601 776 HB2 ASN 108 2HB ASN 108 -2.800 13.523 4.479 777 HB3 ASN 108 1HB ASN 108 -3.849 14.909 4.633 778 HD21 ASN 108 1HD2 ASN 108 -1.597 16.792 5.111 779 HD22 ASN 108 2HD2 ASN 108 -0.827 16.957 3.587 780 H GLY 109 H GLY 109 -1.585 12.928 7.778 781 HA2 GLY 109 2HA GLY 109 -2.709 11.699 9.451 782 HA3 GLY 109 1HA GLY 109 -4.225 12.018 8.617 783 H THR 110 H THR 110 -2.326 9.605 9.427 784 HA THR 110 HA THR 110 -2.858 8.128 6.969 785 HB THR 110 HB THR 110 -1.185 7.260 9.384 786 HG1 THR 110 1HG THR 110 -0.110 8.902 8.514 787 HG21 THR 110 3HG2 THR 110 -2.043 5.415 7.992 788 HG22 THR 110 1HG2 THR 110 -0.299 5.589 7.797 789 HG23 THR 110 2HG2 THR 110 -1.394 6.194 6.552 790 H TYR 111 H TYR 111 -4.634 6.924 6.983 791 HA TYR 111 HA TYR 111 -5.880 6.330 9.601 792 HB2 TYR 111 2HB TYR 111 -7.365 7.051 7.080 793 HB3 TYR 111 1HB TYR 111 -8.050 6.725 8.655 794 HD1 TYR 111 2HD TYR 111 -7.693 8.391 10.501 795 HD2 TYR 111 1HD TYR 111 -6.598 9.175 6.476 796 HE1 TYR 111 2HE TYR 111 -7.650 10.799 10.984 797 HE2 TYR 111 1HE TYR 111 -6.556 11.575 6.942 798 HH TYR 111 HH TYR 111 -6.482 12.827 9.987 799 H VAL 112 H VAL 112 -6.748 4.375 9.810 800 HA VAL 112 HA VAL 112 -7.127 2.798 7.399 801 HB VAL 112 HB VAL 112 -5.311 1.734 8.675 802 HG11 VAL 112 1HG1 VAL 112 -5.589 0.892 10.957 803 HG12 VAL 112 2HG1 VAL 112 -7.159 1.682 11.053 804 HG13 VAL 112 3HG1 VAL 112 -5.695 2.650 10.879 805 HG21 VAL 112 3HG2 VAL 112 -6.857 0.219 7.580 806 HG22 VAL 112 1HG2 VAL 112 -7.889 0.201 9.010 807 HG23 VAL 112 2HG2 VAL 112 -6.272 -0.498 9.083 808 H ASN 113 H ASN 113 -9.174 2.658 6.983 809 HA ASN 113 HA ASN 113 -11.462 2.840 7.186 810 HB2 ASN 113 2HB ASN 113 -10.792 1.254 9.664 811 HB3 ASN 113 1HB ASN 113 -12.454 1.612 9.214 812 HD21 ASN 113 1HD2 ASN 113 -12.863 -0.584 8.984 813 HD22 ASN 113 2HD2 ASN 113 -12.240 -1.501 7.654 814 H ARG 114 H ARG 114 -10.141 5.082 7.896 815 HA ARG 114 HA ARG 114 -10.517 7.155 8.656 816 HB2 ARG 114 2HB ARG 114 -13.090 6.016 9.783 817 HB3 ARG 114 1HB ARG 114 -12.631 7.688 10.024 818 HG2 ARG 114 2HG ARG 114 -14.180 7.652 8.225 819 HG3 ARG 114 1HG ARG 114 -12.598 7.941 7.516 820 HD2 ARG 114 2HD ARG 114 -13.830 6.368 6.143 821 HD3 ARG 114 1HD ARG 114 -12.484 5.528 6.915 822 HE ARG 114 HE ARG 114 -14.760 5.248 8.523 823 HH11 ARG 114 1HH1 ARG 114 -13.555 4.093 5.385 824 HH12 ARG 114 2HH1 ARG 114 -14.530 2.693 5.421 825 HH21 ARG 114 1HH2 ARG 114 -16.072 3.274 8.501 826 HH22 ARG 114 2HH2 ARG 114 -15.918 2.215 7.174 827 H GLU 115 H GLU 115 -9.532 4.743 10.465 828 HA GLU 115 HA GLU 115 -9.391 6.193 12.998 829 HB2 GLU 115 2HB GLU 115 -8.534 3.424 12.156 830 HB3 GLU 115 1HB GLU 115 -8.264 4.087 13.758 831 HG2 GLU 115 2HG GLU 115 -10.995 3.907 12.559 832 HG3 GLU 115 1HG GLU 115 -10.261 2.558 13.424 833 HA PRO 116 HA PRO 116 -5.281 7.412 11.573 834 HB2 PRO 116 2HB PRO 116 -4.840 9.290 13.501 835 HB3 PRO 116 1HB PRO 116 -5.783 9.618 12.047 836 HG2 PRO 116 2HG PRO 116 -6.702 9.161 14.827 837 HG3 PRO 116 1HG PRO 116 -7.456 10.107 13.540 838 HD2 PRO 116 2HD PRO 116 -8.202 7.530 14.375 839 HD3 PRO 116 1HD PRO 116 -8.728 8.338 12.889 840 H ARG 117 H ARG 117 -4.202 5.551 12.096 841 HA ARG 117 HA ARG 117 -3.393 5.217 14.913 842 HB2 ARG 117 2HB ARG 117 -3.468 3.046 12.791 843 HB3 ARG 117 1HB ARG 117 -3.202 2.839 14.514 844 HG2 ARG 117 2HG ARG 117 -5.784 3.736 13.238 845 HG3 ARG 117 1HG ARG 117 -5.441 2.112 13.826 846 HD2 ARG 117 2HD ARG 117 -5.422 4.589 15.556 847 HD3 ARG 117 1HD ARG 117 -6.815 3.526 15.365 848 HE ARG 117 HE ARG 117 -4.710 1.929 16.123 849 HH11 ARG 117 1HH1 ARG 117 -6.609 4.568 17.524 850 HH12 ARG 117 2HH1 ARG 117 -6.342 4.122 19.133 851 HH21 ARG 117 1HH2 ARG 117 -4.365 1.279 18.362 852 HH22 ARG 117 2HH2 ARG 117 -5.044 2.207 19.610 853 H ASN 118 H ASN 118 -1.183 4.779 15.256 854 HA ASN 118 HA ASN 118 0.515 5.889 13.181 855 HB2 ASN 118 2HB ASN 118 0.788 6.610 15.527 856 HB3 ASN 118 1HB ASN 118 1.214 4.969 15.980 857 HD21 ASN 118 1HD2 ASN 118 2.346 6.541 13.005 858 HD22 ASN 118 2HD2 ASN 118 3.989 6.610 13.500 859 H ALA 119 H ALA 119 0.049 2.833 14.830 860 HA ALA 119 HA ALA 119 1.622 1.576 12.701 861 HB1 ALA 119 1HB ALA 119 2.954 1.557 14.777 862 HB2 ALA 119 2HB ALA 119 2.449 -0.068 14.316 863 HB3 ALA 119 3HB ALA 119 1.612 0.776 15.617 864 H GLN 120 H GLN 120 0.638 -0.187 11.842 865 HA GLN 120 HA GLN 120 -1.662 -1.247 13.246 866 HB2 GLN 120 2HB GLN 120 -2.575 0.462 11.757 867 HB3 GLN 120 1HB GLN 120 -1.759 -0.273 10.387 868 HG2 GLN 120 2HG GLN 120 -4.136 -0.810 10.390 869 HG3 GLN 120 1HG GLN 120 -3.156 -2.254 10.593 870 HE21 GLN 120 1HE2 GLN 120 -5.918 -1.834 11.263 871 HE22 GLN 120 2HE2 GLN 120 -6.090 -2.120 12.953 872 H VAL 121 H VAL 121 -2.160 -3.298 12.823 873 HA VAL 121 HA VAL 121 -0.128 -4.890 11.465 874 HB VAL 121 HB VAL 121 -2.534 -5.785 13.106 875 HG11 VAL 121 1HG1 VAL 121 -1.786 -7.487 11.539 876 HG12 VAL 121 2HG1 VAL 121 -1.420 -7.973 13.194 877 HG13 VAL 121 3HG1 VAL 121 -0.139 -7.352 12.152 878 HG21 VAL 121 3HG2 VAL 121 -0.969 -4.561 14.511 879 HG22 VAL 121 1HG2 VAL 121 0.359 -5.573 13.943 880 HG23 VAL 121 2HG2 VAL 121 -0.937 -6.279 14.910 881 H MET 122 H MET 122 -0.575 -5.866 9.589 882 HA MET 122 HA MET 122 -2.258 -4.919 7.700 883 HB2 MET 122 2HB MET 122 -0.498 -6.425 7.188 884 HB3 MET 122 1HB MET 122 -1.309 -7.768 7.984 885 HG2 MET 122 2HG MET 122 -2.405 -6.370 5.542 886 HG3 MET 122 1HG MET 122 -1.286 -7.719 5.440 887 HE1 MET 122 3HE MET 122 -1.894 -10.193 6.111 888 HE2 MET 122 1HE MET 122 -3.431 -10.687 6.824 889 HE3 MET 122 2HE MET 122 -2.318 -9.686 7.747 890 H GLN 123 H GLN 123 -4.336 -4.853 7.229 891 HA GLN 123 HA GLN 123 -6.080 -6.901 8.323 892 HB2 GLN 123 2HB GLN 123 -5.973 -4.270 9.167 893 HB3 GLN 123 1HB GLN 123 -7.206 -4.209 7.917 894 HG2 GLN 123 2HG GLN 123 -8.481 -5.911 9.050 895 HG3 GLN 123 1HG GLN 123 -7.228 -6.069 10.280 896 HE21 GLN 123 1HE2 GLN 123 -9.802 -4.139 9.057 897 HE22 GLN 123 2HE2 GLN 123 -9.933 -3.076 10.417 898 H THR 124 H THR 124 -7.183 -7.822 6.667 899 HA THR 124 HA THR 124 -6.705 -6.721 4.037 900 HB THR 124 HB THR 124 -5.989 -8.985 4.206 901 HG1 THR 124 1HG THR 124 -8.404 -9.465 2.939 902 HG21 THR 124 3HG2 THR 124 -7.527 -10.853 4.772 903 HG22 THR 124 1HG2 THR 124 -8.765 -9.671 5.196 904 HG23 THR 124 2HG2 THR 124 -7.262 -9.756 6.124 905 H GLY 125 H GLY 125 -8.147 -5.906 2.781 906 HA2 GLY 125 2HA GLY 125 -10.274 -5.749 1.760 907 HA3 GLY 125 1HA GLY 125 -10.982 -6.502 3.182 908 H ASP 126 H ASP 126 -8.794 -4.289 4.179 909 HA ASP 126 HA ASP 126 -10.937 -2.377 4.594 910 HB2 ASP 126 2HB ASP 126 -8.576 -3.056 6.340 911 HB3 ASP 126 1HB ASP 126 -9.581 -1.634 6.611 912 H GLU 127 H GLU 127 -10.016 -0.083 5.098 913 HA GLU 127 HA GLU 127 -8.442 0.490 2.695 914 HB2 GLU 127 2HB GLU 127 -9.640 2.686 2.652 915 HB3 GLU 127 1HB GLU 127 -10.666 1.282 2.376 916 HG2 GLU 127 2HG GLU 127 -11.463 1.385 4.666 917 HG3 GLU 127 1HG GLU 127 -10.378 2.734 4.984 918 H ILE 128 H ILE 128 -6.686 1.649 2.817 919 HA ILE 128 HA ILE 128 -6.029 2.906 5.373 920 HB ILE 128 HB ILE 128 -4.100 1.600 3.421 921 HG12 ILE 128 2HG1 ILE 128 -4.957 0.712 6.196 922 HG13 ILE 128 1HG1 ILE 128 -5.445 -0.050 4.688 923 HG21 ILE 128 1HG2 ILE 128 -3.121 3.532 4.565 924 HG22 ILE 128 2HG2 ILE 128 -2.391 2.033 5.143 925 HG23 ILE 128 3HG2 ILE 128 -3.595 2.864 6.127 926 HD11 ILE 128 3HD1 ILE 128 -3.099 -0.656 4.264 927 HD12 ILE 128 1HD1 ILE 128 -3.694 -1.324 5.787 928 HD13 ILE 128 2HD1 ILE 128 -2.649 0.097 5.793 929 H GLN 129 H GLN 129 -6.085 4.973 5.137 930 HA GLN 129 HA GLN 129 -5.494 6.208 2.563 931 HB2 GLN 129 2HB GLN 129 -7.552 7.003 3.534 932 HB3 GLN 129 1HB GLN 129 -6.764 7.320 5.071 933 HG2 GLN 129 2HG GLN 129 -5.413 9.079 4.012 934 HG3 GLN 129 1HG GLN 129 -6.224 8.770 2.482 935 HE21 GLN 129 1HE2 GLN 129 -6.063 11.168 4.190 936 HE22 GLN 129 2HE2 GLN 129 -7.688 11.620 4.533 937 H ILE 130 H ILE 130 -3.501 6.681 2.259 938 HA ILE 130 HA ILE 130 -1.929 7.529 4.532 939 HB ILE 130 HB ILE 130 0.077 7.232 2.990 940 HG12 ILE 130 2HG1 ILE 130 -1.914 5.665 1.324 941 HG13 ILE 130 1HG1 ILE 130 -1.145 7.168 0.837 942 HG21 ILE 130 1HG2 ILE 130 -0.361 5.669 4.756 943 HG22 ILE 130 2HG2 ILE 130 0.189 4.792 3.329 944 HG23 ILE 130 3HG2 ILE 130 -1.523 4.801 3.752 945 HD11 ILE 130 3HD1 ILE 130 -0.093 5.248 -0.226 946 HD12 ILE 130 1HD1 ILE 130 0.255 4.549 1.355 947 HD13 ILE 130 2HD1 ILE 130 1.035 6.054 0.863 948 H GLY 131 H GLY 131 -2.228 9.549 4.827 949 HA2 GLY 131 2HA GLY 131 -1.774 11.757 4.458 950 HA3 GLY 131 1HA GLY 131 -1.317 11.372 2.800 951 H LYS 132 H LYS 132 -2.734 11.647 1.230 952 HA LYS 132 HA LYS 132 -5.441 12.487 2.024 953 HB2 LYS 132 2HB LYS 132 -5.398 14.093 0.179 954 HB3 LYS 132 1HB LYS 132 -4.111 14.401 1.331 955 HG2 LYS 132 2HG LYS 132 -2.545 13.200 -0.195 956 HG3 LYS 132 1HG LYS 132 -3.859 13.090 -1.361 957 HD2 LYS 132 2HD LYS 132 -2.699 15.655 -0.268 958 HD3 LYS 132 1HD LYS 132 -2.359 14.970 -1.856 959 HE2 LYS 132 2HE LYS 132 -4.729 15.183 -2.442 960 HE3 LYS 132 1HE LYS 132 -5.053 15.874 -0.853 961 HZ1 LYS 132 3HZ LYS 132 -3.346 17.039 -2.972 962 HZ2 LYS 132 1HZ LYS 132 -3.526 17.690 -1.420 963 HZ3 LYS 132 2HZ LYS 132 -4.851 17.585 -2.465 964 H PHE 133 H PHE 133 -3.848 10.039 0.613 965 HA PHE 133 HA PHE 133 -6.059 9.534 -1.188 966 HB2 PHE 133 2HB PHE 133 -4.385 8.386 -2.746 967 HB3 PHE 133 1HB PHE 133 -4.438 10.138 -2.767 968 HD1 PHE 133 2HD PHE 133 -2.477 7.194 -1.854 969 HD2 PHE 133 1HD PHE 133 -2.592 11.439 -1.956 970 HE1 PHE 133 2HE PHE 133 -0.057 7.273 -1.472 971 HE2 PHE 133 1HE PHE 133 -0.175 11.524 -1.583 972 HZ PHE 133 HZ PHE 133 1.096 9.453 -1.338 973 H ARG 134 H ARG 134 -6.189 7.166 -1.807 974 HA ARG 134 HA ARG 134 -5.611 5.723 0.646 975 HB2 ARG 134 2HB ARG 134 -7.949 4.832 0.626 976 HB3 ARG 134 1HB ARG 134 -7.737 6.508 1.106 977 HG2 ARG 134 2HG ARG 134 -8.420 7.208 -1.163 978 HG3 ARG 134 1HG ARG 134 -8.711 5.511 -1.563 979 HD2 ARG 134 2HD ARG 134 -10.766 6.716 -0.886 980 HD3 ARG 134 1HD ARG 134 -10.372 5.343 0.153 981 HE ARG 134 HE ARG 134 -9.510 8.017 0.947 982 HH11 ARG 134 1HH1 ARG 134 -11.625 5.245 1.469 983 HH12 ARG 134 2HH1 ARG 134 -11.996 5.611 3.077 984 HH21 ARG 134 1HH2 ARG 134 -10.052 8.588 3.205 985 HH22 ARG 134 2HH2 ARG 134 -11.181 7.639 4.032 986 H LEU 135 H LEU 135 -5.319 3.698 0.632 987 HA LEU 135 HA LEU 135 -5.445 2.245 -1.884 988 HB2 LEU 135 2HB LEU 135 -3.297 2.232 0.244 989 HB3 LEU 135 1HB LEU 135 -3.490 0.923 -0.898 990 HG LEU 135 HG LEU 135 -3.103 2.548 -2.732 991 HD11 LEU 135 1HD1 LEU 135 -1.975 4.678 -2.243 992 HD12 LEU 135 2HD1 LEU 135 -2.264 4.423 -0.523 993 HD13 LEU 135 3HD1 LEU 135 -3.625 4.645 -1.619 994 HD21 LEU 135 3HD2 LEU 135 -0.896 2.205 -0.728 995 HD22 LEU 135 1HD2 LEU 135 -0.666 2.679 -2.411 996 HD23 LEU 135 2HD2 LEU 135 -1.344 1.099 -2.032 997 H VAL 136 H VAL 136 -6.065 0.161 -1.697 998 HA VAL 136 HA VAL 136 -7.337 -0.534 0.875 999 HB VAL 136 HB VAL 136 -8.048 -1.583 -1.900 1000 HG11 VAL 136 1HG1 VAL 136 -10.015 -2.578 -0.815 1001 HG12 VAL 136 2HG1 VAL 136 -9.420 -2.023 0.752 1002 HG13 VAL 136 3HG1 VAL 136 -8.506 -3.224 -0.164 1003 HG21 VAL 136 3HG2 VAL 136 -9.549 0.374 -0.157 1004 HG22 VAL 136 1HG2 VAL 136 -10.121 -0.287 -1.688 1005 HG23 VAL 136 2HG2 VAL 136 -8.700 0.759 -1.654 1006 H PHE 137 H PHE 137 -6.515 -2.237 1.906 1007 HA PHE 137 HA PHE 137 -4.282 -3.571 0.565 1008 HB2 PHE 137 2HB PHE 137 -4.089 -2.223 2.782 1009 HB3 PHE 137 1HB PHE 137 -4.823 -3.645 3.515 1010 HD1 PHE 137 2HD PHE 137 -3.637 -5.888 3.171 1011 HD2 PHE 137 1HD PHE 137 -1.816 -2.136 2.372 1012 HE1 PHE 137 2HE PHE 137 -1.433 -6.939 3.275 1013 HE2 PHE 137 1HE PHE 137 0.402 -3.183 2.471 1014 HZ PHE 137 HZ PHE 137 0.599 -5.591 2.926 1015 H LEU 138 H LEU 138 -4.354 -5.722 0.170 1016 HA LEU 138 HA LEU 138 -6.499 -7.277 1.425 1017 HB2 LEU 138 2HB LEU 138 -5.547 -7.489 -1.441 1018 HB3 LEU 138 1HB LEU 138 -6.639 -8.607 -0.672 1019 HG LEU 138 HG LEU 138 -7.939 -7.321 -2.077 1020 HD11 LEU 138 1HD1 LEU 138 -9.468 -6.056 -0.678 1021 HD12 LEU 138 2HD1 LEU 138 -8.308 -6.148 0.645 1022 HD13 LEU 138 3HD1 LEU 138 -9.028 -7.623 -0.003 1023 HD21 LEU 138 3HD2 LEU 138 -6.647 -4.817 -1.005 1024 HD22 LEU 138 1HD2 LEU 138 -7.985 -4.857 -2.150 1025 HD23 LEU 138 2HD2 LEU 138 -6.415 -5.518 -2.606 1026 H ALA 139 H ALA 139 -5.980 -9.408 1.827 1027 HA ALA 139 HA ALA 139 -3.233 -10.083 2.182 1028 HB1 ALA 139 1HB ALA 139 -5.698 -11.847 2.174 1029 HB2 ALA 139 2HB ALA 139 -4.979 -11.091 3.595 1030 HB3 ALA 139 3HB ALA 139 -4.101 -12.349 2.721 1031 H GLY 140 H GLY 140 -1.915 -11.281 0.823 1032 HA2 GLY 140 2HA GLY 140 -2.773 -11.204 -1.933 1033 HA3 GLY 140 1HA GLY 140 -1.145 -11.546 -1.363 1034 HA PRO 141 HA PRO 141 -3.148 -15.541 -2.582 1035 HB2 PRO 141 2HB PRO 141 -1.012 -15.820 -4.498 1036 HB3 PRO 141 1HB PRO 141 -2.755 -15.866 -4.775 1037 HG2 PRO 141 2HG PRO 141 -1.175 -13.820 -5.681 1038 HG3 PRO 141 1HG PRO 141 -2.883 -13.618 -5.252 1039 HD2 PRO 141 2HD PRO 141 -0.438 -12.940 -3.668 1040 HD3 PRO 141 1HD PRO 141 -1.966 -12.048 -3.830 1041 H ALA 142 H ALA 142 -2.496 -17.017 -1.287 1042 HA ALA 142 HA ALA 142 0.276 -17.021 -0.392 1043 HB1 ALA 142 1HB ALA 142 -0.524 -18.408 1.456 1044 HB2 ALA 142 2HB ALA 142 -2.144 -18.407 0.757 1045 HB3 ALA 142 3HB ALA 142 -1.434 -16.902 1.344 1046 H GLU 143 H GLU 143 1.497 -18.261 -1.616 1047 HA GLU 143 HA GLU 143 0.383 -20.818 -2.516 1048 HB2 GLU 143 2HB GLU 143 1.096 -19.005 -4.218 1049 HB3 GLU 143 1HB GLU 143 2.738 -19.367 -3.714 1050 HG2 GLU 143 2HG GLU 143 2.372 -20.598 -5.674 1051 HG3 GLU 143 1HG GLU 143 2.273 -21.757 -4.349 Start of MODEL 27 1 H1 MET 1 1HT MET 1 57.533 -85.905 49.279 2 H2 MET 1 2HT MET 1 57.397 -84.233 49.480 3 H3 MET 1 3HT MET 1 57.730 -84.861 47.975 4 HA MET 1 HA MET 1 55.468 -84.114 48.200 5 HB2 MET 1 2HB MET 1 54.389 -86.124 47.224 6 HB3 MET 1 1HB MET 1 55.962 -85.813 46.529 7 HG2 MET 1 2HG MET 1 55.807 -88.146 46.777 8 HG3 MET 1 1HG MET 1 56.879 -87.601 48.055 9 HE1 MET 1 2HE MET 1 52.506 -89.003 48.667 10 HE2 MET 1 3HE MET 1 53.343 -88.996 47.115 11 HE3 MET 1 1HE MET 1 52.897 -87.473 47.886 12 H SER 2 H SER 2 56.541 -85.158 51.035 13 HA SER 2 HA SER 2 54.451 -86.608 52.164 14 HB2 SER 2 2HB SER 2 55.535 -85.695 54.298 15 HB3 SER 2 1HB SER 2 56.556 -86.663 53.230 16 HG SER 2 HG SER 2 56.589 -83.843 53.654 17 H ASP 3 H ASP 3 55.053 -83.187 51.835 18 HA ASP 3 HA ASP 3 52.446 -82.635 52.984 19 HB2 ASP 3 2HB ASP 3 53.496 -80.657 54.156 20 HB3 ASP 3 1HB ASP 3 53.916 -82.234 54.810 21 H ASN 4 H ASN 4 51.444 -80.816 52.150 22 HA ASN 4 HA ASN 4 52.935 -79.487 50.045 23 HB2 ASN 4 2HB ASN 4 50.971 -79.382 48.563 24 HB3 ASN 4 1HB ASN 4 51.356 -81.042 48.947 25 HD21 ASN 4 1HD2 ASN 4 49.894 -82.164 50.424 26 HD22 ASN 4 2HD2 ASN 4 48.259 -81.656 50.556 27 H ASN 5 H ASN 5 53.505 -77.867 51.259 28 HA ASN 5 HA ASN 5 51.370 -76.132 52.252 29 HB2 ASN 5 2HB ASN 5 54.183 -76.503 53.285 30 HB3 ASN 5 1HB ASN 5 53.184 -75.126 53.730 31 HD21 ASN 5 1HD2 ASN 5 51.344 -75.477 54.971 32 HD22 ASN 5 2HD2 ASN 5 51.159 -76.895 55.934 33 H GLY 6 H GLY 6 51.072 -74.392 51.210 34 HA2 GLY 6 2HA GLY 6 52.660 -72.391 50.498 35 HA3 GLY 6 1HA GLY 6 52.941 -73.532 49.180 36 H THR 7 H THR 7 51.094 -70.986 50.114 37 HA THR 7 HA THR 7 48.610 -71.828 48.948 38 HB THR 7 HB THR 7 49.522 -69.056 49.742 39 HG1 THR 7 1HG THR 7 48.885 -71.274 51.221 40 HG21 THR 7 3HG2 THR 7 47.113 -68.637 50.048 41 HG22 THR 7 1HG2 THR 7 46.757 -70.283 49.523 42 HG23 THR 7 2HG2 THR 7 47.459 -69.130 48.390 43 HA PRO 8 HA PRO 8 49.987 -70.748 44.748 44 HB2 PRO 8 2HB PRO 8 47.028 -70.636 44.356 45 HB3 PRO 8 1HB PRO 8 48.239 -71.503 43.410 46 HG2 PRO 8 2HG PRO 8 46.643 -72.826 45.066 47 HG3 PRO 8 1HG PRO 8 48.354 -73.264 44.926 48 HD2 PRO 8 2HD PRO 8 46.966 -71.727 47.079 49 HD3 PRO 8 1HD PRO 8 48.266 -72.928 47.206 50 H GLU 9 H GLU 9 50.416 -68.744 44.060 51 HA GLU 9 HA GLU 9 49.415 -66.568 45.588 52 HB2 GLU 9 2HB GLU 9 51.267 -66.550 43.217 53 HB3 GLU 9 1HB GLU 9 50.977 -65.207 44.315 54 HG2 GLU 9 2HG GLU 9 51.846 -66.646 46.159 55 HG3 GLU 9 1HG GLU 9 52.295 -67.831 44.937 56 HA PRO 10 HA PRO 10 46.303 -65.524 42.546 57 HB2 PRO 10 2HB PRO 10 45.185 -63.570 44.243 58 HB3 PRO 10 1HB PRO 10 44.621 -65.227 44.054 59 HG2 PRO 10 2HG PRO 10 45.832 -64.080 46.350 60 HG3 PRO 10 1HG PRO 10 45.418 -65.778 46.096 61 HD2 PRO 10 2HD PRO 10 48.035 -64.431 45.922 62 HD3 PRO 10 1HD PRO 10 47.635 -66.141 46.196 63 H GLN 11 H GLN 11 46.598 -64.055 40.959 64 HA GLN 11 HA GLN 11 48.341 -61.800 41.493 65 HB2 GLN 11 2HB GLN 11 48.748 -63.220 39.490 66 HB3 GLN 11 1HB GLN 11 47.164 -62.762 38.873 67 HG2 GLN 11 2HG GLN 11 47.873 -60.455 38.690 68 HG3 GLN 11 1HG GLN 11 49.426 -60.867 39.411 69 HE21 GLN 11 1HE2 GLN 11 50.522 -60.088 37.628 70 HE22 GLN 11 2HE2 GLN 11 50.593 -60.946 36.132 71 H VAL 12 H VAL 12 47.541 -59.854 41.954 72 HA VAL 12 HA VAL 12 44.681 -59.499 41.764 73 HB VAL 12 HB VAL 12 44.969 -57.662 43.251 74 HG11 VAL 12 1HG1 VAL 12 44.912 -59.862 44.277 75 HG12 VAL 12 2HG1 VAL 12 45.916 -58.767 45.221 76 HG13 VAL 12 3HG1 VAL 12 46.668 -59.970 44.171 77 HG21 VAL 12 3HG2 VAL 12 47.952 -58.042 42.959 78 HG22 VAL 12 1HG2 VAL 12 47.180 -56.967 44.128 79 HG23 VAL 12 2HG2 VAL 12 47.005 -56.666 42.401 80 H GLU 13 H GLU 13 43.896 -57.297 41.183 81 HA GLU 13 HA GLU 13 45.247 -56.301 38.828 82 HB2 GLU 13 2HB GLU 13 43.136 -55.105 38.406 83 HB3 GLU 13 1HB GLU 13 42.870 -56.833 38.546 84 HG2 GLU 13 2HG GLU 13 42.404 -54.935 40.838 85 HG3 GLU 13 1HG GLU 13 41.168 -55.254 39.627 86 H THR 14 H THR 14 45.905 -54.165 38.705 87 HA THR 14 HA THR 14 45.727 -52.679 41.208 88 HB THR 14 HB THR 14 48.076 -52.667 39.292 89 HG1 THR 14 1HG THR 14 47.611 -54.528 40.703 90 HG21 THR 14 3HG2 THR 14 47.716 -51.381 42.018 91 HG22 THR 14 1HG2 THR 14 47.743 -50.518 40.479 92 HG23 THR 14 2HG2 THR 14 49.190 -51.349 41.050 93 H THR 15 H THR 15 44.172 -51.260 40.781 94 HA THR 15 HA THR 15 44.509 -49.564 38.464 95 HB THR 15 HB THR 15 41.897 -50.355 39.824 96 HG1 THR 15 1HG THR 15 43.264 -51.375 37.575 97 HG21 THR 15 3HG2 THR 15 41.869 -48.152 38.686 98 HG22 THR 15 1HG2 THR 15 40.843 -49.322 37.857 99 HG23 THR 15 2HG2 THR 15 42.430 -48.925 37.205 100 H SER 16 H SER 16 44.314 -47.410 39.027 101 HA SER 16 HA SER 16 43.933 -46.851 41.839 102 HB2 SER 16 2HB SER 16 46.376 -46.992 41.267 103 HB3 SER 16 1HB SER 16 46.136 -45.677 40.122 104 HG SER 16 HG SER 16 45.509 -45.503 42.874 105 H VAL 17 H VAL 17 43.052 -44.822 42.221 106 HA VAL 17 HA VAL 17 41.618 -43.745 39.979 107 HB VAL 17 HB VAL 17 40.412 -42.340 41.645 108 HG11 VAL 17 1HG1 VAL 17 39.505 -44.506 41.030 109 HG12 VAL 17 2HG1 VAL 17 39.172 -44.151 42.725 110 HG13 VAL 17 3HG1 VAL 17 40.459 -45.278 42.300 111 HG21 VAL 17 3HG2 VAL 17 40.695 -42.763 44.047 112 HG22 VAL 17 1HG2 VAL 17 42.173 -42.120 43.332 113 HG23 VAL 17 2HG2 VAL 17 42.049 -43.839 43.703 114 H PHE 18 H PHE 18 41.863 -41.790 39.178 115 HA PHE 18 HA PHE 18 44.347 -40.452 39.846 116 HB2 PHE 18 2HB PHE 18 44.005 -39.063 37.841 117 HB3 PHE 18 1HB PHE 18 43.876 -40.765 37.446 118 HD1 PHE 18 1HD PHE 18 41.984 -37.623 37.894 119 HD2 PHE 18 2HD PHE 18 41.869 -41.641 36.508 120 HE1 PHE 18 1HE PHE 18 39.861 -37.160 36.750 121 HE2 PHE 18 2HE PHE 18 39.735 -41.183 35.367 122 HZ PHE 18 HZ PHE 18 38.732 -38.944 35.488 123 H ARG 19 H ARG 19 44.431 -38.180 40.266 124 HA ARG 19 HA ARG 19 42.190 -37.389 41.932 125 HB2 ARG 19 2HB ARG 19 44.950 -36.194 41.622 126 HB3 ARG 19 1HB ARG 19 43.712 -35.583 42.707 127 HG2 ARG 19 2HG ARG 19 44.915 -38.345 42.854 128 HG3 ARG 19 1HG ARG 19 45.381 -36.978 43.868 129 HD2 ARG 19 2HD ARG 19 42.627 -38.233 43.749 130 HD3 ARG 19 1HD ARG 19 43.822 -38.470 45.020 131 HE ARG 19 HE ARG 19 43.599 -35.848 45.059 132 HH11 ARG 19 1HH1 ARG 19 40.993 -38.217 44.839 133 HH12 ARG 19 2HH1 ARG 19 39.904 -37.352 45.812 134 HH21 ARG 19 1HH2 ARG 19 42.104 -34.634 46.425 135 HH22 ARG 19 2HH2 ARG 19 40.570 -35.283 46.763 136 H ALA 20 H ALA 20 40.661 -36.344 40.978 137 HA ALA 20 HA ALA 20 41.165 -34.876 38.562 138 HB1 ALA 20 1HB ALA 20 38.762 -34.617 38.418 139 HB2 ALA 20 2HB ALA 20 38.570 -35.246 40.054 140 HB3 ALA 20 3HB ALA 20 39.156 -36.302 38.765 141 H ASP 21 H ASP 21 42.324 -33.153 39.119 142 HA ASP 21 HA ASP 21 41.450 -31.261 41.140 143 HB2 ASP 21 2HB ASP 21 43.867 -31.543 40.583 144 HB3 ASP 21 1HB ASP 21 43.536 -30.935 38.963 145 H LEU 22 H LEU 22 41.281 -31.757 37.760 146 HA LEU 22 HA LEU 22 40.239 -30.809 36.024 147 HB2 LEU 22 2HB LEU 22 38.186 -31.094 37.366 148 HB3 LEU 22 1HB LEU 22 38.464 -29.544 38.130 149 HG LEU 22 HG LEU 22 38.146 -28.428 35.940 150 HD11 LEU 22 1HD1 LEU 22 37.424 -31.183 34.961 151 HD12 LEU 22 2HD1 LEU 22 38.815 -30.225 34.456 152 HD13 LEU 22 3HD1 LEU 22 37.186 -29.681 34.072 153 HD21 LEU 22 3HD2 LEU 22 36.275 -28.646 37.477 154 HD22 LEU 22 1HD2 LEU 22 35.880 -30.224 36.796 155 HD23 LEU 22 2HD2 LEU 22 35.723 -28.773 35.808 156 H LEU 23 H LEU 23 41.886 -29.684 35.295 157 HA LEU 23 HA LEU 23 42.545 -27.128 36.371 158 HB2 LEU 23 2HB LEU 23 43.528 -28.587 33.908 159 HB3 LEU 23 1HB LEU 23 44.106 -27.009 34.383 160 HG LEU 23 HG LEU 23 44.929 -28.055 36.534 161 HD11 LEU 23 1HD1 LEU 23 43.577 -30.072 36.556 162 HD12 LEU 23 2HD1 LEU 23 45.299 -30.437 36.625 163 HD13 LEU 23 3HD1 LEU 23 44.415 -30.654 35.113 164 HD21 LEU 23 3HD2 LEU 23 46.093 -29.063 33.957 165 HD22 LEU 23 1HD2 LEU 23 46.916 -29.020 35.515 166 HD23 LEU 23 2HD2 LEU 23 46.426 -27.517 34.737 167 H LYS 24 H LYS 24 41.451 -25.391 35.970 168 HA LYS 24 HA LYS 24 39.365 -25.383 34.027 169 HB2 LYS 24 2HB LYS 24 40.341 -23.161 35.835 170 HB3 LYS 24 1HB LYS 24 38.955 -23.017 34.777 171 HG2 LYS 24 2HG LYS 24 38.105 -23.430 36.935 172 HG3 LYS 24 1HG LYS 24 37.934 -24.950 36.066 173 HD2 LYS 24 2HD LYS 24 40.008 -25.750 37.157 174 HD3 LYS 24 1HD LYS 24 40.088 -24.237 38.059 175 HE2 LYS 24 2HE LYS 24 37.944 -24.741 39.114 176 HE3 LYS 24 1HE LYS 24 37.837 -26.232 38.174 177 HZ1 LYS 24 3HZ LYS 24 39.926 -25.598 40.177 178 HZ2 LYS 24 1HZ LYS 24 39.830 -27.027 39.290 179 HZ3 LYS 24 2HZ LYS 24 38.638 -26.634 40.434 180 H GLU 25 H GLU 25 39.032 -23.724 32.451 181 HA GLU 25 HA GLU 25 41.521 -22.950 31.162 182 HB2 GLU 25 2HB GLU 25 40.082 -22.864 29.031 183 HB3 GLU 25 1HB GLU 25 40.508 -24.437 29.664 184 HG2 GLU 25 2HG GLU 25 38.207 -24.403 28.867 185 HG3 GLU 25 1HG GLU 25 38.265 -24.687 30.597 186 H MET 26 H MET 26 41.104 -20.996 29.587 187 HA MET 26 HA MET 26 39.373 -19.061 30.915 188 HB2 MET 26 2HB MET 26 41.706 -18.723 31.711 189 HB3 MET 26 1HB MET 26 42.216 -18.484 30.046 190 HG2 MET 26 2HG MET 26 41.946 -16.353 31.178 191 HG3 MET 26 1HG MET 26 40.765 -16.522 29.878 192 HE1 MET 26 3HE MET 26 39.281 -14.541 30.873 193 HE2 MET 26 1HE MET 26 40.487 -14.325 32.141 194 HE3 MET 26 2HE MET 26 38.779 -14.456 32.562 195 H GLU 27 H GLU 27 38.059 -18.191 29.485 196 HA GLU 27 HA GLU 27 38.666 -18.476 26.672 197 HB2 GLU 27 2HB GLU 27 36.303 -17.980 26.272 198 HB3 GLU 27 1HB GLU 27 36.486 -19.262 27.453 199 HG2 GLU 27 2HG GLU 27 34.915 -18.127 28.575 200 HG3 GLU 27 1HG GLU 27 36.264 -17.113 29.080 201 H SER 28 H SER 28 37.599 -16.542 25.342 202 HA SER 28 HA SER 28 38.349 -14.002 26.472 203 HB2 SER 28 2HB SER 28 40.404 -14.997 25.417 204 HB3 SER 28 1HB SER 28 39.545 -15.048 23.880 205 HG SER 28 HG SER 28 40.015 -12.705 25.409 206 H SER 29 H SER 29 36.917 -12.541 25.807 207 HA SER 29 HA SER 29 34.707 -13.269 24.201 208 HB2 SER 29 2HB SER 29 34.541 -11.707 26.129 209 HB3 SER 29 1HB SER 29 35.537 -10.548 25.259 210 HG SER 29 HG SER 29 33.761 -9.862 24.430 211 H THR 30 H THR 30 34.335 -12.839 22.092 212 HA THR 30 HA THR 30 36.224 -11.130 20.685 213 HB THR 30 HB THR 30 36.870 -13.523 20.331 214 HG1 THR 30 1HG THR 30 37.388 -12.245 18.669 215 HG21 THR 30 3HG2 THR 30 34.133 -13.774 19.053 216 HG22 THR 30 1HG2 THR 30 34.668 -14.581 20.529 217 HG23 THR 30 2HG2 THR 30 35.401 -14.997 18.980 218 H GLY 31 H GLY 31 35.309 -10.285 18.679 219 HA2 GLY 31 2HA GLY 31 32.567 -9.548 19.000 220 HA3 GLY 31 1HA GLY 31 33.644 -9.072 17.691 221 H THR 32 H THR 32 31.552 -11.562 18.865 222 HA THR 32 HA THR 32 31.663 -13.050 16.402 223 HB THR 32 HB THR 32 31.360 -14.240 18.559 224 HG1 THR 32 1HG THR 32 28.916 -14.880 17.494 225 HG21 THR 32 3HG2 THR 32 29.202 -14.143 19.751 226 HG22 THR 32 1HG2 THR 32 28.666 -12.863 18.658 227 HG23 THR 32 2HG2 THR 32 30.021 -12.581 19.752 228 H ALA 33 H ALA 33 29.676 -13.476 15.150 229 HA ALA 33 HA ALA 33 28.358 -10.953 14.632 230 HB1 ALA 33 1HB ALA 33 27.551 -12.045 12.597 231 HB2 ALA 33 2HB ALA 33 28.249 -13.573 13.140 232 HB3 ALA 33 3HB ALA 33 29.298 -12.210 12.761 233 HA PRO 34 HA PRO 34 24.704 -12.358 16.823 234 HB2 PRO 34 2HB PRO 34 23.078 -10.284 16.151 235 HB3 PRO 34 1HB PRO 34 24.333 -10.130 17.384 236 HG2 PRO 34 2HG PRO 34 24.367 -9.261 14.528 237 HG3 PRO 34 1HG PRO 34 24.984 -8.418 15.960 238 HD2 PRO 34 2HD PRO 34 26.581 -9.794 14.232 239 HD3 PRO 34 1HD PRO 34 26.959 -9.603 15.958 240 H ALA 35 H ALA 35 22.585 -13.120 16.221 241 HA ALA 35 HA ALA 35 22.536 -14.235 13.603 242 HB1 ALA 35 1HB ALA 35 20.411 -14.261 15.741 243 HB2 ALA 35 2HB ALA 35 21.694 -15.457 15.551 244 HB3 ALA 35 3HB ALA 35 20.453 -15.287 14.308 245 H SER 36 H SER 36 22.061 -13.058 11.916 246 HA SER 36 HA SER 36 20.293 -10.790 12.078 247 HB2 SER 36 2HB SER 36 22.302 -10.597 10.707 248 HB3 SER 36 1HB SER 36 21.850 -12.024 9.779 249 HG SER 36 HG SER 36 20.178 -10.893 8.861 250 H THR 37 H THR 37 18.409 -10.593 10.686 251 HA THR 37 HA THR 37 16.853 -12.921 10.446 252 HB THR 37 HB THR 37 15.592 -10.963 9.071 253 HG1 THR 37 1HG THR 37 16.625 -9.131 9.357 254 HG21 THR 37 3HG2 THR 37 14.753 -12.109 11.092 255 HG22 THR 37 1HG2 THR 37 14.515 -10.368 11.199 256 HG23 THR 37 2HG2 THR 37 15.833 -11.136 12.087 257 H GLY 38 H GLY 38 15.851 -13.408 8.228 258 HA2 GLY 38 2HA GLY 38 17.805 -13.008 6.115 259 HA3 GLY 38 1HA GLY 38 17.262 -14.635 6.520 260 H ALA 39 H ALA 39 16.691 -11.904 4.739 261 HA ALA 39 HA ALA 39 13.917 -11.934 4.300 262 HB1 ALA 39 1HB ALA 39 16.076 -11.210 2.322 263 HB2 ALA 39 2HB ALA 39 15.456 -10.143 3.573 264 HB3 ALA 39 3HB ALA 39 14.389 -10.689 2.272 265 H GLU 40 H GLU 40 16.527 -13.643 2.764 266 HA GLU 40 HA GLU 40 15.102 -14.895 0.708 267 HB2 GLU 40 2HB GLU 40 17.092 -16.396 0.597 268 HB3 GLU 40 1HB GLU 40 17.462 -14.682 0.554 269 HG2 GLU 40 2HG GLU 40 17.920 -14.861 3.043 270 HG3 GLU 40 1HG GLU 40 17.829 -16.603 2.828 271 H ASN 41 H ASN 41 15.010 -15.552 4.030 272 HA ASN 41 HA ASN 41 14.467 -18.361 3.809 273 HB2 ASN 41 2HB ASN 41 14.079 -16.463 6.126 274 HB3 ASN 41 1HB ASN 41 13.767 -18.193 6.207 275 HD21 ASN 