NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
145116 | 2ko7 | 16491 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 GLY 1 H GLY 1 1.811 -0.001 0.854 2 HA2 GLY 1 1HA GLY 1 1.560 0.634 -1.957 3 HA3 GLY 1 2HA GLY 1 3.057 0.403 -1.066 4 HA PRO 2 HA PRO 2 2.011 -3.308 -3.814 5 HB2 PRO 2 1HB PRO 2 4.022 -2.989 -5.609 6 HB3 PRO 2 2HB PRO 2 2.423 -2.267 -5.820 7 HG2 PRO 2 1HG PRO 2 4.946 -1.017 -4.803 8 HG3 PRO 2 2HG PRO 2 3.747 -0.358 -5.932 9 HD2 PRO 2 1HD PRO 2 3.821 0.335 -3.315 10 HD3 PRO 2 2HD PRO 2 2.307 0.256 -4.240 11 H GLY 3 H GLY 3 2.935 -5.231 -3.360 12 HA2 GLY 3 1HA GLY 3 5.331 -6.239 -3.278 13 HA3 GLY 3 2HA GLY 3 5.473 -5.181 -1.882 14 H SER 4 H SER 4 5.513 -6.492 -0.167 15 HA SER 4 HA SER 4 3.469 -8.605 0.006 16 HB2 SER 4 1HB SER 4 4.939 -9.904 1.300 17 HB3 SER 4 2HB SER 4 5.985 -9.197 0.069 18 HG SER 4 HG SER 4 7.076 -8.695 1.833 19 H MET 5 H MET 5 3.377 -9.167 2.610 20 HA MET 5 HA MET 5 3.212 -6.824 4.258 21 HB2 MET 5 1HB MET 5 0.788 -6.926 4.645 22 HB3 MET 5 2HB MET 5 1.160 -6.534 2.971 23 HG2 MET 5 1HG MET 5 0.726 -9.384 3.658 24 HG3 MET 5 2HG MET 5 -0.675 -8.316 3.635 25 HE1 MET 5 3HE MET 5 1.423 -10.674 1.415 26 HE2 MET 5 1HE MET 5 -0.242 -10.875 1.963 27 HE3 MET 5 2HE MET 5 0.100 -10.643 0.248 28 H THR 6 H THR 6 2.931 -7.309 6.444 29 HA THR 6 HA THR 6 3.512 -10.061 7.135 30 HB THR 6 HB THR 6 3.487 -8.992 9.528 31 HG1 THR 6 HG1 THR 6 3.307 -6.879 9.582 32 HG21 THR 6 3HG2 THR 6 5.777 -8.631 9.357 33 HG22 THR 6 1HG2 THR 6 5.653 -7.970 7.727 34 HG23 THR 6 2HG2 THR 6 5.458 -9.702 7.993 35 H VAL 7 H VAL 7 1.345 -10.787 6.397 36 HA VAL 7 HA VAL 7 -0.591 -10.570 8.605 37 HB VAL 7 HB VAL 7 -1.371 -9.232 6.673 38 HG11 VAL 7 1HG1 VAL 7 -1.471 -11.871 5.215 39 HG12 VAL 7 2HG1 VAL 7 -2.004 -10.305 4.600 40 HG13 VAL 7 3HG1 VAL 7 -0.293 -10.593 4.917 41 HG21 VAL 7 3HG2 VAL 7 -2.862 -11.644 7.610 42 HG22 VAL 7 1HG2 VAL 7 -3.146 -9.939 7.961 43 HG23 VAL 7 2HG2 VAL 7 -3.578 -10.599 6.384 44 H VAL 8 H VAL 8 -1.413 -12.452 9.320 45 HA VAL 8 HA VAL 8 -0.322 -14.906 8.276 46 HB VAL 8 HB VAL 8 -2.344 -14.536 10.489 47 HG11 VAL 8 1HG1 VAL 8 -1.233 -16.762 11.201 48 HG12 VAL 8 2HG1 VAL 8 -2.442 -16.783 9.915 49 HG13 VAL 8 3HG1 VAL 8 -0.725 -16.858 9.516 50 HG21 VAL 8 3HG2 VAL 8 -0.386 -13.305 11.084 51 HG22 VAL 8 1HG2 VAL 8 -0.353 -14.823 11.982 52 HG23 VAL 8 2HG2 VAL 8 0.668 -14.618 10.559 53 H THR 9 H THR 9 -1.292 -16.352 6.991 54 HA THR 9 HA THR 9 -4.072 -15.815 6.191 55 HB THR 9 HB THR 9 -2.089 -17.507 4.672 56 HG1 THR 9 HG1 THR 9 -1.427 -15.715 3.630 57 HG21 THR 9 3HG2 THR 9 -3.743 -16.494 2.829 58 HG22 THR 9 1HG2 THR 9 -4.835 -16.489 4.213 59 HG23 THR 9 2HG2 THR 9 -4.083 -17.996 3.689 60 H THR 10 H THR 10 -5.497 -17.600 5.836 61 HA THR 10 HA THR 10 -4.889 -19.883 7.585 62 HB THR 10 HB THR 10 -7.393 -20.255 7.531 63 HG1 THR 10 HG1 THR 10 -8.029 -19.055 5.777 64 HG21 THR 10 3HG2 THR 10 -7.788 -18.768 9.295 65 HG22 THR 10 1HG2 THR 10 -6.724 -17.537 8.618 66 HG23 THR 10 2HG2 THR 10 -6.041 -19.001 9.325 67 H GLU 11 H GLU 11 -6.332 -21.878 6.880 68 HA GLU 11 HA GLU 11 -5.245 -22.787 4.421 69 HB2 GLU 11 1HB GLU 11 -5.768 -24.241 6.389 70 HB3 GLU 11 2HB GLU 11 -7.476 -24.039 6.028 71 HG2 GLU 11 1HG GLU 11 -7.139 -25.084 3.845 72 HG3 GLU 11 2HG GLU 11 -5.428 -25.294 4.214 73 H SER 12 H SER 12 -8.216 -21.249 5.301 74 HA SER 12 HA SER 12 -9.702 -22.053 2.992 75 HB2 SER 12 1HB SER 12 -10.779 -21.343 5.119 76 HB3 SER 12 2HB SER 12 -10.191 -19.704 4.840 77 HG SER 12 HG SER 12 -12.292 -21.050 3.678 78 H GLY 13 H GLY 13 -7.719 -19.273 3.864 79 HA2 GLY 13 1HA GLY 13 -6.530 -18.442 1.751 80 HA3 GLY 13 2HA GLY 13 -8.166 -18.154 1.175 81 H LEU 14 H LEU 14 -9.217 -17.251 3.694 82 HA LEU 14 HA LEU 14 -8.574 -14.504 3.495 83 HB2 LEU 14 1HB LEU 14 -10.744 -15.006 4.209 84 HB3 LEU 14 2HB LEU 14 -10.174 -16.135 5.436 85 HG LEU 14 HG LEU 14 -9.435 -13.276 5.753 86 HD11 LEU 14 1HD1 LEU 14 -12.130 -14.064 5.345 87 HD12 LEU 14 2HD1 LEU 14 -11.503 -12.487 5.824 88 HD13 LEU 14 3HD1 LEU 14 -11.921 -13.679 7.054 89 HD21 LEU 14 3HD2 LEU 14 -10.195 -14.067 8.150 90 HD22 LEU 14 1HD2 LEU 14 -8.616 -14.503 7.498 91 HD23 LEU 14 2HD2 LEU 14 -9.941 -15.666 7.450 92 H LYS 15 H LYS 15 -7.516 -13.136 4.954 93 HA LYS 15 HA LYS 15 -5.626 -14.502 6.757 94 HB2 LYS 15 1HB LYS 15 -5.166 -11.788 5.538 95 HB3 LYS 15 2HB LYS 15 -3.989 -12.870 6.271 96 HG2 LYS 15 1HG LYS 15 -4.191 -14.402 4.408 97 HG3 LYS 15 2HG LYS 15 -5.444 -13.390 3.686 98 HD2 LYS 15 1HD LYS 15 -3.564 -11.539 3.903 99 HD3 LYS 15 2HD LYS 15 -2.506 -12.952 3.866 100 HE2 LYS 15 1HE LYS 15 -4.672 -12.741 1.835 101 HE3 LYS 15 2HE LYS 15 -3.247 -11.720 1.651 102 HZ1 LYS 15 3HZ LYS 15 -3.343 -14.116 0.630 103 HZ2 LYS 15 1HZ LYS 15 -2.843 -14.571 2.181 104 HZ3 LYS 15 2HZ LYS 15 -1.903 -13.500 1.270 105 H TYR 16 H TYR 16 -4.781 -12.953 8.506 106 HA TYR 16 HA TYR 16 -6.756 -11.025 9.424 107 HB2 TYR 16 1HB TYR 16 -7.187 -12.063 11.517 108 HB3 TYR 16 2HB TYR 16 -7.420 -13.312 10.299 109 HD1 TYR 16 HD1 TYR 16 -5.254 -12.127 13.018 110 HD2 TYR 16 HD2 TYR 16 -5.933 -15.209 10.164 111 HE1 TYR 16 HE1 TYR 16 -3.653 -13.568 14.203 112 HE2 TYR 16 HE2 TYR 16 -4.334 -16.659 11.343 113 HH TYR 16 HH TYR 16 -2.321 -15.468 13.913 114 H GLU 17 H GLU 17 -5.974 -9.603 11.032 115 HA GLU 17 HA GLU 17 -3.249 -9.875 11.966 116 HB2 GLU 17 1HB GLU 17 -3.142 -8.845 9.643 117 HB3 GLU 17 2HB GLU 17 -3.958 -7.446 10.326 118 HG2 GLU 17 1HG GLU 17 -1.660 -6.940 10.314 119 HG3 GLU 17 2HG GLU 17 -2.083 -7.294 11.989 120 H ASP 18 H ASP 18 -3.319 -9.308 14.026 121 HA ASP 18 HA ASP 18 -5.465 -8.015 15.260 122 HB2 ASP 18 1HB ASP 18 -4.238 -8.139 17.247 123 HB3 ASP 18 2HB ASP 18 -3.585 -9.466 16.290 124 H LEU 19 H LEU 19 -5.961 -5.938 15.662 125 HA LEU 19 HA LEU 19 -4.003 -3.887 14.861 126 HB2 LEU 19 1HB LEU 19 -6.865 -4.226 14.197 127 HB3 LEU 19 2HB LEU 19 -6.326 -2.584 14.545 128 HG LEU 19 HG LEU 19 -5.213 -4.391 12.398 129 HD11 LEU 19 1HD1 LEU 19 -6.663 -3.498 10.957 130 HD12 LEU 19 2HD1 LEU 19 -6.456 -1.876 11.617 131 HD13 LEU 19 3HD1 LEU 19 -7.582 -3.000 12.378 132 HD21 LEU 19 3HD2 LEU 19 -4.529 -1.590 13.257 133 HD22 LEU 19 1HD2 LEU 19 -4.111 -2.238 11.671 134 HD23 LEU 19 2HD2 LEU 19 -3.457 -2.985 13.129 135 H THR 20 H THR 20 -6.548 -4.827 17.081 136 HA THR 20 HA THR 20 -5.434 -3.156 19.141 137 HB THR 20 HB THR 20 -8.332 -2.619 18.708 138 HG1 THR 20 HG1 THR 20 -7.592 -0.747 17.402 139 HG21 THR 20 3HG2 THR 20 -5.998 -1.343 20.035 140 HG22 THR 20 1HG2 THR 20 -7.648 -1.560 20.617 141 HG23 THR 20 2HG2 THR 20 -7.286 -0.292 19.446 142 H GLU 21 H GLU 21 -5.703 -4.099 21.070 143 HA GLU 21 HA GLU 21 -6.878 -6.628 21.321 144 HB2 GLU 21 1HB GLU 21 -6.009 -4.594 23.368 145 HB3 GLU 21 2HB GLU 21 -6.657 -6.163 23.824 146 HG2 GLU 21 1HG GLU 21 -4.836 -7.139 22.313 147 HG3 GLU 21 2HG GLU 21 -4.111 -5.534 22.381 148 H GLY 22 H GLY 22 -8.614 -7.206 22.904 149 HA2 GLY 22 1HA GLY 22 -10.714 -5.173 23.138 150 HA3 GLY 22 2HA GLY 22 -11.089 -6.654 22.270 151 H SER 23 H SER 23 -10.316 -8.688 23.609 152 HA SER 23 HA SER 23 -10.705 -10.030 25.405 153 HB2 SER 23 1HB SER 23 -9.081 -8.352 26.444 154 HB3 SER 23 2HB SER 23 -10.498 -7.573 27.147 155 HG SER 23 HG SER 23 -10.170 -10.335 27.475 156 H GLY 24 H GLY 24 -12.942 -9.424 24.101 157 HA2 GLY 24 1HA GLY 24 -14.894 -8.744 26.213 158 HA3 GLY 24 2HA GLY 24 -15.153 -8.427 24.504 159 H ALA 25 H ALA 25 -16.027 -9.984 23.233 160 HA ALA 25 HA ALA 25 -16.131 -12.738 24.109 161 HB1 ALA 25 1HB ALA 25 -18.475 -12.946 24.312 162 HB2 ALA 25 2HB ALA 25 -18.024 -11.546 25.286 163 HB3 ALA 25 3HB ALA 25 -18.748 -11.316 23.695 164 H GLU 26 H GLU 26 -15.925 -13.991 22.376 165 HA GLU 26 HA GLU 26 -15.912 -12.936 19.751 166 HB2 GLU 26 1HB GLU 26 -14.502 -14.815 20.312 167 HB3 GLU 26 2HB GLU 26 -15.900 -15.787 20.748 168 HG2 GLU 26 1HG GLU 26 -16.640 -15.828 18.454 169 HG3 GLU 26 2HG GLU 26 -15.330 -14.748 17.982 170 H ALA 27 H ALA 27 -17.461 -12.785 18.252 171 HA ALA 27 HA ALA 27 -20.171 -13.081 18.893 172 HB1 ALA 27 1HB ALA 27 -19.830 -13.214 16.063 173 HB2 ALA 27 2HB ALA 27 -20.385 -11.863 17.052 174 HB3 ALA 27 3HB ALA 27 -18.664 -12.072 16.732 175 H ARG 28 H ARG 28 -21.762 -14.500 17.925 176 HA ARG 28 HA ARG 28 -20.705 -17.116 17.100 177 HB2 ARG 28 1HB ARG 28 -22.943 -16.692 19.089 178 HB3 ARG 28 2HB ARG 28 -22.363 -18.244 18.501 179 HG2 ARG 28 1HG ARG 28 -20.344 -16.481 19.733 180 HG3 ARG 28 2HG ARG 28 -21.574 -17.147 20.810 181 HD2 ARG 28 1HD ARG 28 -21.038 -19.408 19.881 182 HD3 ARG 28 2HD ARG 28 -19.691 -18.669 19.016 183 HE ARG 28 HE ARG 28 -19.622 -18.106 21.815 184 HH11 ARG 28 1HH1 ARG 28 -18.867 -20.506 19.408 185 HH12 ARG 28 2HH1 ARG 28 -17.620 -21.249 20.353 186 HH21 ARG 28 1HH2 ARG 28 -17.981 -19.076 23.068 187 HH22 ARG 28 2HH2 ARG 28 -17.117 -20.436 22.435 188 H ALA 29 H ALA 29 -21.844 -18.156 15.530 189 HA ALA 29 HA ALA 29 -23.506 -16.685 13.832 190 HB1 ALA 29 1HB ALA 29 -22.218 -19.125 13.723 191 HB2 ALA 29 2HB ALA 29 -23.927 -19.550 13.619 192 HB3 ALA 29 3HB ALA 29 -23.228 -18.420 12.460 193 H GLY 30 H GLY 30 -25.550 -16.075 14.063 194 HA2 GLY 30 1HA GLY 30 -27.872 -16.871 14.262 195 HA3 GLY 30 2HA GLY 30 -27.345 -17.799 15.658 196 H GLN 31 H GLN 31 -25.621 -15.389 16.406 197 HA GLN 31 HA GLN 31 -27.768 -13.970 17.812 198 HB2 GLN 31 1HB GLN 31 -26.319 -13.611 19.553 199 HB3 GLN 31 2HB GLN 31 -25.662 -15.115 18.920 200 HG2 GLN 31 1HG GLN 31 -23.991 -13.827 17.657 201 HG3 GLN 31 2HG GLN 31 -24.629 -12.343 18.364 202 HE21 GLN 31 2HE2 GLN 31 -24.294 -11.931 20.557 203 HE22 GLN 31 1HE2 GLN 31 -23.079 -12.758 21.465 204 H THR 32 H THR 32 -27.899 -11.729 17.839 205 HA THR 32 HA THR 32 -26.736 -10.429 15.510 206 HB THR 32 HB THR 32 -28.627 -9.142 17.470 207 HG1 THR 32 HG1 THR 32 -29.577 -11.101 16.772 208 HG21 THR 32 3HG2 THR 32 -28.639 -8.706 14.522 209 HG22 THR 32 1HG2 THR 32 -27.345 -7.979 15.475 210 HG23 THR 32 2HG2 THR 32 -29.028 -7.588 15.828 211 H VAL 33 H VAL 33 -25.253 -8.823 15.555 212 HA VAL 33 HA VAL 33 -24.549 -7.539 18.067 213 HB VAL 33 HB VAL 33 -22.199 -8.070 17.954 214 HG11 VAL 33 1HG1 VAL 33 -22.258 -10.328 18.660 215 HG12 VAL 33 2HG1 VAL 33 -23.823 -9.636 19.092 216 HG13 VAL 33 3HG1 VAL 33 -23.678 -10.675 17.674 217 HG21 VAL 33 3HG2 VAL 33 -22.888 -8.943 15.284 218 HG22 VAL 33 1HG2 VAL 33 -21.313 -8.539 15.966 219 HG23 VAL 33 2HG2 VAL 33 -21.960 -10.169 16.147 220 H SER 34 H SER 34 -22.912 -5.800 17.733 221 HA SER 34 HA SER 34 -23.272 -4.593 15.071 222 HB2 SER 34 1HB SER 34 -23.458 -3.525 17.793 223 HB3 SER 34 2HB SER 34 -22.461 -2.540 16.723 224 HG SER 34 HG SER 34 -24.305 -1.802 16.044 225 H VAL 35 H VAL 35 -21.536 -4.292 13.842 226 HA VAL 35 HA VAL 35 -18.903 -4.028 15.102 227 HB VAL 35 HB VAL 35 -17.856 -5.632 13.709 228 HG11 VAL 35 1HG1 VAL 35 -18.713 -7.616 14.549 229 HG12 VAL 35 2HG1 VAL 35 -19.349 -6.415 15.674 230 HG13 VAL 35 3HG1 VAL 35 -20.385 -7.073 14.406 231 HG21 VAL 35 3HG2 VAL 35 -19.372 -6.987 12.095 232 HG22 VAL 35 1HG2 VAL 35 -20.432 -5.580 12.190 233 HG23 VAL 35 2HG2 VAL 35 -18.781 -5.402 11.597 234 H HIS 36 H HIS 36 -17.251 -3.200 13.608 235 HA HIS 36 HA HIS 36 -18.459 -1.460 11.561 236 HB2 HIS 36 1HB HIS 36 -16.383 -1.005 13.618 237 HB3 HIS 36 2HB HIS 36 -16.063 -0.291 12.041 238 HD1 HIS 36 HD1 HIS 36 -18.695 0.800 11.187 239 HD2 HIS 36 HD2 HIS 36 -17.408 0.977 15.133 240 HE1 HIS 36 HE1 HIS 36 -19.994 2.681 12.235 241 H TYR 37 H TYR 37 -17.768 -1.598 9.512 242 HA TYR 37 HA TYR 37 -15.446 -3.331 8.972 243 HB2 TYR 37 1HB TYR 37 -16.507 -4.014 6.913 244 HB3 TYR 37 2HB TYR 37 -17.638 -4.260 8.238 245 HD1 TYR 37 HD2 TYR 37 -19.469 -2.541 8.592 246 HD2 TYR 37 HD1 TYR 37 -17.076 -2.659 5.076 247 HE1 TYR 37 HE2 TYR 37 -21.157 -1.203 7.404 248 HE2 TYR 37 HE1 TYR 37 -18.757 -1.321 3.879 249 HH TYR 37 HH TYR 37 -20.975 -0.644 3.967 250 H THR 38 H THR 38 -13.798 -2.494 7.864 251 HA THR 38 HA THR 38 -14.196 0.119 6.557 252 HB THR 38 HB THR 38 -11.488 -0.743 7.481 253 HG1 THR 38 HG1 THR 38 -12.221 0.569 9.472 254 HG21 THR 38 3HG2 THR 38 -12.836 1.957 7.447 255 HG22 THR 38 1HG2 THR 38 -11.864 1.317 6.123 256 HG23 THR 38 2HG2 THR 38 -11.122 1.625 7.693 257 H GLY 39 H GLY 39 -14.339 -0.277 4.428 258 HA2 GLY 39 1HA GLY 39 -13.183 -2.454 3.080 259 HA3 GLY 39 2HA GLY 39 -13.780 -0.987 2.319 260 H TRP 40 H TRP 40 -11.053 -2.827 3.057 261 HA TRP 40 HA TRP 40 -9.282 -0.580 2.345 262 HB2 TRP 40 1HB TRP 40 -8.793 -2.976 4.111 263 HB3 TRP 40 2HB TRP 40 -7.477 -2.005 3.458 264 HD1 TRP 40 HD1 TRP 40 -9.775 0.594 3.996 265 HE1 TRP 40 HE1 TRP 40 -9.599 1.648 6.337 266 HE3 TRP 40 HE3 TRP 40 -7.146 -3.102 6.354 267 HZ2 TRP 40 HZ2 TRP 40 -8.491 0.999 8.851 268 HZ3 TRP 40 HZ3 TRP 40 -6.568 -2.807 8.728 269 HH2 TRP 40 HH2 TRP 40 -7.227 -0.798 9.948 270 H LEU 41 H LEU 41 -7.531 -1.015 0.926 271 HA LEU 41 HA LEU 41 -8.064 -3.270 -0.879 272 HB2 LEU 41 1HB LEU 41 -7.161 -0.506 -1.237 273 HB3 LEU 41 2HB LEU 41 -6.254 -1.689 -2.177 274 HG LEU 41 HG LEU 41 -8.865 -2.388 -2.679 275 HD11 LEU 41 1HD1 LEU 41 -8.799 0.592 -2.946 276 HD12 LEU 41 2HD1 LEU 41 -9.405 -0.172 -1.477 277 HD13 LEU 41 3HD1 LEU 41 -10.176 -0.507 -3.027 278 HD21 LEU 41 3HD2 LEU 41 -6.959 -0.611 -4.188 279 HD22 LEU 41 1HD2 LEU 41 -8.455 -1.244 -4.874 280 HD23 LEU 41 2HD2 LEU 41 -7.182 -2.352 -4.361 281 H THR 42 H THR 42 -6.015 -4.047 -2.057 282 HA THR 42 HA THR 42 -4.342 -5.319 -0.226 283 HB THR 42 HB THR 42 -3.054 -6.098 -2.073 284 HG1 THR 42 HG1 THR 42 -4.255 -4.284 -3.865 285 HG21 THR 42 3HG2 THR 42 -5.779 -5.660 -3.269 286 HG22 THR 42 1HG2 THR 42 -5.516 -6.761 -1.918 287 HG23 THR 42 2HG2 THR 42 -4.707 -7.047 -3.459 288 H ASP 43 H ASP 43 -3.946 -2.288 -1.963 289 HA ASP 43 HA ASP 43 -1.214 -1.911 -1.204 290 HB2 ASP 43 1HB ASP 43 -2.630 -0.840 -3.162 291 HB3 ASP 43 2HB ASP 43 -2.973 0.388 -1.946 292 H GLY 44 H GLY 44 -4.235 -1.430 0.337 293 HA2 GLY 44 1HA GLY 44 -4.181 -1.113 2.753 294 HA3 GLY 44 2HA GLY 44 -2.860 0.021 2.511 295 H GLN 45 H GLN 45 -4.523 0.962 0.062 296 HA GLN 45 HA GLN 45 -5.643 3.225 1.322 297 HB2 GLN 45 1HB GLN 45 -6.529 3.783 -0.899 298 HB3 GLN 45 2HB GLN 45 -4.842 3.294 -0.981 299 HG2 GLN 45 1HG GLN 45 -5.810 0.951 -1.518 300 HG3 GLN 45 2HG GLN 45 -7.278 1.844 -1.914 301 HE21 GLN 45 2HE2 GLN 45 -6.990 3.663 -3.453 302 HE22 GLN 45 1HE2 GLN 45 -5.881 3.442 -4.759 303 H LYS 46 H LYS 46 -7.731 3.780 1.808 304 HA LYS 46 HA LYS 46 -9.614 1.550 2.005 305 HB2 LYS 46 1HB LYS 46 -9.269 2.697 4.075 306 HB3 LYS 46 2HB LYS 46 -9.515 4.265 3.319 307 HG2 LYS 46 1HG LYS 46 -11.866 3.667 2.901 308 HG3 LYS 46 2HG LYS 46 -11.602 2.134 3.735 309 HD2 LYS 46 1HD LYS 46 -12.496 3.452 5.413 310 HD3 LYS 46 2HD LYS 46 -10.761 3.643 5.681 311 HE2 LYS 46 1HE LYS 46 -10.793 5.752 4.462 312 HE3 LYS 46 2HE LYS 46 -12.514 5.552 4.136 313 HZ1 LYS 46 3HZ LYS 46 -11.224 6.565 6.469 314 HZ2 LYS 46 1HZ LYS 46 -12.292 5.310 6.851 315 HZ3 LYS 46 2HZ LYS 46 -12.849 6.668 6.010 316 H PHE 47 H PHE 47 -11.503 1.464 0.924 317 HA PHE 47 HA PHE 47 -12.275 3.806 -0.685 318 HB2 PHE 47 1HB PHE 47 -12.790 2.429 -2.562 319 HB3 PHE 47 2HB PHE 47 -11.178 1.964 -2.028 320 HD1 PHE 47 HD2 PHE 47 -11.124 -0.032 -0.311 321 HD2 PHE 47 HD1 PHE 47 -14.324 0.779 -2.998 322 HE1 PHE 47 HE2 PHE 47 -11.855 -2.374 -0.140 323 HE2 PHE 47 HE1 PHE 47 -15.061 -1.563 -2.831 324 HZ PHE 47 HZ PHE 47 -13.826 -3.143 -1.402 325 H ASP 48 H ASP 48 -13.181 2.583 1.932 326 HA ASP 48 HA ASP 48 -15.935 3.087 1.640 327 HB2 ASP 48 1HB ASP 48 -15.653 0.759 0.561 328 HB3 ASP 48 2HB ASP 48 -15.406 0.179 2.206 329 H SER 49 H SER 49 -16.619 3.786 3.553 330 HA SER 49 HA SER 49 -15.558 2.584 6.000 331 HB2 SER 49 1HB SER 49 -14.830 4.606 6.950 332 HB3 SER 49 2HB SER 49 -14.249 4.698 5.287 333 HG SER 49 HG SER 49 -15.888 6.095 4.794 334 H SER 50 H SER 50 -17.038 2.385 7.581 335 HA SER 50 HA SER 50 -19.768 2.821 7.017 336 HB2 SER 50 1HB SER 50 -19.790 2.450 9.696 337 HB3 SER 50 2HB SER 50 -19.621 1.131 8.537 338 HG SER 50 HG SER 50 -17.423 2.529 9.658 339 H LYS 51 H LYS 51 -17.359 4.902 8.182 340 HA LYS 51 HA LYS 51 -18.734 6.576 9.930 341 HB2 LYS 51 1HB LYS 51 -16.648 7.399 7.901 342 HB3 LYS 51 2HB LYS 51 -17.089 8.280 9.358 343 HG2 LYS 51 1HG LYS 51 -16.033 5.480 9.492 344 HG3 LYS 51 2HG LYS 51 -14.954 6.874 9.393 345 HD2 LYS 51 1HD LYS 51 -17.130 6.805 11.445 346 HD3 LYS 51 2HD LYS 51 -15.627 5.923 11.722 347 HE2 LYS 51 1HE LYS 51 -14.339 7.926 11.552 348 HE3 LYS 51 2HE LYS 51 -15.738 8.845 11.000 349 HZ1 LYS 51 3HZ LYS 51 -16.596 7.876 13.353 350 HZ2 LYS 51 1HZ LYS 51 -15.907 9.407 13.143 351 HZ3 LYS 51 2HZ LYS 51 -14.954 8.117 13.680 352 H ASP 52 H ASP 52 -19.015 6.209 6.506 353 HA ASP 52 HA ASP 52 -20.007 8.651 5.688 354 HB2 ASP 52 1HB ASP 52 -20.949 7.535 3.828 355 HB3 ASP 52 2HB ASP 52 -19.548 6.568 4.284 356 H ARG 53 H ARG 53 -21.621 6.089 7.465 357 HA ARG 53 HA ARG 53 -24.092 7.678 7.509 358 HB2 ARG 53 1HB ARG 53 -23.950 5.134 6.863 359 HB3 ARG 53 2HB ARG 53 -23.915 4.900 8.605 360 HG2 ARG 53 1HG ARG 53 -26.161 4.715 8.105 361 HG3 ARG 53 2HG ARG 53 -26.017 6.397 8.618 362 HD2 ARG 53 1HD ARG 53 -27.363 6.328 6.639 363 HD3 ARG 53 2HD ARG 53 -25.805 7.041 6.224 364 HE ARG 53 HE ARG 53 -25.473 5.316 4.774 365 HH11 ARG 53 1HH1 ARG 53 -27.849 4.343 7.126 366 HH12 ARG 53 2HH1 ARG 53 -28.180 2.827 6.357 367 HH21 ARG 53 1HH2 ARG 53 -25.901 3.322 3.752 368 HH22 ARG 53 2HH2 ARG 53 -27.071 2.246 4.438 369 H ASN 54 H ASN 54 -21.439 6.657 9.423 370 HA ASN 54 HA ASN 54 -20.836 7.069 11.577 371 HB2 ASN 54 1HB ASN 54 -23.203 8.886 11.908 372 HB3 ASN 54 2HB ASN 54 -21.589 9.033 12.596 373 HD21 ASN 54 2HD2 ASN 54 -19.929 9.881 11.353 374 HD22 ASN 54 1HD2 ASN 54 -20.225 10.746 9.888 375 H ASP 55 H ASP 55 -21.755 4.766 11.655 376 HA ASP 55 HA ASP 55 -23.083 4.414 14.101 377 HB2 ASP 55 1HB ASP 55 -25.176 4.924 13.291 378 HB3 ASP 55 2HB ASP 55 -24.791 4.389 11.657 379 HA PRO 56 HA PRO 56 -21.151 0.500 13.561 380 HB2 PRO 56 1HB PRO 56 -22.420 -0.893 15.515 381 HB3 PRO 56 2HB PRO 56 -21.190 0.330 15.852 382 HG2 PRO 56 1HG PRO 56 -24.173 0.566 15.950 383 HG3 PRO 56 2HG PRO 56 -22.963 1.187 17.088 384 HD2 PRO 56 1HD PRO 56 -24.146 2.752 15.221 385 HD3 PRO 56 2HD PRO 56 -22.479 3.015 15.770 386 H PHE 57 H PHE 57 -21.463 -1.311 12.377 387 HA PHE 57 HA PHE 57 -24.002 -1.696 11.099 388 HB2 PHE 57 1HB PHE 57 -21.582 -2.059 10.158 389 HB3 PHE 57 2HB PHE 57 -21.748 -3.657 10.877 390 HD1 PHE 57 HD1 PHE 57 -23.700 -1.324 8.715 391 HD2 PHE 57 HD2 PHE 57 -22.544 -5.337 9.538 392 HE1 PHE 57 HE1 PHE 57 -24.933 -2.083 6.726 393 HE2 PHE 57 HE2 PHE 57 -23.775 -6.102 7.550 394 HZ PHE 57 HZ PHE 57 -24.971 -4.475 6.141 395 H ALA 58 H ALA 58 -25.568 -2.496 12.387 396 HA ALA 58 HA ALA 58 -24.970 -4.817 14.076 397 HB1 ALA 58 1HB ALA 58 -27.634 -3.495 14.106 398 HB2 ALA 58 2HB ALA 58 -26.715 -4.220 15.426 399 HB3 ALA 58 3HB ALA 58 -26.260 -2.635 14.801 400 H PHE 59 H PHE 59 -25.574 -6.798 13.503 401 HA PHE 59 HA PHE 59 -27.966 -7.315 12.014 402 HB2 PHE 59 1HB PHE 59 -27.022 -8.198 10.015 403 HB3 PHE 59 2HB PHE 59 -26.283 -6.618 10.250 404 HD1 PHE 59 HD1 PHE 59 -24.028 -6.693 11.654 405 HD2 PHE 59 HD2 PHE 59 -25.655 -9.943 9.440 406 HE1 PHE 59 HE1 PHE 59 -21.794 -7.716 11.522 407 HE2 PHE 59 HE2 PHE 59 -23.425 -10.973 9.305 408 HZ PHE 59 HZ PHE 59 -21.491 -9.860 10.347 409 H VAL 60 H VAL 60 -27.985 -9.761 11.372 410 HA VAL 60 HA VAL 60 -27.204 -11.216 13.771 411 HB VAL 60 HB VAL 60 -28.892 -12.119 11.432 412 HG11 VAL 60 1HG1 VAL 60 -28.074 -13.413 13.997 413 HG12 VAL 60 2HG1 VAL 60 -29.644 -13.792 13.284 414 HG13 VAL 60 3HG1 VAL 60 -28.164 -14.095 12.373 415 HG21 VAL 60 3HG2 VAL 60 -29.513 -10.287 13.440 416 HG22 VAL 60 1HG2 VAL 60 -30.643 -11.112 12.365 417 HG23 VAL 60 2HG2 VAL 60 -30.270 -11.796 13.948 418 H LEU 61 H LEU 61 -25.603 -12.663 13.867 419 HA LEU 61 HA LEU 61 -23.847 -12.984 11.624 420 HB2 LEU 61 1HB LEU 61 -23.038 -12.814 13.942 421 HB3 LEU 61 2HB LEU 61 -23.819 -14.350 14.312 422 HG LEU 61 HG LEU 61 -22.306 -15.495 12.771 423 HD11 LEU 61 1HD1 LEU 61 -20.281 -13.612 12.351 424 HD12 LEU 61 2HD1 LEU 61 -21.783 -12.813 11.887 425 HD13 LEU 61 3HD1 LEU 61 -21.335 -14.348 11.142 426 HD21 LEU 61 3HD2 LEU 61 -20.312 -14.026 14.306 427 HD22 LEU 61 1HD2 LEU 61 -20.782 -15.724 14.387 428 HD23 LEU 61 2HD2 LEU 61 -21.711 -14.509 15.266 429 H GLY 62 H GLY 62 -23.267 -14.952 10.601 430 HA2 GLY 62 1HA GLY 62 -23.798 -16.881 9.471 431 HA3 GLY 62 2HA GLY 62 -24.317 -17.466 11.044 432 H GLY 63 H GLY 63 -25.646 -14.929 8.928 433 HA2 GLY 63 1HA GLY 63 -27.728 -16.201 7.739 434 HA3 GLY 63 2HA GLY 63 -28.317 -15.924 9.372 435 H GLY 64 H GLY 64 -26.348 -13.932 7.167 436 HA2 GLY 64 1HA GLY 64 -28.443 -11.858 7.373 437 HA3 GLY 64 2HA GLY 64 -26.733 -11.471 7.495 438 H MET 65 H MET 65 -25.937 -10.594 5.715 439 HA MET 65 HA MET 65 -26.485 -11.764 3.129 440 HB2 MET 65 1HB MET 65 -27.414 -8.998 3.869 441 HB3 MET 65 2HB MET 65 -27.074 -9.442 2.202 442 HG2 MET 65 1HG MET 65 -28.719 -11.307 2.454 443 HG3 MET 65 2HG MET 65 -29.146 -10.631 4.024 444 HE1 MET 65 3HE MET 65 -31.215 -9.995 4.096 445 HE2 MET 65 1HE MET 65 -30.910 -8.259 4.151 446 HE3 MET 65 2HE MET 65 -32.129 -8.905 3.052 447 H VAL 66 H VAL 66 -24.125 -11.992 4.085 448 HA VAL 66 HA VAL 66 -22.530 -9.878 2.801 449 HB VAL 66 HB VAL 66 -20.846 -9.994 4.505 450 HG11 VAL 66 1HG1 VAL 66 -23.629 -9.667 5.602 451 HG12 VAL 66 2HG1 VAL 66 -22.177 -9.263 6.518 452 HG13 VAL 66 3HG1 VAL 66 -22.537 -8.412 5.015 453 HG21 VAL 66 3HG2 VAL 66 -20.642 -12.095 5.345 454 HG22 VAL 66 1HG2 VAL 66 -21.627 -11.400 6.633 455 HG23 VAL 66 2HG2 VAL 66 -22.384 -12.373 5.371 456 H ILE 67 H ILE 67 -20.107 -10.784 2.723 457 HA ILE 67 HA ILE 67 -20.302 -13.228 1.156 458 HB ILE 67 HB ILE 67 -18.093 -12.739 0.352 459 HG12 ILE 67 1HG1 ILE 67 -18.055 -10.575 2.466 460 HG13 ILE 67 2HG1 ILE 67 -17.035 -12.009 2.407 461 HG21 ILE 67 1HG2 ILE 67 -18.469 -10.632 -0.737 462 HG22 ILE 67 2HG2 ILE 67 -20.011 -11.472 -0.584 463 HG23 ILE 67 3HG2 ILE 67 -19.618 -10.145 0.508 464 HD11 ILE 67 3HD1 ILE 67 -15.984 -11.169 0.368 465 HD12 ILE 67 1HD1 ILE 67 -16.998 -9.728 0.445 466 HD13 ILE 67 2HD1 ILE 67 -15.811 -10.040 1.712 467 H LYS 68 H LYS 68 -18.576 -14.881 1.371 468 HA LYS 68 HA LYS 68 -18.572 -16.140 3.796 469 HB2 LYS 68 1HB LYS 68 -16.781 -16.259 1.421 470 HB3 LYS 68 2HB LYS 68 -16.243 -17.068 2.887 471 HG2 LYS 68 1HG LYS 68 -18.572 -18.170 2.870 472 HG3 LYS 68 2HG LYS 68 -18.632 -17.649 1.184 473 HD2 LYS 68 1HD LYS 68 -16.938 -19.064 0.546 474 HD3 LYS 68 2HD LYS 68 -16.212 -19.094 2.155 475 HE2 LYS 68 1HE LYS 68 -17.145 -21.223 1.900 476 HE3 LYS 68 2HE LYS 68 -18.320 -20.348 2.880 477 HZ1 LYS 68 3HZ LYS 68 -19.073 -21.738 0.823 478 HZ2 LYS 68 1HZ LYS 68 -18.637 -20.347 -0.036 479 HZ3 LYS 68 2HZ LYS 68 -19.816 -20.259 1.174 480 H GLY 69 H GLY 69 -15.980 -14.033 2.546 481 HA2 GLY 69 1HA GLY 69 -14.240 -14.154 4.690 482 HA3 GLY 69 2HA GLY 69 -14.432 -12.747 3.653 483 H TRP 70 H TRP 70 -17.118 -12.136 4.322 484 HA TRP 70 HA TRP 70 -16.697 -10.573 6.640 485 HB2 TRP 70 1HB TRP 70 -18.987 -11.108 4.813 486 HB3 TRP 70 2HB TRP 70 -19.351 -10.416 6.392 487 HD1 TRP 70 HD1 TRP 70 -16.572 -9.598 3.790 488 HE1 TRP 70 HE1 TRP 70 -16.584 -7.052 3.408 489 HE3 TRP 70 HE3 TRP 70 -20.450 -8.331 6.872 490 HZ2 TRP 70 HZ2 TRP 70 -18.043 -4.805 4.296 491 HZ3 TRP 70 HZ3 TRP 70 -21.090 -5.962 7.050 492 HH2 TRP 70 HH2 TRP 70 -19.909 -4.237 5.788 493 H ASP 71 H ASP 71 -18.844 -13.363 6.072 494 HA ASP 71 HA ASP 71 -19.802 -13.620 8.675 495 HB2 ASP 71 1HB ASP 71 -19.568 -15.426 6.325 496 HB3 ASP 71 2HB ASP 71 -19.872 -16.180 7.887 497 H GLU 72 H GLU 72 -16.921 -15.020 7.165 498 HA GLU 72 HA GLU 72 -16.134 -16.633 9.328 499 HB2 GLU 72 1HB GLU 72 -15.258 -16.632 6.916 500 HB3 GLU 72 2HB GLU 72 -14.212 -15.314 7.423 501 HG2 GLU 72 1HG GLU 72 -12.878 -17.196 7.640 502 HG3 GLU 72 2HG GLU 72 -13.439 -16.891 9.283 503 H GLY 73 H GLY 73 -15.499 -13.251 8.555 504 HA2 GLY 73 1HA GLY 73 -13.620 -12.877 10.691 505 HA3 GLY 73 2HA GLY 73 -14.359 -11.614 9.718 506 H VAL 74 H VAL 74 -17.059 -12.147 10.240 507 HA VAL 74 HA VAL 74 -17.370 -10.810 12.727 508 HB VAL 74 HB VAL 74 -19.497 -12.178 11.074 509 HG11 VAL 74 1HG1 VAL 74 -19.702 -9.982 13.133 510 HG12 VAL 74 2HG1 VAL 74 -21.035 -10.643 12.185 511 HG13 VAL 74 3HG1 VAL 74 -20.198 -11.658 13.359 512 HG21 VAL 74 3HG2 VAL 74 -17.900 -9.866 10.519 513 HG22 VAL 74 1HG2 VAL 74 -19.164 -10.608 9.539 514 HG23 VAL 74 2HG2 VAL 74 -19.582 -9.385 10.739 515 H GLN 75 H GLN 75 -17.365 -14.140 11.775 516 HA GLN 75 HA GLN 75 -18.564 -15.008 14.286 517 HB2 GLN 75 1HB GLN 75 -18.667 -17.178 13.352 518 HB3 GLN 75 2HB GLN 75 -19.098 -16.079 12.048 519 HG2 GLN 75 1HG GLN 75 -16.707 -16.218 11.287 520 HG3 GLN 75 2HG GLN 75 -16.493 -17.517 12.459 521 HE21 GLN 75 2HE2 GLN 75 -19.077 -16.678 10.176 522 HE22 GLN 75 1HE2 GLN 75 -19.116 -18.216 9.391 523 H GLY 76 H GLY 76 -15.902 -13.667 14.108 524 HA2 GLY 76 1HA GLY 76 -14.442 -15.682 15.664 525 HA3 GLY 76 2HA GLY 76 -13.622 -14.924 14.306 526 H MET 77 H MET 77 -14.685 -12.311 14.626 527 HA MET 77 HA MET 77 -12.840 -11.232 16.445 528 HB2 MET 77 1HB MET 77 -15.276 -10.016 15.140 529 HB3 MET 77 2HB MET 77 -14.122 -9.093 16.093 530 HG2 MET 77 1HG MET 77 -13.445 -10.655 13.612 531 HG3 MET 77 2HG MET 77 -13.749 -8.920 13.666 532 HE1 MET 77 3HE MET 77 -10.806 -7.554 15.752 533 HE2 MET 77 1HE MET 77 -12.465 -7.318 15.201 534 HE3 MET 77 2HE MET 77 -12.143 -8.294 16.634 535 H LYS 78 H LYS 78 -13.243 -9.993 18.378 536 HA LYS 78 HA LYS 78 -15.574 -10.974 19.892 537 HB2 LYS 78 1HB LYS 78 -12.925 -10.168 21.090 538 HB3 LYS 78 2HB LYS 78 -14.252 -11.011 21.879 539 HG2 LYS 78 1HG LYS 78 -13.853 -12.905 20.267 540 HG3 LYS 78 2HG LYS 78 -12.373 -12.072 19.789 541 HD2 LYS 78 1HD LYS 78 -11.759 -12.071 22.257 542 HD3 LYS 78 2HD LYS 78 -13.086 -13.214 22.480 543 HE2 LYS 78 1HE LYS 78 -12.035 -14.721 20.846 544 HE3 LYS 78 2HE LYS 78 -10.699 -13.585 20.671 545 HZ1 LYS 78 3HZ LYS 78 -11.436 -15.153 23.075 546 HZ2 LYS 78 1HZ LYS 78 -10.337 -13.868 23.120 547 HZ3 LYS 78 2HZ LYS 78 -10.001 -15.235 22.183 548 H VAL 79 H VAL 79 -16.533 -9.544 21.406 549 HA VAL 79 HA VAL 79 -16.993 -6.966 20.549 550 HB VAL 79 HB VAL 79 -17.183 -8.013 23.377 551 HG11 VAL 79 1HG1 VAL 79 -17.326 -5.744 23.712 552 HG12 VAL 79 2HG1 VAL 79 -18.018 -5.442 22.117 553 HG13 VAL 79 3HG1 VAL 79 -19.015 -6.140 23.394 554 HG21 VAL 79 3HG2 VAL 79 -19.680 -7.646 21.999 555 HG22 VAL 79 1HG2 VAL 79 -18.617 -8.708 21.076 556 HG23 VAL 79 2HG2 VAL 79 -19.018 -9.100 22.748 557 H GLY 80 H GLY 80 -15.857 -5.141 20.564 558 HA2 GLY 80 1HA GLY 80 -14.451 -3.478 21.392 559 HA3 GLY 80 2HA GLY 80 -14.029 -4.537 22.730 560 H GLY 81 H GLY 81 -13.709 -6.346 20.001 561 HA2 GLY 81 1HA GLY 81 -10.808 -5.896 19.985 562 HA3 GLY 81 2HA GLY 81 -11.629 -7.342 19.415 563 H VAL 82 H VAL 82 -9.684 -5.264 18.231 564 HA VAL 82 HA VAL 82 -11.179 -4.893 15.718 565 HB VAL 82 HB VAL 82 -9.123 -3.022 16.900 566 HG11 VAL 82 1HG1 VAL 82 -10.135 -1.671 14.815 567 HG12 VAL 82 2HG1 VAL 82 -8.681 -2.666 14.710 568 HG13 VAL 82 3HG1 VAL 82 -10.234 -3.313 14.179 569 HG21 VAL 82 3HG2 VAL 82 -11.009 -2.396 18.011 570 HG22 VAL 82 1HG2 VAL 82 -11.257 -1.482 16.523 571 HG23 VAL 82 2HG2 VAL 82 -12.087 -3.020 16.762 572 H ARG 83 H ARG 83 -10.300 -5.844 14.002 573 HA ARG 83 HA ARG 83 -7.442 -6.083 13.697 574 HB2 ARG 83 1HB ARG 83 -7.350 -8.095 14.718 575 HB3 ARG 83 2HB ARG 83 -9.088 -8.338 14.608 576 HG2 ARG 83 1HG ARG 83 -8.917 -9.173 12.393 577 HG3 ARG 83 2HG ARG 83 -7.226 -8.681 12.273 578 HD2 ARG 83 1HD ARG 83 -6.704 -10.749 12.916 579 HD3 ARG 83 2HD ARG 83 -7.291 -10.298 14.516 580 HE ARG 83 HE ARG 83 -9.409 -11.173 12.827 581 HH11 ARG 83 1HH1 ARG 83 -6.771 -12.298 14.801 582 HH12 ARG 83 2HH1 ARG 83 -7.500 -13.835 15.128 583 HH21 ARG 83 1HH2 ARG 83 -10.379 -13.193 13.251 584 HH22 ARG 83 2HH2 ARG 83 -9.552 -14.343 14.246 585 H ARG 84 H ARG 84 -6.814 -6.499 11.577 586 HA ARG 84 HA ARG 84 -8.904 -6.063 9.603 587 HB2 ARG 84 1HB ARG 84 -7.054 -4.662 9.246 588 HB3 ARG 84 2HB ARG 84 -5.902 -5.957 9.542 589 HG2 ARG 84 1HG ARG 84 -6.528 -7.012 7.438 590 HG3 ARG 84 2HG ARG 84 -7.710 -5.735 7.144 591 HD2 ARG 84 1HD ARG 84 -6.051 -4.734 6.019 592 HD3 ARG 84 2HD ARG 84 -5.445 -4.296 7.616 593 HE ARG 84 HE ARG 84 -4.368 -6.315 5.828 594 HH11 ARG 84 1HH1 ARG 84 -4.386 -4.910 9.013 595 HH12 ARG 84 2HH1 ARG 84 -2.835 -5.551 9.447 596 HH21 ARG 84 1HH2 ARG 84 -2.326 -7.164 6.387 597 HH22 ARG 84 2HH2 ARG 84 -1.664 -6.832 7.952 598 H LEU 85 H LEU 85 -9.615 -7.534 8.171 599 HA LEU 85 HA LEU 85 -8.257 -10.148 8.103 600 HB2 LEU 85 1HB LEU 85 -11.219 -9.633 7.887 601 HB3 LEU 85 2HB LEU 85 -10.428 -11.207 7.826 602 HG LEU 85 HG LEU 85 -10.211 -9.455 10.253 603 HD11 LEU 85 1HD1 LEU 85 -12.323 -9.783 10.834 604 HD12 LEU 85 2HD1 LEU 85 -12.165 -11.520 10.575 605 HD13 LEU 85 3HD1 LEU 85 -12.627 -10.467 9.237 606 HD21 LEU 85 3HD2 LEU 85 -9.518 -12.206 9.486 607 HD22 LEU 85 1HD2 LEU 85 -10.277 -12.036 11.069 608 HD23 LEU 85 2HD2 LEU 85 -8.799 -11.146 10.700 609 H THR 86 H THR 86 -7.503 -10.670 6.170 610 HA THR 86 HA THR 86 -8.187 -9.131 3.842 611 HB THR 86 HB THR 86 -6.483 -11.624 3.981 612 HG1 THR 86 HG1 THR 86 -4.822 -9.768 3.887 613 HG21 THR 86 3HG2 THR 86 -6.142 -11.345 1.796 614 HG22 THR 86 1HG2 THR 86 -5.697 -9.656 2.039 615 HG23 THR 86 2HG2 THR 86 -7.388 -10.097 1.802 616 H ILE 87 H ILE 87 -9.971 -9.494 2.707 617 HA ILE 87 HA ILE 87 -11.079 -12.209 2.606 618 HB ILE 87 HB ILE 87 -12.358 -9.584 1.834 619 HG12 ILE 87 1HG1 ILE 87 -12.939 -11.374 4.201 620 HG13 ILE 87 2HG1 ILE 87 -11.936 -9.930 4.284 621 HG21 ILE 87 1HG2 ILE 87 -14.370 -11.406 2.176 622 HG22 ILE 87 2HG2 ILE 87 -13.704 -10.898 0.625 623 HG23 ILE 87 3HG2 ILE 87 -13.115 -12.370 1.397 624 HD11 ILE 87 3HD1 ILE 87 -14.510 -9.398 3.072 625 HD12 ILE 87 1HD1 ILE 87 -14.657 -10.072 4.695 626 HD13 ILE 87 2HD1 ILE 87 -13.709 -8.607 4.431 627 HA PRO 88 HA PRO 88 -9.217 -12.196 -1.518 628 HB2 PRO 88 1HB PRO 88 -9.406 -14.885 -1.840 629 HB3 PRO 88 2HB PRO 88 -8.107 -14.116 -0.919 630 HG2 PRO 88 1HG PRO 88 -10.617 -15.415 0.068 631 HG3 PRO 88 2HG PRO 88 -8.967 -15.542 0.705 632 HD2 PRO 88 1HD PRO 88 -10.839 -13.935 1.820 633 HD3 PRO 88 2HD PRO 88 -9.110 -13.532 1.825 634 HA PRO 89 HA PRO 89 -12.704 -12.503 -4.178 635 HB2 PRO 89 1HB PRO 89 -11.729 -13.796 -6.357 636 HB3 PRO 89 2HB PRO 89 -11.296 -12.130 -5.954 637 HG2 PRO 89 1HG PRO 89 -9.774 -14.658 -5.448 638 HG3 PRO 89 2HG PRO 89 -9.180 -13.092 -6.030 639 HD2 PRO 89 1HD PRO 89 -8.914 -13.885 -3.455 640 HD3 PRO 89 2HD PRO 89 -9.127 -12.183 -3.913 641 H GLN 90 H GLN 90 -10.959 -15.548 -3.730 642 HA GLN 90 HA GLN 90 -13.020 -17.242 -4.669 643 HB2 GLN 90 1HB GLN 90 -11.777 -19.015 -3.373 644 HB3 GLN 90 2HB GLN 90 -10.820 -18.136 -4.558 645 HG2 GLN 90 1HG GLN 90 -9.514 -17.166 -2.993 646 HG3 GLN 90 2HG GLN 90 -10.815 -17.065 -1.809 647 HE21 GLN 90 2HE2 GLN 90 -7.965 -18.114 -1.804 648 HE22 GLN 90 1HE2 GLN 90 -8.102 -19.680 -1.087 649 H LEU 91 H LEU 91 -12.801 -15.352 -1.897 650 HA LEU 91 HA LEU 91 -14.951 -16.906 -0.620 651 HB2 LEU 91 1HB LEU 91 -12.517 -15.662 0.582 652 HB3 LEU 91 2HB LEU 91 -13.993 -15.788 1.536 653 HG LEU 91 HG LEU 91 -13.860 -18.314 0.848 654 HD11 LEU 91 1HD1 LEU 91 -11.436 -19.012 0.799 655 HD12 LEU 91 2HD1 LEU 91 -11.048 -17.331 0.437 656 HD13 LEU 91 3HD1 LEU 91 -12.053 -18.262 -0.674 657 HD21 LEU 91 3HD2 LEU 91 -11.778 -17.699 2.834 658 HD22 LEU 91 1HD2 LEU 91 -13.236 -18.683 2.978 659 HD23 LEU 91 2HD2 LEU 91 -13.340 -16.927 3.109 660 H GLY 92 H GLY 92 -14.527 -14.327 -2.373 661 HA2 GLY 92 1HA GLY 92 -16.602 -12.820 -0.958 662 HA3 GLY 92 2HA GLY 92 -15.118 -11.972 -1.368 663 H TYR 93 H TYR 93 -14.869 -11.160 -3.377 664 HA TYR 93 HA TYR 93 -17.112 -10.881 -5.047 665 HB2 TYR 93 1HB TYR 93 -14.220 -10.187 -5.249 666 HB3 TYR 93 2HB TYR 93 -15.180 -10.154 -6.724 667 HD1 TYR 93 HD2 TYR 93 -16.503 -9.302 -3.388 668 HD2 TYR 93 HD1 TYR 93 -15.063 -7.799 -7.099 669 HE1 TYR 93 HE2 TYR 93 -17.331 -7.063 -2.796 670 HE2 TYR 93 HE1 TYR 93 -15.886 -5.555 -6.516 671 HH TYR 93 HH TYR 93 -16.384 -4.374 -4.004 672 H GLY 94 H GLY 94 -14.026 -12.468 -5.892 673 HA2 GLY 94 1HA GLY 94 -14.040 -14.783 -6.671 674 HA3 GLY 94 2HA GLY 94 -15.595 -14.451 -7.417 675 H ALA 95 H ALA 95 -14.383 -15.441 -9.273 676 HA ALA 95 HA ALA 95 -12.422 -13.740 -10.558 677 HB1 ALA 95 1HB ALA 95 -13.368 -15.815 -12.280 678 HB2 ALA 95 2HB ALA 95 -11.787 -15.637 -11.517 679 HB3 ALA 95 3HB ALA 95 -13.086 -16.475 -10.669 680 H ARG 96 H ARG 96 -15.615 -13.444 -10.234 681 HA ARG 96 HA ARG 96 -16.513 -13.057 -12.903 682 HB2 ARG 96 1HB ARG 96 -18.089 -13.496 -11.102 683 HB3 ARG 96 2HB ARG 96 -17.604 -12.016 -10.284 684 HG2 ARG 96 1HG ARG 96 -19.667 -11.575 -11.350 685 HG3 ARG 96 2HG ARG 96 -18.421 -10.754 -12.292 686 HD2 ARG 96 1HD ARG 96 -19.706 -11.758 -13.934 687 HD3 ARG 96 2HD ARG 96 -18.405 -12.926 -13.703 688 HE ARG 96 HE ARG 96 -19.971 -14.432 -13.025 689 HH11 ARG 96 1HH1 ARG 96 -21.272 -11.230 -12.611 690 HH12 ARG 96 2HH1 ARG 96 -22.836 -11.788 -12.117 691 HH21 ARG 96 1HH2 ARG 96 -22.026 -15.179 -12.377 692 HH22 ARG 96 2HH2 ARG 96 -23.264 -14.035 -11.984 693 H GLY 97 H GLY 97 -14.859 -11.058 -10.582 694 HA2 GLY 97 1HA GLY 97 -13.746 -9.060 -10.938 695 HA3 GLY 97 2HA GLY 97 -14.315 -9.081 -12.600 696 H ALA 98 H ALA 98 -14.213 -6.759 -11.037 697 HA ALA 98 HA ALA 98 -17.013 -5.988 -11.148 698 HB1 ALA 98 1HB ALA 98 -16.756 -4.830 -8.883 699 HB2 ALA 98 2HB ALA 98 -17.003 -6.576 -8.883 700 HB3 ALA 98 3HB ALA 98 -15.389 -5.914 -8.626 701 H GLY 99 H GLY 99 -14.409 -5.414 -12.528 702 HA2 GLY 99 1HA GLY 99 -14.743 -2.837 -13.304 703 HA3 GLY 99 2HA GLY 99 -13.781 -2.681 -11.842 704 H GLY 100 H GLY 100 -12.729 -1.734 -14.138 705 HA2 GLY 100 1HA GLY 100 -11.221 -3.590 -15.646 706 HA3 GLY 100 2HA GLY 100 -10.905 -1.865 -15.528 707 H VAL 101 H VAL 101 -10.296 -1.525 -12.898 708 HA VAL 101 HA VAL 101 -7.651 -2.655 -12.784 709 HB VAL 101 HB VAL 101 -8.197 -0.295 -12.110 710 HG11 VAL 101 1HG1 VAL 101 -10.252 -1.164 -10.769 711 HG12 VAL 101 2HG1 VAL 101 -9.079 -1.381 -9.469 712 HG13 VAL 101 3HG1 VAL 101 -9.336 0.218 -10.169 713 HG21 VAL 101 3HG2 VAL 101 -6.478 -0.200 -10.548 714 HG22 VAL 101 1HG2 VAL 101 -6.932 -1.737 -9.810 715 HG23 VAL 101 2HG2 VAL 101 -6.157 -1.714 -11.395 716 H ILE 102 H ILE 102 -10.587 -3.841 -11.920 717 HA ILE 102 HA ILE 102 -9.543 -5.284 -9.579 718 HB ILE 102 HB ILE 102 -12.404 -4.921 -10.476 719 HG12 ILE 102 1HG1 ILE 102 -10.885 -3.771 -8.125 720 HG13 ILE 102 2HG1 ILE 102 -11.421 -2.879 -9.544 721 HG21 ILE 102 1HG2 ILE 102 -13.000 -6.008 -8.364 722 HG22 ILE 102 2HG2 ILE 102 -12.068 -7.081 -9.407 723 HG23 ILE 102 3HG2 ILE 102 -11.292 -6.295 -8.033 724 HD11 ILE 102 3HD1 ILE 102 -13.697 -4.141 -8.493 725 HD12 ILE 102 1HD1 ILE 102 -12.826 -3.441 -7.128 726 HD13 ILE 102 2HD1 ILE 102 -13.303 -2.422 -8.487 727 HA PRO 103 HA PRO 103 -9.356 -8.505 -12.816 728 HB2 PRO 103 1HB PRO 103 -7.359 -9.889 -11.606 729 HB3 PRO 103 2HB PRO 103 -7.065 -8.489 -12.644 730 HG2 PRO 103 1HG PRO 103 -7.157 -8.645 -9.656 731 HG3 PRO 103 2HG PRO 103 -6.013 -7.777 -10.697 732 HD2 PRO 103 1HD PRO 103 -8.077 -6.543 -9.453 733 HD3 PRO 103 2HD PRO 103 -7.461 -6.016 -11.032 734 HA PRO 104 HA PRO 104 -11.653 -11.700 -10.854 735 HB2 PRO 104 1HB PRO 104 -10.676 -13.948 -12.021 736 HB3 PRO 104 2HB PRO 104 -11.702 -12.790 -12.876 737 HG2 PRO 104 1HG PRO 104 -8.724 -13.087 -12.936 738 HG3 PRO 104 2HG PRO 104 -9.847 -12.800 -14.278 739 HD2 PRO 104 1HD PRO 104 -8.379 -10.819 -13.158 740 HD3 PRO 104 2HD PRO 104 -9.997 -10.543 -13.836 741 H ASN 105 H ASN 105 -8.262 -11.561 -10.475 742 HA ASN 105 HA ASN 105 -8.365 -13.561 -8.314 743 HB2 ASN 105 1HB ASN 105 -6.778 -14.051 -10.185 744 HB3 ASN 105 2HB ASN 105 -5.911 -12.572 -9.781 745 HD21 ASN 105 2HD2 ASN 105 -4.366 -12.666 -8.298 746 HD22 ASN 105 1HD2 ASN 105 -4.058 -14.011 -7.257 747 H ALA 106 H ALA 106 -8.787 -10.451 -8.598 748 HA ALA 106 HA ALA 106 -6.827 -9.284 -6.902 749 HB1 ALA 106 1HB ALA 106 -9.386 -7.921 -6.868 750 HB2 ALA 106 2HB ALA 106 -7.821 -7.373 -7.470 751 HB3 ALA 106 3HB ALA 106 -8.875 -8.339 -8.503 752 H THR 107 H THR 107 -6.952 -8.710 -4.730 753 HA THR 107 HA THR 107 -9.025 -10.119 -3.177 754 HB THR 107 HB THR 107 -6.132 -9.657 -2.427 755 HG1 THR 107 HG1 THR 107 -6.187 -12.020 -2.425 756 HG21 THR 107 3HG2 THR 107 -7.025 -11.340 -0.549 757 HG22 THR 107 1HG2 THR 107 -8.514 -10.445 -0.847 758 HG23 THR 107 2HG2 THR 107 -7.055 -9.589 -0.347 759 H LEU 108 H LEU 108 -9.901 -9.085 -1.394 760 HA LEU 108 HA LEU 108 -9.132 -6.268 -1.016 761 HB2 LEU 108 1HB LEU 108 -11.952 -7.302 -0.852 762 HB3 LEU 108 2HB LEU 108 -11.415 -5.624 -0.808 763 HG LEU 108 HG LEU 108 -10.643 -6.970 -3.268 764 HD11 LEU 108 1HD1 LEU 108 -12.782 -7.297 -4.224 765 HD12 LEU 108 2HD1 LEU 108 -13.595 -6.603 -2.821 766 HD13 LEU 108 3HD1 LEU 108 -12.785 -8.164 -2.688 767 HD21 LEU 108 3HD2 LEU 108 -10.500 -4.717 -3.476 768 HD22 LEU 108 1HD2 LEU 108 -11.828 -4.416 -2.355 769 HD23 LEU 108 2HD2 LEU 108 -12.170 -4.911 -4.013 770 H VAL 109 H VAL 109 -8.857 -5.622 1.039 771 HA VAL 109 HA VAL 109 -9.458 -7.574 3.157 772 HB VAL 109 HB VAL 109 -7.738 -6.494 4.493 773 HG11 VAL 109 1HG1 VAL 109 -7.312 -7.981 2.162 774 HG12 VAL 109 2HG1 VAL 109 -6.077 -6.720 2.157 775 HG13 VAL 109 3HG1 VAL 109 -6.223 -7.808 3.538 776 HG21 VAL 109 3HG2 VAL 109 -8.028 -4.409 2.495 777 HG22 VAL 109 1HG2 VAL 109 -7.344 -4.331 4.119 778 HG23 VAL 109 2HG2 VAL 109 -6.341 -4.846 2.763 779 H PHE 110 H PHE 110 -10.584 -6.988 4.970 780 HA PHE 110 HA PHE 110 -11.617 -4.235 5.078 781 HB2 PHE 110 1HB PHE 110 -13.120 -6.815 5.098 782 HB3 PHE 110 2HB PHE 110 -13.729 -5.483 6.074 783 HD1 PHE 110 HD1 PHE 110 -12.496 -6.147 2.618 784 HD2 PHE 110 HD2 PHE 110 -15.219 -4.028 5.110 785 HE1 PHE 110 HE1 PHE 110 -13.566 -5.183 0.623 786 HE2 PHE 110 HE2 PHE 110 -16.294 -3.062 3.119 787 HZ PHE 110 HZ PHE 110 -15.469 -3.639 0.872 788 H GLU 111 H GLU 111 -11.604 -3.291 7.041 789 HA GLU 111 HA GLU 111 -10.370 -4.758 9.221 790 HB2 GLU 111 1HB GLU 111 -9.652 -2.444 8.583 791 HB3 GLU 111 2HB GLU 111 -11.214 -1.859 9.138 792 HG2 GLU 111 1HG GLU 111 -10.628 -2.939 11.374 793 HG3 GLU 111 2HG GLU 111 -8.983 -3.043 10.748 794 H VAL 112 H VAL 112 -11.539 -5.798 10.680 795 HA VAL 112 HA VAL 112 -14.339 -5.032 11.089 796 HB VAL 112 HB VAL 112 -12.999 -7.498 12.182 797 HG11 VAL 112 1HG1 VAL 112 -15.203 -8.358 12.398 798 HG12 VAL 112 2HG1 VAL 112 -15.223 -6.729 13.076 799 HG13 VAL 112 3HG1 VAL 112 -15.885 -7.025 11.468 800 HG21 VAL 112 3HG2 VAL 112 -14.282 -8.518 10.108 801 HG22 VAL 112 1HG2 VAL 112 -13.969 -6.920 9.432 802 HG23 VAL 112 2HG2 VAL 112 -12.626 -7.929 9.968 803 H GLU 113 H GLU 113 -15.008 -4.075 12.900 804 HA GLU 113 HA GLU 113 -13.295 -4.202 15.285 805 HB2 GLU 113 1HB GLU 113 -14.741 -1.683 14.504 806 HB3 GLU 113 2HB GLU 113 -13.454 -1.884 15.684 807 HG2 GLU 113 1HG GLU 113 -12.022 -2.579 13.649 808 HG3 GLU 113 2HG GLU 113 -13.284 -1.791 12.704 809 H LEU 114 H LEU 114 -14.530 -5.459 16.563 810 HA LEU 114 HA LEU 114 -17.368 -5.388 16.610 811 HB2 LEU 114 1HB LEU 114 -15.515 -7.153 17.454 812 HB3 LEU 114 2HB LEU 114 -15.942 -6.398 18.988 813 HG LEU 114 HG LEU 114 -17.340 -8.239 18.911 814 HD11 LEU 114 1HD1 LEU 114 -19.584 -7.409 18.566 815 HD12 LEU 114 2HD1 LEU 114 -18.970 -6.070 17.597 816 HD13 LEU 114 3HD1 LEU 114 -18.591 -6.159 19.318 817 HD21 LEU 114 3HD2 LEU 114 -17.182 -7.838 16.008 818 HD22 LEU 114 1HD2 LEU 114 -18.741 -8.416 16.595 819 HD23 LEU 114 2HD2 LEU 114 -17.274 -9.328 16.948 820 H LEU 115 H LEU 115 -18.729 -4.143 17.729 821 HA LEU 115 HA LEU 115 -17.584 -2.218 19.627 822 HB2 LEU 115 1HB LEU 115 -20.240 -2.194 18.201 823 HB3 LEU 115 2HB LEU 115 -19.644 -0.934 19.279 824 HG LEU 115 HG LEU 115 -17.648 -1.045 17.433 825 HD11 LEU 115 1HD1 LEU 115 -19.665 -0.882 15.444 826 HD12 LEU 115 2HD1 LEU 115 -19.827 -2.433 16.267 827 HD13 LEU 115 3HD1 LEU 115 -18.288 -1.981 15.532 828 HD21 LEU 115 3HD2 LEU 115 -19.971 0.661 17.979 829 HD22 LEU 115 1HD2 LEU 115 -19.284 0.843 16.365 830 HD23 LEU 115 2HD2 LEU 115 -18.269 1.083 17.788 831 H ASP 116 H ASP 116 -20.321 -4.443 19.231 832 HA ASP 116 HA ASP 116 -20.256 -5.278 21.929 833 HB2 ASP 116 1HB ASP 116 -21.277 -2.903 22.037 834 HB3 ASP 116 2HB ASP 116 -22.708 -3.644 21.326 835 H VAL 117 H VAL 117 -22.275 -6.601 22.472 836 HA VAL 117 HA VAL 117 -23.148 -7.983 20.021 837 HB VAL 117 HB VAL 117 -23.611 -9.921 21.587 838 HG11 VAL 117 1HG1 VAL 117 -20.841 -9.941 21.939 839 HG12 VAL 117 2HG1 VAL 117 -21.750 -10.605 20.580 840 HG13 VAL 117 3HG1 VAL 117 -21.122 -8.958 20.502 841 HG21 VAL 117 3HG2 VAL 117 -23.187 -8.091 23.563 842 HG22 VAL 117 1HG2 VAL 117 -23.129 -9.841 23.777 843 HG23 VAL 117 2HG2 VAL 117 -21.639 -8.934 23.517 844 H13 JZF 130 1H3 JZF 130 -20.496 -3.486 -2.010 845 H23 JZF 130 2H3 JZF 130 -19.699 -5.026 -2.273 846 H4 JZF 130 H4 JZF 130 -19.130 -3.014 -0.066 847 H15 JZF 130 1H5 JZF 130 -17.340 -4.474 0.701 848 H25 JZF 130 2H5 JZF 130 -17.684 -5.653 -0.554 849 H17 JZF 130 1H7 JZF 130 -16.952 -2.587 -1.080 850 H27 JZF 130 2H7 JZF 130 -17.272 -3.749 -2.327 851 H8 JZF 130 H8 JZF 130 -19.309 -2.075 -2.762 852 H9 JZF 130 H9 JZF 130 -16.705 -2.405 -4.103 853 H1OH JZF 130 1HO JZF 130 -17.194 -0.365 -1.935 854 H11 JZF 130 H11 JZF 130 -17.099 -3.332 -6.489 855 H112 JZF 130 1H12 JZF 130 -18.734 -0.850 -7.222 856 H212 JZF 130 2H12 JZF 130 -17.327 -1.444 -8.090 857 H13A JZF 130 H13 JZF 130 -16.887 0.519 -6.567 858 H114 JZF 130 1H14 JZF 130 -16.791 0.144 -4.131 859 H214 JZF 130 2H14 JZF 130 -18.408 0.058 -4.783 860 H115 JZF 130 1H15 JZF 130 -22.257 -5.597 1.759 861 H215 JZF 130 2H15 JZF 130 -20.966 -6.621 2.388 862 H116 JZF 130 1H16 JZF 130 -21.624 -7.246 -1.602 863 H216 JZF 130 2H16 JZF 130 -19.900 -7.643 -1.337 864 H117 JZF 130 2H17 JZF 130 -21.424 -10.117 -1.323 865 H217 JZF 130 3H17 JZF 130 -21.882 -9.200 -2.771 866 H317 JZF 130 1H17 JZF 130 -20.183 -9.611 -2.483 867 H118 JZF 130 1H18 JZF 130 -18.705 -3.455 -8.485 868 H218 JZF 130 2H18 JZF 130 -19.020 -4.611 -7.184 869 H318 JZF 130 3H18 JZF 130 -20.029 -3.163 -7.345 870 H119 JZF 130 3H19 JZF 130 -14.861 -0.711 -5.302 871 H219 JZF 130 1H19 JZF 130 -15.353 -2.058 -6.333 872 H319 JZF 130 2H19 JZF 130 -14.870 -0.525 -7.059 Start of MODEL 2 1 H1 GLY 1 H GLY 1 11.097 -1.442 23.380 2 HA2 GLY 1 1HA GLY 1 8.740 -2.100 23.574 3 HA3 GLY 1 2HA GLY 1 8.330 -0.406 23.349 4 HA PRO 2 HA PRO 2 9.858 -2.071 19.059 5 HB2 PRO 2 1HB PRO 2 10.068 -4.769 18.841 6 HB3 PRO 2 2HB PRO 2 11.416 -3.737 19.333 7 HG2 PRO 2 1HG PRO 2 9.565 -5.370 21.026 8 HG3 PRO 2 2HG PRO 2 11.323 -5.178 21.156 9 HD2 PRO 2 1HD PRO 2 9.590 -3.838 22.747 10 HD3 PRO 2 2HD PRO 2 11.148 -3.153 22.243 11 H GLY 3 H GLY 3 8.776 -3.542 17.324 12 HA2 GLY 3 1HA GLY 3 6.174 -4.579 18.035 13 HA3 GLY 3 2HA GLY 3 6.118 -3.067 17.141 14 H SER 4 H SER 4 4.943 -5.317 16.112 15 HA SER 4 HA SER 4 6.486 -5.666 13.676 16 HB2 SER 4 1HB SER 4 5.560 -8.041 15.312 17 HB3 SER 4 2HB SER 4 6.272 -8.122 13.700 18 HG SER 4 HG SER 4 8.022 -8.359 14.894 19 H MET 5 H MET 5 5.232 -6.064 11.882 20 HA MET 5 HA MET 5 2.338 -6.358 12.320 21 HB2 MET 5 1HB MET 5 3.798 -4.303 10.710 22 HB3 MET 5 2HB MET 5 2.217 -4.850 10.167 23 HG2 MET 5 1HG MET 5 1.357 -4.268 12.460 24 HG3 MET 5 2HG MET 5 2.911 -3.490 12.751 25 HE1 MET 5 3HE MET 5 1.870 -0.395 12.614 26 HE2 MET 5 1HE MET 5 3.246 -1.495 12.708 27 HE3 MET 5 2HE MET 5 3.073 -0.416 11.323 28 H THR 6 H THR 6 2.513 -8.565 11.798 29 HA THR 6 HA THR 6 3.181 -9.124 8.982 30 HB THR 6 HB THR 6 4.672 -10.343 10.429 31 HG1 THR 6 HG1 THR 6 4.398 -12.152 9.335 32 HG21 THR 6 3HG2 THR 6 2.426 -10.486 12.141 33 HG22 THR 6 1HG2 THR 6 4.067 -11.049 12.453 34 HG23 THR 6 2HG2 THR 6 2.881 -12.143 11.741 35 H VAL 7 H VAL 7 1.698 -10.095 7.700 36 HA VAL 7 HA VAL 7 -0.995 -10.386 8.786 37 HB VAL 7 HB VAL 7 -0.779 -9.078 6.748 38 HG11 VAL 7 1HG1 VAL 7 -0.201 -11.204 4.889 39 HG12 VAL 7 2HG1 VAL 7 0.571 -9.627 5.068 40 HG13 VAL 7 3HG1 VAL 7 1.120 -10.995 6.038 41 HG21 VAL 7 3HG2 VAL 7 -2.440 -10.230 5.374 42 HG22 VAL 7 1HG2 VAL 7 -2.117 -11.734 6.237 43 HG23 VAL 7 2HG2 VAL 7 -2.831 -10.364 7.088 44 H VAL 8 H VAL 8 -1.881 -12.291 9.234 45 HA VAL 8 HA VAL 8 -0.510 -14.722 8.311 46 HB VAL 8 HB VAL 8 -2.447 -14.364 10.602 47 HG11 VAL 8 1HG1 VAL 8 -2.699 -16.571 9.740 48 HG12 VAL 8 2HG1 VAL 8 -0.952 -16.782 9.606 49 HG13 VAL 8 3HG1 VAL 8 -1.711 -16.684 11.195 50 HG21 VAL 8 3HG2 VAL 8 -0.211 -15.137 11.798 51 HG22 VAL 8 1HG2 VAL 8 0.515 -14.357 10.393 52 HG23 VAL 8 2HG2 VAL 8 -0.547 -13.439 11.461 53 H THR 9 H THR 9 -1.603 -16.355 7.279 54 HA THR 9 HA THR 9 -4.306 -15.672 6.329 55 HB THR 9 HB THR 9 -2.368 -17.580 5.015 56 HG1 THR 9 HG1 THR 9 -1.624 -15.915 3.855 57 HG21 THR 9 3HG2 THR 9 -4.412 -18.124 4.123 58 HG22 THR 9 1HG2 THR 9 -3.940 -16.817 3.037 59 HG23 THR 9 2HG2 THR 9 -5.068 -16.503 4.357 60 H THR 10 H THR 10 -5.875 -17.329 6.149 61 HA THR 10 HA THR 10 -5.552 -19.421 8.161 62 HB THR 10 HB THR 10 -7.961 -19.714 8.034 63 HG1 THR 10 HG1 THR 10 -9.083 -18.999 6.377 64 HG21 THR 10 3HG2 THR 10 -8.303 -16.925 8.145 65 HG22 THR 10 1HG2 THR 10 -6.666 -17.243 8.718 66 HG23 THR 10 2HG2 THR 10 -8.041 -18.031 9.492 67 H GLU 11 H GLU 11 -7.153 -21.403 7.433 68 HA GLU 11 HA GLU 11 -5.666 -22.724 5.373 69 HB2 GLU 11 1HB GLU 11 -8.149 -23.630 6.841 70 HB3 GLU 11 2HB GLU 11 -7.107 -24.648 5.856 71 HG2 GLU 11 1HG GLU 11 -6.073 -23.166 8.247 72 HG3 GLU 11 2HG GLU 11 -6.821 -24.757 8.380 73 H SER 12 H SER 12 -8.678 -21.021 5.557 74 HA SER 12 HA SER 12 -9.761 -22.099 3.122 75 HB2 SER 12 1HB SER 12 -10.946 -20.933 5.209 76 HB3 SER 12 2HB SER 12 -10.730 -19.498 4.206 77 HG SER 12 HG SER 12 -12.738 -20.774 3.925 78 H GLY 13 H GLY 13 -8.052 -19.159 4.081 79 HA2 GLY 13 1HA GLY 13 -6.523 -18.552 2.056 80 HA3 GLY 13 2HA GLY 13 -8.075 -18.232 1.296 81 H LEU 14 H LEU 14 -9.368 -17.145 3.599 82 HA LEU 14 HA LEU 14 -8.646 -14.446 3.346 83 HB2 LEU 14 1HB LEU 14 -10.856 -14.881 3.973 84 HB3 LEU 14 2HB LEU 14 -10.366 -15.952 5.284 85 HG LEU 14 HG LEU 14 -9.549 -13.124 5.541 86 HD11 LEU 14 1HD1 LEU 14 -11.960 -13.231 4.591 87 HD12 LEU 14 2HD1 LEU 14 -11.626 -12.228 6.003 88 HD13 LEU 14 3HD1 LEU 14 -12.381 -13.809 6.204 89 HD21 LEU 14 3HD2 LEU 14 -10.278 -15.426 7.238 90 HD22 LEU 14 1HD2 LEU 14 -10.709 -13.832 7.856 91 HD23 LEU 14 2HD2 LEU 14 -9.030 -14.199 7.459 92 H LYS 15 H LYS 15 -7.547 -13.035 4.683 93 HA LYS 15 HA LYS 15 -5.787 -14.311 6.669 94 HB2 LYS 15 1HB LYS 15 -5.369 -11.773 5.078 95 HB3 LYS 15 2HB LYS 15 -4.250 -12.416 6.273 96 HG2 LYS 15 1HG LYS 15 -3.266 -13.304 4.458 97 HG3 LYS 15 2HG LYS 15 -4.487 -14.560 4.675 98 HD2 LYS 15 1HD LYS 15 -5.926 -13.496 3.050 99 HD3 LYS 15 2HD LYS 15 -4.805 -12.140 2.900 100 HE2 LYS 15 1HE LYS 15 -4.154 -15.005 2.214 101 HE3 LYS 15 2HE LYS 15 -4.626 -13.773 1.045 102 HZ1 LYS 15 3HZ LYS 15 -2.588 -12.603 2.395 103 HZ2 LYS 15 1HZ LYS 15 -2.455 -13.368 0.891 104 HZ3 LYS 15 2HZ LYS 15 -2.087 -14.217 2.307 105 H TYR 16 H TYR 16 -5.051 -12.772 8.430 106 HA TYR 16 HA TYR 16 -7.017 -10.757 9.167 107 HB2 TYR 16 1HB TYR 16 -7.563 -11.724 11.287 108 HB3 TYR 16 2HB TYR 16 -7.839 -12.960 10.064 109 HD1 TYR 16 HD2 TYR 16 -5.761 -14.549 9.633 110 HD2 TYR 16 HD1 TYR 16 -6.402 -12.312 13.195 111 HE1 TYR 16 HE2 TYR 16 -4.297 -16.097 10.862 112 HE2 TYR 16 HE1 TYR 16 -4.938 -13.853 14.433 113 HH TYR 16 HH TYR 16 -3.844 -15.816 14.355 114 H GLU 17 H GLU 17 -6.230 -9.197 10.545 115 HA GLU 17 HA GLU 17 -3.565 -9.553 11.689 116 HB2 GLU 17 1HB GLU 17 -3.925 -8.203 9.283 117 HB3 GLU 17 2HB GLU 17 -3.831 -6.921 10.482 118 HG2 GLU 17 1HG GLU 17 -1.800 -9.050 10.680 119 HG3 GLU 17 2HG GLU 17 -1.691 -7.983 9.282 120 H ASP 18 H ASP 18 -3.674 -8.979 13.746 121 HA ASP 18 HA ASP 18 -5.856 -7.659 14.911 122 HB2 ASP 18 1HB ASP 18 -3.074 -8.281 15.875 123 HB3 ASP 18 2HB ASP 18 -4.204 -7.377 16.880 124 H LEU 19 H LEU 19 -6.288 -5.572 15.376 125 HA LEU 19 HA LEU 19 -4.265 -3.571 14.608 126 HB2 LEU 19 1HB LEU 19 -7.161 -3.777 14.004 127 HB3 LEU 19 2HB LEU 19 -6.509 -2.169 14.315 128 HG LEU 19 HG LEU 19 -5.562 -4.066 12.166 129 HD11 LEU 19 1HD1 LEU 19 -6.517 -1.787 10.970 130 HD12 LEU 19 2HD1 LEU 19 -7.680 -2.070 12.265 131 HD13 LEU 19 3HD1 LEU 19 -7.363 -3.331 11.074 132 HD21 LEU 19 3HD2 LEU 19 -4.659 -1.356 13.066 133 HD22 LEU 19 1HD2 LEU 19 -4.450 -1.871 11.393 134 HD23 LEU 19 2HD2 LEU 19 -3.697 -2.788 12.698 135 H THR 20 H THR 20 -6.921 -4.376 16.780 136 HA THR 20 HA THR 20 -5.694 -2.894 18.915 137 HB THR 20 HB THR 20 -8.440 -2.006 18.014 138 HG1 THR 20 HG1 THR 20 -7.409 -0.139 17.298 139 HG21 THR 20 3HG2 THR 20 -6.608 -1.188 20.256 140 HG22 THR 20 1HG2 THR 20 -8.290 -1.710 20.347 141 HG23 THR 20 2HG2 THR 20 -7.892 -0.133 19.664 142 H GLU 21 H GLU 21 -5.953 -4.102 20.667 143 HA GLU 21 HA GLU 21 -7.597 -6.361 20.789 144 HB2 GLU 21 1HB GLU 21 -6.890 -6.603 23.036 145 HB3 GLU 21 2HB GLU 21 -5.540 -5.865 22.186 146 HG2 GLU 21 1HG GLU 21 -7.541 -4.385 23.878 147 HG3 GLU 21 2HG GLU 21 -5.928 -4.873 24.394 148 H GLY 22 H GLY 22 -9.239 -6.719 22.600 149 HA2 GLY 22 1HA GLY 22 -10.920 -4.358 23.061 150 HA3 GLY 22 2HA GLY 22 -11.628 -5.734 22.227 151 H SER 23 H SER 23 -10.356 -7.788 23.704 152 HA SER 23 HA SER 23 -10.674 -9.063 25.562 153 HB2 SER 23 1HB SER 23 -9.481 -6.910 26.511 154 HB3 SER 23 2HB SER 23 -11.051 -6.629 27.264 155 HG SER 23 HG SER 23 -9.391 -8.912 27.552 156 H GLY 24 H GLY 24 -12.830 -9.245 24.265 157 HA2 GLY 24 1HA GLY 24 -14.987 -8.807 26.217 158 HA3 GLY 24 2HA GLY 24 -15.222 -8.311 24.547 159 H ALA 25 H ALA 25 -16.942 -9.712 24.201 160 HA ALA 25 HA ALA 25 -16.366 -12.585 24.407 161 HB1 ALA 25 1HB ALA 25 -18.464 -12.834 25.084 162 HB2 ALA 25 2HB ALA 25 -18.634 -11.078 25.070 163 HB3 ALA 25 3HB ALA 25 -19.074 -12.018 23.644 164 H GLU 26 H GLU 26 -16.468 -13.930 22.650 165 HA GLU 26 HA GLU 26 -16.133 -12.689 20.073 166 HB2 GLU 26 1HB GLU 26 -14.880 -14.743 20.990 167 HB3 GLU 26 2HB GLU 26 -16.327 -15.650 20.573 168 HG2 GLU 26 1HG GLU 26 -15.766 -14.193 18.288 169 HG3 GLU 26 2HG GLU 26 -14.185 -14.698 18.882 170 H ALA 27 H ALA 27 -17.479 -12.794 18.320 171 HA ALA 27 HA ALA 27 -20.243 -12.904 18.751 172 HB1 ALA 27 1HB ALA 27 -18.463 -12.591 16.439 173 HB2 ALA 27 2HB ALA 27 -20.051 -13.263 16.067 174 HB3 ALA 27 3HB ALA 27 -19.922 -11.704 16.880 175 H ARG 28 H ARG 28 -21.824 -14.398 18.074 176 HA ARG 28 HA ARG 28 -20.859 -17.103 17.453 177 HB2 ARG 28 1HB ARG 28 -22.883 -16.368 19.573 178 HB3 ARG 28 2HB ARG 28 -22.599 -18.008 19.005 179 HG2 ARG 28 1HG ARG 28 -20.376 -18.001 19.864 180 HG3 ARG 28 2HG ARG 28 -20.467 -16.278 20.231 181 HD2 ARG 28 1HD ARG 28 -20.839 -17.238 22.300 182 HD3 ARG 28 2HD ARG 28 -22.479 -16.958 21.717 183 HE ARG 28 HE ARG 28 -22.809 -19.220 21.681 184 HH11 ARG 28 1HH1 ARG 28 -19.391 -18.576 21.837 185 HH12 ARG 28 2HH1 ARG 28 -18.956 -20.238 22.067 186 HH21 ARG 28 1HH2 ARG 28 -22.249 -21.410 21.983 187 HH22 ARG 28 2HH2 ARG 28 -20.583 -21.849 22.149 188 H ALA 29 H ALA 29 -22.087 -18.243 16.029 189 HA ALA 29 HA ALA 29 -23.831 -16.879 14.314 190 HB1 ALA 29 1HB ALA 29 -23.407 -19.833 14.726 191 HB2 ALA 29 2HB ALA 29 -24.366 -19.144 13.415 192 HB3 ALA 29 3HB ALA 29 -22.640 -18.796 13.523 193 H GLY 30 H GLY 30 -25.855 -16.243 14.629 194 HA2 GLY 30 1HA GLY 30 -28.164 -17.018 14.997 195 HA3 GLY 30 2HA GLY 30 -27.563 -17.865 16.414 196 H GLN 31 H GLN 31 -25.801 -15.374 16.860 197 HA GLN 31 HA GLN 31 -27.875 -13.873 18.300 198 HB2 GLN 31 1HB GLN 31 -26.362 -13.446 19.967 199 HB3 GLN 31 2HB GLN 31 -25.734 -14.983 19.387 200 HG2 GLN 31 1HG GLN 31 -24.090 -13.795 18.024 201 HG3 GLN 31 2HG GLN 31 -24.715 -12.258 18.616 202 HE21 GLN 31 2HE2 GLN 31 -25.084 -12.798 21.268 203 HE22 GLN 31 1HE2 GLN 31 -23.559 -13.106 22.020 204 H THR 32 H THR 32 -27.875 -11.597 18.285 205 HA THR 32 HA THR 32 -26.812 -10.463 15.814 206 HB THR 32 HB THR 32 -28.603 -9.013 17.748 207 HG1 THR 32 HG1 THR 32 -30.283 -10.147 17.079 208 HG21 THR 32 3HG2 THR 32 -27.420 -7.979 15.670 209 HG22 THR 32 1HG2 THR 32 -29.123 -7.629 15.962 210 HG23 THR 32 2HG2 THR 32 -28.663 -8.836 14.760 211 H VAL 33 H VAL 33 -25.421 -8.739 15.724 212 HA VAL 33 HA VAL 33 -24.550 -7.444 18.176 213 HB VAL 33 HB VAL 33 -22.187 -7.907 17.835 214 HG11 VAL 33 1HG1 VAL 33 -22.160 -10.269 18.468 215 HG12 VAL 33 2HG1 VAL 33 -23.456 -9.399 19.293 216 HG13 VAL 33 3HG1 VAL 33 -23.827 -10.439 17.917 217 HG21 VAL 33 3HG2 VAL 33 -21.842 -8.232 15.573 218 HG22 VAL 33 1HG2 VAL 33 -21.701 -9.874 16.199 219 HG23 VAL 33 2HG2 VAL 33 -23.195 -9.353 15.420 220 H SER 34 H SER 34 -23.047 -5.639 17.741 221 HA SER 34 HA SER 34 -23.551 -4.492 15.074 222 HB2 SER 34 1HB SER 34 -23.726 -3.379 17.791 223 HB3 SER 34 2HB SER 34 -22.871 -2.349 16.643 224 HG SER 34 HG SER 34 -24.915 -1.788 16.294 225 H VAL 35 H VAL 35 -21.834 -4.348 13.808 226 HA VAL 35 HA VAL 35 -19.215 -3.775 15.013 227 HB VAL 35 HB VAL 35 -18.087 -5.377 13.660 228 HG11 VAL 35 1HG1 VAL 35 -19.859 -6.084 15.652 229 HG12 VAL 35 2HG1 VAL 35 -20.211 -7.234 14.360 230 HG13 VAL 35 3HG1 VAL 35 -18.572 -7.096 14.998 231 HG21 VAL 35 3HG2 VAL 35 -20.636 -5.417 12.175 232 HG22 VAL 35 1HG2 VAL 35 -18.978 -5.573 11.594 233 HG23 VAL 35 2HG2 VAL 35 -19.796 -6.961 12.312 234 H HIS 36 H HIS 36 -17.632 -2.944 13.441 235 HA HIS 36 HA HIS 36 -18.969 -1.412 11.309 236 HB2 HIS 36 1HB HIS 36 -17.186 -0.604 13.432 237 HB3 HIS 36 2HB HIS 36 -16.492 -0.206 11.863 238 HD1 HIS 36 HD1 HIS 36 -18.411 1.050 10.223 239 HD2 HIS 36 HD2 HIS 36 -18.780 1.364 14.350 240 HE1 HIS 36 HE1 HIS 36 -19.883 3.051 10.616 241 H TYR 37 H TYR 37 -18.266 -1.620 9.269 242 HA TYR 37 HA TYR 37 -15.859 -3.260 8.826 243 HB2 TYR 37 1HB TYR 37 -16.864 -3.993 6.736 244 HB3 TYR 37 2HB TYR 37 -17.972 -4.301 8.068 245 HD1 TYR 37 HD1 TYR 37 -20.008 -2.948 8.329 246 HD2 TYR 37 HD2 TYR 37 -17.407 -2.416 5.004 247 HE1 TYR 37 HE1 TYR 37 -21.777 -1.709 7.151 248 HE2 TYR 37 HE2 TYR 37 -19.169 -1.175 3.817 249 HH TYR 37 HH TYR 37 -22.149 -1.294 4.305 250 H THR 38 H THR 38 -14.208 -2.398 7.743 251 HA THR 38 HA THR 38 -14.659 0.145 6.319 252 HB THR 38 HB THR 38 -11.913 -0.411 7.231 253 HG1 THR 38 HG1 THR 38 -14.076 -0.092 9.029 254 HG21 THR 38 3HG2 THR 38 -12.728 1.695 6.133 255 HG22 THR 38 1HG2 THR 38 -11.899 1.939 7.670 256 HG23 THR 38 2HG2 THR 38 -13.659 2.021 7.595 257 H GLY 39 H GLY 39 -14.624 -0.266 4.199 258 HA2 GLY 39 1HA GLY 39 -13.330 -2.474 3.004 259 HA3 GLY 39 2HA GLY 39 -13.961 -1.072 2.153 260 H TRP 40 H TRP 40 -11.179 -2.720 3.166 261 HA TRP 40 HA TRP 40 -9.490 -0.428 2.406 262 HB2 TRP 40 1HB TRP 40 -8.913 -2.738 4.265 263 HB3 TRP 40 2HB TRP 40 -7.678 -1.619 3.694 264 HD1 TRP 40 HD1 TRP 40 -10.320 0.675 4.063 265 HE1 TRP 40 HE1 TRP 40 -10.417 1.750 6.400 266 HE3 TRP 40 HE3 TRP 40 -7.382 -2.647 6.606 267 HZ2 TRP 40 HZ2 TRP 40 -9.384 1.254 8.980 268 HZ3 TRP 40 HZ3 TRP 40 -6.986 -2.275 9.006 269 HH2 TRP 40 HH2 TRP 40 -7.966 -0.363 10.166 270 H LEU 41 H LEU 41 -7.694 -0.809 1.055 271 HA LEU 41 HA LEU 41 -8.063 -3.088 -0.731 272 HB2 LEU 41 1HB LEU 41 -6.846 -0.402 -0.938 273 HB3 LEU 41 2HB LEU 41 -6.096 -1.680 -1.893 274 HG LEU 41 HG LEU 41 -8.639 -2.061 -2.618 275 HD11 LEU 41 1HD1 LEU 41 -9.224 -0.078 -1.074 276 HD12 LEU 41 2HD1 LEU 41 -9.938 -0.142 -2.686 277 HD13 LEU 41 3HD1 LEU 41 -8.566 0.921 -2.371 278 HD21 LEU 41 3HD2 LEU 41 -7.448 0.200 -4.051 279 HD22 LEU 41 1HD2 LEU 41 -7.897 -1.405 -4.629 280 HD23 LEU 41 2HD2 LEU 41 -6.357 -1.165 -3.804 281 H THR 42 H THR 42 -6.231 -4.331 -1.471 282 HA THR 42 HA THR 42 -4.664 -5.355 0.611 283 HB THR 42 HB THR 42 -3.590 -6.731 -0.994 284 HG1 THR 42 HG1 THR 42 -3.593 -6.206 -3.217 285 HG21 THR 42 3HG2 THR 42 -6.293 -6.136 -2.193 286 HG22 THR 42 1HG2 THR 42 -6.063 -7.057 -0.707 287 HG23 THR 42 2HG2 THR 42 -5.413 -7.664 -2.230 288 H ASP 43 H ASP 43 -4.213 -2.597 -1.356 289 HA ASP 43 HA ASP 43 -1.345 -2.490 -1.106 290 HB2 ASP 43 1HB ASP 43 -3.394 -0.495 -2.078 291 HB3 ASP 43 2HB ASP 43 -1.667 -0.155 -2.029 292 H GLY 44 H GLY 44 -4.041 -1.578 0.804 293 HA2 GLY 44 1HA GLY 44 -3.656 -1.070 3.137 294 HA3 GLY 44 2HA GLY 44 -2.215 -0.188 2.656 295 H GLN 45 H GLN 45 -4.638 0.461 0.473 296 HA GLN 45 HA GLN 45 -5.183 3.027 1.781 297 HB2 GLN 45 1HB GLN 45 -5.836 3.824 -0.435 298 HB3 GLN 45 2HB GLN 45 -4.221 3.129 -0.471 299 HG2 GLN 45 1HG GLN 45 -5.430 0.971 -1.226 300 HG3 GLN 45 2HG GLN 45 -6.764 2.058 -1.613 301 HE21 GLN 45 2HE2 GLN 45 -6.748 3.016 -3.524 302 HE22 GLN 45 1HE2 GLN 45 -5.395 3.111 -4.594 303 H LYS 46 H LYS 46 -7.205 3.690 2.300 304 HA LYS 46 HA LYS 46 -9.292 1.672 2.279 305 HB2 LYS 46 1HB LYS 46 -8.856 2.966 4.326 306 HB3 LYS 46 2HB LYS 46 -9.257 4.451 3.474 307 HG2 LYS 46 1HG LYS 46 -11.356 2.443 3.302 308 HG3 LYS 46 2HG LYS 46 -10.985 2.924 4.959 309 HD2 LYS 46 1HD LYS 46 -11.455 4.925 2.762 310 HD3 LYS 46 2HD LYS 46 -12.768 4.272 3.745 311 HE2 LYS 46 1HE LYS 46 -11.765 5.142 5.750 312 HE3 LYS 46 2HE LYS 46 -10.329 5.650 4.863 313 HZ1 LYS 46 3HZ LYS 46 -12.966 6.698 4.084 314 HZ2 LYS 46 1HZ LYS 46 -11.436 7.396 3.893 315 HZ3 LYS 46 2HZ LYS 46 -12.166 7.363 5.418 316 H PHE 47 H PHE 47 -11.370 1.975 1.407 317 HA PHE 47 HA PHE 47 -11.735 4.234 -0.417 318 HB2 PHE 47 1HB PHE 47 -12.301 2.867 -2.285 319 HB3 PHE 47 2HB PHE 47 -10.772 2.253 -1.666 320 HD1 PHE 47 HD2 PHE 47 -10.913 0.259 -0.027 321 HD2 PHE 47 HD1 PHE 47 -14.068 1.423 -2.636 322 HE1 PHE 47 HE2 PHE 47 -11.891 -1.991 0.158 323 HE2 PHE 47 HE1 PHE 47 -15.052 -0.825 -2.454 324 HZ PHE 47 HZ PHE 47 -13.963 -2.536 -1.057 325 H ASP 48 H ASP 48 -12.867 2.861 2.158 326 HA ASP 48 HA ASP 48 -15.483 3.834 1.922 327 HB2 ASP 48 1HB ASP 48 -15.328 1.496 0.562 328 HB3 ASP 48 2HB ASP 48 -15.739 0.898 2.167 329 H SER 49 H SER 49 -16.094 4.318 3.923 330 HA SER 49 HA SER 49 -15.615 2.509 6.126 331 HB2 SER 49 1HB SER 49 -14.352 4.099 7.481 332 HB3 SER 49 2HB SER 49 -13.485 3.767 5.982 333 HG SER 49 HG SER 49 -14.486 6.112 6.916 334 H SER 50 H SER 50 -17.654 2.434 6.838 335 HA SER 50 HA SER 50 -19.468 4.613 6.713 336 HB2 SER 50 1HB SER 50 -19.636 1.859 7.224 337 HB3 SER 50 2HB SER 50 -20.221 2.641 8.693 338 HG SER 50 HG SER 50 -21.698 2.217 6.738 339 H LYS 51 H LYS 51 -17.148 3.559 9.052 340 HA LYS 51 HA LYS 51 -18.166 4.676 11.391 341 HB2 LYS 51 1HB LYS 51 -15.968 4.537 12.273 342 HB3 LYS 51 2HB LYS 51 -16.128 3.195 11.147 343 HG2 LYS 51 1HG LYS 51 -15.032 4.750 9.433 344 HG3 LYS 51 2HG LYS 51 -14.582 5.740 10.824 345 HD2 LYS 51 1HD LYS 51 -13.965 2.800 10.673 346 HD3 LYS 51 2HD LYS 51 -12.874 4.028 10.027 347 HE2 LYS 51 1HE LYS 51 -13.885 4.100 12.857 348 HE3 LYS 51 2HE LYS 51 -12.432 3.212 12.399 349 HZ1 LYS 51 3HZ LYS 51 -11.268 5.084 12.347 350 HZ2 LYS 51 1HZ LYS 51 -12.592 5.874 13.043 351 HZ3 LYS 51 2HZ LYS 51 -12.402 5.863 11.363 352 H ASP 52 H ASP 52 -16.762 6.183 8.609 353 HA ASP 52 HA ASP 52 -15.927 8.618 9.706 354 HB2 ASP 52 1HB ASP 52 -15.267 8.180 7.484 355 HB3 ASP 52 2HB ASP 52 -16.918 7.846 6.970 356 H ARG 53 H ARG 53 -19.076 7.350 9.203 357 HA ARG 53 HA ARG 53 -20.232 9.965 9.915 358 HB2 ARG 53 1HB ARG 53 -20.703 9.177 7.545 359 HB3 ARG 53 2HB ARG 53 -21.640 7.873 8.262 360 HG2 ARG 53 1HG ARG 53 -23.316 9.266 8.952 361 HG3 ARG 53 2HG ARG 53 -22.251 10.668 9.068 362 HD2 ARG 53 1HD ARG 53 -22.751 9.456 6.393 363 HD3 ARG 53 2HD ARG 53 -24.013 10.447 7.124 364 HE ARG 53 HE ARG 53 -21.600 11.367 5.940 365 HH11 ARG 53 1HH1 ARG 53 -23.852 12.018 8.514 366 HH12 ARG 53 2HH1 ARG 53 -23.498 13.713 8.571 367 HH21 ARG 53 1HH2 ARG 53 -21.126 13.598 6.006 368 HH22 ARG 53 2HH2 ARG 53 -21.948 14.610 7.144 369 H ASN 54 H ASN 54 -19.387 7.415 11.402 370 HA ASN 54 HA ASN 54 -20.111 6.151 13.151 371 HB2 ASN 54 1HB ASN 54 -21.942 8.539 13.346 372 HB3 ASN 54 2HB ASN 54 -21.975 7.237 14.531 373 HD21 ASN 54 2HD2 ASN 54 -19.557 9.232 12.862 374 HD22 ASN 54 1HD2 ASN 54 -18.616 9.569 14.271 375 H ASP 55 H ASP 55 -20.986 5.162 10.788 376 HA ASP 55 HA ASP 55 -23.789 4.408 11.291 377 HB2 ASP 55 1HB ASP 55 -23.505 5.498 9.138 378 HB3 ASP 55 2HB ASP 55 -22.210 4.382 8.711 379 HA PRO 56 HA PRO 56 -21.302 0.643 12.265 380 HB2 PRO 56 1HB PRO 56 -22.867 -0.116 14.349 381 HB3 PRO 56 2HB PRO 56 -21.536 1.035 14.517 382 HG2 PRO 56 1HG PRO 56 -24.471 1.559 14.254 383 HG3 PRO 56 2HG PRO 56 -23.291 2.323 15.334 384 HD2 PRO 56 1HD PRO 56 -24.141 3.494 13.046 385 HD3 PRO 56 2HD PRO 56 -22.502 3.727 13.686 386 H PHE 57 H PHE 57 -21.732 -1.385 11.555 387 HA PHE 57 HA PHE 57 -24.398 -1.859 10.436 388 HB2 PHE 57 1HB PHE 57 -22.212 -2.078 9.079 389 HB3 PHE 57 2HB PHE 57 -21.981 -3.586 9.957 390 HD1 PHE 57 HD1 PHE 57 -24.588 -1.813 7.966 391 HD2 PHE 57 HD2 PHE 57 -22.793 -5.523 9.029 392 HE1 PHE 57 HE1 PHE 57 -26.029 -2.971 6.344 393 HE2 PHE 57 HE2 PHE 57 -24.231 -6.687 7.408 394 HZ PHE 57 HZ PHE 57 -25.851 -5.411 6.062 395 H ALA 58 H ALA 58 -25.763 -2.959 11.667 396 HA ALA 58 HA ALA 58 -24.693 -5.037 13.460 397 HB1 ALA 58 1HB ALA 58 -26.254 -4.512 15.032 398 HB2 ALA 58 2HB ALA 58 -26.093 -2.933 14.262 399 HB3 ALA 58 3HB ALA 58 -27.442 -3.987 13.839 400 H PHE 59 H PHE 59 -25.594 -7.073 13.475 401 HA PHE 59 HA PHE 59 -27.959 -7.785 12.096 402 HB2 PHE 59 1HB PHE 59 -27.107 -8.907 10.175 403 HB3 PHE 59 2HB PHE 59 -26.385 -7.302 10.172 404 HD1 PHE 59 HD2 PHE 59 -24.067 -7.204 11.512 405 HD2 PHE 59 HD1 PHE 59 -25.734 -10.669 9.687 406 HE1 PHE 59 HE2 PHE 59 -21.826 -8.212 11.387 407 HE2 PHE 59 HE1 PHE 59 -23.496 -11.683 9.560 408 HZ PHE 59 HZ PHE 59 -21.538 -10.454 10.409 409 H VAL 60 H VAL 60 -27.761 -10.356 11.600 410 HA VAL 60 HA VAL 60 -26.859 -11.495 14.151 411 HB VAL 60 HB VAL 60 -28.811 -12.603 12.128 412 HG11 VAL 60 1HG1 VAL 60 -29.334 -14.204 14.012 413 HG12 VAL 60 2HG1 VAL 60 -27.787 -14.448 13.200 414 HG13 VAL 60 3HG1 VAL 60 -27.842 -13.655 14.775 415 HG21 VAL 60 3HG2 VAL 60 -29.216 -10.574 13.931 416 HG22 VAL 60 1HG2 VAL 60 -30.472 -11.606 13.248 417 HG23 VAL 60 2HG2 VAL 60 -29.769 -11.995 14.817 418 H LEU 61 H LEU 61 -25.236 -12.913 14.237 419 HA LEU 61 HA LEU 61 -23.660 -13.468 11.946 420 HB2 LEU 61 1HB LEU 61 -22.694 -13.281 14.169 421 HB3 LEU 61 2HB LEU 61 -23.607 -14.692 14.701 422 HG LEU 61 HG LEU 61 -22.298 -16.137 13.290 423 HD11 LEU 61 1HD1 LEU 61 -21.439 -15.348 11.404 424 HD12 LEU 61 2HD1 LEU 61 -20.207 -14.527 12.362 425 HD13 LEU 61 3HD1 LEU 61 -21.692 -13.682 11.926 426 HD21 LEU 61 3HD2 LEU 61 -20.532 -16.220 14.682 427 HD22 LEU 61 1HD2 LEU 61 -21.391 -14.938 15.536 428 HD23 LEU 61 2HD2 LEU 61 -20.099 -14.533 14.406 429 H GLY 62 H GLY 62 -23.305 -15.406 10.850 430 HA2 GLY 62 1HA GLY 62 -23.789 -17.499 10.018 431 HA3 GLY 62 2HA GLY 62 -24.687 -17.818 11.494 432 H GLY 63 H GLY 63 -25.457 -15.048 9.538 433 HA2 GLY 63 1HA GLY 63 -28.152 -15.978 9.198 434 HA3 GLY 63 2HA GLY 63 -27.486 -14.466 8.598 435 H GLY 64 H GLY 64 -25.983 -14.691 6.687 436 HA2 GLY 64 1HA GLY 64 -25.378 -16.356 4.884 437 HA3 GLY 64 2HA GLY 64 -27.094 -16.733 4.865 438 H MET 65 H MET 65 -25.745 -13.504 5.224 439 HA MET 65 HA MET 65 -26.883 -12.826 2.592 440 HB2 MET 65 1HB MET 65 -28.120 -11.795 4.434 441 HB3 MET 65 2HB MET 65 -26.635 -11.084 5.050 442 HG2 MET 65 1HG MET 65 -26.470 -9.589 3.260 443 HG3 MET 65 2HG MET 65 -27.633 -10.491 2.290 444 HE1 MET 65 3HE MET 65 -27.698 -7.777 2.218 445 HE2 MET 65 1HE MET 65 -29.446 -7.883 2.007 446 HE3 MET 65 2HE MET 65 -28.770 -6.828 3.248 447 H VAL 66 H VAL 66 -24.127 -12.675 4.676 448 HA VAL 66 HA VAL 66 -22.711 -10.829 2.915 449 HB VAL 66 HB VAL 66 -20.946 -10.818 4.542 450 HG11 VAL 66 1HG1 VAL 66 -23.687 -10.690 5.784 451 HG12 VAL 66 2HG1 VAL 66 -22.219 -10.142 6.596 452 HG13 VAL 66 3HG1 VAL 66 -22.746 -9.363 5.104 453 HG21 VAL 66 3HG2 VAL 66 -21.488 -12.251 6.703 454 HG22 VAL 66 1HG2 VAL 66 -22.303 -13.272 5.519 455 HG23 VAL 66 2HG2 VAL 66 -20.583 -12.923 5.347 456 H ILE 67 H ILE 67 -20.233 -11.554 2.731 457 HA ILE 67 HA ILE 67 -20.312 -13.984 1.144 458 HB ILE 67 HB ILE 67 -18.170 -13.353 0.291 459 HG12 ILE 67 1HG1 ILE 67 -18.142 -11.318 2.525 460 HG13 ILE 67 2HG1 ILE 67 -17.041 -12.673 2.304 461 HG21 ILE 67 1HG2 ILE 67 -20.151 -12.126 -0.545 462 HG22 ILE 67 2HG2 ILE 67 -19.803 -10.841 0.611 463 HG23 ILE 67 3HG2 ILE 67 -18.655 -11.201 -0.678 464 HD11 ILE 67 3HD1 ILE 67 -17.251 -10.231 0.561 465 HD12 ILE 67 1HD1 ILE 67 -15.955 -10.615 1.694 466 HD13 ILE 67 2HD1 ILE 67 -16.193 -11.609 0.256 467 H LYS 68 H LYS 68 -18.517 -15.557 1.298 468 HA LYS 68 HA LYS 68 -18.391 -16.848 3.704 469 HB2 LYS 68 1HB LYS 68 -16.675 -16.857 1.274 470 HB3 LYS 68 2HB LYS 68 -16.040 -17.645 2.713 471 HG2 LYS 68 1HG LYS 68 -18.328 -18.854 2.763 472 HG3 LYS 68 2HG LYS 68 -18.435 -18.351 1.075 473 HD2 LYS 68 1HD LYS 68 -16.740 -19.729 0.415 474 HD3 LYS 68 2HD LYS 68 -15.912 -19.634 1.971 475 HE2 LYS 68 1HE LYS 68 -17.264 -21.256 2.931 476 HE3 LYS 68 2HE LYS 68 -18.555 -21.018 1.755 477 HZ1 LYS 68 3HZ LYS 68 -15.917 -22.118 0.989 478 HZ2 LYS 68 1HZ LYS 68 -17.371 -22.183 0.125 479 HZ3 LYS 68 2HZ LYS 68 -17.179 -23.107 1.528 480 H GLY 69 H GLY 69 -15.916 -14.627 2.414 481 HA2 GLY 69 1HA GLY 69 -14.136 -14.695 4.533 482 HA3 GLY 69 2HA GLY 69 -14.383 -13.300 3.493 483 H TRP 70 H TRP 70 -17.097 -12.801 4.208 484 HA TRP 70 HA TRP 70 -16.694 -11.192 6.498 485 HB2 TRP 70 1HB TRP 70 -18.955 -11.812 4.685 486 HB3 TRP 70 2HB TRP 70 -19.382 -11.219 6.288 487 HD1 TRP 70 HD1 TRP 70 -16.747 -10.108 3.642 488 HE1 TRP 70 HE1 TRP 70 -16.899 -7.548 3.416 489 HE3 TRP 70 HE3 TRP 70 -20.493 -9.217 7.006 490 HZ2 TRP 70 HZ2 TRP 70 -18.406 -5.432 4.519 491 HZ3 TRP 70 HZ3 TRP 70 -21.231 -6.897 7.362 492 HH2 TRP 70 HH2 TRP 70 -20.207 -5.045 6.143 493 H ASP 71 H ASP 71 -18.768 -14.054 6.016 494 HA ASP 71 HA ASP 71 -19.672 -14.338 8.616 495 HB2 ASP 71 1HB ASP 71 -20.710 -15.715 7.032 496 HB3 ASP 71 2HB ASP 71 -19.175 -16.316 6.410 497 H GLU 72 H GLU 72 -16.674 -15.517 7.159 498 HA GLU 72 HA GLU 72 -15.793 -17.032 9.367 499 HB2 GLU 72 1HB GLU 72 -14.860 -17.246 7.087 500 HB3 GLU 72 2HB GLU 72 -14.133 -15.653 7.249 501 HG2 GLU 72 1HG GLU 72 -12.607 -17.616 7.627 502 HG3 GLU 72 2HG GLU 72 -12.626 -16.392 8.895 503 H GLY 73 H GLY 73 -15.284 -13.653 8.445 504 HA2 GLY 73 1HA GLY 73 -13.503 -13.100 10.620 505 HA3 GLY 73 2HA GLY 73 -14.259 -11.915 9.565 506 H VAL 74 H VAL 74 -16.966 -12.884 10.137 507 HA VAL 74 HA VAL 74 -17.448 -11.291 12.471 508 HB VAL 74 HB VAL 74 -19.392 -12.991 10.903 509 HG11 VAL 74 1HG1 VAL 74 -19.943 -10.649 12.718 510 HG12 VAL 74 2HG1 VAL 74 -21.125 -11.688 11.920 511 HG13 VAL 74 3HG1 VAL 74 -20.103 -12.337 13.202 512 HG21 VAL 74 3HG2 VAL 74 -17.990 -10.750 10.045 513 HG22 VAL 74 1HG2 VAL 74 -19.448 -11.427 9.319 514 HG23 VAL 74 2HG2 VAL 74 -19.575 -10.131 10.508 515 H GLN 75 H GLN 75 -17.187 -14.689 11.775 516 HA GLN 75 HA GLN 75 -18.359 -15.492 14.299 517 HB2 GLN 75 1HB GLN 75 -18.004 -17.743 13.574 518 HB3 GLN 75 2HB GLN 75 -18.599 -16.833 12.192 519 HG2 GLN 75 1HG GLN 75 -16.408 -16.715 11.242 520 HG3 GLN 75 2HG GLN 75 -15.693 -17.424 12.689 521 HE21 GLN 75 2HE2 GLN 75 -18.601 -18.349 10.909 522 HE22 GLN 75 1HE2 GLN 75 -18.069 -19.945 10.516 523 H GLY 76 H GLY 76 -15.643 -13.970 13.753 524 HA2 GLY 76 1HA GLY 76 -14.128 -15.564 15.726 525 HA3 GLY 76 2HA GLY 76 -13.340 -14.787 14.361 526 H MET 77 H MET 77 -14.689 -12.331 14.388 527 HA MET 77 HA MET 77 -13.157 -10.816 16.102 528 HB2 MET 77 1HB MET 77 -14.918 -9.024 15.758 529 HB3 MET 77 2HB MET 77 -14.226 -9.717 14.297 530 HG2 MET 77 1HG MET 77 -16.473 -9.636 13.803 531 HG3 MET 77 2HG MET 77 -16.260 -11.296 14.354 532 HE1 MET 77 3HE MET 77 -19.433 -10.625 14.647 533 HE2 MET 77 1HE MET 77 -19.639 -9.051 15.416 534 HE3 MET 77 2HE MET 77 -18.637 -9.203 13.972 535 H LYS 78 H LYS 78 -13.742 -9.543 17.984 536 HA LYS 78 HA LYS 78 -15.851 -10.757 19.636 537 HB2 LYS 78 1HB LYS 78 -13.170 -9.926 20.739 538 HB3 LYS 78 2HB LYS 78 -14.436 -10.839 21.551 539 HG2 LYS 78 1HG LYS 78 -14.034 -12.747 20.146 540 HG3 LYS 78 2HG LYS 78 -12.874 -11.835 19.178 541 HD2 LYS 78 1HD LYS 78 -12.422 -12.040 22.114 542 HD3 LYS 78 2HD LYS 78 -12.087 -13.454 21.111 543 HE2 LYS 78 1HE LYS 78 -10.347 -12.443 20.027 544 HE3 LYS 78 2HE LYS 78 -11.027 -10.827 20.214 545 HZ1 LYS 78 3HZ LYS 78 -10.523 -11.231 22.703 546 HZ2 LYS 78 1HZ LYS 78 -9.262 -10.791 21.664 547 HZ3 LYS 78 2HZ LYS 78 -9.450 -12.406 22.131 548 H VAL 79 H VAL 79 -16.449 -9.377 21.517 549 HA VAL 79 HA VAL 79 -17.212 -6.827 20.718 550 HB VAL 79 HB VAL 79 -16.873 -7.870 23.534 551 HG11 VAL 79 1HG1 VAL 79 -17.063 -5.615 23.905 552 HG12 VAL 79 2HG1 VAL 79 -18.010 -5.341 22.441 553 HG13 VAL 79 3HG1 VAL 79 -18.764 -6.078 23.856 554 HG21 VAL 79 3HG2 VAL 79 -19.409 -8.092 23.305 555 HG22 VAL 79 1HG2 VAL 79 -19.143 -7.934 21.569 556 HG23 VAL 79 2HG2 VAL 79 -18.413 -9.274 22.454 557 H GLY 80 H GLY 80 -16.073 -5.035 20.415 558 HA2 GLY 80 1HA GLY 80 -14.615 -3.301 20.941 559 HA3 GLY 80 2HA GLY 80 -14.033 -4.240 22.307 560 H GLY 81 H GLY 81 -13.952 -6.285 19.745 561 HA2 GLY 81 1HA GLY 81 -11.078 -5.989 19.492 562 HA3 GLY 81 2HA GLY 81 -12.058 -7.288 18.828 563 H VAL 82 H VAL 82 -9.959 -5.292 17.761 564 HA VAL 82 HA VAL 82 -11.441 -4.682 15.297 565 HB VAL 82 HB VAL 82 -9.385 -2.806 16.458 566 HG11 VAL 82 1HG1 VAL 82 -10.785 -3.004 13.944 567 HG12 VAL 82 2HG1 VAL 82 -11.124 -1.467 14.741 568 HG13 VAL 82 3HG1 VAL 82 -9.457 -1.942 14.410 569 HG21 VAL 82 3HG2 VAL 82 -11.670 -1.418 16.681 570 HG22 VAL 82 1HG2 VAL 82 -12.282 -3.044 16.987 571 HG23 VAL 82 2HG2 VAL 82 -10.994 -2.382 17.994 572 H ARG 83 H ARG 83 -10.527 -5.722 13.664 573 HA ARG 83 HA ARG 83 -7.648 -5.682 13.327 574 HB2 ARG 83 1HB ARG 83 -7.564 -8.163 12.963 575 HB3 ARG 83 2HB ARG 83 -7.825 -7.677 14.632 576 HG2 ARG 83 1HG ARG 83 -10.259 -8.078 14.300 577 HG3 ARG 83 2HG ARG 83 -9.881 -8.725 12.702 578 HD2 ARG 83 1HD ARG 83 -9.337 -10.696 13.573 579 HD3 ARG 83 2HD ARG 83 -8.189 -9.937 14.675 580 HE ARG 83 HE ARG 83 -10.682 -9.507 15.767 581 HH11 ARG 83 1HH1 ARG 83 -8.738 -12.258 14.888 582 HH12 ARG 83 2HH1 ARG 83 -9.406 -13.286 16.112 583 HH21 ARG 83 1HH2 ARG 83 -11.569 -10.850 17.383 584 HH22 ARG 83 2HH2 ARG 83 -11.017 -12.484 17.530 585 H ARG 84 H ARG 84 -6.982 -6.090 11.197 586 HA ARG 84 HA ARG 84 -9.097 -5.728 9.228 587 HB2 ARG 84 1HB ARG 84 -7.269 -5.229 7.666 588 HB3 ARG 84 2HB ARG 84 -7.162 -4.244 9.119 589 HG2 ARG 84 1HG ARG 84 -5.476 -5.873 9.994 590 HG3 ARG 84 2HG ARG 84 -5.493 -6.640 8.404 591 HD2 ARG 84 1HD ARG 84 -5.033 -4.229 7.538 592 HD3 ARG 84 2HD ARG 84 -4.507 -3.931 9.194 593 HE ARG 84 HE ARG 84 -3.194 -6.212 8.418 594 HH11 ARG 84 1HH1 ARG 84 -3.411 -2.933 7.267 595 HH12 ARG 84 2HH1 ARG 84 -1.810 -2.922 6.605 596 HH21 ARG 84 1HH2 ARG 84 -1.084 -6.209 7.551 597 HH22 ARG 84 2HH2 ARG 84 -0.488 -4.786 6.767 598 H LEU 85 H LEU 85 -9.910 -7.367 8.115 599 HA LEU 85 HA LEU 85 -8.330 -9.842 7.896 600 HB2 LEU 85 1HB LEU 85 -11.298 -9.657 7.512 601 HB3 LEU 85 2HB LEU 85 -10.320 -11.081 7.864 602 HG LEU 85 HG LEU 85 -10.731 -8.839 9.834 603 HD11 LEU 85 1HD1 LEU 85 -12.180 -11.442 10.000 604 HD12 LEU 85 2HD1 LEU 85 -12.833 -10.139 9.007 605 HD13 LEU 85 3HD1 LEU 85 -12.571 -9.886 10.733 606 HD21 LEU 85 3HD2 LEU 85 -8.772 -10.392 10.084 607 HD22 LEU 85 1HD2 LEU 85 -9.931 -11.706 10.290 608 HD23 LEU 85 2HD2 LEU 85 -9.895 -10.373 11.444 609 H THR 86 H THR 86 -7.678 -10.471 5.948 610 HA THR 86 HA THR 86 -8.471 -8.941 3.619 611 HB THR 86 HB THR 86 -6.625 -11.312 3.547 612 HG1 THR 86 HG1 THR 86 -5.633 -8.723 4.029 613 HG21 THR 86 3HG2 THR 86 -5.705 -9.123 2.028 614 HG22 THR 86 1HG2 THR 86 -7.437 -9.252 1.727 615 HG23 THR 86 2HG2 THR 86 -6.386 -10.639 1.437 616 H ILE 87 H ILE 87 -10.261 -9.476 2.559 617 HA ILE 87 HA ILE 87 -11.102 -12.284 2.485 618 HB ILE 87 HB ILE 87 -12.636 -9.785 1.760 619 HG12 ILE 87 1HG1 ILE 87 -13.163 -11.657 4.062 620 HG13 ILE 87 2HG1 ILE 87 -12.083 -10.276 4.220 621 HG21 ILE 87 1HG2 ILE 87 -13.120 -12.598 1.223 622 HG22 ILE 87 2HG2 ILE 87 -14.438 -11.842 2.117 623 HG23 ILE 87 3HG2 ILE 87 -13.920 -11.168 0.572 624 HD11 ILE 87 3HD1 ILE 87 -13.782 -8.760 4.096 625 HD12 ILE 87 1HD1 ILE 87 -14.818 -9.828 3.150 626 HD13 ILE 87 2HD1 ILE 87 -14.608 -10.107 4.879 627 HA PRO 88 HA PRO 88 -9.359 -12.137 -1.684 628 HB2 PRO 88 1HB PRO 88 -9.350 -14.833 -2.003 629 HB3 PRO 88 2HB PRO 88 -8.093 -13.967 -1.111 630 HG2 PRO 88 1HG PRO 88 -10.474 -15.451 -0.068 631 HG3 PRO 88 2HG PRO 88 -8.805 -15.451 0.531 632 HD2 PRO 88 1HD PRO 88 -10.769 -13.990 1.689 633 HD3 PRO 88 2HD PRO 88 -9.075 -13.457 1.655 634 HA PRO 89 HA PRO 89 -12.877 -12.705 -4.260 635 HB2 PRO 89 1HB PRO 89 -11.852 -13.902 -6.470 636 HB3 PRO 89 2HB PRO 89 -11.546 -12.209 -6.066 637 HG2 PRO 89 1HG PRO 89 -9.813 -14.608 -5.614 638 HG3 PRO 89 2HG PRO 89 -9.362 -12.996 -6.198 639 HD2 PRO 89 1HD PRO 89 -8.971 -13.779 -3.635 640 HD3 PRO 89 2HD PRO 89 -9.332 -12.097 -4.075 641 H GLN 90 H GLN 90 -10.884 -15.599 -3.860 642 HA GLN 90 HA GLN 90 -12.808 -17.456 -4.775 643 HB2 GLN 90 1HB GLN 90 -11.414 -19.134 -3.558 644 HB3 GLN 90 2HB GLN 90 -10.503 -18.114 -4.664 645 HG2 GLN 90 1HG GLN 90 -10.414 -16.776 -2.229 646 HG3 GLN 90 2HG GLN 90 -10.203 -18.478 -1.822 647 HE21 GLN 90 2HE2 GLN 90 -8.064 -18.252 -1.253 648 HE22 GLN 90 1HE2 GLN 90 -6.815 -17.950 -2.407 649 H LEU 91 H LEU 91 -12.721 -15.554 -2.005 650 HA LEU 91 HA LEU 91 -14.710 -17.290 -0.700 651 HB2 LEU 91 1HB LEU 91 -12.363 -15.858 0.438 652 HB3 LEU 91 2HB LEU 91 -13.821 -15.989 1.419 653 HG LEU 91 HG LEU 91 -13.568 -18.553 0.795 654 HD11 LEU 91 1HD1 LEU 91 -10.832 -18.630 1.152 655 HD12 LEU 91 2HD1 LEU 91 -11.062 -17.361 -0.050 656 HD13 LEU 91 3HD1 LEU 91 -11.703 -18.978 -0.342 657 HD21 LEU 91 3HD2 LEU 91 -13.595 -18.228 3.033 658 HD22 LEU 91 1HD2 LEU 91 -12.462 -16.878 2.963 659 HD23 LEU 91 2HD2 LEU 91 -11.865 -18.535 2.865 660 H GLY 92 H GLY 92 -14.471 -14.639 -2.443 661 HA2 GLY 92 1HA GLY 92 -16.755 -13.389 -1.115 662 HA3 GLY 92 2HA GLY 92 -15.338 -12.383 -1.376 663 H TYR 93 H TYR 93 -15.095 -11.395 -3.291 664 HA TYR 93 HA TYR 93 -17.197 -11.233 -5.112 665 HB2 TYR 93 1HB TYR 93 -14.339 -10.378 -5.130 666 HB3 TYR 93 2HB TYR 93 -15.232 -10.327 -6.646 667 HD1 TYR 93 HD1 TYR 93 -16.770 -9.705 -3.356 668 HD2 TYR 93 HD2 TYR 93 -15.203 -7.948 -6.900 669 HE1 TYR 93 HE1 TYR 93 -17.742 -7.541 -2.706 670 HE2 TYR 93 HE2 TYR 93 -16.169 -5.779 -6.259 671 HH TYR 93 HH TYR 93 -18.511 -5.400 -4.018 672 H GLY 94 H GLY 94 -13.976 -12.575 -5.865 673 HA2 GLY 94 1HA GLY 94 -13.736 -14.825 -6.737 674 HA3 GLY 94 2HA GLY 94 -15.327 -14.655 -7.462 675 H ALA 95 H ALA 95 -14.152 -15.417 -9.395 676 HA ALA 95 HA ALA 95 -12.325 -13.547 -10.640 677 HB1 ALA 95 1HB ALA 95 -11.621 -15.351 -11.720 678 HB2 ALA 95 2HB ALA 95 -12.846 -16.304 -10.880 679 HB3 ALA 95 3HB ALA 95 -13.214 -15.577 -12.444 680 H ARG 96 H ARG 96 -15.516 -13.438 -10.210 681 HA ARG 96 HA ARG 96 -16.524 -12.967 -12.824 682 HB2 ARG 96 1HB ARG 96 -17.755 -13.454 -10.545 683 HB3 ARG 96 2HB ARG 96 -17.756 -11.700 -10.414 684 HG2 ARG 96 1HG ARG 96 -18.774 -13.065 -12.876 685 HG3 ARG 96 2HG ARG 96 -19.795 -12.855 -11.453 686 HD2 ARG 96 1HD ARG 96 -18.888 -10.363 -11.664 687 HD3 ARG 96 2HD ARG 96 -18.733 -10.840 -13.354 688 HE ARG 96 HE ARG 96 -21.256 -11.603 -12.689 689 HH11 ARG 96 1HH1 ARG 96 -19.486 -8.612 -12.483 690 HH12 ARG 96 2HH1 ARG 96 -20.890 -7.616 -12.681 691 HH21 ARG 96 1HH2 ARG 96 -23.111 -10.303 -12.950 692 HH22 ARG 96 2HH2 ARG 96 -22.952 -8.579 -12.946 693 H GLY 97 H GLY 97 -14.793 -11.034 -10.534 694 HA2 GLY 97 1HA GLY 97 -13.848 -8.947 -10.774 695 HA3 GLY 97 2HA GLY 97 -14.402 -8.948 -12.442 696 H ALA 98 H ALA 98 -14.426 -6.670 -10.810 697 HA ALA 98 HA ALA 98 -17.327 -6.226 -10.543 698 HB1 ALA 98 1HB ALA 98 -17.131 -5.329 -8.497 699 HB2 ALA 98 2HB ALA 98 -15.610 -6.221 -8.438 700 HB3 ALA 98 3HB ALA 98 -15.615 -4.515 -8.888 701 H GLY 99 H GLY 99 -14.176 -4.873 -11.353 702 HA2 GLY 99 1HA GLY 99 -15.502 -2.985 -13.145 703 HA3 GLY 99 2HA GLY 99 -14.473 -2.302 -11.894 704 H GLY 100 H GLY 100 -13.026 -1.417 -13.383 705 HA2 GLY 100 1HA GLY 100 -11.697 -3.180 -15.276 706 HA3 GLY 100 2HA GLY 100 -11.437 -1.451 -15.099 707 H VAL 101 H VAL 101 -10.757 -1.199 -12.473 708 HA VAL 101 HA VAL 101 -8.069 -2.227 -12.491 709 HB VAL 101 HB VAL 101 -7.743 -0.931 -10.453 710 HG11 VAL 101 1HG1 VAL 101 -7.992 1.231 -11.378 711 HG12 VAL 101 2HG1 VAL 101 -7.758 0.139 -12.745 712 HG13 VAL 101 3HG1 VAL 101 -9.372 0.734 -12.356 713 HG21 VAL 101 3HG2 VAL 101 -9.419 -0.555 -9.044 714 HG22 VAL 101 1HG2 VAL 101 -10.201 0.468 -10.248 715 HG23 VAL 101 2HG2 VAL 101 -10.556 -1.258 -10.194 716 H ILE 102 H ILE 102 -10.926 -3.572 -11.600 717 HA ILE 102 HA ILE 102 -9.749 -5.079 -9.362 718 HB ILE 102 HB ILE 102 -12.652 -4.798 -10.146 719 HG12 ILE 102 1HG1 ILE 102 -11.109 -3.673 -7.798 720 HG13 ILE 102 2HG1 ILE 102 -11.711 -2.750 -9.171 721 HG21 ILE 102 1HG2 ILE 102 -12.306 -5.799 -7.515 722 HG22 ILE 102 2HG2 ILE 102 -13.063 -6.585 -8.899 723 HG23 ILE 102 3HG2 ILE 102 -11.336 -6.786 -8.608 724 HD11 ILE 102 3HD1 ILE 102 -13.009 -3.279 -6.752 725 HD12 ILE 102 1HD1 ILE 102 -13.665 -2.479 -8.180 726 HD13 ILE 102 2HD1 ILE 102 -13.855 -4.222 -7.979 727 HA PRO 103 HA PRO 103 -9.566 -8.126 -12.769 728 HB2 PRO 103 1HB PRO 103 -7.449 -9.467 -11.725 729 HB3 PRO 103 2HB PRO 103 -7.272 -8.008 -12.707 730 HG2 PRO 103 1HG PRO 103 -7.206 -8.307 -9.729 731 HG3 PRO 103 2HG PRO 103 -6.157 -7.337 -10.780 732 HD2 PRO 103 1HD PRO 103 -8.211 -6.262 -9.380 733 HD3 PRO 103 2HD PRO 103 -7.699 -5.633 -10.959 734 HA PRO 104 HA PRO 104 -11.615 -11.513 -10.856 735 HB2 PRO 104 1HB PRO 104 -10.602 -13.654 -12.183 736 HB3 PRO 104 2HB PRO 104 -11.721 -12.506 -12.926 737 HG2 PRO 104 1HG PRO 104 -8.740 -12.660 -13.150 738 HG3 PRO 104 2HG PRO 104 -9.944 -12.362 -14.418 739 HD2 PRO 104 1HD PRO 104 -8.509 -10.371 -13.275 740 HD3 PRO 104 2HD PRO 104 -10.170 -10.138 -13.856 741 H ASN 105 H ASN 105 -8.246 -11.176 -10.584 742 HA ASN 105 HA ASN 105 -8.131 -13.309 -8.554 743 HB2 ASN 105 1HB ASN 105 -6.603 -13.594 -10.517 744 HB3 ASN 105 2HB ASN 105 -5.802 -12.095 -10.055 745 HD21 ASN 105 2HD2 ASN 105 -6.924 -15.018 -8.376 746 HD22 ASN 105 1HD2 ASN 105 -5.442 -15.307 -7.537 747 H ALA 106 H ALA 106 -8.791 -10.251 -8.595 748 HA ALA 106 HA ALA 106 -6.804 -9.150 -6.825 749 HB1 ALA 106 1HB ALA 106 -8.805 -8.109 -8.483 750 HB2 ALA 106 2HB ALA 106 -9.256 -7.656 -6.839 751 HB3 ALA 106 3HB ALA 106 -7.671 -7.213 -7.473 752 H THR 107 H THR 107 -7.098 -8.583 -4.648 753 HA THR 107 HA THR 107 -9.201 -10.125 -3.274 754 HB THR 107 HB THR 107 -6.452 -9.354 -2.277 755 HG1 THR 107 HG1 THR 107 -5.973 -11.468 -2.561 756 HG21 THR 107 3HG2 THR 107 -7.560 -9.355 -0.289 757 HG22 THR 107 1HG2 THR 107 -7.331 -11.096 -0.448 758 HG23 THR 107 2HG2 THR 107 -8.873 -10.365 -0.896 759 H LEU 108 H LEU 108 -10.355 -9.176 -1.610 760 HA LEU 108 HA LEU 108 -10.060 -6.254 -1.383 761 HB2 LEU 108 1HB LEU 108 -12.535 -7.938 -1.036 762 HB3 LEU 108 2HB LEU 108 -12.450 -6.187 -0.855 763 HG LEU 108 HG LEU 108 -11.744 -7.511 -3.453 764 HD11 LEU 108 1HD1 LEU 108 -14.105 -8.082 -2.462 765 HD12 LEU 108 2HD1 LEU 108 -13.919 -7.630 -4.156 766 HD13 LEU 108 3HD1 LEU 108 -14.481 -6.439 -2.983 767 HD21 LEU 108 3HD2 LEU 108 -12.473 -5.315 -4.333 768 HD22 LEU 108 1HD2 LEU 108 -11.104 -5.200 -3.227 769 HD23 LEU 108 2HD2 LEU 108 -12.723 -4.767 -2.675 770 H VAL 109 H VAL 109 -9.583 -5.441 0.550 771 HA VAL 109 HA VAL 109 -9.635 -7.240 2.867 772 HB VAL 109 HB VAL 109 -8.350 -4.540 2.932 773 HG11 VAL 109 1HG1 VAL 109 -7.759 -5.305 4.931 774 HG12 VAL 109 2HG1 VAL 109 -8.432 -6.897 4.571 775 HG13 VAL 109 3HG1 VAL 109 -6.768 -6.520 4.125 776 HG21 VAL 109 3HG2 VAL 109 -6.237 -5.683 2.133 777 HG22 VAL 109 1HG2 VAL 109 -7.274 -6.983 1.546 778 HG23 VAL 109 2HG2 VAL 109 -7.453 -5.352 0.900 779 H PHE 110 H PHE 110 -10.545 -6.616 4.840 780 HA PHE 110 HA PHE 110 -12.091 -4.148 4.937 781 HB2 PHE 110 1HB PHE 110 -13.253 -6.878 4.784 782 HB3 PHE 110 2HB PHE 110 -13.984 -5.766 5.937 783 HD1 PHE 110 HD1 PHE 110 -15.036 -3.687 5.159 784 HD2 PHE 110 HD2 PHE 110 -13.530 -6.593 2.438 785 HE1 PHE 110 HE1 PHE 110 -16.337 -2.656 3.342 786 HE2 PHE 110 HE2 PHE 110 -14.828 -5.566 0.617 787 HZ PHE 110 HZ PHE 110 -16.233 -3.595 1.068 788 H GLU 111 H GLU 111 -12.100 -3.264 6.918 789 HA GLU 111 HA GLU 111 -10.761 -4.723 9.056 790 HB2 GLU 111 1HB GLU 111 -9.973 -2.474 8.599 791 HB3 GLU 111 2HB GLU 111 -11.593 -1.828 8.816 792 HG2 GLU 111 1HG GLU 111 -10.496 -3.340 11.092 793 HG3 GLU 111 2HG GLU 111 -9.706 -1.808 10.721 794 H VAL 112 H VAL 112 -11.865 -5.760 10.566 795 HA VAL 112 HA VAL 112 -14.694 -5.104 10.971 796 HB VAL 112 HB VAL 112 -13.246 -7.506 12.072 797 HG11 VAL 112 1HG1 VAL 112 -15.347 -8.400 12.498 798 HG12 VAL 112 2HG1 VAL 112 -15.557 -6.694 12.900 799 HG13 VAL 112 3HG1 VAL 112 -16.148 -7.317 11.360 800 HG21 VAL 112 3HG2 VAL 112 -14.532 -7.123 9.380 801 HG22 VAL 112 1HG2 VAL 112 -12.901 -7.689 9.744 802 HG23 VAL 112 2HG2 VAL 112 -14.292 -8.713 10.103 803 H GLU 113 H GLU 113 -15.316 -4.011 12.707 804 HA GLU 113 HA GLU 113 -13.701 -4.179 15.154 805 HB2 GLU 113 1HB GLU 113 -12.990 -2.111 14.283 806 HB3 GLU 113 2HB GLU 113 -14.604 -1.692 13.726 807 HG2 GLU 113 1HG GLU 113 -15.346 -1.217 15.909 808 HG3 GLU 113 2HG GLU 113 -13.933 -1.978 16.636 809 H LEU 114 H LEU 114 -15.027 -5.169 16.537 810 HA LEU 114 HA LEU 114 -17.882 -4.836 16.430 811 HB2 LEU 114 1HB LEU 114 -16.485 -6.916 17.124 812 HB3 LEU 114 2HB LEU 114 -16.429 -6.132 18.701 813 HG LEU 114 HG LEU 114 -18.957 -6.910 17.248 814 HD11 LEU 114 1HD1 LEU 114 -18.202 -8.254 19.751 815 HD12 LEU 114 2HD1 LEU 114 -17.211 -8.653 18.349 816 HD13 LEU 114 3HD1 LEU 114 -18.956 -8.899 18.293 817 HD21 LEU 114 3HD2 LEU 114 -18.363 -5.423 19.731 818 HD22 LEU 114 1HD2 LEU 114 -19.653 -6.623 19.821 819 HD23 LEU 114 2HD2 LEU 114 -19.746 -5.314 18.642 820 H LEU 115 H LEU 115 -19.016 -3.308 17.416 821 HA LEU 115 HA LEU 115 -17.710 -1.574 19.351 822 HB2 LEU 115 1HB LEU 115 -20.499 -1.367 18.235 823 HB3 LEU 115 2HB LEU 115 -19.588 -0.112 19.071 824 HG LEU 115 HG LEU 115 -17.937 -0.413 17.046 825 HD11 LEU 115 1HD1 LEU 115 -20.290 -1.943 16.256 826 HD12 LEU 115 2HD1 LEU 115 -18.662 -1.930 15.578 827 HD13 LEU 115 3HD1 LEU 115 -19.831 -0.703 15.088 828 HD21 LEU 115 3HD2 LEU 115 -18.659 1.628 16.524 829 HD22 LEU 115 1HD2 LEU 115 -19.909 1.398 17.747 830 HD23 LEU 115 2HD2 LEU 115 -20.251 1.027 16.057 831 H ASP 116 H ASP 116 -20.607 -3.619 19.150 832 HA ASP 116 HA ASP 116 -20.410 -4.476 21.831 833 HB2 ASP 116 1HB ASP 116 -21.169 -2.410 22.615 834 HB3 ASP 116 2HB ASP 116 -22.268 -2.189 21.256 835 H VAL 117 H VAL 117 -21.751 -6.197 22.243 836 HA VAL 117 HA VAL 117 -23.067 -7.353 19.964 837 HB VAL 117 HB VAL 117 -23.607 -9.221 21.538 838 HG11 VAL 117 1HG1 VAL 117 -21.698 -9.858 20.551 839 HG12 VAL 117 2HG1 VAL 117 -20.944 -8.278 20.775 840 HG13 VAL 117 3HG1 VAL 117 -20.945 -9.451 22.093 841 HG21 VAL 117 3HG2 VAL 117 -23.257 -7.335 23.497 842 HG22 VAL 117 1HG2 VAL 117 -23.330 -9.078 23.754 843 HG23 VAL 117 2HG2 VAL 117 -21.768 -8.274 23.598 844 H13 JZF 130 1H3 JZF 130 -21.024 -4.123 -1.699 845 H23 JZF 130 2H3 JZF 130 -20.190 -5.628 -2.037 846 H4 JZF 130 H4 JZF 130 -19.656 -3.705 0.256 847 H15 JZF 130 1H5 JZF 130 -17.824 -5.152 0.944 848 H25 JZF 130 2H5 JZF 130 -18.148 -6.282 -0.361 849 H17 JZF 130 1H7 JZF 130 -17.497 -3.177 -0.751 850 H27 JZF 130 2H7 JZF 130 -17.797 -4.288 -2.048 851 H8 JZF 130 H8 JZF 130 -19.869 -2.674 -2.431 852 H9 JZF 130 H9 JZF 130 -17.227 -2.804 -3.724 853 H1OH JZF 130 1HO JZF 130 -18.050 -1.170 -0.976 854 H11 JZF 130 H11 JZF 130 -17.531 -3.584 -6.175 855 H112 JZF 130 1H12 JZF 130 -19.241 -1.120 -6.785 856 H212 JZF 130 2H12 JZF 130 -17.793 -1.605 -7.654 857 H13A JZF 130 H13 JZF 130 -17.464 0.268 -5.994 858 H114 JZF 130 1H14 JZF 130 -17.410 -0.263 -3.587 859 H214 JZF 130 2H14 JZF 130 -19.006 -0.365 -4.284 860 H115 JZF 130 1H15 JZF 130 -22.747 -6.473 1.910 861 H215 JZF 130 2H15 JZF 130 -21.405 -7.393 2.592 862 H116 JZF 130 1H16 JZF 130 -22.025 -8.004 -1.426 863 H216 JZF 130 2H16 JZF 130 -20.267 -8.273 -1.234 864 H117 JZF 130 2H17 JZF 130 -21.600 -10.856 -1.214 865 H217 JZF 130 3H17 JZF 130 -22.180 -9.951 -2.625 866 H317 JZF 130 1H17 JZF 130 -20.445 -10.238 -2.408 867 H118 JZF 130 1H18 JZF 130 -19.256 -3.438 -8.202 868 H218 JZF 130 2H18 JZF 130 -19.198 -4.879 -7.178 869 H318 JZF 130 3H18 JZF 130 -20.463 -3.665 -6.926 870 H119 JZF 130 3H19 JZF 130 -15.370 -0.773 -4.862 871 H219 JZF 130 1H19 JZF 130 -15.839 -2.277 -5.662 872 H319 JZF 130 2H19 JZF 130 -15.451 -0.852 -6.625 Start of MODEL 3 1 H1 GLY 1 H GLY 1 5.210 5.549 15.105 2 HA2 GLY 1 1HA GLY 1 5.336 2.837 13.950 3 HA3 GLY 1 2HA GLY 1 3.962 3.334 14.927 4 HA PRO 2 HA PRO 2 3.748 6.002 10.899 5 HB2 PRO 2 1HB PRO 2 5.493 5.364 8.919 6 HB3 PRO 2 2HB PRO 2 5.854 6.560 10.169 7 HG2 PRO 2 1HG PRO 2 6.695 3.693 9.993 8 HG3 PRO 2 2HG PRO 2 7.649 5.111 10.465 9 HD2 PRO 2 1HD PRO 2 6.595 3.396 12.276 10 HD3 PRO 2 2HD PRO 2 6.796 5.128 12.606 11 H GLY 3 H GLY 3 4.513 2.594 10.809 12 HA2 GLY 3 1HA GLY 3 2.216 1.545 9.958 13 HA3 GLY 3 2HA GLY 3 2.878 2.139 8.443 14 H SER 4 H SER 4 2.432 -0.595 9.959 15 HA SER 4 HA SER 4 5.008 -1.733 9.090 16 HB2 SER 4 1HB SER 4 4.576 -1.673 11.627 17 HB3 SER 4 2HB SER 4 3.361 -2.915 11.321 18 HG SER 4 HG SER 4 6.140 -3.052 11.148 19 H MET 5 H MET 5 4.916 -3.443 7.747 20 HA MET 5 HA MET 5 2.265 -4.321 6.885 21 HB2 MET 5 1HB MET 5 5.004 -4.435 5.660 22 HB3 MET 5 2HB MET 5 3.714 -5.467 5.058 23 HG2 MET 5 1HG MET 5 2.418 -3.629 4.376 24 HG3 MET 5 2HG MET 5 3.404 -2.495 5.295 25 HE1 MET 5 3HE MET 5 4.756 -0.852 3.926 26 HE2 MET 5 1HE MET 5 4.805 -1.017 2.171 27 HE3 MET 5 2HE MET 5 3.259 -1.061 3.017 28 H THR 6 H THR 6 3.182 -5.262 9.395 29 HA THR 6 HA THR 6 4.113 -7.982 8.990 30 HB THR 6 HB THR 6 3.782 -8.090 11.538 31 HG1 THR 6 HG1 THR 6 2.413 -6.168 11.561 32 HG21 THR 6 3HG2 THR 6 5.867 -7.166 9.946 33 HG22 THR 6 1HG2 THR 6 5.974 -7.669 11.632 34 HG23 THR 6 2HG2 THR 6 5.730 -5.968 11.233 35 H VAL 7 H VAL 7 2.164 -8.507 7.685 36 HA VAL 7 HA VAL 7 -0.210 -9.032 9.338 37 HB VAL 7 HB VAL 7 -0.014 -9.175 6.329 38 HG11 VAL 7 1HG1 VAL 7 -2.513 -8.765 7.921 39 HG12 VAL 7 2HG1 VAL 7 -2.316 -9.424 6.295 40 HG13 VAL 7 3HG1 VAL 7 -1.855 -10.386 7.701 41 HG21 VAL 7 3HG2 VAL 7 -1.039 -6.904 8.032 42 HG22 VAL 7 1HG2 VAL 7 0.474 -6.903 7.125 43 HG23 VAL 7 2HG2 VAL 7 -1.066 -6.983 6.270 44 H VAL 8 H VAL 8 -0.854 -11.057 9.778 45 HA VAL 8 HA VAL 8 0.873 -13.245 8.947 46 HB VAL 8 HB VAL 8 -1.470 -13.262 10.856 47 HG11 VAL 8 1HG1 VAL 8 -1.241 -15.474 10.239 48 HG12 VAL 8 2HG1 VAL 8 0.502 -15.337 9.997 49 HG13 VAL 8 3HG1 VAL 8 -0.163 -15.376 11.631 50 HG21 VAL 8 3HG2 VAL 8 0.466 -13.501 12.539 51 HG22 VAL 8 1HG2 VAL 8 1.471 -12.840 11.249 52 HG23 VAL 8 2HG2 VAL 8 0.119 -11.901 11.883 53 H THR 9 H THR 9 0.238 -15.013 7.767 54 HA THR 9 HA THR 9 -2.380 -14.791 6.430 55 HB THR 9 HB THR 9 -0.059 -16.303 5.267 56 HG1 THR 9 HG1 THR 9 0.862 -14.342 5.339 57 HG21 THR 9 3HG2 THR 9 -1.833 -16.788 3.930 58 HG22 THR 9 1HG2 THR 9 -1.386 -15.251 3.192 59 HG23 THR 9 2HG2 THR 9 -2.703 -15.317 4.364 60 H THR 10 H THR 10 -3.447 -16.779 5.852 61 HA THR 10 HA THR 10 -2.781 -18.986 7.689 62 HB THR 10 HB THR 10 -5.137 -19.583 7.719 63 HG1 THR 10 HG1 THR 10 -6.636 -18.124 6.658 64 HG21 THR 10 3HG2 THR 10 -5.615 -18.087 9.325 65 HG22 THR 10 1HG2 THR 10 -5.490 -16.722 8.217 66 HG23 THR 10 2HG2 THR 10 -4.036 -17.395 8.955 67 H GLU 11 H GLU 11 -3.552 -21.154 6.933 68 HA GLU 11 HA GLU 11 -2.371 -21.833 4.498 69 HB2 GLU 11 1HB GLU 11 -2.615 -23.510 6.182 70 HB3 GLU 11 2HB GLU 11 -4.361 -23.306 6.220 71 HG2 GLU 11 1HG GLU 11 -4.524 -24.214 3.963 72 HG3 GLU 11 2HG GLU 11 -2.773 -24.408 3.912 73 H SER 12 H SER 12 -5.646 -20.907 5.272 74 HA SER 12 HA SER 12 -6.841 -21.791 2.850 75 HB2 SER 12 1HB SER 12 -7.881 -19.493 4.494 76 HB3 SER 12 2HB SER 12 -8.791 -20.694 3.577 77 HG SER 12 HG SER 12 -8.660 -20.920 5.974 78 H GLY 13 H GLY 13 -4.981 -19.015 3.733 79 HA2 GLY 13 1HA GLY 13 -3.926 -17.847 1.837 80 HA3 GLY 13 2HA GLY 13 -5.502 -17.869 1.059 81 H LEU 14 H LEU 14 -6.934 -17.202 3.518 82 HA LEU 14 HA LEU 14 -6.876 -14.384 3.281 83 HB2 LEU 14 1HB LEU 14 -8.934 -15.318 3.876 84 HB3 LEU 14 2HB LEU 14 -8.221 -16.294 5.159 85 HG LEU 14 HG LEU 14 -8.119 -13.341 5.460 86 HD11 LEU 14 1HD1 LEU 14 -10.333 -13.055 6.043 87 HD12 LEU 14 2HD1 LEU 14 -10.612 -14.784 6.252 88 HD13 LEU 14 3HD1 LEU 14 -10.457 -14.105 4.632 89 HD21 LEU 14 3HD2 LEU 14 -8.971 -14.488 7.796 90 HD22 LEU 14 1HD2 LEU 14 -7.293 -14.140 7.378 91 HD23 LEU 14 2HD2 LEU 14 -7.955 -15.751 7.100 92 H LYS 15 H LYS 15 -6.193 -12.800 4.728 93 HA LYS 15 HA LYS 15 -4.228 -13.709 6.728 94 HB2 LYS 15 1HB LYS 15 -4.208 -11.126 5.156 95 HB3 LYS 15 2HB LYS 15 -2.996 -11.637 6.323 96 HG2 LYS 15 1HG LYS 15 -2.098 -13.211 4.908 97 HG3 LYS 15 2HG LYS 15 -3.584 -13.370 3.969 98 HD2 LYS 15 1HD LYS 15 -2.066 -12.213 2.579 99 HD3 LYS 15 2HD LYS 15 -3.180 -10.989 3.192 100 HE2 LYS 15 1HE LYS 15 -1.590 -9.998 4.491 101 HE3 LYS 15 2HE LYS 15 -0.707 -11.502 4.750 102 HZ1 LYS 15 3HZ LYS 15 -0.705 -9.872 2.268 103 HZ2 LYS 15 1HZ LYS 15 0.086 -11.356 2.452 104 HZ3 LYS 15 2HZ LYS 15 0.569 -10.021 3.371 105 H TYR 16 H TYR 16 -3.931 -12.271 8.585 106 HA TYR 16 HA TYR 16 -6.115 -10.441 9.170 107 HB2 TYR 16 1HB TYR 16 -6.937 -11.553 11.063 108 HB3 TYR 16 2HB TYR 16 -6.741 -12.841 9.880 109 HD1 TYR 16 HD2 TYR 16 -4.184 -13.835 9.954 110 HD2 TYR 16 HD1 TYR 16 -6.314 -12.104 13.205 111 HE1 TYR 16 HE2 TYR 16 -2.768 -15.077 11.535 112 HE2 TYR 16 HE1 TYR 16 -4.903 -13.341 14.796 113 HH TYR 16 HH TYR 16 -3.486 -15.247 14.904 114 H GLU 17 H GLU 17 -5.525 -8.810 10.504 115 HA GLU 17 HA GLU 17 -2.994 -9.052 11.970 116 HB2 GLU 17 1HB GLU 17 -2.824 -7.839 9.684 117 HB3 GLU 17 2HB GLU 17 -3.670 -6.527 10.492 118 HG2 GLU 17 1HG GLU 17 -1.252 -7.664 11.790 119 HG3 GLU 17 2HG GLU 17 -1.048 -6.616 10.387 120 H ASP 18 H ASP 18 -3.353 -8.626 14.034 121 HA ASP 18 HA ASP 18 -5.726 -7.584 15.070 122 HB2 ASP 18 1HB ASP 18 -4.265 -8.938 16.441 123 HB3 ASP 18 2HB ASP 18 -2.974 -7.748 16.311 124 H LEU 19 H LEU 19 -6.304 -5.582 15.894 125 HA LEU 19 HA LEU 19 -4.510 -3.338 15.261 126 HB2 LEU 19 1HB LEU 19 -7.428 -3.641 14.624 127 HB3 LEU 19 2HB LEU 19 -6.657 -2.060 14.727 128 HG LEU 19 HG LEU 19 -5.901 -4.255 12.799 129 HD11 LEU 19 1HD1 LEU 19 -6.772 -2.452 11.165 130 HD12 LEU 19 2HD1 LEU 19 -7.643 -1.834 12.567 131 HD13 LEU 19 3HD1 LEU 19 -7.933 -3.480 12.004 132 HD21 LEU 19 3HD2 LEU 19 -3.946 -3.065 13.056 133 HD22 LEU 19 1HD2 LEU 19 -4.785 -1.551 13.399 134 HD23 LEU 19 2HD2 LEU 19 -4.727 -2.174 11.749 135 H THR 20 H THR 20 -7.211 -4.544 17.179 136 HA THR 20 HA THR 20 -6.329 -2.921 19.421 137 HB THR 20 HB THR 20 -9.248 -2.781 18.736 138 HG1 THR 20 HG1 THR 20 -8.043 -1.912 16.950 139 HG21 THR 20 3HG2 THR 20 -7.349 -1.394 20.567 140 HG22 THR 20 1HG2 THR 20 -8.981 -1.987 20.875 141 HG23 THR 20 2HG2 THR 20 -8.741 -0.498 19.960 142 H GLU 21 H GLU 21 -6.208 -4.285 21.069 143 HA GLU 21 HA GLU 21 -7.202 -6.858 21.156 144 HB2 GLU 21 1HB GLU 21 -6.922 -6.623 23.686 145 HB3 GLU 21 2HB GLU 21 -5.502 -6.329 22.692 146 HG2 GLU 21 1HG GLU 21 -5.690 -3.981 22.963 147 HG3 GLU 21 2HG GLU 21 -7.286 -4.130 23.697 148 H GLY 22 H GLY 22 -8.924 -7.844 22.315 149 HA2 GLY 22 1HA GLY 22 -11.065 -6.135 23.304 150 HA3 GLY 22 2HA GLY 22 -11.439 -7.086 21.874 151 H SER 23 H SER 23 -10.178 -7.417 25.181 152 HA SER 23 HA SER 23 -10.738 -10.211 25.321 153 HB2 SER 23 1HB SER 23 -10.317 -8.311 27.636 154 HB3 SER 23 2HB SER 23 -10.079 -10.058 27.632 155 HG SER 23 HG SER 23 -8.195 -9.804 26.708 156 H GLY 24 H GLY 24 -12.971 -10.148 24.577 157 HA2 GLY 24 1HA GLY 24 -14.811 -9.607 26.820 158 HA3 GLY 24 2HA GLY 24 -15.219 -9.119 25.181 159 H ALA 25 H ALA 25 -16.223 -10.538 23.881 160 HA ALA 25 HA ALA 25 -16.108 -13.389 24.474 161 HB1 ALA 25 1HB ALA 25 -18.431 -11.691 25.013 162 HB2 ALA 25 2HB ALA 25 -18.788 -13.127 24.053 163 HB3 ALA 25 3HB ALA 25 -18.023 -13.291 25.633 164 H GLU 26 H GLU 26 -16.248 -14.638 22.685 165 HA GLU 26 HA GLU 26 -16.092 -13.394 20.132 166 HB2 GLU 26 1HB GLU 26 -14.916 -15.500 20.717 167 HB3 GLU 26 2HB GLU 26 -16.469 -16.321 20.790 168 HG2 GLU 26 1HG GLU 26 -16.669 -15.330 18.335 169 HG3 GLU 26 2HG GLU 26 -14.911 -15.404 18.447 170 H ALA 27 H ALA 27 -17.572 -13.214 18.520 171 HA ALA 27 HA ALA 27 -20.297 -13.097 19.153 172 HB1 ALA 27 1HB ALA 27 -20.668 -12.487 16.928 173 HB2 ALA 27 2HB ALA 27 -19.027 -11.931 17.260 174 HB3 ALA 27 3HB ALA 27 -19.287 -13.417 16.346 175 H ARG 28 H ARG 28 -22.067 -14.339 18.259 176 HA ARG 28 HA ARG 28 -21.366 -17.138 17.677 177 HB2 ARG 28 1HB ARG 28 -22.945 -16.057 19.870 178 HB3 ARG 28 2HB ARG 28 -23.847 -17.235 18.926 179 HG2 ARG 28 1HG ARG 28 -22.621 -18.957 19.670 180 HG3 ARG 28 2HG ARG 28 -21.111 -18.045 19.597 181 HD2 ARG 28 1HD ARG 28 -21.715 -16.892 21.671 182 HD3 ARG 28 2HD ARG 28 -23.221 -17.806 21.740 183 HE ARG 28 HE ARG 28 -21.059 -19.595 21.596 184 HH11 ARG 28 1HH1 ARG 28 -22.524 -17.320 23.786 185 HH12 ARG 28 2HH1 ARG 28 -21.996 -18.153 25.211 186 HH21 ARG 28 1HH2 ARG 28 -20.358 -20.701 23.464 187 HH22 ARG 28 2HH2 ARG 28 -20.763 -20.075 25.026 188 H ALA 29 H ALA 29 -22.530 -18.142 16.101 189 HA ALA 29 HA ALA 29 -23.857 -16.573 14.182 190 HB1 ALA 29 1HB ALA 29 -22.807 -19.114 14.260 191 HB2 ALA 29 2HB ALA 29 -24.538 -19.401 14.076 192 HB3 ALA 29 3HB ALA 29 -23.682 -18.397 12.907 193 H GLY 30 H GLY 30 -25.794 -15.665 14.368 194 HA2 GLY 30 1HA GLY 30 -28.206 -16.146 14.364 195 HA3 GLY 30 2HA GLY 30 -27.916 -17.194 15.744 196 H GLN 31 H GLN 31 -25.925 -14.928 16.571 197 HA GLN 31 HA GLN 31 -27.948 -13.441 18.074 198 HB2 GLN 31 1HB GLN 31 -26.480 -13.354 19.783 199 HB3 GLN 31 2HB GLN 31 -25.667 -14.654 18.924 200 HG2 GLN 31 1HG GLN 31 -24.225 -12.991 17.823 201 HG3 GLN 31 2HG GLN 31 -25.009 -11.722 18.763 202 HE21 GLN 31 2HE2 GLN 31 -25.230 -12.970 21.210 203 HE22 GLN 31 1HE2 GLN 31 -23.652 -13.228 21.863 204 H THR 32 H THR 32 -28.119 -11.235 18.033 205 HA THR 32 HA THR 32 -27.002 -9.920 15.708 206 HB THR 32 HB THR 32 -28.820 -8.753 17.823 207 HG1 THR 32 HG1 THR 32 -29.953 -10.410 16.894 208 HG21 THR 32 3HG2 THR 32 -28.662 -6.850 16.680 209 HG22 THR 32 1HG2 THR 32 -29.176 -7.671 15.207 210 HG23 THR 32 2HG2 THR 32 -27.464 -7.595 15.622 211 H VAL 33 H VAL 33 -25.420 -8.426 15.683 212 HA VAL 33 HA VAL 33 -24.535 -7.193 18.174 213 HB VAL 33 HB VAL 33 -22.241 -7.812 17.945 214 HG11 VAL 33 1HG1 VAL 33 -23.866 -9.444 18.992 215 HG12 VAL 33 2HG1 VAL 33 -23.769 -10.363 17.489 216 HG13 VAL 33 3HG1 VAL 33 -22.323 -10.116 18.468 217 HG21 VAL 33 3HG2 VAL 33 -21.446 -8.096 15.880 218 HG22 VAL 33 1HG2 VAL 33 -22.067 -9.744 15.973 219 HG23 VAL 33 2HG2 VAL 33 -23.044 -8.474 15.236 220 H SER 34 H SER 34 -23.078 -5.389 17.837 221 HA SER 34 HA SER 34 -23.445 -4.183 15.177 222 HB2 SER 34 1HB SER 34 -24.322 -3.149 17.480 223 HB3 SER 34 2HB SER 34 -22.680 -2.505 17.516 224 HG SER 34 HG SER 34 -24.777 -1.671 16.077 225 H VAL 35 H VAL 35 -21.696 -4.111 13.948 226 HA VAL 35 HA VAL 35 -19.088 -3.616 15.209 227 HB VAL 35 HB VAL 35 -17.976 -5.267 13.925 228 HG11 VAL 35 1HG1 VAL 35 -20.202 -7.048 14.483 229 HG12 VAL 35 2HG1 VAL 35 -18.601 -6.972 15.222 230 HG13 VAL 35 3HG1 VAL 35 -19.894 -5.921 15.804 231 HG21 VAL 35 3HG2 VAL 35 -19.622 -6.774 12.454 232 HG22 VAL 35 1HG2 VAL 35 -20.462 -5.229 12.320 233 HG23 VAL 35 2HG2 VAL 35 -18.781 -5.366 11.805 234 H HIS 36 H HIS 36 -17.419 -2.973 13.558 235 HA HIS 36 HA HIS 36 -18.679 -1.280 11.502 236 HB2 HIS 36 1HB HIS 36 -16.392 -0.846 13.357 237 HB3 HIS 36 2HB HIS 36 -16.282 -0.127 11.753 238 HD1 HIS 36 HD1 HIS 36 -17.915 1.796 11.200 239 HD2 HIS 36 HD2 HIS 36 -18.301 0.298 15.056 240 HE1 HIS 36 HE1 HIS 36 -19.341 3.463 12.429 241 H TYR 37 H TYR 37 -18.113 -1.532 9.425 242 HA TYR 37 HA TYR 37 -15.905 -3.393 8.835 243 HB2 TYR 37 1HB TYR 37 -17.116 -4.047 6.822 244 HB3 TYR 37 2HB TYR 37 -18.130 -4.281 8.241 245 HD1 TYR 37 HD1 TYR 37 -20.063 -2.836 8.642 246 HD2 TYR 37 HD2 TYR 37 -17.666 -2.387 5.156 247 HE1 TYR 37 HE1 TYR 37 -21.832 -1.475 7.608 248 HE2 TYR 37 HE2 TYR 37 -19.427 -1.024 4.113 249 HH TYR 37 HH TYR 37 -22.133 0.150 5.883 250 H THR 38 H THR 38 -14.284 -2.689 7.598 251 HA THR 38 HA THR 38 -14.668 -0.209 6.057 252 HB THR 38 HB THR 38 -11.930 -0.534 6.953 253 HG1 THR 38 HG1 THR 38 -13.993 -0.404 8.907 254 HG21 THR 38 3HG2 THR 38 -12.160 1.786 7.532 255 HG22 THR 38 1HG2 THR 38 -13.919 1.671 7.496 256 HG23 THR 38 2HG2 THR 38 -12.994 1.516 6.002 257 H GLY 39 H GLY 39 -14.598 -0.845 3.989 258 HA2 GLY 39 1HA GLY 39 -13.063 -3.102 3.112 259 HA3 GLY 39 2HA GLY 39 -13.964 -1.993 2.089 260 H TRP 40 H TRP 40 -10.917 -3.035 2.984 261 HA TRP 40 HA TRP 40 -9.680 -0.615 1.841 262 HB2 TRP 40 1HB TRP 40 -8.507 -2.539 3.862 263 HB3 TRP 40 2HB TRP 40 -7.656 -1.173 3.145 264 HD1 TRP 40 HD1 TRP 40 -10.481 0.665 3.463 265 HE1 TRP 40 HE1 TRP 40 -10.869 1.715 5.781 266 HE3 TRP 40 HE3 TRP 40 -7.381 -2.312 6.231 267 HZ2 TRP 40 HZ2 TRP 40 -9.978 1.332 8.432 268 HZ3 TRP 40 HZ3 TRP 40 -7.205 -1.904 8.651 269 HH2 TRP 40 HH2 TRP 40 -8.477 -0.119 9.727 270 H LEU 41 H LEU 41 -7.672 -0.993 0.637 271 HA LEU 41 HA LEU 41 -7.878 -3.457 -0.932 272 HB2 LEU 41 1HB LEU 41 -6.700 -0.754 -1.442 273 HB3 LEU 41 2HB LEU 41 -6.207 -2.141 -2.411 274 HG LEU 41 HG LEU 41 -7.893 -0.895 -3.591 275 HD11 LEU 41 1HD1 LEU 41 -9.478 -3.206 -2.611 276 HD12 LEU 41 2HD1 LEU 41 -7.906 -3.526 -3.343 277 HD13 LEU 41 3HD1 LEU 41 -9.149 -2.674 -4.260 278 HD21 LEU 41 3HD2 LEU 41 -10.123 -0.547 -2.700 279 HD22 LEU 41 1HD2 LEU 41 -8.921 0.194 -1.643 280 HD23 LEU 41 2HD2 LEU 41 -9.666 -1.340 -1.191 281 H THR 42 H THR 42 -5.724 -4.288 -1.796 282 HA THR 42 HA THR 42 -4.072 -4.948 0.457 283 HB THR 42 HB THR 42 -3.016 -6.532 -0.909 284 HG1 THR 42 HG1 THR 42 -3.873 -4.947 -3.118 285 HG21 THR 42 3HG2 THR 42 -5.768 -6.210 -2.113 286 HG22 THR 42 1HG2 THR 42 -5.420 -7.000 -0.576 287 HG23 THR 42 2HG2 THR 42 -4.804 -7.686 -2.079 288 H ASP 43 H ASP 43 -4.133 -2.320 -1.527 289 HA ASP 43 HA ASP 43 -1.232 -1.976 -1.646 290 HB2 ASP 43 1HB ASP 43 -3.512 -0.371 -2.811 291 HB3 ASP 43 2HB ASP 43 -1.821 0.106 -2.935 292 H GLY 44 H GLY 44 -3.949 -1.040 0.223 293 HA2 GLY 44 1HA GLY 44 -3.465 -0.128 2.436 294 HA3 GLY 44 2HA GLY 44 -2.246 0.886 1.677 295 H GLN 45 H GLN 45 -4.892 0.737 -0.328 296 HA GLN 45 HA GLN 45 -5.814 3.352 0.626 297 HB2 GLN 45 1HB GLN 45 -6.738 3.652 -1.623 298 HB3 GLN 45 2HB GLN 45 -5.021 3.275 -1.686 299 HG2 GLN 45 1HG GLN 45 -5.727 0.865 -2.077 300 HG3 GLN 45 2HG GLN 45 -7.343 1.506 -2.367 301 HE21 GLN 45 2HE2 GLN 45 -7.802 1.880 -4.403 302 HE22 GLN 45 1HE2 GLN 45 -6.673 2.265 -5.653 303 H LYS 46 H LYS 46 -7.964 3.788 1.013 304 HA LYS 46 HA LYS 46 -9.641 1.431 1.460 305 HB2 LYS 46 1HB LYS 46 -9.451 2.779 3.406 306 HB3 LYS 46 2HB LYS 46 -9.743 4.258 2.500 307 HG2 LYS 46 1HG LYS 46 -12.049 3.628 2.144 308 HG3 LYS 46 2HG LYS 46 -11.775 2.080 2.947 309 HD2 