41 1HD2 ASN 41 15.496 -19.610 6.180 276 HD22 ASN 41 2HD2 ASN 41 17.117 -19.094 6.439 277 H LEU 42 H LEU 42 12.591 -15.444 3.648 278 HA LEU 42 HA LEU 42 10.117 -16.835 4.119 279 HB2 LEU 42 2HB LEU 42 10.762 -13.984 3.377 280 HB3 LEU 42 1HB LEU 42 9.132 -14.589 3.497 281 HG LEU 42 HG LEU 42 9.547 -13.365 5.452 282 HD11 LEU 42 1HD1 LEU 42 8.352 -15.385 5.885 283 HD12 LEU 42 2HD1 LEU 42 9.368 -14.961 7.262 284 HD13 LEU 42 3HD1 LEU 42 9.862 -16.255 6.173 285 HD21 LEU 42 3HD2 LEU 42 12.108 -14.911 5.823 286 HD22 LEU 42 1HD2 LEU 42 11.449 -13.741 6.967 287 HD23 LEU 42 2HD2 LEU 42 11.965 -13.213 5.368 288 HA PRO 43 HA PRO 43 10.029 -17.593 -0.320 289 HB2 PRO 43 2HB PRO 43 7.726 -19.264 0.009 290 HB3 PRO 43 1HB PRO 43 9.388 -19.786 -0.272 291 HG2 PRO 43 2HG PRO 43 7.904 -20.148 2.079 292 HG3 PRO 43 1HG PRO 43 9.644 -20.363 1.914 293 HD2 PRO 43 2HD PRO 43 8.122 -18.121 3.099 294 HD3 PRO 43 1HD PRO 43 9.776 -18.680 3.428 295 H ALA 44 H ALA 44 6.809 -17.781 1.152 296 HA ALA 44 HA ALA 44 6.094 -15.300 -0.185 297 HB1 ALA 44 1HB ALA 44 3.929 -16.224 -0.831 298 HB2 ALA 44 2HB ALA 44 4.379 -17.784 -0.142 299 HB3 ALA 44 3HB ALA 44 5.241 -17.161 -1.547 300 H GLY 45 H GLY 45 6.067 -14.118 1.532 301 HA2 GLY 45 2HA GLY 45 3.987 -14.603 3.519 302 HA3 GLY 45 1HA GLY 45 5.637 -14.256 4.072 303 H SER 46 H SER 46 3.987 -13.160 1.290 304 HA SER 46 HA SER 46 4.954 -10.484 1.664 305 HB2 SER 46 2HB SER 46 3.448 -11.731 -0.611 306 HB3 SER 46 1HB SER 46 4.514 -10.320 -0.645 307 HG SER 46 HG SER 46 6.265 -11.614 -0.336 308 H ALA 47 H ALA 47 3.449 -8.723 1.040 309 HA ALA 47 HA ALA 47 0.624 -9.211 1.600 310 HB1 ALA 47 1HB ALA 47 1.609 -8.237 3.625 311 HB2 ALA 47 2HB ALA 47 0.575 -7.053 2.827 312 HB3 ALA 47 3HB ALA 47 2.324 -6.940 2.670 313 H LEU 48 H LEU 48 -0.727 -7.461 0.508 314 HA LEU 48 HA LEU 48 0.830 -6.090 -1.488 315 HB2 LEU 48 2HB LEU 48 -0.605 -6.774 -3.346 316 HB3 LEU 48 1HB LEU 48 0.208 -8.136 -2.621 317 HG LEU 48 HG LEU 48 -2.070 -8.495 -1.389 318 HD11 LEU 48 1HD1 LEU 48 -2.945 -6.849 -3.749 319 HD12 LEU 48 2HD1 LEU 48 -3.111 -6.412 -2.052 320 HD13 LEU 48 3HD1 LEU 48 -4.007 -7.789 -2.701 321 HD21 LEU 48 3HD2 LEU 48 -1.128 -10.048 -3.001 322 HD22 LEU 48 1HD2 LEU 48 -1.719 -9.054 -4.332 323 HD23 LEU 48 2HD2 LEU 48 -2.862 -9.865 -3.265 324 H LEU 49 H LEU 49 -0.178 -4.345 -2.500 325 HA LEU 49 HA LEU 49 -2.454 -3.282 -1.008 326 HB2 LEU 49 2HB LEU 49 -1.461 -1.031 -1.125 327 HB3 LEU 49 1HB LEU 49 -0.494 -2.116 -0.159 328 HG LEU 49 HG LEU 49 0.242 -1.515 -3.035 329 HD11 LEU 49 1HD1 LEU 49 1.739 0.218 -2.191 330 HD12 LEU 49 2HD1 LEU 49 1.080 0.010 -0.568 331 HD13 LEU 49 3HD1 LEU 49 0.056 0.629 -1.867 332 HD21 LEU 49 3HD2 LEU 49 2.491 -2.054 -2.233 333 HD22 LEU 49 1HD2 LEU 49 1.375 -3.392 -1.954 334 HD23 LEU 49 2HD2 LEU 49 1.840 -2.340 -0.620 335 H VAL 50 H VAL 50 -3.989 -2.368 -2.227 336 HA VAL 50 HA VAL 50 -3.340 -2.001 -5.047 337 HB VAL 50 HB VAL 50 -5.697 -2.392 -5.634 338 HG11 VAL 50 1HG1 VAL 50 -5.829 -4.797 -5.209 339 HG12 VAL 50 2HG1 VAL 50 -4.547 -4.643 -4.010 340 HG13 VAL 50 3HG1 VAL 50 -4.213 -4.291 -5.701 341 HG21 VAL 50 3HG2 VAL 50 -6.789 -1.668 -3.585 342 HG22 VAL 50 1HG2 VAL 50 -6.112 -3.051 -2.719 343 HG23 VAL 50 2HG2 VAL 50 -7.295 -3.310 -4.000 344 H VAL 51 H VAL 51 -3.590 -0.083 -5.900 345 HA VAL 51 HA VAL 51 -4.366 2.069 -4.083 346 HB VAL 51 HB VAL 51 -2.999 2.347 -6.804 347 HG11 VAL 51 1HG1 VAL 51 -2.360 4.535 -5.953 348 HG12 VAL 51 2HG1 VAL 51 -3.243 4.222 -4.460 349 HG13 VAL 51 3HG1 VAL 51 -4.112 4.344 -5.989 350 HG21 VAL 51 3HG2 VAL 51 -1.726 2.237 -4.062 351 HG22 VAL 51 1HG2 VAL 51 -0.903 2.563 -5.588 352 HG23 VAL 51 2HG2 VAL 51 -1.615 0.977 -5.290 353 H LYS 52 H LYS 52 -6.226 2.999 -4.270 354 HA LYS 52 HA LYS 52 -7.749 2.608 -6.718 355 HB2 LYS 52 2HB LYS 52 -8.552 3.571 -3.986 356 HB3 LYS 52 1HB LYS 52 -9.640 3.613 -5.366 357 HG2 LYS 52 2HG LYS 52 -9.314 1.158 -5.607 358 HG3 LYS 52 1HG LYS 52 -8.379 1.190 -4.113 359 HD2 LYS 52 2HD LYS 52 -10.274 1.878 -2.853 360 HD3 LYS 52 1HD LYS 52 -11.189 2.203 -4.325 361 HE2 LYS 52 2HE LYS 52 -10.214 -0.515 -3.482 362 HE3 LYS 52 1HE LYS 52 -11.853 0.081 -3.234 363 HZ1 LYS 52 3HZ LYS 52 -11.698 -1.294 -5.202 364 HZ2 LYS 52 1HZ LYS 52 -10.520 -0.318 -5.869 365 HZ3 LYS 52 2HZ LYS 52 -12.085 0.277 -5.672 366 H ARG 53 H ARG 53 -6.289 5.071 -4.755 367 HA ARG 53 HA ARG 53 -5.992 6.755 -6.980 368 HB2 ARG 53 2HB ARG 53 -8.302 7.423 -6.493 369 HB3 ARG 53 1HB ARG 53 -7.887 7.715 -4.813 370 HG2 ARG 53 2HG ARG 53 -8.065 9.818 -6.057 371 HG3 ARG 53 1HG ARG 53 -6.415 9.562 -5.483 372 HD2 ARG 53 2HD ARG 53 -5.822 8.682 -7.712 373 HD3 ARG 53 1HD ARG 53 -7.445 9.075 -8.281 374 HE ARG 53 HE ARG 53 -6.536 11.433 -7.325 375 HH11 ARG 53 1HH1 ARG 53 -5.068 9.090 -9.525 376 HH12 ARG 53 2HH1 ARG 53 -4.207 10.241 -10.426 377 HH21 ARG 53 1HH2 ARG 53 -5.374 13.028 -8.574 378 HH22 ARG 53 2HH2 ARG 53 -4.400 12.552 -9.890 379 H GLY 54 H GLY 54 -4.070 7.543 -6.718 380 HA2 GLY 54 2HA GLY 54 -3.291 8.828 -4.328 381 HA3 GLY 54 1HA GLY 54 -2.407 7.326 -4.649 382 HA PRO 55 HA PRO 55 -0.877 10.926 -7.371 383 HB2 PRO 55 2HB PRO 55 1.527 10.908 -5.698 384 HB3 PRO 55 1HB PRO 55 0.542 12.292 -6.196 385 HG2 PRO 55 2HG PRO 55 0.603 11.400 -3.659 386 HG3 PRO 55 1HG PRO 55 -0.871 12.068 -4.381 387 HD2 PRO 55 2HD PRO 55 -0.113 9.207 -3.935 388 HD3 PRO 55 1HD PRO 55 -1.680 10.011 -3.697 389 H ASN 56 H ASN 56 0.329 8.084 -5.960 390 HA ASN 56 HA ASN 56 2.631 7.702 -7.484 391 HB2 ASN 56 2HB ASN 56 2.547 5.376 -6.679 392 HB3 ASN 56 1HB ASN 56 2.468 6.600 -5.437 393 HD21 ASN 56 1HD2 ASN 56 1.822 3.896 -5.190 394 HD22 ASN 56 2HD2 ASN 56 0.141 3.775 -4.783 395 H ALA 57 H ALA 57 -0.589 6.134 -7.667 396 HA ALA 57 HA ALA 57 -0.712 5.860 -10.455 397 HB1 ALA 57 1HB ALA 57 1.176 4.308 -10.110 398 HB2 ALA 57 2HB ALA 57 -0.250 3.419 -10.615 399 HB3 ALA 57 3HB ALA 57 0.236 3.413 -8.919 400 H GLY 58 H GLY 58 -2.046 3.272 -10.309 401 HA2 GLY 58 2HA GLY 58 -4.043 3.328 -8.280 402 HA3 GLY 58 1HA GLY 58 -4.611 3.752 -9.899 403 H ALA 59 H ALA 59 -2.290 1.418 -8.533 404 HA ALA 59 HA ALA 59 -3.469 -0.706 -10.116 405 HB1 ALA 59 1HB ALA 59 -1.612 0.215 -11.439 406 HB2 ALA 59 2HB ALA 59 -1.215 -1.395 -10.837 407 HB3 ALA 59 3HB ALA 59 -0.533 0.032 -10.058 408 H ARG 60 H ARG 60 -1.594 -2.616 -9.399 409 HA ARG 60 HA ARG 60 -1.882 -2.621 -6.490 410 HB2 ARG 60 2HB ARG 60 -2.210 -5.028 -6.627 411 HB3 ARG 60 1HB ARG 60 -3.383 -4.120 -7.589 412 HG2 ARG 60 2HG ARG 60 -2.171 -4.655 -9.632 413 HG3 ARG 60 1HG ARG 60 -0.967 -5.535 -8.688 414 HD2 ARG 60 2HD ARG 60 -2.589 -7.032 -9.738 415 HD3 ARG 60 1HD ARG 60 -2.656 -7.122 -7.973 416 HE ARG 60 HE ARG 60 -4.485 -5.227 -8.922 417 HH11 ARG 60 1HH1 ARG 60 -4.041 -8.748 -8.961 418 HH12 ARG 60 2HH1 ARG 60 -5.705 -9.090 -8.806 419 HH21 ARG 60 1HH2 ARG 60 -6.773 -5.721 -8.747 420 HH22 ARG 60 2HH2 ARG 60 -7.275 -7.341 -8.683 421 H PHE 61 H PHE 61 -0.211 -3.424 -5.282 422 HA PHE 61 HA PHE 61 2.265 -4.173 -6.669 423 HB2 PHE 61 2HB PHE 61 2.096 -2.165 -4.393 424 HB3 PHE 61 1HB PHE 61 3.571 -2.723 -5.165 425 HD1 PHE 61 1HD PHE 61 3.999 -2.071 -7.571 426 HD2 PHE 61 2HD PHE 61 0.852 -0.372 -5.259 427 HE1 PHE 61 1HE PHE 61 3.837 -0.202 -9.161 428 HE2 PHE 61 2HE PHE 61 0.689 1.495 -6.847 429 HZ PHE 61 HZ PHE 61 2.178 1.584 -8.798 430 H LEU 62 H LEU 62 3.393 -5.751 -5.560 431 HA LEU 62 HA LEU 62 2.307 -6.571 -2.968 432 HB2 LEU 62 2HB LEU 62 1.733 -8.192 -4.701 433 HB3 LEU 62 1HB LEU 62 3.392 -8.265 -5.239 434 HG LEU 62 HG LEU 62 2.718 -9.196 -2.453 435 HD11 LEU 62 1HD1 LEU 62 2.295 -11.431 -3.366 436 HD12 LEU 62 2HD1 LEU 62 2.399 -10.783 -5.005 437 HD13 LEU 62 3HD1 LEU 62 1.090 -10.279 -3.939 438 HD21 LEU 62 3HD2 LEU 62 5.077 -9.049 -3.161 439 HD22 LEU 62 1HD2 LEU 62 4.720 -10.092 -4.538 440 HD23 LEU 62 2HD2 LEU 62 4.583 -10.721 -2.898 441 H LEU 63 H LEU 63 3.754 -6.893 -1.329 442 HA LEU 63 HA LEU 63 6.456 -5.940 -1.900 443 HB2 LEU 63 2HB LEU 63 5.230 -6.492 0.813 444 HB3 LEU 63 1HB LEU 63 6.763 -5.714 0.505 445 HG LEU 63 HG LEU 63 5.462 -3.945 1.078 446 HD11 LEU 63 1HD1 LEU 63 5.030 -4.032 -1.877 447 HD12 LEU 63 2HD1 LEU 63 6.475 -3.479 -1.048 448 HD13 LEU 63 3HD1 LEU 63 4.952 -2.599 -0.851 449 HD21 LEU 63 3HD2 LEU 63 3.361 -5.129 1.321 450 HD22 LEU 63 1HD2 LEU 63 3.128 -5.114 -0.429 451 HD23 LEU 63 2HD2 LEU 63 3.118 -3.600 0.479 452 H ASP 64 H ASP 64 7.933 -7.389 -2.338 453 HA ASP 64 HA ASP 64 7.759 -10.062 -1.085 454 HB2 ASP 64 2HB ASP 64 7.697 -9.968 -3.611 455 HB3 ASP 64 1HB ASP 64 9.283 -9.222 -3.585 456 H GLN 65 H GLN 65 8.932 -7.371 -0.235 457 HA GLN 65 HA GLN 65 11.599 -8.351 0.444 458 HB2 GLN 65 2HB GLN 65 12.403 -5.996 0.329 459 HB3 GLN 65 1HB GLN 65 11.879 -6.629 -1.226 460 HG2 GLN 65 2HG GLN 65 9.750 -5.453 -0.970 461 HG3 GLN 65 1HG GLN 65 10.307 -4.793 0.563 462 HE21 GLN 65 1HE2 GLN 65 11.932 -3.226 0.559 463 HE22 GLN 65 2HE2 GLN 65 12.321 -2.368 -0.885 464 HA PRO 66 HA PRO 66 10.464 -7.965 4.648 465 HB2 PRO 66 2HB PRO 66 12.853 -6.941 5.675 466 HB3 PRO 66 1HB PRO 66 12.458 -8.647 5.463 467 HG2 PRO 66 2HG PRO 66 14.074 -6.843 3.739 468 HG3 PRO 66 1HG PRO 66 14.266 -8.573 4.061 469 HD2 PRO 66 2HD PRO 66 13.251 -7.657 1.738 470 HD3 PRO 66 1HD PRO 66 12.703 -9.176 2.475 471 H THR 67 H THR 67 12.469 -5.158 3.733 472 HA THR 67 HA THR 67 10.601 -3.487 5.237 473 HB THR 67 HB THR 67 13.519 -2.951 4.588 474 HG1 THR 67 1HG THR 67 13.546 -4.481 6.112 475 HG21 THR 67 3HG2 THR 67 11.588 -1.501 6.423 476 HG22 THR 67 1HG2 THR 67 12.155 -0.916 4.855 477 HG23 THR 67 2HG2 THR 67 13.292 -1.105 6.186 478 H THR 68 H THR 68 9.230 -2.658 3.747 479 HA THR 68 HA THR 68 10.371 -1.669 1.243 480 HB THR 68 HB THR 68 7.473 -1.883 2.055 481 HG1 THR 68 1HG THR 68 8.362 -3.947 1.997 482 HG21 THR 68 3HG2 THR 68 7.040 -1.665 -0.330 483 HG22 THR 68 1HG2 THR 68 8.775 -1.644 -0.659 484 HG23 THR 68 2HG2 THR 68 8.030 -0.318 0.225 485 H THR 69 H THR 69 10.983 0.432 1.322 486 HA THR 69 HA THR 69 9.606 2.140 3.210 487 HB THR 69 HB THR 69 11.525 3.756 2.769 488 HG1 THR 69 1HG THR 69 12.291 1.676 1.081 489 HG21 THR 69 3HG2 THR 69 11.467 2.437 4.794 490 HG22 THR 69 1HG2 THR 69 13.118 2.513 4.196 491 HG23 THR 69 2HG2 THR 69 12.162 1.051 3.951 492 H ALA 70 H ALA 70 8.037 3.316 2.542 493 HA ALA 70 HA ALA 70 7.952 4.236 -0.221 494 HB1 ALA 70 1HB ALA 70 5.597 4.797 0.300 495 HB2 ALA 70 2HB ALA 70 5.840 4.224 1.951 496 HB3 ALA 70 3HB ALA 70 5.931 3.089 0.605 497 H GLY 71 H GLY 71 8.099 6.361 -0.613 498 HA2 GLY 71 2HA GLY 71 8.413 8.638 -0.145 499 HA3 GLY 71 1HA GLY 71 8.097 8.309 1.558 500 H ARG 72 H ARG 72 10.440 7.873 -0.977 501 HA ARG 72 HA ARG 72 12.646 8.588 0.663 502 HB2 ARG 72 2HB ARG 72 12.391 6.217 1.255 503 HB3 ARG 72 1HB ARG 72 12.272 5.784 -0.434 504 HG2 ARG 72 2HG ARG 72 14.607 6.301 -0.766 505 HG3 ARG 72 1HG ARG 72 14.738 6.870 0.911 506 HD2 ARG 72 2HD ARG 72 14.340 4.735 1.787 507 HD3 ARG 72 1HD ARG 72 13.743 4.123 0.255 508 HE ARG 72 HE ARG 72 16.478 4.949 0.190 509 HH11 ARG 72 1HH1 ARG 72 14.285 2.298 1.007 510 HH12 ARG 72 2HH1 ARG 72 15.393 1.054 0.646 511 HH21 ARG 72 1HH2 ARG 72 18.043 3.176 -0.368 512 HH22 ARG 72 2HH2 ARG 72 17.527 1.571 -0.128 513 H HIS 73 H HIS 73 13.421 10.019 -0.717 514 HA HIS 73 HA HIS 73 12.506 10.284 -3.279 515 HB2 HIS 73 2HB HIS 73 14.823 11.662 -1.944 516 HB3 HIS 73 1HB HIS 73 14.316 12.053 -3.582 517 HD1 HIS 73 1HD HIS 73 12.876 14.087 -3.581 518 HD2 HIS 73 2HD HIS 73 12.334 11.821 -0.144 519 HE1 HIS 73 1HE HIS 73 11.175 15.316 -2.196 520 HA PRO 74 HA PRO 74 16.442 9.017 -5.558 521 HB2 PRO 74 2HB PRO 74 18.444 7.695 -4.277 522 HB3 PRO 74 1HB PRO 74 18.401 9.447 -4.478 523 HG2 PRO 74 2HG PRO 74 17.650 7.783 -2.134 524 HG3 PRO 74 1HG PRO 74 18.532 9.320 -2.161 525 HD2 PRO 74 2HD PRO 74 15.903 9.147 -1.507 526 HD3 PRO 74 1HD PRO 74 16.600 10.558 -2.324 527 H GLU 75 H GLU 75 15.667 6.724 -2.937 528 HA GLU 75 HA GLU 75 15.497 4.614 -4.971 529 HB2 GLU 75 2HB GLU 75 16.461 4.298 -2.135 530 HB3 GLU 75 1HB GLU 75 16.230 3.000 -3.281 531 HG2 GLU 75 2HG GLU 75 18.042 3.873 -4.643 532 HG3 GLU 75 1HG GLU 75 18.244 5.222 -3.517 533 H SER 76 H SER 76 13.179 5.379 -4.879 534 HA SER 76 HA SER 76 11.787 4.695 -2.481 535 HB2 SER 76 2HB SER 76 9.749 5.060 -3.964 536 HB3 SER 76 1HB SER 76 10.826 6.446 -3.802 537 HG SER 76 HG SER 76 10.527 4.673 -5.980 538 H ASP 77 H ASP 77 11.265 2.651 -1.889 539 HA ASP 77 HA ASP 77 11.651 0.445 -3.658 540 HB2 ASP 77 2HB ASP 77 10.081 0.584 -1.066 541 HB3 ASP 77 1HB ASP 77 10.364 -0.896 -1.969 542 H ILE 78 H ILE 78 8.772 1.895 -2.273 543 HA ILE 78 HA ILE 78 7.460 1.326 -4.804 544 HB ILE 78 HB ILE 78 5.293 1.143 -3.638 545 HG12 ILE 78 2HG1 ILE 78 6.898 0.976 -1.071 546 HG13 ILE 78 1HG1 ILE 78 5.992 2.392 -1.586 547 HG21 ILE 78 1HG2 ILE 78 5.573 -1.133 -2.760 548 HG22 ILE 78 2HG2 ILE 78 7.320 -0.901 -2.768 549 HG23 ILE 78 3HG2 ILE 78 6.424 -0.881 -4.285 550 HD11 ILE 78 3HD1 ILE 78 3.937 1.146 -1.483 551 HD12 ILE 78 1HD1 ILE 78 4.780 1.099 0.062 552 HD13 ILE 78 2HD1 ILE 78 4.812 -0.315 -1.002 553 H PHE 79 H PHE 79 6.101 2.870 -5.493 554 HA PHE 79 HA PHE 79 6.502 5.433 -4.249 555 HB2 PHE 79 2HB PHE 79 5.683 6.380 -6.452 556 HB3 PHE 79 1HB PHE 79 7.193 5.500 -6.538 557 HD1 PHE 79 2HD PHE 79 6.934 2.950 -7.271 558 HD2 PHE 79 1HD PHE 79 4.067 5.991 -8.030 559 HE1 PHE 79 2HE PHE 79 6.032 1.627 -9.125 560 HE2 PHE 79 1HE PHE 79 3.168 4.677 -9.886 561 HZ PHE 79 HZ PHE 79 4.146 2.489 -10.439 562 H LEU 80 H LEU 80 4.848 6.708 -3.617 563 HA LEU 80 HA LEU 80 2.115 5.756 -3.646 564 HB2 LEU 80 2HB LEU 80 3.093 4.523 -1.730 565 HB3 LEU 80 1HB LEU 80 3.651 6.023 -1.038 566 HG LEU 80 HG LEU 80 1.280 6.733 -0.768 567 HD11 LEU 80 1HD1 LEU 80 -0.494 5.065 -1.020 568 HD12 LEU 80 2HD1 LEU 80 0.670 3.941 -1.724 569 HD13 LEU 80 3HD1 LEU 80 0.276 5.443 -2.561 570 HD21 LEU 80 3HD2 LEU 80 0.763 5.198 1.078 571 HD22 LEU 80 1HD2 LEU 80 2.461 5.674 1.081 572 HD23 LEU 80 2HD2 LEU 80 1.994 4.083 0.482 573 H ASP 81 H ASP 81 3.324 7.774 -1.302 574 HA ASP 81 HA ASP 81 1.996 10.047 -2.373 575 HB2 ASP 81 2HB ASP 81 3.911 9.713 -0.068 576 HB3 ASP 81 1HB ASP 81 3.295 11.286 -0.552 577 H ASP 82 H ASP 82 2.733 10.512 -4.276 578 HA ASP 82 HA ASP 82 5.544 10.679 -4.956 579 HB2 ASP 82 2HB ASP 82 3.825 9.991 -6.612 580 HB3 ASP 82 1HB ASP 82 3.132 11.602 -6.509 581 H VAL 83 H VAL 83 2.909 12.947 -4.852 582 HA VAL 83 HA VAL 83 4.683 15.234 -4.968 583 HB VAL 83 HB VAL 83 1.674 15.138 -4.581 584 HG11 VAL 83 1HG1 VAL 83 1.702 17.447 -5.374 585 HG12 VAL 83 2HG1 VAL 83 3.464 17.402 -5.441 586 HG13 VAL 83 3HG1 VAL 83 2.638 17.257 -3.891 587 HG21 VAL 83 3HG2 VAL 83 3.262 15.483 -7.120 588 HG22 VAL 83 1HG2 VAL 83 1.510 15.619 -6.974 589 HG23 VAL 83 2HG2 VAL 83 2.304 14.070 -6.677 590 H THR 84 H THR 84 2.560 13.604 -2.680 591 HA THR 84 HA THR 84 3.006 15.460 -0.549 592 HB THR 84 HB THR 84 1.530 13.577 0.494 593 HG1 THR 84 1HG THR 84 1.077 12.058 -0.828 594 HG21 THR 84 3HG2 THR 84 0.757 15.852 -0.080 595 HG22 THR 84 1HG2 THR 84 -0.454 14.646 -0.513 596 HG23 THR 84 2HG2 THR 84 0.564 15.358 -1.763 597 H VAL 85 H VAL 85 5.344 14.113 -1.529 598 HA VAL 85 HA VAL 85 5.876 11.750 0.024 599 HB VAL 85 HB VAL 85 6.629 11.977 -2.316 600 HG11 VAL 85 1HG1 VAL 85 8.593 13.338 -2.885 601 HG12 VAL 85 2HG1 VAL 85 8.518 14.073 -1.285 602 HG13 VAL 85 3HG1 VAL 85 7.192 14.306 -2.425 603 HG21 VAL 85 3HG2 VAL 85 7.759 10.388 -0.893 604 HG22 VAL 85 1HG2 VAL 85 8.878 11.631 -0.337 605 HG23 VAL 85 2HG2 VAL 85 8.919 11.098 -2.021 606 H SER 86 H SER 86 7.196 11.530 1.715 607 HA SER 86 HA SER 86 8.693 13.823 2.694 608 HB2 SER 86 2HB SER 86 6.599 13.415 4.024 609 HB3 SER 86 1HB SER 86 7.193 11.798 4.389 610 HG SER 86 HG SER 86 8.240 14.303 5.238 611 H ARG 87 H ARG 87 10.074 12.647 4.601 612 HA ARG 87 HA ARG 87 11.665 10.650 3.172 613 HB2 ARG 87 2HB ARG 87 13.499 11.388 4.720 614 HB3 ARG 87 1HB ARG 87 12.907 12.643 3.642 615 HG2 ARG 87 2HG ARG 87 11.489 13.476 5.524 616 HG3 ARG 87 1HG ARG 87 12.304 12.324 6.573 617 HD2 ARG 87 2HD ARG 87 13.626 14.542 5.012 618 HD3 ARG 87 1HD ARG 87 13.237 14.574 6.728 619 HE ARG 87 HE ARG 87 14.916 12.384 5.942 620 HH11 ARG 87 1HH1 ARG 87 14.842 15.754 7.030 621 HH12 ARG 87 2HH1 ARG 87 16.429 15.744 7.652 622 HH21 ARG 87 1HH2 ARG 87 17.104 12.380 6.761 623 HH22 ARG 87 2HH2 ARG 87 17.750 13.781 7.481 624 H ARG 88 H ARG 88 11.533 8.636 3.832 625 HA ARG 88 HA ARG 88 11.142 6.756 5.069 626 HB2 ARG 88 2HB ARG 88 11.618 8.600 7.449 627 HB3 ARG 88 1HB ARG 88 11.405 6.863 7.575 628 HG2 ARG 88 2HG ARG 88 13.643 8.217 6.078 629 HG3 ARG 88 1HG ARG 88 13.756 7.589 7.718 630 HD2 ARG 88 2HD ARG 88 13.151 5.976 5.238 631 HD3 ARG 88 1HD ARG 88 14.684 6.022 6.100 632 HE ARG 88 HE ARG 88 12.204 5.012 7.338 633 HH11 ARG 88 1HH1 ARG 88 15.687 4.690 6.734 634 HH12 ARG 88 2HH1 ARG 88 15.851 3.232 7.564 635 HH21 ARG 88 1HH2 ARG 88 12.406 2.936 8.450 636 HH22 ARG 88 2HH2 ARG 88 13.908 2.177 8.526 637 H HIS 89 H HIS 89 9.150 8.406 4.127 638 HA HIS 89 HA HIS 89 7.124 9.278 5.721 639 HB2 HIS 89 2HB HIS 89 7.278 9.622 3.285 640 HB3 HIS 89 1HB HIS 89 6.862 7.931 3.049 641 HD2 HIS 89 2HD HIS 89 4.247 7.337 3.014 642 HE1 HIS 89 1HE HIS 89 2.880 11.248 3.792 643 HE2 HIS 89 2HE HIS 89 2.437 9.082 2.583 644 H ALA 90 H ALA 90 6.990 6.054 4.131 645 HA ALA 90 HA ALA 90 5.683 5.063 6.523 646 HB1 ALA 90 1HB ALA 90 3.855 4.052 5.254 647 HB2 ALA 90 2HB ALA 90 4.472 4.783 3.774 648 HB3 ALA 90 3HB ALA 90 3.855 5.805 5.069 649 H GLU 91 H GLU 91 6.075 2.894 6.912 650 HA GLU 91 HA GLU 91 7.698 1.546 4.894 651 HB2 GLU 91 2HB GLU 91 7.757 1.302 7.889 652 HB3 GLU 91 1HB GLU 91 8.584 0.207 6.798 653 HG2 GLU 91 2HG GLU 91 9.870 2.113 5.932 654 HG3 GLU 91 1HG GLU 91 9.106 3.142 7.149 655 H PHE 92 H PHE 92 6.910 -0.180 4.105 656 HA PHE 92 HA PHE 92 4.706 -1.561 5.465 657 HB2 PHE 92 2HB PHE 92 5.604 -1.651 2.546 658 HB3 PHE 92 1HB PHE 92 4.338 -2.660 3.227 659 HD1 PHE 92 2HD PHE 92 5.274 0.911 2.665 660 HD2 PHE 92 1HD PHE 92 2.136 -1.923 3.179 661 HE1 PHE 92 2HE PHE 92 3.617 2.648 2.112 662 HE2 PHE 92 1HE PHE 92 0.481 -0.195 2.625 663 HZ PHE 92 HZ PHE 92 1.217 2.095 2.094 664 H ARG 93 H ARG 93 5.463 -3.235 6.639 665 HA ARG 93 HA ARG 93 7.867 -4.589 5.629 666 HB2 ARG 93 2HB ARG 93 7.093 -4.137 8.501 667 HB3 ARG 93 1HB ARG 93 8.516 -4.977 7.930 668 HG2 ARG 93 2HG ARG 93 9.379 -2.861 7.023 669 HG3 ARG 93 1HG ARG 93 7.944 -2.031 7.644 670 HD2 ARG 93 2HD ARG 93 8.488 -2.906 9.893 671 HD3 ARG 93 1HD ARG 93 9.989 -3.543 9.239 672 HE ARG 93 HE ARG 93 10.059 -0.876 8.627 673 HH11 ARG 93 1HH1 ARG 93 9.786 -2.807 11.583 674 HH12 ARG 93 2HH1 ARG 93 10.395 -1.581 12.591 675 HH21 ARG 93 1HH2 ARG 93 10.854 0.775 9.971 676 HH22 ARG 93 2HH2 ARG 93 11.047 0.556 11.645 677 H ILE 94 H ILE 94 7.883 -6.775 5.933 678 HA ILE 94 HA ILE 94 5.444 -7.813 7.154 679 HB ILE 94 HB ILE 94 5.303 -9.738 5.819 680 HG12 ILE 94 2HG1 ILE 94 7.641 -10.461 5.710 681 HG13 ILE 94 1HG1 ILE 94 6.926 -10.480 4.106 682 HG21 ILE 94 1HG2 ILE 94 6.012 -7.513 3.935 683 HG22 ILE 94 2HG2 ILE 94 4.435 -7.848 4.650 684 HG23 ILE 94 3HG2 ILE 94 5.137 -8.978 3.490 685 HD11 ILE 94 3HD1 ILE 94 9.213 -9.656 4.138 686 HD12 ILE 94 1HD1 ILE 94 8.679 -8.392 5.247 687 HD13 ILE 94 2HD1 ILE 94 8.068 -8.413 3.579 688 H ASN 95 H ASN 95 5.593 -9.324 8.632 689 HA ASN 95 HA ASN 95 8.268 -10.145 9.414 690 HB2 ASN 95 2HB ASN 95 7.276 -8.456 10.994 691 HB3 ASN 95 1HB ASN 95 5.895 -9.516 11.220 692 HD21 ASN 95 1HD2 ASN 95 6.011 -11.047 12.777 693 HD22 ASN 95 2HD2 ASN 95 7.450 -11.429 13.621 694 H GLU 96 H GLU 96 8.381 -12.355 10.077 695 HA GLU 96 HA GLU 96 6.883 -14.009 8.452 696 HB2 GLU 96 2HB GLU 96 7.993 -15.893 9.335 697 HB3 GLU 96 1HB GLU 96 9.137 -14.576 9.416 698 HG2 GLU 96 2HG GLU 96 7.541 -15.645 11.742 699 HG3 GLU 96 1HG GLU 96 9.199 -16.076 11.370 700 H GLY 97 H GLY 97 5.959 -12.913 11.527 701 HA2 GLY 97 2HA GLY 97 3.810 -14.922 11.574 702 HA3 GLY 97 1HA GLY 97 4.291 -13.967 12.958 703 H GLU 98 H GLU 98 4.254 -11.415 11.253 704 HA GLU 98 HA GLU 98 1.403 -11.085 10.801 705 HB2 GLU 98 2HB GLU 98 2.997 -9.530 12.852 706 HB3 GLU 98 1HB GLU 98 1.422 -9.050 12.253 707 HG2 GLU 98 2HG GLU 98 0.426 -11.050 13.246 708 HG3 GLU 98 1HG GLU 98 2.018 -11.592 13.763 709 H PHE 99 H PHE 99 1.012 -9.305 9.429 710 HA PHE 99 HA PHE 99 3.406 -8.128 8.183 711 HB2 PHE 99 2HB PHE 99 0.528 -7.668 7.306 712 HB3 PHE 99 1HB PHE 99 1.989 -7.444 6.378 713 HD1 PHE 99 1HD PHE 99 3.339 -9.502 5.758 714 HD2 PHE 99 2HD PHE 99 -0.649 -9.695 7.184 715 HE1 PHE 99 1HE PHE 99 3.108 -11.756 4.803 716 HE2 PHE 99 2HE PHE 99 -0.893 -11.947 6.237 717 HZ PHE 99 HZ PHE 99 0.988 -12.983 5.042 718 H GLU 100 H GLU 100 3.930 -5.926 8.578 719 HA GLU 100 HA GLU 100 1.911 -4.458 10.086 720 HB2 GLU 100 2HB GLU 100 3.444 -5.498 11.705 721 HB3 GLU 100 1HB GLU 100 4.801 -4.700 10.925 722 HG2 GLU 100 2HG GLU 100 3.914 -2.537 11.542 723 HG3 GLU 100 1HG GLU 100 2.508 -3.287 12.280 724 H VAL 101 H VAL 101 1.650 -2.444 9.469 725 HA VAL 101 HA VAL 101 3.719 -1.239 7.756 726 HB VAL 101 HB VAL 101 0.735 -0.647 7.781 727 HG11 VAL 101 1HG1 VAL 101 1.181 0.679 5.762 728 HG12 VAL 101 2HG1 VAL 101 2.902 0.352 5.934 729 HG13 VAL 101 3HG1 VAL 101 2.059 1.296 7.161 730 HG21 VAL 101 3HG2 VAL 101 0.657 -1.715 5.569 731 HG22 VAL 101 1HG2 VAL 101 1.154 -2.853 6.824 732 HG23 VAL 101 2HG2 VAL 101 2.355 -2.163 5.732 733 H VAL 102 H VAL 102 4.732 0.323 8.758 734 HA VAL 102 HA VAL 102 3.319 1.906 10.782 735 HB VAL 102 HB VAL 102 5.504 2.239 11.954 736 HG11 VAL 102 1HG1 VAL 102 5.627 0.040 13.023 737 HG12 VAL 102 2HG1 VAL 102 4.661 -0.636 11.711 738 HG13 VAL 102 3HG1 VAL 102 3.960 0.570 12.790 739 HG21 VAL 102 3HG2 VAL 102 7.044 1.746 10.116 740 HG22 VAL 102 1HG2 VAL 102 6.520 0.061 10.110 741 HG23 VAL 102 2HG2 VAL 102 7.389 0.712 11.501 742 H ASP 103 H ASP 103 3.243 4.112 10.276 743 HA ASP 103 HA ASP 103 5.268 4.897 8.341 744 HB2 ASP 103 2HB ASP 103 4.027 6.796 7.797 745 HB3 ASP 103 1HB ASP 103 2.774 5.627 8.189 746 H VAL 104 H VAL 104 6.866 6.302 8.762 747 HA VAL 104 HA VAL 104 7.014 7.195 11.531 748 HB VAL 104 HB VAL 104 9.534 6.865 11.480 749 HG11 VAL 104 1HG1 VAL 104 8.093 5.340 12.709 750 HG12 VAL 104 2HG1 VAL 104 9.419 4.449 11.956 751 HG13 VAL 104 3HG1 VAL 104 7.808 4.396 11.248 752 HG21 VAL 104 3HG2 VAL 104 10.423 5.214 9.891 753 HG22 VAL 104 1HG2 VAL 104 9.833 6.662 9.072 754 HG23 VAL 104 2HG2 VAL 104 8.868 5.187 9.061 755 H GLY 105 H GLY 105 6.855 8.215 8.451 756 HA2 GLY 105 2HA GLY 105 8.514 10.590 8.830 757 HA3 GLY 105 1HA GLY 105 7.550 10.228 7.404 758 H SER 106 H SER 106 5.126 9.710 8.493 759 HA SER 106 HA SER 106 3.207 10.569 9.186 760 HB2 SER 106 2HB SER 106 4.881 11.938 11.285 761 HB3 SER 106 1HB SER 106 3.168 11.529 11.399 762 HG SER 106 HG SER 106 4.131 9.315 10.783 763 H LEU 107 H LEU 107 4.602 12.185 7.156 764 HA LEU 107 HA LEU 107 4.024 14.895 7.907 765 HB2 LEU 107 2HB LEU 107 5.964 14.339 6.553 766 HB3 LEU 107 1HB LEU 107 4.908 13.798 5.268 767 HG LEU 107 HG LEU 107 3.978 16.052 5.062 768 HD11 LEU 107 1HD1 LEU 107 6.107 16.817 7.050 769 HD12 LEU 107 2HD1 LEU 107 4.358 16.900 7.291 770 HD13 LEU 107 3HD1 LEU 107 5.136 17.951 6.116 771 HD21 LEU 107 3HD2 LEU 107 5.773 15.397 3.576 772 HD22 LEU 107 1HD2 LEU 107 6.974 15.891 4.774 773 HD23 LEU 107 2HD2 LEU 107 5.942 17.098 4.009 774 H ASN 108 H ASN 108 2.719 12.604 5.491 775 HA ASN 108 HA ASN 108 0.720 14.597 4.848 776 HB2 ASN 108 2HB ASN 108 1.858 13.193 3.051 777 HB3 ASN 108 1HB ASN 108 0.897 11.831 3.625 778 HD21 ASN 108 1HD2 ASN 108 0.060 11.816 1.386 779 HD22 ASN 108 2HD2 ASN 108 -1.212 12.892 1.008 780 H GLY 109 H GLY 109 0.979 11.901 6.867 781 HA2 GLY 109 2HA GLY 109 -0.577 11.598 8.665 782 HA3 GLY 109 1HA GLY 109 -1.814 12.335 7.665 783 H THR 110 H THR 110 -1.168 9.589 9.128 784 HA THR 110 HA THR 110 -2.079 7.851 6.974 785 HB THR 110 HB THR 110 -1.194 6.050 8.701 786 HG1 THR 110 1HG THR 110 0.530 7.022 9.942 787 HG21 THR 110 3HG2 THR 110 1.019 6.259 7.747 788 HG22 THR 110 1HG2 THR 110 0.709 7.937 7.292 789 HG23 THR 110 2HG2 THR 110 -0.174 6.629 6.509 790 H TYR 111 H TYR 111 -3.989 6.852 7.144 791 HA TYR 111 HA TYR 111 -5.414 6.783 9.721 792 HB2 TYR 111 2HB TYR 111 -6.744 7.368 7.072 793 HB3 TYR 111 1HB TYR 111 -7.460 7.442 8.662 794 HD1 TYR 111 1HD TYR 111 -5.377 9.175 6.206 795 HD2 TYR 111 2HD TYR 111 -7.199 9.444 10.033 796 HE1 TYR 111 1HE TYR 111 -5.012 11.604 6.197 797 HE2 TYR 111 2HE TYR 111 -6.834 11.873 10.040 798 HH TYR 111 HH TYR 111 -5.910 13.585 7.232 799 H VAL 112 H VAL 112 -6.646 4.860 9.878 800 HA VAL 112 HA VAL 112 -6.796 3.247 7.446 801 HB VAL 112 HB VAL 112 -5.224 2.164 9.127 802 HG11 VAL 112 1HG1 VAL 112 -6.125 1.118 11.144 803 HG12 VAL 112 2HG1 VAL 112 -7.675 1.900 10.848 804 HG13 VAL 112 3HG1 VAL 112 -6.249 2.875 11.194 805 HG21 VAL 112 3HG2 VAL 112 -6.359 0.779 7.494 806 HG22 VAL 112 1HG2 VAL 112 -7.760 0.643 8.557 807 HG23 VAL 112 2HG2 VAL 112 -6.223 -0.083 9.030 808 H ASN 113 H ASN 113 -8.805 2.771 6.852 809 HA ASN 113 HA ASN 113 -11.066 2.888 6.752 810 HB2 ASN 113 2HB ASN 113 -10.875 2.429 9.755 811 HB3 ASN 113 1HB ASN 113 -12.371 2.369 8.839 812 HD21 ASN 113 1HD2 ASN 113 -12.765 0.623 7.510 813 HD22 ASN 113 2HD2 ASN 113 -11.812 -0.818 7.567 814 H ARG 114 H ARG 114 -9.373 5.183 7.293 815 HA ARG 114 HA ARG 114 -9.482 7.414 7.423 816 HB2 ARG 114 2HB ARG 114 -12.453 6.982 7.718 817 HB3 ARG 114 1HB ARG 114 -11.728 8.580 7.644 818 HG2 ARG 114 2HG ARG 114 -10.842 8.058 5.420 819 HG3 ARG 114 1HG ARG 114 -11.580 6.461 5.504 820 HD2 ARG 114 2HD ARG 114 -12.940 8.010 4.193 821 HD3 ARG 114 1HD ARG 114 -13.789 7.473 5.642 822 HE ARG 114 HE ARG 114 -12.697 9.748 6.483 823 HH11 ARG 114 1HH1 ARG 114 -14.428 9.088 3.455 824 HH12 ARG 114 2HH1 ARG 114 -15.115 10.643 3.358 825 HH21 ARG 114 1HH2 ARG 114 -13.699 11.894 6.350 826 HH22 ARG 114 2HH2 ARG 114 -14.676 12.260 5.025 827 H GLU 115 H GLU 115 -9.517 5.512 9.849 828 HA GLU 115 HA GLU 115 -9.886 7.542 11.929 829 HB2 GLU 115 2HB GLU 115 -10.771 5.038 11.924 830 HB3 GLU 115 1HB GLU 115 -9.121 4.650 12.344 831 HG2 GLU 115 2HG GLU 115 -10.983 6.401 13.949 832 HG3 GLU 115 1HG GLU 115 -10.618 4.718 14.274 833 HA PRO 116 HA PRO 116 -5.472 8.482 11.282 834 HB2 PRO 116 2HB PRO 116 -5.751 9.216 14.162 835 HB3 PRO 116 1HB PRO 116 -5.016 10.120 12.835 836 HG2 PRO 116 2HG PRO 116 -7.431 10.772 13.746 837 HG3 PRO 116 1HG PRO 116 -7.053 10.846 12.015 838 HD2 PRO 116 2HD PRO 116 -8.697 8.873 13.511 839 HD3 PRO 116 1HD PRO 116 -8.852 9.439 11.834 840 H ARG 117 H ARG 117 -3.924 6.955 11.316 841 HA ARG 117 HA ARG 117 -3.424 5.439 13.728 842 HB2 ARG 117 2HB ARG 117 -5.300 4.304 12.567 843 HB3 ARG 117 1HB ARG 117 -4.260 4.104 11.166 844 HG2 ARG 117 2HG ARG 117 -4.337 2.051 12.380 845 HG3 ARG 117 1HG ARG 117 -2.733 2.756 12.562 846 HD2 ARG 117 2HD ARG 117 -3.298 3.574 14.758 847 HD3 ARG 117 1HD ARG 117 -4.960 3.012 14.579 848 HE ARG 117 HE ARG 117 -2.811 1.085 14.342 849 HH11 ARG 117 1HH1 ARG 117 -5.390 2.457 16.389 850 HH12 ARG 117 2HH1 ARG 117 -5.416 1.124 17.432 851 HH21 ARG 117 1HH2 ARG 117 -2.946 -0.778 15.783 852 HH22 ARG 117 2HH2 ARG 117 -4.060 -0.745 17.065 853 H ASN 118 H ASN 118 -1.244 5.457 13.824 854 HA ASN 118 HA ASN 118 0.334 5.939 11.466 855 HB2 ASN 118 2HB ASN 118 1.150 5.557 14.348 856 HB3 ASN 118 1HB ASN 118 2.293 5.827 13.044 857 HD21 ASN 118 1HD2 ASN 118 2.139 7.799 11.907 858 HD22 ASN 118 2HD2 ASN 118 1.596 9.234 12.728 859 H ALA 119 H ALA 119 -0.218 3.227 13.641 860 HA ALA 119 HA ALA 119 1.357 1.598 11.772 861 HB1 ALA 119 1HB ALA 119 2.557 1.870 13.882 862 HB2 ALA 119 2HB ALA 119 2.005 0.200 13.680 863 HB3 ALA 119 3HB ALA 119 1.146 1.290 14.762 864 H GLN 120 H GLN 120 0.403 -0.226 11.111 865 HA GLN 120 HA GLN 120 -1.902 -1.195 12.580 866 HB2 GLN 120 2HB GLN 120 -2.860 0.177 10.772 867 HB3 GLN 120 1HB GLN 120 -1.941 -0.740 9.587 868 HG2 GLN 120 2HG GLN 120 -4.329 -1.408 9.716 869 HG3 GLN 120 1HG GLN 120 -3.212 -2.729 10.042 870 HE21 GLN 120 1HE2 GLN 120 -5.406 -0.523 11.449 871 HE22 GLN 120 2HE2 GLN 120 -5.739 -1.370 12.911 872 H VAL 121 H VAL 121 -2.129 -3.290 12.557 873 HA VAL 121 HA VAL 121 0.079 -4.749 11.290 874 HB VAL 121 HB VAL 121 -1.355 -5.631 13.799 875 HG11 VAL 121 1HG1 VAL 121 0.574 -7.160 14.010 876 HG12 VAL 121 2HG1 VAL 121 1.173 -6.573 12.456 877 HG13 VAL 121 3HG1 VAL 121 -0.363 -7.432 12.543 878 HG21 VAL 121 3HG2 VAL 121 -0.105 -3.545 14.235 879 HG22 VAL 121 1HG2 VAL 121 1.356 -4.309 13.612 880 HG23 VAL 121 2HG2 VAL 121 0.594 -4.925 15.078 881 H MET 122 H MET 122 -0.799 -5.380 9.578 882 HA MET 122 HA MET 122 -2.202 -6.127 8.024 883 HB2 MET 122 2HB MET 122 -2.448 -8.545 8.041 884 HB3 MET 122 1HB MET 122 -0.866 -8.030 8.579 885 HG2 MET 122 2HG MET 122 -1.587 -8.456 10.920 886 HG3 MET 122 1HG MET 122 -3.096 -9.108 10.274 887 HE1 MET 122 3HE MET 122 -1.341 -10.842 12.176 888 HE2 MET 122 1HE MET 122 -1.257 -12.387 11.324 889 HE3 MET 122 2HE MET 122 -2.774 -11.491 11.384 890 H GLN 123 H GLN 123 -4.080 -5.093 7.640 891 HA GLN 123 HA GLN 123 -6.380 -6.246 8.919 892 HB2 GLN 123 2HB GLN 123 -5.686 -3.818 9.453 893 HB3 GLN 123 1HB GLN 123 -5.891 -3.490 7.745 894 HG2 GLN 123 2HG GLN 123 -7.821 -2.751 8.922 895 HG3 GLN 123 1HG GLN 123 -8.236 -4.163 7.955 896 HE21 GLN 123 1HE2 GLN 123 -9.991 -4.512 9.168 897 HE22 GLN 123 2HE2 GLN 123 -9.920 -5.202 10.769 898 H THR 124 H THR 124 -7.461 -7.317 7.212 899 HA THR 124 HA THR 124 -6.355 -6.698 4.601 900 HB THR 124 HB THR 124 -5.703 -8.944 5.377 901 HG1 THR 124 1HG THR 124 -7.469 -9.576 3.320 902 HG21 THR 124 3HG2 THR 124 -7.379 -10.764 5.523 903 HG22 THR 124 1HG2 THR 124 -8.665 -9.576 5.314 904 HG23 THR 124 2HG2 THR 124 -7.648 -9.529 6.752 905 H GLY 125 H GLY 125 -7.565 -6.065 3.079 906 HA2 GLY 125 2HA GLY 125 -9.500 -5.795 1.820 907 HA3 GLY 125 1HA GLY 125 -10.425 -6.575 3.106 908 H ASP 126 H ASP 126 -8.196 -4.210 4.119 909 HA ASP 126 HA ASP 126 -10.432 -2.402 4.396 910 HB2 ASP 126 2HB ASP 126 -8.312 -3.086 6.361 911 HB3 ASP 126 1HB ASP 126 -9.007 -1.477 6.403 912 H GLU 127 H GLU 127 -9.845 -0.158 4.767 913 HA GLU 127 HA GLU 127 -8.110 0.538 2.533 914 HB2 GLU 127 2HB GLU 127 -10.497 0.929 2.265 915 HB3 GLU 127 1HB GLU 127 -10.513 1.894 3.725 916 HG2 GLU 127 2HG GLU 127 -9.104 3.556 2.657 917 HG3 GLU 127 1HG GLU 127 -9.035 2.564 1.196 918 H ILE 128 H ILE 128 -6.382 1.571 2.985 919 HA ILE 128 HA ILE 128 -6.036 3.025 5.491 920 HB ILE 128 HB ILE 128 -3.986 2.105 3.435 921 HG12 ILE 128 2HG1 ILE 128 -4.540 1.044 6.222 922 HG13 ILE 128 1HG1 ILE 128 -4.962 0.233 4.719 923 HG21 ILE 128 1HG2 ILE 128 -3.267 4.151 4.545 924 HG22 ILE 128 2HG2 ILE 128 -2.284 2.789 5.083 925 HG23 ILE 128 3HG2 ILE 128 -3.560 3.420 6.123 926 HD11 ILE 128 3HD1 ILE 128 -2.176 0.843 5.694 927 HD12 ILE 128 1HD1 ILE 128 -2.576 0.039 4.174 928 HD13 ILE 128 2HD1 ILE 128 -2.972 -0.736 5.708 929 H GLN 129 H GLN 129 -5.901 5.176 5.373 930 HA GLN 129 HA GLN 129 -5.909 6.359 2.705 931 HB2 GLN 129 2HB GLN 129 -8.040 6.751 3.817 932 HB3 GLN 129 1HB GLN 129 -7.234 7.384 5.238 933 HG2 GLN 129 2HG GLN 129 -6.431 9.288 3.967 934 HG3 GLN 129 1HG GLN 129 -7.153 8.634 2.502 935 HE21 GLN 129 1HE2 GLN 129 -9.388 8.651 2.299 936 HE22 GLN 129 2HE2 GLN 129 -10.373 9.705 3.206 937 H ILE 130 H ILE 130 -4.291 7.563 2.232 938 HA ILE 130 HA ILE 130 -2.645 8.579 4.403 939 HB ILE 130 HB ILE 130 -0.697 8.662 2.849 940 HG12 ILE 130 2HG1 ILE 130 -1.965 8.495 0.656 941 HG13 ILE 130 1HG1 ILE 130 -0.556 7.462 0.765 942 HG21 ILE 130 1HG2 ILE 130 -0.781 6.944 4.468 943 HG22 ILE 130 2HG2 ILE 130 -0.084 6.301 2.980 944 HG23 ILE 130 3HG2 ILE 130 -1.751 5.921 3.406 945 HD11 ILE 130 3HD1 ILE 130 -3.450 6.598 0.993 946 HD12 ILE 130 1HD1 ILE 130 -2.052 5.541 1.211 947 HD13 ILE 130 2HD1 ILE 130 -2.349 6.309 -0.343 948 H GLY 131 H GLY 131 -2.931 10.559 4.705 949 HA2 GLY 131 2HA GLY 131 -3.231 12.805 4.337 950 HA3 GLY 131 1HA GLY 131 -2.797 12.530 2.655 951 H LYS 132 H LYS 132 -4.401 11.809 1.244 952 HA LYS 132 HA LYS 132 -7.195 12.056 2.050 953 HB2 LYS 132 2HB LYS 132 -6.351 14.330 1.359 954 HB3 LYS 132 1HB LYS 132 -6.013 13.668 -0.230 955 HG2 LYS 132 2HG LYS 132 -8.442 13.167 -0.477 956 HG3 LYS 132 1HG LYS 132 -8.720 13.972 1.068 957 HD2 LYS 132 2HD LYS 132 -7.503 15.251 -1.385 958 HD3 LYS 132 1HD LYS 132 -9.166 15.453 -0.849 959 HE2 LYS 132 2HE LYS 132 -8.359 16.476 1.238 960 HE3 LYS 132 1HE LYS 132 -6.698 16.265 0.691 961 HZ1 LYS 132 3HZ LYS 132 -7.432 18.510 0.267 962 HZ2 LYS 132 1HZ LYS 132 -8.739 17.971 -0.651 963 HZ3 LYS 132 2HZ LYS 132 -7.166 17.730 -1.169 964 H PHE 133 H PHE 133 -4.945 10.184 0.746 965 HA PHE 133 HA PHE 133 -6.395 9.451 -1.701 966 HB2 PHE 133 2HB PHE 133 -3.621 8.612 -0.839 967 HB3 PHE 133 1HB PHE 133 -4.337 8.459 -2.436 968 HD1 PHE 133 1HD PHE 133 -5.051 10.739 -3.558 969 HD2 PHE 133 2HD PHE 133 -2.219 10.364 -0.409 970 HE1 PHE 133 1HE PHE 133 -4.082 12.919 -4.165 971 HE2 PHE 133 2HE PHE 133 -1.249 12.518 -1.002 972 HZ PHE 133 HZ PHE 133 -2.179 13.816 -2.879 973 H ARG 134 H ARG 134 -6.807 7.110 -2.021 974 HA ARG 134 HA ARG 134 -6.680 5.741 0.534 975 HB2 ARG 134 2HB ARG 134 -8.844 4.751 0.410 976 HB3 ARG 134 1HB ARG 134 -9.029 6.458 0.129 977 HG2 ARG 134 2HG ARG 134 -9.025 4.394 -2.069 978 HG3 ARG 134 1HG ARG 134 -10.476 4.924 -1.237 979 HD2 ARG 134 2HD ARG 134 -10.017 7.230 -2.014 980 HD3 ARG 134 1HD ARG 134 -8.635 6.608 -2.931 981 HE ARG 134 HE ARG 134 -10.843 5.085 -3.633 982 HH11 ARG 134 1HH1 ARG 134 -9.946 8.501 -3.951 983 HH12 ARG 134 2HH1 ARG 134 -10.802 8.721 -5.406 984 HH21 ARG 134 1HH2 ARG 134 -12.031 5.424 -5.612 985 HH22 ARG 134 2HH2 ARG 134 -11.988 6.947 -6.377 986 H LEU 135 H LEU 135 -6.024 3.820 0.705 987 HA LEU 135 HA LEU 135 -5.195 2.298 -1.667 988 HB2 LEU 135 2HB LEU 135 -3.358 3.516 -0.583 989 HB3 LEU 135 1HB LEU 135 -3.848 2.922 0.974 990 HG LEU 135 HG LEU 135 -2.702 1.116 -1.180 991 HD11 LEU 135 1HD1 LEU 135 -1.342 2.601 1.067 992 HD12 LEU 135 2HD1 LEU 135 -1.107 2.883 -0.659 993 HD13 LEU 135 3HD1 LEU 135 -0.589 1.363 0.068 994 HD21 LEU 135 3HD2 LEU 135 -2.163 -0.329 0.738 995 HD22 LEU 135 1HD2 LEU 135 -3.899 -0.024 0.664 996 HD23 LEU 135 2HD2 LEU 135 -2.899 0.837 1.834 997 H VAL 136 H VAL 136 -5.767 0.093 -1.479 998 HA VAL 136 HA VAL 136 -7.006 -0.636 1.080 999 HB VAL 136 HB VAL 136 -7.548 -1.876 -1.650 1000 HG11 VAL 136 1HG1 VAL 136 -9.336 -3.131 -0.529 1001 HG12 VAL 136 2HG1 VAL 136 -8.833 -2.456 1.023 1002 HG13 VAL 136 3HG1 VAL 136 -7.751 -3.529 0.140 1003 HG21 VAL 136 3HG2 VAL 136 -9.795 -0.902 -1.401 1004 HG22 VAL 136 1HG2 VAL 136 -8.533 0.330 -1.460 1005 HG23 VAL 136 2HG2 VAL 136 -9.264 -0.111 0.081 1006 H PHE 137 H PHE 137 -6.140 -2.192 2.225 1007 HA PHE 137 HA PHE 137 -3.680 -3.378 1.163 1008 HB2 PHE 137 2HB PHE 137 -3.475 -1.909 3.155 1009 HB3 PHE 137 1HB PHE 137 -4.545 -2.986 4.036 1010 HD1 PHE 137 2HD PHE 137 -1.238 -2.735 2.401 1011 HD2 PHE 137 1HD PHE 137 -3.702 -4.926 5.094 1012 HE1 PHE 137 2HE PHE 137 0.716 -4.042 3.125 1013 HE2 PHE 137 1HE PHE 137 -1.753 -6.235 5.820 1014 HZ PHE 137 HZ PHE 137 0.457 -5.794 4.839 1015 H LEU 138 H LEU 138 -3.494 -5.501 0.929 1016 HA LEU 138 HA LEU 138 -5.507 -7.237 2.164 1017 HB2 LEU 138 2HB LEU 138 -4.309 -7.496 -0.598 1018 HB3 LEU 138 1HB LEU 138 -5.252 -8.733 0.178 1019 HG LEU 138 HG LEU 138 -6.615 -7.738 -1.425 1020 HD11 LEU 138 1HD1 LEU 138 -7.420 -6.640 1.230 1021 HD12 LEU 138 2HD1 LEU 138 -7.781 -8.231 0.564 1022 HD13 LEU 138 3HD1 LEU 138 -8.465 -6.786 -0.181 1023 HD21 LEU 138 3HD2 LEU 138 -5.943 -5.025 -0.293 1024 HD22 LEU 138 1HD2 LEU 138 -7.126 -5.334 -1.566 1025 HD23 LEU 138 2HD2 LEU 138 -5.416 -5.672 -1.846 1026 H ALA 139 H ALA 139 -4.761 -9.214 2.791 1027 HA ALA 139 HA ALA 139 -1.934 -9.333 3.352 1028 HB1 ALA 139 1HB ALA 139 -4.145 -11.303 3.935 1029 HB2 ALA 139 2HB ALA 139 -3.539 -10.068 5.044 1030 HB3 ALA 139 3HB ALA 139 -2.497 -11.402 4.553 1031 H GLY 140 H GLY 140 -0.466 -10.635 2.327 1032 HA2 GLY 140 2HA GLY 140 -1.117 -11.462 -0.304 1033 HA3 GLY 140 1HA GLY 140 0.420 -11.695 0.527 1034 HA PRO 141 HA PRO 141 -2.376 -15.544 0.358 1035 HB2 PRO 141 2HB PRO 141 -1.329 -16.846 -1.779 1036 HB3 PRO 141 1HB PRO 141 -2.734 -15.779 -1.862 1037 HG2 PRO 141 2HG PRO 141 0.117 -15.219 -2.563 1038 HG3 PRO 141 1HG PRO 141 -1.361 -14.713 -3.403 1039 HD2 PRO 141 2HD PRO 141 0.040 -13.062 -1.772 1040 HD3 PRO 141 1HD PRO 141 -1.719 -12.946 -1.983 1041 H ALA 142 H ALA 142 -1.755 -17.234 1.458 1042 HA ALA 142 HA ALA 142 1.046 -17.587 2.086 1043 HB1 ALA 142 1HB ALA 142 0.236 -19.318 3.659 1044 HB2 ALA 142 2HB ALA 142 -1.396 -19.114 3.022 1045 HB3 ALA 142 3HB ALA 142 -0.619 -17.789 3.887 1046 H GLU 143 H GLU 143 2.138 -18.518 0.525 1047 HA GLU 143 HA GLU 143 1.031 -20.897 -0.755 1048 HB2 GLU 143 2HB GLU 143 1.031 -18.795 -2.162 1049 HB3 GLU 143 1HB GLU 143 2.773 -18.766 -1.995 1050 HG2 GLU 143 2HG GLU 143 2.953 -20.861 -3.190 1051 HG3 GLU 143 1HG GLU 143 1.193 -20.971 -3.292 Start of MODEL 28 1 H1 MET 1 1HT MET 1 26.825 -57.051 61.364 2 H2 MET 1 2HT MET 1 26.352 -58.442 62.172 3 H3 MET 1 3HT MET 1 25.630 -56.947 62.540 4 HA MET 1 HA MET 1 25.441 -58.335 59.939 5 HB2 MET 1 2HB MET 1 23.360 -57.996 62.118 6 HB3 MET 1 1HB MET 1 23.023 -58.565 60.492 7 HG2 MET 1 2HG MET 1 24.431 -60.513 60.880 8 HG3 MET 1 1HG MET 1 24.789 -59.936 62.504 9 HE1 MET 1 2HE MET 1 20.554 -61.210 61.139 10 HE2 MET 1 3HE MET 1 21.956 -61.184 60.074 11 HE3 MET 1 1HE MET 1 21.275 -59.673 60.675 12 H SER 2 H SER 2 26.282 -56.172 59.223 13 HA SER 2 HA SER 2 24.625 -53.911 59.612 14 HB2 SER 2 2HB SER 2 26.176 -52.984 57.800 15 HB3 SER 2 1HB SER 2 26.937 -53.518 59.302 16 HG SER 2 HG SER 2 28.124 -54.641 58.033 17 H ASP 3 H ASP 3 25.309 -56.080 56.960 18 HA ASP 3 HA ASP 3 24.398 -56.420 54.917 19 HB2 ASP 3 2HB ASP 3 21.863 -56.459 56.562 20 HB3 ASP 3 1HB ASP 3 21.991 -57.044 54.910 21 H ASN 4 H ASN 4 25.046 -54.330 54.265 22 HA ASN 4 HA ASN 4 22.742 -52.640 53.610 23 HB2 ASN 4 2HB ASN 4 24.482 -51.647 55.154 24 HB3 ASN 4 1HB ASN 4 25.648 -51.813 53.854 25 HD21 ASN 4 1HD2 ASN 4 24.763 -49.474 55.225 26 HD22 ASN 4 2HD2 ASN 4 24.106 -48.396 54.053 27 H ASN 5 H ASN 5 22.312 -52.709 51.523 28 HA ASN 5 HA ASN 5 24.257 -53.929 49.733 29 HB2 ASN 5 2HB ASN 5 21.322 -53.314 49.296 30 HB3 ASN 5 1HB ASN 5 22.364 -54.173 48.169 31 HD21 ASN 5 1HD2 ASN 5 19.911 -55.068 49.408 32 HD22 ASN 5 2HD2 ASN 5 20.290 -56.488 50.307 33 H GLY 6 H GLY 6 25.532 -52.595 48.712 34 HA2 GLY 6 2HA GLY 6 24.632 -49.857 48.224 35 HA3 GLY 6 1HA GLY 6 26.307 -50.400 48.221 36 H THR 7 H THR 7 24.036 -49.271 46.231 37 HA THR 7 HA THR 7 24.531 -51.141 44.096 38 HB THR 7 HB THR 7 22.905 -49.544 42.895 39 HG1 THR 7 1HG THR 7 22.485 -47.855 44.023 40 HG21 THR 7 3HG2 THR 7 20.970 -50.630 43.952 41 HG22 THR 7 1HG2 THR 7 21.988 -51.122 45.305 42 HG23 THR 7 2HG2 THR 7 22.284 -51.777 43.695 43 HA PRO 8 HA PRO 8 27.763 -48.427 42.522 44 HB2 PRO 8 2HB PRO 8 27.419 -50.020 40.053 45 HB3 PRO 8 1HB PRO 8 28.870 -49.785 41.034 46 HG2 PRO 8 2HG PRO 8 27.566 -52.127 41.005 47 HG3 PRO 8 1HG PRO 8 28.332 -51.504 42.479 48 HD2 PRO 8 2HD PRO 8 25.446 -51.500 41.695 49 HD3 PRO 8 1HD PRO 8 26.200 -51.815 43.276 50 H GLU 9 H GLU 9 27.410 -46.494 41.606 51 HA GLU 9 HA GLU 9 25.117 -46.185 39.806 52 HB2 GLU 9 2HB GLU 9 26.651 -44.048 41.330 53 HB3 GLU 9 1HB GLU 9 25.205 -43.782 40.366 54 HG2 GLU 9 2HG GLU 9 23.951 -45.251 41.918 55 HG3 GLU 9 1HG GLU 9 25.398 -45.390 42.907 56 HA PRO 10 HA PRO 10 28.661 -45.820 37.031 57 HB2 PRO 10 2HB PRO 10 27.709 -47.271 35.023 58 HB3 PRO 10 1HB PRO 10 28.225 -48.035 36.531 59 HG2 PRO 10 2HG PRO 10 25.482 -47.555 35.502 60 HG3 PRO 10 1HG PRO 10 26.076 -48.845 36.559 61 HD2 PRO 10 2HD PRO 10 24.736 -46.444 37.332 62 HD3 PRO 10 1HD PRO 10 25.445 -47.678 38.392 63 H GLN 11 H GLN 11 28.807 -45.317 34.654 64 HA GLN 11 HA GLN 11 28.643 -43.978 32.952 65 HB2 GLN 11 2HB GLN 11 25.718 -43.930 33.604 66 HB3 GLN 11 1HB GLN 11 26.375 -43.050 32.238 67 HG2 GLN 11 2HG GLN 11 27.261 -45.229 31.390 68 HG3 GLN 11 1HG GLN 11 26.371 -46.020 32.692 69 HE21 GLN 11 1HE2 GLN 11 26.111 -44.214 29.748 70 HE22 GLN 11 2HE2 GLN 11 24.453 -44.580 29.451 71 H VAL 12 H VAL 12 29.999 -42.547 33.836 72 HA VAL 12 HA VAL 12 28.712 -40.128 34.855 73 HB VAL 12 HB VAL 12 31.601 -40.927 35.342 74 HG11 VAL 12 1HG1 VAL 12 29.900 -38.753 36.556 75 HG12 VAL 12 2HG1 VAL 12 31.239 -38.531 35.430 76 HG13 VAL 12 3HG1 VAL 12 31.542 -39.151 37.055 77 HG21 VAL 12 3HG2 VAL 12 30.130 -42.502 36.496 78 HG22 VAL 12 1HG2 VAL 12 29.259 -41.157 37.229 79 HG23 VAL 12 2HG2 VAL 12 30.948 -41.453 37.653 80 H GLU 13 H GLU 13 28.338 -39.625 32.659 81 HA GLU 13 HA GLU 13 30.619 -38.241 31.495 82 HB2 GLU 13 2HB GLU 13 30.349 -40.379 30.229 83 HB3 GLU 13 1HB GLU 13 28.674 -39.942 29.910 84 HG2 GLU 13 2HG GLU 13 29.564 -37.871 28.779 85 HG3 GLU 13 1HG GLU 13 31.154 -38.605 28.885 86 H THR 14 H THR 14 30.033 -36.234 31.040 87 HA THR 14 HA THR 14 27.350 -35.705 30.139 88 HB THR 14 HB THR 14 28.649 -33.962 32.278 89 HG1 THR 14 1HG THR 14 27.046 -36.207 32.441 90 HG21 THR 14 3HG2 THR 14 26.407 -32.934 32.409 91 HG22 THR 14 1HG2 THR 14 25.837 -34.024 31.146 92 HG23 THR 14 2HG2 THR 14 27.062 -32.808 30.780 93 H THR 15 H THR 15 28.597 -35.710 28.202 94 HA THR 15 HA THR 15 30.473 -33.520 27.971 95 HB THR 15 HB THR 15 29.952 -35.742 25.978 96 HG1 THR 15 1HG THR 15 31.625 -36.795 26.902 97 HG21 THR 15 3HG2 THR 15 32.239 -33.781 26.296 98 HG22 THR 15 1HG2 THR 15 31.008 -33.735 25.036 99 HG23 THR 15 2HG2 THR 15 32.161 -35.071 25.098 100 H SER 16 H SER 16 29.044 -31.871 27.875 101 HA SER 16 HA SER 16 27.638 -31.674 25.342 102 HB2 SER 16 2HB SER 16 26.815 -30.402 27.976 103 HB3 SER 16 1HB SER 16 25.958 -30.262 26.442 104 HG SER 16 HG SER 16 26.050 -32.748 26.652 105 H VAL 17 H VAL 17 29.800 -31.003 24.740 106 HA VAL 17 HA VAL 17 30.511 -28.376 25.736 107 HB VAL 17 HB VAL 17 32.783 -28.802 24.810 108 HG11 VAL 17 1HG1 VAL 17 32.337 -29.282 27.156 109 HG12 VAL 17 2HG1 VAL 17 33.492 -30.438 26.496 110 HG13 VAL 17 3HG1 VAL 17 31.811 -30.912 26.734 111 HG21 VAL 17 3HG2 VAL 17 31.750 -31.597 24.285 112 HG22 VAL 17 1HG2 VAL 17 33.423 -31.068 24.115 113 HG23 VAL 17 2HG2 VAL 17 32.177 -30.413 23.052 114 H PHE 18 H PHE 18 31.186 -26.831 24.263 115 HA PHE 18 HA PHE 18 30.809 -25.448 22.534 116 HB2 PHE 18 2HB PHE 18 30.920 -27.971 20.838 117 HB3 PHE 18 1HB PHE 18 30.971 -26.334 20.207 118 HD1 PHE 18 1HD PHE 18 32.932 -24.870 20.812 119 HD2 PHE 18 2HD PHE 18 32.857 -29.051 21.577 120 HE1 PHE 18 1HE PHE 18 35.384 -24.870 21.019 121 HE2 PHE 18 2HE PHE 18 35.307 -29.061 21.796 122 HZ PHE 18 HZ PHE 18 36.573 -26.970 21.516 123 H ARG 19 H ARG 19 28.840 -25.068 23.505 124 HA ARG 19 HA ARG 19 26.470 -26.261 22.214 125 HB2 ARG 19 2HB ARG 19 26.557 -24.520 24.653 126 HB3 ARG 19 1HB ARG 19 25.250 -25.555 24.113 127 HG2 ARG 19 2HG ARG 19 26.445 -27.514 24.759 128 HG3 ARG 19 1HG ARG 19 27.907 -26.570 25.082 129 HD2 ARG 19 2HD ARG 19 25.294 -26.495 26.573 130 HD3 ARG 19 1HD ARG 19 26.880 -26.986 27.181 131 HE ARG 19 HE ARG 19 26.168 -24.226 26.406 132 HH11 ARG 19 1HH1 ARG 19 27.877 -26.404 28.631 133 HH12 ARG 19 2HH1 ARG 19 28.717 -25.144 29.401 134 HH21 ARG 19 1HH2 ARG 19 27.303 -22.549 27.437 135 HH22 ARG 19 2HH2 ARG 19 28.394 -22.880 28.720 136 H ALA 20 H ALA 20 25.097 -24.866 21.157 137 HA ALA 20 HA ALA 20 25.994 -22.126 20.943 138 HB1 ALA 20 1HB ALA 20 25.389 -23.233 18.843 139 HB2 ALA 20 2HB ALA 20 24.265 -21.917 19.173 140 HB3 ALA 20 3HB ALA 20 23.784 -23.587 19.474 141 H ASP 21 H ASP 21 25.564 -21.694 23.118 142 HA ASP 21 HA ASP 21 23.073 -21.937 24.382 143 HB2 ASP 21 2HB ASP 21 25.265 -19.891 24.851 144 HB3 ASP 21 1HB ASP 21 23.860 -20.078 25.880 145 H LEU 22 H LEU 22 24.529 -19.202 22.756 146 HA LEU 22 HA LEU 22 21.938 -18.435 21.741 147 HB2 LEU 22 2HB LEU 22 22.191 -17.042 23.735 148 HB3 LEU 22 1HB LEU 22 23.796 -16.566 23.222 149 HG LEU 22 HG LEU 22 22.829 -15.383 21.293 150 HD11 LEU 22 1HD1 LEU 22 20.411 -14.951 21.219 151 HD12 LEU 22 2HD1 LEU 22 20.175 -16.139 22.504 152 HD13 LEU 22 3HD1 LEU 22 20.817 -16.644 20.945 153 HD21 LEU 22 3HD2 LEU 22 21.699 -14.570 23.969 154 HD22 LEU 22 1HD2 LEU 22 21.856 -13.522 22.560 155 HD23 LEU 22 2HD2 LEU 22 23.295 -14.164 23.342 156 H LEU 23 H LEU 23 22.236 -18.320 19.622 157 HA LEU 23 HA LEU 23 24.865 -17.461 18.693 158 HB2 LEU 23 2HB LEU 23 23.983 -19.789 18.028 159 HB3 LEU 23 1HB LEU 23 22.764 -18.957 17.097 160 HG LEU 23 HG LEU 23 25.743 -18.692 16.580 161 HD11 LEU 23 1HD1 LEU 23 25.043 -20.991 16.248 162 HD12 LEU 23 2HD1 LEU 23 25.396 -20.214 14.708 163 HD13 LEU 23 3HD1 LEU 23 23.722 -20.454 15.210 164 HD21 LEU 23 3HD2 LEU 23 25.058 -17.825 14.396 165 HD22 LEU 23 1HD2 LEU 23 24.397 -16.831 15.693 166 HD23 LEU 23 2HD2 LEU 23 23.359 -17.981 14.852 167 H LYS 24 H LYS 24 24.645 -15.335 18.622 168 HA LYS 24 HA LYS 24 22.644 -14.277 16.840 169 HB2 LYS 24 2HB LYS 24 21.789 -14.064 19.213 170 HB3 LYS 24 1HB LYS 24 23.176 -13.046 19.556 171 HG2 LYS 24 2HG LYS 24 21.202 -11.692 19.170 172 HG3 LYS 24 1HG LYS 24 22.387 -11.424 17.889 173 HD2 LYS 24 2HD LYS 24 21.150 -12.854 16.379 174 HD3 LYS 24 1HD LYS 24 20.031 -13.305 17.666 175 HE2 LYS 24 2HE LYS 24 19.033 -11.660 16.169 176 HE3 LYS 24 1HE LYS 24 19.250 -10.997 17.786 177 HZ1 LYS 24 3HZ LYS 24 21.259 -9.872 16.979 178 HZ2 LYS 24 1HZ LYS 24 19.901 -9.389 16.123 179 HZ3 LYS 24 2HZ LYS 24 20.998 -10.463 15.438 180 H GLU 25 H GLU 25 24.225 -13.967 15.403 181 HA GLU 25 HA GLU 25 26.756 -12.832 16.090 182 HB2 GLU 25 2HB GLU 25 25.522 -13.624 13.470 183 HB3 GLU 25 1HB GLU 25 27.131 -12.940 13.613 184 HG2 GLU 25 2HG GLU 25 26.191 -15.486 14.907 185 HG3 GLU 25 1HG GLU 25 27.178 -15.375 13.450 186 H MET 26 H MET 26 27.557 -10.918 15.552 187 HA MET 26 HA MET 26 25.836 -8.686 15.390 188 HB2 MET 26 2HB MET 26 28.816 -8.829 14.849 189 HB3 MET 26 1HB MET 26 27.897 -7.375 15.182 190 HG2 MET 26 2HG MET 26 29.118 -7.940 17.142 191 HG3 MET 26 1HG MET 26 27.429 -8.283 17.470 192 HE1 MET 26 3HE MET 26 29.232 -11.041 19.571 193 HE2 MET 26 1HE MET 26 28.051 -9.735 19.582 194 HE3 MET 26 2HE MET 26 29.758 -9.378 19.328 195 H GLU 27 H GLU 27 24.999 -7.787 13.628 196 HA GLU 27 HA GLU 27 26.112 -8.608 11.034 197 HB2 GLU 27 2HB GLU 27 23.786 -9.473 11.733 198 HB3 GLU 27 1HB GLU 27 23.247 -7.816 11.567 199 HG2 GLU 27 2HG GLU 27 24.396 -9.517 9.355 200 HG3 GLU 27 1HG GLU 27 22.689 -9.222 9.627 201 H SER 28 H SER 28 23.883 -6.104 12.267 202 HA SER 28 HA SER 28 25.460 -4.153 10.786 203 HB2 SER 28 2HB SER 28 22.688 -3.916 11.996 204 HB3 SER 28 1HB SER 28 23.504 -2.675 11.044 205 HG SER 28 HG SER 28 23.183 -5.249 9.909 206 H SER 29 H SER 29 27.170 -3.792 12.231 207 HA SER 29 HA SER 29 26.599 -3.326 14.991 208 HB2 SER 29 2HB SER 29 29.124 -2.824 14.983 209 HB3 SER 29 1HB SER 29 28.614 -4.468 14.594 210 HG SER 29 HG SER 29 30.069 -3.890 13.111 211 H THR 30 H THR 30 26.927 -1.478 12.134 212 HA THR 30 HA THR 30 27.118 1.011 13.641 213 HB THR 30 HB THR 30 27.262 0.724 10.637 214 HG1 THR 30 1HG THR 30 29.363 0.099 10.803 215 HG21 THR 30 3HG2 THR 30 28.785 2.630 10.847 216 HG22 THR 30 1HG2 THR 30 28.693 2.522 12.604 217 HG23 THR 30 2HG2 THR 30 27.267 2.976 11.678 218 H GLY 31 H GLY 31 25.583 2.790 12.583 219 HA2 GLY 31 2HA GLY 31 22.933 1.626 12.520 220 HA3 GLY 31 1HA GLY 31 23.340 3.332 12.644 221 H THR 32 H THR 32 23.616 0.644 10.355 222 HA THR 32 HA THR 32 23.398 2.486 8.155 223 HB THR 32 HB THR 32 23.633 0.215 6.897 224 HG1 THR 32 1HG THR 32 23.641 -1.391 8.220 225 HG21 THR 32 3HG2 THR 32 26.075 0.312 7.152 226 HG22 THR 32 1HG2 THR 32 25.886 1.301 8.598 227 HG23 THR 32 2HG2 THR 32 25.397 1.934 7.027 228 H ALA 33 H ALA 33 21.740 2.393 6.620 229 HA ALA 33 HA ALA 33 19.216 1.459 7.620 230 HB1 ALA 33 1HB ALA 33 19.363 3.625 6.472 231 HB2 ALA 33 2HB ALA 33 18.300 2.526 5.592 232 HB3 ALA 33 3HB ALA 33 19.942 2.817 5.019 233 HA PRO 34 HA PRO 34 19.906 -2.413 5.563 234 HB2 PRO 34 2HB PRO 34 17.609 -3.637 6.288 235 HB3 PRO 34 1HB PRO 34 18.965 -3.403 7.395 236 HG2 PRO 34 2HG PRO 34 16.413 -1.875 7.172 237 HG3 PRO 34 1HG PRO 34 17.325 -2.332 8.621 238 HD2 PRO 34 2HD PRO 34 17.387 0.170 7.456 239 HD3 PRO 34 1HD PRO 34 18.672 -0.490 8.485 240 H ALA 35 H ALA 35 19.653 -2.814 3.527 241 HA ALA 35 HA ALA 35 17.033 -2.599 2.295 242 HB1 ALA 35 1HB ALA 35 18.183 -0.498 1.699 243 HB2 ALA 35 2HB ALA 35 17.953 -1.520 0.279 244 HB3 ALA 35 3HB ALA 35 19.536 -1.426 1.052 245 H SER 36 H SER 36 17.124 -4.858 2.604 246 HA SER 36 HA SER 36 18.486 -6.239 0.468 247 HB2 SER 36 2HB SER 36 18.826 -7.008 3.385 248 HB3 SER 36 1HB SER 36 19.402 -7.948 2.010 249 HG SER 36 HG SER 36 20.268 -5.467 1.722 250 H THR 37 H THR 37 17.591 -8.470 0.275 251 HA THR 37 HA THR 37 14.989 -8.666 1.547 252 HB THR 37 HB THR 37 14.665 -7.836 -0.741 253 HG1 THR 37 1HG THR 37 13.352 -9.591 -1.500 254 HG21 THR 37 3HG2 THR 37 15.243 -9.249 -2.692 255 HG22 THR 37 1HG2 THR 37 16.082 -10.364 -1.614 256 HG23 THR 37 2HG2 THR 37 16.678 -8.716 -1.815 257 H GLY 38 H GLY 38 14.135 -10.868 1.459 258 HA2 GLY 38 2HA GLY 38 15.984 -13.037 1.050 259 HA3 GLY 38 1HA GLY 38 15.556 -12.746 2.735 260 H ALA 39 H ALA 39 13.502 -12.210 -0.017 261 HA ALA 39 HA ALA 39 11.273 -13.502 1.193 262 HB1 ALA 39 1HB ALA 39 11.028 -11.606 -0.344 263 HB2 ALA 39 2HB ALA 39 10.107 -13.007 -0.891 264 HB3 ALA 39 3HB ALA 39 11.636 -12.604 -1.664 265 H GLU 40 H GLU 40 13.767 -14.544 -0.930 266 HA GLU 40 HA GLU 40 12.412 -16.997 -1.632 267 HB2 GLU 40 2HB GLU 40 14.428 -17.605 -2.793 268 HB3 GLU 40 1HB GLU 40 14.042 -15.934 -3.167 269 HG2 GLU 40 2HG GLU 40 15.746 -15.181 -1.584 270 HG3 GLU 40 1HG GLU 40 16.097 -16.855 -1.175 271 H ASN 41 H ASN 41 14.464 -15.854 0.855 272 HA ASN 41 HA ASN 41 15.472 -18.462 1.601 273 HB2 ASN 41 2HB ASN 41 16.955 -16.549 1.877 274 HB3 ASN 41 1HB ASN 41 15.781 -15.750 2.914 275 HD21 ASN 41 1HD2 ASN 41 15.694 -16.293 5.082 276 HD22 ASN 41 2HD2 ASN 41 16.786 -17.381 5.809 277 H LEU 42 H LEU 42 13.195 -16.088 2.844 278 HA LEU 42 HA LEU 42 12.329 -17.954 4.877 279 HB2 LEU 42 2HB LEU 42 11.469 -15.152 4.135 280 HB3 LEU 42 1HB LEU 42 10.616 -16.114 5.310 281 HG LEU 42 HG LEU 42 11.918 -14.593 6.520 282 HD11 LEU 42 1HD1 LEU 42 13.413 -17.183 6.561 283 HD12 LEU 42 2HD1 LEU 42 11.954 -16.785 7.468 284 HD13 LEU 42 3HD1 LEU 42 13.460 -15.937 7.807 285 HD21 LEU 42 3HD2 LEU 42 13.439 -13.811 4.830 286 HD22 LEU 42 1HD2 LEU 42 14.277 -15.361 4.813 287 HD23 LEU 42 2HD2 LEU 42 14.369 -14.325 6.239 288 HA PRO 43 HA PRO 43 9.173 -19.591 2.217 289 HB2 PRO 43 2HB PRO 43 7.207 -20.014 4.149 290 HB3 PRO 43 1HB PRO 43 8.483 -21.162 3.743 291 HG2 PRO 43 2HG PRO 43 8.321 -19.233 5.998 292 HG3 PRO 43 1HG PRO 43 9.022 -20.861 5.963 293 HD2 PRO 43 2HD PRO 43 10.538 -18.626 5.918 294 HD3 PRO 43 1HD PRO 43 11.013 -20.110 5.070 295 H ALA 44 H ALA 44 8.376 -18.089 0.972 296 HA ALA 44 HA ALA 44 7.472 -15.588 1.734 297 HB1 ALA 44 1HB ALA 44 6.853 -17.035 -0.822 298 HB2 ALA 44 2HB ALA 44 8.329 -16.125 -0.485 299 HB3 ALA 44 3HB ALA 44 6.773 -15.295 -0.543 300 H GLY 45 H GLY 45 5.592 -14.664 1.995 301 HA2 GLY 45 2HA GLY 45 3.081 -16.014 1.589 302 HA3 GLY 45 1HA GLY 45 3.484 -15.636 3.270 303 H SER 46 H SER 46 3.434 -14.182 0.082 304 HA SER 46 HA SER 46 3.361 -11.513 1.215 305 HB2 SER 46 2HB SER 46 3.344 -12.427 -1.649 306 HB3 SER 46 1HB SER 46 3.722 -10.823 -1.043 307 HG SER 46 HG SER 46 5.633 -11.398 -0.657 308 H ALA 47 H ALA 47 1.769 -9.976 0.395 309 HA ALA 47 HA ALA 47 -0.695 -11.081 -0.656 310 HB1 ALA 47 1HB ALA 47 -0.534 -9.211 1.719 311 HB2 ALA 47 2HB ALA 47 -1.036 -10.900 1.775 312 HB3 ALA 47 3HB ALA 47 -2.020 -9.714 0.916 313 H LEU 48 H LEU 48 -2.152 -8.824 -1.060 314 HA LEU 48 HA LEU 48 -0.238 -7.252 -2.615 315 HB2 LEU 48 2HB LEU 48 -1.791 -7.063 -4.451 316 HB3 LEU 48 1HB LEU 48 -1.409 -8.738 -4.131 317 HG LEU 48 HG LEU 48 -3.976 -7.479 -3.152 318 HD11 LEU 48 1HD1 LEU 48 -3.852 -7.177 -5.576 319 HD12 LEU 48 2HD1 LEU 48 -5.052 -8.392 -5.141 320 HD13 LEU 48 3HD1 LEU 48 -3.483 -8.893 -5.771 321 HD21 LEU 48 3HD2 LEU 48 -4.771 -9.798 -3.188 322 HD22 LEU 48 1HD2 LEU 48 -3.358 -9.636 -2.148 323 HD23 LEU 48 2HD2 LEU 48 -3.193 -10.335 -3.757 324 H LEU 49 H LEU 49 -0.627 -5.156 -2.975 325 HA LEU 49 HA LEU 49 -2.808 -3.931 -1.479 326 HB2 LEU 49 2HB LEU 49 -1.333 -2.010 -0.931 327 HB3 LEU 49 1HB LEU 49 -0.788 -3.486 -0.183 328 HG LEU 49 HG LEU 49 0.493 -2.406 -2.707 329 HD11 LEU 49 1HD1 LEU 49 0.688 -0.696 -0.992 330 HD12 LEU 49 2HD1 LEU 49 2.244 -1.488 -1.234 331 HD13 LEU 49 3HD1 LEU 49 1.255 -1.897 0.169 332 HD21 LEU 49 3HD2 LEU 49 1.470 -4.286 -0.558 333 HD22 LEU 49 1HD2 LEU 49 2.392 -3.760 -1.966 334 HD23 LEU 49 2HD2 LEU 49 0.953 -4.758 -2.176 335 H VAL 50 H VAL 50 -3.915 -2.430 -2.575 336 HA VAL 50 HA VAL 50 -2.962 -1.783 -5.291 337 HB VAL 50 HB VAL 50 -5.857 -2.334 -4.547 338 HG11 VAL 50 1HG1 VAL 50 -6.242 -2.413 -6.964 339 HG12 VAL 50 2HG1 VAL 50 -4.551 -2.000 -7.239 340 HG13 VAL 50 3HG1 VAL 50 -5.621 -0.845 -6.439 341 HG21 VAL 50 3HG2 VAL 50 -4.610 -4.418 -4.368 342 HG22 VAL 50 1HG2 VAL 50 -3.944 -4.178 -5.981 343 HG23 VAL 50 2HG2 VAL 50 -5.673 -4.459 -5.773 344 H VAL 51 H VAL 51 -3.461 0.285 -5.977 345 HA VAL 51 HA VAL 51 -4.238 2.187 -3.850 