LYS 46 1HD LYS 46 -12.738 3.367 4.622 310 HD3 LYS 46 2HD LYS 46 -11.012 3.529 4.952 311 HE2 LYS 46 1HE LYS 46 -12.143 5.684 5.109 312 HE3 LYS 46 2HE LYS 46 -10.984 5.671 3.781 313 HZ1 LYS 46 3HZ LYS 46 -13.601 4.851 2.964 314 HZ2 LYS 46 1HZ LYS 46 -12.590 6.038 2.308 315 HZ3 LYS 46 2HZ LYS 46 -13.597 6.413 3.614 316 H PHE 47 H PHE 47 -11.751 1.273 0.683 317 HA PHE 47 HA PHE 47 -12.594 3.272 -1.291 318 HB2 PHE 47 1HB PHE 47 -13.013 1.685 -2.978 319 HB3 PHE 47 2HB PHE 47 -11.434 1.236 -2.342 320 HD1 PHE 47 HD1 PHE 47 -11.413 -0.584 -0.504 321 HD2 PHE 47 HD2 PHE 47 -14.680 0.097 -3.145 322 HE1 PHE 47 HE1 PHE 47 -12.234 -2.863 -0.070 323 HE2 PHE 47 HE2 PHE 47 -15.507 -2.180 -2.714 324 HZ PHE 47 HZ PHE 47 -14.285 -3.663 -1.175 325 H ASP 48 H ASP 48 -13.339 2.105 1.503 326 HA ASP 48 HA ASP 48 -16.087 2.650 1.361 327 HB2 ASP 48 1HB ASP 48 -15.746 0.246 0.271 328 HB3 ASP 48 2HB ASP 48 -15.757 -0.251 1.961 329 H SER 49 H SER 49 -16.672 3.299 3.326 330 HA SER 49 HA SER 49 -15.537 2.002 5.686 331 HB2 SER 49 1HB SER 49 -14.320 3.760 6.393 332 HB3 SER 49 2HB SER 49 -14.474 4.386 4.751 333 HG SER 49 HG SER 49 -15.222 5.981 6.055 334 H SER 50 H SER 50 -16.868 2.001 7.449 335 HA SER 50 HA SER 50 -19.631 2.476 7.002 336 HB2 SER 50 1HB SER 50 -17.960 1.447 9.222 337 HB3 SER 50 2HB SER 50 -19.515 2.138 9.683 338 HG SER 50 HG SER 50 -20.194 0.206 9.163 339 H LYS 51 H LYS 51 -17.080 4.463 8.064 340 HA LYS 51 HA LYS 51 -18.356 6.214 9.823 341 HB2 LYS 51 1HB LYS 51 -16.205 6.851 7.794 342 HB3 LYS 51 2HB LYS 51 -16.631 7.845 9.182 343 HG2 LYS 51 1HG LYS 51 -15.946 6.028 10.680 344 HG3 LYS 51 2HG LYS 51 -15.489 5.059 9.277 345 HD2 LYS 51 1HD LYS 51 -14.334 7.784 9.492 346 HD3 LYS 51 2HD LYS 51 -13.738 6.558 10.614 347 HE2 LYS 51 1HE LYS 51 -13.292 5.081 8.663 348 HE3 LYS 51 2HE LYS 51 -13.753 6.410 7.601 349 HZ1 LYS 51 3HZ LYS 51 -11.839 7.510 7.997 350 HZ2 LYS 51 1HZ LYS 51 -11.257 5.961 8.349 351 HZ3 LYS 51 2HZ LYS 51 -11.723 6.994 9.604 352 H ASP 52 H ASP 52 -18.721 5.799 6.427 353 HA ASP 52 HA ASP 52 -19.542 8.285 5.553 354 HB2 ASP 52 1HB ASP 52 -20.365 5.500 4.781 355 HB3 ASP 52 2HB ASP 52 -21.106 6.901 4.012 356 H ARG 53 H ARG 53 -21.399 5.829 7.287 357 HA ARG 53 HA ARG 53 -23.757 7.543 7.307 358 HB2 ARG 53 1HB ARG 53 -23.516 4.848 7.134 359 HB3 ARG 53 2HB ARG 53 -23.767 5.034 8.865 360 HG2 ARG 53 1HG ARG 53 -25.903 4.716 7.984 361 HG3 ARG 53 2HG ARG 53 -25.788 6.457 8.251 362 HD2 ARG 53 1HD ARG 53 -25.411 6.867 5.937 363 HD3 ARG 53 2HD ARG 53 -25.194 5.149 5.606 364 HE ARG 53 HE ARG 53 -27.723 5.330 6.608 365 HH11 ARG 53 1HH1 ARG 53 -26.008 6.836 3.979 366 HH12 ARG 53 2HH1 ARG 53 -27.422 7.033 2.997 367 HH21 ARG 53 1HH2 ARG 53 -29.592 5.584 5.325 368 HH22 ARG 53 2HH2 ARG 53 -29.460 6.321 3.764 369 H ASN 54 H ASN 54 -21.010 7.044 9.167 370 HA ASN 54 HA ASN 54 -20.344 7.809 11.204 371 HB2 ASN 54 1HB ASN 54 -21.591 9.864 10.408 372 HB3 ASN 54 2HB ASN 54 -22.973 9.291 11.337 373 HD21 ASN 54 2HD2 ASN 54 -19.629 10.334 11.555 374 HD22 ASN 54 1HD2 ASN 54 -19.701 10.842 13.205 375 H ASP 55 H ASP 55 -22.071 5.403 10.875 376 HA ASP 55 HA ASP 55 -22.617 5.009 13.705 377 HB2 ASP 55 1HB ASP 55 -24.706 5.408 11.755 378 HB3 ASP 55 2HB ASP 55 -24.807 3.786 12.432 379 HA PRO 56 HA PRO 56 -20.999 1.004 12.936 380 HB2 PRO 56 1HB PRO 56 -22.304 -0.464 14.810 381 HB3 PRO 56 2HB PRO 56 -21.024 0.687 15.211 382 HG2 PRO 56 1HG PRO 56 -23.994 1.031 15.358 383 HG3 PRO 56 2HG PRO 56 -22.751 1.529 16.521 384 HD2 PRO 56 1HD PRO 56 -23.888 3.257 14.773 385 HD3 PRO 56 2HD PRO 56 -22.206 3.419 15.319 386 H PHE 57 H PHE 57 -21.841 -1.404 12.815 387 HA PHE 57 HA PHE 57 -24.281 -1.402 11.163 388 HB2 PHE 57 1HB PHE 57 -22.134 -1.757 9.900 389 HB3 PHE 57 2HB PHE 57 -21.905 -3.239 10.822 390 HD1 PHE 57 HD2 PHE 57 -24.999 -1.823 9.323 391 HD2 PHE 57 HD1 PHE 57 -22.120 -4.957 9.289 392 HE1 PHE 57 HE2 PHE 57 -26.359 -3.050 7.681 393 HE2 PHE 57 HE1 PHE 57 -23.475 -6.189 7.646 394 HZ PHE 57 HZ PHE 57 -25.598 -5.236 6.840 395 H ALA 58 H ALA 58 -25.789 -2.175 12.535 396 HA ALA 58 HA ALA 58 -25.170 -4.481 14.217 397 HB1 ALA 58 1HB ALA 58 -26.632 -2.253 14.724 398 HB2 ALA 58 2HB ALA 58 -27.898 -3.401 14.285 399 HB3 ALA 58 3HB ALA 58 -26.788 -3.774 15.604 400 H PHE 59 H PHE 59 -25.525 -6.460 13.481 401 HA PHE 59 HA PHE 59 -27.958 -7.082 12.043 402 HB2 PHE 59 1HB PHE 59 -26.959 -7.966 10.082 403 HB3 PHE 59 2HB PHE 59 -26.227 -6.382 10.314 404 HD1 PHE 59 HD1 PHE 59 -23.940 -6.264 11.390 405 HD2 PHE 59 HD2 PHE 59 -25.644 -9.889 9.950 406 HE1 PHE 59 HE1 PHE 59 -21.703 -7.287 11.326 407 HE2 PHE 59 HE2 PHE 59 -23.410 -10.918 9.885 408 HZ PHE 59 HZ PHE 59 -21.436 -9.617 10.575 409 H VAL 60 H VAL 60 -28.079 -9.492 11.591 410 HA VAL 60 HA VAL 60 -27.242 -10.885 13.992 411 HB VAL 60 HB VAL 60 -28.886 -11.919 11.678 412 HG11 VAL 60 1HG1 VAL 60 -29.694 -13.403 13.706 413 HG12 VAL 60 2HG1 VAL 60 -28.267 -13.835 12.762 414 HG13 VAL 60 3HG1 VAL 60 -28.084 -13.027 14.319 415 HG21 VAL 60 3HG2 VAL 60 -30.594 -10.718 12.435 416 HG22 VAL 60 1HG2 VAL 60 -30.430 -11.469 14.022 417 HG23 VAL 60 2HG2 VAL 60 -29.545 -9.989 13.651 418 H LEU 61 H LEU 61 -25.490 -12.113 14.128 419 HA LEU 61 HA LEU 61 -23.726 -12.515 11.967 420 HB2 LEU 61 1HB LEU 61 -22.866 -12.446 14.189 421 HB3 LEU 61 2HB LEU 61 -23.899 -13.782 14.692 422 HG LEU 61 HG LEU 61 -22.594 -15.301 13.256 423 HD11 LEU 61 1HD1 LEU 61 -21.818 -13.125 11.888 424 HD12 LEU 61 2HD1 LEU 61 -20.934 -14.650 11.875 425 HD13 LEU 61 3HD1 LEU 61 -20.415 -13.340 12.935 426 HD21 LEU 61 3HD2 LEU 61 -20.486 -14.018 14.864 427 HD22 LEU 61 1HD2 LEU 61 -21.085 -15.677 14.886 428 HD23 LEU 61 2HD2 LEU 61 -21.976 -14.407 15.724 429 H GLY 62 H GLY 62 -23.322 -14.259 10.665 430 HA2 GLY 62 1HA GLY 62 -23.860 -16.112 9.417 431 HA3 GLY 62 2HA GLY 62 -24.176 -16.868 10.972 432 H GLY 63 H GLY 63 -25.833 -14.291 9.145 433 HA2 GLY 63 1HA GLY 63 -28.037 -15.844 8.358 434 HA3 GLY 63 2HA GLY 63 -28.414 -15.101 9.906 435 H GLY 64 H GLY 64 -26.751 -13.993 6.946 436 HA2 GLY 64 1HA GLY 64 -28.820 -11.981 6.545 437 HA3 GLY 64 2HA GLY 64 -27.215 -11.374 6.922 438 H MET 65 H MET 65 -26.042 -10.831 5.219 439 HA MET 65 HA MET 65 -25.965 -12.513 2.872 440 HB2 MET 65 1HB MET 65 -27.230 -9.792 2.852 441 HB3 MET 65 2HB MET 65 -26.409 -10.397 1.419 442 HG2 MET 65 1HG MET 65 -27.916 -12.479 1.746 443 HG3 MET 65 2HG MET 65 -28.888 -11.399 2.742 444 HE1 MET 65 3HE MET 65 -27.259 -12.185 -0.454 445 HE2 MET 65 1HE MET 65 -28.357 -11.606 -1.707 446 HE3 MET 65 2HE MET 65 -27.126 -10.529 -1.048 447 H VAL 66 H VAL 66 -23.856 -12.368 4.281 448 HA VAL 66 HA VAL 66 -22.169 -10.232 3.148 449 HB VAL 66 HB VAL 66 -20.743 -10.347 5.073 450 HG11 VAL 66 1HG1 VAL 66 -23.640 -10.263 5.910 451 HG12 VAL 66 2HG1 VAL 66 -22.286 -9.637 6.852 452 HG13 VAL 66 3HG1 VAL 66 -22.688 -8.913 5.294 453 HG21 VAL 66 3HG2 VAL 66 -22.378 -12.760 5.745 454 HG22 VAL 66 1HG2 VAL 66 -20.625 -12.564 5.722 455 HG23 VAL 66 2HG2 VAL 66 -21.576 -11.850 7.025 456 H ILE 67 H ILE 67 -20.097 -10.779 2.415 457 HA ILE 67 HA ILE 67 -19.841 -13.181 1.041 458 HB ILE 67 HB ILE 67 -17.367 -12.605 0.941 459 HG12 ILE 67 1HG1 ILE 67 -18.137 -9.952 2.099 460 HG13 ILE 67 2HG1 ILE 67 -17.664 -11.259 3.180 461 HG21 ILE 67 1HG2 ILE 67 -17.935 -10.365 -0.296 462 HG22 ILE 67 2HG2 ILE 67 -18.522 -11.908 -0.914 463 HG23 ILE 67 3HG2 ILE 67 -19.598 -10.863 0.012 464 HD11 ILE 67 3HD1 ILE 67 -15.873 -10.715 0.899 465 HD12 ILE 67 1HD1 ILE 67 -15.939 -9.498 2.174 466 HD13 ILE 67 2HD1 ILE 67 -15.497 -11.161 2.563 467 H LYS 68 H LYS 68 -18.386 -14.959 1.340 468 HA LYS 68 HA LYS 68 -18.602 -16.315 3.705 469 HB2 LYS 68 1HB LYS 68 -16.313 -16.507 1.738 470 HB3 LYS 68 2HB LYS 68 -16.732 -17.722 2.938 471 HG2 LYS 68 1HG LYS 68 -18.970 -17.914 1.822 472 HG3 LYS 68 2HG LYS 68 -18.334 -16.885 0.536 473 HD2 LYS 68 1HD LYS 68 -16.373 -18.755 0.736 474 HD3 LYS 68 2HD LYS 68 -17.801 -19.712 1.139 475 HE2 LYS 68 1HE LYS 68 -17.677 -17.927 -1.278 476 HE3 LYS 68 2HE LYS 68 -17.140 -19.605 -1.314 477 HZ1 LYS 68 3HZ LYS 68 -19.855 -18.532 -0.988 478 HZ2 LYS 68 1HZ LYS 68 -19.479 -20.034 -0.307 479 HZ3 LYS 68 2HZ LYS 68 -19.311 -19.796 -1.973 480 H GLY 69 H GLY 69 -15.821 -14.345 2.666 481 HA2 GLY 69 1HA GLY 69 -14.191 -14.717 4.881 482 HA3 GLY 69 2HA GLY 69 -14.202 -13.268 3.887 483 H TRP 70 H TRP 70 -16.876 -12.465 4.456 484 HA TRP 70 HA TRP 70 -16.434 -10.994 6.829 485 HB2 TRP 70 1HB TRP 70 -18.662 -11.300 4.886 486 HB3 TRP 70 2HB TRP 70 -19.071 -10.659 6.475 487 HD1 TRP 70 HD1 TRP 70 -15.837 -9.850 4.523 488 HE1 TRP 70 HE1 TRP 70 -15.777 -7.314 4.089 489 HE3 TRP 70 HE3 TRP 70 -20.440 -8.602 6.365 490 HZ2 TRP 70 HZ2 TRP 70 -17.459 -5.080 4.476 491 HZ3 TRP 70 HZ3 TRP 70 -21.138 -6.244 6.296 492 HH2 TRP 70 HH2 TRP 70 -19.677 -4.521 5.371 493 H ASP 71 H ASP 71 -18.704 -13.643 6.103 494 HA ASP 71 HA ASP 71 -19.850 -13.886 8.619 495 HB2 ASP 71 1HB ASP 71 -20.453 -15.078 6.411 496 HB3 ASP 71 2HB ASP 71 -19.258 -16.279 6.892 497 H GLU 72 H GLU 72 -16.969 -15.513 7.321 498 HA GLU 72 HA GLU 72 -16.395 -17.066 9.581 499 HB2 GLU 72 1HB GLU 72 -15.195 -16.536 7.073 500 HB3 GLU 72 2HB GLU 72 -13.966 -16.244 8.296 501 HG2 GLU 72 1HG GLU 72 -15.604 -18.749 8.310 502 HG3 GLU 72 2HG GLU 72 -14.168 -18.594 7.300 503 H GLY 73 H GLY 73 -15.477 -13.765 8.727 504 HA2 GLY 73 1HA GLY 73 -13.698 -13.402 10.929 505 HA3 GLY 73 2HA GLY 73 -14.375 -12.132 9.920 506 H VAL 74 H VAL 74 -16.987 -12.158 10.325 507 HA VAL 74 HA VAL 74 -17.356 -10.907 12.778 508 HB VAL 74 HB VAL 74 -19.529 -12.293 11.207 509 HG11 VAL 74 1HG1 VAL 74 -20.108 -9.726 12.452 510 HG12 VAL 74 2HG1 VAL 74 -21.001 -11.247 12.521 511 HG13 VAL 74 3HG1 VAL 74 -19.647 -10.967 13.617 512 HG21 VAL 74 3HG2 VAL 74 -19.110 -10.912 9.516 513 HG22 VAL 74 1HG2 VAL 74 -19.443 -9.549 10.584 514 HG23 VAL 74 2HG2 VAL 74 -17.796 -10.155 10.415 515 H GLN 75 H GLN 75 -17.642 -14.281 11.902 516 HA GLN 75 HA GLN 75 -18.788 -14.978 14.485 517 HB2 GLN 75 1HB GLN 75 -19.143 -17.133 13.619 518 HB3 GLN 75 2HB GLN 75 -19.449 -16.057 12.261 519 HG2 GLN 75 1HG GLN 75 -17.086 -16.489 11.525 520 HG3 GLN 75 2HG GLN 75 -17.015 -17.746 12.759 521 HE21 GLN 75 2HE2 GLN 75 -19.518 -16.754 10.450 522 HE22 GLN 75 1HE2 GLN 75 -19.710 -18.311 9.727 523 H GLY 76 H GLY 76 -15.987 -13.900 14.059 524 HA2 GLY 76 1HA GLY 76 -14.624 -16.033 15.573 525 HA3 GLY 76 2HA GLY 76 -13.804 -15.206 14.257 526 H MET 77 H MET 77 -14.883 -12.597 14.845 527 HA MET 77 HA MET 77 -12.947 -11.741 16.735 528 HB2 MET 77 1HB MET 77 -15.295 -10.188 15.636 529 HB3 MET 77 2HB MET 77 -13.854 -9.514 16.384 530 HG2 MET 77 1HG MET 77 -14.000 -11.002 13.775 531 HG3 MET 77 2HG MET 77 -13.722 -9.276 13.998 532 HE1 MET 77 3HE MET 77 -12.585 -12.227 13.019 533 HE2 MET 77 1HE MET 77 -11.014 -11.601 12.515 534 HE3 MET 77 2HE MET 77 -11.119 -12.745 13.854 535 H LYS 78 H LYS 78 -13.469 -10.387 18.649 536 HA LYS 78 HA LYS 78 -15.827 -11.434 20.074 537 HB2 LYS 78 1HB LYS 78 -13.136 -10.723 21.256 538 HB3 LYS 78 2HB LYS 78 -14.528 -11.326 22.147 539 HG2 LYS 78 1HG LYS 78 -14.204 -13.461 21.481 540 HG3 LYS 78 2HG LYS 78 -13.582 -12.990 19.898 541 HD2 LYS 78 1HD LYS 78 -11.919 -12.299 22.248 542 HD3 LYS 78 2HD LYS 78 -12.034 -14.010 21.828 543 HE2 LYS 78 1HE LYS 78 -11.417 -13.365 19.478 544 HE3 LYS 78 2HE LYS 78 -11.084 -11.744 20.085 545 HZ1 LYS 78 3HZ LYS 78 -9.418 -12.664 21.560 546 HZ2 LYS 78 1HZ LYS 78 -9.078 -13.095 19.959 547 HZ3 LYS 78 2HZ LYS 78 -9.753 -14.231 21.015 548 H VAL 79 H VAL 79 -16.324 -9.994 22.062 549 HA VAL 79 HA VAL 79 -17.184 -7.504 21.177 550 HB VAL 79 HB VAL 79 -16.672 -8.403 24.015 551 HG11 VAL 79 1HG1 VAL 79 -17.615 -5.870 22.904 552 HG12 VAL 79 2HG1 VAL 79 -18.696 -6.565 24.113 553 HG13 VAL 79 3HG1 VAL 79 -17.008 -6.247 24.516 554 HG21 VAL 79 3HG2 VAL 79 -19.009 -8.972 24.075 555 HG22 VAL 79 1HG2 VAL 79 -19.246 -8.340 22.445 556 HG23 VAL 79 2HG2 VAL 79 -18.265 -9.784 22.697 557 H GLY 80 H GLY 80 -16.093 -5.720 20.703 558 HA2 GLY 80 1HA GLY 80 -14.649 -3.929 21.066 559 HA3 GLY 80 2HA GLY 80 -13.967 -4.790 22.438 560 H GLY 81 H GLY 81 -14.003 -6.946 19.960 561 HA2 GLY 81 1HA GLY 81 -11.158 -6.730 19.583 562 HA3 GLY 81 2HA GLY 81 -12.217 -7.940 18.875 563 H VAL 82 H VAL 82 -10.094 -5.733 18.008 564 HA VAL 82 HA VAL 82 -11.518 -5.113 15.510 565 HB VAL 82 HB VAL 82 -9.617 -3.173 16.817 566 HG11 VAL 82 1HG1 VAL 82 -11.268 -3.221 14.357 567 HG12 VAL 82 2HG1 VAL 82 -11.142 -1.685 15.218 568 HG13 VAL 82 3HG1 VAL 82 -9.685 -2.500 14.648 569 HG21 VAL 82 3HG2 VAL 82 -11.342 -3.116 18.352 570 HG22 VAL 82 1HG2 VAL 82 -11.852 -1.887 17.195 571 HG23 VAL 82 2HG2 VAL 82 -12.570 -3.497 17.145 572 H ARG 83 H ARG 83 -10.447 -5.753 13.761 573 HA ARG 83 HA ARG 83 -7.606 -5.561 13.521 574 HB2 ARG 83 1HB ARG 83 -7.146 -7.954 13.241 575 HB3 ARG 83 2HB ARG 83 -7.717 -7.598 14.865 576 HG2 ARG 83 1HG ARG 83 -9.804 -8.575 14.472 577 HG3 ARG 83 2HG ARG 83 -9.582 -8.549 12.721 578 HD2 ARG 83 1HD ARG 83 -9.103 -10.738 13.081 579 HD3 ARG 83 2HD ARG 83 -7.496 -10.073 13.372 580 HE ARG 83 HE ARG 83 -8.589 -10.014 15.824 581 HH11 ARG 83 1HH1 ARG 83 -8.398 -12.515 13.410 582 HH12 ARG 83 2HH1 ARG 83 -8.378 -13.807 14.563 583 HH21 ARG 83 1HH2 ARG 83 -8.564 -11.707 17.352 584 HH22 ARG 83 2HH2 ARG 83 -8.474 -13.347 16.805 585 H ARG 84 H ARG 84 -6.874 -5.923 11.394 586 HA ARG 84 HA ARG 84 -9.032 -5.904 9.410 587 HB2 ARG 84 1HB ARG 84 -7.495 -3.996 9.375 588 HB3 ARG 84 2HB ARG 84 -6.132 -5.086 9.161 589 HG2 ARG 84 1HG ARG 84 -7.684 -5.814 7.072 590 HG3 ARG 84 2HG ARG 84 -8.093 -4.103 7.212 591 HD2 ARG 84 1HD ARG 84 -6.274 -3.936 5.850 592 HD3 ARG 84 2HD ARG 84 -5.465 -3.869 7.415 593 HE ARG 84 HE ARG 84 -5.563 -6.534 6.749 594 HH11 ARG 84 1HH1 ARG 84 -4.250 -3.633 5.341 595 HH12 ARG 84 2HH1 ARG 84 -2.941 -4.451 4.554 596 HH21 ARG 84 1HH2 ARG 84 -3.843 -7.622 5.718 597 HH22 ARG 84 2HH2 ARG 84 -2.711 -6.720 4.769 598 H LEU 85 H LEU 85 -9.354 -7.571 8.089 599 HA LEU 85 HA LEU 85 -7.202 -9.562 7.797 600 HB2 LEU 85 1HB LEU 85 -9.368 -11.063 7.353 601 HB3 LEU 85 2HB LEU 85 -8.636 -10.866 8.944 602 HG LEU 85 HG LEU 85 -10.743 -8.921 8.229 603 HD11 LEU 85 1HD1 LEU 85 -12.559 -10.349 8.423 604 HD12 LEU 85 2HD1 LEU 85 -11.588 -11.658 9.095 605 HD13 LEU 85 3HD1 LEU 85 -11.455 -11.252 7.384 606 HD21 LEU 85 3HD2 LEU 85 -10.292 -8.578 10.395 607 HD22 LEU 85 1HD2 LEU 85 -9.543 -10.163 10.589 608 HD23 LEU 85 2HD2 LEU 85 -11.297 -10.000 10.676 609 H THR 86 H THR 86 -6.749 -10.275 5.778 610 HA THR 86 HA THR 86 -8.109 -8.917 3.574 611 HB THR 86 HB THR 86 -5.561 -10.546 3.513 612 HG1 THR 86 HG1 THR 86 -4.686 -8.307 3.264 613 HG21 THR 86 3HG2 THR 86 -5.644 -8.670 1.428 614 HG22 THR 86 1HG2 THR 86 -7.232 -9.437 1.447 615 HG23 THR 86 2HG2 THR 86 -5.777 -10.424 1.297 616 H ILE 87 H ILE 87 -9.764 -9.966 2.693 617 HA ILE 87 HA ILE 87 -9.731 -12.897 2.617 618 HB ILE 87 HB ILE 87 -12.017 -10.992 2.097 619 HG12 ILE 87 1HG1 ILE 87 -12.330 -12.753 4.363 620 HG13 ILE 87 2HG1 ILE 87 -10.853 -11.809 4.526 621 HG21 ILE 87 1HG2 ILE 87 -12.171 -13.129 0.867 622 HG22 ILE 87 2HG2 ILE 87 -12.054 -13.991 2.401 623 HG23 ILE 87 3HG2 ILE 87 -13.437 -12.944 2.081 624 HD11 ILE 87 3HD1 ILE 87 -12.226 -10.303 5.449 625 HD12 ILE 87 1HD1 ILE 87 -12.592 -9.888 3.775 626 HD13 ILE 87 2HD1 ILE 87 -13.658 -10.973 4.668 627 HA PRO 88 HA PRO 88 -8.764 -12.802 -1.699 628 HB2 PRO 88 1HB PRO 88 -9.360 -15.394 -2.244 629 HB3 PRO 88 2HB PRO 88 -7.896 -14.906 -1.383 630 HG2 PRO 88 1HG PRO 88 -10.478 -15.950 -0.287 631 HG3 PRO 88 2HG PRO 88 -8.817 -16.362 0.178 632 HD2 PRO 88 1HD PRO 88 -10.346 -14.642 1.605 633 HD3 PRO 88 2HD PRO 88 -8.582 -14.478 1.484 634 HA PRO 89 HA PRO 89 -12.461 -12.365 -4.039 635 HB2 PRO 89 1HB PRO 89 -11.859 -13.552 -6.406 636 HB3 PRO 89 2HB PRO 89 -11.160 -12.009 -5.900 637 HG2 PRO 89 1HG PRO 89 -9.982 -14.758 -5.764 638 HG3 PRO 89 2HG PRO 89 -9.218 -13.236 -6.258 639 HD2 PRO 89 1HD PRO 89 -8.863 -14.314 -3.799 640 HD3 PRO 89 2HD PRO 89 -8.865 -12.561 -4.082 641 H GLN 90 H GLN 90 -11.145 -15.645 -3.987 642 HA GLN 90 HA GLN 90 -13.476 -16.955 -4.903 643 HB2 GLN 90 1HB GLN 90 -12.424 -18.987 -3.850 644 HB3 GLN 90 2HB GLN 90 -11.413 -18.139 -5.012 645 HG2 GLN 90 1HG GLN 90 -9.905 -17.511 -3.455 646 HG3 GLN 90 2HG GLN 90 -11.120 -17.336 -2.189 647 HE21 GLN 90 2HE2 GLN 90 -9.223 -18.416 -1.067 648 HE22 GLN 90 1HE2 GLN 90 -9.252 -20.142 -1.007 649 H LEU 91 H LEU 91 -12.823 -15.366 -2.011 650 HA LEU 91 HA LEU 91 -15.081 -16.730 -0.703 651 HB2 LEU 91 1HB LEU 91 -12.437 -15.894 0.395 652 HB3 LEU 91 2HB LEU 91 -13.851 -15.876 1.447 653 HG LEU 91 HG LEU 91 -14.135 -18.342 0.668 654 HD11 LEU 91 1HD1 LEU 91 -11.265 -17.771 -0.025 655 HD12 LEU 91 2HD1 LEU 91 -12.519 -18.454 -1.059 656 HD13 LEU 91 3HD1 LEU 91 -11.882 -19.393 0.290 657 HD21 LEU 91 3HD2 LEU 91 -12.143 -17.269 2.633 658 HD22 LEU 91 1HD2 LEU 91 -12.391 -19.004 2.442 659 HD23 LEU 91 2HD2 LEU 91 -13.734 -17.971 2.930 660 H GLY 92 H GLY 92 -14.335 -14.050 -2.259 661 HA2 GLY 92 1HA GLY 92 -16.048 -12.389 -0.525 662 HA3 GLY 92 2HA GLY 92 -14.582 -11.724 -1.231 663 H TYR 93 H TYR 93 -14.590 -11.026 -3.320 664 HA TYR 93 HA TYR 93 -17.135 -10.515 -4.507 665 HB2 TYR 93 1HB TYR 93 -14.312 -9.819 -5.089 666 HB3 TYR 93 2HB TYR 93 -15.417 -9.809 -6.458 667 HD1 TYR 93 HD1 TYR 93 -16.445 -8.954 -3.027 668 HD2 TYR 93 HD2 TYR 93 -15.329 -7.446 -6.845 669 HE1 TYR 93 HE1 TYR 93 -17.234 -6.719 -2.368 670 HE2 TYR 93 HE2 TYR 93 -16.113 -5.207 -6.197 671 HH TYR 93 HH TYR 93 -17.758 -4.653 -3.129 672 H GLY 94 H GLY 94 -14.279 -12.288 -5.720 673 HA2 GLY 94 1HA GLY 94 -14.612 -14.567 -6.562 674 HA3 GLY 94 2HA GLY 94 -16.145 -14.017 -7.223 675 H ALA 95 H ALA 95 -15.000 -15.144 -9.114 676 HA ALA 95 HA ALA 95 -12.983 -13.549 -10.444 677 HB1 ALA 95 1HB ALA 95 -14.109 -15.567 -12.138 678 HB2 ALA 95 2HB ALA 95 -12.488 -15.464 -11.450 679 HB3 ALA 95 3HB ALA 95 -13.785 -16.239 -10.540 680 H ARG 96 H ARG 96 -16.140 -13.062 -10.034 681 HA ARG 96 HA ARG 96 -17.047 -12.586 -12.699 682 HB2 ARG 96 1HB ARG 96 -18.359 -12.918 -10.411 683 HB3 ARG 96 2HB ARG 96 -18.266 -11.163 -10.381 684 HG2 ARG 96 1HG ARG 96 -19.185 -12.395 -12.903 685 HG3 ARG 96 2HG ARG 96 -20.273 -12.502 -11.518 686 HD2 ARG 96 1HD ARG 96 -19.690 -9.946 -11.289 687 HD3 ARG 96 2HD ARG 96 -19.306 -10.107 -13.002 688 HE ARG 96 HE ARG 96 -21.824 -11.245 -12.530 689 HH11 ARG 96 1HH1 ARG 96 -20.261 -8.134 -12.554 690 HH12 ARG 96 2HH1 ARG 96 -21.701 -7.268 -12.976 691 HH21 ARG 96 1HH2 ARG 96 -23.726 -10.116 -13.087 692 HH22 ARG 96 2HH2 ARG 96 -23.672 -8.397 -13.278 693 H GLY 97 H GLY 97 -15.243 -10.769 -10.367 694 HA2 GLY 97 1HA GLY 97 -14.069 -8.798 -10.666 695 HA3 GLY 97 2HA GLY 97 -14.704 -8.713 -12.302 696 H ALA 98 H ALA 98 -14.564 -6.375 -11.169 697 HA ALA 98 HA ALA 98 -17.345 -5.663 -10.715 698 HB1 ALA 98 1HB ALA 98 -16.958 -5.789 -8.473 699 HB2 ALA 98 2HB ALA 98 -15.234 -5.449 -8.637 700 HB3 ALA 98 3HB ALA 98 -16.408 -4.138 -8.766 701 H GLY 99 H GLY 99 -14.107 -4.176 -10.414 702 HA2 GLY 99 1HA GLY 99 -15.059 -2.028 -12.203 703 HA3 GLY 99 2HA GLY 99 -13.827 -1.820 -10.966 704 H GLY 100 H GLY 100 -12.753 -0.848 -12.938 705 HA2 GLY 100 1HA GLY 100 -11.795 -2.637 -14.964 706 HA3 GLY 100 2HA GLY 100 -11.274 -0.978 -14.707 707 H VAL 101 H VAL 101 -10.380 -1.184 -12.058 708 HA VAL 101 HA VAL 101 -7.896 -2.653 -12.506 709 HB VAL 101 HB VAL 101 -7.067 -1.422 -10.515 710 HG11 VAL 101 1HG1 VAL 101 -6.538 -0.433 -12.577 711 HG12 VAL 101 2HG1 VAL 101 -8.198 0.107 -12.841 712 HG13 VAL 101 3HG1 VAL 101 -7.203 0.879 -11.606 713 HG21 VAL 101 3HG2 VAL 101 -9.170 0.562 -10.461 714 HG22 VAL 101 1HG2 VAL 101 -9.769 -1.031 -9.998 715 HG23 VAL 101 2HG2 VAL 101 -8.413 -0.312 -9.130 716 H ILE 102 H ILE 102 -10.158 -4.239 -11.967 717 HA ILE 102 HA ILE 102 -9.278 -5.504 -9.482 718 HB ILE 102 HB ILE 102 -12.178 -4.927 -10.100 719 HG12 ILE 102 1HG1 ILE 102 -10.355 -3.903 -7.912 720 HG13 ILE 102 2HG1 ILE 102 -11.007 -2.962 -9.249 721 HG21 ILE 102 1HG2 ILE 102 -12.716 -6.601 -8.748 722 HG22 ILE 102 2HG2 ILE 102 -11.010 -7.026 -8.618 723 HG23 ILE 102 3HG2 ILE 102 -11.731 -5.907 -7.461 724 HD11 ILE 102 3HD1 ILE 102 -13.232 -4.072 -8.012 725 HD12 ILE 102 1HD1 ILE 102 -12.172 -3.577 -6.693 726 HD13 ILE 102 2HD1 ILE 102 -12.675 -2.403 -7.909 727 HA PRO 103 HA PRO 103 -9.629 -8.627 -12.802 728 HB2 PRO 103 1HB PRO 103 -7.628 -10.182 -11.826 729 HB3 PRO 103 2HB PRO 103 -7.336 -8.774 -12.854 730 HG2 PRO 103 1HG PRO 103 -7.153 -9.015 -9.876 731 HG3 PRO 103 2HG PRO 103 -6.055 -8.196 -11.002 732 HD2 PRO 103 1HD PRO 103 -7.897 -6.861 -9.533 733 HD3 PRO 103 2HD PRO 103 -7.399 -6.330 -11.152 734 HA PRO 104 HA PRO 104 -11.953 -11.711 -10.700 735 HB2 PRO 104 1HB PRO 104 -11.266 -13.982 -12.019 736 HB3 PRO 104 2HB PRO 104 -12.283 -12.726 -12.734 737 HG2 PRO 104 1HG PRO 104 -9.356 -13.232 -13.104 738 HG3 PRO 104 2HG PRO 104 -10.582 -12.821 -14.317 739 HD2 PRO 104 1HD PRO 104 -8.868 -10.988 -13.299 740 HD3 PRO 104 2HD PRO 104 -10.520 -10.575 -13.802 741 H ASN 105 H ASN 105 -8.564 -11.748 -10.589 742 HA ASN 105 HA ASN 105 -8.597 -13.817 -8.491 743 HB2 ASN 105 1HB ASN 105 -7.265 -14.395 -10.535 744 HB3 ASN 105 2HB ASN 105 -6.227 -13.015 -10.189 745 HD21 ASN 105 2HD2 ASN 105 -4.543 -13.316 -8.904 746 HD22 ASN 105 1HD2 ASN 105 -4.269 -14.707 -7.916 747 H ALA 106 H ALA 106 -8.856 -10.718 -8.616 748 HA ALA 106 HA ALA 106 -6.603 -9.767 -7.120 749 HB1 ALA 106 1HB ALA 106 -8.931 -8.092 -6.862 750 HB2 ALA 106 2HB ALA 106 -7.402 -7.772 -7.682 751 HB3 ALA 106 3HB ALA 106 -8.705 -8.597 -8.537 752 H THR 107 H THR 107 -6.598 -9.063 -4.943 753 HA THR 107 HA THR 107 -8.435 -10.594 -3.238 754 HB THR 107 HB THR 107 -6.058 -9.256 -2.061 755 HG1 THR 107 HG1 THR 107 -5.670 -11.730 -3.349 756 HG21 THR 107 3HG2 THR 107 -6.100 -11.031 -0.563 757 HG22 THR 107 1HG2 THR 107 -6.901 -12.109 -1.706 758 HG23 THR 107 2HG2 THR 107 -7.810 -10.810 -0.934 759 H LEU 108 H LEU 108 -9.431 -9.636 -1.434 760 HA LEU 108 HA LEU 108 -9.473 -6.691 -1.445 761 HB2 LEU 108 1HB LEU 108 -11.830 -8.495 -0.926 762 HB3 LEU 108 2HB LEU 108 -11.841 -6.733 -0.968 763 HG LEU 108 HG LEU 108 -11.301 -8.528 -3.333 764 HD11 LEU 108 1HD1 LEU 108 -13.762 -7.538 -2.131 765 HD12 LEU 108 2HD1 LEU 108 -13.515 -8.800 -3.337 766 HD13 LEU 108 3HD1 LEU 108 -13.595 -7.109 -3.834 767 HD21 LEU 108 3HD2 LEU 108 -11.333 -5.567 -2.935 768 HD22 LEU 108 1HD2 LEU 108 -11.814 -6.252 -4.487 769 HD23 LEU 108 2HD2 LEU 108 -10.201 -6.566 -3.848 770 H VAL 109 H VAL 109 -9.320 -5.698 0.492 771 HA VAL 109 HA VAL 109 -9.113 -7.431 2.862 772 HB VAL 109 HB VAL 109 -8.070 -4.626 2.811 773 HG11 VAL 109 1HG1 VAL 109 -7.794 -7.038 4.460 774 HG12 VAL 109 2HG1 VAL 109 -6.287 -6.169 4.159 775 HG13 VAL 109 3HG1 VAL 109 -7.654 -5.337 4.902 776 HG21 VAL 109 3HG2 VAL 109 -7.052 -5.405 0.847 777 HG22 VAL 109 1HG2 VAL 109 -5.849 -5.680 2.106 778 HG23 VAL 109 2HG2 VAL 109 -6.818 -7.024 1.505 779 H PHE 110 H PHE 110 -10.109 -6.843 4.794 780 HA PHE 110 HA PHE 110 -11.841 -4.501 4.819 781 HB2 PHE 110 1HB PHE 110 -12.821 -7.342 4.953 782 HB3 PHE 110 2HB PHE 110 -13.725 -6.031 5.705 783 HD1 PHE 110 HD2 PHE 110 -12.412 -7.289 2.490 784 HD2 PHE 110 HD1 PHE 110 -15.070 -4.587 4.427 785 HE1 PHE 110 HE2 PHE 110 -13.468 -6.783 0.327 786 HE2 PHE 110 HE1 PHE 110 -16.132 -4.078 2.266 787 HZ PHE 110 HZ PHE 110 -15.330 -5.175 0.212 788 H GLU 111 H GLU 111 -12.089 -3.635 6.814 789 HA GLU 111 HA GLU 111 -10.678 -4.976 9.004 790 HB2 GLU 111 1HB GLU 111 -9.854 -2.778 8.630 791 HB3 GLU 111 2HB GLU 111 -11.477 -2.108 8.536 792 HG2 GLU 111 1HG GLU 111 -10.819 -3.434 11.071 793 HG3 GLU 111 2HG GLU 111 -9.889 -1.979 10.714 794 H VAL 112 H VAL 112 -11.734 -5.832 10.670 795 HA VAL 112 HA VAL 112 -14.603 -5.234 10.951 796 HB VAL 112 HB VAL 112 -13.262 -7.634 12.158 797 HG11 VAL 112 1HG1 VAL 112 -16.060 -7.443 11.111 798 HG12 VAL 112 2HG1 VAL 112 -15.403 -8.508 12.356 799 HG13 VAL 112 3HG1 VAL 112 -15.646 -6.795 12.698 800 HG21 VAL 112 3HG2 VAL 112 -14.080 -7.209 9.314 801 HG22 VAL 112 1HG2 VAL 112 -12.651 -8.015 9.961 802 HG23 VAL 112 2HG2 VAL 112 -14.225 -8.807 10.046 803 H GLU 113 H GLU 113 -15.301 -4.249 12.734 804 HA GLU 113 HA GLU 113 -13.637 -4.337 15.152 805 HB2 GLU 113 1HB GLU 113 -13.087 -2.221 14.235 806 HB3 GLU 113 2HB GLU 113 -14.758 -1.891 13.798 807 HG2 GLU 113 1HG GLU 113 -15.347 -1.295 15.924 808 HG3 GLU 113 2HG GLU 113 -14.090 -2.282 16.667 809 H LEU 114 H LEU 114 -14.934 -5.570 16.398 810 HA LEU 114 HA LEU 114 -17.799 -5.168 16.438 811 HB2 LEU 114 1HB LEU 114 -17.113 -7.416 16.602 812 HB3 LEU 114 2HB LEU 114 -15.931 -7.044 17.855 813 HG LEU 114 HG LEU 114 -17.696 -6.702 19.472 814 HD11 LEU 114 1HD1 LEU 114 -19.654 -7.420 17.301 815 HD12 LEU 114 2HD1 LEU 114 -19.343 -5.773 17.848 816 HD13 LEU 114 3HD1 LEU 114 -20.015 -6.961 18.965 817 HD21 LEU 114 3HD2 LEU 114 -18.661 -9.213 18.288 818 HD22 LEU 114 1HD2 LEU 114 -17.969 -8.896 19.879 819 HD23 LEU 114 2HD2 LEU 114 -16.911 -9.097 18.482 820 H LEU 115 H LEU 115 -18.818 -3.796 17.730 821 HA LEU 115 HA LEU 115 -17.357 -2.489 19.878 822 HB2 LEU 115 1HB LEU 115 -20.209 -1.894 19.259 823 HB3 LEU 115 2HB LEU 115 -18.925 -0.810 19.790 824 HG LEU 115 HG LEU 115 -19.286 -1.936 17.013 825 HD11 LEU 115 1HD1 LEU 115 -20.779 -0.249 16.958 826 HD12 LEU 115 2HD1 LEU 115 -19.334 0.741 16.754 827 HD13 LEU 115 3HD1 LEU 115 -20.069 0.572 18.348 828 HD21 LEU 115 3HD2 LEU 115 -17.002 -0.696 18.359 829 HD22 LEU 115 1HD2 LEU 115 -17.451 0.076 16.838 830 HD23 LEU 115 2HD2 LEU 115 -17.069 -1.646 16.873 831 H ASP 116 H ASP 116 -20.505 -4.124 19.511 832 HA ASP 116 HA ASP 116 -20.183 -5.430 22.060 833 HB2 ASP 116 1HB ASP 116 -21.050 -3.168 22.674 834 HB3 ASP 116 2HB ASP 116 -22.486 -3.502 21.710 835 H VAL 117 H VAL 117 -21.848 -7.016 22.474 836 HA VAL 117 HA VAL 117 -23.161 -7.889 19.989 837 HB VAL 117 HB VAL 117 -23.125 -10.140 20.857 838 HG11 VAL 117 1HG1 VAL 117 -20.801 -8.598 20.312 839 HG12 VAL 117 2HG1 VAL 117 -20.398 -9.792 21.548 840 HG13 VAL 117 3HG1 VAL 117 -21.083 -10.312 20.007 841 HG21 VAL 117 3HG2 VAL 117 -23.496 -9.632 23.215 842 HG22 VAL 117 1HG2 VAL 117 -22.095 -10.684 23.010 843 HG23 VAL 117 2HG2 VAL 117 -21.868 -8.966 23.337 844 H13 JZF 130 1H3 JZF 130 -17.252 -5.018 -0.313 845 H23 JZF 130 2H3 JZF 130 -17.764 -3.991 1.013 846 H4 JZF 130 H4 JZF 130 -19.164 -4.381 -1.656 847 H15 JZF 130 1H5 JZF 130 -20.816 -2.741 -0.945 848 H25 JZF 130 2H5 JZF 130 -20.027 -2.535 0.611 849 H17 JZF 130 1H7 JZF 130 -17.552 -2.013 -0.674 850 H27 JZF 130 2H7 JZF 130 -17.191 -3.088 -1.986 851 H8 JZF 130 H8 JZF 130 -19.674 -1.864 -2.540 852 H9 JZF 130 H9 JZF 130 -17.087 -2.084 -3.959 853 H1OH JZF 130 1HO JZF 130 -19.361 0.240 -2.344 854 H11 JZF 130 H11 JZF 130 -17.461 -3.278 -6.227 855 H112 JZF 130 1H12 JZF 130 -19.393 -1.074 -7.110 856 H212 JZF 130 2H12 JZF 130 -17.960 -1.594 -7.985 857 H13A JZF 130 H13 JZF 130 -17.691 0.547 -6.674 858 H114 JZF 130 1H14 JZF 130 -17.463 0.426 -4.222 859 H214 JZF 130 2H14 JZF 130 -19.082 0.100 -4.784 860 H115 JZF 130 1H15 JZF 130 -21.959 -6.229 2.036 861 H215 JZF 130 2H15 JZF 130 -20.543 -7.281 2.029 862 H116 JZF 130 1H16 JZF 130 -20.190 -7.202 -2.521 863 H216 JZF 130 2H16 JZF 130 -19.462 -7.546 -0.924 864 H117 JZF 130 2H17 JZF 130 -21.379 -9.340 -2.523 865 H217 JZF 130 3H17 JZF 130 -19.699 -9.700 -2.080 866 H317 JZF 130 1H17 JZF 130 -20.954 -9.644 -0.830 867 H118 JZF 130 1H18 JZF 130 -20.390 -3.408 -7.109 868 H218 JZF 130 2H18 JZF 130 -19.003 -3.912 -8.083 869 H318 JZF 130 3H18 JZF 130 -19.401 -4.783 -6.592 870 H119 JZF 130 3H19 JZF 130 -15.537 -0.561 -5.297 871 H219 JZF 130 1H19 JZF 130 -15.869 -1.775 -6.536 872 H319 JZF 130 2H19 JZF 130 -15.540 -0.107 -7.005 Start of MODEL 4 1 H1 GLY 1 H GLY 1 -2.490 -1.788 23.104 2 HA2 GLY 1 1HA GLY 1 -1.347 0.804 22.264 3 HA3 GLY 1 2HA GLY 1 -0.432 -0.354 23.217 4 HA PRO 2 HA PRO 2 0.175 -0.990 18.568 5 HB2 PRO 2 1HB PRO 2 2.779 -0.231 18.456 6 HB3 PRO 2 2HB PRO 2 1.439 0.897 18.219 7 HG2 PRO 2 1HG PRO 2 3.089 0.402 20.667 8 HG3 PRO 2 2HG PRO 2 2.543 1.942 19.978 9 HD2 PRO 2 1HD PRO 2 1.313 0.773 22.088 10 HD3 PRO 2 2HD PRO 2 0.436 1.748 20.892 11 H GLY 3 H GLY 3 1.791 -2.476 17.578 12 HA2 GLY 3 1HA GLY 3 3.481 -4.040 19.292 13 HA3 GLY 3 2HA GLY 3 1.999 -4.882 18.864 14 H SER 4 H SER 4 2.059 -6.089 17.094 15 HA SER 4 HA SER 4 4.226 -5.603 15.163 16 HB2 SER 4 1HB SER 4 4.314 -7.908 14.726 17 HB3 SER 4 2HB SER 4 4.048 -7.832 16.468 18 HG SER 4 HG SER 4 2.580 -9.276 15.717 19 H MET 5 H MET 5 3.646 -4.763 13.283 20 HA MET 5 HA MET 5 0.860 -5.036 12.402 21 HB2 MET 5 1HB MET 5 2.145 -2.766 12.667 22 HB3 MET 5 2HB MET 5 2.832 -3.192 11.106 23 HG2 MET 5 1HG MET 5 1.038 -1.933 10.467 24 HG3 MET 5 2HG MET 5 0.344 -3.552 10.426 25 HE1 MET 5 3HE MET 5 0.418 -0.202 12.949 26 HE2 MET 5 1HE MET 5 0.043 -0.182 11.226 27 HE3 MET 5 2HE MET 5 -1.250 -0.004 12.411 28 H THR 6 H THR 6 1.370 -7.266 11.733 29 HA THR 6 HA THR 6 2.502 -7.283 9.017 30 HB THR 6 HB THR 6 4.163 -8.300 10.486 31 HG1 THR 6 HG1 THR 6 2.969 -10.506 9.209 32 HG21 THR 6 3HG2 THR 6 2.267 -9.057 12.128 33 HG22 THR 6 1HG2 THR 6 3.750 -10.001 11.992 34 HG23 THR 6 2HG2 THR 6 2.289 -10.529 11.157 35 H VAL 7 H VAL 7 1.466 -8.574 7.530 36 HA VAL 7 HA VAL 7 -1.229 -9.372 8.223 37 HB VAL 7 HB VAL 7 0.171 -9.600 5.556 38 HG11 VAL 7 1HG1 VAL 7 -2.681 -9.877 6.441 39 HG12 VAL 7 2HG1 VAL 7 -2.269 -9.458 4.777 40 HG13 VAL 7 3HG1 VAL 7 -1.710 -10.981 5.468 41 HG21 VAL 7 3HG2 VAL 7 -1.626 -7.507 5.410 42 HG22 VAL 7 1HG2 VAL 7 -0.865 -7.295 6.987 43 HG23 VAL 7 2HG2 VAL 7 0.128 -7.368 5.531 44 H VAL 8 H VAL 8 -1.541 -11.293 9.136 45 HA VAL 8 HA VAL 8 0.217 -13.530 8.461 46 HB VAL 8 HB VAL 8 -1.938 -13.380 10.573 47 HG11 VAL 8 1HG1 VAL 8 -0.570 -15.337 11.494 48 HG12 VAL 8 2HG1 VAL 8 -1.603 -15.648 10.098 49 HG13 VAL 8 3HG1 VAL 8 0.135 -15.437 9.881 50 HG21 VAL 8 3HG2 VAL 8 -0.011 -13.199 12.149 51 HG22 VAL 8 1HG2 VAL 8 1.041 -12.958 10.754 52 HG23 VAL 8 2HG2 VAL 8 -0.230 -11.789 11.113 53 H THR 9 H THR 9 -0.537 -15.498 7.679 54 HA THR 9 HA THR 9 -3.114 -15.338 6.289 55 HB THR 9 HB THR 9 -1.041 -17.472 5.835 56 HG1 THR 9 HG1 THR 9 0.149 -15.707 5.378 57 HG21 THR 9 3HG2 THR 9 -2.741 -18.147 4.519 58 HG22 THR 9 1HG2 THR 9 -2.189 -16.867 3.440 59 HG23 THR 9 2HG2 THR 9 -3.525 -16.568 4.553 60 H THR 10 H THR 10 -4.438 -17.297 6.163 61 HA THR 10 HA THR 10 -4.289 -18.863 8.656 62 HB THR 10 HB THR 10 -6.730 -19.102 8.547 63 HG1 THR 10 HG1 THR 10 -6.350 -17.690 6.144 64 HG21 THR 10 3HG2 THR 10 -7.067 -17.166 9.647 65 HG22 THR 10 1HG2 THR 10 -6.527 -16.184 8.287 66 HG23 THR 10 2HG2 THR 10 -5.344 -16.907 9.378 67 H GLU 11 H GLU 11 -5.967 -20.868 8.256 68 HA GLU 11 HA GLU 11 -4.584 -22.515 6.356 69 HB2 GLU 11 1HB GLU 11 -6.085 -24.305 7.169 70 HB3 GLU 11 2HB GLU 11 -5.260 -23.468 8.476 71 HG2 GLU 11 1HG GLU 11 -7.929 -22.453 7.722 72 HG3 GLU 11 2HG GLU 11 -7.865 -24.026 8.514 73 H SER 12 H SER 12 -7.514 -20.689 6.399 74 HA SER 12 HA SER 12 -8.668 -22.090 4.136 75 HB2 SER 12 1HB SER 12 -9.637 -19.507 5.367 76 HB3 SER 12 2HB SER 12 -10.561 -20.658 4.402 77 HG SER 12 HG SER 12 -11.024 -21.617 6.200 78 H GLY 13 H GLY 13 -6.741 -19.275 4.767 79 HA2 GLY 13 1HA GLY 13 -5.425 -18.632 2.713 80 HA3 GLY 13 2HA GLY 13 -6.992 -18.487 1.931 81 H LEU 14 H LEU 14 -8.467 -17.195 3.860 82 HA LEU 14 HA LEU 14 -7.896 -14.529 3.426 83 HB2 LEU 14 1HB LEU 14 -10.064 -15.035 4.123 84 HB3 LEU 14 2HB LEU 14 -9.500 -15.941 5.525 85 HG LEU 14 HG LEU 14 -8.900 -13.040 5.478 86 HD11 LEU 14 1HD1 LEU 14 -11.636 -13.914 6.309 87 HD12 LEU 14 2HD1 LEU 14 -11.315 -13.440 4.641 88 HD13 LEU 14 3HD1 LEU 14 -11.038 -12.294 5.952 89 HD21 LEU 14 3HD2 LEU 14 -8.379 -14.804 7.296 90 HD22 LEU 14 1HD2 LEU 14 -10.087 -14.645 7.708 91 HD23 LEU 14 2HD2 LEU 14 -9.026 -13.237 7.785 92 H LYS 15 H LYS 15 -6.929 -12.894 4.617 93 HA LYS 15 HA LYS 15 -4.943 -13.818 6.568 94 HB2 LYS 15 1HB LYS 15 -4.999 -11.092 5.299 95 HB3 LYS 15 2HB LYS 15 -3.633 -11.942 6.009 96 HG2 LYS 15 1HG LYS 15 -5.031 -12.691 3.449 97 HG3 LYS 15 2HG LYS 15 -3.479 -11.861 3.579 98 HD2 LYS 15 1HD LYS 15 -2.732 -13.890 4.960 99 HD3 LYS 15 2HD LYS 15 -4.168 -14.690 4.316 100 HE2 LYS 15 1HE LYS 15 -2.264 -13.323 2.462 101 HE3 LYS 15 2HE LYS 15 -1.876 -14.923 3.090 102 HZ1 LYS 15 3HZ LYS 15 -4.551 -14.578 1.999 103 HZ2 LYS 15 1HZ LYS 15 -3.491 -15.891 1.875 104 HZ3 LYS 15 2HZ LYS 15 -3.281 -14.539 0.881 105 H TYR 16 H TYR 16 -4.480 -12.422 8.424 106 HA TYR 16 HA TYR 16 -6.608 -10.621 9.255 107 HB2 TYR 16 1HB TYR 16 -7.293 -11.793 11.146 108 HB3 TYR 16 2HB TYR 16 -7.112 -13.076 9.956 109 HD1 TYR 16 HD2 TYR 16 -4.679 -14.160 9.906 110 HD2 TYR 16 HD1 TYR 16 -6.371 -12.121 13.235 111 HE1 TYR 16 HE2 TYR 16 -3.132 -15.341 11.408 112 HE2 TYR 16 HE1 TYR 16 -4.827 -13.296 14.747 113 HH TYR 16 HH TYR 16 -2.673 -14.431 14.659 114 H GLU 17 H GLU 17 -5.920 -9.042 10.616 115 HA GLU 17 HA GLU 17 -3.300 -9.311 11.890 116 HB2 GLU 17 1HB GLU 17 -2.894 -8.233 9.715 117 HB3 GLU 17 2HB GLU 17 -4.067 -6.986 10.115 118 HG2 GLU 17 1HG GLU 17 -2.584 -6.506 12.144 119 HG3 GLU 17 2HG GLU 17 -1.365 -7.469 11.311 120 H ASP 18 H ASP 18 -3.527 -8.807 13.956 121 HA ASP 18 HA ASP 18 -5.835 -7.506 14.981 122 HB2 ASP 18 1HB ASP 18 -4.750 -7.699 17.155 123 HB3 ASP 18 2HB ASP 18 -4.568 -9.202 16.255 124 H LEU 19 H LEU 19 -6.199 -5.427 15.492 125 HA LEU 19 HA LEU 19 -3.989 -3.525 15.071 126 HB2 LEU 19 1HB LEU 19 -6.877 -3.453 14.381 127 HB3 LEU 19 2HB LEU 19 -6.096 -1.936 14.820 128 HG LEU 19 HG LEU 19 -4.363 -2.936 12.963 129 HD11 LEU 19 1HD1 LEU 19 -6.041 -4.774 12.547 130 HD12 LEU 19 2HD1 LEU 19 -5.549 -3.842 11.134 131 HD13 LEU 19 3HD1 LEU 19 -7.109 -3.531 11.895 132 HD21 LEU 19 3HD2 LEU 19 -5.564 -1.339 11.399 133 HD22 LEU 19 1HD2 LEU 19 -5.016 -0.674 12.937 134 HD23 LEU 19 2HD2 LEU 19 -6.717 -1.083 12.710 135 H THR 20 H THR 20 -6.779 -4.320 17.073 136 HA THR 20 HA THR 20 -5.537 -2.978 19.327 137 HB THR 20 HB THR 20 -8.372 -2.244 18.595 138 HG1 THR 20 HG1 THR 20 -7.416 -0.199 18.000 139 HG21 THR 20 3HG2 THR 20 -7.731 -0.331 20.218 140 HG22 THR 20 1HG2 THR 20 -6.431 -1.409 20.724 141 HG23 THR 20 2HG2 THR 20 -8.113 -1.917 20.888 142 H GLU 21 H GLU 21 -5.647 -4.361 20.959 143 HA GLU 21 HA GLU 21 -7.073 -6.728 20.995 144 HB2 GLU 21 1HB GLU 21 -6.060 -5.080 23.316 145 HB3 GLU 21 2HB GLU 21 -6.653 -6.728 23.465 146 HG2 GLU 21 1HG GLU 21 -4.880 -7.552 22.074 147 HG3 GLU 21 2HG GLU 21 -4.336 -5.911 21.730 148 H GLY 22 H GLY 22 -8.704 -7.317 22.784 149 HA2 GLY 22 1HA GLY 22 -10.653 -5.194 23.281 150 HA3 GLY 22 2HA GLY 22 -11.185 -6.558 22.310 151 H SER 23 H SER 23 -10.145 -8.714 23.520 152 HA SER 23 HA SER 23 -10.452 -10.176 25.236 153 HB2 SER 23 1HB SER 23 -10.628 -7.942 27.222 154 HB3 SER 23 2HB SER 23 -9.824 -9.506 27.364 155 HG SER 23 HG SER 23 -8.140 -8.762 26.193 156 H GLY 24 H GLY 24 -12.652 -10.106 24.021 157 HA2 GLY 24 1HA GLY 24 -14.717 -9.780 26.090 158 HA3 GLY 24 2HA GLY 24 -14.977 -9.079 24.500 159 H ALA 25 H ALA 25 -16.897 -10.440 24.469 160 HA ALA 25 HA ALA 25 -16.460 -13.305 24.217 161 HB1 ALA 25 1HB ALA 25 -18.420 -13.005 25.354 162 HB2 ALA 25 2HB ALA 25 -18.844 -11.543 24.461 163 HB3 ALA 25 3HB ALA 25 -19.040 -13.126 23.707 164 H GLU 26 H GLU 26 -16.671 -14.481 22.354 165 HA GLU 26 HA GLU 26 -16.328 -13.028 19.883 166 HB2 GLU 26 1HB GLU 26 -14.957 -14.982 20.249 167 HB3 GLU 26 2HB GLU 26 -16.379 -15.984 20.503 168 HG2 GLU 26 1HG GLU 26 -17.043 -15.607 18.172 169 HG3 GLU 26 2HG GLU 26 -15.585 -14.648 17.926 170 H ALA 27 H ALA 27 -17.736 -12.881 18.202 171 HA ALA 27 HA ALA 27 -20.489 -13.019 18.696 172 HB1 ALA 27 1HB ALA 27 -20.111 -13.152 15.905 173 HB2 ALA 27 2HB ALA 27 -20.456 -11.730 16.891 174 HB3 ALA 27 3HB ALA 27 -18.786 -12.189 16.559 175 H ARG 28 H ARG 28 -22.097 -14.431 17.989 176 HA ARG 28 HA ARG 28 -21.179 -17.042 16.989 177 HB2 ARG 28 1HB ARG 28 -22.132 -16.569 19.560 178 HB3 ARG 28 2HB ARG 28 -23.520 -17.228 18.704 179 HG2 ARG 28 1HG ARG 28 -22.576 -19.274 18.461 180 HG3 ARG 28 2HG ARG 28 -20.937 -18.629 18.362 181 HD2 ARG 28 1HD ARG 28 -21.169 -18.069 20.827 182 HD3 ARG 28 2HD ARG 28 -22.623 -19.066 20.814 183 HE ARG 28 HE ARG 28 -20.707 -20.671 19.735 184 HH11 ARG 28 1HH1 ARG 28 -20.997 -18.861 22.694 185 HH12 ARG 28 2HH1 ARG 28 -20.020 -19.957 23.614 186 HH21 ARG 28 1HH2 ARG 28 -19.419 -22.122 20.935 187 HH22 ARG 28 2HH2 ARG 28 -19.123 -21.812 22.612 188 H ALA 29 H ALA 29 -22.464 -18.023 15.487 189 HA ALA 29 HA ALA 29 -24.171 -16.466 13.920 190 HB1 ALA 29 1HB ALA 29 -23.768 -19.438 14.103 191 HB2 ALA 29 2HB ALA 29 -24.871 -18.703 12.940 192 HB3 ALA 29 3HB ALA 29 -23.151 -18.318 12.889 193 H GLY 30 H GLY 30 -26.168 -15.773 14.288 194 HA2 GLY 30 1HA GLY 30 -28.503 -16.460 14.633 195 HA3 GLY 30 2HA GLY 30 -27.931 -17.440 15.975 196 H GLN 31 H GLN 31 -26.051 -15.039 16.541 197 HA GLN 31 HA GLN 31 -28.033 -13.576 18.142 198 HB2 GLN 31 1HB GLN 31 -26.465 -13.317 19.796 199 HB3 GLN 31 2HB GLN 31 -25.926 -14.842 19.106 200 HG2 GLN 31 1HG GLN 31 -24.277 -13.611 17.751 201 HG3 GLN 31 2HG GLN 31 -24.785 -12.116 18.536 202 HE21 GLN 31 2HE2 GLN 31 -24.089 -11.661 20.571 203 HE22 GLN 31 1HE2 GLN 31 -22.939 -12.623 21.428 204 H THR 32 H THR 32 -27.961 -11.310 18.278 205 HA THR 32 HA THR 32 -26.852 -10.041 15.887 206 HB THR 32 HB THR 32 -28.567 -8.540 17.814 207 HG1 THR 32 HG1 THR 32 -29.988 -10.125 17.666 208 HG21 THR 32 3HG2 THR 32 -27.535 -7.686 15.602 209 HG22 THR 32 1HG2 THR 32 -29.232 -7.338 15.929 210 HG23 THR 32 2HG2 THR 32 -28.796 -8.642 14.825 211 H VAL 33 H VAL 33 -25.286 -8.525 15.931 212 HA VAL 33 HA VAL 33 -24.487 -7.346 18.483 213 HB VAL 33 HB VAL 33 -22.133 -7.853 18.153 214 HG11 VAL 33 1HG1 VAL 33 -22.193 -9.977 19.015 215 HG12 VAL 33 2HG1 VAL 33 -23.876 -9.495 19.237 216 HG13 VAL 33 3HG1 VAL 33 -23.424 -10.523 17.877 217 HG21 VAL 33 3HG2 VAL 33 -23.017 -8.570 15.522 218 HG22 VAL 33 1HG2 VAL 33 -21.375 -8.347 16.125 219 HG23 VAL 33 2HG2 VAL 33 -22.155 -9.924 16.253 220 H SER 34 H SER 34 -23.142 -5.467 18.260 221 HA SER 34 HA SER 34 -23.518 -4.149 15.662 222 HB2 SER 34 1HB SER 34 -23.594 -2.085 16.784 223 HB3 SER 34 2HB SER 34 -24.460 -3.176 17.865 224 HG SER 34 HG SER 34 -23.077 -2.461 19.282 225 H VAL 35 H VAL 35 -21.803 -4.000 14.393 226 HA VAL 35 HA VAL 35 -19.179 -3.469 15.583 227 HB VAL 35 HB VAL 35 -18.046 -5.150 14.391 228 HG11 VAL 35 1HG1 VAL 35 -20.439 -6.781 15.020 229 HG12 VAL 35 2HG1 VAL 35 -18.755 -7.005 15.498 230 HG13 VAL 35 3HG1 VAL 35 -19.756 -5.808 16.323 231 HG21 VAL 35 3HG2 VAL 35 -19.732 -6.691 12.927 232 HG22 VAL 35 1HG2 VAL 35 -20.429 -5.090 12.677 233 HG23 VAL 35 2HG2 VAL 35 -18.741 -5.391 12.265 234 H HIS 36 H HIS 36 -17.580 -2.745 13.951 235 HA HIS 36 HA HIS 36 -18.919 -1.226 11.813 236 HB2 HIS 36 1HB HIS 36 -16.794 -0.551 13.738 237 HB3 HIS 36 2HB HIS 36 -16.486 -0.021 12.087 238 HD1 HIS 36 HD1 HIS 36 -18.674 1.343 11.021 239 HD2 HIS 36 HD2 HIS 36 -18.242 1.234 15.151 240 HE1 HIS 36 HE1 HIS 36 -20.067 3.246 11.893 241 H TYR 37 H TYR 37 -18.332 -1.534 9.750 242 HA TYR 37 HA TYR 37 -16.003 -3.267 9.240 243 HB2 TYR 37 1HB TYR 37 -17.149 -4.218 7.371 244 HB3 TYR 37 2HB TYR 37 -18.265 -4.258 8.731 245 HD1 TYR 37 HD1 TYR 37 -20.187 -2.720 8.805 246 HD2 TYR 37 HD2 TYR 37 -17.597 -2.874 5.433 247 HE1 TYR 37 HE1 TYR 37 -21.870 -1.528 7.465 248 HE2 TYR 37 HE2 TYR 37 -19.272 -1.681 4.084 249 HH TYR 37 HH TYR 37 -22.173 -1.503 4.492 250 H THR 38 H THR 38 -14.463 -2.544 7.903 251 HA THR 38 HA THR 38 -15.000 -0.064 6.400 252 HB THR 38 HB THR 38 -12.201 -0.704 7.160 253 HG1 THR 38 HG1 THR 38 -14.054 0.413 9.018 254 HG21 THR 38 3HG2 THR 38 -12.161 1.770 7.483 255 HG22 THR 38 1HG2 THR 38 -13.857 1.815 7.005 256 HG23 THR 38 2HG2 THR 38 -12.632 1.273 5.858 257 H GLY 39 H GLY 39 -14.036 0.168 4.357 258 HA2 GLY 39 1HA GLY 39 -13.271 -2.398 3.130 259 HA3 GLY 39 2HA GLY 39 -13.971 -1.034 2.272 260 H TRP 40 H TRP 40 -11.110 -2.611 3.176 261 HA TRP 40 HA TRP 40 -9.508 -0.339 2.197 262 HB2 TRP 40 1HB TRP 40 -8.683 -2.540 4.104 263 HB3 TRP 40 2HB TRP 40 -7.623 -1.270 3.498 264 HD1 TRP 40 HD1 TRP 40 -10.273 0.863 3.904 265 HE1 TRP 40 HE1 TRP 40 -10.528 1.835 6.274 266 HE3 TRP 40 HE3 TRP 40 -7.450 -2.532 6.481 267 HZ2 TRP 40 HZ2 TRP 40 -9.647 1.241 8.889 268 HZ3 TRP 40 HZ3 TRP 40 -7.207 -2.258 8.914 269 HH2 TRP 40 HH2 TRP 40 -8.283 -0.410 10.091 270 H LEU 41 H LEU 41 -7.429 -1.028 1.139 271 HA LEU 41 HA LEU 41 -7.956 -3.346 -0.595 272 HB2 LEU 41 1HB LEU 41 -6.825 -0.668 -1.046 273 HB3 LEU 41 2HB LEU 41 -5.983 -1.985 -1.861 274 HG LEU 41 HG LEU 41 -8.688 -2.409 -2.405 275 HD11 LEU 41 1HD1 LEU 41 -8.094 0.443 -3.084 276 HD12 LEU 41 2HD1 LEU 41 -8.862 0.025 -1.552 277 HD13 LEU 41 3HD1 LEU 41 -9.639 -0.408 -3.075 278 HD21 LEU 41 3HD2 LEU 41 -8.022 -1.790 -4.698 279 HD22 LEU 41 1HD2 LEU 41 -6.860 -2.866 -3.921 280 HD23 LEU 41 2HD2 LEU 41 -6.508 -1.143 -4.063 281 H THR 42 H THR 42 -6.169 -4.677 -1.233 282 HA THR 42 HA THR 42 -4.543 -5.511 0.878 283 HB THR 42 HB THR 42 -3.492 -7.008 -0.637 284 HG1 THR 42 HG1 THR 42 -2.830 -6.028 -2.413 285 HG21 THR 42 3HG2 THR 42 -6.254 -6.767 -0.499 286 HG22 THR 42 1HG2 THR 42 -5.352 -8.176 -1.055 287 HG23 THR 42 2HG2 THR 42 -5.924 -6.981 -2.218 288 H ASP 43 H ASP 43 -4.121 -2.953 -1.366 289 HA ASP 43 HA ASP 43 -1.257 -2.818 -1.187 290 HB2 ASP 43 1HB ASP 43 -3.090 -0.582 -2.047 291 HB3 ASP 43 2HB ASP 43 -1.415 -0.859 -2.519 292 H GLY 44 H GLY 44 -3.890 -1.760 0.737 293 HA2 GLY 44 1HA GLY 44 -3.433 -1.084 3.013 294 HA3 GLY 44 2HA GLY 44 -2.003 -0.249 2.425 295 H GLN 45 H GLN 45 -4.489 0.255 0.275 296 HA GLN 45 HA GLN 45 -4.981 2.914 1.406 297 HB2 GLN 45 1HB GLN 45 -5.700 3.551 -0.839 298 HB3 GLN 45 2HB GLN 45 -4.094 2.834 -0.880 299 HG2 GLN 45 1HG GLN 45 -5.365 0.642 -1.422 300 HG3 GLN 45 2HG GLN 45 -6.685 1.725 -1.859 301 HE21 GLN 45 2HE2 GLN 45 -6.690 2.572 -3.828 302 HE22 GLN 45 1HE2 GLN 45 -5.369 2.535 -4.941 303 H LYS 46 H LYS 46 -6.967 3.604 1.987 304 HA LYS 46 HA LYS 46 -9.072 1.612 2.149 305 HB2 LYS 46 1HB LYS 46 -8.742 2.849 4.148 306 HB3 LYS 46 2HB LYS 46 -8.739 4.382 3.287 307 HG2 LYS 46 1HG LYS 46 -11.076 4.270 2.901 308 HG3 LYS 46 2HG LYS 46 -11.150 2.593 3.446 309 HD2 LYS 46 1HD LYS 46 -11.841 3.562 5.372 310 HD3 LYS 46 2HD LYS 46 -10.105 3.730 5.641 311 HE2 LYS 46 1HE LYS 46 -10.144 5.992 4.839 312 HE3 LYS 46 2HE LYS 46 -11.828 5.836 4.344 313 HZ1 LYS 46 3HZ LYS 46 -11.908 5.189 6.966 314 HZ2 LYS 46 1HZ LYS 46 -12.271 6.714 6.331 315 HZ3 LYS 46 2HZ LYS 46 -10.725 6.398 6.940 316 H PHE 47 H PHE 47 -10.876 1.561 0.948 317 HA PHE 47 HA PHE 47 -11.438 3.856 -0.808 318 HB2 PHE 47 1HB PHE 47 -11.926 2.422 -2.643 319 HB3 PHE 47 2HB PHE 47 -10.383 1.877 -1.993 320 HD1 PHE 47 HD1 PHE 47 -10.573 -0.025 -0.177 321 HD2 PHE 47 HD2 PHE 47 -13.538 0.855 -3.101 322 HE1 PHE 47 HE1 PHE 47 -11.475 -2.302 0.057 323 HE2 PHE 47 HE2 PHE 47 -14.446 -1.420 -2.870 324 HZ PHE 47 HZ PHE 47 -13.415 -3.002 -1.289 325 H ASP 48 H ASP 48 -12.532 2.771 1.817 326 HA ASP 48 HA ASP 48 -15.219 3.464 1.415 327 HB2 ASP 48 1HB ASP 48 -14.892 1.002 0.416 328 HB3 ASP 48 2HB ASP 48 -15.149 0.573 2.105 329 H SER 49 H SER 49 -15.929 4.196 3.307 330 HA SER 49 HA SER 49 -14.964 2.934 5.777 331 HB2 SER 49 1HB SER 49 -14.422 5.019 6.788 332 HB3 SER 49 2HB SER 49 -13.664 5.045 5.196 333 HG SER 49 HG SER 49 -15.315 6.359 4.459 334 H SER 50 H SER 50 -16.441 2.784 7.396 335 HA SER 50 HA SER 50 -19.181 3.050 6.748 336 HB2 SER 50 1HB SER 50 -19.422 2.630 9.309 337 HB3 SER 50 2HB SER 50 -18.745 1.357 8.295 338 HG SER 50 HG SER 50 -17.135 1.454 9.641 339 H LYS 51 H LYS 51 -16.907 5.292 7.849 340 HA LYS 51 HA LYS 51 -18.380 6.949 9.537 341 HB2 LYS 51 1HB LYS 51 -16.232 7.646 7.529 342 HB3 LYS 51 2HB LYS 51 -16.852 8.767 8.734 343 HG2 LYS 51 1HG LYS 51 -16.085 7.276 10.514 344 HG3 LYS 51 2HG LYS 51 -15.452 6.161 9.301 345 HD2 LYS 51 1HD LYS 51 -14.189 8.322 8.470 346 HD3 LYS 51 2HD LYS 51 -14.448 8.839 10.138 347 HE2 LYS 51 1HE LYS 51 -13.195 7.058 11.001 348 HE3 LYS 51 2HE LYS 51 -13.280 6.151 9.491 349 HZ1 LYS 51 3HZ LYS 51 -11.857 8.739 9.729 350 HZ2 LYS 51 1HZ LYS 51 -11.759 7.612 8.471 351 HZ3 LYS 51 2HZ LYS 51 -11.097 7.250 9.984 352 H ASP 52 H ASP 52 -18.644 6.424 6.140 353 HA ASP 52 HA ASP 52 -19.731 8.777 5.201 354 HB2 ASP 52 1HB ASP 52 -19.212 6.778 3.813 355 HB3 ASP 52 2HB ASP 52 -20.649 5.992 4.460 356 H ARG 53 H ARG 53 -21.309 6.190 7.011 357 HA ARG 53 HA ARG 53 -23.813 7.711 7.019 358 HB2 ARG 53 1HB ARG 53 -24.907 5.724 7.703 359 HB3 ARG 53 2HB ARG 53 -23.765 5.241 6.456 360 HG2 ARG 53 1HG ARG 53 -22.247 4.900 8.658 361 HG3 ARG 53 2HG ARG 53 -23.851 4.560 9.312 362 HD2 ARG 53 1HD ARG 53 -22.951 2.495 8.552 363 HD3 ARG 53 2HD ARG 53 -24.191 2.979 7.396 364 HE ARG 53 HE ARG 53 -21.521 3.799 6.686 365 HH11 ARG 53 1HH1 ARG 53 -23.919 1.284 6.473 366 HH12 ARG 53 2HH1 ARG 53 -23.242 0.580 5.041 367 HH21 ARG 53 1HH2 ARG 53 -20.621 2.882 4.802 368 HH22 ARG 53 2HH2 ARG 53 -21.365 1.489 4.093 369 H ASN 54 H ASN 54 -21.148 6.824 9.022 370 HA ASN 54 HA ASN 54 -20.566 7.379 11.149 371 HB2 ASN 54 1HB ASN 54 -21.492 9.632 10.288 372 HB3 ASN 54 2HB ASN 54 -22.912 9.260 11.260 373 HD21 ASN 54 2HD2 ASN 54 -19.384 9.087 11.637 374 HD22 ASN 54 1HD2 ASN 54 -19.345 9.846 13.189 375 H ASP 55 H ASP 55 -21.923 5.084 10.998 376 HA ASP 55 HA ASP 55 -23.188 4.935 13.575 377 HB2 ASP 55 1HB ASP 55 -25.234 5.411 12.638 378 HB3 ASP 55 2HB ASP 55 -24.782 4.765 11.063 379 HA PRO 56 HA PRO 56 -21.301 0.966 13.405 380 HB2 PRO 56 1HB PRO 56 -22.681 -0.265 15.393 381 HB3 PRO 56 2HB PRO 56 -21.446 0.962 15.698 382 HG2 PRO 56 1HG PRO 56 -24.426 1.246 15.641 383 HG3 PRO 56 2HG PRO 56 -23.259 1.931 16.787 384 HD2 PRO 56 1HD PRO 56 -24.329 3.373 14.760 385 HD3 PRO 56 2HD PRO 56 -22.683 3.652 15.366 386 H PHE 57 H PHE 57 -21.591 -0.938 12.364 387 HA PHE 57 HA PHE 57 -24.178 -1.410 11.133 388 HB2 PHE 57 1HB PHE 57 -21.893 -1.542 9.948 389 HB3 PHE 57 2HB PHE 57 -21.719 -3.103 10.745 390 HD1 PHE 57 HD1 PHE 57 -24.503 -1.348 8.977 391 HD2 PHE 57 HD2 PHE 57 -22.106 -4.849 9.319 392 HE1 PHE 57 HE1 PHE 57 -25.798 -2.407 7.173 393 HE2 PHE 57 HE2 PHE 57 -23.396 -5.913 7.515 394 HZ PHE 57 HZ PHE 57 -25.244 -4.692 6.439 395 H ALA 58 H ALA 58 -25.580 -2.349 12.514 396 HA ALA 58 HA ALA 58 -24.683 -4.625 14.126 397 HB1 ALA 58 1HB ALA 58 -27.349 -3.230 14.249 398 HB2 ALA 58 2HB ALA 58 -26.652 -4.334 15.435 399 HB3 ALA 58 3HB ALA 58 -25.940 -2.739 15.190 400 H PHE 59 H PHE 59 -25.397 -6.667 13.814 401 HA PHE 59 HA PHE 59 -27.728 -7.325 12.326 402 HB2 PHE 59 1HB PHE 59 -26.798 -8.216 10.336 403 HB3 PHE 59 2HB PHE 59 -26.074 -6.622 10.521 404 HD1 PHE 59 HD2 PHE 59 -23.756 -6.503 11.599 405 HD2 PHE 59 HD1 PHE 59 -25.461 -10.094 10.078 406 HE1 PHE 59 HE2 PHE 59 -21.513 -7.504 11.457 407 HE2 PHE 59 HE1 PHE 59 -23.221 -11.101 9.934 408 HZ PHE 59 HZ PHE 59 -21.243 -9.805 10.623 409 H VAL 60 H VAL 60 -27.776 -9.759 11.860 410 HA VAL 60 HA VAL 60 -26.737 -11.110 14.232 411 HB VAL 60 HB VAL 60 -29.139 -11.325 13.708 412 HG11 VAL 60 1HG1 VAL 60 -29.915 -12.549 11.801 413 HG12 VAL 60 2HG1 VAL 60 -28.855 -11.259 11.231 414 HG13 VAL 60 3HG1 VAL 60 -28.265 -12.920 11.305 415 HG21 VAL 60 3HG2 VAL 60 -27.639 -13.930 13.453 416 HG22 VAL 60 1HG2 VAL 60 -27.951 -13.077 14.965 417 HG23 VAL 60 2HG2 VAL 60 -29.295 -13.725 14.024 418 H LEU 61 H LEU 61 -25.191 -12.626 14.186 419 HA LEU 61 HA LEU 61 -23.617 -12.998 11.861 420 HB2 LEU 61 1HB LEU 61 -22.613 -13.103 14.040 421 HB3 LEU 61 2HB LEU 61 -23.657 -14.446 14.502 422 HG LEU 61 HG LEU 61 -22.499 -15.933 13.015 423 HD11 LEU 61 1HD1 LEU 61 -21.594 -15.147 11.151 424 HD12 LEU 61 2HD1 LEU 61 -20.282 -14.476 12.119 425 HD13 LEU 61 3HD1 LEU 61 -21.694 -13.489 11.743 426 HD21 LEU 61 3HD2 LEU 61 -20.716 -16.239 14.358 427 HD22 LEU 61 1HD2 LEU 61 -21.454 -14.940 15.295 428 HD23 LEU 61 2HD2 LEU 61 -20.149 -14.580 14.164 429 H GLY 62 H GLY 62 -23.407 -14.737 10.486 430 HA2 GLY 62 1HA GLY 62 -23.981 -16.673 9.380 431 HA3 GLY 62 2HA GLY 62 -24.772 -17.208 10.855 432 H GLY 63 H GLY 63 -25.856 -14.174 9.803 433 HA2 GLY 63 1HA GLY 63 -28.498 -15.058 9.395 434 HA3 GLY 63 2HA GLY 63 -27.874 -13.472 8.966 435 H GLY 64 H GLY 64 -25.808 -14.771 7.212 436 HA2 GLY 64 1HA GLY 64 -25.653 -15.741 5.094 437 HA3 GLY 64 2HA GLY 64 -27.388 -16.019 5.121 438 H MET 65 H MET 65 -25.418 -13.067 5.428 439 HA MET 65 HA MET 65 -26.550 -12.069 2.930 440 HB2 MET 65 1HB MET 65 -26.864 -10.708 5.606 441 HB3 MET 65 2HB MET 65 -27.076 -9.874 4.072 442 HG2 MET 65 1HG MET 65 -29.002 -11.041 3.552 443 HG3 MET 65 2HG MET 65 -28.621 -12.359 4.658 444 HE1 MET 65 3HE MET 65 -31.280 -12.036 5.040 445 HE2 MET 65 1HE MET 65 -31.972 -10.729 6.002 446 HE3 MET 65 2HE MET 65 -31.490 -10.433 4.332 447 H VAL 66 H VAL 66 -23.885 -12.875 4.128 448 HA VAL 66 HA VAL 66 -22.422 -10.531 3.167 449 HB VAL 66 HB VAL 66 -20.846 -10.554 4.984 450 HG11 VAL 66 1HG1 VAL 66 -22.266 -9.806 6.826 451 HG12 VAL 66 2HG1 VAL 66 -22.852 -9.190 5.279 452 HG13 VAL 66 3HG1 VAL 66 -23.667 -10.549 6.055 453 HG21 VAL 66 3HG2 VAL 66 -20.639 -12.774 5.651 454 HG22 VAL 66 1HG2 VAL 66 -21.452 -12.017 7.021 455 HG23 VAL 66 2HG2 VAL 66 -22.378 -12.974 5.866 456 H ILE 67 H ILE 67 -20.346 -10.987 2.345 457 HA ILE 67 HA ILE 67 -20.069 -13.381 0.960 458 HB ILE 67 HB ILE 67 -17.626 -12.707 0.732 459 HG12 ILE 67 1HG1 ILE 67 -18.470 -10.094 1.942 460 HG13 ILE 67 2HG1 ILE 67 -17.833 -11.372 2.971 461 HG21 ILE 67 1HG2 ILE 67 -20.029 -11.382 -0.230 462 HG22 ILE 67 2HG2 ILE 67 -18.604 -10.347 -0.298 463 HG23 ILE 67 3HG2 ILE 67 -18.598 -11.911 -1.113 464 HD11 ILE 67 3HD1 ILE 67 -16.124 -11.031 0.708 465 HD12 ILE 67 1HD1 ILE 67 -16.404 -9.473 1.486 466 HD13 ILE 67 2HD1 ILE 67 -15.765 -10.825 2.423 467 H LYS 68 H LYS 68 -18.512 -15.090 1.181 468 HA LYS 68 HA LYS 68 -18.555 -16.459 3.546 469 HB2 LYS 68 1HB LYS 68 -16.320 -16.540 1.510 470 HB3 LYS 68 2HB LYS 68 -16.685 -17.790 2.693 471 HG2 LYS 68 1HG LYS 68 -18.851 -16.984 0.837 472 HG3 LYS 68 2HG LYS 68 -17.512 -17.930 0.182 473 HD2 LYS 68 1HD LYS 68 -17.916 -19.485 2.200 474 HD3 LYS 68 2HD LYS 68 -19.477 -18.671 2.325 475 HE2 LYS 68 1HE LYS 68 -20.031 -19.323 0.058 476 HE3 LYS 68 2HE LYS 68 -18.439 -20.052 -0.148 477 HZ1 LYS 68 3HZ LYS 68 -20.686 -20.983 1.526 478 HZ2 LYS 68 1HZ LYS 68 -19.102 -21.489 1.836 479 HZ3 LYS 68 2HZ LYS 68 -19.823 -21.832 0.345 480 H GLY 69 H GLY 69 -15.875 -14.410 2.387 481 HA2 GLY 69 1HA GLY 69 -14.154 -14.688 4.533 482 HA3 GLY 69 2HA GLY 69 -14.276 -13.238 3.547 483 H TRP 70 H TRP 70 -16.943 -12.540 4.227 484 HA TRP 70 HA TRP 70 -16.472 -11.062 6.586 485 HB2 TRP 70 1HB TRP 70 -18.754 -11.461 4.730 486 HB3 TRP 70 2HB TRP 70 -19.145 -10.872 6.343 487 HD1 TRP 70 HD1 TRP 70 -16.113 -9.873 4.144 488 HE1 TRP 70 HE1 TRP 70 -16.178 -7.320 3.820 489 HE3 TRP 70 HE3 TRP 70 -20.514 -8.861 6.541 490 HZ2 TRP 70 HZ2 TRP 70 -17.870 -5.163 4.492 491 HZ3 TRP 70 HZ3 TRP 70 -21.284 -6.527 6.656 492 HH2 TRP 70 HH2 TRP 70 -19.988 -4.718 5.653 493 H ASP 71 H ASP 71 -18.716 -13.765 5.966 494 HA ASP 71 HA ASP 71 -19.691 -14.073 8.539 495 HB2 ASP 71 1HB ASP 71 -19.478 -15.781 6.143 496 HB3 ASP 71 2HB ASP 71 -19.654 -16.649 7.665 497 H GLU 72 H GLU 72 -16.842 -15.596 7.060 498 HA GLU 72 HA GLU 72 -16.086 -17.177 9.234 499 HB2 GLU 72 1HB GLU 72 -14.996 -16.446 6.707 500 HB3 GLU 72 2HB GLU 72 -13.741 -16.227 7.917 501 HG2 GLU 72 1HG GLU 72 -15.328 -18.749 7.501 502 HG3 GLU 72 2HG GLU 72 -13.696 -18.457 6.903 503 H GLY 73 H GLY 73 -15.278 -13.821 8.442 504 HA2 GLY 73 1HA GLY 73 -13.491 -13.481 10.646 505 HA3 GLY 73 2HA GLY 73 -14.170 -12.202 9.650 506 H VAL 74 H VAL 74 -16.925 -12.886 10.146 507 HA VAL 74 HA VAL 74 -17.303 -11.420 12.562 508 HB VAL 74 HB VAL 74 -19.341 -12.909 10.900 509 HG11 VAL 74 1HG1 VAL 74 -20.134 -12.451 13.162 510 HG12 VAL 74 2HG1 VAL 74 -19.705 -10.749 12.975 511 HG13 VAL 74 3HG1 VAL 74 -20.981 -11.453 11.981 512 HG21 VAL 74 3HG2 VAL 74 -19.267 -9.991 10.759 513 HG22 VAL 74 1HG2 VAL 74 -17.819 -10.771 10.124 514 HG23 VAL 74 2HG2 VAL 74 -19.403 -11.186 9.469 515 H GLN 75 H GLN 75 -17.147 -14.780 11.765 516 HA GLN 75 HA GLN 75 -18.474 -15.659 14.179 517 HB2 GLN 75 1HB GLN 75 -16.964 -17.164 12.039 518 HB3 GLN 75 2HB GLN 75 -17.750 -17.932 13.411 519 HG2 GLN 75 1HG GLN 75 -19.871 -17.465 12.631 520 HG3 GLN 75 2HG GLN 75 -19.314 -16.141 11.608 521 HE21 GLN 75 2HE2 GLN 75 -18.171 -19.476 11.907 522 HE22 GLN 75 1HE2 GLN 75 -18.440 -19.902 10.254 523 H GLY 76 H GLY 76 -15.622 -14.226 13.730 524 HA2 GLY 76 1HA GLY 76 -14.329 -15.808 15.865 525 HA3 GLY 76 2HA GLY 76 -13.415 -15.127 14.527 526 H MET 77 H MET 77 -15.016 -12.647 14.539 527 HA MET 77 HA MET 77 -13.398 -11.014 16.047 528 HB2 MET 77 1HB MET 77 -15.217 -9.312 15.860 529 HB3 MET 77 2HB MET 77 -14.803 -10.085 14.336 530 HG2 MET 77 1HG MET 77 -16.753 -11.486 14.460 531 HG3 MET 77 2HG MET 77 -17.137 -10.866 16.064 532 HE1 MET 77 3HE MET 77 -19.981 -8.855 14.751 533 HE2 MET 77 1HE MET 77 -19.570 -10.536 15.089 534 HE3 MET 77 2HE MET 77 -19.132 -9.274 16.240 535 H LYS 78 H LYS 78 -13.540 -10.021 18.057 536 HA LYS 78 HA LYS 78 -15.459 -11.238 19.936 537 HB2 LYS 78 1HB LYS 78 -12.608 -10.398 20.495 538 HB3 LYS 78 2HB LYS 78 -13.733 -11.049 21.680 539 HG2 LYS 78 1HG LYS 78 -13.805 -13.161 20.489 540 HG3 LYS 78 2HG LYS 78 -12.733 -12.513 19.245 541 HD2 LYS 78 1HD LYS 78 -10.947 -12.269 20.852 542 HD3 LYS 78 2HD LYS 78 -12.017 -12.765 22.166 543 HE2 LYS 78 1HE LYS 78 -12.324 -14.919 20.741 544 HE3 LYS 78 2HE LYS 78 -10.829 -14.404 19.962 545 HZ1 LYS 78 3HZ LYS 78 -9.817 -15.454 21.625 546 HZ2 LYS 78 1HZ LYS 78 -11.228 -15.565 22.552 547 HZ3 LYS 78 2HZ LYS 78 -10.286 -14.162 22.612 548 H VAL 79 H VAL 79 -16.246 -9.923 21.623 549 HA VAL 79 HA VAL 79 -16.925 -7.321 20.957 550 HB VAL 79 HB VAL 79 -16.777 -8.580 23.698 551 HG11 VAL 79 1HG1 VAL 79 -18.719 -6.622 23.768 552 HG12 VAL 79 2HG1 VAL 79 -17.108 -6.517 24.483 553 HG13 VAL 79 3HG1 VAL 79 -17.403 -5.865 22.870 554 HG21 VAL 79 3HG2 VAL 79 -18.924 -9.320 23.394 555 HG22 VAL 79 1HG2 VAL 79 -19.307 -8.062 22.218 556 HG23 VAL 79 2HG2 VAL 79 -18.317 -9.442 21.743 557 H GLY 80 H GLY 80 -15.810 -5.487 20.898 558 HA2 GLY 80 1HA GLY 80 -14.383 -3.809 21.656 559 HA3 GLY 80 2HA GLY 80 -13.820 -4.894 22.918 560 H GLY 81 H GLY 81 -13.684 -6.627 20.133 561 HA2 GLY 81 1HA GLY 81 -10.806 -6.150 19.909 562 HA3 GLY 81 2HA GLY 81 -11.679 -7.538 19.278 563 H VAL 82 H VAL 82 -9.809 -5.333 18.163 564 HA VAL 82 HA VAL 82 -11.417 -4.860 15.743 565 HB VAL 82 HB VAL 82 -9.515 -2.885 17.012 566 HG11 VAL 82 1HG1 VAL 82 -10.754 -3.057 14.327 567 HG12 VAL 82 2HG1 VAL 82 -10.702 -1.468 15.094 568 HG13 VAL 82 3HG1 VAL 82 -9.208 -2.367 14.821 569 HG21 VAL 82 3HG2 VAL 82 -12.460 -3.190 17.008 570 HG22 VAL 82 1HG2 VAL 82 -11.390 -2.512 18.236 571 HG23 VAL 82 2HG2 VAL 82 -11.823 -1.556 16.819 572 H ARG 83 H ARG 83 -10.522 -5.854 14.072 573 HA ARG 83 HA ARG 83 -7.663 -5.671 13.617 574 HB2 ARG 83 1HB ARG 83 -7.338 -8.070 13.354 575 HB3 ARG 83 2HB ARG 83 -7.885 -7.705 14.985 576 HG2 ARG 83 1HG ARG 83 -9.956 -8.656 14.650 577 HG3 ARG 83 2HG ARG 83 -9.876 -8.464 12.898 578 HD2 ARG 83 1HD ARG 83 -9.624 -10.823 13.784 579 HD3 ARG 83 2HD ARG 83 -8.378 -10.269 12.667 580 HE ARG 83 HE ARG 83 -6.840 -10.464 14.348 581 HH11 ARG 83 1HH1 ARG 83 -10.036 -10.474 15.727 582 HH12 ARG 83 2HH1 ARG 83 -9.488 -10.864 17.324 583 HH21 ARG 83 1HH2 ARG 83 -6.105 -10.977 16.446 584 HH22 ARG 83 2HH2 ARG 83 -7.252 -11.149 17.732 585 H ARG 84 H ARG 84 -7.063 -6.047 11.459 586 HA ARG 84 HA ARG 84 -9.313 -5.926 9.583 587 HB2 ARG 84 1HB ARG 84 -7.785 -4.928 8.014 588 HB3 ARG 84 2HB ARG 84 -7.622 -4.097 9.555 589 HG2 ARG 84 1HG ARG 84 -5.622 -5.494 10.028 590 HG3 ARG 84 2HG ARG 84 -5.756 -6.152 8.397 591 HD2 ARG 84 1HD ARG 84 -5.711 -3.702 7.626 592 HD3 ARG 84 2HD ARG 84 -5.121 -3.347 9.249 593 HE ARG 84 HE ARG 84 -3.547 -5.394 8.202 594 HH11 ARG 84 1HH1 ARG 84 -4.235 -2.038 7.585 595 HH12 ARG 84 2HH1 ARG 84 -2.674 -1.707 6.912 596 HH21 ARG 84 1HH2 ARG 84 -1.488 -4.971 7.317 597 HH22 ARG 84 2HH2 ARG 84 -1.112 -3.376 6.759 598 H LEU 85 H LEU 85 -9.734 -7.533 8.207 599 HA LEU 85 HA LEU 85 -7.728 -9.674 7.926 600 HB2 LEU 85 1HB LEU 85 -10.699 -10.040 7.663 601 HB3 LEU 85 2HB LEU 85 -9.459 -11.283 7.817 602 HG LEU 85 HG LEU 85 -9.081 -10.125 10.161 603 HD11 LEU 85 1HD1 LEU 85 -12.007 -9.773 10.134 604 HD12 LEU 85 2HD1 LEU 85 -11.068 -8.522 9.320 605 HD13 LEU 85 3HD1 LEU 85 -10.761 -8.891 11.017 606 HD21 LEU 85 3HD2 LEU 85 -10.033 -12.474 9.396 607 HD22 LEU 85 1HD2 LEU 85 -11.532 -11.798 10.032 608 HD23 LEU 85 2HD2 LEU 85 -10.117 -11.939 11.075 609 H THR 86 H THR 86 -7.210 -10.363 5.917 610 HA THR 86 HA THR 86 -8.209 -8.789 3.684 611 HB THR 86 HB THR 86 -6.097 -10.940 3.563 612 HG1 THR 86 HG1 THR 86 -4.599 -9.334 4.024 613 HG21 THR 86 3HG2 THR 86 -7.280 -9.149 1.661 614 HG22 THR 86 1HG2 THR 86 -6.070 -10.405 1.400 615 HG23 THR 86 2HG2 THR 86 -5.567 -8.773 1.843 616 H ILE 87 H ILE 87 -10.010 -9.467 2.722 617 HA ILE 87 HA ILE 87 -10.577 -12.334 2.567 618 HB ILE 87 HB ILE 87 -12.338 -9.961 1.945 619 HG12 ILE 87 1HG1 ILE 87 -12.924 -11.892 4.130 620 HG13 ILE 87 2HG1 ILE 87 -11.610 -10.752 4.397 621 HG21 ILE 87 1HG2 ILE 87 -12.730 -12.900 1.642 622 HG22 ILE 87 2HG2 ILE 87 -14.103 -11.889 2.085 623 HG23 ILE 87 3HG2 ILE 87 -13.232 -11.582 0.583 624 HD11 ILE 87 3HD1 ILE 87 -14.116 -10.224 5.065 625 HD12 ILE 87 1HD1 ILE 87 -13.000 -8.971 4.522 626 HD13 ILE 87 2HD1 ILE 87 -14.169 -9.661 3.395 627 HA PRO 88 HA PRO 88 -9.022 -12.116 -1.638 628 HB2 PRO 88 1HB PRO 88 -9.176 -14.790 -2.081 629 HB3 PRO 88 2HB PRO 88 -7.861 -14.042 -1.167 630 HG2 PRO 88 1HG PRO 88 -10.315 -15.432 -0.163 631 HG3 PRO 88 2HG PRO 88 -8.642 -15.558 0.414 632 HD2 PRO 88 1HD PRO 88 -10.503 -14.040 1.664 633 HD3 PRO 88 2HD PRO 88 -8.782 -13.607 1.632 634 HA PRO 89 HA PRO 89 -12.593 -12.357 -4.192 635 HB2 PRO 89 1HB PRO 89 -11.666 -13.513 -6.466 636 HB3 PRO 89 2HB PRO 89 -11.253 -11.862 -5.991 637 HG2 PRO 89 1HG PRO 89 -9.665 -14.379 -5.668 638 HG3 PRO 89 2HG PRO 89 -9.122 -12.772 -6.186 639 HD2 PRO 89 1HD PRO 89 -8.753 -13.691 -3.666 640 HD3 PRO 89 2HD PRO 89 -9.016 -11.973 -4.027 641 H GLN 90 H GLN 90 -10.775 -15.381 -3.946 642 HA GLN 90 HA GLN 90 -12.824 -17.073 -4.915 643 HB2 GLN 90 1HB GLN 90 -11.508 -18.872 -3.706 644 HB3 GLN 90 2HB GLN 90 -10.624 -17.946 -4.912 645 HG2 GLN 90 1HG GLN 90 -9.227 -17.058 -3.399 646 HG3 GLN 90 2HG GLN 90 -10.490 -16.878 -2.182 647 HE21 GLN 90 2HE2 GLN 90 -7.782 -17.861 -1.871 648 HE22 GLN 90 1HE2 GLN 90 -7.913 -19.465 -1.243 649 H LEU 91 H LEU 91 -12.574 -15.313 -2.062 650 HA LEU 91 HA LEU 91 -14.610 -17.011 -0.777 651 HB2 LEU 91 1HB LEU 91 -12.218 -15.648 0.354 652 HB3 LEU 91 2HB LEU 91 -13.661 -15.789 1.355 653 HG LEU 91 HG LEU 91 -12.143 -17.577 1.883 654 HD11 LEU 91 1HD1 LEU 91 -13.608 -19.412 1.694 655 HD12 LEU 91 2HD1 LEU 91 -14.325 -18.789 0.209 656 HD13 LEU 91 3HD1 LEU 91 -14.638 -17.982 1.745 657 HD21 LEU 91 3HD2 LEU 91 -11.007 -17.518 -0.374 658 HD22 LEU 91 1HD2 LEU 91 -12.335 -18.514 -0.969 659 HD23 LEU 91 2HD2 LEU 91 -11.284 -19.120 0.311 660 H GLY 92 H GLY 92 -14.283 -14.292 -2.440 661 HA2 GLY 92 1HA GLY 92 -16.493 -13.001 -1.003 662 HA3 GLY 92 2HA GLY 92 -15.073 -12.042 -1.391 663 H TYR 93 H TYR 93 -15.035 -11.018 -3.287 664 HA TYR 93 HA TYR 93 -17.223 -10.819 -4.952 665 HB2 TYR 93 1HB TYR 93 -14.329 -10.154 -5.260 666 HB3 TYR 93 2HB TYR 93 -15.363 -10.069 -6.681 667 HD1 TYR 93 HD2 TYR 93 -16.432 -9.271 -3.233 668 HD2 TYR 93 HD1 TYR 93 -15.294 -7.720 -7.028 669 HE1 TYR 93 HE2 TYR 93 -17.192 -7.036 -2.541 670 HE2 TYR 93 HE1 TYR 93 -16.049 -5.481 -6.346 671 HH TYR 93 HH TYR 93 -17.824 -4.957 -3.405 672 H GLY 94 H GLY 94 -14.173 -12.409 -5.913 673 HA2 GLY 94 1HA GLY 94 -14.235 -14.724 -6.706 674 HA3 GLY 94 2HA GLY 94 -15.801 -14.362 -7.418 675 H ALA 95 H ALA 95 -14.589 -15.368 -9.290 676 HA ALA 95 HA ALA 95 -12.662 -13.649 -10.601 677 HB1 ALA 95 1HB ALA 95 -13.308 -16.391 -10.703 678 HB2 ALA 95 2HB ALA 95 -13.606 -15.732 -12.312 679 HB3 ALA 95 3HB ALA 95 -12.021 -15.543 -11.561 680 H ARG 96 H ARG 96 -15.850 -13.375 -10.233 681 HA ARG 96 HA ARG 96 -16.746 -12.968 -12.915 682 HB2 ARG 96 1HB ARG 96 -17.857 -12.508 -10.189 683 HB3 ARG 96 2HB ARG 96 -18.578 -11.623 -11.527 684 HG2 ARG 96 1HG ARG 96 -19.025 -13.734 -12.680 685 HG3 ARG 96 2HG ARG 96 -18.315 -14.615 -11.326 686 HD2 ARG 96 1HD ARG 96 -20.731 -14.614 -11.145 687 HD3 ARG 96 2HD ARG 96 -20.024 -13.669 -9.835 688 HE ARG 96 HE ARG 96 -20.675 -11.993 -12.018 689 HH11 ARG 96 1HH1 ARG 96 -22.133 -13.796 -9.421 690 HH12 ARG 96 2HH1 ARG 96 -23.516 -12.759 -9.303 691 HH21 ARG 96 1HH2 ARG 96 -22.491 -10.620 -11.872 692 HH22 ARG 96 2HH2 ARG 96 -23.719 -10.953 -10.698 693 H GLY 97 H GLY 97 -15.115 -11.031 -10.554 694 HA2 GLY 97 1HA GLY 97 -14.067 -8.987 -10.852 695 HA3 GLY 97 2HA GLY 97 -14.721 -8.928 -12.482 696 H ALA 98 H ALA 98 -14.777 -6.592 -11.436 697 HA ALA 98 HA ALA 98 -17.582 -6.094 -10.896 698 HB1 ALA 98 1HB ALA 98 -15.633 -6.079 -8.789 699 HB2 ALA 98 2HB ALA 98 -16.301 -4.462 -9.011 700 HB3 ALA 98 3HB ALA 98 -17.377 -5.825 -8.702 701 H GLY 99 H GLY 99 -14.336 -4.644 -11.096 702 HA2 GLY 99 1HA GLY 99 -15.535 -2.476 -12.710 703 HA3 GLY 99 2HA GLY 99 -14.259 -2.179 -11.538 704 H GLY 100 H GLY 100 -12.989 -1.250 -13.221 705 HA2 GLY 100 1HA GLY 100 -12.136 -3.005 -15.387 706 HA3 GLY 100 2HA GLY 100 -11.710 -1.311 -15.188 707 H VAL 101 H VAL 101 -10.668 -1.304 -12.635 708 HA VAL 101 HA VAL 101 -8.115 -2.600 -13.114 709 HB VAL 101 HB VAL 101 -7.361 -1.350 -11.107 710 HG11 VAL 101 1HG1 VAL 101 -8.776 0.572 -12.917 711 HG12 VAL 101 2HG1 VAL 101 -7.168 0.693 -12.199 712 HG13 VAL 101 3HG1 VAL 101 -7.462 -0.439 -13.520 713 HG21 VAL 101 3HG2 VAL 101 -8.736 -0.199 -9.734 714 HG22 VAL 101 1HG2 VAL 101 -9.805 0.295 -11.046 715 HG23 VAL 101 2HG2 VAL 101 -9.950 -1.319 -10.351 716 H ILE 102 H ILE 102 -10.845 -3.768 -11.959 717 HA ILE 102 HA ILE 102 -9.615 -5.197 -9.699 718 HB ILE 102 HB ILE 102 -12.543 -4.899 -10.381 719 HG12 ILE 102 1HG1 ILE 102 -10.878 -3.655 -8.182 720 HG13 ILE 102 2HG1 ILE 102 -11.549 -2.811 -9.573 721 HG21 ILE 102 1HG2 ILE 102 -12.068 -5.750 -7.706 722 HG22 ILE 102 2HG2 ILE 102 -12.943 -6.581 -8.992 723 HG23 ILE 102 3HG2 ILE 102 -11.207 -6.828 -8.804 724 HD11 ILE 102 3HD1 ILE 102 -13.422 -2.439 -8.469 725 HD12 ILE 102 1HD1 ILE 102 -13.652 -4.170 -8.218 726 HD13 ILE 102 2HD1 ILE 102 -12.723 -3.225 -7.054 727 HA PRO 103 HA PRO 103 -9.595 -8.433 -12.908 728 HB2 PRO 103 1HB PRO 103 -7.582 -9.845 -11.756 729 HB3 PRO 103 2HB PRO 103 -7.300 -8.447 -12.801 730 HG2 PRO 103 1HG PRO 103 -7.310 -8.607 -9.811 731 HG3 PRO 103 2HG PRO 103 -6.185 -7.751 -10.882 732 HD2 PRO 103 1HD PRO 103 -8.198 -6.493 -9.580 733 HD3 PRO 103 2HD PRO 103 -7.619 -5.971 -11.175 734 HA PRO 104 HA PRO 104 -11.876 -11.603 -10.887 735 HB2 PRO 104 1HB PRO 104 -10.960 -13.861 -12.084 736 HB3 PRO 104 2HB PRO 104 -11.995 -12.689 -12.908 737 HG2 PRO 104 1HG PRO 104 -9.023 -13.023 -13.052 738 HG3 PRO 104 2HG PRO 104 -10.180 -12.720 -14.362 739 HD2 PRO 104 1HD PRO 104 -8.657 -10.759 -13.280 740 HD3 PRO 104 2HD PRO 104 -10.289 -10.462 -13.912 741 H ASN 105 H ASN 105 -8.489 -11.469 -10.570 742 HA ASN 105 HA ASN 105 -8.562 -13.464 -8.402 743 HB2 ASN 105 1HB ASN 105 -6.972 -13.622 -10.567 744 HB3 ASN 105 2HB ASN 105 -5.943 -12.639 -9.529 745 HD21 ASN 105 2HD2 ASN 105 -6.511 -13.654 -7.059 746 HD22 ASN 105 1HD2 ASN 105 -5.986 -15.298 -6.969 747 H ALA 106 H ALA 106 -8.995 -10.397 -8.626 748 HA ALA 106 HA ALA 106 -6.902 -9.257 -7.041 749 HB1 ALA 106 1HB ALA 106 -9.415 -7.804 -6.976 750 HB2 ALA 106 2HB ALA 106 -7.840 -7.315 -7.603 751 HB3 ALA 106 3HB ALA 106 -8.939 -8.253 -8.614 752 H THR 107 H THR 107 -6.904 -8.732 -4.874 753 HA THR 107 HA THR 107 -8.911 -10.143 -3.248 754 HB THR 107 HB THR 107 -6.096 -9.308 -2.522 755 HG1 THR 107 HG1 THR 107 -5.573 -11.275 -3.109 756 HG21 THR 107 3HG2 THR 107 -6.744 -10.967 -0.561 757 HG22 THR 107 1HG2 THR 107 -8.366 -10.377 -0.921 758 HG23 THR 107 2HG2 THR 107 -7.096 -9.242 -0.463 759 H LEU 108 H LEU 108 -9.854 -9.130 -1.468 760 HA LEU 108 HA LEU 108 -9.478 -6.212 -1.320 761 HB2 LEU 108 1HB LEU 108 -12.063 -7.739 -1.045 762 HB3 LEU 108 2HB LEU 108 -11.871 -6.000 -0.831 763 HG LEU 108 HG LEU 108 -11.150 -7.274 -3.441 764 HD11 LEU 108 1HD1 LEU 108 -13.263 -7.592 -4.114 765 HD12 LEU 108 2HD1 LEU 108 -13.860 -6.177 -3.249 766 HD13 LEU 108 3HD1 LEU 108 -13.621 -7.698 -2.391 767 HD21 LEU 108 3HD2 LEU 108 -11.991 -4.552 -2.491 768 HD22 LEU 108 1HD2 LEU 108 -12.036 -5.002 -4.196 769 HD23 LEU 108 2HD2 LEU 108 -10.506 -5.024 -3.319 770 H VAL 109 H VAL 109 -9.297 -5.328 0.673 771 HA VAL 109 HA VAL 109 -9.304 -7.193 2.944 772 HB VAL 109 HB VAL 109 -8.102 -4.439 2.993 773 HG11 VAL 109 1HG1 VAL 109 -6.619 -6.327 4.462 774 HG12 VAL 109 2HG1 VAL 109 -7.637 -5.026 5.084 775 HG13 VAL 109 3HG1 VAL 109 -8.319 -6.631 4.820 776 HG21 VAL 109 3HG2 VAL 109 -7.119 -5.534 1.071 777 HG22 VAL 109 1HG2 VAL 109 -5.943 -5.468 2.383 778 HG23 VAL 109 2HG2 VAL 109 -6.784 -6.977 2.029 779 H PHE 110 H PHE 110 -10.263 -6.609 4.923 780 HA PHE 110 HA PHE 110 -11.960 -4.237 4.969 781 HB2 PHE 110 1HB PHE 110 -12.968 -7.070 5.144 782 HB3 PHE 110 2HB PHE 110 -13.862 -5.727 5.849 783 HD1 PHE 110 HD2 PHE 110 -12.738 -7.293 2.740 784 HD2 PHE 110 HD1 PHE 110 -14.971 -4.105 4.460 785 HE1 PHE 110 HE2 PHE 110 -13.766 -6.838 0.552 786 HE2 PHE 110 HE1 PHE 110 -16.004 -3.644 2.275 787 HZ PHE 110 HZ PHE 110 -15.401 -5.011 0.317 788 H GLU 111 H GLU 111 -12.200 -3.375 6.969 789 HA GLU 111 HA GLU 111 -10.741 -4.687 9.137 790 HB2 GLU 111 1HB GLU 111 -10.261 -2.298 8.461 791 HB3 GLU 111 2HB GLU 111 -11.846 -1.879 9.096 792 HG2 GLU 111 1HG GLU 111 -10.762 -3.239 11.188 793 HG3 GLU 111 2HG GLU 111 -9.344 -2.452 10.496 794 H VAL 112 H VAL 112 -11.780 -5.720 10.699 795 HA VAL 112 HA VAL 112 -14.640 -5.144 11.107 796 HB VAL 112 HB VAL 112 -13.248 -7.650 12.019 797 HG11 VAL 112 1HG1 VAL 112 -15.344 -8.499 12.400 798 HG12 VAL 112 2HG1 VAL 112 -15.623 -6.792 12.752 799 HG13 VAL 112 3HG1 VAL 112 -16.103 -7.462 11.193 800 HG21 VAL 112 3HG2 VAL 112 -12.857 -7.496 9.633 801 HG22 VAL 112 1HG2 VAL 112 -14.069 -8.734 9.963 802 HG23 VAL 112 2HG2 VAL 112 -14.564 -7.157 9.349 803 H GLU 113 H GLU 113 -15.221 -4.210 12.949 804 HA GLU 113 HA GLU 113 -13.541 -4.586 15.329 805 HB2 GLU 113 1HB GLU 113 -14.314 -2.081 15.784 806 HB3 GLU 113 2HB GLU 113 -12.841 -2.457 14.900 807 HG2 GLU 113 1HG GLU 113 -13.838 -1.987 12.826 808 HG3 GLU 113 2HG GLU 113 -15.461 -2.002 13.513 809 H LEU 114 H LEU 114 -14.748 -5.540 16.818 810 HA LEU 114 HA LEU 114 -17.634 -5.300 16.772 811 HB2 LEU 114 1HB LEU 114 -16.158 -7.397 17.285 812 HB3 LEU 114 2HB LEU 114 -16.124 -6.728 18.915 813 HG LEU 114 HG LEU 114 -18.611 -7.508 17.393 814 HD11 LEU 114 1HD1 LEU 114 -18.528 -9.538 18.335 815 HD12 LEU 114 2HD1 LEU 114 -17.903 -8.916 19.862 816 HD13 LEU 114 3HD1 LEU 114 -16.805 -9.205 18.513 817 HD21 LEU 114 3HD2 LEU 114 -19.369 -7.333 19.958 818 HD22 LEU 114 1HD2 LEU 114 -19.486 -5.989 18.822 819 HD23 LEU 114 2HD2 LEU 114 -18.122 -6.085 19.936 820 H LEU 115 H LEU 115 -18.768 -3.896 17.932 821 HA LEU 115 HA LEU 115 -17.402 -2.342 19.998 822 HB2 LEU 115 1HB LEU 115 -20.187 -1.816 19.045 823 HB3 LEU 115 2HB LEU 115 -19.001 -0.686 19.695 824 HG LEU 115 HG LEU 115 -19.043 -1.908 16.939 825 HD11 LEU 115 1HD1 LEU 115 -20.496 0.139 17.694 826 HD12 LEU 115 2HD1 LEU 115 -19.644 0.158 16.150 827 HD13 LEU 115 3HD1 LEU 115 -18.969 1.009 17.539 828 HD21 LEU 115 3HD2 LEU 115 -16.783 -1.832 17.268 829 HD22 LEU 115 1HD2 LEU 115 -16.886 -0.532 18.456 830 HD23 LEU 115 2HD2 LEU 115 -17.066 -0.173 16.739 831 H ASP 116 H ASP 116 -20.542 -3.974 19.551 832 HA ASP 116 HA ASP 116 -20.423 -4.996 22.255 833 HB2 ASP 116 1HB ASP 116 -21.414 -2.675 22.429 834 HB3 ASP 116 2HB ASP 116 -22.770 -3.264 21.471 835 H VAL 117 H VAL 117 -22.341 -6.405 22.729 836 HA VAL 117 HA VAL 117 -23.137 -7.797 20.264 837 HB VAL 117 HB VAL 117 -23.627 -9.731 21.772 838 HG11 VAL 117 1HG1 VAL 117 -21.631 -10.255 20.915 839 HG12 VAL 117 2HG1 VAL 117 -21.018 -8.613 21.117 840 HG13 VAL 117 3HG1 VAL 117 -20.967 -9.746 22.467 841 HG21 VAL 117 3HG2 VAL 117 -22.209 -8.069 23.853 842 HG22 VAL 117 1HG2 VAL 117 -23.940 -8.408 23.834 843 HG23 VAL 117 2HG2 VAL 117 -22.785 -9.725 24.040 844 H13 JZF 130 1H3 JZF 130 -17.247 -5.514 -0.368 845 H23 JZF 130 2H3 JZF 130 -17.523 -4.441 0.992 846 H4 JZF 130 H4 JZF 130 -19.247 -4.739 -1.494 847 H15 JZF 130 1H5 JZF 130 -20.675 -2.970 -0.624 848 H25 JZF 130 2H5 JZF 130 -19.699 -2.816 0.828 849 H17 JZF 130 1H7 JZF 130 -17.372 -2.482 -0.737 850 H27 JZF 130 2H7 JZF 130 -17.217 -3.605 -2.050 851 H8 JZF 130 H8 JZF 130 -19.638 -2.313 -2.491 852 H9 JZF 130 H9 JZF 130 -17.087 -2.489 -3.960 853 H1OH JZF 130 1HO JZF 130 -19.474 -0.334 -1.936 854 H11 JZF 130 H11 JZF 130 -17.519 -3.579 -6.270 855 H112 JZF 130 1H12 JZF 130 -19.410 -1.297 -7.032 856 H212 JZF 130 2H12 JZF 130 -18.002 -1.811 -7.948 857 H13A JZF 130 H13 JZF 130 -17.666 0.266 -6.554 858 H114 JZF 130 1H14 JZF 130 -17.408 0.037 -4.112 859 H214 JZF 130 2H14 JZF 130 -19.042 -0.229 -4.665 860 H115 JZF 130 1H15 JZF 130 -21.994 -6.379 2.145 861 H215 JZF 130 2H15 JZF 130 -20.527 -7.191 2.692 862 H116 JZF 130 1H16 JZF 130 -21.284 -7.283 -2.307 863 H216 JZF 130 2H16 JZF 130 -19.896 -7.506 -1.201 864 H117 JZF 130 2H17 JZF 130 -19.907 -9.692 -1.994 865 H217 JZF 130 3H17 JZF 130 -21.275 -9.909 -0.886 866 H317 JZF 130 1H17 JZF 130 -21.568 -9.559 -2.598 867 H118 JZF 130 1H18 JZF 130 -19.486 -5.023 -6.672 868 H218 JZF 130 2H18 JZF 130 -20.464 -3.614 -7.101 869 H318 JZF 130 3H18 JZF 130 -19.107 -4.097 -8.132 870 H119 JZF 130 3H19 JZF 130 -15.819 -2.098 -5.929 871 H219 JZF 130 1H19 JZF 130 -15.675 -0.919 -7.236 872 H319 JZF 130 2H19 JZF 130 -15.447 -0.410 -5.562 Start of MODEL 5 1 H1 GLY 1 H GLY 1 8.321 5.507 4.821 2 HA2 GLY 1 1HA GLY 1 10.075 3.888 4.704 3 HA3 GLY 1 2HA GLY 1 10.522 4.957 6.025 4 HA PRO 2 HA PRO 2 10.518 1.630 8.871 5 HB2 PRO 2 1HB PRO 2 9.387 2.710 11.090 6 HB3 PRO 2 2HB PRO 2 11.005 3.146 10.528 7 HG2 PRO 2 1HG PRO 2 8.413 4.594 10.146 8 HG3 PRO 2 2HG PRO 2 10.009 5.246 10.563 9 HD2 PRO 2 1HD PRO 2 9.003 5.349 8.051 10 HD3 PRO 2 2HD PRO 2 10.741 5.191 8.378 11 H GLY 3 H GLY 3 8.988 0.325 7.656 12 HA2 GLY 3 1HA GLY 3 6.497 -0.045 9.162 13 HA3 GLY 3 2HA GLY 3 6.391 0.176 7.422 14 H SER 4 H SER 4 5.990 -2.119 9.501 15 HA SER 4 HA SER 4 7.486 -4.150 7.977 16 HB2 SER 4 1HB SER 4 6.370 -4.716 10.698 17 HB3 SER 4 2HB SER 4 7.767 -5.430 9.892 18 HG SER 4 HG SER 4 8.882 -4.048 11.003 19 H MET 5 H MET 5 6.041 -4.721 6.428 20 HA MET 5 HA MET 5 3.247 -5.015 6.918 21 HB2 MET 5 1HB MET 5 5.088 -5.465 4.635 22 HB3 MET 5 2HB MET 5 3.576 -6.363 4.618 23 HG2 MET 5 1HG MET 5 2.479 -4.073 5.068 24 HG3 MET 5 2HG MET 5 4.017 -3.410 4.521 25 HE1 MET 5 3HE MET 5 0.631 -5.372 2.862 26 HE2 MET 5 1HE MET 5 0.801 -3.944 3.884 27 HE3 MET 5 2HE MET 5 0.635 -3.763 2.138 28 H THR 6 H THR 6 3.086 -6.456 8.667 29 HA THR 6 HA THR 6 3.774 -9.252 8.035 30 HB THR 6 HB THR 6 5.021 -8.665 9.960 31 HG1 THR 6 HG1 THR 6 3.776 -10.643 10.130 32 HG21 THR 6 3HG2 THR 6 3.800 -6.582 10.488 33 HG22 THR 6 1HG2 THR 6 4.085 -7.574 11.918 34 HG23 THR 6 2HG2 THR 6 2.489 -7.545 11.169 35 H VAL 7 H VAL 7 2.075 -10.456 7.534 36 HA VAL 7 HA VAL 7 -0.444 -10.032 8.987 37 HB VAL 7 HB VAL 7 -0.331 -10.589 6.023 38 HG11 VAL 7 1HG1 VAL 7 -2.632 -9.776 7.795 39 HG12 VAL 7 2HG1 VAL 7 -2.708 -10.145 6.071 40 HG13 VAL 7 3HG1 VAL 7 -2.319 -11.417 7.230 41 HG21 VAL 7 3HG2 VAL 7 -0.785 -7.991 7.484 42 HG22 VAL 7 1HG2 VAL 7 0.512 -8.371 6.351 43 HG23 VAL 7 2HG2 VAL 7 -1.151 -8.246 5.777 44 H VAL 8 H VAL 8 -1.617 -11.865 9.436 45 HA VAL 8 HA VAL 8 -0.196 -14.388 9.038 46 HB VAL 8 HB VAL 8 -2.638 -13.898 10.743 47 HG11 VAL 8 1HG1 VAL 8 -1.677 -15.931 11.938 48 HG12 VAL 8 2HG1 VAL 8 -2.411 -16.207 10.357 49 HG13 VAL 8 3HG1 VAL 8 -0.655 -16.145 10.517 50 HG21 VAL 8 3HG2 VAL 8 -0.876 -12.440 11.520 51 HG22 VAL 8 1HG2 VAL 8 -1.059 -13.786 12.645 52 HG23 VAL 8 2HG2 VAL 8 0.281 -13.771 11.498 53 H THR 9 H THR 9 -0.963 -16.056 7.859 54 HA THR 9 HA THR 9 -3.485 -15.611 6.408 55 HB THR 9 HB THR 9 -1.117 -17.325 5.634 56 HG1 THR 9 HG1 THR 9 -0.444 -15.533 4.751 57 HG21 THR 9 3HG2 THR 9 -2.889 -18.430 4.642 58 HG22 THR 9 1HG2 THR 9 -2.459 -17.264 3.392 59 HG23 THR 9 2HG2 THR 9 -3.837 -16.956 4.448 60 H THR 10 H THR 10 -5.014 -17.230 6.263 61 HA THR 10 HA THR 10 -4.877 -19.247 8.355 62 HB THR 10 HB THR 10 -7.246 -19.645 7.888 63 HG1 THR 10 HG1 THR 10 -8.174 -18.028 6.310 64 HG21 THR 10 3HG2 THR 10 -7.438 -17.981 9.373 65 HG22 THR 10 1HG2 THR 10 -7.778 -16.934 7.995 66 HG23 THR 10 2HG2 THR 10 -6.135 -17.058 8.626 67 H GLU 11 H GLU 11 -6.310 -21.316 7.531 68 HA GLU 11 HA GLU 11 -4.542 -22.638 5.684 69 HB2 GLU 11 1HB GLU 11 -5.680 -24.645 6.263 70 HB3 GLU 11 2HB GLU 11 -5.531 -23.708 7.742 71 HG2 GLU 11 1HG GLU 11 -7.929 -22.853 6.945 72 HG3 GLU 11 2HG GLU 11 -7.935 -24.450 6.198 73 H SER 12 H SER 12 -7.632 -21.104 5.548 74 HA SER 12 HA SER 12 -8.382 -22.368 3.047 75 HB2 SER 12 1HB SER 12 -9.941 -21.515 4.997 76 HB3 SER 12 2HB SER 12 -9.809 -19.977 4.145 77 HG SER 12 HG SER 12 -10.978 -22.386 3.315 78 H GLY 13 H GLY 13 -7.302 -19.197 4.193 79 HA2 GLY 13 1HA GLY 13 -5.713 -18.380 2.224 80 HA3 GLY 13 2HA GLY 13 -7.285 -18.150 1.473 81 H LEU 14 H LEU 14 -8.758 -17.262 3.660 82 HA LEU 14 HA LEU 14 -8.309 -14.538 3.637 83 HB2 LEU 14 1HB LEU 14 -10.420 -15.468 4.317 84 HB3 LEU 14 2HB LEU 14 -9.676 -16.233 5.719 85 HG LEU 14 HG LEU 14 -9.187 -13.447 5.908 86 HD11 LEU 14 1HD1 LEU 14 -12.129 -13.856 5.805 87 HD12 LEU 14 2HD1 LEU 14 -11.267 -13.567 4.294 88 HD13 LEU 14 3HD1 LEU 14 -11.182 -12.383 5.598 89 HD21 LEU 14 3HD2 LEU 14 -11.040 -13.949 7.795 90 HD22 LEU 14 1HD2 LEU 14 -9.343 -14.407 7.942 91 HD23 LEU 14 2HD2 LEU 14 -10.534 -15.595 7.412 92 H LYS 15 H LYS 15 -7.211 -13.097 4.889 93 HA LYS 15 HA LYS 15 -5.347 -14.243 6.862 94 HB2 LYS 15 1HB LYS 15 -5.059 -11.741 5.188 95 HB3 LYS 15 2HB LYS 15 -3.893 -12.305 6.378 96 HG2 LYS 15 1HG LYS 15 -2.899 -13.257 4.615 97 HG3 LYS 15 2HG LYS 15 -4.133 -14.503 4.812 98 HD2 LYS 15 1HD LYS 15 -5.469 -13.598 3.099 99 HD3 LYS 15 2HD LYS 15 -4.582 -12.072 3.103 100 HE2 LYS 15 1HE LYS 15 -4.054 -13.537 1.165 101 HE3 LYS 15 2HE LYS 15 -2.650 -13.123 2.149 102 HZ1 LYS 15 3HZ LYS 15 -4.129 -15.624 2.642 103 HZ2 LYS 15 1HZ LYS 15 -2.521 -15.247 3.010 104 HZ3 LYS 15 2HZ LYS 15 -2.974 -15.546 1.408 105 H TYR 16 H TYR 16 -4.673 -12.683 8.595 106 HA TYR 16 HA TYR 16 -6.663 -10.677 9.288 107 HB2 TYR 16 1HB TYR 16 -7.261 -11.616 11.387 108 HB3 TYR 16 2HB TYR 16 -7.436 -12.911 10.208 109 HD1 TYR 16 HD1 TYR 16 -5.781 -14.746 10.131 110 HD2 TYR 16 HD2 TYR 16 -5.646 -11.749 13.148 111 HE1 TYR 16 HE1 TYR 16 -4.299 -16.175 11.476 112 HE2 TYR 16 HE2 TYR 16 -4.163 -13.170 14.501 113 HH TYR 16 HH TYR 16 -3.064 -15.090 14.627 114 H GLU 17 H GLU 17 -5.892 -9.080 10.624 115 HA GLU 17 HA GLU 17 -3.189 -9.393 11.717 116 HB2 GLU 17 1HB GLU 17 -2.862 -8.281 9.596 117 HB3 GLU 17 2HB GLU 17 -4.127 -7.117 9.966 118 HG2 GLU 17 1HG GLU 17 -2.774 -6.231 11.799 119 HG3 GLU 17 2HG GLU 17 -1.503 -7.391 11.415 120 H ASP 18 H ASP 18 -3.230 -8.923 13.802 121 HA ASP 18 HA ASP 18 -5.413 -7.806 15.143 122 HB2 ASP 18 1HB ASP 18 -2.526 -8.129 15.964 123 HB3 ASP 18 2HB ASP 18 -3.772 -7.539 17.059 124 H LEU 19 H LEU 19 -6.009 -5.779 15.636 125 HA LEU 19 HA LEU 19 -4.154 -3.597 14.944 126 HB2 LEU 19 1HB LEU 19 -7.122 -3.802 14.509 127 HB3 LEU 19 2HB LEU 19 -6.251 -2.272 14.443 128 HG LEU 19 HG LEU 19 -5.841 -4.638 12.616 129 HD11 LEU 19 1HD1 LEU 19 -7.249 -2.008 12.321 130 HD12 LEU 19 2HD1 LEU 19 -7.835 -3.629 11.951 131 HD13 LEU 19 3HD1 LEU 19 -6.616 -2.878 10.923 132 HD21 LEU 19 3HD2 LEU 19 -4.196 -2.313 13.213 133 HD22 LEU 19 1HD2 LEU 19 -4.609 -2.444 11.503 134 HD23 LEU 19 2HD2 LEU 19 -3.801 -3.782 12.320 135 H THR 20 H THR 20 -6.685 -4.755 17.082 136 HA THR 20 HA THR 20 -5.660 -3.153 19.241 137 HB THR 20 HB THR 20 -8.568 -2.703 18.658 138 HG1 THR 20 HG1 THR 20 -7.740 -0.628 17.730 139 HG21 THR 20 3HG2 THR 20 -7.807 -0.485 19.834 140 HG22 THR 20 1HG2 THR 20 -6.449 -1.475 20.368 141 HG23 THR 20 2HG2 THR 20 -8.097 -1.942 20.784 142 H GLU 21 H GLU 21 -5.619 -4.544 20.871 143 HA GLU 21 HA GLU 21 -6.895 -6.986 21.000 144 HB2 GLU 21 1HB GLU 21 -6.353 -6.996 23.390 145 HB3 GLU 21 2HB GLU 21 -5.007 -6.392 22.434 146 HG2 GLU 21 1HG GLU 21 -6.931 -4.440 23.585 147 HG3 GLU 21 2HG GLU 21 -5.749 -5.202 24.647 148 H GLY 22 H GLY 22 -8.593 -7.746 22.460 149 HA2 GLY 22 1HA GLY 22 -10.487 -5.874 23.532 150 HA3 GLY 22 2HA GLY 22 -11.048 -6.616 22.041 151 H SER 23 H SER 23 -10.134 -7.202 25.375 152 HA SER 23 HA SER 23 -10.724 -9.995 25.336 153 HB2 SER 23 1HB SER 23 -9.239 -9.321 27.040 154 HB3 SER 23 2HB SER 23 -10.278 -7.985 27.536 155 HG SER 23 HG SER 23 -10.322 -9.879 28.927 156 H GLY 24 H GLY 24 -12.819 -9.878 24.263 157 HA2 GLY 24 1HA GLY 24 -14.979 -9.282 26.191 158 HA3 GLY 24 2HA GLY 24 -15.129 -8.924 24.477 159 H ALA 25 H ALA 25 -16.359 -10.321 23.430 160 HA ALA 25 HA ALA 25 -16.086 -13.178 24.003 161 HB1 ALA 25 1HB ALA 25 -18.815 -12.862 23.571 162 HB2 ALA 25 2HB ALA 25 -18.020 -13.251 25.097 163 HB3 ALA 25 3HB ALA 25 -18.385 -11.573 24.696 164 H GLU 26 H GLU 26 -16.201 -14.445 22.227 165 HA GLU 26 HA GLU 26 -16.116 -13.226 19.662 166 HB2 GLU 26 1HB GLU 26 -14.855 -15.261 20.167 167 HB3 GLU 26 2HB GLU 26 -16.354 -16.141 20.427 168 HG2 GLU 26 1HG GLU 26 -16.934 -15.566 18.025 169 HG3 GLU 26 2HG GLU 26 -15.253 -15.065 17.854 170 H ALA 27 H ALA 27 -17.647 -12.984 18.133 171 HA ALA 27 HA ALA 27 -20.363 -13.024 18.807 172 HB1 ALA 27 1HB ALA 27 -20.563 -11.870 16.919 173 HB2 ALA 27 2HB ALA 27 -18.828 -12.086 16.682 174 HB3 ALA 27 3HB ALA 27 -19.965 -13.222 15.956 175 H ARG 28 H ARG 28 -22.044 -14.408 18.315 176 HA ARG 28 HA ARG 28 -21.274 -17.065 17.300 177 HB2 ARG 28 1HB ARG 28 -22.213 -16.445 19.855 178 HB3 ARG 28 2HB ARG 28 -23.610 -17.108 19.017 179 HG2 ARG 28 1HG ARG 28 -22.657 -18.981 19.959 180 HG3 ARG 28 2HG ARG 28 -21.990 -19.003 18.326 181 HD2 ARG 28 1HD ARG 28 -20.160 -19.432 19.728 182 HD3 ARG 28 2HD ARG 28 -20.010 -17.729 19.296 183 HE ARG 28 HE ARG 28 -21.451 -17.879 21.676 184 HH11 ARG 28 1HH1 ARG 28 -18.251 -18.577 20.496 185 HH12 ARG 28 2HH1 ARG 28 -17.484 -18.285 22.021 186 HH21 ARG 28 1HH2 ARG 28 -20.452 -17.493 23.690 187 HH22 ARG 28 2HH2 ARG 28 -18.737 -17.670 23.838 188 H ALA 29 H ALA 29 -22.596 -18.018 15.820 189 HA ALA 29 HA ALA 29 -24.260 -16.424 14.235 190 HB1 ALA 29 1HB ALA 29 -23.196 -19.002 14.100 191 HB2 ALA 29 2HB ALA 29 -24.944 -19.209 13.992 192 HB3 ALA 29 3HB ALA 29 -24.110 -18.155 12.852 193 H GLY 30 H GLY 30 -26.244 -15.687 14.588 194 HA2 GLY 30 1HA GLY 30 -28.592 -16.317 14.954 195 HA3 GLY 30 2HA GLY 30 -28.036 -17.281 16.314 196 H GLN 31 H GLN 31 -26.102 -14.944 16.868 197 HA GLN 31 HA GLN 31 -28.039 -13.415 18.455 198 HB2 GLN 31 1HB GLN 31 -26.420 -13.118 20.056 199 HB3 GLN 31 2HB GLN 31 -25.911 -14.663 19.389 200 HG2 GLN 31 1HG GLN 31 -24.292 -13.485 17.960 201 HG3 GLN 31 2HG GLN 31 -24.771 -11.963 18.710 202 HE21 GLN 31 2HE2 GLN 31 -24.005 -11.440 20.699 203 HE22 GLN 31 1HE2 GLN 31 -22.842 -12.385 21.560 204 H THR 32 H THR 32 -28.041 -11.167 18.479 205 HA THR 32 HA THR 32 -26.983 -9.943 16.053 206 HB THR 32 HB THR 32 -28.732 -8.578 18.091 207 HG1 THR 32 HG1 THR 32 -30.492 -9.470 17.137 208 HG21 THR 32 3HG2 THR 32 -28.889 -6.921 16.590 209 HG22 THR 32 1HG2 THR 32 -29.132 -8.043 15.252 210 HG23 THR 32 2HG2 THR 32 -27.499 -7.665 15.800 211 H VAL 33 H VAL 33 -25.363 -8.501 16.007 212 HA VAL 33 HA VAL 33 -24.508 -7.191 18.472 213 HB VAL 33 HB VAL 33 -22.219 -7.831 18.289 214 HG11 VAL 33 1HG1 VAL 33 -22.344 -10.283 18.584 215 HG12 VAL 33 2HG1 VAL 33 -23.592 -9.418 19.483 216 HG13 VAL 33 3HG1 VAL 33 -24.000 -10.245 17.979 217 HG21 VAL 33 3HG2 VAL 33 -22.989 -8.546 15.581 218 HG22 VAL 33 1HG2 VAL 33 -21.400 -8.150 16.238 219 HG23 VAL 33 2HG2 VAL 33 -22.018 -9.798 16.356 220 H SER 34 H SER 34 -23.060 -5.394 18.109 221 HA SER 34 HA SER 34 -23.398 -4.251 15.419 222 HB2 SER 34 1HB SER 34 -23.656 -3.156 18.114 223 HB3 SER 34 2HB SER 34 -22.618 -2.173 17.080 224 HG SER 34 HG SER 34 -24.294 -1.999 15.608 225 H VAL 35 H VAL 35 -21.662 -3.986 14.188 226 HA VAL 35 HA VAL 35 -19.052 -3.536 15.424 227 HB VAL 35 HB VAL 35 -17.930 -5.271 14.339 228 HG11 VAL 35 1HG1 VAL 35 -20.562 -6.588 14.955 229 HG12 VAL 35 2HG1 VAL 35 -18.938 -7.257 15.127 230 HG13 VAL 35 3HG1 VAL 35 -19.485 -5.975 16.209 231 HG21 VAL 35 3HG2 VAL 35 -19.510 -6.756 12.736 232 HG22 VAL 35 1HG2 VAL 35 -20.205 -5.157 12.471 233 HG23 VAL 35 2HG2 VAL 35 -18.492 -5.437 12.159 234 H HIS 36 H HIS 36 -17.415 -2.829 13.845 235 HA HIS 36 HA HIS 36 -18.677 -1.326 11.651 236 HB2 HIS 36 1HB HIS 36 -16.669 -0.636 13.654 237 HB3 HIS 36 2HB HIS 36 -16.155 -0.239 12.017 238 HD1 HIS 36 HD1 HIS 36 -18.837 0.687 10.838 239 HD2 HIS 36 HD2 HIS 36 -17.426 1.808 14.581 240 HE1 HIS 36 HE1 HIS 36 -20.008 2.846 11.379 241 H TYR 37 H TYR 37 -18.050 -1.656 9.602 242 HA TYR 37 HA TYR 37 -15.715 -3.397 9.149 243 HB2 TYR 37 1HB TYR 37 -16.861 -4.407 7.280 244 HB3 TYR 37 2HB TYR 37 -17.897 -4.515 8.698 245 HD1 TYR 37 HD2 TYR 37 -19.947 -3.208 8.845 246 HD2 TYR 37 HD1 TYR 37 -17.452 -2.985 5.406 247 HE1 TYR 37 HE2 TYR 37 -21.770 -2.125 7.599 248 HE2 TYR 37 HE1 TYR 37 -19.268 -1.900 4.151 249 HH TYR 37 HH TYR 37 -21.624 -0.394 5.260 250 H THR 38 H THR 38 -14.204 -2.688 7.773 251 HA THR 38 HA THR 38 -14.809 -0.269 6.199 252 HB THR 38 HB THR 38 -11.975 -0.680 6.653 253 HG1 THR 38 HG1 THR 38 -12.093 -0.167 8.927 254 HG21 THR 38 3HG2 THR 38 -12.124 1.657 7.427 255 HG22 THR 38 1HG2 THR 38 -13.883 1.553 7.363 256 HG23 THR 38 2HG2 THR 38 -12.937 1.418 5.880 257 H GLY 39 H GLY 39 -14.081 -0.145 4.092 258 HA2 GLY 39 1HA GLY 39 -13.165 -2.706 2.954 259 HA3 GLY 39 2HA GLY 39 -14.084 -1.488 2.082 260 H TRP 40 H TRP 40 -10.998 -2.684 2.813 261 HA TRP 40 HA TRP 40 -9.763 -0.358 1.488 262 HB2 TRP 40 1HB TRP 40 -8.440 -2.171 3.516 263 HB3 TRP 40 2HB TRP 40 -7.743 -0.732 2.775 264 HD1 TRP 40 HD1 TRP 40 -10.508 1.029 3.201 265 HE1 TRP 40 HE1 TRP 40 -10.951 1.958 5.560 266 HE3 TRP 40 HE3 TRP 40 -7.494 -2.107 5.888 267 HZ2 TRP 40 HZ2 TRP 40 -10.131 1.432 8.209 268 HZ3 TRP 40 HZ3 TRP 40 -7.379 -1.827 8.330 269 HH2 TRP 40 HH2 TRP 40 -8.671 -0.094 9.465 270 H LEU 41 H LEU 41 -7.743 -0.885 0.304 271 HA LEU 41 HA LEU 41 -8.065 -3.441 -1.097 272 HB2 LEU 41 1HB LEU 41 -7.257 -0.743 -1.868 273 HB3 LEU 41 2HB LEU 41 -6.208 -2.003 -2.514 274 HG LEU 41 HG LEU 41 -7.916 -1.421 -4.125 275 HD11 LEU 41 1HD1 LEU 41 -8.065 -3.538 -4.786 276 HD12 LEU 41 2HD1 LEU 41 -9.068 -3.977 -3.404 277 HD13 LEU 41 3HD1 LEU 41 -7.311 -3.979 -3.254 278 HD21 LEU 41 3HD2 LEU 41 -9.614 -0.586 -2.589 279 HD22 LEU 41 1HD2 LEU 41 -9.892 -2.222 -1.991 280 HD23 LEU 41 2HD2 LEU 41 -10.286 -1.815 -3.661 281 H THR 42 H THR 42 -6.150 -4.634 -1.730 282 HA THR 42 HA THR 42 -4.435 -5.189 0.400 283 HB THR 42 HB THR 42 -3.242 -6.650 -1.054 284 HG1 THR 42 HG1 THR 42 -3.508 -6.467 -3.358 285 HG21 THR 42 3HG2 THR 42 -6.036 -6.658 -0.901 286 HG22 THR 42 1HG2 THR 42 -4.987 -8.019 -1.295 287 HG23 THR 42 2HG2 THR 42 -5.659 -7.020 -2.585 288 H ASP 43 H ASP 43 -4.255 -2.758 -2.026 289 HA ASP 43 HA ASP 43 -1.413 -2.324 -1.777 290 HB2 ASP 43 1HB ASP 43 -3.593 -0.729 -3.136 291 HB3 ASP 43 2HB ASP 43 -1.885 -0.300 -3.181 292 H GLY 44 H GLY 44 -4.247 -1.335 -0.126 293 HA2 GLY 44 1HA GLY 44 -3.962 -0.344 2.072 294 HA3 GLY 44 2HA GLY 44 -2.635 0.601 1.411 295 H GLN 45 H GLN 45 -5.089 0.479 -0.834 296 HA GLN 45 HA GLN 45 -5.843 3.220 -0.239 297 HB2 GLN 45 1HB GLN 45 -5.534 3.149 -2.490 298 HB3 GLN 45 2HB GLN 45 -5.944 1.442 -2.599 299 HG2 GLN 45 1HG GLN 45 -8.216 1.862 -2.742 300 HG3 GLN 45 2HG GLN 45 -8.062 3.475 -2.047 301 HE21 GLN 45 2HE2 GLN 45 -8.901 2.038 -4.746 302 HE22 GLN 45 1HE2 GLN 45 -8.318 3.155 -5.928 303 H LYS 46 H LYS 46 -7.661 3.793 0.747 304 HA LYS 46 HA LYS 46 -9.634 1.746 1.378 305 HB2 LYS 46 1HB LYS 46 -9.000 3.043 3.256 306 HB3 LYS 46 2HB LYS 46 -9.158 4.552 2.366 307 HG2 LYS 46 1HG LYS 46 -11.528 4.409 2.378 308 HG3 LYS 46 2HG LYS 46 -11.486 2.753 2.988 309 HD2 LYS 46 1HD LYS 46 -11.837 3.770 4.975 310 HD3 LYS 46 2HD LYS 46 -10.088 4.003 4.923 311 HE2 LYS 46 1HE LYS 46 -10.547 6.207 3.774 312 HE3 LYS 46 2HE LYS 46 -12.245 5.970 4.186 313 HZ1 LYS 46 3HZ LYS 46 -9.965 6.257 6.060 314 HZ2 LYS 46 1HZ LYS 46 -11.513 5.777 6.545 315 HZ3 LYS 46 2HZ LYS 46 -11.276 7.308 5.866 316 H PHE 47 H PHE 47 -11.637 1.639 0.545 317 HA PHE 47 HA PHE 47 -12.521 3.843 -1.199 318 HB2 PHE 47 1HB PHE 47 -13.517 2.191 -2.711 319 HB3 PHE 47 2HB PHE 47 -11.782 1.933 -2.556 320 HD1 PHE 47 HD2 PHE 47 -10.978 0.110 -0.994 321 HD2 PHE 47 HD1 PHE 47 -15.032 0.483 -2.239 322 HE1 PHE 47 HE2 PHE 47 -11.382 -2.235 -0.369 323 HE2 PHE 47 HE1 PHE 47 -15.442 -1.862 -1.615 324 HZ PHE 47 HZ PHE 47 -13.616 -3.224 -0.680 325 H ASP 48 H ASP 48 -13.428 1.227 0.966 326 HA ASP 48 HA ASP 48 -16.139 2.361 1.150 327 HB2 ASP 48 1HB ASP 48 -15.425 -0.239 0.674 328 HB3 ASP 48 2HB ASP 48 -15.666 -0.249 2.418 329 H SER 49 H SER 49 -16.761 3.313 2.980 330 HA SER 49 HA SER 49 -15.356 2.702 5.475 331 HB2 SER 49 1HB SER 49 -15.177 5.128 5.999 332 HB3 SER 49 2HB SER 49 -14.198 4.657 4.610 333 HG SER 49 HG SER 49 -16.286 5.315 3.434 334 H SER 50 H SER 50 -16.724 2.437 7.113 335 HA SER 50 HA SER 50 -19.512 2.606 6.772 336 HB2 SER 50 1HB SER 50 -17.715 2.154 9.133 337 HB3 SER 50 2HB SER 50 -19.446 2.383 9.380 338 HG SER 50 HG SER 50 -19.512 0.318 8.969 339 H LYS 51 H LYS 51 -17.203 4.975 7.563 340 HA LYS 51 HA LYS 51 -18.607 6.699 9.238 341 HB2 LYS 51 1HB LYS 51 -17.090 8.401 8.560 342 HB3 LYS 51 2HB LYS 51 -16.192 6.889 8.527 343 HG2 LYS 51 1HG LYS 51 -16.902 6.874 6.008 344 HG3 LYS 51 2HG LYS 51 -17.097 8.609 6.272 345 HD2 LYS 51 1HD LYS 51 -14.591 7.037 6.871 346 HD3 LYS 51 2HD LYS 51 -14.854 8.007 5.420 347 HE2 LYS 51 1HE LYS 51 -15.231 9.979 6.925 348 HE3 LYS 51 2HE LYS 51 -14.713 8.968 8.273 349 HZ1 LYS 51 3HZ LYS 51 -12.569 9.039 7.621 350 HZ2 LYS 51 1HZ LYS 51 -13.050 10.487 6.890 351 HZ3 LYS 51 2HZ LYS 51 -12.936 9.072 5.970 352 H ASP 52 H ASP 52 -19.042 5.997 5.880 353 HA ASP 52 HA ASP 52 -20.284 8.269 4.923 354 HB2 ASP 52 1HB ASP 52 -20.489 5.365 4.294 355 HB3 ASP 52 2HB ASP 52 -21.719 6.433 3.626 356 H ARG 53 H ARG 53 -21.649 5.654 6.864 357 HA ARG 53 HA ARG 53 -24.233 7.025 6.938 358 HB2 ARG 53 1HB ARG 53 -23.863 4.461 6.585 359 HB3 ARG 53 2HB ARG 53 -23.665 4.433 8.332 360 HG2 ARG 53 1HG ARG 53 -25.861 5.022 8.727 361 HG3 ARG 53 2HG ARG 53 -26.062 5.739 7.127 362 HD2 ARG 53 1HD ARG 53 -25.489 2.822 7.346 363 HD3 ARG 53 2HD ARG 53 -27.115 3.402 7.707 364 HE ARG 53 HE ARG 53 -25.854 3.263 5.124 365 HH11 ARG 53 1HH1 ARG 53 -28.341 4.777 7.032 366 HH12 ARG 53 2HH1 ARG 53 -29.313 5.206 5.663 367 HH21 ARG 53 1HH2 ARG 53 -27.124 3.822 3.313 368 HH22 ARG 53 2HH2 ARG 53 -28.620 4.661 3.548 369 H ASN 54 H ASN 54 -21.410 6.504 8.830 370 HA ASN 54 HA ASN 54 -20.769 7.243 10.882 371 HB2 ASN 54 1HB ASN 54 -21.939 9.344 9.975 372 HB3 ASN 54 2HB ASN 54 -23.293 8.885 11.003 373 HD21 ASN 54 2HD2 ASN 54 -19.770 9.264 11.193 374 HD22 ASN 54 1HD2 ASN 54 -19.766 10.028 12.742 375 H ASP 55 H ASP 55 -21.761 4.829 11.036 376 HA ASP 55 HA ASP 55 -22.713 4.593 13.667 377 HB2 ASP 55 1HB ASP 55 -24.890 5.133 13.181 378 HB3 ASP 55 2HB ASP 55 -24.766 4.586 11.511 379 HA PRO 56 HA PRO 56 -21.008 0.598 12.982 380 HB2 PRO 56 1HB PRO 56 -22.032 -0.700 15.136 381 HB3 PRO 56 2HB PRO 56 -20.729 0.488 15.260 382 HG2 PRO 56 1HG PRO 56 -23.659 0.831 15.768 383 HG3 PRO 56 2HG PRO 56 -22.282 1.438 16.707 384 HD2 PRO 56 1HD PRO 56 -23.667 2.995 14.978 385 HD3 PRO 56 2HD PRO 56 -21.931 3.214 15.279 386 H PHE 57 H PHE 57 -21.538 -1.255 11.941 387 HA PHE 57 HA PHE 57 -24.255 -1.579 11.052 388 HB2 PHE 57 1HB PHE 57 -22.199 -1.963 9.622 389 HB3 PHE 57 2HB PHE 57 -21.934 -3.442 10.540 390 HD1 PHE 57 HD2 PHE 57 -24.921 -1.825 8.988 391 HD2 PHE 57 HD1 PHE 57 -22.494 -5.304 9.337 392 HE1 PHE 57 HE2 PHE 57 -26.439 -3.032 7.473 393 HE2 PHE 57 HE1 PHE 57 -24.007 -6.516 7.821 394 HZ PHE 57 HZ PHE 57 -25.983 -5.380 6.889 395 H ALA 58 H ALA 58 -25.701 -2.475 12.368 396 HA ALA 58 HA ALA 58 -24.869 -4.658 14.143 397 HB1 ALA 58 1HB ALA 58 -26.475 -2.427 14.572 398 HB2 ALA 58 2HB ALA 58 -27.597 -3.787 14.506 399 HB3 ALA 58 3HB ALA 58 -26.258 -3.804 15.653 400 H PHE 59 H PHE 59 -25.500 -6.696 13.810 401 HA PHE 59 HA PHE 59 -27.932 -7.380 12.474 402 HB2 PHE 59 1HB PHE 59 -27.046 -8.412 10.506 403 HB3 PHE 59 2HB PHE 59 -26.402 -6.774 10.565 404 HD1 PHE 59 HD2 PHE 59 -24.062 -6.531 11.702 405 HD2 PHE 59 HD1 PHE 59 -25.613 -10.172 10.134 406 HE1 PHE 59 HE2 PHE 59 -21.777 -7.424 11.524 407 HE2 PHE 59 HE1 PHE 59 -23.329 -11.071 9.955 408 HZ PHE 59 HZ PHE 59 -21.408 -9.696 10.649 409 H VAL 60 H VAL 60 -27.974 -9.846 12.061 410 HA VAL 60 HA VAL 60 -26.904 -11.113 14.466 411 HB VAL 60 HB VAL 60 -28.914 -12.179 12.478 412 HG11 VAL 60 1HG1 VAL 60 -27.709 -13.255 14.974 413 HG12 VAL 60 2HG1 VAL 60 -29.408 -13.601 14.646 414 HG13 VAL 60 3HG1 VAL 60 -28.168 -14.088 13.490 415 HG21 VAL 60 3HG2 VAL 60 -29.966 -11.596 15.088 416 HG22 VAL 60 1HG2 VAL 60 -29.223 -10.156 14.391 417 HG23 VAL 60 2HG2 VAL 60 -30.494 -11.005 13.512 418 H LEU 61 H LEU 61 -25.226 -12.453 14.420 419 HA LEU 61 HA LEU 61 -23.707 -12.938 12.124 420 HB2 LEU 61 1HB LEU 61 -22.722 -13.034 14.314 421 HB3 LEU 61 2HB LEU 61 -23.771 -14.374 14.772 422 HG LEU 61 HG LEU 61 -22.602 -15.869 13.304 423 HD11 LEU 61 1HD1 LEU 61 -21.687 -15.092 11.439 424 HD12 LEU 61 2HD1 LEU 61 -20.379 -14.421 12.412 425 HD13 LEU 61 3HD1 LEU 61 -21.786 -13.431 12.025 426 HD21 LEU 61 3HD2 LEU 61 -20.207 -14.618 14.392 427 HD22 LEU 61 1HD2 LEU 61 -20.931 -16.186 14.749 428 HD23 LEU 61 2HD2 LEU 61 -21.521 -14.737 15.563 429 H GLY 62 H GLY 62 -23.564 -14.617 10.700 430 HA2 GLY 62 1HA GLY 62 -24.343 -16.356 9.415 431 HA3 GLY 62 2HA GLY 62 -24.563 -17.179 10.952 432 H GLY 63 H GLY 63 -26.235 -14.307 9.710 433 HA2 GLY 63 1HA GLY 63 -28.632 -15.787 9.102 434 HA3 GLY 63 2HA GLY 63 -28.746 -14.865 10.594 435 H GLY 64 H GLY 64 -27.116 -14.045 7.546 436 HA2 GLY 64 1HA GLY 64 -29.130 -11.992 7.018 437 HA3 GLY 64 2HA GLY 64 -27.487 -11.443 7.313 438 H MET 65 H MET 65 -26.356 -11.064 5.539 439 HA MET 65 HA MET 65 -26.309 -12.923 3.354 440 HB2 MET 65 1HB MET 65 -27.849 -10.383 3.164 441 HB3 MET 65 2HB MET 65 -26.887 -10.857 1.771 442 HG2 MET 65 1HG MET 65 -28.093 -13.161 2.130 443 HG3 MET 65 2HG MET 65 -29.282 -12.155 2.955 444 HE1 MET 65 3HE MET 65 -28.421 -12.884 -1.290 445 HE2 MET 65 1HE MET 65 -28.175 -13.803 0.195 446 HE3 MET 65 2HE MET 65 -29.781 -13.709 -0.528 447 H VAL 66 H VAL 66 -24.138 -12.647 4.495 448 HA VAL 66 HA VAL 66 -22.639 -10.451 3.219 449 HB VAL 66 HB VAL 66 -21.061 -10.493 5.040 450 HG11 VAL 66 1HG1 VAL 66 -23.923 -10.389 5.978 451 HG12 VAL 66 2HG1 VAL 66 -22.548 -9.816 6.923 452 HG13 VAL 66 3HG1 VAL 66 -22.943 -9.050 5.385 453 HG21 VAL 66 3HG2 VAL 66 -21.763 -11.948 7.086 454 HG22 VAL 66 1HG2 VAL 66 -22.600 -12.914 5.872 455 HG23 VAL 66 2HG2 VAL 66 -20.856 -12.677 5.761 456 H ILE 67 H ILE 67 -20.490 -10.925 2.510 457 HA ILE 67 HA ILE 67 -20.245 -13.334 1.099 458 HB ILE 67 HB ILE 67 -17.818 -12.656 0.833 459 HG12 ILE 67 1HG1 ILE 67 -18.566 -10.009 1.993 460 HG13 ILE 67 2HG1 ILE 67 -18.070 -11.290 3.094 461 HG21 ILE 67 1HG2 ILE 67 -19.499 -10.314 0.123 462 HG22 ILE 67 2HG2 ILE 67 -18.366 -11.236 -0.864 463 HG23 ILE 67 3HG2 ILE 67 -19.964 -11.892 -0.510 464 HD11 ILE 67 3HD1 ILE 67 -16.231 -11.141 0.914 465 HD12 ILE 67 1HD1 ILE 67 -16.442 -9.543 1.628 466 HD13 ILE 67 2HD1 ILE 67 -15.945 -10.902 2.637 467 H LYS 68 H LYS 68 -18.666 -15.026 1.337 468 HA LYS 68 HA LYS 68 -18.702 -16.371 3.717 469 HB2 LYS 68 1HB LYS 68 -16.444 -16.461 1.708 470 HB3 LYS 68 2HB LYS 68 -16.847 -17.711 2.878 471 HG2 LYS 68 1HG LYS 68 -19.091 -17.882 1.736 472 HG3 LYS 68 2HG LYS 68 -18.418 -16.861 0.463 473 HD2 LYS 68 1HD LYS 68 -16.473 -18.721 0.670 474 HD3 LYS 68 2HD LYS 68 -17.881 -19.688 1.115 475 HE2 LYS 68 1HE LYS 68 -18.082 -17.931 -1.275 476 HE3 LYS 68 2HE LYS 68 -17.116 -19.400 -1.405 477 HZ1 LYS 68 3HZ LYS 68 -19.953 -19.102 -1.351 478 HZ2 LYS 68 1HZ LYS 68 -19.425 -20.198 -0.176 479 HZ3 LYS 68 2HZ LYS 68 -19.022 -20.441 -1.800 480 H GLY 69 H GLY 69 -16.058 -14.286 2.544 481 HA2 GLY 69 1HA GLY 69 -14.330 -14.533 4.693 482 HA3 GLY 69 2HA GLY 69 -14.466 -13.095 3.692 483 H TRP 70 H TRP 70 -17.143 -12.422 4.364 484 HA TRP 70 HA TRP 70 -16.690 -10.916 6.709 485 HB2 TRP 70 1HB TRP 70 -18.976 -11.364 4.864 486 HB3 TRP 70 2HB TRP 70 -19.356 -10.738 6.466 487 HD1 TRP 70 HD1 TRP 70 -16.329 -9.778 4.246 488 HE1 TRP 70 HE1 TRP 70 -16.409 -7.236 3.852 489 HE3 TRP 70 HE3 TRP 70 -20.749 -8.732 6.592 490 HZ2 TRP 70 HZ2 TRP 70 -18.119 -5.073 4.456 491 HZ3 TRP 70 HZ3 TRP 70 -21.536 -6.401 6.640 492 HH2 TRP 70 HH2 TRP 70 -20.247 -4.611 5.594 493 H ASP 71 H ASP 71 -18.989 -13.583 6.123 494 HA ASP 71 HA ASP 71 -19.895 -13.885 8.724 495 HB2 ASP 71 1HB ASP 71 -20.626 -15.051 6.500 496 HB3 ASP 71 2HB ASP 71 -19.470 -16.290 6.983 497 H GLU 72 H GLU 72 -17.148 -15.495 7.143 498 HA GLU 72 HA GLU 72 -16.370 -17.118 9.271 499 HB2 GLU 72 1HB GLU 72 -15.359 -16.431 6.723 500 HB3 GLU 72 2HB GLU 72 -14.055 -16.156 7.869 501 HG2 GLU 72 1HG GLU 72 -15.567 -18.710 7.398 502 HG3 GLU 72 2HG GLU 72 -13.871 -18.381 7.049 503 H GLY 73 H GLY 73 -15.521 -13.765 8.524 504 HA2 GLY 73 1HA GLY 73 -13.657 -13.508 10.678 505 HA3 GLY 73 2HA GLY 73 -14.336 -12.195 9.727 506 H VAL 74 H VAL 74 -17.094 -12.870 10.302 507 HA VAL 74 HA VAL 74 -17.375 -11.423 12.744 508 HB VAL 74 HB VAL 74 -19.489 -12.872 11.143 509 HG11 VAL 74 1HG1 VAL 74 -20.197 -12.405 13.429 510 HG12 VAL 74 2HG1 VAL 74 -19.742 -10.711 13.234 511 HG13 VAL 74 3HG1 VAL 74 -21.065 -11.385 12.281 512 HG21 VAL 74 3HG2 VAL 74 -19.487 -11.189 9.680 513 HG22 VAL 74 1HG2 VAL 74 -19.463 -9.981 10.965 514 HG23 VAL 74 2HG2 VAL 74 -17.953 -10.687 10.389 515 H GLN 75 H GLN 75 -17.297 -14.776 11.899 516 HA GLN 75 HA GLN 75 -18.476 -15.618 14.421 517 HB2 GLN 75 1HB GLN 75 -17.355 -17.194 12.099 518 HB3 GLN 75 2HB GLN 75 -18.061 -17.918 13.538 519 HG2 GLN 75 1HG GLN 75 -20.202 -16.948 13.040 520 HG3 GLN 75 2HG GLN 75 -19.521 -16.059 11.678 521 HE21 GLN 75 2HE2 GLN 75 -19.396 -17.020 9.741 522 HE22 GLN 75 1HE2 GLN 75 -19.842 -18.658 9.423 523 H GLY 76 H GLY 76 -15.732 -14.235 13.949 524 HA2 GLY 76 1HA GLY 76 -14.256 -16.066 15.730 525 HA3 GLY 76 2HA GLY 76 -13.458 -15.319 14.354 526 H MET 77 H MET 77 -14.705 -12.759 14.581 527 HA MET 77 HA MET 77 -12.928 -11.504 16.358 528 HB2 MET 77 1HB MET 77 -14.123 -9.450 15.844 529 HB3 MET 77 2HB MET 77 -13.893 -10.396 14.379 530 HG2 MET 77 1HG MET 77 -16.110 -10.833 14.140 531 HG3 MET 77 2HG MET 77 -16.424 -10.765 15.873 532 HE1 MET 77 3HE MET 77 -17.206 -9.441 12.759 533 HE2 MET 77 1HE MET 77 -18.568 -9.234 13.860 534 HE3 MET 77 2HE MET 77 -17.852 -7.829 13.070 535 H LYS 78 H LYS 78 -13.324 -10.352 18.296 536 HA LYS 78 HA LYS 78 -15.675 -11.306 19.797 537 HB2 LYS 78 1HB LYS 78 -12.995 -10.594 20.990 538 HB3 LYS 78 2HB LYS 78 -14.352 -11.372 21.795 539 HG2 LYS 78 1HG LYS 78 -14.043 -13.274 20.135 540 HG3 LYS 78 2HG LYS 78 -12.495 -12.522 19.738 541 HD2 LYS 78 1HD LYS 78 -12.266 -12.555 22.396 542 HD3 LYS 78 2HD LYS 78 -13.356 -13.930 22.203 543 HE2 LYS 78 1HE LYS 78 -11.726 -14.797 20.468 544 HE3 LYS 78 2HE LYS 78 -10.611 -13.552 21.029 545 HZ1 LYS 78 3HZ LYS 78 -10.909 -14.535 23.303 546 HZ2 LYS 78 1HZ LYS 78 -10.082 -15.512 22.197 547 HZ3 LYS 78 2HZ LYS 78 -11.700 -15.837 22.568 548 H VAL 79 H VAL 79 -16.356 -9.869 21.580 549 HA VAL 79 HA VAL 79 -16.941 -7.303 20.714 550 HB VAL 79 HB VAL 79 -16.756 -8.156 23.604 551 HG11 VAL 79 1HG1 VAL 79 -18.885 -6.508 23.435 552 HG12 VAL 79 2HG1 VAL 79 -17.256 -5.971 23.849 553 HG13 VAL 79 3HG1 VAL 79 -17.845 -5.811 22.194 554 HG21 VAL 79 3HG2 VAL 79 -18.582 -8.955 21.456 555 HG22 VAL 79 1HG2 VAL 79 -18.245 -9.726 23.006 556 HG23 VAL 79 2HG2 VAL 79 -19.385 -8.383 22.918 557 H GLY 80 H GLY 80 -15.767 -5.515 20.519 558 HA2 GLY 80 1HA GLY 80 -14.272 -3.841 21.138 559 HA3 GLY 80 2HA GLY 80 -13.740 -4.846 22.477 560 H GLY 81 H GLY 81 -13.686 -6.791 19.833 561 HA2 GLY 81 1HA GLY 81 -10.796 -6.533 19.613 562 HA3 GLY 81 2HA GLY 81 -11.781 -7.828 18.951 563 H VAL 82 H VAL 82 -9.761 -5.532 18.025 564 HA VAL 82 HA VAL 82 -11.204 -5.042 15.502 565 HB VAL 82 HB VAL 82 -9.284 -3.137 16.849 566 HG11 VAL 82 1HG1 VAL 82 -10.502 -3.254 14.161 567 HG12 VAL 82 2HG1 VAL 82 -10.487 -1.676 14.951 568 HG13 VAL 82 3HG1 VAL 82 -8.975 -2.545 14.687 569 HG21 VAL 82 3HG2 VAL 82 -11.135 -2.719 18.086 570 HG22 VAL 82 1HG2 VAL 82 -11.581 -1.766 16.671 571 HG23 VAL 82 2HG2 VAL 82 -12.228 -3.393 16.878 572 H ARG 83 H ARG 83 -10.208 -5.797 13.755 573 HA ARG 83 HA ARG 83 -7.346 -5.760 13.488 574 HB2 ARG 83 1HB ARG 83 -7.288 -8.274 12.999 575 HB3 ARG 83 2HB ARG 83 -7.347 -7.779 14.685 576 HG2 ARG 83 1HG ARG 83 -9.631 -8.358 14.874 577 HG3 ARG 83 2HG ARG 83 -9.799 -8.540 13.126 578 HD2 ARG 83 1HD ARG 83 -8.858 -10.602 13.114 579 HD3 ARG 83 2HD ARG 83 -7.753 -10.222 14.434 580 HE ARG 83 HE ARG 83 -10.386 -11.369 14.645 581 HH11 ARG 83 1HH1 ARG 83 -7.870 -9.613 16.289 582 HH12 ARG 83 2HH1 ARG 83 -8.388 -10.094 17.871 583 HH21 ARG 83 1HH2 ARG 83 -11.078 -12.009 16.722 584 HH22 ARG 83 2HH2 ARG 83 -10.212 -11.458 18.116 585 H ARG 84 H ARG 84 -6.651 -6.102 11.355 586 HA ARG 84 HA ARG 84 -8.747 -5.728 9.376 587 HB2 ARG 84 1HB ARG 84 -6.682 -4.305 9.426 588 HB3 ARG 84 2HB ARG 84 -5.754 -5.728 8.973 589 HG2 ARG 84 1HG ARG 84 -7.087 -5.896 6.903 590 HG3 ARG 84 2HG ARG 84 -7.919 -4.406 7.352 591 HD2 ARG 84 1HD ARG 84 -6.244 -3.692 5.895 592 HD3 ARG 84 2HD ARG 84 -5.574 -3.376 7.495 593 HE ARG 84 HE ARG 84 -4.831 -5.946 6.495 594 HH11 ARG 84 1HH1 ARG 84 -4.092 -2.547 6.348 595 HH12 ARG 84 2HH1 ARG 84 -2.436 -2.794 5.900 596 HH21 ARG 84 1HH2 ARG 84 -2.654 -6.283 5.906 597 HH22 ARG 84 2HH2 ARG 84 -1.620 -4.919 5.648 598 H LEU 85 H LEU 85 -9.625 -7.424 8.405 599 HA LEU 85 HA LEU 85 -8.028 -9.871 8.095 600 HB2 LEU 85 1HB LEU 85 -11.003 -9.408 8.107 601 HB3 LEU 85 2HB LEU 85 -10.260 -10.948 7.680 602 HG LEU 85 HG LEU 85 -9.148 -10.457 10.123 603 HD11 LEU 85 1HD1 LEU 85 -10.648 -9.514 11.601 604 HD12 LEU 85 2HD1 LEU 85 -12.021 -9.738 10.518 605 HD13 LEU 85 3HD1 LEU 85 -10.831 -8.480 10.184 606 HD21 LEU 85 3HD2 LEU 85 -10.250 -12.349 10.756 607 HD22 LEU 85 1HD2 LEU 85 -10.501 -12.444 9.012 608 HD23 LEU 85 2HD2 LEU 85 -11.783 -11.827 10.055 609 H THR 86 H THR 86 -7.405 -10.514 6.139 610 HA THR 86 HA THR 86 -8.242 -8.972 3.820 611 HB THR 86 HB THR 86 -6.304 -11.252 3.663 612 HG1 THR 86 HG1 THR 86 -4.702 -9.501 4.190 613 HG21 THR 86 3HG2 THR 86 -5.939 -10.400 1.638 614 HG22 THR 86 1HG2 THR 86 -5.517 -8.840 2.343 615 HG23 THR 86 2HG2 THR 86 -7.195 -9.199 1.936 616 H ILE 87 H ILE 87 -10.056 -9.593 2.839 617 HA ILE 87 HA ILE 87 -10.746 -12.437 2.741 618 HB ILE 87 HB ILE 87 -12.386 -10.008 2.012 619 HG12 ILE 87 1HG1 ILE 87 -12.990 -11.882 4.268 620 HG13 ILE 87 2HG1 ILE 87 -11.772 -10.632 4.492 621 HG21 ILE 87 1HG2 ILE 87 -14.240 -11.842 2.158 622 HG22 ILE 87 2HG2 ILE 87 -13.308 -11.637 0.676 623 HG23 ILE 87 3HG2 ILE 87 -12.906 -12.937 1.797 624 HD11 ILE 87 3HD1 ILE 87 -14.225 -9.609 3.326 625 HD12 ILE 87 1HD1 ILE 87 -14.471 -10.362 4.901 626 HD13 ILE 87 2HD1 ILE 87 -13.309 -9.046 4.724 627 HA PRO 88 HA PRO 88 -9.081 -12.395 -1.426 628 HB2 PRO 88 1HB PRO 88 -9.346 -15.070 -1.809 629 HB3 PRO 88 2HB PRO 88 -8.021 -14.359 -0.880 630 HG2 PRO 88 1HG PRO 88 -10.559 -15.611 0.095 631 HG3 PRO 88 2HG PRO 88 -8.909 -15.797 0.717 632 HD2 PRO 88 1HD PRO 88 -10.729 -14.167 1.882 633 HD3 PRO 88 2HD PRO 88 -8.989 -13.811 1.884 634 HA PRO 89 HA PRO 89 -12.599 -12.535 -4.061 635 HB2 PRO 89 1HB PRO 89 -11.666 -13.776 -6.288 636 HB3 PRO 89 2HB PRO 89 -11.196 -12.133 -5.835 637 HG2 PRO 89 1HG PRO 89 -9.723 -14.707 -5.423 638 HG3 PRO 89 2HG PRO 89 -9.101 -13.135 -5.959 639 HD2 PRO 89 1HD PRO 89 -8.833 -14.017 -3.413 640 HD3 PRO 89 2HD PRO 89 -9.014 -12.297 -3.814 641 H GLN 90 H GLN 90 -10.913 -15.629 -3.728 642 HA GLN 90 HA GLN 90 -13.007 -17.253 -4.709 643 HB2 GLN 90 1HB GLN 90 -11.802 -19.087 -3.468 644 HB3 GLN 90 2HB GLN 90 -10.821 -18.189 -4.618 645 HG2 GLN 90 1HG GLN 90 -9.508 -17.293 -3.015 646 HG3 GLN 90 2HG GLN 90 -10.814 -17.211 -1.834 647 HE21 GLN 90 2HE2 GLN 90 -8.024 -18.244 -1.695 648 HE22 GLN 90 1HE2 GLN 90 -8.176 -19.856 -1.093 649 H LEU 91 H LEU 91 -12.752 -15.451 -1.881 650 HA LEU 91 HA LEU 91 -14.936 -16.998 -0.653 651 HB2 LEU 91 1HB LEU 91 -12.477 -15.842 0.581 652 HB3 LEU 91 2HB LEU 91 -13.956 -15.943 1.533 653 HG LEU 91 HG LEU 91 -13.914 -18.453 0.834 654 HD11 LEU 91 1HD1 LEU 91 -12.197 -18.591 -0.719 655 HD12 LEU 91 2HD1 LEU 91 -11.437 -19.168 0.764 656 HD13 LEU 91 3HD1 LEU 91 -11.139 -17.522 0.204 657 HD21 LEU 91 3HD2 LEU 91 -12.522 -16.979 2.964 658 HD22 LEU 91 1HD2 LEU 91 -11.993 -18.645 2.730 659 HD23 LEU 91 2HD2 LEU 91 -13.689 -18.298 3.067 660 H GLY 92 H GLY 92 -14.411 -14.350 -2.309 661 HA2 GLY 92 1HA GLY 92 -16.487 -12.860 -0.876 662 HA3 GLY 92 2HA GLY 92 -14.982 -12.028 -1.237 663 H TYR 93 H TYR 93 -14.663 -11.188 -3.232 664 HA TYR 93 HA TYR 93 -16.905 -10.849 -4.928 665 HB2 TYR 93 1HB TYR 93 -14.034 -10.051 -5.005 666 HB3 TYR 93 2HB TYR 93 -14.949 -9.979 -6.507 667 HD1 TYR 93 HD2 TYR 93 -16.466 -9.350 -3.214 668 HD2 TYR 93 HD1 TYR 93 -14.839 -7.589 -6.729 669 HE1 TYR 93 HE2 TYR 93 -17.390 -7.172 -2.543 670 HE2 TYR 93 HE1 TYR 93 -15.757 -5.405 -6.066 671 HH TYR 93 HH TYR 93 -17.227 -4.904 -2.934 672 H GLY 94 H GLY 94 -13.758 -12.382 -5.651 673 HA2 GLY 94 1HA GLY 94 -13.602 -14.584 -6.599 674 HA3 GLY 94 2HA GLY 94 -15.201 -14.356 -7.291 675 H ALA 95 H ALA 95 -14.170 -15.102 -9.278 676 HA ALA 95 HA ALA 95 -12.253 -13.334 -10.538 677 HB1 ALA 95 1HB ALA 95 -11.726 -15.151 -11.695 678 HB2 ALA 95 2HB ALA 95 -12.985 -16.036 -10.833 679 HB3 ALA 95 3HB ALA 95 -13.356 -15.239 -12.362 680 H ARG 96 H ARG 96 -15.415 -13.010 -9.992 681 HA ARG 96 HA ARG 96 -16.466 -12.380 -12.556 682 HB2 ARG 96 1HB ARG 96 -17.984 -12.918 -10.774 683 HB3 ARG 96 2HB ARG 96 -17.348 -11.621 -9.771 684 HG2 ARG 96 1HG ARG 96 -19.503 -11.017 -10.700 685 HG3 ARG 96 2HG ARG 96 -18.234 -9.971 -11.340 686 HD2 ARG 96 1HD ARG 96 -19.787 -10.664 -13.094 687 HD3 ARG 96 2HD ARG 96 -18.165 -11.288 -13.388 688 HE ARG 96 HE ARG 96 -18.991 -13.410 -13.195 689 HH11 ARG 96 1HH1 ARG 96 -21.280 -11.175 -11.821 690 HH12 ARG 96 2HH1 ARG 96 -22.507 -12.375 -11.584 691 HH21 ARG 96 1HH2 ARG 96 -20.599 -14.999 -12.888 692 HH22 ARG 96 2HH2 ARG 96 -22.118 -14.550 -12.191 693 H GLY 97 H GLY 97 -14.543 -10.649 -10.252 694 HA2 GLY 97 1HA GLY 97 -13.435 -8.639 -10.485 695 HA3 GLY 97 2HA GLY 97 -14.090 -8.520 -12.112 696 H ALA 98 H ALA 98 -13.998 -6.204 -10.986 697 HA ALA 98 HA ALA 98 -16.781 -5.611 -10.320 698 HB1 ALA 98 1HB ALA 98 -16.416 -4.676 -8.293 699 HB2 ALA 98 2HB ALA 98 -15.068 -5.814 -8.272 700 HB3 ALA 98 3HB ALA 98 -14.793 -4.129 -8.713 701 H GLY 99 H GLY 99 -13.641 -3.907 -10.483 702 HA2 GLY 99 1HA GLY 99 -14.865 -2.106 -12.482 703 HA3 GLY 99 2HA GLY 99 -13.830 -1.508 -11.193 704 H GLY 100 H GLY 100 -12.427 -0.576 -12.743 705 HA2 GLY 100 1HA GLY 100 -11.123 -2.255 -14.694 706 HA3 GLY 100 2HA GLY 100 -10.767 -0.566 -14.363 707 H VAL 101 H VAL 101 -10.229 -0.766 -11.608 708 HA VAL 101 HA VAL 101 -7.592 -2.014 -11.737 709 HB VAL 101 HB VAL 101 -7.101 -0.765 -9.682 710 HG11 VAL 101 1HG1 VAL 101 -8.361 1.266 -11.452 711 HG12 VAL 101 2HG1 VAL 101 -6.747 1.232 -10.740 712 HG13 VAL 101 3HG1 VAL 101 -7.120 0.215 -12.132 713 HG21 VAL 101 3HG2 VAL 101 -9.247 1.041 -9.526 714 HG22 VAL 101 1HG2 VAL 101 -9.958 -0.572 -9.561 715 HG23 VAL 101 2HG2 VAL 101 -8.761 -0.163 -8.333 716 H ILE 102 H ILE 102 -9.757 -3.800 -11.551 717 HA ILE 102 HA ILE 102 -9.063 -5.131 -9.057 718 HB ILE 102 HB ILE 102 -11.934 -4.574 -9.813 719 HG12 ILE 102 1HG1 ILE 102 -10.289 -3.680 -7.435 720 HG13 ILE 102 2HG1 ILE 102 -10.816 -2.656 -8.765 721 HG21 ILE 102 1HG2 ILE 102 -12.497 -6.366 -8.636 722 HG22 ILE 102 2HG2 ILE 102 -10.794 -6.728 -8.361 723 HG23 ILE 102 3HG2 ILE 102 -11.672 -5.704 -7.225 724 HD11 ILE 102 3HD1 ILE 102 -12.144 -3.175 -6.357 725 HD12 ILE 102 1HD1 ILE 102 -12.730 -2.253 -7.741 726 HD13 ILE 102 2HD1 ILE 102 -13.076 -3.978 -7.620 727 HA PRO 103 HA PRO 103 -9.162 -8.061 -12.575 728 HB2 PRO 103 1HB PRO 103 -7.128 -9.586 -11.624 729 HB3 PRO 103 2HB PRO 103 -6.865 -8.112 -12.563 730 HG2 PRO 103 1HG PRO 103 -6.759 -8.514 -9.598 731 HG3 PRO 103 2HG PRO 103 -5.664 -7.589 -10.642 732 HD2 PRO 103 1HD PRO 103 -7.603 -6.414 -9.161 733 HD3 PRO 103 2HD PRO 103 -7.080 -5.772 -10.732 734 HA PRO 104 HA PRO 104 -11.413 -11.352 -10.723 735 HB2 PRO 104 1HB PRO 104 -10.586 -13.517 -12.138 736 HB3 PRO 104 2HB PRO 104 -11.634 -12.267 -12.819 737 HG2 PRO 104 1HG PRO 104 -8.677 -12.629 -13.116 738 HG3 PRO 104 2HG PRO 104 -9.881 -12.204 -14.346 739 HD2 PRO 104 1HD PRO 104 -8.282 -10.360 -13.174 740 HD3 PRO 104 2HD PRO 104 -9.933 -9.989 -13.710 741 H ASN 105 H ASN 105 -8.023 -11.271 -10.518 742 HA ASN 105 HA ASN 105 -8.024 -13.470 -8.557 743 HB2 ASN 105 1HB ASN 105 -5.825 -14.004 -9.127 744 HB3 ASN 105 2HB ASN 105 -6.538 -13.594 -10.685 745 HD21 ASN 105 2HD2 ASN 105 -6.201 -11.382 -11.452 746 HD22 ASN 105 1HD2 ASN 105 -4.709 -10.596 -11.077 747 H ALA 106 H ALA 106 -8.453 -10.370 -8.494 748 HA ALA 106 HA ALA 106 -6.353 -9.468 -6.745 749 HB1 ALA 106 1HB ALA 106 -8.348 -8.246 -8.298 750 HB2 ALA 106 2HB ALA 106 -8.684 -7.805 -6.623 751 HB3 ALA 106 3HB ALA 106 -7.103 -7.462 -7.325 752 H THR 107 H THR 107 -6.721 -8.711 -4.556 753 HA THR 107 HA THR 107 -8.786 -10.284 -3.157 754 HB THR 107 HB THR 107 -6.048 -9.517 -2.125 755 HG1 THR 107 HG1 THR 107 -5.662 -11.771 -2.290 756 HG21 THR 107 3HG2 THR 107 -7.118 -9.701 -0.143 757 HG22 THR 107 1HG2 THR 107 -6.975 -11.432 -0.448 758 HG23 THR 107 2HG2 THR 107 -8.473 -10.588 -0.839 759 H LEU 108 H LEU 108 -9.846 -9.337 -1.405 760 HA LEU 108 HA LEU 108 -9.588 -6.406 -1.262 761 HB2 LEU 108 1HB LEU 108 -12.002 -8.068 -0.569 762 HB3 LEU 108 2HB LEU 108 -11.913 -6.311 -0.663 763 HG LEU 108 HG LEU 108 -11.707 -8.233 -2.980 764 HD11 LEU 108 1HD1 LEU 108 -13.937 -8.202 -2.781 765 HD12 LEU 108 2HD1 LEU 108 -13.815 -6.577 -3.454 766 HD13 LEU 108 3HD1 LEU 108 -13.922 -6.801 -1.709 767 HD21 LEU 108 3HD2 LEU 108 -10.341 -6.408 -3.542 768 HD22 LEU 108 1HD2 LEU 108 -11.438 -5.247 -2.793 769 HD23 LEU 108 2HD2 LEU 108 -11.900 -6.057 -4.290 770 H VAL 109 H VAL 109 -8.974 -5.532 0.604 771 HA VAL 109 HA VAL 109 -8.848 -7.258 2.975 772 HB VAL 109 HB VAL 109 -7.487 -4.591 2.629 773 HG11 VAL 109 1HG1 VAL 109 -7.390 -6.801 4.619 774 HG12 VAL 109 2HG1 VAL 109 -5.914 -5.888 4.297 775 HG13 VAL 109 3HG1 VAL 109 -7.361 -5.056 4.867 776 HG21 VAL 109 3HG2 VAL 109 -6.291 -5.593 1.011 777 HG22 VAL 109 1HG2 VAL 109 -5.501 -6.427 2.349 778 HG23 VAL 109 2HG2 VAL 109 -6.821 -7.208 1.480 779 H PHE 110 H PHE 110 -10.452 -7.039 4.378 780 HA PHE 110 HA PHE 110 -11.640 -4.368 4.749 781 HB2 PHE 110 1HB PHE 110 -12.857 -7.096 4.671 782 HB3 PHE 110 2HB PHE 110 -13.594 -5.874 5.702 783 HD1 PHE 110 HD2 PHE 110 -12.323 -6.253 2.215 784 HD2 PHE 110 HD1 PHE 110 -15.253 -4.571 4.803 785 HE1 PHE 110 HE2 PHE 110 -13.512 -5.336 0.267 786 HE2 PHE 110 HE1 PHE 110 -16.447 -3.651 2.859 787 HZ PHE 110 HZ PHE 110 -15.576 -4.032 0.587 788 H GLU 111 H GLU 111 -11.953 -3.604 6.812 789 HA GLU 111 HA GLU 111 -10.517 -5.061 8.913 790 HB2 GLU 111 1HB GLU 111 -10.176 -2.522 8.161 791 HB3 GLU 111 2HB GLU 111 -11.466 -2.273 9.330 792 HG2 GLU 111 1HG GLU 111 -9.050 -3.870 10.063 793 HG3 GLU 111 2HG GLU 111 -9.006 -2.108 10.094 794 H VAL 112 H VAL 112 -11.561 -5.975 10.555 795 HA VAL 112 HA VAL 112 -14.406 -5.307 10.937 796 HB VAL 112 HB VAL 112 -13.124 -7.861 11.872 797 HG11 VAL 112 1HG1 VAL 112 -15.237 -8.591 12.294 798 HG12 VAL 112 2HG1 VAL 112 -15.506 -6.859 12.504 799 HG13 VAL 112 3HG1 VAL 112 -15.945 -7.643 10.986 800 HG21 VAL 112 3HG2 VAL 112 -14.369 -7.326 9.176 801 HG22 VAL 112 1HG2 VAL 112 -12.686 -7.747 9.496 802 HG23 VAL 112 2HG2 VAL 112 -13.964 -8.923 9.805 803 H GLU 113 H GLU 113 -14.961 -4.361 12.782 804 HA GLU 113 HA GLU 113 -13.306 -4.799 15.167 805 HB2 GLU 113 1HB GLU 113 -13.594 -2.374 15.733 806 HB3 GLU 113 2HB GLU 113 -12.559 -2.681 14.346 807 HG2 GLU 113 1HG GLU 113 -15.250 -2.353 13.455 808 HG3 GLU 113 2HG GLU 113 -14.809 -1.004 14.500 809 H LEU 114 H LEU 114 -14.610 -5.778 16.565 810 HA LEU 114 HA LEU 114 -17.456 -5.454 16.510 811 HB2 LEU 114 1HB LEU 114 -15.829 -7.437 17.328 812 HB3 LEU 114 2HB LEU 114 -16.183 -6.673 18.877 813 HG LEU 114 HG LEU 114 -18.324 -7.613 16.978 814 HD11 LEU 114 1HD1 LEU 114 -16.576 -9.319 18.101 815 HD12 LEU 114 2HD1 LEU 114 -18.274 -9.703 17.821 816 HD13 LEU 114 3HD1 LEU 114 -17.743 -9.166 19.415 817 HD21 LEU 114 3HD2 LEU 114 -19.264 -7.701 19.557 818 HD22 LEU 114 1HD2 LEU 114 -19.571 -6.414 18.390 819 HD23 LEU 114 2HD2 LEU 114 -18.257 -6.252 19.555 820 H LEU 115 H LEU 115 -18.601 -3.930 17.488 821 HA LEU 115 HA LEU 115 -17.308 -2.154 19.388 822 HB2 LEU 115 1HB LEU 115 -19.909 -2.113 17.903 823 HB3 LEU 115 2HB LEU 115 -19.617 -1.011 19.247 824 HG LEU 115 HG LEU 115 -17.415 -0.553 17.741 825 HD11 LEU 115 1HD1 LEU 115 -19.624 -1.372 15.878 826 HD12 LEU 115 2HD1 LEU 115 -17.949 -1.921 15.902 827 HD13 LEU 115 3HD1 LEU 115 -18.330 -0.276 15.395 828 HD21 LEU 115 3HD2 LEU 115 -18.633 1.448 16.919 829 HD22 LEU 115 1HD2 LEU 115 -18.823 1.168 18.650 830 HD23 LEU 115 2HD2 LEU 115 -20.128 0.747 17.540 831 H ASP 116 H ASP 116 -20.292 -4.100 19.275 832 HA ASP 116 HA ASP 116 -19.985 -5.040 21.930 833 HB2 ASP 116 1HB ASP 116 -20.618 -2.815 22.602 834 HB3 ASP 116 2HB ASP 116 -21.981 -2.814 21.487 835 H VAL 117 H VAL 117 -21.515 -6.616 22.477 836 HA VAL 117 HA VAL 117 -22.984 -7.666 20.197 837 HB VAL 117 HB VAL 117 -23.383 -9.639 21.670 838 HG11 VAL 117 1HG1 VAL 117 -20.760 -8.651 20.783 839 HG12 VAL 117 2HG1 VAL 117 -20.711 -9.982 21.941 840 HG13 VAL 117 3HG1 VAL 117 -21.586 -10.166 20.420 841 HG21 VAL 117 3HG2 VAL 117 -22.705 -7.857 23.706 842 HG22 VAL 117 1HG2 VAL 117 -23.000 -9.589 23.862 843 HG23 VAL 117 2HG2 VAL 117 -21.358 -8.992 23.623 844 H13 JZF 130 1H3 JZF 130 -20.708 -2.820 0.161 845 H23 JZF 130 2H3 JZF 130 -20.616 -3.991 -1.142 846 H4 JZF 130 H4 JZF 130 -18.531 -3.463 1.006 847 H15 JZF 130 1H5 JZF 130 -17.111 -5.122 -0.070 848 H25 JZF 130 2H5 JZF 130 -18.325 -5.451 -1.296 849 H17 JZF 130 1H7 JZF 130 -17.986 -1.709 -0.265 850 H27 JZF 130 2H7 JZF 130 -17.110 -2.919 -1.147 851 H8 JZF 130 H8 JZF 130 -19.497 -2.917 -2.446 852 H9 JZF 130 H9 JZF 130 -16.987 -2.714 -3.324 853 H1OH JZF 130 1HO JZF 130 -19.026 -0.319 -1.493 854 H11 JZF 130 H11 JZF 130 -16.849 -3.286 -5.847 855 H112 JZF 130 1H12 JZF 130 -17.939 -0.519 -6.571 856 H212 JZF 130 2H12 JZF 130 -16.432 -1.212 -7.151 857 H13A JZF 130 H13 JZF 130 -16.183 0.472 -5.287 858 H114 JZF 130 1H14 JZF 130 -16.769 -0.195 -2.987 859 H214 JZF 130 2H14 JZF 130 -18.158 0.039 -4.017 860 H115 JZF 130 1H15 JZF 130 -21.523 -6.599 2.553 861 H215 JZF 130 2H15 JZF 130 -19.988 -7.468 2.594 862 H116 JZF 130 1H16 JZF 130 -21.408 -7.255 -2.035 863 H216 JZF 130 2H16 JZF 130 -19.994 -7.670 -1.020 864 H117 JZF 130 2H17 JZF 130 -21.929 -9.492 -2.453 865 H217 JZF 130 3H17 JZF 130 -20.203 -9.728 -2.117 866 H317 JZF 130 1H17 JZF 130 -21.402 -10.019 -0.845 867 H118 JZF 130 1H18 JZF 130 -18.258 -2.468 -8.121 868 H218 JZF 130 2H18 JZF 130 -18.161 -4.122 -7.506 869 H318 JZF 130 3H18 JZF 130 -19.535 -3.094 -7.067 870 H119 JZF 130 3H19 JZF 130 -15.079 -2.034 -4.051 871 H219 JZF 130 1H19 JZF 130 -14.650 -1.716 -5.735 872 H319 JZF 130 2H19 JZF 130 -14.279 -0.521 -4.492 Start of MODEL 6 1 H1 GLY 1 H GLY 1 10.657 -10.171 16.288 2 HA2 GLY 1 1HA GLY 1 10.035 -9.214 13.744 3 HA3 GLY 1 2HA GLY 1 9.864 -10.962 13.691 4 HA PRO 2 HA PRO 2 6.623 -9.278 16.888 5 HB2 PRO 2 1HB PRO 2 6.136 -6.610 16.763 6 HB3 PRO 2 2HB PRO 2 7.351 -7.316 17.835 7 HG2 PRO 2 1HG PRO 2 7.711 -6.007 15.167 8 HG3 PRO 2 2HG PRO 2 8.680 -5.828 16.641 9 HD2 PRO 2 1HD PRO 2 9.444 -7.407 14.578 10 HD3 PRO 2 2HD PRO 2 9.840 -7.784 16.267 11 H GLY 3 H GLY 3 6.789 -7.248 13.952 12 HA2 GLY 3 1HA GLY 3 5.124 -8.289 12.231 13 HA3 GLY 3 2HA GLY 3 3.953 -7.812 13.452 14 H SER 4 H SER 4 6.855 -6.175 12.207 15 HA SER 4 HA SER 4 5.525 -3.656 12.115 16 HB2 SER 4 1HB SER 4 8.123 -4.342 10.736 17 HB3 SER 4 2HB SER 4 7.591 -2.766 11.323 18 HG SER 4 HG SER 4 8.713 -4.890 12.697 19 H MET 5 H MET 5 3.814 -3.609 10.736 20 HA MET 5 HA MET 5 2.676 -3.435 8.775 21 HB2 MET 5 1HB MET 5 5.404 -3.303 7.483 22 HB3 MET 5 2HB MET 5 3.885 -2.744 6.795 23 HG2 MET 5 1HG MET 5 3.721 -1.013 8.469 24 HG3 MET 5 2HG MET 5 5.176 -1.609 9.264 25 HE1 MET 5 3HE MET 5 6.724 0.291 9.273 26 HE2 MET 5 1HE MET 5 6.955 1.452 7.966 27 HE3 MET 5 2HE MET 5 5.403 1.360 8.798 28 H THR 6 H THR 6 3.366 -6.043 9.798 29 HA THR 6 HA THR 6 3.513 -7.589 7.293 30 HB THR 6 HB THR 6 4.033 -8.763 10.013 31 HG1 THR 6 HG1 THR 6 6.116 -7.865 8.326 32 HG21 THR 6 3HG2 THR 6 5.444 -10.307 8.617 33 HG22 THR 6 1HG2 THR 6 4.775 -9.518 7.189 34 HG23 THR 6 2HG2 THR 6 3.712 -10.390 8.294 35 H VAL 7 H VAL 7 1.927 -9.027 6.811 36 HA VAL 7 HA VAL 7 -0.326 -9.199 8.707 37 HB VAL 7 HB VAL 7 -0.498 -9.475 5.706 38 HG11 VAL 7 1HG1 VAL 7 -2.704 -9.851 5.954 39 HG12 VAL 7 2HG1 VAL 7 -2.237 -10.367 7.576 40 HG13 VAL 7 3HG1 VAL 7 -2.848 -8.734 7.311 41 HG21 VAL 7 3HG2 VAL 7 -1.700 -7.193 5.992 42 HG22 VAL 7 1HG2 VAL 7 -0.766 -7.084 7.484 43 HG23 VAL 7 2HG2 VAL 7 0.062 -7.237 5.935 44 H VAL 8 H VAL 8 -0.831 -11.150 9.451 45 HA VAL 8 HA VAL 8 0.634 -13.462 8.617 46 HB VAL 8 HB VAL 8 -1.757 -13.352 10.458 47 HG11 VAL 8 1HG1 VAL 8 0.457 -15.379 10.162 48 HG12 VAL 8 2HG1 VAL 8 -0.813 -15.419 11.386 49 HG13 VAL 8 3HG1 VAL 8 -1.226 -15.592 9.680 50 HG21 VAL 8 3HG2 VAL 8 -0.467 -12.170 11.839 51 HG22 VAL 8 1HG2 VAL 8 0.546 -13.606 11.988 52 HG23 VAL 8 2HG2 VAL 8 0.944 -12.366 10.799 53 H THR 9 H THR 9 0.084 -14.990 7.196 54 HA THR 9 HA THR 9 -2.589 -14.838 5.979 55 HB THR 9 HB THR 9 -0.346 -16.368 4.723 56 HG1 THR 9 HG1 THR 9 -0.499 -13.597 5.056 57 HG21 THR 9 3HG2 THR 9 -1.766 -14.839 2.860 58 HG22 THR 9 1HG2 THR 9 -2.977 -15.429 3.998 59 HG23 THR 9 2HG2 THR 9 -1.924 -16.569 3.159 60 H THR 10 H THR 10 -3.521 -16.906 5.227 61 HA THR 10 HA THR 10 -2.963 -19.051 7.167 62 HB THR 10 HB THR 10 -5.273 -19.783 6.880 63 HG1 THR 10 HG1 THR 10 -5.260 -17.766 4.911 64 HG21 THR 10 3HG2 THR 10 -5.882 -16.975 7.327 65 HG22 THR 10 1HG2 THR 10 -4.442 -17.496 8.201 66 HG23 THR 10 2HG2 THR 10 -5.972 -18.339 8.440 67 H GLU 11 H GLU 11 -4.144 -21.187 6.131 68 HA GLU 11 HA GLU 11 -2.398 -21.923 3.984 69 HB2 GLU 11 1HB GLU 11 -4.662 -23.434 5.299 70 HB3 GLU 11 2HB GLU 11 -3.535 -24.125 4.140 71 HG2 GLU 11 1HG GLU 11 -2.558 -22.844 6.660 72 HG3 GLU 11 2HG GLU 11 -3.128 -24.511 6.644 73 H SER 12 H SER 12 -5.753 -21.006 4.285 74 HA SER 12 HA SER 12 -6.481 -21.858 1.638 75 HB2 SER 12 1HB SER 12 -7.972 -19.925 3.423 76 HB3 SER 12 2HB SER 12 -8.628 -20.878 2.092 77 HG SER 12 HG SER 12 -8.471 -22.693 3.296 78 H GLY 13 H GLY 13 -5.612 -18.803 3.191 79 HA2 GLY 13 1HA GLY 13 -4.251 -17.492 1.376 80 HA3 GLY 13 2HA GLY 13 -5.836 -17.414 0.620 81 H LEU 14 H LEU 14 -7.315 -17.143 3.077 82 HA LEU 14 HA LEU 14 -7.422 -14.381 3.314 83 HB2 LEU 14 1HB LEU 14 -9.268 -15.737 3.998 84 HB3 LEU 14 2HB LEU 14 -8.289 -16.541 5.223 85 HG LEU 14 HG LEU 14 -8.539 -13.627 5.543 86 HD11 LEU 14 1HD1 LEU 14 -10.767 -13.508 6.112 87 HD12 LEU 14 2HD1 LEU 14 -10.919 -15.252 6.322 88 HD13 LEU 14 3HD1 LEU 14 -10.816 -14.565 4.701 89 HD21 LEU 14 3HD2 LEU 14 -7.516 -14.596 7.342 90 HD22 LEU 14 1HD2 LEU 14 -8.453 -16.085 7.216 91 HD23 LEU 14 2HD2 LEU 14 -9.192 -14.632 7.891 92 H LYS 15 H LYS 15 -6.758 -12.928 4.932 93 HA LYS 15 HA LYS 15 -4.569 -13.873 6.659 94 HB2 LYS 15 1HB LYS 15 -4.615 -11.264 5.131 95 HB3 LYS 15 2HB LYS 15 -3.339 -11.808 6.213 96 HG2 LYS 15 1HG LYS 15 -2.495 -13.286 4.704 97 HG3 LYS 15 2HG LYS 15 -4.059 -13.563 3.932 98 HD2 LYS 15 1HD LYS 15 -3.036 -12.331 2.301 99 HD3 LYS 15 2HD LYS 15 -3.765 -11.028 3.241 100 HE2 LYS 15 1HE LYS 15 -1.631 -10.233 3.051 101 HE3 LYS 15 2HE LYS 15 -1.480 -11.153 4.548 102 HZ1 LYS 15 3HZ LYS 15 -0.076 -11.496 2.143 103 HZ2 LYS 15 1HZ LYS 15 -0.989 -12.893 2.422 104 HZ3 LYS 15 2HZ LYS 15 0.101 -12.347 3.594 105 H TYR 16 H TYR 16 -4.107 -12.391 8.482 106 HA TYR 16 HA TYR 16 -6.274 -10.606 9.245 107 HB2 TYR 16 1HB TYR 16 -6.826 -11.714 11.274 108 HB3 TYR 16 2HB TYR 16 -6.868 -12.949 10.021 109 HD1 TYR 16 HD2 TYR 16 -4.608 -14.274 9.702 110 HD2 TYR 16 HD1 TYR 16 -5.687 -12.163 13.235 111 HE1 TYR 16 HE2 TYR 16 -3.031 -15.648 10.997 112 HE2 TYR 16 HE1 TYR 16 -4.112 -13.530 14.540 113 HH TYR 16 HH TYR 16 -3.016 -15.725 14.388 114 H GLU 17 H GLU 17 -5.623 -8.974 10.560 115 HA GLU 17 HA GLU 17 -2.980 -9.151 11.815 116 HB2 GLU 17 1HB GLU 17 -3.392 -7.769 9.450 117 HB3 GLU 17 2HB GLU 17 -3.498 -6.515 10.677 118 HG2 GLU 17 1HG GLU 17 -1.208 -8.436 10.328 119 HG3 GLU 17 2HG GLU 17 -1.233 -6.753 9.805 120 H ASP 18 H ASP 18 -3.190 -8.680 13.889 121 HA ASP 18 HA ASP 18 -5.504 -7.623 15.058 122 HB2 ASP 18 1HB ASP 18 -3.499 -8.964 16.090 123 HB3 ASP 18 2HB ASP 18 -2.843 -7.361 16.408 124 H LEU 19 H LEU 19 -6.102 -5.607 15.718 125 HA LEU 19 HA LEU 19 -4.305 -3.385 15.004 126 HB2 LEU 19 1HB LEU 19 -7.205 -3.795 14.444 127 HB3 LEU 19 2HB LEU 19 -6.602 -2.158 14.695 128 HG LEU 19 HG LEU 19 -5.560 -4.053 12.592 129 HD11 LEU 19 1HD1 LEU 19 -6.860 -1.907 11.384 130 HD12 LEU 19 2HD1 LEU 19 -7.952 -2.446 12.659 131 HD13 LEU 19 3HD1 LEU 19 -7.395 -3.586 11.434 132 HD21 LEU 19 3HD2 LEU 19 -3.852 -2.561 12.859 133 HD22 LEU 19 1HD2 LEU 19 -4.914 -1.275 13.433 134 HD23 LEU 19 2HD2 LEU 19 -4.853 -1.667 11.714 135 H THR 20 H THR 20 -6.817 -4.588 17.148 136 HA THR 20 HA THR 20 -5.776 -3.028 19.327 137 HB THR 20 HB THR 20 -8.679 -2.535 18.746 138 HG1 THR 20 HG1 THR 20 -6.636 -0.730 17.965 139 HG21 THR 20 3HG2 THR 20 -7.874 -0.347 19.974 140 HG22 THR 20 1HG2 THR 20 -6.564 -1.396 20.514 141 HG23 THR 20 2HG2 THR 20 -8.237 -1.814 20.885 142 H GLU 21 H GLU 21 -5.797 -4.378 20.990 143 HA GLU 21 HA GLU 21 -7.050 -6.838 21.079 144 HB2 GLU 21 1HB GLU 21 -5.958 -5.031 23.208 145 HB3 GLU 21 2HB GLU 21 -6.773 -6.523 23.656 146 HG2 GLU 21 1HG GLU 21 -4.514 -7.082 23.591 147 HG3 GLU 21 2HG GLU 21 -5.162 -7.688 22.068 148 H GLY 22 H GLY 22 -8.763 -7.605 22.541 149 HA2 GLY 22 1HA GLY 22 -10.702 -5.755 23.554 150 HA3 GLY 22 2HA GLY 22 -11.222 -6.493 22.047 151 H SER 23 H SER 23 -10.238 -7.166 25.365 152 HA SER 23 HA SER 23 -10.977 -9.932 25.249 153 HB2 SER 23 1HB SER 23 -10.732 -8.384 27.812 154 HB3 SER 23 2HB SER 23 -10.301 -10.062 27.484 155 HG SER 23 HG SER 23 -8.491 -8.587 27.651 156 H GLY 24 H GLY 24 -13.139 -9.641 24.361 157 HA2 GLY 24 1HA GLY 24 -15.098 -8.913 26.451 158 HA3 GLY 24 2HA GLY 24 -15.369 -8.622 24.740 159 H ALA 25 H ALA 25 -16.423 -10.125 23.603 160 HA ALA 25 HA ALA 25 -16.442 -12.894 24.531 161 HB1 ALA 25 1HB ALA 25 -18.835 -13.075 24.528 162 HB2 ALA 25 2HB ALA 25 -18.373 -11.753 25.601 163 HB3 ALA 25 3HB ALA 25 -19.005 -11.403 23.992 164 H GLU 26 H GLU 26 -16.482 -14.343 22.902 165 HA GLU 26 HA GLU 26 -16.153 -13.420 20.228 166 HB2 GLU 26 1HB GLU 26 -14.992 -15.410 21.051 167 HB3 GLU 26 2HB GLU 26 -16.531 -16.223 21.296 168 HG2 GLU 26 1HG GLU 26 -16.951 -16.284 18.946 169 HG3 GLU 26 2HG GLU 26 -15.547 -15.270 18.619 170 H ALA 27 H ALA 27 -17.598 -13.190 18.640 171 HA ALA 27 HA ALA 27 -20.355 -13.208 19.128 172 HB1 ALA 27 1HB ALA 27 -20.368 -12.074 17.222 173 HB2 ALA 27 2HB ALA 27 -18.648 -12.420 17.035 174 HB3 ALA 27 3HB ALA 27 -19.847 -13.503 16.328 175 H ARG 28 H ARG 28 -22.017 -14.524 18.156 176 HA ARG 28 HA ARG 28 -21.190 -17.223 17.369 177 HB2 ARG 28 1HB ARG 28 -22.184 -16.619 19.916 178 HB3 ARG 28 2HB ARG 28 -23.545 -17.319 19.050 179 HG2 ARG 28 1HG ARG 28 -20.831 -18.578 19.395 180 HG3 ARG 28 2HG ARG 28 -22.305 -19.019 20.261 181 HD2 ARG 28 1HD ARG 28 -23.231 -19.295 17.797 182 HD3 ARG 28 2HD ARG 28 -21.522 -19.540 17.441 183 HE ARG 28 HE ARG 28 -23.278 -21.349 18.798 184 HH11 ARG 28 1HH1 ARG 28 -19.967 -20.326 18.464 185 HH12 ARG 28 2HH1 ARG 28 -19.309 -21.844 18.980 186 HH21 ARG 28 1HH2 ARG 28 -22.424 -23.351 19.480 187 HH22 ARG 28 2HH2 ARG 28 -20.708 -23.564 19.557 188 H ALA 29 H ALA 29 -22.495 -18.189 15.878 189 HA ALA 29 HA ALA 29 -24.139 -16.608 14.265 190 HB1 ALA 29 1HB ALA 29 -24.252 -19.612 14.452 191 HB2 ALA 29 2HB ALA 29 -24.667 -18.601 13.068 192 HB3 ALA 29 3HB ALA 29 -22.989 -18.728 13.594 193 H GLY 30 H GLY 30 -26.119 -15.851 14.596 194 HA2 GLY 30 1HA GLY 30 -28.477 -16.469 14.939 195 HA3 GLY 30 2HA GLY 30 -27.940 -17.419 16.316 196 H GLN 31 H GLN 31 -26.002 -15.113 16.901 197 HA GLN 31 HA GLN 31 -27.949 -13.545 18.433 198 HB2 GLN 31 1HB GLN 31 -26.351 -13.243 20.054 199 HB3 GLN 31 2HB GLN 31 -25.848 -14.801 19.411 200 HG2 GLN 31 1HG GLN 31 -24.197 -13.652 17.991 201 HG3 GLN 31 2HG GLN 31 -24.671 -12.119 18.720 202 HE21 GLN 31 2HE2 GLN 31 -23.912 -11.577 20.703 203 HE22 GLN 31 1HE2 GLN 31 -22.777 -12.527 21.593 204 H THR 32 H THR 32 -27.925 -11.295 18.444 205 HA THR 32 HA THR 32 -26.860 -10.102 16.009 206 HB THR 32 HB THR 32 -28.505 -8.627 18.046 207 HG1 THR 32 HG1 THR 32 -30.144 -9.881 17.618 208 HG21 THR 32 3HG2 THR 32 -29.101 -7.233 16.269 209 HG22 THR 32 1HG2 THR 32 -28.647 -8.428 15.055 210 HG23 THR 32 2HG2 THR 32 -27.398 -7.576 15.964 211 H VAL 33 H VAL 33 -25.316 -8.545 15.929 212 HA VAL 33 HA VAL 33 -24.343 -7.330 18.391 213 HB VAL 33 HB VAL 33 -22.042 -7.942 18.055 214 HG11 VAL 33 1HG1 VAL 33 -23.841 -10.360 17.918 215 HG12 VAL 33 2HG1 VAL 33 -22.155 -10.374 18.438 216 HG13 VAL 33 3HG1 VAL 33 -23.360 -9.489 19.374 217 HG21 VAL 33 3HG2 VAL 33 -22.942 -8.583 15.413 218 HG22 VAL 33 1HG2 VAL 33 -21.294 -8.426 16.021 219 HG23 VAL 33 2HG2 VAL 33 -22.124 -9.980 16.114 220 H SER 34 H SER 34 -22.838 -5.558 17.996 221 HA SER 34 HA SER 34 -23.289 -4.344 15.350 222 HB2 SER 34 1HB SER 34 -23.958 -3.331 17.815 223 HB3 SER 34 2HB SER 34 -22.405 -2.555 17.506 224 HG SER 34 HG SER 34 -24.725 -1.851 16.544 225 H VAL 35 H VAL 35 -21.586 -4.039 14.082 226 HA VAL 35 HA VAL 35 -18.946 -3.609 15.260 227 HB VAL 35 HB VAL 35 -17.845 -5.292 14.026 228 HG11 VAL 35 1HG1 VAL 35 -19.279 -5.981 16.045 229 HG12 VAL 35 2HG1 VAL 35 -20.341 -6.734 14.853 230 HG13 VAL 35 3HG1 VAL 35 -18.661 -7.253 14.991 231 HG21 VAL 35 3HG2 VAL 35 -20.375 -5.385 12.458 232 HG22 VAL 35 1HG2 VAL 35 -18.702 -5.347 11.902 233 HG23 VAL 35 2HG2 VAL 35 -19.382 -6.839 12.552 234 H HIS 36 H HIS 36 -17.381 -2.765 13.729 235 HA HIS 36 HA HIS 36 -18.691 -1.297 11.541 236 HB2 HIS 36 1HB HIS 36 -16.643 -0.571 13.529 237 HB3 HIS 36 2HB HIS 36 -16.300 -0.027 11.889 238 HD1 HIS 36 HD1 HIS 36 -18.667 1.136 10.784 239 HD2 HIS 36 HD2 HIS 36 -18.004 1.314 14.882 240 HE1 HIS 36 HE1 HIS 36 -20.092 3.035 11.614 241 H TYR 37 H TYR 37 -18.030 -1.572 9.494 242 HA TYR 37 HA TYR 37 -15.671 -3.281 9.049 243 HB2 TYR 37 1HB TYR 37 -16.729 -4.183 7.112 244 HB3 TYR 37 2HB TYR 37 -17.924 -4.227 8.404 245 HD1 TYR 37 HD1 TYR 37 -19.769 -2.548 8.430 246 HD2 TYR 37 HD2 TYR 37 -17.095 -2.908 5.140 247 HE1 TYR 37 HE1 TYR 37 -21.351 -1.304 7.016 248 HE2 TYR 37 HE2 TYR 37 -18.669 -1.664 3.717 249 HH TYR 37 HH TYR 37 -20.685 -0.737 3.576 250 H THR 38 H THR 38 -14.216 -2.740 7.440 251 HA THR 38 HA THR 38 -14.612 -0.150 6.104 252 HB THR 38 HB THR 38 -11.823 -0.543 6.666 253 HG1 THR 38 HG1 THR 38 -13.246 -0.137 9.055 254 HG21 THR 38 3HG2 THR 38 -12.092 1.685 7.730 255 HG22 THR 38 1HG2 THR 38 -13.836 1.539 7.522 256 HG23 THR 38 2HG2 THR 38 -12.782 1.603 6.110 257 H GLY 39 H GLY 39 -14.116 -0.136 3.991 258 HA2 GLY 39 1HA GLY 39 -13.085 -2.611 2.829 259 HA3 GLY 39 2HA GLY 39 -13.859 -1.296 1.957 260 H TRP 40 H TRP 40 -10.913 -2.716 2.867 261 HA TRP 40 HA TRP 40 -9.432 -0.398 1.809 262 HB2 TRP 40 1HB TRP 40 -8.430 -2.525 3.715 263 HB3 TRP 40 2HB TRP 40 -7.505 -1.149 3.120 264 HD1 TRP 40 HD1 TRP 40 -10.313 0.737 3.573 265 HE1 TRP 40 HE1 TRP 40 -10.653 1.635 5.961 266 HE3 TRP 40 HE3 TRP 40 -7.229 -2.469 6.091 267 HZ2 TRP 40 HZ2 TRP 40 -9.734 1.060 8.567 268 HZ3 TRP 40 HZ3 TRP 40 -7.014 -2.228 8.530 269 HH2 TRP 40 HH2 TRP 40 -8.241 -0.499 9.741 270 H LEU 41 H LEU 41 -7.508 -0.889 0.554 271 HA LEU 41 HA LEU 41 -7.928 -3.250 -1.115 272 HB2 LEU 41 1HB LEU 41 -6.565 -0.628 -1.466 273 HB3 LEU 41 2HB LEU 41 -6.010 -1.997 -2.428 274 HG LEU 41 HG LEU 41 -8.891 -1.139 -2.399 275 HD11 LEU 41 1HD1 LEU 41 -6.631 0.260 -3.531 276 HD12 LEU 41 2HD1 LEU 41 -8.324 0.741 -3.437 277 HD13 LEU 41 3HD1 LEU 41 -7.765 -0.258 -4.778 278 HD21 LEU 41 3HD2 LEU 41 -7.207 -3.043 -3.913 279 HD22 LEU 41 1HD2 LEU 41 -8.428 -2.155 -4.826 280 HD23 LEU 41 2HD2 LEU 41 -8.906 -3.147 -3.448 281 H THR 42 H THR 42 -5.903 -4.320 -1.968 282 HA THR 42 HA THR 42 -4.462 -5.452 0.159 283 HB THR 42 HB THR 42 -3.236 -6.684 -1.451 284 HG1 THR 42 HG1 THR 42 -2.440 -5.210 -2.859 285 HG21 THR 42 3HG2 THR 42 -5.798 -6.949 -1.382 286 HG22 THR 42 1HG2 THR 42 -4.926 -7.666 -2.736 287 HG23 THR 42 2HG2 THR 42 -5.781 -6.138 -2.947 288 H ASP 43 H ASP 43 -3.998 -2.537 -1.541 289 HA ASP 43 HA ASP 43 -1.157 -2.375 -0.903 290 HB2 ASP 43 1HB ASP 43 -3.048 -0.759 -2.564 291 HB3 ASP 43 2HB ASP 43 -1.579 0.005 -1.962 292 H GLY 44 H GLY 44 -4.191 -1.442 0.385 293 HA2 GLY 44 1HA GLY 44 -4.208 -0.774 2.731 294 HA3 GLY 44 2HA GLY 44 -2.796 0.215 2.392 295 H GLN 45 H GLN 45 -4.900 0.443 -0.173 296 HA GLN 45 HA GLN 45 -5.641 3.129 0.566 297 HB2 GLN 45 1HB GLN 45 -6.380 1.543 -1.899 298 HB3 GLN 45 2HB GLN 45 -6.569 3.278 -1.685 299 HG2 GLN 45 1HG GLN 45 -4.397 3.703 -2.083 300 HG3 GLN 45 2HG GLN 45 -3.849 2.232 -1.281 301 HE21 GLN 45 2HE2 GLN 45 -6.066 2.757 -3.993 302 HE22 GLN 45 1HE2 GLN 45 -5.193 1.782 -5.121 303 H LYS 46 H LYS 46 -7.460 3.714 1.535 304 HA LYS 46 HA LYS 46 -9.584 1.746 1.880 305 HB2 LYS 46 1HB LYS 46 -8.864 2.851 3.891 306 HB3 LYS 46 2HB LYS 46 -9.071 4.435 3.156 307 HG2 LYS 46 1HG LYS 46 -11.491 4.048 3.034 308 HG3 LYS 46 2HG LYS 46 -11.266 2.481 3.816 309 HD2 LYS 46 1HD LYS 46 -11.808 3.796 5.623 310 HD3 LYS 46 2HD LYS 46 -10.047 3.916 5.642 311 HE2 LYS 46 1HE LYS 46 -11.610 5.906 4.069 312 HE3 LYS 46 2HE LYS 46 -11.564 6.060 5.825 313 HZ1 LYS 46 3HZ LYS 46 -9.636 7.093 5.553 314 HZ2 LYS 46 1HZ LYS 46 -9.557 6.694 3.911 315 HZ3 LYS 46 2HZ LYS 46 -8.962 5.618 5.072 316 H PHE 47 H PHE 47 -11.413 1.777 0.754 317 HA PHE 47 HA PHE 47 -12.125 4.249 -0.684 318 HB2 PHE 47 1HB PHE 47 -13.203 2.727 -2.377 319 HB3 PHE 47 2HB PHE 47 -11.447 2.631 -2.312 320 HD1 PHE 47 HD2 PHE 47 -14.577 0.923 -1.393 321 HD2 PHE 47 HD1 PHE 47 -10.343 0.624 -1.708 322 HE1 PHE 47 HE2 PHE 47 -14.727 -1.510 -1.060 323 HE2 PHE 47 HE1 PHE 47 -10.486 -1.810 -1.376 324 HZ PHE 47 HZ PHE 47 -12.680 -2.880 -1.050 325 H ASP 48 H ASP 48 -13.236 1.524 1.197 326 HA ASP 48 HA ASP 48 -15.953 2.651 1.230 327 HB2 ASP 48 1HB ASP 48 -15.019 -0.008 0.964 328 HB3 ASP 48 2HB ASP 48 -15.793 0.103 2.542 329 H SER 49 H SER 49 -16.669 3.622 3.008 330 HA SER 49 HA SER 49 -15.458 2.963 5.595 331 HB2 SER 49 1HB SER 49 -15.425 5.433 6.137 332 HB3 SER 49 2HB SER 49 -14.234 4.916 4.944 333 HG SER 49 HG SER 49 -15.815 5.597 3.333 334 H SER 50 H SER 50 -16.914 2.742 7.173 335 HA SER 50 HA SER 50 -19.689 2.929 6.609 336 HB2 SER 50 1HB SER 50 -18.985 1.248 8.154 337 HB3 SER 50 2HB SER 50 -18.159 2.432 9.167 338 HG SER 50 HG SER 50 -20.867 1.823 8.979 339 H LYS 51 H LYS 51 -17.426 5.236 7.540 340 HA LYS 51 HA LYS 51 -18.814 6.885 9.300 341 HB2 LYS 51 1HB LYS 51 -16.825 7.560 7.131 342 HB3 LYS 51 2HB LYS 51 -17.423 8.739 8.291 343 HG2 LYS 51 1HG LYS 51 -16.107 6.185 9.155 344 HG3 LYS 51 2HG LYS 51 -15.184 7.643 8.783 345 HD2 LYS 51 1HD LYS 51 -17.476 7.701 10.719 346 HD3 LYS 51 2HD LYS 51 -15.858 7.216 11.230 347 HE2 LYS 51 1HE LYS 51 -15.078 9.408 10.146 348 HE3 LYS 51 2HE LYS 51 -16.780 9.866 10.161 349 HZ1 LYS 51 3HZ LYS 51 -15.443 8.927 12.618 350 HZ2 LYS 51 1HZ LYS 51 -16.842 9.866 12.465 351 HZ3 LYS 51 2HZ LYS 51 -15.328 10.543 12.133 352 H ASP 52 H ASP 52 -19.273 6.337 5.912 353 HA ASP 52 HA ASP 52 -20.548 8.642 5.082 354 HB2 ASP 52 1HB ASP 52 -21.510 7.358 3.330 355 HB3 ASP 52 2HB ASP 52 -19.965 6.595 3.696 356 H ARG 53 H ARG 53 -21.790 6.001 7.033 357 HA ARG 53 HA ARG 53 -24.413 7.313 7.157 358 HB2 ARG 53 1HB ARG 53 -25.112 5.162 8.287 359 HB3 ARG 53 2HB ARG 53 -24.633 5.015 6.601 360 HG2 ARG 53 1HG ARG 53 -22.654 3.931 7.122 361 HG3 ARG 53 2HG ARG 53 -22.649 4.528 8.783 362 HD2 ARG 53 1HD ARG 53 -23.201 2.178 8.771 363 HD3 ARG 53 2HD ARG 53 -24.612 3.113 9.263 364 HE ARG 53 HE ARG 53 -24.575 2.570 6.455 365 HH11 ARG 53 1HH1 ARG 53 -25.375 1.254 9.577 366 HH12 ARG 53 2HH1 ARG 53 -26.560 0.154 8.955 367 HH21 ARG 53 1HH2 ARG 53 -26.133 1.127 5.623 368 HH22 ARG 53 2HH2 ARG 53 -26.990 0.082 6.706 369 H ASN 54 H ASN 54 -21.577 6.620 8.997 370 HA ASN 54 HA ASN 54 -20.910 7.224 11.086 371 HB2 ASN 54 1HB ASN 54 -23.377 8.932 11.328 372 HB3 ASN 54 2HB ASN 54 -21.787 9.194 12.039 373 HD21 ASN 54 2HD2 ASN 54 -20.238 10.231 10.888 374 HD22 ASN 54 1HD2 ASN 54 -20.501 10.923 9.327 375 H ASP 55 H ASP 55 -21.891 4.845 11.181 376 HA ASP 55 HA ASP 55 -22.958 4.557 13.775 377 HB2 ASP 55 1HB ASP 55 -25.118 5.036 13.153 378 HB3 ASP 55 2HB ASP 55 -24.879 4.481 11.499 379 HA PRO 56 HA PRO 56 -21.073 0.631 13.164 380 HB2 PRO 56 1HB PRO 56 -22.167 -0.717 15.251 381 HB3 PRO 56 2HB PRO 56 -20.916 0.515 15.454 382 HG2 PRO 56 1HG PRO 56 -23.880 0.750 15.799 383 HG3 PRO 56 2HG PRO 56 -22.580 1.399 16.816 384 HD2 PRO 56 1HD PRO 56 -23.922 2.919 15.021 385 HD3 PRO 56 2HD PRO 56 -22.214 3.196 15.420 386 H PHE 57 H PHE 57 -21.478 -1.214 12.063 387 HA PHE 57 HA PHE 57 -24.113 -1.627 11.006 388 HB2 PHE 57 1HB PHE 57 -21.863 -1.993 9.806 389 HB3 PHE 57 2HB PHE 57 -21.797 -3.522 10.676 390 HD1 PHE 57 HD1 PHE 57 -24.409 -1.626 8.795 391 HD2 PHE 57 HD2 PHE 57 -22.387 -5.323 9.399 392 HE1 PHE 57 HE1 PHE 57 -25.804 -2.670 7.057 393 HE2 PHE 57 HE2 PHE 57 -23.778 -6.372 7.662 394 HZ PHE 57 HZ PHE 57 -25.488 -5.045 6.488 395 H ALA 58 H ALA 58 -25.571 -2.391 12.434 396 HA ALA 58 HA ALA 58 -24.839 -4.641 14.159 397 HB1 ALA 58 1HB ALA 58 -25.974 -2.620 15.109 398 HB2 ALA 58 2HB ALA 58 -27.408 -3.069 14.187 399 HB3 ALA 58 3HB ALA 58 -26.789 -4.149 15.436 400 H PHE 59 H PHE 59 -25.451 -6.656 13.725 401 HA PHE 59 HA PHE 59 -27.902 -7.264 12.363 402 HB2 PHE 59 1HB PHE 59 -27.013 -8.279 10.394 403 HB3 PHE 59 2HB PHE 59 -26.305 -6.670 10.497 404 HD1 PHE 59 HD2 PHE 59 -23.968 -6.492 11.555 405 HD2 PHE 59 HD1 PHE 59 -25.657 -10.138 10.151 406 HE1 PHE 59 HE2 PHE 59 -21.717 -7.474 11.407 407 HE2 PHE 59 HE1 PHE 59 -23.408 -11.126 10.002 408 HZ PHE 59 HZ PHE 59 -21.435 -9.793 10.629 409 H VAL 60 H VAL 60 -27.909 -9.750 11.847 410 HA VAL 60 HA VAL 60 -27.004 -11.063 14.295 411 HB VAL 60 HB VAL 60 -29.372 -11.295 13.631 412 HG11 VAL 60 1HG1 VAL 60 -28.506 -11.488 11.097 413 HG12 VAL 60 2HG1 VAL 60 -28.726 -13.199 11.470 414 HG13 VAL 60 3HG1 VAL 60 -30.079 -12.079 11.632 415 HG21 VAL 60 3HG2 VAL 60 -27.979 -13.075 14.876 416 HG22 VAL 60 1HG2 VAL 60 -29.561 -13.531 14.243 417 HG23 VAL 60 2HG2 VAL 60 -28.097 -13.995 13.377 418 H LEU 61 H LEU 61 -25.457 -12.580 14.358 419 HA LEU 61 HA LEU 61 -23.736 -12.964 12.146 420 HB2 LEU 61 1HB LEU 61 -22.945 -13.066 14.442 421 HB3 LEU 61 2HB LEU 61 -23.948 -14.484 14.741 422 HG LEU 61 HG LEU 61 -22.579 -15.834 13.315 423 HD11 LEU 61 1HD1 LEU 61 -20.386 -14.286 12.617 424 HD12 LEU 61 2HD1 LEU 61 -21.779 -13.272 12.240 425 HD13 LEU 61 3HD1 LEU 61 -21.646 -14.884 11.536 426 HD21 LEU 61 3HD2 LEU 61 -21.733 -14.749 15.690 427 HD22 LEU 61 1HD2 LEU 61 -20.351 -14.486 14.625 428 HD23 LEU 61 2HD2 LEU 61 -20.988 -16.115 14.858 429 H GLY 62 H GLY 62 -23.906 -14.318 10.489 430 HA2 GLY 62 1HA GLY 62 -24.262 -16.377 9.428 431 HA3 GLY 62 2HA GLY 62 -25.133 -16.933 10.850 432 H GLY 63 H GLY 63 -26.008 -13.849 9.607 433 HA2 GLY 63 1HA GLY 63 -28.691 -14.616 9.170 434 HA3 GLY 63 2HA GLY 63 -27.967 -13.091 8.681 435 H GLY 64 H GLY 64 -26.248 -13.574 6.780 436 HA2 GLY 64 1HA GLY 64 -26.011 -15.112 4.819 437 HA3 GLY 64 2HA GLY 64 -27.768 -15.109 4.763 438 H MET 65 H MET 65 -25.887 -12.244 5.474 439 HA MET 65 HA MET 65 -26.474 -11.216 2.781 440 HB2 MET 65 1HB MET 65 -27.776 -10.395 5.088 441 HB3 MET 65 2HB MET 65 -26.542 -9.165 4.849 442 HG2 MET 65 1HG MET 65 -27.437 -9.207 2.383 443 HG3 MET 65 2HG MET 65 -28.878 -9.867 3.153 444 HE1 MET 65 3HE MET 65 -29.581 -7.967 5.866 445 HE2 MET 65 1HE MET 65 -30.662 -7.202 4.700 446 HE3 MET 65 2HE MET 65 -30.310 -8.926 4.577 447 H VAL 66 H VAL 66 -24.030 -12.301 4.068 448 HA VAL 66 HA VAL 66 -22.283 -10.040 3.440 449 HB VAL 66 HB VAL 66 -20.865 -10.374 5.349 450 HG11 VAL 66 1HG1 VAL 66 -22.414 -9.763 7.191 451 HG12 VAL 66 2HG1 VAL 66 -22.684 -8.842 5.710 452 HG13 VAL 66 3HG1 VAL 66 -23.768 -10.167 6.136 453 HG21 VAL 66 3HG2 VAL 66 -20.746 -12.425 6.217 454 HG22 VAL 66 1HG2 VAL 66 -22.226 -12.041 7.096 455 HG23 VAL 66 2HG2 VAL 66 -22.312 -12.878 5.546 456 H ILE 67 H ILE 67 -20.170 -10.638 2.775 457 HA ILE 67 HA ILE 67 -20.050 -12.986 1.227 458 HB ILE 67 HB ILE 67 -17.595 -12.435 1.014 459 HG12 ILE 67 1HG1 ILE 67 -18.106 -9.789 2.254 460 HG13 ILE 67 2HG1 ILE 67 -17.874 -11.138 3.360 461 HG21 ILE 67 1HG2 ILE 67 -19.897 -10.835 0.194 462 HG22 ILE 67 2HG2 ILE 67 -18.364 -9.967 0.122 463 HG23 ILE 67 3HG2 ILE 67 -18.563 -11.479 -0.763 464 HD11 ILE 67 3HD1 ILE 67 -15.918 -10.801 1.160 465 HD12 ILE 67 1HD1 ILE 67 -15.863 -9.664 2.507 466 HD13 ILE 67 2HD1 ILE 67 -15.687 -11.394 2.804 467 H LYS 68 H LYS 68 -18.581 -14.777 1.416 468 HA LYS 68 HA LYS 68 -18.736 -16.222 3.727 469 HB2 LYS 68 1HB LYS 68 -16.758 -16.280 1.471 470 HB3 LYS 68 2HB LYS 68 -16.573 -17.370 2.839 471 HG2 LYS 68 1HG LYS 68 -19.010 -18.036 2.372 472 HG3 LYS 68 2HG LYS 68 -18.766 -17.260 0.806 473 HD2 LYS 68 1HD LYS 68 -18.212 -19.468 0.366 474 HD3 LYS 68 2HD LYS 68 -16.638 -18.736 0.684 475 HE2 LYS 68 1HE LYS 68 -16.860 -19.509 3.056 476 HE3 LYS 68 2HE LYS 68 -18.306 -20.392 2.571 477 HZ1 LYS 68 3HZ LYS 68 -15.499 -20.900 1.863 478 HZ2 LYS 68 1HZ LYS 68 -16.722 -21.391 0.802 479 HZ3 LYS 68 2HZ LYS 68 -16.686 -21.986 2.385 480 H GLY 69 H GLY 69 -15.977 -14.205 2.717 481 HA2 GLY 69 1HA GLY 69 -14.311 -14.652 4.890 482 HA3 GLY 69 2HA GLY 69 -14.344 -13.167 3.952 483 H TRP 70 H TRP 70 -16.964 -12.332 4.576 484 HA TRP 70 HA TRP 70 -16.504 -10.966 6.994 485 HB2 TRP 70 1HB TRP 70 -18.799 -11.245 5.115 486 HB3 TRP 70 2HB TRP 70 -19.129 -10.602 6.722 487 HD1 TRP 70 HD1 TRP 70 -15.943 -9.813 4.701 488 HE1 TRP 70 HE1 TRP 70 -15.890 -7.282 4.238 489 HE3 TRP 70 HE3 TRP 70 -20.530 -8.549 6.572 490 HZ2 TRP 70 HZ2 TRP 70 -17.570 -5.045 4.616 491 HZ3 TRP 70 HZ3 TRP 70 -21.231 -6.192 6.484 492 HH2 TRP 70 HH2 TRP 70 -19.780 -4.478 5.526 493 H ASP 71 H ASP 71 -18.865 -13.534 6.246 494 HA ASP 71 HA ASP 71 -19.858 -13.874 8.823 495 HB2 ASP 71 1HB ASP 71 -19.795 -15.490 6.346 496 HB3 ASP 71 2HB ASP 71 -20.069 -16.387 7.837 497 H GLU 72 H GLU 72 -17.168 -15.552 7.217 498 HA GLU 72 HA GLU 72 -16.511 -17.313 9.269 499 HB2 GLU 72 1HB GLU 72 -15.583 -17.340 6.943 500 HB3 GLU 72 2HB GLU 72 -14.561 -15.980 7.386 501 HG2 GLU 72 1HG GLU 72 -13.459 -18.224 7.455 502 HG3 GLU 72 2HG GLU 72 -13.341 -17.277 8.937 503 H GLY 73 H GLY 73 -15.635 -13.936 8.797 504 HA2 GLY 73 1HA GLY 73 -13.766 -13.886 10.980 505 HA3 GLY 73 2HA GLY 73 -14.375 -12.495 10.096 506 H VAL 74 H VAL 74 -17.070 -12.654 10.510 507 HA VAL 74 HA VAL 74 -17.387 -11.489 13.027 508 HB VAL 74 HB VAL 74 -19.561 -12.810 11.398 509 HG11 VAL 74 1HG1 VAL 74 -21.039 -11.215 12.491 510 HG12 VAL 74 2HG1 VAL 74 -20.205 -12.209 13.688 511 HG13 VAL 74 3HG1 VAL 74 -19.678 -10.551 13.395 512 HG21 VAL 74 3HG2 VAL 74 -17.879 -10.628 10.716 513 HG22 VAL 74 1HG2 VAL 74 -19.272 -11.258 9.838 514 HG23 VAL 74 2HG2 VAL 74 -19.490 -9.991 11.045 515 H GLN 75 H GLN 75 -17.610 -14.818 12.006 516 HA GLN 75 HA GLN 75 -18.739 -15.662 14.551 517 HB2 GLN 75 1HB GLN 75 -18.858 -17.866 13.587 518 HB3 GLN 75 2HB GLN 75 -19.473 -16.707 12.416 519 HG2 GLN 75 1HG GLN 75 -17.099 -16.741 11.442 520 HG3 GLN 75 2HG GLN 75 -16.888 -18.212 12.390 521 HE21 GLN 75 2HE2 GLN 75 -18.076 -20.049 11.858 522 HE22 GLN 75 1HE2 GLN 75 -18.857 -20.223 10.327 523 H GLY 76 H GLY 76 -16.242 -14.413 14.782 524 HA2 GLY 76 1HA GLY 76 -14.787 -16.497 16.147 525 HA3 GLY 76 2HA GLY 76 -13.943 -15.855 14.745 526 H MET 77 H MET 77 -14.843 -13.158 15.002 527 HA MET 77 HA MET 77 -12.872 -12.150 16.736 528 HB2 MET 77 1HB MET 77 -13.849 -9.946 16.262 529 HB3 MET 77 2HB MET 77 -13.650 -10.896 14.795 530 HG2 MET 77 1HG MET 77 -16.076 -11.537 15.024 531 HG3 MET 77 2HG MET 77 -16.189 -10.314 16.287 532 HE1 MET 77 3HE MET 77 -14.557 -10.943 13.030 533 HE2 MET 77 1HE MET 77 -15.945 -10.479 12.045 534 HE3 MET 77 2HE MET 77 -14.560 -9.395 12.183 535 H LYS 78 H LYS 78 -13.253 -10.644 18.553 536 HA LYS 78 HA LYS 78 -15.534 -11.524 20.201 537 HB2 LYS 78 1HB LYS 78 -12.764 -10.723 21.113 538 HB3 LYS 78 2HB LYS 78 -14.098 -11.155 22.173 539 HG2 LYS 78 1HG LYS 78 -14.091 -13.406 21.390 540 HG3 LYS 78 2HG LYS 78 -12.940 -13.013 20.110 541 HD2 LYS 78 1HD LYS 78 -11.332 -12.344 21.951 542 HD3 LYS 78 2HD LYS 78 -12.460 -13.096 23.081 543 HE2 LYS 78 1HE LYS 78 -12.134 -15.228 22.155 544 HE3 LYS 78 2HE LYS 78 -11.391 -14.573 20.696 545 HZ1 LYS 78 3HZ LYS 78 -9.395 -14.498 21.662 546 HZ2 LYS 78 1HZ LYS 78 -10.043 -15.553 22.816 547 HZ3 LYS 78 2HZ LYS 78 -9.998 -13.890 23.122 548 H VAL 79 H VAL 79 -16.387 -9.969 21.708 549 HA VAL 79 HA VAL 79 -16.970 -7.495 20.627 550 HB VAL 79 HB VAL 79 -16.955 -8.254 23.552 551 HG11 VAL 79 1HG1 VAL 79 -17.316 -6.058 23.845 552 HG12 VAL 79 2HG1 VAL 79 -17.703 -5.794 22.143 553 HG13 VAL 79 3HG1 VAL 79 -18.935 -6.413 23.243 554 HG21 VAL 79 3HG2 VAL 79 -18.774 -9.466 23.149 555 HG22 VAL 79 1HG2 VAL 79 -19.545 -8.108 22.329 556 HG23 VAL 79 2HG2 VAL 79 -18.514 -9.214 21.423 557 H GLY 80 H GLY 80 -15.911 -5.628 20.441 558 HA2 GLY 80 1HA GLY 80 -14.493 -3.878 21.031 559 HA3 GLY 80 2HA GLY 80 -13.933 -4.827 22.400 560 H GLY 81 H GLY 81 -13.777 -6.826 19.796 561 HA2 GLY 81 1HA GLY 81 -10.897 -6.487 19.615 562 HA3 GLY 81 2HA GLY 81 -11.839 -7.803 18.931 563 H VAL 82 H VAL 82 -9.888 -5.383 18.085 564 HA VAL 82 HA VAL 82 -11.291 -4.927 15.531 565 HB VAL 82 HB VAL 82 -9.425 -3.025 16.957 566 HG11 VAL 82 1HG1 VAL 82 -10.234 -3.233 14.188 567 HG12 VAL 82 2HG1 VAL 82 -10.713 -1.687 14.892 568 HG13 VAL 82 3HG1 VAL 82 -9.023 -2.190 14.933 569 HG21 VAL 82 3HG2 VAL 82 -12.372 -3.263 16.780 570 HG22 VAL 82 1HG2 VAL 82 -11.358 -2.639 18.082 571 HG23 VAL 82 2HG2 VAL 82 -11.690 -1.640 16.667 572 H ARG 83 H ARG 83 -10.268 -5.622 13.773 573 HA ARG 83 HA ARG 83 -7.422 -5.549 13.499 574 HB2 ARG 83 1HB ARG 83 -7.172 -8.019 13.146 575 HB3 ARG 83 2HB ARG 83 -7.470 -7.547 14.813 576 HG2 ARG 83 1HG ARG 83 -9.809 -8.180 14.590 577 HG3 ARG 83 2HG ARG 83 -9.535 -8.622 12.904 578 HD2 ARG 83 1HD ARG 83 -8.090 -10.408 13.524 579 HD3 ARG 83 2HD ARG 83 -8.040 -9.866 15.201 580 HE ARG 83 HE ARG 83 -10.695 -10.397 14.600 581 HH11 ARG 83 1HH1 ARG 83 -7.687 -12.139 14.792 582 HH12 ARG 83 2HH1 ARG 83 -8.433 -13.640 15.232 583 HH21 ARG 83 1HH2 ARG 83 -11.689 -12.367 15.178 584 HH22 ARG 83 2HH2 ARG 83 -10.710 -13.768 15.450 585 H ARG 84 H ARG 84 -6.729 -5.959 11.368 586 HA ARG 84 HA ARG 84 -8.873 -5.748 9.402 587 HB2 ARG 84 1HB ARG 84 -7.117 -5.079 7.841 588 HB3 ARG 84 2HB ARG 84 -7.046 -4.115 9.310 589 HG2 ARG 84 1HG ARG 84 -5.288 -5.880 10.060 590 HG3 ARG 84 2HG ARG 84 -5.169 -6.213 8.331 591 HD2 ARG 84 1HD ARG 84 -3.963 -4.374 7.989 592 HD3 ARG 84 2HD ARG 84 -5.142 -3.376 8.839 593 HE ARG 84 HE ARG 84 -3.821 -4.566 10.859 594 HH11 ARG 84 1HH1 ARG 84 -2.745 -2.845 8.030 595 HH12 ARG 84 2HH1 ARG 84 -1.302 -2.248 8.782 596 HH21 ARG 84 1HH2 ARG 84 -1.925 -3.787 11.859 597 HH22 ARG 84 2HH2 ARG 84 -0.837 -2.785 10.960 598 H LEU 85 H LEU 85 -9.516 -7.416 8.217 599 HA LEU 85 HA LEU 85 -7.734 -9.752 8.003 600 HB2 LEU 85 1HB LEU 85 -10.734 -9.779 7.781 601 HB3 LEU 85 2HB LEU 85 -9.651 -11.162 7.922 602 HG LEU 85 HG LEU 85 -9.496 -9.313 10.183 603 HD11 LEU 85 1HD1 LEU 85 -11.604 -9.410 10.998 604 HD12 LEU 85 2HD1 LEU 85 -11.950 -10.960 10.232 605 HD13 LEU 85 3HD1 LEU 85 -12.006 -9.476 9.282 606 HD21 LEU 85 3HD2 LEU 85 -8.732 -11.847 9.703 607 HD22 LEU 85 1HD2 LEU 85 -10.281 -12.139 10.493 608 HD23 LEU 85 2HD2 LEU 85 -9.032 -11.207 11.319 609 H THR 86 H THR 86 -7.196 -10.474 6.032 610 HA THR 86 HA THR 86 -8.215 -9.002 3.724 611 HB THR 86 HB THR 86 -6.030 -11.056 3.579 612 HG1 THR 86 HG1 THR 86 -5.842 -9.215 5.290 613 HG21 THR 86 3HG2 THR 86 -7.219 -9.220 1.783 614 HG22 THR 86 1HG2 THR 86 -5.850 -10.292 1.495 615 HG23 THR 86 2HG2 THR 86 -5.578 -8.657 2.098 616 H ILE 87 H ILE 87 -9.968 -9.829 2.788 617 HA ILE 87 HA ILE 87 -10.309 -12.742 2.704 618 HB ILE 87 HB ILE 87 -12.304 -10.544 2.145 619 HG12 ILE 87 1HG1 ILE 87 -12.509 -12.505 4.396 620 HG13 ILE 87 2HG1 ILE 87 -11.434 -11.122 4.565 621 HG21 ILE 87 1HG2 ILE 87 -13.968 -12.358 2.102 622 HG22 ILE 87 2HG2 ILE 87 -12.785 -12.500 0.802 623 HG23 ILE 87 3HG2 ILE 87 -12.662 -13.537 2.223 624 HD11 ILE 87 3HD1 ILE 87 -14.396 -11.219 4.412 625 HD12 ILE 87 1HD1 ILE 87 -13.346 -10.289 5.480 626 HD13 ILE 87 2HD1 ILE 87 -13.562 -9.791 3.801 627 HA PRO 88 HA PRO 88 -9.080 -12.642 -1.565 628 HB2 PRO 88 1HB PRO 88 -9.640 -15.245 -2.095 629 HB3 PRO 88 2HB PRO 88 -8.207 -14.734 -1.195 630 HG2 PRO 88 1HG PRO 88 -10.815 -15.785 -0.167 631 HG3 PRO 88 2HG PRO 88 -9.166 -16.178 0.355 632 HD2 PRO 88 1HD PRO 88 -10.751 -14.451 1.711 633 HD3 PRO 88 2HD PRO 88 -8.986 -14.276 1.643 634 HA PRO 89 HA PRO 89 -12.707 -12.257 -4.021 635 HB2 PRO 89 1HB PRO 89 -12.018 -13.453 -6.358 636 HB3 PRO 89 2HB PRO 89 -11.352 -11.899 -5.841 637 HG2 PRO 89 1HG PRO 89 -10.150 -14.634 -5.648 638 HG3 PRO 89 2HG PRO 89 -9.386 -13.108 -6.128 639 HD2 PRO 89 1HD PRO 89 -9.098 -14.164 -3.652 640 HD3 PRO 89 2HD PRO 89 -9.110 -12.414 -3.948 641 H GLN 90 H GLN 90 -11.354 -15.525 -3.946 642 HA GLN 90 HA GLN 90 -13.658 -16.855 -4.902 643 HB2 GLN 90 1HB GLN 90 -12.598 -18.880 -3.834 644 HB3 GLN 90 2HB GLN 90 -11.588 -18.022 -4.990 645 HG2 GLN 90 1HG GLN 90 -10.102 -17.366 -3.420 646 HG3 GLN 90 2HG GLN 90 -11.328 -17.224 -2.160 647 HE21 GLN 90 2HE2 GLN 90 -9.354 -18.279 -1.087 648 HE22 GLN 90 1HE2 GLN 90 -9.376 -20.005 -1.019 649 H LEU 91 H LEU 91 -13.063 -15.273 -1.993 650 HA LEU 91 HA LEU 91 -15.343 -16.649 -0.736 651 HB2 LEU 91 1HB LEU 91 -12.712 -15.848 0.429 652 HB3 LEU 91 2HB LEU 91 -14.148 -15.871 1.452 653 HG LEU 91 HG LEU 91 -14.380 -18.319 0.527 654 HD11 LEU 91 1HD1 LEU 91 -12.056 -19.302 0.321 655 HD12 LEU 91 2HD1 LEU 91 -11.487 -17.653 0.062 656 HD13 LEU 91 3HD1 LEU 91 -12.641 -18.374 -1.060 657 HD21 LEU 91 3HD2 LEU 91 -14.161 -17.969 2.838 658 HD22 LEU 91 1HD2 LEU 91 -12.522 -17.338 2.674 659 HD23 LEU 91 2HD2 LEU 91 -12.835 -19.055 2.416 660 H GLY 92 H GLY 92 -14.638 -13.986 -2.271 661 HA2 GLY 92 1HA GLY 92 -16.351 -12.337 -0.539 662 HA3 GLY 92 2HA GLY 92 -14.847 -11.665 -1.150 663 H TYR 93 H TYR 93 -14.748 -10.894 -3.209 664 HA TYR 93 HA TYR 93 -17.210 -10.282 -4.496 665 HB2 TYR 93 1HB TYR 93 -14.327 -9.747 -5.025 666 HB3 TYR 93 2HB TYR 93 -15.450 -9.580 -6.371 667 HD1 TYR 93 HD1 TYR 93 -16.404 -8.850 -2.895 668 HD2 TYR 93 HD2 TYR 93 -15.144 -7.205 -6.611 669 HE1 TYR 93 HE1 TYR 93 -17.014 -6.604 -2.101 670 HE2 TYR 93 HE2 TYR 93 -15.749 -4.954 -5.827 671 HH TYR 93 HH TYR 93 -17.714 -4.296 -3.470 672 H GLY 94 H GLY 94 -14.388 -12.135 -5.670 673 HA2 GLY 94 1HA GLY 94 -14.747 -14.378 -6.569 674 HA3 GLY 94 2HA GLY 94 -16.276 -13.800 -7.214 675 H ALA 95 H ALA 95 -15.241 -14.856 -9.164 676 HA ALA 95 HA ALA 95 -13.153 -13.327 -10.460 677 HB1 ALA 95 1HB ALA 95 -12.787 -15.224 -11.549 678 HB2 ALA 95 2HB ALA 95 -14.121 -15.958 -10.658 679 HB3 ALA 95 3HB ALA 95 -14.418 -15.197 -12.221 680 H ARG 96 H ARG 96 -16.273 -12.678 -9.977 681 HA ARG 96 HA ARG 96 -17.254 -12.074 -12.567 682 HB2 ARG 96 1HB ARG 96 -18.026 -11.113 -9.815 683 HB3 ARG 96 2HB ARG 96 -18.861 -10.586 -11.269 684 HG2 ARG 96 1HG ARG 96 -20.196 -12.318 -10.602 685 HG3 ARG 96 2HG ARG 96 -19.100 -13.152 -11.705 686 HD2 ARG 96 1HD ARG 96 -17.912 -14.145 -9.974 687 HD3 ARG 96 2HD ARG 96 -18.459 -12.960 -8.789 688 HE ARG 96 HE ARG 96 -20.287 -14.269 -8.394 689 HH11 ARG 96 1HH1 ARG 96 -18.880 -15.195 -11.441 690 HH12 ARG 96 2HH1 ARG 96 -19.923 -16.562 -11.656 691 HH21 ARG 96 1HH2 ARG 96 -21.666 -16.066 -8.666 692 HH22 ARG 96 2HH2 ARG 96 -21.508 -17.055 -10.077 693 H GLY 97 H GLY 97 -15.192 -10.392 -10.328 694 HA2 GLY 97 1HA GLY 97 -13.918 -8.497 -10.613 695 HA3 GLY 97 2HA GLY 97 -14.398 -8.504 -12.303 696 H ALA 98 H ALA 98 -14.122 -6.253 -10.450 697 HA ALA 98 HA ALA 98 -16.901 -5.267 -10.518 698 HB1 ALA 98 1HB ALA 98 -16.592 -4.083 -8.550 699 HB2 ALA 98 2HB ALA 98 -15.716 -5.583 -8.241 700 HB3 ALA 98 3HB ALA 98 -14.833 -4.121 -8.683 701 H GLY 99 H GLY 99 -13.547 -4.634 -11.258 702 HA2 GLY 99 1HA GLY 99 -14.368 -2.501 -13.060 703 HA3 GLY 99 2HA GLY 99 -13.279 -2.029 -11.764 704 H GLY 100 H GLY 100 -11.956 -1.418 -13.700 705 HA2 GLY 100 1HA GLY 100 -10.808 -3.502 -15.294 706 HA3 GLY 100 2HA GLY 100 -10.274 -1.829 -15.225 707 H VAL 101 H VAL 101 -9.580 -1.519 -12.606 708 HA VAL 101 HA VAL 101 -7.073 -2.908 -12.522 709 HB VAL 101 HB VAL 101 -6.717 -1.655 -10.397 710 HG11 VAL 101 1HG1 VAL 101 -7.702 0.182 -12.563 711 HG12 VAL 101 2HG1 VAL 101 -6.366 0.431 -11.437 712 HG13 VAL 101 3HG1 VAL 101 -6.226 -0.767 -12.724 713 HG21 VAL 101 3HG2 VAL 101 -8.389 -0.704 -9.276 714 HG22 VAL 101 1HG2 VAL 101 -8.940 0.155 -10.714 715 HG23 VAL 101 2HG2 VAL 101 -9.501 -1.486 -10.399 716 H ILE 102 H ILE 102 -10.126 -3.780 -11.585 717 HA ILE 102 HA ILE 102 -9.154 -5.439 -9.356 718 HB ILE 102 HB ILE 102 -11.987 -4.670 -10.066 719 HG12 ILE 102 1HG1 ILE 102 -10.210 -3.838 -7.761 720 HG13 ILE 102 2HG1 ILE 102 -10.684 -2.819 -9.117 721 HG21 ILE 102 1HG2 ILE 102 -11.763 -5.723 -7.445 722 HG22 ILE 102 2HG2 ILE 102 -12.666 -6.370 -8.814 723 HG23 ILE 102 3HG2 ILE 102 -10.992 -6.859 -8.552 724 HD11 ILE 102 3HD1 ILE 102 -13.018 -3.900 -7.875 725 HD12 ILE 102 1HD1 ILE 102 -11.989 -3.145 -6.659 726 HD13 ILE 102 2HD1 ILE 102 -12.526 -2.217 -8.060 727 HA PRO 103 HA PRO 103 -9.585 -8.497 -12.735 728 HB2 PRO 103 1HB PRO 103 -7.674 -10.155 -11.751 729 HB3 PRO 103 2HB PRO 103 -7.302 -8.750 -12.757 730 HG2 PRO 103 1HG PRO 103 -7.172 -9.035 -9.780 731 HG3 PRO 103 2HG PRO 103 -6.021 -8.255 -10.881 732 HD2 PRO 103 1HD PRO 103 -7.820 -6.853 -9.421 733 HD3 PRO 103 2HD PRO 103 -7.275 -6.326 -11.026 734 HA PRO 104 HA PRO 104 -12.080 -11.495 -10.704 735 HB2 PRO 104 1HB PRO 104 -11.478 -13.780 -12.040 736 HB3 PRO 104 2HB PRO 104 -12.425 -12.471 -12.755 737 HG2 PRO 104 1HG PRO 104 -9.519 -13.107 -13.088 738 HG3 PRO 104 2HG PRO 104 -10.707 -12.626 -14.314 739 HD2 PRO 104 1HD PRO 104 -8.926 -10.886 -13.250 740 HD3 PRO 104 2HD PRO 104 -10.549 -10.392 -13.772 741 H ASN 105 H ASN 105 -8.693 -11.704 -10.559 742 HA ASN 105 HA ASN 105 -8.853 -13.795 -8.489 743 HB2 ASN 105 1HB ASN 105 -7.503 -14.388 -10.517 744 HB3 ASN 105 2HB ASN 105 -6.420 -13.055 -10.127 745 HD21 ASN 105 2HD2 ASN 105 -4.786 -13.428 -8.792 746 HD22 ASN 105 1HD2 ASN 105 -4.579 -14.851 -7.835 747 H ALA 106 H ALA 106 -8.984 -10.684 -8.563 748 HA ALA 106 HA ALA 106 -6.729 -9.871 -6.983 749 HB1 ALA 106 1HB ALA 106 -7.395 -7.816 -7.509 750 HB2 ALA 106 2HB ALA 106 -8.657 -8.562 -8.490 751 HB3 ALA 106 3HB ALA 106 -8.999 -8.087 -6.826 752 H THR 107 H THR 107 -6.745 -9.236 -4.799 753 HA THR 107 HA THR 107 -8.813 -10.583 -3.196 754 HB THR 107 HB THR 107 -6.036 -9.755 -2.331 755 HG1 THR 107 HG1 THR 107 -5.499 -11.504 -3.399 756 HG21 THR 107 3HG2 THR 107 -8.375 -10.881 -0.945 757 HG22 THR 107 1HG2 THR 107 -7.004 -9.976 -0.304 758 HG23 THR 107 2HG2 THR 107 -6.849 -11.704 -0.623 759 H LEU 108 H LEU 108 -9.714 -9.546 -1.391 760 HA LEU 108 HA LEU 108 -9.394 -6.616 -1.379 761 HB2 LEU 108 1HB LEU 108 -11.852 -8.242 -0.744 762 HB3 LEU 108 2HB LEU 108 -11.729 -6.488 -0.628 763 HG LEU 108 HG LEU 108 -11.649 -8.160 -3.135 764 HD11 LEU 108 1HD1 LEU 108 -13.625 -6.643 -3.659 765 HD12 LEU 108 2HD1 LEU 108 -13.626 -6.241 -1.942 766 HD13 LEU 108 3HD1 LEU 108 -13.880 -7.909 -2.458 767 HD21 LEU 108 3HD2 LEU 108 -10.093 -6.440 -3.529 768 HD22 LEU 108 1HD2 LEU 108 -11.078 -5.244 -2.687 769 HD23 LEU 108 2HD2 LEU 108 -11.602 -5.876 -4.248 770 H VAL 109 H VAL 109 -9.073 -5.598 0.537 771 HA VAL 109 HA VAL 109 -8.783 -7.322 2.904 772 HB VAL 109 HB VAL 109 -7.590 -4.580 2.714 773 HG11 VAL 109 1HG1 VAL 109 -7.479 -6.833 4.515 774 HG12 VAL 109 2HG1 VAL 109 -5.865 -6.367 3.972 775 HG13 VAL 109 3HG1 VAL 109 -6.914 -5.179 4.747 776 HG21 VAL 109 3HG2 VAL 109 -6.642 -7.067 1.350 777 HG22 VAL 109 1HG2 VAL 109 -6.680 -5.407 0.754 778 HG23 VAL 109 2HG2 VAL 109 -5.477 -5.887 1.951 779 H PHE 110 H PHE 110 -10.453 -7.189 4.246 780 HA PHE 110 HA PHE 110 -11.730 -4.562 4.640 781 HB2 PHE 110 1HB PHE 110 -12.878 -7.343 4.653 782 HB3 PHE 110 2HB PHE 110 -13.704 -6.013 5.457 783 HD1 PHE 110 HD2 PHE 110 -14.655 -4.179 4.173 784 HD2 PHE 110 HD1 PHE 110 -12.758 -7.473 2.258 785 HE1 PHE 110 HE2 PHE 110 -15.676 -3.519 2.034 786 HE2 PHE 110 HE1 PHE 110 -13.775 -6.818 0.116 787 HZ PHE 110 HZ PHE 110 -15.237 -4.839 0.002 788 H GLU 111 H GLU 111 -11.813 -3.737 6.648 789 HA GLU 111 HA GLU 111 -10.586 -5.313 8.794 790 HB2 GLU 111 1HB GLU 111 -9.827 -2.924 8.054 791 HB3 GLU 111 2HB GLU 111 -11.205 -2.388 9.005 792 HG2 GLU 111 1HG GLU 111 -9.661 -4.281 10.502 793 HG3 GLU 111 2HG GLU 111 -8.624 -2.988 9.903 794 H VAL 112 H VAL 112 -11.651 -5.861 10.615 795 HA VAL 112 HA VAL 112 -14.435 -4.927 10.887 796 HB VAL 112 HB VAL 112 -13.562 -7.556 12.013 797 HG11 VAL 112 1HG1 VAL 112 -16.139 -6.315 11.105 798 HG12 VAL 112 2HG1 VAL 112 -15.988 -8.055 11.359 799 HG13 VAL 112 3HG1 VAL 112 -15.712 -6.940 12.698 800 HG21 VAL 112 3HG2 VAL 112 -14.338 -7.064 9.140 801 HG22 VAL 112 1HG2 VAL 112 -12.805 -7.702 9.733 802 HG23 VAL 112 2HG2 VAL 112 -14.281 -8.652 9.904 803 H GLU 113 H GLU 113 -15.057 -4.123 12.811 804 HA GLU 113 HA GLU 113 -13.283 -4.487 15.124 805 HB2 GLU 113 1HB GLU 113 -14.038 -1.973 15.590 806 HB3 GLU 113 2HB GLU 113 -12.590 -2.364 14.672 807 HG2 GLU 113 1HG GLU 113 -13.596 -1.858 12.634 808 HG3 GLU 113 2HG GLU 113 -15.222 -1.953 13.308 809 H LEU 114 H LEU 114 -14.571 -5.702 16.386 810 HA LEU 114 HA LEU 114 -17.396 -5.424 16.515 811 HB2 LEU 114 1HB LEU 114 -15.629 -7.350 17.239 812 HB3 LEU 114 2HB LEU 114 -16.036 -6.662 18.810 813 HG LEU 114 HG LEU 114 -18.062 -7.727 16.846 814 HD11 LEU 114 1HD1 LEU 114 -16.263 -9.265 18.157 815 HD12 LEU 114 2HD1 LEU 114 -17.894 -9.783 17.732 816 HD13 LEU 114 3HD1 LEU 114 -17.557 -9.173 19.352 817 HD21 LEU 114 3HD2 LEU 114 -19.389 -6.467 18.156 818 HD22 LEU 114 1HD2 LEU 114 -18.194 -6.365 19.449 819 HD23 LEU 114 2HD2 LEU 114 -19.205 -7.802 19.295 820 H LEU 115 H LEU 115 -18.540 -3.948 17.562 821 HA LEU 115 HA LEU 115 -17.235 -2.226 19.511 822 HB2 LEU 115 1HB LEU 115 -19.904 -2.130 18.131 823 HB3 LEU 115 2HB LEU 115 -19.455 -1.008 19.414 824 HG LEU 115 HG LEU 115 -17.364 -0.691 17.726 825 HD11 LEU 115 1HD1 LEU 115 -18.995 -0.381 15.535 826 HD12 LEU 115 2HD1 LEU 115 -19.498 -1.939 16.191 827 HD13 LEU 115 3HD1 LEU 115 -17.807 -1.664 15.770 828 HD21 LEU 115 3HD2 LEU 115 -18.361 1.389 17.120 829 HD22 LEU 115 1HD2 LEU 115 -18.860 1.020 18.771 830 HD23 LEU 115 2HD2 LEU 115 -19.983 0.770 17.434 831 H ASP 116 H ASP 116 -20.214 -4.173 19.327 832 HA ASP 116 HA ASP 116 -19.904 -5.232 21.930 833 HB2 ASP 116 1HB ASP 116 -20.555 -2.831 22.434 834 HB3 ASP 116 2HB ASP 116 -22.122 -3.194 21.716 835 H VAL 117 H VAL 117 -21.706 -6.612 22.560 836 HA VAL 117 HA VAL 117 -23.058 -7.679 20.205 837 HB VAL 117 HB VAL 117 -23.657 -9.579 21.712 838 HG11 VAL 117 1HG1 VAL 117 -20.997 -8.798 20.825 839 HG12 VAL 117 2HG1 VAL 117 -20.968 -9.970 22.144 840 HG13 VAL 117 3HG1 VAL 117 -21.841 -10.336 20.655 841 HG21 VAL 117 3HG2 VAL 117 -22.940 -7.769 23.724 842 HG22 VAL 117 1HG2 VAL 117 -23.402 -9.460 23.917 843 HG23 VAL 117 2HG2 VAL 117 -21.702 -9.025 23.748 844 H13 JZF 130 1H3 JZF 130 -17.265 -4.810 0.027 845 H23 JZF 130 2H3 JZF 130 -17.542 -3.709 1.365 846 H4 JZF 130 H4 JZF 130 -19.294 -4.097 -1.089 847 H15 JZF 130 1H5 JZF 130 -20.742 -2.333 -0.241 848 H25 JZF 130 2H5 JZF 130 -19.749 -2.127 1.193 849 H17 JZF 130 1H7 JZF 130 -17.669 -1.622 -0.423 850 H27 JZF 130 2H7 JZF 130 -17.136 -2.896 -1.473 851 H8 JZF 130 H8 JZF 130 -19.408 -2.304 -2.708 852 H9 JZF 130 H9 JZF 130 -16.790 -2.094 -3.458 853 H1OH JZF 130 1HO JZF 130 -18.909 -0.132 -1.131 854 H11 JZF 130 H11 JZF 130 -16.585 -2.479 -6.011 855 H112 JZF 130 1H12 JZF 130 -17.740 0.302 -6.560 856 H212 JZF 130 2H12 JZF 130 -16.202 -0.306 -7.154 857 H13A JZF 130 H13 JZF 130 -16.038 1.246 -5.171 858 H114 JZF 130 1H14 JZF 130 -16.652 0.400 -2.937 859 H214 JZF 130 2H14 JZF 130 -18.026 0.669 -3.978 860 H115 JZF 130 1H15 JZF 130 -21.675 -5.645 3.017 861 H215 JZF 130 2H15 JZF 130 -20.354 -6.799 2.833 862 H116 JZF 130 1H16 JZF 130 -19.635 -6.917 -0.905 863 H216 JZF 130 2H16 JZF 130 -19.765 -7.974 0.532 864 H117 JZF 130 2H17 JZF 130 -21.488 -8.414 -1.966 865 H217 JZF 130 3H17 JZF 130 -19.886 -9.157 -1.801 866 H317 JZF 130 1H17 JZF 130 -21.170 -9.555 -0.647 867 H118 JZF 130 1H18 JZF 130 -19.203 -1.882 -7.427 868 H218 JZF 130 2H18 JZF 130 -17.679 -1.829 -8.321 869 H318 JZF 130 3H18 JZF 130 -18.187 -3.328 -7.526 870 H119 JZF 130 3H19 JZF 130 -14.496 -0.367 -3.766 871 H219 JZF 130 1H19 JZF 130 -14.885 -1.549 -5.020 872 H319 JZF 130 2H19 JZF 130 -14.082 -0.039 -5.452 Start of MODEL 7 1 H1 GLY 1 H GLY 1 3.602 -7.759 20.693 2 HA2 GLY 1 1HA GLY 1 4.634 -5.878 22.726 3 HA3 GLY 1 2HA GLY 1 5.701 -6.840 21.714 4 HA PRO 2 HA PRO 2 5.053 -2.663 19.749 5 HB2 PRO 2 1HB PRO 2 7.694 -2.121 19.428 6 HB3 PRO 2 2HB PRO 2 6.803 -1.720 20.901 7 HG2 PRO 2 1HG PRO 2 8.596 -4.052 20.348 8 HG3 PRO 2 2HG PRO 2 8.497 -3.037 21.798 9 HD2 PRO 2 1HD PRO 2 7.342 -5.481 21.650 10 HD3 PRO 2 2HD PRO 2 6.652 -4.156 22.609 11 H GLY 3 H GLY 3 4.214 -3.796 17.932 12 HA2 GLY 3 1HA GLY 3 5.239 -3.585 15.531 13 HA3 GLY 3 2HA GLY 3 6.168 -4.969 16.088 14 H SER 4 H SER 4 5.363 -6.910 15.656 15 HA SER 4 HA SER 4 3.950 -8.541 14.934 16 HB2 SER 4 1HB SER 4 2.042 -8.862 16.207 17 HB3 SER 4 2HB SER 4 2.936 -7.739 17.233 18 HG SER 4 HG SER 4 1.216 -6.549 17.082 19 H MET 5 H MET 5 4.277 -6.081 13.322 20 HA MET 5 HA MET 5 1.715 -5.705 12.024 21 HB2 MET 5 1HB MET 5 4.388 -4.659 11.099 22 HB3 MET 5 2HB MET 5 2.792 -4.032 10.711 23 HG2 MET 5 1HG MET 5 2.556 -3.546 13.196 24 HG3 MET 5 2HG MET 5 4.289 -3.843 13.299 25 HE1 MET 5 3HE MET 5 2.125 -1.341 13.736 26 HE2 MET 5 1HE MET 5 3.739 -0.960 14.340 27 HE3 MET 5 2HE MET 5 2.950 0.119 13.189 28 H THR 6 H THR 6 2.126 -8.288 11.793 29 HA THR 6 HA THR 6 3.102 -8.673 9.037 30 HB THR 6 HB THR 6 3.276 -11.169 9.909 31 HG1 THR 6 HG1 THR 6 3.942 -9.728 12.265 32 HG21 THR 6 3HG2 THR 6 5.360 -9.086 10.571 33 HG22 THR 6 1HG2 THR 6 5.114 -9.805 8.980 34 HG23 THR 6 2HG2 THR 6 5.642 -10.810 10.330 35 H VAL 7 H VAL 7 1.693 -9.473 7.606 36 HA VAL 7 HA VAL 7 -1.014 -10.023 8.472 37 HB VAL 7 HB VAL 7 0.131 -10.095 5.678 38 HG11 VAL 7 1HG1 VAL 7 -1.941 -11.318 5.832 39 HG12 VAL 7 2HG1 VAL 7 -2.708 -9.980 6.689 40 HG13 VAL 7 3HG1 VAL 7 -2.229 -9.790 5.002 41 HG21 VAL 7 3HG2 VAL 7 -0.819 -7.844 5.433 42 HG22 VAL 7 1HG2 VAL 7 -1.269 -7.857 7.139 43 HG23 VAL 7 2HG2 VAL 7 0.432 -7.895 6.676 44 H VAL 8 H VAL 8 -1.502 -11.984 9.201 45 HA VAL 8 HA VAL 8 -0.104 -14.322 8.133 46 HB VAL 8 HB VAL 8 -1.984 -14.100 10.488 47 HG11 VAL 8 1HG1 VAL 8 -2.044 -16.320 9.499 48 HG12 VAL 8 2HG1 VAL 8 -0.282 -16.408 9.553 49 HG13 VAL 8 3HG1 VAL 8 -1.210 -16.358 11.052 50 HG21 VAL 8 3HG2 VAL 8 0.934 -13.791 10.174 51 HG22 VAL 8 1HG2 VAL 8 -0.161 -13.099 11.372 52 HG23 VAL 8 2HG2 VAL 8 0.399 -14.763 11.545 53 H THR 9 H THR 9 -1.048 -15.801 6.862 54 HA THR 9 HA THR 9 -3.827 -15.332 6.067 55 HB THR 9 HB THR 9 -1.920 -17.250 4.739 56 HG1 THR 9 HG1 THR 9 -0.830 -15.565 4.091 57 HG21 THR 9 3HG2 THR 9 -3.511 -16.116 2.824 58 HG22 THR 9 1HG2 THR 9 -4.601 -16.192 4.208 59 HG23 THR 9 2HG2 THR 9 -3.824 -17.661 3.615 60 H THR 10 H THR 10 -5.288 -17.124 5.801 61 HA THR 10 HA THR 10 -4.838 -19.208 7.820 62 HB THR 10 HB THR 10 -7.271 -19.539 7.804 63 HG1 THR 10 HG1 THR 10 -8.538 -17.998 6.591 64 HG21 THR 10 3HG2 THR 10 -7.786 -17.693 9.098 65 HG22 THR 10 1HG2 THR 10 -6.901 -16.582 8.054 66 HG23 THR 10 2HG2 THR 10 -6.023 -17.666 9.133 67 H GLU 11 H GLU 11 -6.445 -21.194 7.166 68 HA GLU 11 HA GLU 11 -5.112 -22.452 4.983 69 HB2 GLU 11 1HB GLU 11 -7.497 -23.328 6.620 70 HB3 GLU 11 2HB GLU 11 -6.668 -24.343 5.449 71 HG2 GLU 11 1HG GLU 11 -4.600 -24.129 6.767 72 HG3 GLU 11 2HG GLU 11 -5.486 -23.185 7.963 73 H SER 12 H SER 12 -8.173 -20.829 5.395 74 HA SER 12 HA SER 12 -9.310 -21.769 2.935 75 HB2 SER 12 1HB SER 12 -11.057 -20.058 3.373 76 HB3 SER 12 2HB SER 12 -10.775 -21.104 4.764 77 HG SER 12 HG SER 12 -10.808 -19.037 5.532 78 H GLY 13 H GLY 13 -7.358 -19.057 3.934 79 HA2 GLY 13 1HA GLY 13 -5.999 -18.214 1.967 80 HA3 GLY 13 2HA GLY 13 -7.560 -17.937 1.210 81 H LEU 14 H LEU 14 -8.812 -17.044 3.699 82 HA LEU 14 HA LEU 14 -8.260 -14.283 3.477 83 HB2 LEU 14 1HB LEU 14 -10.429 -14.832 4.136 84 HB3 LEU 14 2HB LEU 14 -9.866 -15.945 5.381 85 HG LEU 14 HG LEU 14 -9.193 -13.082 5.741 86 HD11 LEU 14 1HD1 LEU 14 -11.286 -12.368 5.498 87 HD12 LEU 14 2HD1 LEU 14 -11.673 -13.306 6.940 88 HD13 LEU 14 3HD1 LEU 14 -11.910 -14.010 5.340 89 HD21 LEU 14 3HD2 LEU 14 -10.434 -14.579 7.908 90 HD22 LEU 14 1HD2 LEU 14 -8.892 -13.725 7.857 91 HD23 LEU 14 2HD2 LEU 14 -9.006 -15.376 7.247 92 H LYS 15 H LYS 15 -7.232 -12.859 4.869 93 HA LYS 15 HA LYS 15 -5.349 -14.114 6.753 94 HB2 LYS 15 1HB LYS 15 -5.029 -11.379 5.535 95 HB3 LYS 15 2HB LYS 15 -3.804 -12.375 6.309 96 HG2 LYS 15 1HG LYS 15 -3.846 -13.929 4.458 97 HG3 LYS 15 2HG LYS 15 -5.152 -13.020 3.695 98 HD2 LYS 15 1HD LYS 15 -3.485 -11.025 3.846 99 HD3 LYS 15 2HD LYS 15 -2.268 -12.292 4.018 100 HE2 LYS 15 1HE LYS 15 -4.277 -12.365 1.794 101 HE3 LYS 15 2HE LYS 15 -2.810 -11.398 1.658 102 HZ1 LYS 15 3HZ LYS 15 -1.832 -13.748 2.487 103 HZ2 LYS 15 1HZ LYS 15 -1.951 -13.291 0.862 104 HZ3 LYS 15 2HZ LYS 15 -3.145 -14.268 1.555 105 H TYR 16 H TYR 16 -4.665 -12.624 8.570 106 HA TYR 16 HA TYR 16 -6.721 -10.753 9.434 107 HB2 TYR 16 1HB TYR 16 -7.239 -11.844 11.468 108 HB3 TYR 16 2HB TYR 16 -7.335 -13.096 10.234 109 HD1 TYR 16 HD1 TYR 16 -5.210 -14.551 9.903 110 HD2 TYR 16 HD2 TYR 16 -5.947 -12.194 13.368 111 HE1 TYR 16 HE1 TYR 16 -3.616 -15.929 11.172 112 HE2 TYR 16 HE2 TYR 16 -4.355 -13.565 14.647 113 HH TYR 16 HH TYR 16 -3.481 -16.186 14.287 114 H GLU 17 H GLU 17 -5.944 -9.142 10.704 115 HA GLU 17 HA GLU 17 -3.261 -9.421 11.848 116 HB2 GLU 17 1HB GLU 17 -3.727 -8.032 9.483 117 HB3 GLU 17 2HB GLU 17 -3.674 -6.776 10.712 118 HG2 GLU 17 1HG GLU 17 -1.507 -7.996 11.476 119 HG3 GLU 17 2HG GLU 17 -1.540 -8.667 9.846 120 H ASP 18 H ASP 18 -3.361 -8.902 13.920 121 HA ASP 18 HA ASP 18 -5.584 -7.708 15.148 122 HB2 ASP 18 1HB ASP 18 -4.282 -7.712 17.176 123 HB3 ASP 18 2HB ASP 18 -3.922 -9.189 16.285 124 H LEU 19 H LEU 19 -6.094 -5.653 15.665 125 HA LEU 19 HA LEU 19 -4.163 -3.555 14.919 126 HB2 LEU 19 1HB LEU 19 -7.057 -3.867 14.373 127 HB3 LEU 19 2HB LEU 19 -6.486 -2.243 14.749 128 HG LEU 19 HG LEU 19 -5.456 -3.977 12.503 129 HD11 LEU 19 1HD1 LEU 19 -6.570 -1.989 11.209 130 HD12 LEU 19 2HD1 LEU 19 -7.565 -1.879 12.661 131 HD13 LEU 19 3HD1 LEU 19 -7.527 -3.376 11.729 132 HD21 LEU 19 3HD2 LEU 19 -4.568 -1.447 13.700 133 HD22 LEU 19 1HD2 LEU 19 -4.728 -1.424 11.943 134 HD23 LEU 19 2HD2 LEU 19 -3.683 -2.615 12.717 135 H THR 20 H THR 20 -6.719 -4.526 17.143 136 HA THR 20 HA THR 20 -5.485 -3.061 19.286 137 HB THR 20 HB THR 20 -8.308 -2.262 18.572 138 HG1 THR 20 HG1 THR 20 -7.511 -0.635 17.434 139 HG21 THR 20 3HG2 THR 20 -7.982 -1.891 20.858 140 HG22 THR 20 1HG2 THR 20 -7.614 -0.329 20.128 141 HG23 THR 20 2HG2 THR 20 -6.304 -1.396 20.634 142 H GLU 21 H GLU 21 -5.656 -4.319 21.014 143 HA GLU 21 HA GLU 21 -7.084 -6.676 21.155 144 HB2 GLU 21 1HB GLU 21 -6.626 -6.671 23.545 145 HB3 GLU 21 2HB GLU 21 -5.219 -6.104 22.655 146 HG2 GLU 21 1HG GLU 21 -5.979 -3.762 23.154 147 HG3 GLU 21 2HG GLU 21 -7.173 -4.466 24.242 148 H GLY 22 H GLY 22 -8.799 -7.205 22.829 149 HA2 GLY 22 1HA GLY 22 -10.736 -5.055 23.247 150 HA3 GLY 22 2HA GLY 22 -11.249 -6.408 22.249 151 H SER 23 H SER 23 -9.959 -8.483 23.656 152 HA SER 23 HA SER 23 -10.440 -9.972 25.312 153 HB2 SER 23 1HB SER 23 -9.142 -8.058 26.511 154 HB3 SER 23 2HB SER 23 -10.708 -7.668 27.222 155 HG SER 23 HG SER 23 -9.591 -10.268 27.305 156 H GLY 24 H GLY 24 -12.540 -10.245 24.172 157 HA2 GLY 24 1HA GLY 24 -14.712 -9.828 26.082 158 HA3 GLY 24 2HA GLY 24 -14.929 -9.161 24.471 159 H ALA 25 H ALA 25 -16.804 -10.577 24.379 160 HA ALA 25 HA ALA 25 -16.237 -13.430 24.145 161 HB1 ALA 25 1HB ALA 25 -18.369 -12.106 25.189 162 HB2 ALA 25 2HB ALA 25 -18.964 -12.514 23.579 163 HB3 ALA 25 3HB ALA 25 -18.392 -13.788 24.656 164 H GLU 26 H GLU 26 -16.558 -14.624 22.276 165 HA GLU 26 HA GLU 26 -16.220 -13.149 19.815 166 HB2 GLU 26 1HB GLU 26 -14.880 -15.146 20.196 167 HB3 GLU 26 2HB GLU 26 -16.334 -16.119 20.362 168 HG2 GLU 26 1HG GLU 26 -16.908 -15.560 18.013 169 HG3 GLU 26 2HG GLU 26 -15.353 -14.742 17.875 170 H ALA 27 H ALA 27 -17.637 -13.006 18.130 171 HA ALA 27 HA ALA 27 -20.386 -13.085 18.655 172 HB1 ALA 27 1HB ALA 27 -20.315 -11.794 16.853 173 HB2 ALA 27 2HB ALA 27 -18.684 -12.346 16.468 174 HB3 ALA 27 3HB ALA 27 -20.082 -13.241 15.872 175 H ARG 28 H ARG 28 -22.041 -14.408 17.711 176 HA ARG 28 HA ARG 28 -21.175 -17.071 16.834 177 HB2 ARG 28 1HB ARG 28 -22.156 -16.552 19.391 178 HB3 ARG 28 2HB ARG 28 -23.538 -17.202 18.518 179 HG2 ARG 28 1HG ARG 28 -22.563 -19.089 19.422 180 HG3 ARG 28 2HG ARG 28 -21.909 -19.063 17.784 181 HD2 ARG 28 1HD ARG 28 -19.841 -18.133 18.559 182 HD3 ARG 28 2HD ARG 28 -20.495 -17.909 20.181 183 HE ARG 28 HE ARG 28 -20.005 -20.093 20.628 184 HH11 ARG 28 1HH1 ARG 28 -20.049 -19.638 17.177 185 HH12 ARG 28 2HH1 ARG 28 -19.475 -21.235 16.828 186 HH21 ARG 28 1HH2 ARG 28 -19.249 -22.198 20.182 187 HH22 ARG 28 2HH2 ARG 28 -19.020 -22.690 18.538 188 H ALA 29 H ALA 29 -22.466 -18.025 15.321 189 HA ALA 29 HA ALA 29 -24.121 -16.431 13.733 190 HB1 ALA 29 1HB ALA 29 -24.551 -19.363 13.685 191 HB2 ALA 29 2HB ALA 29 -24.290 -18.232 12.357 192 HB3 ALA 29 3HB ALA 29 -22.926 -18.774 13.335 193 H GLY 30 H GLY 30 -26.104 -15.692 14.088 194 HA2 GLY 30 1HA GLY 30 -28.458 -16.330 14.405 195 HA3 GLY 30 2HA GLY 30 -27.922 -17.326 15.750 196 H GLN 31 H GLN 31 -25.995 -15.003 16.385 197 HA GLN 31 HA GLN 31 -27.955 -13.506 17.974 198 HB2 GLN 31 1HB GLN 31 -26.374 -13.266 19.617 199 HB3 GLN 31 2HB GLN 31 -25.847 -14.789 18.915 200 HG2 GLN 31 1HG GLN 31 -24.194 -13.574 17.565 201 HG3 GLN 31 2HG GLN 31 -24.700 -12.069 18.330 202 HE21 GLN 31 2HE2 GLN 31 -23.996 -11.585 20.354 203 HE22 GLN 31 1HE2 GLN 31 -22.850 -12.539 21.226 204 H THR 32 H THR 32 -27.889 -11.246 18.099 205 HA THR 32 HA THR 32 -26.774 -9.973 15.715 206 HB THR 32 HB THR 32 -28.724 -8.858 17.741 207 HG1 THR 32 HG1 THR 32 -29.125 -10.004 15.160 208 HG21 THR 32 3HG2 THR 32 -27.444 -7.131 16.551 209 HG22 THR 32 1HG2 THR 32 -29.140 -7.126 16.071 210 HG23 THR 32 2HG2 THR 32 -27.926 -7.840 15.011 211 H VAL 33 H VAL 33 -25.216 -8.447 15.762 212 HA VAL 33 HA VAL 33 -24.411 -7.283 18.319 213 HB VAL 33 HB VAL 33 -22.073 -7.804 18.026 214 HG11 VAL 33 1HG1 VAL 33 -23.389 -10.450 17.596 215 HG12 VAL 33 2HG1 VAL 33 -22.128 -9.995 18.743 216 HG13 VAL 33 3HG1 VAL 33 -23.796 -9.492 19.019 217 HG21 VAL 33 3HG2 VAL 33 -21.917 -9.757 16.073 218 HG22 VAL 33 1HG2 VAL 33 -22.940 -8.516 15.350 219 HG23 VAL 33 2HG2 VAL 33 -21.332 -8.098 15.942 220 H SER 34 H SER 34 -23.089 -5.394 18.108 221 HA SER 34 HA SER 34 -23.429 -4.083 15.498 222 HB2 SER 34 1HB SER 34 -24.279 -3.214 17.928 223 HB3 SER 34 2HB SER 34 -22.701 -2.430 17.839 224 HG SER 34 HG SER 34 -24.988 -1.823 16.536 225 H VAL 35 H VAL 35 -21.675 -3.875 14.292 226 HA VAL 35 HA VAL 35 -19.113 -3.263 15.563 227 HB VAL 35 HB VAL 35 -17.890 -4.957 14.528 228 HG11 VAL 35 1HG1 VAL 35 -19.634 -5.667 16.330 229 HG12 VAL 35 2HG1 VAL 35 -20.389 -6.528 14.987 230 HG13 VAL 35 3HG1 VAL 35 -18.728 -6.898 15.451 231 HG21 VAL 35 3HG2 VAL 35 -19.333 -6.530 12.896 232 HG22 VAL 35 1HG2 VAL 35 -20.136 -4.986 12.612 233 HG23 VAL 35 2HG2 VAL 35 -18.402 -5.143 12.332 234 H HIS 36 H HIS 36 -17.468 -2.559 13.956 235 HA HIS 36 HA HIS 36 -18.771 -1.126 11.737 236 HB2 HIS 36 1HB HIS 36 -16.687 -0.358 13.690 237 HB3 HIS 36 2HB HIS 36 -16.418 0.182 12.036 238 HD1 HIS 36 HD1 HIS 36 -18.701 1.421 10.989 239 HD2 HIS 36 HD2 HIS 36 -18.175 1.385 15.111 240 HE1 HIS 36 HE1 HIS 36 -20.164 3.268 11.870 241 H TYR 37 H TYR 37 -18.092 -1.455 9.704 242 HA TYR 37 HA TYR 37 -15.714 -3.155 9.324 243 HB2 TYR 37 1HB TYR 37 -16.769 -4.129 7.396 244 HB3 TYR 37 2HB TYR 37 -17.902 -4.223 8.739 245 HD1 TYR 37 HD1 TYR 37 -17.139 -2.504 5.570 246 HD2 TYR 37 HD2 TYR 37 -19.986 -3.046 8.685 247 HE1 TYR 37 HE1 TYR 37 -18.840 -1.368 4.205 248 HE2 TYR 37 HE2 TYR 37 -21.696 -1.914 7.327 249 HH TYR 37 HH TYR 37 -20.895 -0.386 4.265 250 H THR 38 H THR 38 -14.250 -2.622 7.742 251 HA THR 38 HA THR 38 -14.719 -0.104 6.289 252 HB THR 38 HB THR 38 -11.910 -0.539 6.873 253 HG1 THR 38 HG1 THR 38 -13.678 -0.161 9.081 254 HG21 THR 38 3HG2 THR 38 -13.888 1.689 7.327 255 HG22 THR 38 1HG2 THR 38 -12.647 1.576 6.079 256 HG23 THR 38 2HG2 THR 38 -12.184 1.813 7.764 257 H GLY 39 H GLY 39 -13.703 0.094 4.260 258 HA2 GLY 39 1HA GLY 39 -12.831 -2.491 3.129 259 HA3 GLY 39 2HA GLY 39 -13.677 -1.247 2.221 260 H TRP 40 H TRP 40 -10.662 -2.511 3.098 261 HA TRP 40 HA TRP 40 -9.313 -0.187 1.886 262 HB2 TRP 40 1HB TRP 40 -8.126 -2.053 3.950 263 HB3 TRP 40 2HB TRP 40 -7.383 -0.600 3.285 264 HD1 TRP 40 HD1 TRP 40 -10.142 1.180 3.597 265 HE1 TRP 40 HE1 TRP 40 -10.720 2.048 5.950 266 HE3 TRP 40 HE3 TRP 40 -7.341 -2.073 6.374 267 HZ2 TRP 40 HZ2 TRP 40 -10.075 1.435 8.629 268 HZ3 TRP 40 HZ3 TRP 40 -7.376 -1.865 8.825 269 HH2 TRP 40 HH2 TRP 40 -8.715 -0.146 9.928 270 H LEU 41 H LEU 41 -7.102 -0.825 0.981 271 HA LEU 41 HA LEU 41 -7.492 -3.202 -0.678 272 HB2 LEU 41 1HB LEU 41 -5.769 -0.760 -0.912 273 HB3 LEU 41 2HB LEU 41 -5.461 -2.190 -1.894 274 HG LEU 41 HG LEU 41 -6.709 -0.605 -3.190 275 HD11 LEU 41 1HD1 LEU 41 -8.482 -1.972 -3.924 276 HD12 LEU 41 2HD1 LEU 41 -8.682 -2.703 -2.332 277 HD13 LEU 41 3HD1 LEU 41 -7.255 -3.074 -3.299 278 HD21 LEU 41 3HD2 LEU 41 -7.679 0.627 -1.271 279 HD22 LEU 41 1HD2 LEU 41 -8.824 -0.695 -1.042 280 HD23 LEU 41 2HD2 LEU 41 -8.859 0.254 -2.529 281 H THR 42 H THR 42 -5.268 -4.229 -1.345 282 HA THR 42 HA THR 42 -4.222 -5.457 0.996 283 HB THR 42 HB THR 42 -2.904 -6.804 -0.428 284 HG1 THR 42 HG1 THR 42 -1.824 -5.506 -1.782 285 HG21 THR 42 3HG2 THR 42 -4.458 -7.621 -2.051 286 HG22 THR 42 1HG2 THR 42 -5.285 -6.066 -2.128 287 HG23 THR 42 2HG2 THR 42 -5.392 -7.051 -0.668 288 H ASP 43 H ASP 43 -3.495 -2.552 -0.535 289 HA ASP 43 HA ASP 43 -0.715 -2.537 0.390 290 HB2 ASP 43 1HB ASP 43 -2.275 -0.689 -1.416 291 HB3 ASP 43 2HB ASP 43 -0.660 -0.303 -0.826 292 H GLY 44 H GLY 44 -3.829 -1.472 1.280 293 HA2 GLY 44 1HA GLY 44 -4.003 -0.736 3.630 294 HA3 GLY 44 2HA GLY 44 -2.633 0.317 3.307 295 H GLN 45 H GLN 45 -4.138 0.629 0.544 296 HA GLN 45 HA GLN 45 -5.135 3.186 1.009 297 HB2 GLN 45 1HB GLN 45 -5.541 1.201 -1.205 298 HB3 GLN 45 2HB GLN 45 -6.399 2.736 -1.214 299 HG2 GLN 45 1HG GLN 45 -3.415 2.352 -1.195 300 HG3 GLN 45 2HG GLN 45 -4.402 2.886 -2.554 301 HE21 GLN 45 2HE2 GLN 45 -6.084 4.664 -1.298 302 HE22 GLN 45 1HE2 GLN 45 -5.169 6.015 -0.729 303 H LYS 46 H LYS 46 -7.226 4.028 1.173 304 HA LYS 46 HA LYS 46 -9.244 2.099 2.117 305 HB2 LYS 46 1HB LYS 46 -8.555 3.529 3.923 306 HB3 LYS 46 2HB LYS 46 -8.748 4.966 2.927 307 HG2 LYS 46 1HG LYS 46 -11.163 4.576 2.840 308 HG3 LYS 46 2HG LYS 46 -10.962 3.149 3.859 309 HD2 LYS 46 1HD LYS 46 -10.831 4.380 5.723 310 HD3 LYS 46 2HD LYS 46 -9.707 5.523 4.984 311 HE2 LYS 46 1HE LYS 46 -11.389 6.900 4.238 312 HE3 LYS 46 2HE LYS 46 -12.575 5.597 4.178 313 HZ1 LYS 46 3HZ LYS 46 -12.255 5.627 6.741 314 HZ2 LYS 46 1HZ LYS 46 -13.263 6.770 6.004 315 HZ3 LYS 46 2HZ LYS 46 -11.697 7.202 6.476 316 H PHE 47 H PHE 47 -11.040 1.921 0.955 317 HA PHE 47 HA PHE 47 -11.923 4.200 -0.669 318 HB2 PHE 47 1HB PHE 47 -12.238 2.891 -2.613 319 HB3 PHE 47 2HB PHE 47 -10.637 2.456 -2.023 320 HD1 PHE 47 HD1 PHE 47 -10.459 0.348 -0.573 321 HD2 PHE 47 HD2 PHE 47 -13.823 1.252 -3.019 322 HE1 PHE 47 HE1 PHE 47 -11.114 -2.024 -0.542 323 HE2 PHE 47 HE2 PHE 47 -14.484 -1.118 -2.992 324 HZ PHE 47 HZ PHE 47 -13.130 -2.759 -1.752 325 H ASP 48 H ASP 48 -12.742 2.754 1.883 326 HA ASP 48 HA ASP 48 -15.537 3.026 1.544 327 HB2 ASP 48 1HB ASP 48 -14.671 0.599 0.621 328 HB3 ASP 48 2HB ASP 48 -15.070 0.221 2.295 329 H SER 49 H SER 49 -16.435 3.465 3.466 330 HA SER 49 HA SER 49 -15.378 2.334 5.912 331 HB2 SER 49 1HB SER 49 -14.866 4.457 6.971 332 HB3 SER 49 2HB SER 49 -13.923 4.314 5.488 333 HG SER 49 HG SER 49 -16.272 5.840 5.914 334 H SER 50 H SER 50 -16.997 1.952 7.275 335 HA SER 50 HA SER 50 -19.664 2.549 6.645 336 HB2 SER 50 1HB SER 50 -19.414 0.671 8.005 337 HB3 SER 50 2HB SER 50 -18.287 1.484 9.091 338 HG SER 50 HG SER 50 -21.093 1.751 8.930 339 H LYS 51 H LYS 51 -17.261 4.416 8.188 340 HA LYS 51 HA LYS 51 -18.732 6.005 9.936 341 HB2 LYS 51 1HB LYS 51 -16.410 6.872 8.204 342 HB3 LYS 51 2HB LYS 51 -16.965 7.670 9.669 343 HG2 LYS 51 1HG LYS 51 -16.093 4.811 9.734 344 HG3 LYS 51 2HG LYS 51 -14.910 6.121 9.784 345 HD2 LYS 51 1HD LYS 51 -15.769 6.957 11.810 346 HD3 LYS 51 2HD LYS 51 -17.254 6.014 11.664 347 HE2 LYS 51 1HE LYS 51 -15.916 4.945 13.308 348 HE3 LYS 51 2HE LYS 51 -15.834 3.948 11.856 349 HZ1 LYS 51 3HZ LYS 51 -13.641 4.055 12.175 350 HZ2 LYS 51 1HZ LYS 51 -13.743 5.384 13.218 351 HZ3 LYS 51 2HZ LYS 51 -13.742 5.621 11.543 352 H ASP 52 H ASP 52 -18.678 5.946 6.482 353 HA ASP 52 HA ASP 52 -19.471 8.497 5.792 354 HB2 ASP 52 1HB ASP 52 -18.978 6.929 4.060 355 HB3 ASP 52 2HB ASP 52 -20.237 5.827 4.610 356 H ARG 53 H ARG 53 -21.465 5.807 6.940 357 HA ARG 53 HA ARG 53 -23.885 7.387 6.800 358 HB2 ARG 53 1HB ARG 53 -23.682 4.847 6.422 359 HB3 ARG 53 2HB ARG 53 -23.607 4.725 8.175 360 HG2 ARG 53 1HG ARG 53 -25.843 4.403 7.785 361 HG3 ARG 53 2HG ARG 53 -25.791 6.141 8.089 362 HD2 ARG 53 1HD ARG 53 -25.472 5.152 5.296 363 HD3 ARG 53 2HD ARG 53 -27.081 5.161 6.018 364 HE ARG 53 HE ARG 53 -25.917 7.665 6.447 365 HH11 ARG 53 1HH1 ARG 53 -27.075 5.702 3.815 366 HH12 ARG 53 2HH1 ARG 53 -27.504 7.055 2.822 367 HH21 ARG 53 1HH2 ARG 53 -26.477 9.455 5.149 368 HH22 ARG 53 2HH2 ARG 53 -27.162 9.190 3.582 369 H ASN 54 H ASN 54 -21.388 6.821 9.052 370 HA ASN 54 HA ASN 54 -21.029 7.535 11.181 371 HB2 ASN 54 1HB ASN 54 -22.101 9.637 10.150 372 HB3 ASN 54 2HB ASN 54 -23.563 9.153 11.004 373 HD21 ASN 54 2HD2 ASN 54 -20.092 9.566 11.615 374 HD22 ASN 54 1HD2 ASN 54 -20.281 10.311 13.163 375 H ASP 55 H ASP 55 -21.909 5.129 11.279 376 HA ASP 55 HA ASP 55 -23.275 4.879 13.715 377 HB2 ASP 55 1HB ASP 55 -25.359 5.327 12.846 378 HB3 ASP 55 2HB ASP 55 -24.943 4.711 11.249 379 HA PRO 56 HA PRO 56 -21.285 0.970 13.392 380 HB2 PRO 56 1HB PRO 56 -22.557 -0.339 15.401 381 HB3 PRO 56 2HB PRO 56 -21.346 0.916 15.688 382 HG2 PRO 56 1HG PRO 56 -24.332 1.118 15.744 383 HG3 PRO 56 2HG PRO 56 -23.143 1.812 16.861 384 HD2 PRO 56 1HD PRO 56 -24.324 3.265 14.906 385 HD3 PRO 56 2HD PRO 56 -22.666 3.577 15.457 386 H PHE 57 H PHE 57 -21.561 -0.913 12.313 387 HA PHE 57 HA PHE 57 -24.120 -1.404 11.078 388 HB2 PHE 57 1HB PHE 57 -21.843 -1.637 9.946 389 HB3 PHE 57 2HB PHE 57 -21.663 -3.137 10.850 390 HD1 PHE 57 HD1 PHE 57 -24.514 -1.592 9.004 391 HD2 PHE 57 HD2 PHE 57 -21.923 -4.939 9.458 392 HE1 PHE 57 HE1 PHE 57 -25.761 -2.790 7.255 393 HE2 PHE 57 HE2 PHE 57 -23.166 -6.142 7.709 394 HZ PHE 57 HZ PHE 57 -25.088 -5.068 6.604 395 H ALA 58 H ALA 58 -25.601 -2.248 12.439 396 HA ALA 58 HA ALA 58 -24.839 -4.494 14.159 397 HB1 ALA 58 1HB ALA 58 -26.887 -2.399 14.270 398 HB2 ALA 58 2HB ALA 58 -27.445 -3.999 14.758 399 HB3 ALA 58 3HB ALA 58 -26.067 -3.259 15.573 400 H PHE 59 H PHE 59 -25.365 -6.524 13.676 401 HA PHE 59 HA PHE 59 -27.743 -7.209 12.236 402 HB2 PHE 59 1HB PHE 59 -26.783 -8.108 10.254 403 HB3 PHE 59 2HB PHE 59 -26.120 -6.487 10.426 404 HD1 PHE 59 HD2 PHE 59 -23.808 -6.271 11.501 405 HD2 PHE 59 HD1 PHE 59 -25.377 -9.937 10.013 406 HE1 PHE 59 HE2 PHE 59 -21.529 -7.188 11.368 407 HE2 PHE 59 HE1 PHE 59 -23.100 -10.861 9.879 408 HZ PHE 59 HZ PHE 59 -21.173 -9.486 10.556 409 H VAL 60 H VAL 60 -27.606 -9.681 11.645 410 HA VAL 60 HA VAL 60 -26.621 -11.014 14.061 411 HB VAL 60 HB VAL 60 -29.026 -11.252 13.435 412 HG11 VAL 60 1HG1 VAL 60 -29.744 -12.305 11.518 413 HG12 VAL 60 2HG1 VAL 60 -28.337 -11.423 10.920 414 HG13 VAL 60 3HG1 VAL 60 -28.213 -13.146 11.277 415 HG21 VAL 60 3HG2 VAL 60 -28.981 -13.822 13.578 416 HG22 VAL 60 1HG2 VAL 60 -27.229 -13.641 13.659 417 HG23 VAL 60 2HG2 VAL 60 -28.250 -12.901 14.892 418 H LEU 61 H LEU 61 -25.112 -12.589 14.024 419 HA LEU 61 HA LEU 61 -23.460 -12.866 11.727 420 HB2 LEU 61 1HB LEU 61 -22.467 -13.007 13.891 421 HB3 LEU 61 2HB LEU 61 -23.543 -14.321 14.360 422 HG LEU 61 HG LEU 61 -22.404 -15.856 12.918 423 HD11 LEU 61 1HD1 LEU 61 -20.167 -14.472 11.974 424 HD12 LEU 61 2HD1 LEU 61 -21.554 -13.453 11.590 425 HD13 LEU 61 3HD1 LEU 61 -21.506 -15.124 11.028 426 HD21 LEU 61 3HD2 LEU 61 -20.699 -16.171 14.332 427 HD22 LEU 61 1HD2 LEU 61 -21.294 -14.727 15.151 428 HD23 LEU 61 2HD2 LEU 61 -19.988 -14.597 13.973 429 H GLY 62 H GLY 62 -23.253 -14.524 10.278 430 HA2 GLY 62 1HA GLY 62 -23.758 -16.465 9.141 431 HA3 GLY 62 2HA GLY 62 -24.583 -17.035 10.584 432 H GLY 63 H GLY 63 -25.655 -13.986 9.553 433 HA2 GLY 63 1HA GLY 63 -28.290 -14.796 9.126 434 HA3 GLY 63 2HA GLY 63 -27.609 -13.269 8.588 435 H GLY 64 H GLY 64 -25.737 -14.132 6.742 436 HA2 GLY 64 1HA GLY 64 -25.566 -15.469 4.749 437 HA3 GLY 64 2HA GLY 64 -27.310 -15.685 4.796 438 H MET 65 H MET 65 -25.796 -12.580 5.324 439 HA MET 65 HA MET 65 -26.884 -11.686 2.736 440 HB2 MET 65 1HB MET 65 -28.104 -10.632 4.497 441 HB3 MET 65 2HB MET 65 -26.629 -10.233 5.367 442 HG2 MET 65 1HG MET 65 -27.522 -8.259 4.331 443 HG3 MET 65 2HG MET 65 -25.999 -8.697 3.560 444 HE1 MET 65 3HE MET 65 -30.132 -8.331 2.204 445 HE2 MET 65 1HE MET 65 -29.150 -7.498 3.409 446 HE3 MET 65 2HE MET 65 -29.085 -6.997 1.719 447 H VAL 66 H VAL 66 -24.103 -11.886 4.756 448 HA VAL 66 HA VAL 66 -22.597 -10.026 3.065 449 HB VAL 66 HB VAL 66 -20.844 -10.119 4.709 450 HG11 VAL 66 1HG1 VAL 66 -23.602 -9.805 5.866 451 HG12 VAL 66 2HG1 VAL 66 -22.137 -9.413 6.768 452 HG13 VAL 66 3HG1 VAL 66 -22.514 -8.548 5.277 453 HG21 VAL 66 3HG2 VAL 66 -20.682 -12.310 5.437 454 HG22 VAL 66 1HG2 VAL 66 -21.371 -11.503 6.845 455 HG23 VAL 66 2HG2 VAL 66 -22.409 -12.437 5.769 456 H ILE 67 H ILE 67 -20.240 -10.781 2.683 457 HA ILE 67 HA ILE 67 -20.394 -13.216 1.151 458 HB ILE 67 HB ILE 67 -18.199 -12.682 0.337 459 HG12 ILE 67 1HG1 ILE 67 -18.143 -10.598 2.528 460 HG13 ILE 67 2HG1 ILE 67 -17.121 -12.026 2.408 461 HG21 ILE 67 1HG2 ILE 67 -20.369 -11.193 -0.141 462 HG22 ILE 67 2HG2 ILE 67 -19.296 -9.942 0.486 463 HG23 ILE 67 3HG2 ILE 67 -18.812 -10.898 -0.915 464 HD11 ILE 67 3HD1 ILE 67 -15.909 -10.030 1.771 465 HD12 ILE 67 1HD1 ILE 67 -16.092 -11.113 0.391 466 HD13 ILE 67 2HD1 ILE 67 -17.109 -9.678 0.527 467 H LYS 68 H LYS 68 -18.697 -14.887 1.288 468 HA LYS 68 HA LYS 68 -18.638 -16.211 3.678 469 HB2 LYS 68 1HB LYS 68 -16.859 -16.271 1.279 470 HB3 LYS 68 2HB LYS 68 -16.384 -17.185 2.704 471 HG2 LYS 68 1HG LYS 68 -18.766 -18.168 2.588 472 HG3 LYS 68 2HG LYS 68 -18.763 -17.557 0.932 473 HD2 LYS 68 1HD LYS 68 -16.994 -18.951 0.299 474 HD3 LYS 68 2HD LYS 68 -16.518 -19.257 1.971 475 HE2 LYS 68 1HE LYS 68 -17.571 -21.233 1.322 476 HE3 LYS 68 2HE LYS 68 -18.821 -20.364 2.212 477 HZ1 LYS 68 3HZ LYS 68 -20.084 -20.661 0.426 478 HZ2 LYS 68 1HZ LYS 68 -18.782 -21.178 -0.524 479 HZ3 LYS 68 2HZ LYS 68 -19.115 -19.527 -0.371 480 H GLY 69 H GLY 69 -16.078 -14.076 2.415 481 HA2 GLY 69 1HA GLY 69 -14.258 -14.273 4.480 482 HA3 GLY 69 2HA GLY 69 -14.498 -12.823 3.517 483 H TRP 70 H TRP 70 -17.148 -12.242 4.316 484 HA TRP 70 HA TRP 70 -16.630 -10.818 6.712 485 HB2 TRP 70 1HB TRP 70 -19.026 -11.226 4.965 486 HB3 TRP 70 2HB TRP 70 -19.239 -10.502 6.557 487 HD1 TRP 70 HD1 TRP 70 -16.426 -9.838 3.966 488 HE1 TRP 70 HE1 TRP 70 -16.382 -7.312 3.478 489 HE3 TRP 70 HE3 TRP 70 -20.423 -8.394 6.807 490 HZ2 TRP 70 HZ2 TRP 70 -17.848 -5.011 4.203 491 HZ3 TRP 70 HZ3 TRP 70 -21.036 -6.012 6.856 492 HH2 TRP 70 HH2 TRP 70 -19.773 -4.357 5.580 493 H ASP 71 H ASP 71 -18.867 -13.507 6.018 494 HA ASP 71 HA ASP 71 -19.816 -13.914 8.588 495 HB2 ASP 71 1HB ASP 71 -19.887 -15.308 6.095 496 HB3 ASP 71 2HB ASP 71 -19.515 -16.467 7.368 497 H GLU 72 H GLU 72 -16.977 -15.380 7.029 498 HA GLU 72 HA GLU 72 -16.197 -16.999 9.179 499 HB2 GLU 72 1HB GLU 72 -15.150 -16.251 6.625 500 HB3 GLU 72 2HB GLU 72 -13.866 -16.115 7.818 501 HG2 GLU 72 1HG GLU 72 -15.570 -18.568 7.660 502 HG3 GLU 72 2HG GLU 72 -14.183 -18.347 6.596 503 H GLY 73 H GLY 73 -15.380 -13.652 8.368 504 HA2 GLY 73 1HA GLY 73 -13.485 -13.307 10.459 505 HA3 GLY 73 2HA GLY 73 -14.277 -12.023 9.559 506 H VAL 74 H VAL 74 -16.961 -12.748 10.233 507 HA VAL 74 HA VAL 74 -17.153 -11.426 12.761 508 HB VAL 74 HB VAL 74 -19.354 -12.774 11.192 509 HG11 VAL 74 1HG1 VAL 74 -20.190 -10.472 12.642 510 HG12 VAL 74 2HG1 VAL 74 -20.708 -12.148 12.835 511 HG13 VAL 74 3HG1 VAL 74 -19.321 -11.543 13.741 512 HG21 VAL 74 3HG2 VAL 74 -19.275 -9.894 11.012 513 HG22 VAL 74 1HG2 VAL 74 -17.779 -10.611 10.412 514 HG23 VAL 74 2HG2 VAL 74 -19.329 -11.099 9.725 515 H GLN 75 H GLN 75 -17.144 -14.722 11.708 516 HA GLN 75 HA GLN 75 -18.400 -15.802 14.047 517 HB2 GLN 75 1HB GLN 75 -16.798 -17.054 11.819 518 HB3 GLN 75 2HB GLN 75 -17.470 -17.984 13.152 519 HG2 GLN 75 1HG GLN 75 -19.626 -17.722 12.435 520 HG3 GLN 75 2HG GLN 75 -19.278 -16.214 11.590 521 HE21 GLN 75 2HE2 GLN 75 -20.257 -16.895 9.701 522 HE22 GLN 75 1HE2 GLN 75 -19.559 -18.094 8.672 523 H GLY 76 H GLY 76 -15.485 -14.337 13.617 524 HA2 GLY 76 1HA GLY 76 -14.271 -15.902 15.811 525 HA3 GLY 76 2HA GLY 76 -13.319 -15.243 14.489 526 H MET 77 H MET 77 -14.933 -12.752 14.463 527 HA MET 77 HA MET 77 -13.320 -11.113 15.976 528 HB2 MET 77 1HB MET 77 -14.832 -9.356 15.517 529 HB3 MET 77 2HB MET 77 -14.969 -10.458 14.153 530 HG2 MET 77 1HG MET 77 -16.993 -11.423 15.171 531 HG3 MET 77 2HG MET 77 -16.868 -10.246 16.476 532 HE1 MET 77 3HE MET 77 -19.278 -8.800 16.058 533 HE2 MET 77 1HE MET 77 -19.958 -9.050 14.450 534 HE3 MET 77 2HE MET 77 -19.407 -10.431 15.399 535 H LYS 78 H LYS 78 -13.481 -10.107 17.978 536 HA LYS 78 HA LYS 78 -15.404 -11.330 19.848 537 HB2 LYS 78 1HB LYS 78 -12.584 -10.402 20.427 538 HB3 LYS 78 2HB LYS 78 -13.704 -11.071 21.607 539 HG2 LYS 78 1HG LYS 78 -13.702 -13.198 20.438 540 HG3 LYS 78 2HG LYS 78 -12.630 -12.534 19.203 541 HD2 LYS 78 1HD LYS 78 -10.845 -12.308 20.751 542 HD3 LYS 78 2HD LYS 78 -11.908 -12.619 22.126 543 HE2 LYS 78 1HE LYS 78 -11.675 -14.701 20.013 544 HE3 LYS 78 2HE LYS 78 -10.331 -14.495 21.135 545 HZ1 LYS 78 3HZ LYS 78 -11.458 -15.678 22.608 546 HZ2 LYS 78 1HZ LYS 78 -12.777 -15.812 21.557 547 HZ3 LYS 78 2HZ LYS 78 -12.680 -14.509 22.631 548 H VAL 79 H VAL 79 -16.141 -10.006 21.597 549 HA VAL 79 HA VAL 79 -16.954 -7.450 20.874 550 HB VAL 79 HB VAL 79 -16.657 -8.569 23.665 551 HG11 VAL 79 1HG1 VAL 79 -16.904 -6.249 23.925 552 HG12 VAL 79 2HG1 VAL 79 -18.065 -6.138 22.601 553 HG13 VAL 79 3HG1 VAL 79 -18.530 -6.900 24.123 554 HG21 VAL 79 3HG2 VAL 79 -18.225 -9.541 21.663 555 HG22 VAL 79 1HG2 VAL 79 -18.584 -9.687 23.384 556 HG23 VAL 79 2HG2 VAL 79 -19.315 -8.391 22.437 557 H GLY 80 H GLY 80 -15.860 -5.617 20.670 558 HA2 GLY 80 1HA GLY 80 -14.472 -3.861 21.311 559 HA3 GLY 80 2HA GLY 80 -13.895 -4.842 22.650 560 H GLY 81 H GLY 81 -13.694 -6.763 19.995 561 HA2 GLY 81 1HA GLY 81 -10.823 -6.334 19.813 562 HA3 GLY 81 2HA GLY 81 -11.724 -7.676 19.125 563 H VAL 82 H VAL 82 -9.769 -5.405 18.177 564 HA VAL 82 HA VAL 82 -11.258 -4.866 15.692 565 HB VAL 82 HB VAL 82 -9.285 -2.989 17.000 566 HG11 VAL 82 1HG1 VAL 82 -10.288 -3.191 14.326 567 HG12 VAL 82 2HG1 VAL 82 -10.853 -1.689 15.061 568 HG13 VAL 82 3HG1 VAL 82 -9.127 -2.045 14.996 569 HG21 VAL 82 3HG2 VAL 82 -12.209 -3.263 17.205 570 HG22 VAL 82 1HG2 VAL 82 -11.054 -2.530 18.318 571 HG23 VAL 82 2HG2 VAL 82 -11.618 -1.627 16.912 572 H ARG 83 H ARG 83 -10.331 -5.783 13.993 573 HA ARG 83 HA ARG 83 -7.462 -5.705 13.642 574 HB2 ARG 83 1HB ARG 83 -7.359 -8.188 13.199 575 HB3 ARG 83 2HB ARG 83 -7.547 -7.730 14.886 576 HG2 ARG 83 1HG ARG 83 -9.882 -8.281 14.835 577 HG3 ARG 83 2HG ARG 83 -9.812 -8.579 13.096 578 HD2 ARG 83 1HD ARG 83 -8.142 -10.387 13.568 579 HD3 ARG 83 2HD ARG 83 -8.473 -10.157 15.285 580 HE ARG 83 HE ARG 83 -10.903 -10.576 13.962 581 HH11 ARG 83 1HH1 ARG 83 -7.987 -12.299 14.770 582 HH12 ARG 83 2HH1 ARG 83 -8.763 -13.847 14.829 583 HH21 ARG 83 1HH2 ARG 83 -11.936 -12.608 14.038 584 HH22 ARG 83 2HH2 ARG 83 -11.009 -14.022 14.412 585 H ARG 84 H ARG 84 -6.808 -6.076 11.495 586 HA ARG 84 HA ARG 84 -8.982 -5.791 9.559 587 HB2 ARG 84 1HB ARG 84 -7.234 -5.045 8.004 588 HB3 ARG 84 2HB ARG 84 -7.219 -4.105 9.490 589 HG2 ARG 84 1HG ARG 84 -5.443 -6.097 10.061 590 HG3 ARG 84 2HG ARG 84 -5.170 -5.832 8.338 591 HD2 ARG 84 1HD ARG 84 -5.434 -3.341 9.797 592 HD3 ARG 84 2HD ARG 84 -4.129 -4.342 10.432 593 HE ARG 84 HE ARG 84 -4.095 -4.112 7.573 594 HH11 ARG 84 1HH1 ARG 84 -3.131 -2.613 10.564 595 HH12 ARG 84 2HH1 ARG 84 -1.815 -1.739 9.853 596 HH21 ARG 84 1HH2 ARG 84 -2.365 -2.967 6.625 597 HH22 ARG 84 2HH2 ARG 84 -1.380 -1.941 7.612 598 H LEU 85 H LEU 85 -9.622 -7.464 8.383 599 HA LEU 85 HA LEU 85 -7.797 -9.753 8.082 600 HB2 LEU 85 1HB LEU 85 -10.807 -9.642 7.993 601 HB3 LEU 85 2HB LEU 85 -9.846 -11.085 7.681 602 HG LEU 85 HG LEU 85 -9.122 -10.005 10.230 603 HD11 LEU 85 1HD1 LEU 85 -11.066 -9.755 11.377 604 HD12 LEU 85 2HD1 LEU 85 -11.968 -10.828 10.308 605 HD13 LEU 85 3HD1 LEU 85 -11.608 -9.178 9.801 606 HD21 LEU 85 3HD2 LEU 85 -9.544 -12.206 10.967 607 HD22 LEU 85 1HD2 LEU 85 -8.944 -12.359 9.316 608 HD23 LEU 85 2HD2 LEU 85 -10.670 -12.516 9.644 609 H THR 86 H THR 86 -7.255 -10.471 6.098 610 HA THR 86 HA THR 86 -8.005 -8.832 3.827 611 HB THR 86 HB THR 86 -6.154 -11.222 3.872 612 HG1 THR 86 HG1 THR 86 -5.715 -9.163 5.224 613 HG21 THR 86 3HG2 THR 86 -7.144 -9.541 1.778 614 HG22 THR 86 1HG2 THR 86 -6.033 -10.905 1.671 615 HG23 THR 86 2HG2 THR 86 -5.410 -9.281 1.961 616 H ILE 87 H ILE 87 -9.842 -9.274 2.801 617 HA ILE 87 HA ILE 87 -10.778 -12.044 2.642 618 HB ILE 87 HB ILE 87 -12.193 -9.463 1.965 619 HG12 ILE 87 1HG1 ILE 87 -12.679 -11.403 4.233 620 HG13 ILE 87 2HG1 ILE 87 -11.762 -9.909 4.392 621 HG21 ILE 87 1HG2 ILE 87 -14.201 -11.138 2.043 622 HG22 ILE 87 2HG2 ILE 87 -13.246 -10.958 0.572 623 HG23 ILE 87 3HG2 ILE 87 -12.960 -12.327 1.647 624 HD11 ILE 87 3HD1 ILE 87 -14.562 -10.313 4.584 625 HD12 ILE 87 1HD1 ILE 87 -13.639 -8.827 4.807 626 HD13 ILE 87 2HD1 ILE 87 -14.241 -9.260 3.207 627 HA PRO 88 HA PRO 88 -9.020 -11.948 -1.513 628 HB2 PRO 88 1HB PRO 88 -9.227 -14.627 -1.895 629 HB3 PRO 88 2HB PRO 88 -7.915 -13.888 -0.971 630 HG2 PRO 88 1HG PRO 88 -10.421 -15.196 0.013 631 HG3 PRO 88 2HG PRO 88 -8.765 -15.346 0.628 632 HD2 PRO 88 1HD PRO 88 -10.616 -13.756 1.801 633 HD3 PRO 88 2HD PRO 88 -8.885 -13.363 1.797 634 HA PRO 89 HA PRO 89 -12.538 -12.173 -4.140 635 HB2 PRO 89 1HB PRO 89 -11.593 -13.418 -6.360 636 HB3 PRO 89 2HB PRO 89 -11.147 -11.764 -5.923 637 HG2 PRO 89 1HG PRO 89 -9.634 -14.311 -5.493 638 HG3 PRO 89 2HG PRO 89 -9.037 -12.735 -6.045 639 HD2 PRO 89 1HD PRO 89 -8.748 -13.590 -3.492 640 HD3 PRO 89 2HD PRO 89 -8.957 -11.877 -3.907 641 H GLN 90 H GLN 90 -10.807 -15.234 -3.767 642 HA GLN 90 HA GLN 90 -12.880 -16.899 -4.733 643 HB2 GLN 90 1HB GLN 90 -11.636 -18.697 -3.446 644 HB3 GLN 90 2HB GLN 90 -10.706 -17.830 -4.661 645 HG2 GLN 90 1HG GLN 90 -9.306 -16.952 -3.151 646 HG3 GLN 90 2HG GLN 90 -10.587 -16.671 -1.973 647 HE21 GLN 90 2HE2 GLN 90 -7.931 -17.741 -1.548 648 HE22 GLN 90 1HE2 GLN 90 -8.139 -19.312 -0.860 649 H LEU 91 H LEU 91 -12.648 -15.062 -1.931 650 HA LEU 91 HA LEU 91 -14.734 -16.685 -0.628 651 HB2 LEU 91 1HB LEU 91 -12.353 -15.295 0.494 652 HB3 LEU 91 2HB LEU 91 -13.818 -15.375 1.470 653 HG LEU 91 HG LEU 91 -12.302 -17.152 2.091 654 HD11 LEU 91 1HD1 LEU 91 -14.973 -17.545 1.150 655 HD12 LEU 91 2HD1 LEU 91 -14.140 -18.320 2.498 656 HD13 LEU 91 3HD1 LEU 91 -14.029 -19.011 0.879 657 HD21 LEU 91 3HD2 LEU 91 -11.184 -17.244 -0.169 658 HD22 LEU 91 1HD2 LEU 91 -12.545 -18.227 -0.709 659 HD23 LEU 91 2HD2 LEU 91 -11.504 -18.803 0.593 660 H GLY 92 H GLY 92 -14.321 -14.018 -2.377 661 HA2 GLY 92 1HA GLY 92 -16.452 -12.578 -0.929 662 HA3 GLY 92 2HA GLY 92 -15.087 -11.716 -1.622 663 H TYR 93 H TYR 93 -15.195 -11.065 -3.690 664 HA TYR 93 HA TYR 93 -17.664 -11.226 -5.073 665 HB2 TYR 93 1HB TYR 93 -14.961 -10.335 -6.099 666 HB3 TYR 93 2HB TYR 93 -16.512 -10.013 -6.867 667 HD1 TYR 93 HD2 TYR 93 -17.975 -9.470 -4.181 668 HD2 TYR 93 HD1 TYR 93 -14.347 -8.021 -5.866 669 HE1 TYR 93 HE2 TYR 93 -18.199 -7.401 -2.870 670 HE2 TYR 93 HE1 TYR 93 -14.560 -5.949 -4.559 671 HH TYR 93 HH TYR 93 -17.433 -5.112 -2.897 672 H GLY 94 H GLY 94 -14.444 -12.540 -5.881 673 HA2 GLY 94 1HA GLY 94 -14.270 -14.873 -6.565 674 HA3 GLY 94 2HA GLY 94 -15.825 -14.688 -7.363 675 H ALA 95 H ALA 95 -14.527 -15.656 -9.157 676 HA ALA 95 HA ALA 95 -12.628 -13.904 -10.461 677 HB1 ALA 95 1HB ALA 95 -13.446 -16.078 -12.129 678 HB2 ALA 95 2HB ALA 95 -11.888 -15.795 -11.353 679 HB3 ALA 95 3HB ALA 95 -13.155 -16.668 -10.492 680 H ARG 96 H ARG 96 -15.832 -13.734 -10.204 681 HA ARG 96 HA ARG 96 -16.666 -13.456 -12.918 682 HB2 ARG 96 1HB ARG 96 -18.088 -13.898 -10.785 683 HB3 ARG 96 2HB ARG 96 -18.063 -12.149 -10.606 684 HG2 ARG 96 1HG ARG 96 -19.267 -11.810 -12.577 685 HG3 ARG 96 2HG ARG 96 -18.940 -13.443 -13.161 686 HD2 ARG 96 1HD ARG 96 -20.454 -14.404 -11.648 687 HD3 ARG 96 2HD ARG 96 -20.514 -12.949 -10.654 688 HE ARG 96 HE ARG 96 -22.067 -13.507 -13.001 689 HH11 ARG 96 1HH1 ARG 96 -20.722 -10.993 -11.003 690 HH12 ARG 96 2HH1 ARG 96 -21.893 -9.808 -11.480 691 HH21 ARG 96 1HH2 ARG 96 -23.613 -11.955 -13.637 692 HH22 ARG 96 2HH2 ARG 96 -23.537 -10.356 -12.978 693 H GLY 97 H GLY 97 -15.203 -11.354 -10.571 694 HA2 GLY 97 1HA GLY 97 -14.117 -9.336 -11.045 695 HA3 GLY 97 2HA GLY 97 -14.921 -9.296 -12.607 696 H ALA 98 H ALA 98 -14.684 -7.052 -10.956 697 HA ALA 98 HA ALA 98 -17.500 -6.420 -10.596 698 HB1 ALA 98 1HB ALA 98 -16.833 -5.297 -8.349 699 HB2 ALA 98 2HB ALA 98 -17.183 -7.025 -8.390 700 HB3 ALA 98 3HB ALA 98 -15.511 -6.465 -8.366 701 H GLY 99 H GLY 99 -15.181 -5.660 -12.345 702 HA2 GLY 99 1HA GLY 99 -15.748 -3.079 -12.943 703 HA3 GLY 99 2HA GLY 99 -14.576 -2.926 -11.642 704 H GLY 100 H GLY 100 -13.537 -1.767 -13.581 705 HA2 GLY 100 1HA GLY 100 -12.348 -3.476 -15.577 706 HA3 GLY 100 2HA GLY 100 -12.051 -1.757 -15.361 707 H VAL 101 H VAL 101 -11.115 -1.614 -12.807 708 HA VAL 101 HA VAL 101 -8.477 -2.774 -13.119 709 HB VAL 101 HB VAL 101 -7.818 -1.392 -11.239 710 HG11 VAL 101 1HG1 VAL 101 -7.743 0.488 -12.463 711 HG12 VAL 101 2HG1 VAL 101 -8.578 -0.473 -13.685 712 HG13 VAL 101 3HG1 VAL 101 -9.498 0.581 -12.610 713 HG21 VAL 101 3HG2 VAL 101 -9.416 -1.251 -9.644 714 HG22 VAL 101 1HG2 VAL 101 -9.831 0.231 -10.506 715 HG23 VAL 101 2HG2 VAL 101 -10.736 -1.251 -10.813 716 H ILE 102 H ILE 102 -11.220 -4.024 -12.010 717 HA ILE 102 HA ILE 102 -9.990 -5.362 -9.696 718 HB ILE 102 HB ILE 102 -12.909 -5.208 -10.455 719 HG12 ILE 102 1HG1 ILE 102 -11.338 -3.802 -8.284 720 HG13 ILE 102 2HG1 ILE 102 -12.061 -3.049 -9.701 721 HG21 ILE 102 1HG2 ILE 102 -12.404 -5.952 -7.735 722 HG22 ILE 102 2HG2 ILE 102 -13.295 -6.823 -8.983 723 HG23 ILE 102 3HG2 ILE 102 -11.554 -7.049 -8.824 724 HD11 ILE 102 3HD1 ILE 102 -14.287 -3.759 -8.858 725 HD12 ILE 102 1HD1 ILE 102 -13.495 -4.321 -7.386 726 HD13 ILE 102 2HD1 ILE 102 -13.449 -2.611 -7.816 727 HA PRO 103 HA PRO 103 -9.779 -8.649 -12.856 728 HB2 PRO 103 1HB PRO 103 -7.691 -9.924 -11.680 729 HB3 PRO 103 2HB PRO 103 -7.486 -8.535 -12.755 730 HG2 PRO 103 1HG PRO 103 -7.484 -8.631 -9.763 731 HG3 PRO 103 2HG PRO 103 -6.408 -7.739 -10.855 732 HD2 PRO 103 1HD PRO 103 -8.484 -6.564 -9.574 733 HD3 PRO 103 2HD PRO 103 -7.937 -6.046 -11.182 734 HA PRO 104 HA PRO 104 -11.876 -11.898 -10.764 735 HB2 PRO 104 1HB PRO 104 -10.825 -14.128 -11.900 736 HB3 PRO 104 2HB PRO 104 -11.922 -13.039 -12.757 737 HG2 PRO 104 1HG PRO 104 -8.936 -13.204 -12.883 738 HG3 PRO 104 2HG PRO 104 -10.102 -13.002 -14.204 739 HD2 PRO 104 1HD PRO 104 -8.701 -10.930 -13.168 740 HD3 PRO 104 2HD PRO 104 -10.344 -10.744 -13.812 741 H ASN 105 H ASN 105 -8.511 -11.546 -10.428 742 HA ASN 105 HA ASN 105 -8.480 -13.481 -8.205 743 HB2 ASN 105 1HB ASN 105 -6.894 -13.671 -10.352 744 HB3 ASN 105 2HB ASN 105 -5.917 -12.557 -9.400 745 HD21 ASN 105 2HD2 ASN 105 -5.467 -13.229 -7.151 746 HD22 ASN 105 1HD2 ASN 105 -5.190 -14.908 -6.850 747 H ALA 106 H ALA 106 -9.044 -10.438 -8.552 748 HA ALA 106 HA ALA 106 -7.020 -9.123 -7.037 749 HB1 ALA 106 1HB ALA 106 -9.615 -7.840 -6.914 750 HB2 ALA 106 2HB ALA 106 -8.109 -7.276 -7.638 751 HB3 ALA 106 3HB ALA 106 -9.192 -8.321 -8.558 752 H THR 107 H THR 107 -6.906 -8.671 -4.885 753 HA THR 107 HA THR 107 -8.898 -9.997 -3.165 754 HB THR 107 HB THR 107 -5.976 -9.449 -2.609 755 HG1 THR 107 HG1 THR 107 -6.211 -11.244 -3.925 756 HG21 THR 107 3HG2 THR 107 -6.767 -11.131 -0.651 757 HG22 THR 107 1HG2 THR 107 -8.237 -10.180 -0.859 758 HG23 THR 107 2HG2 THR 107 -6.715 -9.378 -0.471 759 H LEU 108 H LEU 108 -9.724 -8.917 -1.399 760 HA LEU 108 HA LEU 108 -9.002 -6.071 -1.158 761 HB2 LEU 108 1HB LEU 108 -11.757 -7.210 -0.743 762 HB3 LEU 108 2HB LEU 108 -11.292 -5.510 -0.764 763 HG LEU 108 HG LEU 108 -10.564 -6.643 -3.264 764 HD11 LEU 108 1HD1 LEU 108 -13.417 -7.213 -2.473 765 HD12 LEU 108 2HD1 LEU 108 -12.170 -8.418 -2.792 766 HD13 LEU 108 3HD1 LEU 108 -12.737 -7.372 -4.093 767 HD21 LEU 108 3HD2 LEU 108 -11.039 -4.413 -3.340 768 HD22 LEU 108 1HD2 LEU 108 -12.389 -4.547 -2.214 769 HD23 LEU 108 2HD2 LEU 108 -12.586 -5.057 -3.890 770 H VAL 109 H VAL 109 -8.657 -5.300 0.854 771 HA VAL 109 HA VAL 109 -8.874 -7.220 3.065 772 HB VAL 109 HB VAL 109 -7.316 -4.640 3.084 773 HG11 VAL 109 1HG1 VAL 109 -7.770 -6.830 4.959 774 HG12 VAL 109 2HG1 VAL 109 -6.064 -6.445 4.722 775 HG13 VAL 109 3HG1 VAL 109 -7.188 -5.191 5.248 776 HG21 VAL 109 3HG2 VAL 109 -6.544 -7.353 2.072 777 HG22 VAL 109 1HG2 VAL 109 -6.290 -5.774 1.328 778 HG23 VAL 109 2HG2 VAL 109 -5.334 -6.252 2.731 779 H PHE 110 H PHE 110 -10.463 -6.972 4.478 780 HA PHE 110 HA PHE 110 -11.617 -4.286 4.841 781 HB2 PHE 110 1HB PHE 110 -12.879 -6.987 4.659 782 HB3 PHE 110 2HB PHE 110 -13.638 -5.773 5.683 783 HD1 PHE 110 HD2 PHE 110 -12.287 -6.193 2.236 784 HD2 PHE 110 HD1 PHE 110 -15.173 -4.334 4.752 785 HE1 PHE 110 HE2 PHE 110 -13.376 -5.215 0.259 786 HE2 PHE 110 HE1 PHE 110 -16.267 -3.354 2.779 787 HZ PHE 110 HZ PHE 110 -15.368 -3.792 0.528 788 H GLU 111 H GLU 111 -11.916 -3.517 6.885 789 HA GLU 111 HA GLU 111 -10.630 -5.046 9.024 790 HB2 GLU 111 1HB GLU 111 -10.150 -2.538 8.352 791 HB3 GLU 111 2HB GLU 111 -11.546 -2.224 9.373 792 HG2 GLU 111 1HG GLU 111 -9.826 -3.997 10.763 793 HG3 GLU 111 2HG GLU 111 -8.856 -2.666 10.135 794 H VAL 112 H VAL 112 -11.626 -5.487 10.978 795 HA VAL 112 HA VAL 112 -14.497 -4.882 11.174 796 HB VAL 112 HB VAL 112 -13.430 -7.543 12.060 797 HG11 VAL 112 1HG1 VAL 112 -15.623 -8.159 12.277 798 HG12 VAL 112 2HG1 VAL 112 -15.753 -6.434 12.624 799 HG13 VAL 112 3HG1 VAL 112 -16.175 -7.048 11.025 800 HG21 VAL 112 3HG2 VAL 112 -14.390 -6.801 9.302 801 HG22 VAL 112 1HG2 VAL 112 -12.830 -7.490 9.752 802 HG23 VAL 112 2HG2 VAL 112 -14.297 -8.459 9.894 803 H GLU 113 H GLU 113 -15.065 -4.051 13.076 804 HA GLU 113 HA GLU 113 -13.410 -4.627 15.433 805 HB2 GLU 113 1HB GLU 113 -13.641 -2.239 16.120 806 HB3 GLU 113 2HB GLU 113 -12.656 -2.474 14.683 807 HG2 GLU 113 1HG GLU 113 -14.698 -1.924 13.325 808 HG3 GLU 113 2HG GLU 113 -15.474 -1.447 14.834 809 H LEU 114 H LEU 114 -14.685 -5.584 16.865 810 HA LEU 114 HA LEU 114 -17.543 -5.238 16.817 811 HB2 LEU 114 1HB LEU 114 -16.049 -7.332 17.432 812 HB3 LEU 114 2HB LEU 114 -16.160 -6.636 19.048 813 HG LEU 114 HG LEU 114 -18.529 -7.412 17.347 814 HD11 LEU 114 1HD1 LEU 114 -17.863 -8.899 19.806 815 HD12 LEU 114 2HD1 LEU 114 -16.821 -9.184 18.413 816 HD13 LEU 114 3HD1 LEU 114 -18.558 -9.463 18.286 817 HD21 LEU 114 3HD2 LEU 114 -18.186 -6.078 19.957 818 HD22 LEU 114 1HD2 LEU 114 -19.418 -7.338 19.881 819 HD23 LEU 114 2HD2 LEU 114 -19.497 -5.961 18.782 820 H LEU 115 H LEU 115 -18.705 -3.857 17.988 821 HA LEU 115 HA LEU 115 -17.332 -2.260 20.023 822 HB2 LEU 115 1HB LEU 115 -20.093 -1.726 18.997 823 HB3 LEU 115 2HB LEU 115 -18.928 -0.596 19.685 824 HG LEU 115 HG LEU 115 -18.891 -1.818 16.931 825 HD11 LEU 115 1HD1 LEU 115 -19.459 0.244 16.131 826 HD12 LEU 115 2HD1 LEU 115 -18.773 1.095 17.514 827 HD13 LEU 115 3HD1 LEU 115 -20.322 0.266 17.669 828 HD21 LEU 115 3HD2 LEU 115 -16.760 -0.474 18.513 829 HD22 LEU 115 1HD2 LEU 115 -16.880 -0.124 16.789 830 HD23 LEU 115 2HD2 LEU 115 -16.641 -1.783 17.336 831 H ASP 116 H ASP 116 -20.170 -4.302 19.552 832 HA ASP 116 HA ASP 116 -20.192 -5.231 22.201 833 HB2 ASP 116 1HB ASP 116 -20.970 -3.053 22.856 834 HB3 ASP 116 2HB ASP 116 -22.183 -3.045 21.579 835 H VAL 117 H VAL 117 -21.853 -6.779 22.593 836 HA VAL 117 HA VAL 117 -22.968 -7.856 20.121 837 HB VAL 117 HB VAL 117 -23.482 -9.864 21.486 838 HG11 VAL 117 1HG1 VAL 117 -20.817 -10.002 22.182 839 HG12 VAL 117 2HG1 VAL 117 -21.503 -10.408 20.608 840 HG13 VAL 117 3HG1 VAL 117 -20.843 -8.797 20.895 841 HG21 VAL 117 3HG2 VAL 117 -23.249 -8.139 23.631 842 HG22 VAL 117 1HG2 VAL 117 -23.373 -9.896 23.715 843 HG23 VAL 117 2HG2 VAL 117 -21.788 -9.122 23.728 844 H13 JZF 130 1H3 JZF 130 -17.350 -5.563 -0.297 845 H23 JZF 130 2H3 JZF 130 -17.726 -4.593 1.116 846 H4 JZF 130 H4 JZF 130 -19.067 -4.468 -1.609 847 H15 JZF 130 1H5 JZF 130 -20.432 -2.635 -0.770 848 H25 JZF 130 2H5 JZF 130 -19.681 -2.725 0.816 849 H17 JZF 130 1H7 JZF 130 -17.230 -2.399 -0.359 850 H27 JZF 130 2H7 JZF 130 -16.799 -3.533 -1.599 851 H8 JZF 130 H8 JZF 130 -19.044 -1.900 -2.378 852 H9 JZF 130 H9 JZF 130 -16.522 -2.771 -3.705 853 H1OH JZF 130 1HO JZF 130 -16.828 -0.625 -1.315 854 H11 JZF 130 H11 JZF 130 -17.086 -4.113 -5.847 855 H112 JZF 130 1H12 JZF 130 -18.640 -1.729 -6.975 856 H212 JZF 130 2H12 JZF 130 -17.311 -2.557 -7.772 857 H13A JZF 130 H13 JZF 130 -16.700 -0.366 -6.678 858 H114 JZF 130 1H14 JZF 130 -16.491 -0.273 -4.223 859 H214 JZF 130 2H14 JZF 130 -18.143 -0.391 -4.774 860 H115 JZF 130 1H15 JZF 130 -22.197 -6.175 1.927 861 H215 JZF 130 2H15 JZF 130 -21.066 -7.488 1.600 862 H116 JZF 130 1H16 JZF 130 -20.402 -7.692 -2.507 863 H216 JZF 130 2H16 JZF 130 -20.177 -8.191 -0.803 864 H117 JZF 130 2H17 JZF 130 -21.197 -9.927 -2.597 865 H217 JZF 130 3H17 JZF 130 -21.847 -9.870 -0.947 866 H317 JZF 130 1H17 JZF 130 -22.701 -9.050 -2.266 867 H118 JZF 130 1H18 JZF 130 -18.684 -4.731 -7.627 868 H218 JZF 130 2H18 JZF 130 -19.280 -5.288 -6.058 869 H318 JZF 130 3H18 JZF 130 -19.982 -3.846 -6.811 870 H119 JZF 130 3H19 JZF 130 -15.228 -2.910 -6.337 871 H219 JZF 130 1H19 JZF 130 -14.667 -1.317 -6.857 872 H319 JZF 130 2H19 JZF 130 -14.791 -1.689 -5.137 Start of MODEL 8 1 H1 GLY 1 H GLY 1 3.775 -0.621 22.357 2 HA2 GLY 1 1HA GLY 1 6.272 -0.414 22.617 3 HA3 GLY 1 2HA GLY 1 6.260 -2.164 22.770 4 HA PRO 2 HA PRO 2 6.761 -0.746 18.277 5 HB2 PRO 2 1HB PRO 2 9.344 -1.516 17.950 6 HB3 PRO 2 2HB PRO 2 8.886 0.099 18.501 7 HG2 PRO 2 1HG PRO 2 9.797 -2.261 20.101 8 HG3 PRO 2 2HG PRO 2 10.258 -0.556 20.261 9 HD2 PRO 2 1HD PRO 2 8.438 -1.731 21.885 10 HD3 PRO 2 2HD PRO 2 8.345 -0.018 21.428 11 H GLY 3 H GLY 3 6.266 -2.170 16.707 12 HA2 GLY 3 1HA GLY 3 7.306 -4.853 16.682 13 HA3 GLY 3 2HA GLY 3 5.605 -4.782 17.118 14 H SER 4 H SER 4 6.913 -5.963 14.763 15 HA SER 4 HA SER 4 6.222 -4.269 12.535 16 HB2 SER 4 1HB SER 4 7.260 -5.836 11.201 17 HB3 SER 4 2HB SER 4 8.052 -6.182 12.738 18 HG SER 4 HG SER 4 6.927 -7.941 11.350 19 H MET 5 H MET 5 4.759 -5.075 10.799 20 HA MET 5 HA MET 5 2.337 -6.230 12.005 21 HB2 MET 5 1HB MET 5 2.758 -4.264 9.772 22 HB3 MET 5 2HB MET 5 1.252 -5.162 9.909 23 HG2 MET 5 1HG MET 5 0.590 -4.049 11.778 24 HG3 MET 5 2HG MET 5 2.240 -3.745 12.316 25 HE1 MET 5 3HE MET 5 3.587 -1.010 11.127 26 HE2 MET 5 1HE MET 5 2.332 -0.352 12.177 27 HE3 MET 5 2HE MET 5 3.070 -1.909 12.554 28 H THR 6 H THR 6 2.535 -8.388 11.657 29 HA THR 6 HA THR 6 3.148 -9.306 8.935 30 HB THR 6 HB THR 6 4.566 -10.356 10.548 31 HG1 THR 6 HG1 THR 6 2.653 -12.382 10.206 32 HG21 THR 6 3HG2 THR 6 2.032 -11.058 12.034 33 HG22 THR 6 1HG2 THR 6 3.301 -9.958 12.570 34 HG23 THR 6 2HG2 THR 6 