346 HB VAL 51 HB VAL 51 -3.109 2.732 -6.639 347 HG11 VAL 51 1HG1 VAL 51 -4.406 4.606 -5.731 348 HG12 VAL 51 2HG1 VAL 51 -2.685 4.989 -5.798 349 HG13 VAL 51 3HG1 VAL 51 -3.436 4.568 -4.259 350 HG21 VAL 51 3HG2 VAL 51 -1.014 3.239 -5.482 351 HG22 VAL 51 1HG2 VAL 51 -1.485 1.551 -5.274 352 HG23 VAL 51 2HG2 VAL 51 -1.727 2.705 -3.962 353 H LYS 52 H LYS 52 -6.094 3.048 -3.733 354 HA LYS 52 HA LYS 52 -8.056 2.495 -5.825 355 HB2 LYS 52 2HB LYS 52 -8.335 3.562 -3.014 356 HB3 LYS 52 1HB LYS 52 -9.672 3.366 -4.128 357 HG2 LYS 52 2HG LYS 52 -7.906 1.112 -3.191 358 HG3 LYS 52 1HG LYS 52 -9.442 1.542 -2.440 359 HD2 LYS 52 2HD LYS 52 -9.086 0.693 -5.326 360 HD3 LYS 52 1HD LYS 52 -9.643 -0.352 -4.027 361 HE2 LYS 52 2HE LYS 52 -11.587 1.138 -3.675 362 HE3 LYS 52 1HE LYS 52 -11.043 2.148 -5.014 363 HZ1 LYS 52 3HZ LYS 52 -12.737 0.670 -5.763 364 HZ2 LYS 52 1HZ LYS 52 -11.924 -0.682 -5.164 365 HZ3 LYS 52 2HZ LYS 52 -11.284 0.182 -6.454 366 H ARG 53 H ARG 53 -6.454 5.114 -4.174 367 HA ARG 53 HA ARG 53 -7.180 7.002 -6.215 368 HB2 ARG 53 2HB ARG 53 -9.249 6.976 -4.903 369 HB3 ARG 53 1HB ARG 53 -8.344 7.296 -3.439 370 HG2 ARG 53 2HG ARG 53 -9.524 9.290 -4.225 371 HG3 ARG 53 1HG ARG 53 -7.783 9.520 -4.255 372 HD2 ARG 53 2HD ARG 53 -9.108 8.556 -6.738 373 HD3 ARG 53 1HD ARG 53 -9.335 10.242 -6.280 374 HE ARG 53 HE ARG 53 -6.839 10.303 -6.167 375 HH11 ARG 53 1HH1 ARG 53 -8.406 8.018 -8.362 376 HH12 ARG 53 2HH1 ARG 53 -7.294 8.202 -9.622 377 HH21 ARG 53 1HH2 ARG 53 -5.285 10.607 -7.934 378 HH22 ARG 53 2HH2 ARG 53 -5.475 9.718 -9.376 379 H GLY 54 H GLY 54 -5.288 7.890 -6.474 380 HA2 GLY 54 2HA GLY 54 -4.172 9.785 -4.917 381 HA3 GLY 54 1HA GLY 54 -3.439 8.301 -4.337 382 HA PRO 55 HA PRO 55 -1.825 9.701 -8.812 383 HB2 PRO 55 2HB PRO 55 -0.335 11.874 -7.439 384 HB3 PRO 55 1HB PRO 55 -1.065 11.860 -9.044 385 HG2 PRO 55 2HG PRO 55 -2.214 13.191 -7.064 386 HG3 PRO 55 1HG PRO 55 -3.192 12.281 -8.228 387 HD2 PRO 55 2HD PRO 55 -2.457 11.576 -5.414 388 HD3 PRO 55 1HD PRO 55 -3.981 11.333 -6.291 389 H ASN 56 H ASN 56 -0.691 9.141 -5.673 390 HA ASN 56 HA ASN 56 2.088 8.994 -5.767 391 HB2 ASN 56 2HB ASN 56 1.939 7.400 -3.976 392 HB3 ASN 56 1HB ASN 56 0.720 8.659 -3.717 393 HD21 ASN 56 1HD2 ASN 56 1.465 5.398 -4.069 394 HD22 ASN 56 2HD2 ASN 56 -0.144 4.753 -3.916 395 H ALA 57 H ALA 57 -0.393 6.730 -6.947 396 HA ALA 57 HA ALA 57 1.214 5.484 -8.854 397 HB1 ALA 57 1HB ALA 57 0.616 3.857 -6.357 398 HB2 ALA 57 2HB ALA 57 2.211 4.305 -6.954 399 HB3 ALA 57 3HB ALA 57 1.211 3.182 -7.874 400 H GLY 58 H GLY 58 -0.308 3.058 -9.009 401 HA2 GLY 58 2HA GLY 58 -3.033 3.290 -8.631 402 HA3 GLY 58 1HA GLY 58 -2.676 4.045 -10.184 403 H ALA 59 H ALA 59 -1.811 1.107 -8.347 404 HA ALA 59 HA ALA 59 -2.542 -0.613 -10.446 405 HB1 ALA 59 1HB ALA 59 -0.398 0.156 -11.378 406 HB2 ALA 59 2HB ALA 59 -0.245 -1.507 -10.808 407 HB3 ALA 59 3HB ALA 59 0.404 -0.183 -9.844 408 H ARG 60 H ARG 60 -1.408 -2.820 -9.700 409 HA ARG 60 HA ARG 60 -1.852 -3.016 -6.815 410 HB2 ARG 60 2HB ARG 60 -2.210 -5.415 -7.188 411 HB3 ARG 60 1HB ARG 60 -3.271 -4.425 -8.186 412 HG2 ARG 60 2HG ARG 60 -1.910 -4.846 -10.143 413 HG3 ARG 60 1HG ARG 60 -0.732 -5.714 -9.170 414 HD2 ARG 60 2HD ARG 60 -3.601 -6.565 -9.506 415 HD3 ARG 60 1HD ARG 60 -2.266 -7.157 -10.491 416 HE ARG 60 HE ARG 60 -1.713 -7.495 -7.745 417 HH11 ARG 60 1HH1 ARG 60 -3.661 -8.897 -10.356 418 HH12 ARG 60 2HH1 ARG 60 -3.629 -10.478 -9.692 419 HH21 ARG 60 1HH2 ARG 60 -1.695 -9.679 -6.863 420 HH22 ARG 60 2HH2 ARG 60 -2.499 -10.925 -7.708 421 H PHE 61 H PHE 61 -0.263 -3.670 -5.503 422 HA PHE 61 HA PHE 61 2.248 -4.488 -6.760 423 HB2 PHE 61 2HB PHE 61 1.894 -2.812 -4.253 424 HB3 PHE 61 1HB PHE 61 3.430 -3.383 -4.892 425 HD1 PHE 61 1HD PHE 61 4.298 -2.476 -7.017 426 HD2 PHE 61 2HD PHE 61 0.812 -0.892 -5.158 427 HE1 PHE 61 1HE PHE 61 4.486 -0.449 -8.401 428 HE2 PHE 61 2HE PHE 61 0.991 1.134 -6.539 429 HZ PHE 61 HZ PHE 61 2.830 1.357 -8.163 430 H LEU 62 H LEU 62 3.413 -6.029 -5.623 431 HA LEU 62 HA LEU 62 1.866 -7.542 -3.636 432 HB2 LEU 62 2HB LEU 62 2.301 -8.645 -5.869 433 HB3 LEU 62 1HB LEU 62 4.011 -8.489 -5.550 434 HG LEU 62 HG LEU 62 3.727 -9.971 -3.568 435 HD11 LEU 62 1HD1 LEU 62 1.370 -9.598 -3.131 436 HD12 LEU 62 2HD1 LEU 62 1.680 -11.310 -3.418 437 HD13 LEU 62 3HD1 LEU 62 0.951 -10.322 -4.682 438 HD21 LEU 62 3HD2 LEU 62 3.507 -12.024 -4.870 439 HD22 LEU 62 1HD2 LEU 62 4.513 -10.835 -5.695 440 HD23 LEU 62 2HD2 LEU 62 2.851 -11.100 -6.223 441 H LEU 63 H LEU 63 2.970 -7.846 -1.677 442 HA LEU 63 HA LEU 63 5.433 -6.356 -1.427 443 HB2 LEU 63 2HB LEU 63 3.931 -8.038 0.583 444 HB3 LEU 63 1HB LEU 63 5.379 -7.130 0.955 445 HG LEU 63 HG LEU 63 2.751 -5.930 0.073 446 HD11 LEU 63 1HD1 LEU 63 2.625 -6.892 2.307 447 HD12 LEU 63 2HD1 LEU 63 2.602 -5.130 2.380 448 HD13 LEU 63 3HD1 LEU 63 4.075 -6.011 2.781 449 HD21 LEU 63 3HD2 LEU 63 3.789 -3.795 0.712 450 HD22 LEU 63 1HD2 LEU 63 4.656 -4.564 -0.615 451 HD23 LEU 63 2HD2 LEU 63 5.312 -4.628 1.020 452 H ASP 64 H ASP 64 7.214 -7.192 -2.148 453 HA ASP 64 HA ASP 64 7.771 -10.026 -1.598 454 HB2 ASP 64 2HB ASP 64 9.190 -10.046 -3.616 455 HB3 ASP 64 1HB ASP 64 7.541 -9.598 -4.017 456 H GLN 65 H GLN 65 8.378 -7.080 -0.582 457 HA GLN 65 HA GLN 65 11.219 -7.562 -0.040 458 HB2 GLN 65 2HB GLN 65 9.741 -4.925 -0.163 459 HB3 GLN 65 1HB GLN 65 11.455 -5.139 0.153 460 HG2 GLN 65 2HG GLN 65 11.781 -6.021 -2.090 461 HG3 GLN 65 1HG GLN 65 10.058 -5.866 -2.417 462 HE21 GLN 65 1HE2 GLN 65 11.899 -3.533 -0.612 463 HE22 GLN 65 2HE2 GLN 65 11.832 -2.266 -1.758 464 HA PRO 66 HA PRO 66 9.873 -7.929 4.176 465 HB2 PRO 66 2HB PRO 66 12.223 -7.194 5.433 466 HB3 PRO 66 1HB PRO 66 11.895 -8.807 4.794 467 HG2 PRO 66 2HG PRO 66 13.455 -6.568 3.581 468 HG3 PRO 66 1HG PRO 66 13.792 -8.308 3.567 469 HD2 PRO 66 2HD PRO 66 12.756 -7.026 1.432 470 HD3 PRO 66 1HD PRO 66 12.322 -8.703 1.825 471 H THR 67 H THR 67 11.492 -5.016 3.083 472 HA THR 67 HA THR 67 9.691 -3.475 4.758 473 HB THR 67 HB THR 67 12.653 -2.875 4.479 474 HG1 THR 67 1HG THR 67 11.271 -4.504 6.076 475 HG21 THR 67 3HG2 THR 67 12.208 -1.141 6.175 476 HG22 THR 67 1HG2 THR 67 10.500 -1.579 6.183 477 HG23 THR 67 2HG2 THR 67 11.217 -0.858 4.744 478 H THR 68 H THR 68 8.496 -2.345 3.416 479 HA THR 68 HA THR 68 9.652 -1.353 0.912 480 HB THR 68 HB THR 68 6.750 -1.762 1.685 481 HG1 THR 68 1HG THR 68 7.421 -3.789 1.519 482 HG21 THR 68 3HG2 THR 68 6.334 -1.604 -0.738 483 HG22 THR 68 1HG2 THR 68 8.055 -1.338 -1.018 484 HG23 THR 68 2HG2 THR 68 7.108 -0.139 -0.140 485 H THR 69 H THR 69 10.197 0.761 1.100 486 HA THR 69 HA THR 69 8.837 2.445 3.033 487 HB THR 69 HB THR 69 10.632 4.108 2.479 488 HG1 THR 69 1HG THR 69 11.622 1.957 0.868 489 HG21 THR 69 3HG2 THR 69 11.605 1.359 3.283 490 HG22 THR 69 1HG2 THR 69 10.914 2.566 4.364 491 HG23 THR 69 2HG2 THR 69 12.460 2.872 3.578 492 H ALA 70 H ALA 70 7.263 3.810 2.495 493 HA ALA 70 HA ALA 70 6.962 4.601 -0.316 494 HB1 ALA 70 1HB ALA 70 4.975 4.610 1.954 495 HB2 ALA 70 2HB ALA 70 5.066 3.417 0.658 496 HB3 ALA 70 3HB ALA 70 4.643 5.092 0.286 497 H GLY 71 H GLY 71 7.429 6.698 -0.781 498 HA2 GLY 71 2HA GLY 71 6.694 8.798 0.938 499 HA3 GLY 71 1HA GLY 71 8.421 8.480 1.053 500 H ARG 72 H ARG 72 8.297 10.746 0.224 501 HA ARG 72 HA ARG 72 8.133 10.707 -2.693 502 HB2 ARG 72 2HB ARG 72 6.668 12.346 -1.340 503 HB3 ARG 72 1HB ARG 72 8.158 13.196 -0.977 504 HG2 ARG 72 2HG ARG 72 7.151 12.682 -3.772 505 HG3 ARG 72 1HG ARG 72 6.799 14.140 -2.863 506 HD2 ARG 72 2HD ARG 72 9.176 14.677 -2.787 507 HD3 ARG 72 1HD ARG 72 9.561 13.168 -3.609 508 HE ARG 72 HE ARG 72 7.721 14.765 -5.060 509 HH11 ARG 72 1HH1 ARG 72 11.170 14.404 -4.357 510 HH12 ARG 72 2HH1 ARG 72 11.717 15.049 -5.813 511 HH21 ARG 72 1HH2 ARG 72 8.428 15.677 -7.075 512 HH22 ARG 72 2HH2 ARG 72 10.098 15.786 -7.434 513 H HIS 73 H HIS 73 10.042 9.843 -2.926 514 HA HIS 73 HA HIS 73 12.295 11.573 -2.926 515 HB2 HIS 73 2HB HIS 73 12.217 10.642 -0.564 516 HB3 HIS 73 1HB HIS 73 12.358 9.037 -1.252 517 HD1 HIS 73 1HD HIS 73 14.621 8.339 -0.441 518 HD2 HIS 73 2HD HIS 73 14.619 12.169 -2.029 519 HE1 HIS 73 1HE HIS 73 17.017 9.121 -0.382 520 HA PRO 74 HA PRO 74 12.503 9.079 -6.662 521 HB2 PRO 74 2HB PRO 74 15.307 9.178 -6.899 522 HB3 PRO 74 1HB PRO 74 14.157 10.301 -7.628 523 HG2 PRO 74 2HG PRO 74 15.732 10.573 -5.110 524 HG3 PRO 74 1HG PRO 74 15.278 11.811 -6.294 525 HD2 PRO 74 2HD PRO 74 14.046 11.642 -3.958 526 HD3 PRO 74 1HD PRO 74 13.125 12.012 -5.431 527 H GLU 75 H GLU 75 14.740 8.415 -4.029 528 HA GLU 75 HA GLU 75 14.743 5.658 -4.861 529 HB2 GLU 75 2HB GLU 75 16.742 5.465 -3.212 530 HB3 GLU 75 1HB GLU 75 16.976 6.183 -4.796 531 HG2 GLU 75 2HG GLU 75 16.789 8.418 -3.782 532 HG3 GLU 75 1HG GLU 75 16.621 7.661 -2.202 533 H SER 76 H SER 76 12.670 5.670 -4.113 534 HA SER 76 HA SER 76 12.533 4.693 -1.349 535 HB2 SER 76 2HB SER 76 10.314 6.046 -2.925 536 HB3 SER 76 1HB SER 76 10.196 5.458 -1.268 537 HG SER 76 HG SER 76 11.401 7.691 -2.314 538 H ASP 77 H ASP 77 10.607 3.037 -1.260 539 HA ASP 77 HA ASP 77 11.171 1.222 -3.422 540 HB2 ASP 77 2HB ASP 77 9.430 0.846 -0.978 541 HB3 ASP 77 1HB ASP 77 9.734 -0.403 -2.186 542 H ILE 78 H ILE 78 8.428 3.055 -2.283 543 HA ILE 78 HA ILE 78 7.372 2.863 -4.976 544 HB ILE 78 HB ILE 78 5.022 2.839 -4.185 545 HG12 ILE 78 2HG1 ILE 78 6.074 2.041 -1.472 546 HG13 ILE 78 1HG1 ILE 78 5.566 3.679 -1.871 547 HG21 ILE 78 1HG2 ILE 78 4.846 0.461 -3.610 548 HG22 ILE 78 2HG2 ILE 78 6.588 0.417 -3.340 549 HG23 ILE 78 3HG2 ILE 78 5.954 0.762 -4.950 550 HD11 ILE 78 3HD1 ILE 78 3.346 2.931 -2.323 551 HD12 ILE 78 1HD1 ILE 78 3.820 2.429 -0.705 552 HD13 ILE 78 2HD1 ILE 78 3.796 1.244 -2.022 553 H PHE 79 H PHE 79 5.539 4.602 -5.157 554 HA PHE 79 HA PHE 79 6.775 6.996 -4.093 555 HB2 PHE 79 2HB PHE 79 5.241 6.572 -6.642 556 HB3 PHE 79 1HB PHE 79 5.758 8.146 -6.054 557 HD1 PHE 79 2HD PHE 79 8.181 8.638 -5.839 558 HD2 PHE 79 1HD PHE 79 6.759 5.112 -7.749 559 HE1 PHE 79 2HE PHE 79 10.380 8.336 -6.900 560 HE2 PHE 79 1HE PHE 79 8.958 4.799 -8.815 561 HZ PHE 79 HZ PHE 79 10.770 6.412 -8.390 562 H LEU 80 H LEU 80 5.707 8.476 -3.097 563 HA LEU 80 HA LEU 80 2.824 8.630 -2.915 564 HB2 LEU 80 2HB LEU 80 4.065 7.180 -1.089 565 HB3 LEU 80 1HB LEU 80 4.532 8.740 -0.448 566 HG LEU 80 HG LEU 80 1.786 7.614 -0.768 567 HD11 LEU 80 1HD1 LEU 80 1.713 7.823 1.713 568 HD12 LEU 80 2HD1 LEU 80 3.404 8.321 1.679 569 HD13 LEU 80 3HD1 LEU 80 2.950 6.707 1.135 570 HD21 LEU 80 3HD2 LEU 80 2.533 10.341 0.281 571 HD22 LEU 80 1HD2 LEU 80 0.920 9.637 0.339 572 HD23 LEU 80 2HD2 LEU 80 1.665 10.000 -1.215 573 H ASP 81 H ASP 81 2.751 10.685 -3.800 574 HA ASP 81 HA ASP 81 4.903 12.521 -3.035 575 HB2 ASP 81 2HB ASP 81 4.625 13.525 -5.143 576 HB3 ASP 81 1HB ASP 81 4.784 11.787 -5.381 577 H ASP 82 H ASP 82 1.970 12.094 -1.945 578 HA ASP 82 HA ASP 82 0.174 13.995 -2.588 579 HB2 ASP 82 2HB ASP 82 -0.882 14.039 -0.391 580 HB3 ASP 82 1HB ASP 82 -0.328 12.421 -0.740 581 H VAL 83 H VAL 83 1.697 15.184 0.315 582 HA VAL 83 HA VAL 83 2.754 17.483 -0.965 583 HB VAL 83 HB VAL 83 0.411 18.184 -1.041 584 HG11 VAL 83 1HG1 VAL 83 -0.541 16.855 0.712 585 HG12 VAL 83 2HG1 VAL 83 -0.929 18.560 0.978 586 HG13 VAL 83 3HG1 VAL 83 0.333 17.779 1.932 587 HG21 VAL 83 3HG2 VAL 83 0.533 20.310 0.211 588 HG22 VAL 83 1HG2 VAL 83 2.019 19.943 -0.667 589 HG23 VAL 83 2HG2 VAL 83 1.941 19.690 1.077 590 H THR 84 H THR 84 1.694 16.067 2.129 591 HA THR 84 HA THR 84 4.038 17.341 3.351 592 HB THR 84 HB THR 84 1.537 16.351 4.782 593 HG1 THR 84 1HG THR 84 2.295 18.877 3.748 594 HG21 THR 84 3HG2 THR 84 3.565 16.623 6.207 595 HG22 THR 84 1HG2 THR 84 2.322 17.808 6.610 596 HG23 THR 84 2HG2 THR 84 3.718 18.286 5.647 597 H VAL 85 H VAL 85 3.883 15.019 1.791 598 HA VAL 85 HA VAL 85 4.339 12.783 3.518 599 HB VAL 85 HB VAL 85 3.273 12.416 1.365 600 HG11 VAL 85 1HG1 VAL 85 4.147 14.238 0.089 601 HG12 VAL 85 2HG1 VAL 85 4.495 12.726 -0.753 602 HG13 VAL 85 3HG1 VAL 85 5.769 13.555 0.149 603 HG21 VAL 85 3HG2 VAL 85 4.739 10.660 0.428 604 HG22 VAL 85 1HG2 VAL 85 4.611 10.578 2.189 605 HG23 VAL 85 2HG2 VAL 85 6.052 11.260 1.441 606 H SER 86 H SER 86 6.257 11.956 4.037 607 HA SER 86 HA SER 86 8.544 13.702 3.795 608 HB2 SER 86 2HB SER 86 8.196 11.110 5.314 609 HB3 SER 86 1HB SER 86 9.511 12.273 5.512 610 HG SER 86 HG SER 86 6.759 12.873 5.913 611 H ARG 87 H ARG 87 10.760 12.314 3.568 612 HA ARG 87 HA ARG 87 10.726 11.251 0.953 613 HB2 ARG 87 2HB ARG 87 12.895 11.291 3.055 614 HB3 ARG 87 1HB ARG 87 13.151 10.619 1.451 615 HG2 ARG 87 2HG ARG 87 12.615 12.765 0.437 616 HG3 ARG 87 1HG ARG 87 12.300 13.450 2.030 617 HD2 ARG 87 2HD ARG 87 14.946 12.343 1.104 618 HD3 ARG 87 1HD ARG 87 14.522 14.054 1.132 619 HE ARG 87 HE ARG 87 14.280 12.602 3.627 620 HH11 ARG 87 1HH1 ARG 87 16.322 14.739 1.664 621 HH12 ARG 87 2HH1 ARG 87 17.185 15.334 3.002 622 HH21 ARG 87 1HH2 ARG 87 15.497 13.383 5.420 623 HH22 ARG 87 2HH2 ARG 87 16.720 14.534 5.189 624 H ARG 88 H ARG 88 11.156 9.645 4.091 625 HA ARG 88 HA ARG 88 9.626 7.560 2.797 626 HB2 ARG 88 2HB ARG 88 10.632 5.729 3.980 627 HB3 ARG 88 1HB ARG 88 11.982 6.669 3.410 628 HG2 ARG 88 2HG ARG 88 10.917 6.730 6.231 629 HG3 ARG 88 1HG ARG 88 12.229 5.696 5.684 630 HD2 ARG 88 2HD ARG 88 13.508 7.725 5.085 631 HD3 ARG 88 1HD ARG 88 12.183 8.698 5.734 632 HE ARG 88 HE ARG 88 12.904 6.875 7.675 633 HH11 ARG 88 1HH1 ARG 88 14.317 9.721 6.093 634 HH12 ARG 88 2HH1 ARG 88 15.362 10.088 7.372 635 HH21 ARG 88 1HH2 ARG 88 14.340 7.421 9.448 636 HH22 ARG 88 2HH2 ARG 88 15.369 8.780 9.325 637 H HIS 89 H HIS 89 7.715 7.534 3.486 638 HA HIS 89 HA HIS 89 7.168 9.113 5.893 639 HB2 HIS 89 2HB HIS 89 6.362 9.914 3.669 640 HB3 HIS 89 1HB HIS 89 5.358 8.474 3.573 641 HD2 HIS 89 2HD HIS 89 3.173 8.428 5.327 642 HE1 HIS 89 1HE HIS 89 3.591 12.500 6.351 643 HE2 HIS 89 2HE HIS 89 2.440 10.282 6.879 644 H ALA 90 H ALA 90 5.911 6.344 4.082 645 HA ALA 90 HA ALA 90 4.982 5.276 6.640 646 HB1 ALA 90 1HB ALA 90 3.086 5.965 5.254 647 HB2 ALA 90 2HB ALA 90 3.144 4.210 5.421 648 HB3 ALA 90 3HB ALA 90 3.690 4.973 3.926 649 H GLU 91 H GLU 91 5.770 3.373 7.123 650 HA GLU 91 HA GLU 91 7.238 1.994 4.999 651 HB2 GLU 91 2HB GLU 91 7.484 1.780 7.990 652 HB3 GLU 91 1HB GLU 91 8.408 0.835 6.834 653 HG2 GLU 91 2HG GLU 91 9.420 2.873 5.966 654 HG3 GLU 91 1HG GLU 91 8.484 3.827 7.117 655 H PHE 92 H PHE 92 6.484 0.193 4.270 656 HA PHE 92 HA PHE 92 4.396 -1.231 5.761 657 HB2 PHE 92 2HB PHE 92 5.162 -1.389 2.824 658 HB3 PHE 92 1HB PHE 92 3.859 -2.282 3.590 659 HD1 PHE 92 2HD PHE 92 1.836 -1.110 4.311 660 HD2 PHE 92 1HD PHE 92 4.919 0.886 2.174 661 HE1 PHE 92 2HE PHE 92 0.281 0.711 3.774 662 HE2 PHE 92 1HE PHE 92 3.361 2.714 1.635 663 HZ PHE 92 HZ PHE 92 1.043 2.623 2.431 664 H ARG 93 H ARG 93 5.246 -2.913 6.842 665 HA ARG 93 HA ARG 93 7.435 -4.255 5.520 666 HB2 ARG 93 2HB ARG 93 8.573 -4.543 7.745 667 HB3 ARG 93 1HB ARG 93 8.596 -2.923 7.082 668 HG2 ARG 93 2HG ARG 93 6.787 -2.282 8.613 669 HG3 ARG 93 1HG ARG 93 6.790 -3.917 9.277 670 HD2 ARG 93 2HD ARG 93 8.076 -2.421 10.710 671 HD3 ARG 93 1HD ARG 93 9.115 -3.637 9.970 672 HE ARG 93 HE ARG 93 8.953 -0.975 8.738 673 HH11 ARG 93 1HH1 ARG 93 10.897 -3.369 10.529 674 HH12 ARG 93 2HH1 ARG 93 12.344 -2.495 10.345 675 HH21 ARG 93 1HH2 ARG 93 11.044 0.215 8.500 676 HH22 ARG 93 2HH2 ARG 93 12.411 -0.494 9.189 677 H ILE 94 H ILE 94 7.777 -6.350 6.039 678 HA ILE 94 HA ILE 94 5.415 -7.639 7.165 679 HB ILE 94 HB ILE 94 5.386 -8.153 4.825 680 HG12 ILE 94 2HG1 ILE 94 5.757 -10.619 4.721 681 HG13 ILE 94 1HG1 ILE 94 6.603 -10.526 6.259 682 HG21 ILE 94 1HG2 ILE 94 7.620 -7.509 4.213 683 HG22 ILE 94 2HG2 ILE 94 7.246 -9.111 3.579 684 HG23 ILE 94 3HG2 ILE 94 8.271 -8.946 5.004 685 HD11 ILE 94 3HD1 ILE 94 4.328 -11.330 6.523 686 HD12 ILE 94 1HD1 ILE 94 3.708 -9.855 5.787 687 HD13 ILE 94 2HD1 ILE 94 4.545 -9.784 7.340 688 H ASN 95 H ASN 95 5.716 -8.661 8.881 689 HA ASN 95 HA ASN 95 8.383 -9.471 9.719 690 HB2 ASN 95 2HB ASN 95 7.152 -7.940 11.245 691 HB3 ASN 95 1HB ASN 95 5.824 -9.091 11.298 692 HD21 ASN 95 1HD2 ASN 95 5.983 -9.365 13.495 693 HD22 ASN 95 2HD2 ASN 95 7.271 -10.235 14.230 694 H GLU 96 H GLU 96 8.679 -11.596 10.402 695 HA GLU 96 HA GLU 96 7.237 -13.483 8.942 696 HB2 GLU 96 2HB GLU 96 8.500 -15.215 10.293 697 HB3 GLU 96 1HB GLU 96 9.479 -14.058 9.421 698 HG2 GLU 96 2HG GLU 96 10.512 -14.378 11.529 699 HG3 GLU 96 1HG GLU 96 9.742 -12.800 11.586 700 H GLY 97 H GLY 97 6.454 -12.057 11.829 701 HA2 GLY 97 2HA GLY 97 4.510 -14.033 12.602 702 HA3 GLY 97 1HA GLY 97 4.728 -12.439 13.319 703 H GLU 98 H GLU 98 4.227 -10.548 11.550 704 HA GLU 98 HA GLU 98 1.835 -11.214 10.044 705 HB2 GLU 98 2HB GLU 98 1.858 -9.236 12.332 706 HB3 GLU 98 1HB GLU 98 0.584 -9.389 11.148 707 HG2 GLU 98 2HG GLU 98 0.060 -11.607 11.938 708 HG3 GLU 98 1HG GLU 98 1.430 -11.568 13.050 709 H PHE 99 H PHE 99 0.944 -9.008 9.160 710 HA PHE 99 HA PHE 99 3.146 -7.563 7.895 711 HB2 PHE 99 2HB PHE 99 0.139 -7.479 7.478 712 HB3 PHE 99 1HB PHE 99 1.293 -6.513 6.567 713 HD1 PHE 99 2HD PHE 99 0.015 -9.920 7.176 714 HD2 PHE 99 1HD PHE 99 2.454 -7.444 4.717 715 HE1 PHE 99 2HE PHE 99 0.128 -11.708 5.489 716 HE2 PHE 99 1HE PHE 99 2.564 -9.226 3.024 717 HZ PHE 99 HZ PHE 99 1.402 -11.360 3.411 718 H GLU 100 H GLU 100 3.648 -5.451 8.517 719 HA GLU 100 HA GLU 100 1.766 -4.170 10.342 720 HB2 GLU 100 2HB GLU 100 3.507 -5.358 11.645 721 HB3 GLU 100 1HB GLU 100 4.739 -4.424 10.821 722 HG2 GLU 100 2HG GLU 100 4.103 -2.439 11.905 723 HG3 GLU 100 1HG GLU 100 2.582 -3.137 12.462 724 H VAL 101 H VAL 101 1.535 -1.953 10.062 725 HA VAL 101 HA VAL 101 3.388 -0.769 8.174 726 HB VAL 101 HB VAL 101 1.328 -1.090 6.933 727 HG11 VAL 101 1HG1 VAL 101 -0.818 -0.126 7.625 728 HG12 VAL 101 2HG1 VAL 101 -0.097 0.330 9.169 729 HG13 VAL 101 3HG1 VAL 101 -0.251 -1.373 8.737 730 HG21 VAL 101 3HG2 VAL 101 0.733 1.228 6.355 731 HG22 VAL 101 1HG2 VAL 101 2.478 1.008 6.508 732 HG23 VAL 101 2HG2 VAL 101 1.569 1.788 7.802 733 H VAL 102 H VAL 102 4.418 0.845 8.919 734 HA VAL 102 HA VAL 102 3.304 2.250 11.215 735 HB VAL 102 HB VAL 102 5.626 2.595 12.074 736 HG11 VAL 102 1HG1 VAL 102 4.759 -0.274 11.779 737 HG12 VAL 102 2HG1 VAL 102 4.244 0.852 13.037 738 HG13 VAL 102 3HG1 VAL 102 5.923 0.314 12.963 739 HG21 VAL 102 3HG2 VAL 102 6.384 0.562 9.961 740 HG22 VAL 102 1HG2 VAL 102 7.440 1.131 11.255 741 HG23 VAL 102 2HG2 VAL 102 6.888 2.253 10.015 742 H ASP 103 H ASP 103 3.095 4.323 11.020 743 HA ASP 103 HA ASP 103 4.220 5.678 8.712 744 HB2 ASP 103 2HB ASP 103 1.955 6.188 9.036 745 HB3 ASP 103 1HB ASP 103 2.148 6.389 10.777 746 H VAL 104 H VAL 104 5.910 6.990 8.827 747 HA VAL 104 HA VAL 104 6.729 7.860 11.501 748 HB VAL 104 HB VAL 104 9.063 8.071 10.660 749 HG11 VAL 104 1HG1 VAL 104 8.415 6.062 11.842 750 HG12 VAL 104 2HG1 VAL 104 9.579 5.678 10.577 751 HG13 VAL 104 3HG1 VAL 104 7.867 5.328 10.335 752 HG21 VAL 104 3HG2 VAL 104 8.595 8.365 8.281 753 HG22 VAL 104 1HG2 VAL 104 8.002 6.708 8.185 754 HG23 VAL 104 2HG2 VAL 104 9.704 7.017 8.540 755 H GLY 105 H GLY 105 4.966 9.025 9.256 756 HA2 GLY 105 2HA GLY 105 6.164 11.706 9.306 757 HA3 GLY 105 1HA GLY 105 5.285 11.091 7.899 758 H SER 106 H SER 106 4.836 11.216 11.366 759 HA SER 106 HA SER 106 2.042 11.044 11.237 760 HB2 SER 106 2HB SER 106 3.792 11.832 13.554 761 HB3 SER 106 1HB SER 106 2.172 11.127 13.626 762 HG SER 106 HG SER 106 3.395 9.529 12.110 763 H LEU 107 H LEU 107 4.035 13.691 10.774 764 HA LEU 107 HA LEU 107 2.391 15.737 11.866 765 HB2 LEU 107 2HB LEU 107 4.856 15.836 11.196 766 HB3 LEU 107 1HB LEU 107 4.313 15.954 9.546 767 HG LEU 107 HG LEU 107 3.513 18.010 11.610 768 HD11 LEU 107 1HD1 LEU 107 5.355 19.392 10.780 769 HD12 LEU 107 2HD1 LEU 107 5.902 18.055 9.772 770 HD13 LEU 107 3HD1 LEU 107 5.956 17.912 11.530 771 HD21 LEU 107 3HD2 LEU 107 2.225 17.973 9.515 772 HD22 LEU 107 1HD2 LEU 107 3.723 18.123 8.598 773 HD23 LEU 107 2HD2 LEU 107 3.202 19.438 9.653 774 H ASN 108 H ASN 108 2.657 14.071 8.806 775 HA ASN 108 HA ASN 108 0.455 15.561 7.621 776 HB2 ASN 108 2HB ASN 108 2.446 14.652 6.302 777 HB3 ASN 108 1HB ASN 108 1.789 13.056 6.644 778 HD21 ASN 108 1HD2 ASN 108 1.849 12.882 4.333 779 HD22 ASN 108 2HD2 ASN 108 0.601 13.481 3.353 780 H GLY 109 H GLY 109 1.217 12.360 8.857 781 HA2 GLY 109 2HA GLY 109 -0.155 11.093 10.219 782 HA3 GLY 109 1HA GLY 109 -1.509 12.118 9.793 783 H THR 110 H THR 110 -0.369 9.117 9.624 784 HA THR 110 HA THR 110 -1.787 8.459 7.174 785 HB THR 110 HB THR 110 0.090 6.913 8.964 786 HG1 THR 110 1HG THR 110 1.380 7.914 7.603 787 HG21 THR 110 3HG2 THR 110 -1.397 5.865 6.531 788 HG22 THR 110 1HG2 THR 110 -1.640 5.345 8.195 789 HG23 THR 110 2HG2 THR 110 -0.115 5.004 7.382 790 H TYR 111 H TYR 111 -3.617 7.123 7.262 791 HA TYR 111 HA TYR 111 -4.819 6.823 9.939 792 HB2 TYR 111 2HB TYR 111 -6.217 7.772 7.435 793 HB3 TYR 111 1HB TYR 111 -6.978 7.442 8.978 794 HD1 TYR 111 2HD TYR 111 -4.815 9.743 7.111 795 HD2 TYR 111 1HD TYR 111 -6.856 9.044 10.773 796 HE1 TYR 111 2HE TYR 111 -4.489 12.089 7.728 797 HE2 TYR 111 1HE TYR 111 -6.545 11.400 11.398 798 HH TYR 111 HH TYR 111 -4.964 13.240 10.831 799 H VAL 112 H VAL 112 -6.696 5.373 9.872 800 HA VAL 112 HA VAL 112 -6.653 3.381 7.750 801 HB VAL 112 HB VAL 112 -5.643 2.423 9.884 802 HG11 VAL 112 1HG1 VAL 112 -8.348 2.964 11.071 803 HG12 VAL 112 2HG1 VAL 112 -6.834 3.744 11.515 804 HG13 VAL 112 3HG1 VAL 112 -7.061 2.023 11.827 805 HG21 VAL 112 3HG2 VAL 112 -7.058 0.405 9.991 806 HG22 VAL 112 1HG2 VAL 112 -6.747 0.920 8.332 807 HG23 VAL 112 2HG2 VAL 112 -8.306 1.255 9.081 808 H ASN 113 H ASN 113 -8.585 2.650 7.111 809 HA ASN 113 HA ASN 113 -10.522 4.129 6.357 810 HB2 ASN 113 2HB ASN 113 -10.438 1.627 6.225 811 HB3 ASN 113 1HB ASN 113 -11.255 1.580 7.776 812 HD21 ASN 113 1HD2 ASN 113 -12.047 0.546 5.286 813 HD22 ASN 113 2HD2 ASN 113 -13.556 1.274 4.807 814 H ARG 114 H ARG 114 -10.779 5.883 7.513 815 HA ARG 114 HA ARG 114 -11.921 7.470 8.558 816 HB2 ARG 114 2HB ARG 114 -14.212 7.220 9.311 817 HB3 ARG 114 1HB ARG 114 -13.982 6.381 7.792 818 HG2 ARG 114 2HG ARG 114 -13.913 4.261 8.969 819 HG3 ARG 114 1HG ARG 114 -14.081 5.107 10.506 820 HD2 ARG 114 2HD ARG 114 -16.254 5.917 9.853 821 HD3 ARG 114 1HD ARG 114 -16.092 5.157 8.267 822 HE ARG 114 HE ARG 114 -15.709 3.130 9.990 823 HH11 ARG 114 1HH1 ARG 114 -18.283 5.550 9.752 824 HH12 ARG 114 2HH1 ARG 114 -19.533 4.510 10.220 825 HH21 ARG 114 1HH2 ARG 114 -17.449 1.653 10.655 826 HH22 ARG 114 2HH2 ARG 114 -19.035 2.240 10.753 827 H GLU 115 H GLU 115 -10.265 5.372 10.287 828 HA GLU 115 HA GLU 115 -10.937 6.820 12.723 829 HB2 GLU 115 2HB GLU 115 -10.253 3.881 12.564 830 HB3 GLU 115 1HB GLU 115 -10.402 4.781 14.072 831 HG2 GLU 115 2HG GLU 115 -12.720 5.353 13.479 832 HG3 GLU 115 1HG GLU 115 -12.571 4.377 12.027 833 HA PRO 116 HA PRO 116 -6.766 8.025 12.745 834 HB2 PRO 116 2HB PRO 116 -6.547 9.034 15.212 835 HB3 PRO 116 1HB PRO 116 -7.581 9.784 13.986 836 HG2 PRO 116 2HG PRO 116 -8.316 7.988 16.259 837 HG3 PRO 116 1HG PRO 116 -9.138 9.444 15.683 838 HD2 PRO 116 2HD PRO 116 -9.918 6.891 15.057 839 HD3 PRO 116 1HD PRO 116 -10.256 8.308 14.042 840 H ARG 117 H ARG 117 -5.541 6.205 12.542 841 HA ARG 117 HA ARG 117 -4.133 5.438 14.946 842 HB2 ARG 117 2HB ARG 117 -5.217 3.431 12.957 843 HB3 ARG 117 1HB ARG 117 -3.918 3.069 14.079 844 HG2 ARG 117 2HG ARG 117 -5.436 3.581 15.954 845 HG3 ARG 117 1HG ARG 117 -6.737 3.822 14.786 846 HD2 ARG 117 2HD ARG 117 -6.822 1.598 15.764 847 HD3 ARG 117 1HD ARG 117 -6.503 1.523 14.033 848 HE ARG 117 HE ARG 117 -4.030 1.503 15.240 849 HH11 ARG 117 1HH1 ARG 117 -6.918 -0.510 15.533 850 HH12 ARG 117 2HH1 ARG 117 -6.041 -1.953 15.752 851 HH21 ARG 117 1HH2 ARG 117 -2.838 -0.509 15.593 852 HH22 ARG 117 2HH2 ARG 117 -3.725 -1.949 15.806 853 H ASN 118 H ASN 118 -2.131 5.795 14.660 854 HA ASN 118 HA ASN 118 -1.190 6.508 12.019 855 HB2 ASN 118 2HB ASN 118 -0.784 7.889 14.092 856 HB3 ASN 118 1HB ASN 118 0.306 6.621 14.639 857 HD21 ASN 118 1HD2 ASN 118 2.344 6.487 13.752 858 HD22 ASN 118 2HD2 ASN 118 2.911 7.636 12.576 859 H ALA 119 H ALA 119 -0.933 3.915 14.280 860 HA ALA 119 HA ALA 119 0.812 2.487 12.375 861 HB1 ALA 119 1HB ALA 119 1.698 1.227 14.293 862 HB2 ALA 119 2HB ALA 119 0.752 2.238 15.393 863 HB3 ALA 119 3HB ALA 119 2.061 2.945 14.451 864 H GLN 120 H GLN 120 0.109 0.551 11.816 865 HA GLN 120 HA GLN 120 -2.271 -0.456 13.113 866 HB2 GLN 120 2HB GLN 120 -3.141 0.998 11.377 867 HB3 GLN 120 1HB GLN 120 -2.112 0.249 10.174 868 HG2 GLN 120 2HG GLN 120 -4.434 -0.466 9.972 869 HG3 GLN 120 1HG GLN 120 -3.372 -1.818 10.353 870 HE21 GLN 120 1HE2 GLN 120 -5.815 0.216 11.484 871 HE22 GLN 120 2HE2 GLN 120 -6.322 -0.733 12.852 872 H VAL 121 H VAL 121 -2.639 -2.609 12.772 873 HA VAL 121 HA VAL 121 -0.361 -4.072 11.703 874 HB VAL 121 HB VAL 121 -1.317 -4.980 13.845 875 HG11 VAL 121 1HG1 VAL 121 -3.518 -6.021 13.952 876 HG12 VAL 121 2HG1 VAL 121 -3.868 -5.439 12.323 877 HG13 VAL 121 3HG1 VAL 121 -3.619 -4.287 13.635 878 HG21 VAL 121 3HG2 VAL 121 -1.634 -7.329 13.179 879 HG22 VAL 121 1HG2 VAL 121 -0.271 -6.573 12.351 880 HG23 VAL 121 2HG2 VAL 121 -1.796 -6.813 11.502 881 H MET 122 H MET 122 -0.451 -4.835 9.674 882 HA MET 122 HA MET 122 -2.369 -3.491 8.075 883 HB2 MET 122 2HB MET 122 0.131 -4.080 7.577 884 HB3 MET 122 1HB MET 122 -0.533 -5.600 7.007 885 HG2 MET 122 2HG MET 122 -1.806 -4.492 5.320 886 HG3 MET 122 1HG MET 122 -1.361 -2.911 5.958 887 HE1 MET 122 3HE MET 122 0.617 -2.859 2.621 888 HE2 MET 122 1HE MET 122 -0.467 -1.975 3.696 889 HE3 MET 122 2HE MET 122 -1.013 -3.460 2.916 890 H GLN 123 H GLN 123 -4.341 -4.100 7.659 891 HA GLN 123 HA GLN 123 -5.094 -6.854 8.221 892 HB2 GLN 123 2HB GLN 123 -6.094 -5.073 9.600 893 HB3 GLN 123 1HB GLN 123 -6.721 -4.310 8.149 894 HG2 GLN 123 2HG GLN 123 -8.091 -6.307 7.722 895 HG3 GLN 123 1HG GLN 123 -7.478 -7.012 9.216 896 HE21 GLN 123 1HE2 GLN 123 -9.492 -7.150 10.095 897 HE22 GLN 123 2HE2 GLN 123 -10.367 -5.782 10.661 898 H THR 124 H THR 124 -6.051 -8.049 6.710 899 HA THR 124 HA THR 124 -5.948 -7.073 4.030 900 HB THR 124 HB THR 124 -6.571 -9.404 3.480 901 HG1 THR 124 1HG THR 124 -7.654 -9.754 5.569 902 HG21 THR 124 3HG2 THR 124 -4.219 -8.762 3.630 903 HG22 THR 124 1HG2 THR 124 -4.436 -10.412 4.213 904 HG23 THR 124 2HG2 THR 124 -4.226 -9.089 5.362 905 H GLY 125 H GLY 125 -7.610 -6.375 2.925 906 HA2 GLY 125 2HA GLY 125 -9.820 -6.733 2.131 907 HA3 GLY 125 1HA GLY 125 -10.299 -7.143 3.774 908 H ASP 126 H ASP 126 -8.269 -4.680 4.291 909 HA ASP 126 HA ASP 126 -10.528 -2.849 4.023 910 HB2 ASP 126 2HB ASP 126 -9.618 -3.698 6.408 911 HB3 ASP 126 1HB ASP 126 -8.642 -2.250 6.203 912 H GLU 127 H GLU 127 -9.718 -0.558 4.582 913 HA GLU 127 HA GLU 127 -7.798 0.109 2.475 914 HB2 GLU 127 2HB GLU 127 -10.208 1.551 3.568 915 HB3 GLU 127 1HB GLU 127 -9.144 2.179 2.314 916 HG2 GLU 127 2HG GLU 127 -9.880 0.671 0.738 917 HG3 GLU 127 1HG GLU 127 -10.411 -0.492 1.947 918 H ILE 128 H ILE 128 -6.081 1.193 3.046 919 HA ILE 128 HA ILE 128 -5.911 2.454 5.692 920 HB ILE 128 HB ILE 128 -3.677 1.207 4.032 921 HG12 ILE 128 2HG1 ILE 128 -4.908 0.243 6.632 922 HG13 ILE 128 1HG1 ILE 128 -5.201 -0.465 5.052 923 HG21 ILE 128 1HG2 ILE 128 -2.888 3.116 5.343 924 HG22 ILE 128 2HG2 ILE 128 -2.248 1.611 5.999 925 HG23 ILE 128 3HG2 ILE 128 -3.593 2.420 6.804 926 HD11 ILE 128 3HD1 ILE 128 -2.558 -0.372 6.486 927 HD12 ILE 128 1HD1 ILE 128 -2.843 -1.098 4.905 928 HD13 ILE 128 2HD1 ILE 128 -3.612 -1.779 6.341 929 H GLN 129 H GLN 129 -5.373 4.617 5.627 930 HA GLN 129 HA GLN 129 -4.974 5.663 2.930 931 HB2 GLN 129 2HB GLN 129 -7.024 6.457 4.043 932 HB3 GLN 129 1HB GLN 129 -6.054 7.083 5.371 933 HG2 GLN 129 2HG GLN 129 -4.974 8.654 3.867 934 HG3 GLN 129 1HG GLN 129 -5.872 7.993 2.506 935 HE21 GLN 129 1HE2 GLN 129 -6.006 9.968 5.328 936 HE22 GLN 129 2HE2 GLN 129 -7.557 10.652 5.012 937 H ILE 130 H ILE 130 -2.994 6.103 2.534 938 HA ILE 130 HA ILE 130 -1.285 6.886 4.717 939 HB ILE 130 HB ILE 130 0.593 6.534 2.887 940 HG12 ILE 130 2HG1 ILE 130 0.044 4.491 1.459 941 HG13 ILE 130 1HG1 ILE 130 -1.646 4.764 1.834 942 HG21 ILE 130 1HG2 ILE 130 0.878 4.248 3.655 943 HG22 ILE 130 2HG2 ILE 130 -0.766 4.264 4.293 944 HG23 ILE 130 3HG2 ILE 130 0.450 5.349 4.964 945 HD11 ILE 130 3HD1 ILE 130 -1.522 6.917 0.700 946 HD12 ILE 130 1HD1 ILE 130 -1.090 5.580 -0.371 947 HD13 ILE 130 2HD1 ILE 130 0.172 6.609 0.310 948 H GLY 131 H GLY 131 -0.871 8.833 5.108 949 HA2 GLY 131 2HA GLY 131 -0.597 11.090 4.825 950 HA3 GLY 131 1HA GLY 131 -0.433 10.805 3.089 951 H LYS 132 H LYS 132 -2.217 10.772 1.816 952 HA LYS 132 HA LYS 132 -4.823 11.308 3.013 953 HB2 LYS 132 2HB LYS 132 -3.706 13.511 2.464 954 HB3 LYS 132 1HB LYS 132 -3.688 13.021 0.784 955 HG2 LYS 132 2HG LYS 132 -5.515 14.560 1.175 956 HG3 LYS 132 1HG LYS 132 -6.151 12.966 0.782 957 HD2 LYS 132 2HD LYS 132 -7.435 13.936 2.603 958 HD3 LYS 132 1HD LYS 132 -6.528 12.553 3.206 959 HE2 LYS 132 2HE LYS 132 -4.834 14.079 4.127 960 HE3 LYS 132 1HE LYS 132 -5.743 15.456 3.501 961 HZ1 LYS 132 3HZ LYS 132 -6.168 15.074 5.869 962 HZ2 LYS 132 1HZ LYS 132 -6.743 13.533 5.537 963 HZ3 LYS 132 2HZ LYS 132 -7.565 14.882 4.970 964 H PHE 133 H PHE 133 -3.072 9.347 1.131 965 HA PHE 133 HA PHE 133 -5.055 9.114 -1.020 966 HB2 PHE 133 2HB PHE 133 -2.253 7.989 -0.861 967 HB3 PHE 133 1HB PHE 133 -3.362 7.763 -2.201 968 HD1 PHE 133 1HD PHE 133 -4.436 10.642 -2.231 969 HD2 PHE 133 2HD PHE 133 -0.517 9.019 -2.025 970 HE1 PHE 133 1HE PHE 133 -3.557 12.645 -3.314 971 HE2 PHE 133 2HE PHE 133 0.375 11.032 -3.111 972 HZ PHE 133 HZ PHE 133 -1.155 12.852 -3.756 973 H ARG 134 H ARG 134 -5.793 7.008 -1.602 974 HA ARG 134 HA ARG 134 -5.997 5.397 0.837 975 HB2 ARG 134 2HB ARG 134 -8.025 5.604 -1.392 976 HB3 ARG 134 1HB ARG 134 -8.156 4.512 -0.026 977 HG2 ARG 134 2HG ARG 134 -9.537 6.300 0.560 978 HG3 ARG 134 1HG ARG 134 -8.046 6.626 1.428 979 HD2 ARG 134 2HD ARG 134 -7.359 8.179 -0.343 980 HD3 ARG 134 1HD ARG 134 -8.873 7.875 -1.192 981 HE ARG 134 HE ARG 134 -8.609 9.166 1.434 982 HH11 ARG 134 1HH1 ARG 134 -10.491 8.640 -1.555 983 HH12 ARG 134 2HH1 ARG 134 -11.553 9.923 -1.245 984 HH21 ARG 134 1HH2 ARG 134 -10.132 10.940 1.808 985 HH22 ARG 134 2HH2 ARG 134 -11.371 11.209 0.660 986 H LEU 135 H LEU 135 -5.204 3.514 0.924 987 HA LEU 135 HA LEU 135 -4.539 2.028 -1.518 988 HB2 LEU 135 2HB LEU 135 -2.623 2.891 -0.214 989 HB3 LEU 135 1HB LEU 135 -3.254 2.107 1.214 990 HG LEU 135 HG LEU 135 -2.960 -0.083 -0.033 991 HD11 LEU 135 1HD1 LEU 135 -1.303 1.674 -1.825 992 HD12 LEU 135 2HD1 LEU 135 -2.764 0.795 -2.278 993 HD13 LEU 135 3HD1 LEU 135 -1.305 -0.088 -1.834 994 HD21 LEU 135 3HD2 LEU 135 -1.509 0.677 1.774 995 HD22 LEU 135 1HD2 LEU 135 -0.519 1.554 0.613 996 HD23 LEU 135 2HD2 LEU 135 -0.608 -0.211 0.554 997 H VAL 136 H VAL 136 -5.322 -0.090 -1.510 998 HA VAL 136 HA VAL 136 -6.680 -0.945 0.937 999 HB VAL 136 HB VAL 136 -8.278 -0.531 -0.917 1000 HG11 VAL 136 1HG1 VAL 136 -8.322 -1.946 -2.901 1001 HG12 VAL 136 2HG1 VAL 136 -6.781 -2.656 -2.411 1002 HG13 VAL 136 3HG1 VAL 136 -6.871 -0.947 -2.818 1003 HG21 VAL 136 3HG2 VAL 136 -7.997 -3.449 -0.201 1004 HG22 VAL 136 1HG2 VAL 136 -9.446 -2.711 -0.888 1005 HG23 VAL 136 2HG2 VAL 136 -8.875 -2.222 0.709 1006 H PHE 137 H PHE 137 -6.253 -2.973 1.683 1007 HA PHE 137 HA PHE 137 -4.018 -4.346 0.340 1008 HB2 PHE 137 2HB PHE 137 -3.445 -3.268 2.500 1009 HB3 PHE 137 1HB PHE 137 -4.694 -4.218 3.287 1010 HD1 PHE 137 2HD PHE 137 -1.835 -4.898 0.982 1011 HD2 PHE 137 1HD PHE 137 -3.879 -5.921 4.563 1012 HE1 PHE 137 2HE PHE 137 -0.157 -6.635 1.437 1013 HE2 PHE 137 1HE PHE 137 -2.205 -7.657 5.025 1014 HZ PHE 137 HZ PHE 137 -0.343 -8.011 3.472 1015 H LEU 138 H LEU 138 -4.473 -6.367 -0.336 1016 HA LEU 138 HA LEU 138 -6.955 -7.582 0.684 1017 HB2 LEU 138 2HB LEU 138 -5.779 -7.819 -2.092 1018 HB3 LEU 138 1HB LEU 138 -7.118 -8.765 -1.505 1019 HG LEU 138 HG LEU 138 -8.028 -7.128 -2.892 1020 HD11 LEU 138 1HD1 LEU 138 -9.467 -5.794 -1.474 1021 HD12 LEU 138 2HD1 LEU 138 -8.459 -6.184 -0.086 1022 HD13 LEU 138 3HD1 LEU 138 -9.334 -7.466 -0.929 1023 HD21 LEU 138 3HD2 LEU 138 -7.640 -4.713 -2.662 1024 HD22 LEU 138 1HD2 LEU 138 -6.157 -5.592 -3.044 1025 HD23 LEU 138 2HD2 LEU 138 -6.454 -5.034 -1.396 1026 H ALA 139 H ALA 139 -7.051 -9.786 0.998 1027 HA ALA 139 HA ALA 139 -4.509 -11.024 1.592 1028 HB1 ALA 139 1HB ALA 139 -5.850 -12.852 2.536 1029 HB2 ALA 139 2HB ALA 139 -7.323 -12.043 2.008 1030 HB3 ALA 139 3HB ALA 139 -6.297 -11.302 3.235 1031 H GLY 140 H GLY 140 -3.590 -11.553 -0.227 1032 HA2 GLY 140 2HA GLY 140 -4.800 -13.780 -1.681 1033 HA3 GLY 140 1HA GLY 140 -4.090 -12.432 -2.578 1034 HA PRO 141 HA PRO 141 -0.623 -14.337 0.208 1035 HB2 PRO 141 2HB PRO 141 -0.882 -17.029 0.587 1036 HB3 PRO 141 1HB PRO 141 -1.226 -15.756 1.766 1037 HG2 PRO 141 2HG PRO 141 -3.114 -17.319 0.061 1038 HG3 PRO 141 1HG PRO 141 -3.345 -16.687 1.699 1039 HD2 PRO 141 2HD PRO 141 -4.419 -15.530 -0.519 1040 HD3 PRO 141 1HD PRO 141 -4.000 -14.623 0.945 1041 H ALA 142 H ALA 142 0.751 -14.265 -1.098 1042 HA ALA 142 HA ALA 142 0.909 -16.095 -3.384 1043 HB1 ALA 142 1HB ALA 142 0.904 -13.727 -3.967 1044 HB2 ALA 142 2HB ALA 142 2.452 -14.472 -4.372 1045 HB3 ALA 142 3HB ALA 142 2.308 -13.462 -2.939 1046 H GLU 143 H GLU 143 1.975 -17.833 -2.763 1047 HA GLU 143 HA GLU 143 4.367 -17.566 -1.172 1048 HB2 GLU 143 2HB GLU 143 2.545 -19.879 -1.812 1049 HB3 GLU 143 1HB GLU 143 3.924 -19.912 -0.728 1050 HG2 GLU 143 2HG GLU 143 2.822 -18.352 0.766 1051 HG3 GLU 143 1HG GLU 143 1.465 -18.223 -0.346 Start of MODEL 29 1 H1 MET 1 1HT MET 1 2.237 52.156 56.197 2 H2 MET 1 2HT MET 1 2.649 53.754 55.872 3 H3 MET 1 3HT MET 1 1.306 53.061 55.146 4 HA MET 1 HA MET 1 1.644 53.452 58.057 5 HB2 MET 1 2HB MET 1 -0.043 55.003 56.078 6 HB3 MET 1 1HB MET 1 -0.218 55.131 57.821 7 HG2 MET 1 2HG MET 1 2.001 56.052 58.011 8 HG3 MET 1 1HG MET 1 2.290 55.803 56.292 9 HE1 MET 1 2HE MET 1 2.722 58.582 57.845 10 HE2 MET 1 3HE MET 1 2.051 59.721 56.675 11 HE3 MET 1 1HE MET 1 3.055 58.378 56.128 12 H SER 2 H SER 2 -1.424 53.550 56.213 13 HA SER 2 HA SER 2 -2.384 51.337 57.758 14 HB2 SER 2 2HB SER 2 -3.554 52.692 55.306 15 HB3 SER 2 1HB SER 2 -4.421 51.599 56.388 16 HG SER 2 HG SER 2 -3.275 53.513 57.832 17 H ASP 3 H ASP 3 -0.985 51.934 54.730 18 HA ASP 3 HA ASP 3 -1.274 49.297 53.619 19 HB2 ASP 3 2HB ASP 3 0.120 50.167 51.830 20 HB3 ASP 3 1HB ASP 3 -1.075 51.392 52.233 21 H ASN 4 H ASN 4 0.334 47.696 53.707 22 HA ASN 4 HA ASN 4 2.998 48.212 54.403 23 HB2 ASN 4 2HB ASN 4 3.217 47.195 56.552 24 HB3 ASN 4 1HB ASN 4 1.916 48.355 56.712 25 HD21 ASN 4 1HD2 ASN 4 2.626 45.888 58.189 26 HD22 ASN 4 2HD2 ASN 4 1.204 44.922 58.209 27 H ASN 5 H ASN 5 4.197 46.160 54.658 28 HA ASN 5 HA ASN 5 2.975 43.705 54.028 29 HB2 ASN 5 2HB ASN 5 4.215 43.280 51.887 30 HB3 ASN 5 1HB ASN 5 2.981 44.515 51.720 31 HD21 ASN 5 1HD2 ASN 5 3.593 46.605 51.294 32 HD22 ASN 5 2HD2 ASN 5 5.186 47.046 50.817 33 H GLY 6 H GLY 6 4.157 42.189 54.939 34 HA2 GLY 6 2HA GLY 6 6.722 42.988 56.025 35 HA3 GLY 6 1HA GLY 6 5.789 41.558 56.460 36 H THR 7 H THR 7 8.539 41.621 55.876 37 HA THR 7 HA THR 7 8.884 40.557 53.229 38 HB THR 7 HB THR 7 10.805 40.596 55.565 39 HG1 THR 7 1HG THR 7 9.775 42.603 54.065 40 HG21 THR 7 3HG2 THR 7 11.464 39.118 53.703 41 HG22 THR 7 1HG2 THR 7 12.528 40.520 53.794 42 HG23 THR 7 2HG2 THR 7 11.263 40.449 52.568 43 HA PRO 8 HA PRO 8 8.018 36.353 54.699 44 HB2 PRO 8 2HB PRO 8 9.330 35.549 52.184 45 HB3 PRO 8 1HB PRO 8 7.693 35.195 52.737 46 HG2 PRO 8 2HG PRO 8 8.171 36.902 50.725 47 HG3 PRO 8 1HG PRO 8 6.834 37.146 51.862 48 HD2 PRO 8 2HD PRO 8 9.494 38.505 51.749 49 HD3 PRO 8 1HD PRO 8 7.885 39.163 52.132 50 H GLU 9 H GLU 9 9.367 35.308 56.016 51 HA GLU 9 HA GLU 9 12.189 35.783 55.838 52 HB2 GLU 9 2HB GLU 9 10.523 34.151 57.761 53 HB3 GLU 9 1HB GLU 9 12.253 34.396 57.908 54 HG2 GLU 9 2HG GLU 9 10.215 36.599 57.923 55 HG3 GLU 9 1HG GLU 9 10.905 35.866 59.370 56 HA PRO 10 HA PRO 10 12.757 31.965 53.577 57 HB2 PRO 10 2HB PRO 10 15.514 31.951 54.487 58 HB3 PRO 10 1HB PRO 10 14.909 32.162 52.844 59 HG2 PRO 10 2HG PRO 10 16.081 34.177 54.243 60 HG3 PRO 10 1HG PRO 10 14.829 34.451 53.017 61 HD2 PRO 10 2HD PRO 10 14.606 34.438 55.992 62 HD3 PRO 10 1HD PRO 10 13.802 35.475 54.785 63 H GLN 11 H GLN 11 11.987 30.239 54.519 64 HA GLN 11 HA GLN 11 12.404 29.550 57.211 65 HB2 GLN 11 2HB GLN 11 11.283 27.932 54.907 66 HB3 GLN 11 1HB GLN 11 11.348 27.343 56.559 67 HG2 GLN 11 2HG GLN 11 9.124 28.108 56.114 68 HG3 GLN 11 1HG GLN 11 9.877 29.232 57.234 69 HE21 GLN 11 1HE2 GLN 11 8.466 30.858 56.709 70 HE22 GLN 11 2HE2 GLN 11 8.548 31.717 55.223 71 H VAL 12 H VAL 12 14.044 28.532 58.088 72 HA VAL 12 HA VAL 12 16.365 27.987 56.728 73 HB VAL 12 HB VAL 12 17.145 26.791 58.729 74 HG11 VAL 12 1HG1 VAL 12 17.306 29.186 58.713 75 HG12 VAL 12 2HG1 VAL 12 16.914 28.642 60.344 76 HG13 VAL 12 3HG1 VAL 12 15.659 29.335 59.321 77 HG21 VAL 12 3HG2 VAL 12 14.331 27.141 59.777 78 HG22 VAL 12 1HG2 VAL 12 15.710 26.586 60.725 79 HG23 VAL 12 2HG2 VAL 12 15.116 25.611 59.382 80 H GLU 13 H GLU 13 17.085 26.414 55.565 81 HA GLU 13 HA GLU 13 15.292 24.396 54.772 82 HB2 GLU 13 2HB GLU 13 17.107 23.602 53.340 83 HB3 GLU 13 1HB GLU 13 16.814 25.320 53.163 84 HG2 GLU 13 2HG GLU 13 18.770 25.830 54.503 85 HG3 GLU 13 1HG GLU 13 19.036 24.118 54.806 86 H THR 14 H THR 14 15.242 22.282 55.213 87 HA THR 14 HA THR 14 17.272 21.117 56.911 88 HB THR 14 HB THR 14 14.302 21.105 57.577 89 HG1 THR 14 1HG THR 14 16.356 22.743 58.236 90 HG21 THR 14 3HG2 THR 14 14.970 19.928 59.630 91 HG22 THR 14 1HG2 THR 14 16.654 19.939 59.107 92 HG23 THR 14 2HG2 THR 14 15.456 19.004 58.211 93 H THR 15 H THR 15 17.489 18.907 56.478 94 HA THR 15 HA THR 15 15.803 17.942 54.315 95 HB THR 15 HB THR 15 18.716 17.267 54.840 96 HG1 THR 15 1HG THR 15 18.603 19.411 54.249 97 HG21 THR 15 3HG2 THR 15 17.423 15.601 53.543 98 HG22 THR 15 1HG2 THR 15 18.636 16.406 52.547 99 HG23 THR 15 2HG2 THR 15 16.941 16.869 52.419 100 H SER 16 H SER 16 14.732 16.191 54.821 101 HA SER 16 HA SER 16 14.769 14.951 57.338 102 HB2 SER 16 2HB SER 16 12.797 14.950 55.799 103 HB3 SER 16 1HB SER 16 13.672 13.846 54.749 104 HG SER 16 HG SER 16 12.095 13.050 56.397 105 H VAL 17 H VAL 17 15.820 13.814 54.367 106 HA VAL 17 HA VAL 17 18.016 12.340 55.590 107 HB VAL 17 HB VAL 17 17.619 10.473 53.913 108 HG11 VAL 17 1HG1 VAL 17 15.654 10.817 56.175 109 HG12 VAL 17 2HG1 VAL 17 17.273 10.122 56.295 110 HG13 VAL 17 3HG1 VAL 17 16.016 9.282 55.383 111 HG21 VAL 17 3HG2 VAL 17 15.271 10.064 53.242 112 HG22 VAL 17 1HG2 VAL 17 15.952 11.518 52.512 113 HG23 VAL 17 2HG2 VAL 17 14.845 11.651 53.879 114 H PHE 18 H PHE 18 19.872 12.598 54.511 115 HA PHE 18 HA PHE 18 19.927 14.132 52.127 116 HB2 PHE 18 2HB PHE 18 21.789 14.252 53.734 117 HB3 PHE 18 1HB PHE 18 22.135 12.545 53.479 118 HD1 PHE 18 1HD PHE 18 21.994 15.818 51.724 119 HD2 PHE 18 2HD PHE 18 23.647 11.894 51.816 120 HE1 PHE 18 1HE PHE 18 23.527 16.423 49.898 121 HE2 PHE 18 2HE PHE 18 25.180 12.495 49.991 122 HZ PHE 18 HZ PHE 18 25.120 14.760 49.031 123 H ARG 19 H ARG 19 19.380 13.375 50.275 124 HA ARG 19 HA ARG 19 19.580 10.508 49.738 125 HB2 ARG 19 2HB ARG 19 17.975 12.670 48.384 126 HB3 ARG 19 1HB ARG 19 17.989 10.978 47.914 127 HG2 ARG 19 2HG ARG 19 17.039 10.375 50.075 128 HG3 ARG 19 1HG ARG 19 17.038 12.079 50.541 129 HD2 ARG 19 2HD ARG 19 15.523 12.608 48.748 130 HD3 ARG 19 1HD ARG 19 15.589 10.945 48.165 131 HE ARG 19 HE ARG 19 14.593 11.564 50.844 132 HH11 ARG 19 1HH1 ARG 19 14.050 10.244 47.613 133 HH12 ARG 19 2HH1 ARG 19 12.588 9.467 48.019 134 HH21 ARG 19 1HH2 ARG 19 12.593 10.484 51.416 135 HH22 ARG 19 2HH2 ARG 19 11.737 9.618 50.241 136 H ALA 20 H ALA 20 21.425 10.049 48.741 137 HA ALA 20 HA ALA 20 22.565 11.996 46.946 138 HB1 ALA 20 1HB ALA 20 23.631 9.299 47.797 139 HB2 ALA 20 2HB ALA 20 24.045 10.843 48.540 140 HB3 ALA 20 3HB ALA 20 24.506 10.516 46.870 141 H ASP 21 H ASP 21 20.520 11.659 45.693 142 HA ASP 21 HA ASP 21 20.169 9.342 44.116 143 HB2 ASP 21 2HB ASP 21 19.309 12.201 43.593 144 HB3 ASP 21 1HB ASP 21 18.809 10.833 42.610 145 H LEU 22 H LEU 22 21.734 12.420 43.533 146 HA LEU 22 HA LEU 22 23.494 13.063 42.252 147 HB2 LEU 22 2HB LEU 22 24.182 10.141 42.526 148 HB3 LEU 22 1HB LEU 22 25.295 11.363 41.951 149 HG LEU 22 HG LEU 22 24.070 11.288 44.713 150 HD11 LEU 22 1HD1 LEU 22 25.664 9.487 44.398 151 HD12 LEU 22 2HD1 LEU 22 26.319 10.724 45.474 152 HD13 LEU 22 3HD1 LEU 22 26.869 10.630 43.806 153 HD21 LEU 22 3HD2 LEU 22 26.173 13.115 43.537 154 HD22 LEU 22 1HD2 LEU 22 25.699 13.057 45.234 155 HD23 LEU 22 2HD2 LEU 22 24.538 13.570 44.018 156 H LEU 23 H LEU 23 21.309 12.809 40.781 157 HA LEU 23 HA LEU 23 22.050 11.321 38.390 158 HB2 LEU 23 2HB LEU 23 19.696 11.242 39.459 159 HB3 LEU 23 1HB LEU 23 19.505 12.875 38.875 160 HG LEU 23 HG LEU 23 18.364 11.202 37.460 161 HD11 LEU 23 1HD1 LEU 23 19.026 13.264 36.408 162 HD12 LEU 23 2HD1 LEU 23 19.172 11.917 35.276 163 HD13 LEU 23 3HD1 LEU 23 20.612 12.591 36.036 164 HD21 LEU 23 3HD2 LEU 23 19.635 9.666 36.069 165 HD22 LEU 23 1HD2 LEU 23 19.883 9.337 37.782 166 HD23 LEU 23 2HD2 LEU 23 21.130 10.176 36.851 167 H LYS 24 H LYS 24 23.452 12.458 37.278 168 HA LYS 24 HA LYS 24 23.018 15.324 36.950 169 HB2 LYS 24 2HB LYS 24 25.322 15.592 36.293 170 HB3 LYS 24 1HB LYS 24 25.303 14.638 37.756 171 HG2 LYS 24 2HG LYS 24 25.735 13.545 34.961 172 HG3 LYS 24 1HG LYS 24 27.008 13.903 36.116 173 HD2 LYS 24 2HD LYS 24 25.999 12.186 37.642 174 HD3 LYS 24 1HD LYS 24 24.846 11.812 36.360 175 HE2 LYS 24 2HE LYS 24 26.686 11.214 34.867 176 HE3 LYS 24 1HE LYS 24 27.838 11.560 36.149 177 HZ1 LYS 24 3HZ LYS 24 25.748 9.449 36.209 178 HZ2 LYS 24 1HZ LYS 24 26.802 9.788 37.476 179 HZ3 LYS 24 2HZ LYS 24 27.385 9.198 36.013 180 H GLU 25 H GLU 25 22.580 16.188 35.019 181 HA GLU 25 HA GLU 25 22.172 14.252 32.876 182 HB2 GLU 25 2HB GLU 25 20.865 16.930 33.324 183 HB3 GLU 25 1HB GLU 25 20.585 15.881 31.941 184 HG2 GLU 25 2HG GLU 25 19.751 14.146 33.487 185 HG3 GLU 25 1HG GLU 25 19.926 15.295 34.811 186 H MET 26 H MET 26 22.706 14.770 30.819 187 HA MET 26 HA MET 26 24.115 17.176 30.178 188 HB2 MET 26 2HB MET 26 26.047 15.928 29.192 189 HB3 MET 26 1HB MET 26 25.984 15.776 30.939 190 HG2 MET 26 2HG MET 26 25.025 13.541 30.718 191 HG3 MET 26 1HG MET 26 25.049 13.697 28.966 192 HE1 MET 26 3HE MET 26 27.853 14.905 31.516 193 HE2 MET 26 1HE MET 26 28.861 13.463 31.584 194 HE3 MET 26 2HE MET 26 27.223 13.423 32.235 195 H GLU 27 H GLU 27 23.710 17.661 28.055 196 HA GLU 27 HA GLU 27 21.680 16.093 26.843 197 HB2 GLU 27 2HB GLU 27 23.028 18.629 25.983 198 HB3 GLU 27 1HB GLU 27 21.848 17.813 24.960 199 HG2 GLU 27 2HG GLU 27 21.358 18.822 27.756 200 HG3 GLU 27 1HG GLU 27 20.807 19.585 26.266 201 H SER 28 H SER 28 22.419 14.209 26.417 202 HA SER 28 HA SER 28 24.480 13.930 24.357 203 HB2 SER 28 2HB SER 28 24.995 13.040 26.664 204 HB3 SER 28 1HB SER 28 23.637 11.940 26.481 205 HG SER 28 HG SER 28 26.083 12.013 25.109 206 H SER 29 H SER 29 23.672 13.236 22.470 207 HA SER 29 HA SER 29 21.236 11.617 22.488 208 HB2 SER 29 2HB SER 29 20.916 13.910 21.477 209 HB3 SER 29 1HB SER 29 22.164 13.510 20.300 210 HG SER 29 HG SER 29 20.465 11.532 20.173 211 H THR 30 H THR 30 21.977 9.626 22.265 212 HA THR 30 HA THR 30 24.255 9.149 20.528 213 HB THR 30 HB THR 30 24.285 6.898 21.704 214 HG1 THR 30 1HG THR 30 22.567 8.229 23.561 215 HG21 THR 30 3HG2 THR 30 24.626 9.370 23.417 216 HG22 THR 30 1HG2 THR 30 25.831 8.704 22.317 217 HG23 THR 30 2HG2 THR 30 25.341 7.791 23.741 218 H GLY 31 H GLY 31 23.729 8.585 18.541 219 HA2 GLY 31 2HA GLY 31 21.349 6.914 18.173 220 HA3 GLY 31 1HA GLY 31 21.892 8.119 17.009 221 H THR 32 H THR 32 21.876 4.912 17.702 222 HA THR 32 HA THR 32 24.283 4.473 16.115 223 HB THR 32 HB THR 32 24.346 3.473 18.431 224 HG1 THR 32 1HG THR 32 25.496 1.993 17.639 225 HG21 THR 32 3HG2 THR 32 22.953 1.488 18.908 226 HG22 THR 32 1HG2 THR 32 22.063 1.770 17.416 227 HG23 THR 32 2HG2 THR 32 21.983 2.948 18.730 228 H ALA 33 H ALA 33 24.046 2.547 14.650 229 HA ALA 33 HA ALA 33 21.551 2.807 13.223 230 HB1 ALA 33 1HB ALA 33 22.653 1.506 11.468 231 HB2 ALA 33 2HB ALA 33 24.027 1.221 12.537 232 HB3 ALA 33 3HB ALA 33 23.664 2.854 11.986 233 HA PRO 34 HA PRO 34 20.043 -0.846 15.289 234 HB2 PRO 34 2HB PRO 34 17.563 -0.847 14.199 235 HB3 PRO 34 1HB PRO 34 18.026 0.264 15.491 236 HG2 PRO 34 2HG PRO 34 17.818 0.760 12.553 237 HG3 PRO 34 1HG PRO 34 17.349 1.811 13.899 238 HD2 PRO 34 2HD PRO 34 19.670 2.092 12.475 239 HD3 PRO 34 1HD PRO 34 19.482 2.621 14.157 240 H ALA 35 H ALA 35 19.842 -2.990 14.706 241 HA ALA 35 HA ALA 35 20.425 -3.562 11.928 242 HB1 ALA 35 1HB ALA 35 20.358 -5.434 14.297 243 HB2 ALA 35 2HB ALA 35 21.803 -4.671 13.626 244 HB3 ALA 35 3HB ALA 35 20.904 -5.845 12.672 245 H SER 36 H SER 36 18.473 -3.098 11.004 246 HA SER 36 HA SER 36 16.150 -4.661 11.798 247 HB2 SER 36 2HB SER 36 16.457 -2.443 9.764 248 HB3 SER 36 1HB SER 36 14.932 -3.123 10.350 249 HG SER 36 HG SER 36 15.829 -2.537 12.498 250 H THR 37 H THR 37 18.640 -5.597 10.339 251 HA THR 37 HA THR 37 17.612 -6.453 7.798 252 HB THR 37 HB THR 37 20.033 -7.426 7.799 253 HG1 THR 37 1HG THR 37 21.015 -7.084 9.593 254 HG21 THR 37 3HG2 THR 37 19.530 -4.446 7.820 255 HG22 THR 37 1HG2 THR 37 19.305 -5.521 6.439 256 HG23 THR 37 2HG2 THR 37 20.921 -5.248 7.089 257 H GLY 38 H GLY 38 17.602 -8.712 7.271 258 HA2 GLY 38 2HA GLY 38 17.999 -11.008 8.003 259 HA3 GLY 38 1HA GLY 38 17.529 -10.498 9.618 260 H ALA 39 H ALA 39 15.442 -8.847 7.887 261 HA ALA 39 HA ALA 39 13.314 -10.713 8.336 262 HB1 ALA 39 1HB ALA 39 13.239 -8.025 6.955 263 HB2 ALA 39 2HB ALA 39 12.998 -8.289 8.682 264 HB3 ALA 39 3HB ALA 39 11.842 -8.942 7.518 265 H GLU 40 H GLU 40 15.222 -9.684 5.671 266 HA GLU 40 HA GLU 40 13.683 -10.631 3.513 267 HB2 GLU 40 2HB GLU 40 15.860 -10.635 2.267 268 HB3 GLU 40 1HB GLU 40 15.477 -9.117 3.059 269 HG2 GLU 40 2HG GLU 40 17.018 -9.614 4.847 270 HG3 GLU 40 1HG GLU 40 17.332 -11.207 4.169 271 H ASN 41 H ASN 41 15.200 -12.386 5.913 272 HA ASN 41 HA ASN 41 15.971 -14.666 4.392 273 HB2 ASN 41 2HB ASN 41 15.748 -14.189 7.345 274 HB3 ASN 41 1HB ASN 41 16.149 -15.765 6.679 275 HD21 ASN 41 1HD2 ASN 41 18.142 -16.049 5.686 276 HD22 ASN 41 2HD2 ASN 41 19.440 -14.927 5.839 277 H LEU 42 H LEU 42 12.953 -13.575 5.489 278 HA LEU 42 HA LEU 42 11.714 -15.964 6.124 279 HB2 LEU 42 2HB LEU 42 9.596 -14.794 5.692 280 HB3 LEU 42 1HB LEU 42 10.693 -13.857 6.667 281 HG LEU 42 HG LEU 42 11.228 -12.537 4.533 282 HD11 LEU 42 1HD1 LEU 42 10.283 -14.060 2.883 283 HD12 LEU 42 2HD1 LEU 42 9.510 -12.477 2.808 284 HD13 LEU 42 3HD1 LEU 42 8.677 -13.830 3.573 285 HD21 LEU 42 3HD2 LEU 42 9.919 -11.645 6.357 286 HD22 LEU 42 1HD2 LEU 42 8.467 -12.409 5.708 287 HD23 LEU 42 2HD2 LEU 42 9.266 -11.120 4.804 288 HA PRO 43 HA PRO 43 11.318 -18.115 2.274 289 HB2 PRO 43 2HB PRO 43 8.642 -19.093 3.035 290 HB3 PRO 43 1HB PRO 43 10.130 -20.006 2.791 291 HG2 PRO 43 2HG PRO 43 9.084 -19.635 5.241 292 HG3 PRO 43 1HG PRO 43 10.831 -19.713 4.968 293 HD2 PRO 43 2HD PRO 43 9.084 -17.313 5.391 294 HD3 PRO 43 1HD PRO 43 10.701 -17.666 6.043 295 H ALA 44 H ALA 44 7.860 -17.429 2.906 296 HA ALA 44 HA ALA 44 7.596 -15.307 1.093 297 HB1 ALA 44 1HB ALA 44 6.305 -16.466 -0.663 298 HB2 ALA 44 2HB ALA 44 6.656 -18.013 0.110 299 HB3 ALA 44 3HB ALA 44 7.963 -17.069 -0.601 300 H GLY 45 H GLY 45 5.199 -14.925 0.717 301 HA2 GLY 45 2HA GLY 45 2.981 -15.822 1.654 302 HA3 GLY 45 1HA GLY 45 3.794 -15.591 3.204 303 H SER 46 H SER 46 3.329 -13.840 0.189 304 HA SER 46 HA SER 46 3.493 -11.332 1.603 305 HB2 SER 46 2HB SER 46 3.324 -11.973 -1.329 306 HB3 SER 46 1HB SER 46 3.651 -10.394 -0.628 307 HG SER 46 HG SER 46 5.593 -10.914 -0.292 308 H ALA 47 H ALA 47 2.027 -9.642 1.022 309 HA ALA 47 HA ALA 47 -0.676 -10.485 0.316 310 HB1 ALA 47 1HB ALA 47 -1.500 -8.805 1.927 311 HB2 ALA 47 2HB ALA 47 0.166 -8.501 2.431 312 HB3 ALA 47 3HB ALA 47 -0.574 -10.074 2.729 313 H LEU 48 H LEU 48 -1.922 -8.355 -0.442 314 HA LEU 48 HA LEU 48 0.028 -6.754 -1.877 315 HB2 LEU 48 2HB LEU 48 -1.245 -6.960 -3.988 316 HB3 LEU 48 1HB LEU 48 -0.485 -8.440 -3.469 317 HG LEU 48 HG LEU 48 -2.829 -9.103 -2.590 318 HD11 LEU 48 1HD1 LEU 48 -3.907 -6.942 -2.716 319 HD12 LEU 48 2HD1 LEU 48 -4.728 -8.117 -3.742 320 HD13 LEU 48 3HD1 LEU 48 -3.666 -6.905 -4.463 321 HD21 LEU 48 3HD2 LEU 48 -3.489 -9.927 -4.805 322 HD22 LEU 48 1HD2 LEU 48 -1.768 -10.158 -4.493 323 HD23 LEU 48 2HD2 LEU 48 -2.306 -8.853 -5.544 324 H LEU 49 H LEU 49 -0.618 -4.781 -2.635 325 HA LEU 49 HA LEU 49 -3.089 -3.841 -1.426 326 HB2 LEU 49 2HB LEU 49 -2.018 -1.645 -1.099 327 HB3 LEU 49 1HB LEU 49 -1.307 -2.890 -0.109 328 HG LEU 49 HG LEU 49 0.521 -2.947 -1.982 329 HD11 LEU 49 1HD1 LEU 49 -0.607 -1.540 -3.589 330 HD12 LEU 49 2HD1 LEU 49 0.898 -0.791 -3.059 331 HD13 LEU 49 3HD1 LEU 49 -0.645 -0.209 -2.436 332 HD21 LEU 49 3HD2 LEU 49 0.926 -2.259 0.308 333 HD22 LEU 49 1HD2 LEU 49 0.276 -0.656 -0.039 334 HD23 LEU 49 2HD2 LEU 49 1.770 -1.188 -0.811 335 H VAL 50 H VAL 50 -4.245 -2.313 -2.530 336 HA VAL 50 HA VAL 50 -3.518 -1.969 -5.357 337 HB VAL 50 HB VAL 50 -6.331 -2.318 -4.262 338 HG11 VAL 50 1HG1 VAL 50 -7.012 -2.486 -6.609 339 HG12 VAL 50 2HG1 VAL 50 -5.349 -2.168 -7.105 340 HG13 VAL 50 3HG1 VAL 50 -6.263 -0.933 -6.241 341 HG21 VAL 50 3HG2 VAL 50 -6.392 -4.503 -5.369 342 HG22 VAL 50 1HG2 VAL 50 -5.142 -4.451 -4.126 343 HG23 VAL 50 2HG2 VAL 50 -4.701 -4.325 -5.833 344 H VAL 51 H VAL 51 -3.398 0.138 -5.854 345 HA VAL 51 HA VAL 51 -4.480 2.099 -3.952 346 HB VAL 51 HB VAL 51 -2.766 2.568 -6.414 347 HG11 VAL 51 1HG1 VAL 51 -2.296 4.746 -5.401 348 HG12 VAL 51 2HG1 VAL 51 -3.391 4.361 -4.072 349 HG13 VAL 51 3HG1 VAL 51 -4.020 4.533 -5.711 350 HG21 VAL 51 3HG2 VAL 51 -0.878 2.848 -4.843 351 HG22 VAL 51 1HG2 VAL 51 -1.523 1.203 -4.837 352 HG23 VAL 51 2HG2 VAL 51 -1.926 2.314 -3.530 353 H LYS 52 H LYS 52 -6.396 2.889 -4.247 354 HA LYS 52 HA LYS 52 -7.761 2.462 -6.766 355 HB2 LYS 52 2HB LYS 52 -8.674 3.650 -4.146 356 HB3 LYS 52 1HB LYS 52 -9.714 3.441 -5.547 357 HG2 LYS 52 2HG LYS 52 -9.400 1.030 -5.425 358 HG3 LYS 52 1HG LYS 52 -8.309 1.233 -4.055 359 HD2 LYS 52 2HD LYS 52 -10.085 2.136 -2.707 360 HD3 LYS 52 1HD LYS 52 -11.173 2.152 -4.097 361 HE2 LYS 52 2HE LYS 52 -9.963 -0.321 -2.860 362 HE3 LYS 52 1HE LYS 52 -11.603 0.258 -2.573 363 HZ1 LYS 52 3HZ LYS 52 -12.105 -0.046 -4.888 364 HZ2 LYS 52 1HZ LYS 52 -11.530 -1.492 -4.262 365 HZ3 LYS 52 2HZ LYS 52 -10.549 -0.529 -5.249 366 H ARG 53 H ARG 53 -6.435 5.044 -4.884 367 HA ARG 53 HA ARG 53 -6.271 6.682 -7.213 368 HB2 ARG 53 2HB ARG 53 -8.528 7.362 -6.421 369 HB3 ARG 53 1HB ARG 53 -7.843 7.762 -4.843 370 HG2 ARG 53 2HG ARG 53 -6.398 9.432 -5.899 371 HG3 ARG 53 1HG ARG 53 -7.088 9.023 -7.461 372 HD2 ARG 53 2HD ARG 53 -9.260 9.840 -6.728 373 HD3 ARG 53 1HD ARG 53 -8.592 10.219 -5.131 374 HE ARG 53 HE ARG 53 -7.050 11.405 -7.157 375 HH11 ARG 53 1HH1 ARG 53 -10.246 11.870 -5.679 376 HH12 ARG 53 2HH1 ARG 53 -10.225 13.560 -5.858 377 HH21 ARG 53 1HH2 ARG 53 -7.009 13.683 -7.383 378 HH22 ARG 53 2HH2 ARG 53 -8.347 14.620 -6.887 379 H GLY 54 H GLY 54 -4.409 7.641 -7.177 380 HA2 GLY 54 2HA GLY 54 -3.187 9.086 -5.316 381 HA3 GLY 54 1HA GLY 54 -2.836 7.449 -4.785 382 HA PRO 55 HA PRO 55 -0.531 8.738 -9.026 383 HB2 PRO 55 2HB PRO 55 0.689 11.058 -7.606 384 HB3 PRO 55 1HB PRO 55 0.211 10.909 -9.299 385 HG2 PRO 55 2HG PRO 55 -1.281 12.327 -7.654 386 HG3 PRO 55 1HG PRO 55 -2.043 11.240 -8.834 387 HD2 PRO 55 2HD PRO 55 -1.620 10.844 -5.897 388 HD3 PRO 55 1HD PRO 55 -3.043 10.480 -6.897 389 H ASN 56 H ASN 56 0.125 8.485 -5.783 390 HA ASN 56 HA ASN 56 2.823 8.138 -5.351 391 HB2 ASN 56 2HB ASN 56 0.639 6.287 -4.348 392 HB3 ASN 56 1HB ASN 56 2.212 6.524 -3.616 393 HD21 ASN 56 1HD2 ASN 56 -0.355 6.818 -2.402 394 HD22 ASN 56 2HD2 ASN 56 -0.465 8.459 -1.882 395 H ALA 57 H ALA 57 0.424 5.979 -6.877 396 HA ALA 57 HA ALA 57 2.399 4.471 -8.277 397 HB1 ALA 57 1HB ALA 57 1.813 2.260 -7.373 398 HB2 ALA 57 2HB ALA 57 0.743 3.018 -6.199 399 HB3 ALA 57 3HB ALA 57 2.483 3.297 -6.110 400 H GLY 58 H GLY 58 -0.923 4.014 -7.085 401 HA2 GLY 58 2HA GLY 58 -2.929 3.930 -8.219 402 HA3 GLY 58 1HA GLY 58 -2.086 4.555 -9.632 403 H ALA 59 H ALA 59 -1.224 1.615 -7.898 404 HA ALA 59 HA ALA 59 -2.329 -0.065 -9.961 405 HB1 ALA 59 1HB ALA 59 -0.120 -1.117 -10.388 406 HB2 ALA 59 2HB ALA 59 0.643 0.117 -9.385 407 HB3 ALA 59 3HB ALA 59 -0.151 0.574 -10.887 408 H ARG 60 H ARG 60 -1.277 -2.427 -9.254 409 HA ARG 60 HA ARG 60 -1.487 -2.521 -6.326 410 HB2 ARG 60 2HB ARG 60 -2.662 -4.545 -6.390 411 HB3 ARG 60 1HB ARG 60 -3.391 -3.650 -7.717 412 HG2 ARG 60 2HG ARG 60 -2.196 -4.935 -9.340 413 HG3 ARG 60 1HG ARG 60 -1.168 -5.652 -8.101 414 HD2 ARG 60 2HD ARG 60 -3.346 -6.597 -7.124 415 HD3 ARG 60 1HD ARG 60 -4.066 -6.173 -8.678 416 HE ARG 60 HE ARG 60 -1.816 -7.561 -9.318 417 HH11 ARG 60 1HH1 ARG 60 -4.773 -8.336 -7.514 418 HH12 ARG 60 2HH1 ARG 60 -4.597 -10.021 -7.680 419 HH21 ARG 60 1HH2 ARG 60 -1.584 -9.893 -9.515 420 HH22 ARG 60 2HH2 ARG 60 -2.723 -10.921 -8.808 421 H PHE 61 H PHE 61 -0.026 -3.940 -5.285 422 