3.633 -11.684 12.427 35 H VAL 7 H VAL 7 1.646 -10.251 7.695 36 HA VAL 7 HA VAL 7 -1.060 -10.485 8.758 37 HB VAL 7 HB VAL 7 -0.728 -9.299 6.626 38 HG11 VAL 7 1HG1 VAL 7 -0.127 -10.541 4.607 39 HG12 VAL 7 2HG1 VAL 7 1.179 -10.576 5.793 40 HG13 VAL 7 3HG1 VAL 7 0.146 -11.989 5.576 41 HG21 VAL 7 3HG2 VAL 7 -2.868 -10.376 7.085 42 HG22 VAL 7 1HG2 VAL 7 -2.491 -10.438 5.363 43 HG23 VAL 7 2HG2 VAL 7 -2.280 -11.875 6.365 44 H VAL 8 H VAL 8 -2.198 -12.363 8.907 45 HA VAL 8 HA VAL 8 -0.714 -14.845 8.337 46 HB VAL 8 HB VAL 8 -2.846 -14.385 10.429 47 HG11 VAL 8 1HG1 VAL 8 -1.170 -16.827 9.854 48 HG12 VAL 8 2HG1 VAL 8 -2.316 -16.645 11.184 49 HG13 VAL 8 3HG1 VAL 8 -2.892 -16.653 9.517 50 HG21 VAL 8 3HG2 VAL 8 -0.939 -14.833 12.006 51 HG22 VAL 8 1HG2 VAL 8 0.146 -14.667 10.625 52 HG23 VAL 8 2HG2 VAL 8 -0.848 -13.302 11.135 53 H THR 9 H THR 9 -1.666 -16.424 7.156 54 HA THR 9 HA THR 9 -4.290 -15.793 5.994 55 HB THR 9 HB THR 9 -2.183 -17.700 4.961 56 HG1 THR 9 HG1 THR 9 -1.735 -15.340 4.900 57 HG21 THR 9 3HG2 THR 9 -4.883 -16.859 3.973 58 HG22 THR 9 1HG2 THR 9 -4.183 -18.474 4.065 59 HG23 THR 9 2HG2 THR 9 -3.628 -17.342 2.832 60 H THR 10 H THR 10 -5.912 -17.351 5.866 61 HA THR 10 HA THR 10 -5.743 -19.426 7.910 62 HB THR 10 HB THR 10 -8.163 -19.637 7.669 63 HG1 THR 10 HG1 THR 10 -7.815 -17.735 5.575 64 HG21 THR 10 3HG2 THR 10 -7.028 -16.878 7.999 65 HG22 THR 10 1HG2 THR 10 -7.617 -17.989 9.235 66 HG23 THR 10 2HG2 THR 10 -8.758 -17.176 8.163 67 H GLU 11 H GLU 11 -6.940 -21.519 7.378 68 HA GLU 11 HA GLU 11 -5.584 -22.840 5.300 69 HB2 GLU 11 1HB GLU 11 -6.779 -24.777 5.925 70 HB3 GLU 11 2HB GLU 11 -6.582 -23.856 7.409 71 HG2 GLU 11 1HG GLU 11 -9.063 -23.920 5.707 72 HG3 GLU 11 2HG GLU 11 -8.819 -24.811 7.208 73 H SER 12 H SER 12 -8.582 -21.116 5.378 74 HA SER 12 HA SER 12 -9.576 -22.261 2.917 75 HB2 SER 12 1HB SER 12 -11.280 -20.324 3.194 76 HB3 SER 12 2HB SER 12 -11.313 -21.643 4.363 77 HG SER 12 HG SER 12 -11.248 -19.949 5.668 78 H GLY 13 H GLY 13 -8.165 -19.185 3.977 79 HA2 GLY 13 1HA GLY 13 -6.588 -18.514 1.955 80 HA3 GLY 13 2HA GLY 13 -8.157 -18.194 1.232 81 H LEU 14 H LEU 14 -9.475 -17.202 3.523 82 HA LEU 14 HA LEU 14 -8.820 -14.495 3.399 83 HB2 LEU 14 1HB LEU 14 -11.008 -15.215 4.074 84 HB3 LEU 14 2HB LEU 14 -10.348 -16.044 5.483 85 HG LEU 14 HG LEU 14 -9.674 -13.240 5.542 86 HD11 LEU 14 1HD1 LEU 14 -11.963 -13.444 4.214 87 HD12 LEU 14 2HD1 LEU 14 -11.674 -12.173 5.401 88 HD13 LEU 14 3HD1 LEU 14 -12.599 -13.605 5.852 89 HD21 LEU 14 3HD2 LEU 14 -9.892 -15.128 7.356 90 HD22 LEU 14 1HD2 LEU 14 -11.560 -14.562 7.431 91 HD23 LEU 14 2HD2 LEU 14 -10.235 -13.444 7.754 92 H LYS 15 H LYS 15 -7.692 -13.110 4.724 93 HA LYS 15 HA LYS 15 -5.881 -14.398 6.657 94 HB2 LYS 15 1HB LYS 15 -5.466 -11.845 5.090 95 HB3 LYS 15 2HB LYS 15 -4.318 -12.558 6.215 96 HG2 LYS 15 1HG LYS 15 -3.424 -13.547 4.437 97 HG3 LYS 15 2HG LYS 15 -4.827 -14.618 4.470 98 HD2 LYS 15 1HD LYS 15 -5.940 -13.398 2.810 99 HD3 LYS 15 2HD LYS 15 -4.904 -11.986 3.029 100 HE2 LYS 15 1HE LYS 15 -4.372 -13.180 0.961 101 HE3 LYS 15 2HE LYS 15 -3.018 -13.207 2.090 102 HZ1 LYS 15 3HZ LYS 15 -3.114 -15.417 2.260 103 HZ2 LYS 15 1HZ LYS 15 -4.045 -15.370 0.848 104 HZ3 LYS 15 2HZ LYS 15 -4.802 -15.451 2.358 105 H TYR 16 H TYR 16 -5.133 -12.924 8.433 106 HA TYR 16 HA TYR 16 -7.016 -10.840 9.185 107 HB2 TYR 16 1HB TYR 16 -7.662 -11.810 11.261 108 HB3 TYR 16 2HB TYR 16 -7.921 -13.047 10.036 109 HD1 TYR 16 HD2 TYR 16 -5.951 -14.737 9.705 110 HD2 TYR 16 HD1 TYR 16 -6.485 -12.348 13.184 111 HE1 TYR 16 HE2 TYR 16 -4.557 -16.305 10.988 112 HE2 TYR 16 HE1 TYR 16 -5.092 -13.909 14.478 113 HH TYR 16 HH TYR 16 -3.990 -16.944 13.120 114 H GLU 17 H GLU 17 -6.064 -9.241 10.310 115 HA GLU 17 HA GLU 17 -3.449 -9.765 11.546 116 HB2 GLU 17 1HB GLU 17 -3.846 -8.293 9.189 117 HB3 GLU 17 2HB GLU 17 -3.581 -7.096 10.449 118 HG2 GLU 17 1HG GLU 17 -1.721 -9.371 10.458 119 HG3 GLU 17 2HG GLU 17 -1.614 -8.302 9.061 120 H ASP 18 H ASP 18 -3.463 -9.196 13.608 121 HA ASP 18 HA ASP 18 -5.591 -7.879 14.865 122 HB2 ASP 18 1HB ASP 18 -3.638 -9.388 15.809 123 HB3 ASP 18 2HB ASP 18 -2.867 -7.830 16.093 124 H LEU 19 H LEU 19 -6.020 -5.796 15.322 125 HA LEU 19 HA LEU 19 -4.005 -3.790 14.547 126 HB2 LEU 19 1HB LEU 19 -6.908 -3.988 13.963 127 HB3 LEU 19 2HB LEU 19 -6.242 -2.384 14.262 128 HG LEU 19 HG LEU 19 -5.327 -4.296 12.113 129 HD11 LEU 19 1HD1 LEU 19 -7.506 -2.441 12.221 130 HD12 LEU 19 2HD1 LEU 19 -7.015 -3.513 10.910 131 HD13 LEU 19 3HD1 LEU 19 -6.315 -1.899 11.038 132 HD21 LEU 19 3HD2 LEU 19 -4.430 -1.549 12.933 133 HD22 LEU 19 1HD2 LEU 19 -4.163 -2.178 11.307 134 HD23 LEU 19 2HD2 LEU 19 -3.458 -3.003 12.698 135 H THR 20 H THR 20 -6.512 -4.729 16.800 136 HA THR 20 HA THR 20 -5.329 -3.117 18.867 137 HB THR 20 HB THR 20 -8.228 -2.532 18.337 138 HG1 THR 20 HG1 THR 20 -7.590 -0.715 17.162 139 HG21 THR 20 3HG2 THR 20 -7.349 -0.348 19.491 140 HG22 THR 20 1HG2 THR 20 -6.034 -1.397 20.019 141 HG23 THR 20 2HG2 THR 20 -7.699 -1.783 20.455 142 H GLU 21 H GLU 21 -5.351 -4.374 20.601 143 HA GLU 21 HA GLU 21 -6.670 -6.783 20.856 144 HB2 GLU 21 1HB GLU 21 -4.766 -5.700 22.281 145 HB3 GLU 21 2HB GLU 21 -6.090 -5.129 23.288 146 HG2 GLU 21 1HG GLU 21 -6.778 -7.342 23.790 147 HG3 GLU 21 2HG GLU 21 -5.702 -8.020 22.570 148 H GLY 22 H GLY 22 -8.336 -7.390 22.493 149 HA2 GLY 22 1HA GLY 22 -10.225 -5.431 23.369 150 HA3 GLY 22 2HA GLY 22 -10.797 -6.289 21.946 151 H SER 23 H SER 23 -10.085 -6.502 25.337 152 HA SER 23 HA SER 23 -10.604 -9.319 25.545 153 HB2 SER 23 1HB SER 23 -10.582 -7.260 27.762 154 HB3 SER 23 2HB SER 23 -10.387 -9.005 27.930 155 HG SER 23 HG SER 23 -8.344 -8.690 27.633 156 H GLY 24 H GLY 24 -12.667 -9.353 24.429 157 HA2 GLY 24 1HA GLY 24 -14.881 -8.588 26.229 158 HA3 GLY 24 2HA GLY 24 -14.986 -8.370 24.488 159 H ALA 25 H ALA 25 -15.982 -9.919 23.390 160 HA ALA 25 HA ALA 25 -15.762 -12.695 24.218 161 HB1 ALA 25 1HB ALA 25 -17.751 -12.879 25.177 162 HB2 ALA 25 2HB ALA 25 -18.005 -11.145 24.970 163 HB3 ALA 25 3HB ALA 25 -18.531 -12.270 23.717 164 H GLU 26 H GLU 26 -15.852 -14.077 22.527 165 HA GLU 26 HA GLU 26 -15.788 -13.016 19.888 166 HB2 GLU 26 1HB GLU 26 -14.648 -15.149 20.899 167 HB3 GLU 26 2HB GLU 26 -16.151 -15.937 20.438 168 HG2 GLU 26 1HG GLU 26 -15.559 -14.624 18.154 169 HG3 GLU 26 2HG GLU 26 -13.942 -14.953 18.775 170 H ALA 27 H ALA 27 -17.329 -12.899 18.360 171 HA ALA 27 HA ALA 27 -20.043 -13.008 19.040 172 HB1 ALA 27 1HB ALA 27 -18.912 -13.161 16.251 173 HB2 ALA 27 2HB ALA 27 -20.501 -12.566 16.735 174 HB3 ALA 27 3HB ALA 27 -19.050 -11.669 17.183 175 H ARG 28 H ARG 28 -21.708 -14.429 18.399 176 HA ARG 28 HA ARG 28 -20.803 -17.136 17.668 177 HB2 ARG 28 1HB ARG 28 -23.095 -16.486 19.526 178 HB3 ARG 28 2HB ARG 28 -22.466 -18.083 19.141 179 HG2 ARG 28 1HG ARG 28 -20.485 -17.709 20.356 180 HG3 ARG 28 2HG ARG 28 -20.792 -15.975 20.469 181 HD2 ARG 28 1HD ARG 28 -21.266 -17.046 22.590 182 HD3 ARG 28 2HD ARG 28 -22.755 -16.432 21.874 183 HE ARG 28 HE ARG 28 -22.212 -19.195 21.274 184 HH11 ARG 28 1HH1 ARG 28 -23.675 -16.971 23.517 185 HH12 ARG 28 2HH1 ARG 28 -24.776 -18.142 24.162 186 HH21 ARG 28 1HH2 ARG 28 -23.657 -20.747 22.116 187 HH22 ARG 28 2HH2 ARG 28 -24.764 -20.290 23.365 188 H ALA 29 H ALA 29 -21.969 -18.217 16.148 189 HA ALA 29 HA ALA 29 -23.549 -16.766 14.342 190 HB1 ALA 29 1HB ALA 29 -22.827 -18.527 13.176 191 HB2 ALA 29 2HB ALA 29 -22.622 -19.511 14.626 192 HB3 ALA 29 3HB ALA 29 -24.205 -19.391 13.858 193 H GLY 30 H GLY 30 -25.563 -16.062 14.566 194 HA2 GLY 30 1HA GLY 30 -27.914 -16.765 14.747 195 HA3 GLY 30 2HA GLY 30 -27.439 -17.698 16.158 196 H GLN 31 H GLN 31 -25.629 -15.289 16.829 197 HA GLN 31 HA GLN 31 -27.727 -13.822 18.258 198 HB2 GLN 31 1HB GLN 31 -26.237 -13.454 19.959 199 HB3 GLN 31 2HB GLN 31 -25.592 -14.963 19.327 200 HG2 GLN 31 1HG GLN 31 -23.942 -13.708 18.029 201 HG3 GLN 31 2HG GLN 31 -24.582 -12.202 18.684 202 HE21 GLN 31 2HE2 GLN 31 -24.184 -11.671 20.826 203 HE22 GLN 31 1HE2 GLN 31 -22.971 -12.466 21.764 204 H THR 32 H THR 32 -27.907 -11.606 18.172 205 HA THR 32 HA THR 32 -26.774 -10.359 15.810 206 HB THR 32 HB THR 32 -28.619 -9.055 17.809 207 HG1 THR 32 HG1 THR 32 -29.593 -10.986 17.077 208 HG21 THR 32 3HG2 THR 32 -28.856 -8.486 14.941 209 HG22 THR 32 1HG2 THR 32 -27.315 -8.006 15.651 210 HG23 THR 32 2HG2 THR 32 -28.826 -7.383 16.316 211 H VAL 33 H VAL 33 -25.280 -8.762 15.771 212 HA VAL 33 HA VAL 33 -24.479 -7.445 18.241 213 HB VAL 33 HB VAL 33 -22.140 -7.979 18.038 214 HG11 VAL 33 1HG1 VAL 33 -23.641 -10.578 17.813 215 HG12 VAL 33 2HG1 VAL 33 -22.164 -10.253 18.722 216 HG13 VAL 33 3HG1 VAL 33 -23.696 -9.549 19.244 217 HG21 VAL 33 3HG2 VAL 33 -21.278 -8.512 16.061 218 HG22 VAL 33 1HG2 VAL 33 -22.056 -10.090 16.181 219 HG23 VAL 33 2HG2 VAL 33 -22.888 -8.755 15.384 220 H SER 34 H SER 34 -22.894 -5.690 17.833 221 HA SER 34 HA SER 34 -23.324 -4.532 15.159 222 HB2 SER 34 1HB SER 34 -22.562 -2.428 16.768 223 HB3 SER 34 2HB SER 34 -24.224 -2.839 16.348 224 HG SER 34 HG SER 34 -24.392 -2.973 18.454 225 H VAL 35 H VAL 35 -21.606 -4.178 13.917 226 HA VAL 35 HA VAL 35 -18.979 -3.784 15.142 227 HB VAL 35 HB VAL 35 -17.873 -5.434 13.867 228 HG11 VAL 35 1HG1 VAL 35 -18.729 -7.430 14.740 229 HG12 VAL 35 2HG1 VAL 35 -19.310 -6.186 15.848 230 HG13 VAL 35 3HG1 VAL 35 -20.396 -6.866 14.636 231 HG21 VAL 35 3HG2 VAL 35 -20.406 -5.507 12.286 232 HG22 VAL 35 1HG2 VAL 35 -18.737 -5.373 11.731 233 HG23 VAL 35 2HG2 VAL 35 -19.352 -6.921 12.311 234 H HIS 36 H HIS 36 -17.394 -2.892 13.667 235 HA HIS 36 HA HIS 36 -18.665 -1.361 11.498 236 HB2 HIS 36 1HB HIS 36 -16.734 -0.663 13.584 237 HB3 HIS 36 2HB HIS 36 -16.241 -0.136 11.977 238 HD1 HIS 36 HD1 HIS 36 -19.013 0.645 10.855 239 HD2 HIS 36 HD2 HIS 36 -17.620 1.697 14.625 240 HE1 HIS 36 HE1 HIS 36 -20.320 2.692 11.508 241 H TYR 37 H TYR 37 -17.958 -1.573 9.460 242 HA TYR 37 HA TYR 37 -15.559 -3.228 9.018 243 HB2 TYR 37 1HB TYR 37 -16.580 -4.080 7.006 244 HB3 TYR 37 2HB TYR 37 -17.715 -4.288 8.336 245 HD1 TYR 37 HD2 TYR 37 -19.563 -2.524 8.593 246 HD2 TYR 37 HD1 TYR 37 -17.232 -2.963 5.060 247 HE1 TYR 37 HE2 TYR 37 -21.289 -1.328 7.312 248 HE2 TYR 37 HE1 TYR 37 -18.952 -1.768 3.770 249 HH TYR 37 HH TYR 37 -20.996 -0.879 3.807 250 H THR 38 H THR 38 -13.949 -2.383 7.858 251 HA THR 38 HA THR 38 -14.473 0.104 6.362 252 HB THR 38 HB THR 38 -11.705 -0.309 7.257 253 HG1 THR 38 HG1 THR 38 -12.181 0.268 9.422 254 HG21 THR 38 3HG2 THR 38 -12.519 1.742 6.162 255 HG22 THR 38 1HG2 THR 38 -11.873 2.065 7.770 256 HG23 THR 38 2HG2 THR 38 -13.617 2.015 7.514 257 H GLY 39 H GLY 39 -14.445 -0.409 4.262 258 HA2 GLY 39 1HA GLY 39 -13.081 -2.617 3.153 259 HA3 GLY 39 2HA GLY 39 -13.764 -1.274 2.248 260 H TRP 40 H TRP 40 -10.924 -2.790 3.290 261 HA TRP 40 HA TRP 40 -9.317 -0.473 2.432 262 HB2 TRP 40 1HB TRP 40 -8.637 -2.693 4.367 263 HB3 TRP 40 2HB TRP 40 -7.458 -1.537 3.755 264 HD1 TRP 40 HD1 TRP 40 -10.168 0.669 4.059 265 HE1 TRP 40 HE1 TRP 40 -10.317 1.800 6.366 266 HE3 TRP 40 HE3 TRP 40 -7.149 -2.493 6.709 267 HZ2 TRP 40 HZ2 TRP 40 -9.290 1.404 8.965 268 HZ3 TRP 40 HZ3 TRP 40 -6.784 -2.047 9.100 269 HH2 TRP 40 HH2 TRP 40 -7.832 -0.137 10.203 270 H LEU 41 H LEU 41 -7.210 -1.073 1.410 271 HA LEU 41 HA LEU 41 -7.668 -3.234 -0.511 272 HB2 LEU 41 1HB LEU 41 -5.854 -0.839 -0.500 273 HB3 LEU 41 2HB LEU 41 -5.693 -2.135 -1.683 274 HG LEU 41 HG LEU 41 -6.902 -0.373 -2.718 275 HD11 LEU 41 1HD1 LEU 41 -7.781 -2.871 -2.724 276 HD12 LEU 41 2HD1 LEU 41 -8.636 -1.578 -3.564 277 HD13 LEU 41 3HD1 LEU 41 -9.188 -2.114 -1.978 278 HD21 LEU 41 3HD2 LEU 41 -7.576 0.737 -0.588 279 HD22 LEU 41 1HD2 LEU 41 -8.868 -0.454 -0.435 280 HD23 LEU 41 2HD2 LEU 41 -8.855 0.662 -1.801 281 H THR 42 H THR 42 -5.475 -4.214 -1.322 282 HA THR 42 HA THR 42 -4.408 -5.701 0.855 283 HB THR 42 HB THR 42 -3.169 -6.927 -0.724 284 HG1 THR 42 HG1 THR 42 -2.889 -6.012 -2.913 285 HG21 THR 42 3HG2 THR 42 -5.751 -6.839 -1.004 286 HG22 THR 42 1HG2 THR 42 -4.778 -7.619 -2.250 287 HG23 THR 42 2HG2 THR 42 -5.387 -5.983 -2.502 288 H ASP 43 H ASP 43 -3.678 -2.652 -0.332 289 HA ASP 43 HA ASP 43 -0.871 -2.776 0.494 290 HB2 ASP 43 1HB ASP 43 -2.460 -0.681 -0.991 291 HB3 ASP 43 2HB ASP 43 -0.806 -0.424 -0.441 292 H GLY 44 H GLY 44 -3.953 -1.729 1.569 293 HA2 GLY 44 1HA GLY 44 -4.150 -1.282 3.965 294 HA3 GLY 44 2HA GLY 44 -2.661 -0.357 3.844 295 H GLN 45 H GLN 45 -4.498 0.226 1.134 296 HA GLN 45 HA GLN 45 -5.152 2.880 2.043 297 HB2 GLN 45 1HB GLN 45 -5.758 1.546 -0.602 298 HB3 GLN 45 2HB GLN 45 -5.882 3.266 -0.257 299 HG2 GLN 45 1HG GLN 45 -3.622 3.583 -0.291 300 HG3 GLN 45 2HG GLN 45 -3.271 1.923 0.189 301 HE21 GLN 45 2HE2 GLN 45 -5.137 3.363 -2.464 302 HE22 GLN 45 1HE2 GLN 45 -4.306 2.530 -3.728 303 H LYS 46 H LYS 46 -7.208 3.798 2.178 304 HA LYS 46 HA LYS 46 -9.362 1.851 2.623 305 HB2 LYS 46 1HB LYS 46 -8.772 3.269 4.541 306 HB3 LYS 46 2HB LYS 46 -9.097 4.707 3.582 307 HG2 LYS 46 1HG LYS 46 -11.456 3.544 3.301 308 HG3 LYS 46 2HG LYS 46 -10.981 2.782 4.821 309 HD2 LYS 46 1HD LYS 46 -10.750 5.748 4.460 310 HD3 LYS 46 2HD LYS 46 -12.296 5.011 4.889 311 HE2 LYS 46 1HE LYS 46 -11.450 4.173 6.919 312 HE3 LYS 46 2HE LYS 46 -9.779 4.447 6.429 313 HZ1 LYS 46 3HZ LYS 46 -10.902 6.919 6.309 314 HZ2 LYS 46 1HZ LYS 46 -9.941 6.333 7.571 315 HZ3 LYS 46 2HZ LYS 46 -11.627 6.242 7.679 316 H PHE 47 H PHE 47 -11.184 1.878 1.440 317 HA PHE 47 HA PHE 47 -11.772 4.198 -0.241 318 HB2 PHE 47 1HB PHE 47 -11.941 2.964 -2.250 319 HB3 PHE 47 2HB PHE 47 -10.423 2.447 -1.524 320 HD1 PHE 47 HD1 PHE 47 -10.638 0.334 0.051 321 HD2 PHE 47 HD2 PHE 47 -13.366 1.357 -3.052 322 HE1 PHE 47 HE1 PHE 47 -11.380 -2.009 -0.064 323 HE2 PHE 47 HE2 PHE 47 -14.113 -0.984 -3.172 324 HZ PHE 47 HZ PHE 47 -13.120 -2.671 -1.676 325 H ASP 48 H ASP 48 -12.901 2.792 2.178 326 HA ASP 48 HA ASP 48 -15.620 3.188 1.628 327 HB2 ASP 48 1HB ASP 48 -15.746 1.211 0.374 328 HB3 ASP 48 2HB ASP 48 -14.646 0.351 1.448 329 H SER 49 H SER 49 -16.534 3.678 3.510 330 HA SER 49 HA SER 49 -15.701 2.277 5.938 331 HB2 SER 49 1HB SER 49 -14.280 4.264 5.870 332 HB3 SER 49 2HB SER 49 -15.696 5.292 5.647 333 HG SER 49 HG SER 49 -15.220 3.636 7.904 334 H SER 50 H SER 50 -17.280 2.097 7.482 335 HA SER 50 HA SER 50 -19.969 2.409 6.625 336 HB2 SER 50 1HB SER 50 -20.030 2.009 9.392 337 HB3 SER 50 2HB SER 50 -20.136 0.766 8.145 338 HG SER 50 HG SER 50 -17.763 1.728 9.373 339 H LYS 51 H LYS 51 -17.784 4.576 7.965 340 HA LYS 51 HA LYS 51 -19.313 6.114 9.707 341 HB2 LYS 51 1HB LYS 51 -17.112 6.911 7.801 342 HB3 LYS 51 2HB LYS 51 -17.800 8.008 8.991 343 HG2 LYS 51 1HG LYS 51 -17.186 6.151 10.690 344 HG3 LYS 51 2HG LYS 51 -16.111 5.581 9.411 345 HD2 LYS 51 1HD LYS 51 -15.021 7.761 9.339 346 HD3 LYS 51 2HD LYS 51 -16.119 8.363 10.583 347 HE2 LYS 51 1HE LYS 51 -14.106 7.805 11.690 348 HE3 LYS 51 2HE LYS 51 -15.248 6.517 12.069 349 HZ1 LYS 51 3HZ LYS 51 -14.197 5.309 10.111 350 HZ2 LYS 51 1HZ LYS 51 -13.281 5.424 11.529 351 HZ3 LYS 51 2HZ LYS 51 -12.945 6.441 10.220 352 H ASP 52 H ASP 52 -19.495 5.797 6.276 353 HA ASP 52 HA ASP 52 -20.602 8.187 5.463 354 HB2 ASP 52 1HB ASP 52 -20.014 6.222 4.003 355 HB3 ASP 52 2HB ASP 52 -21.525 5.472 4.511 356 H ARG 53 H ARG 53 -22.098 5.556 7.229 357 HA ARG 53 HA ARG 53 -24.684 6.934 7.164 358 HB2 ARG 53 1HB ARG 53 -24.614 4.509 6.632 359 HB3 ARG 53 2HB ARG 53 -24.005 4.197 8.251 360 HG2 ARG 53 1HG ARG 53 -26.034 4.849 9.252 361 HG3 ARG 53 2HG ARG 53 -26.623 5.580 7.757 362 HD2 ARG 53 1HD ARG 53 -26.143 2.641 8.240 363 HD3 ARG 53 2HD ARG 53 -27.713 3.441 8.171 364 HE ARG 53 HE ARG 53 -26.518 4.024 5.779 365 HH11 ARG 53 1HH1 ARG 53 -27.343 1.114 7.503 366 HH12 ARG 53 2HH1 ARG 53 -27.583 0.176 6.066 367 HH21 ARG 53 1HH2 ARG 53 -26.831 2.799 3.880 368 HH22 ARG 53 2HH2 ARG 53 -27.290 1.135 4.006 369 H ASN 54 H ASN 54 -21.960 6.462 9.148 370 HA ASN 54 HA ASN 54 -21.437 7.147 11.253 371 HB2 ASN 54 1HB ASN 54 -24.066 8.585 11.454 372 HB3 ASN 54 2HB ASN 54 -22.500 9.043 12.117 373 HD21 ASN 54 2HD2 ASN 54 -20.879 9.808 10.653 374 HD22 ASN 54 1HD2 ASN 54 -21.342 10.582 9.180 375 H ASP 55 H ASP 55 -22.168 4.679 11.335 376 HA ASP 55 HA ASP 55 -23.200 4.240 13.890 377 HB2 ASP 55 1HB ASP 55 -25.395 4.684 13.333 378 HB3 ASP 55 2HB ASP 55 -25.194 4.139 11.670 379 HA PRO 56 HA PRO 56 -21.179 0.424 13.051 380 HB2 PRO 56 1HB PRO 56 -22.115 -1.035 15.141 381 HB3 PRO 56 2HB PRO 56 -20.905 0.241 15.325 382 HG2 PRO 56 1HG PRO 56 -23.856 0.342 15.820 383 HG3 PRO 56 2HG PRO 56 -22.534 1.011 16.795 384 HD2 PRO 56 1HD PRO 56 -24.022 2.530 15.119 385 HD3 PRO 56 2HD PRO 56 -22.310 2.865 15.445 386 H PHE 57 H PHE 57 -21.566 -1.391 11.898 387 HA PHE 57 HA PHE 57 -24.181 -1.862 10.877 388 HB2 PHE 57 1HB PHE 57 -21.876 -2.277 9.754 389 HB3 PHE 57 2HB PHE 57 -21.915 -3.816 10.608 390 HD1 PHE 57 HD2 PHE 57 -24.404 -1.795 8.693 391 HD2 PHE 57 HD1 PHE 57 -22.498 -5.559 9.251 392 HE1 PHE 57 HE2 PHE 57 -25.780 -2.754 6.893 393 HE2 PHE 57 HE1 PHE 57 -23.870 -6.525 7.451 394 HZ PHE 57 HZ PHE 57 -25.514 -5.122 6.270 395 H ALA 58 H ALA 58 -25.664 -2.585 12.302 396 HA ALA 58 HA ALA 58 -24.974 -4.816 14.070 397 HB1 ALA 58 1HB ALA 58 -26.126 -2.707 14.907 398 HB2 ALA 58 2HB ALA 58 -27.567 -3.300 14.080 399 HB3 ALA 58 3HB ALA 58 -26.841 -4.249 15.377 400 H PHE 59 H PHE 59 -25.527 -6.826 13.569 401 HA PHE 59 HA PHE 59 -28.010 -7.445 12.264 402 HB2 PHE 59 1HB PHE 59 -27.133 -8.459 10.276 403 HB3 PHE 59 2HB PHE 59 -26.490 -6.822 10.361 404 HD1 PHE 59 HD2 PHE 59 -24.164 -6.680 11.673 405 HD2 PHE 59 HD1 PHE 59 -25.682 -10.128 9.693 406 HE1 PHE 59 HE2 PHE 59 -21.878 -7.568 11.474 407 HE2 PHE 59 HE1 PHE 59 -23.399 -11.022 9.491 408 HZ PHE 59 HZ PHE 59 -21.493 -9.741 10.381 409 H VAL 60 H VAL 60 -27.845 -9.964 11.610 410 HA VAL 60 HA VAL 60 -27.069 -11.282 14.092 411 HB VAL 60 HB VAL 60 -28.687 -12.275 11.742 412 HG11 VAL 60 1HG1 VAL 60 -28.032 -14.296 12.488 413 HG12 VAL 60 2HG1 VAL 60 -27.519 -13.668 14.055 414 HG13 VAL 60 3HG1 VAL 60 -29.225 -14.002 13.753 415 HG21 VAL 60 3HG2 VAL 60 -30.535 -11.597 12.819 416 HG22 VAL 60 1HG2 VAL 60 -29.915 -12.094 14.394 417 HG23 VAL 60 2HG2 VAL 60 -29.440 -10.540 13.709 418 H LEU 61 H LEU 61 -25.275 -12.441 14.282 419 HA LEU 61 HA LEU 61 -23.358 -12.699 12.276 420 HB2 LEU 61 1HB LEU 61 -22.807 -12.855 14.627 421 HB3 LEU 61 2HB LEU 61 -23.752 -14.335 14.777 422 HG LEU 61 HG LEU 61 -22.159 -15.587 13.553 423 HD11 LEU 61 1HD1 LEU 61 -20.029 -14.028 12.886 424 HD12 LEU 61 2HD1 LEU 61 -21.384 -12.958 12.529 425 HD13 LEU 61 3HD1 LEU 61 -21.292 -14.548 11.771 426 HD21 LEU 61 3HD2 LEU 61 -21.539 -14.324 15.930 427 HD22 LEU 61 1HD2 LEU 61 -20.105 -14.071 14.935 428 HD23 LEU 61 2HD2 LEU 61 -20.696 -15.707 15.230 429 H GLY 62 H GLY 62 -22.918 -14.194 10.746 430 HA2 GLY 62 1HA GLY 62 -22.992 -16.347 9.764 431 HA3 GLY 62 2HA GLY 62 -24.384 -16.729 10.765 432 H GLY 63 H GLY 63 -25.368 -13.903 9.876 433 HA2 GLY 63 1HA GLY 63 -26.352 -14.768 7.228 434 HA3 GLY 63 2HA GLY 63 -27.419 -14.062 8.432 435 H GLY 64 H GLY 64 -27.990 -12.092 7.792 436 HA2 GLY 64 1HA GLY 64 -27.798 -9.883 7.187 437 HA3 GLY 64 2HA GLY 64 -26.078 -10.013 7.521 438 H MET 65 H MET 65 -27.100 -12.349 5.318 439 HA MET 65 HA MET 65 -26.596 -12.684 3.121 440 HB2 MET 65 1HB MET 65 -27.823 -9.948 3.155 441 HB3 MET 65 2HB MET 65 -27.225 -10.627 1.648 442 HG2 MET 65 1HG MET 65 -28.784 -12.360 1.669 443 HG3 MET 65 2HG MET 65 -29.143 -12.135 3.379 444 HE1 MET 65 3HE MET 65 -30.028 -11.731 -0.031 445 HE2 MET 65 1HE MET 65 -31.548 -12.142 0.765 446 HE3 MET 65 2HE MET 65 -31.388 -10.608 -0.092 447 H VAL 66 H VAL 66 -24.331 -12.240 4.483 448 HA VAL 66 HA VAL 66 -22.798 -10.288 2.904 449 HB VAL 66 HB VAL 66 -21.125 -10.315 4.626 450 HG11 VAL 66 1HG1 VAL 66 -23.823 -9.537 5.073 451 HG12 VAL 66 2HG1 VAL 66 -23.147 -10.106 6.600 452 HG13 VAL 66 3HG1 VAL 66 -22.346 -8.812 5.708 453 HG21 VAL 66 3HG2 VAL 66 -20.814 -12.321 5.597 454 HG22 VAL 66 1HG2 VAL 66 -22.002 -11.740 6.763 455 HG23 VAL 66 2HG2 VAL 66 -22.509 -12.778 5.431 456 H ILE 67 H ILE 67 -20.462 -10.975 2.532 457 HA ILE 67 HA ILE 67 -20.496 -13.460 1.089 458 HB ILE 67 HB ILE 67 -18.325 -12.881 0.288 459 HG12 ILE 67 1HG1 ILE 67 -18.293 -10.855 2.530 460 HG13 ILE 67 2HG1 ILE 67 -17.219 -12.234 2.322 461 HG21 ILE 67 1HG2 ILE 67 -18.725 -10.726 -0.700 462 HG22 ILE 67 2HG2 ILE 67 -20.255 -11.593 -0.586 463 HG23 ILE 67 3HG2 ILE 67 -19.879 -10.314 0.568 464 HD11 ILE 67 3HD1 ILE 67 -16.070 -10.203 1.749 465 HD12 ILE 67 1HD1 ILE 67 -16.307 -11.175 0.296 466 HD13 ILE 67 2HD1 ILE 67 -17.335 -9.773 0.597 467 H LYS 68 H LYS 68 -18.804 -15.103 1.324 468 HA LYS 68 HA LYS 68 -18.758 -16.337 3.762 469 HB2 LYS 68 1HB LYS 68 -16.498 -16.468 1.761 470 HB3 LYS 68 2HB LYS 68 -16.931 -17.693 2.947 471 HG2 LYS 68 1HG LYS 68 -19.247 -17.561 1.641 472 HG3 LYS 68 2HG LYS 68 -18.170 -17.047 0.341 473 HD2 LYS 68 1HD LYS 68 -18.148 -19.323 0.036 474 HD3 LYS 68 2HD LYS 68 -16.764 -19.127 1.114 475 HE2 LYS 68 1HE LYS 68 -19.448 -19.556 2.322 476 HE3 LYS 68 2HE LYS 68 -18.643 -20.933 1.570 477 HZ1 LYS 68 3HZ LYS 68 -16.713 -19.738 3.103 478 HZ2 LYS 68 1HZ LYS 68 -17.555 -21.157 3.475 479 HZ3 LYS 68 2HZ LYS 68 -18.102 -19.670 4.066 480 H GLY 69 H GLY 69 -16.176 -14.260 2.442 481 HA2 GLY 69 1HA GLY 69 -14.405 -14.353 4.560 482 HA3 GLY 69 2HA GLY 69 -14.610 -12.960 3.507 483 H TRP 70 H TRP 70 -17.297 -12.354 4.219 484 HA TRP 70 HA TRP 70 -16.830 -10.757 6.511 485 HB2 TRP 70 1HB TRP 70 -19.124 -11.283 4.697 486 HB3 TRP 70 2HB TRP 70 -19.501 -10.622 6.286 487 HD1 TRP 70 HD1 TRP 70 -16.763 -9.739 3.661 488 HE1 TRP 70 HE1 TRP 70 -16.780 -7.185 3.343 489 HE3 TRP 70 HE3 TRP 70 -20.561 -8.547 6.868 490 HZ2 TRP 70 HZ2 TRP 70 -18.213 -4.960 4.322 491 HZ3 TRP 70 HZ3 TRP 70 -21.193 -6.182 7.121 492 HH2 TRP 70 HH2 TRP 70 -20.042 -4.427 5.874 493 H ASP 71 H ASP 71 -18.868 -13.627 5.988 494 HA ASP 71 HA ASP 71 -19.828 -13.828 8.620 495 HB2 ASP 71 1HB ASP 71 -20.645 -15.039 6.504 496 HB3 ASP 71 2HB ASP 71 -19.363 -16.203 6.827 497 H GLU 72 H GLU 72 -17.011 -15.295 7.044 498 HA GLU 72 HA GLU 72 -16.182 -16.871 9.220 499 HB2 GLU 72 1HB GLU 72 -15.387 -16.749 6.693 500 HB3 GLU 72 2HB GLU 72 -14.158 -15.693 7.373 501 HG2 GLU 72 1HG GLU 72 -14.715 -18.526 8.221 502 HG3 GLU 72 2HG GLU 72 -13.373 -17.988 7.213 503 H GLY 73 H GLY 73 -15.584 -13.511 8.376 504 HA2 GLY 73 1HA GLY 73 -13.594 -13.121 10.417 505 HA3 GLY 73 2HA GLY 73 -14.352 -11.869 9.444 506 H VAL 74 H VAL 74 -17.005 -12.185 10.046 507 HA VAL 74 HA VAL 74 -17.191 -10.870 12.545 508 HB VAL 74 HB VAL 74 -19.418 -12.132 10.940 509 HG11 VAL 74 1HG1 VAL 74 -20.857 -10.526 12.102 510 HG12 VAL 74 2HG1 VAL 74 -20.066 -11.625 13.234 511 HG13 VAL 74 3HG1 VAL 74 -19.475 -9.973 13.046 512 HG21 VAL 74 3HG2 VAL 74 -19.165 -10.514 9.440 513 HG22 VAL 74 1HG2 VAL 74 -19.303 -9.293 10.706 514 HG23 VAL 74 2HG2 VAL 74 -17.724 -9.962 10.293 515 H GLN 75 H GLN 75 -17.321 -14.194 11.616 516 HA GLN 75 HA GLN 75 -18.561 -15.027 14.112 517 HB2 GLN 75 1HB GLN 75 -18.699 -17.182 13.192 518 HB3 GLN 75 2HB GLN 75 -18.983 -16.109 11.827 519 HG2 GLN 75 1HG GLN 75 -16.640 -16.382 11.146 520 HG3 GLN 75 2HG GLN 75 -16.395 -17.497 12.490 521 HE21 GLN 75 2HE2 GLN 75 -18.944 -17.084 10.054 522 HE22 GLN 75 1HE2 GLN 75 -18.913 -18.719 9.497 523 H GLY 76 H GLY 76 -15.768 -13.773 13.752 524 HA2 GLY 76 1HA GLY 76 -14.400 -15.751 15.457 525 HA3 GLY 76 2HA GLY 76 -13.550 -15.004 14.113 526 H MET 77 H MET 77 -14.687 -12.389 14.434 527 HA MET 77 HA MET 77 -12.840 -11.266 16.214 528 HB2 MET 77 1HB MET 77 -15.366 -10.113 15.025 529 HB3 MET 77 2HB MET 77 -14.186 -9.168 15.923 530 HG2 MET 77 1HG MET 77 -13.613 -10.695 13.394 531 HG3 MET 77 2HG MET 77 -13.937 -8.966 13.487 532 HE1 MET 77 3HE MET 77 -11.158 -7.335 15.083 533 HE2 MET 77 1HE MET 77 -12.870 -7.659 15.358 534 HE3 MET 77 2HE MET 77 -11.656 -8.373 16.419 535 H LYS 78 H LYS 78 -13.255 -10.017 18.157 536 HA LYS 78 HA LYS 78 -15.526 -11.055 19.722 537 HB2 LYS 78 1HB LYS 78 -12.844 -10.352 20.904 538 HB3 LYS 78 2HB LYS 78 -14.162 -11.241 21.657 539 HG2 LYS 78 1HG LYS 78 -13.796 -13.080 20.054 540 HG3 LYS 78 2HG LYS 78 -12.419 -12.194 19.394 541 HD2 LYS 78 1HD LYS 78 -11.603 -13.824 20.958 542 HD3 LYS 78 2HD LYS 78 -11.394 -12.219 21.661 543 HE2 LYS 78 1HE LYS 78 -13.212 -12.514 23.129 544 HE3 LYS 78 2HE LYS 78 -13.805 -13.916 22.240 545 HZ1 LYS 78 3HZ LYS 78 -11.302 -14.653 22.968 546 HZ2 LYS 78 1HZ LYS 78 -12.725 -15.096 23.770 547 HZ3 LYS 78 2HZ LYS 78 -11.825 -13.771 24.313 548 H VAL 79 H VAL 79 -16.297 -9.661 21.425 549 HA VAL 79 HA VAL 79 -16.799 -7.059 20.663 550 HB VAL 79 HB VAL 79 -16.705 -8.041 23.518 551 HG11 VAL 79 1HG1 VAL 79 -18.629 -6.341 23.674 552 HG12 VAL 79 2HG1 VAL 79 -16.976 -5.727 23.615 553 HG13 VAL 79 3HG1 VAL 79 -17.984 -5.690 22.168 554 HG21 VAL 79 3HG2 VAL 79 -18.415 -9.381 23.059 555 HG22 VAL 79 1HG2 VAL 79 -19.336 -8.010 22.441 556 HG23 VAL 79 2HG2 VAL 79 -18.303 -8.940 21.355 557 H GLY 80 H GLY 80 -15.622 -5.263 20.591 558 HA2 GLY 80 1HA GLY 80 -14.122 -3.636 21.317 559 HA3 GLY 80 2HA GLY 80 -13.612 -4.716 22.606 560 H GLY 81 H GLY 81 -13.545 -6.512 19.856 561 HA2 GLY 81 1HA GLY 81 -10.648 -6.173 19.638 562 HA3 GLY 81 2HA GLY 81 -11.581 -7.532 19.031 563 H VAL 82 H VAL 82 -9.623 -5.374 17.909 564 HA VAL 82 HA VAL 82 -11.197 -4.889 15.467 565 HB VAL 82 HB VAL 82 -9.143 -3.001 16.628 566 HG11 VAL 82 1HG1 VAL 82 -9.004 -2.547 14.397 567 HG12 VAL 82 2HG1 VAL 82 -10.645 -3.104 14.067 568 HG13 VAL 82 3HG1 VAL 82 -10.381 -1.526 14.811 569 HG21 VAL 82 3HG2 VAL 82 -11.484 -1.618 16.537 570 HG22 VAL 82 1HG2 VAL 82 -12.046 -3.230 16.979 571 HG23 VAL 82 2HG2 VAL 82 -10.843 -2.412 17.975 572 H ARG 83 H ARG 83 -10.360 -5.962 13.814 573 HA ARG 83 HA ARG 83 -7.476 -5.988 13.411 574 HB2 ARG 83 1HB ARG 83 -8.983 -8.584 13.218 575 HB3 ARG 83 2HB ARG 83 -7.244 -8.326 13.256 576 HG2 ARG 83 1HG ARG 83 -7.421 -7.610 15.601 577 HG3 ARG 83 2HG ARG 83 -9.154 -7.942 15.551 578 HD2 ARG 83 1HD ARG 83 -7.958 -9.798 16.564 579 HD3 ARG 83 2HD ARG 83 -8.682 -10.289 15.034 580 HE ARG 83 HE ARG 83 -6.204 -9.615 14.277 581 HH11 ARG 83 1HH1 ARG 83 -7.369 -11.599 16.890 582 HH12 ARG 83 2HH1 ARG 83 -5.977 -12.630 16.902 583 HH21 ARG 83 1HH2 ARG 83 -4.366 -10.965 14.282 584 HH22 ARG 83 2HH2 ARG 83 -4.268 -12.268 15.418 585 H ARG 84 H ARG 84 -6.852 -6.340 11.257 586 HA ARG 84 HA ARG 84 -8.969 -5.796 9.330 587 HB2 ARG 84 1HB ARG 84 -6.995 -5.482 7.758 588 HB3 ARG 84 2HB ARG 84 -7.122 -4.341 9.090 589 HG2 ARG 84 1HG ARG 84 -5.402 -5.492 10.310 590 HG3 ARG 84 2HG ARG 84 -5.346 -6.771 9.096 591 HD2 ARG 84 1HD ARG 84 -4.719 -3.871 8.558 592 HD3 ARG 84 2HD ARG 84 -3.508 -5.107 8.895 593 HE ARG 84 HE ARG 84 -5.241 -5.786 6.713 594 HH11 ARG 84 1HH1 ARG 84 -2.369 -4.047 7.634 595 HH12 ARG 84 2HH1 ARG 84 -1.668 -4.105 6.051 596 HH21 ARG 84 1HH2 ARG 84 -4.328 -5.870 4.624 597 HH22 ARG 84 2HH2 ARG 84 -2.783 -5.142 4.340 598 H LEU 85 H LEU 85 -9.956 -7.492 8.456 599 HA LEU 85 HA LEU 85 -8.451 -9.970 8.026 600 HB2 LEU 85 1HB LEU 85 -11.410 -9.614 7.673 601 HB3 LEU 85 2HB LEU 85 -10.509 -11.105 7.941 602 HG LEU 85 HG LEU 85 -10.714 -8.956 10.035 603 HD11 LEU 85 1HD1 LEU 85 -12.753 -9.606 10.670 604 HD12 LEU 85 2HD1 LEU 85 -12.397 -11.311 10.396 605 HD13 LEU 85 3HD1 LEU 85 -12.895 -10.287 9.049 606 HD21 LEU 85 3HD2 LEU 85 -10.207 -10.840 11.535 607 HD22 LEU 85 1HD2 LEU 85 -8.933 -10.571 10.345 608 HD23 LEU 85 2HD2 LEU 85 -10.070 -11.902 10.133 609 H THR 86 H THR 86 -7.794 -10.533 6.064 610 HA THR 86 HA THR 86 -8.566 -8.926 3.777 611 HB THR 86 HB THR 86 -6.750 -11.310 3.611 612 HG1 THR 86 HG1 THR 86 -5.039 -9.833 4.206 613 HG21 THR 86 3HG2 THR 86 -5.861 -8.959 2.249 614 HG22 THR 86 1HG2 THR 86 -7.556 -9.246 1.856 615 HG23 THR 86 2HG2 THR 86 -6.358 -10.509 1.571 616 H ILE 87 H ILE 87 -10.365 -9.417 2.711 617 HA ILE 87 HA ILE 87 -11.247 -12.208 2.576 618 HB ILE 87 HB ILE 87 -12.718 -9.675 1.838 619 HG12 ILE 87 1HG1 ILE 87 -13.357 -11.528 4.121 620 HG13 ILE 87 2HG1 ILE 87 -12.197 -10.218 4.312 621 HG21 ILE 87 1HG2 ILE 87 -13.887 -11.114 0.558 622 HG22 ILE 87 2HG2 ILE 87 -13.311 -12.529 1.437 623 HG23 ILE 87 3HG2 ILE 87 -14.630 -11.560 2.094 624 HD11 ILE 87 3HD1 ILE 87 -13.793 -8.616 4.258 625 HD12 ILE 87 1HD1 ILE 87 -14.835 -9.530 3.167 626 HD13 ILE 87 2HD1 ILE 87 -14.769 -9.946 4.880 627 HA PRO 88 HA PRO 88 -9.439 -12.087 -1.561 628 HB2 PRO 88 1HB PRO 88 -9.533 -14.777 -1.911 629 HB3 PRO 88 2HB PRO 88 -8.259 -13.973 -0.986 630 HG2 PRO 88 1HG PRO 88 -10.718 -15.371 -0.006 631 HG3 PRO 88 2HG PRO 88 -9.062 -15.445 0.625 632 HD2 PRO 88 1HD PRO 88 -10.987 -13.919 1.763 633 HD3 PRO 88 2HD PRO 88 -9.274 -13.455 1.767 634 HA PRO 89 HA PRO 89 -12.924 -12.487 -4.212 635 HB2 PRO 89 1HB PRO 89 -11.909 -13.713 -6.411 636 HB3 PRO 89 2HB PRO 89 -11.538 -12.037 -5.987 637 HG2 PRO 89 1HG PRO 89 -9.920 -14.512 -5.520 638 HG3 PRO 89 2HG PRO 89 -9.387 -12.917 -6.083 639 HD2 PRO 89 1HD PRO 89 -9.082 -13.734 -3.520 640 HD3 PRO 89 2HD PRO 89 -9.361 -12.035 -3.954 641 H GLN 90 H GLN 90 -11.065 -15.469 -3.804 642 HA GLN 90 HA GLN 90 -13.065 -17.227 -4.761 643 HB2 GLN 90 1HB GLN 90 -11.747 -18.967 -3.484 644 HB3 GLN 90 2HB GLN 90 -10.840 -18.049 -4.678 645 HG2 GLN 90 1HG GLN 90 -10.662 -16.681 -2.201 646 HG3 GLN 90 2HG GLN 90 -10.306 -18.385 -1.918 647 HE21 GLN 90 2HE2 GLN 90 -8.152 -18.280 -1.628 648 HE22 GLN 90 1HE2 GLN 90 -7.030 -17.736 -2.824 649 H LEU 91 H LEU 91 -12.911 -15.363 -1.971 650 HA LEU 91 HA LEU 91 -14.964 -17.037 -0.684 651 HB2 LEU 91 1HB LEU 91 -12.615 -15.620 0.494 652 HB3 LEU 91 2HB LEU 91 -14.074 -15.838 1.458 653 HG LEU 91 HG LEU 91 -12.504 -17.571 2.000 654 HD11 LEU 91 1HD1 LEU 91 -14.044 -19.197 2.076 655 HD12 LEU 91 2HD1 LEU 91 -14.277 -19.199 0.328 656 HD13 LEU 91 3HD1 LEU 91 -15.099 -18.000 1.325 657 HD21 LEU 91 3HD2 LEU 91 -11.435 -18.961 0.473 658 HD22 LEU 91 1HD2 LEU 91 -11.375 -17.381 -0.309 659 HD23 LEU 91 2HD2 LEU 91 -12.569 -18.575 -0.823 660 H GLY 92 H GLY 92 -14.657 -14.402 -2.428 661 HA2 GLY 92 1HA GLY 92 -16.903 -13.086 -1.105 662 HA3 GLY 92 2HA GLY 92 -15.455 -12.120 -1.350 663 H TYR 93 H TYR 93 -15.034 -11.267 -3.332 664 HA TYR 93 HA TYR 93 -17.150 -10.952 -5.144 665 HB2 TYR 93 1HB TYR 93 -14.240 -10.286 -5.164 666 HB3 TYR 93 2HB TYR 93 -15.131 -10.183 -6.678 667 HD1 TYR 93 HD1 TYR 93 -16.539 -9.427 -3.346 668 HD2 TYR 93 HD2 TYR 93 -15.023 -7.829 -6.986 669 HE1 TYR 93 HE1 TYR 93 -17.363 -7.200 -2.705 670 HE2 TYR 93 HE2 TYR 93 -15.842 -5.598 -6.354 671 HH TYR 93 HH TYR 93 -18.052 -5.066 -3.943 672 H GLY 94 H GLY 94 -14.013 -12.474 -5.903 673 HA2 GLY 94 1HA GLY 94 -13.920 -14.758 -6.738 674 HA3 GLY 94 2HA GLY 94 -15.489 -14.485 -7.481 675 H ALA 95 H ALA 95 -14.287 -15.367 -9.373 676 HA ALA 95 HA ALA 95 -12.362 -13.600 -10.619 677 HB1 ALA 95 1HB ALA 95 -12.990 -16.336 -10.810 678 HB2 ALA 95 2HB ALA 95 -13.307 -15.633 -12.397 679 HB3 ALA 95 3HB ALA 95 -11.717 -15.453 -11.654 680 H ARG 96 H ARG 96 -15.555 -13.350 -10.257 681 HA ARG 96 HA ARG 96 -16.510 -12.907 -12.888 682 HB2 ARG 96 1HB ARG 96 -17.975 -13.341 -10.933 683 HB3 ARG 96 2HB ARG 96 -17.547 -11.761 -10.290 684 HG2 ARG 96 1HG ARG 96 -19.653 -11.520 -11.320 685 HG3 ARG 96 2HG ARG 96 -18.481 -10.771 -12.406 686 HD2 ARG 96 1HD ARG 96 -18.503 -12.680 -13.851 687 HD3 ARG 96 2HD ARG 96 -19.482 -13.596 -12.705 688 HE ARG 96 HE ARG 96 -21.029 -11.448 -13.267 689 HH11 ARG 96 1HH1 ARG 96 -19.389 -13.804 -15.237 690 HH12 ARG 96 2HH1 ARG 96 -20.549 -13.728 -16.523 691 HH21 ARG 96 1HH2 ARG 96 -22.562 -11.339 -14.952 692 HH22 ARG 96 2HH2 ARG 96 -22.352 -12.325 -16.360 693 H GLY 97 H GLY 97 -14.671 -10.991 -10.674 694 HA2 GLY 97 1HA GLY 97 -13.622 -8.964 -10.974 695 HA3 GLY 97 2HA GLY 97 -14.140 -9.013 -12.652 696 H ALA 98 H ALA 98 -14.080 -6.774 -10.741 697 HA ALA 98 HA ALA 98 -16.952 -6.108 -10.738 698 HB1 ALA 98 1HB ALA 98 -16.539 -4.633 -8.859 699 HB2 ALA 98 2HB ALA 98 -15.995 -6.268 -8.481 700 HB3 ALA 98 3HB ALA 98 -14.819 -5.024 -8.903 701 H GLY 99 H GLY 99 -13.771 -5.194 -11.744 702 HA2 GLY 99 1HA GLY 99 -14.827 -3.218 -13.534 703 HA3 GLY 99 2HA GLY 99 -13.932 -2.499 -12.205 704 H GLY 100 H GLY 100 -12.649 -1.727 -14.127 705 HA2 GLY 100 1HA GLY 100 -11.048 -3.564 -15.590 706 HA3 GLY 100 2HA GLY 100 -10.783 -1.831 -15.467 707 H VAL 101 H VAL 101 -10.273 -1.416 -12.856 708 HA VAL 101 HA VAL 101 -7.621 -2.471 -12.591 709 HB VAL 101 HB VAL 101 -8.273 -0.145 -11.926 710 HG11 VAL 101 1HG1 VAL 101 -9.140 -0.873 -9.260 711 HG12 VAL 101 2HG1 VAL 101 -9.845 0.273 -10.403 712 HG13 VAL 101 3HG1 VAL 101 -10.265 -1.438 -10.495 713 HG21 VAL 101 3HG2 VAL 101 -6.571 -0.025 -10.423 714 HG22 VAL 101 1HG2 VAL 101 -7.167 -1.385 -9.472 715 HG23 VAL 101 2HG2 VAL 101 -6.307 -1.675 -10.984 716 H ILE 102 H ILE 102 -10.590 -3.714 -11.814 717 HA ILE 102 HA ILE 102 -9.554 -5.199 -9.494 718 HB ILE 102 HB ILE 102 -12.414 -4.833 -10.395 719 HG12 ILE 102 1HG1 ILE 102 -10.943 -3.717 -7.997 720 HG13 ILE 102 2HG1 ILE 102 -11.396 -2.801 -9.430 721 HG21 ILE 102 1HG2 ILE 102 -12.192 -5.776 -7.725 722 HG22 ILE 102 2HG2 ILE 102 -12.946 -6.561 -9.112 723 HG23 ILE 102 3HG2 ILE 102 -11.238 -6.831 -8.766 724 HD11 ILE 102 3HD1 ILE 102 -13.377 -4.178 -7.640 725 HD12 ILE 102 1HD1 ILE 102 -12.890 -2.493 -7.460 726 HD13 ILE 102 2HD1 ILE 102 -13.708 -3.023 -8.930 727 HA PRO 103 HA PRO 103 -9.366 -8.340 -12.817 728 HB2 PRO 103 1HB PRO 103 -7.324 -9.718 -11.676 729 HB3 PRO 103 2HB PRO 103 -7.072 -8.293 -12.690 730 HG2 PRO 103 1HG PRO 103 -7.102 -8.511 -9.705 731 HG3 PRO 103 2HG PRO 103 -5.992 -7.604 -10.750 732 HD2 PRO 103 1HD PRO 103 -8.049 -6.427 -9.440 733 HD3 PRO 103 2HD PRO 103 -7.473 -5.858 -11.020 734 HA PRO 104 HA PRO 104 -11.579 -11.606 -10.875 735 HB2 PRO 104 1HB PRO 104 -10.599 -13.814 -12.114 736 HB3 PRO 104 2HB PRO 104 -11.659 -12.651 -12.919 737 HG2 PRO 104 1HG PRO 104 -8.680 -12.907 -13.053 738 HG3 PRO 104 2HG PRO 104 -9.837 -12.605 -14.363 739 HD2 PRO 104 1HD PRO 104 -8.370 -10.630 -13.231 740 HD3 PRO 104 2HD PRO 104 -10.006 -10.361 -13.866 741 H ASN 105 H ASN 105 -8.201 -11.386 -10.530 742 HA ASN 105 HA ASN 105 -8.219 -13.454 -8.431 743 HB2 ASN 105 1HB ASN 105 -6.657 -13.861 -10.344 744 HB3 ASN 105 2HB ASN 105 -5.811 -12.378 -9.911 745 HD21 ASN 105 2HD2 ASN 105 -7.120 -15.114 -8.067 746 HD22 ASN 105 1HD2 ASN 105 -5.655 -15.463 -7.221 747 H ALA 106 H ALA 106 -8.753 -10.373 -8.588 748 HA ALA 106 HA ALA 106 -6.768 -9.262 -6.838 749 HB1 ALA 106 1HB ALA 106 -9.187 -7.733 -6.845 750 HB2 ALA 106 2HB ALA 106 -7.620 -7.344 -7.556 751 HB3 ALA 106 3HB ALA 106 -8.810 -8.254 -8.487 752 H THR 107 H THR 107 -6.973 -8.733 -4.667 753 HA THR 107 HA THR 107 -9.106 -10.178 -3.238 754 HB THR 107 HB THR 107 -6.329 -9.453 -2.284 755 HG1 THR 107 HG1 THR 107 -7.372 -12.066 -2.515 756 HG21 THR 107 3HG2 THR 107 -8.757 -10.344 -0.869 757 HG22 THR 107 1HG2 THR 107 -7.348 -9.471 -0.266 758 HG23 THR 107 2HG2 THR 107 -7.280 -11.222 -0.471 759 H LEU 108 H LEU 108 -10.199 -9.181 -1.557 760 HA LEU 108 HA LEU 108 -9.807 -6.267 -1.353 761 HB2 LEU 108 1HB LEU 108 -12.352 -7.853 -1.048 762 HB3 LEU 108 2HB LEU 108 -12.202 -6.110 -0.840 763 HG LEU 108 HG LEU 108 -11.482 -7.389 -3.451 764 HD11 LEU 108 1HD1 LEU 108 -13.650 -7.474 -4.203 765 HD12 LEU 108 2HD1 LEU 108 -14.237 -6.352 -2.976 766 HD13 LEU 108 3HD1 LEU 108 -13.848 -8.015 -2.536 767 HD21 LEU 108 3HD2 LEU 108 -11.966 -4.688 -2.388 768 HD22 LEU 108 1HD2 LEU 108 -12.663 -5.016 -3.974 769 HD23 LEU 108 2HD2 LEU 108 -10.931 -5.222 -3.713 770 H VAL 109 H VAL 109 -9.324 -5.474 0.587 771 HA VAL 109 HA VAL 109 -9.442 -7.274 2.896 772 HB VAL 109 HB VAL 109 -8.129 -4.585 2.972 773 HG11 VAL 109 1HG1 VAL 109 -8.273 -6.922 4.635 774 HG12 VAL 109 2HG1 VAL 109 -6.595 -6.573 4.217 775 HG13 VAL 109 3HG1 VAL 109 -7.588 -5.337 4.991 776 HG21 VAL 109 3HG2 VAL 109 -7.268 -5.517 0.933 777 HG22 VAL 109 1HG2 VAL 109 -6.031 -5.665 2.181 778 HG23 VAL 109 2HG2 VAL 109 -6.982 -7.073 1.712 779 H PHE 110 H PHE 110 -10.311 -6.603 4.894 780 HA PHE 110 HA PHE 110 -11.869 -4.144 4.960 781 HB2 PHE 110 1HB PHE 110 -13.037 -6.896 4.949 782 HB3 PHE 110 2HB PHE 110 -13.798 -5.658 5.942 783 HD1 PHE 110 HD2 PHE 110 -12.907 -6.613 2.501 784 HD2 PHE 110 HD1 PHE 110 -15.078 -3.912 4.973 785 HE1 PHE 110 HE2 PHE 110 -14.105 -5.772 0.524 786 HE2 PHE 110 HE1 PHE 110 -16.281 -3.068 3.000 787 HZ PHE 110 HZ PHE 110 -15.794 -3.996 0.771 788 H GLU 111 H GLU 111 -11.869 -3.236 6.929 789 HA GLU 111 HA GLU 111 -10.519 -4.663 9.079 790 HB2 GLU 111 1HB GLU 111 -9.743 -2.421 8.620 791 HB3 GLU 111 2HB GLU 111 -11.370 -1.779 8.790 792 HG2 GLU 111 1HG GLU 111 -10.147 -3.221 11.086 793 HG3 GLU 111 2HG GLU 111 -9.625 -1.576 10.728 794 H VAL 112 H VAL 112 -11.730 -5.872 10.374 795 HA VAL 112 HA VAL 112 -14.488 -5.054 10.947 796 HB VAL 112 HB VAL 112 -13.184 -7.684 11.645 797 HG11 VAL 112 1HG1 VAL 112 -16.075 -6.848 11.439 798 HG12 VAL 112 2HG1 VAL 112 -15.500 -8.477 11.801 799 HG13 VAL 112 3HG1 VAL 112 -15.184 -7.157 12.929 800 HG21 VAL 112 3HG2 VAL 112 -14.529 -8.509 9.638 801 HG22 VAL 112 1HG2 VAL 112 -14.613 -6.817 9.149 802 HG23 VAL 112 2HG2 VAL 112 -13.047 -7.614 9.301 803 H GLU 113 H GLU 113 -14.997 -4.172 12.836 804 HA GLU 113 HA GLU 113 -13.306 -4.733 15.172 805 HB2 GLU 113 1HB GLU 113 -13.527 -2.352 15.853 806 HB3 GLU 113 2HB GLU 113 -12.591 -2.573 14.382 807 HG2 GLU 113 1HG GLU 113 -14.879 -2.141 13.206 808 HG3 GLU 113 2HG GLU 113 -15.300 -1.392 14.745 809 H LEU 114 H LEU 114 -14.554 -5.707 16.616 810 HA LEU 114 HA LEU 114 -17.396 -5.524 16.597 811 HB2 LEU 114 1HB LEU 114 -15.721 -7.387 17.470 812 HB3 LEU 114 2HB LEU 114 -15.951 -6.526 18.990 813 HG LEU 114 HG LEU 114 -17.521 -8.222 19.111 814 HD11 LEU 114 1HD1 LEU 114 -18.516 -5.987 19.482 815 HD12 LEU 114 2HD1 LEU 114 -19.684 -7.188 18.931 816 HD13 LEU 114 3HD1 LEU 114 -19.059 -5.985 17.803 817 HD21 LEU 114 3HD2 LEU 114 -17.475 -8.028 16.208 818 HD22 LEU 114 1HD2 LEU 114 -19.098 -8.270 16.856 819 HD23 LEU 114 2HD2 LEU 114 -17.813 -9.413 17.247 820 H LEU 115 H LEU 115 -18.677 -4.099 17.571 821 HA LEU 115 HA LEU 115 -17.475 -2.182 19.429 822 HB2 LEU 115 1HB LEU 115 -20.006 -2.155 17.808 823 HB3 LEU 115 2HB LEU 115 -19.667 -0.958 19.057 824 HG LEU 115 HG LEU 115 -17.418 -0.799 17.527 825 HD11 LEU 115 1HD1 LEU 115 -17.780 -1.835 15.586 826 HD12 LEU 115 2HD1 LEU 115 -18.884 -0.510 15.222 827 HD13 LEU 115 3HD1 LEU 115 -19.506 -2.013 15.902 828 HD21 LEU 115 3HD2 LEU 115 -18.270 1.298 16.799 829 HD22 LEU 115 1HD2 LEU 115 -18.924 1.006 18.410 830 HD23 LEU 115 2HD2 LEU 115 -19.939 0.759 16.988 831 H ASP 116 H ASP 116 -20.321 -4.284 19.122 832 HA ASP 116 HA ASP 116 -20.288 -4.915 21.904 833 HB2 ASP 116 1HB ASP 116 -21.341 -2.630 21.897 834 HB3 ASP 116 2HB ASP 116 -22.660 -3.307 20.946 835 H VAL 117 H VAL 117 -22.146 -6.346 22.499 836 HA VAL 117 HA VAL 117 -22.968 -7.917 20.148 837 HB VAL 117 HB VAL 117 -23.300 -9.777 21.858 838 HG11 VAL 117 1HG1 VAL 117 -20.616 -9.889 22.090 839 HG12 VAL 117 2HG1 VAL 117 -21.490 -10.282 20.608 840 HG13 VAL 117 3HG1 VAL 117 -20.771 -8.684 20.813 841 HG21 VAL 117 3HG2 VAL 117 -22.890 -7.799 23.688 842 HG22 VAL 117 1HG2 VAL 117 -22.732 -9.525 24.014 843 HG23 VAL 117 2HG2 VAL 117 -21.303 -8.565 23.629 844 H13 JZF 130 1H3 JZF 130 -17.681 -5.671 -0.177 845 H23 JZF 130 2H3 JZF 130 -17.941 -4.451 1.055 846 H4 JZF 130 H4 JZF 130 -19.534 -4.849 -1.502 847 H15 JZF 130 1H5 JZF 130 -20.850 -2.892 -0.898 848 H25 JZF 130 2H5 JZF 130 -19.952 -2.677 0.595 849 H17 JZF 130 1H7 JZF 130 -17.421 -2.801 -0.837 850 H27 JZF 130 2H7 JZF 130 -17.475 -3.946 -2.139 851 H8 JZF 130 H8 JZF 130 -19.625 -2.463 -2.747 852 H9 JZF 130 H9 JZF 130 -16.904 -2.567 -3.845 853 H1OH JZF 130 1HO JZF 130 -19.451 -0.415 -2.241 854 H11 JZF 130 H11 JZF 130 -17.024 -3.404 -6.293 855 H112 JZF 130 1H12 JZF 130 -18.701 -0.968 -7.082 856 H212 JZF 130 2H12 JZF 130 -17.191 -1.459 -7.832 857 H13A JZF 130 H13 JZF 130 -16.995 0.453 -6.196 858 H114 JZF 130 1H14 JZF 130 -17.113 -0.025 -3.780 859 H214 JZF 130 2H14 JZF 130 -18.654 -0.155 -4.588 860 H115 JZF 130 1H15 JZF 130 -22.563 -5.858 2.205 861 H215 JZF 130 2H15 JZF 130 -21.221 -6.878 2.724 862 H116 JZF 130 1H16 JZF 130 -21.487 -7.101 -1.336 863 H216 JZF 130 2H16 JZF 130 -19.836 -7.738 -1.073 864 H117 JZF 130 2H17 JZF 130 -22.039 -8.966 -2.554 865 H217 JZF 130 3H17 JZF 130 -20.374 -9.552 -2.378 866 H317 JZF 130 1H17 JZF 130 -21.605 -10.007 -1.188 867 H118 JZF 130 1H18 JZF 130 -18.579 -4.729 -7.410 868 H218 JZF 130 2H18 JZF 130 -19.890 -3.558 -7.223 869 H318 JZF 130 3H18 JZF 130 -18.632 -3.291 -8.442 870 H119 JZF 130 3H19 JZF 130 -14.969 -0.502 -4.924 871 H219 JZF 130 1H19 JZF 130 -15.384 -2.066 -5.631 872 H319 JZF 130 2H19 JZF 130 -14.947 -0.716 -6.678 Start of MODEL 9 1 H1 GLY 1 H GLY 1 1.505 0.842 19.154 2 HA2 GLY 1 1HA GLY 1 -0.116 2.268 17.522 3 HA3 GLY 1 2HA GLY 1 1.577 2.680 17.753 4 HA PRO 2 HA PRO 2 0.858 1.868 13.240 5 HB2 PRO 2 1HB PRO 2 2.145 4.101 12.388 6 HB3 PRO 2 2HB PRO 2 0.432 4.086 12.822 7 HG2 PRO 2 1HG PRO 2 2.788 4.978 14.439 8 HG3 PRO 2 2HG PRO 2 1.200 5.746 14.258 9 HD2 PRO 2 1HD PRO 2 1.859 4.253 16.419 10 HD3 PRO 2 2HD PRO 2 0.203 4.333 15.782 11 H GLY 3 H GLY 3 2.603 1.894 11.477 12 HA2 GLY 3 1HA GLY 3 5.130 2.007 11.278 13 HA3 GLY 3 2HA GLY 3 5.128 0.957 12.688 14 H SER 4 H SER 4 5.790 -0.985 12.049 15 HA SER 4 HA SER 4 5.527 -2.006 9.441 16 HB2 SER 4 1HB SER 4 7.103 -2.705 11.430 17 HB3 SER 4 2HB SER 4 5.805 -3.843 11.792 18 HG SER 4 HG SER 4 7.310 -4.793 10.401 19 H MET 5 H MET 5 3.966 -3.127 8.444 20 HA MET 5 HA MET 5 1.581 -3.827 10.022 21 HB2 MET 5 1HB MET 5 1.933 -2.971 7.161 22 HB3 MET 5 2HB MET 5 0.481 -3.815 7.684 23 HG2 MET 5 1HG MET 5 1.466 -1.289 8.977 24 HG3 MET 5 2HG MET 5 0.344 -1.308 7.619 25 HE1 MET 5 3HE MET 5 -0.813 -0.411 11.303 26 HE2 MET 5 1HE MET 5 0.029 -1.849 11.881 27 HE3 MET 5 2HE MET 5 0.854 -0.714 10.812 28 H THR 6 H THR 6 2.582 -5.850 10.625 29 HA THR 6 HA THR 6 3.360 -7.779 8.688 30 HB THR 6 HB THR 6 2.500 -8.265 11.546 31 HG1 THR 6 HG1 THR 6 4.241 -7.051 11.849 32 HG21 THR 6 3HG2 THR 6 3.418 -9.997 9.414 33 HG22 THR 6 1HG2 THR 6 2.776 -10.414 11.002 34 HG23 THR 6 2HG2 THR 6 4.493 -10.062 10.810 35 H VAL 7 H VAL 7 2.068 -8.840 7.349 36 HA VAL 7 HA VAL 7 -0.718 -9.339 8.169 37 HB VAL 7 HB VAL 7 0.379 -9.189 5.358 38 HG11 VAL 7 1HG1 VAL 7 -2.296 -8.874 5.139 39 HG12 VAL 7 2HG1 VAL 7 -1.467 -10.423 4.971 40 HG13 VAL 7 3HG1 VAL 7 -2.212 -9.981 6.508 41 HG21 VAL 7 3HG2 VAL 7 -0.857 -7.163 7.152 42 HG22 VAL 7 1HG2 VAL 7 0.424 -6.981 5.954 43 HG23 VAL 7 2HG2 VAL 7 -1.256 -7.117 5.435 44 H VAL 8 H VAL 8 -0.675 -11.340 9.050 45 HA VAL 8 HA VAL 8 0.925 -13.470 7.991 46 HB VAL 8 HB VAL 8 -1.353 -13.668 9.964 47 HG11 VAL 8 1HG1 VAL 8 0.853 -15.512 9.122 48 HG12 VAL 8 2HG1 VAL 8 0.118 -15.647 10.721 49 HG13 VAL 8 3HG1 VAL 8 -0.874 -15.837 9.275 50 HG21 VAL 8 3HG2 VAL 8 1.140 -13.823 11.269 51 HG22 VAL 8 1HG2 VAL 8 1.196 -12.400 10.229 52 HG23 VAL 8 2HG2 VAL 8 -0.090 -12.568 11.424 53 H THR 9 H THR 9 0.440 -14.737 6.335 54 HA THR 9 HA THR 9 -2.285 -14.737 5.282 55 HB THR 9 HB THR 9 0.080 -16.080 3.990 56 HG1 THR 9 HG1 THR 9 0.894 -14.115 3.904 57 HG21 THR 9 3HG2 THR 9 -1.565 -16.632 2.568 58 HG22 THR 9 1HG2 THR 9 -1.508 -14.946 2.054 59 HG23 THR 9 2HG2 THR 9 -2.681 -15.460 3.266 60 H THR 10 H THR 10 -3.422 -16.649 4.812 61 HA THR 10 HA THR 10 -2.655 -18.915 6.515 62 HB THR 10 HB THR 10 -4.966 -19.605 6.470 63 HG1 THR 10 HG1 THR 10 -6.494 -18.485 5.229 64 HG21 THR 10 3HG2 THR 10 -4.076 -17.402 7.752 65 HG22 THR 10 1HG2 THR 10 -5.706 -18.049 7.939 66 HG23 THR 10 2HG2 THR 10 -5.410 -16.709 6.830 67 H GLU 11 H GLU 11 -3.961 -20.996 5.491 68 HA GLU 11 HA GLU 11 -2.412 -21.633 3.155 69 HB2 GLU 11 1HB GLU 11 -3.504 -23.863 3.356 70 HB3 GLU 11 2HB GLU 11 -2.693 -23.340 4.826 71 HG2 GLU 11 1HG GLU 11 -4.764 -22.785 5.862 72 HG3 GLU 11 2HG GLU 11 -5.646 -23.033 4.356 73 H SER 12 H SER 12 -5.629 -20.573 3.808 74 HA SER 12 HA SER 12 -6.621 -21.383 1.195 75 HB2 SER 12 1HB SER 12 -8.375 -19.607 2.678 76 HB3 SER 12 2HB SER 12 -8.654 -21.263 2.142 77 HG SER 12 HG SER 12 -8.651 -21.469 4.287 78 H GLY 13 H GLY 13 -4.556 -19.133 1.977 79 HA2 GLY 13 1HA GLY 13 -3.865 -17.367 0.592 80 HA3 GLY 13 2HA GLY 13 -5.471 -17.326 -0.120 81 H LEU 14 H LEU 14 -7.041 -17.077 2.151 82 HA LEU 14 HA LEU 14 -7.117 -14.355 2.569 83 HB2 LEU 14 1HB LEU 14 -9.037 -15.547 3.135 84 HB3 LEU 14 2HB LEU 14 -8.148 -16.674 4.157 85 HG LEU 14 HG LEU 14 -8.211 -13.838 5.018 86 HD11 LEU 14 1HD1 LEU 14 -10.570 -14.734 4.183 87 HD12 LEU 14 2HD1 LEU 14 -10.396 -13.731 5.622 88 HD13 LEU 14 3HD1 LEU 14 -10.556 -15.480 5.780 89 HD21 LEU 14 3HD2 LEU 14 -8.835 -15.421 7.140 90 HD22 LEU 14 1HD2 LEU 14 -7.197 -14.968 6.669 91 HD23 LEU 14 2HD2 LEU 14 -7.865 -16.518 6.156 92 H LYS 15 H LYS 15 -6.422 -12.964 4.184 93 HA LYS 15 HA LYS 15 -4.302 -14.018 5.941 94 HB2 LYS 15 1HB LYS 15 -4.428 -11.284 4.653 95 HB3 LYS 15 2HB LYS 15 -3.157 -11.862 5.721 96 HG2 LYS 15 1HG LYS 15 -2.136 -13.014 4.092 97 HG3 LYS 15 2HG LYS 15 -3.658 -13.561 3.384 98 HD2 LYS 15 1HD LYS 15 -3.847 -11.020 2.693 99 HD3 LYS 15 2HD LYS 15 -2.090 -11.083 2.856 100 HE2 LYS 15 1HE LYS 15 -2.501 -13.318 1.421 101 HE3 LYS 15 2HE LYS 15 -3.867 -12.353 0.865 102 HZ1 LYS 15 3HZ LYS 15 -1.341 -12.210 -0.104 103 HZ2 LYS 15 1HZ LYS 15 -1.400 -10.886 0.947 104 HZ3 LYS 15 2HZ LYS 15 -2.532 -11.025 -0.302 105 H TYR 16 H TYR 16 -3.921 -12.689 7.901 106 HA TYR 16 HA TYR 16 -6.174 -11.078 8.792 107 HB2 TYR 16 1HB TYR 16 -6.811 -12.405 10.597 108 HB3 TYR 16 2HB TYR 16 -6.539 -13.594 9.328 109 HD1 TYR 16 HD2 TYR 16 -4.145 -14.648 9.262 110 HD2 TYR 16 HD1 TYR 16 -5.799 -12.698 12.663 111 HE1 TYR 16 HE2 TYR 16 -2.551 -15.835 10.710 112 HE2 TYR 16 HE1 TYR 16 -4.208 -13.879 14.120 113 HH TYR 16 HH TYR 16 -2.388 -16.524 13.093 114 H GLU 17 H GLU 17 -5.615 -9.551 10.270 115 HA GLU 17 HA GLU 17 -3.101 -9.749 11.708 116 HB2 GLU 17 1HB GLU 17 -2.429 -7.442 10.891 117 HB3 GLU 17 2HB GLU 17 -2.243 -8.758 9.740 118 HG2 GLU 17 1HG GLU 17 -3.789 -7.932 8.336 119 HG3 GLU 17 2HG GLU 17 -4.821 -7.349 9.641 120 H ASP 18 H ASP 18 -3.531 -9.159 13.718 121 HA ASP 18 HA ASP 18 -5.908 -7.915 14.531 122 HB2 ASP 18 1HB ASP 18 -5.044 -7.981 16.721 123 HB3 ASP 18 2HB ASP 18 -4.290 -9.352 15.911 124 H LEU 19 H LEU 19 -6.328 -5.838 15.341 125 HA LEU 19 HA LEU 19 -4.467 -3.769 14.373 126 HB2 LEU 19 1HB LEU 19 -7.434 -3.975 14.373 127 HB3 LEU 19 2HB LEU 19 -6.709 -2.379 14.551 128 HG LEU 19 HG LEU 19 -7.397 -3.362 12.190 129 HD11 LEU 19 1HD1 LEU 19 -5.844 -1.267 13.112 130 HD12 LEU 19 2HD1 LEU 19 -6.446 -1.486 11.470 131 HD13 LEU 19 3HD1 LEU 19 -4.831 -2.050 11.898 132 HD21 LEU 19 3HD2 LEU 19 -4.515 -4.206 12.363 133 HD22 LEU 19 1HD2 LEU 19 -5.651 -4.459 11.038 134 HD23 LEU 19 2HD2 LEU 19 -5.857 -5.335 12.555 135 H THR 20 H THR 20 -6.954 -4.366 16.854 136 HA THR 20 HA THR 20 -5.247 -3.139 18.857 137 HB THR 20 HB THR 20 -8.010 -2.044 18.292 138 HG1 THR 20 HG1 THR 20 -6.624 -0.070 18.055 139 HG21 THR 20 3HG2 THR 20 -6.872 -0.356 20.089 140 HG22 THR 20 1HG2 THR 20 -6.233 -1.907 20.633 141 HG23 THR 20 2HG2 THR 20 -7.976 -1.663 20.516 142 H GLU 21 H GLU 21 -5.410 -4.201 20.729 143 HA GLU 21 HA GLU 21 -6.867 -6.519 21.063 144 HB2 GLU 21 1HB GLU 21 -5.647 -4.618 23.048 145 HB3 GLU 21 2HB GLU 21 -6.497 -6.063 23.577 146 HG2 GLU 21 1HG GLU 21 -4.318 -6.276 21.550 147 HG3 GLU 21 2HG GLU 21 -3.925 -6.112 23.260 148 H GLY 22 H GLY 22 -8.519 -6.916 22.842 149 HA2 GLY 22 1HA GLY 22 -10.376 -4.733 23.311 150 HA3 GLY 22 2HA GLY 22 -10.973 -6.009 22.259 151 H SER 23 H SER 23 -10.482 -8.299 23.246 152 HA SER 23 HA SER 23 -10.991 -9.830 24.850 153 HB2 SER 23 1HB SER 23 -10.452 -7.766 26.972 154 HB3 SER 23 2HB SER 23 -10.161 -9.505 27.022 155 HG SER 23 HG SER 23 -8.400 -7.716 26.483 156 H GLY 24 H GLY 24 -13.194 -9.815 24.228 157 HA2 GLY 24 1HA GLY 24 -14.944 -8.743 26.324 158 HA3 GLY 24 2HA GLY 24 -15.290 -8.312 24.656 159 H ALA 25 H ALA 25 -16.361 -9.729 23.369 160 HA ALA 25 HA ALA 25 -16.712 -12.486 24.256 161 HB1 ALA 25 1HB ALA 25 -19.207 -11.083 23.477 162 HB2 ALA 25 2HB ALA 25 -18.963 -12.430 24.589 163 HB3 ALA 25 3HB ALA 25 -18.569 -10.787 25.094 164 H GLU 26 H GLU 26 -16.539 -13.820 22.580 165 HA GLU 26 HA GLU 26 -16.277 -12.832 19.924 166 HB2 GLU 26 1HB GLU 26 -15.079 -14.833 20.861 167 HB3 GLU 26 2HB GLU 26 -16.602 -15.707 20.787 168 HG2 GLU 26 1HG GLU 26 -16.594 -15.035 18.293 169 HG3 GLU 26 2HG GLU 26 -14.877 -14.732 18.553 170 H ALA 27 H ALA 27 -17.742 -12.643 18.348 171 HA ALA 27 HA ALA 27 -20.492 -12.813 18.851 172 HB1 ALA 27 1HB ALA 27 -20.664 -11.736 16.909 173 HB2 ALA 27 2HB ALA 27 -18.902 -11.773 16.847 174 HB3 ALA 27 3HB ALA 27 -19.839 -13.024 16.032 175 H ARG 28 H ARG 28 -22.091 -14.210 17.948 176 HA ARG 28 HA ARG 28 -21.116 -16.852 17.109 177 HB2 ARG 28 1HB ARG 28 -23.318 -16.389 19.129 178 HB3 ARG 28 2HB ARG 28 -22.756 -17.949 18.543 179 HG2 ARG 28 1HG ARG 28 -20.792 -17.846 19.746 180 HG3 ARG 28 2HG ARG 28 -20.838 -16.086 19.866 181 HD2 ARG 28 1HD ARG 28 -21.332 -17.228 22.007 182 HD3 ARG 28 2HD ARG 28 -22.644 -16.190 21.451 183 HE ARG 28 HE ARG 28 -22.946 -18.918 20.628 184 HH11 ARG 28 1HH1 ARG 28 -23.463 -16.661 23.228 185 HH12 ARG 28 2HH1 ARG 28 -24.762 -17.567 23.930 186 HH21 ARG 28 1HH2 ARG 28 -24.655 -20.120 21.543 187 HH22 ARG 28 2HH2 ARG 28 -25.439 -19.534 22.972 188 H ALA 29 H ALA 29 -22.310 -17.860 15.558 189 HA ALA 29 HA ALA 29 -23.961 -16.347 13.890 190 HB1 ALA 29 1HB ALA 29 -24.520 -19.160 13.631 191 HB2 ALA 29 2HB ALA 29 -23.676 -18.076 12.525 192 HB3 ALA 29 3HB ALA 29 -22.789 -18.880 13.821 193 H GLY 30 H GLY 30 -25.986 -15.683 14.146 194 HA2 GLY 30 1HA GLY 30 -28.324 -16.408 14.392 195 HA3 GLY 30 2HA GLY 30 -27.800 -17.344 15.784 196 H GLN 31 H GLN 31 -25.994 -14.986 16.495 197 HA GLN 31 HA GLN 31 -28.080 -13.485 17.910 198 HB2 GLN 31 1HB GLN 31 -26.617 -13.185 19.652 199 HB3 GLN 31 2HB GLN 31 -26.025 -14.716 19.021 200 HG2 GLN 31 1HG GLN 31 -24.303 -13.500 17.754 201 HG3 GLN 31 2HG GLN 31 -24.873 -11.992 18.467 202 HE21 GLN 31 2HE2 GLN 31 -24.602 -11.667 20.713 203 HE22 GLN 31 1HE2 GLN 31 -23.389 -12.524 21.595 204 H THR 32 H THR 32 -28.135 -11.246 17.912 205 HA THR 32 HA THR 32 -26.880 -10.000 15.598 206 HB THR 32 HB THR 32 -28.788 -8.650 17.498 207 HG1 THR 32 HG1 THR 32 -30.469 -9.461 16.234 208 HG21 THR 32 3HG2 THR 32 -29.014 -7.050 15.899 209 HG22 THR 32 1HG2 THR 32 -28.799 -8.191 14.572 210 HG23 THR 32 2HG2 THR 32 -27.396 -7.598 15.462 211 H VAL 33 H VAL 33 -25.335 -8.461 15.676 212 HA VAL 33 HA VAL 33 -24.668 -7.175 18.201 213 HB VAL 33 HB VAL 33 -22.335 -7.776 18.156 214 HG11 VAL 33 1HG1 VAL 33 -22.478 -10.022 18.868 215 HG12 VAL 33 2HG1 VAL 33 -24.051 -9.306 19.226 216 HG13 VAL 33 3HG1 VAL 33 -23.856 -10.349 17.817 217 HG21 VAL 33 3HG2 VAL 33 -22.915 -8.516 15.457 218 HG22 VAL 33 1HG2 VAL 33 -21.350 -8.352 16.252 219 HG23 VAL 33 2HG2 VAL 33 -22.205 -9.894 16.297 220 H SER 34 H SER 34 -23.128 -5.406 17.938 221 HA SER 34 HA SER 34 -23.376 -4.201 15.272 222 HB2 SER 34 1HB SER 34 -23.492 -3.167 18.004 223 HB3 SER 34 2HB SER 34 -22.430 -2.222 16.960 224 HG SER 34 HG SER 34 -25.092 -2.233 17.040 225 H VAL 35 H VAL 35 -21.648 -3.919 14.022 226 HA VAL 35 HA VAL 35 -18.988 -3.764 15.225 227 HB VAL 35 HB VAL 35 -18.019 -5.451 13.888 228 HG11 VAL 35 1HG1 VAL 35 -20.633 -6.709 14.662 229 HG12 VAL 35 2HG1 VAL 35 -19.013 -7.408 14.712 230 HG13 VAL 35 3HG1 VAL 35 -19.471 -6.157 15.868 231 HG21 VAL 35 3HG2 VAL 35 -19.462 -6.765 12.255 232 HG22 VAL 35 1HG2 VAL 35 -20.625 -5.447 12.393 233 HG23 VAL 35 2HG2 VAL 35 -19.004 -5.131 11.774 234 H HIS 36 H HIS 36 -17.340 -3.014 13.699 235 HA HIS 36 HA HIS 36 -18.524 -1.273 11.643 236 HB2 HIS 36 1HB HIS 36 -16.243 -0.945 13.531 237 HB3 HIS 36 2HB HIS 36 -16.115 -0.174 11.953 238 HD1 HIS 36 HD1 HIS 36 -18.493 1.262 11.385 239 HD2 HIS 36 HD2 HIS 36 -17.352 0.709 15.342 240 HE1 HIS 36 HE1 HIS 36 -19.695 3.046 12.688 241 H TYR 37 H TYR 37 -17.941 -1.493 9.568 242 HA TYR 37 HA TYR 37 -15.749 -3.367 8.959 243 HB2 TYR 37 1HB TYR 37 -16.946 -4.056 6.987 244 HB3 TYR 37 2HB TYR 37 -18.039 -4.175 8.361 245 HD1 TYR 37 HD1 TYR 37 -19.874 -2.552 8.630 246 HD2 TYR 37 HD2 TYR 37 -17.356 -2.507 5.201 247 HE1 TYR 37 HE1 TYR 37 -21.514 -1.148 7.452 248 HE2 TYR 37 HE2 TYR 37 -18.988 -1.102 4.014 249 HH TYR 37 HH TYR 37 -21.126 0.666 5.234 250 H THR 38 H THR 38 -14.123 -2.657 7.730 251 HA THR 38 HA THR 38 -14.479 -0.119 6.275 252 HB THR 38 HB THR 38 -11.730 -0.623 7.097 253 HG1 THR 38 HG1 THR 38 -13.716 -0.232 9.107 254 HG21 THR 38 3HG2 THR 38 -13.609 1.692 7.584 255 HG22 THR 38 1HG2 THR 38 -12.568 1.500 6.174 256 HG23 THR 38 2HG2 THR 38 -11.856 1.716 7.772 257 H GLY 39 H GLY 39 -14.545 -0.718 4.189 258 HA2 GLY 39 1HA GLY 39 -13.112 -2.968 3.160 259 HA3 GLY 39 2HA GLY 39 -14.003 -1.783 2.218 260 H TRP 40 H TRP 40 -10.969 -2.973 2.965 261 HA TRP 40 HA TRP 40 -9.686 -0.569 1.842 262 HB2 TRP 40 1HB TRP 40 -8.532 -2.539 3.828 263 HB3 TRP 40 2HB TRP 40 -7.646 -1.205 3.094 264 HD1 TRP 40 HD1 TRP 40 -10.341 0.777 3.463 265 HE1 TRP 40 HE1 TRP 40 -10.659 1.821 5.794 266 HE3 TRP 40 HE3 TRP 40 -7.421 -2.415 6.188 267 HZ2 TRP 40 HZ2 TRP 40 -9.787 1.354 8.438 268 HZ3 TRP 40 HZ3 TRP 40 -7.215 -2.046 8.612 269 HH2 TRP 40 HH2 TRP 40 -8.374 -0.200 9.712 270 H LEU 41 H LEU 41 -7.814 -0.945 0.501 271 HA LEU 41 HA LEU 41 -8.124 -3.354 -1.102 272 HB2 LEU 41 1HB LEU 41 -6.703 -0.745 -1.480 273 HB3 LEU 41 2HB LEU 41 -6.346 -2.124 -2.517 274 HG LEU 41 HG LEU 41 -8.973 -2.093 -2.849 275 HD11 LEU 41 1HD1 LEU 41 -9.030 -0.112 -1.185 276 HD12 LEU 41 2HD1 LEU 41 -10.007 -0.034 -2.651 277 HD13 LEU 41 3HD1 LEU 41 -8.479 0.842 -2.563 278 HD21 LEU 41 3HD2 LEU 41 -7.476 0.025 -4.317 279 HD22 LEU 41 1HD2 LEU 41 -8.580 -1.207 -4.929 280 HD23 LEU 41 2HD2 LEU 41 -6.943 -1.652 -4.447 281 H THR 42 H THR 42 -6.099 -4.404 -1.940 282 HA THR 42 HA THR 42 -4.602 -5.454 0.190 283 HB THR 42 HB THR 42 -3.369 -6.693 -1.412 284 HG1 THR 42 HG1 THR 42 -4.022 -4.551 -3.133 285 HG21 THR 42 3HG2 THR 42 -6.006 -6.207 -2.784 286 HG22 THR 42 1HG2 THR 42 -5.864 -7.115 -1.279 287 HG23 THR 42 2HG2 THR 42 -5.061 -7.695 -2.738 288 H ASP 43 H ASP 43 -4.229 -2.568 -1.580 289 HA ASP 43 HA ASP 43 -1.382 -2.331 -0.998 290 HB2 ASP 43 1HB ASP 43 -3.343 -0.738 -2.613 291 HB3 ASP 43 2HB ASP 43 -1.828 0.000 -2.102 292 H GLY 44 H GLY 44 -4.409 -1.441 0.335 293 HA2 GLY 44 1HA GLY 44 -4.377 -0.740 2.677 294 HA3 GLY 44 2HA GLY 44 -3.013 0.293 2.277 295 H GLN 45 H GLN 45 -5.199 0.394 -0.229 296 HA GLN 45 HA GLN 45 -5.962 3.081 0.396 297 HB2 GLN 45 1HB GLN 45 -6.567 1.206 -1.875 298 HB3 GLN 45 2HB GLN 45 -7.373 2.763 -1.743 299 HG2 GLN 45 1HG GLN 45 -4.411 2.292 -1.982 300 HG3 GLN 45 2HG GLN 45 -5.484 2.926 -3.228 301 HE21 GLN 45 2HE2 GLN 45 -6.974 4.739 -1.911 302 HE22 GLN 45 1HE2 GLN 45 -5.981 6.009 -1.290 303 H LYS 46 H LYS 46 -8.040 3.893 0.759 304 HA LYS 46 HA LYS 46 -9.896 1.935 1.921 305 HB2 LYS 46 1HB LYS 46 -9.103 3.692 3.441 306 HB3 LYS 46 2HB LYS 46 -9.710 4.924 2.342 307 HG2 LYS 46 1HG LYS 46 -11.995 4.063 2.690 308 HG3 LYS 46 2HG LYS 46 -11.353 2.907 3.859 309 HD2 LYS 46 1HD LYS 46 -10.780 5.823 4.185 310 HD3 LYS 46 2HD LYS 46 -12.349 5.179 4.675 311 HE2 LYS 46 1HE LYS 46 -11.350 3.704 6.241 312 HE3 LYS 46 2HE LYS 46 -9.737 4.002 5.596 313 HZ1 LYS 46 3HZ LYS 46 -11.224 6.296 6.627 314 HZ2 LYS 46 1HZ LYS 46 -9.565 5.971 6.680 315 HZ3 LYS 46 2HZ LYS 46 -10.613 5.196 7.758 316 H PHE 47 H PHE 47 -11.765 1.517 0.948 317 HA PHE 47 HA PHE 47 -12.919 3.523 -0.855 318 HB2 PHE 47 1HB PHE 47 -13.328 1.922 -2.585 319 HB3 PHE 47 2HB PHE 47 -11.626 1.793 -2.154 320 HD1 PHE 47 HD2 PHE 47 -10.957 -0.065 -0.535 321 HD2 PHE 47 HD1 PHE 47 -14.703 0.052 -2.553 322 HE1 PHE 47 HE2 PHE 47 -11.241 -2.477 -0.141 323 HE2 PHE 47 HE1 PHE 47 -14.993 -2.359 -2.161 324 HZ PHE 47 HZ PHE 47 -13.260 -3.628 -0.955 325 H ASP 48 H ASP 48 -13.450 2.327 1.896 326 HA ASP 48 HA ASP 48 -16.252 2.433 1.810 327 HB2 ASP 48 1HB ASP 48 -15.570 0.073 0.793 328 HB3 ASP 48 2HB ASP 48 -15.454 -0.357 2.497 329 H SER 49 H SER 49 -16.879 3.072 3.764 330 HA SER 49 HA SER 49 -15.645 1.987 6.156 331 HB2 SER 49 1HB SER 49 -15.188 4.295 7.058 332 HB3 SER 49 2HB SER 49 -14.128 3.803 5.737 333 HG SER 49 HG SER 49 -14.748 5.668 4.954 334 H SER 50 H SER 50 -17.195 1.613 7.586 335 HA SER 50 HA SER 50 -19.871 2.368 7.187 336 HB2 SER 50 1HB SER 50 -19.891 1.695 9.795 337 HB3 SER 50 2HB SER 50 -19.816 0.501 8.499 338 HG SER 50 HG SER 50 -17.454 1.609 9.555 339 H LYS 51 H LYS 51 -17.253 4.058 8.561 340 HA LYS 51 HA LYS 51 -18.496 5.656 10.481 341 HB2 LYS 51 1HB LYS 51 -16.633 7.131 10.277 342 HB3 LYS 51 2HB LYS 51 -16.027 5.500 10.017 343 HG2 LYS 51 1HG LYS 51 -16.487 6.131 7.487 344 HG3 LYS 51 2HG LYS 51 -16.269 7.765 8.120 345 HD2 LYS 51 1HD LYS 51 -14.311 5.519 8.577 346 HD3 LYS 51 2HD LYS 51 -14.181 6.674 7.249 347 HE2 LYS 51 1HE LYS 51 -13.576 8.388 8.620 348 HE3 LYS 51 2HE LYS 51 -14.516 7.776 9.980 349 HZ1 LYS 51 3HZ LYS 51 -11.936 7.679 10.029 350 HZ2 LYS 51 1HZ LYS 51 -12.145 6.286 9.092 351 HZ3 LYS 51 2HZ LYS 51 -12.838 6.381 10.632 352 H ASP 52 H ASP 52 -18.769 5.669 7.055 353 HA ASP 52 HA ASP 52 -19.408 8.286 6.456 354 HB2 ASP 52 1HB ASP 52 -19.211 6.421 4.809 355 HB3 ASP 52 2HB ASP 52 -20.792 5.844 5.330 356 H ARG 53 H ARG 53 -21.503 5.759 7.786 357 HA ARG 53 HA ARG 53 -23.779 7.540 7.900 358 HB2 ARG 53 1HB ARG 53 -23.688 4.913 7.583 359 HB3 ARG 53 2HB ARG 53 -23.720 4.927 9.341 360 HG2 ARG 53 1HG ARG 53 -25.835 5.904 9.415 361 HG3 ARG 53 2HG ARG 53 -25.741 6.449 7.739 362 HD2 ARG 53 1HD ARG 53 -27.232 4.591 7.807 363 HD3 ARG 53 2HD ARG 53 -25.737 4.045 7.048 364 HE ARG 53 HE ARG 53 -25.448 3.447 9.707 365 HH11 ARG 53 1HH1 ARG 53 -27.740 2.660 7.208 366 HH12 ARG 53 2HH1 ARG 53 -28.140 1.114 7.879 367 HH21 ARG 53 1HH2 ARG 53 -25.965 1.413 10.601 368 HH22 ARG 53 2HH2 ARG 53 -27.130 0.406 9.810 369 H ASN 54 H ASN 54 -21.097 6.849 9.846 370 HA ASN 54 HA ASN 54 -20.462 7.536 11.919 371 HB2 ASN 54 1HB ASN 54 -22.964 9.230 11.939 372 HB3 ASN 54 2HB ASN 54 -21.490 9.488 12.867 373 HD21 ASN 54 2HD2 ASN 54 -19.477 9.528 11.331 374 HD22 ASN 54 1HD2 ASN 54 -19.635 10.600 9.985 375 H ASP 55 H ASP 55 -21.508 5.136 12.001 376 HA ASP 55 HA ASP 55 -22.461 4.837 14.618 377 HB2 ASP 55 1HB ASP 55 -24.514 5.388 12.690 378 HB3 ASP 55 2HB ASP 55 -24.705 3.741 13.285 379 HA PRO 56 HA PRO 56 -21.079 0.740 13.877 380 HB2 PRO 56 1HB PRO 56 -22.508 -0.653 15.718 381 HB3 PRO 56 2HB PRO 56 -21.172 0.420 16.150 382 HG2 PRO 56 1HG PRO 56 -24.120 0.937 16.235 383 HG3 PRO 56 2HG PRO 56 -22.875 1.360 17.425 384 HD2 PRO 56 1HD PRO 56 -23.871 3.154 15.659 385 HD3 PRO 56 2HD PRO 56 -22.195 3.217 16.242 386 H PHE 57 H PHE 57 -21.648 -1.283 12.984 387 HA PHE 57 HA PHE 57 -24.223 -1.256 11.591 388 HB2 PHE 57 1HB PHE 57 -22.026 -1.540 10.347 389 HB3 PHE 57 2HB PHE 57 -21.908 -3.129 11.096 390 HD1 PHE 57 HD2 PHE 57 -24.847 -1.343 9.674 391 HD2 PHE 57 HD1 PHE 57 -22.203 -4.668 9.401 392 HE1 PHE 57 HE2 PHE 57 -26.229 -2.290 7.872 393 HE2 PHE 57 HE1 PHE 57 -23.580 -5.619 7.597 394 HZ PHE 57 HZ PHE 57 -25.597 -4.431 6.831 395 H ALA 58 H ALA 58 -25.740 -2.122 12.898 396 HA ALA 58 HA ALA 58 -25.150 -4.532 14.426 397 HB1 ALA 58 1HB ALA 58 -26.487 -2.496 15.274 398 HB2 ALA 58 2HB ALA 58 -27.822 -3.183 14.347 399 HB3 ALA 58 3HB ALA 58 -27.081 -4.115 15.648 400 H PHE 59 H PHE 59 -25.540 -6.495 13.661 401 HA PHE 59 HA PHE 59 -27.871 -7.035 12.042 402 HB2 PHE 59 1HB PHE 59 -26.758 -7.862 10.113 403 HB3 PHE 59 2HB PHE 59 -26.046 -6.286 10.441 404 HD1 PHE 59 HD1 PHE 59 -23.840 -6.233 11.728 405 HD2 PHE 59 HD2 PHE 59 -25.418 -9.748 9.918 406 HE1 PHE 59 HE1 PHE 59 -21.601 -7.252 11.761 407 HE2 PHE 59 HE2 PHE 59 -23.182 -10.772 9.949 408 HZ PHE 59 HZ PHE 59 -21.269 -9.524 10.872 409 H VAL 60 H VAL 60 -28.013 -9.415 11.517 410 HA VAL 60 HA VAL 60 -27.258 -10.911 13.890 411 HB VAL 60 HB VAL 60 -28.964 -11.732 11.535 412 HG11 VAL 60 1HG1 VAL 60 -29.727 -13.397 13.458 413 HG12 VAL 60 2HG1 VAL 60 -28.389 -13.772 12.370 414 HG13 VAL 60 3HG1 VAL 60 -28.064 -13.143 13.986 415 HG21 VAL 60 3HG2 VAL 60 -30.712 -10.763 12.525 416 HG22 VAL 60 1HG2 VAL 60 -30.282 -11.428 14.101 417 HG23 VAL 60 2HG2 VAL 60 -29.546 -9.923 13.548 418 H LEU 61 H LEU 61 -25.687 -12.389 13.991 419 HA LEU 61 HA LEU 61 -23.889 -12.724 11.803 420 HB2 LEU 61 1HB LEU 61 -23.189 -12.708 14.171 421 HB3 LEU 61 2HB LEU 61 -24.030 -14.239 14.406 422 HG LEU 61 HG LEU 61 -22.476 -15.378 12.970 423 HD11 LEU 61 1HD1 LEU 61 -21.665 -14.193 11.259 424 HD12 LEU 61 2HD1 LEU 61 -20.422 -13.667 12.393 425 HD13 LEU 61 3HD1 LEU 61 -21.842 -12.660 12.114 426 HD21 LEU 61 3HD2 LEU 61 -21.066 -15.588 14.670 427 HD22 LEU 61 1HD2 LEU 61 -21.801 -14.164 15.405 428 HD23 LEU 61 2HD2 LEU 61 -20.387 -13.989 14.365 429 H GLY 62 H GLY 62 -23.453 -14.561 10.580 430 HA2 GLY 62 1HA GLY 62 -23.848 -16.598 9.575 431 HA3 GLY 62 2HA GLY 62 -24.882 -17.013 10.934 432 H GLY 63 H GLY 63 -25.569 -14.072 9.282 433 HA2 GLY 63 1HA GLY 63 -28.182 -14.954 8.579 434 HA3 GLY 63 2HA GLY 63 -27.454 -13.417 8.136 435 H GLY 64 H GLY 64 -25.366 -14.067 6.576 436 HA2 GLY 64 1HA GLY 64 -24.842 -15.580 4.702 437 HA3 GLY 64 2HA GLY 64 -26.572 -15.676 4.410 438 H MET 65 H MET 65 -26.602 -12.666 5.097 439 HA MET 65 HA MET 65 -26.615 -11.742 2.433 440 HB2 MET 65 1HB MET 65 -26.502 -10.135 4.992 441 HB3 MET 65 2HB MET 65 -26.952 -9.515 3.409 442 HG2 MET 65 1HG MET 65 -28.900 -10.968 3.374 443 HG3 MET 65 2HG MET 65 -28.441 -11.635 4.939 444 HE1 MET 65 3HE MET 65 -31.685 -9.683 4.922 445 HE2 MET 65 1HE MET 65 -31.039 -8.516 3.768 446 HE3 MET 65 2HE MET 65 -30.830 -10.244 3.484 447 H VAL 66 H VAL 66 -24.139 -11.886 4.859 448 HA VAL 66 HA VAL 66 -22.379 -10.112 3.347 449 HB VAL 66 HB VAL 66 -20.850 -10.250 5.196 450 HG11 VAL 66 1HG1 VAL 66 -23.697 -9.963 6.147 451 HG12 VAL 66 2HG1 VAL 66 -22.273 -9.415 7.034 452 HG13 VAL 66 3HG1 VAL 66 -22.676 -8.692 5.477 453 HG21 VAL 66 3HG2 VAL 66 -20.750 -12.366 6.030 454 HG22 VAL 66 1HG2 VAL 66 -21.818 -11.652 7.238 455 HG23 VAL 66 2HG2 VAL 66 -22.493 -12.611 5.921 456 H ILE 67 H ILE 67 -20.357 -10.766 2.545 457 HA ILE 67 HA ILE 67 -20.279 -13.215 1.224 458 HB ILE 67 HB ILE 67 -17.794 -12.742 0.971 459 HG12 ILE 67 1HG1 ILE 67 -18.394 -10.028 2.084 460 HG13 ILE 67 2HG1 ILE 67 -17.915 -11.320 3.179 461 HG21 ILE 67 1HG2 ILE 67 -19.902 -10.757 0.168 462 HG22 ILE 67 2HG2 ILE 67 -18.242 -10.669 -0.419 463 HG23 ILE 67 3HG2 ILE 67 -19.231 -12.085 -0.778 464 HD11 ILE 67 3HD1 ILE 67 -15.782 -11.191 2.563 465 HD12 ILE 67 1HD1 ILE 67 -16.186 -11.088 0.850 466 HD13 ILE 67 2HD1 ILE 67 -16.222 -9.638 1.853 467 H LYS 68 H LYS 68 -18.868 -15.037 1.499 468 HA LYS 68 HA LYS 68 -19.009 -16.319 3.909 469 HB2 LYS 68 1HB LYS 68 -17.062 -16.608 1.634 470 HB3 LYS 68 2HB LYS 68 -16.967 -17.645 3.052 471 HG2 LYS 68 1HG LYS 68 -19.621 -17.425 1.790 472 HG3 LYS 68 2HG LYS 68 -18.374 -18.251 0.852 473 HD2 LYS 68 1HD LYS 68 -18.706 -18.966 3.724 474 HD3 LYS 68 2HD LYS 68 -19.896 -19.559 2.564 475 HE2 LYS 68 1HE LYS 68 -16.969 -19.875 2.027 476 HE3 LYS 68 2HE LYS 68 -17.800 -20.996 3.105 477 HZ1 LYS 68 3HZ LYS 68 -18.613 -22.063 1.361 478 HZ2 LYS 68 1HZ LYS 68 -17.720 -21.059 0.333 479 HZ3 LYS 68 2HZ LYS 68 -19.308 -20.648 0.747 480 H GLY 69 H GLY 69 -16.204 -14.498 2.675 481 HA2 GLY 69 1HA GLY 69 -14.484 -14.859 4.818 482 HA3 GLY 69 2HA GLY 69 -14.497 -13.437 3.785 483 H TRP 70 H TRP 70 -17.098 -12.511 4.457 484 HA TRP 70 HA TRP 70 -16.493 -10.994 6.759 485 HB2 TRP 70 1HB TRP 70 -18.821 -11.283 4.939 486 HB3 TRP 70 2HB TRP 70 -19.142 -10.602 6.532 487 HD1 TRP 70 HD1 TRP 70 -16.035 -9.924 4.325 488 HE1 TRP 70 HE1 TRP 70 -15.917 -7.393 3.874 489 HE3 TRP 70 HE3 TRP 70 -20.396 -8.495 6.576 490 HZ2 TRP 70 HZ2 TRP 70 -17.467 -5.094 4.403 491 HZ3 TRP 70 HZ3 TRP 70 -21.005 -6.111 6.560 492 HH2 TRP 70 HH2 TRP 70 -19.570 -4.447 5.496 493 H ASP 71 H ASP 71 -18.954 -13.526 6.253 494 HA ASP 71 HA ASP 71 -19.914 -13.671 8.847 495 HB2 ASP 71 1HB ASP 71 -20.040 -15.297 6.459 496 HB3 ASP 71 2HB ASP 71 -19.930 -16.310 7.896 497 H GLU 72 H GLU 72 -17.229 -15.484 7.383 498 HA GLU 72 HA GLU 72 -16.573 -17.043 9.603 499 HB2 GLU 72 1HB GLU 72 -15.690 -17.096 7.146 500 HB3 GLU 72 2HB GLU 72 -14.456 -16.001 7.754 501 HG2 GLU 72 1HG GLU 72 -13.893 -17.694 9.483 502 HG3 GLU 72 2HG GLU 72 -15.024 -18.798 8.703 503 H GLY 73 H GLY 73 -15.521 -13.793 8.684 504 HA2 GLY 73 1HA GLY 73 -13.638 -13.515 10.807 505 HA3 GLY 73 2HA GLY 73 -14.289 -12.214 9.820 506 H VAL 74 H VAL 74 -16.993 -12.432 10.385 507 HA VAL 74 HA VAL 74 -17.171 -11.022 12.819 508 HB VAL 74 HB VAL 74 -19.404 -12.362 11.287 509 HG11 VAL 74 1HG1 VAL 74 -19.485 -10.081 13.260 510 HG12 VAL 74 2HG1 VAL 74 -20.862 -10.763 12.392 511 HG13 VAL 74 3HG1 VAL 74 -20.002 -11.735 13.587 512 HG21 VAL 74 3HG2 VAL 74 -17.715 -10.284 10.478 513 HG22 VAL 74 1HG2 VAL 74 -19.240 -10.775 9.739 514 HG23 VAL 74 2HG2 VAL 74 -19.222 -9.508 10.966 515 H GLN 75 H GLN 75 -17.413 -14.397 12.042 516 HA GLN 75 HA GLN 75 -18.661 -15.122 14.542 517 HB2 GLN 75 1HB GLN 75 -17.430 -16.792 12.346 518 HB3 GLN 75 2HB GLN 75 -18.227 -17.459 13.764 519 HG2 GLN 75 1HG GLN 75 -20.320 -16.778 13.075 520 HG3 GLN 75 2HG GLN 75 -19.676 -15.525 12.015 521 HE21 GLN 75 2HE2 GLN 75 -18.848 -18.952 12.284 522 HE22 GLN 75 1HE2 GLN 75 -19.249 -19.359 10.654 523 H GLY 76 H GLY 76 -15.718 -13.975 13.928 524 HA2 GLY 76 1HA GLY 76 -14.451 -15.697 15.969 525 HA3 GLY 76 2HA GLY 76 -13.560 -15.050 14.600 526 H MET 77 H MET 77 -14.982 -12.459 14.774 527 HA MET 77 HA MET 77 -13.145 -11.095 16.405 528 HB2 MET 77 1HB MET 77 -15.759 -10.232 15.171 529 HB3 MET 77 2HB MET 77 -14.709 -9.130 16.052 530 HG2 MET 77 1HG MET 77 -13.884 -10.698 13.621 531 HG3 MET 77 2HG MET 77 -14.437 -9.025 13.600 532 HE1 MET 77 3HE MET 77 -11.664 -7.077 15.375 533 HE2 MET 77 1HE MET 77 -13.325 -7.111 14.784 534 HE3 MET 77 2HE MET 77 -12.929 -7.837 16.342 535 H LYS 78 H LYS 78 -13.455 -9.932 18.349 536 HA LYS 78 HA LYS 78 -15.668 -10.942 20.014 537 HB2 LYS 78 1HB LYS 78 -12.913 -10.147 20.968 538 HB3 LYS 78 2HB LYS 78 -14.198 -10.860 21.935 539 HG2 LYS 78 1HG LYS 78 -14.040 -12.922 20.649 540 HG3 LYS 78 2HG LYS 78 -12.773 -12.208 19.649 541 HD2 LYS 78 1HD LYS 78 -11.544 -11.825 21.890 542 HD3 LYS 78 2HD LYS 78 -12.674 -13.018 22.534 543 HE2 LYS 78 1HE LYS 78 -11.197 -13.645 20.024 544 HE3 LYS 78 2HE LYS 78 -10.333 -13.733 21.558 545 HZ1 LYS 78 3HZ LYS 78 -11.163 -15.784 21.676 546 HZ2 LYS 78 1HZ LYS 78 -12.317 -15.503 20.471 547 HZ3 LYS 78 2HZ LYS 78 -12.638 -15.057 22.070 548 H VAL 79 H VAL 79 -16.638 -9.515 21.474 549 HA VAL 79 HA VAL 79 -17.083 -6.924 20.645 550 HB VAL 79 HB VAL 79 -17.294 -7.995 23.463 551 HG11 VAL 79 1HG1 VAL 79 -19.109 -6.144 23.533 552 HG12 VAL 79 2HG1 VAL 79 -17.415 -5.699 23.750 553 HG13 VAL 79 3HG1 VAL 79 -18.203 -5.443 22.193 554 HG21 VAL 79 3HG2 VAL 79 -18.862 -9.290 22.512 555 HG22 VAL 79 1HG2 VAL 79 -19.827 -7.815 22.469 556 HG23 VAL 79 2HG2 VAL 79 -18.916 -8.314 21.044 557 H GLY 80 H GLY 80 -15.965 -5.086 20.723 558 HA2 GLY 80 1HA GLY 80 -14.558 -3.446 21.592 559 HA3 GLY 80 2HA GLY 80 -14.131 -4.540 22.898 560 H GLY 81 H GLY 81 -13.811 -6.283 20.132 561 HA2 GLY 81 1HA GLY 81 -10.915 -5.776 20.087 562 HA3 GLY 81 2HA GLY 81 -11.704 -7.255 19.558 563 H VAL 82 H VAL 82 -9.817 -5.226 18.274 564 HA VAL 82 HA VAL 82 -11.382 -4.890 15.800 565 HB VAL 82 HB VAL 82 -9.185 -3.018 16.672 566 HG11 VAL 82 1HG1 VAL 82 -10.580 -1.586 14.959 567 HG12 VAL 82 2HG1 VAL 82 -9.358 -2.732 14.405 568 HG13 VAL 82 3HG1 VAL 82 -11.065 -3.175 14.369 569 HG21 VAL 82 3HG2 VAL 82 -11.449 -1.535 16.833 570 HG22 VAL 82 1HG2 VAL 82 -12.025 -3.096 17.419 571 HG23 VAL 82 2HG2 VAL 82 -10.663 -2.304 18.212 572 H ARG 83 H ARG 83 -10.582 -6.004 14.154 573 HA ARG 83 HA ARG 83 -7.706 -6.252 13.804 574 HB2 ARG 83 1HB ARG 83 -8.011 -8.224 15.052 575 HB3 ARG 83 2HB ARG 83 -9.546 -8.583 14.273 576 HG2 ARG 83 1HG ARG 83 -8.372 -9.074 12.185 577 HG3 ARG 83 2HG ARG 83 -6.833 -8.724 12.975 578 HD2 ARG 83 1HD ARG 83 -8.750 -10.825 13.959 579 HD3 ARG 83 2HD ARG 83 -7.462 -11.164 12.804 580 HE ARG 83 HE ARG 83 -5.889 -10.878 14.495 581 HH11 ARG 83 1HH1 ARG 83 -9.106 -10.185 15.630 582 HH12 ARG 83 2HH1 ARG 83 -8.663 -10.215 17.305 583 HH21 ARG 83 1HH2 ARG 83 -5.292 -10.920 16.696 584 HH22 ARG 83 2HH2 ARG 83 -6.493 -10.633 17.910 585 H ARG 84 H ARG 84 -7.084 -6.550 11.683 586 HA ARG 84 HA ARG 84 -9.247 -6.305 9.711 587 HB2 ARG 84 1HB ARG 84 -7.672 -4.463 9.682 588 HB3 ARG 84 2HB ARG 84 -6.320 -5.578 9.541 589 HG2 ARG 84 1HG ARG 84 -8.012 -6.183 7.401 590 HG3 ARG 84 2HG ARG 84 -7.954 -4.422 7.487 591 HD2 ARG 84 1HD ARG 84 -5.337 -5.072 7.854 592 HD3 ARG 84 2HD ARG 84 -5.866 -6.352 6.763 593 HE ARG 84 HE ARG 84 -6.823 -4.149 5.562 594 HH11 ARG 84 1HH1 ARG 84 -3.684 -4.935 6.847 595 HH12 ARG 84 2HH1 ARG 84 -2.828 -3.941 5.716 596 HH21 ARG 84 1HH2 ARG 84 -5.707 -2.836 4.067 597 HH22 ARG 84 2HH2 ARG 84 -3.979 -2.747 4.136 598 H LEU 85 H LEU 85 -9.540 -7.789 8.146 599 HA LEU 85 HA LEU 85 -7.518 -9.903 7.839 600 HB2 LEU 85 1HB LEU 85 -10.435 -10.519 7.641 601 HB3 LEU 85 2HB LEU 85 -9.084 -11.609 7.942 602 HG LEU 85 HG LEU 85 -9.089 -9.935 10.149 603 HD11 LEU 85 1HD1 LEU 85 -11.242 -9.619 10.909 604 HD12 LEU 85 2HD1 LEU 85 -11.918 -10.838 9.829 605 HD13 LEU 85 3HD1 LEU 85 -11.414 -9.274 9.188 606 HD21 LEU 85 3HD2 LEU 85 -9.345 -11.882 11.312 607 HD22 LEU 85 1HD2 LEU 85 -8.911 -12.538 9.733 608 HD23 LEU 85 2HD2 LEU 85 -10.601 -12.493 10.235 609 H THR 86 H THR 86 -7.115 -10.560 5.787 610 HA THR 86 HA THR 86 -8.395 -9.032 3.653 611 HB THR 86 HB THR 86 -6.171 -10.930 3.080 612 HG1 THR 86 HG1 THR 86 -4.686 -9.268 3.801 613 HG21 THR 86 3HG2 THR 86 -7.495 -8.962 1.671 614 HG22 THR 86 1HG2 THR 86 -5.944 -9.678 1.235 615 HG23 THR 86 2HG2 THR 86 -5.994 -8.172 2.152 616 H ILE 87 H ILE 87 -10.168 -9.919 2.814 617 HA ILE 87 HA ILE 87 -10.393 -12.829 2.636 618 HB ILE 87 HB ILE 87 -12.447 -10.668 2.152 619 HG12 ILE 87 1HG1 ILE 87 -12.712 -12.699 4.305 620 HG13 ILE 87 2HG1 ILE 87 -11.503 -11.442 4.543 621 HG21 ILE 87 1HG2 ILE 87 -14.071 -12.522 2.058 622 HG22 ILE 87 2HG2 ILE 87 -12.907 -12.570 0.735 623 HG23 ILE 87 3HG2 ILE 87 -12.732 -13.669 2.104 624 HD11 ILE 87 3HD1 ILE 87 -13.497 -9.866 3.881 625 HD12 ILE 87 1HD1 ILE 87 -14.461 -11.237 4.429 626 HD13 ILE 87 2HD1 ILE 87 -13.311 -10.472 5.526 627 HA PRO 88 HA PRO 88 -9.207 -12.628 -1.647 628 HB2 PRO 88 1HB PRO 88 -9.623 -15.257 -2.183 629 HB3 PRO 88 2HB PRO 88 -8.209 -14.668 -1.301 630 HG2 PRO 88 1HG PRO 88 -10.736 -15.872 -0.240 631 HG3 PRO 88 2HG PRO 88 -9.060 -16.172 0.256 632 HD2 PRO 88 1HD PRO 88 -10.721 -14.546 1.644 633 HD3 PRO 88 2HD PRO 88 -8.970 -14.268 1.551 634 HA PRO 89 HA PRO 89 -12.881 -12.452 -4.055 635 HB2 PRO 89 1HB PRO 89 -12.167 -13.625 -6.397 636 HB3 PRO 89 2HB PRO 89 -11.574 -12.037 -5.898 637 HG2 PRO 89 1HG PRO 89 -10.230 -14.705 -5.710 638 HG3 PRO 89 2HG PRO 89 -9.553 -13.144 -6.210 639 HD2 PRO 89 1HD PRO 89 -9.174 -14.170 -3.733 640 HD3 PRO 89 2HD PRO 89 -9.280 -12.424 -4.038 641 H GLN 90 H GLN 90 -11.364 -15.644 -3.957 642 HA GLN 90 HA GLN 90 -13.615 -17.095 -4.876 643 HB2 GLN 90 1HB GLN 90 -12.427 -19.055 -3.796 644 HB3 GLN 90 2HB GLN 90 -11.510 -18.174 -5.011 645 HG2 GLN 90 1HG GLN 90 -9.960 -17.500 -3.541 646 HG3 GLN 90 2HG GLN 90 -11.144 -17.217 -2.266 647 HE21 GLN 90 2HE2 GLN 90 -8.551 -18.492 -2.089 648 HE22 GLN 90 1HE2 GLN 90 -8.830 -20.090 -1.495 649 H LEU 91 H LEU 91 -13.056 -15.460 -1.995 650 HA LEU 91 HA LEU 91 -15.178 -17.000 -0.650 651 HB2 LEU 91 1HB LEU 91 -12.614 -15.900 0.385 652 HB3 LEU 91 2HB LEU 91 -14.012 -15.922 1.458 653 HG LEU 91 HG LEU 91 -12.639 -17.862 1.863 654 HD11 LEU 91 1HD1 LEU 91 -15.187 -17.988 1.849 655 HD12 LEU 91 2HD1 LEU 91 -14.298 -19.511 1.792 656 HD13 LEU 91 3HD1 LEU 91 -15.015 -18.853 0.321 657 HD21 LEU 91 3HD2 LEU 91 -12.053 -19.453 0.214 658 HD22 LEU 91 1HD2 LEU 91 -11.652 -17.874 -0.462 659 HD23 LEU 91 2HD2 LEU 91 -13.114 -18.711 -0.985 660 H GLY 92 H GLY 92 -14.709 -14.291 -2.275 661 HA2 GLY 92 1HA GLY 92 -16.719 -12.846 -0.702 662 HA3 GLY 92 2HA GLY 92 -15.232 -12.005 -1.115 663 H TYR 93 H TYR 93 -14.997 -11.130 -3.112 664 HA TYR 93 HA TYR 93 -17.310 -10.687 -4.668 665 HB2 TYR 93 1HB TYR 93 -14.435 -9.980 -4.859 666 HB3 TYR 93 2HB TYR 93 -15.355 -9.935 -6.359 667 HD1 TYR 93 HD2 TYR 93 -16.819 -9.162 -3.069 668 HD2 TYR 93 HD1 TYR 93 -15.214 -7.563 -6.671 669 HE1 TYR 93 HE2 TYR 93 -17.689 -6.942 -2.465 670 HE2 TYR 93 HE1 TYR 93 -16.079 -5.338 -6.075 671 HH TYR 93 HH TYR 93 -18.377 -4.804 -3.812 672 H GLY 94 H GLY 94 -14.279 -12.249 -5.730 673 HA2 GLY 94 1HA GLY 94 -14.344 -14.510 -6.649 674 HA3 GLY 94 2HA GLY 94 -15.930 -14.127 -7.302 675 H ALA 95 H ALA 95 -14.429 -15.137 -9.126 676 HA ALA 95 HA ALA 95 -12.606 -13.396 -10.425 677 HB1 ALA 95 1HB ALA 95 -13.461 -16.052 -10.731 678 HB2 ALA 95 2HB ALA 95 -13.796 -15.244 -12.263 679 HB3 ALA 95 3HB ALA 95 -12.163 -15.227 -11.596 680 H ARG 96 H ARG 96 -15.961 -13.331 -10.173 681 HA ARG 96 HA ARG 96 -16.887 -12.542 -12.645 682 HB2 ARG 96 1HB ARG 96 -18.347 -12.913 -10.712 683 HB3 ARG 96 2HB ARG 96 -17.712 -11.463 -9.944 684 HG2 ARG 96 1HG ARG 96 -19.895 -11.062 -10.939 685 HG3 ARG 96 2HG ARG 96 -18.647 -10.093 -11.724 686 HD2 ARG 96 1HD ARG 96 -18.634 -11.465 -13.633 687 HD3 ARG 96 2HD ARG 96 -19.511 -12.755 -12.811 688 HE ARG 96 HE ARG 96 -21.113 -10.450 -12.869 689 HH11 ARG 96 1HH1 ARG 96 -19.819 -12.871 -15.010 690 HH12 ARG 96 2HH1 ARG 96 -21.121 -12.750 -16.146 691 HH21 ARG 96 1HH2 ARG 96 -22.833 -10.281 -14.357 692 HH22 ARG 96 2HH2 ARG 96 -22.835 -11.276 -15.774 693 H GLY 97 H GLY 97 -14.968 -10.747 -10.344 694 HA2 GLY 97 1HA GLY 97 -13.756 -8.807 -10.640 695 HA3 GLY 97 2HA GLY 97 -14.262 -8.807 -12.323 696 H ALA 98 H ALA 98 -14.058 -6.534 -10.571 697 HA ALA 98 HA ALA 98 -16.890 -5.717 -10.488 698 HB1 ALA 98 1HB ALA 98 -15.075 -4.154 -8.818 699 HB2 ALA 98 2HB ALA 98 -16.653 -4.847 -8.442 700 HB3 ALA 98 3HB ALA 98 -15.204 -5.847 -8.338 701 H GLY 99 H GLY 99 -13.605 -4.868 -11.354 702 HA2 GLY 99 1HA GLY 99 -14.613 -2.883 -13.214 703 HA3 GLY 99 2HA GLY 99 -13.606 -2.243 -11.923 704 H GLY 100 H GLY 100 -12.209 -1.544 -13.696 705 HA2 GLY 100 1HA GLY 100 -10.861 -3.525 -15.283 706 HA3 GLY 100 2HA GLY 100 -10.471 -1.814 -15.197 707 H VAL 101 H VAL 101 -9.894 -1.453 -12.556 708 HA VAL 101 HA VAL 101 -7.283 -2.619 -12.386 709 HB VAL 101 HB VAL 101 -7.101 -1.354 -10.255 710 HG11 VAL 101 1HG1 VAL 101 -7.828 -0.110 -12.849 711 HG12 VAL 101 2HG1 VAL 101 -7.676 0.947 -11.445 712 HG13 VAL 101 3HG1 VAL 101 -6.313 -0.052 -11.950 713 HG21 VAL 101 3HG2 VAL 101 -9.461 0.254 -10.566 714 HG22 VAL 101 1HG2 VAL 101 -9.902 -1.440 -10.349 715 HG23 VAL 101 2HG2 VAL 101 -8.891 -0.632 -9.151 716 H ILE 102 H ILE 102 -10.284 -3.753 -11.549 717 HA ILE 102 HA ILE 102 -9.244 -5.347 -9.305 718 HB ILE 102 HB ILE 102 -12.109 -4.822 -10.104 719 HG12 ILE 102 1HG1 ILE 102 -10.484 -3.850 -7.742 720 HG13 ILE 102 2HG1 ILE 102 -11.009 -2.869 -9.106 721 HG21 ILE 102 1HG2 ILE 102 -10.975 -6.925 -8.569 722 HG22 ILE 102 2HG2 ILE 102 -11.874 -5.869 -7.481 723 HG23 ILE 102 3HG2 ILE 102 -12.676 -6.582 -8.880 724 HD11 ILE 102 3HD1 ILE 102 -13.276 -4.157 -7.950 725 HD12 ILE 102 1HD1 ILE 102 -12.353 -3.343 -6.688 726 HD13 ILE 102 2HD1 ILE 102 -12.920 -2.436 -8.090 727 HA PRO 103 HA PRO 103 -9.285 -8.411 -12.697 728 HB2 PRO 103 1HB PRO 103 -7.307 -9.928 -11.621 729 HB3 PRO 103 2HB PRO 103 -6.991 -8.492 -12.602 730 HG2 PRO 103 1HG PRO 103 -6.994 -8.788 -9.623 731 HG3 PRO 103 2HG PRO 103 -5.850 -7.916 -10.660 732 HD2 PRO 103 1HD PRO 103 -7.822 -6.663 -9.291 733 HD3 PRO 103 2HD PRO 103 -7.236 -6.085 -10.864 734 HA PRO 104 HA PRO 104 -11.645 -11.605 -10.809 735 HB2 PRO 104 1HB PRO 104 -10.798 -13.831 -12.113 736 HB3 PRO 104 2HB PRO 104 -11.803 -12.594 -12.877 737 HG2 PRO 104 1HG PRO 104 -8.842 -13.003 -13.053 738 HG3 PRO 104 2HG PRO 104 -9.996 -12.609 -14.341 739 HD2 PRO 104 1HD PRO 104 -8.414 -10.743 -13.179 740 HD3 PRO 104 2HD PRO 104 -10.040 -10.371 -13.788 741 H ASN 105 H ASN 105 -8.268 -11.547 -10.474 742 HA ASN 105 HA ASN 105 -8.379 -13.655 -8.417 743 HB2 ASN 105 1HB ASN 105 -6.884 -14.142 -10.370 744 HB3 ASN 105 2HB ASN 105 -5.926 -12.732 -9.927 745 HD21 ASN 105 2HD2 ASN 105 -7.245 -15.696 -8.495 746 HD22 ASN 105 1HD2 ASN 105 -5.857 -16.049 -7.529 747 H ALA 106 H ALA 106 -8.736 -10.562 -8.504 748 HA ALA 106 HA ALA 106 -6.634 -9.580 -6.817 749 HB1 ALA 106 1HB ALA 106 -8.605 -8.428 -8.403 750 HB2 ALA 106 2HB ALA 106 -9.038 -7.981 -6.752 751 HB3 ALA 106 3HB ALA 106 -7.439 -7.586 -7.381 752 H THR 107 H THR 107 -6.734 -9.066 -4.631 753 HA THR 107 HA THR 107 -8.780 -10.546 -3.129 754 HB THR 107 HB THR 107 -6.070 -9.555 -2.221 755 HG1 THR 107 HG1 THR 107 -5.383 -11.545 -2.643 756 HG21 THR 107 3HG2 THR 107 -6.547 -11.037 -0.243 757 HG22 THR 107 1HG2 THR 107 -8.217 -11.125 -0.799 758 HG23 THR 107 2HG2 THR 107 -7.525 -9.572 -0.330 759 H LEU 108 H LEU 108 -9.881 -9.599 -1.407 760 HA LEU 108 HA LEU 108 -9.763 -6.655 -1.327 761 HB2 LEU 108 1HB LEU 108 -12.138 -8.439 -0.812 762 HB3 LEU 108 2HB LEU 108 -12.131 -6.678 -0.751 763 HG LEU 108 HG LEU 108 -11.739 -8.386 -3.207 764 HD11 LEU 108 1HD1 LEU 108 -14.054 -7.074 -1.956 765 HD12 LEU 108 2HD1 LEU 108 -13.981 -8.451 -3.054 766 HD13 LEU 108 3HD1 LEU 108 -13.876 -6.810 -3.690 767 HD21 LEU 108 3HD2 LEU 108 -11.889 -6.164 -4.378 768 HD22 LEU 108 1HD2 LEU 108 -10.398 -6.445 -3.478 769 HD23 LEU 108 2HD2 LEU 108 -11.651 -5.403 -2.804 770 H VAL 109 H VAL 109 -9.393 -5.704 0.579 771 HA VAL 109 HA VAL 109 -9.224 -7.425 2.953 772 HB VAL 109 HB VAL 109 -8.164 -4.682 3.134 773 HG11 VAL 109 1HG1 VAL 109 -7.765 -6.154 4.944 774 HG12 VAL 109 2HG1 VAL 109 -7.206 -7.438 3.870 775 HG13 VAL 109 3HG1 VAL 109 -6.228 -5.988 4.096 776 HG21 VAL 109 3HG2 VAL 109 -7.508 -5.051 0.873 777 HG22 VAL 109 1HG2 VAL 109 -6.088 -5.330 1.881 778 HG23 VAL 109 2HG2 VAL 109 -6.989 -6.698 1.228 779 H PHE 110 H PHE 110 -10.203 -6.867 4.885 780 HA PHE 110 HA PHE 110 -11.861 -4.472 4.983 781 HB2 PHE 110 1HB PHE 110 -12.902 -7.280 4.982 782 HB3 PHE 110 2HB PHE 110 -13.734 -6.050 5.928 783 HD1 PHE 110 HD1 PHE 110 -12.656 -6.969 2.517 784 HD2 PHE 110 HD2 PHE 110 -15.139 -4.467 4.901 785 HE1 PHE 110 HE1 PHE 110 -13.845 -6.228 0.494 786 HE2 PHE 110 HE2 PHE 110 -16.334 -3.723 2.883 787 HZ PHE 110 HZ PHE 110 -15.688 -4.604 0.676 788 H GLU 111 H GLU 111 -11.971 -3.605 6.976 789 HA GLU 111 HA GLU 111 -10.640 -5.071 9.139 790 HB2 GLU 111 1HB GLU 111 -10.045 -2.640 8.301 791 HB3 GLU 111 2HB GLU 111 -11.376 -2.184 9.355 792 HG2 GLU 111 1HG GLU 111 -9.714 -3.971 10.789 793 HG3 GLU 111 2HG GLU 111 -8.684 -2.755 10.034 794 H VAL 112 H VAL 112 -11.782 -5.898 10.754 795 HA VAL 112 HA VAL 112 -14.563 -5.003 11.108 796 HB VAL 112 HB VAL 112 -13.436 -7.552 12.233 797 HG11 VAL 112 1HG1 VAL 112 -16.234 -6.814 11.390 798 HG12 VAL 112 2HG1 VAL 112 -15.730 -8.262 12.263 799 HG13 VAL 112 3HG1 VAL 112 -15.621 -6.681 13.038 800 HG21 VAL 112 3HG2 VAL 112 -14.406 -8.671 10.201 801 HG22 VAL 112 1HG2 VAL 112 -14.512 -7.073 9.462 802 HG23 VAL 112 2HG2 VAL 112 -12.940 -7.734 9.912 803 H GLU 113 H GLU 113 -15.172 -4.049 12.947 804 HA GLU 113 HA GLU 113 -13.418 -4.269 15.297 805 HB2 GLU 113 1HB GLU 113 -12.853 -2.140 14.480 806 HB3 GLU 113 2HB GLU 113 -14.510 -1.780 14.016 807 HG2 GLU 113 1HG GLU 113 -15.162 -1.392 16.237 808 HG3 GLU 113 2HG GLU 113 -13.702 -2.140 16.881 809 H LEU 114 H LEU 114 -14.657 -5.475 16.613 810 HA LEU 114 HA LEU 114 -17.493 -5.318 16.717 811 HB2 LEU 114 1HB LEU 114 -15.691 -7.154 17.501 812 HB3 LEU 114 2HB LEU 114 -16.037 -6.391 19.051 813 HG LEU 114 HG LEU 114 -17.501 -8.187 19.003 814 HD11 LEU 114 1HD1 LEU 114 -18.651 -6.071 19.499 815 HD12 LEU 114 2HD1 LEU 114 -19.724 -7.262 18.764 816 HD13 LEU 114 3HD1 LEU 114 -19.093 -5.928 17.797 817 HD21 LEU 114 3HD2 LEU 114 -17.468 -7.727 16.099 818 HD22 LEU 114 1HD2 LEU 114 -19.006 -8.284 16.758 819 HD23 LEU 114 2HD2 LEU 114 -17.542 -9.235 17.013 820 H LEU 115 H LEU 115 -18.781 -4.019 17.857 821 HA LEU 115 HA LEU 115 -17.532 -2.173 19.769 822 HB2 LEU 115 1HB LEU 115 -20.160 -1.997 18.303 823 HB3 LEU 115 2HB LEU 115 -19.559 -0.800 19.449 824 HG LEU 115 HG LEU 115 -17.508 -0.907 17.661 825 HD11 LEU 115 1HD1 LEU 115 -19.603 -2.243 16.377 826 HD12 LEU 115 2HD1 LEU 115 -18.111 -1.638 15.656 827 HD13 LEU 115 3HD1 LEU 115 -19.557 -0.629 15.667 828 HD21 LEU 115 3HD2 LEU 115 -18.023 1.239 17.966 829 HD22 LEU 115 1HD2 LEU 115 -19.713 0.867 18.306 830 HD23 LEU 115 2HD2 LEU 115 -19.170 1.051 16.639 831 H ASP 116 H ASP 116 -20.350 -4.281 19.347 832 HA ASP 116 HA ASP 116 -20.343 -5.172 22.011 833 HB2 ASP 116 1HB ASP 116 -21.234 -2.680 22.084 834 HB3 ASP 116 2HB ASP 116 -22.742 -3.444 21.589 835 H VAL 117 H VAL 117 -22.447 -6.356 22.545 836 HA VAL 117 HA VAL 117 -23.465 -7.578 20.066 837 HB VAL 117 HB VAL 117 -23.943 -9.582 21.395 838 HG11 VAL 117 1HG1 VAL 117 -21.225 -9.485 22.212 839 HG12 VAL 117 2HG1 VAL 117 -21.918 -10.252 20.781 840 HG13 VAL 117 3HG1 VAL 117 -21.381 -8.573 20.711 841 HG21 VAL 117 3HG2 VAL 117 -23.304 -9.806 23.679 842 HG22 VAL 117 1HG2 VAL 117 -22.506 -8.233 23.672 843 HG23 VAL 117 2HG2 VAL 117 -24.263 -8.331 23.551 844 H13 JZF 130 1H3 JZF 130 -20.709 -2.458 0.204 845 H23 JZF 130 2H3 JZF 130 -20.868 -3.691 -1.033 846 H4 JZF 130 H4 JZF 130 -18.489 -3.224 0.801 847 H15 JZF 130 1H5 JZF 130 -17.339 -5.031 -0.355 848 H25 JZF 130 2H5 JZF 130 -18.722 -5.325 -1.396 849 H17 JZF 130 1H7 JZF 130 -18.022 -1.565 -0.629 850 H27 JZF 130 2H7 JZF 130 -17.315 -2.873 -1.521 851 H8 JZF 130 H8 JZF 130 -19.733 -2.883 -2.632 852 H9 JZF 130 H9 JZF 130 -17.259 -2.435 -3.647 853 H1OH JZF 130 1HO JZF 130 -19.307 -0.194 -1.860 854 H11 JZF 130 H11 JZF 130 -17.187 -3.140 -6.138 855 H112 JZF 130 1H12 JZF 130 -18.725 -0.616 -6.934 856 H212 JZF 130 2H12 JZF 130 -17.168 -1.114 -7.578 857 H13A JZF 130 H13 JZF 130 -17.066 0.704 -5.830 858 H114 JZF 130 1H14 JZF 130 -17.406 0.105 -3.462 859 H214 JZF 130 2H14 JZF 130 -18.874 0.065 -4.405 860 H115 JZF 130 1H15 JZF 130 -21.786 -6.245 2.513 861 H215 JZF 130 2H15 JZF 130 -20.159 -6.627 3.078 862 H116 JZF 130 1H16 JZF 130 -21.370 -7.083 -1.329 863 H216 JZF 130 2H16 JZF 130 -19.934 -7.887 -0.626 864 H117 JZF 130 2H17 JZF 130 -21.512 -10.074 -0.852 865 H217 JZF 130 3H17 JZF 130 -22.282 -9.103 -2.121 866 H317 JZF 130 1H17 JZF 130 -20.559 -9.503 -2.233 867 H118 JZF 130 1H18 JZF 130 -18.606 -4.340 -7.509 868 H218 JZF 130 2H18 JZF 130 -19.964 -3.233 -7.272 869 H318 JZF 130 3H18 JZF 130 -18.664 -2.810 -8.398 870 H119 JZF 130 3H19 JZF 130 -15.291 -0.671 -4.315 871 H219 JZF 130 1H19 JZF 130 -15.521 -1.857 -5.603 872 H319 JZF 130 2H19 JZF 130 -14.959 -0.232 -5.994 Start of MODEL 10 1 H1 GLY 1 H GLY 1 7.702 -15.485 -3.448 2 HA2 GLY 1 1HA GLY 1 7.793 -16.349 -1.321 3 HA3 GLY 1 2HA GLY 1 9.512 -15.983 -1.333 4 HA PRO 2 HA PRO 2 8.985 -12.671 1.483 5 HB2 PRO 2 1HB PRO 2 10.503 -10.671 0.451 6 HB3 PRO 2 2HB PRO 2 11.196 -12.127 1.175 7 HG2 PRO 2 1HG PRO 2 10.768 -11.468 -1.713 8 HG3 PRO 2 2HG PRO 2 12.172 -12.219 -0.933 9 HD2 PRO 2 1HD PRO 2 10.306 -13.656 -2.270 10 HD3 PRO 2 2HD PRO 2 11.180 -14.298 -0.864 11 H GLY 3 H GLY 3 7.148 -11.575 1.762 12 HA2 GLY 3 1HA GLY 3 6.072 -10.014 -0.488 13 HA3 GLY 3 2HA GLY 3 5.145 -10.593 0.888 14 H SER 4 H SER 4 5.293 -7.899 -0.196 15 HA SER 4 HA SER 4 6.898 -6.305 1.554 16 HB2 SER 4 1HB SER 4 5.184 -4.496 0.618 17 HB3 SER 4 2HB SER 4 6.484 -5.139 -0.384 18 HG SER 4 HG SER 4 4.778 -5.465 -1.642 19 H MET 5 H MET 5 3.454 -7.138 1.395 20 HA MET 5 HA MET 5 2.768 -5.613 3.716 21 HB2 MET 5 1HB MET 5 1.228 -7.837 2.365 22 HB3 MET 5 2HB MET 5 0.581 -6.686 3.527 23 HG2 MET 5 1HG MET 5 0.409 -5.036 2.006 24 HG3 MET 5 2HG MET 5 1.869 -5.525 1.149 25 HE1 MET 5 3HE MET 5 0.045 -5.359 -1.664 26 HE2 MET 5 1HE MET 5 1.625 -5.500 -0.893 27 HE3 MET 5 2HE MET 5 0.968 -6.856 -1.809 28 H THR 6 H THR 6 2.565 -6.249 5.806 29 HA THR 6 HA THR 6 3.574 -8.934 6.457 30 HB THR 6 HB THR 6 3.342 -6.754 8.498 31 HG1 THR 6 HG1 THR 6 5.412 -6.019 7.863 32 HG21 THR 6 3HG2 THR 6 4.283 -9.371 8.505 33 HG22 THR 6 1HG2 THR 6 4.551 -8.153 9.752 34 HG23 THR 6 2HG2 THR 6 5.741 -8.379 8.470 35 H VAL 7 H VAL 7 1.502 -9.918 6.131 36 HA VAL 7 HA VAL 7 -0.274 -9.553 8.443 37 HB VAL 7 HB VAL 7 -1.298 -10.031 5.644 38 HG11 VAL 7 1HG1 VAL 7 -3.433 -9.944 6.518 39 HG12 VAL 7 2HG1 VAL 7 -2.555 -10.786 7.797 40 HG13 VAL 7 3HG1 VAL 7 -2.921 -9.068 7.960 41 HG21 VAL 7 3HG2 VAL 7 -0.473 -7.828 5.582 42 HG22 VAL 7 1HG2 VAL 7 -2.196 -7.663 5.920 43 HG23 VAL 7 2HG2 VAL 7 -1.022 -7.488 7.223 44 H VAL 8 H VAL 8 -0.893 -11.400 9.401 45 HA VAL 8 HA VAL 8 0.301 -13.860 8.641 46 HB VAL 8 HB VAL 8 -1.962 -13.468 10.601 47 HG11 VAL 8 1HG1 VAL 8 -1.486 -15.797 9.904 48 HG12 VAL 8 2HG1 VAL 8 0.170 -15.598 10.480 49 HG13 VAL 8 3HG1 VAL 8 -1.178 -15.507 11.615 50 HG21 VAL 8 3HG2 VAL 8 -0.056 -13.439 12.286 51 HG22 VAL 8 1HG2 VAL 8 1.006 -13.114 10.916 52 HG23 VAL 8 2HG2 VAL 8 -0.284 -11.981 11.321 53 H THR 9 H THR 9 -0.366 -15.288 7.192 54 HA THR 9 HA THR 9 -3.134 -15.140 6.226 55 HB THR 9 HB THR 9 -0.923 -16.713 4.921 56 HG1 THR 9 HG1 THR 9 -0.101 -14.917 4.150 57 HG21 THR 9 3HG2 THR 9 -2.446 -15.836 2.920 58 HG22 THR 9 1HG2 THR 9 -3.656 -15.798 4.201 59 HG23 THR 9 2HG2 THR 9 -2.829 -17.307 3.813 60 H THR 10 H THR 10 -4.267 -17.142 5.748 61 HA THR 10 HA THR 10 -3.579 -19.258 7.676 62 HB THR 10 HB THR 10 -5.953 -19.883 7.649 63 HG1 THR 10 HG1 THR 10 -7.105 -19.204 6.018 64 HG21 THR 10 3HG2 THR 10 -4.876 -17.419 8.657 65 HG22 THR 10 1HG2 THR 10 -6.079 -18.485 9.381 66 HG23 THR 10 2HG2 THR 10 -6.583 -17.213 8.268 67 H GLU 11 H GLU 11 -4.953 -21.369 6.879 68 HA GLU 11 HA GLU 11 -3.511 -22.278 4.587 69 HB2 GLU 11 1HB GLU 11 -5.701 -23.580 6.214 70 HB3 GLU 11 2HB GLU 11 -4.803 -24.388 4.936 71 HG2 GLU 11 1HG GLU 11 -3.274 -23.115 7.139 72 HG3 GLU 11 2HG GLU 11 -4.127 -24.622 7.467 73 H SER 12 H SER 12 -6.677 -20.986 5.146 74 HA SER 12 HA SER 12 -7.838 -21.955 2.709 75 HB2 SER 12 1HB SER 12 -9.782 -20.910 3.389 76 HB3 SER 12 2HB SER 12 -8.977 -21.113 4.945 77 HG SER 12 HG SER 12 -9.789 -18.975 4.597 78 H GLY 13 H GLY 13 -6.065 -19.114 3.699 79 HA2 GLY 13 1HA GLY 13 -4.834 -18.118 1.732 80 HA3 GLY 13 2HA GLY 13 -6.422 -17.990 0.991 81 H LEU 14 H LEU 14 -7.844 -17.167 3.316 82 HA LEU 14 HA LEU 14 -7.510 -14.392 3.162 83 HB2 LEU 14 1HB LEU 14 -9.625 -15.170 3.797 84 HB3 LEU 14 2HB LEU 14 -8.962 -16.186 5.077 85 HG LEU 14 HG LEU 14 -8.616 -13.251 5.352 86 HD11 LEU 14 1HD1 LEU 14 -11.068 -14.003 4.595 87 HD12 LEU 14 2HD1 LEU 14 -10.774 -12.714 5.761 88 HD13 LEU 14 3HD1 LEU 14 -11.189 -14.333 6.324 89 HD21 LEU 14 3HD2 LEU 14 -9.635 -14.990 7.510 90 HD22 LEU 14 1HD2 LEU 14 -8.394 -13.738 7.548 91 HD23 LEU 14 2HD2 LEU 14 -8.010 -15.342 6.921 92 H LYS 15 H LYS 15 -6.690 -12.874 4.621 93 HA LYS 15 HA LYS 15 -4.715 -13.952 6.524 94 HB2 LYS 15 1HB LYS 15 -4.596 -11.225 5.245 95 HB3 LYS 15 2HB LYS 15 -3.315 -12.082 6.093 96 HG2 LYS 15 1HG LYS 15 -3.176 -13.704 4.292 97 HG3 LYS 15 2HG LYS 15 -4.503 -12.901 3.449 98 HD2 LYS 15 1HD LYS 15 -3.070 -10.814 3.460 99 HD3 LYS 15 2HD LYS 15 -1.738 -11.841 3.997 100 HE2 LYS 15 1HE LYS 15 -2.029 -13.231 1.989 101 HE3 LYS 15 2HE LYS 15 -3.326 -12.164 1.451 102 HZ1 LYS 15 3HZ LYS 15 -1.142 -10.549 2.001 103 HZ2 LYS 15 1HZ LYS 15 -1.789 -10.922 0.483 104 HZ3 LYS 15 2HZ LYS 15 -0.539 -11.864 1.124 105 H TYR 16 H TYR 16 -4.215 -12.456 8.361 106 HA TYR 16 HA TYR 16 -6.388 -10.685 9.140 107 HB2 TYR 16 1HB TYR 16 -7.037 -11.823 11.069 108 HB3 TYR 16 2HB TYR 16 -6.841 -13.126 9.901 109 HD1 TYR 16 HD1 TYR 16 -4.844 -14.593 10.012 110 HD2 TYR 16 HD2 TYR 16 -5.643 -11.672 13.000 111 HE1 TYR 16 HE1 TYR 16 -3.266 -15.719 11.526 112 HE2 TYR 16 HE2 TYR 16 -4.067 -12.789 14.522 113 HH TYR 16 HH TYR 16 -2.960 -15.862 14.091 114 H GLU 17 H GLU 17 -5.755 -9.068 10.495 115 HA GLU 17 HA GLU 17 -3.097 -9.227 11.716 116 HB2 GLU 17 1HB GLU 17 -2.623 -8.086 9.682 117 HB3 GLU 17 2HB GLU 17 -4.055 -7.078 9.832 118 HG2 GLU 17 1HG GLU 17 -1.967 -5.874 10.322 119 HG3 GLU 17 2HG GLU 17 -3.092 -5.886 11.679 120 H ASP 18 H ASP 18 -3.266 -8.746 13.793 121 HA ASP 18 HA ASP 18 -5.602 -7.693 14.968 122 HB2 ASP 18 1HB ASP 18 -2.806 -7.925 16.102 123 HB3 ASP 18 2HB ASP 18 -4.254 -7.584 17.045 124 H LEU 19 H LEU 19 -6.224 -5.673 15.453 125 HA LEU 19 HA LEU 19 -4.309 -3.492 14.938 126 HB2 LEU 19 1HB LEU 19 -7.268 -3.623 14.396 127 HB3 LEU 19 2HB LEU 19 -6.335 -2.128 14.347 128 HG LEU 19 HG LEU 19 -5.727 -4.500 12.594 129 HD11 LEU 19 1HD1 LEU 19 -7.869 -3.949 11.886 130 HD12 LEU 19 2HD1 LEU 19 -6.835 -2.990 10.828 131 HD13 LEU 19 3HD1 LEU 19 -7.639 -2.229 12.201 132 HD21 LEU 19 3HD2 LEU 19 -4.609 -2.736 11.236 133 HD22 LEU 19 1HD2 LEU 19 -3.879 -2.993 12.821 134 HD23 LEU 19 2HD2 LEU 19 -4.920 -1.596 12.545 135 H THR 20 H THR 20 -6.821 -4.769 16.992 136 HA THR 20 HA THR 20 -5.931 -3.136 19.185 137 HB THR 20 HB THR 20 -8.853 -2.847 18.598 138 HG1 THR 20 HG1 THR 20 -8.468 -1.073 17.332 139 HG21 THR 20 3HG2 THR 20 -6.798 -1.540 20.306 140 HG22 THR 20 1HG2 THR 20 -8.459 -1.994 20.685 141 HG23 THR 20 2HG2 THR 20 -8.136 -0.553 19.720 142 H GLU 21 H GLU 21 -5.831 -4.550 20.793 143 HA GLU 21 HA GLU 21 -6.974 -7.060 20.870 144 HB2 GLU 21 1HB GLU 21 -6.568 -6.957 23.353 145 HB3 GLU 21 2HB GLU 21 -5.177 -6.566 22.352 146 HG2 GLU 21 1HG GLU 21 -5.620 -4.174 22.708 147 HG3 GLU 21 2HG GLU 21 -6.964 -4.600 23.766 148 H GLY 22 H GLY 22 -8.669 -7.947 22.220 149 HA2 GLY 22 1HA GLY 22 -10.678 -6.175 23.293 150 HA3 GLY 22 2HA GLY 22 -11.168 -6.976 21.808 151 H SER 23 H SER 23 -9.756 -7.722 24.991 152 HA SER 23 HA SER 23 -10.612 -10.444 24.927 153 HB2 SER 23 1HB SER 23 -8.678 -9.852 26.252 154 HB3 SER 23 2HB SER 23 -9.625 -8.703 27.197 155 HG SER 23 HG SER 23 -9.781 -10.395 28.469 156 H GLY 24 H GLY 24 -12.872 -10.078 24.378 157 HA2 GLY 24 1HA GLY 24 -14.474 -9.500 26.792 158 HA3 GLY 24 2HA GLY 24 -14.959 -8.925 25.204 159 H ALA 25 H ALA 25 -16.152 -10.218 23.922 160 HA ALA 25 HA ALA 25 -16.352 -13.066 24.590 161 HB1 ALA 25 1HB ALA 25 -18.412 -11.082 25.013 162 HB2 ALA 25 2HB ALA 25 -18.952 -12.360 23.924 163 HB3 ALA 25 3HB ALA 25 -18.346 -12.767 25.530 164 H GLU 26 H GLU 26 -16.388 -14.356 22.849 165 HA GLU 26 HA GLU 26 -16.119 -13.193 20.242 166 HB2 GLU 26 1HB GLU 26 -14.795 -15.127 20.743 167 HB3 GLU 26 2HB GLU 26 -16.218 -16.052 21.204 168 HG2 GLU 26 1HG GLU 26 -16.959 -16.209 18.968 169 HG3 GLU 26 2HG GLU 26 -15.798 -14.999 18.424 170 H ALA 27 H ALA 27 -17.597 -13.002 18.665 171 HA ALA 27 HA ALA 27 -20.337 -13.144 19.217 172 HB1 ALA 27 1HB ALA 27 -19.236 -13.258 16.430 173 HB2 ALA 27 2HB ALA 27 -20.696 -12.459 17.014 174 HB3 ALA 27 3HB ALA 27 -19.110 -11.798 17.412 175 H ARG 28 H ARG 28 -21.970 -14.484 18.195 176 HA ARG 28 HA ARG 28 -21.058 -17.128 17.329 177 HB2 ARG 28 1HB ARG 28 -22.167 -16.575 19.893 178 HB3 ARG 28 2HB ARG 28 -23.356 -17.493 18.978 179 HG2 ARG 28 1HG ARG 28 -20.498 -18.300 19.478 180 HG3 ARG 28 2HG ARG 28 -21.927 -18.963 20.274 181 HD2 ARG 28 1HD ARG 28 -22.615 -19.336 17.702 182 HD3 ARG 28 2HD ARG 28 -20.861 -19.447 17.563 183 HE ARG 28 HE ARG 28 -20.986 -21.500 18.539 184 HH11 ARG 28 1HH1 ARG 28 -23.834 -19.694 19.405 185 HH12 ARG 28 2HH1 ARG 28 -24.573 -21.014 20.250 186 HH21 ARG 28 1HH2 ARG 28 -21.948 -23.245 19.649 187 HH22 ARG 28 2HH2 ARG 28 -23.498 -23.033 20.389 188 H ALA 29 H ALA 29 -22.350 -18.096 15.828 189 HA ALA 29 HA ALA 29 -24.055 -16.546 14.267 190 HB1 ALA 29 1HB ALA 29 -24.731 -19.325 14.018 191 HB2 ALA 29 2HB ALA 29 -23.866 -18.278 12.892 192 HB3 ALA 29 3HB ALA 29 -22.983 -19.133 14.156 193 H GLY 30 H GLY 30 -26.074 -15.872 14.555 194 HA2 GLY 30 1HA GLY 30 -28.405 -16.590 14.953 195 HA3 GLY 30 2HA GLY 30 -27.807 -17.419 16.383 196 H GLN 31 H GLN 31 -26.013 -15.217 17.112 197 HA GLN 31 HA GLN 31 -28.032 -13.517 18.364 198 HB2 GLN 31 1HB GLN 31 -26.255 -12.846 19.896 199 HB3 GLN 31 2HB GLN 31 -26.379 -14.598 19.820 200 HG2 GLN 31 1HG GLN 31 -24.324 -14.839 18.958 201 HG3 GLN 31 2HG GLN 31 -24.470 -13.409 17.937 202 HE21 GLN 31 2HE2 GLN 31 -24.814 -13.707 21.437 203 HE22 GLN 31 1HE2 GLN 31 -23.512 -12.643 21.836 204 H THR 32 H THR 32 -28.000 -11.276 18.260 205 HA THR 32 HA THR 32 -26.769 -10.199 15.859 206 HB THR 32 HB THR 32 -28.667 -8.904 17.826 207 HG1 THR 32 HG1 THR 32 -30.158 -9.245 16.051 208 HG21 THR 32 3HG2 THR 32 -27.297 -7.252 16.650 209 HG22 THR 32 1HG2 THR 32 -28.970 -7.193 16.097 210 HG23 THR 32 2HG2 THR 32 -27.740 -7.976 15.104 211 H VAL 33 H VAL 33 -25.334 -8.480 15.796 212 HA VAL 33 HA VAL 33 -24.357 -7.336 18.283 213 HB VAL 33 HB VAL 33 -22.041 -7.897 17.915 214 HG11 VAL 33 1HG1 VAL 33 -23.602 -10.458 17.664 215 HG12 VAL 33 2HG1 VAL 33 -22.076 -10.192 18.510 216 HG13 VAL 33 3HG1 VAL 33 -23.568 -9.489 19.137 217 HG21 VAL 33 3HG2 VAL 33 -21.287 -8.398 15.887 218 HG22 VAL 33 1HG2 VAL 33 -22.162 -9.928 15.949 219 HG23 VAL 33 2HG2 VAL 33 -22.939 -8.494 15.278 220 H SER 34 H SER 34 -22.953 -5.499 17.952 221 HA SER 34 HA SER 34 -23.383 -4.253 15.319 222 HB2 SER 34 1HB SER 34 -23.596 -3.262 18.070 223 HB3 SER 34 2HB SER 34 -22.668 -2.200 17.012 224 HG SER 34 HG SER 34 -24.443 -1.669 16.026 225 H VAL 35 H VAL 35 -21.649 -4.153 14.071 226 HA VAL 35 HA VAL 35 -19.036 -3.621 15.308 227 HB VAL 35 HB VAL 35 -17.912 -5.217 13.957 228 HG11 VAL 35 1HG1 VAL 35 -19.835 -5.952 15.843 229 HG12 VAL 35 2HG1 VAL 35 -20.012 -7.107 14.521 230 HG13 VAL 35 3HG1 VAL 35 -18.447 -6.899 15.308 231 HG21 VAL 35 3HG2 VAL 35 -19.798 -6.698 12.580 232 HG22 VAL 35 1HG2 VAL 35 -20.308 -5.029 12.329 233 HG23 VAL 35 2HG2 VAL 35 -18.677 -5.528 11.883 234 H HIS 36 H HIS 36 -17.388 -3.148 13.437 235 HA HIS 36 HA HIS 36 -18.709 -1.375 11.489 236 HB2 HIS 36 1HB HIS 36 -16.474 -0.862 13.371 237 HB3 HIS 36 2HB HIS 36 -16.316 -0.177 11.756 238 HD1 HIS 36 HD1 HIS 36 -18.957 0.937 11.105 239 HD2 HIS 36 HD2 HIS 36 -17.450 1.067 14.975 240 HE1 HIS 36 HE1 HIS 36 -20.194 2.806 12.245 241 H TYR 37 H TYR 37 -18.137 -1.607 9.411 242 HA TYR 37 HA TYR 37 -15.893 -3.420 8.815 243 HB2 TYR 37 1HB TYR 37 -17.069 -4.079 6.800 244 HB3 TYR 37 2HB TYR 37 -18.134 -4.285 8.187 245 HD1 TYR 37 HD2 TYR 37 -20.035 -2.766 8.530 246 HD2 TYR 37 HD1 TYR 37 -17.556 -2.464 5.085 247 HE1 TYR 37 HE2 TYR 37 -21.747 -1.387 7.426 248 HE2 TYR 37 HE1 TYR 37 -19.260 -1.083 3.972 249 HH TYR 37 HH TYR 37 -22.395 -0.856 4.993 250 H THR 38 H THR 38 -14.262 -2.686 7.609 251 HA THR 38 HA THR 38 -14.644 -0.181 6.107 252 HB THR 38 HB THR 38 -11.917 -0.545 7.069 253 HG1 THR 38 HG1 THR 38 -12.481 0.037 9.261 254 HG21 THR 38 3HG2 THR 38 -12.845 1.512 6.042 255 HG22 THR 38 1HG2 THR 38 -12.142 1.797 7.633 256 HG23 THR 38 2HG2 THR 38 -13.893 1.707 7.447 257 H GLY 39 H GLY 39 -14.517 -0.745 4.026 258 HA2 GLY 39 1HA GLY 39 -13.010 -3.000 3.112 259 HA3 GLY 39 2HA GLY 39 -13.842 -1.825 2.103 260 H TRP 40 H TRP 40 -10.863 -3.004 3.029 261 HA TRP 40 HA TRP 40 -9.510 -0.565 2.075 262 HB2 TRP 40 1HB TRP 40 -8.484 -2.689 3.970 263 HB3 TRP 40 2HB TRP 40 -7.522 -1.352 3.345 264 HD1 TRP 40 HD1 TRP 40 -10.334 0.574 3.757 265 HE1 TRP 40 HE1 TRP 40 -10.632 1.554 6.118 266 HE3 TRP 40 HE3 TRP 40 -7.210 -2.548 6.332 267 HZ2 TRP 40 HZ2 TRP 40 -9.670 1.068 8.727 268 HZ3 TRP 40 HZ3 TRP 40 -6.955 -2.223 8.757 269 HH2 TRP 40 HH2 TRP 40 -8.160 -0.452 9.928 270 H LEU 41 H LEU 41 -7.685 -0.834 0.701 271 HA LEU 41 HA LEU 41 -7.927 -3.156 -1.031 272 HB2 LEU 41 1HB LEU 41 -7.680 -0.640 -1.703 273 HB3 LEU 41 2HB LEU 41 -5.961 -0.952 -1.471 274 HG LEU 41 HG LEU 41 -6.423 -2.950 -3.113 275 HD11 LEU 41 1HD1 LEU 41 -8.670 -1.036 -3.718 276 HD12 LEU 41 2HD1 LEU 41 -8.805 -2.734 -3.262 277 HD13 LEU 41 3HD1 LEU 41 -8.104 -2.293 -4.819 278 HD21 LEU 41 3HD2 LEU 41 -4.877 -1.477 -3.902 279 HD22 LEU 41 1HD2 LEU 41 -5.905 -0.072 -3.622 280 HD23 LEU 41 2HD2 LEU 41 -6.197 -1.115 -5.014 281 H THR 42 H THR 42 -6.047 -4.344 -1.757 282 HA THR 42 HA THR 42 -4.469 -5.305 0.355 283 HB THR 42 HB THR 42 -3.366 -6.689 -1.223 284 HG1 THR 42 HG1 THR 42 -4.351 -5.111 -3.368 285 HG21 THR 42 3HG2 THR 42 -5.170 -7.678 -2.452 286 HG22 THR 42 1HG2 THR 42 -6.087 -6.173 -2.422 287 HG23 THR 42 2HG2 THR 42 -5.824 -7.075 -0.929 288 H ASP 43 H ASP 43 -4.100 -2.554 -1.618 289 HA ASP 43 HA ASP 43 -1.219 -2.387 -1.273 290 HB2 ASP 43 1HB ASP 43 -3.275 -0.739 -2.709 291 HB3 ASP 43 2HB ASP 43 -1.682 -0.065 -2.376 292 H GLY 44 H GLY 44 -4.071 -1.370 0.331 293 HA2 GLY 44 1HA GLY 44 -3.811 -0.630 2.639 294 HA3 GLY 44 2HA GLY 44 -2.431 0.322 2.111 295 H GLN 45 H GLN 45 -4.814 0.512 -0.204 296 HA GLN 45 HA GLN 45 -5.574 3.172 0.739 297 HB2 GLN 45 1HB GLN 45 -4.973 3.505 -1.428 298 HB3 GLN 45 2HB GLN 45 -5.353 1.854 -1.898 299 HG2 GLN 45 1HG GLN 45 -7.591 2.331 -2.254 300 HG3 GLN 45 2HG GLN 45 -7.540 3.787 -1.261 301 HE21 GLN 45 2HE2 GLN 45 -7.487 2.575 -4.371 302 HE22 GLN 45 1HE2 GLN 45 -6.967 3.997 -5.201 303 H LYS 46 H LYS 46 -7.523 3.607 1.532 304 HA LYS 46 HA LYS 46 -9.473 1.520 1.801 305 HB2 LYS 46 1HB LYS 46 -9.121 3.116 3.609 306 HB3 LYS 46 2HB LYS 46 -9.576 4.447 2.553 307 HG2 LYS 46 1HG LYS 46 -11.818 3.205 2.314 308 HG3 LYS 46 2HG LYS 46 -11.303 2.320 3.752 309 HD2 LYS 46 1HD LYS 46 -11.183 5.305 3.734 310 HD3 LYS 46 2HD LYS 46 -12.732 4.497 3.986 311 HE2 LYS 46 1HE LYS 46 -11.793 4.918 6.133 312 HE3 LYS 46 2HE LYS 46 -11.646 3.188 5.825 313 HZ1 LYS 46 3HZ LYS 46 -9.377 4.776 4.986 314 HZ2 LYS 46 1HZ LYS 46 -9.422 3.297 5.808 315 HZ3 LYS 46 2HZ LYS 46 -9.637 4.743 6.658 316 H PHE 47 H PHE 47 -11.431 1.304 0.806 317 HA PHE 47 HA PHE 47 -12.210 3.305 -1.186 318 HB2 PHE 47 1HB PHE 47 -12.659 1.540 -2.850 319 HB3 PHE 47 2HB PHE 47 -10.952 1.619 -2.425 320 HD1 PHE 47 HD1 PHE 47 -14.082 -0.260 -1.826 321 HD2 PHE 47 HD2 PHE 47 -9.834 -0.248 -1.558 322 HE1 PHE 47 HE1 PHE 47 -14.113 -2.658 -1.277 323 HE2 PHE 47 HE2 PHE 47 -9.859 -2.647 -1.009 324 HZ PHE 47 HZ PHE 47 -12.000 -3.855 -0.869 325 H ASP 48 H ASP 48 -13.089 1.979 1.505 326 HA ASP 48 HA ASP 48 -15.881 2.302 1.059 327 HB2 ASP 48 1HB ASP 48 -15.115 -0.153 0.292 328 HB3 ASP 48 2HB ASP 48 -15.335 -0.458 2.013 329 H SER 49 H SER 49 -16.717 3.073 2.881 330 HA SER 49 HA SER 49 -15.823 2.087 5.463 331 HB2 SER 49 1HB SER 49 -15.677 4.690 6.092 332 HB3 SER 49 2HB SER 49 -14.274 3.771 5.547 333 HG SER 49 HG SER 49 -14.457 5.691 4.369 334 H SER 50 H SER 50 -17.470 1.982 6.852 335 HA SER 50 HA SER 50 -20.088 2.724 6.043 336 HB2 SER 50 1HB SER 50 -20.492 2.163 8.615 337 HB3 SER 50 2HB SER 50 -20.179 0.894 7.432 338 HG SER 50 HG SER 50 -18.606 0.408 8.743 339 H LYS 51 H LYS 51 -17.590 4.477 7.460 340 HA LYS 51 HA LYS 51 -18.881 6.172 9.252 341 HB2 LYS 51 1HB LYS 51 -16.627 6.877 7.363 342 HB3 LYS 51 2HB LYS 51 -17.064 7.755 8.823 343 HG2 LYS 