HA PHE 61 HA PHE 61 1.573 -5.677 -6.844 423 HB2 PHE 61 2HB PHE 61 3.766 -4.826 -6.222 424 HB3 PHE 61 1HB PHE 61 2.891 -3.606 -7.131 425 HD1 PHE 61 1HD PHE 61 2.101 -1.570 -5.980 426 HD2 PHE 61 2HD PHE 61 4.454 -4.495 -3.980 427 HE1 PHE 61 1HE PHE 61 2.635 0.056 -4.220 428 HE2 PHE 61 2HE PHE 61 4.985 -2.880 -2.218 429 HZ PHE 61 HZ PHE 61 4.077 -0.598 -2.331 430 H LEU 62 H LEU 62 2.687 -7.199 -5.578 431 HA LEU 62 HA LEU 62 1.576 -7.423 -2.943 432 HB2 LEU 62 2HB LEU 62 2.502 -9.715 -2.940 433 HB3 LEU 62 1HB LEU 62 1.417 -9.434 -4.275 434 HG LEU 62 HG LEU 62 3.578 -9.125 -5.679 435 HD11 LEU 62 1HD1 LEU 62 5.521 -10.368 -4.896 436 HD12 LEU 62 2HD1 LEU 62 4.743 -10.601 -3.332 437 HD13 LEU 62 3HD1 LEU 62 5.176 -8.977 -3.867 438 HD21 LEU 62 3HD2 LEU 62 3.733 -11.534 -6.056 439 HD22 LEU 62 1HD2 LEU 62 2.057 -10.994 -5.928 440 HD23 LEU 62 2HD2 LEU 62 2.828 -11.817 -4.571 441 H LEU 63 H LEU 63 2.753 -7.434 -1.079 442 HA LEU 63 HA LEU 63 5.134 -5.869 -1.226 443 HB2 LEU 63 2HB LEU 63 3.981 -7.389 1.121 444 HB3 LEU 63 1HB LEU 63 5.247 -6.186 1.210 445 HG LEU 63 HG LEU 63 2.385 -5.654 0.401 446 HD11 LEU 63 1HD1 LEU 63 2.612 -6.193 2.767 447 HD12 LEU 63 2HD1 LEU 63 2.234 -4.489 2.534 448 HD13 LEU 63 3HD1 LEU 63 3.881 -4.977 2.926 449 HD21 LEU 63 3HD2 LEU 63 4.703 -3.766 0.838 450 HD22 LEU 63 1HD2 LEU 63 3.028 -3.291 0.544 451 HD23 LEU 63 2HD2 LEU 63 3.932 -4.132 -0.708 452 H ASP 64 H ASP 64 6.890 -6.667 -1.899 453 HA ASP 64 HA ASP 64 7.662 -9.458 -1.350 454 HB2 ASP 64 2HB ASP 64 7.489 -8.932 -3.717 455 HB3 ASP 64 1HB ASP 64 8.538 -7.540 -3.518 456 H GLN 65 H GLN 65 8.595 -6.140 -1.177 457 HA GLN 65 HA GLN 65 11.241 -6.672 -0.224 458 HB2 GLN 65 2HB GLN 65 9.687 -4.065 -0.070 459 HB3 GLN 65 1HB GLN 65 11.414 -4.266 0.092 460 HG2 GLN 65 2HG GLN 65 11.093 -3.342 -2.045 461 HG3 GLN 65 1HG GLN 65 11.421 -5.047 -2.328 462 HE21 GLN 65 1HE2 GLN 65 8.284 -3.831 -1.195 463 HE22 GLN 65 2HE2 GLN 65 7.447 -4.157 -2.665 464 HA PRO 66 HA PRO 66 9.767 -7.772 3.862 465 HB2 PRO 66 2HB PRO 66 12.149 -7.050 5.170 466 HB3 PRO 66 1HB PRO 66 11.742 -8.650 4.547 467 HG2 PRO 66 2HG PRO 66 13.431 -6.524 3.343 468 HG3 PRO 66 1HG PRO 66 13.570 -8.282 3.216 469 HD2 PRO 66 2HD PRO 66 12.642 -6.779 1.200 470 HD3 PRO 66 1HD PRO 66 12.012 -8.413 1.511 471 H THR 67 H THR 67 11.388 -4.718 3.281 472 HA THR 67 HA THR 67 9.388 -3.496 4.990 473 HB THR 67 HB THR 67 12.283 -2.584 4.904 474 HG1 THR 67 1HG THR 67 11.079 -4.571 6.225 475 HG21 THR 67 3HG2 THR 67 10.628 -0.823 5.425 476 HG22 THR 67 1HG2 THR 67 11.607 -1.203 6.839 477 HG23 THR 67 2HG2 THR 67 9.962 -1.831 6.710 478 H THR 68 H THR 68 8.188 -2.761 3.374 479 HA THR 68 HA THR 68 9.409 -1.476 1.064 480 HB THR 68 HB THR 68 6.517 -2.160 1.704 481 HG1 THR 68 1HG THR 68 8.067 -3.952 1.317 482 HG21 THR 68 3HG2 THR 68 6.722 -0.286 0.108 483 HG22 THR 68 1HG2 THR 68 6.091 -1.729 -0.684 484 HG23 THR 68 2HG2 THR 68 7.779 -1.273 -0.902 485 H THR 69 H THR 69 9.688 0.711 1.155 486 HA THR 69 HA THR 69 8.095 2.085 3.173 487 HB THR 69 HB THR 69 10.759 2.964 2.052 488 HG1 THR 69 1HG THR 69 11.052 1.140 3.288 489 HG21 THR 69 3HG2 THR 69 10.726 4.513 3.978 490 HG22 THR 69 1HG2 THR 69 9.117 3.933 4.409 491 HG23 THR 69 2HG2 THR 69 9.363 4.802 2.896 492 H ALA 70 H ALA 70 6.601 3.344 2.501 493 HA ALA 70 HA ALA 70 6.732 4.512 -0.160 494 HB1 ALA 70 1HB ALA 70 4.663 3.360 0.432 495 HB2 ALA 70 2HB ALA 70 4.375 5.089 0.259 496 HB3 ALA 70 3HB ALA 70 4.486 4.368 1.869 497 H GLY 71 H GLY 71 7.962 6.253 -0.016 498 HA2 GLY 71 2HA GLY 71 7.891 8.632 0.536 499 HA3 GLY 71 1HA GLY 71 7.325 8.173 2.135 500 H ARG 72 H ARG 72 9.977 7.674 -0.059 501 HA ARG 72 HA ARG 72 11.951 8.333 1.942 502 HB2 ARG 72 2HB ARG 72 11.353 5.617 1.071 503 HB3 ARG 72 1HB ARG 72 12.941 6.093 0.505 504 HG2 ARG 72 2HG ARG 72 12.006 6.146 3.362 505 HG3 ARG 72 1HG ARG 72 13.025 4.899 2.639 506 HD2 ARG 72 2HD ARG 72 14.695 6.673 2.123 507 HD3 ARG 72 1HD ARG 72 13.690 7.815 3.011 508 HE ARG 72 HE ARG 72 14.479 5.410 4.401 509 HH11 ARG 72 1HH1 ARG 72 15.011 8.863 3.912 510 HH12 ARG 72 2HH1 ARG 72 16.015 9.056 5.251 511 HH21 ARG 72 1HH2 ARG 72 15.818 5.640 6.246 512 HH22 ARG 72 2HH2 ARG 72 16.498 7.157 6.650 513 H HIS 73 H HIS 73 11.445 10.041 0.287 514 HA HIS 73 HA HIS 73 11.301 9.807 -2.365 515 HB2 HIS 73 2HB HIS 73 10.801 11.828 -1.058 516 HB3 HIS 73 1HB HIS 73 12.514 12.200 -0.994 517 HD1 HIS 73 1HD HIS 73 9.472 12.566 -3.135 518 HD2 HIS 73 2HD HIS 73 13.602 13.024 -3.498 519 HE1 HIS 73 1HE HIS 73 9.848 13.811 -5.265 520 HA PRO 74 HA PRO 74 16.092 10.269 -3.319 521 HB2 PRO 74 2HB PRO 74 17.111 8.678 -1.010 522 HB3 PRO 74 1HB PRO 74 17.864 10.035 -1.852 523 HG2 PRO 74 2HG PRO 74 16.795 10.415 0.532 524 HG3 PRO 74 1HG PRO 74 16.550 11.614 -0.752 525 HD2 PRO 74 2HD PRO 74 14.669 9.499 0.239 526 HD3 PRO 74 1HD PRO 74 14.330 11.196 -0.167 527 H GLU 75 H GLU 75 14.839 7.411 -1.549 528 HA GLU 75 HA GLU 75 15.121 5.772 -3.908 529 HB2 GLU 75 2HB GLU 75 16.436 4.920 -1.311 530 HB3 GLU 75 1HB GLU 75 16.301 3.945 -2.758 531 HG2 GLU 75 2HG GLU 75 17.784 5.532 -3.928 532 HG3 GLU 75 1HG GLU 75 17.943 6.442 -2.427 533 H SER 76 H SER 76 12.884 5.732 -3.791 534 HA SER 76 HA SER 76 11.674 4.522 -1.406 535 HB2 SER 76 2HB SER 76 10.371 5.851 -3.786 536 HB3 SER 76 1HB SER 76 9.531 5.203 -2.386 537 HG SER 76 HG SER 76 11.566 7.017 -1.957 538 H ASP 77 H ASP 77 10.405 2.662 -1.586 539 HA ASP 77 HA ASP 77 10.876 0.906 -3.782 540 HB2 ASP 77 2HB ASP 77 8.724 0.817 -1.631 541 HB3 ASP 77 1HB ASP 77 9.152 -0.515 -2.694 542 H ILE 78 H ILE 78 8.239 2.919 -2.629 543 HA ILE 78 HA ILE 78 7.397 3.297 -5.378 544 HB ILE 78 HB ILE 78 5.023 3.589 -4.608 545 HG12 ILE 78 2HG1 ILE 78 5.935 2.152 -2.097 546 HG13 ILE 78 1HG1 ILE 78 5.517 3.859 -2.171 547 HG21 ILE 78 1HG2 ILE 78 5.663 1.607 -5.790 548 HG22 ILE 78 2HG2 ILE 78 4.478 1.201 -4.550 549 HG23 ILE 78 3HG2 ILE 78 6.183 0.835 -4.293 550 HD11 ILE 78 3HD1 ILE 78 3.699 2.517 -1.257 551 HD12 ILE 78 1HD1 ILE 78 3.646 1.569 -2.742 552 HD13 ILE 78 2HD1 ILE 78 3.230 3.285 -2.771 553 H PHE 79 H PHE 79 7.157 5.351 -5.930 554 HA PHE 79 HA PHE 79 7.979 7.291 -3.925 555 HB2 PHE 79 2HB PHE 79 7.729 7.497 -6.934 556 HB3 PHE 79 1HB PHE 79 8.229 8.822 -5.894 557 HD1 PHE 79 2HD PHE 79 9.179 5.521 -7.219 558 HD2 PHE 79 1HD PHE 79 10.443 8.928 -5.010 559 HE1 PHE 79 2HE PHE 79 11.509 4.751 -7.368 560 HE2 PHE 79 1HE PHE 79 12.774 8.163 -5.160 561 HZ PHE 79 HZ PHE 79 13.307 6.069 -6.336 562 H LEU 80 H LEU 80 6.508 8.360 -2.894 563 HA LEU 80 HA LEU 80 3.775 8.348 -3.565 564 HB2 LEU 80 2HB LEU 80 5.270 10.092 -1.612 565 HB3 LEU 80 1HB LEU 80 3.526 9.991 -1.730 566 HG LEU 80 HG LEU 80 5.370 7.743 -0.931 567 HD11 LEU 80 1HD1 LEU 80 5.229 9.452 0.783 568 HD12 LEU 80 2HD1 LEU 80 4.366 8.000 1.287 569 HD13 LEU 80 3HD1 LEU 80 3.468 9.406 0.710 570 HD21 LEU 80 3HD2 LEU 80 3.459 6.794 -1.993 571 HD22 LEU 80 1HD2 LEU 80 2.373 7.878 -1.120 572 HD23 LEU 80 2HD2 LEU 80 3.240 6.631 -0.249 573 H ASP 81 H ASP 81 2.539 10.444 -3.632 574 HA ASP 81 HA ASP 81 3.289 11.946 -5.949 575 HB2 ASP 81 2HB ASP 81 0.941 11.440 -5.487 576 HB3 ASP 81 1HB ASP 81 1.027 12.327 -3.974 577 H ASP 82 H ASP 82 4.080 12.180 -2.801 578 HA ASP 82 HA ASP 82 4.873 13.759 -1.343 579 HB2 ASP 82 2HB ASP 82 6.101 14.544 -3.907 580 HB3 ASP 82 1HB ASP 82 6.303 15.645 -2.566 581 H VAL 83 H VAL 83 2.792 14.398 -0.837 582 HA VAL 83 HA VAL 83 2.014 17.102 -1.669 583 HB VAL 83 HB VAL 83 0.784 15.330 0.478 584 HG11 VAL 83 1HG1 VAL 83 -1.216 16.703 0.196 585 HG12 VAL 83 2HG1 VAL 83 -0.370 17.697 -0.985 586 HG13 VAL 83 3HG1 VAL 83 0.170 17.672 0.695 587 HG21 VAL 83 3HG2 VAL 83 -0.001 15.584 -2.416 588 HG22 VAL 83 1HG2 VAL 83 -0.919 14.713 -1.188 589 HG23 VAL 83 2HG2 VAL 83 0.696 14.165 -1.643 590 H THR 84 H THR 84 3.311 15.277 0.861 591 HA THR 84 HA THR 84 4.897 17.057 2.166 592 HB THR 84 HB THR 84 2.276 16.602 3.710 593 HG1 THR 84 1HG THR 84 2.899 18.522 2.107 594 HG21 THR 84 3HG2 THR 84 4.823 17.960 4.625 595 HG22 THR 84 1HG2 THR 84 4.226 16.399 5.186 596 HG23 THR 84 2HG2 THR 84 3.324 17.872 5.550 597 H VAL 85 H VAL 85 6.101 15.277 1.836 598 HA VAL 85 HA VAL 85 5.327 12.851 3.232 599 HB VAL 85 HB VAL 85 7.158 13.286 0.837 600 HG11 VAL 85 1HG1 VAL 85 8.146 11.571 2.359 601 HG12 VAL 85 2HG1 VAL 85 7.579 10.894 0.831 602 HG13 VAL 85 3HG1 VAL 85 6.616 10.695 2.296 603 HG21 VAL 85 3HG2 VAL 85 5.567 11.912 -0.301 604 HG22 VAL 85 1HG2 VAL 85 4.732 13.245 0.501 605 HG23 VAL 85 2HG2 VAL 85 4.683 11.628 1.199 606 H SER 86 H SER 86 6.559 11.993 4.707 607 HA SER 86 HA SER 86 8.269 13.735 6.163 608 HB2 SER 86 2HB SER 86 6.576 12.185 7.119 609 HB3 SER 86 1HB SER 86 7.557 10.833 6.580 610 HG SER 86 HG SER 86 7.815 11.318 8.736 611 H ARG 87 H ARG 87 10.296 12.512 7.176 612 HA ARG 87 HA ARG 87 12.283 12.206 5.142 613 HB2 ARG 87 2HB ARG 87 12.554 13.065 7.536 614 HB3 ARG 87 1HB ARG 87 12.470 11.397 8.052 615 HG2 ARG 87 2HG ARG 87 14.540 10.896 6.913 616 HG3 ARG 87 1HG ARG 87 14.585 12.531 6.226 617 HD2 ARG 87 2HD ARG 87 14.570 13.445 8.522 618 HD3 ARG 87 1HD ARG 87 14.669 11.806 9.146 619 HE ARG 87 HE ARG 87 16.836 11.995 7.544 620 HH11 ARG 87 1HH1 ARG 87 15.576 14.040 10.169 621 HH12 ARG 87 2HH1 ARG 87 17.116 14.525 10.713 622 HH21 ARG 87 1HH2 ARG 87 18.937 12.710 8.284 623 HH22 ARG 87 2HH2 ARG 87 19.054 13.780 9.612 624 H ARG 88 H ARG 88 10.445 10.088 7.182 625 HA ARG 88 HA ARG 88 10.656 7.958 5.234 626 HB2 ARG 88 2HB ARG 88 10.586 7.437 8.252 627 HB3 ARG 88 1HB ARG 88 10.619 6.224 6.995 628 HG2 ARG 88 2HG ARG 88 12.765 6.101 7.794 629 HG3 ARG 88 1HG ARG 88 12.979 7.271 6.493 630 HD2 ARG 88 2HD ARG 88 14.116 7.998 8.528 631 HD3 ARG 88 1HD ARG 88 12.801 9.103 8.114 632 HE ARG 88 HE ARG 88 11.931 7.066 9.872 633 HH11 ARG 88 1HH1 ARG 88 13.971 9.967 10.007 634 HH12 ARG 88 2HH1 ARG 88 13.419 10.472 11.532 635 HH21 ARG 88 1HH2 ARG 88 11.244 7.742 12.055 636 HH22 ARG 88 2HH2 ARG 88 11.903 9.154 12.731 637 H HIS 89 H HIS 89 8.514 7.545 4.731 638 HA HIS 89 HA HIS 89 6.657 9.027 6.446 639 HB2 HIS 89 2HB HIS 89 6.886 9.521 3.968 640 HB3 HIS 89 1HB HIS 89 6.042 7.998 3.698 641 HD2 HIS 89 2HD HIS 89 3.347 7.983 4.756 642 HE1 HIS 89 1HE HIS 89 3.153 12.196 4.573 643 HE2 HIS 89 2HE HIS 89 1.908 10.071 5.178 644 H ALA 90 H ALA 90 5.956 6.217 4.356 645 HA ALA 90 HA ALA 90 4.737 5.019 6.727 646 HB1 ALA 90 1HB ALA 90 3.761 4.877 3.870 647 HB2 ALA 90 2HB ALA 90 3.020 5.809 5.170 648 HB3 ALA 90 3HB ALA 90 3.038 4.047 5.246 649 H GLU 91 H GLU 91 6.001 3.472 7.321 650 HA GLU 91 HA GLU 91 7.413 1.893 5.302 651 HB2 GLU 91 2HB GLU 91 7.637 1.818 8.316 652 HB3 GLU 91 1HB GLU 91 8.645 0.936 7.184 653 HG2 GLU 91 2HG GLU 91 9.502 3.055 6.312 654 HG3 GLU 91 1HG GLU 91 8.511 3.927 7.483 655 H PHE 92 H PHE 92 6.660 -0.036 4.726 656 HA PHE 92 HA PHE 92 4.667 -1.307 6.470 657 HB2 PHE 92 2HB PHE 92 5.166 -1.813 3.522 658 HB3 PHE 92 1HB PHE 92 3.840 -2.431 4.490 659 HD1 PHE 92 1HD PHE 92 2.183 -0.705 5.434 660 HD2 PHE 92 2HD PHE 92 4.930 0.143 2.308 661 HE1 PHE 92 1HE PHE 92 0.790 1.196 4.730 662 HE2 PHE 92 2HE PHE 92 3.549 2.045 1.599 663 HZ PHE 92 HZ PHE 92 1.474 2.577 2.811 664 H ARG 93 H ARG 93 5.662 -2.868 7.617 665 HA ARG 93 HA ARG 93 7.836 -4.251 6.254 666 HB2 ARG 93 2HB ARG 93 8.518 -3.228 8.434 667 HB3 ARG 93 1HB ARG 93 7.321 -4.228 9.253 668 HG2 ARG 93 2HG ARG 93 8.496 -6.237 8.675 669 HG3 ARG 93 1HG ARG 93 9.583 -5.350 7.615 670 HD2 ARG 93 2HD ARG 93 10.709 -5.913 9.678 671 HD3 ARG 93 1HD ARG 93 10.498 -4.170 9.571 672 HE ARG 93 HE ARG 93 8.346 -5.228 10.984 673 HH11 ARG 93 1HH1 ARG 93 11.843 -4.883 11.399 674 HH12 ARG 93 2HH1 ARG 93 11.778 -4.776 13.101 675 HH21 ARG 93 1HH2 ARG 93 8.252 -5.061 13.278 676 HH22 ARG 93 2HH2 ARG 93 9.686 -4.887 14.206 677 H ILE 94 H ILE 94 7.610 -6.215 5.680 678 HA ILE 94 HA ILE 94 5.110 -7.486 6.447 679 HB ILE 94 HB ILE 94 4.982 -6.652 4.169 680 HG12 ILE 94 2HG1 ILE 94 3.948 -8.934 4.693 681 HG13 ILE 94 1HG1 ILE 94 4.168 -8.557 2.994 682 HG21 ILE 94 1HG2 ILE 94 7.453 -8.217 3.566 683 HG22 ILE 94 2HG2 ILE 94 7.244 -6.464 3.535 684 HG23 ILE 94 3HG2 ILE 94 6.420 -7.476 2.350 685 HD11 ILE 94 3HD1 ILE 94 6.136 -10.034 2.953 686 HD12 ILE 94 1HD1 ILE 94 4.684 -10.890 3.480 687 HD13 ILE 94 2HD1 ILE 94 5.892 -10.389 4.664 688 H ASN 95 H ASN 95 5.417 -9.121 7.605 689 HA ASN 95 HA ASN 95 7.601 -10.944 6.992 690 HB2 ASN 95 2HB ASN 95 7.751 -9.866 9.270 691 HB3 ASN 95 1HB ASN 95 6.140 -10.457 9.632 692 HD21 ASN 95 1HD2 ASN 95 8.656 -10.905 10.980 693 HD22 ASN 95 2HD2 ASN 95 8.903 -12.609 11.045 694 H GLU 96 H GLU 96 6.807 -13.101 6.816 695 HA GLU 96 HA GLU 96 4.165 -13.146 5.850 696 HB2 GLU 96 2HB GLU 96 4.542 -15.610 5.491 697 HB3 GLU 96 1HB GLU 96 5.671 -14.538 4.691 698 HG2 GLU 96 2HG GLU 96 6.951 -16.333 5.477 699 HG3 GLU 96 1HG GLU 96 7.267 -15.023 6.605 700 H GLY 97 H GLY 97 5.397 -13.546 8.914 701 HA2 GLY 97 2HA GLY 97 3.053 -14.901 9.931 702 HA3 GLY 97 1HA GLY 97 4.414 -14.335 10.879 703 H GLU 98 H GLU 98 4.448 -11.592 10.087 704 HA GLU 98 HA GLU 98 1.835 -10.642 10.958 705 HB2 GLU 98 2HB GLU 98 4.464 -9.941 12.234 706 HB3 GLU 98 1HB GLU 98 2.973 -9.069 12.501 707 HG2 GLU 98 2HG GLU 98 1.963 -11.008 13.523 708 HG3 GLU 98 1HG GLU 98 3.396 -11.974 13.160 709 H PHE 99 H PHE 99 1.308 -8.678 10.187 710 HA PHE 99 HA PHE 99 3.201 -7.435 8.314 711 HB2 PHE 99 2HB PHE 99 0.157 -7.341 8.304 712 HB3 PHE 99 1HB PHE 99 1.223 -6.628 7.104 713 HD1 PHE 99 2HD PHE 99 -0.128 -9.812 8.410 714 HD2 PHE 99 1HD PHE 99 2.157 -7.938 5.353 715 HE1 PHE 99 2HE PHE 99 -0.247 -11.866 7.076 716 HE2 PHE 99 1HE PHE 99 2.035 -10.000 4.007 717 HZ PHE 99 HZ PHE 99 0.840 -11.965 4.871 718 H GLU 100 H GLU 100 3.822 -5.372 8.930 719 HA GLU 100 HA GLU 100 2.004 -3.987 10.725 720 HB2 GLU 100 2HB GLU 100 3.678 -3.293 12.264 721 HB3 GLU 100 1HB GLU 100 3.798 -5.039 12.101 722 HG2 GLU 100 2HG GLU 100 5.677 -4.753 10.582 723 HG3 GLU 100 1HG GLU 100 5.455 -3.001 10.760 724 H VAL 101 H VAL 101 1.875 -1.896 10.569 725 HA VAL 101 HA VAL 101 3.412 -0.623 8.433 726 HB VAL 101 HB VAL 101 1.149 -0.870 7.588 727 HG11 VAL 101 1HG1 VAL 101 -0.028 -1.228 9.679 728 HG12 VAL 101 2HG1 VAL 101 -0.816 0.034 8.729 729 HG13 VAL 101 3HG1 VAL 101 0.193 0.467 10.110 730 HG21 VAL 101 3HG2 VAL 101 1.568 1.969 8.532 731 HG22 VAL 101 1HG2 VAL 101 0.470 1.473 7.242 732 HG23 VAL 101 2HG2 VAL 101 2.211 1.253 7.056 733 H VAL 102 H VAL 102 4.528 1.084 8.987 734 HA VAL 102 HA VAL 102 4.015 2.287 11.620 735 HB VAL 102 HB VAL 102 6.637 2.203 10.105 736 HG11 VAL 102 1HG1 VAL 102 7.633 3.000 12.201 737 HG12 VAL 102 2HG1 VAL 102 6.021 3.095 12.916 738 HG13 VAL 102 3HG1 VAL 102 6.444 4.133 11.555 739 HG21 VAL 102 3HG2 VAL 102 7.388 0.583 11.796 740 HG22 VAL 102 1HG2 VAL 102 6.030 -0.038 10.855 741 HG23 VAL 102 2HG2 VAL 102 5.767 0.571 12.488 742 H ASP 103 H ASP 103 3.121 4.250 11.436 743 HA ASP 103 HA ASP 103 3.650 5.823 9.065 744 HB2 ASP 103 2HB ASP 103 1.310 5.670 9.574 745 HB3 ASP 103 1HB ASP 103 1.589 6.107 11.256 746 H VAL 104 H VAL 104 5.385 6.897 9.237 747 HA VAL 104 HA VAL 104 5.762 8.462 11.657 748 HB VAL 104 HB VAL 104 8.270 8.627 10.773 749 HG11 VAL 104 1HG1 VAL 104 7.146 6.144 12.087 750 HG12 VAL 104 2HG1 VAL 104 7.643 7.629 12.907 751 HG13 VAL 104 3HG1 VAL 104 8.842 6.624 12.101 752 HG21 VAL 104 3HG2 VAL 104 7.888 7.408 8.683 753 HG22 VAL 104 1HG2 VAL 104 7.352 5.999 9.598 754 HG23 VAL 104 2HG2 VAL 104 9.023 6.543 9.721 755 H GLY 105 H GLY 105 4.256 8.807 9.089 756 HA2 GLY 105 2HA GLY 105 5.215 11.519 8.523 757 HA3 GLY 105 1HA GLY 105 4.471 10.480 7.296 758 H SER 106 H SER 106 3.737 11.047 10.651 759 HA SER 106 HA SER 106 0.957 10.940 10.296 760 HB2 SER 106 2HB SER 106 1.028 11.619 12.771 761 HB3 SER 106 1HB SER 106 1.778 10.090 12.300 762 HG SER 106 HG SER 106 3.524 10.813 13.095 763 H LEU 107 H LEU 107 3.159 13.491 9.986 764 HA LEU 107 HA LEU 107 1.500 15.680 10.667 765 HB2 LEU 107 2HB LEU 107 3.956 15.746 10.338 766 HB3 LEU 107 1HB LEU 107 3.714 15.506 8.633 767 HG LEU 107 HG LEU 107 2.492 17.627 8.480 768 HD11 LEU 107 1HD1 LEU 107 1.678 17.827 10.757 769 HD12 LEU 107 2HD1 LEU 107 2.630 19.249 10.329 770 HD13 LEU 107 3HD1 LEU 107 3.329 17.998 11.354 771 HD21 LEU 107 3HD2 LEU 107 5.270 17.839 9.633 772 HD22 LEU 107 1HD2 LEU 107 4.451 19.093 8.704 773 HD23 LEU 107 2HD2 LEU 107 4.856 17.555 7.941 774 H ASN 108 H ASN 108 2.196 13.954 7.675 775 HA ASN 108 HA ASN 108 0.149 15.243 6.142 776 HB2 ASN 108 2HB ASN 108 2.089 14.198 5.047 777 HB3 ASN 108 1HB ASN 108 1.651 12.651 5.766 778 HD21 ASN 108 1HD2 ASN 108 0.874 14.990 3.313 779 HD22 ASN 108 2HD2 ASN 108 -0.207 13.970 2.424 780 H GLY 109 H GLY 109 0.588 12.137 7.742 781 HA2 GLY 109 2HA GLY 109 -1.073 11.247 9.190 782 HA3 GLY 109 1HA GLY 109 -2.289 12.129 8.292 783 H THR 110 H THR 110 -0.404 9.230 8.503 784 HA THR 110 HA THR 110 -1.791 8.030 6.267 785 HB THR 110 HB THR 110 0.137 6.839 8.295 786 HG1 THR 110 1HG THR 110 1.515 7.906 7.260 787 HG21 THR 110 3HG2 THR 110 -1.218 5.120 7.233 788 HG22 THR 110 1HG2 THR 110 0.422 5.048 6.600 789 HG23 THR 110 2HG2 THR 110 -0.875 5.774 5.639 790 H TYR 111 H TYR 111 -3.764 7.169 6.594 791 HA TYR 111 HA TYR 111 -4.573 6.511 9.339 792 HB2 TYR 111 2HB TYR 111 -6.341 6.580 6.891 793 HB3 TYR 111 1HB TYR 111 -6.786 6.492 8.584 794 HD1 TYR 111 1HD TYR 111 -6.490 8.541 10.033 795 HD2 TYR 111 2HD TYR 111 -6.136 8.624 5.799 796 HE1 TYR 111 1HE TYR 111 -6.953 10.964 10.033 797 HE2 TYR 111 2HE TYR 111 -6.574 11.024 5.793 798 HH TYR 111 HH TYR 111 -6.456 12.914 8.495 799 H VAL 112 H VAL 112 -4.926 4.424 9.853 800 HA VAL 112 HA VAL 112 -4.967 2.430 7.684 801 HB VAL 112 HB VAL 112 -4.075 1.955 10.555 802 HG11 VAL 112 1HG1 VAL 112 -4.948 -0.020 9.434 803 HG12 VAL 112 2HG1 VAL 112 -3.210 -0.173 9.684 804 HG13 VAL 112 3HG1 VAL 112 -3.838 0.232 8.087 805 HG21 VAL 112 3HG2 VAL 112 -2.470 3.440 9.450 806 HG22 VAL 112 1HG2 VAL 112 -2.336 2.304 8.108 807 HG23 VAL 112 2HG2 VAL 112 -1.768 1.846 9.718 808 H ASN 113 H ASN 113 -6.908 1.399 7.544 809 HA ASN 113 HA ASN 113 -9.059 0.853 7.929 810 HB2 ASN 113 2HB ASN 113 -8.505 1.216 10.917 811 HB3 ASN 113 1HB ASN 113 -9.880 0.377 10.222 812 HD21 ASN 113 1HD2 ASN 113 -9.540 -1.711 9.359 813 HD22 ASN 113 2HD2 ASN 113 -8.139 -2.635 9.756 814 H ARG 114 H ARG 114 -7.888 3.489 7.803 815 HA ARG 114 HA ARG 114 -8.241 5.589 7.801 816 HB2 ARG 114 2HB ARG 114 -11.052 4.695 7.737 817 HB3 ARG 114 1HB ARG 114 -10.776 6.404 8.088 818 HG2 ARG 114 2HG ARG 114 -9.379 6.598 6.094 819 HG3 ARG 114 1HG ARG 114 -9.675 4.905 5.722 820 HD2 ARG 114 2HD ARG 114 -11.982 5.333 5.308 821 HD3 ARG 114 1HD ARG 114 -11.854 6.966 5.961 822 HE ARG 114 HE ARG 114 -10.508 7.583 4.112 823 HH11 ARG 114 1HH1 ARG 114 -12.093 4.450 3.705 824 HH12 ARG 114 2HH1 ARG 114 -12.026 4.460 2.021 825 HH21 ARG 114 1HH2 ARG 114 -10.516 7.627 1.675 826 HH22 ARG 114 2HH2 ARG 114 -11.218 6.297 0.880 827 H GLU 115 H GLU 115 -7.900 4.158 10.401 828 HA GLU 115 HA GLU 115 -8.577 6.343 12.217 829 HB2 GLU 115 2HB GLU 115 -7.080 3.778 12.770 830 HB3 GLU 115 1HB GLU 115 -7.712 4.898 13.954 831 HG2 GLU 115 2HG GLU 115 -9.988 4.276 13.301 832 HG3 GLU 115 1HG GLU 115 -9.322 3.134 12.127 833 HA PRO 116 HA PRO 116 -4.288 7.781 11.636 834 HB2 PRO 116 2HB PRO 116 -4.682 9.203 14.187 835 HB3 PRO 116 1HB PRO 116 -4.339 9.876 12.594 836 HG2 PRO 116 2HG PRO 116 -6.741 10.155 13.783 837 HG3 PRO 116 1HG PRO 116 -6.564 10.015 12.027 838 HD2 PRO 116 2HD PRO 116 -7.405 7.946 14.020 839 HD3 PRO 116 1HD PRO 116 -8.021 8.269 12.383 840 H ARG 117 H ARG 117 -2.768 6.323 12.165 841 HA ARG 117 HA ARG 117 -2.461 5.498 14.958 842 HB2 ARG 117 2HB ARG 117 -2.358 3.688 12.527 843 HB3 ARG 117 1HB ARG 117 -1.913 3.214 14.156 844 HG2 ARG 117 2HG ARG 117 -4.677 4.062 13.300 845 HG3 ARG 117 1HG ARG 117 -4.136 2.392 13.454 846 HD2 ARG 117 2HD ARG 117 -3.638 2.832 15.850 847 HD3 ARG 117 1HD ARG 117 -4.311 4.451 15.640 848 HE ARG 117 HE ARG 117 -6.278 2.700 14.785 849 HH11 ARG 117 1HH1 ARG 117 -4.625 3.330 17.861 850 HH12 ARG 117 2HH1 ARG 117 -5.909 2.742 18.806 851 HH21 ARG 117 1HH2 ARG 117 -7.955 1.961 16.023 852 HH22 ARG 117 2HH2 ARG 117 -7.904 1.933 17.729 853 H ASN 118 H ASN 118 -0.320 5.744 15.546 854 HA ASN 118 HA ASN 118 1.552 6.500 13.479 855 HB2 ASN 118 2HB ASN 118 3.251 6.777 15.239 856 HB3 ASN 118 1HB ASN 118 1.766 7.600 15.676 857 HD21 ASN 118 1HD2 ASN 118 0.608 6.848 17.434 858 HD22 ASN 118 2HD2 ASN 118 1.258 5.728 18.568 859 H ALA 119 H ALA 119 0.818 3.718 15.309 860 HA ALA 119 HA ALA 119 2.274 2.179 13.317 861 HB1 ALA 119 1HB ALA 119 3.124 0.632 15.054 862 HB2 ALA 119 2HB ALA 119 2.497 1.704 16.304 863 HB3 ALA 119 3HB ALA 119 3.800 2.251 15.245 864 H GLN 120 H GLN 120 1.089 0.452 12.716 865 HA GLN 120 HA GLN 120 -1.059 -0.433 14.423 866 HB2 GLN 120 2HB GLN 120 -2.143 1.229 12.992 867 HB3 GLN 120 1HB GLN 120 -1.503 0.451 11.561 868 HG2 GLN 120 2HG GLN 120 -3.886 -0.044 11.906 869 HG3 GLN 120 1HG GLN 120 -2.893 -1.496 11.941 870 HE21 GLN 120 1HE2 GLN 120 -4.820 0.635 13.752 871 HE22 GLN 120 2HE2 GLN 120 -5.027 -0.348 15.160 872 H VAL 121 H VAL 121 -1.726 -2.485 13.997 873 HA VAL 121 HA VAL 121 0.242 -4.122 12.641 874 HB VAL 121 HB VAL 121 -2.387 -4.945 13.941 875 HG11 VAL 121 1HG1 VAL 121 -1.405 -7.198 14.008 876 HG12 VAL 121 2HG1 VAL 121 0.025 -6.597 13.169 877 HG13 VAL 121 3HG1 VAL 121 -1.538 -6.599 12.354 878 HG21 VAL 121 3HG2 VAL 121 -0.912 -3.889 15.571 879 HG22 VAL 121 1HG2 VAL 121 0.399 -4.971 15.107 880 HG23 VAL 121 2HG2 VAL 121 -1.045 -5.618 15.887 881 H MET 122 H MET 122 0.093 -4.370 10.571 882 HA MET 122 HA MET 122 -1.910 -3.091 9.033 883 HB2 MET 122 2HB MET 122 0.559 -3.383 8.522 884 HB3 MET 122 1HB MET 122 0.191 -5.040 8.095 885 HG2 MET 122 2HG MET 122 -1.222 -4.272 6.280 886 HG3 MET 122 1HG MET 122 -0.930 -2.594 6.752 887 HE1 MET 122 3HE MET 122 1.176 -2.736 3.487 888 HE2 MET 122 1HE MET 122 -0.044 -1.860 4.408 889 HE3 MET 122 2HE MET 122 -0.402 -3.466 3.782 890 H GLN 123 H GLN 123 -3.773 -3.882 8.307 891 HA GLN 123 HA GLN 123 -4.385 -6.675 8.939 892 HB2 GLN 123 2HB GLN 123 -5.608 -4.869 10.110 893 HB3 GLN 123 1HB GLN 123 -6.204 -4.299 8.562 894 HG2 GLN 123 2HG GLN 123 -7.916 -5.565 9.650 895 HG3 GLN 123 1HG GLN 123 -7.341 -6.453 8.244 896 HE21 GLN 123 1HE2 GLN 123 -8.090 -8.396 9.084 897 HE22 GLN 123 2HE2 GLN 123 -7.298 -9.199 10.388 898 H THR 124 H THR 124 -4.770 -8.053 7.305 899 HA THR 124 HA THR 124 -4.845 -7.203 4.576 900 HB THR 124 HB THR 124 -5.193 -9.739 4.315 901 HG1 THR 124 1HG THR 124 -5.896 -10.386 6.202 902 HG21 THR 124 3HG2 THR 124 -2.984 -8.668 4.055 903 HG22 THR 124 1HG2 THR 124 -2.843 -10.244 4.835 904 HG23 THR 124 2HG2 THR 124 -2.740 -8.769 5.798 905 H GLY 125 H GLY 125 -6.691 -6.472 3.696 906 HA2 GLY 125 2HA GLY 125 -8.837 -7.273 2.863 907 HA3 GLY 125 1HA GLY 125 -9.165 -7.831 4.498 908 H ASP 126 H ASP 126 -7.573 -4.867 4.589 909 HA ASP 126 HA ASP 126 -10.127 -3.432 4.612 910 HB2 ASP 126 2HB ASP 126 -9.235 -4.075 6.973 911 HB3 ASP 126 1HB ASP 126 -7.985 -2.872 6.683 912 H GLU 127 H GLU 127 -8.894 -0.874 5.307 913 HA GLU 127 HA GLU 127 -7.285 -0.558 2.908 914 HB2 GLU 127 2HB GLU 127 -8.600 1.398 2.218 915 HB3 GLU 127 1HB GLU 127 -9.522 -0.098 2.183 916 HG2 GLU 127 2HG GLU 127 -10.462 0.554 4.400 917 HG3 GLU 127 1HG GLU 127 -9.688 2.126 4.202 918 H ILE 128 H ILE 128 -6.027 1.308 2.733 919 HA ILE 128 HA ILE 128 -5.400 2.622 5.283 920 HB ILE 128 HB ILE 128 -3.441 1.634 3.179 921 HG12 ILE 128 2HG1 ILE 128 -3.866 0.683 6.025 922 HG13 ILE 128 1HG1 ILE 128 -4.334 -0.191 4.573 923 HG21 ILE 128 1HG2 ILE 128 -1.665 2.389 4.714 924 HG22 ILE 128 2HG2 ILE 128 -2.892 3.070 5.782 925 HG23 ILE 128 3HG2 ILE 128 -2.674 3.726 4.161 926 HD11 ILE 128 3HD1 ILE 128 -2.300 -1.097 5.546 927 HD12 ILE 128 1HD1 ILE 128 -1.516 0.477 5.415 928 HD13 ILE 128 2HD1 ILE 128 -1.970 -0.404 3.957 929 H GLN 129 H GLN 129 -5.262 4.791 5.064 930 HA GLN 129 HA GLN 129 -5.398 5.834 2.322 931 HB2 GLN 129 2HB GLN 129 -7.553 6.016 3.522 932 HB3 GLN 129 1HB GLN 129 -6.763 6.952 4.778 933 HG2 GLN 129 2HG GLN 129 -6.245 8.696 3.123 934 HG3 GLN 129 1HG GLN 129 -7.076 7.753 1.889 935 HE21 GLN 129 1HE2 GLN 129 -8.670 9.274 1.497 936 HE22 GLN 129 2HE2 GLN 129 -9.863 9.682 2.672 937 H ILE 130 H ILE 130 -3.624 6.817 1.887 938 HA ILE 130 HA ILE 130 -2.130 8.078 4.037 939 HB ILE 130 HB ILE 130 -0.219 8.364 2.472 940 HG12 ILE 130 2HG1 ILE 130 -1.498 8.198 0.284 941 HG13 ILE 130 1HG1 ILE 130 -0.004 7.290 0.338 942 HG21 ILE 130 1HG2 ILE 130 -0.089 6.612 3.985 943 HG22 ILE 130 2HG2 ILE 130 0.523 6.008 2.446 944 HG23 ILE 130 3HG2 ILE 130 -1.098 5.563 2.987 945 HD11 ILE 130 3HD1 ILE 130 -1.630 6.002 -0.819 946 HD12 ILE 130 1HD1 ILE 130 -2.819 6.169 0.469 947 HD13 ILE 130 2HD1 ILE 130 -1.359 5.229 0.735 948 H GLY 131 H GLY 131 -2.681 10.027 4.461 949 HA2 GLY 131 2HA GLY 131 -3.123 12.242 4.166 950 HA3 GLY 131 1HA GLY 131 -2.608 12.070 2.494 951 H LYS 132 H LYS 132 -4.052 12.020 0.962 952 HA LYS 132 HA LYS 132 -6.855 11.596 1.710 953 HB2 LYS 132 2HB LYS 132 -5.866 13.510 -0.415 954 HB3 LYS 132 1HB LYS 132 -7.540 13.209 0.022 955 HG2 LYS 132 2HG LYS 132 -6.974 14.095 2.328 956 HG3 LYS 132 1HG LYS 132 -5.417 14.590 1.660 957 HD2 LYS 132 2HD LYS 132 -6.866 16.497 1.582 958 HD3 LYS 132 1HD LYS 132 -6.686 15.902 -0.072 959 HE2 LYS 132 2HE LYS 132 -8.839 14.673 0.192 960 HE3 LYS 132 1HE LYS 132 -8.995 15.382 1.793 961 HZ1 LYS 132 3HZ LYS 132 -8.962 16.851 -0.778 962 HZ2 LYS 132 1HZ LYS 132 -9.101 17.581 0.736 963 HZ3 LYS 132 2HZ LYS 132 -10.301 16.537 0.156 964 H PHE 133 H PHE 133 -4.543 9.962 0.455 965 HA PHE 133 HA PHE 133 -5.856 9.244 -2.069 966 HB2 PHE 133 2HB PHE 133 -3.146 8.401 -1.027 967 HB3 PHE 133 1HB PHE 133 -3.802 8.050 -2.619 968 HD1 PHE 133 1HD PHE 133 -4.658 10.313 -3.858 969 HD2 PHE 133 2HD PHE 133 -1.567 10.049 -0.948 970 HE1 PHE 133 1HE PHE 133 -3.657 12.377 -4.736 971 HE2 PHE 133 2HE PHE 133 -0.566 12.111 -1.819 972 HZ PHE 133 HZ PHE 133 -1.606 13.277 -3.711 973 H ARG 134 H ARG 134 -6.816 7.294 -2.330 974 HA ARG 134 HA ARG 134 -7.046 5.692 0.094 975 HB2 ARG 134 2HB ARG 134 -9.063 4.673 -1.114 976 HB3 ARG 134 1HB ARG 134 -9.206 6.338 -0.578 977 HG2 ARG 134 2HG ARG 134 -8.862 7.127 -2.817 978 HG3 ARG 134 1HG ARG 134 -8.521 5.500 -3.391 979 HD2 ARG 134 2HD ARG 134 -10.797 4.817 -2.948 980 HD3 ARG 134 1HD ARG 134 -11.147 6.359 -2.166 981 HE ARG 134 HE ARG 134 -10.510 7.275 -4.481 982 HH11 ARG 134 1HH1 ARG 134 -12.435 4.327 -3.923 983 HH12 ARG 134 2HH1 ARG 134 -13.343 4.479 -5.332 984 HH21 ARG 134 1HH2 ARG 134 -11.828 7.491 -6.448 985 HH22 ARG 134 2HH2 ARG 134 -12.993 6.311 -6.792 986 H LEU 135 H LEU 135 -6.071 3.882 0.299 987 HA LEU 135 HA LEU 135 -5.386 2.251 -2.012 988 HB2 LEU 135 2HB LEU 135 -3.416 3.425 -1.131 989 HB3 LEU 135 1HB LEU 135 -3.802 2.922 0.487 990 HG LEU 135 HG LEU 135 -2.995 0.908 -1.626 991 HD11 LEU 135 1HD1 LEU 135 -0.705 1.154 -0.765 992 HD12 LEU 135 2HD1 LEU 135 -1.234 2.478 0.269 993 HD13 LEU 135 3HD1 LEU 135 -1.267 2.664 -1.484 994 HD21 LEU 135 3HD2 LEU 135 -2.249 -0.348 0.370 995 HD22 LEU 135 1HD2 LEU 135 -3.972 0.029 0.464 996 HD23 LEU 135 2HD2 LEU 135 -2.800 0.966 1.390 997 H VAL 136 H VAL 136 -5.790 0.038 -1.668 998 HA VAL 136 HA VAL 136 -6.995 -0.617 0.915 999 HB VAL 136 HB VAL 136 -8.716 -0.562 -0.868 1000 HG11 VAL 136 1HG1 VAL 136 -8.735 -2.210 -2.681 1001 HG12 VAL 136 2HG1 VAL 136 -7.102 -2.697 -2.219 1002 HG13 VAL 136 3HG1 VAL 136 -7.402 -1.059 -2.798 1003 HG21 VAL 136 3HG2 VAL 136 -9.691 -2.798 -0.535 1004 HG22 VAL 136 1HG2 VAL 136 -9.063 -2.111 0.963 1005 HG23 VAL 136 2HG2 VAL 136 -8.150 -3.355 0.115 1006 H PHE 137 H PHE 137 -6.380 -2.609 1.844 1007 HA PHE 137 HA PHE 137 -4.099 -3.866 0.491 1008 HB2 PHE 137 2HB PHE 137 -3.273 -2.496 2.310 1009 HB3 PHE 137 1HB PHE 137 -4.426 -3.210 3.421 1010 HD1 PHE 137 1HD PHE 137 -1.729 -4.345 1.096 1011 HD2 PHE 137 2HD PHE 137 -3.612 -4.764 4.878 1012 HE1 PHE 137 1HE PHE 137 -0.043 -6.004 1.749 1013 HE2 PHE 137 2HE PHE 137 -1.938 -6.427 5.535 1014 HZ PHE 137 HZ PHE 137 -0.151 -7.047 3.977 1015 H LEU 138 H LEU 138 -4.422 -5.907 0.064 1016 HA LEU 138 HA LEU 138 -6.428 -7.380 1.639 1017 HB2 LEU 138 2HB LEU 138 -5.767 -7.735 -1.293 1018 HB3 LEU 138 1HB LEU 138 -6.899 -8.698 -0.386 1019 HG LEU 138 HG LEU 138 -8.195 -7.314 -1.709 1020 HD11 LEU 138 1HD1 LEU 138 -9.386 -5.827 -0.201 1021 HD12 LEU 138 2HD1 LEU 138 -8.100 -6.020 0.985 1022 HD13 LEU 138 3HD1 LEU 138 -9.063 -7.416 0.491 1023 HD21 LEU 138 3HD2 LEU 138 -7.941 -4.869 -1.895 1024 HD22 LEU 138 1HD2 LEU 138 -6.520 -5.739 -2.468 1025 HD23 LEU 138 2HD2 LEU 138 -6.496 -4.958 -0.888 1026 H ALA 139 H ALA 139 -6.071 -9.782 1.315 1027 HA ALA 139 HA ALA 139 -3.391 -10.495 1.923 1028 HB1 ALA 139 1HB ALA 139 -5.767 -12.214 1.164 1029 HB2 ALA 139 2HB ALA 139 -5.287 -11.783 2.804 1030 HB3 ALA 139 3HB ALA 139 -4.244 -12.812 1.821 1031 H GLY 140 H GLY 140 -2.044 -11.780 0.582 1032 HA2 GLY 140 2HA GLY 140 -2.370 -11.027 -2.227 1033 HA3 GLY 140 1HA GLY 140 -0.853 -11.482 -1.460 1034 HA PRO 141 HA PRO 141 -2.398 -15.088 -3.775 1035 HB2 PRO 141 2HB PRO 141 0.389 -15.540 -4.371 1036 HB3 PRO 141 1HB PRO 141 -0.964 -15.345 -5.484 1037 HG2 PRO 141 2HG PRO 141 0.977 -13.441 -5.225 1038 HG3 PRO 141 1HG PRO 141 -0.701 -13.051 -5.635 1039 HD2 PRO 141 2HD PRO 141 0.706 -12.840 -3.006 1040 HD3 PRO 141 1HD PRO 141 -0.489 -11.750 -3.731 1041 H ALA 142 H ALA 142 -2.699 -16.718 -2.580 1042 HA ALA 142 HA ALA 142 -0.885 -17.452 -0.442 1043 HB1 ALA 142 1HB ALA 142 -3.557 -18.588 -1.311 1044 HB2 ALA 142 2HB ALA 142 -3.302 -17.451 0.012 1045 HB3 ALA 142 3HB ALA 142 -2.668 -19.089 0.126 1046 H GLU 143 H GLU 143 0.824 -18.503 -1.208 1047 HA GLU 143 HA GLU 143 0.451 -20.699 -3.048 1048 HB2 GLU 143 2HB GLU 143 0.648 -18.584 -4.350 1049 HB3 GLU 143 1HB GLU 143 2.200 -18.307 -3.598 1050 HG2 GLU 143 2HG GLU 143 3.111 -20.253 -4.714 1051 HG3 GLU 143 1HG GLU 143 1.523 -20.620 -5.402 Start of MODEL 30 1 H1 MET 1 1HT MET 1 -60.112 38.864 8.601 2 H2 MET 1 2HT MET 1 -60.692 39.766 7.293 3 H3 MET 1 3HT MET 1 -59.076 39.909 7.790 4 HA MET 1 HA MET 1 -60.278 37.451 6.735 5 HB2 MET 1 2HB MET 1 -59.045 37.860 4.673 6 HB3 MET 1 1HB MET 1 -60.066 39.242 4.996 7 HG2 MET 1 2HG MET 1 -57.096 39.085 5.495 8 HG3 MET 1 1HG MET 1 -57.866 39.883 4.130 9 HE1 MET 1 2HE MET 1 -56.497 42.095 4.651 10 HE2 MET 1 3HE MET 1 -55.717 41.296 6.016 11 HE3 MET 1 1HE MET 1 -56.457 42.882 6.229 12 H SER 2 H SER 2 -58.962 35.680 6.878 13 HA SER 2 HA SER 2 -56.734 35.985 8.679 14 HB2 SER 2 2HB SER 2 -58.456 34.109 8.823 15 HB3 SER 2 1HB SER 2 -57.726 33.450 7.365 16 HG SER 2 HG SER 2 -56.490 33.902 9.853 17 H ASP 3 H ASP 3 -57.322 34.746 5.410 18 HA ASP 3 HA ASP 3 -55.925 34.021 3.810 19 HB2 ASP 3 2HB ASP 3 -55.757 36.944 3.959 20 HB3 ASP 3 1HB ASP 3 -54.557 36.164 2.929 21 H ASN 4 H ASN 4 -54.757 32.518 4.744 22 HA ASN 4 HA ASN 4 -51.972 32.827 4.311 23 HB2 ASN 4 2HB ASN 4 -51.204 32.193 6.560 24 HB3 ASN 4 1HB ASN 4 -52.085 33.712 6.650 25 HD21 ASN 4 1HD2 ASN 4 -54.035 33.767 7.700 26 HD22 ASN 4 2HD2 ASN 4 -54.627 32.503 8.701 27 H ASN 5 H ASN 5 -50.945 30.644 4.896 28 HA ASN 5 HA ASN 5 -52.905 28.556 4.246 29 HB2 ASN 5 2HB ASN 5 -51.102 28.831 2.564 30 HB3 ASN 5 1HB ASN 5 -49.899 28.538 3.817 31 HD21 ASN 5 1HD2 ASN 5 -52.255 27.108 1.727 32 HD22 ASN 5 2HD2 ASN 5 -51.855 25.465 2.058 33 H GLY 6 H GLY 6 -53.533 27.708 6.093 34 HA2 GLY 6 2HA GLY 6 -51.522 26.396 7.726 35 HA3 GLY 6 1HA GLY 6 -52.529 27.590 8.541 36 H THR 7 H THR 7 -53.531 25.542 5.890 37 HA THR 7 HA THR 7 -55.836 24.771 7.310 38 HB THR 7 HB THR 7 -56.095 23.430 5.086 39 HG1 THR 7 1HG THR 7 -54.564 23.732 3.645 40 HG21 THR 7 3HG2 THR 7 -57.281 25.545 5.599 41 HG22 THR 7 1HG2 THR 7 -56.785 25.479 3.908 42 HG23 THR 7 2HG2 THR 7 -55.870 26.451 5.058 43 HA PRO 8 HA PRO 8 -54.063 21.171 9.297 44 HB2 PRO 8 2HB PRO 8 -56.811 20.075 9.015 45 HB3 PRO 8 1HB PRO 8 -55.815 20.248 10.460 46 HG2 PRO 8 2HG PRO 8 -57.873 21.880 10.011 47 HG3 PRO 8 1HG PRO 8 -56.374 22.470 10.746 48 HD2 PRO 8 2HD PRO 8 -57.381 22.815 7.959 49 HD3 PRO 8 1HD PRO 8 -56.470 23.937 8.996 50 H GLU 9 H GLU 9 -53.028 19.485 8.451 51 HA GLU 9 HA GLU 9 -53.977 18.374 5.943 52 HB2 GLU 9 2HB GLU 9 -51.384 17.907 7.428 53 HB3 GLU 9 1HB GLU 9 -51.787 17.247 5.853 54 HG2 GLU 9 2HG GLU 9 -51.951 19.566 4.993 55 HG3 GLU 9 1HG GLU 9 -51.356 20.138 6.556 56 HA PRO 10 HA PRO 10 -55.939 15.145 8.270 57 HB2 PRO 10 2HB PRO 10 -55.924 13.265 6.209 58 HB3 PRO 10 1HB PRO 10 -57.195 14.459 6.489 59 HG2 PRO 10 2HG PRO 10 -54.894 14.536 4.596 60 HG3 PRO 10 1HG PRO 10 -56.549 15.129 4.372 61 HD2 PRO 10 2HD PRO 10 -54.520 16.780 4.854 62 HD3 PRO 10 1HD PRO 10 -56.126 17.087 5.550 63 H GLN 11 H GLN 11 -55.217 13.564 9.519 64 HA GLN 11 HA GLN 11 -52.449 12.873 9.493 65 HB2 GLN 11 2HB GLN 11 -53.723 13.195 11.570 66 HB3 GLN 11 1HB GLN 11 -54.737 11.821 11.160 67 HG2 GLN 11 2HG GLN 11 -52.809 10.348 11.316 68 HG3 GLN 11 1HG GLN 11 -51.780 11.725 11.710 69 HE21 GLN 11 1HE2 GLN 11 -54.272 9.624 12.821 70 HE22 GLN 11 2HE2 GLN 11 -54.220 10.075 14.480 71 H VAL 12 H VAL 12 -51.701 11.474 8.067 72 HA VAL 12 HA VAL 12 -53.477 9.471 6.966 73 HB VAL 12 HB VAL 12 -50.584 9.991 6.243 74 HG11 VAL 12 1HG1 VAL 12 -52.771 8.520 4.776 75 HG12 VAL 12 2HG1 VAL 12 -51.359 7.803 5.551 76 HG13 VAL 12 3HG1 VAL 12 -51.160 8.842 4.141 77 HG21 VAL 12 3HG2 VAL 12 -51.434 11.270 4.325 78 HG22 VAL 12 1HG2 VAL 12 -51.899 12.010 5.857 79 HG23 VAL 12 2HG2 VAL 12 -53.077 11.078 4.935 80 H GLU 13 H GLU 13 -53.638 7.607 7.938 81 HA GLU 13 HA GLU 13 -51.207 6.361 8.922 82 HB2 GLU 13 2HB GLU 13 -52.428 7.235 10.883 83 HB3 GLU 13 1HB GLU 13 -53.864 6.364 10.362 84 HG2 GLU 13 2HG GLU 13 -52.603 4.245 10.593 85 HG3 GLU 13 1HG GLU 13 -51.251 5.155 11.252 86 H THR 14 H THR 14 -50.974 4.508 7.921 87 HA THR 14 HA THR 14 -53.149 3.407 6.412 88 HB THR 14 HB THR 14 -51.006 3.329 5.334 89 HG1 THR 14 1HG THR 14 -50.657 0.980 5.128 90 HG21 THR 14 3HG2 THR 14 -49.097 2.027 6.236 91 HG22 THR 14 1HG2 THR 14 -49.974 1.843 7.750 92 HG23 THR 14 2HG2 THR 14 -49.489 3.451 7.184 93 H THR 15 H THR 15 -51.681 2.884 9.488 94 HA THR 15 HA THR 15 -52.237 1.705 11.292 95 HB THR 15 HB THR 15 -54.741 0.727 9.867 96 HG1 THR 15 1HG THR 15 -54.392 3.227 11.275 97 HG21 THR 15 3HG2 THR 15 -55.709 0.824 12.131 98 HG22 THR 15 1HG2 THR 15 -54.175 1.426 12.757 99 HG23 THR 15 2HG2 THR 15 -54.279 -0.209 12.106 100 H SER 16 H SER 16 -51.026 0.530 8.746 101 HA SER 16 HA SER 16 -50.673 -2.171 9.720 102 HB2 SER 16 2HB SER 16 -52.494 -2.392 8.068 103 HB3 SER 16 1HB SER 16 -51.560 -1.477 6.889 104 HG SER 16 HG SER 16 -51.247 -4.118 7.773 105 H VAL 17 H VAL 17 -48.500 -2.182 9.961 106 HA VAL 17 HA VAL 17 -46.916 -0.540 8.118 107 HB VAL 17 HB VAL 17 -46.144 -1.590 10.854 108 HG11 VAL 17 1HG1 VAL 17 -44.216 -1.222 9.420 109 HG12 VAL 17 2HG1 VAL 17 -44.270 -0.020 10.707 110 HG13 VAL 17 3HG1 VAL 17 -44.766 0.419 9.074 111 HG21 VAL 17 3HG2 VAL 17 -47.936 0.042 11.053 112 HG22 VAL 17 1HG2 VAL 17 -47.032 1.181 10.055 113 HG23 VAL 17 2HG2 VAL 17 -46.417 0.715 11.644 114 H PHE 18 H PHE 18 -45.717 -1.610 6.679 115 HA PHE 18 HA PHE 18 -45.297 -4.459 7.013 116 HB2 PHE 18 2HB PHE 18 -46.009 -3.737 4.801 117 HB3 PHE 18 1HB PHE 18 -44.721 -2.548 4.725 118 HD1 PHE 18 2HD PHE 18 -45.371 -6.197 4.804 119 HD2 PHE 18 1HD PHE 18 -42.626 -3.086 3.874 120 HE1 PHE 18 2HE PHE 18 -43.887 -7.818 3.706 121 HE2 PHE 18 1HE PHE 18 -41.148 -4.700 2.779 122 HZ PHE 18 HZ PHE 18 -41.770 -7.062 2.697 123 H ARG 19 H ARG 19 -43.353 -5.313 7.634 124 HA ARG 19 HA ARG 19 -41.144 -3.419 7.884 125 HB2 ARG 19 2HB ARG 19 -41.715 -5.826 9.624 126 HB3 ARG 19 1HB ARG 19 -40.315 -4.784 9.745 127 HG2 ARG 19 2HG ARG 19 -41.680 -4.100 11.507 128 HG3 ARG 19 1HG ARG 19 -42.021 -2.912 10.252 129 HD2 ARG 19 2HD ARG 19 -44.080 -3.662 11.332 130 HD3 ARG 19 1HD ARG 19 -44.046 -4.145 9.637 131 HE ARG 19 HE ARG 19 -42.985 -6.201 11.241 132 HH11 ARG 19 1HH1 ARG 19 -46.133 -4.786 10.356 133 HH12 ARG 19 2HH1 ARG 19 -47.003 -6.181 10.776 134 HH21 ARG 19 1HH2 ARG 19 -44.210 -8.123 11.709 135 HH22 ARG 19 2HH2 ARG 19 -45.916 -8.106 11.517 136 H ALA 20 H ALA 20 -39.252 -4.022 7.031 137 HA ALA 20 HA ALA 20 -39.053 -6.658 5.809 138 HB1 ALA 20 1HB ALA 20 -37.274 -4.204 5.562 139 HB2 ALA 20 2HB ALA 20 -38.459 -4.737 4.370 140 HB3 ALA 20 3HB ALA 20 -37.031 -5.722 4.694 141 H ASP 21 H ASP 21 -38.971 -7.608 7.826 142 HA ASP 21 HA ASP 21 -37.212 -6.722 9.906 143 HB2 ASP 21 2HB ASP 21 -39.449 -7.721 10.321 144 HB3 ASP 21 1HB ASP 21 -38.820 -9.266 9.762 145 H LEU 22 H LEU 22 -37.290 -9.513 7.757 146 HA LEU 22 HA LEU 22 -34.540 -9.985 8.573 147 HB2 LEU 22 2HB LEU 22 -34.796 -12.379 8.077 148 HB3 LEU 22 1HB LEU 22 -35.824 -11.855 9.384 149 HG LEU 22 HG LEU 22 -36.864 -12.264 6.574 150 HD11 LEU 22 1HD1 LEU 22 -36.730 -14.214 8.866 151 HD12 LEU 22 2HD1 LEU 22 -35.867 -14.331 7.333 152 HD13 LEU 22 3HD1 LEU 22 -37.627 -14.453 7.368 153 HD21 LEU 22 3HD2 LEU 22 -39.009 -12.486 7.681 154 HD22 LEU 22 1HD2 LEU 22 -38.281 -10.946 8.131 155 HD23 LEU 22 2HD2 LEU 22 -38.248 -12.303 9.258 156 H LEU 23 H LEU 23 -33.195 -9.460 7.097 157 HA LEU 23 HA LEU 23 -34.026 -9.208 4.359 158 HB2 LEU 23 2HB LEU 23 -32.504 -7.570 5.609 159 HB3 LEU 23 1HB LEU 23 -31.272 -8.796 5.554 160 HG LEU 23 HG LEU 23 -32.465 -7.561 3.055 161 HD11 LEU 23 1HD1 LEU 23 -31.432 -5.823 4.379 162 HD12 LEU 23 2HD1 LEU 23 -30.445 -6.185 2.963 163 HD13 LEU 23 3HD1 LEU 23 -29.971 -6.797 4.551 164 HD21 LEU 23 3HD2 LEU 23 -30.430 -8.382 1.974 165 HD22 LEU 23 1HD2 LEU 23 -31.327 -9.714 2.707 166 HD23 LEU 23 2HD2 LEU 23 -29.889 -9.076 3.504 167 H LYS 24 H LYS 24 -34.045 -10.945 3.138 168 HA LYS 24 HA LYS 24 -32.542 -13.286 3.819 169 HB2 LYS 24 2HB LYS 24 -34.858 -13.368 2.795 170 HB3 LYS 24 1HB LYS 24 -34.173 -12.734 1.315 171 HG2 LYS 24 2HG LYS 24 -33.248 -15.338 2.522 172 HG3 LYS 24 1HG LYS 24 -34.612 -15.248 1.413 173 HD2 LYS 24 2HD LYS 24 -33.194 -14.423 -0.347 174 HD3 LYS 24 1HD LYS 24 -31.843 -14.238 0.764 175 HE2 LYS 24 2HE LYS 24 -31.569 -16.211 -0.628 176 HE3 LYS 24 1HE LYS 24 -31.741 -16.656 1.056 177 HZ1 LYS 24 3HZ LYS 24 -32.989 -18.063 -0.460 178 HZ2 LYS 24 1HZ LYS 24 -33.956 -16.768 -0.928 179 HZ3 LYS 24 2HZ LYS 24 -33.988 -17.341 0.669 180 H GLU 25 H GLU 25 -30.477 -13.328 3.438 181 HA GLU 25 HA GLU 25 -29.485 -12.034 1.006 182 HB2 GLU 25 2HB GLU 25 -27.370 -11.650 2.179 183 HB3 GLU 25 1HB GLU 25 -28.709 -10.875 3.009 184 HG2 GLU 25 2HG GLU 25 -28.764 -12.733 4.608 185 HG3 GLU 25 1HG GLU 25 -27.383 -13.458 3.784 186 H MET 26 H MET 26 -27.140 -13.015 0.609 187 HA MET 26 HA MET 26 -26.773 -15.765 1.059 188 HB2 MET 26 2HB MET 26 -27.049 -16.488 -1.303 189 HB3 MET 26 1HB MET 26 -28.574 -15.947 -0.629 190 HG2 MET 26 2HG MET 26 -28.239 -13.757 -1.741 191 HG3 MET 26 1HG MET 26 -26.786 -14.413 -2.490 192 HE1 MET 26 3HE MET 26 -27.736 -13.736 -4.892 193 HE2 MET 26 1HE MET 26 -29.164 -13.071 -4.096 194 HE3 MET 26 2HE MET 26 -29.349 -14.183 -5.450 195 H GLU 27 H GLU 27 -24.771 -16.366 -0.433 196 HA GLU 27 HA GLU 27 -23.278 -13.942 -1.003 197 HB2 GLU 27 2HB GLU 27 -22.773 -14.514 1.329 198 HB3 GLU 27 1HB GLU 27 -22.302 -16.130 0.837 199 HG2 GLU 27 2HG GLU 27 -20.375 -14.689 1.278 200 HG3 GLU 27 1HG GLU 27 -20.426 -15.258 -0.384 201 H SER 28 H SER 28 -21.775 -14.148 -2.566 202 HA SER 28 HA SER 28 -21.784 -16.673 -4.028 203 HB2 SER 28 2HB SER 28 -20.936 -15.125 -5.896 204 HB3 SER 28 1HB SER 28 -22.636 -14.984 -5.442 205 HG SER 28 HG SER 28 -22.221 -13.128 -4.408 206 H SER 29 H SER 29 -19.800 -14.353 -2.380 207 HA SER 29 HA SER 29 -17.325 -15.571 -3.292 208 HB2 SER 29 2HB SER 29 -17.839 -13.428 -1.204 209 HB3 SER 29 1HB SER 29 -16.271 -13.834 -1.896 210 HG SER 29 HG SER 29 -18.291 -12.293 -2.881 211 H THR 30 H THR 30 -15.760 -16.108 -1.265 212 HA THR 30 HA THR 30 -17.016 -16.877 1.112 213 HB THR 30 HB THR 30 -17.885 -18.673 -0.470 214 HG1 THR 30 1HG THR 30 -17.979 -19.259 1.555 215 HG21 THR 30 3HG2 THR 30 -14.988 -19.572 -0.441 216 HG22 THR 30 1HG2 THR 30 -15.873 -18.988 -1.851 217 HG23 THR 30 2HG2 THR 30 -16.336 -20.509 -1.089 218 H GLY 31 H GLY 31 -15.368 -18.459 2.296 219 HA2 GLY 31 2HA GLY 31 -12.848 -17.047 2.207 220 HA3 GLY 31 1HA GLY 31 -13.309 -18.288 3.371 221 H THR 32 H THR 32 -11.437 -17.614 0.657 222 HA THR 32 HA THR 32 -11.414 -20.200 -0.449 223 HB THR 32 HB THR 32 -9.320 -19.178 -1.584 224 HG1 THR 32 1HG THR 32 -9.292 -16.902 -1.430 225 HG21 THR 32 3HG2 THR 32 -10.742 -17.848 -3.098 226 HG22 THR 32 1HG2 THR 32 -12.039 -17.889 -1.906 227 HG23 THR 32 2HG2 THR 32 -11.511 -19.381 -2.684 228 H ALA 33 H ALA 33 -10.401 -21.879 0.357 229 HA ALA 33 HA ALA 33 -8.566 -21.537 2.572 230 HB1 ALA 33 1HB ALA 33 -8.820 -23.951 2.862 231 HB2 ALA 33 2HB ALA 33 -9.764 -24.034 1.378 232 HB3 ALA 33 3HB ALA 33 -10.393 -23.158 2.770 233 HA PRO 34 HA PRO 34 -5.255 -22.556 -0.285 234 HB2 PRO 34 2HB PRO 34 -3.236 -21.584 1.156 235 HB3 PRO 34 1HB PRO 34 -4.383 -20.487 0.379 236 HG2 PRO 34 2HG PRO 34 -4.165 -21.275 3.244 237 HG3 PRO 34 1HG PRO 34 -4.643 -19.722 2.541 238 HD2 PRO 34 2HD PRO 34 -6.382 -21.721 3.504 239 HD3 PRO 34 1HD PRO 34 -6.829 -20.319 2.510 240 H ALA 35 H ALA 35 -3.004 -23.654 0.235 241 HA ALA 35 HA ALA 35 -3.541 -25.965 1.937 242 HB1 ALA 35 1HB ALA 35 -1.562 -26.946 0.853 243 HB2 ALA 35 2HB ALA 35 -1.274 -25.429 0.005 244 HB3 ALA 35 3HB ALA 35 -2.722 -26.371 -0.343 245 H SER 36 H SER 36 -2.281 -22.995 2.229 246 HA SER 36 HA SER 36 0.006 -23.663 3.811 247 HB2 SER 36 2HB SER 36 -1.227 -20.978 3.242 248 HB3 SER 36 1HB SER 36 0.377 -21.284 3.915 249 HG SER 36 HG SER 36 0.883 -22.390 2.002 250 H THR 37 H THR 37 -0.998 -24.803 5.515 251 HA THR 37 HA THR 37 -2.534 -23.257 7.397 252 HB THR 37 HB THR 37 -1.193 -25.956 7.771 253 HG1 THR 37 1HG THR 37 -3.771 -25.308 6.764 254 HG21 THR 37 3HG2 THR 37 -2.992 -26.300 9.408 255 HG22 THR 37 1HG2 THR 37 -3.648 -24.707 9.033 256 HG23 THR 37 2HG2 THR 37 -2.070 -24.846 9.799 257 H GLY 38 H GLY 38 -1.403 -21.793 8.555 258 HA2 GLY 38 2HA GLY 38 0.346 -21.212 10.053 259 HA3 GLY 38 1HA GLY 38 1.353 -22.450 9.297 260 H ALA 39 H ALA 39 -0.431 -19.534 8.444 261 HA ALA 39 HA ALA 39 1.036 -19.030 6.073 262 HB1 ALA 39 1HB ALA 39 -1.218 -18.146 6.424 263 HB2 ALA 39 2HB ALA 39 -0.073 -16.853 6.066 264 HB3 ALA 39 3HB ALA 39 -0.616 -17.116 7.722 265 H GLU 40 H GLU 40 1.500 -18.234 9.397 266 HA GLU 40 HA GLU 40 3.402 -16.178 8.961 267 HB2 GLU 40 2HB GLU 40 4.000 -16.555 11.426 268 HB3 GLU 40 1HB GLU 40 2.386 -15.991 11.050 269 HG2 GLU 40 2HG GLU 40 2.992 -18.890 11.559 270 HG3 GLU 40 1HG GLU 40 2.639 -17.759 12.864 271 H ASN 41 H ASN 41 3.622 -19.446 8.609 272 HA ASN 41 HA ASN 41 6.453 -19.639 9.138 273 HB2 ASN 41 2HB ASN 41 4.485 -21.574 7.945 274 HB3 ASN 41 1HB ASN 41 6.200 -21.920 8.102 275 HD21 ASN 41 1HD2 ASN 41 7.049 -22.238 10.194 276 HD22 ASN 41 2HD2 ASN 41 6.018 -22.541 11.551 277 H LEU 42 H LEU 42 4.546 -18.503 6.620 278 HA LEU 42 HA LEU 42 6.550 -19.160 4.623 279 HB2 LEU 42 2HB LEU 42 3.655 -18.452 4.432 280 HB3 LEU 42 1HB LEU 42 4.711 -18.268 3.062 281 HG LEU 42 HG LEU 42 5.168 -20.739 3.176 282 HD11 LEU 42 1HD1 LEU 42 2.931 -20.747 5.195 283 HD12 LEU 42 2HD1 LEU 42 4.622 -21.132 5.517 284 HD13 LEU 42 3HD1 LEU 42 3.672 -22.167 4.453 285 HD21 LEU 42 3HD2 LEU 42 3.047 -21.380 2.195 286 HD22 LEU 42 1HD2 LEU 42 3.539 -19.785 1.636 287 HD23 LEU 42 2HD2 LEU 42 2.283 -19.939 2.864 288 HA PRO 43 HA PRO 43 7.550 -14.694 5.010 289 HB2 PRO 43 2HB PRO 43 9.725 -14.837 3.350 290 HB3 PRO 43 1HB PRO 43 9.809 -15.226 5.072 291 HG2 PRO 43 2HG PRO 43 9.519 -17.071 2.726 292 HG3 PRO 43 1HG PRO 43 10.583 -17.231 4.131 293 HD2 PRO 43 2HD PRO 43 8.315 -18.599 3.967 294 HD3 PRO 43 1HD PRO 43 8.840 -17.923 5.520 295 H ALA 44 H ALA 44 7.125 -16.769 2.305 296 HA ALA 44 HA ALA 44 6.600 -14.550 0.491 297 HB1 ALA 44 1HB ALA 44 8.055 -16.353 -0.328 298 HB2 ALA 44 2HB ALA 44 6.570 -16.272 -1.279 299 HB3 ALA 44 3HB ALA 44 6.768 -17.521 -0.051 300 H GLY 45 H GLY 45 4.948 -15.321 2.727 301 HA2 GLY 45 2HA GLY 45 2.423 -16.191 1.557 302 HA3 GLY 45 1HA GLY 45 2.734 -15.859 3.271 303 H SER 46 H SER 46 2.665 -14.375 0.186 304 HA SER 46 HA SER 46 2.626 -11.730 1.278 305 HB2 SER 46 2HB SER 46 2.604 -11.221 -1.222 306 HB3 SER 46 1HB SER 46 4.032 -11.959 -0.496 307 HG SER 46 HG SER 46 1.962 -13.286 -1.983 308 H ALA 47 H ALA 47 1.212 -10.199 0.833 309 HA ALA 47 HA ALA 47 -1.464 -10.909 -0.107 310 HB1 ALA 47 1HB ALA 47 -0.679 -8.948 2.063 311 HB2 ALA 47 2HB ALA 47 -1.487 -10.489 2.328 312 HB3 ALA 47 3HB ALA 47 -2.317 -9.192 1.463 313 H LEU 48 H LEU 48 -2.517 -8.474 -0.635 314 HA LEU 48 HA LEU 48 -0.381 -7.100 -2.029 315 HB2 LEU 48 2HB LEU 48 -1.370 -7.106 -4.144 316 HB3 LEU 48 1HB LEU 48 -1.504 -8.748 -3.584 317 HG LEU 48 HG LEU 48 -3.747 -6.724 -3.748 318 HD11 LEU 48 1HD1 LEU 48 -2.969 -7.541 -5.890 319 HD12 LEU 48 2HD1 LEU 48 -4.590 -8.140 -5.525 320 HD13 LEU 48 3HD1 LEU 48 -3.192 -9.204 -5.350 321 HD21 LEU 48 3HD2 LEU 48 -3.854 -9.641 -2.973 322 HD22 LEU 48 1HD2 LEU 48 -5.247 -8.588 -3.211 323 HD23 LEU 48 2HD2 LEU 48 -4.129 -8.280 -1.883 324 H LEU 49 H LEU 49 -0.685 -5.009 -2.482 325 HA LEU 49 HA LEU 49 -2.932 -3.748 -1.087 326 HB2 LEU 49 2HB LEU 49 -1.511 -1.704 -0.992 327 HB3 LEU 49 1HB LEU 49 -0.864 -3.021 -0.042 328 HG LEU 49 HG LEU 49 0.213 -2.442 -2.808 329 HD11 LEU 49 1HD1 LEU 49 1.051 -1.148 -0.211 330 HD12 LEU 49 2HD1 LEU 49 0.329 -0.336 -1.610 331 HD13 LEU 49 3HD1 LEU 49 1.931 -1.050 -1.737 332 HD21 LEU 49 3HD2 LEU 49 1.439 -3.610 -0.310 333 HD22 LEU 49 1HD2 LEU 49 2.245 -3.417 -1.863 334 HD23 LEU 49 2HD2 LEU 49 0.889 -4.532 -1.708 335 H VAL 50 H VAL 50 -4.236 -2.559 -2.259 336 HA VAL 50 HA VAL 50 -3.553 -2.199 -5.082 337 HB VAL 50 HB VAL 50 -6.314 -2.385 -3.853 338 HG11 VAL 50 1HG1 VAL 50 -6.279 -1.061 -5.869 339 HG12 VAL 50 2HG1 VAL 50 -7.095 -2.597 -6.159 340 HG13 VAL 50 3HG1 VAL 50 -5.448 -2.354 -6.738 341 HG21 VAL 50 3HG2 VAL 50 -5.201 -4.554 -3.695 342 HG22 VAL 50 1HG2 VAL 50 -4.819 -4.497 -5.415 343 HG23 VAL 50 2HG2 VAL 50 -6.499 -4.601 -4.888 344 H VAL 51 H VAL 51 -3.188 -0.167 -5.551 345 HA VAL 51 HA VAL 51 -4.140 1.882 -3.717 346 HB VAL 51 HB VAL 51 -2.327 2.327 -6.147 347 HG11 VAL 51 1HG1 VAL 51 -3.350 4.260 -5.108 348 HG12 VAL 51 2HG1 VAL 51 -1.603 4.213 -4.873 349 HG13 VAL 51 3HG1 VAL 51 -2.680 3.777 -3.548 350 HG21 VAL 51 3HG2 VAL 51 -1.291 0.575 -4.758 351 HG22 VAL 51 1HG2 VAL 51 -1.474 1.600 -3.334 352 HG23 VAL 51 2HG2 VAL 51 -0.408 2.099 -4.650 353 H LYS 52 H LYS 52 -6.022 2.761 -4.134 354 HA LYS 52 HA LYS 52 -7.355 2.372 -6.656 355 HB2 LYS 52 2HB LYS 52 -8.144 4.167 -4.342 356 HB3 LYS 52 1HB LYS 52 -9.190 3.670 -5.657 357 HG2 LYS 52 2HG LYS 52 -8.000 1.842 -3.565 358 HG3 LYS 52 1HG LYS 52 -9.659 2.427 -3.603 359 HD2 LYS 52 2HD LYS 52 -8.384 0.697 -5.736 360 HD3 LYS 52 1HD LYS 52 -9.411 0.102 -4.440 361 HE2 LYS 52 2HE LYS 52 -10.248 2.077 -6.571 362 HE3 LYS 52 1HE LYS 52 -10.634 0.362 -6.562 363 HZ1 LYS 52 3HZ LYS 52 -12.452 1.706 -5.756 364 HZ2 LYS 52 1HZ LYS 52 -11.521 2.325 -4.501 365 HZ3 LYS 52 2HZ LYS 52 -11.940 0.679 -4.558 366 H ARG 53 H ARG 53 -5.705 4.892 -5.005 367 HA ARG 53 HA ARG 53 -4.841 6.207 -7.319 368 HB2 ARG 53 2HB ARG 53 -7.190 7.177 -7.126 369 HB3 ARG 53 1HB ARG 53 -6.761 7.736 -5.519 370 HG2 ARG 53 2HG ARG 53 -5.003 9.161 -6.485 371 HG3 ARG 53 1HG ARG 53 -5.453 8.595 -8.094 372 HD2 ARG 53 2HD ARG 53 -7.698 9.502 -7.785 373 HD3 ARG 53 1HD ARG 53 -7.247 10.066 -6.179 374 HE ARG 53 HE ARG 53 -5.438 11.191 -7.948 375 HH11 ARG 53 1HH1 ARG 53 -8.926 11.316 -7.366 376 HH12 ARG 53 2HH1 ARG 53 -9.125 12.869 -8.030 377 HH21 ARG 53 1HH2 ARG 53 -5.700 13.329 -8.810 378 HH22 ARG 53 2HH2 ARG 53 -7.232 14.054 -8.908 379 H GLY 54 H GLY 54 -2.869 6.965 -6.612 380 HA2 GLY 54 2HA GLY 54 -2.651 7.612 -3.798 381 HA3 GLY 54 1HA GLY 54 -1.788 6.189 -4.331 382 HA PRO 55 HA PRO 55 0.730 10.116 -4.684 383 HB2 PRO 55 2HB PRO 55 2.600 9.386 -2.838 384 HB3 PRO 55 1HB PRO 55 1.152 10.305 -2.435 385 HG2 PRO 55 2HG PRO 55 1.688 7.383 -2.121 386 HG3 PRO 55 1HG PRO 55 0.880 8.495 -1.003 387 HD2 PRO 55 2HD PRO 55 -0.474 6.801 -2.595 388 HD3 PRO 55 1HD PRO 55 -1.103 8.397 -2.148 389 H ASN 56 H ASN 56 1.662 6.784 -4.211 390 HA ASN 56 HA ASN 56 4.092 6.970 -5.752 391 HB2 ASN 56 2HB ASN 56 4.069 5.405 -3.919 392 HB3 ASN 56 1HB ASN 56 2.614 4.637 -4.522 393 HD21 ASN 56 1HD2 ASN 56 5.503 5.461 -6.476 394 HD22 ASN 56 2HD2 ASN 56 5.867 3.803 -6.821 395 H ALA 57 H ALA 57 0.998 5.236 -6.138 396 HA ALA 57 HA ALA 57 1.036 5.540 -8.967 397 HB1 ALA 57 1HB ALA 57 2.607 3.662 -8.690 398 HB2 ALA 57 2HB ALA 57 1.114 3.131 -9.457 399 HB3 ALA 57 3HB ALA 57 1.397 2.790 -7.748 400 H GLY 58 H GLY 58 -0.718 3.368 -9.416 401 HA2 GLY 58 2HA GLY 58 -2.962 3.598 -7.636 402 HA3 GLY 58 1HA GLY 58 -3.170 4.262 -9.262 403 H ALA 59 H ALA 59 -1.395 1.513 -8.030 404 HA ALA 59 HA ALA 59 -2.836 -0.279 -9.818 405 HB1 ALA 59 1HB ALA 59 0.170 -0.014 -9.555 406 HB2 ALA 59 2HB ALA 59 -0.783 0.393 -10.980 407 HB3 ALA 59 3HB ALA 59 -0.655 -1.285 -10.452 408 H ARG 60 H ARG 60 -1.568 -2.615 -9.116 409 HA ARG 60 HA ARG 60 -1.730 -2.498 -6.214 410 HB2 ARG 60 2HB ARG 60 -2.682 -4.755 -6.215 411 HB3 ARG 60 1HB ARG 60 -3.677 -3.593 -7.082 412 HG2 ARG 60 2HG ARG 60 -2.823 -4.465 -9.200 413 HG3 ARG 60 1HG ARG 60 -1.872 -5.658 -8.309 414 HD2 ARG 60 2HD ARG 60 -3.970 -6.525 -7.322 415 HD3 ARG 60 1HD ARG 60 -4.871 -5.378 -8.309 416 HE ARG 60 HE ARG 60 -3.322 -6.731 -10.066 417 HH11 ARG 60 1HH1 ARG 60 -5.787 -7.676 -7.696 418 HH12 ARG 60 2HH1 ARG 60 -6.288 -9.041 -8.560 419 HH21 ARG 60 1HH2 ARG 60 -4.052 -8.619 -11.269 420 HH22 ARG 60 2HH2 ARG 60 -5.327 -9.560 -10.655 421 H PHE 61 H PHE 61 -0.310 -3.612 -5.031 422 HA PHE 61 HA PHE 61 1.955 -4.792 -6.491 423 HB2 PHE 61 2HB PHE 61 2.132 -3.000 -4.052 424 HB3 PHE 61 1HB PHE 61 3.485 -3.747 -4.891 425 HD1 PHE 61 2HD PHE 61 4.095 -2.962 -7.164 426 HD2 PHE 61 1HD PHE 61 1.155 -0.987 -4.808 427 HE1 PHE 61 2HE PHE 61 4.277 -0.976 -8.600 428 HE2 PHE 61 1HE PHE 61 1.332 0.999 -6.242 429 HZ PHE 61 HZ PHE 61 2.898 1.007 -8.145 430 H LEU 62 H LEU 62 3.093 -6.389 -5.266 431 HA LEU 62 HA LEU 62 1.495 -7.537 -3.109 432 HB2 LEU 62 2HB LEU 62 3.350 -8.855 -5.100 433 HB3 LEU 62 1HB LEU 62 2.763 -9.665 -3.672 434 HG LEU 62 HG LEU 62 0.418 -9.343 -4.591 435 HD11 LEU 62 1HD1 LEU 62 1.889 -8.641 -7.121 436 HD12 LEU 62 2HD1 LEU 62 0.850 -7.569 -6.186 437 HD13 LEU 62 3HD1 LEU 62 0.162 -8.985 -6.987 438 HD21 LEU 62 3HD2 LEU 62 0.602 -11.232 -6.143 439 HD22 LEU 62 1HD2 LEU 62 1.551 -11.483 -4.679 440 HD23 LEU 62 2HD2 LEU 62 2.355 -11.021 -6.175 441 H LEU 63 H LEU 63 2.521 -8.028 -1.201 442 HA LEU 63 HA LEU 63 4.993 -6.655 -0.726 443 HB2 LEU 63 2HB LEU 63 3.388 -8.517 1.020 444 HB3 LEU 63 1HB LEU 63 4.935 -7.879 1.523 445 HG LEU 63 HG LEU 63 3.233 -6.622 2.589 446 HD11 LEU 63 1HD1 LEU 63 3.681 -4.357 1.860 447 HD12 LEU 63 2HD1 LEU 63 4.362 -4.964 0.357 448 HD13 LEU 63 3HD1 LEU 63 5.145 -5.338 1.894 449 HD21 LEU 63 3HD2 LEU 63 1.539 -5.343 1.348 450 HD22 LEU 63 1HD2 LEU 63 1.346 -7.091 1.158 451 HD23 LEU 63 2HD2 LEU 63 2.065 -6.136 -0.138 452 H ASP 64 H ASP 64 6.825 -7.318 -1.257 453 HA ASP 64 HA ASP 64 7.391 -10.197 -1.283 454 HB2 ASP 64 2HB ASP 64 6.750 -9.485 -3.539 455 HB3 ASP 64 1HB ASP 64 8.026 -8.277 -3.512 456 H GLN 65 H GLN 65 8.530 -6.929 -0.924 457 HA GLN 65 HA GLN 65 11.186 -7.913 -0.255 458 HB2 GLN 65 2HB GLN 65 11.028 -6.197 -2.012 459 HB3 GLN 65 1HB GLN 65 10.177 -5.147 -0.895 460 HG2 GLN 65 2HG GLN 65 12.185 -5.109 0.536 461 HG3 GLN 65 1HG GLN 65 13.035 -6.049 -0.694 462 HE21 GLN 65 1HE2 GLN 65 11.591 -3.035 0.079 463 HE22 GLN 65 2HE2 GLN 65 12.254 -2.119 -1.219 464 HA PRO 66 HA PRO 66 10.028 -7.712 4.075 465 HB2 PRO 66 2HB PRO 66 12.613 -6.702 4.812 466 HB3 PRO 66 1HB PRO 66 11.986 -8.340 4.994 467 HG2 PRO 66 2HG PRO 66 13.723 -7.209 2.903 468 HG3 PRO 66 1HG PRO 66 13.530 -8.891 3.410 469 HD2 PRO 66 2HD PRO 66 12.610 -7.985 1.069 470 HD3 PRO 66 1HD PRO 66 11.755 -9.249 1.975 471 H THR 67 H THR 67 12.177 -4.927 3.262 472 HA THR 67 HA THR 67 10.245 -3.290 4.730 473 HB THR 67 HB THR 67 13.119 -2.616 4.059 474 HG1 THR 67 1HG THR 67 13.675 -3.427 5.949 475 HG21 THR 67 3HG2 THR 67 11.682 -0.666 4.473 476 HG22 THR 67 1HG2 THR 67 12.839 -0.878 5.787 477 HG23 THR 67 2HG2 THR 67 11.160 -1.369 6.004 478 H THR 68 H THR 68 8.919 -2.217 3.421 479 HA THR 68 HA THR 68 9.957 -1.170 0.879 480 HB THR 68 HB THR 68 7.121 -1.907 1.688 481 HG1 THR 68 1HG THR 68 8.601 -3.700 1.250 482 HG21 THR 68 3HG2 THR 68 7.141 -0.056 0.089 483 HG22 THR 68 1HG2 THR 68 6.567 -1.522 -0.705 484 HG23 THR 68 2HG2 THR 68 8.219 -0.955 -0.971 485 H THR 69 H THR 69 10.219 1.096 1.054 486 HA THR 69 HA THR 69 8.582 2.284 3.139 487 HB THR 69 HB THR 69 10.941 2.317 3.762 488 HG1 THR 69 1HG THR 69 10.865 4.266 4.534 489 HG21 THR 69 3HG2 THR 69 11.388 3.978 1.278 490 HG22 THR 69 1HG2 THR 69 11.994 2.348 1.569 491 HG23 THR 69 2HG2 THR 69 12.584 3.694 2.545 492 H ALA 70 H ALA 70 7.184 3.761 2.655 493 HA ALA 70 HA ALA 70 7.139 4.792 -0.065 494 HB1 ALA 70 1HB ALA 70 4.985 4.770 2.051 495 HB2 ALA 70 2HB ALA 70 5.133 3.600 0.749 