51 1HG LYS 51 -16.130 6.208 10.203 344 HG3 LYS 51 2HG LYS 51 -16.429 4.871 9.090 345 HD2 LYS 51 1HD LYS 51 -14.049 5.316 9.241 346 HD3 LYS 51 2HD LYS 51 -14.639 5.717 7.627 347 HE2 LYS 51 1HE LYS 51 -14.585 7.868 9.679 348 HE3 LYS 51 2HE LYS 51 -13.051 7.346 8.983 349 HZ1 LYS 51 3HZ LYS 51 -14.993 9.041 7.864 350 HZ2 LYS 51 1HZ LYS 51 -14.857 7.666 6.887 351 HZ3 LYS 51 2HZ LYS 51 -13.489 8.599 7.230 352 H ASP 52 H ASP 52 -19.056 6.018 5.808 353 HA ASP 52 HA ASP 52 -19.764 8.583 5.084 354 HB2 ASP 52 1HB ASP 52 -20.554 5.881 4.054 355 HB3 ASP 52 2HB ASP 52 -21.308 7.324 3.383 356 H ARG 53 H ARG 53 -21.629 6.195 6.813 357 HA ARG 53 HA ARG 53 -23.974 7.966 6.770 358 HB2 ARG 53 1HB ARG 53 -24.090 5.458 6.136 359 HB3 ARG 53 2HB ARG 53 -23.959 5.169 7.865 360 HG2 ARG 53 1HG ARG 53 -25.985 6.412 8.272 361 HG3 ARG 53 2HG ARG 53 -26.092 6.848 6.565 362 HD2 ARG 53 1HD ARG 53 -26.177 4.369 6.073 363 HD3 ARG 53 2HD ARG 53 -26.388 4.123 7.806 364 HE ARG 53 HE ARG 53 -28.360 5.026 5.945 365 HH11 ARG 53 1HH1 ARG 53 -27.327 5.194 9.265 366 HH12 ARG 53 2HH1 ARG 53 -28.909 5.547 9.876 367 HH21 ARG 53 1HH2 ARG 53 -30.448 5.491 6.737 368 HH22 ARG 53 2HH2 ARG 53 -30.684 5.715 8.437 369 H ASN 54 H ASN 54 -21.456 6.759 8.768 370 HA ASN 54 HA ASN 54 -20.867 7.164 10.927 371 HB2 ASN 54 1HB ASN 54 -21.675 9.520 10.138 372 HB3 ASN 54 2HB ASN 54 -23.060 9.196 11.177 373 HD21 ASN 54 2HD2 ASN 54 -19.651 9.807 11.046 374 HD22 ASN 54 1HD2 ASN 54 -19.430 10.100 12.734 375 H ASP 55 H ASP 55 -21.931 4.966 11.108 376 HA ASP 55 HA ASP 55 -23.490 4.896 13.473 377 HB2 ASP 55 1HB ASP 55 -25.459 5.309 12.345 378 HB3 ASP 55 2HB ASP 55 -24.888 4.560 10.856 379 HA PRO 56 HA PRO 56 -21.527 0.962 13.613 380 HB2 PRO 56 1HB PRO 56 -23.025 -0.210 15.550 381 HB3 PRO 56 2HB PRO 56 -21.836 1.054 15.887 382 HG2 PRO 56 1HG PRO 56 -24.808 1.276 15.606 383 HG3 PRO 56 2HG PRO 56 -23.738 2.032 16.801 384 HD2 PRO 56 1HD PRO 56 -24.683 3.365 14.642 385 HD3 PRO 56 2HD PRO 56 -23.091 3.702 15.350 386 H PHE 57 H PHE 57 -21.703 -0.952 12.583 387 HA PHE 57 HA PHE 57 -24.159 -1.528 11.174 388 HB2 PHE 57 1HB PHE 57 -21.726 -1.757 10.290 389 HB3 PHE 57 2HB PHE 57 -21.730 -3.295 11.146 390 HD1 PHE 57 HD1 PHE 57 -24.275 -1.523 9.071 391 HD2 PHE 57 HD2 PHE 57 -21.928 -5.025 9.656 392 HE1 PHE 57 HE1 PHE 57 -25.386 -2.584 7.149 393 HE2 PHE 57 HE2 PHE 57 -23.034 -6.091 7.734 394 HZ PHE 57 HZ PHE 57 -24.764 -4.870 6.477 395 H ALA 58 H ALA 58 -25.710 -2.360 12.463 396 HA ALA 58 HA ALA 58 -25.008 -4.598 14.232 397 HB1 ALA 58 1HB ALA 58 -27.738 -3.605 14.429 398 HB2 ALA 58 2HB ALA 58 -26.521 -3.836 15.686 399 HB3 ALA 58 3HB ALA 58 -26.524 -2.359 14.723 400 H PHE 59 H PHE 59 -25.537 -6.602 13.673 401 HA PHE 59 HA PHE 59 -27.955 -7.209 12.251 402 HB2 PHE 59 1HB PHE 59 -27.019 -8.112 10.255 403 HB3 PHE 59 2HB PHE 59 -26.327 -6.504 10.443 404 HD1 PHE 59 HD2 PHE 59 -24.006 -6.329 11.482 405 HD2 PHE 59 HD1 PHE 59 -25.648 -9.974 10.022 406 HE1 PHE 59 HE2 PHE 59 -21.743 -7.284 11.331 407 HE2 PHE 59 HE1 PHE 59 -23.389 -10.935 9.871 408 HZ PHE 59 HZ PHE 59 -21.432 -9.590 10.524 409 H VAL 60 H VAL 60 -28.046 -9.632 11.755 410 HA VAL 60 HA VAL 60 -27.216 -11.029 14.144 411 HB VAL 60 HB VAL 60 -28.750 -12.055 11.752 412 HG11 VAL 60 1HG1 VAL 60 -29.509 -13.766 13.498 413 HG12 VAL 60 2HG1 VAL 60 -27.883 -13.942 12.835 414 HG13 VAL 60 3HG1 VAL 60 -28.112 -13.238 14.436 415 HG21 VAL 60 3HG2 VAL 60 -30.319 -11.785 14.124 416 HG22 VAL 60 1HG2 VAL 60 -29.529 -10.247 13.773 417 HG23 VAL 60 2HG2 VAL 60 -30.544 -11.017 12.552 418 H LEU 61 H LEU 61 -25.641 -12.520 14.331 419 HA LEU 61 HA LEU 61 -23.706 -12.741 12.225 420 HB2 LEU 61 1HB LEU 61 -22.948 -12.622 14.499 421 HB3 LEU 61 2HB LEU 61 -23.909 -14.032 14.939 422 HG LEU 61 HG LEU 61 -22.459 -15.483 13.690 423 HD11 LEU 61 1HD1 LEU 61 -21.543 -14.642 11.839 424 HD12 LEU 61 2HD1 LEU 61 -20.280 -14.011 12.895 425 HD13 LEU 61 3HD1 LEU 61 -21.640 -12.986 12.438 426 HD21 LEU 61 3HD2 LEU 61 -20.988 -15.562 15.357 427 HD22 LEU 61 1HD2 LEU 61 -21.708 -14.067 15.954 428 HD23 LEU 61 2HD2 LEU 61 -20.289 -14.005 14.909 429 H GLY 62 H GLY 62 -23.334 -14.404 10.855 430 HA2 GLY 62 1HA GLY 62 -23.755 -16.306 9.641 431 HA3 GLY 62 2HA GLY 62 -24.083 -17.065 11.191 432 H GLY 63 H GLY 63 -25.762 -14.547 9.301 433 HA2 GLY 63 1HA GLY 63 -27.884 -16.078 8.389 434 HA3 GLY 63 2HA GLY 63 -28.333 -15.537 10.000 435 H GLY 64 H GLY 64 -26.661 -13.996 7.248 436 HA2 GLY 64 1HA GLY 64 -28.824 -12.023 7.108 437 HA3 GLY 64 2HA GLY 64 -27.198 -11.438 7.431 438 H MET 65 H MET 65 -26.183 -10.698 5.701 439 HA MET 65 HA MET 65 -26.289 -12.164 3.202 440 HB2 MET 65 1HB MET 65 -27.150 -9.268 3.336 441 HB3 MET 65 2HB MET 65 -26.954 -10.218 1.869 442 HG2 MET 65 1HG MET 65 -28.743 -11.724 2.635 443 HG3 MET 65 2HG MET 65 -28.963 -10.704 4.055 444 HE1 MET 65 3HE MET 65 -31.612 -11.113 2.599 445 HE2 MET 65 1HE MET 65 -31.286 -9.981 3.912 446 HE3 MET 65 2HE MET 65 -32.134 -9.433 2.466 447 H VAL 66 H VAL 66 -24.067 -12.333 4.251 448 HA VAL 66 HA VAL 66 -22.384 -10.158 3.202 449 HB VAL 66 HB VAL 66 -20.865 -10.332 5.049 450 HG11 VAL 66 1HG1 VAL 66 -22.685 -8.811 5.415 451 HG12 VAL 66 2HG1 VAL 66 -23.727 -10.121 5.974 452 HG13 VAL 66 3HG1 VAL 66 -22.329 -9.634 6.934 453 HG21 VAL 66 3HG2 VAL 66 -22.112 -11.912 6.969 454 HG22 VAL 66 1HG2 VAL 66 -22.220 -12.849 5.479 455 HG23 VAL 66 2HG2 VAL 66 -20.649 -12.303 6.066 456 H ILE 67 H ILE 67 -20.205 -10.809 2.629 457 HA ILE 67 HA ILE 67 -20.156 -13.231 1.166 458 HB ILE 67 HB ILE 67 -17.711 -12.703 0.851 459 HG12 ILE 67 1HG1 ILE 67 -18.155 -9.997 1.974 460 HG13 ILE 67 2HG1 ILE 67 -17.916 -11.291 3.143 461 HG21 ILE 67 1HG2 ILE 67 -19.984 -10.958 0.107 462 HG22 ILE 67 2HG2 ILE 67 -18.362 -10.359 -0.235 463 HG23 ILE 67 3HG2 ILE 67 -18.894 -11.899 -0.911 464 HD11 ILE 67 3HD1 ILE 67 -15.736 -11.205 2.817 465 HD12 ILE 67 1HD1 ILE 67 -15.953 -11.530 1.097 466 HD13 ILE 67 2HD1 ILE 67 -15.973 -9.869 1.691 467 H LYS 68 H LYS 68 -18.649 -14.998 1.411 468 HA LYS 68 HA LYS 68 -18.763 -16.328 3.796 469 HB2 LYS 68 1HB LYS 68 -16.834 -16.494 1.504 470 HB3 LYS 68 2HB LYS 68 -16.604 -17.505 2.925 471 HG2 LYS 68 1HG LYS 68 -19.178 -18.028 2.452 472 HG3 LYS 68 2HG LYS 68 -18.662 -17.637 0.810 473 HD2 LYS 68 1HD LYS 68 -16.699 -19.322 2.009 474 HD3 LYS 68 2HD LYS 68 -18.289 -20.052 2.245 475 HE2 LYS 68 1HE LYS 68 -17.757 -20.902 0.189 476 HE3 LYS 68 2HE LYS 68 -18.583 -19.422 -0.294 477 HZ1 LYS 68 3HZ LYS 68 -15.739 -20.091 -0.425 478 HZ2 LYS 68 1HZ LYS 68 -16.152 -18.477 -0.130 479 HZ3 LYS 68 2HZ LYS 68 -16.702 -19.248 -1.531 480 H GLY 69 H GLY 69 -16.037 -14.348 2.634 481 HA2 GLY 69 1HA GLY 69 -14.330 -14.679 4.799 482 HA3 GLY 69 2HA GLY 69 -14.382 -13.247 3.782 483 H TRP 70 H TRP 70 -17.036 -12.442 4.425 484 HA TRP 70 HA TRP 70 -16.526 -10.928 6.755 485 HB2 TRP 70 1HB TRP 70 -18.833 -11.299 4.911 486 HB3 TRP 70 2HB TRP 70 -19.168 -10.606 6.496 487 HD1 TRP 70 HD1 TRP 70 -16.068 -9.875 4.298 488 HE1 TRP 70 HE1 TRP 70 -16.019 -7.349 3.806 489 HE3 TRP 70 HE3 TRP 70 -20.492 -8.535 6.482 490 HZ2 TRP 70 HZ2 TRP 70 -17.640 -5.088 4.282 491 HZ3 TRP 70 HZ3 TRP 70 -21.170 -6.171 6.420 492 HH2 TRP 70 HH2 TRP 70 -19.772 -4.484 5.343 493 H ASP 71 H ASP 71 -18.730 -13.658 6.156 494 HA ASP 71 HA ASP 71 -19.778 -13.843 8.741 495 HB2 ASP 71 1HB ASP 71 -20.818 -15.021 6.907 496 HB3 ASP 71 2HB ASP 71 -19.365 -15.981 6.644 497 H GLU 72 H GLU 72 -16.903 -15.319 7.304 498 HA GLU 72 HA GLU 72 -16.230 -16.957 9.498 499 HB2 GLU 72 1HB GLU 72 -15.317 -16.969 7.072 500 HB3 GLU 72 2HB GLU 72 -14.183 -15.758 7.654 501 HG2 GLU 72 1HG GLU 72 -12.953 -17.645 7.965 502 HG3 GLU 72 2HG GLU 72 -13.746 -17.533 9.535 503 H GLY 73 H GLY 73 -15.453 -13.615 8.692 504 HA2 GLY 73 1HA GLY 73 -13.595 -13.290 10.859 505 HA3 GLY 73 2HA GLY 73 -14.252 -12.012 9.847 506 H VAL 74 H VAL 74 -16.990 -12.435 10.322 507 HA VAL 74 HA VAL 74 -17.279 -11.051 12.798 508 HB VAL 74 HB VAL 74 -19.434 -12.262 11.061 509 HG11 VAL 74 1HG1 VAL 74 -20.903 -10.627 12.143 510 HG12 VAL 74 2HG1 VAL 74 -20.203 -11.746 13.314 511 HG13 VAL 74 3HG1 VAL 74 -19.566 -10.108 13.168 512 HG21 VAL 74 3HG2 VAL 74 -19.227 -9.419 10.853 513 HG22 VAL 74 1HG2 VAL 74 -17.657 -10.144 10.505 514 HG23 VAL 74 2HG2 VAL 74 -19.080 -10.638 9.587 515 H GLN 75 H GLN 75 -17.418 -14.368 11.847 516 HA GLN 75 HA GLN 75 -18.821 -15.187 14.259 517 HB2 GLN 75 1HB GLN 75 -18.929 -17.343 13.325 518 HB3 GLN 75 2HB GLN 75 -19.140 -16.255 11.959 519 HG2 GLN 75 1HG GLN 75 -16.787 -16.550 11.365 520 HG3 GLN 75 2HG GLN 75 -16.585 -17.650 12.727 521 HE21 GLN 75 2HE2 GLN 75 -19.133 -17.305 10.288 522 HE22 GLN 75 1HE2 GLN 75 -19.045 -18.932 9.715 523 H GLY 76 H GLY 76 -16.003 -13.975 14.102 524 HA2 GLY 76 1HA GLY 76 -14.785 -15.969 15.893 525 HA3 GLY 76 2HA GLY 76 -13.836 -15.289 14.580 526 H MET 77 H MET 77 -14.853 -12.627 14.757 527 HA MET 77 HA MET 77 -13.068 -11.475 16.526 528 HB2 MET 77 1HB MET 77 -14.157 -9.391 16.101 529 HB3 MET 77 2HB MET 77 -14.239 -10.335 14.619 530 HG2 MET 77 1HG MET 77 -16.557 -11.025 15.335 531 HG3 MET 77 2HG MET 77 -16.436 -9.795 16.591 532 HE1 MET 77 3HE MET 77 -14.532 -7.729 14.159 533 HE2 MET 77 1HE MET 77 -15.838 -6.583 14.463 534 HE3 MET 77 2HE MET 77 -15.172 -7.533 15.792 535 H LYS 78 H LYS 78 -13.509 -10.149 18.448 536 HA LYS 78 HA LYS 78 -15.673 -11.278 20.100 537 HB2 LYS 78 1HB LYS 78 -12.944 -10.442 21.094 538 HB3 LYS 78 2HB LYS 78 -14.221 -11.209 22.031 539 HG2 LYS 78 1HG LYS 78 -14.008 -13.184 20.477 540 HG3 LYS 78 2HG LYS 78 -12.548 -12.419 19.848 541 HD2 LYS 78 1HD LYS 78 -11.431 -12.608 21.903 542 HD3 LYS 78 2HD LYS 78 -12.928 -12.916 22.786 543 HE2 LYS 78 1HE LYS 78 -13.087 -15.104 21.985 544 HE3 LYS 78 2HE LYS 78 -11.965 -14.798 20.660 545 HZ1 LYS 78 3HZ LYS 78 -10.775 -14.362 23.225 546 HZ2 LYS 78 1HZ LYS 78 -10.238 -15.317 21.937 547 HZ3 LYS 78 2HZ LYS 78 -11.344 -15.945 23.050 548 H VAL 79 H VAL 79 -16.122 -9.851 22.061 549 HA VAL 79 HA VAL 79 -17.034 -7.358 21.225 550 HB VAL 79 HB VAL 79 -16.438 -8.275 24.042 551 HG11 VAL 79 1HG1 VAL 79 -18.465 -6.499 24.271 552 HG12 VAL 79 2HG1 VAL 79 -16.763 -6.095 24.504 553 HG13 VAL 79 3HG1 VAL 79 -17.542 -5.776 22.954 554 HG21 VAL 79 3HG2 VAL 79 -18.557 -9.169 24.141 555 HG22 VAL 79 1HG2 VAL 79 -19.164 -8.149 22.837 556 HG23 VAL 79 2HG2 VAL 79 -18.120 -9.522 22.470 557 H GLY 80 H GLY 80 -15.961 -5.568 20.734 558 HA2 GLY 80 1HA GLY 80 -14.520 -3.772 21.063 559 HA3 GLY 80 2HA GLY 80 -13.820 -4.620 22.434 560 H GLY 81 H GLY 81 -13.859 -6.796 19.978 561 HA2 GLY 81 1HA GLY 81 -11.019 -6.548 19.567 562 HA3 GLY 81 2HA GLY 81 -12.068 -7.787 18.895 563 H VAL 82 H VAL 82 -9.966 -5.656 17.913 564 HA VAL 82 HA VAL 82 -11.461 -5.036 15.459 565 HB VAL 82 HB VAL 82 -9.491 -3.134 16.727 566 HG11 VAL 82 1HG1 VAL 82 -9.461 -2.391 14.606 567 HG12 VAL 82 2HG1 VAL 82 -10.952 -3.235 14.182 568 HG13 VAL 82 3HG1 VAL 82 -11.022 -1.684 15.020 569 HG21 VAL 82 3HG2 VAL 82 -12.446 -3.383 17.009 570 HG22 VAL 82 1HG2 VAL 82 -11.233 -2.921 18.203 571 HG23 VAL 82 2HG2 VAL 82 -11.730 -1.772 16.961 572 H ARG 83 H ARG 83 -10.514 -6.015 13.807 573 HA ARG 83 HA ARG 83 -7.638 -5.857 13.468 574 HB2 ARG 83 1HB ARG 83 -8.935 -8.572 13.335 575 HB3 ARG 83 2HB ARG 83 -7.220 -8.182 13.322 576 HG2 ARG 83 1HG ARG 83 -7.429 -7.394 15.660 577 HG3 ARG 83 2HG ARG 83 -9.109 -7.934 15.651 578 HD2 ARG 83 1HD ARG 83 -7.934 -10.178 14.797 579 HD3 ARG 83 2HD ARG 83 -6.602 -9.506 15.737 580 HE ARG 83 HE ARG 83 -8.908 -9.373 17.300 581 HH11 ARG 83 1HH1 ARG 83 -6.820 -11.776 15.890 582 HH12 ARG 83 2HH1 ARG 83 -7.126 -12.954 17.123 583 HH21 ARG 83 1HH2 ARG 83 -9.319 -10.915 18.930 584 HH22 ARG 83 2HH2 ARG 83 -8.548 -12.464 18.851 585 H ARG 84 H ARG 84 -6.960 -6.190 11.327 586 HA ARG 84 HA ARG 84 -9.136 -6.018 9.370 587 HB2 ARG 84 1HB ARG 84 -7.432 -5.095 7.849 588 HB3 ARG 84 2HB ARG 84 -7.560 -4.166 9.337 589 HG2 ARG 84 1HG ARG 84 -5.579 -5.434 10.194 590 HG3 ARG 84 2HG ARG 84 -5.407 -6.123 8.578 591 HD2 ARG 84 1HD ARG 84 -5.303 -3.198 9.307 592 HD3 ARG 84 2HD ARG 84 -3.936 -4.211 8.843 593 HE ARG 84 HE ARG 84 -5.938 -4.210 6.830 594 HH11 ARG 84 1HH1 ARG 84 -3.374 -2.284 8.185 595 HH12 ARG 84 2HH1 ARG 84 -3.071 -1.419 6.715 596 HH21 ARG 84 1HH2 ARG 84 -5.549 -3.078 4.889 597 HH22 ARG 84 2HH2 ARG 84 -4.309 -1.870 4.841 598 H LEU 85 H LEU 85 -9.613 -7.748 8.202 599 HA LEU 85 HA LEU 85 -7.529 -9.790 7.794 600 HB2 LEU 85 1HB LEU 85 -10.474 -10.312 7.602 601 HB3 LEU 85 2HB LEU 85 -9.162 -11.466 7.835 602 HG LEU 85 HG LEU 85 -9.130 -9.736 10.064 603 HD11 LEU 85 1HD1 LEU 85 -11.273 -9.619 10.885 604 HD12 LEU 85 2HD1 LEU 85 -11.855 -10.932 9.862 605 HD13 LEU 85 3HD1 LEU 85 -11.549 -9.342 9.165 606 HD21 LEU 85 3HD2 LEU 85 -9.040 -11.691 11.194 607 HD22 LEU 85 1HD2 LEU 85 -8.779 -12.354 9.580 608 HD23 LEU 85 2HD2 LEU 85 -10.388 -12.397 10.301 609 H THR 86 H THR 86 -7.081 -10.478 5.766 610 HA THR 86 HA THR 86 -8.274 -8.971 3.574 611 HB THR 86 HB THR 86 -6.117 -10.968 3.086 612 HG1 THR 86 HG1 THR 86 -4.563 -9.486 3.867 613 HG21 THR 86 3HG2 THR 86 -5.744 -9.734 1.242 614 HG22 THR 86 1HG2 THR 86 -5.875 -8.210 2.119 615 HG23 THR 86 2HG2 THR 86 -7.332 -9.042 1.574 616 H ILE 87 H ILE 87 -10.071 -9.807 2.727 617 HA ILE 87 HA ILE 87 -10.403 -12.709 2.600 618 HB ILE 87 HB ILE 87 -12.367 -10.487 2.030 619 HG12 ILE 87 1HG1 ILE 87 -12.618 -12.465 4.261 620 HG13 ILE 87 2HG1 ILE 87 -11.521 -11.102 4.450 621 HG21 ILE 87 1HG2 ILE 87 -14.053 -12.308 2.000 622 HG22 ILE 87 2HG2 ILE 87 -12.906 -12.388 0.664 623 HG23 ILE 87 3HG2 ILE 87 -12.734 -13.478 2.039 624 HD11 ILE 87 3HD1 ILE 87 -13.679 -9.780 3.628 625 HD12 ILE 87 1HD1 ILE 87 -14.470 -11.171 4.369 626 HD13 ILE 87 2HD1 ILE 87 -13.379 -10.165 5.322 627 HA PRO 88 HA PRO 88 -9.122 -12.608 -1.664 628 HB2 PRO 88 1HB PRO 88 -9.553 -15.245 -2.145 629 HB3 PRO 88 2HB PRO 88 -8.147 -14.648 -1.256 630 HG2 PRO 88 1HG PRO 88 -10.700 -15.806 -0.207 631 HG3 PRO 88 2HG PRO 88 -9.034 -16.108 0.321 632 HD2 PRO 88 1HD PRO 88 -10.702 -14.436 1.646 633 HD3 PRO 88 2HD PRO 88 -8.948 -14.175 1.574 634 HA PRO 89 HA PRO 89 -12.761 -12.452 -4.127 635 HB2 PRO 89 1HB PRO 89 -12.017 -13.668 -6.437 636 HB3 PRO 89 2HB PRO 89 -11.424 -12.074 -5.957 637 HG2 PRO 89 1HG PRO 89 -10.096 -14.745 -5.702 638 HG3 PRO 89 2HG PRO 89 -9.404 -13.196 -6.219 639 HD2 PRO 89 1HD PRO 89 -9.068 -14.181 -3.719 640 HD3 PRO 89 2HD PRO 89 -9.161 -12.440 -4.055 641 H GLN 90 H GLN 90 -11.259 -15.651 -3.967 642 HA GLN 90 HA GLN 90 -13.498 -17.109 -4.894 643 HB2 GLN 90 1HB GLN 90 -12.346 -19.058 -3.789 644 HB3 GLN 90 2HB GLN 90 -11.369 -18.174 -4.954 645 HG2 GLN 90 1HG GLN 90 -9.923 -17.431 -3.389 646 HG3 GLN 90 2HG GLN 90 -11.162 -17.308 -2.142 647 HE21 GLN 90 2HE2 GLN 90 -8.500 -18.452 -1.979 648 HE22 GLN 90 1HE2 GLN 90 -8.707 -20.100 -1.503 649 H LEU 91 H LEU 91 -12.991 -15.422 -2.032 650 HA LEU 91 HA LEU 91 -15.191 -16.884 -0.733 651 HB2 LEU 91 1HB LEU 91 -12.601 -15.924 0.393 652 HB3 LEU 91 2HB LEU 91 -14.030 -15.951 1.425 653 HG LEU 91 HG LEU 91 -14.213 -18.430 0.714 654 HD11 LEU 91 1HD1 LEU 91 -11.393 -17.764 -0.086 655 HD12 LEU 91 2HD1 LEU 91 -12.647 -18.548 -1.047 656 HD13 LEU 91 3HD1 LEU 91 -11.916 -19.401 0.312 657 HD21 LEU 91 3HD2 LEU 91 -12.298 -17.196 2.639 658 HD22 LEU 91 1HD2 LEU 91 -12.307 -18.948 2.432 659 HD23 LEU 91 2HD2 LEU 91 -13.773 -18.114 2.946 660 H GLY 92 H GLY 92 -14.611 -14.222 -2.338 661 HA2 GLY 92 1HA GLY 92 -16.488 -12.652 -0.718 662 HA3 GLY 92 2HA GLY 92 -14.974 -11.900 -1.201 663 H TYR 93 H TYR 93 -14.700 -11.201 -3.293 664 HA TYR 93 HA TYR 93 -17.091 -10.662 -4.758 665 HB2 TYR 93 1HB TYR 93 -14.213 -9.974 -5.015 666 HB3 TYR 93 2HB TYR 93 -15.179 -9.908 -6.484 667 HD1 TYR 93 HD1 TYR 93 -16.591 -9.163 -3.176 668 HD2 TYR 93 HD2 TYR 93 -14.969 -7.522 -6.750 669 HE1 TYR 93 HE1 TYR 93 -17.421 -6.941 -2.524 670 HE2 TYR 93 HE2 TYR 93 -15.793 -5.295 -6.108 671 HH TYR 93 HH TYR 93 -18.076 -4.719 -3.995 672 H GLY 94 H GLY 94 -14.087 -12.290 -5.804 673 HA2 GLY 94 1HA GLY 94 -14.221 -14.557 -6.713 674 HA3 GLY 94 2HA GLY 94 -15.772 -14.111 -7.407 675 H ALA 95 H ALA 95 -14.606 -15.054 -9.331 676 HA ALA 95 HA ALA 95 -12.602 -13.363 -10.553 677 HB1 ALA 95 1HB ALA 95 -13.444 -16.055 -10.838 678 HB2 ALA 95 2HB ALA 95 -13.627 -15.260 -12.402 679 HB3 ALA 95 3HB ALA 95 -12.064 -15.250 -11.586 680 H ARG 96 H ARG 96 -15.775 -12.948 -10.155 681 HA ARG 96 HA ARG 96 -16.697 -12.360 -12.778 682 HB2 ARG 96 1HB ARG 96 -17.667 -11.785 -10.007 683 HB3 ARG 96 2HB ARG 96 -18.393 -10.929 -11.361 684 HG2 ARG 96 1HG ARG 96 -19.003 -13.054 -12.389 685 HG3 ARG 96 2HG ARG 96 -18.259 -13.920 -11.043 686 HD2 ARG 96 1HD ARG 96 -19.851 -12.980 -9.497 687 HD3 ARG 96 2HD ARG 96 -20.531 -11.959 -10.764 688 HE ARG 96 HE ARG 96 -20.662 -14.740 -11.410 689 HH11 ARG 96 1HH1 ARG 96 -22.207 -12.182 -9.625 690 HH12 ARG 96 2HH1 ARG 96 -23.769 -12.931 -9.651 691 HH21 ARG 96 1HH2 ARG 96 -22.713 -15.736 -11.451 692 HH22 ARG 96 2HH2 ARG 96 -24.056 -14.953 -10.689 693 H GLY 97 H GLY 97 -14.880 -10.593 -10.400 694 HA2 GLY 97 1HA GLY 97 -13.657 -8.646 -10.703 695 HA3 GLY 97 2HA GLY 97 -14.342 -8.504 -12.315 696 H ALA 98 H ALA 98 -14.151 -6.198 -11.163 697 HA ALA 98 HA ALA 98 -16.901 -5.474 -10.571 698 HB1 ALA 98 1HB ALA 98 -16.280 -4.172 -8.569 699 HB2 ALA 98 2HB ALA 98 -16.044 -5.907 -8.353 700 HB3 ALA 98 3HB ALA 98 -14.657 -4.859 -8.652 701 H GLY 99 H GLY 99 -13.693 -3.930 -10.271 702 HA2 GLY 99 1HA GLY 99 -14.670 -1.825 -12.097 703 HA3 GLY 99 2HA GLY 99 -13.490 -1.562 -10.822 704 H GLY 100 H GLY 100 -12.415 -0.562 -12.796 705 HA2 GLY 100 1HA GLY 100 -11.340 -2.276 -14.800 706 HA3 GLY 100 2HA GLY 100 -10.821 -0.633 -14.455 707 H VAL 101 H VAL 101 -10.009 -0.923 -11.804 708 HA VAL 101 HA VAL 101 -7.532 -2.415 -12.209 709 HB VAL 101 HB VAL 101 -6.692 -1.229 -10.244 710 HG11 VAL 101 1HG1 VAL 101 -6.444 -0.154 -12.398 711 HG12 VAL 101 2HG1 VAL 101 -8.048 0.567 -12.253 712 HG13 VAL 101 3HG1 VAL 101 -6.755 1.061 -11.158 713 HG21 VAL 101 3HG2 VAL 101 -9.397 -0.956 -9.601 714 HG22 VAL 101 1HG2 VAL 101 -8.017 -0.307 -8.715 715 HG23 VAL 101 2HG2 VAL 101 -8.827 0.681 -9.931 716 H ILE 102 H ILE 102 -9.824 -3.990 -11.790 717 HA ILE 102 HA ILE 102 -9.055 -5.315 -9.296 718 HB ILE 102 HB ILE 102 -11.916 -4.704 -10.048 719 HG12 ILE 102 1HG1 ILE 102 -10.236 -3.809 -7.695 720 HG13 ILE 102 2HG1 ILE 102 -10.734 -2.798 -9.047 721 HG21 ILE 102 1HG2 ILE 102 -10.815 -6.849 -8.535 722 HG22 ILE 102 2HG2 ILE 102 -11.694 -5.780 -7.442 723 HG23 ILE 102 3HG2 ILE 102 -12.509 -6.470 -8.845 724 HD11 ILE 102 3HD1 ILE 102 -12.653 -2.331 -8.057 725 HD12 ILE 102 1HD1 ILE 102 -13.020 -4.042 -7.841 726 HD13 ILE 102 2HD1 ILE 102 -12.065 -3.185 -6.631 727 HA PRO 103 HA PRO 103 -9.241 -8.357 -12.709 728 HB2 PRO 103 1HB PRO 103 -7.257 -9.912 -11.700 729 HB3 PRO 103 2HB PRO 103 -6.947 -8.478 -12.686 730 HG2 PRO 103 1HG PRO 103 -6.863 -8.786 -9.709 731 HG3 PRO 103 2HG PRO 103 -5.737 -7.929 -10.777 732 HD2 PRO 103 1HD PRO 103 -7.644 -6.649 -9.343 733 HD3 PRO 103 2HD PRO 103 -7.097 -6.075 -10.931 734 HA PRO 104 HA PRO 104 -11.603 -11.512 -10.759 735 HB2 PRO 104 1HB PRO 104 -10.851 -13.743 -12.111 736 HB3 PRO 104 2HB PRO 104 -11.858 -12.479 -12.827 737 HG2 PRO 104 1HG PRO 104 -8.915 -12.948 -13.116 738 HG3 PRO 104 2HG PRO 104 -10.106 -12.518 -14.357 739 HD2 PRO 104 1HD PRO 104 -8.444 -10.696 -13.240 740 HD3 PRO 104 2HD PRO 104 -10.083 -10.285 -13.785 741 H ASN 105 H ASN 105 -8.224 -11.505 -10.525 742 HA ASN 105 HA ASN 105 -8.297 -13.642 -8.497 743 HB2 ASN 105 1HB ASN 105 -6.141 -14.314 -9.069 744 HB3 ASN 105 2HB ASN 105 -6.839 -13.915 -10.637 745 HD21 ASN 105 2HD2 ASN 105 -6.267 -11.921 -11.617 746 HD22 ASN 105 1HD2 ASN 105 -4.779 -11.140 -11.217 747 H ALA 106 H ALA 106 -8.615 -10.545 -8.530 748 HA ALA 106 HA ALA 106 -6.444 -9.640 -6.874 749 HB1 ALA 106 1HB ALA 106 -7.162 -7.631 -7.486 750 HB2 ALA 106 2HB ALA 106 -8.439 -8.417 -8.416 751 HB3 ALA 106 3HB ALA 106 -8.739 -7.921 -6.750 752 H THR 107 H THR 107 -6.587 -8.998 -4.689 753 HA THR 107 HA THR 107 -8.606 -10.498 -3.169 754 HB THR 107 HB THR 107 -6.165 -9.317 -1.897 755 HG1 THR 107 HG1 THR 107 -5.246 -10.445 -3.573 756 HG21 THR 107 3HG2 THR 107 -8.206 -10.627 -0.813 757 HG22 THR 107 1HG2 THR 107 -6.558 -10.817 -0.218 758 HG23 THR 107 2HG2 THR 107 -7.247 -12.022 -1.307 759 H LEU 108 H LEU 108 -9.698 -9.540 -1.429 760 HA LEU 108 HA LEU 108 -9.642 -6.594 -1.408 761 HB2 LEU 108 1HB LEU 108 -12.016 -8.387 -0.926 762 HB3 LEU 108 2HB LEU 108 -12.021 -6.624 -0.907 763 HG LEU 108 HG LEU 108 -11.574 -8.398 -3.306 764 HD11 LEU 108 1HD1 LEU 108 -13.896 -6.969 -2.175 765 HD12 LEU 108 2HD1 LEU 108 -13.827 -8.432 -3.156 766 HD13 LEU 108 3HD1 LEU 108 -13.672 -6.851 -3.921 767 HD21 LEU 108 3HD2 LEU 108 -11.815 -6.060 -4.438 768 HD22 LEU 108 1HD2 LEU 108 -10.251 -6.583 -3.812 769 HD23 LEU 108 2HD2 LEU 108 -11.244 -5.461 -2.879 770 H VAL 109 H VAL 109 -9.271 -5.643 0.491 771 HA VAL 109 HA VAL 109 -9.124 -7.336 2.878 772 HB VAL 109 HB VAL 109 -8.186 -4.507 2.900 773 HG11 VAL 109 1HG1 VAL 109 -6.346 -6.385 3.973 774 HG12 VAL 109 2HG1 VAL 109 -7.323 -5.190 4.827 775 HG13 VAL 109 3HG1 VAL 109 -7.960 -6.810 4.543 776 HG21 VAL 109 3HG2 VAL 109 -7.178 -5.037 0.879 777 HG22 VAL 109 1HG2 VAL 109 -5.940 -5.485 2.053 778 HG23 VAL 109 2HG2 VAL 109 -6.951 -6.730 1.320 779 H PHE 110 H PHE 110 -10.137 -6.793 4.810 780 HA PHE 110 HA PHE 110 -11.940 -4.503 4.847 781 HB2 PHE 110 1HB PHE 110 -12.852 -7.368 5.137 782 HB3 PHE 110 2HB PHE 110 -13.814 -5.991 5.663 783 HD1 PHE 110 HD1 PHE 110 -14.730 -4.418 4.021 784 HD2 PHE 110 HD2 PHE 110 -12.636 -7.926 2.829 785 HE1 PHE 110 HE1 PHE 110 -15.651 -4.192 1.751 786 HE2 PHE 110 HE2 PHE 110 -13.553 -7.705 0.557 787 HZ PHE 110 HZ PHE 110 -15.061 -5.836 0.015 788 H GLU 111 H GLU 111 -12.093 -3.598 6.816 789 HA GLU 111 HA GLU 111 -10.694 -4.934 9.016 790 HB2 GLU 111 1HB GLU 111 -9.881 -2.718 8.513 791 HB3 GLU 111 2HB GLU 111 -11.506 -2.054 8.604 792 HG2 GLU 111 1HG GLU 111 -10.438 -3.432 11.002 793 HG3 GLU 111 2HG GLU 111 -9.785 -1.846 10.596 794 H VAL 112 H VAL 112 -11.787 -5.831 10.626 795 HA VAL 112 HA VAL 112 -14.626 -5.128 10.960 796 HB VAL 112 HB VAL 112 -13.551 -7.542 12.298 797 HG11 VAL 112 1HG1 VAL 112 -15.700 -8.426 11.824 798 HG12 VAL 112 2HG1 VAL 112 -15.944 -6.753 12.329 799 HG13 VAL 112 3HG1 VAL 112 -16.023 -7.180 10.619 800 HG21 VAL 112 3HG2 VAL 112 -13.768 -8.869 10.204 801 HG22 VAL 112 1HG2 VAL 112 -13.875 -7.355 9.306 802 HG23 VAL 112 2HG2 VAL 112 -12.404 -7.750 10.196 803 H GLU 113 H GLU 113 -15.266 -4.134 12.758 804 HA GLU 113 HA GLU 113 -13.583 -4.312 15.159 805 HB2 GLU 113 1HB GLU 113 -12.955 -2.204 14.343 806 HB3 GLU 113 2HB GLU 113 -14.583 -1.831 13.793 807 HG2 GLU 113 1HG GLU 113 -15.323 -1.300 15.920 808 HG3 GLU 113 2HG GLU 113 -14.018 -2.189 16.704 809 H LEU 114 H LEU 114 -14.888 -5.488 16.439 810 HA LEU 114 HA LEU 114 -17.744 -5.053 16.491 811 HB2 LEU 114 1HB LEU 114 -17.078 -7.300 16.714 812 HB3 LEU 114 2HB LEU 114 -15.883 -6.905 17.948 813 HG LEU 114 HG LEU 114 -17.626 -6.513 19.572 814 HD11 LEU 114 1HD1 LEU 114 -19.957 -6.761 19.087 815 HD12 LEU 114 2HD1 LEU 114 -19.612 -7.232 17.423 816 HD13 LEU 114 3HD1 LEU 114 -19.278 -5.586 17.960 817 HD21 LEU 114 3HD2 LEU 114 -17.894 -8.693 20.027 818 HD22 LEU 114 1HD2 LEU 114 -16.904 -8.946 18.590 819 HD23 LEU 114 2HD2 LEU 114 -18.662 -9.027 18.474 820 H LEU 115 H LEU 115 -18.724 -3.599 17.720 821 HA LEU 115 HA LEU 115 -17.255 -2.248 19.826 822 HB2 LEU 115 1HB LEU 115 -20.113 -1.661 19.271 823 HB3 LEU 115 2HB LEU 115 -18.793 -0.564 19.673 824 HG LEU 115 HG LEU 115 -19.298 -1.846 16.988 825 HD11 LEU 115 1HD1 LEU 115 -19.322 1.085 17.569 826 HD12 LEU 115 2HD1 LEU 115 -20.758 0.107 17.872 827 HD13 LEU 115 3HD1 LEU 115 -20.079 0.196 16.247 828 HD21 LEU 115 3HD2 LEU 115 -17.439 -0.520 16.188 829 HD22 LEU 115 1HD2 LEU 115 -16.901 -1.582 17.489 830 HD23 LEU 115 2HD2 LEU 115 -17.172 0.132 17.806 831 H ASP 116 H ASP 116 -20.236 -4.148 19.498 832 HA ASP 116 HA ASP 116 -19.926 -5.286 22.095 833 HB2 ASP 116 1HB ASP 116 -21.742 -2.964 21.730 834 HB3 ASP 116 2HB ASP 116 -22.362 -4.316 22.674 835 H VAL 117 H VAL 117 -21.500 -6.924 22.547 836 HA VAL 117 HA VAL 117 -22.737 -7.954 20.102 837 HB VAL 117 HB VAL 117 -22.925 -10.088 21.309 838 HG11 VAL 117 1HG1 VAL 117 -20.286 -10.188 21.808 839 HG12 VAL 117 2HG1 VAL 117 -20.969 -10.206 20.182 840 HG13 VAL 117 3HG1 VAL 117 -20.359 -8.699 20.867 841 HG21 VAL 117 3HG2 VAL 117 -23.155 -9.027 23.574 842 HG22 VAL 117 1HG2 VAL 117 -22.057 -10.405 23.504 843 HG23 VAL 117 2HG2 VAL 117 -21.411 -8.765 23.553 844 H13 JZF 130 1H3 JZF 130 -19.693 -2.387 0.453 845 H23 JZF 130 2H3 JZF 130 -20.124 -3.440 -0.882 846 H4 JZF 130 H4 JZF 130 -17.718 -3.695 0.958 847 H15 JZF 130 1H5 JZF 130 -17.010 -5.616 -0.358 848 H25 JZF 130 2H5 JZF 130 -18.415 -5.491 -1.405 849 H17 JZF 130 1H7 JZF 130 -16.761 -2.156 -0.323 850 H27 JZF 130 2H7 JZF 130 -16.553 -3.464 -1.443 851 H8 JZF 130 H8 JZF 130 -18.887 -2.608 -2.328 852 H9 JZF 130 H9 JZF 130 -16.393 -2.613 -3.440 853 H1OH JZF 130 1HO JZF 130 -19.282 -0.528 -2.089 854 H11 JZF 130 H11 JZF 130 -16.585 -2.935 -6.002 855 H112 JZF 130 1H12 JZF 130 -17.533 -0.044 -6.331 856 H212 JZF 130 2H12 JZF 130 -16.160 -0.772 -7.149 857 H13A JZF 130 H13 JZF 130 -15.572 0.696 -5.181 858 H114 JZF 130 1H14 JZF 130 -15.945 -0.160 -2.899 859 H214 JZF 130 2H14 JZF 130 -17.420 0.267 -3.729 860 H115 JZF 130 1H15 JZF 130 -21.386 -5.919 2.745 861 H215 JZF 130 2H15 JZF 130 -20.081 -7.106 2.720 862 H116 JZF 130 1H16 JZF 130 -21.840 -7.391 -1.150 863 H216 JZF 130 2H16 JZF 130 -20.055 -7.501 -1.195 864 H117 JZF 130 2H17 JZF 130 -20.109 -9.661 -2.044 865 H217 JZF 130 3H17 JZF 130 -21.439 -10.141 -0.973 866 H317 JZF 130 1H17 JZF 130 -21.784 -9.282 -2.483 867 H118 JZF 130 1H18 JZF 130 -18.164 -3.527 -7.536 868 H218 JZF 130 2H18 JZF 130 -19.367 -2.413 -6.872 869 H318 JZF 130 3H18 JZF 130 -18.154 -1.825 -8.022 870 H119 JZF 130 3H19 JZF 130 -13.880 -0.881 -4.154 871 H219 JZF 130 1H19 JZF 130 -14.700 -2.218 -4.967 872 H319 JZF 130 2H19 JZF 130 -13.921 -0.954 -5.919 Start of MODEL 11 1 H1 GLY 1 H GLY 1 1.053 -6.098 22.455 2 HA2 GLY 1 1HA GLY 1 0.525 -8.306 20.587 3 HA3 GLY 1 2HA GLY 1 0.854 -6.640 20.136 4 HA PRO 2 HA PRO 2 4.711 -9.374 19.862 5 HB2 PRO 2 1HB PRO 2 4.957 -9.358 17.159 6 HB3 PRO 2 2HB PRO 2 4.037 -10.589 18.032 7 HG2 PRO 2 1HG PRO 2 3.056 -8.146 16.608 8 HG3 PRO 2 2HG PRO 2 2.387 -9.788 16.602 9 HD2 PRO 2 1HD PRO 2 1.352 -7.799 18.120 10 HD3 PRO 2 2HD PRO 2 1.329 -9.500 18.630 11 H GLY 3 H GLY 3 3.600 -6.386 18.441 12 HA2 GLY 3 1HA GLY 3 4.730 -4.337 18.529 13 HA3 GLY 3 2HA GLY 3 6.209 -5.195 18.934 14 H SER 4 H SER 4 4.118 -5.932 16.202 15 HA SER 4 HA SER 4 5.672 -4.505 14.283 16 HB2 SER 4 1HB SER 4 7.261 -6.326 14.808 17 HB3 SER 4 2HB SER 4 6.030 -7.511 14.369 18 HG SER 4 HG SER 4 7.726 -6.179 12.776 19 H MET 5 H MET 5 5.078 -5.272 11.992 20 HA MET 5 HA MET 5 2.207 -5.905 11.992 21 HB2 MET 5 1HB MET 5 3.889 -4.472 9.930 22 HB3 MET 5 2HB MET 5 2.175 -4.824 9.758 23 HG2 MET 5 1HG MET 5 1.766 -3.472 11.810 24 HG3 MET 5 2HG MET 5 3.468 -3.016 11.782 25 HE1 MET 5 3HE MET 5 0.144 -3.025 10.403 26 HE2 MET 5 1HE MET 5 0.003 -1.267 10.412 27 HE3 MET 5 2HE MET 5 0.164 -2.130 8.882 28 H THR 6 H THR 6 2.301 -8.138 11.957 29 HA THR 6 HA THR 6 3.490 -9.318 9.529 30 HB THR 6 HB THR 6 3.749 -11.430 10.801 31 HG1 THR 6 HG1 THR 6 3.296 -11.505 12.944 32 HG21 THR 6 3HG2 THR 6 5.398 -9.257 10.798 33 HG22 THR 6 1HG2 THR 6 5.825 -10.841 11.444 34 HG23 THR 6 2HG2 THR 6 5.236 -9.577 12.524 35 H VAL 7 H VAL 7 1.831 -9.626 8.172 36 HA VAL 7 HA VAL 7 -0.817 -10.260 9.074 37 HB VAL 7 HB VAL 7 -0.371 -8.930 7.019 38 HG11 VAL 7 1HG1 VAL 7 0.195 -11.457 5.542 39 HG12 VAL 7 2HG1 VAL 7 0.589 -9.791 5.117 40 HG13 VAL 7 3HG1 VAL 7 1.516 -10.627 6.363 41 HG21 VAL 7 3HG2 VAL 7 -1.878 -11.382 6.204 42 HG22 VAL 7 1HG2 VAL 7 -2.473 -10.369 7.520 43 HG23 VAL 7 2HG2 VAL 7 -2.258 -9.685 5.908 44 H VAL 8 H VAL 8 -1.814 -12.194 9.183 45 HA VAL 8 HA VAL 8 -0.255 -14.564 8.378 46 HB VAL 8 HB VAL 8 -2.228 -14.326 10.654 47 HG11 VAL 8 1HG1 VAL 8 -1.562 -16.615 11.207 48 HG12 VAL 8 2HG1 VAL 8 -2.303 -16.527 9.608 49 HG13 VAL 8 3HG1 VAL 8 -0.552 -16.670 9.763 50 HG21 VAL 8 3HG2 VAL 8 -0.398 -13.377 11.602 51 HG22 VAL 8 1HG2 VAL 8 0.060 -15.065 11.824 52 HG23 VAL 8 2HG2 VAL 8 0.720 -14.142 10.474 53 H THR 9 H THR 9 -1.215 -16.078 7.132 54 HA THR 9 HA THR 9 -3.939 -15.496 6.205 55 HB THR 9 HB THR 9 -2.037 -17.430 4.898 56 HG1 THR 9 HG1 THR 9 -1.016 -15.369 5.039 57 HG21 THR 9 3HG2 THR 9 -3.905 -17.741 3.688 58 HG22 THR 9 1HG2 THR 9 -3.513 -16.185 2.958 59 HG23 THR 9 2HG2 THR 9 -4.658 -16.268 4.298 60 H THR 10 H THR 10 -5.391 -17.294 5.787 61 HA THR 10 HA THR 10 -5.063 -19.416 7.796 62 HB THR 10 HB THR 10 -7.509 -19.715 7.643 63 HG1 THR 10 HG1 THR 10 -8.158 -19.005 5.702 64 HG21 THR 10 3HG2 THR 10 -6.161 -17.757 8.969 65 HG22 THR 10 1HG2 THR 10 -7.878 -18.102 9.174 66 HG23 THR 10 2HG2 THR 10 -7.361 -16.814 8.086 67 H GLU 11 H GLU 11 -6.643 -21.373 7.046 68 HA GLU 11 HA GLU 11 -5.254 -22.601 4.889 69 HB2 GLU 11 1HB GLU 11 -6.168 -23.832 6.852 70 HB3 GLU 11 2HB GLU 11 -7.790 -23.521 6.251 71 HG2 GLU 11 1HG GLU 11 -5.830 -24.860 4.460 72 HG3 GLU 11 2HG GLU 11 -6.571 -25.786 5.764 73 H SER 12 H SER 12 -8.308 -20.939 5.202 74 HA SER 12 HA SER 12 -9.340 -21.796 2.666 75 HB2 SER 12 1HB SER 12 -10.841 -21.129 4.501 76 HB3 SER 12 2HB SER 12 -10.195 -19.490 4.434 77 HG SER 12 HG SER 12 -12.088 -20.667 2.883 78 H GLY 13 H GLY 13 -7.407 -19.134 3.831 79 HA2 GLY 13 1HA GLY 13 -5.936 -18.252 1.970 80 HA3 GLY 13 2HA GLY 13 -7.447 -17.959 1.122 81 H LEU 14 H LEU 14 -8.817 -17.130 3.600 82 HA LEU 14 HA LEU 14 -8.360 -14.365 3.426 83 HB2 LEU 14 1HB LEU 14 -10.491 -15.101 4.128 84 HB3 LEU 14 2HB LEU 14 -9.807 -16.069 5.433 85 HG LEU 14 HG LEU 14 -9.362 -13.144 5.570 86 HD11 LEU 14 1HD1 LEU 14 -11.534 -12.621 6.344 87 HD12 LEU 14 2HD1 LEU 14 -12.030 -14.313 6.319 88 HD13 LEU 14 3HD1 LEU 14 -11.744 -13.456 4.805 89 HD21 LEU 14 3HD2 LEU 14 -10.428 -14.726 7.818 90 HD22 LEU 14 1HD2 LEU 14 -9.115 -13.549 7.775 91 HD23 LEU 14 2HD2 LEU 14 -8.837 -15.201 7.222 92 H LYS 15 H LYS 15 -7.303 -12.917 4.743 93 HA LYS 15 HA LYS 15 -5.372 -14.099 6.626 94 HB2 LYS 15 1HB LYS 15 -5.109 -11.402 5.308 95 HB3 LYS 15 2HB LYS 15 -3.861 -12.340 6.117 96 HG2 LYS 15 1HG LYS 15 -3.949 -14.002 4.326 97 HG3 LYS 15 2HG LYS 15 -5.197 -13.055 3.513 98 HD2 LYS 15 1HD LYS 15 -3.427 -11.133 3.687 99 HD3 LYS 15 2HD LYS 15 -2.288 -12.471 3.859 100 HE2 LYS 15 1HE LYS 15 -4.288 -12.527 1.646 101 HE3 LYS 15 2HE LYS 15 -2.866 -11.496 1.494 102 HZ1 LYS 15 3HZ LYS 15 -1.977 -13.968 2.385 103 HZ2 LYS 15 1HZ LYS 15 -1.739 -13.275 0.860 104 HZ3 LYS 15 2HZ LYS 15 -3.068 -14.285 1.132 105 H TYR 16 H TYR 16 -4.721 -12.653 8.440 106 HA TYR 16 HA TYR 16 -6.712 -10.697 9.260 107 HB2 TYR 16 1HB TYR 16 -7.320 -11.760 11.287 108 HB3 TYR 16 2HB TYR 16 -7.460 -13.001 10.047 109 HD1 TYR 16 HD1 TYR 16 -5.604 -14.701 9.820 110 HD2 TYR 16 HD2 TYR 16 -5.885 -12.048 13.135 111 HE1 TYR 16 HE1 TYR 16 -4.109 -16.165 11.112 112 HE2 TYR 16 HE2 TYR 16 -4.390 -13.505 14.435 113 HH TYR 16 HH TYR 16 -2.935 -15.241 14.300 114 H GLU 17 H GLU 17 -5.856 -9.091 10.457 115 HA GLU 17 HA GLU 17 -3.199 -9.497 11.645 116 HB2 GLU 17 1HB GLU 17 -2.780 -8.375 9.560 117 HB3 GLU 17 2HB GLU 17 -4.058 -7.209 9.873 118 HG2 GLU 17 1HG GLU 17 -1.882 -6.216 10.230 119 HG3 GLU 17 2HG GLU 17 -2.783 -6.302 11.743 120 H ASP 18 H ASP 18 -3.277 -9.059 13.736 121 HA ASP 18 HA ASP 18 -5.466 -7.828 15.007 122 HB2 ASP 18 1HB ASP 18 -4.119 -9.379 16.245 123 HB3 ASP 18 2HB ASP 18 -2.666 -8.421 15.974 124 H LEU 19 H LEU 19 -5.925 -5.767 15.468 125 HA LEU 19 HA LEU 19 -3.843 -3.745 14.952 126 HB2 LEU 19 1HB LEU 19 -6.821 -3.527 14.536 127 HB3 LEU 19 2HB LEU 19 -5.665 -2.215 14.315 128 HG LEU 19 HG LEU 19 -5.916 -4.725 12.664 129 HD11 LEU 19 1HD1 LEU 19 -5.962 -2.464 11.058 130 HD12 LEU 19 2HD1 LEU 19 -6.950 -2.033 12.454 131 HD13 LEU 19 3HD1 LEU 19 -7.340 -3.470 11.508 132 HD21 LEU 19 3HD2 LEU 19 -3.561 -4.176 12.977 133 HD22 LEU 19 1HD2 LEU 19 -3.872 -2.514 12.476 134 HD23 LEU 19 2HD2 LEU 19 -4.074 -3.834 11.324 135 H THR 20 H THR 20 -6.422 -4.829 17.035 136 HA THR 20 HA THR 20 -5.366 -3.300 19.228 137 HB THR 20 HB THR 20 -8.254 -2.749 18.608 138 HG1 THR 20 HG1 THR 20 -7.429 -0.704 17.740 139 HG21 THR 20 3HG2 THR 20 -7.433 -0.601 19.902 140 HG22 THR 20 1HG2 THR 20 -6.167 -1.695 20.459 141 HG23 THR 20 2HG2 THR 20 -7.861 -2.076 20.769 142 H GLU 21 H GLU 21 -5.353 -4.755 20.803 143 HA GLU 21 HA GLU 21 -6.727 -7.146 20.874 144 HB2 GLU 21 1HB GLU 21 -4.763 -6.361 22.323 145 HB3 GLU 21 2HB GLU 21 -5.977 -5.645 23.375 146 HG2 GLU 21 1HG GLU 21 -6.927 -7.770 23.859 147 HG3 GLU 21 2HG GLU 21 -5.950 -8.554 22.619 148 H GLY 22 H GLY 22 -8.377 -7.851 22.490 149 HA2 GLY 22 1HA GLY 22 -10.174 -6.012 23.667 150 HA3 GLY 22 2HA GLY 22 -10.797 -6.520 22.104 151 H SER 23 H SER 23 -9.915 -7.578 25.328 152 HA SER 23 HA SER 23 -10.877 -10.268 24.889 153 HB2 SER 23 1HB SER 23 -10.269 -9.062 27.580 154 HB3 SER 23 2HB SER 23 -10.137 -10.746 27.073 155 HG SER 23 HG SER 23 -8.135 -9.379 27.237 156 H GLY 24 H GLY 24 -13.043 -9.699 24.218 157 HA2 GLY 24 1HA GLY 24 -14.778 -8.976 26.500 158 HA3 GLY 24 2HA GLY 24 -15.133 -8.530 24.838 159 H ALA 25 H ALA 25 -16.194 -9.942 23.533 160 HA ALA 25 HA ALA 25 -16.536 -12.708 24.386 161 HB1 ALA 25 1HB ALA 25 -19.119 -12.074 23.717 162 HB2 ALA 25 2HB ALA 25 -18.500 -12.266 25.357 163 HB3 ALA 25 3HB ALA 25 -18.598 -10.660 24.634 164 H GLU 26 H GLU 26 -16.575 -14.065 22.700 165 HA GLU 26 HA GLU 26 -16.288 -13.019 20.047 166 HB2 GLU 26 1HB GLU 26 -15.053 -15.013 20.851 167 HB3 GLU 26 2HB GLU 26 -16.574 -15.889 20.951 168 HG2 GLU 26 1HG GLU 26 -16.768 -16.099 18.687 169 HG3 GLU 26 2HG GLU 26 -15.833 -14.640 18.360 170 H ALA 27 H ALA 27 -17.722 -13.006 18.391 171 HA ALA 27 HA ALA 27 -20.471 -12.978 18.925 172 HB1 ALA 27 1HB ALA 27 -20.554 -13.200 16.305 173 HB2 ALA 27 2HB ALA 27 -19.950 -11.733 17.076 174 HB3 ALA 27 3HB ALA 27 -18.817 -12.931 16.450 175 H ARG 28 H ARG 28 -22.149 -14.387 18.295 176 HA ARG 28 HA ARG 28 -21.329 -17.145 17.686 177 HB2 ARG 28 1HB ARG 28 -23.503 -16.406 19.649 178 HB3 ARG 28 2HB ARG 28 -22.917 -18.021 19.277 179 HG2 ARG 28 1HG ARG 28 -20.853 -17.625 20.358 180 HG3 ARG 28 2HG ARG 28 -21.166 -15.891 20.468 181 HD2 ARG 28 1HD ARG 28 -23.203 -17.593 21.722 182 HD3 ARG 28 2HD ARG 28 -21.607 -17.685 22.466 183 HE ARG 28 HE ARG 28 -22.253 -14.989 22.084 184 HH11 ARG 28 1HH1 ARG 28 -23.277 -17.723 23.981 185 HH12 ARG 28 2HH1 ARG 28 -23.837 -16.758 25.307 186 HH21 ARG 28 1HH2 ARG 28 -22.986 -13.709 23.823 187 HH22 ARG 28 2HH2 ARG 28 -23.672 -14.475 25.215 188 H ALA 29 H ALA 29 -22.617 -18.253 16.282 189 HA ALA 29 HA ALA 29 -24.241 -16.827 14.503 190 HB1 ALA 29 1HB ALA 29 -23.774 -19.738 14.996 191 HB2 ALA 29 2HB ALA 29 -25.010 -19.217 13.851 192 HB3 ALA 29 3HB ALA 29 -23.327 -18.752 13.604 193 H GLY 30 H GLY 30 -26.202 -16.014 14.812 194 HA2 GLY 30 1HA GLY 30 -28.569 -16.598 15.149 195 HA3 GLY 30 2HA GLY 30 -28.059 -17.492 16.573 196 H GLN 31 H GLN 31 -26.107 -15.120 17.001 197 HA GLN 31 HA GLN 31 -28.062 -13.488 18.462 198 HB2 GLN 31 1HB GLN 31 -26.498 -13.145 20.099 199 HB3 GLN 31 2HB GLN 31 -25.969 -14.717 19.515 200 HG2 GLN 31 1HG GLN 31 -24.291 -13.618 18.107 201 HG3 GLN 31 2HG GLN 31 -24.810 -12.052 18.730 202 HE21 GLN 31 2HE2 GLN 31 -24.302 -11.478 20.837 203 HE22 GLN 31 1HE2 GLN 31 -23.108 -12.318 21.760 204 H THR 32 H THR 32 -27.868 -11.201 18.481 205 HA THR 32 HA THR 32 -26.771 -10.145 15.979 206 HB THR 32 HB THR 32 -28.530 -8.616 17.883 207 HG1 THR 32 HG1 THR 32 -29.720 -10.442 17.417 208 HG21 THR 32 3HG2 THR 32 -28.946 -7.199 16.098 209 HG22 THR 32 1HG2 THR 32 -28.520 -8.417 14.897 210 HG23 THR 32 2HG2 THR 32 -27.255 -7.625 15.836 211 H VAL 33 H VAL 33 -25.288 -8.505 15.896 212 HA VAL 33 HA VAL 33 -24.385 -7.250 18.365 213 HB VAL 33 HB VAL 33 -22.065 -7.815 18.074 214 HG11 VAL 33 1HG1 VAL 33 -23.670 -10.356 17.853 215 HG12 VAL 33 2HG1 VAL 33 -22.103 -10.146 18.637 216 HG13 VAL 33 3HG1 VAL 33 -23.541 -9.386 19.319 217 HG21 VAL 33 3HG2 VAL 33 -22.073 -9.875 16.156 218 HG22 VAL 33 1HG2 VAL 33 -22.905 -8.502 15.426 219 HG23 VAL 33 2HG2 VAL 33 -21.270 -8.308 16.059 220 H SER 34 H SER 34 -22.804 -5.502 17.944 221 HA SER 34 HA SER 34 -23.256 -4.311 15.286 222 HB2 SER 34 1HB SER 34 -23.176 -3.104 18.031 223 HB3 SER 34 2HB SER 34 -22.745 -2.120 16.632 224 HG SER 34 HG SER 34 -25.009 -2.062 17.234 225 H VAL 35 H VAL 35 -21.527 -3.923 14.071 226 HA VAL 35 HA VAL 35 -18.928 -3.469 15.330 227 HB VAL 35 HB VAL 35 -17.765 -5.113 14.111 228 HG11 VAL 35 1HG1 VAL 35 -18.644 -7.141 14.932 229 HG12 VAL 35 2HG1 VAL 35 -19.194 -5.897 16.057 230 HG13 VAL 35 3HG1 VAL 35 -20.302 -6.548 14.848 231 HG21 VAL 35 3HG2 VAL 35 -19.416 -6.629 12.587 232 HG22 VAL 35 1HG2 VAL 35 -20.129 -5.031 12.368 233 HG23 VAL 35 2HG2 VAL 35 -18.433 -5.302 11.969 234 H HIS 36 H HIS 36 -17.282 -2.749 13.716 235 HA HIS 36 HA HIS 36 -18.572 -1.213 11.556 236 HB2 HIS 36 1HB HIS 36 -16.659 -0.438 13.642 237 HB3 HIS 36 2HB HIS 36 -16.198 0.085 12.025 238 HD1 HIS 36 HD1 HIS 36 -18.761 0.978 10.799 239 HD2 HIS 36 HD2 HIS 36 -17.849 1.695 14.789 240 HE1 HIS 36 HE1 HIS 36 -20.185 2.939 11.473 241 H TYR 37 H TYR 37 -17.826 -1.455 9.534 242 HA TYR 37 HA TYR 37 -15.391 -3.075 9.169 243 HB2 TYR 37 1HB TYR 37 -16.365 -3.993 7.161 244 HB3 TYR 37 2HB TYR 37 -17.512 -4.196 8.481 245 HD1 TYR 37 HD2 TYR 37 -19.507 -2.704 8.614 246 HD2 TYR 37 HD1 TYR 37 -16.910 -2.697 5.244 247 HE1 TYR 37 HE2 TYR 37 -21.243 -1.576 7.286 248 HE2 TYR 37 HE1 TYR 37 -18.638 -1.568 3.907 249 HH TYR 37 HH TYR 37 -21.852 -0.910 5.237 250 H THR 38 H THR 38 -13.784 -2.240 7.993 251 HA THR 38 HA THR 38 -14.329 0.215 6.453 252 HB THR 38 HB THR 38 -11.552 -0.084 7.278 253 HG1 THR 38 HG1 THR 38 -13.413 0.428 9.363 254 HG21 THR 38 3HG2 THR 38 -12.477 1.974 6.360 255 HG22 THR 38 1HG2 THR 38 -11.891 2.246 8.000 256 HG23 THR 38 2HG2 THR 38 -13.621 2.077 7.698 257 H GLY 39 H GLY 39 -14.210 -0.219 4.349 258 HA2 GLY 39 1HA GLY 39 -12.821 -2.468 3.288 259 HA3 GLY 39 2HA GLY 39 -13.565 -1.176 2.357 260 H TRP 40 H TRP 40 -10.660 -2.562 3.374 261 HA TRP 40 HA TRP 40 -9.153 -0.198 2.464 262 HB2 TRP 40 1HB TRP 40 -8.316 -2.376 4.390 263 HB3 TRP 40 2HB TRP 40 -7.247 -1.112 3.789 264 HD1 TRP 40 HD1 TRP 40 -10.030 0.931 4.123 265 HE1 TRP 40 HE1 TRP 40 -10.296 1.973 6.462 266 HE3 TRP 40 HE3 TRP 40 -6.977 -2.207 6.762 267 HZ2 TRP 40 HZ2 TRP 40 -9.338 1.523 9.079 268 HZ3 TRP 40 HZ3 TRP 40 -6.705 -1.833 9.178 269 HH2 TRP 40 HH2 TRP 40 -7.862 -0.005 10.311 270 H LEU 41 H LEU 41 -7.284 -0.564 1.165 271 HA LEU 41 HA LEU 41 -7.577 -2.896 -0.561 272 HB2 LEU 41 1HB LEU 41 -6.210 -0.251 -0.798 273 HB3 LEU 41 2HB LEU 41 -5.719 -1.584 -1.842 274 HG LEU 41 HG LEU 41 -8.592 -0.749 -1.700 275 HD11 LEU 41 1HD1 LEU 41 -6.338 0.684 -3.005 276 HD12 LEU 41 2HD1 LEU 41 -7.812 1.318 -2.275 277 HD13 LEU 41 3HD1 LEU 41 -7.871 0.562 -3.867 278 HD21 LEU 41 3HD2 LEU 41 -7.994 -1.442 -4.263 279 HD22 LEU 41 1HD2 LEU 41 -8.633 -2.544 -3.043 280 HD23 LEU 41 2HD2 LEU 41 -6.898 -2.481 -3.350 281 H THR 42 H THR 42 -5.791 -4.214 -1.161 282 HA THR 42 HA THR 42 -4.220 -5.117 0.957 283 HB THR 42 HB THR 42 -3.113 -6.550 -0.583 284 HG1 THR 42 HG1 THR 42 -3.602 -6.004 -2.961 285 HG21 THR 42 3HG2 THR 42 -5.767 -6.119 -1.923 286 HG22 THR 42 1HG2 THR 42 -5.659 -6.764 -0.286 287 HG23 THR 42 2HG2 THR 42 -4.911 -7.632 -1.626 288 H ASP 43 H ASP 43 -3.735 -2.480 -1.183 289 HA ASP 43 HA ASP 43 -0.883 -2.340 -0.936 290 HB2 ASP 43 1HB ASP 43 -2.425 -1.326 -2.775 291 HB3 ASP 43 2HB ASP 43 -2.611 0.011 -1.643 292 H GLY 44 H GLY 44 -3.540 -1.404 1.015 293 HA2 GLY 44 1HA GLY 44 -3.111 -0.863 3.333 294 HA3 GLY 44 2HA GLY 44 -1.678 0.011 2.811 295 H GLN 45 H GLN 45 -4.135 0.637 0.663 296 HA GLN 45 HA GLN 45 -4.706 3.192 1.993 297 HB2 GLN 45 1HB GLN 45 -5.269 4.048 -0.220 298 HB3 GLN 45 2HB GLN 45 -3.657 3.345 -0.222 299 HG2 GLN 45 1HG GLN 45 -4.881 1.212 -1.062 300 HG3 GLN 45 2HG GLN 45 -6.159 2.345 -1.496 301 HE21 GLN 45 2HE2 GLN 45 -2.611 2.372 -1.655 302 HE22 GLN 45 1HE2 GLN 45 -2.520 2.818 -3.322 303 H LYS 46 H LYS 46 -6.734 3.778 2.526 304 HA LYS 46 HA LYS 46 -8.794 1.768 2.439 305 HB2 LYS 46 1HB LYS 46 -8.644 3.052 4.444 306 HB3 LYS 46 2HB LYS 46 -8.686 4.569 3.555 307 HG2 LYS 46 1HG LYS 46 -10.982 4.278 3.007 308 HG3 LYS 46 2HG LYS 46 -10.976 2.620 3.614 309 HD2 LYS 46 1HD LYS 46 -11.895 3.661 5.421 310 HD3 LYS 46 2HD LYS 46 -10.189 3.844 5.837 311 HE2 LYS 46 1HE LYS 46 -11.527 5.943 4.191 312 HE3 LYS 46 2HE LYS 46 -11.821 5.895 5.928 313 HZ1 LYS 46 3HZ LYS 46 -9.474 6.726 4.491 314 HZ2 LYS 46 1HZ LYS 46 -9.133 5.662 5.761 315 HZ3 LYS 46 2HZ LYS 46 -9.967 7.102 6.065 316 H PHE 47 H PHE 47 -10.780 1.897 1.392 317 HA PHE 47 HA PHE 47 -11.206 4.086 -0.493 318 HB2 PHE 47 1HB PHE 47 -11.472 2.679 -2.394 319 HB3 PHE 47 2HB PHE 47 -9.948 2.214 -1.647 320 HD1 PHE 47 HD1 PHE 47 -10.045 0.215 -0.000 321 HD2 PHE 47 HD2 PHE 47 -13.039 1.064 -2.904 322 HE1 PHE 47 HE1 PHE 47 -10.811 -2.121 0.112 323 HE2 PHE 47 HE2 PHE 47 -13.810 -1.270 -2.796 324 HZ PHE 47 HZ PHE 47 -12.697 -2.866 -1.286 325 H ASP 48 H ASP 48 -12.399 2.665 2.000 326 HA ASP 48 HA ASP 48 -15.105 3.261 1.408 327 HB2 ASP 48 1HB ASP 48 -14.510 0.843 0.411 328 HB3 ASP 48 2HB ASP 48 -14.880 0.372 2.068 329 H SER 49 H SER 49 -16.005 3.905 3.249 330 HA SER 49 HA SER 49 -15.177 2.649 5.768 331 HB2 SER 49 1HB SER 49 -15.339 5.107 6.703 332 HB3 SER 49 2HB SER 49 -13.848 4.537 5.954 333 HG SER 49 HG SER 49 -14.673 5.487 3.972 334 H SER 50 H SER 50 -16.733 2.614 7.378 335 HA SER 50 HA SER 50 -19.430 2.650 6.509 336 HB2 SER 50 1HB SER 50 -18.664 1.118 8.259 337 HB3 SER 50 2HB SER 50 -18.299 2.483 9.314 338 HG SER 50 HG SER 50 -20.739 1.345 8.655 339 H LYS 51 H LYS 51 -17.379 5.106 7.561 340 HA LYS 51 HA LYS 51 -19.037 6.783 9.040 341 HB2 LYS 51 1HB LYS 51 -17.529 8.542 8.513 342 HB3 LYS 51 2HB LYS 51 -16.566 7.072 8.589 343 HG2 LYS 51 1HG LYS 51 -16.951 6.993 6.025 344 HG3 LYS 51 2HG LYS 51 -17.341 8.704 6.214 345 HD2 LYS 51 1HD LYS 51 -14.791 7.427 7.193 346 HD3 LYS 51 2HD LYS 51 -14.954 8.255 5.642 347 HE2 LYS 51 1HE LYS 51 -15.637 9.576 8.255 348 HE3 LYS 51 2HE LYS 51 -14.006 9.601 7.586 349 HZ1 LYS 51 3HZ LYS 51 -14.874 10.671 5.602 350 HZ2 LYS 51 1HZ LYS 51 -15.244 11.583 6.979 351 HZ3 LYS 51 2HZ LYS 51 -16.441 10.643 6.241 352 H ASP 52 H ASP 52 -19.086 5.999 5.679 353 HA ASP 52 HA ASP 52 -20.287 8.192 4.520 354 HB2 ASP 52 1HB ASP 52 -19.631 6.366 3.132 355 HB3 ASP 52 2HB ASP 52 -20.684 5.247 3.993 356 H ARG 53 H ARG 53 -21.738 5.682 6.513 357 HA ARG 53 HA ARG 53 -24.344 7.019 6.289 358 HB2 ARG 53 1HB ARG 53 -24.093 4.516 5.850 359 HB3 ARG 53 2HB ARG 53 -23.815 4.347 7.579 360 HG2 ARG 53 1HG ARG 53 -26.074 3.898 7.350 361 HG3 ARG 53 2HG ARG 53 -26.048 5.591 7.847 362 HD2 ARG 53 1HD ARG 53 -26.708 6.348 5.790 363 HD3 ARG 53 2HD ARG 53 -25.996 4.977 4.939 364 HE ARG 53 HE ARG 53 -28.033 3.870 6.351 365 HH11 ARG 53 1HH1 ARG 53 -27.803 6.524 4.109 366 HH12 ARG 53 2HH1 ARG 53 -29.417 6.329 3.511 367 HH21 ARG 53 1HH2 ARG 53 -30.160 3.604 5.572 368 HH22 ARG 53 2HH2 ARG 53 -30.757 4.669 4.345 369 H ASN 54 H ASN 54 -21.685 6.587 8.368 370 HA ASN 54 HA ASN 54 -21.242 7.225 10.505 371 HB2 ASN 54 1HB ASN 54 -23.562 8.992 9.791 372 HB3 ASN 54 2HB ASN 54 -22.891 9.028 11.419 373 HD21 ASN 54 2HD2 ASN 54 -22.594 10.125 8.243 374 HD22 ASN 54 1HD2 ASN 54 -21.076 10.933 8.401 375 H ASP 55 H ASP 55 -22.011 4.877 10.801 376 HA ASP 55 HA ASP 55 -23.387 4.682 13.224 377 HB2 ASP 55 1HB ASP 55 -25.482 5.039 12.328 378 HB3 ASP 55 2HB ASP 55 -25.050 4.342 10.768 379 HA PRO 56 HA PRO 56 -21.278 0.825 13.062 380 HB2 PRO 56 1HB PRO 56 -22.506 -0.434 15.130 381 HB3 PRO 56 2HB PRO 56 -21.333 0.868 15.358 382 HG2 PRO 56 1HG PRO 56 -24.324 0.982 15.416 383 HG3 PRO 56 2HG PRO 56 -23.153 1.758 16.498 384 HD2 PRO 56 1HD PRO 56 -24.383 3.089 14.486 385 HD3 PRO 56 2HD PRO 56 -22.734 3.475 15.018 386 H PHE 57 H PHE 57 -21.500 -1.086 12.031 387 HA PHE 57 HA PHE 57 -24.023 -1.706 10.807 388 HB2 PHE 57 1HB PHE 57 -21.541 -2.027 9.927 389 HB3 PHE 57 2HB PHE 57 -21.719 -3.601 10.695 390 HD1 PHE 57 HD1 PHE 57 -23.671 -1.351 8.443 391 HD2 PHE 57 HD2 PHE 57 -22.442 -5.320 9.368 392 HE1 PHE 57 HE1 PHE 57 -24.860 -2.179 6.455 393 HE2 PHE 57 HE2 PHE 57 -23.628 -6.154 7.381 394 HZ PHE 57 HZ PHE 57 -24.839 -4.583 5.921 395 H ALA 58 H ALA 58 -25.530 -2.483 12.179 396 HA ALA 58 HA ALA 58 -24.785 -4.670 13.992 397 HB1 ALA 58 1HB ALA 58 -27.456 -3.339 14.063 398 HB2 ALA 58 2HB ALA 58 -26.528 -4.070 15.373 399 HB3 ALA 58 3HB ALA 58 -26.047 -2.505 14.718 400 H PHE 59 H PHE 59 -25.600 -6.681 13.776 401 HA PHE 59 HA PHE 59 -27.971 -7.307 12.355 402 HB2 PHE 59 1HB PHE 59 -27.153 -8.263 10.365 403 HB3 PHE 59 2HB PHE 59 -26.292 -6.734 10.500 404 HD1 PHE 59 HD2 PHE 59 -23.974 -6.869 11.717 405 HD2 PHE 59 HD1 PHE 59 -25.962 -10.178 9.924 406 HE1 PHE 59 HE2 PHE 59 -21.829 -8.061 11.547 407 HE2 PHE 59 HE1 PHE 59 -23.820 -11.376 9.752 408 HZ PHE 59 HZ PHE 59 -21.749 -10.317 10.563 409 H VAL 60 H VAL 60 -27.834 -9.841 11.766 410 HA VAL 60 HA VAL 60 -26.958 -11.112 14.258 411 HB VAL 60 HB VAL 60 -29.330 -11.367 13.631 412 HG11 VAL 60 1HG1 VAL 60 -28.885 -11.356 11.157 413 HG12 VAL 60 2HG1 VAL 60 -28.363 -13.034 11.317 414 HG13 VAL 60 3HG1 VAL 60 -30.023 -12.584 11.710 415 HG21 VAL 60 3HG2 VAL 60 -27.797 -13.962 13.490 416 HG22 VAL 60 1HG2 VAL 60 -28.173 -13.082 14.971 417 HG23 VAL 60 2HG2 VAL 60 -29.475 -13.759 13.992 418 H LEU 61 H LEU 61 -25.408 -12.627 14.317 419 HA LEU 61 HA LEU 61 -23.784 -13.062 12.007 420 HB2 LEU 61 1HB LEU 61 -22.629 -12.958 14.040 421 HB3 LEU 61 2HB LEU 61 -23.738 -14.079 14.827 422 HG LEU 61 HG LEU 61 -22.804 -15.922 13.506 423 HD11 LEU 61 1HD1 LEU 61 -21.335 -15.681 11.821 424 HD12 LEU 61 2HD1 LEU 61 -20.488 -14.347 12.604 425 HD13 LEU 61 3HD1 LEU 61 -21.997 -14.049 11.740 426 HD21 LEU 61 3HD2 LEU 61 -20.423 -14.579 14.679 427 HD22 LEU 61 1HD2 LEU 61 -20.996 -16.236 14.868 428 HD23 LEU 61 2HD2 LEU 61 -21.799 -14.921 15.728 429 H GLY 62 H GLY 62 -23.734 -14.744 10.628 430 HA2 GLY 62 1HA GLY 62 -24.098 -16.912 9.844 431 HA3 GLY 62 2HA GLY 62 -24.998 -17.266 11.311 432 H GLY 63 H GLY 63 -26.189 -14.414 10.201 433 HA2 GLY 63 1HA GLY 63 -28.711 -15.374 9.560 434 HA3 GLY 63 2HA GLY 63 -28.093 -13.804 9.072 435 H GLY 64 H GLY 64 -26.256 -14.209 7.241 436 HA2 GLY 64 1HA GLY 64 -25.791 -15.590 5.273 437 HA3 GLY 64 2HA GLY 64 -27.502 -15.986 5.237 438 H MET 65 H MET 65 -25.658 -12.940 5.458 439 HA MET 65 HA MET 65 -26.841 -12.073 2.934 440 HB2 MET 65 1HB MET 65 -27.240 -10.713 5.587 441 HB3 MET 65 2HB MET 65 -27.329 -9.814 4.078 442 HG2 MET 65 1HG MET 65 -29.239 -10.920 3.380 443 HG3 MET 65 2HG MET 65 -28.969 -12.279 4.468 444 HE1 MET 65 3HE MET 65 -31.567 -8.816 4.857 445 HE2 MET 65 1HE MET 65 -30.941 -9.768 3.511 446 HE3 MET 65 2HE MET 65 -32.153 -10.459 4.591 447 H VAL 66 H VAL 66 -24.144 -12.776 4.063 448 HA VAL 66 HA VAL 66 -22.763 -10.405 3.046 449 HB VAL 66 HB VAL 66 -21.149 -10.359 4.821 450 HG11 VAL 66 1HG1 VAL 66 -22.554 -9.696 6.722 451 HG12 VAL 66 2HG1 VAL 66 -23.175 -9.066 5.195 452 HG13 VAL 66 3HG1 VAL 66 -23.944 -10.461 5.952 453 HG21 VAL 66 3HG2 VAL 66 -22.589 -12.801 5.823 454 HG22 VAL 66 1HG2 VAL 66 -20.881 -12.619 5.420 455 HG23 VAL 66 2HG2 VAL 66 -21.536 -11.835 6.857 456 H ILE 67 H ILE 67 -20.648 -10.821 2.243 457 HA ILE 67 HA ILE 67 -20.360 -13.196 0.822 458 HB ILE 67 HB ILE 67 -17.926 -12.498 0.590 459 HG12 ILE 67 1HG1 ILE 67 -18.784 -9.912 1.848 460 HG13 ILE 67 2HG1 ILE 67 -18.123 -11.200 2.849 461 HG21 ILE 67 1HG2 ILE 67 -19.714 -11.900 -1.002 462 HG22 ILE 67 2HG2 ILE 67 -20.007 -10.424 -0.083 463 HG23 ILE 67 3HG2 ILE 67 -18.459 -10.667 -0.892 464 HD11 ILE 67 3HD1 ILE 67 -16.057 -10.677 2.260 465 HD12 ILE 67 1HD1 ILE 67 -16.463 -10.751 0.546 466 HD13 ILE 67 2HD1 ILE 67 -16.715 -9.257 1.448 467 H LYS 68 H LYS 68 -18.769 -14.885 1.014 468 HA LYS 68 HA LYS 68 -18.800 -16.298 3.351 469 HB2 LYS 68 1HB LYS 68 -16.546 -16.299 1.335 470 HB3 LYS 68 2HB LYS 68 -16.904 -17.580 2.486 471 HG2 LYS 68 1HG LYS 68 -19.196 -17.698 1.345 472 HG3 LYS 68 2HG LYS 68 -18.444 -16.759 0.053 473 HD2 LYS 68 1HD LYS 68 -18.015 -18.862 -0.721 474 HD3 LYS 68 2HD LYS 68 -16.581 -18.632 0.284 475 HE2 LYS 68 1HE LYS 68 -19.040 -19.800 1.502 476 HE3 LYS 68 2HE LYS 68 -18.029 -20.815 0.475 477 HZ1 LYS 68 3HZ LYS 68 -16.140 -19.903 1.973 478 HZ2 LYS 68 1HZ LYS 68 -17.117 -21.164 2.535 479 HZ3 LYS 68 2HZ LYS 68 -17.391 -19.581 3.065 480 H GLY 69 H GLY 69 -16.144 -14.185 2.250 481 HA2 GLY 69 1HA GLY 69 -14.432 -14.469 4.398 482 HA3 GLY 69 2HA GLY 69 -14.583 -12.999 3.448 483 H TRP 70 H TRP 70 -17.249 -12.350 4.126 484 HA TRP 70 HA TRP 70 -16.824 -10.938 6.531 485 HB2 TRP 70 1HB TRP 70 -19.041 -11.280 4.608 486 HB3 TRP 70 2HB TRP 70 -19.522 -10.836 6.244 487 HD1 TRP 70 HD1 TRP 70 -16.626 -9.568 3.972 488 HE1 TRP 70 HE1 TRP 70 -16.711 -6.996 3.959 489 HE3 TRP 70 HE3 TRP 70 -20.728 -8.877 6.944 490 HZ2 TRP 70 HZ2 TRP 70 -18.305 -4.945 5.064 491 HZ3 TRP 70 HZ3 TRP 70 -21.467 -6.578 7.418 492 HH2 TRP 70 HH2 TRP 70 -20.279 -4.654 6.496 493 H ASP 71 H ASP 71 -19.146 -13.560 5.841 494 HA ASP 71 HA ASP 71 -20.052 -13.971 8.419 495 HB2 ASP 71 1HB ASP 71 -21.187 -15.080 6.658 496 HB3 ASP 71 2HB ASP 71 -19.716 -15.876 6.107 497 H GLU 72 H GLU 72 -17.182 -15.293 6.839 498 HA GLU 72 HA GLU 72 -16.431 -17.098 8.851 499 HB2 GLU 72 1HB GLU 72 -15.377 -16.195 6.395 500 HB3 GLU 72 2HB GLU 72 -14.118 -15.937 7.594 501 HG2 GLU 72 1HG GLU 72 -14.158 -18.249 8.222 502 HG3 GLU 72 2HG GLU 72 -15.553 -18.549 7.187 503 H GLY 73 H GLY 73 -15.643 -13.677 8.370 504 HA2 GLY 73 1HA GLY 73 -13.901 -13.543 10.643 505 HA3 GLY 73 2HA GLY 73 -14.520 -12.180 9.722 506 H VAL 74 H VAL 74 -17.298 -12.795 10.061 507 HA VAL 74 HA VAL 74 -17.794 -11.448 12.485 508 HB VAL 74 HB VAL 74 -19.758 -13.092 10.884 509 HG11 VAL 74 1HG1 VAL 74 -20.570 -10.653 12.341 510 HG12 VAL 74 2HG1 VAL 74 -21.433 -12.174 12.099 511 HG13 VAL 74 3HG1 VAL 74 -20.169 -12.061 13.324 512 HG21 VAL 74 3HG2 VAL 74 -18.299 -10.965 9.952 513 HG22 VAL 74 1HG2 VAL 74 -19.861 -11.490 9.326 514 HG23 VAL 74 2HG2 VAL 74 -19.780 -10.196 10.521 515 H GLN 75 H GLN 75 -17.794 -14.855 11.625 516 HA GLN 75 HA GLN 75 -18.813 -15.646 14.223 517 HB2 GLN 75 1HB GLN 75 -18.687 -17.917 13.379 518 HB3 GLN 75 2HB GLN 75 -19.467 -16.883 12.189 519 HG2 GLN 75 1HG GLN 75 -17.173 -16.696 11.097 520 HG3 GLN 75 2HG GLN 75 -16.708 -18.049 12.127 521 HE21 GLN 75 2HE2 GLN 75 -19.650 -17.279 10.302 522 HE22 GLN 75 1HE2 GLN 75 -19.686 -18.755 9.405 523 H GLY 76 H GLY 76 -16.491 -14.184 14.497 524 HA2 GLY 76 1HA GLY 76 -14.848 -16.063 15.925 525 HA3 GLY 76 2HA GLY 76 -14.050 -15.401 14.506 526 H MET 77 H MET 77 -15.142 -12.791 14.614 527 HA MET 77 HA MET 77 -13.305 -11.460 16.180 528 HB2 MET 77 1HB MET 77 -14.839 -9.474 15.949 529 HB3 MET 77 2HB MET 77 -14.415 -10.271 14.440 530 HG2 MET 77 1HG MET 77 -16.581 -11.483 14.542 531 HG3 MET 77 2HG MET 77 -17.000 -10.518 15.955 532 HE1 MET 77 3HE MET 77 -19.267 -9.024 14.798 533 HE2 MET 77 1HE MET 77 -19.249 -9.246 13.048 534 HE3 MET 77 2HE MET 77 -18.969 -10.623 14.115 535 H LYS 78 H LYS 78 -13.585 -10.134 18.094 536 HA LYS 78 HA LYS 78 -15.649 -11.144 19.934 537 HB2 LYS 78 1HB LYS 78 -12.754 -10.600 20.618 538 HB3 LYS 78 2HB LYS 78 -14.001 -11.086 21.759 539 HG2 LYS 78 1HG LYS 78 -14.060 -13.248 20.988 540 HG3 LYS 78 2HG LYS 78 -13.445 -12.810 19.392 541 HD2 LYS 78 1HD LYS 78 -11.325 -12.114 20.857 542 HD3 LYS 78 2HD LYS 78 -11.983 -13.368 21.911 543 HE2 LYS 78 1HE LYS 78 -11.564 -15.035 20.416 544 HE3 LYS 78 2HE LYS 78 -11.782 -13.984 19.018 545 HZ1 LYS 78 3HZ LYS 78 -9.526 -14.384 19.016 546 HZ2 LYS 78 1HZ LYS 78 -9.394 -14.350 20.702 547 HZ3 LYS 78 2HZ LYS 78 -9.607 -12.910 19.842 548 H VAL 79 H VAL 79 -16.337 -9.691 21.563 549 HA VAL 79 HA VAL 79 -16.745 -7.072 20.789 550 HB VAL 79 HB VAL 79 -16.653 -8.069 23.640 551 HG11 VAL 79 1HG1 VAL 79 -18.514 -6.243 23.770 552 HG12 VAL 79 2HG1 VAL 79 -16.813 -5.779 23.848 553 HG13 VAL 79 3HG1 VAL 79 -17.710 -5.598 22.340 554 HG21 VAL 79 3HG2 VAL 79 -18.406 -8.735 21.464 555 HG22 VAL 79 1HG2 VAL 79 -18.388 -9.355 23.115 556 HG23 VAL 79 2HG2 VAL 79 -19.301 -7.896 22.731 557 H GLY 80 H GLY 80 -15.501 -5.322 20.701 558 HA2 GLY 80 1HA GLY 80 -13.919 -3.759 21.391 559 HA3 GLY 80 2HA GLY 80 -13.432 -4.858 22.673 560 H GLY 81 H GLY 81 -13.491 -6.660 19.928 561 HA2 GLY 81 1HA GLY 81 -10.587 -6.469 19.669 562 HA3 GLY 81 2HA GLY 81 -11.603 -7.761 19.046 563 H VAL 82 H VAL 82 -9.609 -5.443 18.065 564 HA VAL 82 HA VAL 82 -11.119 -4.970 15.577 565 HB VAL 82 HB VAL 82 -9.119 -3.080 16.826 566 HG11 VAL 82 1HG1 VAL 82 -8.960 -2.273 14.756 567 HG12 VAL 82 2HG1 VAL 82 -10.285 -3.286 14.181 568 HG13 VAL 82 3HG1 VAL 82 -10.627 -1.729 14.936 569 HG21 VAL 82 3HG2 VAL 82 -11.422 -1.696 16.781 570 HG22 VAL 82 1HG2 VAL 82 -12.052 -3.321 17.050 571 HG23 VAL 82 2HG2 VAL 82 -10.881 -2.632 18.174 572 H ARG 83 H ARG 83 -10.230 -5.992 13.919 573 HA ARG 83 HA ARG 83 -7.337 -5.965 13.583 574 HB2 ARG 83 1HB ARG 83 -8.826 -8.569 13.315 575 HB3 ARG 83 2HB ARG 83 -7.088 -8.307 13.336 576 HG2 ARG 83 1HG ARG 83 -7.302 -7.576 15.711 577 HG3 ARG 83 2HG ARG 83 -8.995 -8.070 15.648 578 HD2 ARG 83 1HD ARG 83 -6.870 -9.996 14.823 579 HD3 ARG 83 2HD ARG 83 -7.160 -9.711 16.539 580 HE ARG 83 HE ARG 83 -8.805 -11.202 14.748 581 HH11 ARG 83 1HH1 ARG 83 -8.857 -9.182 17.583 582 HH12 ARG 83 2HH1 ARG 83 -10.320 -9.869 18.205 583 HH21 ARG 83 1HH2 ARG 83 -10.732 -12.115 15.557 584 HH22 ARG 83 2HH2 ARG 83 -11.386 -11.538 17.052 585 H ARG 84 H ARG 84 -6.656 -6.264 11.435 586 HA ARG 84 HA ARG 84 -8.740 -5.703 9.472 587 HB2 ARG 84 1HB ARG 84 -6.715 -4.272 9.575 588 HB3 ARG 84 2HB ARG 84 -5.734 -5.669 9.154 589 HG2 ARG 84 1HG ARG 84 -7.311 -5.795 7.080 590 HG3 ARG 84 2HG ARG 84 -7.624 -4.101 7.466 591 HD2 ARG 84 1HD ARG 84 -4.982 -5.390 6.813 592 HD3 ARG 84 2HD ARG 84 -5.842 -4.161 5.886 593 HE ARG 84 HE ARG 84 -5.387 -3.025 8.340 594 HH11 ARG 84 1HH1 ARG 84 -3.422 -4.410 5.823 595 HH12 ARG 84 2HH1 ARG 84 -2.052 -3.404 6.158 596 HH21 ARG 84 1HH2 ARG 84 -3.590 -1.695 8.792 597 HH22 ARG 84 2HH2 ARG 84 -2.149 -1.861 7.848 598 H LEU 85 H LEU 85 -9.672 -7.433 8.592 599 HA LEU 85 HA LEU 85 -8.067 -9.831 8.085 600 HB2 LEU 85 1HB LEU 85 -11.053 -9.443 7.947 601 HB3 LEU 85 2HB LEU 85 -10.196 -10.973 7.767 602 HG LEU 85 HG LEU 85 -9.700 -9.550 10.296 603 HD11 LEU 85 1HD1 LEU 85 -12.271 -11.005 10.230 604 HD12 LEU 85 2HD1 LEU 85 -12.258 -9.383 9.539 605 HD13 LEU 85 3HD1 LEU 85 -11.765 -9.631 11.214 606 HD21 LEU 85 3HD2 LEU 85 -9.314 -11.635 11.060 607 HD22 LEU 85 1HD2 LEU 85 -9.182 -12.021 9.344 608 HD23 LEU 85 2HD2 LEU 85 -10.694 -12.322 10.201 609 H THR 86 H THR 86 -7.416 -10.340 6.103 610 HA THR 86 HA THR 86 -8.245 -8.692 3.865 611 HB THR 86 HB THR 86 -6.317 -11.002 3.723 612 HG1 THR 86 HG1 THR 86 -5.410 -8.380 4.151 613 HG21 THR 86 3HG2 THR 86 -7.185 -8.863 1.952 614 HG22 THR 86 1HG2 THR 86 -6.298 -10.341 1.584 615 HG23 THR 86 2HG2 THR 86 -5.433 -8.910 2.145 616 H ILE 87 H ILE 87 -10.044 -9.215 2.812 617 HA ILE 87 HA ILE 87 -10.853 -12.019 2.622 618 HB ILE 87 HB ILE 87 -12.354 -9.508 1.868 619 HG12 ILE 87 1HG1 ILE 87 -12.778 -11.399 4.191 620 HG13 ILE 87 2HG1 ILE 87 -11.959 -9.845 4.310 621 HG21 ILE 87 1HG2 ILE 87 -12.840 -12.327 1.325 622 HG22 ILE 87 2HG2 ILE 87 -14.185 -11.538 2.147 623 HG23 ILE 87 3HG2 ILE 87 -13.584 -10.892 0.620 624 HD11 ILE 87 3HD1 ILE 87 -14.569 -9.624 3.070 625 HD12 ILE 87 1HD1 ILE 87 -14.641 -10.313 4.691 626 HD13 ILE 87 2HD1 ILE 87 -13.881 -8.742 4.433 627 HA PRO 88 HA PRO 88 -9.006 -11.911 -1.485 628 HB2 PRO 88 1HB PRO 88 -9.183 -14.592 -1.875 629 HB3 PRO 88 2HB PRO 88 -7.903 -13.843 -0.912 630 HG2 PRO 88 1HG PRO 88 -10.428 -15.170 -0.003 631 HG3 PRO 88 2HG PRO 88 -8.789 -15.309 0.661 632 HD2 PRO 88 1HD PRO 88 -10.686 -13.733 1.779 633 HD3 PRO 88 2HD PRO 88 -8.958 -13.327 1.826 634 HA PRO 89 HA PRO 89 -12.445 -12.159 -4.215 635 HB2 PRO 89 1HB PRO 89 -11.425 -13.392 -6.408 636 HB3 PRO 89 2HB PRO 89 -11.006 -11.736 -5.955 637 HG2 PRO 89 1HG PRO 89 -9.484 -14.271 -5.485 638 HG3 PRO 89 2HG PRO 89 -8.885 -12.689 -6.016 639 HD2 PRO 89 1HD PRO 89 -8.663 -13.547 -3.458 640 HD3 PRO 89 2HD PRO 89 -8.874 -11.834 -3.876 641 H GLN 90 H GLN 90 -10.701 -15.207 -3.794 642 HA GLN 90 HA GLN 90 -12.730 -16.887 -4.823 643 HB2 GLN 90 1HB GLN 90 -11.511 -18.678 -3.507 644 HB3 GLN 90 2HB GLN 90 -10.547 -17.796 -4.684 645 HG2 GLN 90 1HG GLN 90 -9.209 -16.911 -3.122 646 HG3 GLN 90 2HG GLN 90 -10.532 -16.654 -1.986 647 HE21 GLN 90 2HE2 GLN 90 -7.882 -17.694 -1.475 648 HE22 GLN 90 1HE2 GLN 90 -8.094 -19.274 -0.808 649 H LEU 91 H LEU 91 -12.593 -15.054 -2.010 650 HA LEU 91 HA LEU 91 -14.712 -16.690 -0.778 651 HB2 LEU 91 1HB LEU 91 -12.366 -15.307 0.423 652 HB3 LEU 91 2HB LEU 91 -13.860 -15.392 1.355 653 HG LEU 91 HG LEU 91 -12.377 -17.175 2.018 654 HD11 LEU 91 1HD1 LEU 91 -14.062 -19.006 0.675 655 HD12 LEU 91 2HD1 LEU 91 -15.006 -17.553 1.001 656 HD13 LEU 91 3HD1 LEU 91 -14.199 -18.395 2.324 657 HD21 LEU 91 3HD2 LEU 91 -11.158 -17.239 -0.189 658 HD22 LEU 91 1HD2 LEU 91 -12.490 -18.220 -0.802 659 HD23 LEU 91 2HD2 LEU 91 -11.506 -18.808 0.539 660 H GLY 92 H GLY 92 -14.263 -14.021 -2.506 661 HA2 GLY 92 1HA GLY 92 -16.401 -12.565 -1.080 662 HA3 GLY 92 2HA GLY 92 -15.042 -11.720 -1.805 663 H TYR 93 H TYR 93 -15.153 -11.134 -3.897 664 HA TYR 93 HA TYR 93 -17.653 -11.388 -5.252 665 HB2 TYR 93 1HB TYR 93 -15.010 -10.302 -6.247 666 HB3 TYR 93 2HB TYR 93 -16.566 -10.096 -7.043 667 HD1 TYR 93 HD1 TYR 93 -18.141 -9.653 -4.421 668 HD2 TYR 93 HD2 TYR 93 -14.552 -7.968 -5.963 669 HE1 TYR 93 HE1 TYR 93 -18.544 -7.611 -3.110 670 HE2 TYR 93 HE2 TYR 93 -14.944 -5.922 -4.655 671 HH TYR 93 HH TYR 93 -16.230 -5.325 -2.511 672 H GLY 94 H GLY 94 -14.361 -12.554 -5.976 673 HA2 GLY 94 1HA GLY 94 -14.060 -14.852 -6.704 674 HA3 GLY 94 2HA GLY 94 -15.601 -14.728 -7.540 675 H ALA 95 H ALA 95 -14.272 -15.591 -9.337 676 HA ALA 95 HA ALA 95 -12.385 -13.767 -10.558 677 HB1 ALA 95 1HB ALA 95 -12.869 -16.540 -10.681 678 HB2 ALA 95 2HB ALA 95 -13.124 -15.903 -12.306 679 HB3 ALA 95 3HB ALA 95 -11.592 -15.622 -11.479 680 H ARG 96 H ARG 96 -15.597 -13.670 -10.353 681 HA ARG 96 HA ARG 96 -16.386 -13.324 -13.075 682 HB2 ARG 96 1HB ARG 96 -17.849 -13.879 -11.010 683 HB3 ARG 96 2HB ARG 96 -17.847 -12.143 -10.731 684 HG2 ARG 96 1HG ARG 96 -19.806 -12.540 -11.925 685 HG3 ARG 96 2HG ARG 96 -18.676 -11.932 -13.136 686 HD2 ARG 96 1HD ARG 96 -18.141 -14.379 -13.616 687 HD3 ARG 96 2HD ARG 96 -19.582 -14.759 -12.673 688 HE ARG 96 HE ARG 96 -19.486 -13.671 -15.332 689 HH11 ARG 96 1HH1 ARG 96 -21.385 -13.984 -12.431 690 HH12 ARG 96 2HH1 ARG 96 -22.899 -13.749 -13.241 691 HH21 ARG 96 1HH2 ARG 96 -21.472 -13.360 -16.409 692 HH22 ARG 96 2HH2 ARG 96 -22.947 -13.396 -15.504 693 H GLY 97 H GLY 97 -15.019 -11.268 -10.631 694 HA2 GLY 97 1HA GLY 97 -13.935 -9.228 -11.080 695 HA3 GLY 97 2HA GLY 97 -14.817 -9.118 -12.596 696 H ALA 98 H ALA 98 -14.632 -6.884 -11.116 697 HA ALA 98 HA ALA 98 -17.393 -6.531 -10.188 698 HB1 ALA 98 1HB ALA 98 -15.054 -6.416 -8.531 699 HB2 ALA 98 2HB ALA 98 -15.842 -4.839 -8.580 700 HB3 ALA 98 3HB ALA 98 -16.752 -6.264 -8.080 701 H GLY 99 H GLY 99 -14.524 -4.422 -10.266 702 HA2 GLY 99 1HA GLY 99 -16.074 -2.564 -11.952 703 HA3 GLY 99 2HA GLY 99 -14.779 -2.092 -10.862 704 H GLY 100 H GLY 100 -13.723 -0.975 -12.550 705 HA2 GLY 100 1HA GLY 100 -12.903 -2.392 -14.926 706 HA3 GLY 100 2HA GLY 100 -12.451 -0.754 -14.477 707 H VAL 101 H VAL 101 -11.178 -1.013 -12.128 708 HA VAL 101 HA VAL 101 -8.769 -2.463 -12.907 709 HB VAL 101 HB VAL 101 -7.660 -1.229 -11.099 710 HG11 VAL 101 1HG1 VAL 101 -7.451 0.699 -12.293 711 HG12 VAL 101 2HG1 VAL 101 -8.310 -0.273 -13.489 712 HG13 VAL 101 3HG1 VAL 101 -9.191 0.892 -12.500 713 HG21 VAL 101 3HG2 VAL 101 -8.754 -0.237 -9.430 714 HG22 VAL 101 1HG2 VAL 101 -9.796 0.644 -10.548 715 HG23 VAL 101 2HG2 VAL 101 -10.222 -0.994 -10.050 716 H ILE 102 H ILE 102 -10.866 -4.124 -12.134 717 HA ILE 102 HA ILE 102 -9.773 -5.253 -9.648 718 HB ILE 102 HB ILE 102 -12.706 -5.123 -10.360 719 HG12 ILE 102 1HG1 ILE 102 -11.135 -3.801 -8.136 720 HG13 ILE 102 2HG1 ILE 102 -11.832 -2.987 -9.533 721 HG21 ILE 102 1HG2 ILE 102 -12.238 -5.957 -7.686 722 HG22 ILE 102 2HG2 ILE 102 -13.018 -6.842 -8.996 723 HG23 ILE 102 3HG2 ILE 102 -11.276 -6.973 -8.759 724 HD11 ILE 102 3HD1 ILE 102 -13.868 -4.471 -8.194 725 HD12 ILE 102 1HD1 ILE 102 -13.012 -3.456 -7.033 726 HD13 ILE 102 2HD1 ILE 102 -13.746 -2.733 -8.465 727 HA PRO 103 HA PRO 103 -9.536 -8.498 -12.844 728 HB2 PRO 103 1HB PRO 103 -7.428 -9.761 -11.691 729 HB3 PRO 103 2HB PRO 103 -7.245 -8.355 -12.746 730 HG2 PRO 103 1HG PRO 103 -7.233 -8.493 -9.756 731 HG3 PRO 103 2HG PRO 103 -6.172 -7.571 -10.838 732 HD2 PRO 103 1HD PRO 103 -8.261 -6.442 -9.536 733 HD3 PRO 103 2HD PRO 103 -7.725 -5.894 -11.137 734 HA PRO 104 HA PRO 104 -11.587 -11.801 -10.791 735 HB2 PRO 104 1HB PRO 104 -10.518 -14.001 -11.970 736 HB3 PRO 104 2HB PRO 104 -11.633 -12.911 -12.802 737 HG2 PRO 104 1HG PRO 104 -8.646 -13.040 -12.949 738 HG3 PRO 104 2HG PRO 104 -9.822 -12.830 -14.259 739 HD2 PRO 104 1HD PRO 104 -8.437 -10.759 -13.198 740 HD3 PRO 104 2HD PRO 104 -10.087 -10.581 -13.830 741 H ASN 105 H ASN 105 -8.232 -11.402 -10.456 742 HA ASN 105 HA ASN 105 -8.160 -13.385 -8.277 743 HB2 ASN 105 1HB ASN 105 -5.925 -13.866 -8.734 744 HB3 ASN 105 2HB ASN 105 -6.608 -13.666 -10.345 745 HD21 ASN 105 2HD2 ASN 105 -6.258 -11.653 -11.434 746 HD22 ASN 105 1HD2 ASN 105 -4.855 -10.711 -11.076 747 H ALA 106 H ALA 106 -8.799 -10.356 -8.539 748 HA ALA 106 HA ALA 106 -6.787 -9.068 -6.957 749 HB1 ALA 106 1HB ALA 106 -7.817 -7.202 -7.595 750 HB2 ALA 106 2HB ALA 106 -8.894 -8.220 -8.553 751 HB3 ALA 106 3HB ALA 106 -9.356 -7.739 -6.920 752 H THR 107 H THR 107 -6.836 -8.527 -4.798 753 HA THR 107 HA THR 107 -8.841 -9.956 -3.180 754 HB THR 107 HB THR 107 -6.014 -9.188 -2.426 755 HG1 THR 107 HG1 THR 107 -5.731 -11.491 -2.458 756 HG21 THR 107 3HG2 THR 107 -6.821 -10.993 -0.571 757 HG22 THR 107 1HG2 THR 107 -8.330 -10.128 -0.866 758 HG23 THR 107 2HG2 THR 107 -6.894 -9.245 -0.346 759 H LEU 108 H LEU 108 -9.792 -8.928 -1.427 760 HA LEU 108 HA LEU 108 -9.325 -6.024 -1.241 761 HB2 LEU 108 1HB LEU 108 -11.966 -7.422 -0.866 762 HB3 LEU 108 2HB LEU 108 -11.674 -5.685 -0.856 763 HG LEU 108 HG LEU 108 -10.850 -6.944 -3.348 764 HD11 LEU 108 1HD1 LEU 108 -12.800 -8.389 -2.622 765 HD12 LEU 108 2HD1 LEU 108 -12.954 -7.588 -4.185 766 HD13 LEU 108 3HD1 LEU 108 -13.800 -6.945 -2.778 767 HD21 LEU 108 3HD2 LEU 108 -10.998 -4.659 -3.466 768 HD22 LEU 108 1HD2 LEU 108 -12.419 -4.586 -2.423 769 HD23 LEU 108 2HD2 LEU 108 -12.580 -5.119 -4.097 770 H VAL 109 H VAL 109 -8.940 -5.233 0.735 771 HA VAL 109 HA VAL 109 -9.067 -7.091 2.998 772 HB VAL 109 HB VAL 109 -7.774 -4.383 3.095 773 HG11 VAL 109 1HG1 VAL 109 -7.469 -6.976 4.580 774 HG12 VAL 109 2HG1 VAL 109 -6.250 -5.702 4.657 775 HG13 VAL 109 3HG1 VAL 109 -7.894 -5.386 5.214 776 HG21 VAL 109 3HG2 VAL 109 -5.638 -5.589 2.472 777 HG22 VAL 109 1HG2 VAL 109 -6.659 -6.902 1.886 778 HG23 VAL 109 2HG2 VAL 109 -6.776 -5.301 1.156 779 H PHE 110 H PHE 110 -9.980 -6.484 4.994 780 HA PHE 110 HA PHE 110 -11.576 -4.049 5.090 781 HB2 PHE 110 1HB PHE 110 -12.710 -6.832 5.130 782 HB3 PHE 110 2HB PHE 110 -13.530 -5.517 5.966 783 HD1 PHE 110 HD2 PHE 110 -12.373 -6.704 2.670 784 HD2 PHE 110 HD1 PHE 110 -14.793 -3.913 4.785 785 HE1 PHE 110 HE2 PHE 110 -13.441 -6.035 0.558 786 HE2 PHE 110 HE1 PHE 110 -15.866 -3.240 2.675 787 HZ PHE 110 HZ PHE 110 -15.190 -4.301 0.558 788 H GLU 111 H GLU 111 -11.643 -3.185 7.082 789 HA GLU 111 HA GLU 111 -10.337 -4.670 9.234 790 HB2 GLU 111 1HB GLU 111 -9.658 -2.306 8.554 791 HB3 GLU 111 2HB GLU 111 -11.165 -1.772 9.286 792 HG2 GLU 111 1HG GLU 111 -9.847 -3.445 11.150 793 HG3 GLU 111 2HG GLU 111 -8.669 -2.292 10.527 794 H VAL 112 H VAL 112 -11.580 -5.771 10.585 795 HA VAL 112 HA VAL 112 -14.326 -4.854 11.077 796 HB VAL 112 HB VAL 112 -13.173 -7.524 11.864 797 HG11 VAL 112 1HG1 VAL 112 -15.550 -8.200 11.826 798 HG12 VAL 112 2HG1 VAL 112 -15.218 -6.930 13.006 799 HG13 VAL 112 3HG1 VAL 112 -15.993 -6.530 11.473 800 HG21 VAL 112 3HG2 VAL 112 -14.543 -6.758 9.289 801 HG22 VAL 112 1HG2 VAL 112 -12.886 -7.331 9.479 802 HG23 VAL 112 2HG2 VAL 112 -14.238 -8.415 9.810 803 H GLU 113 H GLU 113 -14.903 -4.044 12.989 804 HA GLU 113 HA GLU 113 -13.209 -4.582 15.329 805 HB2 GLU 113 1HB GLU 113 -13.469 -2.207 16.017 806 HB3 GLU 113 2HB GLU 113 -12.525 -2.409 14.548 807 HG2 GLU 113 1HG GLU 113 -14.616 -1.899 13.257 808 HG3 GLU 113 2HG GLU 113 -15.365 -1.461 14.791 809 H LEU 114 H LEU 114 -14.416 -5.499 16.839 810 HA LEU 114 HA LEU 114 -17.281 -5.350 16.789 811 HB2 LEU 114 1HB LEU 114 -15.615 -7.250 17.598 812 HB3 LEU 114 2HB LEU 114 -15.827 -6.431 19.144 813 HG LEU 114 HG LEU 114 -17.409 -8.116 19.230 814 HD11 LEU 114 1HD1 LEU 114 -18.916 -5.809 18.008 815 HD12 LEU 114 2HD1 LEU 114 -18.397 -5.908 19.690 816 HD13 LEU 114 3HD1 LEU 114 -19.576 -7.060 19.062 817 HD21 LEU 114 3HD2 LEU 114 -19.003 -8.096 16.989 818 HD22 LEU 114 1HD2 LEU 114 -17.717 -9.252 17.334 819 HD23 LEU 114 2HD2 LEU 114 -17.386 -7.839 16.331 820 H LEU 115 H LEU 115 -18.538 -3.928 17.793 821 HA LEU 115 HA LEU 115 -17.315 -2.108 19.738 822 HB2 LEU 115 1HB LEU 115 -20.035 -1.783 18.520 823 HB3 LEU 115 2HB LEU 115 -18.983 -0.551 19.216 824 HG LEU 115 HG LEU 115 -18.724 -1.910 16.542 825 HD11 LEU 115 1HD1 LEU 115 -20.073 0.362 17.312 826 HD12 LEU 115 2HD1 LEU 115 -19.544 -0.029 15.676 827 HD13 LEU 115 3HD1 LEU 115 -18.537 0.986 16.709 828 HD21 LEU 115 3HD2 LEU 115 -16.718 -0.243 16.406 829 HD22 LEU 115 1HD2 LEU 115 -16.502 -1.833 17.138 830 HD23 LEU 115 2HD2 LEU 115 -16.713 -0.412 18.162 831 H ASP 116 H ASP 116 -20.176 -4.153 19.279 832 HA ASP 116 HA ASP 116 -20.255 -4.880 22.026 833 HB2 ASP 116 1HB ASP 116 -21.266 -2.489 21.906 834 HB3 ASP 116 2HB ASP 116 -22.660 -3.288 21.184 835 H VAL 117 H VAL 117 -22.309 -6.164 22.509 836 HA VAL 117 HA VAL 117 -23.153 -7.580 20.063 837 HB VAL 117 HB VAL 117 -23.367 -9.619 21.419 838 HG11 VAL 117 1HG1 VAL 117 -20.842 -8.232 20.899 839 HG12 VAL 117 2HG1 VAL 117 -20.723 -9.530 22.090 840 HG13 VAL 117 3HG1 VAL 117 -21.349 -9.867 20.475 841 HG21 VAL 117 3HG2 VAL 117 -23.355 -7.911 23.575 842 HG22 VAL 117 1HG2 VAL 117 -23.218 -9.668 23.649 843 HG23 VAL 117 2HG2 VAL 117 -21.765 -8.669 23.661 844 H13 JZF 130 1H3 JZF 130 -20.155 -2.734 0.625 845 H23 JZF 130 2H3 JZF 130 -20.702 -3.333 -0.931 846 H4 JZF 130 H4 JZF 130 -18.426 -4.424 0.763 847 H15 JZF 130 1H5 JZF 130 -17.983 -6.037 -1.005 848 H25 JZF 130 2H5 JZF 130 -19.317 -5.430 -1.974 849 H17 JZF 130 1H7 JZF 130 -17.423 -2.563 -0.088 850 H27 JZF 130 2H7 JZF 130 -16.988 -3.781 -1.243 851 H8 JZF 130 H8 JZF 130 -19.347 -2.416 -2.105 852 H9 JZF 130 H9 JZF 130 -16.776 -3.168 -3.360 853 H1OH JZF 130 1HO JZF 130 -17.109 -0.733 -1.622 854 H11 JZF 130 H11 JZF 130 -17.248 -4.599 -5.467 855 H112 JZF 130 1H12 JZF 130 -18.826 -2.297 -6.722 856 H212 JZF 130 2H12 JZF 130 -17.455 -3.119 -7.452 857 H13A JZF 130 H13 JZF 130 -16.927 -0.876 -6.422 858 H114 JZF 130 1H14 JZF 130 -16.790 -0.690 -3.967 859 H214 JZF 130 2H14 JZF 130 -18.422 -0.869 -4.559 860 H115 JZF 130 1H15 JZF 130 -22.519 -6.395 1.889 861 H215 JZF 130 2H15 JZF 130 -21.344 -7.697 1.697 862 H116 JZF 130 1H16 JZF 130 -23.031 -8.575 -2.240 863 H216 JZF 130 2H16 JZF 130 -21.271 -8.315 -2.056 864 H117 JZF 130 2H17 JZF 130 -20.894 -10.548 -2.464 865 H217 JZF 130 3H17 JZF 130 -21.937 -10.984 -1.097 866 H317 JZF 130 1H17 JZF 130 -22.634 -10.780 -2.713 867 H118 JZF 130 1H18 JZF 130 -18.708 -5.489 -7.147 868 H218 JZF 130 2H18 JZF 130 -19.571 -5.713 -5.620 869 H318 JZF 130 3H18 JZF 130 -20.029 -4.393 -6.710 870 H119 JZF 130 3H19 JZF 130 -15.408 -3.316 -5.378 871 H219 JZF 130 1H19 JZF 130 -15.035 -2.283 -6.761 872 H319 JZF 130 2H19 JZF 130 -14.864 -1.654 -5.122 Start of MODEL 12 1 H1 GLY 1 H GLY 1 1.608 1.754 2.228 2 HA2 GLY 1 1HA GLY 1 -0.517 1.223 0.287 3 HA3 GLY 1 2HA GLY 1 0.299 2.777 0.186 4 HA PRO 2 HA PRO 2 3.504 1.063 -2.255 5 HB2 PRO 2 1HB PRO 2 5.738 2.260 -1.280 6 HB3 PRO 2 2HB PRO 2 4.522 3.123 -2.229 7 HG2 PRO 2 1HG PRO 2 4.902 3.045 0.739 8 HG3 PRO 2 2HG PRO 2 4.537 4.430 -0.306 9 HD2 PRO 2 1HD PRO 2 2.639 3.167 1.154 10 HD3 PRO 2 2HD PRO 2 2.293 3.915 -0.418 11 H GLY 3 H GLY 3 3.800 0.763 1.214 12 HA2 GLY 3 1HA GLY 3 4.890 -1.891 0.934 13 HA3 GLY 3 2HA GLY 3 6.029 -0.739 1.616 14 H SER 4 H SER 4 6.115 -1.770 3.610 15 HA SER 4 HA SER 4 5.497 -2.296 5.738 16 HB2 SER 4 1HB SER 4 5.011 0.259 5.526 17 HB3 SER 4 2HB SER 4 3.319 -0.235 5.561 18 HG SER 4 HG SER 4 3.963 0.152 7.656 19 H MET 5 H MET 5 4.494 -4.103 4.072 20 HA MET 5 HA MET 5 1.634 -4.383 4.607 21 HB2 MET 5 1HB MET 5 2.828 -4.813 2.322 22 HB3 MET 5 2HB MET 5 3.251 -6.361 3.039 23 HG2 MET 5 1HG MET 5 1.013 -7.024 3.206 24 HG3 MET 5 2HG MET 5 0.421 -5.383 2.957 25 HE1 MET 5 3HE MET 5 0.643 -8.560 1.874 26 HE2 MET 5 1HE MET 5 0.190 -8.523 0.170 27 HE3 MET 5 2HE MET 5 1.890 -8.625 0.628 28 H THR 6 H THR 6 2.566 -4.594 6.957 29 HA THR 6 HA THR 6 3.606 -7.192 7.634 30 HB THR 6 HB THR 6 2.947 -6.297 10.031 31 HG1 THR 6 HG1 THR 6 2.368 -4.254 10.088 32 HG21 THR 6 3HG2 THR 6 5.097 -4.596 9.275 33 HG22 THR 6 1HG2 THR 6 5.237 -6.096 8.358 34 HG23 THR 6 2HG2 THR 6 5.166 -6.142 10.120 35 H VAL 7 H VAL 7 1.729 -8.252 6.481 36 HA VAL 7 HA VAL 7 -0.458 -8.686 8.407 37 HB VAL 7 HB VAL 7 -0.721 -8.660 5.397 38 HG11 VAL 7 1HG1 VAL 7 -2.580 -9.844 5.650 39 HG12 VAL 7 2HG1 VAL 7 -2.264 -9.971 7.382 40 HG13 VAL 7 3HG1 VAL 7 -3.218 -8.627 6.754 41 HG21 VAL 7 3HG2 VAL 7 -1.937 -6.649 5.606 42 HG22 VAL 7 1HG2 VAL 7 -2.034 -6.799 7.360 43 HG23 VAL 7 2HG2 VAL 7 -0.490 -6.431 6.590 44 H VAL 8 H VAL 8 -0.623 -10.721 9.068 45 HA VAL 8 HA VAL 8 1.005 -12.781 7.904 46 HB VAL 8 HB VAL 8 -1.096 -13.076 10.052 47 HG11 VAL 8 1HG1 VAL 8 1.247 -14.777 9.221 48 HG12 VAL 8 2HG1 VAL 8 0.345 -15.009 10.719 49 HG13 VAL 8 3HG1 VAL 8 -0.464 -15.201 9.163 50 HG21 VAL 8 3HG2 VAL 8 0.449 -11.386 10.768 51 HG22 VAL 8 1HG2 VAL 8 0.820 -12.879 11.630 52 HG23 VAL 8 2HG2 VAL 8 1.827 -12.370 10.275 53 H THR 9 H THR 9 0.432 -14.345 6.521 54 HA THR 9 HA THR 9 -2.367 -14.409 5.626 55 HB THR 9 HB THR 9 0.108 -15.404 4.200 56 HG1 THR 9 HG1 THR 9 0.223 -13.274 3.917 57 HG21 THR 9 3HG2 THR 9 -1.869 -15.106 2.328 58 HG22 THR 9 1HG2 THR 9 -2.759 -15.739 3.712 59 HG23 THR 9 2HG2 THR 9 -1.387 -16.636 3.061 60 H THR 10 H THR 10 -3.489 -16.332 5.454 61 HA THR 10 HA THR 10 -2.464 -18.507 7.105 62 HB THR 10 HB THR 10 -4.706 -19.355 7.179 63 HG1 THR 10 HG1 THR 10 -5.110 -17.569 5.026 64 HG21 THR 10 3HG2 THR 10 -5.310 -17.808 8.666 65 HG22 THR 10 1HG2 THR 10 -5.629 -16.634 7.390 66 HG23 THR 10 2HG2 THR 10 -4.005 -16.790 8.060 67 H GLU 11 H GLU 11 -3.627 -20.722 6.199 68 HA GLU 11 HA GLU 11 -2.092 -21.328 3.840 69 HB2 GLU 11 1HB GLU 11 -3.756 -22.918 5.757 70 HB3 GLU 11 2HB GLU 11 -3.296 -23.624 4.215 71 HG2 GLU 11 1HG GLU 11 -1.217 -22.402 5.971 72 HG3 GLU 11 2HG GLU 11 -1.828 -24.020 6.313 73 H SER 12 H SER 12 -5.361 -20.518 4.568 74 HA SER 12 HA SER 12 -6.379 -21.553 2.048 75 HB2 SER 12 1HB SER 12 -7.898 -19.855 4.027 76 HB3 SER 12 2HB SER 12 -8.544 -20.988 2.840 77 HG SER 12 HG SER 12 -8.535 -22.299 4.491 78 H GLY 13 H GLY 13 -4.480 -19.097 2.626 79 HA2 GLY 13 1HA GLY 13 -3.988 -17.387 1.083 80 HA3 GLY 13 2HA GLY 13 -5.634 -17.490 0.477 81 H LEU 14 H LEU 14 -7.072 -17.215 2.831 82 HA LEU 14 HA LEU 14 -7.300 -14.481 3.111 83 HB2 LEU 14 1HB LEU 14 -8.992 -16.122 3.820 84 HB3 LEU 14 2HB LEU 14 -7.966 -16.570 5.181 85 HG LEU 14 HG LEU 14 -8.282 -13.841 5.483 86 HD11 LEU 14 1HD1 LEU 14 -11.076 -14.597 5.291 87 HD12 LEU 14 2HD1 LEU 14 -10.274 -14.583 3.721 88 HD13 LEU 14 3HD1 LEU 14 -10.256 -13.139 4.733 89 HD21 LEU 14 3HD2 LEU 14 -9.194 -14.415 7.497 90 HD22 LEU 14 1HD2 LEU 14 -8.463 -15.956 7.049 91 HD23 LEU 14 2HD2 LEU 14 -10.191 -15.698 6.809 92 H LYS 15 H LYS 15 -6.534 -12.949 4.524 93 HA LYS 15 HA LYS 15 -4.269 -13.779 6.217 94 HB2 LYS 15 1HB LYS 15 -4.599 -11.023 5.054 95 HB3 LYS 15 2HB LYS 15 -3.148 -11.761 5.719 96 HG2 LYS 15 1HG LYS 15 -3.031 -13.278 3.821 97 HG3 LYS 15 2HG LYS 15 -4.509 -12.576 3.159 98 HD2 LYS 15 1HD LYS 15 -3.325 -10.365 3.114 99 HD3 LYS 15 2HD LYS 15 -1.843 -11.222 3.544 100 HE2 LYS 15 1HE LYS 15 -2.059 -12.590 1.521 101 HE3 LYS 15 2HE LYS 15 -3.531 -11.719 1.092 102 HZ1 LYS 15 3HZ LYS 15 -2.316 -9.735 0.773 103 HZ2 LYS 15 1HZ LYS 15 -1.455 -10.946 -0.038 104 HZ3 LYS 15 2HZ LYS 15 -0.912 -10.381 1.461 105 H TYR 16 H TYR 16 -3.858 -12.354 8.094 106 HA TYR 16 HA TYR 16 -6.138 -10.832 9.063 107 HB2 TYR 16 1HB TYR 16 -6.525 -12.101 11.012 108 HB3 TYR 16 2HB TYR 16 -6.423 -13.291 9.720 109 HD1 TYR 16 HD2 TYR 16 -3.857 -14.098 9.309 110 HD2 TYR 16 HD1 TYR 16 -5.468 -12.661 12.975 111 HE1 TYR 16 HE2 TYR 16 -2.098 -15.294 10.543 112 HE2 TYR 16 HE1 TYR 16 -3.713 -13.852 14.220 113 HH TYR 16 HH TYR 16 -2.082 -15.412 14.067 114 H GLU 17 H GLU 17 -5.613 -9.315 10.612 115 HA GLU 17 HA GLU 17 -3.004 -9.304 11.848 116 HB2 GLU 17 1HB GLU 17 -2.710 -8.334 9.512 117 HB3 GLU 17 2HB GLU 17 -3.708 -6.989 10.049 118 HG2 GLU 17 1HG GLU 17 -1.788 -7.226 12.025 119 HG3 GLU 17 2HG GLU 17 -0.907 -7.530 10.529 120 H ASP 18 H ASP 18 -3.385 -8.701 13.864 121 HA ASP 18 HA ASP 18 -5.775 -7.487 14.724 122 HB2 ASP 18 1HB ASP 18 -4.036 -8.910 16.042 123 HB3 ASP 18 2HB ASP 18 -3.245 -7.363 16.335 124 H LEU 19 H LEU 19 -6.207 -5.408 15.489 125 HA LEU 19 HA LEU 19 -4.278 -3.340 14.658 126 HB2 LEU 19 1HB LEU 19 -7.256 -3.462 14.335 127 HB3 LEU 19 2HB LEU 19 -6.403 -1.920 14.349 128 HG LEU 19 HG LEU 19 -5.984 -4.158 12.369 129 HD11 LEU 19 1HD1 LEU 19 -7.113 -1.424 11.847 130 HD12 LEU 19 2HD1 LEU 19 -8.131 -2.809 12.242 131 HD13 LEU 19 3HD1 LEU 19 -7.125 -2.839 10.794 132 HD21 LEU 19 3HD2 LEU 19 -4.375 -1.860 13.089 133 HD22 LEU 19 1HD2 LEU 19 -4.864 -1.818 11.395 134 HD23 LEU 19 2HD2 LEU 19 -3.996 -3.217 12.027 135 H THR 20 H THR 20 -6.730 -4.338 16.962 136 HA THR 20 HA THR 20 -5.486 -2.780 19.035 137 HB THR 20 HB THR 20 -8.386 -2.159 18.503 138 HG1 THR 20 HG1 THR 20 -7.801 -0.527 17.233 139 HG21 THR 20 3HG2 THR 20 -7.873 -1.622 20.714 140 HG22 THR 20 1HG2 THR 20 -7.635 -0.094 19.867 141 HG23 THR 20 2HG2 THR 20 -6.243 -1.085 20.307 142 H GLU 21 H GLU 21 -5.520 -4.011 20.790 143 HA GLU 21 HA GLU 21 -6.802 -6.445 21.023 144 HB2 GLU 21 1HB GLU 21 -4.908 -5.407 22.450 145 HB3 GLU 21 2HB GLU 21 -6.210 -4.759 23.439 146 HG2 GLU 21 1HG GLU 21 -6.862 -6.834 24.187 147 HG3 GLU 21 2HG GLU 21 -6.159 -7.670 22.803 148 H GLY 22 H GLY 22 -8.439 -7.063 22.717 149 HA2 GLY 22 1HA GLY 22 -10.462 -5.019 23.231 150 HA3 GLY 22 2HA GLY 22 -10.943 -6.375 22.222 151 H SER 23 H SER 23 -10.221 -8.578 23.266 152 HA SER 23 HA SER 23 -10.638 -10.109 24.896 153 HB2 SER 23 1HB SER 23 -10.081 -8.011 26.975 154 HB3 SER 23 2HB SER 23 -9.689 -9.730 27.002 155 HG SER 23 HG SER 23 -8.118 -7.767 26.284 156 H GLY 24 H GLY 24 -12.914 -9.817 24.143 157 HA2 GLY 24 1HA GLY 24 -14.580 -8.944 26.416 158 HA3 GLY 24 2HA GLY 24 -15.005 -8.501 24.770 159 H ALA 25 H ALA 25 -16.084 -9.932 23.500 160 HA ALA 25 HA ALA 25 -16.355 -12.701 24.378 161 HB1 ALA 25 1HB ALA 25 -18.650 -12.705 24.652 162 HB2 ALA 25 2HB ALA 25 -18.192 -11.163 25.376 163 HB3 ALA 25 3HB ALA 25 -18.866 -11.206 23.747 164 H GLU 26 H GLU 26 -16.177 -14.005 22.682 165 HA GLU 26 HA GLU 26 -16.030 -13.001 20.030 166 HB2 GLU 26 1HB GLU 26 -14.776 -14.991 20.905 167 HB3 GLU 26 2HB GLU 26 -16.290 -15.885 20.888 168 HG2 GLU 26 1HG GLU 26 -16.268 -14.988 18.361 169 HG3 GLU 26 2HG GLU 26 -14.535 -15.084 18.663 170 H ALA 27 H ALA 27 -17.529 -12.861 18.474 171 HA ALA 27 HA ALA 27 -20.263 -13.021 19.052 172 HB1 ALA 27 1HB ALA 27 -19.138 -11.680 17.223 173 HB2 ALA 27 2HB ALA 27 -19.110 -13.171 16.279 174 HB3 ALA 27 3HB ALA 27 -20.650 -12.478 16.788 175 H ARG 28 H ARG 28 -21.888 -14.421 18.139 176 HA ARG 28 HA ARG 28 -20.925 -17.102 17.416 177 HB2 ARG 28 1HB ARG 28 -23.163 -16.541 19.370 178 HB3 ARG 28 2HB ARG 28 -22.603 -18.128 18.857 179 HG2 ARG 28 1HG ARG 28 -20.676 -18.003 20.107 180 HG3 ARG 28 2HG ARG 28 -20.686 -16.238 20.138 181 HD2 ARG 28 1HD ARG 28 -23.034 -17.409 21.399 182 HD3 ARG 28 2HD ARG 28 -21.527 -17.910 22.164 183 HE ARG 28 HE ARG 28 -21.722 -15.076 21.692 184 HH11 ARG 28 1HH1 ARG 28 -22.424 -17.682 23.891 185 HH12 ARG 28 2HH1 ARG 28 -22.489 -16.660 25.288 186 HH21 ARG 28 1HH2 ARG 28 -21.806 -13.719 23.524 187 HH22 ARG 28 2HH2 ARG 28 -22.139 -14.406 25.078 188 H ALA 29 H ALA 29 -22.099 -18.156 15.880 189 HA ALA 29 HA ALA 29 -23.715 -16.681 14.135 190 HB1 ALA 29 1HB ALA 29 -23.373 -18.436 12.820 191 HB2 ALA 29 2HB ALA 29 -22.541 -19.222 14.162 192 HB3 ALA 29 3HB ALA 29 -24.266 -19.492 13.915 193 H GLY 30 H GLY 30 -25.739 -16.007 14.358 194 HA2 GLY 30 1HA GLY 30 -28.082 -16.729 14.571 195 HA3 GLY 30 2HA GLY 30 -27.583 -17.649 15.982 196 H GLN 31 H GLN 31 -25.788 -15.264 16.675 197 HA GLN 31 HA GLN 31 -27.891 -13.770 18.068 198 HB2 GLN 31 1HB GLN 31 -26.426 -13.421 19.796 199 HB3 GLN 31 2HB GLN 31 -25.801 -14.945 19.180 200 HG2 GLN 31 1HG GLN 31 -24.108 -13.715 17.898 201 HG3 GLN 31 2HG GLN 31 -24.720 -12.204 18.568 202 HE21 GLN 31 2HE2 GLN 31 -24.408 -11.764 20.769 203 HE22 GLN 31 1HE2 GLN 31 -23.195 -12.580 21.690 204 H THR 32 H THR 32 -28.043 -11.555 17.975 205 HA THR 32 HA THR 32 -26.824 -10.319 15.647 206 HB THR 32 HB THR 32 -28.714 -8.967 17.565 207 HG1 THR 32 HG1 THR 32 -30.390 -9.938 16.572 208 HG21 THR 32 3HG2 THR 32 -29.071 -7.432 15.897 209 HG22 THR 32 1HG2 THR 32 -28.690 -8.576 14.611 210 HG23 THR 32 2HG2 THR 32 -27.392 -7.857 15.564 211 H VAL 33 H VAL 33 -25.362 -8.680 15.662 212 HA VAL 33 HA VAL 33 -24.622 -7.409 18.175 213 HB VAL 33 HB VAL 33 -22.273 -7.915 18.005 214 HG11 VAL 33 1HG1 VAL 33 -23.854 -10.470 17.742 215 HG12 VAL 33 2HG1 VAL 33 -22.289 -10.275 18.533 216 HG13 VAL 33 3HG1 VAL 33 -23.724 -9.505 19.212 217 HG21 VAL 33 3HG2 VAL 33 -22.106 -9.981 16.117 218 HG22 VAL 33 1HG2 VAL 33 -22.976 -8.667 15.325 219 HG23 VAL 33 2HG2 VAL 33 -21.382 -8.375 16.021 220 H SER 34 H SER 34 -23.039 -5.634 17.833 221 HA SER 34 HA SER 34 -23.414 -4.431 15.170 222 HB2 SER 34 1HB SER 34 -24.330 -3.405 17.490 223 HB3 SER 34 2HB SER 34 -22.722 -2.683 17.465 224 HG SER 34 HG SER 34 -24.121 -1.322 16.382 225 H VAL 35 H VAL 35 -21.652 -4.129 13.989 226 HA VAL 35 HA VAL 35 -19.088 -3.626 15.306 227 HB VAL 35 HB VAL 35 -17.893 -5.293 14.172 228 HG11 VAL 35 1HG1 VAL 35 -20.490 -6.682 14.791 229 HG12 VAL 35 2HG1 VAL 35 -18.854 -7.331 14.912 230 HG13 VAL 35 3HG1 VAL 35 -19.396 -6.085 16.037 231 HG21 VAL 35 3HG2 VAL 35 -20.258 -5.360 12.363 232 HG22 VAL 35 1HG2 VAL 35 -18.539 -5.297 11.974 233 HG23 VAL 35 2HG2 VAL 35 -19.266 -6.810 12.515 234 H HIS 36 H HIS 36 -17.424 -2.855 13.775 235 HA HIS 36 HA HIS 36 -18.668 -1.306 11.605 236 HB2 HIS 36 1HB HIS 36 -16.647 -0.670 13.636 237 HB3 HIS 36 2HB HIS 36 -16.211 -0.151 12.011 238 HD1 HIS 36 HD1 HIS 36 -18.771 0.893 10.889 239 HD2 HIS 36 HD2 HIS 36 -17.661 1.520 14.843 240 HE1 HIS 36 HE1 HIS 36 -20.054 2.924 11.634 241 H TYR 37 H TYR 37 -18.011 -1.583 9.559 242 HA TYR 37 HA TYR 37 -15.710 -3.365 9.101 243 HB2 TYR 37 1HB TYR 37 -16.796 -4.075 7.040 244 HB3 TYR 37 2HB TYR 37 -17.882 -4.314 8.404 245 HD1 TYR 37 HD1 TYR 37 -19.867 -2.910 8.675 246 HD2 TYR 37 HD2 TYR 37 -17.290 -2.452 5.321 247 HE1 TYR 37 HE1 TYR 37 -21.606 -1.606 7.525 248 HE2 TYR 37 HE2 TYR 37 -19.021 -1.145 4.162 249 HH TYR 37 HH TYR 37 -21.573 0.233 5.625 250 H THR 38 H THR 38 -14.133 -2.765 7.698 251 HA THR 38 HA THR 38 -14.469 -0.226 6.251 252 HB THR 38 HB THR 38 -11.732 -0.580 7.114 253 HG1 THR 38 HG1 THR 38 -12.395 0.042 9.387 254 HG21 THR 38 3HG2 THR 38 -12.620 1.516 6.275 255 HG22 THR 38 1HG2 THR 38 -12.071 1.727 7.937 256 HG23 THR 38 2HG2 THR 38 -13.793 1.575 7.590 257 H GLY 39 H GLY 39 -14.397 -0.808 4.171 258 HA2 GLY 39 1HA GLY 39 -12.943 -3.087 3.236 259 HA3 GLY 39 2HA GLY 39 -13.769 -1.899 2.239 260 H TRP 40 H TRP 40 -10.783 -3.087 3.241 261 HA TRP 40 HA TRP 40 -9.413 -0.716 2.149 262 HB2 TRP 40 1HB TRP 40 -8.396 -2.711 4.185 263 HB3 TRP 40 2HB TRP 40 -7.450 -1.391 3.501 264 HD1 TRP 40 HD1 TRP 40 -10.267 0.529 3.761 265 HE1 TRP 40 HE1 TRP 40 -10.633 1.617 6.065 266 HE3 TRP 40 HE3 TRP 40 -7.211 -2.460 6.564 267 HZ2 TRP 40 HZ2 TRP 40 -9.743 1.256 8.719 268 HZ3 TRP 40 HZ3 TRP 40 -7.023 -2.022 8.978 269 HH2 TRP 40 HH2 TRP 40 -8.263 -0.201 10.031 270 H LEU 41 H LEU 41 -7.280 -1.235 1.120 271 HA LEU 41 HA LEU 41 -7.638 -3.511 -0.666 272 HB2 LEU 41 1HB LEU 41 -6.008 -1.013 -0.722 273 HB3 LEU 41 2HB LEU 41 -5.521 -2.382 -1.719 274 HG LEU 41 HG LEU 41 -8.063 -2.221 -2.492 275 HD11 LEU 41 1HD1 LEU 41 -8.196 -0.191 -0.829 276 HD12 LEU 41 2HD1 LEU 41 -9.035 -0.155 -2.380 277 HD13 LEU 41 3HD1 LEU 41 -7.495 0.684 -2.191 278 HD21 LEU 41 3HD2 LEU 41 -5.938 -2.048 -3.838 279 HD22 LEU 41 1HD2 LEU 41 -6.003 -0.307 -3.564 280 HD23 LEU 41 2HD2 LEU 41 -7.304 -1.110 -4.443 281 H THR 42 H THR 42 -5.442 -4.527 -1.389 282 HA THR 42 HA THR 42 -4.403 -5.913 0.859 283 HB THR 42 HB THR 42 -3.103 -7.174 -0.649 284 HG1 THR 42 HG1 THR 42 -2.731 -6.372 -2.827 285 HG21 THR 42 3HG2 THR 42 -4.649 -7.869 -2.309 286 HG22 THR 42 1HG2 THR 42 -5.411 -6.280 -2.368 287 HG23 THR 42 2HG2 THR 42 -5.615 -7.304 -0.946 288 H ASP 43 H ASP 43 -3.656 -2.909 -0.449 289 HA ASP 43 HA ASP 43 -0.877 -2.978 0.475 290 HB2 ASP 43 1HB ASP 43 -0.856 -0.626 -0.552 291 HB3 ASP 43 2HB ASP 43 -0.996 -1.989 -1.658 292 H GLY 44 H GLY 44 -3.996 -1.898 1.395 293 HA2 GLY 44 1HA GLY 44 -4.251 -1.340 3.770 294 HA3 GLY 44 2HA GLY 44 -2.785 -0.381 3.623 295 H GLN 45 H GLN 45 -4.581 -0.004 0.851 296 HA GLN 45 HA GLN 45 -5.281 2.688 1.541 297 HB2 GLN 45 1HB GLN 45 -5.611 1.003 -0.925 298 HB3 GLN 45 2HB GLN 45 -6.355 2.592 -0.806 299 HG2 GLN 45 1HG GLN 45 -3.417 1.970 -0.615 300 HG3 GLN 45 2HG GLN 45 -4.247 2.738 -1.968 301 HE21 GLN 45 2HE2 GLN 45 -5.893 4.493 -0.649 302 HE22 GLN 45 1HE2 GLN 45 -4.937 5.687 0.156 303 H LYS 46 H LYS 46 -7.344 3.603 1.645 304 HA LYS 46 HA LYS 46 -9.446 1.703 2.407 305 HB2 LYS 46 1HB LYS 46 -8.705 3.525 3.999 306 HB3 LYS 46 2HB LYS 46 -9.407 4.685 2.878 307 HG2 LYS 46 1HG LYS 46 -11.572 4.000 3.319 308 HG3 LYS 46 2HG LYS 46 -11.056 2.430 3.938 309 HD2 LYS 46 1HD LYS 46 -11.644 3.573 5.870 310 HD3 LYS 46 2HD LYS 46 -9.897 3.815 5.795 311 HE2 LYS 46 1HE LYS 46 -11.830 5.790 4.618 312 HE3 LYS 46 2HE LYS 46 -11.357 5.850 6.315 313 HZ1 LYS 46 3HZ LYS 46 -9.917 6.708 4.012 314 HZ2 LYS 46 1HZ LYS 46 -9.001 5.628 4.938 315 HZ3 LYS 46 2HZ LYS 46 -9.621 7.034 5.645 316 H PHE 47 H PHE 47 -11.135 1.371 1.124 317 HA PHE 47 HA PHE 47 -11.893 3.457 -0.800 318 HB2 PHE 47 1HB PHE 47 -12.096 1.907 -2.590 319 HB3 PHE 47 2HB PHE 47 -10.521 1.603 -1.863 320 HD1 PHE 47 HD2 PHE 47 -10.368 -0.304 -0.157 321 HD2 PHE 47 HD1 PHE 47 -13.614 0.179 -2.868 322 HE1 PHE 47 HE2 PHE 47 -10.959 -2.674 0.134 323 HE2 PHE 47 HE1 PHE 47 -14.211 -2.191 -2.580 324 HZ PHE 47 HZ PHE 47 -12.882 -3.621 -1.078 325 H ASP 48 H ASP 48 -12.898 2.225 1.833 326 HA ASP 48 HA ASP 48 -15.638 2.573 1.366 327 HB2 ASP 48 1HB ASP 48 -14.969 0.186 0.345 328 HB3 ASP 48 2HB ASP 48 -15.228 -0.298 2.019 329 H SER 49 H SER 49 -16.514 3.138 3.249 330 HA SER 49 HA SER 49 -15.664 1.866 5.722 331 HB2 SER 49 1HB SER 49 -14.109 3.817 5.319 332 HB3 SER 49 2HB SER 49 -15.514 4.874 5.456 333 HG SER 49 HG SER 49 -14.066 3.668 7.407 334 H SER 50 H SER 50 -17.129 2.129 7.435 335 HA SER 50 HA SER 50 -19.835 2.482 6.639 336 HB2 SER 50 1HB SER 50 -19.574 2.557 9.494 337 HB3 SER 50 2HB SER 50 -20.187 1.253 8.477 338 HG SER 50 HG SER 50 -17.538 1.713 9.347 339 H LYS 51 H LYS 51 -17.469 4.689 7.437 340 HA LYS 51 HA LYS 51 -18.741 6.585 9.020 341 HB2 LYS 51 1HB LYS 51 -16.835 7.114 6.732 342 HB3 LYS 51 2HB LYS 51 -17.191 8.212 8.059 343 HG2 LYS 51 1HG LYS 51 -16.118 5.490 8.641 344 HG3 LYS 51 2HG LYS 51 -15.031 6.772 8.102 345 HD2 LYS 51 1HD LYS 51 -16.940 7.158 10.391 346 HD3 LYS 51 2HD LYS 51 -15.333 6.465 10.622 347 HE2 LYS 51 1HE LYS 51 -14.447 8.526 9.422 348 HE3 LYS 51 2HE LYS 51 -16.059 9.209 9.630 349 HZ1 LYS 51 3HZ LYS 51 -14.082 8.496 11.703 350 HZ2 LYS 51 1HZ LYS 51 -15.724 8.644 12.082 351 HZ3 LYS 51 2HZ LYS 51 -14.876 9.969 11.460 352 H ASP 52 H ASP 52 -19.300 5.716 5.727 353 HA ASP 52 HA ASP 52 -20.395 7.996 4.633 354 HB2 ASP 52 1HB ASP 52 -21.147 5.095 4.283 355 HB3 ASP 52 2HB ASP 52 -21.885 6.383 3.333 356 H ARG 53 H ARG 53 -21.749 5.841 7.023 357 HA ARG 53 HA ARG 53 -24.218 7.446 7.045 358 HB2 ARG 53 1HB ARG 53 -24.502 5.014 6.588 359 HB3 ARG 53 2HB ARG 53 -23.796 4.669 8.162 360 HG2 ARG 53 1HG ARG 53 -25.640 5.445 9.310 361 HG3 ARG 53 2HG ARG 53 -26.182 6.450 7.964 362 HD2 ARG 53 1HD ARG 53 -26.989 4.588 6.766 363 HD3 ARG 53 2HD ARG 53 -26.130 3.451 7.803 364 HE ARG 53 HE ARG 53 -27.869 4.788 9.458 365 HH11 ARG 53 1HH1 ARG 53 -28.127 2.823 6.596 366 HH12 ARG 53 2HH1 ARG 53 -29.696 2.209 7.000 367 HH21 ARG 53 1HH2 ARG 53 -29.934 3.986 10.002 368 HH22 ARG 53 2HH2 ARG 53 -30.723 2.872 8.938 369 H ASN 54 H ASN 54 -21.381 6.700 8.749 370 HA ASN 54 HA ASN 54 -20.561 7.360 10.765 371 HB2 ASN 54 1HB ASN 54 -21.839 9.505 9.966 372 HB3 ASN 54 2HB ASN 54 -22.970 9.077 11.246 373 HD21 ASN 54 2HD2 ASN 54 -19.446 9.197 10.816 374 HD22 ASN 54 1HD2 ASN 54 -19.126 10.032 12.295 375 H ASP 55 H ASP 55 -22.503 5.132 10.497 376 HA ASP 55 HA ASP 55 -23.152 4.897 13.347 377 HB2 ASP 55 1HB ASP 55 -25.352 4.209 13.002 378 HB3 ASP 55 2HB ASP 55 -25.171 5.512 11.830 379 HA PRO 56 HA PRO 56 -21.316 0.921 13.043 380 HB2 PRO 56 1HB PRO 56 -22.684 -0.422 14.965 381 HB3 PRO 56 2HB PRO 56 -21.473 0.812 15.332 382 HG2 PRO 56 1HG PRO 56 -24.457 1.045 15.270 383 HG3 PRO 56 2HG PRO 56 -23.308 1.698 16.453 384 HD2 PRO 56 1HD PRO 56 -24.394 3.211 14.487 385 HD3 PRO 56 2HD PRO 56 -22.757 3.492 15.114 386 H PHE 57 H PHE 57 -21.712 -1.306 12.489 387 HA PHE 57 HA PHE 57 -24.183 -1.631 10.942 388 HB2 PHE 57 1HB PHE 57 -21.742 -1.923 10.005 389 HB3 PHE 57 2HB PHE 57 -21.867 -3.517 10.742 390 HD1 PHE 57 HD2 PHE 57 -24.139 -1.330 8.741 391 HD2 PHE 57 HD1 PHE 57 -22.356 -5.163 9.235 392 HE1 PHE 57 HE2 PHE 57 -25.352 -2.145 6.761 393 HE2 PHE 57 HE1 PHE 57 -23.565 -5.984 7.255 394 HZ PHE 57 HZ PHE 57 -25.066 -4.475 6.016 395 H ALA 58 H ALA 58 -25.700 -2.450 12.281 396 HA ALA 58 HA ALA 58 -24.994 -4.728 13.989 397 HB1 ALA 58 1HB ALA 58 -27.622 -3.278 14.020 398 HB2 ALA 58 2HB ALA 58 -26.879 -4.247 15.293 399 HB3 ALA 58 3HB ALA 58 -26.210 -2.668 14.883 400 H PHE 59 H PHE 59 -25.652 -6.734 13.539 401 HA PHE 59 HA PHE 59 -28.042 -7.311 12.088 402 HB2 PHE 59 1HB PHE 59 -27.113 -8.254 10.098 403 HB3 PHE 59 2HB PHE 59 -26.439 -6.636 10.262 404 HD1 PHE 59 HD1 PHE 59 -24.147 -6.551 11.586 405 HD2 PHE 59 HD2 PHE 59 -25.689 -9.973 9.578 406 HE1 PHE 59 HE1 PHE 59 -21.875 -7.482 11.434 407 HE2 PHE 59 HE2 PHE 59 -23.419 -10.910 9.424 408 HZ PHE 59 HZ PHE 59 -21.509 -9.665 10.354 409 H VAL 60 H VAL 60 -28.009 -9.779 11.473 410 HA VAL 60 HA VAL 60 -27.272 -11.171 13.910 411 HB VAL 60 HB VAL 60 -28.728 -12.217 11.478 412 HG11 VAL 60 1HG1 VAL 60 -27.925 -14.094 12.603 413 HG12 VAL 60 2HG1 VAL 60 -28.157 -13.359 14.191 414 HG13 VAL 60 3HG1 VAL 60 -29.552 -13.888 13.250 415 HG21 VAL 60 3HG2 VAL 60 -29.607 -10.656 13.821 416 HG22 VAL 60 1HG2 VAL 60 -30.303 -10.771 12.205 417 HG23 VAL 60 2HG2 VAL 60 -30.614 -12.038 13.391 418 H LEU 61 H LEU 61 -25.696 -12.659 14.125 419 HA LEU 61 HA LEU 61 -23.725 -12.867 12.042 420 HB2 LEU 61 1HB LEU 61 -23.066 -12.690 14.379 421 HB3 LEU 61 2HB LEU 61 -23.903 -14.198 14.741 422 HG LEU 61 HG LEU 61 -22.303 -15.452 13.444 423 HD11 LEU 61 1HD1 LEU 61 -21.723 -12.863 12.317 424 HD12 LEU 61 2HD1 LEU 61 -21.312 -14.469 11.718 425 HD13 LEU 61 3HD1 LEU 61 -20.251 -13.661 12.872 426 HD21 LEU 61 3HD2 LEU 61 -20.341 -13.841 14.862 427 HD22 LEU 61 1HD2 LEU 61 -20.850 -15.508 15.135 428 HD23 LEU 61 2HD2 LEU 61 -21.776 -14.178 15.831 429 H GLY 62 H GLY 62 -23.082 -14.723 10.939 430 HA2 GLY 62 1HA GLY 62 -23.466 -16.648 9.744 431 HA3 GLY 62 2HA GLY 62 -23.977 -17.314 11.288 432 H GLY 63 H GLY 63 -25.392 -14.839 9.148 433 HA2 GLY 63 1HA GLY 63 -27.375 -16.183 7.905 434 HA3 GLY 63 2HA GLY 63 -28.016 -15.997 9.530 435 H GLY 64 H GLY 64 -26.539 -14.080 6.914 436 HA2 GLY 64 1HA GLY 64 -28.646 -12.090 7.257 437 HA3 GLY 64 2HA GLY 64 -26.997 -11.543 7.523 438 H MET 65 H MET 65 -26.113 -10.581 5.831 439 HA MET 65 HA MET 65 -26.470 -11.695 3.171 440 HB2 MET 65 1HB MET 65 -28.335 -10.112 3.379 441 HB3 MET 65 2HB MET 65 -27.208 -8.833 3.811 442 HG2 MET 65 1HG MET 65 -26.318 -8.725 1.660 443 HG3 MET 65 2HG MET 65 -26.968 -10.301 1.215 444 HE1 MET 65 3HE MET 65 -27.483 -9.352 -0.884 445 HE2 MET 65 1HE MET 65 -29.117 -10.008 -0.782 446 HE3 MET 65 2HE MET 65 -28.868 -8.337 -1.289 447 H VAL 66 H VAL 66 -24.182 -12.102 3.938 448 HA VAL 66 HA VAL 66 -22.486 -9.931 2.940 449 HB VAL 66 HB VAL 66 -20.884 -10.144 4.709 450 HG11 VAL 66 1HG1 VAL 66 -23.701 -9.839 5.727 451 HG12 VAL 66 2HG1 VAL 66 -22.270 -9.462 6.688 452 HG13 VAL 66 3HG1 VAL 66 -22.598 -8.568 5.203 453 HG21 VAL 66 3HG2 VAL 66 -20.680 -12.178 5.621 454 HG22 VAL 66 1HG2 VAL 66 -21.968 -11.670 6.714 455 HG23 VAL 66 2HG2 VAL 66 -22.355 -12.603 5.269 456 H ILE 67 H ILE 67 -20.161 -10.773 2.668 457 HA ILE 67 HA ILE 67 -20.310 -13.162 1.065 458 HB ILE 67 HB ILE 67 -17.890 -12.717 0.623 459 HG12 ILE 67 1HG1 ILE 67 -18.006 -10.005 1.722 460 HG13 ILE 67 2HG1 ILE 67 -18.015 -11.256 2.960 461 HG21 ILE 67 1HG2 ILE 67 -18.512 -10.270 -0.319 462 HG22 ILE 67 2HG2 ILE 67 -19.044 -11.774 -1.068 463 HG23 ILE 67 3HG2 ILE 67 -20.125 -10.898 0.016 464 HD11 ILE 67 3HD1 ILE 67 -16.033 -11.974 1.100 465 HD12 ILE 67 1HD1 ILE 67 -15.834 -10.253 1.429 466 HD13 ILE 67 2HD1 ILE 67 -15.823 -11.412 2.759 467 H LYS 68 H LYS 68 -18.777 -14.941 1.273 468 HA LYS 68 HA LYS 68 -18.886 -16.278 3.654 469 HB2 LYS 68 1HB LYS 68 -17.024 -16.447 1.319 470 HB3 LYS 68 2HB LYS 68 -16.685 -17.412 2.749 471 HG2 LYS 68 1HG LYS 68 -19.123 -18.210 2.520 472 HG3 LYS 68 2HG LYS 68 -19.014 -17.570 0.879 473 HD2 LYS 68 1HD LYS 68 -18.354 -19.741 0.530 474 HD3 LYS 68 2HD LYS 68 -16.792 -18.972 0.824 475 HE2 LYS 68 1HE LYS 68 -17.188 -19.601 3.287 476 HE3 LYS 68 2HE LYS 68 -18.424 -20.691 2.663 477 HZ1 LYS 68 3HZ LYS 68 -15.704 -20.762 1.539 478 HZ2 LYS 68 1HZ LYS 68 -16.868 -21.988 1.600 479 HZ3 LYS 68 2HZ LYS 68 -16.028 -21.549 3.001 480 H GLY 69 H GLY 69 -16.158 -14.301 2.491 481 HA2 GLY 69 1HA GLY 69 -14.453 -14.647 4.660 482 HA3 GLY 69 2HA GLY 69 -14.489 -13.219 3.636 483 H TRP 70 H TRP 70 -17.136 -12.385 4.269 484 HA TRP 70 HA TRP 70 -16.619 -10.859 6.586 485 HB2 TRP 70 1HB TRP 70 -18.918 -11.229 4.740 486 HB3 TRP 70 2HB TRP 70 -19.271 -10.551 6.327 487 HD1 TRP 70 HD1 TRP 70 -16.253 -9.810 3.999 488 HE1 TRP 70 HE1 TRP 70 -16.177 -7.271 3.590 489 HE3 TRP 70 HE3 TRP 70 -20.475 -8.452 6.542 490 HZ2 TRP 70 HZ2 TRP 70 -17.705 -4.993 4.257 491 HZ3 TRP 70 HZ3 TRP 70 -21.097 -6.073 6.609 492 HH2 TRP 70 HH2 TRP 70 -19.739 -4.380 5.490 493 H ASP 71 H ASP 71 -18.745 -13.646 6.016 494 HA ASP 71 HA ASP 71 -19.832 -13.794 8.597 495 HB2 ASP 71 1HB ASP 71 -19.519 -15.717 6.330 496 HB3 ASP 71 2HB ASP 71 -20.012 -16.339 7.903 497 H GLU 72 H GLU 72 -16.983 -15.373 7.189 498 HA GLU 72 HA GLU 72 -16.292 -16.896 9.449 499 HB2 GLU 72 1HB GLU 72 -15.402 -16.998 7.005 500 HB3 GLU 72 2HB GLU 72 -14.234 -15.806 7.558 501 HG2 GLU 72 1HG GLU 72 -13.461 -17.345 9.280 502 HG3 GLU 72 2HG GLU 72 -14.644 -18.539 8.749 503 H GLY 73 H GLY 73 -15.588 -13.580 8.535 504 HA2 GLY 73 1HA GLY 73 -13.650 -13.167 10.617 505 HA3 GLY 73 2HA GLY 73 -14.371 -11.927 9.601 506 H VAL 74 H VAL 74 -17.027 -12.148 10.140 507 HA VAL 74 HA VAL 74 -17.258 -10.794 12.606 508 HB VAL 74 HB VAL 74 -19.448 -12.063 10.956 509 HG11 VAL 74 1HG1 VAL 74 -19.583 -9.898 13.052 510 HG12 VAL 74 2HG1 VAL 74 -20.934 -10.488 12.082 511 HG13 VAL 74 3HG1 VAL 74 -20.147 -11.557 13.244 512 HG21 VAL 74 3HG2 VAL 74 -17.739 -9.892 10.366 513 HG22 VAL 74 1HG2 VAL 74 -19.157 -10.439 9.471 514 HG23 VAL 74 2HG2 VAL 74 -19.328 -9.221 10.736 515 H GLN 75 H GLN 75 -17.457 -14.141 11.740 516 HA GLN 75 HA GLN 75 -18.742 -14.896 14.233 517 HB2 GLN 75 1HB GLN 75 -18.884 -17.074 13.363 518 HB3 GLN 75 2HB GLN 75 -19.136 -16.028 11.971 519 HG2 GLN 75 1HG GLN 75 -16.802 -16.344 11.315 520 HG3 GLN 75 2HG GLN 75 -16.560 -17.404 12.703 521 HE21 GLN 75 2HE2 GLN 75 -18.953 -17.056 10.099 522 HE22 GLN 75 1HE2 GLN 75 -18.972 -18.728 9.664 523 H GLY 76 H GLY 76 -15.898 -13.714 13.853 524 HA2 GLY 76 1HA GLY 76 -14.598 -15.671 15.638 525 HA3 GLY 76 2HA GLY 76 -13.714 -14.941 14.307 526 H MET 77 H MET 77 -14.885 -12.318 14.603 527 HA MET 77 HA MET 77 -13.049 -11.159 16.355 528 HB2 MET 77 1HB MET 77 -15.652 -10.024 15.319 529 HB3 MET 77 2HB MET 77 -14.371 -9.085 16.074 530 HG2 MET 77 1HG MET 77 -13.770 -10.757 13.679 531 HG3 MET 77 2HG MET 77 -14.564 -9.196 13.488 532 HE1 MET 77 3HE MET 77 -11.902 -10.859 12.872 533 HE2 MET 77 1HE MET 77 -10.943 -9.468 12.365 534 HE3 MET 77 2HE MET 77 -10.472 -10.391 13.793 535 H LYS 78 H LYS 78 -13.427 -9.953 18.323 536 HA LYS 78 HA LYS 78 -15.626 -11.064 19.942 537 HB2 LYS 78 1HB LYS 78 -12.885 -10.304 20.961 538 HB3 LYS 78 2HB LYS 78 -14.173 -11.084 21.869 539 HG2 LYS 78 1HG LYS 78 -13.985 -13.021 20.289 540 HG3 LYS 78 2HG LYS 78 -12.543 -12.248 19.627 541 HD2 LYS 78 1HD LYS 78 -11.721 -12.188 22.069 542 HD3 LYS 78 2HD LYS 78 -12.988 -13.380 22.370 543 HE2 LYS 78 1HE LYS 78 -10.917 -13.709 20.212 544 HE3 LYS 78 2HE LYS 78 -10.675 -14.287 21.860 545 HZ1 LYS 78 3HZ LYS 78 -12.647 -15.201 19.861 546 HZ2 LYS 78 1HZ LYS 78 -12.881 -15.490 21.511 547 HZ3 LYS 78 2HZ LYS 78 -11.518 -16.114 20.729 548 H VAL 79 H VAL 79 -16.494 -9.703 21.579 549 HA VAL 79 HA VAL 79 -17.037 -7.101 20.840 550 HB VAL 79 HB VAL 79 -17.036 -8.215 23.649 551 HG11 VAL 79 1HG1 VAL 79 -17.321 -6.007 24.096 552 HG12 VAL 79 2HG1 VAL 79 -17.939 -5.645 22.483 553 HG13 VAL 79 3HG1 VAL 79 -18.989 -6.402 23.682 554 HG21 VAL 79 3HG2 VAL 79 -18.509 -9.604 22.575 555 HG22 VAL 79 1HG2 VAL 79 -19.589 -8.278 23.006 556 HG23 VAL 79 2HG2 VAL 79 -18.943 -8.393 21.369 557 H GLY 80 H GLY 80 -15.881 -5.292 20.808 558 HA2 GLY 80 1HA GLY 80 -14.445 -3.637 21.597 559 HA3 GLY 80 2HA GLY 80 -13.972 -4.708 22.907 560 H GLY 81 H GLY 81 -13.753 -6.496 20.158 561 HA2 GLY 81 1HA GLY 81 -10.855 -6.053 20.040 562 HA3 GLY 81 2HA GLY 81 -11.703 -7.483 19.472 563 H VAL 82 H VAL 82 -9.833 -5.250 18.317 564 HA VAL 82 HA VAL 82 -11.396 -4.871 15.845 565 HB VAL 82 HB VAL 82 -9.258 -3.037 16.938 566 HG11 VAL 82 1HG1 VAL 82 -9.118 -2.156 14.906 567 HG12 VAL 82 2HG1 VAL 82 -10.212 -3.403 14.303 568 HG13 VAL 82 3HG1 VAL 82 -10.858 -1.870 14.889 569 HG21 VAL 82 3HG2 VAL 82 -10.931 -2.275 18.219 570 HG22 VAL 82 1HG2 VAL 82 -11.563 -1.576 16.727 571 HG23 VAL 82 2HG2 VAL 82 -12.157 -3.138 17.291 572 H ARG 83 H ARG 83 -10.634 -6.031 14.215 573 HA ARG 83 HA ARG 83 -7.773 -6.170 13.732 574 HB2 ARG 83 1HB ARG 83 -7.932 -8.120 15.050 575 HB3 ARG 83 2HB ARG 83 -9.473 -8.578 14.336 576 HG2 ARG 83 1HG ARG 83 -8.428 -9.204 12.290 577 HG3 ARG 83 2HG ARG 83 -6.885 -8.520 12.806 578 HD2 ARG 83 1HD ARG 83 -8.298 -10.915 13.967 579 HD3 ARG 83 2HD ARG 83 -6.798 -10.911 13.041 580 HE ARG 83 HE ARG 83 -6.200 -9.333 15.140 581 HH11 ARG 83 1HH1 ARG 83 -7.619 -12.502 14.897 582 HH12 ARG 83 2HH1 ARG 83 -6.985 -13.045 16.415 583 HH21 ARG 83 1HH2 ARG 83 -5.359 -10.036 17.140 584 HH22 ARG 83 2HH2 ARG 83 -5.701 -11.641 17.691 585 H ARG 84 H ARG 84 -7.237 -6.648 11.586 586 HA ARG 84 HA ARG 84 -9.520 -6.572 9.726 587 HB2 ARG 84 1HB ARG 84 -7.935 -5.541 8.112 588 HB3 ARG 84 2HB ARG 84 -8.186 -4.570 9.557 589 HG2 ARG 84 1HG ARG 84 -6.065 -5.017 10.382 590 HG3 ARG 84 2HG ARG 84 -5.870 -6.452 9.373 591 HD2 ARG 84 1HD ARG 84 -6.243 -3.860 7.988 592 HD3 ARG 84 2HD ARG 84 -4.705 -4.117 8.811 593 HE ARG 84 HE ARG 84 -5.101 -6.388 7.338 594 HH11 ARG 84 1HH1 ARG 84 -4.931 -2.980 6.648 595 HH12 ARG 84 2HH1 ARG 84 -4.297 -3.202 5.051 596 HH21 ARG 84 1HH2 ARG 84 -4.267 -6.693 5.237 597 HH22 ARG 84 2HH2 ARG 84 -3.921 -5.314 4.249 598 H LEU 85 H LEU 85 -9.618 -7.996 8.037 599 HA LEU 85 HA LEU 85 -7.448 -9.964 7.793 600 HB2 LEU 85 1HB LEU 85 -10.322 -10.768 7.553 601 HB3 LEU 85 2HB LEU 85 -8.906 -11.784 7.810 602 HG LEU 85 HG LEU 85 -9.060 -10.115 10.057 603 HD11 LEU 85 1HD1 LEU 85 -11.254 -9.463 9.863 604 HD12 LEU 85 2HD1 LEU 85 -11.423 -10.955 10.788 605 HD13 LEU 85 3HD1 LEU 85 -11.741 -10.953 9.053 606 HD21 LEU 85 3HD2 LEU 85 -8.999 -12.092 11.192 607 HD22 LEU 85 1HD2 LEU 85 -8.502 -12.660 9.598 608 HD23 LEU 85 2HD2 LEU 85 -10.171 -12.870 10.128 609 H THR 86 H THR 86 -6.963 -10.609 5.750 610 HA THR 86 HA THR 86 -8.192 -9.104 3.588 611 HB THR 86 HB THR 86 -5.851 -11.016 3.487 612 HG1 THR 86 HG1 THR 86 -5.734 -8.935 4.780 613 HG21 THR 86 3HG2 THR 86 -5.955 -10.769 1.277 614 HG22 THR 86 1HG2 THR 86 -5.750 -9.029 1.474 615 HG23 THR 86 2HG2 THR 86 -7.369 -9.728 1.439 616 H ILE 87 H ILE 87 -9.980 -9.923 2.712 617 HA ILE 87 HA ILE 87 -10.304 -12.825 2.527 618 HB ILE 87 HB ILE 87 -12.282 -10.597 2.032 619 HG12 ILE 87 1HG1 ILE 87 -12.676 -12.610 4.170 620 HG13 ILE 87 2HG1 ILE 87 -11.377 -11.452 4.429 621 HG21 ILE 87 1HG2 ILE 87 -12.675 -13.586 1.987 622 HG22 ILE 87 2HG2 ILE 87 -13.965 -12.386 1.904 623 HG23 ILE 87 3HG2 ILE 87 -12.776 -12.494 0.606 624 HD11 ILE 87 3HD1 ILE 87 -13.290 -9.751 3.722 625 HD12 ILE 87 1HD1 ILE 87 -14.302 -11.045 4.366 626 HD13 ILE 87 2HD1 ILE 87 -13.069 -10.299 5.383 627 HA PRO 88 HA PRO 88 -9.073 -12.648 -1.743 628 HB2 PRO 88 1HB PRO 88 -9.590 -15.254 -2.302 629 HB3 PRO 88 2HB PRO 88 -8.162 -14.729 -1.401 630 HG2 PRO 88 1HG PRO 88 -10.747 -15.836 -0.375 631 HG3 PRO 88 2HG PRO 88 -9.090 -16.207 0.136 632 HD2 PRO 88 1HD PRO 88 -10.699 -14.524 1.518 633 HD3 PRO 88 2HD PRO 88 -8.937 -14.316 1.445 634 HA PRO 89 HA PRO 89 -12.716 -12.299 -4.181 635 HB2 PRO 89 1HB PRO 89 -12.017 -13.461 -6.533 636 HB3 PRO 89 2HB PRO 89 -11.375 -11.901 -6.003 637 HG2 PRO 89 1HG PRO 89 -10.127 -14.618 -5.843 638 HG3 PRO 89 2HG PRO 89 -9.391 -13.074 -6.311 639 HD2 PRO 89 1HD PRO 89 -9.075 -14.151 -3.847 640 HD3 PRO 89 2HD PRO 89 -9.116 -12.398 -4.125 641 H GLN 90 H GLN 90 -11.312 -15.544 -4.121 642 HA GLN 90 HA GLN 90 -13.601 -16.901 -5.086 643 HB2 GLN 90 1HB GLN 90 -12.499 -18.920 -4.048 644 HB3 GLN 90 2HB GLN 90 -11.514 -18.035 -5.204 645 HG2 GLN 90 1HG GLN 90 -10.014 -17.395 -3.649 646 HG3 GLN 90 2HG GLN 90 -11.230 -17.238 -2.382 647 HE21 GLN 90 2HE2 GLN 90 -8.559 -18.580 -2.512 648 HE22 GLN 90 1HE2 GLN 90 -8.852 -20.192 -1.964 649 H LEU 91 H LEU 91 -13.028 -15.323 -2.178 650 HA LEU 91 HA LEU 91 -15.236 -16.790 -0.893 651 HB2 LEU 91 1HB LEU 91 -12.642 -15.835 0.229 652 HB3 LEU 91 2HB LEU 91 -14.063 -15.896 1.269 653 HG LEU 91 HG LEU 91 -14.223 -18.364 0.489 654 HD11 LEU 91 1HD1 LEU 91 -11.345 -17.729 -0.141 655 HD12 LEU 91 2HD1 LEU 91 -12.581 -18.276 -1.274 656 HD13 LEU 91 3HD1 LEU 91 -12.016 -19.354 0.003 657 HD21 LEU 91 3HD2 LEU 91 -12.294 -17.186 2.449 658 HD22 LEU 91 1HD2 LEU 91 -12.392 -18.933 2.231 659 HD23 LEU 91 2HD2 LEU 91 -13.816 -18.028 2.744 660 H GLY 92 H GLY 92 -14.628 -14.085 -2.448 661 HA2 GLY 92 1HA GLY 92 -16.467 -12.528 -0.759 662 HA3 GLY 92 2HA GLY 92 -14.986 -11.780 -1.337 663 H TYR 93 H TYR 93 -14.897 -10.975 -3.377 664 HA TYR 93 HA TYR 93 -17.341 -10.476 -4.720 665 HB2 TYR 93 1HB TYR 93 -14.465 -9.879 -5.236 666 HB3 TYR 93 2HB TYR 93 -15.593 -9.733 -6.579 667 HD1 TYR 93 HD2 TYR 93 -16.524 -9.018 -3.090 668 HD2 TYR 93 HD1 TYR 93 -15.364 -7.358 -6.832 669 HE1 TYR 93 HE2 TYR 93 -17.177 -6.785 -2.295 670 HE2 TYR 93 HE1 TYR 93 -16.012 -5.119 -6.046 671 HH TYR 93 HH TYR 93 -16.381 -4.274 -3.004 672 H GLY 94 H GLY 94 -14.448 -12.214 -5.897 673 HA2 GLY 94 1HA GLY 94 -14.764 -14.504 -6.747 674 HA3 GLY 94 2HA GLY 94 -16.273 -13.942 -7.451 675 H ALA 95 H ALA 95 -15.081 -15.049 -9.321 676 HA ALA 95 HA ALA 95 -13.014 -13.450 -10.567 677 HB1 ALA 95 1HB ALA 95 -13.831 -16.135 -10.721 678 HB2 ALA 95 2HB ALA 95 -14.088 -15.440 -12.322 679 HB3 ALA 95 3HB ALA 95 -12.495 -15.358 -11.571 680 H ARG 96 H ARG 96 -16.183 -12.958 -10.253 681 HA ARG 96 HA ARG 96 -17.005 -12.447 -12.938 682 HB2 ARG 96 1HB ARG 96 -18.109 -11.848 -10.223 683 HB3 ARG 96 2HB ARG 96 -18.777 -11.015 -11.620 684 HG2 ARG 96 1HG ARG 96 -20.171 -12.841 -11.395 685 HG3 ARG 96 2HG ARG 96 -19.024 -13.381 -12.623 686 HD2 ARG 96 1HD ARG 96 -17.869 -14.743 -11.101 687 HD3 ARG 96 2HD ARG 96 -18.594 -13.945 -9.707 688 HE ARG 96 HE ARG 96 -20.706 -15.049 -11.033 689 HH11 ARG 96 1HH1 ARG 96 -17.713 -16.261 -9.731 690 HH12 ARG 96 2HH1 ARG 96 -18.349 -17.835 -9.386 691 HH21 ARG 96 1HH2 ARG 96 -21.555 -17.119 -10.584 692 HH22 ARG 96 2HH2 ARG 96 -20.534 -18.322 -9.873 693 H GLY 97 H GLY 97 -15.287 -10.651 -10.518 694 HA2 GLY 97 1HA GLY 97 -14.013 -8.728 -10.881 695 HA3 GLY 97 2HA GLY 97 -14.802 -8.528 -12.439 696 H ALA 98 H ALA 98 -14.540 -6.260 -11.250 697 HA ALA 98 HA ALA 98 -17.238 -5.566 -10.420 698 HB1 ALA 98 1HB ALA 98 -16.764 -5.451 -8.253 699 HB2 ALA 98 2HB ALA 98 -15.052 -5.757 -8.550 700 HB3 ALA 98 3HB ALA 98 -15.680 -4.110 -8.626 701 H GLY 99 H GLY 99 -14.016 -4.022 -10.381 702 HA2 GLY 99 1HA GLY 99 -15.159 -1.879 -12.061 703 HA3 GLY 99 2HA GLY 99 -13.870 -1.638 -10.891 704 H GLY 100 H GLY 100 -12.733 -0.628 -12.691 705 HA2 GLY 100 1HA GLY 100 -11.929 -2.248 -14.928 706 HA3 GLY 100 2HA GLY 100 -11.341 -0.638 -14.539 707 H VAL 101 H VAL 101 -10.274 -0.984 -12.044 708 HA VAL 101 HA VAL 101 -7.930 -2.607 -12.673 709 HB VAL 101 HB VAL 101 -6.850 -1.462 -10.798 710 HG11 VAL 101 1HG1 VAL 101 -6.833 0.803 -11.740 711 HG12 VAL 101 2HG1 VAL 101 -6.764 -0.430 -13.001 712 HG13 VAL 101 3HG1 VAL 101 -8.276 0.418 -12.677 713 HG21 VAL 101 3HG2 VAL 101 -7.981 -0.448 -9.171 714 HG22 VAL 101 1HG2 VAL 101 -8.841 0.568 -10.328 715 HG23 VAL 101 2HG2 VAL 101 -9.467 -1.030 -9.922 716 H ILE 102 H ILE 102 -10.229 -4.076 -12.033 717 HA ILE 102 HA ILE 102 -9.337 -5.361 -9.550 718 HB ILE 102 HB ILE 102 -12.219 -4.786 -10.246 719 HG12 ILE 102 1HG1 ILE 102 -10.451 -3.806 -7.994 720 HG13 ILE 102 2HG1 ILE 102 -11.075 -2.841 -9.327 721 HG21 ILE 102 1HG2 ILE 102 -12.757 -5.900 -8.134 722 HG22 ILE 102 2HG2 ILE 102 -11.966 -6.999 -9.262 723 HG23 ILE 102 3HG2 ILE 102 -11.056 -6.310 -7.918 724 HD11 ILE 102 3HD1 ILE 102 -12.290 -3.496 -6.806 725 HD12 ILE 102 1HD1 ILE 102 -12.774 -2.307 -8.016 726 HD13 ILE 102 2HD1 ILE 102 -13.324 -3.978 -8.151 727 HA PRO 103 HA PRO 103 -9.562 -8.529 -12.830 728 HB2 PRO 103 1HB PRO 103 -7.616 -10.079 -11.745 729 HB3 PRO 103 2HB PRO 103 -7.271 -8.684 -12.774 730 HG2 PRO 103 1HG PRO 103 -7.226 -8.892 -9.788 731 HG3 PRO 103 2HG PRO 103 -6.074 -8.089 -10.871 732 HD2 PRO 103 1HD PRO 103 -7.978 -6.732 -9.505 733 HD3 PRO 103 2HD PRO 103 -7.403 -6.220 -11.105 734 HA PRO 104 HA PRO 104 -11.990 -11.584 -10.805 735 HB2 PRO 104 1HB PRO 104 -11.243 -13.874 -12.059 736 HB3 PRO 104 2HB PRO 104 -12.222 -12.626 -12.840 737 HG2 PRO 104 1HG PRO 104 -9.281 -13.141 -13.059 738 HG3 PRO 104 2HG PRO 104 -10.445 -12.744 -14.336 739 HD2 PRO 104 1HD PRO 104 -8.780 -10.900 -13.260 740 HD3 PRO 104 2HD PRO 104 -10.404 -10.492 -13.849 741 H ASN 105 H ASN 105 -8.604 -11.641 -10.544 742 HA ASN 105 HA ASN 105 -8.750 -13.669 -8.410 743 HB2 ASN 105 1HB ASN 105 -7.333 -14.301 -10.377 744 HB3 ASN 105 2HB ASN 105 -6.303 -12.917 -10.022 745 HD21 ASN 105 2HD2 ASN 105 -7.837 -15.440 -8.051 746 HD22 ASN 105 1HD2 ASN 105 -6.385 -15.936 -7.255 747 H ALA 106 H ALA 106 -8.960 -10.563 -8.618 748 HA ALA 106 HA ALA 106 -6.775 -9.571 -7.076 749 HB1 ALA 106 1HB ALA 106 -7.636 -7.571 -7.553 750 HB2 ALA 106 2HB ALA 106 -8.803 -8.434 -8.555 751 HB3 ALA 106 3HB ALA 106 -9.215 -8.002 -6.896 752 H THR 107 H THR 107 -6.696 -9.025 -4.902 753 HA THR 107 HA THR 107 -8.587 -10.496 -3.209 754 HB THR 107 HB THR 107 -6.189 -9.268 -1.981 755 HG1 THR 107 HG1 THR 107 -4.791 -10.286 -3.194 756 HG21 THR 107 3HG2 THR 107 -7.151 -12.113 -1.829 757 HG22 THR 107 1HG2 THR 107 -7.906 -10.822 -0.894 758 HG23 THR 107 2HG2 THR 107 -6.202 -11.208 -0.650 759 H LEU 108 H LEU 108 -9.543 -9.535 -1.387 760 HA LEU 108 HA LEU 108 -9.440 -6.595 -1.299 761 HB2 LEU 108 1HB LEU 108 -11.933 -8.235 -0.898 762 HB3 LEU 108 2HB LEU 108 -11.807 -6.479 -0.967 763 HG LEU 108 HG LEU 108 -11.209 -8.280 -3.307 764 HD11 LEU 108 1HD1 LEU 108 -13.566 -6.938 -3.831 765 HD12 LEU 108 2HD1 LEU 108 -13.753 -7.485 -2.165 766 HD13 LEU 108 3HD1 LEU 108 -13.399 -8.650 -3.440 767 HD21 LEU 108 3HD2 LEU 108 -10.249 -6.320 -3.917 768 HD22 LEU 108 1HD2 LEU 108 -11.244 -5.362 -2.819 769 HD23 LEU 108 2HD2 LEU 108 -11.912 -5.923 -4.352 770 H VAL 109 H VAL 109 -9.121 -5.753 0.663 771 HA VAL 109 HA VAL 109 -9.173 -7.577 2.964 772 HB VAL 109 HB VAL 109 -7.955 -4.842 3.055 773 HG11 VAL 109 1HG1 VAL 109 -8.096 -7.133 4.759 774 HG12 VAL 109 2HG1 VAL 109 -6.409 -6.809 4.352 775 HG13 VAL 109 3HG1 VAL 109 -7.399 -5.546 5.085 776 HG21 VAL 109 3HG2 VAL 109 -7.011 -5.768 1.049 777 HG22 VAL 109 1HG2 VAL 109 -5.803 -5.861 2.331 778 HG23 VAL 109 2HG2 VAL 109 -6.695 -7.305 1.854 779 H PHE 110 H PHE 110 -10.150 -6.978 4.918 780 HA PHE 110 HA PHE 110 -11.781 -4.562 4.960 781 HB2 PHE 110 1HB PHE 110 -12.854 -7.358 4.957 782 HB3 PHE 110 2HB PHE 110 -13.694 -6.110 5.871 783 HD1 PHE 110 HD1 PHE 110 -12.526 -7.053 2.493 784 HD2 PHE 110 HD2 PHE 110 -15.073 -4.541 4.800 785 HE1 PHE 110 HE1 PHE 110 -13.658 -6.317 0.436 786 HE2 PHE 110 HE2 PHE 110 -16.209 -3.802 2.746 787 HZ PHE 110 HZ PHE 110 -15.503 -4.690 0.561 788 H GLU 111 H GLU 111 -11.889 -3.667 6.936 789 HA GLU 111 HA GLU 111 -10.641 -5.137 9.143 790 HB2 GLU 111 1HB GLU 111 -9.634 -2.991 8.653 791 HB3 GLU 111 2HB GLU 111 -11.196 -2.192 8.765 792 HG2 GLU 111 1HG GLU 111 -10.133 -3.691 11.113 793 HG3 GLU 111 2HG GLU 111 -9.518 -2.080 10.746 794 H VAL 112 H VAL 112 -11.888 -6.029 10.635 795 HA VAL 112 HA VAL 112 -14.593 -4.937 11.051 796 HB VAL 112 HB VAL 112 -13.694 -7.724 11.766 797 HG11 VAL 112 1HG1 VAL 112 -15.679 -6.863 12.926 798 HG12 VAL 112 2HG1 VAL 112 -16.440 -6.540 11.367 799 HG13 VAL 112 3HG1 VAL 112 -16.075 -8.198 11.846 800 HG21 VAL 112 3HG2 VAL 112 -13.426 -7.435 9.365 801 HG22 VAL 112 1HG2 VAL 112 -14.806 -8.478 9.712 802 HG23 VAL 112 2HG2 VAL 112 -15.066 -6.798 9.243 803 H GLU 113 H GLU 113 -15.133 -4.180 13.003 804 HA GLU 113 HA GLU 113 -13.457 -4.888 15.310 805 HB2 GLU 113 1HB GLU 113 -13.604 -2.509 16.068 806 HB3 GLU 113 2HB GLU 113 -12.632 -2.746 14.623 807 HG2 GLU 113 1HG GLU 113 -14.794 -2.155 13.348 808 HG3 GLU 113 2HG GLU 113 -15.334 -1.498 14.892 809 H LEU 114 H LEU 114 -14.694 -5.746 16.830 810 HA LEU 114 HA LEU 114 -17.542 -5.501 16.795 811 HB2 LEU 114 1HB LEU 114 -15.909 -7.412 17.667 812 HB3 LEU 114 2HB LEU 114 -16.135 -6.551 19.188 813 HG LEU 114 HG LEU 114 -17.744 -8.212 19.285 814 HD11 LEU 114 1HD1 LEU 114 -19.194 -5.912 17.985 815 HD12 LEU 114 2HD1 LEU 114 -18.705 -5.979 19.677 816 HD13 LEU 114 3HD1 LEU 114 -19.890 -7.127 19.057 817 HD21 LEU 114 3HD2 LEU 114 -18.084 -9.392 17.427 818 HD22 LEU 114 1HD2 LEU 114 -17.634 -8.035 16.394 819 HD23 LEU 114 2HD2 LEU 114 -19.288 -8.180 16.988 820 H LEU 115 H LEU 115 -18.775 -4.041 17.778 821 HA LEU 115 HA LEU 115 -17.510 -2.208 19.689 822 HB2 LEU 115 1HB LEU 115 -20.198 -1.801 18.430 823 HB3 LEU 115 2HB LEU 115 -19.096 -0.598 19.098 824 HG LEU 115 HG LEU 115 -18.859 -2.055 16.471 825 HD11 LEU 115 1HD1 LEU 115 -20.161 0.280 17.149 826 HD12 LEU 115 2HD1 LEU 115 -19.646 -0.197 15.532 827 HD13 LEU 115 3HD1 LEU 115 -18.611 0.837 16.518 828 HD21 LEU 115 3HD2 LEU 115 -16.643 -1.997 17.071 829 HD22 LEU 115 1HD2 LEU 115 -16.836 -0.554 18.067 830 HD23 LEU 115 2HD2 LEU 115 -16.822 -0.416 16.308 831 H ASP 116 H ASP 116 -20.234 -4.388 19.273 832 HA ASP 116 HA ASP 116 -20.444 -4.958 22.015 833 HB2 ASP 116 1HB ASP 116 -21.462 -2.537 21.707 834 HB3 ASP 116 2HB ASP 116 -22.872 -3.440 21.158 835 H VAL 117 H VAL 117 -22.320 -6.358 22.507 836 HA VAL 117 HA VAL 117 -23.183 -7.793 20.084 837 HB VAL 117 HB VAL 117 -23.586 -9.717 21.694 838 HG11 VAL 117 1HG1 VAL 117 -20.907 -9.906 21.978 839 HG12 VAL 117 2HG1 VAL 117 -21.763 -10.220 20.467 840 HG13 VAL 117 3HG1 VAL 117 -21.012 -8.649 20.746 841 HG21 VAL 117 3HG2 VAL 117 -21.597 -8.747 23.577 842 HG22 VAL 117 1HG2 VAL 117 -23.082 -7.796 23.609 843 HG23 VAL 117 2HG2 VAL 117 -23.144 -9.539 23.875 844 H13 JZF 130 1H3 JZF 130 -17.267 -4.710 -0.378 845 H23 JZF 130 2H3 JZF 130 -17.600 -3.778 1.070 846 H4 JZF 130 H4 JZF 130 -19.234 -3.841 -1.492 847 H15 JZF 130 1H5 JZF 130 -20.710 -2.176 -0.504 848 H25 JZF 130 2H5 JZF 130 -19.786 -2.159 0.990 849 H17 JZF 130 1H7 JZF 130 -17.641 -1.477 -0.455 850 H27 JZF 130 2H7 JZF 130 -17.044 -2.626 -1.608 851 H8 JZF 130 H8 JZF 130 -19.526 -1.518 -2.507 852 H9 JZF 130 H9 JZF 130 -16.880 -2.012 -3.723 853 H1OH JZF 130 1HO JZF 130 -19.223 0.560 -2.447 854 H11 JZF 130 H11 JZF 130 -17.186 -3.451 -5.854 855 H112 JZF 130 1H12 JZF 130 -18.933 -1.278 -7.116 856 H212 JZF 130 2H12 JZF 130 -17.483 -1.970 -7.827 857 H13A JZF 130 H13 JZF 130 -17.171 0.297 -6.763 858 H114 JZF 130 1H14 JZF 130 -17.097 0.463 -4.304 859 H214 JZF 130 2H14 JZF 130 -18.695 0.152 -4.930 860 H115 JZF 130 1H15 JZF 130 -22.081 -5.847 1.887 861 H215 JZF 130 2H15 JZF 130 -20.624 -6.715 2.372 862 H116 JZF 130 1H16 JZF 130 -21.863 -7.291 -1.993 863 H216 JZF 130 2H16 JZF 130 -20.147 -7.214 -2.491 864 H117 JZF 130 2H17 JZF 130 -19.833 -9.574 -2.144 865 H217 JZF 130 3H17 JZF 130 -21.281 -9.706 -1.127 866 H317 JZF 130 1H17 JZF 130 -21.444 -9.485 -2.877 867 H118 JZF 130 1H18 JZF 130 -18.793 -4.038 -7.801 868 H218 JZF 130 2H18 JZF 130 -18.976 -4.968 -6.308 869 H318 JZF 130 3H18 JZF 130 -20.115 -3.664 -6.684 870 H119 JZF 130 3H19 JZF 130 -15.037 -0.297 -5.486 871 H219 JZF 130 1H19 JZF 130 -15.504 -1.993 -5.642 872 H319 JZF 130 2H19 JZF 130 -15.172 -1.036 -7.086 Start of MODEL 13 1 H1 GLY 1 H GLY 1 1.137 -8.805 19.203 2 HA2 GLY 1 1HA GLY 1 3.777 -8.453 19.391 3 HA3 GLY 1 2HA GLY 1 3.065 -9.164 17.950 4 HA PRO 2 HA PRO 2 3.784 -4.455 17.025 5 HB2 PRO 2 1HB PRO 2 5.406 -3.148 18.766 6 HB3 PRO 2 2HB PRO 2 3.650 -3.212 18.952 7 HG2 PRO 2 1HG PRO 2 5.759 -4.846 20.310 8 HG3 PRO 2 2HG PRO 2 4.307 -4.097 20.999 9 HD2 PRO 2 1HD PRO 2 4.432 -6.729 20.373 10 HD3 PRO 2 2HD PRO 2 2.929 -5.790 20.259 11 H GLY 3 H GLY 3 5.743 -3.236 16.249 12 HA2 GLY 3 1HA GLY 3 7.884 -3.149 15.390 13 HA3 GLY 3 2HA GLY 3 8.316 -4.480 16.453 14 H SER 4 H SER 4 7.944 -3.570 13.290 15 HA SER 4 HA SER 4 7.877 -4.672 11.298 16 HB2 SER 4 1HB SER 4 9.844 -5.796 12.613 17 HB3 SER 4 2HB SER 4 8.759 -7.185 12.680 18 HG SER 4 HG SER 4 10.320 -6.809 10.780 19 H MET 5 H MET 5 5.433 -4.466 11.955 20 HA MET 5 HA MET 5 4.087 -6.960 12.449 21 HB2 MET 5 1HB MET 5 3.070 -4.216 11.704 22 HB3 MET 5 2HB MET 5 2.020 -5.592 12.018 23 HG2 MET 5 1HG MET 5 2.735 -5.717 14.286 24 HG3 MET 5 2HG MET 5 4.005 -4.527 14.007 25 HE1 MET 5 3HE MET 5 2.428 -1.234 13.755 26 HE2 MET 5 1HE MET 5 3.530 -2.348 12.945 27 HE3 MET 5 2HE MET 5 1.917 -2.072 12.289 28 H THR 6 H THR 6 2.685 -8.045 11.008 29 HA THR 6 HA THR 6 2.696 -7.315 8.203 30 HB THR 6 HB THR 6 4.768 -8.555 8.292 31 HG1 THR 6 HG1 THR 6 2.835 -10.369 7.275 32 HG21 THR 6 3HG2 THR 6 4.853 -10.880 9.057 33 HG22 THR 6 1HG2 THR 6 3.159 -10.790 9.537 34 HG23 THR 6 2HG2 THR 6 4.364 -9.801 10.363 35 H VAL 7 H VAL 7 1.258 -8.665 6.915 36 HA VAL 7 HA VAL 7 -1.085 -9.406 8.413 37 HB VAL 7 HB VAL 7 -1.371 -8.244 6.306 38 HG11 VAL 7 1HG1 VAL 7 -0.197 -8.700 4.473 39 HG12 VAL 7 2HG1 VAL 7 0.690 -9.901 5.414 40 HG13 VAL 7 3HG1 VAL 7 -0.729 -10.381 4.482 41 HG21 VAL 7 3HG2 VAL 7 -3.023 -9.999 7.100 42 HG22 VAL 7 1HG2 VAL 7 -3.107 -9.555 5.395 43 HG23 VAL 7 2HG2 VAL 7 -2.328 -11.063 5.877 44 H VAL 8 H VAL 8 -1.644 -11.376 9.070 45 HA VAL 8 HA VAL 8 0.028 -13.641 8.312 46 HB VAL 8 HB VAL 8 -2.186 -13.527 10.364 47 HG11 VAL 8 1HG1 VAL 8 -1.937 -15.770 10.012 48 HG12 VAL 8 2HG1 VAL 8 -0.255 -15.617 9.499 49 HG13 VAL 8 3HG1 VAL 8 -0.669 -15.517 11.211 50 HG21 VAL 8 3HG2 VAL 8 0.797 -13.254 10.730 51 HG22 VAL 8 1HG2 VAL 8 -0.397 -11.971 10.928 52 HG23 VAL 8 2HG2 VAL 8 -0.395 -13.351 12.027 53 H THR 9 H THR 9 -0.557 -15.029 6.791 54 HA THR 9 HA THR 9 -3.354 -15.072 5.907 55 HB THR 9 HB THR 9 -0.980 -16.282 4.486 56 HG1 THR 9 HG1 THR 9 -0.706 -14.018 4.674 57 HG21 THR 9 3HG2 THR 9 -2.711 -17.206 3.358 58 HG22 THR 9 1HG2 THR 9 -2.777 -15.626 2.579 59 HG23 THR 9 2HG2 THR 9 -3.862 -15.994 3.919 60 H THR 10 H THR 10 -4.425 -17.061 5.509 61 HA THR 10 HA THR 10 -3.373 -19.297 7.115 62 HB THR 10 HB THR 10 -5.618 -19.977 7.592 63 HG1 THR 10 HG1 THR 10 -7.340 -18.468 6.720 64 HG21 THR 10 3HG2 THR 10 -5.802 -17.001 7.884 65 HG22 THR 10 1HG2 THR 10 -4.573 -17.907 8.765 66 HG23 THR 10 2HG2 THR 10 -6.281 -18.265 9.016 67 H GLU 11 H GLU 11 -4.815 -21.381 6.367 68 HA GLU 11 HA GLU 11 -3.805 -21.978 3.749 69 HB2 GLU 11 1HB GLU 11 -5.514 -23.598 5.645 70 HB3 GLU 11 2HB GLU 11 -4.838 -24.211 4.142 71 HG2 GLU 11 1HG GLU 11 -3.340 -24.964 5.723 72 HG3 GLU 11 2HG GLU 11 -2.570 -23.495 5.129 73 H SER 12 H SER 12 -6.840 -20.986 5.085 74 HA SER 12 HA SER 12 -8.478 -21.864 2.916 75 HB2 SER 12 1HB SER 12 -9.152 -21.214 5.356 76 HB3 SER 12 2HB SER 12 -9.226 -19.575 4.710 77 HG SER 12 HG SER 12 -11.065 -21.445 4.543 78 H GLY 13 H GLY 13 -6.481 -19.101 3.512 79 HA2 GLY 13 1HA GLY 13 -5.773 -17.910 1.468 80 HA3 GLY 13 2HA GLY 13 -7.465 -17.901 0.996 81 H LEU 14 H LEU 14 -8.551 -17.215 3.535 82 HA LEU 14 HA LEU 14 -8.292 -14.389 3.404 83 HB2 LEU 14 1HB LEU 14 -10.394 -15.167 4.049 84 HB3 LEU 14 2HB LEU 14 -9.718 -16.285 5.231 85 HG LEU 14 HG LEU 14 -9.317 -13.389 5.726 86 HD11 LEU 14 1HD1 LEU 14 -11.717 -13.855 6.959 87 HD12 LEU 14 2HD1 LEU 14 -11.944 -14.610 5.381 88 HD13 LEU 14 3HD1 LEU 14 -11.485 -12.910 5.488 89 HD21 LEU 14 3HD2 LEU 14 -8.822 -14.139 7.758 90 HD22 LEU 14 1HD2 LEU 14 -8.954 -15.777 7.117 91 HD23 LEU 14 2HD2 LEU 14 -10.351 -15.011 7.875 92 H LYS 15 H LYS 15 -7.263 -12.961 4.739 93 HA LYS 15 HA LYS 15 -5.331 -14.130 6.626 94 HB2 LYS 15 1HB LYS 15 -5.167 -11.380 5.403 95 HB3 LYS 15 2HB LYS 15 -3.892 -12.283 6.210 96 HG2 LYS 15 1HG LYS 15 -3.806 -13.862 4.379 97 HG3 LYS 15 2HG LYS 15 -5.152 -13.044 3.582 98 HD2 LYS 15 1HD LYS 15 -3.576 -10.949 3.791 99 HD3 LYS 15 2HD LYS 15 -2.315 -12.179 3.899 100 HE2 LYS 15 1HE LYS 15 -3.394 -13.179 1.794 101 HE3 LYS 15 2HE LYS 15 -4.219 -11.628 1.646 102 HZ1 LYS 15 3HZ LYS 15 -1.414 -11.327 2.107 103 HZ2 LYS 15 1HZ LYS 15 -2.381 -10.669 0.885 104 HZ3 LYS 15 2HZ LYS 15 -1.730 -12.219 0.705 105 H TYR 16 H TYR 16 -4.733 -12.650 8.468 106 HA TYR 16 HA TYR 16 -6.862 -10.870 9.344 107 HB2 TYR 16 1HB TYR 16 -7.484 -12.036 11.252 108 HB3 TYR 16 2HB TYR 16 -7.280 -13.339 10.087 109 HD1 TYR 16 HD1 TYR 16 -5.210 -14.737 10.159 110 HD2 TYR 16 HD2 TYR 16 -6.124 -11.898 13.194 111 HE1 TYR 16 HE1 TYR 16 -3.601 -15.834 11.662 112 HE2 TYR 16 HE2 TYR 16 -4.517 -12.986 14.704 113 HH TYR 16 HH TYR 16 -3.539 -15.548 14.812 114 H GLU 17 H GLU 17 -6.156 -9.262 10.661 115 HA GLU 17 HA GLU 17 -3.494 -9.474 11.857 116 HB2 GLU 17 1HB GLU 17 -2.997 -8.417 9.774 117 HB3 GLU 17 2HB GLU 17 -4.369 -7.329 9.925 118 HG2 GLU 17 1HG GLU 17 -2.156 -6.282 10.359 119 HG3 GLU 17 2HG GLU 17 -3.320 -6.112 11.672 120 H ASP 18 H ASP 18 -3.631 -8.910 13.915 121 HA ASP 18 HA ASP 18 -5.939 -7.585 14.965 122 HB2 ASP 18 1HB ASP 18 -5.021 -7.989 17.105 123 HB3 ASP 18 2HB ASP 18 -4.534 -9.373 16.130 124 H LEU 19 H LEU 19 -6.190 -5.512 15.625 125 HA LEU 19 HA LEU 19 -3.897 -3.697 15.260 126 HB2 LEU 19 1HB LEU 19 -6.762 -3.403 14.443 127 HB3 LEU 19 2HB LEU 19 -5.767 -1.982 14.750 128 HG LEU 19 HG LEU 19 -4.154 -3.108 13.021 129 HD11 LEU 19 1HD1 LEU 19 -6.554 -4.071 11.649 130 HD12 LEU 19 2HD1 LEU 19 -6.072 -5.040 13.041 131 HD13 LEU 19 3HD1 LEU 19 -4.932 -4.760 11.725 132 HD21 LEU 19 3HD2 LEU 19 -5.185 -0.959 12.675 133 HD22 LEU 19 1HD2 LEU 19 -6.728 -1.720 12.286 134 HD23 LEU 19 2HD2 LEU 19 -5.349 -1.921 11.205 135 H THR 20 H THR 20 -6.878 -4.361 17.021 136 HA THR 20 HA THR 20 -5.797 -2.874 19.300 137 HB THR 20 HB THR 20 -8.715 -2.591 18.669 138 HG1 THR 20 HG1 THR 20 -8.009 -0.491 17.720 139 HG21 THR 20 3HG2 THR 20 -6.701 -1.284 20.428 140 HG22 THR 20 1HG2 THR 20 -8.366 -1.749 20.772 141 HG23 THR 20 2HG2 THR 20 -8.033 -0.303 19.818 142 H GLU 21 H GLU 21 -5.707 -4.252 20.939 143 HA GLU 21 HA GLU 21 -6.849 -6.761 21.060 144 HB2 GLU 21 1HB GLU 21 -5.045 -5.574 22.564 145 HB3 GLU 21 2HB GLU 21 -6.427 -5.229 23.594 146 HG2 GLU 21 1HG GLU 21 -6.857 -7.516 23.957 147 HG3 GLU 21 2HG GLU 21 -5.772 -8.003 22.656 148 H GLY 22 H GLY 22 -8.448 -7.540 22.732 149 HA2 GLY 22 1HA GLY 22 -10.472 -5.800 23.697 150 HA3 GLY 22 2HA GLY 22 -10.988 -6.553 22.196 151 H SER 23 H SER 23 -10.041 -7.139 25.524 152 HA SER 23 HA SER 23 -10.567 -9.955 25.428 153 HB2 SER 23 1HB SER 23 -10.572 -9.541 28.039 154 HB3 SER 23 2HB SER 23 -9.068 -9.471 27.120 155 HG SER 23 HG SER 23 -10.428 -7.476 28.428 156 H GLY 24 H GLY 24 -12.708 -9.845 24.459 157 HA2 GLY 24 1HA GLY 24 -14.784 -9.335 26.500 158 HA3 GLY 24 2HA GLY 24 -15.015 -8.906 24.811 159 H ALA 25 H ALA 25 -15.897 -10.368 23.481 160 HA ALA 25 HA ALA 25 -15.697 -13.202 24.017 161 HB1 ALA 25 1HB ALA 25 -18.508 -12.456 23.701 162 HB2 ALA 25 2HB ALA 25 -17.758 -13.630 24.783 163 HB3 ALA 25 3HB ALA 25 -17.785 -11.921 25.219 164 H GLU 26 H GLU 26 -15.932 -14.416 22.197 165 HA GLU 26 HA GLU 26 -15.956 -13.045 19.688 166 HB2 GLU 26 1HB GLU 26 -14.563 -15.023 20.032 167 HB3 GLU 26 2HB GLU 26 -15.995 -16.002 20.316 168 HG2 GLU 26 1HG GLU 26 -16.729 -15.603 18.024 169 HG3 GLU 26 2HG GLU 26 -15.299 -14.613 17.738 170 H ALA 27 H ALA 27 -17.548 -12.860 18.204 171 HA ALA 27 HA ALA 27 -20.231 -13.052 18.979 172 HB1 ALA 27 1HB ALA 27 -19.130 -12.934 16.174 173 HB2 ALA 27 2HB ALA 27 -20.774 -12.530 16.673 174 HB3 ALA 27 3HB ALA 27 -19.419 -11.543 17.220 175 H ARG 28 H ARG 28 -21.915 -14.427 18.244 176 HA ARG 28 HA ARG 28 -21.008 -17.074 17.320 177 HB2 ARG 28 1HB ARG 28 -22.075 -16.505 19.813 178 HB3 ARG 28 2HB ARG 28 -23.454 -17.117 18.908 179 HG2 ARG 28 1HG ARG 28 -22.566 -19.210 18.696 180 HG3 ARG 28 2HG ARG 28 -20.901 -18.631 18.785 181 HD2 ARG 28 1HD ARG 28 -21.399 -18.051 21.211 182 HD3 ARG 28 2HD ARG 28 -22.869 -19.006 21.026 183 HE ARG 28 HE ARG 28 -20.614 -20.493 20.185 184 HH11 ARG 28 1HH1 ARG 28 -22.207 -19.315 23.048 185 HH12 ARG 28 2HH1 ARG 28 -21.616 -20.590 24.060 186 HH21 ARG 28 1HH2 ARG 28 -19.829 -22.178 21.508 187 HH22 ARG 28 2HH2 ARG 28 -20.263 -22.218 23.183 188 H ALA 29 H ALA 29 -22.221 -18.078 15.776 189 HA ALA 29 HA ALA 29 -23.818 -16.526 14.076 190 HB1 ALA 29 1HB ALA 29 -22.707 -18.403 13.160 191 HB2 ALA 29 2HB ALA 29 -23.466 -19.504 14.311 192 HB3 ALA 29 3HB ALA 29 -24.434 -18.744 13.047 193 H GLY 30 H GLY 30 -25.830 -15.825 14.333 194 HA2 GLY 30 1HA GLY 30 -28.182 -16.510 14.540 195 HA3 GLY 30 2HA GLY 30 -27.691 -17.487 15.916 196 H GLN 31 H GLN 31 -25.846 -15.103 16.608 197 HA GLN 31 HA GLN 31 -27.909 -13.652 18.107 198 HB2 GLN 31 1HB GLN 31 -26.400 -13.355 19.808 199 HB3 GLN 31 2HB GLN 31 -25.799 -14.865 19.137 200 HG2 GLN 31 1HG GLN 31 -24.133 -13.608 17.844 201 HG3 GLN 31 2HG GLN 31 -24.717 -12.114 18.575 202 HE21 GLN 31 2HE2 GLN 31 -24.129 -11.602 20.634 203 HE22 GLN 31 1HE2 GLN 31 -22.981 -12.508 21.553 204 H THR 32 H THR 32 -28.036 -11.428 18.098 205 HA THR 32 HA THR 32 -26.856 -10.134 15.776 206 HB THR 32 HB THR 32 -28.716 -8.807 17.734 207 HG1 THR 32 HG1 THR 32 -30.226 -10.148 17.130 208 HG21 THR 32 3HG2 THR 32 -27.462 -7.673 15.730 209 HG22 THR 32 1HG2 THR 32 -29.157 -7.303 16.041 210 HG23 THR 32 2HG2 THR 32 -28.723 -8.444 14.769 211 H VAL 33 H VAL 33 -25.376 -8.519 15.822 212 HA VAL 33 HA VAL 33 -24.616 -7.322 18.372 213 HB VAL 33 HB VAL 33 -22.287 -7.818 18.178 214 HG11 VAL 33 1HG1 VAL 33 -22.269 -10.246 18.436 215 HG12 VAL 33 2HG1 VAL 33 -23.657 -9.530 19.258 216 HG13 VAL 33 3HG1 VAL 33 -23.872 -10.341 17.707 217 HG21 VAL 33 3HG2 VAL 33 -22.982 -9.172 15.573 218 HG22 VAL 33 1HG2 VAL 33 -22.022 -7.707 15.784 219 HG23 VAL 33 2HG2 VAL 33 -21.407 -9.256 16.361 220 H SER 34 H SER 34 -23.247 -5.438 18.130 221 HA SER 34 HA SER 34 -23.617 -4.161 15.504 222 HB2 SER 34 1HB SER 34 -24.503 -3.267 17.909 223 HB3 SER 34 2HB SER 34 -22.934 -2.467 17.830 224 HG SER 34 HG SER 34 -25.110 -1.659 16.697 225 H VAL 35 H VAL 35 -21.855 -3.968 14.308 226 HA VAL 35 HA VAL 35 -19.313 -3.288 15.588 227 HB VAL 35 HB VAL 35 -18.057 -4.981 14.595 228 HG11 VAL 35 1HG1 VAL 35 -18.857 -6.894 15.578 229 HG12 VAL 35 2HG1 VAL 35 -19.853 -5.678 16.379 230 HG13 VAL 35 3HG1 VAL 35 -20.511 -6.614 15.036 231 HG21 VAL 35 3HG2 VAL 35 -19.470 -6.604 12.979 232 HG22 VAL 35 1HG2 VAL 35 -20.280 -5.071 12.657 233 HG23 VAL 35 2HG2 VAL 35 -18.542 -5.221 12.399 234 H HIS 36 H HIS 36 -17.670 -2.574 13.991 235 HA HIS 36 HA HIS 36 -18.977 -1.193 11.743 236 HB2 HIS 36 1HB HIS 36 -16.903 -0.388 13.688 237 HB3 HIS 36 2HB HIS 36 -16.618 0.119 12.026 238 HD1 HIS 36 HD1 HIS 36 -18.847 1.376 10.930 239 HD2 HIS 36 HD2 HIS 36 -18.444 1.350 15.065 240 HE1 HIS 36 HE1 HIS 36 -20.325 3.233 11.761 241 H TYR 37 H TYR 37 -18.308 -1.560 9.715 242 HA TYR 37 HA TYR 37 -15.905 -3.228 9.351 243 HB2 TYR 37 1HB TYR 37 -16.963 -4.293 7.477 244 HB3 TYR 37 2HB TYR 37 -18.082 -4.361 8.834 245 HD1 TYR 37 HD1 TYR 37 -20.048 -2.827 8.884 246 HD2 TYR 37 HD2 TYR 37 -17.525 -3.146 5.472 247 HE1 TYR 37 HE1 TYR 37 -21.791 -1.776 7.504 248 HE2 TYR 37 HE2 TYR 37 -19.262 -2.094 4.083 249 HH TYR 37 HH TYR 37 -21.227 -0.545 4.453 250 H THR 38 H THR 38 -14.351 -2.481 8.051 251 HA THR 38 HA THR 38 -14.947 -0.096 6.422 252 HB THR 38 HB THR 38 -12.125 -0.506 7.088 253 HG1 THR 38 HG1 THR 38 -12.531 0.325 9.288 254 HG21 THR 38 3HG2 THR 38 -14.045 1.808 7.361 255 HG22 THR 38 1HG2 THR 38 -12.915 1.526 6.038 256 HG23 THR 38 2HG2 THR 38 -12.308 1.902 7.651 257 H GLY 39 H GLY 39 -13.843 0.125 4.414 258 HA2 GLY 39 1HA GLY 39 -12.986 -2.471 3.298 259 HA3 GLY 39 2HA GLY 39 -13.774 -1.202 2.373 260 H TRP 40 H TRP 40 -10.815 -2.533 3.357 261 HA TRP 40 HA TRP 40 -9.369 -0.215 2.251 262 HB2 TRP 40 1HB TRP 40 -8.334 -2.246 4.242 263 HB3 TRP 40 2HB TRP 40 -7.456 -0.848 3.628 264 HD1 TRP 40 HD1 TRP 40 -10.267 0.999 3.967 265 HE1 TRP 40 HE1 TRP 40 -10.721 1.915 6.330 266 HE3 TRP 40 HE3 TRP 40 -7.293 -2.176 6.653 267 HZ2 TRP 40 HZ2 TRP 40 -9.922 1.365 8.981 268 HZ3 TRP 40 HZ3 TRP 40 -7.194 -1.913 9.098 269 HH2 TRP 40 HH2 TRP 40 -8.481 -0.179 10.235 270 H LEU 41 H LEU 41 -7.269 -0.797 1.206 271 HA LEU 41 HA LEU 41 -7.678 -3.133 -0.504 272 HB2 LEU 41 1HB LEU 41 -6.311 -0.535 -0.766 273 HB3 LEU 41 2HB LEU 41 -5.516 -1.898 -1.551 274 HG LEU 41 HG LEU 41 -7.881 -2.296 -2.598 275 HD11 LEU 41 1HD1 LEU 41 -9.331 -0.522 -2.722 276 HD12 LEU 41 2HD1 LEU 41 -8.079 0.669 -2.372 277 HD13 LEU 41 3HD1 LEU 41 -8.721 -0.340 -1.076 278 HD21 LEU 41 3HD2 LEU 41 -5.810 -0.277 -3.372 279 HD22 LEU 41 1HD2 LEU 41 -7.242 -0.525 -4.371 280 HD23 LEU 41 2HD2 LEU 41 -6.138 -1.866 -4.066 281 H THR 42 H THR 42 -5.802 -4.457 -1.095 282 HA THR 42 HA THR 42 -4.510 -5.519 1.156 283 HB THR 42 HB THR 42 -3.351 -6.978 -0.314 284 HG1 THR 42 HG1 THR 42 -3.408 -6.432 -2.662 285 HG21 THR 42 3HG2 THR 42 -6.091 -6.602 -0.502 286 HG22 THR 42 1HG2 THR 42 -5.191 -8.014 -1.051 287 HG23 THR 42 2HG2 THR 42 -5.561 -6.710 -2.180 288 H ASP 43 H ASP 43 -3.746 -2.813 -0.771 289 HA ASP 43 HA ASP 43 -0.916 -2.844 -0.085 290 HB2 ASP 43 1HB ASP 43 -2.383 -0.622 -1.497 291 HB3 ASP 43 2HB ASP 43 -0.665 -1.007 -1.559 292 H GLY 44 H GLY 44 -3.867 -1.571 1.099 293 HA2 GLY 44 1HA GLY 44 -3.833 -0.760 3.404 294 HA3 GLY 44 2HA GLY 44 -2.350 0.096 3.007 295 H GLN 45 H GLN 45 -4.438 0.307 0.424 296 HA GLN 45 HA GLN 45 -5.054 3.069 1.078 297 HB2 GLN 45 1HB GLN 45 -4.364 3.039 -1.102 298 HB3 GLN 45 2HB GLN 45 -4.994 1.424 -1.394 299 HG2 GLN 45 1HG GLN 45 -6.200 3.071 -2.695 300 HG3 GLN 45 2HG GLN 45 -7.258 2.318 -1.502 301 HE21 GLN 45 2HE2 GLN 45 -8.294 4.477 -2.388 302 HE22 GLN 45 1HE2 GLN 45 -8.084 5.833 -1.339 303 H LYS 46 H LYS 46 -6.895 3.627 2.012 304 HA LYS 46 HA LYS 46 -9.077 1.779 2.262 305 HB2 LYS 46 1HB LYS 46 -8.628 3.191 4.136 306 HB3 LYS 46 2HB LYS 46 -8.690 4.640 3.140 307 HG2 LYS 46 1HG LYS 46 -11.096 4.220 2.750 308 HG3 LYS 46 2HG LYS 46 -11.001 2.849 3.858 309 HD2 LYS 46 1HD LYS 46 -11.320 4.224 5.575 310 HD3 LYS 46 2HD LYS 46 -9.839 5.088 5.154 311 HE2 LYS 46 1HE LYS 46 -11.095 6.514 3.627 312 HE3 LYS 46 2HE LYS 46 -12.575 5.632 4.002 313 HZ1 LYS 46 3HZ LYS 46 -11.071 7.526 5.671 314 HZ2 LYS 46 1HZ LYS 46 -11.990 6.320 6.420 315 HZ3 LYS 46 2HZ LYS 46 -12.736 7.433 5.388 316 H PHE 47 H PHE 47 -10.789 1.579 0.979 317 HA PHE 47 HA PHE 47 -11.458 3.801 -0.833 318 HB2 PHE 47 1HB PHE 47 -11.816 2.325 -2.647 319 HB3 PHE 47 2HB PHE 47 -10.284 1.824 -1.940 320 HD1 PHE 47 HD1 PHE 47 -10.519 -0.040 -0.071 321 HD2 PHE 47 HD2 PHE 47 -13.350 0.702 -3.161 322 HE1 PHE 47 HE1 PHE 47 -11.379 -2.332 0.172 323 HE2 PHE 47 HE2 PHE 47 -14.215 -1.589 -2.923 324 HZ PHE 47 HZ PHE 47 -13.230 -3.109 -1.255 325 H ASP 48 H ASP 48 -12.504 2.607 1.806 326 HA ASP 48 HA ASP 48 -15.203 3.231 1.445 327 HB2 ASP 48 1HB ASP 48 -14.532 0.554 0.657 328 HB3 ASP 48 2HB ASP 48 -15.563 0.497 2.084 329 H SER 49 H SER 49 -16.334 3.282 3.386 330 HA SER 49 HA SER 49 -15.222 2.051 5.755 331 HB2 SER 49 1HB SER 49 -15.078 4.265 6.960 332 HB3 SER 49 2HB SER 49 -13.840 4.010 5.730 333 HG SER 49 HG SER 49 -16.245 5.475 5.360 334 H SER 50 H SER 50 -16.755 1.658 7.256 335 HA SER 50 HA SER 50 -19.481 2.058 6.579 336 HB2 SER 50 1HB SER 50 -19.073 0.112 7.822 337 HB3 SER 50 2HB SER 50 -18.062 0.959 8.993 338 HG SER 50 HG SER 50 -20.859 0.870 8.781 339 H LYS 51 H LYS 51 -17.191 3.892 8.380 340 HA LYS 51 HA LYS 51 -18.887 5.320 10.096 341 HB2 LYS 51 1HB LYS 51 -17.101 6.919 10.295 342 HB3 LYS 51 2HB LYS 51 -16.396 5.310 10.206 343 HG2 LYS 51 1HG LYS 51 -16.389 6.015 7.592 344 HG3 LYS 51 2HG LYS 51 -16.158 7.584 8.369 345 HD2 LYS 51 1HD LYS 51 -14.535 5.275 9.320 346 HD3 LYS 51 2HD LYS 51 -14.111 6.023 7.778 347 HE2 LYS 51 1HE LYS 51 -14.578 8.106 9.635 348 HE3 LYS 51 2HE LYS 51 -13.541 6.920 10.426 349 HZ1 LYS 51 3HZ LYS 51 -11.833 7.394 9.078 350 HZ2 LYS 51 1HZ LYS 51 -12.655 8.846 8.796 351 HZ3 LYS 51 2HZ LYS 51 -12.805 7.564 7.704 352 H ASP 52 H ASP 52 -18.492 5.462 6.695 353 HA ASP 52 HA ASP 52 -19.124 8.092 6.091 354 HB2 ASP 52 1HB ASP 52 -18.459 6.333 4.444 355 HB3 ASP 52 2HB ASP 52 -20.079 5.655 4.576 356 H ARG 53 H ARG 53 -21.264 5.401 6.900 357 HA ARG 53 HA ARG 53 -23.659 6.934 6.483 358 HB2 ARG 53 1HB ARG 53 -23.238 4.316 6.427 359 HB3 ARG 53 2HB ARG 53 -23.652 4.448 8.131 360 HG2 ARG 53 1HG ARG 53 -25.818 5.175 7.674 361 HG3 ARG 53 2HG ARG 53 -25.416 5.617 6.013 362 HD2 ARG 53 1HD ARG 53 -26.613 3.636 5.771 363 HD3 ARG 53 2HD ARG 53 -24.932 3.112 5.689 364 HE ARG 53 HE ARG 53 -25.566 2.865 8.321 365 HH11 ARG 53 1HH1 ARG 53 -26.966 1.685 5.360 366 HH12 ARG 53 2HH1 ARG 53 -27.594 0.240 6.080 367 HH21 ARG 53 1HH2 ARG 53 -26.387 0.966 9.281 368 HH22 ARG 53 2HH2 ARG 53 -27.265 -0.168 8.310 369 H ASN 54 H ASN 54 -21.380 6.679 8.973 370 HA ASN 54 HA ASN 54 -21.256 7.562 11.065 371 HB2 ASN 54 1HB ASN 54 -23.872 8.965 10.543 372 HB3 ASN 54 2HB ASN 54 -22.546 9.480 11.581 373 HD21 ASN 54 2HD2 ASN 54 -20.372 9.306 10.068 374 HD22 ASN 54 1HD2 ASN 54 -20.490 10.324 8.677 375 H ASP 55 H ASP 55 -22.063 5.073 11.148 376 HA ASP 55 HA ASP 55 -23.492 4.834 13.539 377 HB2 ASP 55 1HB ASP 55 -25.563 5.251 12.624 378 HB3 ASP 55 2HB ASP 55 -25.108 4.624 11.042 379 HA PRO 56 HA PRO 56 -21.460 0.940 13.301 380 HB2 PRO 56 1HB PRO 56 -22.757 -0.355 15.303 381 HB3 PRO 56 2HB PRO 56 -21.563 0.915 15.596 382 HG2 PRO 56 1HG PRO 56 -24.551 1.090 15.595 383 HG3 PRO 56 2HG PRO 56 -23.389 1.808 16.725 384 HD2 PRO 56 1HD PRO 56 -24.547 3.226 14.730 385 HD3 PRO 56 2HD PRO 56 -22.902 3.560 15.308 386 H PHE 57 H PHE 57 -21.702 -0.983 12.275 387 HA PHE 57 HA PHE 57 -24.242 -1.510 11.002 388 HB2 PHE 57 1HB PHE 57 -21.861 -1.727 9.972 389 HB3 PHE 57 2HB PHE 57 -21.837 -3.292 10.776 390 HD1 PHE 57 HD2 PHE 57 -24.314 -1.347 8.767 391 HD2 PHE 57 HD1 PHE 57 -22.301 -5.045 9.387 392 HE1 PHE 57 HE2 PHE 57 -25.546 -2.330 6.878 393 HE2 PHE 57 HE1 PHE 57 -23.529 -6.034 7.498 394 HZ PHE 57 HZ PHE 57 -25.155 -4.677 6.242 395 H ALA 58 H ALA 58 -25.714 -2.371 12.363 396 HA ALA 58 HA ALA 58 -24.918 -4.615 14.075 397 HB1 ALA 58 1HB ALA 58 -27.666 -3.798 14.385 398 HB2 ALA 58 2HB ALA 58 -26.358 -3.820 15.569 399 HB3 ALA 58 3HB ALA 58 -26.574 -2.419 14.521 400 H PHE 59 H PHE 59 -25.546 -6.647 13.679 401 HA PHE 59 HA PHE 59 -27.913 -7.305 12.227 402 HB2 PHE 59 1HB PHE 59 -26.992 -8.204 10.239 403 HB3 PHE 59 2HB PHE 59 -26.256 -6.615 10.418 404 HD1 PHE 59 HD2 PHE 59 -23.949 -6.561 11.616 405 HD2 PHE 59 HD1 PHE 59 -25.656 -10.043 9.860 406 HE1 PHE 59 HE2 PHE 59 -21.715 -7.581 11.474 407 HE2 PHE 59 HE1 PHE 59 -23.424 -11.068 9.716 408 HZ PHE 59 HZ PHE 59 -21.449 -9.837 10.523 409 H VAL 60 H VAL 60 -27.716 -9.803 11.585 410 HA VAL 60 HA VAL 60 -26.914 -11.129 14.061 411 HB VAL 60 HB VAL 60 -28.624 -12.065 11.757 412 HG11 VAL 60 1HG1 VAL 60 -29.062 -13.867 13.731 413 HG12 VAL 60 2HG1 VAL 60 -27.945 -14.116 12.387 414 HG13 VAL 60 3HG1 VAL 60 -27.341 -13.550 13.945 415 HG21 VAL 60 3HG2 VAL 60 -30.437 -11.517 12.991 416 HG22 VAL 60 1HG2 VAL 60 -29.655 -11.930 14.517 417 HG23 VAL 60 2HG2 VAL 60 -29.315 -10.383 13.742 418 H LEU 61 H LEU 61 -25.251 -12.502 14.208 419 HA LEU 61 HA LEU 61 -23.397 -12.746 12.067 420 HB2 LEU 61 1HB LEU 61 -22.589 -12.710 14.315 421 HB3 LEU 61 2HB LEU 61 -23.585 -14.096 14.752 422 HG LEU 61 HG LEU 61 -22.197 -15.580 13.498 423 HD11 LEU 61 1HD1 LEU 61 -21.254 -14.849 11.626 424 HD12 LEU 61 2HD1 LEU 61 -20.025 -14.073 12.625 425 HD13 LEU 61 3HD1 LEU 61 -21.447 -13.165 12.114 426 HD21 LEU 61 3HD2 LEU 61 -20.604 -15.664 15.060 427 HD22 LEU 61 1HD2 LEU 61 -21.354 -14.214 15.727 428 HD23 LEU 61 2HD2 LEU 61 -19.978 -14.071 14.633 429 H GLY 62 H GLY 62 -22.951 -14.436 10.717 430 HA2 GLY 62 1HA GLY 62 -23.091 -16.690 9.985 431 HA3 GLY 62 2HA GLY 62 -24.502 -16.907 11.009 432 H GLY 63 H GLY 63 -25.411 -14.179 9.841 433 HA2 GLY 63 1HA GLY 63 -26.292 -15.198 7.217 434 HA3 GLY 63 2HA GLY 63 -27.459 -14.554 8.362 435 H GLY 64 H GLY 64 -28.148 -12.656 7.623 436 HA2 GLY 64 1HA GLY 64 -28.109 -10.466 6.932 437 HA3 GLY 64 2HA GLY 64 -26.434 -10.417 7.462 438 H MET 65 H MET 65 -27.030 -12.875 5.210 439 HA MET 65 HA MET 65 -26.237 -13.204 3.098 440 HB2 MET 65 1HB MET 65 -27.752 -10.634 2.959 441 HB3 MET 65 2HB MET 65 -26.852 -11.161 1.543 442 HG2 MET 65 1HG MET 65 -28.082 -13.332 1.674 443 HG3 MET 65 2HG MET 65 -29.079 -12.618 2.939 444 HE1 MET 65 3HE MET 65 -28.146 -11.171 -1.039 445 HE2 MET 65 1HE MET 65 -27.907 -12.825 -0.472 446 HE3 MET 65 2HE MET 65 -29.321 -12.422 -1.447 447 H VAL 66 H VAL 66 -24.102 -12.797 4.430 448 HA VAL 66 HA VAL 66 -22.616 -10.605 3.137 449 HB VAL 66 HB VAL 66 -21.055 -10.651 4.970 450 HG11 VAL 66 1HG1 VAL 66 -22.550 -10.024 6.846 451 HG12 VAL 66 2HG1 VAL 66 -23.000 -9.271 5.315 452 HG13 VAL 66 3HG1 VAL 66 -23.916 -10.650 5.924 453 HG21 VAL 66 3HG2 VAL 66 -20.796 -12.834 5.661 454 HG22 VAL 66 1HG2 VAL 66 -21.761 -12.170 6.979 455 HG23 VAL 66 2HG2 VAL 66 -22.533 -13.134 5.721 456 H ILE 67 H ILE 67 -20.585 -11.019 2.246 457 HA ILE 67 HA ILE 67 -20.259 -13.427 0.889 458 HB ILE 67 HB ILE 67 -17.855 -12.657 0.569 459 HG12 ILE 67 1HG1 ILE 67 -18.765 -10.055 1.751 460 HG13 ILE 67 2HG1 ILE 67 -18.052 -11.285 2.789 461 HG21 ILE 67 1HG2 ILE 67 -18.918 -11.943 -1.258 462 HG22 ILE 67 2HG2 ILE 67 -20.340 -11.451 -0.339 463 HG23 ILE 67 3HG2 ILE 67 -18.960 -10.363 -0.476 464 HD11 ILE 67 3HD1 ILE 67 -16.025 -10.664 2.177 465 HD12 ILE 67 1HD1 ILE 67 -16.414 -10.939 0.480 466 HD13 ILE 67 2HD1 ILE 67 -16.739 -9.370 1.216 467 H LYS 68 H LYS 68 -18.623 -15.064 1.091 468 HA LYS 68 HA LYS 68 -18.535 -16.388 3.480 469 HB2 LYS 68 1HB LYS 68 -16.690 -16.406 1.115 470 HB3 LYS 68 2HB LYS 68 -16.320 -17.385 2.528 471 HG2 LYS 68 1HG LYS 68 -18.627 -18.382 2.286 472 HG3 LYS 68 2HG LYS 68 -18.709 -17.576 0.717 473 HD2 LYS 68 1HD LYS 68 -17.888 -19.612 0.071 474 HD3 LYS 68 2HD LYS 68 -16.373 -18.760 0.379 475 HE2 LYS 68 1HE LYS 68 -16.223 -20.908 1.409 476 HE3 LYS 68 2HE LYS 68 -16.403 -19.710 2.690 477 HZ1 LYS 68 3HZ LYS 68 -18.222 -21.815 1.851 478 HZ2 LYS 68 1HZ LYS 68 -18.944 -20.340 2.262 479 HZ3 LYS 68 2HZ LYS 68 -17.971 -21.147 3.385 480 H GLY 69 H GLY 69 -15.981 -14.252 2.201 481 HA2 GLY 69 1HA GLY 69 -14.188 -14.415 4.301 482 HA3 GLY 69 2HA GLY 69 -14.396 -12.994 3.288 483 H TRP 70 H TRP 70 -17.070 -12.389 4.030 484 HA TRP 70 HA TRP 70 -16.590 -10.843 6.345 485 HB2 TRP 70 1HB TRP 70 -18.915 -11.371 4.570 486 HB3 TRP 70 2HB TRP 70 -19.265 -10.734 6.175 487 HD1 TRP 70 HD1 TRP 70 -16.273 -9.708 3.953 488 HE1 TRP 70 HE1 TRP 70 -16.449 -7.181 3.494 489 HE3 TRP 70 HE3 TRP 70 -20.780 -8.790 6.184 490 HZ2 TRP 70 HZ2 TRP 70 -18.259 -5.078 4.010 491 HZ3 TRP 70 HZ3 TRP 70 -21.663 -6.494 6.158 492 HH2 TRP 70 HH2 TRP 70 -20.427 -4.677 5.093 493 H ASP 71 H ASP 71 -18.829 -13.579 5.851 494 HA ASP 71 HA ASP 71 -19.671 -13.876 8.469 495 HB2 ASP 71 1HB ASP 71 -20.548 -15.078 6.418 496 HB3 ASP 71 2HB ASP 71 -19.185 -16.183 6.581 497 H GLU 72 H GLU 72 -16.747 -15.073 6.916 498 HA GLU 72 HA GLU 72 -15.904 -16.756 9.028 499 HB2 GLU 72 1HB GLU 72 -15.073 -16.521 6.536 500 HB3 GLU 72 2HB GLU 72 -13.929 -15.391 7.248 501 HG2 GLU 72 1HG GLU 72 -14.285 -18.273 8.037 502 HG3 GLU 72 2HG GLU 72 -12.978 -17.620 7.050 503 H GLY 73 H GLY 73 -15.314 -13.354 8.274 504 HA2 GLY 73 1HA GLY 73 -13.461 -12.985 10.440 505 HA3 GLY 73 2HA GLY 73 -14.168 -11.721 9.443 506 H VAL 74 H VAL 74 -16.910 -12.479 9.971 507 HA VAL 74 HA VAL 74 -17.288 -11.008 12.391 508 HB VAL 74 HB VAL 74 -19.383 -12.536 10.846 509 HG11 VAL 74 1HG1 VAL 74 -19.789 -10.010 12.404 510 HG12 VAL 74 2HG1 VAL 74 -20.973 -11.228 11.926 511 HG13 VAL 74 3HG1 VAL 74 -19.811 -11.580 13.206 512 HG21 VAL 74 3HG2 VAL 74 -17.803 -10.307 10.015 513 HG22 VAL 74 1HG2 VAL 74 -19.105 -11.128 9.152 514 HG23 VAL 74 2HG2 VAL 74 -19.473 -9.782 10.231 515 H GLN 75 H GLN 75 -17.306 -14.386 11.513 516 HA GLN 75 HA GLN 75 -18.521 -15.256 13.976 517 HB2 GLN 75 1HB GLN 75 -18.246 -17.471 13.156 518 HB3 GLN 75 2HB GLN 75 -18.703 -16.479 11.778 519 HG2 GLN 75 1HG GLN 75 -16.450 -16.439 10.977 520 HG3 GLN 75 2HG GLN 75 -15.870 -17.242 12.436 521 HE21 GLN 75 2HE2 GLN 75 -18.694 -17.937 10.429 522 HE22 GLN 75 1HE2 GLN 75 -18.218 -19.543 10.005 523 H GLY 76 H GLY 76 -15.643 -13.905 13.429 524 HA2 GLY 76 1HA GLY 76 -14.304 -15.572 15.469 525 HA3 GLY 76 2HA GLY 76 -13.433 -14.841 14.129 526 H MET 77 H MET 77 -15.036 -12.356 14.325 527 HA MET 77 HA MET 77 -13.333 -10.813 15.857 528 HB2 MET 77 1HB MET 77 -14.865 -9.015 15.565 529 HB3 MET 77 2HB MET 77 -14.974 -10.010 14.119 530 HG2 MET 77 1HG MET 77 -16.977 -11.114 15.179 531 HG3 MET 77 2HG MET 77 -16.918 -9.846 16.401 532 HE1 MET 77 3HE MET 77 -19.428 -8.889 15.826 533 HE2 MET 77 1HE MET 77 -19.990 -8.874 14.154 534 HE3 MET 77 2HE MET 77 -19.458 -10.385 14.891 535 H LYS 78 H LYS 78 -13.531 -9.788 17.886 536 HA LYS 78 HA LYS 78 -15.359 -11.143 19.761 537 HB2 LYS 78 1HB LYS 78 -12.562 -10.142 20.330 538 HB3 LYS 78 2HB LYS 78 -13.635 -10.917 21.488 539 HG2 LYS 78 1HG LYS 78 -13.588 -12.966 20.134 540 HG3 LYS 78 2HG LYS 78 -12.464 -12.184 19.020 541 HD2 LYS 78 1HD LYS 78 -10.790 -12.015 20.715 542 HD3 LYS 78 2HD LYS 78 -11.924 -12.529 21.965 543 HE2 LYS 78 1HE LYS 78 -11.481 -14.354 19.666 544 HE3 LYS 78 2HE LYS 78 -10.182 -14.199 20.848 545 HZ1 LYS 78 3HZ LYS 78 -12.587 -14.491 22.239 546 HZ2 LYS 78 1HZ LYS 78 -11.282 -15.566 22.172 547 HZ3 LYS 78 2HZ LYS 78 -12.541 -15.694 21.050 548 H VAL 79 H VAL 79 -16.142 -9.900 21.527 549 HA VAL 79 HA VAL 79 -17.001 -7.333 20.906 550 HB VAL 79 HB VAL 79 -16.702 -8.585 23.640 551 HG11 VAL 79 1HG1 VAL 79 -18.722 -6.891 23.970 552 HG12 VAL 79 2HG1 VAL 79 -17.044 -6.417 24.244 553 HG13 VAL 79 3HG1 VAL 79 -17.842 -6.004 22.726 554 HG21 VAL 79 3HG2 VAL 79 -18.180 -9.630 21.747 555 HG22 VAL 79 1HG2 VAL 79 -18.803 -9.490 23.391 556 HG23 VAL 79 2HG2 VAL 79 -19.282 -8.318 22.163 557 H GLY 80 H GLY 80 -15.939 -5.475 20.778 558 HA2 GLY 80 1HA GLY 80 -14.586 -3.720 21.485 559 HA3 GLY 80 2HA GLY 80 -14.008 -4.732 22.801 560 H GLY 81 H GLY 81 -13.738 -6.570 20.096 561 HA2 GLY 81 1HA GLY 81 -10.877 -5.996 19.918 562 HA3 GLY 81 2HA GLY 81 -11.689 -7.430 19.307 563 H VAL 82 H VAL 82 -9.821 -5.345 18.109 564 HA VAL 82 HA VAL 82 -11.432 -4.871 15.692 565 HB VAL 82 HB VAL 82 -9.382 -2.951 16.805 566 HG11 VAL 82 1HG1 VAL 82 -9.291 -2.176 14.723 567 HG12 VAL 82 2HG1 VAL 82 -10.577 -3.265 14.200 568 HG13 VAL 82 3HG1 VAL 82 -10.978 -1.694 14.894 569 HG21 VAL 82 3HG2 VAL 82 -12.306 -3.164 17.134 570 HG22 VAL 82 1HG2 VAL 82 -11.094 -2.428 18.183 571 HG23 VAL 82 2HG2 VAL 82 -11.684 -1.555 16.768 572 H ARG 83 H ARG 83 -10.605 -5.974 14.053 573 HA ARG 83 HA ARG 83 -7.725 -5.975 13.616 574 HB2 ARG 83 1HB ARG 83 -9.211 -8.587 13.478 575 HB3 ARG 83 2HB ARG 83 -7.473 -8.314 13.494 576 HG2 ARG 83 1HG ARG 83 -7.710 -7.487 15.842 577 HG3 ARG 83 2HG ARG 83 -9.393 -8.016 15.789 578 HD2 ARG 83 1HD ARG 83 -7.182 -9.906 15.083 579 HD3 ARG 83 2HD ARG 83 -7.588 -9.599 16.771 580 HE ARG 83 HE ARG 83 -9.876 -10.269 15.191 581 HH11 ARG 83 1HH1 ARG 83 -7.166 -11.578 16.940 582 HH12 ARG 83 2HH1 ARG 83 -7.929 -13.105 17.238 583 HH21 ARG 83 1HH2 ARG 83 -10.891 -12.275 15.577 584 HH22 ARG 83 2HH2 ARG 83 -10.047 -13.501 16.461 585 H ARG 84 H ARG 84 -7.121 -6.345 11.462 586 HA ARG 84 HA ARG 84 -9.336 -6.070 9.551 587 HB2 ARG 84 1HB ARG 84 -7.681 -5.121 8.017 588 HB3 ARG 84 2HB ARG 84 -7.704 -4.245 9.542 589 HG2 ARG 84 1HG ARG 84 -5.751 -5.840 10.179 590 HG3 ARG 84 2HG ARG 84 -5.614 -6.059 8.433 591 HD2 ARG 84 1HD ARG 84 -5.350 -3.664 8.130 592 HD3 ARG 84 2HD ARG 84 -5.569 -3.402 9.860 593 HE ARG 84 HE ARG 84 -3.402 -5.177 9.274 594 HH11 ARG 84 1HH1 ARG 84 -4.338 -1.832 9.507 595 HH12 ARG 84 2HH1 ARG 84 -2.732 -1.269 9.828 596 HH21 ARG 84 1HH2 ARG 84 -1.282 -4.448 9.696 597 HH22 ARG 84 2HH2 ARG 84 -0.994 -2.758 9.935 598 H LEU 85 H LEU 85 -9.836 -7.744 8.311 599 HA LEU 85 HA LEU 85 -7.826 -9.861 7.929 600 HB2 LEU 85 1HB LEU 85 -10.836 -10.003 7.912 601 HB3 LEU 85 2HB LEU 85 -9.775 -11.346 7.494 602 HG LEU 85 HG LEU 85 -8.817 -10.845 9.922 603 HD11 LEU 85 1HD1 LEU 85 -10.101 -9.656 11.300 604 HD12 LEU 85 2HD1 LEU 85 -11.581 -10.418 10.718 605 HD13 LEU 85 3HD1 LEU 85 -10.896 -9.045 9.849 606 HD21 LEU 85 3HD2 LEU 85 -11.411 -12.304 9.855 607 HD22 LEU 85 1HD2 LEU 85 -9.872 -12.764 10.585 608 HD23 LEU 85 2HD2 LEU 85 -10.088 -12.878 8.838 609 H THR 86 H THR 86 -7.287 -10.509 5.913 610 HA THR 86 HA THR 86 -8.184 -8.856 3.705 611 HB THR 86 HB THR 86 -6.213 -11.136 3.561 612 HG1 THR 86 HG1 THR 86 -5.865 -9.196 5.130 613 HG21 THR 86 3HG2 THR 86 -6.225 -10.576 1.399 614 HG22 THR 86 1HG2 THR 86 -5.469 -9.055 1.869 615 HG23 THR 86 2HG2 THR 86 -7.222 -9.155 1.705 616 H ILE 87 H ILE 87 -10.001 -9.390 2.689 617 HA ILE 87 HA ILE 87 -10.803 -12.193 2.510 618 HB ILE 87 HB ILE 87 -12.294 -9.672 1.772 619 HG12 ILE 87 1HG1 ILE 87 -13.115 -11.554 3.943 620 HG13 ILE 87 2HG1 ILE 87 -11.794 -10.434 4.257 621 HG21 ILE 87 1HG2 ILE 87 -14.202 -11.554 1.909 622 HG22 ILE 87 2HG2 ILE 87 -13.387 -11.107 0.411 623 HG23 ILE 87 3HG2 ILE 87 -12.862 -12.531 1.308 624 HD11 ILE 87 3HD1 ILE 87 -14.134 -9.713 4.928 625 HD12 ILE 87 1HD1 ILE 87 -13.170 -8.565 3.999 626 HD13 ILE 87 2HD1 ILE 87 -14.437 -9.500 3.204 627 HA PRO 88 HA PRO 88 -8.989 -12.155 -1.607 628 HB2 PRO 88 1HB PRO 88 -9.237 -14.832 -1.985 629 HB3 PRO 88 2HB PRO 88 -7.936 -14.113 -1.029 630 HG2 PRO 88 1HG PRO 88 -10.493 -15.369 -0.107 631 HG3 PRO 88 2HG PRO 88 -8.857 -15.548 0.553 632 HD2 PRO 88 1HD PRO 88 -10.708 -13.917 1.669 633 HD3 PRO 88 2HD PRO 88 -8.970 -13.557 1.710 634 HA PRO 89 HA PRO 89 -12.440 -12.324 -4.327 635 HB2 PRO 89 1HB PRO 89 -11.459 -13.593 -6.517 636 HB3 PRO 89 2HB PRO 89 -10.995 -11.946 -6.073 637 HG2 PRO 89 1HG PRO 89 -9.540 -14.519 -5.596 638 HG3 PRO 89 2HG PRO 89 -8.901 -12.955 -6.135 639 HD2 PRO 89 1HD PRO 89 -8.695 -13.807 -3.574 640 HD3 PRO 89 2HD PRO 89 -8.861 -12.092 -3.998 641 H GLN 90 H GLN 90 -10.776 -15.415 -3.900 642 HA GLN 90 HA GLN 90 -12.846 -17.048 -4.919 643 HB2 GLN 90 1HB GLN 90 -11.680 -18.871 -3.636 644 HB3 GLN 90 2HB GLN 90 -10.657 -17.978 -4.753 645 HG2 GLN 90 1HG GLN 90 -9.407 -17.067 -3.105 646 HG3 GLN 90 2HG GLN 90 -10.752 -17.001 -1.968 647 HE21 GLN 90 2HE2 GLN 90 -8.020 -17.955 -1.589 648 HE22 GLN 90 1HE2 GLN 90 -8.155 -19.593 -1.060 649 H LEU 91 H LEU 91 -12.667 -15.202 -2.115 650 HA LEU 91 HA LEU 91 -14.858 -16.752 -0.901 651 HB2 LEU 91 1HB LEU 91 -12.444 -15.522 0.332 652 HB3 LEU 91 2HB LEU 91 -13.943 -15.545 1.257 653 HG LEU 91 HG LEU 91 -13.927 -18.090 0.738 654 HD11 LEU 91 1HD1 LEU 91 -12.136 -18.108 -0.870 655 HD12 LEU 91 2HD1 LEU 91 -11.635 -18.997 0.568 656 HD13 LEU 91 3HD1 LEU 91 -11.037 -17.362 0.290 657 HD21 LEU 91 3HD2 LEU 91 -13.666 -17.090 2.961 658 HD22 LEU 91 1HD2 LEU 91 -11.941 -16.881 2.660 659 HD23 LEU 91 2HD2 LEU 91 -12.629 -18.502 2.753 660 H GLY 92 H GLY 92 -14.299 -14.113 -2.607 661 HA2 GLY 92 1HA GLY 92 -16.285 -12.518 -1.109 662 HA3 GLY 92 2HA GLY 92 -14.927 -11.774 -1.940 663 H TYR 93 H TYR 93 -15.095 -11.298 -4.068 664 HA TYR 93 HA TYR 93 -17.714 -11.511 -5.258 665 HB2 TYR 93 1HB TYR 93 -15.148 -10.321 -6.330 666 HB3 TYR 93 2HB TYR 93 -16.727 -10.177 -7.093 667 HD1 TYR 93 HD1 TYR 93 -18.258 -9.822 -4.426 668 HD2 TYR 93 HD2 TYR 93 -14.791 -7.966 -6.051 669 HE1 TYR 93 HE1 TYR 93 -18.720 -7.807 -3.094 670 HE2 TYR 93 HE2 TYR 93 -15.243 -5.946 -4.722 671 HH TYR 93 HH TYR 93 -17.024 -5.784 -2.168 672 H GLY 94 H GLY 94 -14.453 -12.721 -5.975 673 HA2 GLY 94 1HA GLY 94 -14.164 -14.971 -6.793 674 HA3 GLY 94 2HA GLY 94 -15.707 -14.820 -7.620 675 H ALA 95 H ALA 95 -14.377 -15.660 -9.434 676 HA ALA 95 HA ALA 95 -12.493 -13.815 -10.628 677 HB1 ALA 95 1HB ALA 95 -12.984 -16.588 -10.800 678 HB2 ALA 95 2HB ALA 95 -13.225 -15.916 -12.414 679 HB3 ALA 95 3HB ALA 95 -11.698 -15.658 -11.570 680 H ARG 96 H ARG 96 -15.707 -13.728 -10.418 681 HA ARG 96 HA ARG 96 -16.509 -13.346 -13.127 682 HB2 ARG 96 1HB ARG 96 -17.958 -13.902 -11.049 683 HB3 ARG 96 2HB ARG 96 -17.946 -12.166 -10.767 684 HG2 ARG 96 1HG ARG 96 -19.916 -12.555 -11.947 685 HG3 ARG 96 2HG ARG 96 -18.793 -11.946 -13.164 686 HD2 ARG 96 1HD ARG 96 -18.267 -14.416 -13.622 687 HD3 ARG 96 2HD ARG 96 -19.740 -14.758 -12.716 688 HE ARG 96 HE ARG 96 -20.254 -12.836 -14.721 689 HH11 ARG 96 1HH1 ARG 96 -19.610 -16.231 -14.297 690 HH12 ARG 96 2HH1 ARG 96 -20.471 -16.706 -15.723 691 HH21 ARG 96 1HH2 ARG 96 -21.391 -13.448 -16.601 692 HH22 ARG 96 2HH2 ARG 96 -21.483 -15.122 -17.034 693 H GLY 97 H GLY 97 -15.022 -11.346 -10.734 694 HA2 GLY 97 1HA GLY 97 -13.977 -9.293 -11.121 695 HA3 GLY 97 2HA GLY 97 -14.805 -9.190 -12.668 696 H ALA 98 H ALA 98 -14.657 -6.944 -11.201 697 HA ALA 98 HA ALA 98 -17.426 -6.350 -10.731 698 HB1 ALA 98 1HB ALA 98 -16.215 -5.391 -8.363 699 HB2 ALA 98 2HB ALA 98 -17.506 -6.582 -8.528 700 HB3 ALA 98 3HB ALA 98 -15.822 -7.105 -8.504 701 H GLY 99 H GLY 99 -15.069 -5.496 -12.360 702 HA2 GLY 99 1HA GLY 99 -15.582 -2.870 -12.780 703 HA3 GLY 99 2HA GLY 99 -14.441 -2.829 -11.444 704 H GLY 100 H GLY 100 -13.493 -1.541 -13.451 705 HA2 GLY 100 1HA GLY 100 -12.209 -3.156 -15.446 706 HA3 GLY 100 2HA GLY 100 -11.944 -1.442 -15.162 707 H VAL 101 H VAL 101 -11.096 -1.465 -12.528 708 HA VAL 101 HA VAL 101 -8.424 -2.572 -12.862 709 HB VAL 101 HB VAL 101 -7.801 -1.227 -10.931 710 HG11 VAL 101 1HG1 VAL 101 -8.248 1.001 -11.861 711 HG12 VAL 101 2HG1 VAL 101 -7.786 -0.154 -13.112 712 HG13 VAL 101 3HG1 VAL 101 -9.478 0.305 -12.916 713 HG21 VAL 101 3HG2 VAL 101 -10.758 -0.799 -10.723 714 HG22 VAL 101 1HG2 VAL 101 -9.610 -1.277 -9.472 715 HG23 VAL 101 2HG2 VAL 101 -9.625 0.383 -10.068 716 H ILE 102 H ILE 102 -11.066 -4.001 -11.978 717 HA ILE 102 HA ILE 102 -9.909 -5.318 -9.608 718 HB ILE 102 HB ILE 102 -12.817 -5.134 -10.406 719 HG12 ILE 102 1HG1 ILE 102 -11.280 -3.851 -8.137 720 HG13 ILE 102 2HG1 ILE 102 -11.958 -3.021 -9.533 721 HG21 ILE 102 1HG2 ILE 102 -12.413 -6.007 -7.725 722 HG22 ILE 102 2HG2 ILE 102 -13.213 -6.845 -9.053 723 HG23 ILE 102 3HG2 ILE 102 -11.478 -7.038 -8.806 724 HD11 ILE 102 3HD1 ILE 102 -13.845 -2.727 -8.432 725 HD12 ILE 102 1HD1 ILE 102 -14.045 -4.473 -8.292 726 HD13 ILE 102 2HD1 ILE 102 -13.175 -3.582 -7.043 727 HA PRO 103 HA PRO 103 -9.644 -8.519 -12.857 728 HB2 PRO 103 1HB PRO 103 -7.541 -9.796 -11.708 729 HB3 PRO 103 2HB PRO 103 -7.353 -8.380 -12.748 730 HG2 PRO 103 1HG PRO 103 -7.353 -8.548 -9.760 731 HG3 PRO 103 2HG PRO 103 -6.287 -7.616 -10.828 732 HD2 PRO 103 1HD PRO 103 -8.380 -6.498 -9.523 733 HD3 PRO 103 2HD PRO 103 -7.837 -5.935 -11.116 734 HA PRO 104 HA PRO 104 -11.703 -11.843 -10.847 735 HB2 PRO 104 1HB PRO 104 -10.626 -14.032 -12.037 736 HB3 PRO 104 2HB PRO 104 -11.735 -12.935 -12.868 737 HG2 PRO 104 1HG PRO 104 -8.747 -13.062 -12.996 738 HG3 PRO 104 2HG PRO 104 -9.915 -12.841 -14.312 739 HD2 PRO 104 1HD PRO 104 -8.539 -10.778 -13.224 740 HD3 PRO 104 2HD PRO 104 -10.184 -10.595 -13.865 741 H ASN 105 H ASN 105 -8.346 -11.455 -10.495 742 HA ASN 105 HA ASN 105 -8.289 -13.451 -8.328 743 HB2 ASN 105 1HB ASN 105 -6.052 -13.932 -8.777 744 HB3 ASN 105 2HB ASN 105 -6.727 -13.721 -10.390 745 HD21 ASN 105 2HD2 ASN 105 -6.424 -11.637 -11.417 746 HD22 ASN 105 1HD2 ASN 105 -5.001 -10.723 -11.064 747 H ALA 106 H ALA 106 -8.915 -10.415 -8.579 748 HA ALA 106 HA ALA 106 -6.914 -9.130 -6.991 749 HB1 ALA 106 1HB ALA 106 -9.471 -7.806 -6.888 750 HB2 ALA 106 2HB ALA 106 -7.963 -7.281 -7.638 751 HB3 ALA 106 3HB ALA 106 -9.086 -8.303 -8.536 752 H THR 107 H THR 107 -7.030 -8.493 -4.829 753 HA THR 107 HA THR 107 -9.008 -9.957 -3.203 754 HB THR 107 HB THR 107 -6.137 -9.326 -2.490 755 HG1 THR 107 HG1 THR 107 -5.979 -11.114 -3.678 756 HG21 THR 107 3HG2 THR 107 -7.146 -9.277 -0.426 757 HG22 THR 107 1HG2 THR 107 -6.839 -11.006 -0.582 758 HG23 THR 107 2HG2 THR 107 -8.447 -10.363 -0.915 759 H LEU 108 H LEU 108 -9.885 -8.924 -1.415 760 HA LEU 108 HA LEU 108 -9.265 -6.057 -1.148 761 HB2 LEU 108 1HB LEU 108 -12.016 -7.116 -0.663 762 HB3 LEU 108 2HB LEU 108 -11.504 -5.474 -1.047 763 HG LEU 108 HG LEU 108 -11.439 -7.752 -3.021 764 HD11 LEU 108 1HD1 LEU 108 -13.438 -6.371 -3.959 765 HD12 LEU 108 2HD1 LEU 108 -13.607 -5.836 -2.287 766 HD13 LEU 108 3HD1 LEU 108 -13.706 -7.553 -2.678 767 HD21 LEU 108 3HD2 LEU 108 -9.982 -6.136 -3.813 768 HD22 LEU 108 1HD2 LEU 108 -10.932 -4.806 -3.151 769 HD23 LEU 108 2HD2 LEU 108 -11.506 -5.677 -4.574 770 H VAL 109 H VAL 109 -9.034 -5.285 0.883 771 HA VAL 109 HA VAL 109 -9.267 -7.231 3.070 772 HB VAL 109 HB VAL 109 -7.825 -4.591 3.206 773 HG11 VAL 109 1HG1 VAL 109 -7.615 -5.202 5.335 774 HG12 VAL 109 2HG1 VAL 109 -8.291 -6.799 5.011 775 HG13 VAL 109 3HG1 VAL 109 -6.567 -6.506 4.780 776 HG21 VAL 109 3HG2 VAL 109 -7.021 -7.109 1.889 777 HG22 VAL 109 1HG2 VAL 109 -6.514 -5.449 1.575 778 HG23 VAL 109 2HG2 VAL 109 -5.812 -6.346 2.922 779 H PHE 110 H PHE 110 -10.253 -6.678 5.033 780 HA PHE 110 HA PHE 110 -11.786 -4.186 5.110 781 HB2 PHE 110 1HB PHE 110 -12.907 -6.964 5.149 782 HB3 PHE 110 2HB PHE 110 -13.710 -5.695 6.069 783 HD1 PHE 110 HD1 PHE 110 -12.404 -6.407 2.655 784 HD2 PHE 110 HD2 PHE 110 -15.296 -4.382 5.033 785 HE1 PHE 110 HE1 PHE 110 -13.559 -5.665 0.613 786 HE2 PHE 110 HE2 PHE 110 -16.455 -3.637 2.995 787 HZ PHE 110 HZ PHE 110 -15.588 -4.279 0.782 788 H GLU 111 H GLU 111 -12.186 -3.395 7.157 789 HA GLU 111 HA GLU 111 -10.753 -4.776 9.321 790 HB2 GLU 111 1HB GLU 111 -10.102 -2.411 8.601 791 HB3 GLU 111 2HB GLU 111 -11.617 -1.889 9.323 792 HG2 GLU 111 1HG GLU 111 -10.260 -3.527 11.202 793 HG3 GLU 111 2HG GLU 111 -9.121 -2.336 10.576 794 H VAL 112 H VAL 112 -11.941 -5.779 10.790 795 HA VAL 112 HA VAL 112 -14.717 -4.895 11.212 796 HB VAL 112 HB VAL 112 -13.588 -7.567 12.022 797 HG11 VAL 112 1HG1 VAL 112 -15.757 -6.633 12.990 798 HG12 VAL 112 2HG1 VAL 112 -16.436 -6.862 11.377 799 HG13 VAL 112 3HG1 VAL 112 -15.819 -8.246 12.281 800 HG21 VAL 112 3HG2 VAL 112 -14.506 -6.616 9.364 801 HG22 VAL 112 1HG2 VAL 112 -13.286 -7.821 9.779 802 HG23 VAL 112 2HG2 VAL 112 -14.999 -8.231 9.873 803 H GLU 113 H GLU 113 -15.273 -4.048 13.111 804 HA GLU 113 HA GLU 113 -13.608 -4.612 15.464 805 HB2 GLU 113 1HB GLU 113 -13.806 -2.229 16.137 806 HB3 GLU 113 2HB GLU 113 -12.866 -2.460 14.670 807 HG2 GLU 113 1HG GLU 113 -15.009 -1.942 13.404 808 HG3 GLU 113 2HG GLU 113 -15.648 -1.381 14.948 809 H LEU 114 H LEU 114 -14.866 -5.535 16.931 810 HA LEU 114 HA LEU 114 -17.726 -5.215 16.885 811 HB2 LEU 114 1HB LEU 114 -16.208 -7.278 17.550 812 HB3 LEU 114 2HB LEU 114 -16.325 -6.543 19.147 813 HG LEU 114 HG LEU 114 -18.700 -7.361 17.476 814 HD11 LEU 114 1HD1 LEU 114 -17.998 -8.844 19.925 815 HD12 LEU 114 2HD1 LEU 114 -16.962 -9.119 18.525 816 HD13 LEU 114 3HD1 LEU 114 -18.697 -9.413 18.409 817 HD21 LEU 114 3HD2 LEU 114 -19.389 -7.286 20.151 818 HD22 LEU 114 1HD2 LEU 114 -19.790 -6.076 18.933 819 HD23 LEU 114 2HD2 LEU 114 -18.359 -5.869 19.942 820 H LEU 115 H LEU 115 -18.897 -3.815 18.023 821 HA LEU 115 HA LEU 115 -17.535 -2.152 20.010 822 HB2 LEU 115 1HB LEU 115 -20.310 -1.682 18.989 823 HB3 LEU 115 2HB LEU 115 -19.157 -0.519 19.641 824 HG LEU 115 HG LEU 115 -19.120 -1.809 16.918 825 HD11 LEU 115 1HD1 LEU 115 -19.025 1.119 17.411 826 HD12 LEU 115 2HD1 LEU 115 -20.563 0.285 17.627 827 HD13 LEU 115 3HD1 LEU 115 -19.735 0.216 16.072 828 HD21 LEU 115 3HD2 LEU 115 -16.866 -1.739 17.325 829 HD22 LEU 115 1HD2 LEU 115 -16.998 -0.385 18.448 830 HD23 LEU 115 2HD2 LEU 115 -17.129 -0.105 16.711 831 H ASP 116 H ASP 116 -20.310 -4.284 19.618 832 HA ASP 116 HA ASP 116 -20.314 -5.152 22.272 833 HB2 ASP 116 1HB ASP 116 -21.094 -3.079 23.052 834 HB3 ASP 116 2HB ASP 116 -22.167 -2.862 21.672 835 H VAL 117 H VAL 117 -21.619 -6.913 22.523 836 HA VAL 117 HA VAL 117 -22.961 -7.868 20.141 837 HB VAL 117 HB VAL 117 -23.313 -9.950 21.477 838 HG11 VAL 117 1HG1 VAL 117 -21.447 -10.290 20.262 839 HG12 VAL 117 2HG1 VAL 117 -20.710 -8.769 20.770 840 HG13 VAL 117 3HG1 VAL 117 -20.646 -10.179 21.829 841 HG21 VAL 117 3HG2 VAL 117 -22.610 -8.199 23.623 842 HG22 VAL 117 1HG2 VAL 117 -23.170 -9.871 23.691 843 HG23 VAL 117 2HG2 VAL 117 -21.447 -9.522 23.550 844 H13 JZF 130 1H3 JZF 130 -17.086 -5.738 -0.039 845 H23 JZF 130 2H3 JZF 130 -17.695 -4.713 1.247 846 H4 JZF 130 H4 JZF 130 -18.944 -5.170 -1.486 847 H15 JZF 130 1H5 JZF 130 -20.676 -3.571 -0.879 848 H25 JZF 130 2H5 JZF 130 -19.974 -3.326 0.713 849 H17 JZF 130 1H7 JZF 130 -17.496 -2.715 -0.452 850 H27 JZF 130 2H7 JZF 130 -16.967 -3.818 -1.681 851 H8 JZF 130 H8 JZF 130 -19.466 -2.690 -2.448 852 H9 JZF 130 H9 JZF 130 -16.809 -2.975 -3.736 853 H1OH JZF 130 1HO JZF 130 -19.272 -0.649 -2.143 854 H11 JZF 130 H11 JZF 130 -17.058 -4.353 -5.915 855 H112 JZF 130 1H12 JZF 130 -19.009 -2.283 -7.044 856 H212 JZF 130 2H12 JZF 130 -17.529 -2.826 -7.818 857 H13A JZF 130 H13 JZF 130 -17.370 -0.583 -6.671 858 H114 JZF 130 1H14 JZF 130 -17.241 -0.506 -4.210 859 H214 JZF 130 2H14 JZF 130 -18.826 -0.923 -4.808 860 H115 JZF 130 1H15 JZF 130 -22.037 -7.100 1.754 861 H215 JZF 130 2H15 JZF 130 -20.575 -7.845 2.403 862 H116 JZF 130 1H16 JZF 130 -22.886 -7.819 -1.350 863 H216 JZF 130 2H16 JZF 130 -21.665 -7.813 -2.657 864 H117 JZF 130 2H17 JZF 130 -23.062 -9.903 -2.758 865 H217 JZF 130 3H17 JZF 130 -21.377 -10.297 -2.369 866 H317 JZF 130 1H17 JZF 130 -22.603 -10.290 -1.090 867 H118 JZF 130 1H18 JZF 130 -18.808 -5.977 -6.320 868 H218 JZF 130 2H18 JZF 130 -19.973 -4.718 -6.753 869 H318 JZF 130 3H18 JZF 130 -18.605 -5.065 -7.824 870 H119 JZF 130 3H19 JZF 130 -15.458 -2.835 -6.190 871 H219 JZF 130 1H19 JZF 130 -15.209 -1.240 -6.908 872 H319 JZF 130 2H19 JZF 130 -15.257 -1.418 -5.154 Start of MODEL 14 1 H1 GLY 1 H GLY 1 6.068 -5.464 22.059 2 HA2 GLY 1 1HA GLY 1 7.575 -3.007 21.411 3 HA3 GLY 1 2HA GLY 1 7.170 -4.253 20.241 4 HA PRO 2 HA PRO 2 3.967 -0.758 20.360 5 HB2 PRO 2 1HB PRO 2 4.562 0.359 17.958 6 HB3 PRO 2 2HB PRO 2 5.313 0.878 19.472 7 HG2 PRO 2 1HG PRO 2 6.378 -0.960 17.362 8 HG3 PRO 2 2HG PRO 2 7.211 0.334 18.243 9 HD2 PRO 2 1HD PRO 2 7.479 -2.280 18.896 10 HD3 PRO 2 2HD PRO 2 7.552 -0.982 20.104 11 H GLY 3 H GLY 3 5.160 -2.777 17.696 12 HA2 GLY 3 1HA GLY 3 2.709 -4.096 17.310 13 HA3 GLY 3 2HA GLY 3 2.818 -2.783 16.147 14 H SER 4 H SER 4 4.305 -2.895 14.470 15 HA SER 4 HA SER 4 5.463 -3.960 12.824 16 HB2 SER 4 1HB SER 4 7.172 -3.808 14.720 17 HB3 SER 4 2HB SER 4 6.824 -5.510 15.028 18 HG SER 4 HG SER 4 7.921 -6.041 13.309 19 H MET 5 H MET 5 2.964 -5.177 13.800 20 HA MET 5 HA MET 5 3.248 -8.008 13.787 21 HB2 MET 5 1HB MET 5 0.803 -6.326 13.208 22 HB3 MET 5 2HB MET 5 0.805 -8.047 13.569 23 HG2 MET 5 1HG MET 5 1.710 -5.869 15.438 24 HG3 MET 5 2HG MET 5 0.153 -6.693 15.495 25 HE1 MET 5 3HE MET 5 0.434 -7.259 17.938 26 HE2 MET 5 1HE MET 5 1.710 -8.255 18.639 27 HE3 MET 5 2HE MET 5 2.060 -6.603 18.129 28 H THR 6 H THR 6 2.322 -9.444 12.139 29 HA THR 6 HA THR 6 2.717 -8.370 9.421 30 HB THR 6 HB THR 6 4.519 -9.916 10.046 31 HG1 THR 6 HG1 THR 6 4.329 -10.283 7.967 32 HG21 THR 6 3HG2 THR 6 2.357 -12.008 10.296 33 HG22 THR 6 1HG2 THR 6 3.192 -11.264 11.659 34 HG23 THR 6 2HG2 THR 6 4.091 -12.248 10.504 35 H VAL 7 H VAL 7 1.499 -9.423 7.717 36 HA VAL 7 HA VAL 7 -1.216 -9.948 8.535 37 HB VAL 7 HB VAL 7 0.012 -9.965 5.773 38 HG11 VAL 7 1HG1 VAL 7 -2.436 -9.584 5.129 39 HG12 VAL 7 2HG1 VAL 7 -1.960 -11.216 5.602 40 HG13 VAL 7 3HG1 VAL 7 -2.821 -10.182 6.742 41 HG21 VAL 7 3HG2 VAL 7 0.148 -7.756 6.140 42 HG22 VAL 7 1HG2 VAL 7 -1.603 -7.770 5.927 43 HG23 VAL 7 2HG2 VAL 7 -0.911 -7.827 7.549 44 H VAL 8 H VAL 8 -1.470 -11.915 9.459 45 HA VAL 8 HA VAL 8 -0.155 -14.272 8.510 46 HB VAL 8 HB VAL 8 -2.490 -14.002 10.410 47 HG11 VAL 8 1HG1 VAL 8 -0.780 -16.332 9.607 48 HG12 VAL 8 2HG1 VAL 8 -1.592 -16.282 11.172 49 HG13 VAL 8 3HG1 VAL 8 -2.538 -16.222 9.685 50 HG21 VAL 8 3HG2 VAL 8 0.316 -13.447 10.703 51 HG22 VAL 8 1HG2 VAL 8 -0.998 -13.214 11.856 52 HG23 VAL 8 2HG2 VAL 8 -0.164 -14.765 11.771 53 H THR 9 H THR 9 -0.947 -15.937 7.290 54 HA THR 9 HA THR 9 -3.533 -15.452 5.960 55 HB THR 9 HB THR 9 -1.321 -17.116 4.776 56 HG1 THR 9 HG1 THR 9 -0.495 -15.304 3.830 57 HG21 THR 9 3HG2 THR 9 -3.037 -17.506 3.368 58 HG22 THR 9 1HG2 THR 9 -2.663 -15.901 2.741 59 HG23 THR 9 2HG2 THR 9 -3.947 -16.105 3.932 60 H THR 10 H THR 10 -4.710 -17.377 5.261 61 HA THR 10 HA THR 10 -4.345 -19.594 7.164 62 HB THR 10 HB THR 10 -6.725 -20.075 6.898 63 HG1 THR 10 HG1 THR 10 -7.995 -18.900 5.536 64 HG21 THR 10 3HG2 THR 10 -5.634 -17.723 8.080 65 HG22 THR 10 1HG2 THR 10 -7.036 -18.663 8.592 66 HG23 THR 10 2HG2 THR 10 -7.233 -17.338 7.445 67 H GLU 11 H GLU 11 -5.756 -21.585 6.131 68 HA GLU 11 HA GLU 11 -4.128 -22.482 3.953 69 HB2 GLU 11 1HB GLU 11 -6.496 -23.741 5.345 70 HB3 GLU 11 2HB GLU 11 -5.548 -24.542 4.100 71 HG2 GLU 11 1HG GLU 11 -3.582 -24.475 5.482 72 HG3 GLU 11 2HG GLU 11 -4.430 -23.526 6.702 73 H SER 12 H SER 12 -7.268 -21.061 4.278 74 HA SER 12 HA SER 12 -8.112 -21.836 1.612 75 HB2 SER 12 1HB SER 12 -10.208 -21.003 2.162 76 HB3 SER 12 2HB SER 12 -9.600 -21.480 3.748 77 HG SER 12 HG SER 12 -10.027 -19.481 4.244 78 H GLY 13 H GLY 13 -6.605 -19.149 3.204 79 HA2 GLY 13 1HA GLY 13 -5.290 -17.778 1.539 80 HA3 GLY 13 2HA GLY 13 -6.831 -17.566 0.720 81 H LEU 14 H LEU 14 -8.384 -17.270 3.136 82 HA LEU 14 HA LEU 14 -8.371 -14.527 3.443 83 HB2 LEU 14 1HB LEU 14 -10.192 -16.080 4.116 84 HB3 LEU 14 2HB LEU 14 -9.234 -16.527 5.526 85 HG LEU 14 HG LEU 14 -9.350 -13.851 5.855 86 HD11 LEU 14 1HD1 LEU 14 -12.089 -13.825 5.404 87 HD12 LEU 14 2HD1 LEU 14 -11.402 -14.505 3.929 88 HD13 LEU 14 3HD1 LEU 14 -10.859 -12.930 4.510 89 HD21 LEU 14 3HD2 LEU 14 -10.541 -14.358 7.710 90 HD22 LEU 14 1HD2 LEU 14 -10.148 -16.009 7.229 91 HD23 LEU 14 2HD2 LEU 14 -11.722 -15.324 6.823 92 H LYS 15 H LYS 15 -7.217 -13.100 4.583 93 HA LYS 15 HA LYS 15 -5.227 -14.153 6.482 94 HB2 LYS 15 1HB LYS 15 -5.163 -11.769 4.641 95 HB3 LYS 15 2HB LYS 15 -4.047 -11.932 5.990 96 HG2 LYS 15 1HG LYS 15 -2.954 -13.734 5.039 97 HG3 LYS 15 2HG LYS 15 -4.314 -14.133 3.987 98 HD2 LYS 15 1HD LYS 15 -3.768 -11.694 3.049 99 HD3 LYS 15 2HD LYS 15 -2.161 -12.122 3.642 100 HE2 LYS 15 1HE LYS 15 -1.915 -13.837 2.138 101 HE3 LYS 15 2HE LYS 15 -3.651 -14.111 2.003 102 HZ1 LYS 15 3HZ LYS 15 -2.215 -11.769 0.877 103 HZ2 LYS 15 1HZ LYS 15 -3.858 -12.125 0.686 104 HZ3 LYS 15 2HZ LYS 15 -2.688 -13.130 -0.009 105 H TYR 16 H TYR 16 -4.640 -12.679 8.268 106 HA TYR 16 HA TYR 16 -6.662 -10.725 9.019 107 HB2 TYR 16 1HB TYR 16 -7.251 -11.745 11.084 108 HB3 TYR 16 2HB TYR 16 -7.407 -13.000 9.859 109 HD1 TYR 16 HD2 TYR 16 -5.684 -14.784 9.698 110 HD2 TYR 16 HD1 TYR 16 -5.679 -11.943 12.865 111 HE1 TYR 16 HE2 TYR 16 -4.187 -16.242 10.995 112 HE2 TYR 16 HE1 TYR 16 -4.180 -13.392 14.170 113 HH TYR 16 HH TYR 16 -3.425 -16.635 13.164 114 H GLU 17 H GLU 17 -5.832 -9.072 10.164 115 HA GLU 17 HA GLU 17 -3.180 -9.414 11.386 116 HB2 GLU 17 1HB GLU 17 -3.401 -8.158 9.038 117 HB3 GLU 17 2HB GLU 17 -3.800 -6.809 10.092 118 HG2 GLU 17 1HG GLU 17 -1.325 -8.470 10.448 119 HG3 GLU 17 2HG GLU 17 -1.381 -7.039 9.421 120 H ASP 18 H ASP 18 -3.276 -8.934 13.467 121 HA ASP 18 HA ASP 18 -5.486 -7.740 14.719 122 HB2 ASP 18 1HB ASP 18 -3.771 -9.255 15.792 123 HB3 ASP 18 2HB ASP 18 -2.685 -7.869 15.844 124 H LEU 19 H LEU 19 -5.975 -5.689 15.277 125 HA LEU 19 HA LEU 19 -4.031 -3.595 14.556 126 HB2 LEU 19 1HB LEU 19 -6.923 -3.883 14.004 127 HB3 LEU 19 2HB LEU 19 -6.355 -2.268 14.424 128 HG LEU 19 HG LEU 19 -5.349 -3.946 12.126 129 HD11 LEU 19 1HD1 LEU 19 -7.192 -3.219 11.106 130 HD12 LEU 19 2HD1 LEU 19 -6.444 -1.623 11.134 131 HD13 LEU 19 3HD1 LEU 19 -7.570 -2.091 12.408 132 HD21 LEU 19 3HD2 LEU 19 -3.535 -2.629 12.660 133 HD22 LEU 19 1HD2 LEU 19 -4.535 -1.306 13.260 134 HD23 LEU 19 2HD2 LEU 19 -4.402 -1.593 11.525 135 H THR 20 H THR 20 -6.579 -4.588 16.777 136 HA THR 20 HA THR 20 -5.328 -3.164 18.937 137 HB THR 20 HB THR 20 -8.148 -2.336 18.251 138 HG1 THR 20 HG1 THR 20 -5.728 -0.888 17.815 139 HG21 THR 20 3HG2 THR 20 -7.445 -0.436 19.834 140 HG22 THR 20 1HG2 THR 20 -6.124 -1.503 20.309 141 HG23 THR 20 2HG2 THR 20 -7.796 -2.011 20.544 142 H GLU 21 H GLU 21 -5.490 -4.461 20.636 143 HA GLU 21 HA GLU 21 -6.951 -6.803 20.742 144 HB2 GLU 21 1HB GLU 21 -5.024 -5.896 22.261 145 HB3 GLU 21 2HB GLU 21 -6.341 -5.302 23.263 146 HG2 GLU 21 1HG GLU 21 -7.039 -7.410 23.841 147 HG3 GLU 21 2HG GLU 21 -6.342 -8.152 22.403 148 H GLY 22 H GLY 22 -8.671 -7.364 22.368 149 HA2 GLY 22 1HA GLY 22 -10.624 -5.175 22.672 150 HA3 GLY 22 2HA GLY 22 -11.110 -6.710 21.968 151 H SER 23 H SER 23 -9.985 -8.572 23.539 152 HA SER 23 HA SER 23 -10.248 -9.714 25.489 153 HB2 SER 23 1HB SER 23 -10.414 -7.107 26.979 154 HB3 SER 23 2HB SER 23 -9.699 -8.634 27.496 155 HG SER 23 HG SER 23 -7.890 -7.895 26.755 156 H GLY 24 H GLY 24 -12.511 -9.604 24.138 157 HA2 GLY 24 1HA GLY 24 -14.539 -9.142 26.230 158 HA3 GLY 24 2HA GLY 24 -14.820 -8.603 24.581 159 H ALA 25 H ALA 25 -16.724 -9.940 24.619 160 HA ALA 25 HA ALA 25 -16.314 -12.822 24.702 161 HB1 ALA 25 1HB ALA 25 -18.718 -13.000 24.586 162 HB2 ALA 25 2HB ALA 25 -18.275 -11.811 25.811 163 HB3 ALA 25 3HB ALA 25 -18.861 -11.278 24.235 164 H GLU 26 H GLU 26 -16.584 -14.203 22.976 165 HA GLU 26 HA GLU 26 -16.141 -13.045 20.370 166 HB2 GLU 26 1HB GLU 26 -14.884 -15.027 21.034 167 HB3 GLU 26 2HB GLU 26 -16.379 -15.926 21.254 168 HG2 GLU 26 1HG GLU 26 -16.836 -15.892 18.920 169 HG3 GLU 26 2HG GLU 26 -15.518 -14.760 18.621 170 H ALA 27 H ALA 27 -17.523 -12.999 18.666 171 HA ALA 27 HA ALA 27 -20.285 -12.974 19.121 172 HB1 ALA 27 1HB ALA 27 -20.539 -12.520 16.830 173 HB2 ALA 27 2HB ALA 27 -18.977 -11.825 17.265 174 HB3 ALA 27 3HB ALA 27 -19.049 -13.367 16.411 175 H ARG 28 H ARG 28 -21.942 -14.382 18.535 176 HA ARG 28 HA ARG 28 -21.122 -17.119 17.827 177 HB2 ARG 28 1HB ARG 28 -22.921 -16.198 20.045 178 HB3 ARG 28 2HB ARG 28 -23.148 -17.785 19.321 179 HG2 ARG 28 1HG ARG 28 -20.921 -18.444 19.946 180 HG3 ARG 28 2HG ARG 28 -20.573 -16.821 20.545 181 HD2 ARG 28 1HD ARG 28 -22.455 -17.123 22.175 182 HD3 ARG 28 2HD ARG 28 -22.544 -18.807 21.660 183 HE ARG 28 HE ARG 28 -20.657 -19.247 22.885 184 HH11 ARG 28 1HH1 ARG 28 -21.014 -15.804 22.520 185 HH12 ARG 28 2HH1 ARG 28 -19.743 -15.423 23.633 186 HH21 ARG 28 1HH2 ARG 28 -18.981 -18.758 24.353 187 HH22 ARG 28 2HH2 ARG 28 -18.586 -17.104 24.674 188 H ALA 29 H ALA 29 -22.382 -18.169 16.365 189 HA ALA 29 HA ALA 29 -24.024 -16.693 14.643 190 HB1 ALA 29 1HB ALA 29 -22.815 -18.787 14.055 191 HB2 ALA 29 2HB ALA 29 -24.026 -19.688 14.967 192 HB3 ALA 29 3HB ALA 29 -24.503 -18.766 13.542 193 H GLY 30 H GLY 30 -26.034 -15.985 14.894 194 HA2 GLY 30 1HA GLY 30 -28.379 -16.663 15.228 195 HA3 GLY 30 2HA GLY 30 -27.838 -17.516 16.666 196 H GLN 31 H GLN 31 -25.987 -15.136 17.178 197 HA GLN 31 HA GLN 31 -28.029 -13.506 18.517 198 HB2 GLN 31 1HB GLN 31 -26.553 -13.135 20.236 199 HB3 GLN 31 2HB GLN 31 -26.014 -14.723 19.708 200 HG2 GLN 31 1HG GLN 31 -24.252 -13.656 18.367 201 HG3 GLN 31 2HG GLN 31 -24.774 -12.083 18.968 202 HE21 GLN 31 2HE2 GLN 31 -25.103 -12.303 21.539 203 HE22 GLN 31 1HE2 GLN 31 -23.683 -12.863 22.347 204 H THR 32 H THR 32 -28.038 -11.277 18.363 205 HA THR 32 HA THR 32 -26.773 -10.212 15.973 206 HB THR 32 HB THR 32 -28.545 -8.631 17.816 207 HG1 THR 32 HG1 THR 32 -29.621 -10.609 17.341 208 HG21 THR 32 3HG2 THR 32 -27.253 -7.750 15.716 209 HG22 THR 32 1HG2 THR 32 -28.925 -7.264 15.993 210 HG23 THR 32 2HG2 THR 32 -28.557 -8.538 14.829 211 H VAL 33 H VAL 33 -25.345 -8.498 15.917 212 HA VAL 33 HA VAL 33 -24.464 -7.276 18.403 213 HB VAL 33 HB VAL 33 -22.135 -7.824 18.136 214 HG11 VAL 33 1HG1 VAL 33 -22.168 -10.163 18.685 215 HG12 VAL 33 2HG1 VAL 33 -23.605 -9.402 19.371 216 HG13 VAL 33 3HG1 VAL 33 -23.735 -10.368 17.901 217 HG21 VAL 33 3HG2 VAL 33 -22.023 -9.868 16.252 218 HG22 VAL 33 1HG2 VAL 33 -22.984 -8.602 15.486 219 HG23 VAL 33 2HG2 VAL 33 -21.366 -8.240 16.088 220 H SER 34 H SER 34 -22.976 -5.474 18.043 221 HA SER 34 HA SER 34 -23.368 -4.284 15.377 222 HB2 SER 34 1HB SER 34 -23.905 -2.312 16.344 223 HB3 SER 34 2HB SER 34 -24.187 -3.278 17.792 224 HG SER 34 HG SER 34 -22.787 -1.755 18.452 225 H VAL 35 H VAL 35 -21.624 -3.935 14.180 226 HA VAL 35 HA VAL 35 -19.048 -3.431 15.471 227 HB VAL 35 HB VAL 35 -17.854 -5.082 14.313 228 HG11 VAL 35 1HG1 VAL 35 -18.668 -7.041 15.216 229 HG12 VAL 35 2HG1 VAL 35 -19.538 -5.831 16.161 230 HG13 VAL 35 3HG1 VAL 35 -20.342 -6.652 14.823 231 HG21 VAL 35 3HG2 VAL 35 -19.445 -6.588 12.710 232 HG22 VAL 35 1HG2 VAL 35 -20.135 -4.984 12.466 233 HG23 VAL 35 2HG2 VAL 35 -18.424 -5.266 12.144 234 H HIS 36 H HIS 36 -17.382 -2.733 13.852 235 HA HIS 36 HA HIS 36 -18.668 -1.158 11.721 236 HB2 HIS 36 1HB HIS 36 -16.688 -0.476 13.762 237 HB3 HIS 36 2HB HIS 36 -16.195 0.000 12.140 238 HD1 HIS 36 HD1 HIS 36 -18.898 0.887 10.995 239 HD2 HIS 36 HD2 HIS 36 -17.543 1.889 14.793 240 HE1 HIS 36 HE1 HIS 36 -20.147 2.977 11.625 241 H TYR 37 H TYR 37 -17.913 -1.291 9.670 242 HA TYR 37 HA TYR 37 -15.601 -3.059 9.207 243 HB2 TYR 37 1HB TYR 37 -16.672 -3.915 7.229 244 HB3 TYR 37 2HB TYR 37 -17.802 -4.064 8.570 245 HD1 TYR 37 HD2 TYR 37 -19.686 -2.415 8.765 246 HD2 TYR 37 HD1 TYR 37 -17.208 -2.634 5.313 247 HE1 TYR 37 HE2 TYR 37 -21.383 -1.188 7.476 248 HE2 TYR 37 HE1 TYR 37 -18.898 -1.407 4.015 249 HH TYR 37 HH TYR 37 -21.125 -0.779 4.018 250 H THR 38 H THR 38 -14.001 -2.290 7.972 251 HA THR 38 HA THR 38 -14.491 0.191 6.457 252 HB THR 38 HB THR 38 -11.731 -0.267 7.393 253 HG1 THR 38 HG1 THR 38 -13.734 0.581 9.235 254 HG21 THR 38 3HG2 THR 38 -12.381 1.748 6.179 255 HG22 THR 38 1HG2 THR 38 -11.861 2.152 7.814 256 HG23 THR 38 2HG2 THR 38 -13.579 2.123 7.417 257 H GLY 39 H GLY 39 -14.440 -0.325 4.363 258 HA2 GLY 39 1HA GLY 39 -13.076 -2.584 3.315 259 HA3 GLY 39 2HA GLY 39 -13.805 -1.290 2.375 260 H TRP 40 H TRP 40 -10.929 -2.749 3.282 261 HA TRP 40 HA TRP 40 -9.380 -0.399 2.407 262 HB2 TRP 40 1HB TRP 40 -8.594 -2.627 4.293 263 HB3 TRP 40 2HB TRP 40 -7.465 -1.433 3.660 264 HD1 TRP 40 HD1 TRP 40 -10.093 0.788 4.053 265 HE1 TRP 40 HE1 TRP 40 -10.240 1.847 6.394 266 HE3 TRP 40 HE3 TRP 40 -7.203 -2.547 6.634 267 HZ2 TRP 40 HZ2 TRP 40 -9.259 1.337 8.991 268 HZ3 TRP 40 HZ3 TRP 40 -6.856 -2.189 9.044 269 HH2 TRP 40 HH2 TRP 40 -7.863 -0.287 10.196 270 H LEU 41 H LEU 41 -7.507 -0.808 1.097 271 HA LEU 41 HA LEU 41 -7.950 -2.984 -0.769 272 HB2 LEU 41 1HB LEU 41 -6.515 -0.423 -0.767 273 HB3 LEU 41 2HB LEU 41 -5.713 -1.715 -1.658 274 HG LEU 41 HG LEU 41 -8.515 -0.708 -2.155 275 HD11 LEU 41 1HD1 LEU 41 -5.874 0.042 -3.206 276 HD12 LEU 41 2HD1 LEU 41 -7.379 0.958 -3.148 277 HD13 LEU 41 3HD1 LEU 41 -7.122 -0.236 -4.420 278 HD21 LEU 41 3HD2 LEU 41 -8.181 -2.095 -4.272 279 HD22 LEU 41 1HD2 LEU 41 -8.511 -2.967 -2.775 280 HD23 LEU 41 2HD2 LEU 41 -6.865 -2.884 -3.403 281 H THR 42 H THR 42 -5.996 -4.176 -1.606 282 HA THR 42 HA THR 42 -4.846 -5.705 0.425 283 HB THR 42 HB THR 42 -3.540 -6.783 -1.243 284 HG1 THR 42 HG1 THR 42 -3.304 -5.775 -3.348 285 HG21 THR 42 3HG2 THR 42 -6.188 -6.670 -1.436 286 HG22 THR 42 1HG2 THR 42 -5.206 -7.545 -2.610 287 HG23 THR 42 2HG2 THR 42 -5.791 -5.924 -2.984 288 H ASP 43 H ASP 43 -3.927 -2.653 -0.833 289 HA ASP 43 HA ASP 43 -1.213 -2.869 0.241 290 HB2 ASP 43 1HB ASP 43 -1.035 -0.505 -0.764 291 HB3 ASP 43 2HB ASP 43 -1.161 -1.862 -1.880 292 H GLY 44 H GLY 44 -4.311 -1.628 1.022 293 HA2 GLY 44 1HA GLY 44 -4.613 -1.080 3.406 294 HA3 GLY 44 2HA GLY 44 -3.124 -0.153 3.292 295 H GLN 45 H GLN 45 -4.850 0.240 0.474 296 HA GLN 45 HA GLN 45 -5.547 2.944 1.176 297 HB2 GLN 45 1HB GLN 45 -5.864 1.356 -1.371 298 HB3 GLN 45 2HB GLN 45 -6.349 3.038 -1.211 299 HG2 GLN 45 1HG GLN 45 -4.176 3.792 -1.059 300 HG3 GLN 45 2HG GLN 45 -3.561 2.227 -0.530 301 HE21 GLN 45 2HE2 GLN 45 -5.623 3.054 -3.278 302 HE22 GLN 45 1HE2 GLN 45 -4.547 2.460 -4.492 303 H LYS 46 H LYS 46 -7.373 3.448 2.171 304 HA LYS 46 HA LYS 46 -9.590 1.654 2.325 305 HB2 LYS 46 1HB LYS 46 -9.012 3.154 4.178 306 HB3 LYS 46 2HB LYS 46 -9.355 4.550 3.165 307 HG2 LYS 46 1HG LYS 46 -11.710 3.451 2.941 308 HG3 LYS 46 2HG LYS 46 -11.237 2.608 4.418 309 HD2 LYS 46 1HD LYS 46 -11.015 5.593 4.154 310 HD3 LYS 46 2HD LYS 46 -12.514 4.813 4.665 311 HE2 LYS 46 1HE LYS 46 -11.447 5.316 6.673 312 HE3 LYS 46 2HE LYS 46 -11.051 3.618 6.410 313 HZ1 LYS 46 3HZ LYS 46 -9.242 5.476 6.991 314 HZ2 LYS 46 1HZ LYS 46 -9.178 5.539 5.301 315 HZ3 LYS 46 2HZ LYS 46 -8.885 4.080 6.105 316 H PHE 47 H PHE 47 -11.263 1.471 0.990 317 HA PHE 47 HA PHE 47 -11.888 3.723 -0.801 318 HB2 PHE 47 1HB PHE 47 -12.316 2.203 -2.617 319 HB3 PHE 47 2HB PHE 47 -10.711 1.856 -1.984 320 HD1 PHE 47 HD2 PHE 47 -10.300 -0.178 -0.687 321 HD2 PHE 47 HD1 PHE 47 -14.093 0.616 -2.449 322 HE1 PHE 47 HE2 PHE 47 -10.929 -2.537 -0.388 323 HE2 PHE 47 HE1 PHE 47 -14.728 -1.743 -2.152 324 HZ PHE 47 HZ PHE 47 -13.145 -3.323 -1.122 325 H ASP 48 H ASP 48 -12.999 2.547 1.801 326 HA ASP 48 HA ASP 48 -15.704 3.130 1.328 327 HB2 ASP 48 1HB ASP 48 -15.279 0.724 0.292 328 HB3 ASP 48 2HB ASP 48 -15.467 0.225 1.971 329 H SER 49 H SER 49 -16.491 3.819 3.205 330 HA SER 49 HA SER 49 -15.580 2.559 5.692 331 HB2 SER 49 1HB SER 49 -15.587 4.997 6.636 332 HB3 SER 49 2HB SER 49 -14.180 4.421 5.743 333 HG SER 49 HG SER 49 -14.648 5.726 4.127 334 H SER 50 H SER 50 -17.117 2.357 7.239 335 HA SER 50 HA SER 50 -19.836 2.688 6.495 336 HB2 SER 50 1HB SER 50 -19.570 0.909 7.949 337 HB3 SER 50 2HB SER 50 -18.398 1.765 8.950 338 HG SER 50 HG SER 50 -21.069 1.575 9.245 339 H LYS 51 H LYS 51 -17.574 4.833 7.763 340 HA LYS 51 HA LYS 51 -19.042 6.401 9.534 341 HB2 LYS 51 1HB LYS 51 -16.817 7.067 7.617 342 HB3 LYS 51 2HB LYS 51 -17.519 8.283 8.676 343 HG2 LYS 51 1HG LYS 51 -16.960 6.774 10.606 344 HG3 LYS 51 2HG LYS 51 -16.047 5.784 9.465 345 HD2 LYS 51 1HD LYS 51 -14.456 7.222 10.420 346 HD3 LYS 51 2HD LYS 51 -14.819 7.936 8.847 347 HE2 LYS 51 1HE LYS 51 -16.481 9.413 10.022 348 HE3 LYS 51 2HE LYS 51 -15.835 8.806 11.546 349 HZ1 LYS 51 3HZ LYS 51 -13.837 9.866 11.224 350 HZ2 LYS 51 1HZ LYS 51 -14.908 10.982 10.537 351 HZ3 LYS 51 2HZ LYS 51 -14.010 9.950 9.543 352 H ASP 52 H ASP 52 -19.282 6.092 6.102 353 HA ASP 52 HA ASP 52 -20.378 8.499 5.320 354 HB2 ASP 52 1HB ASP 52 -19.844 6.352 3.948 355 HB3 ASP 52 2HB ASP 52 -21.512 5.911 4.302 356 H ARG 53 H ARG 53 -21.829 5.920 7.169 357 HA ARG 53 HA ARG 53 -24.426 7.285 7.109 358 HB2 ARG 53 1HB ARG 53 -24.175 4.772 6.649 359 HB3 ARG 53 2HB ARG 53 -23.864 4.611 8.373 360 HG2 ARG 53 1HG ARG 53 -26.027 5.315 8.942 361 HG3 ARG 53 2HG ARG 53 -26.330 5.959 7.327 362 HD2 ARG 53 1HD ARG 53 -27.504 3.982 7.251 363 HD3 ARG 53 2HD ARG 53 -25.949 3.485 6.585 364 HE ARG 53 HE ARG 53 -25.839 3.074 9.330 365 HH11 ARG 53 1HH1 ARG 53 -27.631 1.888 6.591 366 HH12 ARG 53 2HH1 ARG 53 -27.896 0.319 7.278 367 HH21 ARG 53 1HH2 ARG 53 -26.181 1.012 10.245 368 HH22 ARG 53 2HH2 ARG 53 -27.071 -0.177 9.357 369 H ASN 54 H ASN 54 -21.683 6.748 9.081 370 HA ASN 54 HA ASN 54 -21.125 7.434 11.176 371 HB2 ASN 54 1HB ASN 54 -23.686 8.996 11.349 372 HB3 ASN 54 2HB ASN 54 -22.105 9.386 12.022 373 HD21 ASN 54 2HD2 ASN 54 -20.571 10.359 10.743 374 HD22 ASN 54 1HD2 ASN 54 -20.931 11.021 9.189 375 H ASP 55 H ASP 55 -21.944 5.010 11.318 376 HA ASP 55 HA ASP 55 -23.018 4.668 13.873 377 HB2 ASP 55 1HB ASP 55 -25.192 5.155 13.291 378 HB3 ASP 55 2HB ASP 55 -24.987 4.593 11.634 379 HA PRO 56 HA PRO 56 -21.121 0.764 13.163 380 HB2 PRO 56 1HB PRO 56 -22.155 -0.619 15.257 381 HB3 PRO 56 2HB PRO 56 -20.907 0.619 15.446 382 HG2 PRO 56 1HG PRO 56 -23.864 0.829 15.867 383 HG3 PRO 56 2HG PRO 56 -22.543 1.473 16.860 384 HD2 PRO 56 1HD PRO 56 -23.938 3.008 15.119 385 HD3 PRO 56 2HD PRO 56 -22.223 3.291 15.480 386 H PHE 57 H PHE 57 -21.544 -1.045 12.019 387 HA PHE 57 HA PHE 57 -24.217 -1.476 11.060 388 HB2 PHE 57 1HB PHE 57 -22.099 -1.734 9.687 389 HB3 PHE 57 2HB PHE 57 -21.809 -3.230 10.568 390 HD1 PHE 57 HD2 PHE 57 -24.721 -1.628 8.861 391 HD2 PHE 57 HD1 PHE 57 -22.345 -5.118 9.400 392 HE1 PHE 57 HE2 PHE 57 -26.144 -2.840 7.261 393 HE2 PHE 57 HE1 PHE 57 -23.764 -6.335 7.801 394 HZ PHE 57 HZ PHE 57 -25.667 -5.197 6.730 395 H ALA 58 H ALA 58 -25.639 -2.416 12.385 396 HA ALA 58 HA ALA 58 -24.763 -4.681 14.037 397 HB1 ALA 58 1HB ALA 58 -27.386 -3.228 14.266 398 HB2 ALA 58 2HB ALA 58 -26.600 -4.265 15.458 399 HB3 ALA 58 3HB ALA 58 -25.919 -2.683 15.080 400 H PHE 59 H PHE 59 -25.515 -6.694 13.714 401 HA PHE 59 HA PHE 59 -27.952 -7.241 12.316 402 HB2 PHE 59 1HB PHE 59 -27.067 -8.296 10.361 403 HB3 PHE 59 2HB PHE 59 -26.341 -6.696 10.455 404 HD1 PHE 59 HD2 PHE 59 -24.037 -6.629 11.755 405 HD2 PHE 59 HD1 PHE 59 -25.704 -10.083 9.910 406 HE1 PHE 59 HE2 PHE 59 -21.797 -7.638 11.629 407 HE2 PHE 59 HE1 PHE 59 -23.467 -11.099 9.781 408 HZ PHE 59 HZ PHE 59 -21.509 -9.876 10.640 409 H VAL 60 H VAL 60 -28.018 -9.728 11.805 410 HA VAL 60 HA VAL 60 -27.278 -11.051 14.284 411 HB VAL 60 HB VAL 60 -28.907 -12.055 11.945 412 HG11 VAL 60 1HG1 VAL 60 -27.872 -13.361 14.354 413 HG12 VAL 60 2HG1 VAL 60 -29.605 -13.575 14.097 414 HG13 VAL 60 3HG1 VAL 60 -28.459 -14.060 12.846 415 HG21 VAL 60 3HG2 VAL 60 -30.697 -11.084 12.854 416 HG22 VAL 60 1HG2 VAL 60 -30.288 -11.677 14.464 417 HG23 VAL 60 2HG2 VAL 60 -29.579 -10.175 13.871 418 H LEU 61 H LEU 61 -25.725 -12.549 14.511 419 HA LEU 61 HA LEU 61 -23.841 -12.939 12.393 420 HB2 LEU 61 1HB LEU 61 -23.111 -12.762 14.701 421 HB3 LEU 61 2HB LEU 61 -24.046 -14.194 15.126 422 HG LEU 61 HG LEU 61 -22.566 -15.606 13.868 423 HD11 LEU 61 1HD1 LEU 61 -20.430 -13.985 13.117 424 HD12 LEU 61 2HD1 LEU 61 -21.870 -13.129 12.569 425 HD13 LEU 61 3HD1 LEU 61 -21.583 -14.791 12.053 426 HD21 LEU 61 3HD2 LEU 61 -20.453 -14.045 15.120 427 HD22 LEU 61 1HD2 LEU 61 -21.044 -15.663 15.498 428 HD23 LEU 61 2HD2 LEU 61 -21.865 -14.248 16.158 429 H GLY 62 H GLY 62 -23.570 -14.646 11.061 430 HA2 GLY 62 1HA GLY 62 -23.780 -16.867 10.331 431 HA3 GLY 62 2HA GLY 62 -24.967 -17.148 11.597 432 H GLY 63 H GLY 63 -25.403 -14.320 9.699 433 HA2 GLY 63 1HA GLY 63 -27.943 -15.195 8.770 434 HA3 GLY 63 2HA GLY 63 -27.126 -13.711 8.304 435 H GLY 64 H GLY 64 -25.770 -13.699 6.481 436 HA2 GLY 64 1HA GLY 64 -24.743 -15.561 4.905 437 HA3 GLY 64 2HA GLY 64 -26.450 -15.783 4.551 438 H MET 65 H MET 65 -26.680 -12.742 5.067 439 HA MET 65 HA MET 65 -26.708 -11.954 2.376 440 HB2 MET 65 1HB MET 65 -27.898 -10.936 4.458 441 HB3 MET 65 2HB MET 65 -26.437 -9.971 4.612 442 HG2 MET 65 1HG MET 65 -26.824 -8.825 2.645 443 HG3 MET 65 2HG MET 65 -27.887 -10.078 2.007 444 HE1 MET 65 3HE MET 65 -27.279 -7.052 3.840 445 HE2 MET 65 1HE MET 65 -28.527 -6.409 2.773 446 HE3 MET 65 2HE MET 65 -28.806 -6.480 4.513 447 H VAL 66 H VAL 66 -24.182 -11.953 4.743 448 HA VAL 66 HA VAL 66 -22.488 -10.196 3.139 449 HB VAL 66 HB VAL 66 -20.908 -10.269 4.950 450 HG11 VAL 66 1HG1 VAL 66 -22.660 -8.695 5.294 451 HG12 VAL 66 2HG1 VAL 66 -23.757 -9.950 5.874 452 HG13 VAL 66 3HG1 VAL 66 -22.358 -9.483 6.842 453 HG21 VAL 66 3HG2 VAL 66 -22.571 -12.574 5.870 454 HG22 VAL 66 1HG2 VAL 66 -20.817 -12.432 5.743 455 HG23 VAL 66 2HG2 VAL 66 -21.676 -11.616 7.050 456 H ILE 67 H ILE 67 -20.443 -10.841 2.349 457 HA ILE 67 HA ILE 67 -20.358 -13.286 1.033 458 HB ILE 67 HB ILE 67 -17.857 -12.825 0.826 459 HG12 ILE 67 1HG1 ILE 67 -18.556 -10.134 1.977 460 HG13 ILE 67 2HG1 ILE 67 -17.926 -11.423 2.998 461 HG21 ILE 67 1HG2 ILE 67 -18.727 -12.026 -1.065 462 HG22 ILE 67 2HG2 ILE 67 -20.135 -11.368 -0.233 463 HG23 ILE 67 3HG2 ILE 67 -18.640 -10.436 -0.307 464 HD11 ILE 67 3HD1 ILE 67 -15.860 -10.968 2.367 465 HD12 ILE 67 1HD1 ILE 67 -16.291 -11.141 0.666 466 HD13 ILE 67 2HD1 ILE 67 -16.482 -9.583 1.470 467 H LYS 68 H LYS 68 -18.952 -15.114 1.311 468 HA LYS 68 HA LYS 68 -19.128 -16.412 3.711 469 HB2 LYS 68 1HB LYS 68 -17.282 -16.697 1.379 470 HB3 LYS 68 2HB LYS 68 -16.966 -17.644 2.826 471 HG2 LYS 68 1HG LYS 68 -19.393 -18.408 2.650 472 HG3 LYS 68 2HG LYS 68 -19.357 -17.733 1.019 473 HD2 LYS 68 1HD LYS 68 -17.183 -19.594 1.857 474 HD3 LYS 68 2HD LYS 68 -18.767 -20.260 1.454 475 HE2 LYS 68 1HE LYS 68 -18.673 -19.184 -0.732 476 HE3 LYS 68 2HE LYS 68 -17.111 -18.474 -0.327 477 HZ1 LYS 68 3HZ LYS 68 -16.082 -20.559 -0.359 478 HZ2 LYS 68 1HZ LYS 68 -17.095 -20.573 -1.715 479 HZ3 LYS 68 2HZ LYS 68 -17.550 -21.400 -0.311 480 H GLY 69 H GLY 69 -16.280 -14.625 2.521 481 HA2 GLY 69 1HA GLY 69 -14.602 -14.995 4.689 482 HA3 GLY 69 2HA GLY 69 -14.589 -13.569 3.661 483 H TRP 70 H TRP 70 -17.203 -12.639 4.302 484 HA TRP 70 HA TRP 70 -16.617 -11.132 6.620 485 HB2 TRP 70 1HB TRP 70 -18.888 -11.371 4.735 486 HB3 TRP 70 2HB TRP 70 -19.278 -10.749 6.336 487 HD1 TRP 70 HD1 TRP 70 -16.206 -9.993 4.079 488 HE1 TRP 70 HE1 TRP 70 -16.043 -7.440 3.802 489 HE3 TRP 70 HE3 TRP 70 -20.386 -8.626 6.685 490 HZ2 TRP 70 HZ2 TRP 70 -17.494 -5.149 4.585 491 HZ3 TRP 70 HZ3 TRP 70 -20.927 -6.233 6.875 492 HH2 TRP 70 HH2 TRP 70 -19.509 -4.532 5.846 493 H ASP 71 H ASP 71 -18.958 -13.750 6.043 494 HA ASP 71 HA ASP 71 -20.026 -13.872 8.616 495 HB2 ASP 71 1HB ASP 71 -21.143 -15.061 6.887 496 HB3 ASP 71 2HB ASP 71 -19.694 -15.977 6.481 497 H GLU 72 H GLU 72 -17.215 -15.527 7.233 498 HA GLU 72 HA GLU 72 -16.623 -17.104 9.496 499 HB2 GLU 72 1HB GLU 72 -15.478 -16.604 6.923 500 HB3 GLU 72 2HB GLU 72 -14.210 -16.480 8.134 501 HG2 GLU 72 1HG GLU 72 -14.478 -18.682 8.825 502 HG3 GLU 72 2HG GLU 72 -16.083 -18.811 8.108 503 H GLY 73 H GLY 73 -15.772 -13.821 8.588 504 HA2 GLY 73 1HA GLY 73 -13.822 -13.492 10.673 505 HA3 GLY 73 2HA GLY 73 -14.494 -12.221 9.661 506 H VAL 74 H VAL 74 -17.176 -12.405 10.212 507 HA VAL 74 HA VAL 74 -17.333 -11.053 12.705 508 HB VAL 74 HB VAL 74 -18.850 -10.517 10.860 509 HG11 VAL 74 1HG1 VAL 74 -19.674 -12.211 9.669 510 HG12 VAL 74 2HG1 VAL 74 -19.351 -13.372 10.959 511 HG13 VAL 74 3HG1 VAL 74 -20.844 -12.433 10.969 512 HG21 VAL 74 3HG2 VAL 74 -20.923 -11.384 12.654 513 HG22 VAL 74 1HG2 VAL 74 -19.525 -10.806 13.561 514 HG23 VAL 74 2HG2 VAL 74 -20.297 -9.760 12.369 515 H GLN 75 H GLN 75 -17.642 -14.356 11.768 516 HA GLN 75 HA GLN 75 -19.020 -15.098 14.226 517 HB2 GLN 75 1HB GLN 75 -19.315 -17.231 13.290 518 HB3 GLN 75 2HB GLN 75 -19.493 -16.129 11.930 519 HG2 GLN 75 1HG GLN 75 -17.113 -16.572 11.350 520 HG3 GLN 75 2HG GLN 75 -17.088 -17.799 12.615 521 HE21 GLN 75 2HE2 GLN 75 -17.894 -19.773 12.202 522 HE22 GLN 75 1HE2 GLN 75 -18.618 -20.243 10.706 523 H GLY 76 H GLY 76 -16.190 -14.025 14.058 524 HA2 GLY 76 1HA GLY 76 -15.011 -16.113 15.755 525 HA3 GLY 76 2HA GLY 76 -14.072 -15.492 14.406 526 H MET 77 H MET 77 -14.903 -12.772 14.615 527 HA MET 77 HA MET 77 -12.990 -11.771 16.370 528 HB2 MET 77 1HB MET 77 -14.024 -9.578 15.994 529 HB3 MET 77 2HB MET 77 -13.864 -10.478 14.491 530 HG2 MET 77 1HG MET 77 -16.124 -10.792 14.274 531 HG3 MET 77 2HG MET 77 -16.420 -10.639 16.005 532 HE1 MET 77 3HE MET 77 -17.891 -7.668 13.371 533 HE2 MET 77 1HE MET 77 -17.048 -9.086 12.747 534 HE3 MET 77 2HE MET 77 -18.332 -9.279 13.940 535 H LYS 78 H LYS 78 -13.406 -10.270 18.219 536 HA LYS 78 HA LYS 78 -15.669 -11.179 19.868 537 HB2 LYS 78 1HB LYS 78 -12.939 -10.564 20.989 538 HB3 LYS 78 2HB LYS 78 -14.292 -11.341 21.800 539 HG2 LYS 78 1HG LYS 78 -14.039 -13.309 20.429 540 HG3 LYS 78 2HG LYS 78 -12.764 -12.527 19.492 541 HD2 LYS 78 1HD LYS 78 -11.536 -12.278 21.726 542 HD3 LYS 78 2HD LYS 78 -12.699 -13.449 22.351 543 HE2 LYS 78 1HE LYS 78 -10.753 -14.652 21.677 544 HE3 LYS 78 2HE LYS 78 -12.021 -14.986 20.499 545 HZ1 LYS 78 3HZ LYS 78 -9.491 -13.650 20.148 546 HZ2 LYS 78 1HZ LYS 78 -10.793 -12.840 19.433 547 HZ3 LYS 78 2HZ LYS 78 -10.462 -14.445 19.013 548 H VAL 79 H VAL 79 -16.217 -9.680 21.638 549 HA VAL 79 HA VAL 79 -16.686 -7.099 20.750 550 HB VAL 79 HB VAL 79 -16.501 -8.032 23.618 551 HG11 VAL 79 1HG1 VAL 79 -17.885 -5.626 22.437 552 HG12 VAL 79 2HG1 VAL 79 -17.956 -6.136 24.125 553 HG13 VAL 79 3HG1 VAL 79 -16.427 -5.599 23.429 554 HG21 VAL 79 3HG2 VAL 79 -18.944 -7.790 21.871 555 HG22 VAL 79 1HG2 VAL 79 -18.074 -9.300 22.142 556 HG23 VAL 79 2HG2 VAL 79 -18.846 -8.473 23.494 557 H GLY 80 H GLY 80 -15.478 -5.326 20.576 558 HA2 GLY 80 1HA GLY 80 -13.873 -3.738 21.144 559 HA3 GLY 80 2HA GLY 80 -13.309 -4.803 22.422 560 H GLY 81 H GLY 81 -13.467 -6.729 19.800 561 HA2 GLY 81 1HA GLY 81 -10.598 -6.578 19.396 562 HA3 GLY 81 2HA GLY 81 -11.682 -7.801 18.750 563 H VAL 82 H VAL 82 -9.638 -5.466 17.841 564 HA VAL 82 HA VAL 82 -11.153 -4.903 15.376 565 HB VAL 82 HB VAL 82 -9.183 -3.048 16.719 566 HG11 VAL 82 1HG1 VAL 82 -10.252 -3.178 14.035 567 HG12 VAL 82 2HG1 VAL 82 -10.653 -1.651 14.823 568 HG13 VAL 82 3HG1 VAL 82 -8.969 -2.160 14.688 569 HG21 VAL 82 3HG2 VAL 82 -10.975 -2.624 18.024 570 HG22 VAL 82 1HG2 VAL 82 -11.506 -1.680 16.632 571 HG23 VAL 82 2HG2 VAL 82 -12.114 -3.319 16.871 572 H ARG 83 H ARG 83 -10.253 -5.842 13.676 573 HA ARG 83 HA ARG 83 -7.397 -5.708 13.252 574 HB2 ARG 83 1HB ARG 83 -7.214 -8.175 12.850 575 HB3 ARG 83 2HB ARG 83 -7.450 -7.729 14.534 576 HG2 ARG 83 1HG ARG 83 -9.685 -8.454 14.526 577 HG3 ARG 83 2HG ARG 83 -9.732 -8.539 12.763 578 HD2 ARG 83 1HD ARG 83 -8.662 -10.543 12.696 579 HD3 ARG 83 2HD ARG 83 -7.706 -10.203 14.138 580 HE ARG 83 HE ARG 83 -10.276 -11.491 14.021 581 HH11 ARG 83 1HH1 ARG 83 -8.048 -9.700 16.009 582 HH12 ARG 83 2HH1 ARG 83 -8.692 -10.301 17.500 583 HH21 ARG 83 1HH2 ARG 83 -11.133 -12.290 15.978 584 HH22 ARG 83 2HH2 ARG 83 -10.446 -11.775 17.482 585 H ARG 84 H ARG 84 -6.792 -6.066 11.093 586 HA ARG 84 HA ARG 84 -9.011 -5.822 9.209 587 HB2 ARG 84 1HB ARG 84 -7.166 -5.235 7.585 588 HB3 ARG 84 2HB ARG 84 -7.371 -4.125 8.933 589 HG2 ARG 84 1HG ARG 84 -5.470 -5.084 10.067 590 HG3 ARG 84 2HG ARG 84 -5.300 -6.306 8.805 591 HD2 ARG 84 1HD ARG 84 -4.907 -4.493 7.165 592 HD3 ARG 84 2HD ARG 84 -4.970 -3.326 8.486 593 HE ARG 84 HE ARG 84 -3.059 -5.240 9.145 594 HH11 ARG 84 1HH1 ARG 84 -3.572 -2.776 6.739 595 HH12 ARG 84 2HH1 ARG 84 -1.883 -2.473 6.502 596 HH21 ARG 84 1HH2 ARG 84 -0.833 -4.849 8.841 597 HH22 ARG 84 2HH2 ARG 84 -0.326 -3.653 7.697 598 H LEU 85 H LEU 85 -9.707 -7.531 8.124 599 HA LEU 85 HA LEU 85 -7.880 -9.810 7.758 600 HB2 LEU 85 1HB LEU 85 -10.887 -9.853 7.631 601 HB3 LEU 85 2HB LEU 85 -9.795 -11.237 7.672 602 HG LEU 85 HG LEU 85 -9.132 -10.168 10.009 603 HD11 LEU 85 1HD1 LEU 85 -10.671 -8.854 11.027 604 HD12 LEU 85 2HD1 LEU 85 -12.022 -9.545 10.129 605 HD13 LEU 85 3HD1 LEU 85 -10.973 -8.353 9.362 606 HD21 LEU 85 3HD2 LEU 85 -10.295 -11.887 10.975 607 HD22 LEU 85 1HD2 LEU 85 -10.302 -12.412 9.291 608 HD23 LEU 85 2HD2 LEU 85 -11.726 -11.629 9.976 609 H THR 86 H THR 86 -7.432 -10.543 5.758 610 HA THR 86 HA THR 86 -8.464 -8.997 3.506 611 HB THR 86 HB THR 86 -6.429 -11.128 3.092 612 HG1 THR 86 HG1 THR 86 -5.559 -8.639 4.079 613 HG21 THR 86 3HG2 THR 86 -7.460 -8.987 1.632 614 HG22 THR 86 1HG2 THR 86 -6.066 -9.981 1.211 615 HG23 THR 86 2HG2 THR 86 -5.839 -8.476 2.102 616 H ILE 87 H ILE 87 -10.282 -9.741 2.624 617 HA ILE 87 HA ILE 87 -10.778 -12.624 2.541 618 HB ILE 87 HB ILE 87 -12.607 -10.300 1.930 619 HG12 ILE 87 1HG1 ILE 87 -13.213 -12.196 4.110 620 HG13 ILE 87 2HG1 ILE 87 -11.798 -11.182 4.373 621 HG21 ILE 87 1HG2 ILE 87 -14.327 -12.268 2.113 622 HG22 ILE 87 2HG2 ILE 87 -13.497 -11.939 0.592 623 HG23 ILE 87 3HG2 ILE 87 -12.939 -13.247 1.636 624 HD11 ILE 87 3HD1 ILE 87 -13.021 -9.286 4.552 625 HD12 ILE 87 1HD1 ILE 87 -14.270 -9.850 3.442 626 HD13 ILE 87 2HD1 ILE 87 -14.231 -10.445 5.102 627 HA PRO 88 HA PRO 88 -9.403 -12.595 -1.705 628 HB2 PRO 88 1HB PRO 88 -9.839 -15.239 -2.141 629 HB3 PRO 88 2HB PRO 88 -8.440 -14.630 -1.248 630 HG2 PRO 88 1HG PRO 88 -11.008 -15.758 -0.203 631 HG3 PRO 88 2HG PRO 88 -9.349 -16.056 0.347 632 HD2 PRO 88 1HD PRO 88 -11.024 -14.354 1.623 633 HD3 PRO 88 2HD PRO 88 -9.268 -14.100 1.564 634 HA PRO 89 HA PRO 89 -13.020 -12.465 -4.203 635 HB2 PRO 89 1HB PRO 89 -12.251 -13.709 -6.490 636 HB3 PRO 89 2HB PRO 89 -11.664 -12.108 -6.023 637 HG2 PRO 89 1HG PRO 89 -10.337 -14.775 -5.722 638 HG3 PRO 89 2HG PRO 89 -9.640 -13.232 -6.250 639 HD2 PRO 89 1HD PRO 89 -9.329 -14.186 -3.735 640 HD3 PRO 89 2HD PRO 89 -9.420 -12.449 -4.093 641 H GLN 90 H GLN 90 -11.514 -15.663 -4.008 642 HA GLN 90 HA GLN 90 -13.747 -17.130 -4.931 643 HB2 GLN 90 1HB GLN 90 -12.612 -19.085 -3.994 644 HB3 GLN 90 2HB GLN 90 -11.489 -18.072 -4.892 645 HG2 GLN 90 1HG GLN 90 -10.928 -17.039 -2.605 646 HG3 GLN 90 2HG GLN 90 -11.716 -18.467 -1.937 647 HE21 GLN 90 2HE2 GLN 90 -10.405 -20.070 -1.481 648 HE22 GLN 90 1HE2 GLN 90 -8.901 -20.416 -2.257 649 H LEU 91 H LEU 91 -13.254 -15.421 -2.078 650 HA LEU 91 HA LEU 91 -15.461 -16.874 -0.779 651 HB2 LEU 91 1HB LEU 91 -13.214 -15.497 0.675 652 HB3 LEU 91 2HB LEU 91 -14.489 -16.496 1.371 653 HG LEU 91 HG LEU 91 -12.130 -17.388 -0.274 654 HD11 LEU 91 1HD1 LEU 91 -12.188 -18.937 1.922 655 HD12 LEU 91 2HD1 LEU 91 -12.904 -17.462 2.569 656 HD13 LEU 91 3HD1 LEU 91 -11.306 -17.413 1.824 657 HD21 LEU 91 3HD2 LEU 91 -13.407 -19.670 0.516 658 HD22 LEU 91 1HD2 LEU 91 -13.484 -18.967 -1.101 659 HD23 LEU 91 2HD2 LEU 91 -14.758 -18.626 0.071 660 H GLY 92 H GLY 92 -14.874 -14.223 -2.407 661 HA2 GLY 92 1HA GLY 92 -16.797 -12.657 -0.847 662 HA3 GLY 92 2HA GLY 92 -15.267 -11.898 -1.261 663 H TYR 93 H TYR 93 -14.924 -11.150 -3.317 664 HA TYR 93 HA TYR 93 -17.242 -10.610 -4.881 665 HB2 TYR 93 1HB TYR 93 -14.332 -9.983 -5.087 666 HB3 TYR 93 2HB TYR 93 -15.322 -9.816 -6.533 667 HD1 TYR 93 HD2 TYR 93 -16.649 -9.186 -3.165 668 HD2 TYR 93 HD1 TYR 93 -15.039 -7.427 -6.689 669 HE1 TYR 93 HE2 TYR 93 -17.396 -6.973 -2.394 670 HE2 TYR 93 HE1 TYR 93 -15.780 -5.209 -5.927 671 HH TYR 93 HH TYR 93 -17.999 -4.641 -3.801 672 H GLY 94 H GLY 94 -14.211 -12.245 -5.831 673 HA2 GLY 94 1HA GLY 94 -14.308 -14.502 -6.758 674 HA3 GLY 94 2HA GLY 94 -15.847 -14.064 -7.485 675 H ALA 95 H ALA 95 -14.686 -14.966 -9.407 676 HA ALA 95 HA ALA 95 -12.635 -13.288 -10.572 677 HB1 ALA 95 1HB ALA 95 -13.694 -15.159 -12.448 678 HB2 ALA 95 2HB ALA 95 -12.114 -15.146 -11.663 679 HB3 ALA 95 3HB ALA 95 -13.474 -15.962 -10.892 680 H ARG 96 H ARG 96 -15.808 -12.832 -10.213 681 HA ARG 96 HA ARG 96 -16.748 -12.234 -12.805 682 HB2 ARG 96 1HB ARG 96 -18.148 -12.539 -10.728 683 HB3 ARG 96 2HB ARG 96 -17.642 -10.929 -10.234 684 HG2 ARG 96 1HG ARG 96 -19.827 -10.844 -11.255 685 HG3 ARG 96 2HG ARG 96 -18.652 -10.001 -12.267 686 HD2 ARG 96 1HD ARG 96 -20.269 -11.491 -13.492 687 HD3 ARG 96 2HD ARG 96 -18.562 -11.796 -13.812 688 HE ARG 96 HE ARG 96 -18.828 -13.886 -12.940 689 HH11 ARG 96 1HH1 ARG 96 -21.440 -11.873 -11.824 690 HH12 ARG 96 2HH1 ARG 96 -22.283 -13.172 -11.048 691 HH21 ARG 96 1HH2 ARG 96 -19.928 -15.605 -11.922 692 HH22 ARG 96 2HH2 ARG 96 -21.422 -15.295 -11.103 693 H GLY 97 H GLY 97 -14.825 -10.445 -10.508 694 HA2 GLY 97 1HA GLY 97 -13.567 -8.537 -10.820 695 HA3 GLY 97 2HA GLY 97 -14.068 -8.541 -12.505 696 H ALA 98 H ALA 98 -13.857 -6.355 -10.485 697 HA ALA 98 HA ALA 98 -16.651 -5.419 -10.594 698 HB1 ALA 98 1HB ALA 98 -15.542 -5.793 -8.309 699 HB2 ALA 98 2HB ALA 98 -14.617 -4.336 -8.676 700 HB3 ALA 98 3HB ALA 98 -16.377 -4.265 -8.587 701 H GLY 99 H GLY 99 -13.376 -4.812 -11.480 702 HA2 GLY 99 1HA GLY 99 -14.153 -2.671 -13.215 703 HA3 GLY 99 2HA GLY 99 -13.242 -2.091 -11.828 704 H GLY 100 H GLY 100 -12.006 -1.476 -13.983 705 HA2 GLY 100 1HA GLY 100 -10.473 -3.419 -15.309 706 HA3 GLY 100 2HA GLY 100 -10.073 -1.712 -15.195 707 H VAL 101 H VAL 101 -9.592 -1.330 -12.563 708 HA VAL 101 HA VAL 101 -7.021 -2.542 -12.251 709 HB VAL 101 HB VAL 101 -6.934 -1.273 -10.110 710 HG11 VAL 101 1HG1 VAL 101 -6.586 -0.363 -12.589 711 HG12 VAL 101 2HG1 VAL 101 -7.907 0.698 -12.097 712 HG13 VAL 101 3HG1 VAL 101 -6.407 0.666 -11.169 713 HG21 VAL 101 3HG2 VAL 101 -9.674 -1.379 -10.219 714 HG22 VAL 101 1HG2 VAL 101 -8.728 -0.344 -9.149 715 HG23 VAL 101 2HG2 VAL 101 -9.333 0.288 -10.680 716 H ILE 102 H ILE 102 -10.090 -3.603 -11.528 717 HA ILE 102 HA ILE 102 -9.163 -5.229 -9.256 718 HB ILE 102 HB ILE 102 -11.985 -4.601 -10.131 719 HG12 ILE 102 1HG1 ILE 102 -10.446 -3.743 -7.671 720 HG13 ILE 102 2HG1 ILE 102 -10.781 -2.719 -9.063 721 HG21 ILE 102 1HG2 ILE 102 -11.895 -5.683 -7.523 722 HG22 ILE 102 2HG2 ILE 102 -12.638 -6.371 -8.966 723 HG23 ILE 102 3HG2 ILE 102 -10.963 -6.753 -8.569 724 HD11 ILE 102 3HD1 ILE 102 -13.085 -2.674 -8.596 725 HD12 ILE 102 1HD1 ILE 102 -12.955 -3.998 -7.439 726 HD13 ILE 102 2HD1 ILE 102 -12.271 -2.419 -7.053 727 HA PRO 103 HA PRO 103 -9.219 -8.271 -12.676 728 HB2 PRO 103 1HB PRO 103 -7.280 -9.830 -11.590 729 HB3 PRO 103 2HB PRO 103 -6.927 -8.397 -12.563 730 HG2 PRO 103 1HG PRO 103 -6.961 -8.704 -9.585 731 HG3 PRO 103 2HG PRO 103 -5.792 -7.850 -10.609 732 HD2 PRO 103 1HD PRO 103 -7.751 -6.565 -9.251 733 HD3 PRO 103 2HD PRO 103 -7.140 -5.992 -10.816 734 HA PRO 104 HA PRO 104 -11.661 -11.420 -10.819 735 HB2 PRO 104 1HB PRO 104 -10.861 -13.654 -12.139 736 HB3 PRO 104 2HB PRO 104 -11.836 -12.388 -12.895 737 HG2 PRO 104 1HG PRO 104 -8.885 -12.863 -13.066 738 HG3 PRO 104 2HG PRO 104 -10.026 -12.432 -14.354 739 HD2 PRO 104 1HD PRO 104 -8.405 -10.612 -13.173 740 HD3 PRO 104 2HD PRO 104 -10.021 -10.199 -13.783 741 H ASN 105 H ASN 105 -8.290 -11.430 -10.462 742 HA ASN 105 HA ASN 105 -8.448 -13.565 -8.437 743 HB2 ASN 105 1HB ASN 105 -6.264 -14.227 -8.917 744 HB3 ASN 105 2HB ASN 105 -6.902 -13.836 -10.512 745 HD21 ASN 105 2HD2 ASN 105 -4.167 -13.780 -9.144 746 HD22 ASN 105 1HD2 ASN 105 -3.527 -12.239 -9.591 747 H ALA 106 H ALA 106 -8.749 -10.457 -8.494 748 HA ALA 106 HA ALA 106 -6.656 -9.552 -6.747 749 HB1 ALA 106 1HB ALA 106 -8.714 -8.355 -8.299 750 HB2 ALA 106 2HB ALA 106 -8.874 -7.794 -6.635 751 HB3 ALA 106 3HB ALA 106 -7.348 -7.583 -7.493 752 H THR 107 H THR 107 -6.913 -8.867 -4.569 753 HA THR 107 HA THR 107 -9.040 -10.321 -3.138 754 HB THR 107 HB THR 107 -6.301 -9.537 -2.122 755 HG1 THR 107 HG1 THR 107 -6.618 -11.384 -3.701 756 HG21 THR 107 3HG2 THR 107 -6.956 -11.089 -0.231 757 HG22 THR 107 1HG2 THR 107 -8.608 -10.991 -0.839 758 HG23 THR 107 2HG2 THR 107 -7.789 -9.535 -0.272 759 H LEU 108 H LEU 108 -10.088 -9.321 -1.402 760 HA LEU 108 HA LEU 108 -9.764 -6.394 -1.289 761 HB2 LEU 108 1HB LEU 108 -12.269 -8.019 -0.869 762 HB3 LEU 108 2HB LEU 108 -12.146 -6.266 -0.735 763 HG LEU 108 HG LEU 108 -11.674 -7.820 -3.277 764 HD11 LEU 108 1HD1 LEU 108 -13.930 -6.378 -3.689 765 HD12 LEU 108 2HD1 LEU 108 -14.128 -6.841 -2.000 766 HD13 LEU 108 3HD1 LEU 108 -13.902 -8.081 -3.233 767 HD21 LEU 108 3HD2 LEU 108 -10.501 -5.759 -3.354 768 HD22 LEU 108 1HD2 LEU 108 -11.856 -4.884 -2.640 769 HD23 LEU 108 2HD2 LEU 108 -11.989 -5.531 -4.276 770 H VAL 109 H VAL 109 -9.409 -5.480 0.644 771 HA VAL 109 HA VAL 109 -9.392 -7.242 2.994 772 HB VAL 109 HB VAL 109 -8.145 -4.553 3.130 773 HG11 VAL 109 1HG1 VAL 109 -6.463 -6.659 3.997 774 HG12 VAL 109 2HG1 VAL 109 -7.327 -5.473 4.977 775 HG13 VAL 109 3HG1 VAL 109 -8.094 -7.008 4.569 776 HG21 VAL 109 3HG2 VAL 109 -6.983 -6.823 1.520 777 HG22 VAL 109 1HG2 VAL 109 -7.419 -5.217 0.935 778 HG23 VAL 109 2HG2 VAL 109 -6.074 -5.411 2.059 779 H PHE 110 H PHE 110 -10.281 -6.564 4.965 780 HA PHE 110 HA PHE 110 -11.841 -4.105 5.009 781 HB2 PHE 110 1HB PHE 110 -13.002 -6.859 5.030 782 HB3 PHE 110 2HB PHE 110 -13.762 -5.615 6.016 783 HD1 PHE 110 HD2 PHE 110 -12.852 -6.565 2.573 784 HD2 PHE 110 HD1 PHE 110 -15.083 -3.912 5.044 785 HE1 PHE 110 HE2 PHE 110 -14.062 -5.743 0.594 786 HE2 PHE 110 HE1 PHE 110 -16.297 -3.087 3.069 787 HZ PHE 110 HZ PHE 110 -15.786 -4.002 0.840 788 H GLU 111 H GLU 111 -11.872 -3.183 6.976 789 HA GLU 111 HA GLU 111 -10.470 -4.549 9.127 790 HB2 GLU 111 1HB GLU 111 -9.945 -2.183 8.483 791 HB3 GLU 111 2HB GLU 111 -11.537 -1.724 9.070 792 HG2 GLU 111 1HG GLU 111 -10.530 -3.080 11.206 793 HG3 GLU 111 2HG GLU 111 -9.086 -2.317 10.543 794 H VAL 112 H VAL 112 -11.628 -5.819 10.415 795 HA VAL 112 HA VAL 112 -14.419 -5.139 10.989 796 HB VAL 112 HB VAL 112 -12.978 -7.671 11.766 797 HG11 VAL 112 1HG1 VAL 112 -15.314 -6.784 12.694 798 HG12 VAL 112 2HG1 VAL 112 -15.886 -7.554 11.212 799 HG13 VAL 112 3HG1 VAL 112 -14.994 -8.495 12.408 800 HG21 VAL 112 3HG2 VAL 112 -14.558 -7.104 9.258 801 HG22 VAL 112 1HG2 VAL 112 -12.827 -7.427 9.356 802 HG23 VAL 112 2HG2 VAL 112 -13.984 -8.693 9.766 803 H GLU 113 H GLU 113 -14.943 -4.182 12.834 804 HA GLU 113 HA GLU 113 -13.278 -4.653 15.207 805 HB2 GLU 113 1HB GLU 113 -13.599 -2.234 15.810 806 HB3 GLU 113 2HB GLU 113 -12.548 -2.519 14.429 807 HG2 GLU 113 1HG GLU 113 -15.255 -2.194 13.548 808 HG3 GLU 113 2HG GLU 113 -14.782 -0.840 14.572 809 H LEU 114 H LEU 114 -14.554 -5.638 16.622 810 HA LEU 114 HA LEU 114 -17.405 -5.375 16.576 811 HB2 LEU 114 1HB LEU 114 -15.750 -7.321 17.394 812 HB3 LEU 114 2HB LEU 114 -16.076 -6.546 18.942 813 HG LEU 114 HG LEU 114 -18.276 -7.485 17.119 814 HD11 LEU 114 1HD1 LEU 114 -18.151 -9.603 17.866 815 HD12 LEU 114 2HD1 LEU 114 -17.583 -9.122 19.464 816 HD13 LEU 114 3HD1 LEU 114 -16.451 -9.205 18.114 817 HD21 LEU 114 3HD2 LEU 114 -18.120 -6.126 19.656 818 HD22 LEU 114 1HD2 LEU 114 -18.985 -7.655 19.812 819 HD23 LEU 114 2HD2 LEU 114 -19.525 -6.452 18.640 820 H LEU 115 H LEU 115 -18.598 -3.896 17.568 821 HA LEU 115 HA LEU 115 -17.331 -2.130 19.520 822 HB2 LEU 115 1HB LEU 115 -19.844 -1.963 17.889 823 HB3 LEU 115 2HB LEU 115 -19.543 -0.866 19.234 824 HG LEU 115 HG LEU 115 -17.256 -0.559 17.815 825 HD11 LEU 115 1HD1 LEU 115 -19.383 -1.461 15.937 826 HD12 LEU 115 2HD1 LEU 115 -17.645 -1.761 15.905 827 HD13 LEU 115 3HD1 LEU 115 -18.277 -0.184 15.430 828 HD21 LEU 115 3HD2 LEU 115 -18.957 1.120 18.710 829 HD22 LEU 115 1HD2 LEU 115 -19.740 0.985 17.135 830 HD23 LEU 115 2HD2 LEU 115 -18.077 1.563 17.246 831 H ASP 116 H ASP 116 -20.353 -3.983 19.165 832 HA ASP 116 HA ASP 116 -20.278 -4.669 21.977 833 HB2 ASP 116 1HB ASP 116 -21.535 -2.387 21.558 834 HB3 ASP 116 2HB ASP 116 -22.843 -3.448 21.044 835 H VAL 117 H VAL 117 -22.233 -6.085 22.532 836 HA VAL 117 HA VAL 117 -22.534 -8.019 20.369 837 HB VAL 117 HB VAL 117 -23.684 -8.500 23.075 838 HG11 VAL 117 1HG1 VAL 117 -23.865 -10.138 21.220 839 HG12 VAL 117 2HG1 VAL 117 -22.105 -10.268 21.211 840 HG13 VAL 117 3HG1 VAL 117 -23.021 -10.769 22.633 841 HG21 VAL 117 3HG2 VAL 117 -21.715 -7.784 23.970 842 HG22 VAL 117 1HG2 VAL 117 -21.237 -9.426 23.537 843 HG23 VAL 117 2HG2 VAL 117 -20.806 -8.076 22.487 844 H13 JZF 130 1H3 JZF 130 -20.573 -2.621 0.062 845 H23 JZF 130 2H3 JZF 130 -20.590 -3.888 -1.151 846 H4 JZF 130 H4 JZF 130 -18.419 -3.341 0.906 847 H15 JZF 130 1H5 JZF 130 -17.136 -5.162 -0.074 848 H25 JZF 130 2H5 JZF 130 -18.400 -5.501 -1.245 849 H17 JZF 130 1H7 JZF 130 -17.658 -1.789 -0.474 850 H27 JZF 130 2H7 JZF 130 -17.098 -3.118 -1.437 851 H8 JZF 130 H8 JZF 130 -19.466 -2.871 -2.554 852 H9 JZF 130 H9 JZF 130 -16.961 -2.428 -3.505 853 H1OH JZF 130 1HO JZF 130 -18.953 -0.288 -1.527 854 H11 JZF 130 H11 JZF 130 -16.881 -2.941 -6.042 855 H112 JZF 130 1H12 JZF 130 -18.337 -0.320 -6.655 856 H212 JZF 130 2H12 JZF 130 -16.787 -0.813 -7.321 857 H13A JZF 130 H13 JZF 130 -16.653 0.862 -5.438 858 H114 JZF 130 1H14 JZF 130 -17.037 0.094 -3.126 859 H214 JZF 130 2H14 JZF 130 -18.494 0.169 -4.083 860 H115 JZF 130 1H15 JZF 130 -21.822 -6.327 2.398 861 H215 JZF 130 2H15 JZF 130 -20.246 -6.753 3.067 862 H116 JZF 130 1H16 JZF 130 -20.952 -7.171 -1.405 863 H216 JZF 130 2H16 JZF 130 -19.670 -8.060 -0.531 864 H117 JZF 130 2H17 JZF 130 -20.135 -9.711 -2.121 865 H217 JZF 130 3H17 JZF 130 -21.458 -10.106 -1.007 866 H317 JZF 130 1H17 JZF 130 -21.768 -9.093 -2.428 867 H118 JZF 130 1H18 JZF 130 -19.596 -2.566 -7.381 868 H218 JZF 130 2H18 JZF 130 -18.091 -2.646 -8.304 869 H318 JZF 130 3H18 JZF 130 -18.601 -4.029 -7.321 870 H119 JZF 130 3H19 JZF 130 -14.548 -0.128 -5.632 871 H219 JZF 130 1H19 JZF 130 -14.974 -0.665 -4.004 872 H319 JZF 130 2H19 JZF 130 -15.178 -1.758 -5.373 Start of MODEL 15 1 H1 GLY 1 H GLY 1 0.562 -0.502 8.203 2 HA2 GLY 1 1HA GLY 1 1.079 1.906 9.028 3 HA3 GLY 1 2HA GLY 1 -0.329 1.613 10.037 4 HA PRO 2 HA PRO 2 3.582 0.213 12.214 5 HB2 PRO 2 1HB PRO 2 3.280 1.805 14.392 6 HB3 PRO 2 2HB PRO 2 4.137 2.323 12.936 7 HG2 PRO 2 1HG PRO 2 1.329 2.911 13.791 8 HG3 PRO 2 2HG PRO 2 2.534 4.001 13.081 9 HD2 PRO 2 1HD PRO 2 0.536 2.893 11.628 10 HD3 PRO 2 2HD PRO 2 2.132 3.253 10.938 11 H GLY 3 H GLY 3 3.543 -0.211 14.820 12 HA2 GLY 3 1HA GLY 3 2.174 -0.997 16.641 13 HA3 GLY 3 2HA GLY 3 0.949 -1.451 15.466 14 H SER 4 H SER 4 0.724 -3.589 15.674 15 HA SER 4 HA SER 4 3.086 -5.267 16.018 16 HB2 SER 4 1HB SER 4 0.123 -5.803 16.224 17 HB3 SER 4 2HB SER 4 1.318 -7.100 16.256 18 HG SER 4 HG SER 4 1.406 -6.659 18.309 19 H MET 5 H MET 5 4.037 -6.242 14.365 20 HA MET 5 HA MET 5 2.661 -6.332 11.787 21 HB2 MET 5 1HB MET 5 5.075 -5.434 12.205 22 HB3 MET 5 2HB MET 5 5.521 -7.135 12.204 23 HG2 MET 5 1HG MET 5 5.883 -6.426 10.016 24 HG3 MET 5 2HG MET 5 4.342 -7.279 9.958 25 HE1 MET 5 3HE MET 5 6.354 -4.680 9.009 26 HE2 MET 5 1HE MET 5 5.282 -4.521 7.617 27 HE3 MET 5 2HE MET 5 5.439 -3.191 8.764 28 H THR 6 H THR 6 2.065 -8.182 14.021 29 HA THR 6 HA THR 6 3.111 -10.743 13.164 30 HB THR 6 HB THR 6 1.293 -11.516 14.919 31 HG1 THR 6 HG1 THR 6 0.272 -9.813 15.669 32 HG21 THR 6 3HG2 THR 6 3.159 -11.957 16.050 33 HG22 THR 6 1HG2 THR 6 3.284 -10.265 16.531 34 HG23 THR 6 2HG2 THR 6 4.038 -10.814 15.034 35 H VAL 7 H VAL 7 2.139 -10.268 10.948 36 HA VAL 7 HA VAL 7 -0.722 -10.715 10.744 37 HB VAL 7 HB VAL 7 1.289 -10.521 8.501 38 HG11 VAL 7 1HG1 VAL 7 -1.109 -9.525 7.619 39 HG12 VAL 7 2HG1 VAL 7 -0.498 -11.151 7.310 40 HG13 VAL 7 3HG1 VAL 7 -1.605 -10.864 8.653 41 HG21 VAL 7 3HG2 VAL 7 1.381 -8.522 9.918 42 HG22 VAL 7 1HG2 VAL 7 0.686 -8.166 8.337 43 HG23 VAL 7 2HG2 VAL 7 -0.362 -8.323 9.746 44 H VAL 8 H VAL 8 -1.695 -12.589 10.243 45 HA VAL 8 HA VAL 8 -0.024 -14.848 9.370 46 HB VAL 8 HB VAL 8 -2.180 -14.978 11.483 47 HG11 VAL 8 1HG1 VAL 8 -1.573 -17.341 11.676 48 HG12 VAL 8 2HG1 VAL 8 -2.173 -16.960 10.060 49 HG13 VAL 8 3HG1 VAL 8 -0.442 -17.161 10.335 50 HG21 VAL 8 3HG2 VAL 8 0.188 -16.005 12.501 51 HG22 VAL 8 1HG2 VAL 8 0.684 -14.566 11.610 52 HG23 VAL 8 2HG2 VAL 8 -0.530 -14.440 12.883 53 H THR 9 H THR 9 -0.964 -16.270 7.946 54 HA THR 9 HA THR 9 -3.649 -15.534 6.974 55 HB THR 9 HB THR 9 -1.713 -16.937 5.185 56 HG1 THR 9 HG1 THR 9 -0.430 -15.263 5.086 57 HG21 THR 9 3HG2 THR 9 -2.939 -15.110 3.668 58 HG22 THR 9 1HG2 THR 9 -4.142 -15.251 4.950 59 HG23 THR 9 2HG2 THR 9 -3.660 -16.678 4.032 60 H THR 10 H THR 10 -5.108 -17.147 6.537 61 HA THR 10 HA THR 10 -4.467 -19.762 7.669 62 HB THR 10 HB THR 10 -6.879 -20.188 7.620 63 HG1 THR 10 HG1 THR 10 -7.210 -17.530 6.668 64 HG21 THR 10 3HG2 THR 10 -6.851 -19.211 9.623 65 HG22 THR 10 1HG2 THR 10 -7.279 -17.687 8.848 66 HG23 THR 10 2HG2 THR 10 -5.584 -18.100 9.106 67 H GLU 11 H GLU 11 -5.097 -21.723 6.578 68 HA GLU 11 HA GLU 11 -4.156 -21.943 3.979 69 HB2 GLU 11 1HB GLU 