496 HB3 ALA 70 3HB ALA 70 4.788 5.292 0.376 497 H GLY 71 H GLY 71 8.153 6.716 -0.228 498 HA2 GLY 71 2HA GLY 71 7.262 8.944 1.171 499 HA3 GLY 71 1HA GLY 71 8.764 8.350 1.894 500 H ARG 72 H ARG 72 10.056 9.999 1.204 501 HA ARG 72 HA ARG 72 10.307 9.977 -1.667 502 HB2 ARG 72 2HB ARG 72 9.556 12.162 -0.855 503 HB3 ARG 72 1HB ARG 72 10.968 12.267 0.182 504 HG2 ARG 72 2HG ARG 72 12.429 12.437 -1.678 505 HG3 ARG 72 1HG ARG 72 11.131 12.041 -2.808 506 HD2 ARG 72 2HD ARG 72 9.995 14.103 -2.273 507 HD3 ARG 72 1HD ARG 72 11.208 14.483 -1.050 508 HE ARG 72 HE ARG 72 12.825 14.628 -2.822 509 HH11 ARG 72 1HH1 ARG 72 9.401 14.818 -3.864 510 HH12 ARG 72 2HH1 ARG 72 9.746 15.798 -5.195 511 HH21 ARG 72 1HH2 ARG 72 13.244 15.999 -4.682 512 HH22 ARG 72 2HH2 ARG 72 11.958 16.472 -5.683 513 H HIS 73 H HIS 73 12.675 11.241 0.716 514 HA HIS 73 HA HIS 73 14.865 10.945 0.872 515 HB2 HIS 73 2HB HIS 73 14.182 8.074 0.149 516 HB3 HIS 73 1HB HIS 73 15.787 8.645 0.565 517 HD1 HIS 73 1HD HIS 73 13.816 6.502 2.098 518 HD2 HIS 73 2HD HIS 73 14.989 10.310 3.274 519 HE1 HIS 73 1HE HIS 73 13.622 6.534 4.582 520 HA PRO 74 HA PRO 74 16.735 11.166 -3.246 521 HB2 PRO 74 2HB PRO 74 19.199 10.096 -2.000 522 HB3 PRO 74 1HB PRO 74 18.973 11.626 -2.852 523 HG2 PRO 74 2HG PRO 74 19.319 11.543 -0.200 524 HG3 PRO 74 1HG PRO 74 18.232 12.722 -0.955 525 HD2 PRO 74 2HD PRO 74 17.580 10.182 0.475 526 HD3 PRO 74 1HD PRO 74 16.749 11.752 0.522 527 H GLU 75 H GLU 75 16.861 8.519 -1.087 528 HA GLU 75 HA GLU 75 17.366 6.536 -3.202 529 HB2 GLU 75 2HB GLU 75 17.586 6.160 -0.215 530 HB3 GLU 75 1HB GLU 75 18.189 5.097 -1.476 531 HG2 GLU 75 2HG GLU 75 19.229 7.863 -0.916 532 HG3 GLU 75 1HG GLU 75 19.963 6.380 -0.327 533 H SER 76 H SER 76 15.010 7.044 -3.590 534 HA SER 76 HA SER 76 12.998 6.283 -1.716 535 HB2 SER 76 2HB SER 76 12.662 6.426 -4.714 536 HB3 SER 76 1HB SER 76 11.487 6.786 -3.442 537 HG SER 76 HG SER 76 12.912 8.508 -2.820 538 H ASP 77 H ASP 77 12.147 4.191 -1.344 539 HA ASP 77 HA ASP 77 13.142 1.989 -2.910 540 HB2 ASP 77 2HB ASP 77 12.605 1.773 -0.480 541 HB3 ASP 77 1HB ASP 77 10.909 2.058 -0.856 542 H ILE 78 H ILE 78 10.004 3.499 -2.337 543 HA ILE 78 HA ILE 78 9.400 3.047 -5.139 544 HB ILE 78 HB ILE 78 6.969 3.040 -4.573 545 HG12 ILE 78 2HG1 ILE 78 7.857 2.738 -1.689 546 HG13 ILE 78 1HG1 ILE 78 7.148 4.194 -2.378 547 HG21 ILE 78 1HG2 ILE 78 8.055 0.921 -4.958 548 HG22 ILE 78 2HG2 ILE 78 6.824 0.743 -3.709 549 HG23 ILE 78 3HG2 ILE 78 8.526 0.820 -3.263 550 HD11 ILE 78 3HD1 ILE 78 5.087 2.994 -2.822 551 HD12 ILE 78 1HD1 ILE 78 5.518 2.916 -1.117 552 HD13 ILE 78 2HD1 ILE 78 5.793 1.517 -2.161 553 H PHE 79 H PHE 79 8.512 4.857 -6.154 554 HA PHE 79 HA PHE 79 9.225 7.240 -4.671 555 HB2 PHE 79 2HB PHE 79 9.440 8.388 -6.789 556 HB3 PHE 79 1HB PHE 79 10.320 6.872 -6.871 557 HD1 PHE 79 2HD PHE 79 9.072 4.881 -8.045 558 HD2 PHE 79 1HD PHE 79 7.933 8.964 -8.444 559 HE1 PHE 79 2HE PHE 79 7.848 4.336 -10.103 560 HE2 PHE 79 1HE PHE 79 6.708 8.426 -10.494 561 HZ PHE 79 HZ PHE 79 6.663 6.106 -11.333 562 H LEU 80 H LEU 80 7.775 8.435 -3.797 563 HA LEU 80 HA LEU 80 5.097 8.372 -4.819 564 HB2 LEU 80 2HB LEU 80 6.344 9.546 -2.354 565 HB3 LEU 80 1HB LEU 80 4.727 10.038 -2.841 566 HG LEU 80 HG LEU 80 3.969 7.674 -2.646 567 HD11 LEU 80 1HD1 LEU 80 6.697 7.096 -1.535 568 HD12 LEU 80 2HD1 LEU 80 6.065 6.536 -3.081 569 HD13 LEU 80 3HD1 LEU 80 5.325 5.988 -1.577 570 HD21 LEU 80 3HD2 LEU 80 5.285 8.731 -0.154 571 HD22 LEU 80 1HD2 LEU 80 4.020 7.506 -0.211 572 HD23 LEU 80 2HD2 LEU 80 3.675 9.149 -0.746 573 H ASP 81 H ASP 81 4.305 9.726 -6.122 574 HA ASP 81 HA ASP 81 6.230 11.533 -7.386 575 HB2 ASP 81 2HB ASP 81 5.574 9.776 -8.802 576 HB3 ASP 81 1HB ASP 81 3.885 9.927 -8.379 577 H ASP 82 H ASP 82 3.646 11.785 -5.391 578 HA ASP 82 HA ASP 82 2.247 13.960 -6.677 579 HB2 ASP 82 2HB ASP 82 0.873 13.967 -4.701 580 HB3 ASP 82 1HB ASP 82 1.168 12.287 -5.156 581 H VAL 83 H VAL 83 1.802 15.746 -4.623 582 HA VAL 83 HA VAL 83 4.482 16.854 -4.148 583 HB VAL 83 HB VAL 83 3.233 17.938 -6.035 584 HG11 VAL 83 1HG1 VAL 83 0.991 17.841 -5.227 585 HG12 VAL 83 2HG1 VAL 83 1.428 19.519 -5.552 586 HG13 VAL 83 3HG1 VAL 83 1.380 18.924 -3.893 587 HG21 VAL 83 3HG2 VAL 83 3.927 19.748 -3.717 588 HG22 VAL 83 1HG2 VAL 83 3.748 20.272 -5.391 589 HG23 VAL 83 2HG2 VAL 83 5.038 19.151 -4.944 590 H THR 84 H THR 84 2.106 15.483 -2.453 591 HA THR 84 HA THR 84 2.334 17.429 -0.290 592 HB THR 84 HB THR 84 -0.003 17.458 -1.031 593 HG1 THR 84 1HG THR 84 0.360 15.964 1.331 594 HG21 THR 84 3HG2 THR 84 -1.426 15.441 -0.970 595 HG22 THR 84 1HG2 THR 84 -0.014 14.463 -0.566 596 HG23 THR 84 2HG2 THR 84 -0.115 15.261 -2.136 597 H VAL 85 H VAL 85 3.832 15.103 -1.222 598 HA VAL 85 HA VAL 85 3.385 13.021 0.654 599 HB VAL 85 HB VAL 85 4.130 12.440 -1.562 600 HG11 VAL 85 1HG1 VAL 85 6.360 13.018 -2.415 601 HG12 VAL 85 2HG1 VAL 85 6.611 14.068 -1.022 602 HG13 VAL 85 3HG1 VAL 85 5.341 14.439 -2.189 603 HG21 VAL 85 3HG2 VAL 85 6.112 11.065 -1.041 604 HG22 VAL 85 1HG2 VAL 85 4.860 10.962 0.200 605 HG23 VAL 85 2HG2 VAL 85 6.292 11.951 0.471 606 H SER 86 H SER 86 4.280 12.706 2.507 607 HA SER 86 HA SER 86 5.977 14.578 3.790 608 HB2 SER 86 2HB SER 86 4.312 13.228 5.013 609 HB3 SER 86 1HB SER 86 5.127 11.750 4.521 610 HG SER 86 HG SER 86 6.186 11.971 6.276 611 H ARG 87 H ARG 87 8.145 14.075 4.545 612 HA ARG 87 HA ARG 87 9.902 13.165 2.596 613 HB2 ARG 87 2HB ARG 87 11.628 13.109 4.431 614 HB3 ARG 87 1HB ARG 87 10.734 14.614 4.307 615 HG2 ARG 87 2HG ARG 87 9.311 13.870 6.198 616 HG3 ARG 87 1HG ARG 87 10.317 12.429 6.334 617 HD2 ARG 87 2HD ARG 87 11.269 15.274 6.616 618 HD3 ARG 87 1HD ARG 87 10.974 14.150 7.938 619 HE ARG 87 HE ARG 87 12.902 13.423 5.873 620 HH11 ARG 87 1HH1 ARG 87 12.311 14.387 9.222 621 HH12 ARG 87 2HH1 ARG 87 13.889 14.031 9.752 622 HH21 ARG 87 1HH2 ARG 87 15.035 12.925 6.588 623 HH22 ARG 87 2HH2 ARG 87 15.490 13.147 8.209 624 H ARG 88 H ARG 88 8.623 11.427 5.342 625 HA ARG 88 HA ARG 88 8.794 9.010 3.769 626 HB2 ARG 88 2HB ARG 88 9.424 9.086 6.760 627 HB3 ARG 88 1HB ARG 88 9.222 7.644 5.802 628 HG2 ARG 88 2HG ARG 88 11.513 7.825 6.106 629 HG3 ARG 88 1HG ARG 88 11.253 8.448 4.481 630 HD2 ARG 88 2HD ARG 88 12.833 9.837 5.707 631 HD3 ARG 88 1HD ARG 88 11.359 10.734 5.346 632 HE ARG 88 HE ARG 88 10.678 10.489 7.601 633 HH11 ARG 88 1HH1 ARG 88 14.057 9.593 7.003 634 HH12 ARG 88 2HH1 ARG 88 14.527 9.692 8.636 635 HH21 ARG 88 1HH2 ARG 88 11.333 10.662 9.870 636 HH22 ARG 88 2HH2 ARG 88 12.938 10.328 10.295 637 H HIS 89 H HIS 89 6.791 8.041 3.814 638 HA HIS 89 HA HIS 89 4.928 9.460 5.555 639 HB2 HIS 89 2HB HIS 89 4.578 9.746 3.090 640 HB3 HIS 89 1HB HIS 89 4.279 8.015 2.975 641 HD2 HIS 89 2HD HIS 89 1.828 7.144 3.975 642 HE1 HIS 89 1HE HIS 89 0.310 11.025 4.652 643 HE2 HIS 89 2HE HIS 89 0.016 8.542 5.083 644 H ALA 90 H ALA 90 5.202 6.250 4.012 645 HA ALA 90 HA ALA 90 4.364 5.152 6.577 646 HB1 ALA 90 1HB ALA 90 3.108 4.423 3.930 647 HB2 ALA 90 2HB ALA 90 2.334 5.341 5.223 648 HB3 ALA 90 3HB ALA 90 2.776 3.653 5.480 649 H GLU 91 H GLU 91 5.659 3.604 7.143 650 HA GLU 91 HA GLU 91 7.271 2.365 5.040 651 HB2 GLU 91 2HB GLU 91 8.443 3.269 7.079 652 HB3 GLU 91 1HB GLU 91 7.581 2.080 8.045 653 HG2 GLU 91 2HG GLU 91 8.653 0.276 6.774 654 HG3 GLU 91 1HG GLU 91 9.524 1.470 5.821 655 H PHE 92 H PHE 92 6.810 0.397 4.373 656 HA PHE 92 HA PHE 92 4.789 -1.128 5.832 657 HB2 PHE 92 2HB PHE 92 5.661 -1.278 2.931 658 HB3 PHE 92 1HB PHE 92 4.449 -2.314 3.671 659 HD1 PHE 92 1HD PHE 92 2.258 -1.403 4.273 660 HD2 PHE 92 2HD PHE 92 5.176 0.969 2.283 661 HE1 PHE 92 1HE PHE 92 0.514 0.222 3.656 662 HE2 PHE 92 2HE PHE 92 3.441 2.595 1.670 663 HZ PHE 92 HZ PHE 92 1.106 2.223 2.354 664 H ARG 93 H ARG 93 5.667 -2.624 7.005 665 HA ARG 93 HA ARG 93 8.161 -3.850 6.083 666 HB2 ARG 93 2HB ARG 93 8.246 -2.487 8.184 667 HB3 ARG 93 1HB ARG 93 7.103 -3.613 8.897 668 HG2 ARG 93 2HG ARG 93 8.702 -5.419 8.641 669 HG3 ARG 93 1HG ARG 93 9.838 -4.294 7.882 670 HD2 ARG 93 2HD ARG 93 8.780 -4.135 10.698 671 HD3 ARG 93 1HD ARG 93 10.405 -4.622 10.219 672 HE ARG 93 HE ARG 93 9.871 -2.064 9.176 673 HH11 ARG 93 1HH1 ARG 93 10.522 -3.623 12.274 674 HH12 ARG 93 2HH1 ARG 93 11.077 -2.219 13.034 675 HH21 ARG 93 1HH2 ARG 93 10.632 -0.170 10.132 676 HH22 ARG 93 2HH2 ARG 93 11.163 -0.133 11.764 677 H ILE 94 H ILE 94 8.015 -5.964 5.635 678 HA ILE 94 HA ILE 94 5.618 -7.305 6.605 679 HB ILE 94 HB ILE 94 5.410 -6.971 4.214 680 HG12 ILE 94 2HG1 ILE 94 4.648 -9.231 5.173 681 HG13 ILE 94 1HG1 ILE 94 4.824 -9.138 3.434 682 HG21 ILE 94 1HG2 ILE 94 8.022 -8.365 3.840 683 HG22 ILE 94 2HG2 ILE 94 7.671 -6.658 3.568 684 HG23 ILE 94 3HG2 ILE 94 6.924 -7.888 2.545 685 HD11 ILE 94 3HD1 ILE 94 5.614 -11.267 4.302 686 HD12 ILE 94 1HD1 ILE 94 6.757 -10.437 5.360 687 HD13 ILE 94 2HD1 ILE 94 6.956 -10.360 3.608 688 H ASN 95 H ASN 95 5.958 -8.705 8.023 689 HA ASN 95 HA ASN 95 8.430 -10.245 7.985 690 HB2 ASN 95 2HB ASN 95 8.029 -8.965 10.107 691 HB3 ASN 95 1HB ASN 95 6.480 -9.786 10.276 692 HD21 ASN 95 1HD2 ASN 95 7.030 -10.784 12.231 693 HD22 ASN 95 2HD2 ASN 95 8.217 -12.026 12.325 694 H GLU 96 H GLU 96 8.214 -12.424 8.070 695 HA GLU 96 HA GLU 96 6.232 -13.646 6.613 696 HB2 GLU 96 2HB GLU 96 7.136 -15.770 7.600 697 HB3 GLU 96 1HB GLU 96 8.356 -14.689 6.940 698 HG2 GLU 96 2HG GLU 96 8.784 -13.860 9.239 699 HG3 GLU 96 1HG GLU 96 7.667 -15.084 9.830 700 H GLY 97 H GLY 97 6.222 -12.895 9.997 701 HA2 GLY 97 2HA GLY 97 3.949 -14.584 10.550 702 HA3 GLY 97 1HA GLY 97 4.734 -13.502 11.690 703 H GLU 98 H GLU 98 4.546 -11.036 10.392 704 HA GLU 98 HA GLU 98 1.716 -10.636 9.988 705 HB2 GLU 98 2HB GLU 98 3.286 -9.381 12.235 706 HB3 GLU 98 1HB GLU 98 1.713 -8.836 11.697 707 HG2 GLU 98 2HG GLU 98 0.654 -10.797 12.453 708 HG3 GLU 98 1HG GLU 98 2.186 -11.645 12.632 709 H PHE 99 H PHE 99 1.254 -8.614 9.125 710 HA PHE 99 HA PHE 99 3.462 -7.287 7.748 711 HB2 PHE 99 2HB PHE 99 0.454 -7.098 7.488 712 HB3 PHE 99 1HB PHE 99 1.576 -6.153 6.518 713 HD1 PHE 99 1HD PHE 99 0.430 -9.605 7.266 714 HD2 PHE 99 2HD PHE 99 2.434 -7.049 4.529 715 HE1 PHE 99 1HE PHE 99 0.394 -11.394 5.589 716 HE2 PHE 99 2HE PHE 99 2.406 -8.847 2.844 717 HZ PHE 99 HZ PHE 99 1.386 -11.016 3.373 718 H GLU 100 H GLU 100 4.210 -5.355 8.570 719 HA GLU 100 HA GLU 100 2.483 -3.986 10.512 720 HB2 GLU 100 2HB GLU 100 4.529 -5.027 11.510 721 HB3 GLU 100 1HB GLU 100 5.514 -4.034 10.450 722 HG2 GLU 100 2HG GLU 100 4.659 -2.011 11.535 723 HG3 GLU 100 1HG GLU 100 3.643 -2.995 12.580 724 H VAL 101 H VAL 101 2.078 -1.894 10.158 725 HA VAL 101 HA VAL 101 3.650 -0.546 8.111 726 HB VAL 101 HB VAL 101 1.478 -1.119 7.097 727 HG11 VAL 101 1HG1 VAL 101 -0.633 -0.193 7.916 728 HG12 VAL 101 2HG1 VAL 101 0.208 0.458 9.320 729 HG13 VAL 101 3HG1 VAL 101 0.103 -1.288 9.090 730 HG21 VAL 101 3HG2 VAL 101 0.756 1.131 6.399 731 HG22 VAL 101 1HG2 VAL 101 2.512 0.960 6.395 732 HG23 VAL 101 2HG2 VAL 101 1.711 1.826 7.707 733 H VAL 102 H VAL 102 4.490 1.260 8.731 734 HA VAL 102 HA VAL 102 3.520 2.458 11.250 735 HB VAL 102 HB VAL 102 6.330 2.601 10.127 736 HG11 VAL 102 1HG1 VAL 102 6.934 3.551 12.304 737 HG12 VAL 102 2HG1 VAL 102 5.244 3.494 12.801 738 HG13 VAL 102 3HG1 VAL 102 5.735 4.550 11.478 739 HG21 VAL 102 3HG2 VAL 102 5.822 0.344 10.868 740 HG22 VAL 102 1HG2 VAL 102 5.261 0.964 12.424 741 HG23 VAL 102 2HG2 VAL 102 6.956 1.135 11.969 742 H ASP 103 H ASP 103 2.668 4.422 11.080 743 HA ASP 103 HA ASP 103 3.073 5.930 8.653 744 HB2 ASP 103 2HB ASP 103 0.789 5.843 9.367 745 HB3 ASP 103 1HB ASP 103 1.220 6.342 11.000 746 H VAL 104 H VAL 104 4.654 7.183 8.551 747 HA VAL 104 HA VAL 104 5.351 8.808 10.879 748 HB VAL 104 HB VAL 104 7.663 9.063 9.802 749 HG11 VAL 104 1HG1 VAL 104 6.848 6.289 10.672 750 HG12 VAL 104 2HG1 VAL 104 7.328 7.610 11.736 751 HG13 VAL 104 3HG1 VAL 104 8.501 6.901 10.625 752 HG21 VAL 104 3HG2 VAL 104 8.367 7.308 8.235 753 HG22 VAL 104 1HG2 VAL 104 7.086 8.308 7.552 754 HG23 VAL 104 2HG2 VAL 104 6.713 6.701 8.179 755 H GLY 105 H GLY 105 3.522 8.875 8.415 756 HA2 GLY 105 2HA GLY 105 4.319 11.494 7.401 757 HA3 GLY 105 1HA GLY 105 3.281 10.339 6.562 758 H SER 106 H SER 106 3.132 10.977 9.978 759 HA SER 106 HA SER 106 0.385 11.385 10.166 760 HB2 SER 106 2HB SER 106 2.367 12.536 12.070 761 HB3 SER 106 1HB SER 106 0.842 11.723 12.424 762 HG SER 106 HG SER 106 1.899 9.812 11.415 763 H LEU 107 H LEU 107 2.803 13.367 9.086 764 HA LEU 107 HA LEU 107 2.117 15.990 9.653 765 HB2 LEU 107 2HB LEU 107 4.146 15.104 8.518 766 HB3 LEU 107 1HB LEU 107 3.172 14.741 7.122 767 HG LEU 107 HG LEU 107 2.774 17.144 6.771 768 HD11 LEU 107 1HD1 LEU 107 2.990 17.892 9.084 769 HD12 LEU 107 2HD1 LEU 107 4.106 18.762 8.032 770 HD13 LEU 107 3HD1 LEU 107 4.698 17.462 9.066 771 HD21 LEU 107 3HD2 LEU 107 4.625 15.976 5.686 772 HD22 LEU 107 1HD2 LEU 107 5.670 16.386 7.039 773 HD23 LEU 107 2HD2 LEU 107 5.016 17.664 6.013 774 H ASN 108 H ASN 108 0.978 13.660 7.286 775 HA ASN 108 HA ASN 108 -1.209 15.464 6.585 776 HB2 ASN 108 2HB ASN 108 -0.095 13.152 4.976 777 HB3 ASN 108 1HB ASN 108 -1.477 14.138 4.500 778 HD21 ASN 108 1HD2 ASN 108 -1.116 16.323 3.944 779 HD22 ASN 108 2HD2 ASN 108 0.447 16.882 3.479 780 H GLY 109 H GLY 109 -0.366 12.128 7.395 781 HA2 GLY 109 2HA GLY 109 -1.619 11.134 9.195 782 HA3 GLY 109 1HA GLY 109 -3.044 11.946 8.585 783 H THR 110 H THR 110 -1.651 9.064 8.912 784 HA THR 110 HA THR 110 -3.030 7.959 6.593 785 HB THR 110 HB THR 110 -0.941 6.744 8.441 786 HG1 THR 110 1HG THR 110 0.324 7.772 7.190 787 HG21 THR 110 3HG2 THR 110 -0.891 4.892 6.796 788 HG22 THR 110 1HG2 THR 110 -2.244 5.631 5.942 789 HG23 THR 110 2HG2 THR 110 -2.467 5.028 7.583 790 H TYR 111 H TYR 111 -5.003 7.088 7.030 791 HA TYR 111 HA TYR 111 -5.378 6.183 9.749 792 HB2 TYR 111 2HB TYR 111 -7.723 7.002 9.803 793 HB3 TYR 111 1HB TYR 111 -6.496 8.239 9.832 794 HD1 TYR 111 2HD TYR 111 -9.110 6.649 7.749 795 HD2 TYR 111 1HD TYR 111 -6.493 9.972 8.217 796 HE1 TYR 111 2HE TYR 111 -10.389 7.895 6.051 797 HE2 TYR 111 1HE TYR 111 -7.772 11.225 6.538 798 HH TYR 111 HH TYR 111 -10.807 10.060 5.320 799 H VAL 112 H VAL 112 -6.475 4.497 10.251 800 HA VAL 112 HA VAL 112 -7.292 2.787 8.011 801 HB VAL 112 HB VAL 112 -6.800 0.821 9.360 802 HG11 VAL 112 1HG1 VAL 112 -4.495 2.739 9.543 803 HG12 VAL 112 2HG1 VAL 112 -4.919 1.736 8.159 804 HG13 VAL 112 3HG1 VAL 112 -4.385 0.982 9.662 805 HG21 VAL 112 3HG2 VAL 112 -6.048 2.701 11.605 806 HG22 VAL 112 1HG2 VAL 112 -5.812 0.950 11.616 807 HG23 VAL 112 2HG2 VAL 112 -7.440 1.618 11.560 808 H ASN 113 H ASN 113 -9.177 1.803 8.041 809 HA ASN 113 HA ASN 113 -11.407 1.871 8.117 810 HB2 ASN 113 2HB ASN 113 -10.988 2.203 11.116 811 HB3 ASN 113 1HB ASN 113 -12.560 1.942 10.379 812 HD21 ASN 113 1HD2 ASN 113 -11.324 -0.002 8.435 813 HD22 ASN 113 2HD2 ASN 113 -11.066 -1.417 9.296 814 H ARG 114 H ARG 114 -10.990 4.063 10.751 815 HA ARG 114 HA ARG 114 -11.648 6.370 9.063 816 HB2 ARG 114 2HB ARG 114 -13.056 5.567 11.614 817 HB3 ARG 114 1HB ARG 114 -13.134 7.177 10.934 818 HG2 ARG 114 2HG ARG 114 -14.037 4.700 9.487 819 HG3 ARG 114 1HG ARG 114 -15.100 5.739 10.437 820 HD2 ARG 114 2HD ARG 114 -13.487 6.556 8.024 821 HD3 ARG 114 1HD ARG 114 -15.234 6.322 8.090 822 HE ARG 114 HE ARG 114 -14.744 8.150 10.028 823 HH11 ARG 114 1HH1 ARG 114 -14.035 8.032 6.554 824 HH12 ARG 114 2HH1 ARG 114 -14.123 9.714 6.357 825 HH21 ARG 114 1HH2 ARG 114 -14.818 10.467 9.729 826 HH22 ARG 114 2HH2 ARG 114 -14.563 11.134 8.199 827 H GLU 115 H GLU 115 -9.640 4.984 11.413 828 HA GLU 115 HA GLU 115 -9.272 7.562 12.789 829 HB2 GLU 115 2HB GLU 115 -9.571 4.883 13.851 830 HB3 GLU 115 1HB GLU 115 -8.150 5.693 14.478 831 HG2 GLU 115 2HG GLU 115 -10.209 5.950 15.856 832 HG3 GLU 115 1HG GLU 115 -9.445 7.458 15.377 833 HA PRO 116 HA PRO 116 -5.045 7.594 11.315 834 HB2 PRO 116 2HB PRO 116 -4.664 9.558 13.495 835 HB3 PRO 116 1HB PRO 116 -4.401 9.758 11.761 836 HG2 PRO 116 2HG PRO 116 -6.457 10.943 12.991 837 HG3 PRO 116 1HG PRO 116 -6.612 10.297 11.348 838 HD2 PRO 116 2HD PRO 116 -7.550 9.126 13.941 839 HD3 PRO 116 1HD PRO 116 -8.355 9.188 12.354 840 H ARG 117 H ARG 117 -3.313 6.463 11.972 841 HA ARG 117 HA ARG 117 -3.081 5.757 14.816 842 HB2 ARG 117 2HB ARG 117 -2.874 3.859 12.471 843 HB3 ARG 117 1HB ARG 117 -2.425 3.462 14.117 844 HG2 ARG 117 2HG ARG 117 -5.193 4.203 13.195 845 HG3 ARG 117 1HG ARG 117 -4.613 2.566 13.505 846 HD2 ARG 117 2HD ARG 117 -4.149 3.238 15.848 847 HD3 ARG 117 1HD ARG 117 -4.849 4.812 15.496 848 HE ARG 117 HE ARG 117 -6.823 3.201 14.764 849 HH11 ARG 117 1HH1 ARG 117 -4.832 3.166 17.685 850 HH12 ARG 117 2HH1 ARG 117 -6.091 2.610 18.691 851 HH21 ARG 117 1HH2 ARG 117 -8.559 2.409 16.171 852 HH22 ARG 117 2HH2 ARG 117 -8.211 2.208 17.827 853 H ASN 118 H ASN 118 -0.930 4.936 15.325 854 HA ASN 118 HA ASN 118 1.124 6.333 13.795 855 HB2 ASN 118 2HB ASN 118 1.107 6.604 16.254 856 HB3 ASN 118 1HB ASN 118 1.286 4.866 16.444 857 HD21 ASN 118 1HD2 ASN 118 3.319 3.919 16.108 858 HD22 ASN 118 2HD2 ASN 118 4.737 4.851 15.911 859 H ALA 119 H ALA 119 0.569 3.113 15.213 860 HA ALA 119 HA ALA 119 2.022 1.992 12.940 861 HB1 ALA 119 1HB ALA 119 3.545 1.993 14.861 862 HB2 ALA 119 2HB ALA 119 3.078 0.349 14.429 863 HB3 ALA 119 3HB ALA 119 2.341 1.140 15.824 864 H GLN 120 H GLN 120 1.136 0.165 12.159 865 HA GLN 120 HA GLN 120 -1.109 -0.968 13.596 866 HB2 GLN 120 2HB GLN 120 -1.264 0.457 11.034 867 HB3 GLN 120 1HB GLN 120 -2.117 -1.077 11.124 868 HG2 GLN 120 2HG GLN 120 -2.488 1.279 12.961 869 HG3 GLN 120 1HG GLN 120 -3.563 0.721 11.663 870 HE21 GLN 120 1HE2 GLN 120 -4.776 -1.136 11.937 871 HE22 GLN 120 2HE2 GLN 120 -4.993 -1.868 13.460 872 H VAL 121 H VAL 121 -1.650 -2.942 13.099 873 HA VAL 121 HA VAL 121 0.330 -4.486 11.621 874 HB VAL 121 HB VAL 121 -2.092 -5.506 13.174 875 HG11 VAL 121 1HG1 VAL 121 0.381 -6.943 12.205 876 HG12 VAL 121 2HG1 VAL 121 -1.227 -7.070 11.504 877 HG13 VAL 121 3HG1 VAL 121 -0.927 -7.665 13.140 878 HG21 VAL 121 3HG2 VAL 121 -0.523 -6.092 14.987 879 HG22 VAL 121 1HG2 VAL 121 -0.605 -4.348 14.717 880 HG23 VAL 121 2HG2 VAL 121 0.770 -5.273 14.111 881 H MET 122 H MET 122 -0.058 -4.457 9.587 882 HA MET 122 HA MET 122 -2.192 -3.269 8.281 883 HB2 MET 122 2HB MET 122 0.187 -3.849 7.475 884 HB3 MET 122 1HB MET 122 -0.486 -5.409 7.048 885 HG2 MET 122 2HG MET 122 -0.407 -4.042 5.104 886 HG3 MET 122 1HG MET 122 -2.091 -4.273 5.570 887 HE1 MET 122 3HE MET 122 -1.853 -0.610 4.049 888 HE2 MET 122 1HE MET 122 -2.584 -2.204 3.865 889 HE3 MET 122 2HE MET 122 -0.855 -1.987 3.583 890 H GLN 123 H GLN 123 -4.207 -3.927 7.877 891 HA GLN 123 HA GLN 123 -4.847 -6.712 8.475 892 HB2 GLN 123 2HB GLN 123 -5.825 -5.082 9.984 893 HB3 GLN 123 1HB GLN 123 -6.533 -4.221 8.633 894 HG2 GLN 123 2HG GLN 123 -8.004 -6.091 8.175 895 HG3 GLN 123 1HG GLN 123 -7.243 -7.035 9.455 896 HE21 GLN 123 1HE2 GLN 123 -9.199 -7.249 10.552 897 HE22 GLN 123 2HE2 GLN 123 -9.880 -5.939 11.433 898 H THR 124 H THR 124 -5.798 -7.985 7.038 899 HA THR 124 HA THR 124 -5.976 -7.171 4.333 900 HB THR 124 HB THR 124 -6.842 -9.655 4.327 901 HG1 THR 124 1HG THR 124 -6.403 -10.735 6.188 902 HG21 THR 124 3HG2 THR 124 -4.624 -8.911 3.487 903 HG22 THR 124 1HG2 THR 124 -4.514 -10.446 4.349 904 HG23 THR 124 2HG2 THR 124 -4.008 -8.958 5.140 905 H GLY 125 H GLY 125 -7.753 -6.175 3.588 906 HA2 GLY 125 2HA GLY 125 -10.054 -6.688 2.945 907 HA3 GLY 125 1HA GLY 125 -10.357 -7.049 4.636 908 H ASP 126 H ASP 126 -8.347 -4.492 4.814 909 HA ASP 126 HA ASP 126 -10.670 -2.705 4.897 910 HB2 ASP 126 2HB ASP 126 -9.602 -3.080 7.115 911 HB3 ASP 126 1HB ASP 126 -8.106 -2.393 6.489 912 H GLU 127 H GLU 127 -10.324 -0.504 4.495 913 HA GLU 127 HA GLU 127 -8.248 -0.038 2.506 914 HB2 GLU 127 2HB GLU 127 -9.857 1.671 1.477 915 HB3 GLU 127 1HB GLU 127 -10.231 -0.022 1.209 916 HG2 GLU 127 2HG GLU 127 -11.860 0.063 3.010 917 HG3 GLU 127 1HG GLU 127 -11.422 1.752 3.264 918 H ILE 128 H ILE 128 -6.961 1.444 2.871 919 HA ILE 128 HA ILE 128 -7.240 3.041 5.326 920 HB ILE 128 HB ILE 128 -4.780 1.863 4.006 921 HG12 ILE 128 2HG1 ILE 128 -6.179 1.073 6.575 922 HG13 ILE 128 1HG1 ILE 128 -6.268 0.196 5.057 923 HG21 ILE 128 1HG2 ILE 128 -3.569 2.583 6.026 924 HG22 ILE 128 2HG2 ILE 128 -5.031 3.386 6.600 925 HG23 ILE 128 3HG2 ILE 128 -4.239 3.948 5.129 926 HD11 ILE 128 3HD1 ILE 128 -3.771 0.634 6.682 927 HD12 ILE 128 1HD1 ILE 128 -3.885 -0.273 5.176 928 HD13 ILE 128 2HD1 ILE 128 -4.721 -0.851 6.617 929 H GLN 129 H GLN 129 -7.021 5.204 5.086 930 HA GLN 129 HA GLN 129 -6.194 6.104 2.458 931 HB2 GLN 129 2HB GLN 129 -8.334 7.010 3.037 932 HB3 GLN 129 1HB GLN 129 -7.731 7.571 4.594 933 HG2 GLN 129 2HG GLN 129 -6.423 9.264 3.599 934 HG3 GLN 129 1HG GLN 129 -6.608 8.571 1.993 935 HE21 GLN 129 1HE2 GLN 129 -7.143 11.228 3.076 936 HE22 GLN 129 2HE2 GLN 129 -8.798 11.566 2.733 937 H ILE 130 H ILE 130 -4.431 7.001 2.083 938 HA ILE 130 HA ILE 130 -2.680 7.802 4.273 939 HB ILE 130 HB ILE 130 -0.830 7.548 2.516 940 HG12 ILE 130 2HG1 ILE 130 -2.995 6.015 1.035 941 HG13 ILE 130 1HG1 ILE 130 -2.250 7.516 0.498 942 HG21 ILE 130 1HG2 ILE 130 -2.319 5.098 3.419 943 HG22 ILE 130 2HG2 ILE 130 -1.028 5.951 4.275 944 HG23 ILE 130 3HG2 ILE 130 -0.679 5.095 2.776 945 HD11 ILE 130 3HD1 ILE 130 -0.858 4.865 0.821 946 HD12 ILE 130 1HD1 ILE 130 -0.109 6.365 0.272 947 HD13 ILE 130 2HD1 ILE 130 -1.362 5.599 -0.703 948 H GLY 131 H GLY 131 -3.014 9.906 4.573 949 HA2 GLY 131 2HA GLY 131 -2.946 12.147 4.138 950 HA3 GLY 131 1HA GLY 131 -2.352 11.773 2.522 951 H LYS 132 H LYS 132 -3.718 11.815 0.854 952 HA LYS 132 HA LYS 132 -6.590 12.082 1.418 953 HB2 LYS 132 2HB LYS 132 -4.980 13.656 -0.599 954 HB3 LYS 132 1HB LYS 132 -6.731 13.665 -0.530 955 HG2 LYS 132 2HG LYS 132 -4.886 14.608 1.672 956 HG3 LYS 132 1HG LYS 132 -5.723 15.646 0.523 957 HD2 LYS 132 2HD LYS 132 -7.089 13.807 2.506 958 HD3 LYS 132 1HD LYS 132 -6.845 15.535 2.733 959 HE2 LYS 132 2HE LYS 132 -8.186 15.974 0.723 960 HE3 LYS 132 1HE LYS 132 -8.449 14.241 0.524 961 HZ1 LYS 132 3HZ LYS 132 -9.356 15.900 2.815 962 HZ2 LYS 132 1HZ LYS 132 -9.578 14.239 2.689 963 HZ3 LYS 132 2HZ LYS 132 -10.332 15.273 1.608 964 H PHE 133 H PHE 133 -4.533 9.998 0.353 965 HA PHE 133 HA PHE 133 -6.041 9.247 -2.058 966 HB2 PHE 133 2HB PHE 133 -3.211 8.566 -1.256 967 HB3 PHE 133 1HB PHE 133 -4.082 7.959 -2.661 968 HD1 PHE 133 1HD PHE 133 -4.928 9.775 -4.332 969 HD2 PHE 133 2HD PHE 133 -1.850 10.437 -1.471 970 HE1 PHE 133 1HE PHE 133 -4.063 11.634 -5.697 971 HE2 PHE 133 2HE PHE 133 -0.977 12.292 -2.833 972 HZ PHE 133 HZ PHE 133 -2.090 12.896 -4.942 973 H ARG 134 H ARG 134 -6.291 6.784 -2.262 974 HA ARG 134 HA ARG 134 -6.236 5.650 0.416 975 HB2 ARG 134 2HB ARG 134 -8.554 6.466 -0.080 976 HB3 ARG 134 1HB ARG 134 -8.640 5.276 -1.372 977 HG2 ARG 134 2HG ARG 134 -8.427 3.466 0.194 978 HG3 ARG 134 1HG ARG 134 -8.110 4.585 1.513 979 HD2 ARG 134 2HD ARG 134 -10.361 3.881 1.722 980 HD3 ARG 134 1HD ARG 134 -10.388 5.534 1.119 981 HE ARG 134 HE ARG 134 -10.543 3.449 -0.875 982 HH11 ARG 134 1HH1 ARG 134 -12.285 5.807 1.098 983 HH12 ARG 134 2HH1 ARG 134 -13.761 5.616 0.298 984 HH21 ARG 134 1HH2 ARG 134 -12.606 3.190 -2.006 985 HH22 ARG 134 2HH2 ARG 134 -13.948 4.112 -1.516 986 H LEU 135 H LEU 135 -5.753 3.644 0.682 987 HA LEU 135 HA LEU 135 -5.064 2.020 -1.657 988 HB2 LEU 135 2HB LEU 135 -3.115 3.052 -0.583 989 HB3 LEU 135 1HB LEU 135 -3.639 2.487 0.975 990 HG LEU 135 HG LEU 135 -2.750 0.599 -1.225 991 HD11 LEU 135 1HD1 LEU 135 -1.152 1.906 0.982 992 HD12 LEU 135 2HD1 LEU 135 -0.946 2.172 -0.752 993 HD13 LEU 135 3HD1 LEU 135 -0.579 0.598 -0.043 994 HD21 LEU 135 3HD2 LEU 135 -3.999 -0.440 0.628 995 HD22 LEU 135 1HD2 LEU 135 -2.914 0.322 1.790 996 HD23 LEU 135 2HD2 LEU 135 -2.297 -0.903 0.689 997 H VAL 136 H VAL 136 -5.945 -0.019 -1.533 998 HA VAL 136 HA VAL 136 -7.177 -0.731 1.019 999 HB VAL 136 HB VAL 136 -8.864 -0.386 -0.754 1000 HG11 VAL 136 1HG1 VAL 136 -9.051 -1.900 -2.667 1001 HG12 VAL 136 2HG1 VAL 136 -7.499 -2.606 -2.225 1002 HG13 VAL 136 3HG1 VAL 136 -7.588 -0.910 -2.715 1003 HG21 VAL 136 3HG2 VAL 136 -10.078 -2.516 -0.554 1004 HG22 VAL 136 1HG2 VAL 136 -9.378 -2.005 0.982 1005 HG23 VAL 136 2HG2 VAL 136 -8.607 -3.281 0.048 1006 H PHE 137 H PHE 137 -6.701 -2.674 1.900 1007 HA PHE 137 HA PHE 137 -4.530 -4.103 0.531 1008 HB2 PHE 137 2HB PHE 137 -3.867 -2.844 2.520 1009 HB3 PHE 137 1HB PHE 137 -5.031 -3.740 3.486 1010 HD1 PHE 137 2HD PHE 137 -2.069 -4.218 1.311 1011 HD2 PHE 137 1HD PHE 137 -4.351 -5.671 4.578 1012 HE1 PHE 137 2HE PHE 137 -0.343 -5.894 1.769 1013 HE2 PHE 137 1HE PHE 137 -2.622 -7.351 5.047 1014 HZ PHE 137 HZ PHE 137 -0.614 -7.464 3.642 1015 H LEU 138 H LEU 138 -5.005 -6.121 -0.015 1016 HA LEU 138 HA LEU 138 -7.174 -7.463 1.441 1017 HB2 LEU 138 2HB LEU 138 -6.590 -7.721 -1.523 1018 HB3 LEU 138 1HB LEU 138 -7.785 -8.632 -0.644 1019 HG LEU 138 HG LEU 138 -8.978 -7.077 -1.880 1020 HD11 LEU 138 1HD1 LEU 138 -10.054 -5.583 -0.302 1021 HD12 LEU 138 2HD1 LEU 138 -8.767 -5.901 0.861 1022 HD13 LEU 138 3HD1 LEU 138 -9.827 -7.209 0.343 1023 HD21 LEU 138 3HD2 LEU 138 -7.082 -4.918 -0.968 1024 HD22 LEU 138 1HD2 LEU 138 -8.522 -4.666 -1.954 1025 HD23 LEU 138 2HD2 LEU 138 -7.182 -5.620 -2.584 1026 H ALA 139 H ALA 139 -7.044 -9.818 1.210 1027 HA ALA 139 HA ALA 139 -4.415 -10.819 1.659 1028 HB1 ALA 139 1HB ALA 139 -6.357 -11.835 2.733 1029 HB2 ALA 139 2HB ALA 139 -5.529 -13.024 1.724 1030 HB3 ALA 139 3HB ALA 139 -7.023 -12.272 1.161 1031 H GLY 140 H GLY 140 -3.100 -11.742 0.215 1032 HA2 GLY 140 2HA GLY 140 -4.063 -11.668 -2.553 1033 HA3 GLY 140 1HA GLY 140 -2.456 -11.113 -2.091 1034 HA PRO 141 HA PRO 141 -2.284 -15.519 -3.301 1035 HB2 PRO 141 2HB PRO 141 -0.476 -14.807 -5.411 1036 HB3 PRO 141 1HB PRO 141 -2.080 -15.535 -5.536 1037 HG2 PRO 141 2HG PRO 141 -1.501 -12.981 -6.377 1038 HG3 PRO 141 1HG PRO 141 -3.113 -13.511 -5.864 1039 HD2 PRO 141 2HD PRO 141 -1.035 -12.006 -4.326 1040 HD3 PRO 141 1HD PRO 141 -2.800 -11.774 -4.369 1041 H ALA 142 H ALA 142 -0.906 -16.626 -2.215 1042 HA ALA 142 HA ALA 142 1.798 -15.642 -1.723 1043 HB1 ALA 142 1HB ALA 142 0.300 -18.047 -0.643 1044 HB2 ALA 142 2HB ALA 142 0.578 -16.531 0.222 1045 HB3 ALA 142 3HB ALA 142 1.936 -17.587 -0.174 1046 H GLU 143 H GLU 143 3.058 -16.084 -3.419 1047 HA GLU 143 HA GLU 143 2.295 -18.105 -5.262 1048 HB2 GLU 143 2HB GLU 143 3.255 -15.915 -5.945 1049 HB3 GLU 143 1HB GLU 143 4.788 -16.411 -5.249 1050 HG2 GLU 143 2HG GLU 143 4.940 -18.244 -6.837 1051 HG3 GLU 143 1HG GLU 143 3.375 -17.798 -7.514
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