11 -4.570 -23.778 5.737 70 HB3 GLU 11 2HB GLU 11 -6.212 -23.825 5.111 71 HG2 GLU 11 1HG GLU 11 -5.375 -24.385 2.901 72 HG3 GLU 11 2HG GLU 11 -3.717 -24.291 3.493 73 H SER 12 H SER 12 -7.322 -21.110 5.136 74 HA SER 12 HA SER 12 -8.826 -21.674 2.831 75 HB2 SER 12 1HB SER 12 -9.241 -19.586 4.982 76 HB3 SER 12 2HB SER 12 -10.435 -19.987 3.748 77 HG SER 12 HG SER 12 -10.011 -21.204 6.058 78 H GLY 13 H GLY 13 -6.576 -19.159 3.548 79 HA2 GLY 13 1HA GLY 13 -5.638 -18.028 1.573 80 HA3 GLY 13 2HA GLY 13 -7.288 -17.848 0.997 81 H LEU 14 H LEU 14 -8.374 -17.111 3.580 82 HA LEU 14 HA LEU 14 -7.810 -14.303 3.464 83 HB2 LEU 14 1HB LEU 14 -10.041 -14.800 3.895 84 HB3 LEU 14 2HB LEU 14 -9.635 -16.032 5.087 85 HG LEU 14 HG LEU 14 -8.919 -13.224 5.728 86 HD11 LEU 14 1HD1 LEU 14 -11.501 -13.817 4.845 87 HD12 LEU 14 2HD1 LEU 14 -10.974 -12.390 5.737 88 HD13 LEU 14 3HD1 LEU 14 -11.597 -13.792 6.606 89 HD21 LEU 14 3HD2 LEU 14 -8.385 -14.464 7.530 90 HD22 LEU 14 1HD2 LEU 14 -9.505 -15.759 7.105 91 HD23 LEU 14 2HD2 LEU 14 -10.102 -14.303 7.902 92 H LYS 15 H LYS 15 -6.890 -13.001 5.046 93 HA LYS 15 HA LYS 15 -5.347 -14.423 7.116 94 HB2 LYS 15 1HB LYS 15 -3.462 -13.201 6.667 95 HB3 LYS 15 2HB LYS 15 -4.162 -13.256 5.055 96 HG2 LYS 15 1HG LYS 15 -5.321 -11.023 5.900 97 HG3 LYS 15 2HG LYS 15 -3.891 -10.984 6.934 98 HD2 LYS 15 1HD LYS 15 -3.799 -11.334 3.941 99 HD3 LYS 15 2HD LYS 15 -3.635 -9.778 4.757 100 HE2 LYS 15 1HE LYS 15 -1.507 -10.180 5.302 101 HE3 LYS 15 2HE LYS 15 -1.877 -11.808 5.868 102 HZ1 LYS 15 3HZ LYS 15 -2.080 -11.850 3.101 103 HZ2 LYS 15 1HZ LYS 15 -0.890 -12.577 4.059 104 HZ3 LYS 15 2HZ LYS 15 -0.651 -11.016 3.456 105 H TYR 16 H TYR 16 -4.716 -12.992 8.968 106 HA TYR 16 HA TYR 16 -6.606 -10.818 9.473 107 HB2 TYR 16 1HB TYR 16 -7.412 -11.702 11.506 108 HB3 TYR 16 2HB TYR 16 -7.489 -13.046 10.371 109 HD1 TYR 16 HD2 TYR 16 -5.569 -14.739 10.410 110 HD2 TYR 16 HD1 TYR 16 -6.239 -11.913 13.520 111 HE1 TYR 16 HE2 TYR 16 -4.225 -16.115 11.942 112 HE2 TYR 16 HE1 TYR 16 -4.896 -13.281 15.061 113 HH TYR 16 HH TYR 16 -2.833 -15.628 14.112 114 H GLU 17 H GLU 17 -5.910 -9.300 10.992 115 HA GLU 17 HA GLU 17 -3.305 -9.693 12.245 116 HB2 GLU 17 1HB GLU 17 -2.640 -8.707 10.175 117 HB3 GLU 17 2HB GLU 17 -3.925 -7.510 10.258 118 HG2 GLU 17 1HG GLU 17 -1.797 -6.497 10.771 119 HG3 GLU 17 2HG GLU 17 -2.839 -6.481 12.192 120 H ASP 18 H ASP 18 -3.503 -9.120 14.295 121 HA ASP 18 HA ASP 18 -5.722 -7.796 15.370 122 HB2 ASP 18 1HB ASP 18 -4.581 -7.850 17.458 123 HB3 ASP 18 2HB ASP 18 -4.093 -9.304 16.592 124 H LEU 19 H LEU 19 -6.186 -5.709 15.794 125 HA LEU 19 HA LEU 19 -4.163 -3.703 15.041 126 HB2 LEU 19 1HB LEU 19 -7.042 -3.954 14.452 127 HB3 LEU 19 2HB LEU 19 -6.478 -2.335 14.863 128 HG LEU 19 HG LEU 19 -5.427 -4.046 12.610 129 HD11 LEU 19 1HD1 LEU 19 -7.642 -3.286 12.098 130 HD12 LEU 19 2HD1 LEU 19 -6.490 -2.310 11.188 131 HD13 LEU 19 3HD1 LEU 19 -7.255 -1.651 12.634 132 HD21 LEU 19 3HD2 LEU 19 -3.615 -2.739 13.067 133 HD22 LEU 19 1HD2 LEU 19 -4.582 -1.454 13.790 134 HD23 LEU 19 2HD2 LEU 19 -4.518 -1.628 12.036 135 H THR 20 H THR 20 -6.792 -4.486 17.263 136 HA THR 20 HA THR 20 -5.497 -3.050 19.389 137 HB THR 20 HB THR 20 -8.246 -2.093 18.579 138 HG1 THR 20 HG1 THR 20 -5.779 -0.696 18.303 139 HG21 THR 20 3HG2 THR 20 -7.980 -1.759 20.890 140 HG22 THR 20 1HG2 THR 20 -7.547 -0.209 20.169 141 HG23 THR 20 2HG2 THR 20 -6.283 -1.310 20.718 142 H GLU 21 H GLU 21 -5.768 -4.247 21.147 143 HA GLU 21 HA GLU 21 -7.343 -6.511 21.318 144 HB2 GLU 21 1HB GLU 21 -5.408 -5.667 22.838 145 HB3 GLU 21 2HB GLU 21 -6.691 -4.907 23.770 146 HG2 GLU 21 1HG GLU 21 -6.023 -7.096 24.660 147 HG3 GLU 21 2HG GLU 21 -7.721 -7.036 24.189 148 H GLY 22 H GLY 22 -9.147 -6.933 22.863 149 HA2 GLY 22 1HA GLY 22 -10.957 -4.631 23.158 150 HA3 GLY 22 2HA GLY 22 -11.525 -6.073 22.329 151 H SER 23 H SER 23 -10.467 -8.075 23.890 152 HA SER 23 HA SER 23 -10.870 -9.298 25.765 153 HB2 SER 23 1HB SER 23 -9.639 -7.241 26.760 154 HB3 SER 23 2HB SER 23 -11.235 -6.757 27.334 155 HG SER 23 HG SER 23 -9.597 -8.824 28.168 156 H GLY 24 H GLY 24 -12.958 -9.501 24.388 157 HA2 GLY 24 1HA GLY 24 -15.213 -8.875 26.183 158 HA3 GLY 24 2HA GLY 24 -15.344 -8.592 24.454 159 H ALA 25 H ALA 25 -16.393 -10.120 23.389 160 HA ALA 25 HA ALA 25 -15.967 -12.922 24.097 161 HB1 ALA 25 1HB ALA 25 -17.939 -13.155 25.084 162 HB2 ALA 25 2HB ALA 25 -18.349 -11.473 24.743 163 HB3 ALA 25 3HB ALA 25 -18.719 -12.729 23.561 164 H GLU 26 H GLU 26 -15.979 -14.273 22.372 165 HA GLU 26 HA GLU 26 -15.894 -13.141 19.763 166 HB2 GLU 26 1HB GLU 26 -14.505 -15.057 20.373 167 HB3 GLU 26 2HB GLU 26 -15.942 -16.033 20.640 168 HG2 GLU 26 1HG GLU 26 -16.446 -16.128 18.362 169 HG3 GLU 26 2HG GLU 26 -15.376 -14.780 17.979 170 H ALA 27 H ALA 27 -17.450 -12.917 18.287 171 HA ALA 27 HA ALA 27 -20.158 -13.264 18.904 172 HB1 ALA 27 1HB ALA 27 -20.629 -12.518 16.728 173 HB2 ALA 27 2HB ALA 27 -19.115 -11.724 17.166 174 HB3 ALA 27 3HB ALA 27 -19.098 -13.127 16.098 175 H ARG 28 H ARG 28 -21.734 -14.647 17.855 176 HA ARG 28 HA ARG 28 -20.651 -17.216 16.925 177 HB2 ARG 28 1HB ARG 28 -21.837 -16.815 19.420 178 HB3 ARG 28 2HB ARG 28 -23.104 -17.540 18.439 179 HG2 ARG 28 1HG ARG 28 -21.964 -19.307 19.521 180 HG3 ARG 28 2HG ARG 28 -21.469 -19.339 17.828 181 HD2 ARG 28 1HD ARG 28 -19.478 -17.916 18.580 182 HD3 ARG 28 2HD ARG 28 -19.921 -18.391 20.219 183 HE ARG 28 HE ARG 28 -19.771 -20.736 18.808 184 HH11 ARG 28 1HH1 ARG 28 -17.612 -18.095 19.498 185 HH12 ARG 28 2HH1 ARG 28 -16.185 -19.076 19.442 186 HH21 ARG 28 1HH2 ARG 28 -17.900 -22.038 18.731 187 HH22 ARG 28 2HH2 ARG 28 -16.350 -21.318 19.005 188 H ALA 29 H ALA 29 -21.779 -18.204 15.308 189 HA ALA 29 HA ALA 29 -23.422 -16.671 13.649 190 HB1 ALA 29 1HB ALA 29 -23.145 -18.357 12.217 191 HB2 ALA 29 2HB ALA 29 -22.133 -19.100 13.457 192 HB3 ALA 29 3HB ALA 29 -23.840 -19.530 13.336 193 H GLY 30 H GLY 30 -25.471 -16.074 13.870 194 HA2 GLY 30 1HA GLY 30 -27.794 -16.871 14.020 195 HA3 GLY 30 2HA GLY 30 -27.283 -17.847 15.389 196 H GLN 31 H GLN 31 -25.563 -15.424 16.190 197 HA GLN 31 HA GLN 31 -27.723 -14.071 17.642 198 HB2 GLN 31 1HB GLN 31 -26.282 -13.755 19.401 199 HB3 GLN 31 2HB GLN 31 -25.623 -15.241 18.729 200 HG2 GLN 31 1HG GLN 31 -23.952 -13.910 17.502 201 HG3 GLN 31 2HG GLN 31 -24.584 -12.455 18.271 202 HE21 GLN 31 2HE2 GLN 31 -24.036 -11.993 20.347 203 HE22 GLN 31 1HE2 GLN 31 -22.902 -12.914 21.268 204 H THR 32 H THR 32 -28.007 -11.888 17.570 205 HA THR 32 HA THR 32 -26.770 -10.500 15.350 206 HB THR 32 HB THR 32 -28.759 -9.350 17.306 207 HG1 THR 32 HG1 THR 32 -30.348 -10.299 16.181 208 HG21 THR 32 3HG2 THR 32 -27.380 -8.048 15.427 209 HG22 THR 32 1HG2 THR 32 -29.051 -7.646 15.821 210 HG23 THR 32 2HG2 THR 32 -28.693 -8.659 14.422 211 H VAL 33 H VAL 33 -25.282 -8.912 15.460 212 HA VAL 33 HA VAL 33 -24.668 -7.647 18.010 213 HB VAL 33 HB VAL 33 -22.329 -8.162 17.984 214 HG11 VAL 33 1HG1 VAL 33 -22.364 -10.584 18.358 215 HG12 VAL 33 2HG1 VAL 33 -23.766 -9.794 19.083 216 HG13 VAL 33 3HG1 VAL 33 -23.938 -10.680 17.567 217 HG21 VAL 33 3HG2 VAL 33 -22.847 -8.840 15.239 218 HG22 VAL 33 1HG2 VAL 33 -21.307 -8.548 16.049 219 HG23 VAL 33 2HG2 VAL 33 -22.012 -10.165 16.050 220 H SER 34 H SER 34 -23.024 -5.893 17.737 221 HA SER 34 HA SER 34 -23.363 -4.631 15.099 222 HB2 SER 34 1HB SER 34 -23.668 -3.643 17.810 223 HB3 SER 34 2HB SER 34 -22.523 -2.660 16.897 224 HG SER 34 HG SER 34 -25.114 -2.520 16.781 225 H VAL 35 H VAL 35 -21.622 -4.274 13.890 226 HA VAL 35 HA VAL 35 -19.000 -4.001 15.156 227 HB VAL 35 HB VAL 35 -17.923 -5.628 13.824 228 HG11 VAL 35 1HG1 VAL 35 -20.460 -7.071 14.488 229 HG12 VAL 35 2HG1 VAL 35 -18.789 -7.606 14.674 230 HG13 VAL 35 3HG1 VAL 35 -19.454 -6.390 15.766 231 HG21 VAL 35 3HG2 VAL 35 -19.689 -7.004 12.287 232 HG22 VAL 35 1HG2 VAL 35 -20.318 -5.362 12.147 233 HG23 VAL 35 2HG2 VAL 35 -18.649 -5.708 11.696 234 H HIS 36 H HIS 36 -17.344 -3.196 13.647 235 HA HIS 36 HA HIS 36 -18.562 -1.467 11.600 236 HB2 HIS 36 1HB HIS 36 -16.349 -1.079 13.544 237 HB3 HIS 36 2HB HIS 36 -16.164 -0.323 11.964 238 HD1 HIS 36 HD1 HIS 36 -18.493 1.106 11.273 239 HD2 HIS 36 HD2 HIS 36 -17.601 0.543 15.291 240 HE1 HIS 36 HE1 HIS 36 -19.787 2.877 12.503 241 H TYR 37 H TYR 37 -17.947 -1.639 9.530 242 HA TYR 37 HA TYR 37 -15.681 -3.423 8.924 243 HB2 TYR 37 1HB TYR 37 -16.840 -4.123 6.917 244 HB3 TYR 37 2HB TYR 37 -17.899 -4.355 8.303 245 HD1 TYR 37 HD1 TYR 37 -19.840 -2.882 8.644 246 HD2 TYR 37 HD2 TYR 37 -17.377 -2.539 5.191 247 HE1 TYR 37 HE1 TYR 37 -21.589 -1.555 7.535 248 HE2 TYR 37 HE2 TYR 37 -19.119 -1.211 4.073 249 HH TYR 37 HH TYR 37 -21.609 -0.927 4.242 250 H THR 38 H THR 38 -14.077 -2.629 7.720 251 HA THR 38 HA THR 38 -14.538 -0.102 6.273 252 HB THR 38 HB THR 38 -11.773 -0.416 7.036 253 HG1 THR 38 HG1 THR 38 -13.717 -0.452 9.119 254 HG21 THR 38 3HG2 THR 38 -12.697 1.695 6.342 255 HG22 THR 38 1HG2 THR 38 -12.184 1.837 8.023 256 HG23 THR 38 2HG2 THR 38 -13.894 1.646 7.636 257 H GLY 39 H GLY 39 -14.488 -0.579 4.169 258 HA2 GLY 39 1HA GLY 39 -13.063 -2.813 3.104 259 HA3 GLY 39 2HA GLY 39 -13.884 -1.566 2.177 260 H TRP 40 H TRP 40 -10.894 -2.808 3.170 261 HA TRP 40 HA TRP 40 -9.510 -0.414 2.151 262 HB2 TRP 40 1HB TRP 40 -8.518 -2.508 4.097 263 HB3 TRP 40 2HB TRP 40 -7.542 -1.191 3.455 264 HD1 TRP 40 HD1 TRP 40 -10.443 0.679 3.833 265 HE1 TRP 40 HE1 TRP 40 -10.714 1.738 6.163 266 HE3 TRP 40 HE3 TRP 40 -7.124 -2.215 6.431 267 HZ2 TRP 40 HZ2 TRP 40 -9.660 1.393 8.758 268 HZ3 TRP 40 HZ3 TRP 40 -6.814 -1.785 8.834 269 HH2 TRP 40 HH2 TRP 40 -8.056 -0.017 9.971 270 H LEU 41 H LEU 41 -7.762 -0.699 0.727 271 HA LEU 41 HA LEU 41 -7.925 -3.160 -0.834 272 HB2 LEU 41 1HB LEU 41 -6.755 -0.445 -1.358 273 HB3 LEU 41 2HB LEU 41 -6.427 -1.821 -2.410 274 HG LEU 41 HG LEU 41 -9.026 -1.969 -2.564 275 HD11 LEU 41 1HD1 LEU 41 -10.144 0.174 -2.377 276 HD12 LEU 41 2HD1 LEU 41 -8.652 0.926 -1.813 277 HD13 LEU 41 3HD1 LEU 41 -9.453 -0.294 -0.823 278 HD21 LEU 41 3HD2 LEU 41 -8.060 0.406 -4.020 279 HD22 LEU 41 1HD2 LEU 41 -8.817 -1.069 -4.622 280 HD23 LEU 41 2HD2 LEU 41 -7.102 -1.064 -4.210 281 H THR 42 H THR 42 -6.011 -4.264 -1.543 282 HA THR 42 HA THR 42 -4.204 -4.844 0.517 283 HB THR 42 HB THR 42 -3.076 -6.276 -0.997 284 HG1 THR 42 HG1 THR 42 -3.154 -6.001 -3.218 285 HG21 THR 42 3HG2 THR 42 -5.869 -6.169 -2.117 286 HG22 THR 42 1HG2 THR 42 -5.518 -6.776 -0.500 287 HG23 THR 42 2HG2 THR 42 -4.829 -7.578 -1.912 288 H ASP 43 H ASP 43 -4.225 -2.304 -1.762 289 HA ASP 43 HA ASP 43 -1.390 -1.844 -1.805 290 HB2 ASP 43 1HB ASP 43 -3.785 -0.301 -2.768 291 HB3 ASP 43 2HB ASP 43 -2.178 0.422 -2.776 292 H GLY 44 H GLY 44 -3.970 -1.076 0.316 293 HA2 GLY 44 1HA GLY 44 -3.315 -0.350 2.559 294 HA3 GLY 44 2HA GLY 44 -2.175 0.747 1.794 295 H GLN 45 H GLN 45 -4.449 1.209 -0.263 296 HA GLN 45 HA GLN 45 -5.571 3.473 1.171 297 HB2 GLN 45 1HB GLN 45 -6.386 4.201 -1.009 298 HB3 GLN 45 2HB GLN 45 -4.676 3.801 -1.092 299 HG2 GLN 45 1HG GLN 45 -5.616 1.456 -1.842 300 HG3 GLN 45 2HG GLN 45 -7.010 2.430 -2.307 301 HE21 GLN 45 2HE2 GLN 45 -6.873 3.773 -4.045 302 HE22 GLN 45 1HE2 GLN 45 -5.507 3.834 -5.101 303 H LYS 46 H LYS 46 -7.727 3.811 1.578 304 HA LYS 46 HA LYS 46 -9.396 1.414 1.529 305 HB2 LYS 46 1HB LYS 46 -10.780 2.518 3.153 306 HB3 LYS 46 2HB LYS 46 -9.102 2.707 3.644 307 HG2 LYS 46 1HG LYS 46 -9.065 4.974 2.919 308 HG3 LYS 46 2HG LYS 46 -10.641 4.811 2.143 309 HD2 LYS 46 1HD LYS 46 -11.019 4.028 4.806 310 HD3 LYS 46 2HD LYS 46 -10.006 5.472 4.872 311 HE2 LYS 46 1HE LYS 46 -12.401 6.014 4.948 312 HE3 LYS 46 2HE LYS 46 -11.610 6.693 3.526 313 HZ1 LYS 46 3HZ LYS 46 -13.873 5.462 3.306 314 HZ2 LYS 46 1HZ LYS 46 -12.913 4.070 3.317 315 HZ3 LYS 46 2HZ LYS 46 -12.678 5.250 2.128 316 H PHE 47 H PHE 47 -11.645 1.554 0.886 317 HA PHE 47 HA PHE 47 -12.304 3.752 -0.929 318 HB2 PHE 47 1HB PHE 47 -12.841 2.341 -2.761 319 HB3 PHE 47 2HB PHE 47 -11.252 1.823 -2.209 320 HD1 PHE 47 HD2 PHE 47 -11.435 -0.053 -0.263 321 HD2 PHE 47 HD1 PHE 47 -14.296 0.675 -3.329 322 HE1 PHE 47 HE2 PHE 47 -12.267 -2.356 -0.028 323 HE2 PHE 47 HE1 PHE 47 -15.133 -1.627 -3.099 324 HZ PHE 47 HZ PHE 47 -14.118 -3.146 -1.448 325 H ASP 48 H ASP 48 -13.172 2.489 1.735 326 HA ASP 48 HA ASP 48 -15.886 3.147 1.584 327 HB2 ASP 48 1HB ASP 48 -15.258 0.419 0.801 328 HB3 ASP 48 2HB ASP 48 -16.337 0.465 2.192 329 H SER 49 H SER 49 -16.460 3.704 3.579 330 HA SER 49 HA SER 49 -15.497 2.173 5.865 331 HB2 SER 49 1HB SER 49 -14.994 5.137 5.518 332 HB3 SER 49 2HB SER 49 -14.782 4.265 7.036 333 HG SER 49 HG SER 49 -12.859 3.857 6.309 334 H SER 50 H SER 50 -16.882 2.171 7.578 335 HA SER 50 HA SER 50 -19.560 2.978 7.121 336 HB2 SER 50 1HB SER 50 -18.086 1.808 9.460 337 HB3 SER 50 2HB SER 50 -19.743 2.379 9.657 338 HG SER 50 HG SER 50 -19.198 0.723 7.481 339 H LYS 51 H LYS 51 -16.860 4.667 8.229 340 HA LYS 51 HA LYS 51 -17.890 6.393 10.154 341 HB2 LYS 51 1HB LYS 51 -16.059 7.845 9.656 342 HB3 LYS 51 2HB LYS 51 -15.487 6.194 9.455 343 HG2 LYS 51 1HG LYS 51 -15.685 6.383 7.051 344 HG3 LYS 51 2HG LYS 51 -16.360 8.006 7.212 345 HD2 LYS 51 1HD LYS 51 -14.050 8.234 6.651 346 HD3 LYS 51 2HD LYS 51 -14.233 8.684 8.348 347 HE2 LYS 51 1HE LYS 51 -13.597 5.851 7.724 348 HE3 LYS 51 2HE LYS 51 -12.317 7.044 7.509 349 HZ1 LYS 51 3HZ LYS 51 -13.680 7.407 9.983 350 HZ2 LYS 51 1HZ LYS 51 -12.029 7.179 9.691 351 HZ3 LYS 51 2HZ LYS 51 -13.050 5.842 9.860 352 H ASP 52 H ASP 52 -18.414 6.283 6.733 353 HA ASP 52 HA ASP 52 -19.184 8.885 6.170 354 HB2 ASP 52 1HB ASP 52 -18.981 7.314 4.379 355 HB3 ASP 52 2HB ASP 52 -20.205 6.260 5.082 356 H ARG 53 H ARG 53 -20.923 6.345 7.837 357 HA ARG 53 HA ARG 53 -23.263 8.106 8.091 358 HB2 ARG 53 1HB ARG 53 -24.400 6.011 8.929 359 HB3 ARG 53 2HB ARG 53 -23.906 5.982 7.242 360 HG2 ARG 53 1HG ARG 53 -22.166 4.493 7.647 361 HG3 ARG 53 2HG ARG 53 -22.152 4.836 9.378 362 HD2 ARG 53 1HD ARG 53 -23.183 2.767 9.290 363 HD3 ARG 53 2HD ARG 53 -24.556 3.872 9.336 364 HE ARG 53 HE ARG 53 -25.139 3.164 7.243 365 HH11 ARG 53 1HH1 ARG 53 -21.828 2.276 7.853 366 HH12 ARG 53 2HH1 ARG 53 -21.674 1.343 6.401 367 HH21 ARG 53 1HH2 ARG 53 -24.949 1.939 5.329 368 HH22 ARG 53 2HH2 ARG 53 -23.450 1.153 4.966 369 H ASN 54 H ASN 54 -20.675 6.627 9.837 370 HA ASN 54 HA ASN 54 -19.965 6.810 11.990 371 HB2 ASN 54 1HB ASN 54 -20.598 9.262 11.463 372 HB3 ASN 54 2HB ASN 54 -22.025 8.955 12.450 373 HD21 ASN 54 2HD2 ASN 54 -18.501 8.835 12.477 374 HD22 ASN 54 1HD2 ASN 54 -18.325 9.151 14.167 375 H ASP 55 H ASP 55 -21.408 4.695 11.793 376 HA ASP 55 HA ASP 55 -22.744 4.466 14.315 377 HB2 ASP 55 1HB ASP 55 -24.733 5.175 13.398 378 HB3 ASP 55 2HB ASP 55 -24.319 4.598 11.786 379 HA PRO 56 HA PRO 56 -21.170 0.384 13.862 380 HB2 PRO 56 1HB PRO 56 -22.663 -0.877 15.746 381 HB3 PRO 56 2HB PRO 56 -21.341 0.224 16.148 382 HG2 PRO 56 1HG PRO 56 -24.288 0.744 16.095 383 HG3 PRO 56 2HG PRO 56 -23.084 1.249 17.295 384 HD2 PRO 56 1HD PRO 56 -24.016 2.916 15.375 385 HD3 PRO 56 2HD PRO 56 -22.361 3.020 16.009 386 H PHE 57 H PHE 57 -21.592 -1.388 12.657 387 HA PHE 57 HA PHE 57 -24.173 -1.561 11.359 388 HB2 PHE 57 1HB PHE 57 -21.841 -1.869 10.264 389 HB3 PHE 57 2HB PHE 57 -21.911 -3.494 10.937 390 HD1 PHE 57 HD1 PHE 57 -24.400 -1.283 9.248 391 HD2 PHE 57 HD2 PHE 57 -22.396 -5.037 9.317 392 HE1 PHE 57 HE1 PHE 57 -25.725 -2.021 7.311 393 HE2 PHE 57 HE2 PHE 57 -23.718 -5.782 7.379 394 HZ PHE 57 HZ PHE 57 -25.384 -4.273 6.374 395 H ALA 58 H ALA 58 -25.707 -2.425 12.646 396 HA ALA 58 HA ALA 58 -25.098 -4.842 14.179 397 HB1 ALA 58 1HB ALA 58 -27.777 -3.555 14.275 398 HB2 ALA 58 2HB ALA 58 -26.844 -4.326 15.559 399 HB3 ALA 58 3HB ALA 58 -26.413 -2.708 15.006 400 H PHE 59 H PHE 59 -25.717 -6.802 13.540 401 HA PHE 59 HA PHE 59 -28.091 -7.263 12.014 402 HB2 PHE 59 1HB PHE 59 -27.119 -8.079 9.986 403 HB3 PHE 59 2HB PHE 59 -26.452 -6.475 10.271 404 HD1 PHE 59 HD2 PHE 59 -24.206 -6.532 11.734 405 HD2 PHE 59 HD1 PHE 59 -25.664 -9.702 9.297 406 HE1 PHE 59 HE2 PHE 59 -21.929 -7.448 11.570 407 HE2 PHE 59 HE1 PHE 59 -23.389 -10.624 9.130 408 HZ PHE 59 HZ PHE 59 -21.517 -9.497 10.266 409 H VAL 60 H VAL 60 -28.170 -9.658 11.319 410 HA VAL 60 HA VAL 60 -27.467 -11.224 13.639 411 HB VAL 60 HB VAL 60 -28.862 -12.076 11.098 412 HG11 VAL 60 1HG1 VAL 60 -27.952 -13.995 12.187 413 HG12 VAL 60 2HG1 VAL 60 -28.516 -13.438 13.763 414 HG13 VAL 60 3HG1 VAL 60 -29.679 -13.950 12.539 415 HG21 VAL 60 3HG2 VAL 60 -29.768 -10.368 13.111 416 HG22 VAL 60 1HG2 VAL 60 -30.739 -11.174 11.880 417 HG23 VAL 60 2HG2 VAL 60 -30.513 -11.928 13.458 418 H LEU 61 H LEU 61 -25.663 -12.359 13.855 419 HA LEU 61 HA LEU 61 -23.733 -12.572 11.792 420 HB2 LEU 61 1HB LEU 61 -23.137 -12.483 14.157 421 HB3 LEU 61 2HB LEU 61 -23.930 -14.034 14.422 422 HG LEU 61 HG LEU 61 -22.260 -15.159 13.083 423 HD11 LEU 61 1HD1 LEU 61 -20.218 -13.405 12.635 424 HD12 LEU 61 2HD1 LEU 61 -21.635 -12.427 12.256 425 HD13 LEU 61 3HD1 LEU 61 -21.371 -13.957 11.421 426 HD21 LEU 61 3HD2 LEU 61 -20.357 -13.644 14.641 427 HD22 LEU 61 1HD2 LEU 61 -20.918 -15.303 14.850 428 HD23 LEU 61 2HD2 LEU 61 -21.828 -13.968 15.558 429 H GLY 62 H GLY 62 -23.105 -14.298 10.536 430 HA2 GLY 62 1HA GLY 62 -23.452 -16.159 9.232 431 HA3 GLY 62 2HA GLY 62 -23.838 -16.948 10.755 432 H GLY 63 H GLY 63 -25.502 -14.445 8.834 433 HA2 GLY 63 1HA GLY 63 -27.499 -15.952 7.708 434 HA3 GLY 63 2HA GLY 63 -28.057 -15.636 9.344 435 H GLY 64 H GLY 64 -26.785 -13.965 6.470 436 HA2 GLY 64 1HA GLY 64 -28.916 -12.031 6.606 437 HA3 GLY 64 2HA GLY 64 -27.348 -11.364 7.038 438 H MET 65 H MET 65 -26.247 -10.471 5.434 439 HA MET 65 HA MET 65 -26.348 -11.639 2.769 440 HB2 MET 65 1HB MET 65 -28.175 -9.990 2.786 441 HB3 MET 65 2HB MET 65 -27.042 -8.742 3.284 442 HG2 MET 65 1HG MET 65 -26.026 -8.649 1.220 443 HG3 MET 65 2HG MET 65 -26.542 -10.274 0.777 444 HE1 MET 65 3HE MET 65 -27.665 -8.573 -1.926 445 HE2 MET 65 1HE MET 65 -27.800 -6.962 -1.220 446 HE3 MET 65 2HE MET 65 -26.375 -7.949 -0.896 447 H VAL 66 H VAL 66 -24.163 -12.094 3.800 448 HA VAL 66 HA VAL 66 -22.308 -9.989 2.944 449 HB VAL 66 HB VAL 66 -20.918 -10.184 4.862 450 HG11 VAL 66 1HG1 VAL 66 -23.813 -9.979 5.679 451 HG12 VAL 66 2HG1 VAL 66 -22.452 -9.519 6.705 452 HG13 VAL 66 3HG1 VAL 66 -22.746 -8.663 5.190 453 HG21 VAL 66 3HG2 VAL 66 -22.206 -11.784 6.717 454 HG22 VAL 66 1HG2 VAL 66 -22.326 -12.695 5.212 455 HG23 VAL 66 2HG2 VAL 66 -20.747 -12.193 5.816 456 H ILE 67 H ILE 67 -20.257 -10.735 2.273 457 HA ILE 67 HA ILE 67 -20.280 -13.235 0.958 458 HB ILE 67 HB ILE 67 -17.833 -12.775 0.561 459 HG12 ILE 67 1HG1 ILE 67 -18.253 -10.018 1.610 460 HG13 ILE 67 2HG1 ILE 67 -17.886 -11.286 2.774 461 HG21 ILE 67 1HG2 ILE 67 -19.157 -10.277 -0.229 462 HG22 ILE 67 2HG2 ILE 67 -18.393 -11.520 -1.217 463 HG23 ILE 67 3HG2 ILE 67 -20.040 -11.749 -0.630 464 HD11 ILE 67 3HD1 ILE 67 -15.830 -10.318 2.212 465 HD12 ILE 67 1HD1 ILE 67 -15.889 -11.839 1.321 466 HD13 ILE 67 2HD1 ILE 67 -16.207 -10.317 0.489 467 H LYS 68 H LYS 68 -18.756 -14.998 1.255 468 HA LYS 68 HA LYS 68 -18.858 -16.221 3.698 469 HB2 LYS 68 1HB LYS 68 -16.742 -16.498 1.559 470 HB3 LYS 68 2HB LYS 68 -16.912 -17.599 2.921 471 HG2 LYS 68 1HG LYS 68 -19.338 -17.144 1.306 472 HG3 LYS 68 2HG LYS 68 -18.024 -18.024 0.522 473 HD2 LYS 68 1HD LYS 68 -19.346 -19.682 1.534 474 HD3 LYS 68 2HD LYS 68 -17.968 -19.477 2.617 475 HE2 LYS 68 1HE LYS 68 -19.227 -18.481 4.249 476 HE3 LYS 68 2HE LYS 68 -20.399 -17.833 3.103 477 HZ1 LYS 68 3HZ LYS 68 -20.556 -20.608 2.972 478 HZ2 LYS 68 1HZ LYS 68 -21.711 -19.532 3.582 479 HZ3 LYS 68 2HZ LYS 68 -20.549 -20.200 4.614 480 H GLY 69 H GLY 69 -16.093 -14.363 2.422 481 HA2 GLY 69 1HA GLY 69 -14.382 -14.588 4.581 482 HA3 GLY 69 2HA GLY 69 -14.443 -13.194 3.512 483 H TRP 70 H TRP 70 -17.096 -12.371 4.160 484 HA TRP 70 HA TRP 70 -16.549 -10.775 6.432 485 HB2 TRP 70 1HB TRP 70 -18.791 -11.129 4.544 486 HB3 TRP 70 2HB TRP 70 -19.241 -10.535 6.140 487 HD1 TRP 70 HD1 TRP 70 -16.115 -9.592 4.046 488 HE1 TRP 70 HE1 TRP 70 -16.111 -7.037 3.738 489 HE3 TRP 70 HE3 TRP 70 -20.556 -8.494 6.329 490 HZ2 TRP 70 HZ2 TRP 70 -17.771 -4.845 4.379 491 HZ3 TRP 70 HZ3 TRP 70 -21.275 -6.143 6.440 492 HH2 TRP 70 HH2 TRP 70 -19.910 -4.358 5.485 493 H ASP 71 H ASP 71 -18.840 -13.459 5.938 494 HA ASP 71 HA ASP 71 -19.845 -13.560 8.538 495 HB2 ASP 71 1HB ASP 71 -19.692 -15.464 6.258 496 HB3 ASP 71 2HB ASP 71 -20.069 -16.133 7.843 497 H GLU 72 H GLU 72 -17.025 -15.148 7.110 498 HA GLU 72 HA GLU 72 -16.359 -16.726 9.351 499 HB2 GLU 72 1HB GLU 72 -15.289 -16.216 6.767 500 HB3 GLU 72 2HB GLU 72 -13.994 -15.983 7.933 501 HG2 GLU 72 1HG GLU 72 -14.513 -18.220 8.873 502 HG3 GLU 72 2HG GLU 72 -15.680 -18.447 7.572 503 H GLY 73 H GLY 73 -15.508 -13.437 8.411 504 HA2 GLY 73 1HA GLY 73 -13.592 -13.074 10.512 505 HA3 GLY 73 2HA GLY 73 -14.273 -11.814 9.494 506 H VAL 74 H VAL 74 -16.963 -12.052 10.044 507 HA VAL 74 HA VAL 74 -17.156 -10.657 12.503 508 HB VAL 74 HB VAL 74 -19.383 -11.878 10.867 509 HG11 VAL 74 1HG1 VAL 74 -20.823 -10.268 11.975 510 HG12 VAL 74 2HG1 VAL 74 -20.028 -11.297 13.168 511 HG13 VAL 74 3HG1 VAL 74 -19.454 -9.651 12.900 512 HG21 VAL 74 3HG2 VAL 74 -17.616 -9.716 10.288 513 HG22 VAL 74 1HG2 VAL 74 -18.972 -10.323 9.338 514 HG23 VAL 74 2HG2 VAL 74 -19.237 -9.072 10.553 515 H GLN 75 H GLN 75 -17.477 -13.999 11.621 516 HA GLN 75 HA GLN 75 -18.755 -14.717 14.129 517 HB2 GLN 75 1HB GLN 75 -19.007 -16.874 13.248 518 HB3 GLN 75 2HB GLN 75 -19.207 -15.820 11.855 519 HG2 GLN 75 1HG GLN 75 -16.878 -16.244 11.216 520 HG3 GLN 75 2HG GLN 75 -16.712 -17.333 12.593 521 HE21 GLN 75 2HE2 GLN 75 -19.074 -16.820 9.988 522 HE22 GLN 75 1HE2 GLN 75 -19.175 -18.481 9.524 523 H GLY 76 H GLY 76 -15.842 -13.677 13.643 524 HA2 GLY 76 1HA GLY 76 -14.596 -15.691 15.409 525 HA3 GLY 76 2HA GLY 76 -13.708 -14.954 14.084 526 H MET 77 H MET 77 -14.838 -12.310 14.481 527 HA MET 77 HA MET 77 -12.938 -11.259 16.254 528 HB2 MET 77 1HB MET 77 -15.449 -10.064 15.081 529 HB3 MET 77 2HB MET 77 -14.313 -9.141 16.056 530 HG2 MET 77 1HG MET 77 -13.612 -10.566 13.501 531 HG3 MET 77 2HG MET 77 -14.002 -8.852 13.626 532 HE1 MET 77 3HE MET 77 -11.790 -8.230 16.642 533 HE2 MET 77 1HE MET 77 -11.393 -7.137 15.315 534 HE3 MET 77 2HE MET 77 -13.071 -7.595 15.609 535 H LYS 78 H LYS 78 -13.318 -10.037 18.229 536 HA LYS 78 HA LYS 78 -15.485 -11.212 19.845 537 HB2 LYS 78 1HB LYS 78 -12.802 -10.205 20.810 538 HB3 LYS 78 2HB LYS 78 -14.040 -10.979 21.790 539 HG2 LYS 78 1HG LYS 78 -13.767 -13.001 20.288 540 HG3 LYS 78 2HG LYS 78 -12.320 -12.209 19.660 541 HD2 LYS 78 1HD LYS 78 -11.463 -13.547 21.346 542 HD3 LYS 78 2HD LYS 78 -11.660 -11.993 22.161 543 HE2 LYS 78 1HE LYS 78 -13.643 -12.711 23.240 544 HE3 LYS 78 2HE LYS 78 -13.763 -14.144 22.221 545 HZ1 LYS 78 3HZ LYS 78 -11.489 -13.698 24.064 546 HZ2 LYS 78 1HZ LYS 78 -11.953 -15.138 23.307 547 HZ3 LYS 78 2HZ LYS 78 -12.903 -14.492 24.548 548 H VAL 79 H VAL 79 -16.409 -9.870 21.507 549 HA VAL 79 HA VAL 79 -17.201 -7.353 20.652 550 HB VAL 79 HB VAL 79 -17.103 -8.275 23.526 551 HG11 VAL 79 1HG1 VAL 79 -19.324 -6.814 23.369 552 HG12 VAL 79 2HG1 VAL 79 -17.752 -6.107 23.745 553 HG13 VAL 79 3HG1 VAL 79 -18.390 -6.017 22.103 554 HG21 VAL 79 3HG2 VAL 79 -18.536 -9.354 21.308 555 HG22 VAL 79 1HG2 VAL 79 -18.585 -9.842 23.002 556 HG23 VAL 79 2HG2 VAL 79 -19.681 -8.592 22.412 557 H GLY 80 H GLY 80 -16.167 -5.477 20.527 558 HA2 GLY 80 1HA GLY 80 -14.882 -3.676 21.254 559 HA3 GLY 80 2HA GLY 80 -14.364 -4.636 22.632 560 H GLY 81 H GLY 81 -13.932 -6.553 20.002 561 HA2 GLY 81 1HA GLY 81 -11.069 -6.003 19.989 562 HA3 GLY 81 2HA GLY 81 -11.863 -7.411 19.300 563 H VAL 82 H VAL 82 -9.908 -5.247 18.308 564 HA VAL 82 HA VAL 82 -11.340 -4.729 15.785 565 HB VAL 82 HB VAL 82 -9.357 -2.885 17.128 566 HG11 VAL 82 1HG1 VAL 82 -8.951 -2.179 15.049 567 HG12 VAL 82 2HG1 VAL 82 -10.301 -3.100 14.384 568 HG13 VAL 82 3HG1 VAL 82 -10.579 -1.504 15.082 569 HG21 VAL 82 3HG2 VAL 82 -12.304 -3.013 17.070 570 HG22 VAL 82 1HG2 VAL 82 -11.218 -2.323 18.277 571 HG23 VAL 82 2HG2 VAL 82 -11.594 -1.420 16.810 572 H ARG 83 H ARG 83 -10.438 -5.815 14.176 573 HA ARG 83 HA ARG 83 -7.546 -5.855 13.888 574 HB2 ARG 83 1HB ARG 83 -9.043 -8.462 13.718 575 HB3 ARG 83 2HB ARG 83 -7.304 -8.202 13.773 576 HG2 ARG 83 1HG ARG 83 -7.539 -7.402 16.101 577 HG3 ARG 83 2HG ARG 83 -9.257 -7.797 16.027 578 HD2 ARG 83 1HD ARG 83 -8.655 -10.143 15.530 579 HD3 ARG 83 2HD ARG 83 -6.954 -9.718 15.715 580 HE ARG 83 HE ARG 83 -8.276 -8.937 18.038 581 HH11 ARG 83 1HH1 ARG 83 -7.506 -11.867 16.323 582 HH12 ARG 83 2HH1 ARG 83 -7.454 -12.845 17.752 583 HH21 ARG 83 1HH2 ARG 83 -8.210 -10.213 19.927 584 HH22 ARG 83 2HH2 ARG 83 -7.856 -11.903 19.802 585 H ARG 84 H ARG 84 -6.845 -6.239 11.767 586 HA ARG 84 HA ARG 84 -8.952 -5.903 9.756 587 HB2 ARG 84 1HB ARG 84 -7.192 -5.080 8.286 588 HB3 ARG 84 2HB ARG 84 -7.175 -4.204 9.811 589 HG2 ARG 84 1HG ARG 84 -5.409 -6.176 10.352 590 HG3 ARG 84 2HG ARG 84 -5.154 -5.968 8.618 591 HD2 ARG 84 1HD ARG 84 -5.357 -3.418 9.955 592 HD3 ARG 84 2HD ARG 84 -4.099 -4.416 10.684 593 HE ARG 84 HE ARG 84 -4.010 -4.308 7.806 594 HH11 ARG 84 1HH1 ARG 84 -2.974 -2.826 10.780 595 HH12 ARG 84 2HH1 ARG 84 -1.587 -2.066 10.071 596 HH21 ARG 84 1HH2 ARG 84 -2.187 -3.314 6.860 597 HH22 ARG 84 2HH2 ARG 84 -1.141 -2.344 7.841 598 H LEU 85 H LEU 85 -9.488 -7.522 8.452 599 HA LEU 85 HA LEU 85 -7.588 -9.752 8.134 600 HB2 LEU 85 1HB LEU 85 -10.580 -9.986 7.962 601 HB3 LEU 85 2HB LEU 85 -9.394 -11.285 8.062 602 HG LEU 85 HG LEU 85 -8.882 -10.169 10.401 603 HD11 LEU 85 1HD1 LEU 85 -10.829 -8.473 9.637 604 HD12 LEU 85 2HD1 LEU 85 -10.465 -8.858 11.319 605 HD13 LEU 85 3HD1 LEU 85 -11.785 -9.684 10.492 606 HD21 LEU 85 3HD2 LEU 85 -10.000 -11.926 11.350 607 HD22 LEU 85 1HD2 LEU 85 -9.938 -12.467 9.672 608 HD23 LEU 85 2HD2 LEU 85 -11.411 -11.736 10.309 609 H THR 86 H THR 86 -7.152 -10.459 6.112 610 HA THR 86 HA THR 86 -8.206 -8.870 3.905 611 HB THR 86 HB THR 86 -5.928 -10.854 4.018 612 HG1 THR 86 HG1 THR 86 -5.873 -8.538 4.915 613 HG21 THR 86 3HG2 THR 86 -6.105 -11.017 1.800 614 HG22 THR 86 1HG2 THR 86 -5.720 -9.300 1.704 615 HG23 THR 86 2HG2 THR 86 -7.403 -9.824 1.760 616 H ILE 87 H ILE 87 -9.892 -9.577 2.790 617 HA ILE 87 HA ILE 87 -10.485 -12.449 2.756 618 HB ILE 87 HB ILE 87 -12.224 -10.088 2.036 619 HG12 ILE 87 1HG1 ILE 87 -12.927 -11.971 4.215 620 HG13 ILE 87 2HG1 ILE 87 -11.561 -10.904 4.521 621 HG21 ILE 87 1HG2 ILE 87 -12.967 -11.816 0.645 622 HG22 ILE 87 2HG2 ILE 87 -12.702 -13.045 1.880 623 HG23 ILE 87 3HG2 ILE 87 -14.031 -11.899 2.049 624 HD11 ILE 87 3HD1 ILE 87 -13.710 -9.393 3.404 625 HD12 ILE 87 1HD1 ILE 87 -14.296 -10.336 4.774 626 HD13 ILE 87 2HD1 ILE 87 -12.932 -9.235 4.979 627 HA PRO 88 HA PRO 88 -8.891 -12.474 -1.418 628 HB2 PRO 88 1HB PRO 88 -9.305 -15.125 -1.834 629 HB3 PRO 88 2HB PRO 88 -7.949 -14.501 -0.888 630 HG2 PRO 88 1HG PRO 88 -10.562 -15.617 0.055 631 HG3 PRO 88 2HG PRO 88 -8.930 -15.905 0.685 632 HD2 PRO 88 1HD PRO 88 -10.662 -14.186 1.858 633 HD3 PRO 88 2HD PRO 88 -8.905 -13.931 1.876 634 HA PRO 89 HA PRO 89 -12.383 -12.397 -4.089 635 HB2 PRO 89 1HB PRO 89 -11.520 -13.704 -6.306 636 HB3 PRO 89 2HB PRO 89 -10.943 -12.096 -5.853 637 HG2 PRO 89 1HG PRO 89 -9.651 -14.762 -5.424 638 HG3 PRO 89 2HG PRO 89 -8.920 -13.237 -5.959 639 HD2 PRO 89 1HD PRO 89 -8.731 -14.128 -3.408 640 HD3 PRO 89 2HD PRO 89 -8.792 -12.401 -3.815 641 H GLN 90 H GLN 90 -10.920 -15.591 -3.701 642 HA GLN 90 HA GLN 90 -13.117 -17.071 -4.701 643 HB2 GLN 90 1HB GLN 90 -12.035 -18.978 -3.428 644 HB3 GLN 90 2HB GLN 90 -11.025 -18.178 -4.626 645 HG2 GLN 90 1HG GLN 90 -9.563 -17.457 -3.097 646 HG3 GLN 90 2HG GLN 90 -10.825 -17.047 -1.936 647 HE21 GLN 90 2HE2 GLN 90 -8.281 -18.384 -1.503 648 HE22 GLN 90 1HE2 GLN 90 -8.654 -19.918 -0.802 649 H LEU 91 H LEU 91 -12.753 -15.276 -1.888 650 HA LEU 91 HA LEU 91 -14.943 -16.756 -0.583 651 HB2 LEU 91 1HB LEU 91 -12.494 -15.477 0.517 652 HB3 LEU 91 2HB LEU 91 -13.964 -15.436 1.489 653 HG LEU 91 HG LEU 91 -12.494 -17.288 2.122 654 HD11 LEU 91 1HD1 LEU 91 -14.916 -17.504 2.398 655 HD12 LEU 91 2HD1 LEU 91 -14.157 -19.058 2.055 656 HD13 LEU 91 3HD1 LEU 91 -15.035 -18.207 0.785 657 HD21 LEU 91 3HD2 LEU 91 -12.009 -19.099 0.644 658 HD22 LEU 91 1HD2 LEU 91 -11.524 -17.605 -0.160 659 HD23 LEU 91 2HD2 LEU 91 -13.024 -18.410 -0.624 660 H GLY 92 H GLY 92 -14.353 -14.117 -2.354 661 HA2 GLY 92 1HA GLY 92 -16.395 -12.534 -0.920 662 HA3 GLY 92 2HA GLY 92 -15.018 -11.780 -1.710 663 H TYR 93 H TYR 93 -15.148 -11.268 -3.824 664 HA TYR 93 HA TYR 93 -17.713 -11.461 -5.095 665 HB2 TYR 93 1HB TYR 93 -15.083 -10.424 -6.174 666 HB3 TYR 93 2HB TYR 93 -16.661 -10.194 -6.920 667 HD1 TYR 93 HD1 TYR 93 -18.108 -9.733 -4.205 668 HD2 TYR 93 HD2 TYR 93 -14.608 -8.073 -5.964 669 HE1 TYR 93 HE1 TYR 93 -18.431 -7.678 -2.893 670 HE2 TYR 93 HE2 TYR 93 -14.920 -6.014 -4.656 671 HH TYR 93 HH TYR 93 -16.052 -5.342 -2.522 672 H GLY 94 H GLY 94 -14.459 -12.699 -5.864 673 HA2 GLY 94 1HA GLY 94 -14.217 -15.005 -6.582 674 HA3 GLY 94 2HA GLY 94 -15.768 -14.855 -7.396 675 H ALA 95 H ALA 95 -14.513 -15.748 -9.219 676 HA ALA 95 HA ALA 95 -12.585 -13.994 -10.476 677 HB1 ALA 95 1HB ALA 95 -13.442 -16.090 -12.215 678 HB2 ALA 95 2HB ALA 95 -11.884 -15.877 -11.414 679 HB3 ALA 95 3HB ALA 95 -13.184 -16.746 -10.598 680 H ARG 96 H ARG 96 -15.788 -13.775 -10.206 681 HA ARG 96 HA ARG 96 -16.632 -13.401 -12.901 682 HB2 ARG 96 1HB ARG 96 -17.825 -12.498 -10.276 683 HB3 ARG 96 2HB ARG 96 -18.610 -12.278 -11.835 684 HG2 ARG 96 1HG ARG 96 -17.744 -15.000 -10.961 685 HG3 ARG 96 2HG ARG 96 -19.247 -14.300 -10.355 686 HD2 ARG 96 1HD ARG 96 -19.986 -15.436 -12.218 687 HD3 ARG 96 2HD ARG 96 -19.712 -13.822 -12.874 688 HE ARG 96 HE ARG 96 -17.443 -15.577 -13.104 689 HH11 ARG 96 1HH1 ARG 96 -20.412 -14.512 -14.579 690 HH12 ARG 96 2HH1 ARG 96 -19.933 -14.970 -16.180 691 HH21 ARG 96 1HH2 ARG 96 -16.801 -16.184 -15.207 692 HH22 ARG 96 2HH2 ARG 96 -17.879 -15.921 -16.536 693 H GLY 97 H GLY 97 -15.056 -11.404 -10.546 694 HA2 GLY 97 1HA GLY 97 -13.927 -9.405 -10.979 695 HA3 GLY 97 2HA GLY 97 -14.738 -9.311 -12.535 696 H ALA 98 H ALA 98 -14.704 -6.989 -11.537 697 HA ALA 98 HA ALA 98 -17.417 -6.491 -10.639 698 HB1 ALA 98 1HB ALA 98 -16.248 -4.826 -8.901 699 HB2 ALA 98 2HB ALA 98 -16.729 -6.471 -8.482 700 HB3 ALA 98 3HB ALA 98 -15.052 -6.122 -8.904 701 H GLY 99 H GLY 99 -14.389 -4.601 -10.672 702 HA2 GLY 99 1HA GLY 99 -15.729 -2.716 -12.509 703 HA3 GLY 99 2HA GLY 99 -14.511 -2.253 -11.330 704 H GLY 100 H GLY 100 -13.184 -1.287 -12.877 705 HA2 GLY 100 1HA GLY 100 -12.236 -2.871 -15.120 706 HA3 GLY 100 2HA GLY 100 -11.802 -1.206 -14.758 707 H VAL 101 H VAL 101 -10.823 -1.396 -12.208 708 HA VAL 101 HA VAL 101 -8.324 -2.826 -12.691 709 HB VAL 101 HB VAL 101 -7.429 -1.546 -10.806 710 HG11 VAL 101 1HG1 VAL 101 -7.202 0.447 -11.942 711 HG12 VAL 101 2HG1 VAL 101 -7.739 -0.632 -13.230 712 HG13 VAL 101 3HG1 VAL 101 -8.886 0.466 -12.462 713 HG21 VAL 101 3HG2 VAL 101 -8.711 -0.591 -9.257 714 HG22 VAL 101 1HG2 VAL 101 -9.609 0.312 -10.477 715 HG23 VAL 101 2HG2 VAL 101 -10.106 -1.324 -10.048 716 H ILE 102 H ILE 102 -10.513 -4.474 -12.109 717 HA ILE 102 HA ILE 102 -9.614 -5.630 -9.569 718 HB ILE 102 HB ILE 102 -12.518 -5.331 -10.344 719 HG12 ILE 102 1HG1 ILE 102 -10.922 -4.052 -8.114 720 HG13 ILE 102 2HG1 ILE 102 -11.544 -3.230 -9.541 721 HG21 ILE 102 1HG2 ILE 102 -12.071 -6.146 -7.636 722 HG22 ILE 102 2HG2 ILE 102 -12.987 -6.954 -8.907 723 HG23 ILE 102 3HG2 ILE 102 -11.259 -7.260 -8.736 724 HD11 ILE 102 3HD1 ILE 102 -13.213 -4.533 -7.403 725 HD12 ILE 102 1HD1 ILE 102 -12.913 -2.803 -7.573 726 HD13 ILE 102 2HD1 ILE 102 -13.819 -3.667 -8.815 727 HA PRO 103 HA PRO 103 -9.548 -8.855 -12.811 728 HB2 PRO 103 1HB PRO 103 -7.472 -10.210 -11.704 729 HB3 PRO 103 2HB PRO 103 -7.251 -8.810 -12.760 730 HG2 PRO 103 1HG PRO 103 -7.185 -8.957 -9.770 731 HG3 PRO 103 2HG PRO 103 -6.108 -8.078 -10.871 732 HD2 PRO 103 1HD PRO 103 -8.120 -6.865 -9.525 733 HD3 PRO 103 2HD PRO 103 -7.594 -6.336 -11.136 734 HA PRO 104 HA PRO 104 -11.700 -12.070 -10.722 735 HB2 PRO 104 1HB PRO 104 -10.761 -14.310 -11.936 736 HB3 PRO 104 2HB PRO 104 -11.845 -13.165 -12.736 737 HG2 PRO 104 1HG PRO 104 -8.871 -13.428 -12.957 738 HG3 PRO 104 2HG PRO 104 -10.068 -13.157 -14.237 739 HD2 PRO 104 1HD PRO 104 -8.566 -11.157 -13.200 740 HD3 PRO 104 2HD PRO 104 -10.221 -10.901 -13.790 741 H ASN 105 H ASN 105 -8.324 -11.823 -10.466 742 HA ASN 105 HA ASN 105 -8.287 -13.822 -8.300 743 HB2 ASN 105 1HB ASN 105 -6.821 -14.357 -10.259 744 HB3 ASN 105 2HB ASN 105 -5.918 -12.882 -9.929 745 HD21 ASN 105 2HD2 ASN 105 -4.103 -13.243 -8.903 746 HD22 ASN 105 1HD2 ASN 105 -3.820 -14.470 -7.720 747 H ALA 106 H ALA 106 -8.776 -10.752 -8.555 748 HA ALA 106 HA ALA 106 -6.683 -9.558 -7.018 749 HB1 ALA 106 1HB ALA 106 -8.837 -8.633 -8.518 750 HB2 ALA 106 2HB ALA 106 -9.186 -8.131 -6.863 751 HB3 ALA 106 3HB ALA 106 -7.667 -7.660 -7.626 752 H THR 107 H THR 107 -6.812 -8.784 -4.862 753 HA THR 107 HA THR 107 -8.664 -10.332 -3.170 754 HB THR 107 HB THR 107 -5.936 -9.280 -2.397 755 HG1 THR 107 HG1 THR 107 -5.254 -11.408 -2.642 756 HG21 THR 107 3HG2 THR 107 -6.950 -9.503 -0.367 757 HG22 THR 107 1HG2 THR 107 -6.457 -11.179 -0.600 758 HG23 THR 107 2HG2 THR 107 -8.114 -10.690 -0.954 759 H LEU 108 H LEU 108 -9.587 -9.327 -1.358 760 HA LEU 108 HA LEU 108 -9.377 -6.390 -1.302 761 HB2 LEU 108 1HB LEU 108 -11.878 -8.031 -0.926 762 HB3 LEU 108 2HB LEU 108 -11.764 -6.278 -0.788 763 HG LEU 108 HG LEU 108 -10.887 -7.387 -3.369 764 HD11 LEU 108 1HD1 LEU 108 -13.096 -7.825 -4.199 765 HD12 LEU 108 2HD1 LEU 108 -13.811 -7.414 -2.640 766 HD13 LEU 108 3HD1 LEU 108 -12.803 -8.853 -2.796 767 HD21 LEU 108 3HD2 LEU 108 -12.802 -5.461 -3.778 768 HD22 LEU 108 1HD2 LEU 108 -11.063 -5.182 -3.678 769 HD23 LEU 108 2HD2 LEU 108 -12.072 -4.971 -2.247 770 H VAL 109 H VAL 109 -9.086 -5.485 0.649 771 HA VAL 109 HA VAL 109 -9.023 -7.281 2.971 772 HB VAL 109 HB VAL 109 -7.930 -4.509 3.095 773 HG11 VAL 109 1HG1 VAL 109 -6.178 -6.418 4.167 774 HG12 VAL 109 2HG1 VAL 109 -7.243 -5.320 5.047 775 HG13 VAL 109 3HG1 VAL 109 -7.801 -6.939 4.620 776 HG21 VAL 109 3HG2 VAL 109 -5.757 -5.397 2.197 777 HG22 VAL 109 1HG2 VAL 109 -6.654 -6.798 1.610 778 HG23 VAL 109 2HG2 VAL 109 -7.033 -5.188 0.997 779 H PHE 110 H PHE 110 -10.032 -6.750 4.908 780 HA PHE 110 HA PHE 110 -11.701 -4.364 5.011 781 HB2 PHE 110 1HB PHE 110 -12.736 -7.172 4.910 782 HB3 PHE 110 2HB PHE 110 -13.591 -5.975 5.878 783 HD1 PHE 110 HD1 PHE 110 -12.469 -6.814 2.465 784 HD2 PHE 110 HD2 PHE 110 -14.952 -4.330 4.870 785 HE1 PHE 110 HE1 PHE 110 -13.620 -6.012 0.444 786 HE2 PHE 110 HE2 PHE 110 -16.107 -3.525 2.853 787 HZ PHE 110 HZ PHE 110 -15.442 -4.367 0.636 788 H GLU 111 H GLU 111 -11.819 -3.528 7.011 789 HA GLU 111 HA GLU 111 -10.537 -5.030 9.173 790 HB2 GLU 111 1HB GLU 111 -10.029 -2.538 8.393 791 HB3 GLU 111 2HB GLU 111 -11.350 -2.182 9.496 792 HG2 GLU 111 1HG GLU 111 -9.093 -3.908 10.401 793 HG3 GLU 111 2HG GLU 111 -8.897 -2.157 10.344 794 H VAL 112 H VAL 112 -11.667 -5.875 10.793 795 HA VAL 112 HA VAL 112 -14.490 -5.092 11.079 796 HB VAL 112 HB VAL 112 -13.299 -7.611 12.207 797 HG11 VAL 112 1HG1 VAL 112 -15.520 -8.379 12.321 798 HG12 VAL 112 2HG1 VAL 112 -15.577 -6.710 12.891 799 HG13 VAL 112 3HG1 VAL 112 -16.103 -7.102 11.254 800 HG21 VAL 112 3HG2 VAL 112 -14.075 -8.779 10.176 801 HG22 VAL 112 1HG2 VAL 112 -14.428 -7.216 9.438 802 HG23 VAL 112 2HG2 VAL 112 -12.767 -7.644 9.845 803 H GLU 113 H GLU 113 -15.166 -4.162 12.905 804 HA GLU 113 HA GLU 113 -13.487 -4.374 15.308 805 HB2 GLU 113 1HB GLU 113 -14.847 -1.789 14.632 806 HB3 GLU 113 2HB GLU 113 -13.489 -2.078 15.711 807 HG2 GLU 113 1HG GLU 113 -12.117 -2.635 13.698 808 HG3 GLU 113 2HG GLU 113 -13.470 -2.097 12.706 809 H LEU 114 H LEU 114 -14.775 -5.587 16.570 810 HA LEU 114 HA LEU 114 -17.623 -5.357 16.582 811 HB2 LEU 114 1HB LEU 114 -15.857 -7.280 17.340 812 HB3 LEU 114 2HB LEU 114 -16.339 -6.619 18.902 813 HG LEU 114 HG LEU 114 -18.296 -7.635 16.847 814 HD11 LEU 114 1HD1 LEU 114 -16.512 -9.245 18.039 815 HD12 LEU 114 2HD1 LEU 114 -18.163 -9.735 17.663 816 HD13 LEU 114 3HD1 LEU 114 -17.753 -9.197 19.291 817 HD21 LEU 114 3HD2 LEU 114 -19.396 -7.850 19.353 818 HD22 LEU 114 1HD2 LEU 114 -19.715 -6.558 18.195 819 HD23 LEU 114 2HD2 LEU 114 -18.496 -6.336 19.449 820 H LEU 115 H LEU 115 -18.876 -4.050 17.746 821 HA LEU 115 HA LEU 115 -17.605 -2.345 19.762 822 HB2 LEU 115 1HB LEU 115 -20.302 -2.058 18.449 823 HB3 LEU 115 2HB LEU 115 -19.519 -0.882 19.502 824 HG LEU 115 HG LEU 115 -17.657 -1.037 17.589 825 HD11 LEU 115 1HD1 LEU 115 -19.841 -1.001 15.698 826 HD12 LEU 115 2HD1 LEU 115 -19.701 -2.567 16.497 827 HD13 LEU 115 3HD1 LEU 115 -18.316 -1.885 15.644 828 HD21 LEU 115 3HD2 LEU 115 -18.234 1.108 17.740 829 HD22 LEU 115 1HD2 LEU 115 -19.885 0.707 18.212 830 HD23 LEU 115 2HD2 LEU 115 -19.449 0.777 16.504 831 H ASP 116 H ASP 116 -20.374 -4.490 19.283 832 HA ASP 116 HA ASP 116 -20.359 -5.360 21.976 833 HB2 ASP 116 1HB ASP 116 -21.392 -3.030 22.152 834 HB3 ASP 116 2HB ASP 116 -22.774 -3.692 21.283 835 H VAL 117 H VAL 117 -22.287 -6.779 22.450 836 HA VAL 117 HA VAL 117 -23.128 -8.107 19.960 837 HB VAL 117 HB VAL 117 -23.538 -10.101 21.477 838 HG11 VAL 117 1HG1 VAL 117 -20.865 -10.297 21.787 839 HG12 VAL 117 2HG1 VAL 117 -21.696 -10.534 20.248 840 HG13 VAL 117 3HG1 VAL 117 -20.953 -8.978 20.620 841 HG21 VAL 117 3HG2 VAL 117 -22.774 -10.157 23.649 842 HG22 VAL 117 1HG2 VAL 117 -21.636 -8.833 23.395 843 HG23 VAL 117 2HG2 VAL 117 -23.362 -8.498 23.538 844 H13 JZF 130 1H3 JZF 130 -17.246 -5.192 0.318 845 H23 JZF 130 2H3 JZF 130 -18.195 -4.071 1.278 846 H4 JZF 130 H4 JZF 130 -18.772 -5.013 -1.554 847 H15 JZF 130 1H5 JZF 130 -20.704 -3.533 -1.573 848 H25 JZF 130 2H5 JZF 130 -20.392 -3.008 0.074 849 H17 JZF 130 1H7 JZF 130 -17.630 -2.394 -0.583 850 H27 JZF 130 2H7 JZF 130 -16.954 -3.544 -1.690 851 H8 JZF 130 H8 JZF 130 -19.419 -2.441 -2.691 852 H9 JZF 130 H9 JZF 130 -16.728 -2.959 -3.845 853 H1OH JZF 130 1HO JZF 130 -19.160 -0.483 -2.124 854 H11 JZF 130 H11 JZF 130 -16.953 -4.548 -5.878 855 H112 JZF 130 1H12 JZF 130 -18.810 -2.556 -7.275 856 H212 JZF 130 2H12 JZF 130 -17.324 -3.214 -7.942 857 H13A JZF 130 H13 JZF 130 -17.135 -0.870 -7.027 858 H114 JZF 130 1H14 JZF 130 -17.074 -0.542 -4.584 859 H214 JZF 130 2H14 JZF 130 -18.653 -0.977 -5.186 860 H115 JZF 130 1H15 JZF 130 -22.191 -6.681 1.739 861 H215 JZF 130 2H15 JZF 130 -20.741 -7.660 1.966 862 H116 JZF 130 1H16 JZF 130 -22.330 -8.069 -2.422 863 H216 JZF 130 2H16 JZF 130 -20.642 -8.368 -2.930 864 H117 JZF 130 2H17 JZF 130 -22.555 -10.374 -2.538 865 H217 JZF 130 3H17 JZF 130 -20.802 -10.639 -2.488 866 H317 JZF 130 1H17 JZF 130 -21.701 -10.371 -0.985 867 H118 JZF 130 1H18 JZF 130 -19.863 -4.968 -6.679 868 H218 JZF 130 2H18 JZF 130 -18.532 -5.334 -7.783 869 H318 JZF 130 3H18 JZF 130 -18.658 -6.187 -6.236 870 H119 JZF 130 3H19 JZF 130 -15.312 -3.011 -5.824 871 H219 JZF 130 1H19 JZF 130 -15.061 -2.025 -7.268 872 H319 JZF 130 2H19 JZF 130 -15.008 -1.277 -5.671 Start of MODEL 16 1 H1 GLY 1 H GLY 1 3.368 3.683 -1.761 2 HA2 GLY 1 1HA GLY 1 4.915 1.912 -1.812 3 HA3 GLY 1 2HA GLY 1 5.900 3.241 -1.218 4 HA PRO 2 HA PRO 2 6.717 1.116 2.521 5 HB2 PRO 2 1HB PRO 2 6.578 3.075 4.395 6 HB3 PRO 2 2HB PRO 2 7.896 2.959 3.223 7 HG2 PRO 2 1HG PRO 2 5.462 4.700 3.169 8 HG3 PRO 2 2HG PRO 2 7.140 5.111 2.770 9 HD2 PRO 2 1HD PRO 2 5.279 4.583 0.875 10 HD3 PRO 2 2HD PRO 2 6.997 4.188 0.662 11 H GLY 3 H GLY 3 4.654 -0.096 2.330 12 HA2 GLY 3 1HA GLY 3 2.941 0.513 4.638 13 HA3 GLY 3 2HA GLY 3 2.189 0.239 3.074 14 H SER 4 H SER 4 4.828 -1.372 4.847 15 HA SER 4 HA SER 4 3.773 -3.957 4.076 16 HB2 SER 4 1HB SER 4 6.294 -3.152 4.326 17 HB3 SER 4 2HB SER 4 6.053 -3.695 5.986 18 HG SER 4 HG SER 4 6.471 -5.592 5.188 19 H MET 5 H MET 5 3.676 -5.704 5.783 20 HA MET 5 HA MET 5 3.226 -5.096 8.492 21 HB2 MET 5 1HB MET 5 0.783 -5.364 8.597 22 HB3 MET 5 2HB MET 5 1.243 -3.936 7.679 23 HG2 MET 5 1HG MET 5 0.790 -6.456 6.185 24 HG3 MET 5 2HG MET 5 -0.613 -5.617 6.842 25 HE1 MET 5 3HE MET 5 -0.148 -6.417 4.079 26 HE2 MET 5 1HE MET 5 -0.294 -5.058 2.965 27 HE3 MET 5 2HE MET 5 1.298 -5.710 3.356 28 H THR 6 H THR 6 2.555 -6.945 9.728 29 HA THR 6 HA THR 6 3.220 -9.441 8.378 30 HB THR 6 HB THR 6 3.073 -10.342 10.796 31 HG1 THR 6 HG1 THR 6 3.237 -8.754 12.392 32 HG21 THR 6 3HG2 THR 6 5.140 -9.565 9.353 33 HG22 THR 6 1HG2 THR 6 5.325 -9.976 11.057 34 HG23 THR 6 2HG2 THR 6 5.218 -8.286 10.564 35 H VAL 7 H VAL 7 1.314 -9.835 7.213 36 HA VAL 7 HA VAL 7 -1.155 -10.194 8.744 37 HB VAL 7 HB VAL 7 -0.775 -10.438 5.759 38 HG11 VAL 7 1HG1 VAL 7 -3.378 -9.620 6.726 39 HG12 VAL 7 2HG1 VAL 7 -2.942 -10.942 5.641 40 HG13 VAL 7 3HG1 VAL 7 -2.894 -11.181 7.388 41 HG21 VAL 7 3HG2 VAL 7 -1.702 -8.050 7.353 42 HG22 VAL 7 1HG2 VAL 7 -0.152 -8.197 6.524 43 HG23 VAL 7 2HG2 VAL 7 -1.651 -8.168 5.594 44 H VAL 8 H VAL 8 -2.007 -12.136 9.201 45 HA VAL 8 HA VAL 8 -0.491 -14.505 8.391 46 HB VAL 8 HB VAL 8 -2.690 -14.324 10.452 47 HG11 VAL 8 1HG1 VAL 8 -1.092 -16.491 9.351 48 HG12 VAL 8 2HG1 VAL 8 -0.992 -16.392 11.111 49 HG13 VAL 8 3HG1 VAL 8 -2.563 -16.549 10.322 50 HG21 VAL 8 3HG2 VAL 8 -0.912 -12.878 11.161 51 HG22 VAL 8 1HG2 VAL 8 -0.827 -14.364 12.106 52 HG23 VAL 8 2HG2 VAL 8 0.300 -14.100 10.776 53 H THR 9 H THR 9 -1.310 -16.091 7.142 54 HA THR 9 HA THR 9 -4.015 -15.678 6.064 55 HB THR 9 HB THR 9 -1.888 -17.427 4.837 56 HG1 THR 9 HG1 THR 9 -1.382 -15.607 3.534 57 HG21 THR 9 3HG2 THR 9 -3.412 -16.389 2.828 58 HG22 THR 9 1HG2 THR 9 -4.596 -16.543 4.125 59 HG23 THR 9 2HG2 THR 9 -3.687 -17.956 3.589 60 H THR 10 H THR 10 -5.385 -17.494 5.718 61 HA THR 10 HA THR 10 -4.905 -19.657 7.646 62 HB THR 10 HB THR 10 -7.289 -20.043 7.663 63 HG1 THR 10 HG1 THR 10 -7.249 -18.240 5.486 64 HG21 THR 10 3HG2 THR 10 -6.667 -17.092 7.839 65 HG22 THR 10 1HG2 THR 10 -6.482 -18.275 9.133 66 HG23 THR 10 2HG2 THR 10 -8.089 -17.879 8.524 67 H GLU 11 H GLU 11 -6.260 -21.720 6.922 68 HA GLU 11 HA GLU 11 -4.897 -22.775 4.671 69 HB2 GLU 11 1HB GLU 11 -5.820 -23.999 6.757 70 HB3 GLU 11 2HB GLU 11 -7.343 -24.032 5.881 71 HG2 GLU 11 1HG GLU 11 -6.336 -25.283 4.086 72 HG3 GLU 11 2HG GLU 11 -4.752 -25.162 4.850 73 H SER 12 H SER 12 -8.031 -21.325 5.131 74 HA SER 12 HA SER 12 -9.128 -22.229 2.641 75 HB2 SER 12 1HB SER 12 -10.319 -21.361 4.844 76 HB3 SER 12 2HB SER 12 -10.186 -19.802 4.029 77 HG SER 12 HG SER 12 -12.109 -20.689 3.399 78 H GLY 13 H GLY 13 -7.489 -19.326 3.782 79 HA2 GLY 13 1HA GLY 13 -6.091 -18.409 1.823 80 HA3 GLY 13 2HA GLY 13 -7.664 -18.188 1.072 81 H LEU 14 H LEU 14 -9.021 -17.401 3.493 82 HA LEU 14 HA LEU 14 -8.623 -14.631 3.386 83 HB2 LEU 14 1HB LEU 14 -10.734 -15.474 4.071 84 HB3 LEU 14 2HB LEU 14 -10.011 -16.387 5.394 85 HG LEU 14 HG LEU 14 -9.742 -13.427 5.443 86 HD11 LEU 14 1HD1 LEU 14 -12.178 -14.345 6.733 87 HD12 LEU 14 2HD1 LEU 14 -12.233 -14.505 4.977 88 HD13 LEU 14 3HD1 LEU 14 -11.898 -12.936 5.709 89 HD21 LEU 14 3HD2 LEU 14 -10.341 -14.081 7.910 90 HD22 LEU 14 1HD2 LEU 14 -8.723 -14.370 7.270 91 HD23 LEU 14 2HD2 LEU 14 -9.881 -15.697 7.371 92 H LYS 15 H LYS 15 -7.583 -13.184 4.709 93 HA LYS 15 HA LYS 15 -5.670 -14.349 6.623 94 HB2 LYS 15 1HB LYS 15 -5.360 -11.690 5.237 95 HB3 LYS 15 2HB LYS 15 -4.135 -12.609 6.102 96 HG2 LYS 15 1HG LYS 15 -4.148 -14.305 4.368 97 HG3 LYS 15 2HG LYS 15 -5.430 -13.444 3.513 98 HD2 LYS 15 1HD LYS 15 -3.787 -11.453 3.520 99 HD3 LYS 15 2HD LYS 15 -2.558 -12.664 3.895 100 HE2 LYS 15 1HE LYS 15 -3.570 -13.927 1.858 101 HE3 LYS 15 2HE LYS 15 -4.220 -12.346 1.428 102 HZ1 LYS 15 3HZ LYS 15 -1.348 -12.762 2.009 103 HZ2 LYS 15 1HZ LYS 15 -2.079 -11.452 1.226 104 HZ3 LYS 15 2HZ LYS 15 -1.989 -12.955 0.455 105 H TYR 16 H TYR 16 -5.089 -12.978 8.466 106 HA TYR 16 HA TYR 16 -6.992 -10.901 9.188 107 HB2 TYR 16 1HB TYR 16 -7.730 -11.930 11.213 108 HB3 TYR 16 2HB TYR 16 -7.975 -13.103 9.925 109 HD1 TYR 16 HD1 TYR 16 -5.792 -14.665 9.548 110 HD2 TYR 16 HD2 TYR 16 -6.885 -12.752 13.188 111 HE1 TYR 16 HE1 TYR 16 -4.486 -16.326 10.807 112 HE2 TYR 16 HE2 TYR 16 -5.581 -14.406 14.456 113 HH TYR 16 HH TYR 16 -3.367 -16.511 12.999 114 H GLU 17 H GLU 17 -6.062 -9.333 10.359 115 HA GLU 17 HA GLU 17 -3.550 -9.925 11.764 116 HB2 GLU 17 1HB GLU 17 -2.651 -7.739 10.959 117 HB3 GLU 17 2HB GLU 17 -2.861 -8.936 9.689 118 HG2 GLU 17 1HG GLU 17 -4.223 -7.608 8.558 119 HG3 GLU 17 2HG GLU 17 -5.231 -7.330 9.977 120 H ASP 18 H ASP 18 -3.739 -9.387 13.824 121 HA ASP 18 HA ASP 18 -5.896 -7.948 14.895 122 HB2 ASP 18 1HB ASP 18 -3.208 -8.710 16.031 123 HB3 ASP 18 2HB ASP 18 -4.422 -7.856 16.979 124 H LEU 19 H LEU 19 -6.200 -5.848 15.422 125 HA LEU 19 HA LEU 19 -4.012 -3.975 14.798 126 HB2 LEU 19 1HB LEU 19 -6.924 -3.886 14.154 127 HB3 LEU 19 2HB LEU 19 -6.044 -2.377 14.392 128 HG LEU 19 HG LEU 19 -5.337 -4.479 12.346 129 HD11 LEU 19 1HD1 LEU 19 -6.499 -1.791 11.736 130 HD12 LEU 19 2HD1 LEU 19 -7.545 -3.167 12.084 131 HD13 LEU 19 3HD1 LEU 19 -6.425 -3.233 10.724 132 HD21 LEU 19 3HD2 LEU 19 -4.055 -2.017 13.297 133 HD22 LEU 19 1HD2 LEU 19 -4.206 -2.145 11.544 134 HD23 LEU 19 2HD2 LEU 19 -3.368 -3.405 12.451 135 H THR 20 H THR 20 -6.659 -4.802 16.923 136 HA THR 20 HA THR 20 -5.477 -3.243 19.047 137 HB THR 20 HB THR 20 -8.371 -2.659 18.529 138 HG1 THR 20 HG1 THR 20 -7.483 -0.660 17.508 139 HG21 THR 20 3HG2 THR 20 -7.415 -0.441 19.600 140 HG22 THR 20 1HG2 THR 20 -6.147 -1.530 20.160 141 HG23 THR 20 2HG2 THR 20 -7.828 -1.833 20.600 142 H GLU 21 H GLU 21 -5.408 -4.713 20.613 143 HA GLU 21 HA GLU 21 -6.899 -7.026 20.818 144 HB2 GLU 21 1HB GLU 21 -5.426 -5.383 22.853 145 HB3 GLU 21 2HB GLU 21 -6.314 -6.819 23.342 146 HG2 GLU 21 1HG GLU 21 -4.040 -7.429 23.014 147 HG3 GLU 21 2HG GLU 21 -4.986 -8.127 21.701 148 H GLY 22 H GLY 22 -8.485 -7.625 22.522 149 HA2 GLY 22 1HA GLY 22 -10.129 -5.563 23.661 150 HA3 GLY 22 2HA GLY 22 -10.883 -6.339 22.276 151 H SER 23 H SER 23 -10.160 -6.566 25.606 152 HA SER 23 HA SER 23 -10.549 -9.379 25.903 153 HB2 SER 23 1HB SER 23 -10.308 -7.046 27.747 154 HB3 SER 23 2HB SER 23 -11.024 -8.529 28.378 155 HG SER 23 HG SER 23 -8.515 -8.047 28.241 156 H GLY 24 H GLY 24 -12.510 -9.571 24.603 157 HA2 GLY 24 1HA GLY 24 -14.908 -8.976 26.221 158 HA3 GLY 24 2HA GLY 24 -14.894 -8.736 24.480 159 H ALA 25 H ALA 25 -16.098 -10.247 23.552 160 HA ALA 25 HA ALA 25 -15.528 -13.049 24.133 161 HB1 ALA 25 1HB ALA 25 -17.439 -12.310 25.593 162 HB2 ALA 25 2HB ALA 25 -18.371 -12.060 24.116 163 HB3 ALA 25 3HB ALA 25 -17.783 -13.672 24.526 164 H GLU 26 H GLU 26 -15.798 -14.398 22.398 165 HA GLU 26 HA GLU 26 -15.860 -13.219 19.820 166 HB2 GLU 26 1HB GLU 26 -14.568 -15.208 20.137 167 HB3 GLU 26 2HB GLU 26 -15.964 -16.091 20.740 168 HG2 GLU 26 1HG GLU 26 -16.990 -16.037 18.554 169 HG3 GLU 26 2HG GLU 26 -15.667 -15.054 17.930 170 H ALA 27 H ALA 27 -17.433 -13.170 18.269 171 HA ALA 27 HA ALA 27 -20.112 -13.022 19.064 172 HB1 ALA 27 1HB ALA 27 -19.063 -13.427 16.266 173 HB2 ALA 27 2HB ALA 27 -20.641 -12.781 16.718 174 HB3 ALA 27 3HB ALA 27 -19.176 -11.873 17.093 175 H ARG 28 H ARG 28 -21.928 -14.324 18.360 176 HA ARG 28 HA ARG 28 -21.241 -17.162 17.972 177 HB2 ARG 28 1HB ARG 28 -22.914 -15.871 20.030 178 HB3 ARG 28 2HB ARG 28 -23.622 -17.295 19.280 179 HG2 ARG 28 1HG ARG 28 -21.814 -18.666 19.969 180 HG3 ARG 28 2HG ARG 28 -20.862 -17.266 20.469 181 HD2 ARG 28 1HD ARG 28 -21.692 -17.518 22.515 182 HD3 ARG 28 2HD ARG 28 -23.271 -17.069 21.871 183 HE ARG 28 HE ARG 28 -22.720 -19.830 21.460 184 HH11 ARG 28 1HH1 ARG 28 -23.726 -17.516 23.859 185 HH12 ARG 28 2HH1 ARG 28 -24.602 -18.677 24.800 186 HH21 ARG 28 1HH2 ARG 28 -23.871 -21.368 22.690 187 HH22 ARG 28 2HH2 ARG 28 -24.683 -20.868 24.135 188 H ALA 29 H ALA 29 -22.444 -18.297 16.519 189 HA ALA 29 HA ALA 29 -23.853 -16.870 14.529 190 HB1 ALA 29 1HB ALA 29 -24.554 -19.319 13.894 191 HB2 ALA 29 2HB ALA 29 -22.890 -18.770 13.683 192 HB3 ALA 29 3HB ALA 29 -23.326 -19.748 15.085 193 H GLY 30 H GLY 30 -25.815 -16.020 14.732 194 HA2 GLY 30 1HA GLY 30 -28.209 -16.628 14.820 195 HA3 GLY 30 2HA GLY 30 -27.829 -17.536 16.276 196 H GLN 31 H GLN 31 -25.935 -15.184 16.934 197 HA GLN 31 HA GLN 31 -28.022 -13.565 18.215 198 HB2 GLN 31 1HB GLN 31 -26.325 -12.913 19.827 199 HB3 GLN 31 2HB GLN 31 -26.394 -14.666 19.705 200 HG2 GLN 31 1HG GLN 31 -24.304 -14.826 18.909 201 HG3 GLN 31 2HG GLN 31 -24.453 -13.371 17.926 202 HE21 GLN 31 2HE2 GLN 31 -24.923 -13.777 21.400 203 HE22 GLN 31 1HE2 GLN 31 -23.667 -12.693 21.879 204 H THR 32 H THR 32 -27.945 -11.307 18.179 205 HA THR 32 HA THR 32 -26.626 -10.213 15.822 206 HB THR 32 HB THR 32 -28.648 -8.943 17.678 207 HG1 THR 32 HG1 THR 32 -28.928 -10.076 15.074 208 HG21 THR 32 3HG2 THR 32 -27.555 -8.021 15.018 209 HG22 THR 32 1HG2 THR 32 -27.271 -7.262 16.583 210 HG23 THR 32 2HG2 THR 32 -28.891 -7.266 15.887 211 H VAL 33 H VAL 33 -25.254 -8.426 15.856 212 HA VAL 33 HA VAL 33 -24.421 -7.318 18.411 213 HB VAL 33 HB VAL 33 -22.070 -7.802 18.122 214 HG11 VAL 33 1HG1 VAL 33 -23.560 -10.397 17.797 215 HG12 VAL 33 2HG1 VAL 33 -22.068 -10.105 18.694 216 HG13 VAL 33 3HG1 VAL 33 -23.594 -9.441 19.279 217 HG21 VAL 33 3HG2 VAL 33 -22.974 -8.751 15.484 218 HG22 VAL 33 1HG2 VAL 33 -21.448 -8.010 15.964 219 HG23 VAL 33 2HG2 VAL 33 -21.727 -9.726 16.261 220 H SER 34 H SER 34 -23.107 -5.418 18.198 221 HA SER 34 HA SER 34 -23.473 -4.109 15.591 222 HB2 SER 34 1HB SER 34 -24.351 -3.225 17.965 223 HB3 SER 34 2HB SER 34 -22.735 -2.518 17.995 224 HG SER 34 HG SER 34 -24.860 -1.620 16.723 225 H VAL 35 H VAL 35 -21.738 -3.888 14.360 226 HA VAL 35 HA VAL 35 -19.156 -3.288 15.597 227 HB VAL 35 HB VAL 35 -17.953 -4.979 14.549 228 HG11 VAL 35 1HG1 VAL 35 -19.710 -5.711 16.331 229 HG12 VAL 35 2HG1 VAL 35 -20.459 -6.548 14.970 230 HG13 VAL 35 3HG1 VAL 35 -18.802 -6.930 15.438 231 HG21 VAL 35 3HG2 VAL 35 -19.393 -6.517 12.884 232 HG22 VAL 35 1HG2 VAL 35 -20.196 -4.967 12.628 233 HG23 VAL 35 2HG2 VAL 35 -18.461 -5.119 12.347 234 H HIS 36 H HIS 36 -17.537 -2.567 13.973 235 HA HIS 36 HA HIS 36 -18.875 -1.084 11.811 236 HB2 HIS 36 1HB HIS 36 -16.762 -0.390 13.733 237 HB3 HIS 36 2HB HIS 36 -16.416 0.096 12.076 238 HD1 HIS 36 HD1 HIS 36 -18.656 1.396 10.948 239 HD2 HIS 36 HD2 HIS 36 -18.119 1.515 15.066 240 HE1 HIS 36 HE1 HIS 36 -20.014 3.356 11.747 241 H TYR 37 H TYR 37 -18.292 -1.404 9.747 242 HA TYR 37 HA TYR 37 -15.988 -3.172 9.244 243 HB2 TYR 37 1HB TYR 37 -17.144 -4.099 7.371 244 HB3 TYR 37 2HB TYR 37 -18.270 -4.113 8.723 245 HD1 TYR 37 HD1 TYR 37 -20.082 -2.385 8.824 246 HD2 TYR 37 HD2 TYR 37 -17.625 -2.895 5.388 247 HE1 TYR 37 HE1 TYR 37 -21.728 -1.156 7.472 248 HE2 TYR 37 HE2 TYR 37 -19.264 -1.666 4.027 249 HH TYR 37 HH TYR 37 -21.087 0.101 4.490 250 H THR 38 H THR 38 -14.526 -2.619 7.691 251 HA THR 38 HA THR 38 -14.980 -0.094 6.245 252 HB THR 38 HB THR 38 -12.178 -0.670 6.950 253 HG1 THR 38 HG1 THR 38 -14.170 -0.348 8.893 254 HG21 THR 38 3HG2 THR 38 -12.727 1.371 5.820 255 HG22 THR 38 1HG2 THR 38 -12.251 1.780 7.467 256 HG23 THR 38 2HG2 THR 38 -13.957 1.766 7.019 257 H GLY 39 H GLY 39 -13.892 0.119 4.234 258 HA2 GLY 39 1HA GLY 39 -13.103 -2.481 3.078 259 HA3 GLY 39 2HA GLY 39 -13.886 -1.192 2.175 260 H TRP 40 H TRP 40 -10.938 -2.590 3.069 261 HA TRP 40 HA TRP 40 -9.472 -0.280 1.969 262 HB2 TRP 40 1HB TRP 40 -8.451 -2.329 3.949 263 HB3 TRP 40 2HB TRP 40 -7.545 -0.959 3.314 264 HD1 TRP 40 HD1 TRP 40 -10.268 0.990 3.677 265 HE1 TRP 40 HE1 TRP 40 -10.674 1.922 6.042 266 HE3 TRP 40 HE3 TRP 40 -7.419 -2.307 6.351 267 HZ2 TRP 40 HZ2 TRP 40 -9.890 1.338 8.690 268 HZ3 TRP 40 HZ3 TRP 40 -7.300 -2.051 8.795 269 HH2 TRP 40 HH2 TRP 40 -8.510 -0.266 9.938 270 H LEU 41 H LEU 41 -7.465 -0.839 0.816 271 HA LEU 41 HA LEU 41 -7.892 -3.217 -0.830 272 HB2 LEU 41 1HB LEU 41 -6.631 -0.585 -1.209 273 HB3 LEU 41 2HB LEU 41 -5.805 -1.934 -1.988 274 HG LEU 41 HG LEU 41 -7.309 -0.836 -3.541 275 HD11 LEU 41 1HD1 LEU 41 -7.054 -3.472 -3.237 276 HD12 LEU 41 2HD1 LEU 41 -8.073 -2.750 -4.482 277 HD13 LEU 41 3HD1 LEU 41 -8.794 -3.334 -2.982 278 HD21 LEU 41 3HD2 LEU 41 -9.417 -1.454 -1.480 279 HD22 LEU 41 1HD2 LEU 41 -9.774 -0.989 -3.143 280 HD23 LEU 41 2HD2 LEU 41 -8.925 0.132 -2.078 281 H THR 42 H THR 42 -5.952 -4.441 -1.536 282 HA THR 42 HA THR 42 -4.550 -5.463 0.677 283 HB THR 42 HB THR 42 -3.411 -6.894 -0.827 284 HG1 THR 42 HG1 THR 42 -3.053 -6.396 -2.948 285 HG21 THR 42 3HG2 THR 42 -5.895 -7.181 -0.698 286 HG22 THR 42 1HG2 THR 42 -5.169 -7.810 -2.176 287 HG23 THR 42 2HG2 THR 42 -6.024 -6.268 -2.201 288 H ASP 43 H ASP 43 -3.961 -2.739 -1.284 289 HA ASP 43 HA ASP 43 -1.107 -2.667 -0.696 290 HB2 ASP 43 1HB ASP 43 -2.908 -0.854 -2.307 291 HB3 ASP 43 2HB ASP 43 -1.204 -0.515 -2.020 292 H GLY 44 H GLY 44 -4.066 -1.473 0.553 293 HA2 GLY 44 1HA GLY 44 -3.982 -0.627 2.848 294 HA3 GLY 44 2HA GLY 44 -2.553 0.284 2.382 295 H GLN 45 H GLN 45 -4.734 0.360 -0.128 296 HA GLN 45 HA GLN 45 -5.437 3.107 0.489 297 HB2 GLN 45 1HB GLN 45 -4.904 3.100 -1.718 298 HB3 GLN 45 2HB GLN 45 -5.357 1.414 -1.931 299 HG2 GLN 45 1HG GLN 45 -7.590 1.925 -2.286 300 HG3 GLN 45 2HG GLN 45 -7.447 3.514 -1.535 301 HE21 GLN 45 2HE2 GLN 45 -6.451 1.616 -4.335 302 HE22 GLN 45 1HE2 GLN 45 -6.330 2.952 -5.424 303 H LYS 46 H LYS 46 -7.261 3.639 1.472 304 HA LYS 46 HA LYS 46 -9.382 1.701 1.793 305 HB2 LYS 46 1HB LYS 46 -8.846 2.998 3.726 306 HB3 LYS 46 2HB LYS 46 -8.972 4.505 2.829 307 HG2 LYS 46 1HG LYS 46 -11.331 4.325 2.685 308 HG3 LYS 46 2HG LYS 46 -11.304 2.662 3.275 309 HD2 LYS 46 1HD LYS 46 -11.820 3.658 5.240 310 HD3 LYS 46 2HD LYS 46 -10.073 3.893 5.323 311 HE2 LYS 46 1HE LYS 46 -11.856 5.923 4.024 312 HE3 LYS 46 2HE LYS 46 -11.611 5.910 5.769 313 HZ1 LYS 46 3HZ LYS 46 -9.869 7.204 5.282 314 HZ2 LYS 46 1HZ LYS 46 -9.812 6.722 3.661 315 HZ3 LYS 46 2HZ LYS 46 -9.093 5.763 4.854 316 H PHE 47 H PHE 47 -11.178 1.573 0.617 317 HA PHE 47 HA PHE 47 -11.848 3.837 -1.147 318 HB2 PHE 47 1HB PHE 47 -12.594 2.311 -2.820 319 HB3 PHE 47 2HB PHE 47 -11.017 1.737 -2.288 320 HD1 PHE 47 HD2 PHE 47 -10.911 -0.185 -0.670 321 HD2 PHE 47 HD1 PHE 47 -14.496 0.954 -2.663 322 HE1 PHE 47 HE2 PHE 47 -11.879 -2.394 -0.186 323 HE2 PHE 47 HE1 PHE 47 -15.469 -1.254 -2.181 324 HZ PHE 47 HZ PHE 47 -14.160 -2.932 -0.942 325 H ASP 48 H ASP 48 -13.008 1.423 1.080 326 HA ASP 48 HA ASP 48 -15.666 2.696 1.007 327 HB2 ASP 48 1HB ASP 48 -14.909 -0.122 0.837 328 HB3 ASP 48 2HB ASP 48 -16.088 0.194 2.108 329 H SER 49 H SER 49 -16.697 3.065 2.969 330 HA SER 49 HA SER 49 -15.435 2.289 5.451 331 HB2 SER 49 1HB SER 49 -15.259 4.667 6.248 332 HB3 SER 49 2HB SER 49 -14.107 4.242 4.982 333 HG SER 49 HG SER 49 -14.926 5.814 3.876 334 H SER 50 H SER 50 -16.904 2.064 7.031 335 HA SER 50 HA SER 50 -19.657 2.310 6.462 336 HB2 SER 50 1HB SER 50 -19.742 2.000 9.099 337 HB3 SER 50 2HB SER 50 -19.287 0.669 8.035 338 HG SER 50 HG SER 50 -17.486 0.636 9.098 339 H LYS 51 H LYS 51 -17.374 4.585 7.498 340 HA LYS 51 HA LYS 51 -18.872 6.252 9.168 341 HB2 LYS 51 1HB LYS 51 -17.288 8.000 8.589 342 HB3 LYS 51 2HB LYS 51 -16.440 6.476 8.812 343 HG2 LYS 51 1HG LYS 51 -16.799 6.321 6.193 344 HG3 LYS 51 2HG LYS 51 -16.859 8.077 6.354 345 HD2 LYS 51 1HD LYS 51 -14.657 6.512 7.645 346 HD3 LYS 51 2HD LYS 51 -14.578 6.915 5.928 347 HE2 LYS 51 1HE LYS 51 -15.152 9.325 6.796 348 HE3 LYS 51 2HE LYS 51 -14.496 8.707 8.311 349 HZ1 LYS 51 3HZ LYS 51 -12.726 7.962 6.313 350 HZ2 LYS 51 1HZ LYS 51 -12.488 9.126 7.518 351 HZ3 LYS 51 2HZ LYS 51 -13.112 9.582 6.014 352 H ASP 52 H ASP 52 -19.136 5.644 5.805 353 HA ASP 52 HA ASP 52 -20.140 7.992 4.768 354 HB2 ASP 52 1HB ASP 52 -19.699 5.879 3.494 355 HB3 ASP 52 2HB ASP 52 -21.205 5.233 4.139 356 H ARG 53 H ARG 53 -21.823 5.528 6.660 357 HA ARG 53 HA ARG 53 -24.303 7.055 6.553 358 HB2 ARG 53 1HB ARG 53 -23.907 4.401 6.532 359 HB3 ARG 53 2HB ARG 53 -24.074 4.643 8.266 360 HG2 ARG 53 1HG ARG 53 -26.219 4.105 7.450 361 HG3 ARG 53 2HG ARG 53 -26.233 5.838 7.780 362 HD2 ARG 53 1HD ARG 53 -27.232 5.765 5.708 363 HD3 ARG 53 2HD ARG 53 -25.544 6.028 5.270 364 HE ARG 53 HE ARG 53 -26.235 3.255 5.384 365 HH11 ARG 53 1HH1 ARG 53 -26.335 6.114 3.401 366 HH12 ARG 53 2HH1 ARG 53 -26.383 5.236 1.909 367 HH21 ARG 53 1HH2 ARG 53 -26.297 2.087 3.426 368 HH22 ARG 53 2HH2 ARG 53 -26.362 2.945 1.924 369 H ASN 54 H ASN 54 -21.563 6.714 8.542 370 HA ASN 54 HA ASN 54 -20.973 7.625 10.540 371 HB2 ASN 54 1HB ASN 54 -23.555 9.190 10.398 372 HB3 ASN 54 2HB ASN 54 -22.097 9.609 11.293 373 HD21 ASN 54 2HD2 ASN 54 -20.153 10.032 10.009 374 HD22 ASN 54 1HD2 ASN 54 -20.333 10.790 8.467 375 H ASP 55 H ASP 55 -22.121 5.168 10.692 376 HA ASP 55 HA ASP 55 -23.082 5.133 13.381 377 HB2 ASP 55 1HB ASP 55 -25.034 5.240 11.290 378 HB3 ASP 55 2HB ASP 55 -25.103 3.650 12.045 379 HA PRO 56 HA PRO 56 -21.248 1.148 13.269 380 HB2 PRO 56 1HB PRO 56 -22.635 -0.128 15.222 381 HB3 PRO 56 2HB PRO 56 -21.437 1.127 15.558 382 HG2 PRO 56 1HG PRO 56 -24.421 1.338 15.444 383 HG3 PRO 56 2HG PRO 56 -23.294 2.044 16.617 384 HD2 PRO 56 1HD PRO 56 -24.360 3.472 14.578 385 HD3 PRO 56 2HD PRO 56 -22.734 3.788 15.217 386 H PHE 57 H PHE 57 -21.484 -0.831 12.319 387 HA PHE 57 HA PHE 57 -24.046 -1.347 11.023 388 HB2 PHE 57 1HB PHE 57 -21.716 -1.376 9.867 389 HB3 PHE 57 2HB PHE 57 -21.559 -2.973 10.591 390 HD1 PHE 57 HD1 PHE 57 -24.190 -1.063 8.752 391 HD2 PHE 57 HD2 PHE 57 -22.049 -4.714 9.195 392 HE1 PHE 57 HE1 PHE 57 -25.460 -2.030 6.880 393 HE2 PHE 57 HE2 PHE 57 -23.315 -5.687 7.323 394 HZ PHE 57 HZ PHE 57 -25.022 -4.345 6.163 395 H ALA 58 H ALA 58 -25.403 -2.362 12.394 396 HA ALA 58 HA ALA 58 -24.401 -4.667 13.913 397 HB1 ALA 58 1HB ALA 58 -25.697 -3.967 15.571 398 HB2 ALA 58 2HB ALA 58 -26.129 -2.560 14.598 399 HB3 ALA 58 3HB ALA 58 -27.121 -4.018 14.531 400 H PHE 59 H PHE 59 -25.270 -6.693 13.689 401 HA PHE 59 HA PHE 59 -27.622 -7.249 12.195 402 HB2 PHE 59 1HB PHE 59 -26.722 -8.207 10.217 403 HB3 PHE 59 2HB PHE 59 -25.945 -6.637 10.387 404 HD1 PHE 59 HD2 PHE 59 -23.684 -6.749 11.822 405 HD2 PHE 59 HD1 PHE 59 -25.392 -9.970 9.626 406 HE1 PHE 59 HE2 PHE 59 -21.477 -7.828 11.696 407 HE2 PHE 59 HE1 PHE 59 -23.187 -11.055 9.497 408 HZ PHE 59 HZ PHE 59 -21.226 -9.984 10.532 409 H VAL 60 H VAL 60 -27.637 -9.728 11.627 410 HA VAL 60 HA VAL 60 -26.889 -11.090 14.087 411 HB VAL 60 HB VAL 60 -29.174 -11.357 13.166 412 HG11 VAL 60 1HG1 VAL 60 -29.561 -12.674 11.180 413 HG12 VAL 60 2HG1 VAL 60 -28.529 -11.299 10.779 414 HG13 VAL 60 3HG1 VAL 60 -27.828 -12.908 10.958 415 HG21 VAL 60 3HG2 VAL 60 -27.383 -13.424 14.030 416 HG22 VAL 60 1HG2 VAL 60 -29.102 -13.222 14.370 417 HG23 VAL 60 2HG2 VAL 60 -28.586 -14.093 12.927 418 H LEU 61 H LEU 61 -25.340 -12.600 14.272 419 HA LEU 61 HA LEU 61 -23.495 -12.956 12.095 420 HB2 LEU 61 1HB LEU 61 -22.500 -12.760 14.208 421 HB3 LEU 61 2HB LEU 61 -23.611 -13.921 14.932 422 HG LEU 61 HG LEU 61 -22.497 -15.734 13.704 423 HD11 LEU 61 1HD1 LEU 61 -20.683 -15.436 12.303 424 HD12 LEU 61 2HD1 LEU 61 -20.330 -13.826 12.929 425 HD13 LEU 61 3HD1 LEU 61 -21.720 -14.075 11.873 426 HD21 LEU 61 3HD2 LEU 61 -20.179 -14.456 14.960 427 HD22 LEU 61 1HD2 LEU 61 -20.982 -15.981 15.337 428 HD23 LEU 61 2HD2 LEU 61 -21.636 -14.463 15.954 429 H GLY 62 H GLY 62 -23.390 -14.596 10.694 430 HA2 GLY 62 1HA GLY 62 -23.815 -16.607 9.668 431 HA3 GLY 62 2HA GLY 62 -24.146 -17.258 11.267 432 H GLY 63 H GLY 63 -25.848 -14.617 9.642 433 HA2 GLY 63 1HA GLY 63 -28.037 -16.186 8.748 434 HA3 GLY 63 2HA GLY 63 -28.400 -15.485 10.318 435 H GLY 64 H GLY 64 -26.379 -13.883 7.949 436 HA2 GLY 64 1HA GLY 64 -28.525 -11.879 7.611 437 HA3 GLY 64 2HA GLY 64 -26.814 -11.481 7.664 438 H MET 65 H MET 65 -26.042 -10.937 5.747 439 HA MET 65 HA MET 65 -26.483 -12.618 3.449 440 HB2 MET 65 1HB MET 65 -27.742 -9.912 3.685 441 HB3 MET 65 2HB MET 65 -27.179 -10.467 2.114 442 HG2 MET 65 1HG MET 65 -28.572 -12.563 2.563 443 HG3 MET 65 2HG MET 65 -29.326 -11.623 3.849 444 HE1 MET 65 3HE MET 65 -31.904 -11.981 1.105 445 HE2 MET 65 1HE MET 65 -30.518 -12.523 0.159 446 HE3 MET 65 2HE MET 65 -30.702 -13.048 1.832 447 H VAL 66 H VAL 66 -24.130 -12.486 4.390 448 HA VAL 66 HA VAL 66 -22.694 -10.404 2.874 449 HB VAL 66 HB VAL 66 -20.908 -10.466 4.498 450 HG11 VAL 66 1HG1 VAL 66 -22.198 -9.706 6.551 451 HG12 VAL 66 2HG1 VAL 66 -22.546 -8.862 5.041 452 HG13 VAL 66 3HG1 VAL 66 -23.661 -10.088 5.644 453 HG21 VAL 66 3HG2 VAL 66 -21.420 -11.781 6.677 454 HG22 VAL 66 1HG2 VAL 66 -22.484 -12.735 5.644 455 HG23 VAL 66 2HG2 VAL 66 -20.760 -12.639 5.285 456 H ILE 67 H ILE 67 -20.285 -11.167 2.578 457 HA ILE 67 HA ILE 67 -20.430 -13.600 1.033 458 HB ILE 67 HB ILE 67 -18.254 -13.063 0.214 459 HG12 ILE 67 1HG1 ILE 67 -18.137 -11.069 2.483 460 HG13 ILE 67 2HG1 ILE 67 -17.120 -12.489 2.263 461 HG21 ILE 67 1HG2 ILE 67 -19.605 -10.400 0.552 462 HG22 ILE 67 2HG2 ILE 67 -18.653 -10.981 -0.814 463 HG23 ILE 67 3HG2 ILE 67 -20.247 -11.665 -0.496 464 HD11 ILE 67 3HD1 ILE 67 -17.146 -10.022 0.542 465 HD12 ILE 67 1HD1 ILE 67 -15.900 -10.492 1.697 466 HD13 ILE 67 2HD1 ILE 67 -16.168 -11.459 0.246 467 H LYS 68 H LYS 68 -18.746 -15.276 1.199 468 HA LYS 68 HA LYS 68 -18.715 -16.589 3.595 469 HB2 LYS 68 1HB LYS 68 -16.631 -16.643 1.407 470 HB3 LYS 68 2HB LYS 68 -16.689 -17.796 2.733 471 HG2 LYS 68 1HG LYS 68 -19.149 -17.437 1.119 472 HG3 LYS 68 2HG LYS 68 -17.791 -18.290 0.380 473 HD2 LYS 68 1HD LYS 68 -18.684 -19.037 3.132 474 HD3 LYS 68 2HD LYS 68 -19.597 -19.610 1.734 475 HE2 LYS 68 1HE LYS 68 -16.633 -19.928 1.758 476 HE3 LYS 68 2HE LYS 68 -17.615 -21.020 2.734 477 HZ1 LYS 68 3HZ LYS 68 -18.925 -21.125 0.430 478 HZ2 LYS 68 1HZ LYS 68 -17.663 -22.181 0.822 479 HZ3 LYS 68 2HZ LYS 68 -17.365 -20.833 -0.155 480 H GLY 69 H GLY 69 -16.103 -14.505 2.344 481 HA2 GLY 69 1HA GLY 69 -14.339 -14.690 4.463 482 HA3 GLY 69 2HA GLY 69 -14.519 -13.264 3.452 483 H TRP 70 H TRP 70 -17.180 -12.608 4.163 484 HA TRP 70 HA TRP 70 -16.706 -11.087 6.494 485 HB2 TRP 70 1HB TRP 70 -19.011 -11.556 4.680 486 HB3 TRP 70 2HB TRP 70 -19.377 -10.929 6.285 487 HD1 TRP 70 HD1 TRP 70 -16.643 -10.004 3.670 488 HE1 TRP 70 HE1 TRP 70 -16.645 -7.443 3.411 489 HE3 TRP 70 HE3 TRP 70 -20.423 -8.862 6.917 490 HZ2 TRP 70 HZ2 TRP 70 -18.061 -5.232 4.446 491 HZ3 TRP 70 HZ3 TRP 70 -21.040 -6.500 7.225 492 HH2 TRP 70 HH2 TRP 70 -19.881 -4.724 6.015 493 H ASP 71 H ASP 71 -18.913 -13.832 5.937 494 HA ASP 71 HA ASP 71 -19.855 -14.120 8.525 495 HB2 ASP 71 1HB ASP 71 -20.491 -15.366 6.319 496 HB3 ASP 71 2HB ASP 71 -19.284 -16.537 6.842 497 H GLU 72 H GLU 72 -16.941 -15.490 7.049 498 HA GLU 72 HA GLU 72 -16.156 -17.050 9.264 499 HB2 GLU 72 1HB GLU 72 -15.109 -16.377 6.683 500 HB3 GLU 72 2HB GLU 72 -13.836 -16.197 7.881 501 HG2 GLU 72 1HG GLU 72 -14.651 -18.540 8.683 502 HG3 GLU 72 2HG GLU 72 -15.332 -18.638 7.060 503 H GLY 73 H GLY 73 -15.627 -13.686 8.412 504 HA2 GLY 73 1HA GLY 73 -13.668 -13.221 10.460 505 HA3 GLY 73 2HA GLY 73 -14.480 -11.997 9.495 506 H VAL 74 H VAL 74 -17.092 -12.309 10.083 507 HA VAL 74 HA VAL 74 -17.327 -11.064 12.600 508 HB VAL 74 HB VAL 74 -18.959 -10.630 10.871 509 HG11 VAL 74 1HG1 VAL 74 -20.689 -12.762 10.791 510 HG12 VAL 74 2HG1 VAL 74 -19.502 -12.350 9.551 511 HG13 VAL 74 3HG1 VAL 74 -19.107 -13.540 10.793 512 HG21 VAL 74 3HG2 VAL 74 -20.509 -10.211 12.414 513 HG22 VAL 74 1HG2 VAL 74 -20.855 -11.929 12.616 514 HG23 VAL 74 2HG2 VAL 74 -19.554 -11.176 13.539 515 H GLN 75 H GLN 75 -17.369 -14.382 11.636 516 HA GLN 75 HA GLN 75 -18.579 -15.273 14.127 517 HB2 GLN 75 1HB GLN 75 -18.676 -17.416 13.183 518 HB3 GLN 75 2HB GLN 75 -18.977 -16.339 11.827 519 HG2 GLN 75 1HG GLN 75 -16.659 -16.572 11.114 520 HG3 GLN 75 2HG GLN 75 -16.342 -17.637 12.483 521 HE21 GLN 75 2HE2 GLN 75 -19.127 -17.496 10.313 522 HE22 GLN 75 1HE2 GLN 75 -18.964 -19.107 9.711 523 H GLY 76 H GLY 76 -15.829 -13.939 13.790 524 HA2 GLY 76 1HA GLY 76 -14.403 -15.901 15.464 525 HA3 GLY 76 2HA GLY 76 -13.576 -15.125 14.121 526 H MET 77 H MET 77 -14.764 -12.539 14.462 527 HA MET 77 HA MET 77 -12.938 -11.379 16.231 528 HB2 MET 77 1HB MET 77 -14.114 -9.305 15.864 529 HB3 MET 77 2HB MET 77 -14.051 -10.197 14.350 530 HG2 MET 77 1HG MET 77 -16.318 -10.759 14.452 531 HG3 MET 77 2HG MET 77 -16.430 -10.348 16.162 532 HE1 MET 77 3HE MET 77 -17.555 -8.675 12.649 533 HE2 MET 77 1HE MET 77 -18.223 -9.794 13.838 534 HE3 MET 77 2HE MET 77 -18.701 -8.097 13.859 535 H LYS 78 H LYS 78 -13.384 -10.132 18.183 536 HA LYS 78 HA LYS 78 -15.577 -11.280 19.782 537 HB2 LYS 78 1HB LYS 78 -12.879 -10.481 20.874 538 HB3 LYS 78 2HB LYS 78 -14.161 -11.346 21.712 539 HG2 LYS 78 1HG LYS 78 -13.839 -13.179 19.976 540 HG3 LYS 78 2HG LYS 78 -12.344 -12.344 19.545 541 HD2 LYS 78 1HD LYS 78 -11.739 -12.476 22.010 542 HD3 LYS 78 2HD LYS 78 -13.085 -13.606 22.174 543 HE2 LYS 78 1HE LYS 78 -12.070 -15.183 20.755 544 HE3 LYS 78 2HE LYS 78 -10.913 -14.005 20.138 545 HZ1 LYS 78 3HZ LYS 78 -10.706 -15.703 22.407 546 HZ2 LYS 78 1HZ LYS 78 -10.495 -14.084 22.853 547 HZ3 LYS 78 2HZ LYS 78 -9.512 -14.768 21.658 548 H VAL 79 H VAL 79 -16.237 -9.921 21.631 549 HA VAL 79 HA VAL 79 -16.948 -7.351 20.856 550 HB VAL 79 HB VAL 79 -16.680 -8.356 23.693 551 HG11 VAL 79 1HG1 VAL 79 -18.834 -6.635 23.538 552 HG12 VAL 79 2HG1 VAL 79 -17.249 -6.263 24.217 553 HG13 VAL 79 3HG1 VAL 79 -17.607 -5.857 22.538 554 HG21 VAL 79 3HG2 VAL 79 -18.087 -9.906 22.678 555 HG22 VAL 79 1HG2 VAL 79 -19.211 -8.717 23.335 556 HG23 VAL 79 2HG2 VAL 79 -18.814 -8.700 21.617 557 H GLY 80 H GLY 80 -15.811 -5.543 20.654 558 HA2 GLY 80 1HA GLY 80 -14.360 -3.833 21.280 559 HA3 GLY 80 2HA GLY 80 -13.793 -4.835 22.607 560 H GLY 81 H GLY 81 -13.695 -6.756 19.948 561 HA2 GLY 81 1HA GLY 81 -10.815 -6.394 19.707 562 HA3 GLY 81 2HA GLY 81 -11.755 -7.732 19.064 563 H VAL 82 H VAL 82 -9.803 -5.451 18.061 564 HA VAL 82 HA VAL 82 -11.333 -4.949 15.591 565 HB VAL 82 HB VAL 82 -9.298 -3.087 16.825 566 HG11 VAL 82 1HG1 VAL 82 -9.127 -2.480 14.656 567 HG12 VAL 82 2HG1 VAL 82 -10.685 -3.185 14.222 568 HG13 VAL 82 3HG1 VAL 82 -10.618 -1.607 15.009 569 HG21 VAL 82 3HG2 VAL 82 -12.232 -3.289 17.073 570 HG22 VAL 82 1HG2 VAL 82 -11.041 -2.612 18.183 571 HG23 VAL 82 2HG2 VAL 82 -11.585 -1.672 16.794 572 H ARG 83 H ARG 83 -10.455 -5.863 13.865 573 HA ARG 83 HA ARG 83 -7.589 -5.872 13.476 574 HB2 ARG 83 1HB ARG 83 -7.439 -8.298 13.116 575 HB3 ARG 83 2HB ARG 83 -7.891 -7.916 14.772 576 HG2 ARG 83 1HG ARG 83 -10.252 -8.373 14.186 577 HG3 ARG 83 2HG ARG 83 -9.718 -8.872 12.580 578 HD2 ARG 83 1HD ARG 83 -9.701 -10.914 13.558 579 HD3 ARG 83 2HD ARG 83 -8.094 -10.392 14.063 580 HE ARG 83 HE ARG 83 -9.890 -9.548 16.010 581 HH11 ARG 83 1HH1 ARG 83 -8.712 -12.538 14.672 582 HH12 ARG 83 2HH1 ARG 83 -8.933 -13.433 16.139 583 HH21 ARG 83 1HH2 ARG 83 -10.186 -10.715 17.947 584 HH22 ARG 83 2HH2 ARG 83 -9.773 -12.395 18.001 585 H ARG 84 H ARG 84 -6.973 -6.246 11.318 586 HA ARG 84 HA ARG 84 -9.132 -5.799 9.410 587 HB2 ARG 84 1HB ARG 84 -7.283 -4.285 9.216 588 HB3 ARG 84 2HB ARG 84 -6.129 -5.612 9.178 589 HG2 ARG 84 1HG ARG 84 -7.133 -6.342 7.023 590 HG3 ARG 84 2HG ARG 84 -8.130 -4.886 7.053 591 HD2 ARG 84 1HD ARG 84 -6.432 -3.977 5.896 592 HD3 ARG 84 2HD ARG 84 -5.667 -3.837 7.478 593 HE ARG 84 HE ARG 84 -5.056 -6.357 6.454 594 HH11 ARG 84 1HH1 ARG 84 -4.430 -3.007 5.740 595 HH12 ARG 84 2HH1 ARG 84 -2.896 -3.317 4.997 596 HH21 ARG 84 1HH2 ARG 84 -3.037 -6.778 5.479 597 HH22 ARG 84 2HH2 ARG 84 -2.105 -5.462 4.848 598 H LEU 85 H LEU 85 -10.011 -7.454 8.374 599 HA LEU 85 HA LEU 85 -8.440 -9.913 8.032 600 HB2 LEU 85 1HB LEU 85 -11.404 -9.662 7.641 601 HB3 LEU 85 2HB LEU 85 -10.455 -11.117 7.941 602 HG LEU 85 HG LEU 85 -10.723 -8.962 10.015 603 HD11 LEU 85 1HD1 LEU 85 -12.928 -10.119 9.032 604 HD12 LEU 85 2HD1 LEU 85 -12.735 -9.696 10.733 605 HD13 LEU 85 3HD1 LEU 85 -12.448 -11.352 10.199 606 HD21 LEU 85 3HD2 LEU 85 -10.220 -10.801 11.535 607 HD22 LEU 85 1HD2 LEU 85 -8.959 -10.629 10.314 608 HD23 LEU 85 2HD2 LEU 85 -10.152 -11.921 10.173 609 H THR 86 H THR 86 -7.744 -10.458 6.078 610 HA THR 86 HA THR 86 -8.561 -8.889 3.778 611 HB THR 86 HB THR 86 -6.645 -11.184 3.593 612 HG1 THR 86 HG1 THR 86 -5.012 -9.547 4.219 613 HG21 THR 86 3HG2 THR 86 -6.387 -10.302 1.563 614 HG22 THR 86 1HG2 THR 86 -5.714 -8.858 2.317 615 HG23 THR 86 2HG2 THR 86 -7.441 -8.950 1.973 616 H ILE 87 H ILE 87 -10.354 -9.472 2.741 617 HA ILE 87 HA ILE 87 -11.087 -12.302 2.595 618 HB ILE 87 HB ILE 87 -12.662 -9.830 1.864 619 HG12 ILE 87 1HG1 ILE 87 -13.356 -11.757 4.053 620 HG13 ILE 87 2HG1 ILE 87 -12.142 -10.515 4.342 621 HG21 ILE 87 1HG2 ILE 87 -14.475 -11.845 2.049 622 HG22 ILE 87 2HG2 ILE 87 -13.783 -11.254 0.540 623 HG23 ILE 87 3HG2 ILE 87 -13.100 -12.678 1.324 624 HD11 ILE 87 3HD1 ILE 87 -14.698 -10.141 4.878 625 HD12 ILE 87 1HD1 ILE 87 -13.660 -8.832 4.312 626 HD13 ILE 87 2HD1 ILE 87 -14.729 -9.663 3.181 627 HA PRO 88 HA PRO 88 -9.273 -12.163 -1.528 628 HB2 PRO 88 1HB PRO 88 -9.352 -14.853 -1.891 629 HB3 PRO 88 2HB PRO 88 -8.093 -14.047 -0.947 630 HG2 PRO 88 1HG PRO 88 -10.559 -15.459 -0.003 631 HG3 PRO 88 2HG PRO 88 -8.911 -15.530 0.648 632 HD2 PRO 88 1HD PRO 88 -10.856 -14.015 1.768 633 HD3 PRO 88 2HD PRO 88 -9.144 -13.544 1.795 634 HA PRO 89 HA PRO 89 -12.720 -12.570 -4.227 635 HB2 PRO 89 1HB PRO 89 -11.675 -13.795 -6.413 636 HB3 PRO 89 2HB PRO 89 -11.310 -12.120 -5.985 637 HG2 PRO 89 1HG PRO 89 -9.698 -14.594 -5.496 638 HG3 PRO 89 2HG PRO 89 -9.159 -12.998 -6.052 639 HD2 PRO 89 1HD PRO 89 -8.887 -13.815 -3.485 640 HD3 PRO 89 2HD PRO 89 -9.160 -12.116 -3.923 641 H GLN 90 H GLN 90 -10.866 -15.550 -3.788 642 HA GLN 90 HA GLN 90 -12.850 -17.311 -4.774 643 HB2 GLN 90 1HB GLN 90 -11.550 -19.043 -3.455 644 HB3 GLN 90 2HB GLN 90 -10.637 -18.145 -4.660 645 HG2 GLN 90 1HG GLN 90 -9.307 -17.188 -3.131 646 HG3 GLN 90 2HG GLN 90 -10.618 -16.973 -1.972 647 HE21 GLN 90 2HE2 GLN 90 -7.919 -17.908 -1.508 648 HE22 GLN 90 1HE2 GLN 90 -8.057 -19.488 -0.823 649 H LEU 91 H LEU 91 -12.740 -15.442 -1.985 650 HA LEU 91 HA LEU 91 -14.790 -17.133 -0.711 651 HB2 LEU 91 1HB LEU 91 -12.466 -15.681 0.454 652 HB3 LEU 91 2HB LEU 91 -13.943 -15.811 1.407 653 HG LEU 91 HG LEU 91 -12.409 -17.548 2.056 654 HD11 LEU 91 1HD1 LEU 91 -14.137 -18.905 2.339 655 HD12 LEU 91 2HD1 LEU 91 -14.076 -19.389 0.645 656 HD13 LEU 91 3HD1 LEU 91 -15.031 -17.987 1.127 657 HD21 LEU 91 3HD2 LEU 91 -11.471 -19.133 0.577 658 HD22 LEU 91 1HD2 LEU 91 -11.204 -17.557 -0.167 659 HD23 LEU 91 2HD2 LEU 91 -12.494 -18.604 -0.760 660 H GLY 92 H GLY 92 -14.474 -14.489 -2.476 661 HA2 GLY 92 1HA GLY 92 -16.816 -13.238 -1.268 662 HA3 GLY 92 2HA GLY 92 -15.383 -12.232 -1.419 663 H TYR 93 H TYR 93 -15.072 -11.166 -3.271 664 HA TYR 93 HA TYR 93 -17.020 -10.947 -5.218 665 HB2 TYR 93 1HB TYR 93 -14.128 -10.212 -5.091 666 HB3 TYR 93 2HB TYR 93 -14.955 -10.097 -6.641 667 HD1 TYR 93 HD2 TYR 93 -16.615 -9.467 -3.414 668 HD2 TYR 93 HD1 TYR 93 -14.797 -7.713 -6.837 669 HE1 TYR 93 HE2 TYR 93 -17.520 -7.275 -2.764 670 HE2 TYR 93 HE1 TYR 93 -15.695 -5.515 -6.196 671 HH TYR 93 HH TYR 93 -18.122 -5.090 -4.007 672 H GLY 94 H GLY 94 -13.816 -12.399 -5.828 673 HA2 GLY 94 1HA GLY 94 -13.567 -14.620 -6.730 674 HA3 GLY 94 2HA GLY 94 -15.155 -14.452 -7.463 675 H ALA 95 H ALA 95 -14.093 -15.166 -9.430 676 HA ALA 95 HA ALA 95 -12.180 -13.372 -10.658 677 HB1 ALA 95 1HB ALA 95 -12.865 -16.087 -10.959 678 HB2 ALA 95 2HB ALA 95 -13.215 -15.299 -12.498 679 HB3 ALA 95 3HB ALA 95 -11.601 -15.185 -11.796 680 H ARG 96 H ARG 96 -15.353 -13.093 -10.169 681 HA ARG 96 HA ARG 96 -16.364 -12.486 -12.757 682 HB2 ARG 96 1HB ARG 96 -17.924 -13.051 -11.033 683 HB3 ARG 96 2HB ARG 96 -17.316 -11.777 -9.984 684 HG2 ARG 96 1HG ARG 96 -18.171 -10.092 -11.541 685 HG3 ARG 96 2HG ARG 96 -18.799 -11.378 -12.574 686 HD2 ARG 96 1HD ARG 96 -20.662 -10.786 -11.339 687 HD3 ARG 96 2HD ARG 96 -20.028 -12.156 -10.428 688 HE ARG 96 HE ARG 96 -19.557 -10.741 -8.685 689 HH11 ARG 96 1HH1 ARG 96 -20.237 -8.871 -11.541 690 HH12 ARG 96 2HH1 ARG 96 -20.277 -7.357 -10.699 691 HH21 ARG 96 1HH2 ARG 96 -19.607 -8.755 -7.565 692 HH22 ARG 96 2HH2 ARG 96 -19.917 -7.292 -8.437 693 H GLY 97 H GLY 97 -14.540 -10.716 -10.399 694 HA2 GLY 97 1HA GLY 97 -13.435 -8.699 -10.647 695 HA3 GLY 97 2HA GLY 97 -14.128 -8.561 -12.256 696 H ALA 98 H ALA 98 -14.050 -6.265 -11.092 697 HA ALA 98 HA ALA 98 -16.826 -5.730 -10.356 698 HB1 ALA 98 1HB ALA 98 -16.444 -4.901 -8.301 699 HB2 ALA 98 2HB ALA 98 -15.006 -5.922 -8.364 700 HB3 ALA 98 3HB ALA 98 -14.888 -4.206 -8.756 701 H GLY 99 H GLY 99 -13.704 -4.000 -10.580 702 HA2 GLY 99 1HA GLY 99 -15.000 -2.167 -12.502 703 HA3 GLY 99 2HA GLY 99 -13.943 -1.581 -11.225 704 H GLY 100 H GLY 100 -12.555 -0.608 -12.745 705 HA2 GLY 100 1HA GLY 100 -11.288 -2.224 -14.777 706 HA3 GLY 100 2HA GLY 100 -10.939 -0.541 -14.411 707 H VAL 101 H VAL 101 -10.310 -0.755 -11.702 708 HA VAL 101 HA VAL 101 -7.686 -2.018 -11.906 709 HB VAL 101 HB VAL 101 -7.117 -0.773 -9.881 710 HG11 VAL 101 1HG1 VAL 101 -7.025 0.253 -12.198 711 HG12 VAL 101 2HG1 VAL 101 -8.508 1.108 -11.770 712 HG13 VAL 101 3HG1 VAL 101 -7.033 1.380 -10.842 713 HG21 VAL 101 3HG2 VAL 101 -8.651 -0.021 -8.459 714 HG22 VAL 101 1HG2 VAL 101 -9.403 0.953 -9.722 715 HG23 VAL 101 2HG2 VAL 101 -9.897 -0.724 -9.490 716 H ILE 102 H ILE 102 -9.823 -3.813 -11.677 717 HA ILE 102 HA ILE 102 -9.094 -5.125 -9.179 718 HB ILE 102 HB ILE 102 -11.972 -4.623 -9.946 719 HG12 ILE 102 1HG1 ILE 102 -10.350 -3.697 -7.565 720 HG13 ILE 102 2HG1 ILE 102 -10.894 -2.684 -8.897 721 HG21 ILE 102 1HG2 ILE 102 -12.504 -6.429 -8.774 722 HG22 ILE 102 2HG2 ILE 102 -10.796 -6.752 -8.480 723 HG23 ILE 102 3HG2 ILE 102 -11.708 -5.744 -7.357 724 HD11 ILE 102 3HD1 ILE 102 -12.216 -3.228 -6.489 725 HD12 ILE 102 1HD1 ILE 102 -12.815 -2.315 -7.874 726 HD13 ILE 102 2HD1 ILE 102 -13.131 -4.046 -7.755 727 HA PRO 103 HA PRO 103 -9.119 -8.083 -12.672 728 HB2 PRO 103 1HB PRO 103 -7.078 -9.576 -11.684 729 HB3 PRO 103 2HB PRO 103 -6.822 -8.105 -12.629 730 HG2 PRO 103 1HG PRO 103 -6.750 -8.487 -9.661 731 HG3 PRO 103 2HG PRO 103 -5.652 -7.554 -10.696 732 HD2 PRO 103 1HD PRO 103 -7.625 -6.396 -9.248 733 HD3 PRO 103 2HD PRO 103 -7.090 -5.757 -10.815 734 HA PRO 104 HA PRO 104 -11.352 -11.391 -10.828 735 HB2 PRO 104 1HB PRO 104 -10.480 -13.554 -12.218 736 HB3 PRO 104 2HB PRO 104 -11.534 -12.321 -12.921 737 HG2 PRO 104 1HG PRO 104 -8.569 -12.648 -13.176 738 HG3 PRO 104 2HG PRO 104 -9.762 -12.245 -14.425 739 HD2 PRO 104 1HD PRO 104 -8.202 -10.374 -13.244 740 HD3 PRO 104 2HD PRO 104 -9.850 -10.027 -13.804 741 H ASN 105 H ASN 105 -7.979 -11.238 -10.551 742 HA ASN 105 HA ASN 105 -7.976 -13.429 -8.580 743 HB2 ASN 105 1HB ASN 105 -6.489 -13.765 -10.571 744 HB3 ASN 105 2HB ASN 105 -5.583 -12.339 -10.073 745 HD21 ASN 105 2HD2 ASN 105 -6.658 -15.510 -8.953 746 HD22 ASN 105 1HD2 ASN 105 -5.287 -15.816 -7.946 747 H ALA 106 H ALA 106 -8.481 -10.365 -8.511 748 HA ALA 106 HA ALA 106 -6.397 -9.443 -6.729 749 HB1 ALA 106 1HB ALA 106 -8.657 -7.709 -6.711 750 HB2 ALA 106 2HB ALA 106 -7.067 -7.449 -7.428 751 HB3 ALA 106 3HB ALA 106 -8.343 -8.218 -8.370 752 H THR 107 H THR 107 -6.731 -8.800 -4.554 753 HA THR 107 HA THR 107 -8.915 -10.266 -3.227 754 HB THR 107 HB THR 107 -6.181 -9.529 -2.166 755 HG1 THR 107 HG1 THR 107 -5.678 -11.527 -2.672 756 HG21 THR 107 3HG2 THR 107 -7.169 -11.212 -0.324 757 HG22 THR 107 1HG2 THR 107 -8.664 -10.420 -0.821 758 HG23 THR 107 2HG2 THR 107 -7.320 -9.460 -0.201 759 H LEU 108 H LEU 108 -10.079 -9.280 -1.579 760 HA LEU 108 HA LEU 108 -9.791 -6.352 -1.443 761 HB2 LEU 108 1HB LEU 108 -12.262 -7.992 -0.914 762 HB3 LEU 108 2HB LEU 108 -12.153 -6.234 -0.972 763 HG LEU 108 HG LEU 108 -11.707 -8.062 -3.330 764 HD11 LEU 108 1HD1 LEU 108 -14.135 -6.903 -2.156 765 HD12 LEU 108 2HD1 LEU 108 -13.939 -8.284 -3.233 766 HD13 LEU 108 3HD1 LEU 108 -13.945 -6.648 -3.890 767 HD21 LEU 108 3HD2 LEU 108 -11.499 -5.142 -2.884 768 HD22 LEU 108 1HD2 LEU 108 -12.242 -5.677 -4.391 769 HD23 LEU 108 2HD2 LEU 108 -10.604 -6.190 -3.985 770 H VAL 109 H VAL 109 -9.346 -5.445 0.460 771 HA VAL 109 HA VAL 109 -9.282 -7.164 2.832 772 HB VAL 109 HB VAL 109 -8.134 -4.389 2.661 773 HG11 VAL 109 1HG1 VAL 109 -6.502 -5.874 4.243 774 HG12 VAL 109 2HG1 VAL 109 -7.850 -4.899 4.831 775 HG13 VAL 109 3HG1 VAL 109 -8.064 -6.629 4.557 776 HG21 VAL 109 3HG2 VAL 109 -5.946 -5.623 2.177 777 HG22 VAL 109 1HG2 VAL 109 -6.965 -6.970 1.667 778 HG23 VAL 109 2HG2 VAL 109 -7.076 -5.417 0.838 779 H PHE 110 H PHE 110 -10.368 -6.691 4.700 780 HA PHE 110 HA PHE 110 -11.985 -4.258 4.811 781 HB2 PHE 110 1HB PHE 110 -13.082 -7.064 5.042 782 HB3 PHE 110 2HB PHE 110 -13.960 -5.630 5.564 783 HD1 PHE 110 HD2 PHE 110 -14.805 -4.028 3.938 784 HD2 PHE 110 HD1 PHE 110 -12.798 -7.577 2.715 785 HE1 PHE 110 HE2 PHE 110 -15.669 -3.725 1.654 786 HE2 PHE 110 HE1 PHE 110 -13.658 -7.280 0.429 787 HZ PHE 110 HZ PHE 110 -15.096 -5.353 -0.104 788 H GLU 111 H GLU 111 -12.135 -3.408 6.810 789 HA GLU 111 HA GLU 111 -10.767 -4.831 8.966 790 HB2 GLU 111 1HB GLU 111 -10.264 -2.399 8.257 791 HB3 GLU 111 2HB GLU 111 -11.753 -1.993 9.100 792 HG2 GLU 111 1HG GLU 111 -10.490 -3.487 10.973 793 HG3 GLU 111 2HG GLU 111 -9.122 -2.730 10.158 794 H VAL 112 H VAL 112 -11.780 -5.627 10.702 795 HA VAL 112 HA VAL 112 -14.627 -4.952 11.070 796 HB VAL 112 HB VAL 112 -13.487 -7.585 11.939 797 HG11 VAL 112 1HG1 VAL 112 -16.250 -7.092 10.921 798 HG12 VAL 112 2HG1 VAL 112 -15.681 -8.273 12.102 799 HG13 VAL 112 3HG1 VAL 112 -15.813 -6.572 12.548 800 HG21 VAL 112 3HG2 VAL 112 -12.899 -7.736 9.701 801 HG22 VAL 112 1HG2 VAL 112 -14.524 -8.422 9.714 802 HG23 VAL 112 2HG2 VAL 112 -14.271 -6.764 9.170 803 H GLU 113 H GLU 113 -15.136 -4.089 12.971 804 HA GLU 113 HA GLU 113 -13.446 -4.671 15.301 805 HB2 GLU 113 1HB GLU 113 -13.618 -2.288 15.985 806 HB3 GLU 113 2HB GLU 113 -12.696 -2.522 14.506 807 HG2 GLU 113 1HG GLU 113 -14.904 -2.010 13.296 808 HG3 GLU 113 2HG GLU 113 -15.434 -1.369 14.851 809 H LEU 114 H LEU 114 -14.706 -5.614 16.754 810 HA LEU 114 HA LEU 114 -17.561 -5.237 16.754 811 HB2 LEU 114 1HB LEU 114 -16.098 -7.354 17.332 812 HB3 LEU 114 2HB LEU 114 -16.138 -6.657 18.950 813 HG LEU 114 HG LEU 114 -18.567 -7.416 17.327 814 HD11 LEU 114 1HD1 LEU 114 -16.854 -9.175 18.426 815 HD12 LEU 114 2HD1 LEU 114 -18.593 -9.442 18.311 816 HD13 LEU 114 3HD1 LEU 114 -17.891 -8.844 19.814 817 HD21 LEU 114 3HD2 LEU 114 -18.153 -5.980 19.862 818 HD22 LEU 114 1HD2 LEU 114 -19.369 -7.258 19.903 819 HD23 LEU 114 2HD2 LEU 114 -19.514 -5.940 18.739 820 H LEU 115 H LEU 115 -18.706 -3.886 17.982 821 HA LEU 115 HA LEU 115 -17.277 -2.246 19.936 822 HB2 LEU 115 1HB LEU 115 -20.110 -1.831 19.052 823 HB3 LEU 115 2HB LEU 115 -18.975 -0.652 19.706 824 HG LEU 115 HG LEU 115 -19.008 -1.838 16.938 825 HD11 LEU 115 1HD1 LEU 115 -19.638 0.235 16.193 826 HD12 LEU 115 2HD1 LEU 115 -18.953 1.068 17.589 827 HD13 LEU 115 3HD1 LEU 115 -20.469 0.181 17.748 828 HD21 LEU 115 3HD2 LEU 115 -16.850 -0.419 18.429 829 HD22 LEU 115 1HD2 LEU 115 -17.047 -0.124 16.702 830 HD23 LEU 115 2HD2 LEU 115 -16.738 -1.759 17.287 831 H ASP 116 H ASP 116 -20.171 -4.271 19.657 832 HA ASP 116 HA ASP 116 -19.970 -5.280 22.271 833 HB2 ASP 116 1HB ASP 116 -20.814 -2.764 22.493 834 HB3 ASP 116 2HB ASP 116 -22.368 -3.515 22.143 835 H VAL 117 H VAL 117 -21.380 -6.970 22.618 836 HA VAL 117 HA VAL 117 -22.799 -7.905 20.284 837 HB VAL 117 HB VAL 117 -23.282 -9.914 21.695 838 HG11 VAL 117 1HG1 VAL 117 -20.586 -10.204 22.079 839 HG12 VAL 117 2HG1 VAL 117 -21.440 -10.488 20.560 840 HG13 VAL 117 3HG1 VAL 117 -20.661 -8.933 20.859 841 HG21 VAL 117 3HG2 VAL 117 -22.612 -8.163 23.789 842 HG22 VAL 117 1HG2 VAL 117 -23.034 -9.872 23.902 843 HG23 VAL 117 2HG2 VAL 117 -21.345 -9.389 23.742 844 H13 JZF 130 1H3 JZF 130 -17.589 -5.731 -0.235 845 H23 JZF 130 2H3 JZF 130 -17.540 -4.755 1.222 846 H4 JZF 130 H4 JZF 130 -19.685 -4.738 -0.932 847 H15 JZF 130 1H5 JZF 130 -20.799 -2.955 0.296 848 H25 JZF 130 2H5 JZF 130 -19.577 -2.983 1.559 849 H17 JZF 130 1H7 JZF 130 -17.871 -2.393 -0.336 850 H27 JZF 130 2H7 JZF 130 -17.408 -3.659 -1.427 851 H8 JZF 130 H8 JZF 130 -19.758 -3.017 -2.508 852 H9 JZF 130 H9 JZF 130 -17.157 -2.841 -3.408 853 H1OH JZF 130 1HO JZF 130 -19.696 -1.187 -0.862 854 H11 JZF 130 H11 JZF 130 -17.101 -3.324 -5.951 855 H112 JZF 130 1H12 JZF 130 -18.348 -0.591 -6.536 856 H212 JZF 130 2H12 JZF 130 -16.837 -1.192 -7.201 857 H13A JZF 130 H13 JZF 130 -16.586 0.442 -5.293 858 H114 JZF 130 1H14 JZF 130 -17.042 -0.326 -2.994 859 H214 JZF 130 2H14 JZF 130 -18.483 -0.126 -3.957 860 H115 JZF 130 1H15 JZF 130 -21.784 -6.468 3.141 861 H215 JZF 130 2H15 JZF 130 -20.381 -7.536 3.127 862 H116 JZF 130 1H16 JZF 130 -21.375 -7.109 -0.726 863 H216 JZF 130 2H16 JZF 130 -19.742 -7.834 -0.806 864 H117 JZF 130 2H17 JZF 130 -20.531 -9.430 -2.263 865 H217 JZF 130 3H17 JZF 130 -21.704 -9.964 -1.044 866 H317 JZF 130 1H17 JZF 130 -22.140 -8.690 -2.196 867 H118 JZF 130 1H18 JZF 130 -18.498 -4.200 -7.533 868 H218 JZF 130 2H18 JZF 130 -19.847 -3.153 -7.072 869 H318 JZF 130 3H18 JZF 130 -18.587 -2.547 -8.161 870 H119 JZF 130 3H19 JZF 130 -15.305 -2.010 -4.150 871 H219 JZF 130 1H19 JZF 130 -14.998 -1.704 -5.863 872 H319 JZF 130 2H19 JZF 130 -14.595 -0.475 -4.664 Start of MODEL 17 1 H1 GLY 1 H GLY 1 -2.430 -0.078 5.139 2 HA2 GLY 1 1HA GLY 1 -2.046 2.242 3.375 3 HA3 GLY 1 2HA GLY 1 -1.558 2.145 5.061 4 HA PRO 2 HA PRO 2 1.990 1.176 2.051 5 HB2 PRO 2 1HB PRO 2 3.391 3.480 2.366 6 HB3 PRO 2 2HB PRO 2 2.160 3.267 1.115 7 HG2 PRO 2 1HG PRO 2 1.941 4.620 3.776 8 HG3 PRO 2 2HG PRO 2 1.314 5.140 2.201 9 HD2 PRO 2 1HD PRO 2 -0.245 3.955 4.071 10 HD3 PRO 2 2HD PRO 2 -0.517 3.746 2.329 11 H GLY 3 H GLY 3 4.129 0.669 2.698 12 HA2 GLY 3 1HA GLY 3 5.829 1.110 4.526 13 HA3 GLY 3 2HA GLY 3 4.509 0.742 5.625 14 H SER 4 H SER 4 5.963 -0.901 6.468 15 HA SER 4 HA SER 4 7.010 -3.029 5.035 16 HB2 SER 4 1HB SER 4 5.992 -2.899 7.878 17 HB3 SER 4 2HB SER 4 6.845 -4.296 7.221 18 HG SER 4 HG SER 4 8.672 -3.147 7.096 19 H MET 5 H MET 5 6.237 -5.383 5.390 20 HA MET 5 HA MET 5 3.389 -5.499 4.650 21 HB2 MET 5 1HB MET 5 5.771 -7.094 3.763 22 HB3 MET 5 2HB MET 5 4.154 -7.776 3.644 23 HG2 MET 5 1HG MET 5 3.676 -5.455 2.457 24 HG3 MET 5 2HG MET 5 5.402 -5.567 2.121 25 HE1 MET 5 3HE MET 5 1.992 -8.209 0.852 26 HE2 MET 5 1HE MET 5 2.011 -6.753 1.849 27 HE3 MET 5 2HE MET 5 2.060 -6.618 0.091 28 H THR 6 H THR 6 3.815 -5.420 7.300 29 HA THR 6 HA THR 6 4.209 -7.986 8.485 30 HB THR 6 HB THR 6 3.112 -6.814 10.515 31 HG1 THR 6 HG1 THR 6 2.134 -5.115 9.314 32 HG21 THR 6 3HG2 THR 6 5.176 -5.635 11.029 33 HG22 THR 6 1HG2 THR 6 5.636 -5.653 9.327 34 HG23 THR 6 2HG2 THR 6 5.537 -7.165 10.230 35 H VAL 7 H VAL 7 2.700 -9.211 7.152 36 HA VAL 7 HA VAL 7 -0.008 -9.135 8.292 37 HB VAL 7 HB VAL 7 0.536 -9.661 5.370 38 HG11 VAL 7 1HG1 VAL 7 -1.433 -10.789 6.182 39 HG12 VAL 7 2HG1 VAL 7 -2.014 -9.305 6.940 40 HG13 VAL 7 3HG1 VAL 7 -1.920 -9.421 5.182 41 HG21 VAL 7 3HG2 VAL 7 -0.592 -7.173 6.653 42 HG22 VAL 7 1HG2 VAL 7 1.011 -7.320 5.931 43 HG23 VAL 7 2HG2 VAL 7 -0.428 -7.470 4.922 44 H VAL 8 H VAL 8 -1.065 -11.137 8.429 45 HA VAL 8 HA VAL 8 0.677 -13.478 8.000 46 HB VAL 8 HB VAL 8 -1.419 -13.157 10.152 47 HG11 VAL 8 1HG1 VAL 8 0.636 -15.322 9.714 48 HG12 VAL 8 2HG1 VAL 8 -0.523 -15.236 11.042 49 HG13 VAL 8 3HG1 VAL 8 -1.091 -15.467 9.388 50 HG21 VAL 8 3HG2 VAL 8 1.354 -12.330 10.036 51 HG22 VAL 8 1HG2 VAL 8 0.125 -11.989 11.254 52 HG23 VAL 8 2HG2 VAL 8 1.067 -13.476 11.345 53 H THR 9 H THR 9 -0.071 -14.967 6.647 54 HA THR 9 HA THR 9 -2.876 -14.822 5.809 55 HB THR 9 HB THR 9 -0.808 -16.524 4.453 56 HG1 THR 9 HG1 THR 9 0.117 -14.455 4.559 57 HG21 THR 9 3HG2 THR 9 -2.376 -15.382 2.541 58 HG22 THR 9 1HG2 THR 9 -3.506 -15.509 3.888 59 HG23 THR 9 2HG2 THR 9 -2.687 -16.950 3.285 60 H THR 10 H THR 10 -3.995 -16.879 5.351 61 HA THR 10 HA THR 10 -3.318 -18.895 7.388 62 HB THR 10 HB THR 10 -5.673 -19.522 7.411 63 HG1 THR 10 HG1 THR 10 -7.107 -18.680 6.019 64 HG21 THR 10 3HG2 THR 10 -6.228 -17.877 8.842 65 HG22 THR 10 1HG2 THR 10 -6.023 -16.617 7.626 66 HG23 THR 10 2HG2 THR 10 -4.620 -17.245 8.490 67 H GLU 11 H GLU 11 -4.706 -21.039 6.661 68 HA GLU 11 HA GLU 11 -3.209 -22.077 4.466 69 HB2 GLU 11 1HB GLU 11 -3.723 -23.560 6.268 70 HB3 GLU 11 2HB GLU 11 -5.443 -23.222 6.140 71 HG2 GLU 11 1HG GLU 11 -5.619 -24.420 4.105 72 HG3 GLU 11 2HG GLU 11 -3.868 -24.539 3.948 73 H SER 12 H SER 12 -6.416 -20.780 4.863 74 HA SER 12 HA SER 12 -7.409 -21.781 2.356 75 HB2 SER 12 1HB SER 12 -8.680 -19.460 3.747 76 HB3 SER 12 2HB SER 12 -9.435 -20.833 2.938 77 HG SER 12 HG SER 12 -9.614 -21.649 4.856 78 H GLY 13 H GLY 13 -5.824 -18.887 3.495 79 HA2 GLY 13 1HA GLY 13 -4.535 -17.800 1.612 80 HA3 GLY 13 2HA GLY 13 -6.088 -17.718 0.795 81 H LEU 14 H LEU 14 -7.439 -17.128 3.401 82 HA LEU 14 HA LEU 14 -7.399 -14.311 3.204 83 HB2 LEU 14 1HB LEU 14 -9.402 -15.257 3.946 84 HB3 LEU 14 2HB LEU 14 -8.590 -16.249 5.155 85 HG LEU 14 HG LEU 14 -8.454 -13.305 5.500 86 HD11 LEU 14 1HD1 LEU 14 -10.848 -14.022 4.812 87 HD12 LEU 14 2HD1 LEU 14 -10.622 -13.012 6.240 88 HD13 LEU 14 3HD1 LEU 14 -10.907 -14.743 6.421 89 HD21 LEU 14 3HD2 LEU 14 -9.137 -14.429 7.873 90 HD22 LEU 14 1HD2 LEU 14 -7.480 -14.197 7.315 91 HD23 LEU 14 2HD2 LEU 14 -8.271 -15.759 7.101 92 H LYS 15 H LYS 15 -6.610 -12.741 4.612 93 HA LYS 15 HA LYS 15 -4.476 -13.665 6.423 94 HB2 LYS 15 1HB LYS 15 -4.666 -11.200 4.698 95 HB3 LYS 15 2HB LYS 15 -3.506 -11.341 6.012 96 HG2 LYS 15 1HG LYS 15 -2.246 -12.907 4.921 97 HG3 LYS 15 2HG LYS 15 -3.607 -13.494 3.962 98 HD2 LYS 15 1HD LYS 15 -3.467 -11.006 3.004 99 HD3 LYS 15 2HD LYS 15 -1.780 -11.208 3.481 100 HE2 LYS 15 1HE LYS 15 -1.886 -13.429 2.210 101 HE3 LYS 15 2HE LYS 15 -3.380 -12.810 1.508 102 HZ1 LYS 15 3HZ LYS 15 -1.227 -10.923 1.384 103 HZ2 LYS 15 1HZ LYS 15 -2.256 -11.468 0.157 104 HZ3 LYS 15 2HZ LYS 15 -0.875 -12.358 0.561 105 H TYR 16 H TYR 16 -3.983 -12.089 8.206 106 HA TYR 16 HA TYR 16 -6.238 -10.466 9.070 107 HB2 TYR 16 1HB TYR 16 -6.622 -11.587 11.112 108 HB3 TYR 16 2HB TYR 16 -6.556 -12.863 9.901 109 HD1 TYR 16 HD2 TYR 16 -4.476 -14.250 9.701 110 HD2 TYR 16 HD1 TYR 16 -5.085 -11.527 12.913 111 HE1 TYR 16 HE2 TYR 16 -2.725 -15.393 10.995 112 HE2 TYR 16 HE1 TYR 16 -3.335 -12.663 14.216 113 HH TYR 16 HH TYR 16 -2.132 -15.675 13.444 114 H GLU 17 H GLU 17 -5.669 -8.802 10.410 115 HA GLU 17 HA GLU 17 -2.898 -8.715 11.380 116 HB2 GLU 17 1HB GLU 17 -3.490 -7.393 9.155 117 HB3 GLU 17 2HB GLU 17 -4.102 -6.209 10.302 118 HG2 GLU 17 1HG GLU 17 -1.344 -7.327 10.584 119 HG3 GLU 17 2HG GLU 17 -1.679 -6.004 9.469 120 H ASP 18 H ASP 18 -2.795 -8.206 13.460 121 HA ASP 18 HA ASP 18 -5.146 -7.459 14.912 122 HB2 ASP 18 1HB ASP 18 -2.268 -7.890 15.691 123 HB3 ASP 18 2HB ASP 18 -3.465 -7.317 16.848 124 H LEU 19 H LEU 19 -5.851 -5.487 15.397 125 HA LEU 19 HA LEU 19 -4.017 -3.217 14.991 126 HB2 LEU 19 1HB LEU 19 -6.915 -3.599 14.414 127 HB3 LEU 19 2HB LEU 19 -6.336 -1.985 14.822 128 HG LEU 19 HG LEU 19 -4.574 -2.678 12.884 129 HD11 LEU 19 1HD1 LEU 19 -7.112 -4.184 12.400 130 HD12 LEU 19 2HD1 LEU 19 -5.442 -4.704 12.175 131 HD13 LEU 19 3HD1 LEU 19 -6.168 -3.557 11.048 132 HD21 LEU 19 3HD2 LEU 19 -7.265 -1.347 12.650 133 HD22 LEU 19 1HD2 LEU 19 -6.054 -1.336 11.368 134 HD23 LEU 19 2HD2 LEU 19 -5.699 -0.582 12.922 135 H THR 20 H THR 20 -6.579 -4.542 17.021 136 HA THR 20 HA THR 20 -5.487 -3.242 19.340 137 HB THR 20 HB THR 20 -8.308 -2.500 18.551 138 HG1 THR 20 HG1 THR 20 -7.506 -0.570 17.897 139 HG21 THR 20 3HG2 THR 20 -6.513 -1.593 20.804 140 HG22 THR 20 1HG2 THR 20 -7.974 -2.570 20.951 141 HG23 THR 20 2HG2 THR 20 -8.085 -0.891 20.421 142 H GLU 21 H GLU 21 -5.527 -4.823 20.787 143 HA GLU 21 HA GLU 21 -7.185 -7.098 20.605 144 HB2 GLU 21 1HB GLU 21 -5.369 -6.005 22.730 145 HB3 GLU 21 2HB GLU 21 -6.377 -7.407 23.059 146 HG2 GLU 21 1HG GLU 21 -4.211 -8.160 22.401 147 HG3 GLU 21 2HG GLU 21 -5.354 -8.545 21.115 148 H GLY 22 H GLY 22 -8.782 -7.829 22.162 149 HA2 GLY 22 1HA GLY 22 -10.036 -5.923 23.914 150 HA3 GLY 22 2HA GLY 22 -10.965 -6.220 22.452 151 H SER 23 H SER 23 -10.091 -7.386 25.548 152 HA SER 23 HA SER 23 -10.991 -10.086 25.138 153 HB2 SER 23 1HB SER 23 -10.552 -8.645 27.762 154 HB3 SER 23 2HB SER 23 -10.604 -10.388 27.503 155 HG SER 23 HG SER 23 -8.464 -9.719 27.609 156 H GLY 24 H GLY 24 -13.086 -9.486 24.200 157 HA2 GLY 24 1HA GLY 24 -15.063 -8.808 26.291 158 HA3 GLY 24 2HA GLY 24 -15.249 -8.369 24.600 159 H ALA 25 H ALA 25 -17.194 -9.423 24.312 160 HA ALA 25 HA ALA 25 -17.270 -12.309 24.803 161 HB1 ALA 25 1HB ALA 25 -19.314 -10.186 24.519 162 HB2 ALA 25 2HB ALA 25 -19.746 -11.801 23.955 163 HB3 ALA 25 3HB ALA 25 -19.245 -11.557 25.628 164 H GLU 26 H GLU 26 -17.368 -13.797 23.205 165 HA GLU 26 HA GLU 26 -16.758 -12.915 20.522 166 HB2 GLU 26 1HB GLU 26 -15.579 -14.837 21.479 167 HB3 GLU 26 2HB GLU 26 -17.103 -15.696 21.656 168 HG2 GLU 26 1HG GLU 26 -16.676 -14.788 18.940 169 HG3 GLU 26 2HG GLU 26 -15.372 -15.829 19.511 170 H ALA 27 H ALA 27 -18.065 -12.969 18.772 171 HA ALA 27 HA ALA 27 -20.878 -13.067 19.162 172 HB1 ALA 27 1HB ALA 27 -19.684 -11.647 17.477 173 HB2 ALA 27 2HB ALA 27 -19.428 -13.109 16.523 174 HB3 ALA 27 3HB ALA 27 -21.067 -12.543 16.847 175 H ARG 28 H ARG 28 -22.395 -14.543 18.378 176 HA ARG 28 HA ARG 28 -21.356 -17.124 17.436 177 HB2 ARG 28 1HB ARG 28 -23.216 -16.639 19.754 178 HB3 ARG 28 2HB ARG 28 -23.175 -18.180 18.909 179 HG2 ARG 28 1HG ARG 28 -20.852 -18.483 19.490 180 HG3 ARG 28 2HG ARG 28 -20.806 -16.887 20.242 181 HD2 ARG 28 1HD ARG 28 -21.032 -18.558 21.958 182 HD3 ARG 28 2HD ARG 28 -22.534 -17.641 21.845 183 HE ARG 28 HE ARG 28 -22.580 -20.015 20.255 184 HH11 ARG 28 1HH1 ARG 28 -22.988 -18.773 23.481 185 HH12 ARG 28 2HH1 ARG 28 -24.032 -20.061 23.986 186 HH21 ARG 28 1HH2 ARG 28 -23.953 -21.717 20.907 187 HH22 ARG 28 2HH2 ARG 28 -24.579 -21.735 22.521 188 H ALA 29 H ALA 29 -22.600 -18.158 15.938 189 HA ALA 29 HA ALA 29 -24.341 -16.718 14.337 190 HB1 ALA 29 1HB ALA 29 -23.111 -19.020 13.994 191 HB2 ALA 29 2HB ALA 29 -24.674 -19.671 14.492 192 HB3 ALA 29 3HB ALA 29 -24.566 -18.617 13.082 193 H GLY 30 H GLY 30 -26.373 -16.063 14.583 194 HA2 GLY 30 1HA GLY 30 -28.695 -16.764 15.004 195 HA3 GLY 30 2HA GLY 30 -28.101 -17.565 16.451 196 H GLN 31 H GLN 31 -26.284 -15.231 16.977 197 HA GLN 31 HA GLN 31 -28.330 -13.524 18.210 198 HB2 GLN 31 1HB GLN 31 -26.901 -13.148 19.973 199 HB3 GLN 31 2HB GLN 31 -26.414 -14.773 19.509 200 HG2 GLN 31 1HG GLN 31 -24.561 -13.817 18.202 201 HG3 GLN 31 2HG GLN 31 -25.029 -12.210 18.756 202 HE21 GLN 31 2HE2 GLN 31 -25.634 -12.720 21.386 203 HE22 GLN 31 1HE2 GLN 31 -24.200 -13.190 22.226 204 H THR 32 H THR 32 -28.173 -11.266 18.122 205 HA THR 32 HA THR 32 -26.863 -10.280 15.717 206 HB THR 32 HB THR 32 -28.545 -8.597 17.553 207 HG1 THR 32 HG1 THR 32 -30.262 -9.363 15.946 208 HG21 THR 32 3HG2 THR 32 -27.210 -7.806 15.440 209 HG22 THR 32 1HG2 THR 32 -28.849 -7.221 15.724 210 HG23 THR 32 2HG2 THR 32 -28.565 -8.521 14.566 211 H VAL 33 H VAL 33 -25.353 -8.633 15.661 212 HA VAL 33 HA VAL 33 -24.390 -7.500 18.166 213 HB VAL 33 HB VAL 33 -22.096 -8.127 17.840 214 HG11 VAL 33 1HG1 VAL 33 -23.707 -9.725 18.960 215 HG12 VAL 33 2HG1 VAL 33 -23.683 -10.654 17.459 216 HG13 VAL 33 3HG1 VAL 33 -22.196 -10.424 18.380 217 HG21 VAL 33 3HG2 VAL 33 -21.450 -9.700 16.020 218 HG22 VAL 33 1HG2 VAL 33 -23.054 -9.479 15.322 219 HG23 VAL 33 2HG2 VAL 33 -21.949 -8.110 15.443 220 H SER 34 H SER 34 -22.847 -5.740 17.829 221 HA SER 34 HA SER 34 -23.242 -4.459 15.205 222 HB2 SER 34 1HB SER 34 -22.533 -2.414 16.894 223 HB3 SER 34 2HB SER 34 -24.189 -2.840 16.466 224 HG SER 34 HG SER 34 -23.251 -2.783 18.846 225 H VAL 35 H VAL 35 -21.499 -4.064 14.013 226 HA VAL 35 HA VAL 35 -18.904 -3.681 15.301 227 HB VAL 35 HB VAL 35 -17.754 -5.316 14.069 228 HG11 VAL 35 1HG1 VAL 35 -18.742 -7.377 14.742 229 HG12 VAL 35 2HG1 VAL 35 -19.179 -6.167 15.950 230 HG13 VAL 35 3HG1 VAL 35 -20.358 -6.673 14.740 231 HG21 VAL 35 3HG2 VAL 35 -18.361 -5.437 11.907 232 HG22 VAL 35 1HG2 VAL 35 -19.412 -6.743 12.456 233 HG23 VAL 35 2HG2 VAL 35 -20.058 -5.113 12.261 234 H HIS 36 H HIS 36 -17.233 -2.964 13.698 235 HA HIS 36 HA HIS 36 -18.496 -1.277 11.640 236 HB2 HIS 36 1HB HIS 36 -16.297 -0.800 13.573 237 HB3 HIS 36 2HB HIS 36 -16.097 -0.102 11.969 238 HD1 HIS 36 HD1 HIS 36 -18.613 1.129 11.235 239 HD2 HIS 36 HD2 HIS 36 -17.394 1.035 15.206 240 HE1 HIS 36 HE1 HIS 36 -19.886 2.975 12.373 241 H TYR 37 H TYR 37 -17.890 -1.494 9.571 242 HA TYR 37 HA TYR 37 -15.598 -3.257 8.998 243 HB2 TYR 37 1HB TYR 37 -16.744 -4.135 7.114 244 HB3 TYR 37 2HB TYR 37 -17.912 -4.140 8.430 245 HD1 TYR 37 HD2 TYR 37 -16.985 -2.603 5.237 246 HD2 TYR 37 HD1 TYR 37 -19.829 -2.653 8.401 247 HE1 TYR 37 HE2 TYR 37 -18.548 -1.312 3.844 248 HE2 TYR 37 HE1 TYR 37 -21.400 -1.363 7.017 249 HH TYR 37 HH TYR 37 -20.713 0.393 4.605 250 H THR 38 H THR 38 -14.064 -2.554 7.624 251 HA THR 38 HA THR 38 -14.554 -0.036 6.175 252 HB THR 38 HB THR 38 -11.769 -0.405 6.964 253 HG1 THR 38 HG1 THR 38 -12.108 0.041 9.167 254 HG21 THR 38 3HG2 THR 38 -13.706 1.855 7.468 255 HG22 THR 38 1HG2 THR 38 -12.767 1.653 5.990 256 HG23 THR 38 2HG2 THR 38 -11.946 1.937 7.524 257 H GLY 39 H GLY 39 -14.599 -0.632 4.093 258 HA2 GLY 39 1HA GLY 39 -13.149 -2.856 3.056 259 HA3 GLY 39 2HA GLY 39 -14.025 -1.658 2.114 260 H TRP 40 H TRP 40 -10.994 -2.847 2.948 261 HA TRP 40 HA TRP 40 -9.690 -0.450 1.833 262 HB2 TRP 40 1HB TRP 40 -8.596 -2.438 3.835 263 HB3 TRP 40 2HB TRP 40 -7.660 -1.141 3.097 264 HD1 TRP 40 HD1 TRP 40 -10.431 0.829 3.441 265 HE1 TRP 40 HE1 TRP 40 -10.692 1.949 5.743 266 HE3 TRP 40 HE3 TRP 40 -7.324 -2.182 6.165 267 HZ2 TRP 40 HZ2 TRP 40 -9.711 1.602 8.367 268 HZ3 TRP 40 HZ3 TRP 40 -7.040 -1.720 8.565 269 HH2 TRP 40 HH2 TRP 40 -8.209 0.134 9.641 270 H LEU 41 H LEU 41 -7.860 -0.801 0.464 271 HA LEU 41 HA LEU 41 -8.092 -3.281 -1.064 272 HB2 LEU 41 1HB LEU 41 -7.184 -0.526 -1.624 273 HB3 LEU 41 2HB LEU 41 -6.346 -1.816 -2.483 274 HG LEU 41 HG LEU 41 -8.983 -2.456 -2.885 275 HD11 LEU 41 1HD1 LEU 41 -8.865 0.484 -3.399 276 HD12 LEU 41 2HD1 LEU 41 -9.396 -0.119 -1.829 277 HD13 LEU 41 3HD1 LEU 41 -10.265 -0.582 -3.292 278 HD21 LEU 41 3HD2 LEU 41 -6.923 -0.996 -4.488 279 HD22 LEU 41 1HD2 LEU 41 -8.537 -1.265 -5.146 280 HD23 LEU 41 2HD2 LEU 41 -7.534 -2.639 -4.679 281 H THR 42 H THR 42 -6.226 -4.473 -1.714 282 HA THR 42 HA THR 42 -4.430 -5.044 0.350 283 HB THR 42 HB THR 42 -3.326 -6.527 -1.141 284 HG1 THR 42 HG1 THR 42 -3.829 -6.319 -3.477 285 HG21 THR 42 3HG2 THR 42 -6.101 -6.503 -0.886 286 HG22 THR 42 1HG2 THR 42 -5.096 -7.870 -1.365 287 HG23 THR 42 2HG2 THR 42 -5.809 -6.826 -2.595 288 H ASP 43 H ASP 43 -4.366 -2.578 -2.024 289 HA ASP 43 HA ASP 43 -1.521 -2.184 -2.036 290 HB2 ASP 43 1HB ASP 43 -3.544 -0.109 -2.844 291 HB3 ASP 43 2HB ASP 43 -1.919 -0.365 -3.473 292 H GLY 44 H GLY 44 -4.110 -1.284 0.019 293 HA2 GLY 44 1HA GLY 44 -3.573 -0.468 2.231 294 HA3 GLY 44 2HA GLY 44 -2.269 0.468 1.515 295 H GLN 45 H GLN 45 -4.920 0.649 -0.482 296 HA GLN 45 HA GLN 45 -5.598 3.293 0.590 297 HB2 GLN 45 1HB GLN 45 -6.495 3.778 -1.630 298 HB3 GLN 45 2HB GLN 45 -4.831 3.222 -1.737 299 HG2 GLN 45 1HG GLN 45 -5.885 0.899 -2.153 300 HG3 GLN 45 2HG GLN 45 -7.344 1.816 -2.525 301 HE21 GLN 45 2HE2 GLN 45 -6.447 3.968 -3.838 302 HE22 GLN 45 1HE2 GLN 45 -5.641 3.512 -5.296 303 H LYS 46 H LYS 46 -7.632 3.841 1.198 304 HA LYS 46 HA LYS 46 -9.492 1.674 1.654 305 HB2 LYS 46 1HB LYS 46 -9.194 3.241 3.448 306 HB3 LYS 46 2HB LYS 46 -9.537 4.603 2.390 307 HG2 LYS 46 1HG LYS 46 -11.817 4.119 2.307 308 HG3 LYS 46 2HG LYS 46 -11.581 2.472 2.897 309 HD2 LYS 46 1HD LYS 46 -12.232 3.350 4.867 310 HD3 LYS 46 2HD LYS 46 -10.557 3.900 4.958 311 HE2 LYS 46 1HE LYS 46 -11.281 6.022 3.854 312 HE3 LYS 46 2HE LYS 46 -12.948 5.467 4.000 313 HZ1 LYS 46 3HZ LYS 46 -12.206 5.185 6.497 314 HZ2 LYS 46 1HZ LYS 46 -12.774 6.664 5.903 315 HZ3 LYS 46 2HZ LYS 46 -11.111 6.403 6.071 316 H PHE 47 H PHE 47 -11.600 1.543 0.866 317 HA PHE 47 HA PHE 47 -12.400 3.425 -1.221 318 HB2 PHE 47 1HB PHE 47 -12.806 1.741 -2.861 319 HB3 PHE 47 2HB PHE 47 -11.166 1.486 -2.274 320 HD1 PHE 47 HD1 PHE 47 -10.849 -0.277 -0.432 321 HD2 PHE 47 HD2 PHE 47 -14.329 -0.003 -2.867 322 HE1 PHE 47 HE1 PHE 47 -11.402 -2.614 0.102 323 HE2 PHE 47 HE2 PHE 47 -14.888 -2.340 -2.337 324 HZ PHE 47 HZ PHE 47 -13.424 -3.648 -0.850 325 H ASP 48 H ASP 48 -13.188 2.305 1.572 326 HA ASP 48 HA ASP 48 -15.950 2.743 1.332 327 HB2 ASP 48 1HB ASP 48 -15.510 0.332 0.327 328 HB3 ASP 48 2HB ASP 48 -15.501 -0.126 2.027 329 H SER 49 H SER 49 -16.601 3.455 3.252 330 HA SER 49 HA SER 49 -15.506 2.275 5.691 331 HB2 SER 49 1HB SER 49 -15.175 4.624 6.614 332 HB3 SER 49 2HB SER 49 -14.003 4.100 5.405 333 HG SER 49 HG SER 49 -15.357 5.227 3.849 334 H SER 50 H SER 50 -16.906 2.264 7.390 335 HA SER 50 HA SER 50 -19.657 2.648 6.855 336 HB2 SER 50 1HB SER 50 -19.838 2.287 9.407 337 HB3 SER 50 2HB SER 50 -19.174 0.974 8.435 338 HG SER 50 HG SER 50 -17.741 2.867 9.987 339 H LYS 51 H LYS 51 -17.195 4.737 8.014 340 HA LYS 51 HA LYS 51 -18.624 6.535 9.587 341 HB2 LYS 51 1HB LYS 51 -16.859 8.084 9.209 342 HB3 LYS 51 2HB LYS 51 -16.129 6.484 9.204 343 HG2 LYS 51 1HG LYS 51 -16.037 6.496 6.787 344 HG3 LYS 51 2HG LYS 51 -16.861 8.056 6.742 345 HD2 LYS 51 1HD LYS 51 -14.312 7.743 8.279 346 HD3 LYS 51 2HD LYS 51 -14.271 7.964 6.528 347 HE2 LYS 51 1HE LYS 51 -15.530 10.039 6.750 348 HE3 LYS 51 2HE LYS 51 -15.623 9.810 8.495 349 HZ1 LYS 51 3HZ LYS 51 -13.015 9.939 7.118 350 HZ2 LYS 51 1HZ LYS 51 -13.368 10.222 8.748 351 HZ3 LYS 51 2HZ LYS 51 -13.826 11.351 7.575 352 H ASP 52 H ASP 52 -18.678 6.022 6.169 353 HA ASP 52 HA ASP 52 -19.529 8.453 5.180 354 HB2 ASP 52 1HB ASP 52 -19.038 6.320 3.886 355 HB3 ASP 52 2HB ASP 52 -20.676 5.809 4.284 356 H ARG 53 H ARG 53 -21.375 5.991 6.887 357 HA ARG 53 HA ARG 53 -23.785 7.653 6.694 358 HB2 ARG 53 1HB ARG 53 -23.669 5.076 6.205 359 HB3 ARG 53 2HB ARG 53 -23.748 4.939 7.956 360 HG2 ARG 53 1HG ARG 53 -25.961 4.868 7.551 361 HG3 ARG 53 2HG ARG 53 -25.789 6.624 7.560 362 HD2 ARG 53 1HD ARG 53 -27.036 6.095 5.624 363 HD3 ARG 53 2HD ARG 53 -25.406 6.475 5.070 364 HE ARG 53 HE ARG 53 -25.700 3.690 5.517 365 HH11 ARG 53 1HH1 ARG 53 -26.527 6.229 3.283 366 HH12 ARG 53 2HH1 ARG 53 -26.622 5.171 1.914 367 HH21 ARG 53 1HH2 ARG 53 -25.822 2.288 3.722 368 HH22 ARG 53 2HH2 ARG 53 -26.222 2.930 2.165 369 H ASN 54 H ASN 54 -21.287 6.739 8.840 370 HA ASN 54 HA ASN 54 -20.829 7.275 11.003 371 HB2 ASN 54 1HB ASN 54 -21.856 9.511 10.067 372 HB3 ASN 54 2HB ASN 54 -23.197 9.102 11.134 373 HD21 ASN 54 2HD2 ASN 54 -19.664 9.369 11.134 374 HD22 ASN 54 1HD2 ASN 54 -19.542 10.020 12.730 375 H ASP 55 H ASP 55 -21.818 4.969 11.086 376 HA ASP 55 HA ASP 55 -23.329 4.789 13.470 377 HB2 ASP 55 1HB ASP 55 -25.346 5.165 12.441 378 HB3 ASP 55 2HB ASP 55 -24.788 4.557 10.885 379 HA PRO 56 HA PRO 56 -21.293 0.892 13.442 380 HB2 PRO 56 1HB PRO 56 -22.737 -0.378 15.359 381 HB3 PRO 56 2HB PRO 56 -21.569 0.897 15.723 382 HG2 PRO 56 1HG PRO 56 -24.549 1.066 15.494 383 HG3 PRO 56 2HG PRO 56 -23.476 1.803 16.698 384 HD2 PRO 56 1HD PRO 56 -24.482 3.190 14.602 385 HD3 PRO 56 2HD PRO 56 -22.886 3.536 15.298 386 H PHE 57 H PHE 57 -21.454 -1.041 12.420 387 HA PHE 57 HA PHE 57 -23.891 -1.593 10.970 388 HB2 PHE 57 1HB PHE 57 -21.415 -1.825 10.151 389 HB3 PHE 57 2HB PHE 57 -21.498 -3.397 10.938 390 HD1 PHE 57 HD2 PHE 57 -23.630 -1.342 8.661 391 HD2 PHE 57 HD1 PHE 57 -21.990 -5.162 9.573 392 HE1 PHE 57 HE2 PHE 57 -24.713 -2.281 6.661 393 HE2 PHE 57 HE1 PHE 57 -23.069 -6.107 7.574 394 HZ PHE 57 HZ PHE 57 -24.433 -4.666 6.116 395 H ALA 58 H ALA 58 -25.460 -2.440 12.228 396 HA ALA 58 HA ALA 58 -24.783 -4.714 13.963 397 HB1 ALA 58 1HB ALA 58 -26.379 -2.453 14.396 398 HB2 ALA 58 2HB ALA 58 -27.493 -3.815 14.265 399 HB3 ALA 58 3HB ALA 58 -26.188 -3.854 15.451 400 H PHE 59 H PHE 59 -25.529 -6.707 13.549 401 HA PHE 59 HA PHE 59 -27.873 -7.208 11.993 402 HB2 PHE 59 1HB PHE 59 -26.906 -8.195 10.059 403 HB3 PHE 59 2HB PHE 59 -26.112 -6.637 10.257 404 HD1 PHE 59 HD1 PHE 59 -23.906 -6.753 11.744 405 HD2 PHE 59 HD2 PHE 59 -25.591 -10.006 9.577 406 HE1 PHE 59 HE1 PHE 59 -21.712 -7.867 11.717 407 HE2 PHE 59 HE2 PHE 59 -23.401 -11.125 9.547 408 HZ PHE 59 HZ PHE 59 -21.458 -10.057 10.619 409 H VAL 60 H VAL 60 -28.024 -9.653 11.499 410 HA VAL 60 HA VAL 60 -27.406 -11.036 13.967 411 HB VAL 60 HB VAL 60 -28.900 -11.995 11.522 412 HG11 VAL 60 1HG1 VAL 60 -28.011 -13.339 13.954 413 HG12 VAL 60 2HG1 VAL 60 -29.743 -13.496 13.656 414 HG13 VAL 60 3HG1 VAL 60 -28.586 -14.015 12.430 415 HG21 VAL 60 3HG2 VAL 60 -30.160 -10.243 12.464 416 HG22 VAL 60 1HG2 VAL 60 -30.877 -11.724 13.100 417 HG23 VAL 60 2HG2 VAL 60 -29.800 -10.760 14.111 418 H LEU 61 H LEU 61 -26.016 -12.718 14.230 419 HA LEU 61 HA LEU 61 -23.995 -13.072 12.193 420 HB2 LEU 61 1HB LEU 61 -23.363 -12.849 14.541 421 HB3 LEU 61 2HB LEU 61 -24.281 -14.301 14.932 422 HG LEU 61 HG LEU 61 -22.728 -15.683 13.746 423 HD11 LEU 61 1HD1 LEU 61 -20.595 -14.164 12.974 424 HD12 LEU 61 2HD1 LEU 61 -21.960 -13.146 12.519 425 HD13 LEU 61 3HD1 LEU 61 -21.843 -14.792 11.897 426 HD21 LEU 61 3HD2 LEU 61 -20.602 -14.214 14.965 427 HD22 LEU 61 1HD2 LEU 61 -21.401 -15.684 15.523 428 HD23 LEU 61 2HD2 LEU 61 -22.042 -14.106 15.979 429 H GLY 62 H GLY 62 -23.577 -14.905 11.028 430 HA2 GLY 62 1HA GLY 62 -23.811 -17.154 10.392 431 HA3 GLY 62 2HA GLY 62 -25.149 -17.311 11.520 432 H GLY 63 H GLY 63 -27.036 -15.687 10.851 433 HA2 GLY 63 1HA GLY 63 -27.551 -16.248 7.998 434 HA3 GLY 63 2HA GLY 63 -28.795 -16.215 9.239 435 H GLY 64 H GLY 64 -26.565 -14.237 7.361 436 HA2 GLY 64 1HA GLY 64 -28.407 -11.969 7.761 437 HA3 GLY 64 2HA GLY 64 -26.671 -11.742 7.922 438 H MET 65 H MET 65 -25.796 -10.815 6.207 439 HA MET 65 HA MET 65 -26.324 -11.813 3.557 440 HB2 MET 65 1HB MET 65 -28.183 -10.238 3.835 441 HB3 MET 65 2HB MET 65 -27.049 -8.961 4.253 442 HG2 MET 65 1HG MET 65 -26.400 -8.639 2.109 443 HG3 MET 65 2HG MET 65 -26.630 -10.329 1.668 444 HE1 MET 65 3HE MET 65 -28.888 -7.091 2.730 445 HE2 MET 65 1HE MET 65 -27.727 -6.880 1.419 446 HE3 MET 65 2HE MET 65 -29.457 -6.872 1.075 447 H VAL 66 H VAL 66 -24.015 -12.231 4.215 448 HA VAL 66 HA VAL 66 -22.354 -10.021 3.234 449 HB VAL 66 HB VAL 66 -20.662 -10.371 4.913 450 HG11 VAL 66 1HG1 VAL 66 -23.442 -9.923 5.953 451 HG12 VAL 66 2HG1 VAL 66 -22.025 -9.789 6.997 452 HG13 VAL 66 3HG1 VAL 66 -22.191 -8.733 5.594 453 HG21 VAL 66 3HG2 VAL 66 -20.889 -12.740 5.285 454 HG22 VAL 66 1HG2 VAL 66 -21.065 -11.899 6.825 455 HG23 VAL 66 2HG2 VAL 66 -22.490 -12.515 5.990 456 H ILE 67 H ILE 67 -19.965 -10.969 3.040 457 HA ILE 67 HA ILE 67 -20.212 -13.203 1.213 458 HB ILE 67 HB ILE 67 -17.758 -12.796 0.825 459 HG12 ILE 67 1HG1 ILE 67 -17.982 -10.145 2.126 460 HG13 ILE 67 2HG1 ILE 67 -17.789 -11.521 3.207 461 HG21 ILE 67 1HG2 ILE 67 -18.134 -10.641 -0.370 462 HG22 ILE 67 2HG2 ILE 67 -19.365 -11.864 -0.682 463 HG23 ILE 67 3HG2 ILE 67 -19.705 -10.533 0.424 464 HD11 ILE 67 3HD1 ILE 67 -15.610 -11.305 2.872 465 HD12 ILE 67 1HD1 ILE 67 -15.888 -11.948 1.254 466 HD13 ILE 67 2HD1 ILE 67 -15.850 -10.204 1.516 467 H LYS 68 H LYS 68 -18.672 -15.010 1.280 468 HA LYS 68 HA LYS 68 -18.830 -16.537 3.540 469 HB2 LYS 68 1HB LYS 68 -16.622 -16.565 1.474 470 HB3 LYS 68 2HB LYS 68 -16.931 -17.853 2.631 471 HG2 LYS 68 1HG LYS 68 -18.979 -18.415 1.617 472 HG3 LYS 68 2HG LYS 68 -19.008 -16.924 0.673 473 HD2 LYS 68 1HD LYS 68 -16.728 -17.903 -0.255 474 HD3 LYS 68 2HD LYS 68 -17.467 -19.430 0.234 475 HE2 LYS 68 1HE LYS 68 -19.069 -17.488 -1.364 476 HE3 LYS 68 2HE LYS 68 -17.840 -18.455 -2.178 477 HZ1 LYS 68 3HZ LYS 68 -20.400 -19.250 -1.120 478 HZ2 LYS 68 1HZ LYS 68 -19.136 -20.294 -0.699 479 HZ3 LYS 68 2HZ LYS 68 -19.458 -19.968 -2.328 480 H GLY 69 H GLY 69 -16.022 -14.560 2.573 481 HA2 GLY 69 1HA GLY 69 -14.378 -15.077 4.742 482 HA3 GLY 69 2HA GLY 69 -14.377 -13.573 3.834 483 H TRP 70 H TRP 70 -17.016 -12.743 4.483 484 HA TRP 70 HA TRP 70 -16.526 -11.406 6.914 485 HB2 TRP 70 1HB TRP 70 -18.728 -11.565 4.961 486 HB3 TRP 70 2HB TRP 70 -19.223 -11.159 6.601 487 HD1 TRP 70 HD1 TRP 70 -16.316 -9.948 4.308 488 HE1 TRP 70 HE1 TRP 70 -16.233 -7.379 4.443 489 HE3 TRP 70 HE3 TRP 70 -20.207 -9.179 7.534 490 HZ2 TRP 70 HZ2 TRP 70 -17.631 -5.302 5.745 491 HZ3 TRP 70 HZ3 TRP 70 -20.769 -6.870 8.174 492 HH2 TRP 70 HH2 TRP 70 -19.507 -4.973 7.297 493 H ASP 71 H ASP 71 -18.899 -13.957 6.149 494 HA ASP 71 HA ASP 71 -19.924 -14.332 8.691 495 HB2 ASP 71 1HB ASP 71 -19.741 -15.958 6.231 496 HB3 ASP 71 2HB ASP 71 -20.006 -16.865 7.717 497 H GLU 72 H GLU 72 -17.085 -15.852 7.202 498 HA GLU 72 HA GLU 72 -16.447 -17.595 9.295 499 HB2 GLU 72 1HB GLU 72 -15.296 -16.810 6.834 500 HB3 GLU 72 2HB GLU 72 -14.053 -16.607 8.060 501 HG2 GLU 72 1HG GLU 72 -15.556 -19.111 7.362 502 HG3 GLU 72 2HG GLU 72 -13.833 -18.792 7.175 503 H GLY 73 H GLY 73 -15.537 -14.223 8.731 504 HA2 GLY 73 1HA GLY 73 -13.782 -14.068 10.983 505 HA3 GLY 73 2HA GLY 73 -14.409 -12.712 10.057 506 H VAL 74 H VAL 74 -17.008 -12.656 10.405 507 HA VAL 74 HA VAL 74 -17.407 -11.608 12.943 508 HB VAL 74 HB VAL 74 -19.581 -12.788 11.213 509 HG11 VAL 74 1HG1 VAL 74 -20.175 -12.098 13.536 510 HG12 VAL 74 2HG1 VAL 74 -19.677 -10.457 13.121 511 HG13 VAL 74 3HG1 VAL 74 -21.031 -11.208 12.277 512 HG21 VAL 74 3HG2 VAL 74 -19.447 -10.038 10.767 513 HG22 VAL 74 1HG2 VAL 74 -17.777 -10.600 10.688 514 HG23 VAL 74 2HG2 VAL 74 -19.000 -11.321 9.642 515 H GLN 75 H GLN 75 -17.655 -14.892 11.822 516 HA GLN 75 HA GLN 75 -19.067 -15.813 14.168 517 HB2 GLN 75 1HB GLN 75 -17.874 -17.185 11.771 518 HB3 GLN 75 2HB GLN 75 -18.481 -18.101 13.144 519 HG2 GLN 75 1HG GLN 75 -20.675 -17.462 12.767 520 HG3 GLN 75 2HG GLN 75 -20.205 -16.067 11.796 521 HE21 GLN 75 2HE2 GLN 75 -19.128 -19.423 11.581 522 HE22 GLN 75 1HE2 GLN 75 -19.691 -19.688 9.970 523 H GLY 76 H GLY 76 -16.948 -14.522 15.133 524 HA2 GLY 76 1HA GLY 76 -15.665 -16.373 16.769 525 HA3 GLY 76 2HA GLY 76 -14.583 -16.056 15.421 526 H MET 77 H MET 77 -15.401 -13.288 15.107 527 HA MET 77 HA MET 77 -13.505 -11.987 16.603 528 HB2 MET 77 1HB MET 77 -16.107 -10.731 15.728 529 HB3 MET 77 2HB MET 77 -14.569 -9.919 15.988 530 HG2 MET 77 1HG MET 77 -14.093 -11.941 14.096 531 HG3 MET 77 2HG MET 77 -15.592 -11.146 13.621 532 HE1 MET 77 3HE MET 77 -14.824 -9.736 11.391 533 HE2 MET 77 1HE MET 77 -13.092 -9.450 11.222 534 HE3 MET 77 2HE MET 77 -13.686 -11.070 11.584 535 H LYS 78 H LYS 78 -13.689 -10.460 18.375 536 HA LYS 78 HA LYS 78 -15.840 -11.142 20.269 537 HB2 LYS 78 1HB LYS 78 -12.930 -10.646 20.927 538 HB3 LYS 78 2HB LYS 78 -14.207 -10.941 22.100 539 HG2 LYS 78 1HG LYS 78 -14.568 -13.167 21.020 540 HG3 LYS 78 2HG LYS 78 -13.124 -12.859 20.053 541 HD2 LYS 78 1HD LYS 78 -12.063 -12.377 22.420 542 HD3 LYS 78 2HD LYS 78 -13.384 -13.412 22.968 543 HE2 LYS 78 1HE LYS 78 -12.119 -15.165 22.449 544 HE3 LYS 78 2HE LYS 78 -12.302 -14.719 20.754 545 HZ1 LYS 78 3HZ LYS 78 -10.303 -13.128 21.955 546 HZ2 LYS 78 1HZ LYS 78 -10.165 -14.206 20.658 547 HZ3 LYS 78 2HZ LYS 78 -9.967 -14.761 22.244 548 H VAL 79 H VAL 79 -16.526 -9.489 21.674 549 HA VAL 79 HA VAL 79 -16.800 -6.961 20.621 550 HB VAL 79 HB VAL 79 -16.799 -7.651 23.562 551 HG11 VAL 79 1HG1 VAL 79 -17.470 -5.226 22.034 552 HG12 VAL 79 2HG1 VAL 79 -18.649 -5.707 23.257 553 HG13 VAL 79 3HG1 VAL 79 -16.971 -5.409 23.716 554 HG21 VAL 79 3HG2 VAL 79 -18.710 -8.748 23.259 555 HG22 VAL 79 1HG2 VAL 79 -19.399 -7.392 22.366 556 HG23 VAL 79 2HG2 VAL 79 -18.456 -8.618 21.519 557 H GLY 80 H GLY 80 -15.557 -5.202 20.465 558 HA2 GLY 80 1HA GLY 80 -13.926 -3.644 21.050 559 HA3 GLY 80 2HA GLY 80 -13.431 -4.696 22.368 560 H GLY 81 H GLY 81 -13.599 -6.617 19.709 561 HA2 GLY 81 1HA GLY 81 -10.709 -6.603 19.423 562 HA3 GLY 81 2HA GLY 81 -11.821 -7.779 18.738 563 H VAL 82 H VAL 82 -9.704 -5.392 17.974 564 HA VAL 82 HA VAL 82 -11.097 -4.787 15.446 565 HB VAL 82 HB VAL 82 -8.912 -3.061 16.572 566 HG11 VAL 82 1HG1 VAL 82 -10.733 -3.001 14.297 567 HG12 VAL 82 2HG1 VAL 82 -10.717 -1.495 15.218 568 HG13 VAL 82 3HG1 VAL 82 -9.215 -2.143 14.557 569 HG21 VAL 82 3HG2 VAL 82 -11.128 -1.648 17.175 570 HG22 VAL 82 1HG2 VAL 82 -11.706 -3.286 17.482 571 HG23 VAL 82 2HG2 VAL 82 -10.282 -2.680 18.327 572 H ARG 83 H ARG 83 -10.239 -5.818 13.777 573 HA ARG 83 HA ARG 83 -7.364 -5.871 13.414 574 HB2 ARG 83 1HB ARG 83 -8.933 -8.454 13.402 575 HB3 ARG 83 2HB ARG 83 -7.209 -8.268 13.110 576 HG2 ARG 83 1HG ARG 83 -7.042 -7.351 15.459 577 HG3 ARG 83 2HG ARG 83 -8.700 -7.909 15.691 578 HD2 ARG 83 1HD ARG 83 -6.863 -9.891 14.534 579 HD3 ARG 83 2HD ARG 83 -6.488 -9.401 16.186 580 HE ARG 83 HE ARG 83 -8.627 -11.071 15.356 581 HH11 ARG 83 1HH1 ARG 83 -7.777 -8.608 17.666 582 HH12 ARG 83 2HH1 ARG 83 -8.922 -9.142 18.852 583 HH21 ARG 83 1HH2 ARG 83 -10.138 -11.783 16.910 584 HH22 ARG 83 2HH2 ARG 83 -10.263 -10.949 18.421 585 H ARG 84 H ARG 84 -6.729 -6.231 11.264 586 HA ARG 84 HA ARG 84 -8.885 -5.816 9.329 587 HB2 ARG 84 1HB ARG 84 -7.053 -4.193 9.310 588 HB3 ARG 84 2HB ARG 84 -5.893 -5.488 9.046 589 HG2 ARG 84 1HG ARG 84 -7.263 -5.982 6.919 590 HG3 ARG 84 2HG ARG 84 -7.921 -4.363 7.159 591 HD2 ARG 84 1HD ARG 84 -6.133 -3.894 5.804 592 HD3 ARG 84 2HD ARG 84 -5.391 -3.712 7.393 593 HE ARG 84 HE ARG 84 -4.932 -6.307 6.801 594 HH11 ARG 84 1HH1 ARG 84 -4.379 -3.334 5.075 595 HH12 ARG 84 2HH1 ARG 84 -2.992 -3.933 4.227 596 HH21 ARG 84 1HH2 ARG 84 -3.107 -7.106 5.691 597 HH22 ARG 84 2HH2 ARG 84 -2.269 -6.078 4.577 598 H LEU 85 H LEU 85 -9.670 -7.599 8.426 599 HA LEU 85 HA LEU 85 -7.868 -9.865 7.937 600 HB2 LEU 85 1HB LEU 85 -10.857 -9.650 8.165 601 HB3 LEU 85 2HB LEU 85 -10.061 -11.089 7.530 602 HG LEU 85 HG LEU 85 -9.209 -10.108 10.202 603 HD11 LEU 85 1HD1 LEU 85 -11.077 -10.668 11.342 604 HD12 LEU 85 2HD1 LEU 85 -11.550 -11.908 10.180 605 HD13 LEU 85 3HD1 LEU 85 -11.860 -10.207 9.830 606 HD21 LEU 85 3HD2 LEU 85 -8.426 -12.182 8.774 607 HD22 LEU 85 1HD2 LEU 85 -9.848 -12.927 9.504 608 HD23 LEU 85 2HD2 LEU 85 -8.570 -12.277 10.530 609 H THR 86 H THR 86 -7.350 -10.482 5.931 610 HA THR 86 HA THR 86 -8.479 -8.960 3.700 611 HB THR 86 HB THR 86 -6.202 -10.868 3.357 612 HG1 THR 86 HG1 THR 86 -4.856 -8.953 3.950 613 HG21 THR 86 3HG2 THR 86 -5.939 -9.791 1.415 614 HG22 THR 86 1HG2 THR 86 -5.994 -8.214 2.201 615 HG23 THR 86 2HG2 THR 86 -7.492 -9.020 1.736 616 H ILE 87 H ILE 87 -10.203 -9.864 2.782 617 HA ILE 87 HA ILE 87 -10.378 -12.784 2.609 618 HB ILE 87 HB ILE 87 -12.485 -10.685 2.083 619 HG12 ILE 87 1HG1 ILE 87 -12.663 -12.671 4.298 620 HG13 ILE 87 2HG1 ILE 87 -11.554 -11.319 4.501 621 HG21 ILE 87 1HG2 ILE 87 -14.034 -12.653 2.105 622 HG22 ILE 87 2HG2 ILE 87 -12.950 -12.580 0.716 623 HG23 ILE 87 3HG2 ILE 87 -12.611 -13.693 2.041 624 HD11 ILE 87 3HD1 ILE 87 -13.314 -10.225 5.300 625 HD12 ILE 87 1HD1 ILE 87 -13.837 -10.092 3.621 626 HD13 ILE 87 2HD1 ILE 87 -14.455 -11.395 4.637 627 HA PRO 88 HA PRO 88 -9.137 -12.507 -1.653 628 HB2 PRO 88 1HB PRO 88 -9.494 -15.136 -2.228 629 HB3 PRO 88 2HB PRO 88 -8.104 -14.532 -1.318 630 HG2 PRO 88 1HG PRO 88 -10.623 -15.798 -0.311 631 HG3 PRO 88 2HG PRO 88 -8.949 -16.072 0.206 632 HD2 PRO 88 1HD PRO 88 -10.662 -14.496 1.590 633 HD3 PRO 88 2HD PRO 88 -8.916 -14.183 1.527 634 HA PRO 89 HA PRO 89 -12.777 -12.375 -4.116 635 HB2 PRO 89 1HB PRO 89 -12.008 -13.511 -6.459 636 HB3 PRO 89 2HB PRO 89 -11.451 -11.918 -5.936 637 HG2 PRO 89 1HG PRO 89 -10.063 -14.564 -5.753 638 HG3 PRO 89 2HG PRO 89 -9.406 -12.986 -6.228 639 HD2 PRO 89 1HD PRO 89 -9.045 -14.030 -3.756 640 HD3 PRO 89 2HD PRO 89 -9.178 -12.283 -4.045 641 H GLN 90 H GLN 90 -11.204 -15.541 -4.033 642 HA GLN 90 HA GLN 90 -13.417 -17.021 -4.997 643 HB2 GLN 90 1HB GLN 90 -12.209 -18.972 -3.926 644 HB3 GLN 90 2HB GLN 90 -11.289 -18.059 -5.115 645 HG2 GLN 90 1HG GLN 90 -9.775 -17.375 -3.613 646 HG3 GLN 90 2HG GLN 90 -10.983 -17.133 -2.351 647 HE21 GLN 90 2HE2 GLN 90 -8.366 -18.366 -2.163 648 HE22 GLN 90 1HE2 GLN 90 -8.624 -19.975 -1.592 649 H LEU 91 H LEU 91 -12.925 -15.408 -2.091 650 HA LEU 91 HA LEU 91 -15.037 -16.999 -0.791 651 HB2 LEU 91 1HB LEU 91 -12.505 -15.870 0.290 652 HB3 LEU 91 2HB LEU 91 -13.917 -15.927 1.344 653 HG LEU 91 HG LEU 91 -12.519 -17.849 1.745 654 HD11 LEU 91 1HD1 LEU 91 -14.924 -18.748 0.173 655 HD12 LEU 91 2HD1 LEU 91 -15.008 -18.072 1.799 656 HD13 LEU 91 3HD1 LEU 91 -14.139 -19.580 1.516 657 HD21 LEU 91 3HD2 LEU 91 -11.894 -19.417 0.083 658 HD22 LEU 91 1HD2 LEU 91 -11.493 -17.823 -0.558 659 HD23 LEU 91 2HD2 LEU 91 -12.938 -18.663 -1.122 660 H GLY 92 H GLY 92 -14.606 -14.271 -2.385 661 HA2 GLY 92 1HA GLY 92 -16.661 -12.879 -0.827 662 HA3 GLY 92 2HA GLY 92 -15.180 -12.006 -1.195 663 H TYR 93 H TYR 93 -14.907 -11.112 -3.183 664 HA TYR 93 HA TYR 93 -17.184 -10.640 -4.768 665 HB2 TYR 93 1HB TYR 93 -14.284 -10.012 -4.968 666 HB3 TYR 93 2HB TYR 93 -15.237 -9.896 -6.443 667 HD1 TYR 93 HD2 TYR 93 -16.695 -9.183 -3.155 668 HD2 TYR 93 HD1 TYR 93 -14.925 -7.504 -6.640 669 HE1 TYR 93 HE2 TYR 93 -17.476 -6.954 -2.470 670 HE2 TYR 93 HE1 TYR 93 -15.700 -5.269 -5.964 671 HH TYR 93 HH TYR 93 -17.983 -4.783 -3.502 672 H GLY 94 H GLY 94 -14.173 -12.230 -5.840 673 HA2 GLY 94 1HA GLY 94 -14.312 -14.515 -6.739 674 HA3 GLY 94 2HA GLY 94 -15.850 -14.051 -7.454 675 H ALA 95 H ALA 95 -14.643 -14.996 -9.361 676 HA ALA 95 HA ALA 95 -12.619 -13.298 -10.538 677 HB1 ALA 95 1HB ALA 95 -13.476 -15.988 -10.863 678 HB2 ALA 95 2HB ALA 95 -13.588 -15.176 -12.425 679 HB3 ALA 95 3HB ALA 95 -12.059 -15.191 -11.546 680 H ARG 96 H ARG 96 -15.797 -12.883 -10.196 681 HA ARG 96 HA ARG 96 -16.665 -12.280 -12.836 682 HB2 ARG 96 1HB ARG 96 -17.704 -11.643 -10.091 683 HB3 ARG 96 2HB ARG 96 -18.443 -10.928 -11.517 684 HG2 ARG 96 1HG ARG 96 -19.135 -13.016 -12.338 685 HG3 ARG 96 2HG ARG 96 -18.082 -13.891 -11.225 686 HD2 ARG 96 1HD ARG 96 -20.323 -14.067 -10.413 687 HD3 ARG 96 2HD ARG 96 -19.439 -12.983 -9.341 688 HE ARG 96 HE ARG 96 -20.630 -11.345 -11.187 689 HH11 ARG 96 1HH1 ARG 96 -21.720 -13.736 -8.903 690 HH12 ARG 96 2HH1 ARG 96 -23.258 -12.980 -8.647 691 HH21 ARG 96 1HH2 ARG 96 -22.651 -10.340 -10.858 692 HH22 ARG 96 2HH2 ARG 96 -23.787 -11.049 -9.760 693 H GLY 97 H GLY 97 -14.899 -10.537 -10.408 694 HA2 GLY 97 1HA GLY 97 -13.665 -8.588 -10.688 695 HA3 GLY 97 2HA GLY 97 -14.369 -8.407 -12.288 696 H ALA 98 H ALA 98 -14.135 -6.144 -10.991 697 HA ALA 98 HA ALA 98 -16.894 -5.465 -10.313 698 HB1 ALA 98 1HB ALA 98 -14.557 -5.189 -8.489 699 HB2 ALA 98 2HB ALA 98 -15.813 -3.950 -8.457 700 HB3 ALA 98 3HB ALA 98 -16.225 -5.633 -8.129 701 H GLY 99 H GLY 99 -13.600 -4.294 -10.923 702 HA2 GLY 99 1HA GLY 99 -14.739 -2.177 -12.598 703 HA3 GLY 99 2HA GLY 99 -13.676 -1.697 -11.284 704 H GLY 100 H GLY 100 -12.382 -0.752 -13.026 705 HA2 GLY 100 1HA GLY 100 -11.096 -2.483 -14.921 706 HA3 GLY 100 2HA GLY 100 -10.706 -0.797 -14.616 707 H VAL 101 H VAL 101 -10.124 -0.957 -11.876 708 HA VAL 101 HA VAL 101 -7.521 -2.273 -12.020 709 HB VAL 101 HB VAL 101 -6.976 -0.992 -9.988 710 HG11 VAL 101 1HG1 VAL 101 -6.823 1.155 -11.022 711 HG12 VAL 101 2HG1 VAL 101 -6.654 -0.063 -12.288 712 HG13 VAL 101 3HG1 VAL 101 -8.180 0.800 -12.089 713 HG21 VAL 101 3HG2 VAL 101 -8.623 -0.302 -8.663 714 HG22 VAL 101 1HG2 VAL 101 -9.036 0.904 -9.881 715 HG23 VAL 101 2HG2 VAL 101 -9.831 -0.670 -9.894 716 H ILE 102 H ILE 102 -9.751 -3.982 -11.743 717 HA ILE 102 HA ILE 102 -9.045 -5.267 -9.225 718 HB ILE 102 HB ILE 102 -11.908 -4.658 -9.971 719 HG12 ILE 102 1HG1 ILE 102 -10.213 -3.759 -7.631 720 HG13 ILE 102 2HG1 ILE 102 -10.746 -2.749 -8.969 721 HG21 ILE 102 1HG2 ILE 102 -11.664 -5.744 -7.365 722 HG22 ILE 102 2HG2 ILE 102 -12.506 -6.416 -8.760 723 HG23 ILE 102 3HG2 ILE 102 -10.811 -6.812 -8.479 724 HD11 ILE 102 3HD1 ILE 102 -12.043 -3.228 -6.525 725 HD12 ILE 102 1HD1 ILE 102 -12.617 -2.280 -7.897 726 HD13 ILE 102 2HD1 ILE 102 -13.017 -3.994 -7.780 727 HA PRO 103 HA PRO 103 -9.227 -8.304 -12.640 728 HB2 PRO 103 1HB PRO 103 -7.252 -9.866 -11.625 729 HB3 PRO 103 2HB PRO 103 -6.934 -8.430 -12.606 730 HG2 PRO 103 1HG PRO 103 -6.864 -8.745 -9.630 731 HG3 PRO 103 2HG PRO 103 -5.731 -7.888 -10.691 732 HD2 PRO 103 1HD PRO 103 -7.642 -6.607 -9.264 733 HD3 PRO 103 2HD PRO 103 -7.086 -6.030 -10.848 734 HA PRO 104 HA PRO 104 -11.602 -11.461 -10.709 735 HB2 PRO 104 1HB PRO 104 -10.841 -13.692 -12.054 736 HB3 PRO 104 2HB PRO 104 -11.841 -12.428 -12.779 737 HG2 PRO 104 1HG PRO 104 -8.897 -12.898 -13.044 738 HG3 PRO 104 2HG PRO 104 -10.078 -12.468 -14.295 739 HD2 PRO 104 1HD PRO 104 -8.424 -10.646 -13.165 740 HD3 PRO 104 2HD PRO 104 -10.059 -10.236 -13.723 741 H ASN 105 H ASN 105 -8.227 -11.451 -10.445 742 HA ASN 105 HA ASN 105 -8.318 -13.584 -8.413 743 HB2 ASN 105 1HB ASN 105 -6.887 -14.083 -10.410 744 HB3 ASN 105 2HB ASN 105 -5.890 -12.696 -9.982 745 HD21 ASN 105 2HD2 ASN 105 -7.107 -15.773 -8.761 746 HD22 ASN 105 1HD2 ASN 105 -5.748 -16.113 -7.750 747 H ALA 106 H ALA 106 -8.648 -10.501 -8.435 748 HA ALA 106 HA ALA 106 -6.473 -9.605 -6.766 749 HB1 ALA 106 1HB ALA 106 -8.664 -7.805 -6.643 750 HB2 ALA 106 2HB ALA 106 -7.136 -7.623 -7.506 751 HB3 ALA 106 3HB ALA 106 -8.516 -8.377 -8.305 752 H THR 107 H THR 107 -6.546 -9.136 -4.582 753 HA THR 107 HA THR 107 -8.652 -10.528 -3.096 754 HB THR 107 HB THR 107 -5.965 -9.509 -2.153 755 HG1 THR 107 HG1 THR 107 -5.819 -11.982 -1.939 756 HG21 THR 107 3HG2 THR 107 -7.435 -9.494 -0.283 757 HG22 THR 107 1HG2 THR 107 -6.484 -10.974 -0.161 758 HG23 THR 107 2HG2 THR 107 -8.147 -11.039 -0.746 759 H LEU 108 H LEU 108 -9.761 -9.556 -1.380 760 HA LEU 108 HA LEU 108 -9.692 -6.610 -1.390 761 HB2 LEU 108 1HB LEU 108 -12.025 -8.431 -0.814 762 HB3 LEU 108 2HB LEU 108 -12.058 -6.669 -0.776 763 HG LEU 108 HG LEU 108 -11.686 -8.422 -3.202 764 HD11 LEU 108 1HD1 LEU 108 -13.922 -8.428 -3.083 765 HD12 LEU 108 2HD1 LEU 108 -13.796 -6.769 -3.668 766 HD13 LEU 108 3HD1 LEU 108 -13.966 -7.085 -1.941 767 HD21 LEU 108 3HD2 LEU 108 -11.147 -5.559 -2.729 768 HD22 LEU 108 1HD2 LEU 108 -12.043 -5.954 -4.196 769 HD23 LEU 108 2HD2 LEU 108 -10.455 -6.667 -3.914 770 H VAL 109 H VAL 109 -9.297 -5.599 0.476 771 HA VAL 109 HA VAL 109 -9.066 -7.234 2.901 772 HB VAL 109 HB VAL 109 -8.071 -4.414 2.696 773 HG11 VAL 109 1HG1 VAL 109 -7.500 -4.946 4.786 774 HG12 VAL 109 2HG1 VAL 109 -7.814 -6.662 4.522 775 HG13 VAL 109 3HG1 VAL 109 -6.256 -5.969 4.070 776 HG21 VAL 109 3HG2 VAL 109 -5.843 -5.803 2.112 777 HG22 VAL 109 1HG2 VAL 109 -7.041 -6.778 1.262 778 HG23 VAL 109 2HG2 VAL 109 -6.876 -5.063 0.889 779 H PHE 110 H PHE 110 -10.043 -6.656 4.828 780 HA PHE 110 HA PHE 110 -11.785 -4.320 4.880 781 HB2 PHE 110 1HB PHE 110 -12.727 -7.159 4.932 782 HB3 PHE 110 2HB PHE 110 -13.583 -5.959 5.894 783 HD1 PHE 110 HD2 PHE 110 -12.664 -6.981 2.488 784 HD2 PHE 110 HD1 PHE 110 -14.954 -4.298 4.870 785 HE1 PHE 110 HE2 PHE 110 -13.926 -6.291 0.492 786 HE2 PHE 110 HE1 PHE 110 -16.221 -3.605 2.878 787 HZ PHE 110 HZ PHE 110 -15.706 -4.601 0.685 788 H GLU 111 H GLU 111 -11.856 -3.391 6.839 789 HA GLU 111 HA GLU 111 -10.475 -4.762 9.029 790 HB2 GLU 111 1HB GLU 111 -9.915 -2.366 8.148 791 HB3 GLU 111 2HB GLU 111 -11.304 -1.883 9.110 792 HG2 GLU 111 1HG GLU 111 -8.808 -3.240 10.097 793 HG3 GLU 111 2HG GLU 111 -9.298 -1.571 10.386 794 H VAL 112 H VAL 112 -11.643 -5.705 10.552 795 HA VAL 112 HA VAL 112 -14.402 -4.789 10.999 796 HB VAL 112 HB VAL 112 -13.231 -7.407 11.925 797 HG11 VAL 112 1HG1 VAL 112 -15.979 -6.235 11.756 798 HG12 VAL 112 2HG1 VAL 112 -15.749 -7.984 11.727 799 HG13 VAL 112 3HG1 VAL 112 -15.190 -7.043 13.110 800 HG21 VAL 112 3HG2 VAL 112 -13.052 -7.877 9.724 801 HG22 VAL 112 1HG2 VAL 112 -14.796 -8.111 9.844 802 HG23 VAL 112 2HG2 VAL 112 -14.150 -6.582 9.249 803 H GLU 113 H GLU 113 -15.018 -3.991 12.922 804 HA GLU 113 HA GLU 113 -13.207 -4.291 15.215 805 HB2 GLU 113 1HB GLU 113 -12.675 -2.122 14.404 806 HB3 GLU 113 2HB GLU 113 -14.368 -1.730 14.133 807 HG2 GLU 113 1HG GLU 113 -14.790 -1.435 16.405 808 HG3 GLU 113 2HG GLU 113 -13.330 -2.299 16.881 809 H LEU 114 H LEU 114 -14.429 -5.556 16.492 810 HA LEU 114 HA LEU 114 -17.246 -5.474 16.642 811 HB2 LEU 114 1HB LEU 114 -15.384 -7.228 17.445 812 HB3 LEU 114 2HB LEU 114 -15.726 -6.444 18.986 813 HG LEU 114 HG LEU 114 -17.104 -8.334 18.950 814 HD11 LEU 114 1HD1 LEU 114 -18.230 -6.157 19.513 815 HD12 LEU 114 2HD1 LEU 114 -19.307 -7.465 19.023 816 HD13 LEU 114 3HD1 LEU 114 -18.911 -6.177 17.885 817 HD21 LEU 114 3HD2 LEU 114 -17.189 -7.812 16.078 818 HD22 LEU 114 1HD2 LEU 114 -18.741 -8.306 16.755 819 HD23 LEU 114 2HD2 LEU 114 -17.322 -9.333 16.961 820 H LEU 115 H LEU 115 -18.603 -4.260 17.807 821 HA LEU 115 HA LEU 115 -17.431 -2.336 19.699 822 HB2 LEU 115 1HB LEU 115 -20.155 -2.133 18.456 823 HB3 LEU 115 2HB LEU 115 -19.204 -0.863 19.222 824 HG LEU 115 HG LEU 115 -18.800 -2.100 16.508 825 HD11 LEU 115 1HD1 LEU 115 -20.291 0.060 17.330 826 HD12 LEU 115 2HD1 LEU 115 -19.700 -0.231 15.694 827 HD13 LEU 115 3HD1 LEU 115 -18.778 0.793 16.795 828 HD21 LEU 115 3HD2 LEU 115 -16.936 -0.421 18.159 829 HD22 LEU 115 1HD2 LEU 115 -16.858 -0.454 16.397 830 HD23 LEU 115 2HD2 LEU 115 -16.604 -1.936 17.319 831 H ASP 116 H ASP 116 -20.139 -4.565 19.229 832 HA ASP 116 HA ASP 116 -20.198 -5.263 21.985 833 HB2 ASP 116 1HB ASP 116 -21.340 -3.068 22.106 834 HB3 ASP 116 2HB ASP 116 -22.546 -3.652 20.963 835 H VAL 117 H VAL 117 -21.870 -6.876 22.462 836 HA VAL 117 HA VAL 117 -22.742 -8.273 20.016 837 HB VAL 117 HB VAL 117 -22.675 -10.357 21.447 838 HG11 VAL 117 1HG1 VAL 117 -20.898 -10.552 20.104 839 HG12 VAL 117 2HG1 VAL 117 -20.455 -8.855 20.299 840 HG13 VAL 117 3HG1 VAL 117 -19.948 -10.043 21.499 841 HG21 VAL 117 3HG2 VAL 117 -22.204 -8.519 23.487 842 HG22 VAL 117 1HG2 VAL 117 -22.112 -10.277 23.598 843 HG23 VAL 117 2HG2 VAL 117 -20.661 -9.338 23.248 844 H13 JZF 130 1H3 JZF 130 -20.725 -3.658 -1.563 845 H23 JZF 130 2H3 JZF 130 -19.713 -5.080 -1.734 846 H4 JZF 130 H4 JZF 130 -19.547 -2.958 0.435 847 H15 JZF 130 1H5 JZF 130 -17.622 -4.140 1.341 848 H25 JZF 130 2H5 JZF 130 -17.733 -5.385 0.107 849 H17 JZF 130 1H7 JZF 130 -17.448 -2.198 -0.471 850 H27 JZF 130 2H7 JZF 130 -17.425 -3.482 -1.637 851 H8 JZF 130 H8 JZF 130 -19.631 -2.307 -2.466 852 H9 JZF 130 H9 JZF 130 -16.987 -2.372 -3.483 853 H1OH JZF 130 1HO JZF 130 -19.672 -0.142 -2.239 854 H11 JZF 130 H11 JZF 130 -17.088 -2.969 -6.001 855 H112 JZF 130 1H12 JZF 130 -18.361 -0.258 -6.630 856 H212 JZF 130 2H12 JZF 130 -16.895 -0.896 -7.358 857 H13A JZF 130 H13 JZF 130 -16.523 0.820 -5.545 858 H114 JZF 130 1H14 JZF 130 -16.840 0.158 -3.191 859 H214 JZF 130 2H14 JZF 130 -18.337 0.323 -4.072 860 H115 JZF 130 1H15 JZF 130 -22.282 -5.836 2.352 861 H215 JZF 130 2H15 JZF 130 -20.953 -6.907 2.796 862 H116 JZF 130 1H16 JZF 130 -21.479 -7.375 -1.170 863 H216 JZF 130 2H16 JZF 130 -19.810 -7.876 -0.766 864 H117 JZF 130 2H17 JZF 130 -21.935 -9.386 -2.206 865 H217 JZF 130 3H17 JZF 130 -20.184 -9.666 -2.182 866 H317 JZF 130 1H17 JZF 130 -21.203 -10.316 -0.886 867 H118 JZF 130 1H18 JZF 130 -18.750 -2.243 -8.126 868 H218 JZF 130 2H18 JZF 130 -18.536 -3.883 -7.499 869 H318 JZF 130 3H18 JZF 130 -19.894 -2.891 -6.939 870 H119 JZF 130 3H19 JZF 130 -15.196 -1.625 -4.411 871 H219 JZF 130 1H19 JZF 130 -14.956 -1.309 -6.132 872 H319 JZF 130 2H19 JZF 130 -14.508 -0.087 -4.942 Start of MODEL 18 1 H1 GLY 1 H GLY 1 15.049 -7.408 11.721 2 HA2 GLY 1 1HA GLY 1 14.180 -5.558 10.234 3 HA3 GLY 1 2HA GLY 1 13.406 -6.851 9.330 4 HA PRO 2 HA PRO 2 10.508 -5.170 12.611 5 HB2 PRO 2 1HB PRO 2 8.521 -4.470 10.900 6 HB3 PRO 2 2HB PRO 2 9.840 -3.378 11.338 7 HG2 PRO 2 1HG PRO 2 9.516 -5.069 8.890 8 HG3 PRO 2 2HG PRO 2 10.078 -3.393 9.025 9 HD2 PRO 2 1HD PRO 2 11.777 -5.480 8.726 10 HD3 PRO 2 2HD PRO 2 12.206 -4.025 9.648 11 H GLY 3 H GLY 3 10.071 -7.203 13.425 12 HA2 GLY 3 1HA GLY 3 8.238 -8.888 11.837 13 HA3 GLY 3 2HA GLY 3 9.338 -9.499 13.064 14 H SER 4 H SER 4 7.302 -6.641 13.370 15 HA SER 4 HA SER 4 6.003 -7.905 15.673 16 HB2 SER 4 1HB SER 4 6.169 -5.002 14.831 17 HB3 SER 4 2HB SER 4 5.308 -5.582 16.257 18 HG SER 4 HG SER 4 7.140 -5.732 17.270 19 H MET 5 H MET 5 5.011 -5.593 13.140 20 HA MET 5 HA MET 5 2.329 -6.770 13.203 21 HB2 MET 5 1HB MET 5 2.866 -4.221 13.371 22 HB3 MET 5 2HB MET 5 3.059 -4.326 11.626 23 HG2 MET 5 1HG MET 5 0.764 -5.269 11.492 24 HG3 MET 5 2HG MET 5 0.591 -4.966 13.220 25 HE1 MET 5 3HE MET 5 -0.692 -1.555 13.431 26 HE2 MET 5 1HE MET 5 -0.754 -3.248 13.921 27 HE3 MET 5 2HE MET 5 0.690 -2.290 14.245 28 H THR 6 H THR 6 2.210 -8.486 11.885 29 HA THR 6 HA THR 6 2.969 -8.088 9.074 30 HB THR 6 HB THR 6 3.579 -10.585 9.064 31 HG1 THR 6 HG1 THR 6 3.912 -11.544 10.967 32 HG21 THR 6 3HG2 THR 6 5.172 -8.304 10.079 33 HG22 THR 6 1HG2 THR 6 5.437 -9.333 8.672 34 HG23 THR 6 2HG2 THR 6 5.868 -9.911 10.282 35 H VAL 7 H VAL 7 1.780 -9.359 7.558 36 HA VAL 7 HA VAL 7 -0.941 -9.844 8.415 37 HB VAL 7 HB VAL 7 -0.598 -8.687 6.311 38 HG11 VAL 7 1HG1 VAL 7 1.494 -10.480 5.953 39 HG12 VAL 7 2HG1 VAL 7 0.318 -10.914 4.711 40 HG13 VAL 7 3HG1 VAL 7 0.936 -9.264 4.805 41 HG21 VAL 7 3HG2 VAL 7 -2.549 -10.235 6.628 42 HG22 VAL 7 1HG2 VAL 7 -2.115 -9.918 4.948 43 HG23 VAL 7 2HG2 VAL 7 -1.654 -11.443 5.706 44 H VAL 8 H VAL 8 -1.758 -11.756 8.948 45 HA VAL 8 HA VAL 8 -0.201 -14.170 8.316 46 HB VAL 8 HB VAL 8 -2.285 -13.749 10.463 47 HG11 VAL 8 1HG1 VAL 8 -0.571 -16.142 9.809 48 HG12 VAL 8 2HG1 VAL 8 -1.538 -15.968 11.275 49 HG13 VAL 8 3HG1 VAL 8 -2.327 -16.034 9.699 50 HG21 VAL 8 3HG2 VAL 8 0.696 -13.658 10.442 51 HG22 VAL 8 1HG2 VAL 8 -0.458 -12.626 11.288 52 HG23 VAL 8 2HG2 VAL 8 -0.136 -14.257 11.877 53 H THR 9 H THR 9 -1.010 -15.661 6.988 54 HA THR 9 HA THR 9 -3.785 -15.341 6.078 55 HB THR 9 HB THR 9 -1.655 -16.990 4.721 56 HG1 THR 9 HG1 THR 9 -0.770 -15.057 4.437 57 HG21 THR 9 3HG2 THR 9 -4.404 -16.059 4.060 58 HG22 THR 9 1HG2 THR 9 -3.626 -17.604 3.724 59 HG23 THR 9 2HG2 THR 9 -3.232 -16.188 2.750 60 H THR 10 H THR 10 -5.085 -17.228 5.717 61 HA THR 10 HA THR 10 -4.462 -19.379 7.620 62 HB THR 10 HB THR 10 -6.844 -19.883 7.648 63 HG1 THR 10 HG1 THR 10 -6.853 -18.080 5.507 64 HG21 THR 10 3HG2 THR 10 -7.495 -18.118 8.981 65 HG22 THR 10 1HG2 THR 10 -6.778 -16.909 7.916 66 HG23 THR 10 2HG2 THR 10 -5.747 -17.890 8.957 67 H GLU 11 H GLU 11 -5.961 -21.426 6.837 68 HA GLU 11 HA GLU 11 -4.543 -22.453 4.582 69 HB2 GLU 11 1HB GLU 11 -5.320 -23.775 6.605 70 HB3 GLU 11 2HB GLU 11 -6.938 -23.706 5.921 71 HG2 GLU 11 1HG GLU 11 -6.339 -25.022 4.080 72 HG3 GLU 11 2HG GLU 11 -4.616 -24.797 4.373 73 H SER 12 H SER 12 -7.724 -21.112 5.112 74 HA SER 12 HA SER 12 -8.817 -21.980 2.613 75 HB2 SER 12 1HB SER 12 -10.742 -20.716 3.187 76 HB3 SER 12 2HB SER 12 -10.127 -21.348 4.714 77 HG SER 12 HG SER 12 -9.776 -19.383 5.360 78 H GLY 13 H GLY 13 -7.063 -19.174 3.740 79 HA2 GLY 13 1HA GLY 13 -5.763 -18.145 1.825 80 HA3 GLY 13 2HA GLY 13 -7.335 -17.967 1.059 81 H LEU 14 H LEU 14 -8.650 -17.294 3.606 82 HA LEU 14 HA LEU 14 -8.384 -14.491 3.475 83 HB2 LEU 14 1HB LEU 14 -10.460 -15.384 4.168 84 HB3 LEU 14 2HB LEU 14 -9.706 -16.328 5.452 85 HG LEU 14 HG LEU 14 -9.469 -13.377 5.627 86 HD11 LEU 14 1HD1 LEU 14 -11.643 -12.952 5.574 87 HD12 LEU 14 2HD1 LEU 14 -11.872 -14.059 6.927 88 HD13 LEU 14 3HD1 LEU 14 -12.000 -14.653 5.272 89 HD21 LEU 14 3HD2 LEU 14 -10.369 -15.022 7.889 90 HD22 LEU 14 1HD2 LEU 14 -9.100 -13.800 7.803 91 HD23 LEU 14 2HD2 LEU 14 -8.784 -15.442 7.239 92 H LYS 15 H LYS 15 -7.380 -13.020 4.797 93 HA LYS 15 HA LYS 15 -5.434 -14.131 6.711 94 HB2 LYS 15 1HB LYS 15 -5.172 -11.482 5.297 95 HB3 LYS 15 2HB LYS 15 -3.930 -12.371 6.170 96 HG2 LYS 15 1HG LYS 15 -3.874 -14.065 4.458 97 HG3 LYS 15 2HG LYS 15 -5.216 -13.294 3.609 98 HD2 LYS 15 1HD LYS 15 -3.747 -11.238 3.435 99 HD3 LYS 15 2HD LYS 15 -2.416 -12.256 3.990 100 HE2 LYS 15 1HE LYS 15 -3.022 -13.816 2.074 101 HE3 LYS 15 2HE LYS 15 -4.033 -12.506 1.467 102 HZ1 LYS 15 3HZ LYS 15 -1.193 -12.034 2.105 103 HZ2 LYS 15 1HZ LYS 15 -2.205 -11.175 1.055 104 HZ3 LYS 15 2HZ LYS 15 -1.636 -12.707 0.618 105 H TYR 16 H TYR 16 -4.817 -12.609 8.478 106 HA TYR 16 HA TYR 16 -6.842 -10.650 9.202 107 HB2 TYR 16 1HB TYR 16 -7.453 -11.644 11.266 108 HB3 TYR 16 2HB TYR 16 -7.575 -12.927 10.067 109 HD1 TYR 16 HD2 TYR 16 -5.596 -14.546 9.864 110 HD2 TYR 16 HD1 TYR 16 -6.134 -11.929 13.176 111 HE1 TYR 16 HE2 TYR 16 -4.098 -15.954 11.213 112 HE2 TYR 16 HE1 TYR 16 -4.636 -13.330 14.534 113 HH TYR 16 HH TYR 16 -3.943 -16.220 14.119 114 H GLU 17 H GLU 17 -6.021 -8.988 10.346 115 HA GLU 17 HA GLU 17 -3.377 -9.314 11.584 116 HB2 GLU 17 1HB GLU 17 -3.155 -8.260 9.334 117 HB3 GLU 17 2HB GLU 17 -4.185 -6.947 9.887 118 HG2 GLU 17 1HG GLU 17 -2.451 -6.655 11.761 119 HG3 GLU 17 2HG GLU 17 -1.404 -7.640 10.740 120 H ASP 18 H ASP 18 -3.486 -8.783 13.652 121 HA ASP 18 HA ASP 18 -5.701 -7.559 14.861 122 HB2 ASP 18 1HB ASP 18 -4.112 -9.032 16.054 123 HB3 ASP 18 2HB ASP 18 -2.882 -7.777 15.936 124 H LEU 19 H LEU 19 -6.236 -5.497 15.256 125 HA LEU 19 HA LEU 19 -4.254 -3.417 14.599 126 HB2 LEU 19 1HB LEU 19 -7.113 -3.719 13.872 127 HB3 LEU 19 2HB LEU 19 -6.532 -2.092 14.221 128 HG LEU 19 HG LEU 19 -5.434 -3.937 12.099 129 HD11 LEU 19 1HD1 LEU 19 -7.572 -1.932 12.121 130 HD12 LEU 19 2HD1 LEU 19 -7.266 -3.259 11.000 131 HD13 LEU 19 3HD1 LEU 19 -6.389 -1.738 10.827 132 HD21 LEU 19 3HD2 LEU 19 -4.730 -1.174 11.820 133 HD22 LEU 19 1HD2 LEU 19 -3.681 -2.587 11.948 134 HD23 LEU 19 2HD2 LEU 19 -4.231 -1.761 13.407 135 H THR 20 H THR 20 -6.821 -4.462 16.732 136 HA THR 20 HA THR 20 -5.795 -2.826 18.860 137 HB THR 20 HB THR 20 -8.678 -2.318 18.179 138 HG1 THR 20 HG1 THR 20 -7.774 -0.262 17.304 139 HG21 THR 20 3HG2 THR 20 -8.293 -1.592 20.337 140 HG22 THR 20 1HG2 THR 20 -7.940 -0.130 19.416 141 HG23 THR 20 2HG2 THR 20 -6.621 -1.144 20.001 142 H GLU 21 H GLU 21 -5.774 -4.230 20.482 143 HA GLU 21 HA GLU 21 -7.257 -6.587 20.623 144 HB2 GLU 21 1HB GLU 21 -6.451 -6.803 22.884 145 HB3 GLU 21 2HB GLU 21 -5.166 -6.131 21.889 146 HG2 GLU 21 1HG GLU 21 -6.002 -3.848 22.725 147 HG3 GLU 21 2HG GLU 21 -6.835 -4.779 23.969 148 H GLY 22 H GLY 22 -8.829 -7.185 22.345 149 HA2 GLY 22 1HA GLY 22 -10.451 -5.096 23.485 150 HA3 GLY 22 2HA GLY 22 -11.223 -5.911 22.133 151 H SER 23 H SER 23 -10.548 -6.006 25.456 152 HA SER 23 HA SER 23 -10.855 -8.821 25.853 153 HB2 SER 23 1HB SER 23 -10.813 -6.423 27.661 154 HB3 SER 23 2HB SER 23 -11.305 -7.996 28.289 155 HG SER 23 HG SER 23 -8.809 -7.115 27.440 156 H GLY 24 H GLY 24 -12.803 -9.037 24.493 157 HA2 GLY 24 1HA GLY 24 -15.230 -8.480 26.082 158 HA3 GLY 24 2HA GLY 24 -15.202 -8.281 24.336 159 H ALA 25 H ALA 25 -16.688 -9.791 23.761 160 HA ALA 25 HA ALA 25 -15.996 -12.587 24.377 161 HB1 ALA 25 1HB ALA 25 -18.009 -13.024 25.218 162 HB2 ALA 25 2HB ALA 25 -18.271 -11.280 25.270 163 HB3 ALA 25 3HB ALA 25 -18.824 -12.214 23.880 164 H GLU 26 H GLU 26 -16.055 -14.007 22.701 165 HA GLU 26 HA GLU 26 -15.982 -12.981 20.061 166 HB2 GLU 26 1HB GLU 26 -14.692 -14.956 20.775 167 HB3 GLU 26 2HB GLU 26 -16.190 -15.851 20.990 168 HG2 GLU 26 1HG GLU 26 -16.648 -15.785 18.649 169 HG3 GLU 26 2HG GLU 26 -15.302 -14.683 18.366 170 H ALA 27 H ALA 27 -17.504 -12.846 18.520 171 HA ALA 27 HA ALA 27 -20.230 -12.961 19.165 172 HB1 ALA 27 1HB ALA 27 -19.114 -11.633 17.312 173 HB2 ALA 27 2HB ALA 27 -19.158 -13.119 16.363 174 HB3 ALA 27 3HB ALA 27 -20.661 -12.387 16.924 175 H ARG 28 H ARG 28 -21.802 -14.469 18.866 176 HA ARG 28 HA ARG 28 -20.914 -17.124 17.947 177 HB2 ARG 28 1HB ARG 28 -22.048 -16.378 20.395 178 HB3 ARG 28 2HB ARG 28 -23.347 -17.169 19.514 179 HG2 ARG 28 1HG ARG 28 -20.630 -18.407 19.800 180 HG3 ARG 28 2HG ARG 28 -21.901 -18.624 21.004 181 HD2 ARG 28 1HD ARG 28 -23.091 -20.011 19.685 182 HD3 ARG 28 2HD ARG 28 -22.717 -19.101 18.221 183 HE ARG 28 HE ARG 28 -21.054 -20.597 17.804 184 HH11 ARG 28 1HH1 ARG 28 -21.759 -20.660 21.212 185 HH12 ARG 28 2HH1 ARG 28 -20.663 -21.960 21.548 186 HH21 ARG 28 1HH2 ARG 28 -19.609 -22.309 18.232 187 HH22 ARG 28 2HH2 ARG 28 -19.440 -22.897 19.852 188 H ALA 29 H ALA 29 -22.104 -18.203 16.443 189 HA ALA 29 HA ALA 29 -23.732 -16.759 14.682 190 HB1 ALA 29 1HB ALA 29 -24.400 -19.213 13.978 191 HB2 ALA 29 2HB ALA 29 -22.791 -18.567 13.651 192 HB3 ALA 29 3HB ALA 29 -23.050 -19.632 15.033 193 H GLY 30 H GLY 30 -25.755 -16.082 14.911 194 HA2 GLY 30 1HA GLY 30 -28.096 -16.805 15.158 195 HA3 GLY 30 2HA GLY 30 -27.582 -17.693 16.585 196 H GLN 31 H GLN 31 -25.783 -15.244 17.144 197 HA GLN 31 HA GLN 31 -27.863 -13.763 18.583 198 HB2 GLN 31 1HB GLN 31 -26.327 -13.308 20.226 199 HB3 GLN 31 2HB GLN 31 -25.700 -14.842 19.640 200 HG2 GLN 31 1HG GLN 31 -24.090 -13.637 18.239 201 HG3 GLN 31 2HG GLN 31 -24.706 -12.109 18.865 202 HE21 GLN 31 2HE2 GLN 31 -24.092 -11.419 20.861 203 HE22 GLN 31 1HE2 GLN 31 -22.908 -12.222 21.829 204 H THR 32 H THR 32 -28.061 -11.546 18.454 205 HA THR 32 HA THR 32 -27.083 -10.358 16.006 206 HB THR 32 HB THR 32 -28.703 -8.938 18.111 207 HG1 THR 32 HG1 THR 32 -30.539 -9.732 16.855 208 HG21 THR 32 3HG2 THR 32 -29.042 -8.617 15.168 209 HG22 THR 32 1HG2 THR 32 -27.632 -7.890 15.937 210 HG23 THR 32 2HG2 THR 32 -29.254 -7.438 16.463 211 H VAL 33 H VAL 33 -25.556 -8.811 15.800 212 HA VAL 33 HA VAL 33 -24.527 -7.446 18.159 213 HB VAL 33 HB VAL 33 -22.227 -8.036 17.780 214 HG11 VAL 33 1HG1 VAL 33 -23.555 -9.531 19.202 215 HG12 VAL 33 2HG1 VAL 33 -23.919 -10.534 17.796 216 HG13 VAL 33 3HG1 VAL 33 -22.258 -10.393 18.374 217 HG21 VAL 33 3HG2 VAL 33 -21.534 -8.625 15.753 218 HG22 VAL 33 1HG2 VAL 33 -22.338 -10.181 15.961 219 HG23 VAL 33 2HG2 VAL 33 -23.199 -8.837 15.210 220 H SER 34 H SER 34 -23.032 -5.691 17.605 221 HA SER 34 HA SER 34 -23.555 -4.655 14.896 222 HB2 SER 34 1HB SER 34 -23.614 -3.367 17.574 223 HB3 SER 34 2HB SER 34 -22.972 -2.406 16.242 224 HG SER 34 HG SER 34 -25.553 -3.285 16.719 225 H VAL 35 H VAL 35 -21.826 -4.600 13.640 226 HA VAL 35 HA VAL 35 -19.215 -3.972 14.843 227 HB VAL 35 HB VAL 35 -18.083 -5.619 13.576 228 HG11 VAL 35 1HG1 VAL 35 -20.598 -6.960 14.557 229 HG12 VAL 35 2HG1 VAL 35 -18.992 -7.677 14.408 230 HG13 VAL 35 3HG1 VAL 35 -19.289 -6.414 15.604 231 HG21 VAL 35 3HG2 VAL 35 -19.091 -5.530 11.459 232 HG22 VAL 35 1HG2 VAL 35 -19.427 -7.160 12.043 233 HG23 VAL 35 2HG2 VAL 35 -20.684 -5.924 12.104 234 H HIS 36 H HIS 36 -17.664 -3.051 13.364 235 HA HIS 36 HA HIS 36 -18.967 -1.619 11.147 236 HB2 HIS 36 1HB HIS 36 -17.276 -0.732 13.297 237 HB3 HIS 36 2HB HIS 36 -16.498 -0.390 11.754 238 HD1 HIS 36 HD1 HIS 36 -18.602 0.610 9.983 239 HD2 HIS 36 HD2 HIS 36 -18.631 1.469 14.047 240 HE1 HIS 36 HE1 HIS 36 -20.016 2.675 10.223 241 H TYR 37 H TYR 37 -18.199 -1.813 9.124 242 HA TYR 37 HA TYR 37 -15.738 -3.393 8.757 243 HB2 TYR 37 1HB TYR 37 -16.707 -4.248 6.679 244 HB3 TYR 37 2HB TYR 37 -17.754 -4.608 8.048 245 HD1 TYR 37 HD1 TYR 37 -19.795 -3.154 8.420 246 HD2 TYR 37 HD2 TYR 37 -17.507 -3.025 4.835 247 HE1 TYR 37 HE1 TYR 37 -21.684 -2.090 7.260 248 HE2 TYR 37 HE2 TYR 37 -19.390 -1.959 3.665 249 HH TYR 37 HH TYR 37 -21.432 -0.509 4.402 250 H THR 38 H THR 38 -14.142 -2.513 7.602 251 HA THR 38 HA THR 38 -14.728 -0.057 6.080 252 HB THR 38 HB THR 38 -11.943 -0.322 6.868 253 HG1 THR 38 HG1 THR 38 -13.961 -0.469 8.839 254 HG21 THR 38 3HG2 THR 38 -12.372 1.983 7.714 255 HG22 THR 38 1HG2 THR 38 -14.072 1.775 7.294 256 HG23 THR 38 2HG2 THR 38 -12.841 1.748 6.031 257 H GLY 39 H GLY 39 -14.671 -0.529 3.976 258 HA2 GLY 39 1HA GLY 39 -13.237 -2.726 2.883 259 HA3 GLY 39 2HA GLY 39 -14.023 -1.446 1.969 260 H TRP 40 H TRP 40 -11.070 -2.761 2.974 261 HA TRP 40 HA TRP 40 -9.633 -0.375 2.008 262 HB2 TRP 40 1HB TRP 40 -8.727 -2.480 3.983 263 HB3 TRP 40 2HB TRP 40 -7.698 -1.201 3.347 264 HD1 TRP 40 HD1 TRP 40 -10.514 0.788 3.638 265 HE1 TRP 40 HE1 TRP 40 -10.811 1.871 5.954 266 HE3 TRP 40 HE3 TRP 40 -7.416 -2.240 6.353 267 HZ2 TRP 40 HZ2 TRP 40 -9.858 1.492 8.583 268 HZ3 TRP 40 HZ3 TRP 40 -7.164 -1.813 8.762 269 HH2 TRP 40 HH2 TRP 40 -8.360 0.016 9.853 270 H LEU 41 H LEU 41 -7.742 -0.728 0.726 271 HA LEU 41 HA LEU 41 -8.005 -3.062 -0.990 272 HB2 LEU 41 1HB LEU 41 -6.685 -0.410 -1.181 273 HB3 LEU 41 2HB LEU 41 -6.011 -1.730 -2.133 274 HG LEU 41 HG LEU 41 -8.878 -0.805 -2.293 275 HD11 LEU 41 1HD1 LEU 41 -7.339 -0.315 -4.653 276 HD12 LEU 41 2HD1 LEU 41 -6.571 0.467 -3.272 277 HD13 LEU 41 3HD1 LEU 41 -8.254 0.821 -3.661 278 HD21 LEU 41 3HD2 LEU 41 -8.307 -2.085 -4.612 279 HD22 LEU 41 1HD2 LEU 41 -9.074 -2.845 -3.217 280 HD23 LEU 41 2HD2 LEU 41 -7.336 -3.014 -3.468 281 H THR 42 H THR 42 -6.133 -4.315 -1.637 282 HA THR 42 HA THR 42 -4.693 -5.347 0.525 283 HB THR 42 HB THR 42 -3.508 -6.702 -1.024 284 HG1 THR 42 HG1 THR 42 -4.065 -4.603 -2.831 285 HG21 THR 42 3HG2 THR 42 -5.990 -7.050 -0.878 286 HG22 THR 42 1HG2 THR 42 -5.252 -7.642 -2.365 287 HG23 THR 42 2HG2 THR 42 -6.146 -6.121 -2.368 288 H ASP 43 H ASP 43 -4.102 -2.590 -1.421 289 HA ASP 43 HA ASP 43 -1.263 -2.485 -0.822 290 HB2 ASP 43 1HB ASP 43 -1.159 -0.612 -2.253 291 HB3 ASP 43 2HB ASP 43 -2.335 -1.687 -3.004 292 H GLY 44 H GLY 44 -4.214 -1.404 0.539 293 HA2 GLY 44 1HA GLY 44 -4.130 -0.668 2.862 294 HA3 GLY 44 2HA GLY 44 -2.691 0.254 2.450 295 H GLN 45 H GLN 45 -4.873 0.491 -0.052 296 HA GLN 45 HA GLN 45 -5.571 3.199 0.744 297 HB2 GLN 45 1HB GLN 45 -4.975 3.353 -1.444 298 HB3 GLN 45 2HB GLN 45 -5.433 1.692 -1.796 299 HG2 GLN 45 1HG GLN 45 -7.650 2.245 -2.173 300 HG3 GLN 45 2HG GLN 45 -7.523 3.765 -1.289 301 HE21 GLN 45 2HE2 GLN 45 -8.672 3.672 -3.771 302 HE22 GLN 45 1HE2 GLN 45 -7.660 4.483 -4.912 303 H LYS 46 H LYS 46 -7.446 3.708 1.642 304 HA LYS 46 HA LYS 46 -9.524 1.751 1.940 305 HB2 LYS 46 1HB LYS 46 -9.044 3.276 3.765 306 HB3 LYS 46 2HB LYS 46 -9.380 4.664 2.737 307 HG2 LYS 46 1HG LYS 46 -11.729 3.757 2.507 308 HG3 LYS 46 2HG LYS 46 -11.319 2.635 3.806 309 HD2 LYS 46 1HD LYS 46 -11.078 5.634 4.017 310 HD3 LYS 46 2HD LYS 46 -12.478 4.710 4.570 311 HE2 LYS 46 1HE LYS 46 -11.305 3.720 6.297 312 HE3 LYS 46 2HE LYS 46 -9.744 3.964 5.516 313 HZ1 LYS 46 3HZ LYS 46 -10.518 6.483 5.880 314 HZ2 LYS 46 1HZ LYS 46 -9.594 5.622 7.005 315 HZ3 LYS 46 2HZ LYS 46 -11.267 5.758 7.213 316 H PHE 47 H PHE 47 -11.579 1.761 1.071 317 HA PHE 47 HA PHE 47 -12.234 3.805 -0.914 318 HB2 PHE 47 1HB PHE 47 -12.725 2.227 -2.644 319 HB3 PHE 47 2HB PHE 47 -11.102 1.869 -2.065 320 HD1 PHE 47 HD2 PHE 47 -10.679 -0.122 -0.703 321 HD2 PHE 47 HD1 PHE 47 -14.520 0.681 -2.352 322 HE1 PHE 47 HE2 PHE 47 -11.340 -2.455 -0.291 323 HE2 PHE 47 HE1 PHE 47 -15.188 -1.651 -1.942 324 HZ PHE 47 HZ PHE 47 -13.596 -3.223 -0.912 325 H ASP 48 H ASP 48 -13.140 2.613 1.803 326 HA ASP 48 HA ASP 48 -15.848 3.249 1.589 327 HB2 ASP 48 1HB ASP 48 -16.272 1.285 0.345 328 HB3 ASP 48 2HB ASP 48 -15.214 0.313 1.364 329 H SER 49 H SER 49 -16.447 3.833 3.566 330 HA SER 49 HA SER 49 -15.719 2.274 5.887 331 HB2 SER 49 1HB SER 49 -14.692 4.246 7.054 332 HB3 SER 49 2HB SER 49 -13.722 3.615 5.724 333 HG SER 49 HG SER 49 -14.043 5.981 5.841 334 H SER 50 H SER 50 -17.753 2.047 6.606 335 HA SER 50 HA SER 50 -19.750 4.054 6.413 336 HB2 SER 50 1HB SER 50 -19.554 1.429 7.866 337 HB3 SER 50 2HB SER 50 -20.931 2.500 8.126 338 HG SER 50 HG SER 50 -21.707 1.811 6.312 339 H LYS 51 H LYS 51 -17.270 3.386 8.705 340 HA LYS 51 HA LYS 51 -18.332 4.471 11.040 341 HB2 LYS 51 1HB LYS 51 -15.475 4.562 10.053 342 HB3 LYS 51 2HB LYS 51 -15.985 4.876 11.707 343 HG2 LYS 51 1HG LYS 51 -16.666 2.627 12.017 344 HG3 LYS 51 2HG LYS 51 -16.503 2.273 10.296 345 HD2 LYS 51 1HD LYS 51 -14.218 3.061 12.100 346 HD3 LYS 51 2HD LYS 51 -14.634 1.396 11.687 347 HE2 LYS 51 1HE LYS 51 -14.351 2.010 9.280 348 HE3 LYS 51 2HE LYS 51 -13.748 3.581 9.808 349 HZ1 LYS 51 3HZ LYS 51 -12.323 1.668 11.217 350 HZ2 LYS 51 1HZ LYS 51 -11.755 2.666 9.974 351 HZ3 LYS 51 2HZ LYS 51 -12.363 1.129 9.614 352 H ASP 52 H ASP 52 -17.240 6.014 8.142 353 HA ASP 52 HA ASP 52 -16.664 8.578 9.097 354 HB2 ASP 52 1HB ASP 52 -17.560 7.479 6.462 355 HB3 ASP 52 2HB ASP 52 -17.539 9.225 6.698 356 H ARG 53 H ARG 53 -19.711 6.995 8.435 357 HA ARG 53 HA ARG 53 -21.138 9.469 9.148 358 HB2 ARG 53 1HB ARG 53 -22.639 7.157 8.056 359 HB3 ARG 53 2HB ARG 53 -22.847 8.878 7.759 360 HG2 ARG 53 1HG ARG 53 -20.672 7.151 6.595 361 HG3 ARG 53 2HG ARG 53 -22.130 7.682 5.755 362 HD2 ARG 53 1HD ARG 53 -21.451 9.950 5.820 363 HD3 ARG 53 2HD ARG 53 -20.160 9.603 6.970 364 HE ARG 53 HE ARG 53 -19.658 8.111 4.676 365 HH11 ARG 53 1HH1 ARG 53 -19.847 11.456 5.624 366 HH12 ARG 53 2HH1 ARG 53 -18.705 11.992 4.437 367 HH21 ARG 53 1HH2 ARG 53 -18.153 8.805 3.109 368 HH22 ARG 53 2HH2 ARG 53 -17.743 10.484 3.006 369 H ASN 54 H ASN 54 -19.878 7.200 10.825 370 HA ASN 54 HA ASN 54 -20.348 6.014 12.715 371 HB2 ASN 54 1HB ASN 54 -21.130 8.545 13.133 372 HB3 ASN 54 2HB ASN 54 -22.683 7.742 13.340 373 HD21 ASN 54 2HD2 ASN 54 -19.336 6.946 14.215 374 HD22 ASN 54 1HD2 ASN 54 -19.665 6.651 15.885 375 H ASP 55 H ASP 55 -21.564 4.999 10.378 376 HA ASP 55 HA ASP 55 -24.142 3.999 11.389 377 HB2 ASP 55 1HB ASP 55 -24.497 5.040 9.286 378 HB3 ASP 55 2HB ASP 55 -23.065 4.289 8.588 379 HA PRO 56 HA PRO 56 -21.284 0.423 11.847 380 HB2 PRO 56 1HB PRO 56 -22.495 -0.527 14.083 381 HB3 PRO 56 2HB PRO 56 -21.253 0.730 14.123 382 HG2 PRO 56 1HG PRO 56 -24.231 1.003 14.259 383 HG3 PRO 56 2HG PRO 56 -22.987 1.837 15.208 384 HD2 PRO 56 1HD PRO 56 -24.224 2.991 13.094 385 HD3 PRO 56 2HD PRO 56 -22.540 3.350 13.527 386 H PHE 57 H PHE 57 -21.640 -1.682 11.254 387 HA PHE 57 HA PHE 57 -24.244 -2.281 10.136 388 HB2 PHE 57 1HB PHE 57 -21.880 -2.788 9.122 389 HB3 PHE 57 2HB PHE 57 -21.960 -4.221 10.142 390 HD1 PHE 57 HD2 PHE 57 -24.069 -2.369 7.684 391 HD2 PHE 57 HD1 PHE 57 -22.829 -6.136 9.230 392 HE1 PHE 57 HE2 PHE 57 -25.406 -3.512 5.963 393 HE2 PHE 57 HE1 PHE 57 -24.163 -7.285 7.512 394 HZ PHE 57 HZ PHE 57 -25.455 -5.973 5.876 395 H ALA 58 H ALA 58 -25.776 -3.136 11.366 396 HA ALA 58 HA ALA 58 -24.990 -5.008 13.503 397 HB1 ALA 58 1HB ALA 58 -26.817 -4.305 14.791 398 HB2 ALA 58 2HB ALA 58 -26.143 -2.818 14.122 399 HB3 ALA 58 3HB ALA 58 -27.598 -3.523 13.416 400 H PHE 59 H PHE 59 -25.736 -7.040 13.444 401 HA PHE 59 HA PHE 59 -28.180 -7.815 12.236 402 HB2 PHE 59 1HB PHE 59 -27.397 -9.021 10.316 403 HB3 PHE 59 2HB PHE 59 -26.771 -7.380 10.200 404 HD1 PHE 59 HD1 PHE 59 -24.382 -7.085 11.360 405 HD2 PHE 59 HD2 PHE 59 -25.957 -10.731 9.829 406 HE1 PHE 59 HE1 PHE 59 -22.098 -7.971 11.129 407 HE2 PHE 59 HE2 PHE 59 -23.676 -11.623 9.596 408 HZ PHE 59 HZ PHE 59 -21.743 -10.243 10.247 409 H VAL 60 H VAL 60 -27.974 -10.398 11.800 410 HA VAL 60 HA VAL 60 -27.035 -11.449 14.361 411 HB VAL 60 HB VAL 60 -29.356 -11.926 13.720 412 HG11 VAL 60 1HG1 VAL 60 -28.752 -13.919 11.695 413 HG12 VAL 60 2HG1 VAL 60 -29.973 -12.645 11.700 414 HG13 VAL 60 3HG1 VAL 60 -28.324 -12.287 11.184 415 HG21 VAL 60 3HG2 VAL 60 -28.318 -13.503 15.181 416 HG22 VAL 60 1HG2 VAL 60 -29.252 -14.415 13.994 417 HG23 VAL 60 2HG2 VAL 60 -27.499 -14.298 13.836 418 H LEU 61 H LEU 61 -25.334 -12.764 14.555 419 HA LEU 61 HA LEU 61 -23.516 -13.166 12.466 420 HB2 LEU 61 1HB LEU 61 -22.915 -13.194 14.844 421 HB3 LEU 61 2HB LEU 61 -23.789 -14.712 15.041 422 HG LEU 61 HG LEU 61 -22.182 -15.903 13.763 423 HD11 LEU 61 1HD1 LEU 61 -21.550 -13.248 12.720 424 HD12 LEU 61 2HD1 LEU 61 -21.381 -14.835 11.971 425 HD13 LEU 61 3HD1 LEU 61 -20.133 -14.239 13.065 426 HD21 LEU 61 3HD2 LEU 61 -21.561 -14.618 16.130 427 HD22 LEU 61 1HD2 LEU 61 -20.159 -14.311 15.104 428 HD23 LEU 61 2HD2 LEU 61 -20.682 -15.968 15.410 429 H GLY 62 H GLY 62 -23.685 -14.449 10.757 430 HA2 GLY 62 1HA GLY 62 -23.834 -16.535 9.685 431 HA3 GLY 62 2HA GLY 62 -24.661 -17.176 11.097 432 H GLY 63 H GLY 63 -25.851 -14.174 9.999 433 HA2 GLY 63 1HA GLY 63 -27.751 -15.283 8.121 434 HA3 GLY 63 2HA GLY 63 -28.449 -14.839 9.672 435 H GLY 64 H GLY 64 -26.123 -13.388 7.380 436 HA2 GLY 64 1HA GLY 64 -27.816 -10.980 7.349 437 HA3 GLY 64 2HA GLY 64 -26.101 -10.832 7.701 438 H MET 65 H MET 65 -26.815 -13.305 5.490 439 HA MET 65 HA MET 65 -26.264 -13.578 3.296 440 HB2 MET 65 1HB MET 65 -28.353 -11.895 3.399 441 HB3 MET 65 2HB MET 65 -27.189 -10.845 2.603 442 HG2 MET 65 1HG MET 65 -26.822 -12.791 0.985 443 HG3 MET 65 2HG MET 65 -28.309 -13.455 1.659 444 HE1 MET 65 3HE MET 65 -30.474 -12.445 1.670 445 HE2 MET 65 1HE MET 65 -31.100 -11.393 0.400 446 HE3 MET 65 2HE MET 65 -30.526 -13.012 0.000 447 H VAL 66 H VAL 66 -24.061 -12.940 4.649 448 HA VAL 66 HA VAL 66 -22.719 -10.858 3.054 449 HB VAL 66 HB VAL 66 -21.102 -10.620 4.814 450 HG11 VAL 66 1HG1 VAL 66 -23.017 -9.271 5.162 451 HG12 VAL 66 2HG1 VAL 66 -23.951 -10.632 5.786 452 HG13 VAL 66 3HG1 VAL 66 -22.614 -9.972 6.729 453 HG21 VAL 66 3HG2 VAL 66 -21.327 -11.916 6.931 454 HG22 VAL 66 1HG2 VAL 66 -22.526 -12.930 6.127 455 HG23 VAL 66 2HG2 VAL 66 -20.864 -12.895 5.539 456 H ILE 67 H ILE 67 -20.658 -11.277 2.190 457 HA ILE 67 HA ILE 67 -20.269 -13.720 0.974 458 HB ILE 67 HB ILE 67 -17.824 -12.989 0.776 459 HG12 ILE 67 1HG1 ILE 67 -18.887 -10.392 1.881 460 HG13 ILE 67 2HG1 ILE 67 -18.015 -11.549 2.880 461 HG21 ILE 67 1HG2 ILE 67 -18.673 -12.291 -1.153 462 HG22 ILE 67 2HG2 ILE 67 -20.231 -11.953 -0.402 463 HG23 ILE 67 3HG2 ILE 67 -18.967 -10.724 -0.400 464 HD11 ILE 67 3HD1 ILE 67 -16.572 -10.996 0.453 465 HD12 ILE 67 1HD1 ILE 67 -16.938 -9.512 1.332 466 HD13 ILE 67 2HD1 ILE 67 -16.065 -10.819 2.132 467 H LYS 68 H LYS 68 -18.693 -15.388 1.292 468 HA LYS 68 HA LYS 68 -18.724 -16.640 3.721 469 HB2 LYS 68 1HB LYS 68 -16.628 -16.762 1.552 470 HB3 LYS 68 2HB LYS 68 -16.654 -17.855 2.929 471 HG2 LYS 68 1HG LYS 68 -18.902 -18.608 2.247 472 HG3 LYS 68 2HG LYS 68 -18.788 -17.571 0.824 473 HD2 LYS 68 1HD LYS 68 -18.086 -19.578 -0.049 474 HD3 LYS 68 2HD LYS 68 -16.542 -18.875 0.441 475 HE2 LYS 68 1HE LYS 68 -16.377 -21.001 1.311 476 HE3 LYS 68 2HE LYS 68 -17.016 -20.107 2.689 477 HZ1 LYS 68 3HZ LYS 68 -18.986 -21.261 0.890 478 HZ2 LYS 68 1HZ LYS 68 -18.983 -21.167 2.580 479 HZ3 LYS 68 2HZ LYS 68 -18.081 -22.365 1.798 480 H GLY 69 H GLY 69 -16.071 -14.607 2.473 481 HA2 GLY 69 1HA GLY 69 -14.358 -14.748 4.639 482 HA3 GLY 69 2HA GLY 69 -14.499 -13.351 3.581 483 H TRP 70 H TRP 70 -17.179 -12.663 4.213 484 HA TRP 70 HA TRP 70 -16.748 -11.061 6.496 485 HB2 TRP 70 1HB TRP 70 -18.984 -11.574 4.628 486 HB3 TRP 70 2HB TRP 70 -19.441 -10.978 6.221 487 HD1 TRP 70 HD1 TRP 70 -16.504 -9.925 3.899 488 HE1 TRP 70 HE1 TRP 70 -16.611 -7.370 3.609 489 HE3 TRP 70 HE3 TRP 70 -20.729 -8.975 6.617 490 HZ2 TRP 70 HZ2 TRP 70 -18.267 -5.234 4.425 491 HZ3 TRP 70 HZ3 TRP 70 -21.507 -6.649 6.813 492 HH2 TRP 70 HH2 TRP 70 -20.300 -4.819 5.740 493 H ASP 71 H ASP 71 -18.926 -13.842 6.007 494 HA ASP 71 HA ASP 71 -19.868 -14.024 8.623 495 HB2 ASP 71 1HB ASP 71 -20.736 -15.255 6.587 496 HB3 ASP 71 2HB ASP 71 -19.400 -16.384 6.798 497 H GLU 72 H GLU 72 -17.038 -15.538 7.118 498 HA GLU 72 HA GLU 72 -16.257 -17.078 9.340 499 HB2 GLU 72 1HB GLU 72 -15.429 -17.026 6.823 500 HB3 GLU 72 2HB GLU 72 -14.199 -15.961 7.490 501 HG2 GLU 72 1HG GLU 72 -13.411 -18.249 7.409 502 HG3 GLU 72 2HG GLU 72 -13.547 -17.693 9.076 503 H GLY 73 H GLY 73 -15.709 -13.729 8.481 504 HA2 GLY 73 1HA GLY 73 -13.688 -13.298 10.485 505 HA3 GLY 73 2HA GLY 73 -14.482 -12.063 9.520 506 H VAL 74 H VAL 74 -17.098 -12.329 10.148 507 HA VAL 74 HA VAL 74 -17.255 -11.067 12.674 508 HB VAL 74 HB VAL 74 -18.875 -10.559 10.942 509 HG11 VAL 74 1HG1 VAL 74 -19.546 -12.250 9.648 510 HG12 VAL 74 2HG1 VAL 74 -19.157 -13.454 10.879 511 HG13 VAL 74 3HG1 VAL 74 -20.709 -12.615 10.923 512 HG21 VAL 74 3HG2 VAL 74 -20.196 -11.898 13.301 513 HG22 VAL 74 1HG2 VAL 74 -19.541 -10.260 13.280 514 HG23 VAL 74 2HG2 VAL 74 -20.921 -10.672 12.262 515 H GLN 75 H GLN 75 -17.396 -14.368 11.695 516 HA GLN 75 HA GLN 75 -18.668 -15.242 14.160 517 HB2 GLN 75 1HB GLN 75 -18.790 -17.381 13.205 518 HB3 GLN 75 2HB GLN 75 -19.053 -16.289 11.852 519 HG2 GLN 75 1HG GLN 75 -16.699 -16.550 11.205 520 HG3 GLN 75 2HG GLN 75 -16.475 -17.685 12.535 521 HE21 GLN 75 2HE2 GLN 75 -19.108 -17.293 10.201 522 HE22 GLN 75 1HE2 GLN 75 -19.019 -18.897 9.567 523 H GLY 76 H GLY 76 -15.875 -13.975 13.868 524 HA2 GLY 76 1HA GLY 76 -14.537 -15.961 15.583 525 HA3 GLY 76 2HA GLY 76 -13.664 -15.238 14.240 526 H MET 77 H MET 77 -14.777 -12.607 14.525 527 HA MET 77 HA MET 77 -12.937 -11.499 16.330 528 HB2 MET 77 1HB MET 77 -14.020 -9.373 15.883 529 HB3 MET 77 2HB MET 77 -13.870 -10.289 14.390 530 HG2 MET 77 1HG MET 77 -16.245 -11.024 14.718 531 HG3 MET 77 2HG MET 77 -16.341 -9.867 16.044 532 HE1 MET 77 3HE MET 77 -15.052 -7.544 15.579 533 HE2 MET 77 1HE MET 77 -14.178 -7.597 14.048 534 HE3 MET 77 2HE MET 77 -15.561 -6.520 14.236 535 H LYS 78 H LYS 78 -13.569 -9.983 18.137 536 HA LYS 78 HA LYS 78 -15.827 -11.044 19.695 537 HB2 LYS 78 1HB LYS 78 -13.192 -10.298 20.950 538 HB3 LYS 78 2HB LYS 78 -14.534 -11.169 21.680 539 HG2 LYS 78 1HG LYS 78 -14.012 -12.898 19.764 540 HG3 LYS 78 2HG LYS 78 -12.421 -12.138 19.833 541 HD2 LYS 78 1HD LYS 78 -12.476 -12.545 22.328 542 HD3 LYS 78 2HD LYS 78 -13.902 -13.547 22.045 543 HE2 LYS 78 1HE LYS 78 -12.691 -15.122 20.813 544 HE3 LYS 78 2HE LYS 78 -11.349 -14.011 20.541 545 HZ1 LYS 78 3HZ LYS 78 -11.752 -15.842 22.672 546 HZ2 LYS 78 1HZ LYS 78 -11.552 -14.273 23.273 547 HZ3 LYS 78 2HZ LYS 78 -10.369 -14.953 22.274 548 H VAL 79 H VAL 79 -16.551 -9.589 21.423 549 HA VAL 79 HA VAL 79 -17.108 -7.031 20.541 550 HB VAL 79 HB VAL 79 -16.940 -7.857 23.441 551 HG11 VAL 79 1HG1 VAL 79 -18.992 -6.202 23.397 552 HG12 VAL 79 2HG1 VAL 79 -17.338 -5.606 23.545 553 HG13 VAL 79 3HG1 VAL 79 -18.154 -5.566 21.982 554 HG21 VAL 79 3HG2 VAL 79 -18.530 -9.348 22.989 555 HG22 VAL 79 1HG2 VAL 79 -19.589 -8.000 22.576 556 HG23 VAL 79 2HG2 VAL 79 -18.649 -8.800 21.317 557 H GLY 80 H GLY 80 -15.948 -5.233 20.353 558 HA2 GLY 80 1HA GLY 80 -14.451 -3.557 20.961 559 HA3 GLY 80 2HA GLY 80 -13.915 -4.559 22.302 560 H GLY 81 H GLY 81 -13.871 -6.500 19.648 561 HA2 GLY 81 1HA GLY 81 -10.978 -6.212 19.409 562 HA3 GLY 81 2HA GLY 81 -11.946 -7.546 18.799 563 H VAL 82 H VAL 82 -9.975 -5.265 17.766 564 HA VAL 82 HA VAL 82 -11.464 -4.872 15.254 565 HB VAL 82 HB VAL 82 -9.536 -2.886 16.465 566 HG11 VAL 82 1HG1 VAL 82 -10.656 -3.212 13.830 567 HG12 VAL 82 2HG1 VAL 82 -11.146 -1.671 14.536 568 HG13 VAL 82 3HG1 VAL 82 -9.434 -2.073 14.398 569 HG21 VAL 82 3HG2 VAL 82 -11.870 -1.572 16.422 570 HG22 VAL 82 1HG2 VAL 82 -12.466 -3.209 16.699 571 HG23 VAL 82 2HG2 VAL 82 -11.310 -2.490 17.820 572 H ARG 83 H ARG 83 -10.511 -5.904 13.639 573 HA ARG 83 HA ARG 83 -7.617 -5.787 13.347 574 HB2 ARG 83 1HB ARG 83 -8.999 -8.456 13.150 575 HB3 ARG 83 2HB ARG 83 -7.272 -8.123 13.190 576 HG2 ARG 83 1HG ARG 83 -7.613 -7.275 15.541 577 HG3 ARG 83 2HG ARG 83 -9.240 -7.952 15.451 578 HD2 ARG 83 1HD ARG 83 -8.268 -10.159 14.955 579 HD3 ARG 83 2HD ARG 83 -6.654 -9.466 15.112 580 HE ARG 83 HE ARG 83 -6.865 -9.634 17.375 581 HH11 ARG 83 1HH1 ARG 83 -10.042 -9.715 15.955 582 HH12 ARG 83 2HH1 ARG 83 -10.848 -10.035 17.455 583 HH21 ARG 83 1HH2 ARG 83 -7.914 -10.055 19.357 584 HH22 ARG 83 2HH2 ARG 83 -9.636 -10.228 19.390 585 H ARG 84 H ARG 84 -6.893 -6.142 11.220 586 HA ARG 84 HA ARG 84 -8.948 -5.685 9.211 587 HB2 ARG 84 1HB ARG 84 -7.069 -4.206 9.095 588 HB3 ARG 84 2HB ARG 84 -5.935 -5.550 9.128 589 HG2 ARG 84 1HG ARG 84 -6.883 -6.284 6.928 590 HG3 ARG 84 2HG ARG 84 -7.788 -4.769 6.893 591 HD2 ARG 84 1HD ARG 84 -5.998 -3.627 6.222 592 HD3 ARG 84 2HD ARG 84 -5.002 -4.314 7.505 593 HE ARG 84 HE ARG 84 -5.096 -5.139 4.763 594 HH11 ARG 84 1HH1 ARG 84 -4.453 -6.182 8.021 595 HH12 ARG 84 2HH1 ARG 84 -3.402 -7.473 7.539 596 HH21 ARG 84 1HH2 ARG 84 -3.714 -6.834 4.116 597 HH22 ARG 84 2HH2 ARG 84 -2.982 -7.842 5.318 598 H LEU 85 H LEU 85 -9.888 -7.447 8.403 599 HA LEU 85 HA LEU 85 -8.292 -9.872 8.003 600 HB2 LEU 85 1HB LEU 85 -11.244 -9.346 8.136 601 HB3 LEU 85 2HB LEU 85 -10.599 -10.863 7.513 602 HG LEU 85 HG LEU 85 -9.611 -10.063 10.172 603 HD11 LEU 85 1HD1 LEU 85 -11.972 -11.314 10.823 604 HD12 LEU 85 2HD1 LEU 85 -12.456 -10.159 9.581 605 HD13 LEU 85 3HD1 LEU 85 -11.615 -9.598 11.026 606 HD21 LEU 85 3HD2 LEU 85 -9.785 -12.406 10.597 607 HD22 LEU 85 1HD2 LEU 85 -9.091 -12.202 8.988 608 HD23 LEU 85 2HD2 LEU 85 -10.789 -12.648 9.166 609 H THR 86 H THR 86 -7.599 -10.413 6.048 610 HA THR 86 HA THR 86 -8.476 -8.887 3.740 611 HB THR 86 HB THR 86 -6.493 -11.139 3.610 612 HG1 THR 86 HG1 THR 86 -6.214 -8.645 4.871 613 HG21 THR 86 3HG2 THR 86 -7.465 -9.264 1.783 614 HG22 THR 86 1HG2 THR 86 -6.070 -10.322 1.577 615 HG23 THR 86 2HG2 THR 86 -5.854 -8.692 2.215 616 H ILE 87 H ILE 87 -10.268 -9.522 2.733 617 HA ILE 87 HA ILE 87 -10.934 -12.371 2.622 618 HB ILE 87 HB ILE 87 -12.579 -9.941 1.911 619 HG12 ILE 87 1HG1 ILE 87 -13.253 -11.879 4.084 620 HG13 ILE 87 2HG1 ILE 87 -12.001 -10.679 4.383 621 HG21 ILE 87 1HG2 ILE 87 -13.606 -11.430 0.555 622 HG22 ILE 87 2HG2 ILE 87 -12.992 -12.825 1.441 623 HG23 ILE 87 3HG2 ILE 87 -14.376 -11.926 2.062 624 HD11 ILE 87 3HD1 ILE 87 -14.555 -10.252 4.938 625 HD12 ILE 87 1HD1 ILE 87 -13.470 -8.960 4.425 626 HD13 ILE 87 2HD1 ILE 87 -14.558 -9.713 3.259 627 HA PRO 88 HA PRO 88 -9.199 -12.242 -1.530 628 HB2 PRO 88 1HB PRO 88 -9.276 -14.932 -1.886 629 HB3 PRO 88 2HB PRO 88 -8.007 -14.122 -0.960 630 HG2 PRO 88 1HG PRO 88 -10.457 -15.537 0.019 631 HG3 PRO 88 2HG PRO 88 -8.800 -15.603 0.648 632 HD2 PRO 88 1HD PRO 88 -10.733 -14.090 1.791 633 HD3 PRO 88 2HD PRO 88 -9.022 -13.615 1.795 634 HA PRO 89 HA PRO 89 -12.683 -12.658 -4.179 635 HB2 PRO 89 1HB PRO 89 -11.663 -13.874 -6.381 636 HB3 PRO 89 2HB PRO 89 -11.300 -12.198 -5.955 637 HG2 PRO 89 1HG PRO 89 -9.668 -14.664 -5.493 638 HG3 PRO 89 2HG PRO 89 -9.145 -13.065 -6.054 639 HD2 PRO 89 1HD PRO 89 -8.834 -13.884 -3.492 640 HD3 PRO 89 2HD PRO 89 -9.122 -12.187 -3.923 641 H GLN 90 H GLN 90 -10.804 -15.632 -3.793 642 HA GLN 90 HA GLN 90 -12.790 -17.401 -4.749 643 HB2 GLN 90 1HB GLN 90 -11.470 -19.137 -3.486 644 HB3 GLN 90 2HB GLN 90 -10.548 -18.193 -4.648 645 HG2 GLN 90 1HG GLN 90 -9.294 -17.197 -3.057 646 HG3 GLN 90 2HG GLN 90 -10.604 -17.178 -1.878 647 HE21 GLN 90 2HE2 GLN 90 -7.763 -18.026 -1.701 648 HE22 GLN 90 1HE2 GLN 90 -7.813 -19.638 -1.084 649 H LEU 91 H LEU 91 -12.651 -15.543 -1.950 650 HA LEU 91 HA LEU 91 -14.730 -17.208 -0.695 651 HB2 LEU 91 1HB LEU 91 -12.348 -15.880 0.518 652 HB3 LEU 91 2HB LEU 91 -13.817 -16.064 1.474 653 HG LEU 91 HG LEU 91 -13.611 -18.576 0.802 654 HD11 LEU 91 1HD1 LEU 91 -10.813 -17.556 0.358 655 HD12 LEU 91 2HD1 LEU 91 -11.842 -18.407 -0.793 656 HD13 LEU 91 3HD1 LEU 91 -11.219 -19.251 0.624 657 HD21 LEU 91 3HD2 LEU 91 -11.784 -18.720 2.722 658 HD22 LEU 91 1HD2 LEU 91 -13.452 -18.249 3.049 659 HD23 LEU 91 2HD2 LEU 91 -12.202 -17.015 2.897 660 H GLY 92 H GLY 92 -14.394 -14.570 -2.399 661 HA2 GLY 92 1HA GLY 92 -16.573 -13.203 -1.008 662 HA3 GLY 92 2HA GLY 92 -15.115 -12.274 -1.322 663 H TYR 93 H TYR 93 -14.826 -11.369 -3.285 664 HA TYR 93 HA TYR 93 -17.012 -11.130 -5.037 665 HB2 TYR 93 1HB TYR 93 -14.156 -10.282 -5.080 666 HB3 TYR 93 2HB TYR 93 -15.043 -10.248 -6.599 667 HD1 TYR 93 HD2 TYR 93 -16.664 -9.611 -3.364 668 HD2 TYR 93 HD1 TYR 93 -14.942 -7.851 -6.834 669 HE1 TYR 93 HE2 TYR 93 -17.640 -7.441 -2.741 670 HE2 TYR 93 HE1 TYR 93 -15.911 -5.676 -6.219 671 HH TYR 93 HH TYR 93 -18.325 -5.308 -3.974 672 H GLY 94 H GLY 94 -13.822 -12.566 -5.767 673 HA2 GLY 94 1HA GLY 94 -13.614 -14.788 -6.679 674 HA3 GLY 94 2HA GLY 94 -15.215 -14.602 -7.379 675 H ALA 95 H ALA 95 -14.140 -15.348 -9.351 676 HA ALA 95 HA ALA 95 -12.270 -13.537 -10.617 677 HB1 ALA 95 1HB ALA 95 -11.678 -15.351 -11.746 678 HB2 ALA 95 2HB ALA 95 -12.921 -16.263 -10.888 679 HB3 ALA 95 3HB ALA 95 -13.298 -15.493 -12.429 680 H ARG 96 H ARG 96 -15.444 -13.302 -10.098 681 HA ARG 96 HA ARG 96 -16.516 -12.750 -12.663 682 HB2 ARG 96 1HB ARG 96 -17.464 -11.634 -10.022 683 HB3 ARG 96 2HB ARG 96 -18.404 -11.822 -11.496 684 HG2 ARG 96 1HG ARG 96 -17.287 -14.057 -9.816 685 HG3 ARG 96 2HG ARG 96 -18.971 -13.531 -9.866 686 HD2 ARG 96 1HD ARG 96 -17.363 -14.802 -12.071 687 HD3 ARG 96 2HD ARG 96 -18.782 -15.456 -11.255 688 HE ARG 96 HE ARG 96 -19.667 -13.133 -12.364 689 HH11 ARG 96 1HH1 ARG 96 -18.057 -15.967 -13.588 690 HH12 ARG 96 2HH1 ARG 96 -18.773 -15.855 -15.161 691 HH21 ARG 96 1HH2 ARG 96 -20.617 -12.974 -14.432 692 HH22 ARG 96 2HH2 ARG 96 -20.229 -14.151 -15.640 693 H GLY 97 H GLY 97 -14.719 -10.861 -10.344 694 HA2 GLY 97 1HA GLY 97 -13.640 -8.839 -10.635 695 HA3 GLY 97 2HA GLY 97 -14.217 -8.820 -12.295 696 H ALA 98 H ALA 98 -14.134 -6.497 -10.853 697 HA ALA 98 HA ALA 98 -16.832 -5.616 -11.041 698 HB1 ALA 98 1HB ALA 98 -15.870 -6.475 -8.435 699 HB2 ALA 98 2HB ALA 98 -16.443 -4.806 -8.437 700 HB3 ALA 98 3HB ALA 98 -17.509 -6.105 -8.973 701 H GLY 99 H GLY 99 -15.616 -4.255 -12.507 702 HA2 GLY 99 1HA GLY 99 -15.319 -1.779 -12.407 703 HA3 GLY 99 2HA GLY 99 -14.182 -2.084 -11.102 704 H GLY 100 H GLY 100 -12.699 -0.825 -12.449 705 HA2 GLY 100 1HA GLY 100 -11.704 -2.249 -14.814 706 HA3 GLY 100 2HA GLY 100 -11.324 -0.590 -14.376 707 H VAL 101 H VAL 101 -10.496 -0.862 -11.772 708 HA VAL 101 HA VAL 101 -7.938 -2.212 -12.162 709 HB VAL 101 HB VAL 101 -7.196 -1.000 -10.164 710 HG11 VAL 101 1HG1 VAL 101 -6.637 0.492 -11.720 711 HG12 VAL 101 2HG1 VAL 101 -8.135 0.228 -12.614 712 HG13 VAL 101 3HG1 VAL 101 -8.097 1.375 -11.275 713 HG21 VAL 101 3HG2 VAL 101 -9.462 0.787 -9.935 714 HG22 VAL 101 1HG2 VAL 101 -9.902 -0.878 -9.557 715 HG23 VAL 101 2HG2 VAL 101 -8.589 -0.092 -8.680 716 H ILE 102 H ILE 102 -10.097 -3.945 -11.793 717 HA ILE 102 HA ILE 102 -9.284 -5.237 -9.301 718 HB ILE 102 HB ILE 102 -12.174 -4.783 -10.054 719 HG12 ILE 102 1HG1 ILE 102 -10.552 -3.806 -7.693 720 HG13 ILE 102 2HG1 ILE 102 -11.105 -2.817 -9.040 721 HG21 ILE 102 1HG2 ILE 102 -11.887 -5.860 -7.452 722 HG22 ILE 102 2HG2 ILE 102 -12.672 -6.581 -8.857 723 HG23 ILE 102 3HG2 ILE 102 -10.958 -6.872 -8.558 724 HD11 ILE 102 3HD1 ILE 102 -12.416 -3.301 -6.627 725 HD12 ILE 102 1HD1 ILE 102 -13.045 -2.463 -8.045 726 HD13 ILE 102 2HD1 ILE 102 -13.319 -4.195 -7.850 727 HA PRO 103 HA PRO 103 -9.299 -8.247 -12.750 728 HB2 PRO 103 1HB PRO 103 -7.224 -9.693 -11.762 729 HB3 PRO 103 2HB PRO 103 -7.001 -8.233 -12.733 730 HG2 PRO 103 1HG PRO 103 -6.890 -8.567 -9.760 731 HG3 PRO 103 2HG PRO 103 -5.819 -7.634 -10.822 732 HD2 PRO 103 1HD PRO 103 -7.794 -6.483 -9.370 733 HD3 PRO 103 2HD PRO 103 -7.286 -5.861 -10.953 734 HA PRO 104 HA PRO 104 -11.463 -11.557 -10.828 735 HB2 PRO 104 1HB PRO 104 -10.579 -13.727 -12.200 736 HB3 PRO 104 2HB PRO 104 -11.659 -12.519 -12.906 737 HG2 PRO 104 1HG PRO 104 -8.694 -12.808 -13.197 738 HG3 PRO 104 2HG PRO 104 -9.910 -12.440 -14.435 739 HD2 PRO 104 1HD PRO 104 -8.360 -10.531 -13.302 740 HD3 PRO 104 2HD PRO 104 -10.021 -10.215 -13.843 741 H ASN 105 H ASN 105 -8.087 -11.357 -10.603 742 HA ASN 105 HA ASN 105 -8.026 -13.519 -8.602 743 HB2 ASN 105 1HB ASN 105 -5.818 -14.018 -9.166 744 HB3 ASN 105 2HB ASN 105 -6.541 -13.658 -10.731 745 HD21 ASN 105 2HD2 ASN 105 -3.935 -13.118 -8.819 746 HD22 ASN 105 1HD2 ASN 105 -3.359 -11.648 -9.520 747 H ALA 106 H ALA 106 -8.559 -10.450 -8.584 748 HA ALA 106 HA ALA 106 -6.468 -9.463 -6.855 749 HB1 ALA 106 1HB ALA 106 -7.233 -7.476 -7.481 750 HB2 ALA 106 2HB ALA 106 -8.434 -8.300 -8.476 751 HB3 ALA 106 3HB ALA 106 -8.830 -7.831 -6.823 752 H THR 107 H THR 107 -6.767 -8.790 -4.678 753 HA THR 107 HA THR 107 -8.846 -10.327 -3.267 754 HB THR 107 HB THR 107 -6.136 -9.429 -2.268 755 HG1 THR 107 HG1 THR 107 -5.530 -11.313 -2.993 756 HG21 THR 107 3HG2 THR 107 -6.993 -11.197 -0.431 757 HG22 THR 107 1HG2 THR 107 -8.535 -10.478 -0.893 758 HG23 THR 107 2HG2 THR 107 -7.234 -9.456 -0.283 759 H LEU 108 H LEU 108 -9.984 -9.371 -1.573 760 HA LEU 108 HA LEU 108 -9.809 -6.431 -1.471 761 HB2 LEU 108 1HB LEU 108 -12.226 -8.172 -1.010 762 HB3 LEU 108 2HB LEU 108 -12.188 -6.411 -0.955 763 HG LEU 108 HG LEU 108 -11.592 -8.018 -3.434 764 HD11 LEU 108 1HD1 LEU 108 -13.994 -6.783 -3.854 765 HD12 LEU 108 2HD1 LEU 108 -14.134 -7.316 -2.179 766 HD13 LEU 108 3HD1 LEU 108 -13.777 -8.486 -3.450 767 HD21 LEU 108 3HD2 LEU 108 -12.059 -5.842 -4.536 768 HD22 LEU 108 1HD2 LEU 108 -10.635 -5.816 -3.495 769 HD23 LEU 108 2HD2 LEU 108 -12.147 -5.096 -2.940 770 H VAL 109 H VAL 109 -9.327 -5.542 0.426 771 HA VAL 109 HA VAL 109 -9.286 -7.256 2.802 772 HB VAL 109 HB VAL 109 -8.117 -4.491 2.648 773 HG11 VAL 109 1HG1 VAL 109 -6.592 -6.361 4.153 774 HG12 VAL 109 2HG1 VAL 109 -7.473 -4.942 4.724 775 HG13 VAL 109 3HG1 VAL 109 -8.282 -6.507 4.633 776 HG21 VAL 109 3HG2 VAL 109 -6.970 -7.061 1.601 777 HG22 VAL 109 1HG2 VAL 109 -7.076 -5.491 0.804 778 HG23 VAL 109 2HG2 VAL 109 -5.939 -5.732 2.130 779 H PHE 110 H PHE 110 -10.287 -6.691 4.720 780 HA PHE 110 HA PHE 110 -11.898 -4.265 4.810 781 HB2 PHE 110 1HB PHE 110 -12.997 -7.045 4.727 782 HB3 PHE 110 2HB PHE 110 -13.814 -5.836 5.713 783 HD1 PHE 110 HD2 PHE 110 -12.759 -6.677 2.279 784 HD2 PHE 110 HD1 PHE 110 -15.157 -4.161 4.736 785 HE1 PHE 110 HE2 PHE 110 -13.923 -5.841 0.280 786 HE2 PHE 110 HE1 PHE 110 -16.326 -3.321 2.740 787 HZ PHE 110 HZ PHE 110 -15.709 -4.160 0.509 788 H GLU 111 H GLU 111 -11.964 -3.400 6.798 789 HA GLU 111 HA GLU 111 -10.691 -4.896 8.963 790 HB2 GLU 111 1HB GLU 111 -10.024 -2.511 8.253 791 HB3 GLU 111 2HB GLU 111 -11.496 -1.999 9.067 792 HG2 GLU 111 1HG GLU 111 -9.778 -3.764 10.652 793 HG3 GLU 111 2HG GLU 111 -9.061 -2.208 10.239 794 H VAL 112 H VAL 112 -11.907 -5.908 10.402 795 HA VAL 112 HA VAL 112 -14.676 -5.014 10.810 796 HB VAL 112 HB VAL 112 -13.916 -7.545 12.062 797 HG11 VAL 112 1HG1 VAL 112 -16.223 -6.694 11.814 798 HG12 VAL 112 2HG1 VAL 112 -16.066 -6.854 10.063 799 HG13 VAL 112 3HG1 VAL 112 -15.998 -8.286 11.091 800 HG21 VAL 112 3HG2 VAL 112 -13.647 -7.201 9.084 801 HG22 VAL 112 1HG2 VAL 112 -12.467 -7.863 10.216 802 HG23 VAL 112 2HG2 VAL 112 -13.938 -8.763 9.849 803 H GLU 113 H GLU 113 -15.306 -4.173 12.696 804 HA GLU 113 HA GLU 113 -13.622 -4.584 15.066 805 HB2 GLU 113 1HB GLU 113 -13.941 -2.193 15.669 806 HB3 GLU 113 2HB GLU 113 -12.982 -2.422 14.214 807 HG2 GLU 113 1HG GLU 113 -15.124 -2.038 12.915 808 HG3 GLU 113 2HG GLU 113 -15.823 -1.487 14.437 809 H LEU 114 H LEU 114 -14.861 -5.586 16.500 810 HA LEU 114 HA LEU 114 -17.710 -5.475 16.446 811 HB2 LEU 114 1HB LEU 114 -16.014 -7.302 17.336 812 HB3 LEU 114 2HB LEU 114 -16.250 -6.434 18.852 813 HG LEU 114 HG LEU 114 -17.817 -8.102 19.033 814 HD11 LEU 114 1HD1 LEU 114 -18.883 -5.884 19.242 815 HD12 LEU 114 2HD1 LEU 114 -20.002 -7.139 18.712 816 HD13 LEU 114 3HD1 LEU 114 -19.360 -5.981 17.547 817 HD21 LEU 114 3HD2 LEU 114 -17.793 -8.009 16.093 818 HD22 LEU 114 1HD2 LEU 114 -19.339 -8.437 16.826 819 HD23 LEU 114 2HD2 LEU 114 -17.899 -9.388 17.188 820 H LEU 115 H LEU 115 -19.018 -4.047 17.372 821 HA LEU 115 HA LEU 115 -17.889 -2.052 19.173 822 HB2 LEU 115 1HB LEU 115 -20.526 -2.247 17.736 823 HB3 LEU 115 2HB LEU 115 -20.136 -0.961 18.876 824 HG LEU 115 HG LEU 115 -18.043 -0.763 17.172 825 HD11 LEU 115 1HD1 LEU 115 -18.498 -2.147 15.443 826 HD12 LEU 115 2HD1 LEU 115 -19.465 -0.772 14.909 827 HD13 LEU 115 3HD1 LEU 115 -20.238 -2.125 15.736 828 HD21 LEU 115 3HD2 LEU 115 -18.926 1.267 16.664 829 HD22 LEU 115 1HD2 LEU 115 -19.996 0.845 18.001 830 HD23 LEU 115 2HD2 LEU 115 -20.532 0.613 16.337 831 H ASP 116 H ASP 116 -20.701 -4.234 19.065 832 HA ASP 116 HA ASP 116 -20.441 -4.919 21.817 833 HB2 ASP 116 1HB ASP 116 -21.442 -2.631 21.989 834 HB3 ASP 116 2HB ASP 116 -22.844 -3.228 21.104 835 H VAL 117 H VAL 117 -22.219 -6.366 22.539 836 HA VAL 117 HA VAL 117 -23.303 -7.846 20.236 837 HB VAL 117 HB VAL 117 -23.472 -9.767 21.882 838 HG11 VAL 117 1HG1 VAL 117 -20.993 -8.606 20.755 839 HG12 VAL 117 2HG1 VAL 117 -20.808 -9.941 21.895 840 HG13 VAL 117 3HG1 VAL 117 -21.770 -10.155 20.432 841 HG21 VAL 117 3HG2 VAL 117 -21.592 -8.062 23.510 842 HG22 VAL 117 1HG2 VAL 117 -23.286 -8.345 23.910 843 HG23 VAL 117 2HG2 VAL 117 -22.148 -9.692 23.888 844 H13 JZF 130 1H3 JZF 130 -21.033 -3.286 -0.077 845 H23 JZF 130 2H3 JZF 130 -20.959 -4.595 -1.243 846 H4 JZF 130 H4 JZF 130 -18.875 -3.878 0.851 847 H15 JZF 130 1H5 JZF 130 -17.485 -5.674 -0.025 848 H25 JZF 130 2H5 JZF 130 -18.699 -6.111 -1.217 849 H17 JZF 130 1H7 JZF 130 -18.101 -2.363 -0.557 850 H27 JZF 130 2H7 JZF 130 -17.520 -3.699 -1.497 851 H8 JZF 130 H8 JZF 130 -19.866 -3.527 -2.638 852 H9 JZF 130 H9 JZF 130 -17.378 -2.981 -3.565 853 H1OH JZF 130 1HO JZF 130 -19.498 -0.947 -1.560 854 H11 JZF 130 H11 JZF 130 -17.256 -3.472 -6.105 855 H112 JZF 130 1H12 JZF 130 -18.797 -0.899 -6.715 856 H212 JZF 130 2H12 JZF 130 -17.226 -1.332 -7.369 857 H13A JZF 130 H13 JZF 130 -17.168 0.332 -5.472 858 H114 JZF 130 1H14 JZF 130 -17.547 -0.466 -3.170 859 H214 JZF 130 2H14 JZF 130 -18.997 -0.435 -4.140 860 H115 JZF 130 1H15 JZF 130 -21.975 -6.775 2.676 861 H215 JZF 130 2H15 JZF 130 -20.438 -7.616 2.885 862 H116 JZF 130 1H16 JZF 130 -21.852 -7.882 -0.919 863 H216 JZF 130 2H16 JZF 130 -20.089 -8.103 -1.124 864 H117 JZF 130 2H17 JZF 130 -21.594 -10.672 -1.087 865 H217 JZF 130 3H17 JZF 130 -22.074 -9.615 -2.429 866 H317 JZF 130 1H17 JZF 130 -20.380 -10.102 -2.246 867 H118 JZF 130 1H18 JZF 130 -20.009 -3.532 -7.273 868 H218 JZF 130 2H18 JZF 130 -18.739 -2.922 -8.342 869 H318 JZF 130 3H18 JZF 130 -18.602 -4.542 -7.638 870 H119 JZF 130 3H19 JZF 130 -15.568 -2.223 -5.430 871 H219 JZF 130 1H19 JZF 130 -15.057 -0.547 -5.654 872 H319 JZF 130 2H19 JZF 130 -15.437 -1.143 -4.038 Start of MODEL 19 1 H1 GLY 1 H GLY 1 -0.093 -7.936 26.917 2 HA2 GLY 1 1HA GLY 1 2.545 -8.861 26.101 3 HA3 GLY 1 2HA GLY 1 1.118 -9.859 26.343 4 HA PRO 2 HA PRO 2 0.637 -7.873 21.956 5 HB2 PRO 2 1HB PRO 2 2.794 -6.539 20.987 6 HB3 PRO 2 2HB PRO 2 1.513 -5.749 21.914 7 HG2 PRO 2 1HG PRO 2 4.202 -6.699 22.826 8 HG3 PRO 2 2HG PRO 2 3.359 -5.188 23.213 9 HD2 PRO 2 1HD PRO 2 3.419 -7.297 24.910 10 HD3 PRO 2 2HD PRO 2 2.037 -6.187 24.814 11 H GLY 3 H GLY 3 1.857 -8.214 19.749 12 HA2 GLY 3 1HA GLY 3 3.817 -10.390 19.980 13 HA3 GLY 3 2HA GLY 3 2.327 -10.688 19.096 14 H SER 4 H SER 4 3.736 -11.153 17.280 15 HA SER 4 HA SER 4 5.391 -9.134 16.147 16 HB2 SER 4 1HB SER 4 6.004 -11.286 15.489 17 HB3 SER 4 2HB SER 4 4.337 -11.780 15.200 18 HG SER 4 HG SER 4 5.701 -11.334 13.293 19 H MET 5 H MET 5 4.946 -7.573 14.699 20 HA MET 5 HA MET 5 2.141 -7.163 13.995 21 HB2 MET 5 1HB MET 5 4.531 -5.328 13.741 22 HB3 MET 5 2HB MET 5 2.875 -4.891 13.340 23 HG2 MET 5 1HG MET 5 2.439 -5.654 15.825 24 HG3 MET 5 2HG MET 5 4.152 -5.274 15.991 25 HE1 MET 5 3HE MET 5 4.469 -1.697 16.202 26 HE2 MET 5 1HE MET 5 4.074 -2.781 17.536 27 HE3 MET 5 2HE MET 5 5.135 -3.331 16.239 28 H THR 6 H THR 6 2.295 -8.981 12.442 29 HA THR 6 HA THR 6 3.050 -7.953 9.812 30 HB THR 6 HB THR 6 4.956 -9.347 10.595 31 HG1 THR 6 HG1 THR 6 5.182 -10.059 8.595 32 HG21 THR 6 3HG2 THR 6 4.637 -11.309 11.600 33 HG22 THR 6 1HG2 THR 6 3.759 -11.919 10.198 34 HG23 THR 6 2HG2 THR 6 2.896 -11.061 11.474 35 H VAL 7 H VAL 7 2.104 -9.237 8.036 36 HA VAL 7 HA VAL 7 -0.628 -9.877 8.620 37 HB VAL 7 HB VAL 7 0.828 -10.291 6.009 38 HG11 VAL 7 1HG1 VAL 7 -1.239 -11.394 5.902 39 HG12 VAL 7 2HG1 VAL 7 -2.067 -10.112 6.788 40 HG13 VAL 7 3HG1 VAL 7 -1.524 -9.833 5.133 41 HG21 VAL 7 3HG2 VAL 7 1.199 -8.030 6.454 42 HG22 VAL 7 1HG2 VAL 7 -0.269 -8.027 5.475 43 HG23 VAL 7 2HG2 VAL 7 -0.374 -7.826 7.224 44 H VAL 8 H VAL 8 -1.633 -11.836 8.643 45 HA VAL 8 HA VAL 8 0.052 -14.223 8.265 46 HB VAL 8 HB VAL 8 -2.020 -13.840 10.431 47 HG11 VAL 8 1HG1 VAL 8 -1.974 -16.128 9.612 48 HG12 VAL 8 2HG1 VAL 8 -0.223 -16.185 9.820 49 HG13 VAL 8 3HG1 VAL 8 -1.275 -16.038 11.229 50 HG21 VAL 8 3HG2 VAL 8 0.989 -13.903 10.503 51 HG22 VAL 8 1HG2 VAL 8 -0.085 -12.611 11.039 52 HG23 VAL 8 2HG2 VAL 8 -0.016 -14.129 11.934 53 H THR 9 H THR 9 -0.753 -15.657 6.883 54 HA THR 9 HA THR 9 -3.539 -15.350 6.015 55 HB THR 9 HB THR 9 -1.359 -16.949 4.667 56 HG1 THR 9 HG1 THR 9 -0.680 -14.874 4.478 57 HG21 THR 9 3HG2 THR 9 -3.061 -16.272 2.714 58 HG22 THR 9 1HG2 THR 9 -4.191 -16.320 4.066 59 HG23 THR 9 2HG2 THR 9 -3.237 -17.748 3.663 60 H THR 10 H THR 10 -4.910 -17.158 5.787 61 HA THR 10 HA THR 10 -4.272 -19.334 7.645 62 HB THR 10 HB THR 10 -6.686 -19.830 7.620 63 HG1 THR 10 HG1 THR 10 -7.971 -18.908 6.201 64 HG21 THR 10 3HG2 THR 10 -7.140 -18.259 9.181 65 HG22 THR 10 1HG2 THR 10 -6.716 -16.923 8.113 66 HG23 THR 10 2HG2 THR 10 -5.448 -17.824 8.944 67 H GLU 11 H GLU 11 -5.418 -21.477 7.011 68 HA GLU 11 HA GLU 11 -4.169 -22.449 4.677 69 HB2 GLU 11 1HB GLU 11 -5.381 -24.537 5.128 70 HB3 GLU 11 2HB GLU 11 -4.633 -23.894 6.583 71 HG2 GLU 11 1HG GLU 11 -7.445 -23.137 6.045 72 HG3 GLU 11 2HG GLU 11 -7.122 -24.798 6.539 73 H SER 12 H SER 12 -7.239 -20.988 5.233 74 HA SER 12 HA SER 12 -8.474 -22.021 2.841 75 HB2 SER 12 1HB SER 12 -9.507 -19.611 4.289 76 HB3 SER 12 2HB SER 12 -10.402 -20.922 3.521 77 HG SER 12 HG SER 12 -10.247 -20.834 5.942 78 H GLY 13 H GLY 13 -6.693 -19.169 3.798 79 HA2 GLY 13 1HA GLY 13 -5.487 -18.213 1.778 80 HA3 GLY 13 2HA GLY 13 -7.099 -18.043 1.100 81 H LEU 14 H LEU 14 -8.392 -17.213 3.511 82 HA LEU 14 HA LEU 14 -7.997 -14.440 3.352 83 HB2 LEU 14 1HB LEU 14 -10.110 -15.161 4.051 84 HB3 LEU 14 2HB LEU 14 -9.436 -16.211 5.296 85 HG LEU 14 HG LEU 14 -9.000 -13.289 5.589 86 HD11 LEU 14 1HD1 LEU 14 -11.381 -13.547 4.876 87 HD12 LEU 14 2HD1 LEU 14 -11.167 -12.883 6.495 88 HD13 LEU 14 3HD1 LEU 14 -11.634 -14.571 6.289 89 HD21 LEU 14 3HD2 LEU 14 -8.420 -15.444 7.113 90 HD22 LEU 14 1HD2 LEU 14 -9.984 -14.983 7.786 91 HD23 LEU 14 2HD2 LEU 14 -8.661 -13.817 7.752 92 H LYS 15 H LYS 15 -7.094 -12.958 4.803 93 HA LYS 15 HA LYS 15 -5.121 -14.108 6.667 94 HB2 LYS 15 1HB LYS 15 -4.855 -11.425 5.320 95 HB3 LYS 15 2HB LYS 15 -3.613 -12.348 6.157 96 HG2 LYS 15 1HG LYS 15 -3.683 -14.036 4.380 97 HG3 LYS 15 2HG LYS 15 -4.902 -13.078 3.534 98 HD2 LYS 15 1HD LYS 15 -3.209 -11.177 3.580 99 HD3 LYS 15 2HD LYS 15 -2.022 -12.389 4.066 100 HE2 LYS 15 1HE LYS 15 -2.917 -13.685 1.987 101 HE3 LYS 15 2HE LYS 15 -3.493 -12.098 1.480 102 HZ1 LYS 15 3HZ LYS 15 -1.167 -12.866 0.752 103 HZ2 LYS 15 1HZ LYS 15 -0.694 -12.466 2.326 104 HZ3 LYS 15 2HZ LYS 15 -1.353 -11.281 1.315 105 H TYR 16 H TYR 16 -4.475 -12.546 8.428 106 HA TYR 16 HA TYR 16 -6.546 -10.657 9.204 107 HB2 TYR 16 1HB TYR 16 -7.072 -11.677 11.282 108 HB3 TYR 16 2HB TYR 16 -7.192 -12.954 10.077 109 HD1 TYR 16 HD2 TYR 16 -5.153 -14.500 9.800 110 HD2 TYR 16 HD1 TYR 16 -5.719 -11.957 13.164 111 HE1 TYR 16 HE2 TYR 16 -3.582 -15.877 11.098 112 HE2 TYR 16 HE1 TYR 16 -4.149 -13.326 14.471 113 HH TYR 16 HH TYR 16 -3.380 -16.102 14.101 114 H GLU 17 H GLU 17 -5.858 -9.109 10.676 115 HA GLU 17 HA GLU 17 -3.188 -9.318 11.810 116 HB2 GLU 17 1HB GLU 17 -2.629 -8.360 9.699 117 HB3 GLU 17 2HB GLU 17 -3.974 -7.232 9.781 118 HG2 GLU 17 1HG GLU 17 -1.685 -6.279 10.216 119 HG3 GLU 17 2HG GLU 17 -2.920 -5.926 11.423 120 H ASP 18 H ASP 18 -3.366 -8.712 13.853 121 HA ASP 18 HA ASP 18 -5.607 -7.470 14.965 122 HB2 ASP 18 1HB ASP 18 -4.417 -7.431 17.011 123 HB3 ASP 18 2HB ASP 18 -3.814 -8.845 16.150 124 H LEU 19 H LEU 19 -6.095 -5.390 15.531 125 HA LEU 19 HA LEU 19 -4.216 -3.297 14.662 126 HB2 LEU 19 1HB LEU 19 -7.122 -3.630 14.088 127 HB3 LEU 19 2HB LEU 19 -6.464 -2.003 14.249 128 HG LEU 19 HG LEU 19 -5.563 -4.078 12.251 129 HD11 LEU 19 1HD1 LEU 19 -6.903 -1.497 11.574 130 HD12 LEU 19 2HD1 LEU 19 -7.871 -2.899 12.031 131 HD13 LEU 19 3HD1 LEU 19 -6.793 -2.988 10.637 132 HD21 LEU 19 3HD2 LEU 19 -4.423 -1.547 13.163 133 HD22 LEU 19 1HD2 LEU 19 -4.647 -1.639 11.416 134 HD23 LEU 19 2HD2 LEU 19 -3.685 -2.862 12.247 135 H THR 20 H THR 20 -6.827 -4.227 16.831 136 HA THR 20 HA THR 20 -5.754 -2.471 18.875 137 HB THR 20 HB THR 20 -8.697 -2.218 18.374 138 HG1 THR 20 HG1 THR 20 -6.717 -0.533 17.206 139 HG21 THR 20 3HG2 THR 20 -8.219 -1.209 20.376 140 HG22 THR 20 1HG2 THR 20 -7.954 0.152 19.286 141 HG23 THR 20 2HG2 THR 20 -6.580 -0.774 19.891 142 H GLU 21 H GLU 21 -5.674 -3.628 20.676 143 HA GLU 21 HA GLU 21 -6.716 -6.157 21.032 144 HB2 GLU 21 1HB GLU 21 -5.745 -4.052 22.920 145 HB3 GLU 21 2HB GLU 21 -6.505 -5.496 23.574 146 HG2 GLU 21 1HG GLU 21 -4.852 -6.904 22.661 147 HG3 GLU 21 2HG GLU 21 -4.216 -5.617 21.637 148 H GLY 22 H GLY 22 -8.406 -6.956 22.434 149 HA2 GLY 22 1HA GLY 22 -10.529 -5.114 23.174 150 HA3 GLY 22 2HA GLY 22 -10.929 -6.250 21.894 151 H SER 23 H SER 23 -11.328 -5.749 25.054 152 HA SER 23 HA SER 23 -11.101 -8.590 25.783 153 HB2 SER 23 1HB SER 23 -9.907 -6.877 27.207 154 HB3 SER 23 2HB SER 23 -11.493 -6.258 27.667 155 HG SER 23 HG SER 23 -10.737 -7.776 29.181 156 H GLY 24 H GLY 24 -13.078 -8.971 24.529 157 HA2 GLY 24 1HA GLY 24 -15.461 -8.356 26.158 158 HA3 GLY 24 2HA GLY 24 -15.501 -8.204 24.407 159 H ALA 25 H ALA 25 -16.291 -9.880 23.333 160 HA ALA 25 HA ALA 25 -15.721 -12.590 24.130 161 HB1 ALA 25 1HB ALA 25 -18.629 -12.162 23.910 162 HB2 ALA 25 2HB ALA 25 -17.714 -13.252 24.953 163 HB3 ALA 25 3HB ALA 25 -17.866 -11.548 25.378 164 H GLU 26 H GLU 26 -15.962 -14.039 22.465 165 HA GLU 26 HA GLU 26 -16.086 -12.979 19.836 166 HB2 GLU 26 1HB GLU 26 -14.716 -14.925 20.348 167 HB3 GLU 26 2HB GLU 26 -16.145 -15.841 20.805 168 HG2 GLU 26 1HG GLU 26 -16.847 -16.096 18.627 169 HG3 GLU 26 2HG GLU 26 -15.943 -14.693 18.061 170 H ALA 27 H ALA 27 -17.696 -12.953 18.353 171 HA ALA 27 HA ALA 27 -20.368 -12.985 19.184 172 HB1 ALA 27 1HB ALA 27 -20.944 -12.715 16.857 173 HB2 ALA 27 2HB ALA 27 -19.522 -11.740 17.227 174 HB3 ALA 27 3HB ALA 27 -19.344 -13.267 16.363 175 H ARG 28 H ARG 28 -22.099 -14.397 18.611 176 HA ARG 28 HA ARG 28 -21.247 -17.174 18.113 177 HB2 ARG 28 1HB ARG 28 -23.026 -16.018 20.178 178 HB3 ARG 28 2HB ARG 28 -23.574 -17.516 19.438 179 HG2 ARG 28 1HG ARG 28 -21.680 -18.698 20.178 180 HG3 ARG 28 2HG ARG 28 -20.821 -17.213 20.593 181 HD2 ARG 28 1HD ARG 28 -22.610 -16.781 22.304 182 HD3 ARG 28 2HD ARG 28 -23.217 -18.403 21.976 183 HE ARG 28 HE ARG 28 -20.950 -17.712 23.558 184 HH11 ARG 28 1HH1 ARG 28 -22.239 -20.148 21.431 185 HH12 ARG 28 2HH1 ARG 28 -21.303 -21.432 22.121 186 HH21 ARG 28 1HH2 ARG 28 -19.713 -19.394 24.476 187 HH22 ARG 28 2HH2 ARG 28 -19.867 -21.002 23.854 188 H ALA 29 H ALA 29 -22.384 -18.358 16.648 189 HA ALA 29 HA ALA 29 -23.882 -17.005 14.680 190 HB1 ALA 29 1HB ALA 29 -23.169 -19.837 15.223 191 HB2 ALA 29 2HB ALA 29 -24.480 -19.514 14.087 192 HB3 ALA 29 3HB ALA 29 -22.874 -18.847 13.793 193 H GLY 30 H GLY 30 -25.886 -16.260 14.876 194 HA2 GLY 30 1HA GLY 30 -28.246 -16.980 14.982 195 HA3 GLY 30 2HA GLY 30 -27.816 -17.864 16.439 196 H GLN 31 H GLN 31 -26.042 -15.469 17.149 197 HA GLN 31 HA GLN 31 -28.201 -13.921 18.392 198 HB2 GLN 31 1HB GLN 31 -26.553 -13.217 20.032 199 HB3 GLN 31 2HB GLN 31 -26.561 -14.971 19.903 200 HG2 GLN 31 1HG GLN 31 -24.455 -15.058 19.134 201 HG3 GLN 31 2HG GLN 31 -24.636 -13.599 18.162 202 HE21 GLN 31 2HE2 GLN 31 -25.190 -14.003 21.618 203 HE22 GLN 31 1HE2 GLN 31 -23.960 -12.902 22.128 204 H THR 32 H THR 32 -28.220 -11.668 18.347 205 HA THR 32 HA THR 32 -27.152 -10.504 15.954 206 HB THR 32 HB THR 32 -28.415 -8.902 18.158 207 HG1 THR 32 HG1 THR 32 -30.439 -9.506 16.949 208 HG21 THR 32 3HG2 THR 32 -29.079 -7.451 16.454 209 HG22 THR 32 1HG2 THR 32 -28.886 -8.678 15.203 210 HG23 THR 32 2HG2 THR 32 -27.464 -7.952 15.954 211 H VAL 33 H VAL 33 -25.584 -8.939 15.739 212 HA VAL 33 HA VAL 33 -24.196 -7.947 18.092 213 HB VAL 33 HB VAL 33 -21.996 -8.676 17.378 214 HG11 VAL 33 1HG1 VAL 33 -23.466 -10.128 18.838 215 HG12 VAL 33 2HG1 VAL 33 -23.768 -11.106 17.400 216 HG13 VAL 33 3HG1 VAL 33 -22.128 -10.944 18.029 217 HG21 VAL 33 3HG2 VAL 33 -21.685 -10.232 15.531 218 HG22 VAL 33 1HG2 VAL 33 -23.413 -10.181 15.181 219 HG23 VAL 33 2HG2 VAL 33 -22.425 -8.736 14.962 220 H SER 34 H SER 34 -22.829 -6.156 17.661 221 HA SER 34 HA SER 34 -23.359 -4.890 15.055 222 HB2 SER 34 1HB SER 34 -22.496 -2.895 16.810 223 HB3 SER 34 2HB SER 34 -24.154 -3.191 16.288 224 HG SER 34 HG SER 34 -24.590 -4.147 18.149 225 H VAL 35 H VAL 35 -21.674 -4.797 13.741 226 HA VAL 35 HA VAL 35 -19.004 -4.333 14.879 227 HB VAL 35 HB VAL 35 -17.965 -5.952 13.501 228 HG11 VAL 35 1HG1 VAL 35 -18.712 -7.920 14.455 229 HG12 VAL 35 2HG1 VAL 35 -19.391 -6.707 15.542 230 HG13 VAL 35 3HG1 VAL 35 -20.410 -7.465 14.318 231 HG21 VAL 35 3HG2 VAL 35 -20.505 -5.828 11.998 232 HG22 VAL 35 1HG2 VAL 35 -18.849 -6.012 11.420 233 HG23 VAL 35 2HG2 VAL 35 -19.715 -7.404 12.071 234 H HIS 36 H HIS 36 -17.502 -3.323 13.445 235 HA HIS 36 HA HIS 36 -18.826 -1.804 11.300 236 HB2 HIS 36 1HB HIS 36 -17.099 -1.014 13.461 237 HB3 HIS 36 2HB HIS 36 -16.346 -0.607 11.922 238 HD1 HIS 36 HD1 HIS 36 -18.293 0.602 10.219 239 HD2 HIS 36 HD2 HIS 36 -18.622 1.023 14.340 240 HE1 HIS 36 HE1 HIS 36 -19.746 2.624 10.575 241 H TYR 37 H TYR 37 -18.111 -1.962 9.261 242 HA TYR 37 HA TYR 37 -15.649 -3.514 8.797 243 HB2 TYR 37 1HB TYR 37 -16.643 -4.326 6.733 244 HB3 TYR 37 2HB TYR 37 -17.716 -4.675 8.084 245 HD1 TYR 37 HD1 TYR 37 -19.779 -3.320 8.399 246 HD2 TYR 37 HD2 TYR 37 -17.328 -2.911 4.945 247 HE1 TYR 37 HE1 TYR 37 -21.625 -2.190 7.230 248 HE2 TYR 37 HE2 TYR 37 -19.167 -1.780 3.767 249 HH TYR 37 HH TYR 37 -21.740 -1.759 3.961 250 H THR 38 H THR 38 -14.066 -2.580 7.672 251 HA THR 38 HA THR 38 -14.664 -0.047 6.287 252 HB THR 38 HB THR 38 -11.891 -0.702 7.188 253 HG1 THR 38 HG1 THR 38 -12.349 0.109 9.240 254 HG21 THR 38 3HG2 THR 38 -12.384 1.291 5.798 255 HG22 THR 38 1HG2 THR 38 -11.710 1.705 7.374 256 HG23 THR 38 2HG2 THR 38 -13.439 1.889 7.078 257 H GLY 39 H GLY 39 -14.801 -0.489 4.169 258 HA2 GLY 39 1HA GLY 39 -13.535 -2.620 2.849 259 HA3 GLY 39 2HA GLY 39 -14.221 -1.204 2.068 260 H TRP 40 H TRP 40 -11.384 -2.868 2.834 261 HA TRP 40 HA TRP 40 -9.751 -0.544 2.048 262 HB2 TRP 40 1HB TRP 40 -9.111 -2.864 3.866 263 HB3 TRP 40 2HB TRP 40 -7.859 -1.830 3.182 264 HD1 TRP 40 HD1 TRP 40 -10.346 0.613 3.692 265 HE1 TRP 40 HE1 TRP 40 -10.206 1.737 6.003 266 HE3 TRP 40 HE3 TRP 40 -7.393 -2.808 6.081 267 HZ2 TRP 40 HZ2 TRP 40 -9.003 1.240 8.508 268 HZ3 TRP 40 HZ3 TRP 40 -6.792 -2.409 8.434 269 HH2 TRP 40 HH2 TRP 40 -7.581 -0.426 9.620 270 H LEU 41 H LEU 41 -7.981 -0.917 0.631 271 HA LEU 41 HA LEU 41 -8.431 -3.195 -1.157 272 HB2 LEU 41 1HB LEU 41 -7.223 -0.486 -1.489 273 HB3 LEU 41 2HB LEU 41 -6.772 -1.779 -2.597 274 HG LEU 41 HG LEU 41 -9.428 -1.973 -2.797 275 HD11 LEU 41 1HD1 LEU 41 -9.619 -0.048 -1.137 276 HD12 LEU 41 2HD1 LEU 41 -10.556 0.071 -2.625 277 HD13 LEU 41 3HD1 LEU 41 -9.058 0.985 -2.451 278 HD21 LEU 41 3HD2 LEU 41 -8.286 0.252 -4.369 279 HD22 LEU 41 1HD2 LEU 41 -9.126 -1.204 -4.902 280 HD23 LEU 41 2HD2 LEU 41 -7.426 -1.286 -4.441 281 H THR 42 H THR 42 -6.533 -4.244 -2.121 282 HA THR 42 HA THR 42 -4.796 -5.279 -0.204 283 HB THR 42 HB THR 42 -3.392 -5.891 -2.355 284 HG1 THR 42 HG1 THR 42 -4.286 -4.712 -3.938 285 HG21 THR 42 3HG2 THR 42 -4.425 -7.696 -1.392 286 HG22 THR 42 1HG2 THR 42 -5.356 -7.587 -2.884 287 HG23 THR 42 2HG2 THR 42 -6.011 -6.926 -1.386 288 H ASP 43 H ASP 43 -4.564 -2.410 -2.126 289 HA ASP 43 HA ASP 43 -1.730 -2.068 -1.804 290 HB2 ASP 43 1HB ASP 43 -3.246 -1.109 -3.667 291 HB3 ASP 43 2HB ASP 43 -3.654 0.139 -2.493 292 H GLY 44 H GLY 44 -4.512 -1.430 0.092 293 HA2 GLY 44 1HA GLY 44 -4.142 -0.971 2.454 294 HA3 GLY 44 2HA GLY 44 -2.838 0.106 1.976 295 H GLN 45 H GLN 45 -4.820 0.924 -0.291 296 HA GLN 45 HA GLN 45 -5.838 3.210 1.130 297 HB2 GLN 45 1HB GLN 45 -6.631 3.953 -1.074 298 HB3 GLN 45 2HB GLN 45 -4.939 3.478 -1.120 299 HG2 GLN 45 1HG GLN 45 -6.038 1.155 -1.825 300 HG3 GLN 45 2HG GLN 45 -7.293 2.246 -2.408 301 HE21 GLN 45 2HE2 GLN 45 -5.296 0.513 -3.792 302 HE22 GLN 45 1HE2 GLN 45 -4.492 1.566 -4.901 303 H LYS 46 H LYS 46 -7.869 3.588 1.799 304 HA LYS 46 HA LYS 46 -9.746 1.396 1.771 305 HB2 LYS 46 1HB LYS 46 -10.820 2.469 3.486 306 HB3 LYS 46 2HB LYS 46 -9.222 3.182 3.655 307 HG2 LYS 46 1HG LYS 46 -10.256 4.967 1.989 308 HG3 LYS 46 2HG LYS 46 -11.757 4.397 2.722 309 HD2 LYS 46 1HD LYS 46 -10.835 4.874 4.949 310 HD3 LYS 46 2HD LYS 46 -9.351 5.469 4.199 311 HE2 LYS 46 1HE LYS 46 -12.050 6.620 3.548 312 HE3 LYS 46 2HE LYS 46 -11.087 7.202 4.905 313 HZ1 LYS 46 3HZ LYS 46 -10.795 8.482 2.816 314 HZ2 LYS 46 1HZ LYS 46 -10.102 7.110 2.108 315 HZ3 LYS 46 2HZ LYS 46 -9.353 7.849 3.433 316 H PHE 47 H PHE 47 -11.976 1.622 1.098 317 HA PHE 47 HA PHE 47 -12.508 3.714 -0.873 318 HB2 PHE 47 1HB PHE 47 -13.162 2.173 -2.593 319 HB3 PHE 47 2HB PHE 47 -11.543 1.726 -2.066 320 HD1 PHE 47 HD1 PHE 47 -11.410 -0.124 -0.246 321 HD2 PHE 47 HD2 PHE 47 -14.804 0.560 -2.722 322 HE1 PHE 47 HE1 PHE 47 -12.183 -2.420 0.185 323 HE2 PHE 47 HE2 PHE 47 -15.583 -1.734 -2.295 324 HZ PHE 47 HZ PHE 47 -14.272 -3.227 -0.839 325 H ASP 48 H ASP 48 -13.454 2.564 1.853 326 HA ASP 48 HA ASP 48 -16.109 3.406 1.693 327 HB2 ASP 48 1HB ASP 48 -15.828 0.859 0.602 328 HB3 ASP 48 2HB ASP 48 -16.431 0.567 2.232 329 H SER 49 H SER 49 -16.628 4.011 3.687 330 HA SER 49 HA SER 49 -15.981 2.373 5.978 331 HB2 SER 49 1HB SER 49 -13.910 3.482 5.975 332 HB3 SER 49 2HB SER 49 -14.626 5.010 5.460 333 HG SER 49 HG SER 49 -14.004 4.745 7.773 334 H SER 50 H SER 50 -18.057 2.284 6.643 335 HA SER 50 HA SER 50 -19.860 4.473 6.552 336 HB2 SER 50 1HB SER 50 -19.926 1.803 7.953 337 HB3 SER 50 2HB SER 50 -21.230 2.978 8.123 338 HG SER 50 HG SER 50 -21.913 1.957 6.390 339 H LYS 51 H LYS 51 -17.380 3.599 8.720 340 HA LYS 51 HA LYS 51 -18.320 4.547 11.163 341 HB2 LYS 51 1HB LYS 51 -15.528 4.571 10.009 342 HB3 LYS 51 2HB LYS 51 -15.895 4.964 11.683 343 HG2 LYS 51 1HG LYS 51 -16.706 2.750 12.093 344 HG3 LYS 51 2HG LYS 51 -16.573 2.336 10.382 345 HD2 LYS 51 1HD LYS 51 -14.699 1.395 11.570 346 HD3 LYS 51 2HD LYS 51 -14.125 2.702 10.531 347 HE2 LYS 51 1HE LYS 51 -14.146 4.217 12.476 348 HE3 LYS 51 2HE LYS 51 -14.648 2.871 13.498 349 HZ1 LYS 51 3HZ LYS 51 -12.604 1.806 13.215 350 HZ2 LYS 51 1HZ LYS 51 -12.191 3.431 13.442 351 HZ3 LYS 51 2HZ LYS 51 -12.170 2.762 11.889 352 H ASP 52 H ASP 52 -17.186 6.266 8.351 353 HA ASP 52 HA ASP 52 -16.667 8.765 9.524 354 HB2 ASP 52 1HB ASP 52 -16.206 7.893 7.108 355 HB3 ASP 52 2HB ASP 52 -17.817 8.518 6.763 356 H ARG 53 H ARG 53 -19.613 7.120 8.894 357 HA ARG 53 HA ARG 53 -21.122 9.571 9.531 358 HB2 ARG 53 1HB ARG 53 -23.052 8.331 8.369 359 HB3 ARG 53 2HB ARG 53 -21.796 9.029 7.356 360 HG2 ARG 53 1HG ARG 53 -20.765 6.865 7.072 361 HG3 ARG 53 2HG ARG 53 -21.927 6.138 8.183 362 HD2 ARG 53 1HD ARG 53 -22.635 5.648 5.955 363 HD3 ARG 53 2HD ARG 53 -23.744 6.843 6.626 364 HE ARG 53 HE ARG 53 -21.582 7.993 5.124 365 HH11 ARG 53 1HH1 ARG 53 -24.773 6.613 4.947 366 HH12 ARG 53 2HH1 ARG 53 -25.180 7.418 3.467 367 HH21 ARG 53 1HH2 ARG 53 -22.106 9.057 3.176 368 HH22 ARG 53 2HH2 ARG 53 -23.662 8.807 2.460 369 H ASN 54 H ASN 54 -19.931 7.249 11.155 370 HA ASN 54 HA ASN 54 -20.488 5.950 12.943 371 HB2 ASN 54 1HB ASN 54 -21.387 8.420 13.444 372 HB3 ASN 54 2HB ASN 54 -22.928 7.568 13.472 373 HD21 ASN 54 2HD2 ASN 54 -19.629 7.308 14.742 374 HD22 ASN 54 1HD2 ASN 54 -20.091 6.711 16.296 375 H ASP 55 H ASP 55 -21.401 4.894 10.564 376 HA ASP 55 HA ASP 55 -24.064 3.839 11.249 377 HB2 ASP 55 1HB ASP 55 -22.694 4.353 8.639 378 HB3 ASP 55 2HB ASP 55 -23.893 3.066 8.736 379 HA PRO 56 HA PRO 56 -21.158 0.347 12.035 380 HB2 PRO 56 1HB PRO 56 -22.539 -0.601 14.171 381 HB3 PRO 56 2HB PRO 56 -21.333 0.685 14.301 382 HG2 PRO 56 1HG PRO 56 -24.317 0.891 14.172 383 HG3 PRO 56 2HG PRO 56 -23.179 1.766 15.214 384 HD2 PRO 56 1HD PRO 56 -24.251 2.864 12.983 385 HD3 PRO 56 2HD PRO 56 -22.620 3.267 13.556 386 H PHE 57 H PHE 57 -21.426 -1.799 11.506 387 HA PHE 57 HA PHE 57 -23.960 -2.474 10.231 388 HB2 PHE 57 1HB PHE 57 -21.656 -2.796 9.144 389 HB3 PHE 57 2HB PHE 57 -21.469 -4.168 10.232 390 HD1 PHE 57 HD2 PHE 57 -23.522 -2.797 7.485 391 HD2 PHE 57 HD1 PHE 57 -22.503 -6.233 9.782 392 HE1 PHE 57 HE2 PHE 57 -24.745 -4.219 5.894 393 HE2 PHE 57 HE1 PHE 57 -23.724 -7.661 8.193 394 HZ PHE 57 HZ PHE 57 -24.849 -6.654 6.247 395 H ALA 58 H ALA 58 -25.419 -3.204 11.664 396 HA ALA 58 HA ALA 58 -24.570 -5.324 13.528 397 HB1 ALA 58 1HB ALA 58 -27.018 -3.623 13.891 398 HB2 ALA 58 2HB ALA 58 -26.174 -4.610 15.085 399 HB3 ALA 58 3HB ALA 58 -25.433 -3.126 14.486 400 H PHE 59 H PHE 59 -25.548 -7.263 13.431 401 HA PHE 59 HA PHE 59 -28.156 -7.677 12.381 402 HB2 PHE 59 1HB PHE 59 -27.624 -8.878 10.359 403 HB3 PHE 59 2HB PHE 59 -26.876 -7.287 10.270 404 HD1 PHE 59 HD1 PHE 59 -24.394 -7.190 11.140 405 HD2 PHE 59 HD2 PHE 59 -26.368 -10.719 9.811 406 HE1 PHE 59 HE1 PHE 59 -22.213 -8.239 10.699 407 HE2 PHE 59 HE2 PHE 59 -24.190 -11.775 9.369 408 HZ PHE 59 HZ PHE 59 -22.109 -10.535 9.813 409 H VAL 60 H VAL 60 -28.359 -10.208 11.863 410 HA VAL 60 HA VAL 60 -27.510 -11.507 14.305 411 HB VAL 60 HB VAL 60 -29.203 -12.543 12.027 412 HG11 VAL 60 1HG1 VAL 60 -29.836 -14.035 14.221 413 HG12 VAL 60 2HG1 VAL 60 -28.735 -14.539 12.937 414 HG13 VAL 60 3HG1 VAL 60 -28.096 -13.822 14.417 415 HG21 VAL 60 3HG2 VAL 60 -30.657 -11.066 12.918 416 HG22 VAL 60 1HG2 VAL 60 -30.864 -12.316 14.145 417 HG23 VAL 60 2HG2 VAL 60 -29.777 -10.959 14.443 418 H LEU 61 H LEU 61 -25.699 -12.636 14.480 419 HA LEU 61 HA LEU 61 -23.939 -13.149 12.368 420 HB2 LEU 61 1HB LEU 61 -23.243 -13.023 14.704 421 HB3 LEU 61 2HB LEU 61 -24.128 -14.506 15.054 422 HG LEU 61 HG LEU 61 -22.590 -15.802 13.741 423 HD11 LEU 61 1HD1 LEU 61 -21.965 -13.236 12.579 424 HD12 LEU 61 2HD1 LEU 61 -21.632 -14.858 11.974 425 HD13 LEU 61 3HD1 LEU 61 -20.504 -14.084 13.087 426 HD21 LEU 61 3HD2 LEU 61 -21.967 -14.572 16.106 427 HD22 LEU 61 1HD2 LEU 61 -20.564 -14.200 15.104 428 HD23 LEU 61 2HD2 LEU 61 -21.046 -15.877 15.358 429 H GLY 62 H GLY 62 -23.673 -14.808 10.981 430 HA2 GLY 62 1HA GLY 62 -23.890 -16.964 10.119 431 HA3 GLY 62 2HA GLY 62 -24.950 -17.368 11.461 432 H GLY 63 H GLY 63 -25.693 -14.476 9.775 433 HA2 GLY 63 1HA GLY 63 -27.210 -15.427 7.632 434 HA3 GLY 63 2HA GLY 63 -28.264 -15.386 9.038 435 H GLY 64 H GLY 64 -26.388 -13.473 6.790 436 HA2 GLY 64 1HA GLY 64 -28.151 -11.222 7.232 437 HA3 GLY 64 2HA GLY 64 -26.487 -10.941 7.724 438 H MET 65 H MET 65 -27.076 -13.057 5.058 439 HA MET 65 HA MET 65 -26.445 -12.936 2.873 440 HB2 MET 65 1HB MET 65 -27.815 -10.298 3.316 441 HB3 MET 65 2HB MET 65 -27.146 -10.716 1.745 442 HG2 MET 65 1HG MET 65 -28.544 -12.788 1.797 443 HG3 MET 65 2HG MET 65 -29.312 -12.154 3.251 444 HE1 MET 65 3HE MET 65 -32.307 -10.784 1.669 445 HE2 MET 65 1HE MET 65 -31.765 -12.462 1.613 446 HE3 MET 65 2HE MET 65 -31.477 -11.491 3.057 447 H VAL 66 H VAL 66 -24.239 -12.794 4.198 448 HA VAL 66 HA VAL 66 -22.745 -10.536 3.034 449 HB VAL 66 HB VAL 66 -21.271 -10.481 4.929 450 HG11 VAL 66 1HG1 VAL 66 -23.427 -9.236 5.046 451 HG12 VAL 66 2HG1 VAL 66 -24.093 -10.575 5.983 452 HG13 VAL 66 3HG1 VAL 66 -22.742 -9.637 6.620 453 HG21 VAL 66 3HG2 VAL 66 -22.798 -12.908 5.816 454 HG22 VAL 66 1HG2 VAL 66 -21.058 -12.707 5.615 455 HG23 VAL 66 2HG2 VAL 66 -21.887 -11.921 6.958 456 H ILE 67 H ILE 67 -20.675 -10.974 2.248 457 HA ILE 67 HA ILE 67 -20.275 -13.397 0.969 458 HB ILE 67 HB ILE 67 -17.827 -12.672 0.850 459 HG12 ILE 67 1HG1 ILE 67 -18.874 -10.075 1.958 460 HG13 ILE 67 2HG1 ILE 67 -18.110 -11.274 2.996 461 HG21 ILE 67 1HG2 ILE 67 -18.574 -11.866 -1.077 462 HG22 ILE 67 2HG2 ILE 67 -20.183 -11.646 -0.391 463 HG23 ILE 67 3HG2 ILE 67 -18.987 -10.356 -0.265 464 HD11 ILE 67 3HD1 ILE 67 -16.083 -10.647 2.358 465 HD12 ILE 67 1HD1 ILE 67 -16.517 -10.719 0.651 466 HD13 ILE 67 2HD1 ILE 67 -16.853 -9.261 1.586 467 H LYS 68 H LYS 68 -18.721 -15.080 1.303 468 HA LYS 68 HA LYS 68 -18.827 -16.376 3.705 469 HB2 LYS 68 1HB LYS 68 -16.473 -16.502 1.815 470 HB3 LYS 68 2HB LYS 68 -16.977 -17.744 2.952 471 HG2 LYS 68 1HG LYS 68 -19.201 -17.701 1.613 472 HG3 LYS 68 2HG LYS 68 -18.219 -16.934 0.362 473 HD2 LYS 68 1HD LYS 68 -16.602 -18.963 0.918 474 HD3 LYS 68 2HD LYS 68 -18.118 -19.705 1.435 475 HE2 LYS 68 1HE LYS 68 -17.480 -18.565 -1.282 476 HE3 LYS 68 2HE LYS 68 -17.712 -20.263 -0.871 477 HZ1 LYS 68 3HZ LYS 68 -20.022 -19.612 -0.179 478 HZ2 LYS 68 1HZ LYS 68 -19.710 -19.526 -1.840 479 HZ3 LYS 68 2HZ LYS 68 -19.748 -18.112 -0.913 480 H GLY 69 H GLY 69 -16.137 -14.321 2.581 481 HA2 GLY 69 1HA GLY 69 -14.493 -14.511 4.798 482 HA3 GLY 69 2HA GLY 69 -14.593 -13.096 3.760 483 H TRP 70 H TRP 70 -17.288 -12.404 4.313 484 HA TRP 70 HA TRP 70 -16.923 -10.848 6.642 485 HB2 TRP 70 1HB TRP 70 -19.127 -11.324 4.711 486 HB3 TRP 70 2HB TRP 70 -19.581 -10.679 6.286 487 HD1 TRP 70 HD1 TRP 70 -16.424 -9.728 4.261 488 HE1 TRP 70 HE1 TRP 70 -16.502 -7.196 3.807 489 HE3 TRP 70 HE3 TRP 70 -21.027 -8.692 6.231 490 HZ2 TRP 70 HZ2 TRP 70 -18.279 -5.044 4.229 491 HZ3 TRP 70 HZ3 TRP 70 -21.841 -6.371 6.166 492 HH2 TRP 70 HH2 TRP 70 -20.494 -4.586 5.186 493 H ASP 71 H ASP 71 -19.070 -13.621 6.008 494 HA ASP 71 HA ASP 71 -20.108 -13.833 8.601 495 HB2 ASP 71 1HB ASP 71 -21.216 -14.996 6.839 496 HB3 ASP 71 2HB ASP 71 -19.753 -15.876 6.408 497 H GLU 72 H GLU 72 -17.322 -15.442 7.096 498 HA GLU 72 HA GLU 72 -16.624 -17.043 9.295 499 HB2 GLU 72 1HB GLU 72 -15.518 -16.383 6.726 500 HB3 GLU 72 2HB GLU 72 -14.247 -16.346 7.939 501 HG2 GLU 72 1HG GLU 72 -16.139 -18.657 7.638 502 HG3 GLU 72 2HG GLU 72 -14.614 -18.543 6.761 503 H GLY 73 H GLY 73 -15.989 -13.691 8.549 504 HA2 GLY 73 1HA GLY 73 -13.972 -13.388 10.594 505 HA3 GLY 73 2HA GLY 73 -14.686 -12.104 9.631 506 H VAL 74 H VAL 74 -17.296 -12.168 10.177 507 HA VAL 74 HA VAL 74 -17.481 -10.960 12.707 508 HB VAL 74 HB VAL 74 -19.045 -10.418 10.921 509 HG11 VAL 74 1HG1 VAL 74 -19.376 -13.275 10.838 510 HG12 VAL 74 2HG1 VAL 74 -20.939 -12.473 11.009 511 HG13 VAL 74 3HG1 VAL 74 -19.874 -12.055 9.666 512 HG21 VAL 74 3HG2 VAL 74 -20.521 -11.657 13.240 513 HG22 VAL 74 1HG2 VAL 74 -19.689 -10.104 13.301 514 HG23 VAL 74 2HG2 VAL 74 -21.065 -10.325 12.221 515 H GLN 75 H GLN 75 -17.703 -14.255 11.725 516 HA GLN 75 HA GLN 75 -19.056 -15.090 14.159 517 HB2 GLN 75 1HB GLN 75 -19.203 -17.232 13.204 518 HB3 GLN 75 2HB GLN 75 -19.424 -16.130 11.851 519 HG2 GLN 75 1HG GLN 75 -17.064 -16.436 11.241 520 HG3 GLN 75 2HG GLN 75 -16.888 -17.585 12.566 521 HE21 GLN 75 2HE2 GLN 75 -19.464 -17.113 10.182 522 HE22 GLN 75 1HE2 GLN 75 -19.404 -18.717 9.543 523 H GLY 76 H GLY 76 -16.257 -13.878 14.004 524 HA2 GLY 76 1HA GLY 76 -15.024 -15.877 15.766 525 HA3 GLY 76 2HA GLY 76 -14.090 -15.261 14.411 526 H MET 77 H MET 77 -15.036 -12.567 14.542 527 HA MET 77 HA MET 77 -13.170 -11.434 16.258 528 HB2 MET 77 1HB MET 77 -15.714 -10.171 15.221 529 HB3 MET 77 2HB MET 77 -14.322 -9.305 15.857 530 HG2 MET 77 1HG MET 77 -13.925 -11.166 13.573 531 HG3 MET 77 2HG MET 77 -14.685 -9.604 13.279 532 HE1 MET 77 3HE MET 77 -10.868 -11.186 14.024 533 HE2 MET 77 1HE MET 77 -12.036 -11.396 12.719 534 HE3 MET 77 2HE MET 77 -10.691 -10.272 12.526 535 H LYS 78 H LYS 78 -13.492 -10.098 18.161 536 HA LYS 78 HA LYS 78 -15.737 -11.021 19.833 537 HB2 LYS 78 1HB LYS 78 -12.990 -10.317 20.863 538 HB3 LYS 78 2HB LYS 78 -14.304 -11.082 21.746 539 HG2 LYS 78 1HG LYS 78 -14.067 -12.965 19.987 540 HG3 LYS 78 2HG LYS 78 -12.481 -12.250 19.688 541 HD2 LYS 78 1HD LYS 78 -12.215 -12.384 22.266 542 HD3 LYS 78 2HD LYS 78 -13.535 -13.552 22.171 543 HE2 LYS 78 1HE LYS 78 -12.197 -14.829 20.505 544 HE3 LYS 78 2HE LYS 78 -10.862 -13.711 20.784 545 HZ1 LYS 78 3HZ LYS 78 -11.867 -15.857 22.467 546 HZ2 LYS 78 1HZ LYS 78 -11.401 -14.445 23.274 547 HZ3 LYS 78 2HZ LYS 78 -10.293 -15.263 22.292 548 H VAL 79 H VAL 79 -16.623 -9.536 21.299 549 HA VAL 79 HA VAL 79 -16.966 -6.942 20.452 550 HB VAL 79 HB VAL 79 -17.127 -7.895 23.315 551 HG11 VAL 79 1HG1 VAL 79 -18.398 -5.538 21.926 552 HG12 VAL 79 2HG1 VAL 79 -18.760 -6.065 23.571 553 HG13 VAL 79 3HG1 VAL 79 -17.146 -5.478 23.167 554 HG21 VAL 79 3HG2 VAL 79 -19.584 -8.120 22.734 555 HG22 VAL 79 1HG2 VAL 79 -19.096 -7.997 21.044 556 HG23 VAL 79 2HG2 VAL 79 -18.505 -9.329 22.038 557 H GLY 80 H GLY 80 -15.793 -5.134 20.503 558 HA2 GLY 80 1HA GLY 80 -14.302 -3.546 21.332 559 HA3 GLY 80 2HA GLY 80 -13.853 -4.670 22.606 560 H GLY 81 H GLY 81 -13.714 -6.392 19.815 561 HA2 GLY 81 1HA GLY 81 -10.806 -6.046 19.682 562 HA3 GLY 81 2HA GLY 81 -11.711 -7.421 19.068 563 H VAL 82 H VAL 82 -9.798 -5.122 18.024 564 HA VAL 82 HA VAL 82 -11.301 -4.735 15.518 565 HB VAL 82 HB VAL 82 -9.263 -2.773 16.551 566 HG11 VAL 82 1HG1 VAL 82 -10.832 -1.333 14.983 567 HG12 VAL 82 2HG1 VAL 82 -9.501 -2.292 14.332 568 HG13 VAL 82 3HG1 VAL 82 -11.152 -2.910 14.262 569 HG21 VAL 82 3HG2 VAL 82 -12.125 -3.072 17.252 570 HG22 VAL 82 1HG2 VAL 82 -10.789 -2.410 18.193 571 HG23 VAL 82 2HG2 VAL 82 -11.543 -1.440 16.928 572 H ARG 83 H ARG 83 -10.340 -5.508 13.757 573 HA ARG 83 HA ARG 83 -7.507 -5.453 13.378 574 HB2 ARG 83 1HB ARG 83 -7.221 -7.911 13.166 575 HB3 ARG 83 2HB ARG 83 -7.562 -7.394 14.811 576 HG2 ARG 83 1HG ARG 83 -10.012 -7.947 14.246 577 HG3 ARG 83 2HG ARG 83 -9.331 -8.852 12.892 578 HD2 ARG 83 1HD ARG 83 -8.834 -10.546 14.238 579 HD3 ARG 83 2HD ARG 83 -7.868 -9.481 15.259 580 HE ARG 83 HE ARG 83 -10.417 -8.982 16.043 581 HH11 ARG 83 1HH1 ARG 83 -8.512 -11.877 15.711 582 HH12 ARG 83 2HH1 ARG 83 -9.327 -12.716 16.989 583 HH21 ARG 83 1HH2 ARG 83 -11.498 -10.077 17.727 584 HH22 ARG 83 2HH2 ARG 83 -11.026 -11.692 18.134 585 H ARG 84 H ARG 84 -6.893 -5.952 11.245 586 HA ARG 84 HA ARG 84 -9.111 -5.846 9.352 587 HB2 ARG 84 1HB ARG 84 -7.354 -5.300 7.689 588 HB3 ARG 84 2HB ARG 84 -7.380 -4.187 9.050 589 HG2 ARG 84 1HG ARG 84 -5.478 -5.357 10.045 590 HG3 ARG 84 2HG ARG 84 -5.451 -6.468 8.674 591 HD2 ARG 84 1HD ARG 84 -5.370 -4.113 7.373 592 HD3 ARG 84 2HD ARG 84 -4.554 -3.663 8.869 593 HE ARG 84 HE ARG 84 -2.750 -4.898 8.205 594 HH11 ARG 84 1HH1 ARG 84 -5.525 -5.859 6.335 595 HH12 ARG 84 2HH1 ARG 84 -4.618 -6.886 5.275 596 HH21 ARG 84 1HH2 ARG 84 -1.545 -6.248 6.816 597 HH22 ARG 84 2HH2 ARG 84 -2.355 -7.108 5.550 598 H LEU 85 H LEU 85 -9.628 -7.447 7.973 599 HA LEU 85 HA LEU 85 -7.895 -9.830 7.935 600 HB2 LEU 85 1HB LEU 85 -10.901 -9.799 7.738 601 HB3 LEU 85 2HB LEU 85 -9.860 -11.220 7.788 602 HG LEU 85 HG LEU 85 -9.531 -9.500 10.116 603 HD11 LEU 85 1HD1 LEU 85 -12.094 -10.944 10.235 604 HD12 LEU 85 2HD1 LEU 85 -12.089 -9.463 9.277 605 HD13 LEU 85 3HD1 LEU 85 -11.611 -9.417 10.973 606 HD21 LEU 85 3HD2 LEU 85 -8.913 -12.012 9.553 607 HD22 LEU 85 1HD2 LEU 85 -10.518 -12.299 10.226 608 HD23 LEU 85 2HD2 LEU 85 -9.286 -11.492 11.197 609 H THR 86 H THR 86 -7.204 -10.439 5.995 610 HA THR 86 HA THR 86 -8.067 -9.023 3.643 611 HB THR 86 HB THR 86 -6.171 -11.372 3.772 612 HG1 THR 86 HG1 THR 86 -4.573 -9.592 3.783 613 HG21 THR 86 3HG2 THR 86 -6.043 -11.101 1.566 614 HG22 THR 86 1HG2 THR 86 -5.457 -9.458 1.819 615 HG23 THR 86 2HG2 THR 86 -7.185 -9.760 1.639 616 H ILE 87 H ILE 87 -9.911 -9.564 2.674 617 HA ILE 87 HA ILE 87 -10.750 -12.371 2.638 618 HB ILE 87 HB ILE 87 -12.293 -9.879 1.909 619 HG12 ILE 87 1HG1 ILE 87 -12.619 -11.719 4.287 620 HG13 ILE 87 2HG1 ILE 87 -11.752 -10.187 4.339 621 HG21 ILE 87 1HG2 ILE 87 -14.192 -11.719 2.218 622 HG22 ILE 87 2HG2 ILE 87 -13.415 -11.413 0.666 623 HG23 ILE 87 3HG2 ILE 87 -12.890 -12.770 1.662 624 HD11 ILE 87 3HD1 ILE 87 -13.638 -9.092 4.675 625 HD12 ILE 87 1HD1 ILE 87 -14.348 -9.781 3.215 626 HD13 ILE 87 2HD1 ILE 87 -14.483 -10.637 4.751 627 HA PRO 88 HA PRO 88 -9.147 -12.395 -1.564 628 HB2 PRO 88 1HB PRO 88 -9.427 -15.075 -1.895 629 HB3 PRO 88 2HB PRO 88 -8.077 -14.352 -1.012 630 HG2 PRO 88 1HG PRO 88 -10.593 -15.582 0.047 631 HG3 PRO 88 2HG PRO 88 -8.927 -15.762 0.630 632 HD2 PRO 88 1HD PRO 88 -10.714 -14.108 1.814 633 HD3 PRO 88 2HD PRO 88 -8.974 -13.757 1.766 634 HA PRO 89 HA PRO 89 -12.730 -12.571 -4.106 635 HB2 PRO 89 1HB PRO 89 -11.859 -13.856 -6.333 636 HB3 PRO 89 2HB PRO 89 -11.372 -12.207 -5.923 637 HG2 PRO 89 1HG PRO 89 -9.898 -14.779 -5.501 638 HG3 PRO 89 2HG PRO 89 -9.284 -13.219 -6.081 639 HD2 PRO 89 1HD PRO 89 -8.954 -14.056 -3.527 640 HD3 PRO 89 2HD PRO 89 -9.139 -12.343 -3.955 641 H GLN 90 H GLN 90 -11.047 -15.665 -3.762 642 HA GLN 90 HA GLN 90 -13.166 -17.301 -4.662 643 HB2 GLN 90 1HB GLN 90 -11.948 -19.131 -3.512 644 HB3 GLN 90 2HB GLN 90 -10.915 -18.168 -4.561 645 HG2 GLN 90 1HG GLN 90 -10.556 -16.866 -2.240 646 HG3 GLN 90 2HG GLN 90 -10.876 -18.491 -1.636 647 HE21 GLN 90 2HE2 GLN 90 -8.617 -16.412 -3.087 648 HE22 GLN 90 1HE2 GLN 90 -7.345 -17.559 -3.308 649 H LEU 91 H LEU 91 -12.846 -15.444 -1.875 650 HA LEU 91 HA LEU 91 -15.011 -16.957 -0.573 651 HB2 LEU 91 1HB LEU 91 -12.499 -15.838 0.566 652 HB3 LEU 91 2HB LEU 91 -13.954 -15.816 1.560 653 HG LEU 91 HG LEU 91 -13.871 -18.415 0.670 654 HD11 LEU 91 1HD1 LEU 91 -11.801 -19.126 0.276 655 HD12 LEU 91 2HD1 LEU 91 -11.157 -18.259 1.670 656 HD13 LEU 91 3HD1 LEU 91 -11.343 -17.429 0.125 657 HD21 LEU 91 3HD2 LEU 91 -13.209 -18.943 2.956 658 HD22 LEU 91 1HD2 LEU 91 -14.395 -17.637 2.929 659 HD23 LEU 91 2HD2 LEU 91 -12.691 -17.274 3.202 660 H GLY 92 H GLY 92 -14.490 -14.334 -2.282 661 HA2 GLY 92 1HA GLY 92 -16.533 -12.807 -0.834 662 HA3 GLY 92 2HA GLY 92 -15.033 -11.992 -1.251 663 H TYR 93 H TYR 93 -14.778 -11.173 -3.260 664 HA TYR 93 HA TYR 93 -17.061 -10.883 -4.909 665 HB2 TYR 93 1HB TYR 93 -14.197 -10.065 -5.072 666 HB3 TYR 93 2HB TYR 93 -15.157 -10.014 -6.546 667 HD1 TYR 93 HD2 TYR 93 -16.420 -9.317 -3.138 668 HD2 TYR 93 HD1 TYR 93 -15.228 -7.668 -6.875 669 HE1 TYR 93 HE2 TYR 93 -17.336 -7.137 -2.462 670 HE2 TYR 93 HE1 TYR 93 -16.139 -5.483 -6.208 671 HH TYR 93 HH TYR 93 -18.161 -5.083 -3.505 672 H GLY 94 H GLY 94 -13.921 -12.421 -5.651 673 HA2 GLY 94 1HA GLY 94 -13.784 -14.641 -6.566 674 HA3 GLY 94 2HA GLY 94 -15.384 -14.411 -7.255 675 H ALA 95 H ALA 95 -14.428 -15.159 -9.255 676 HA ALA 95 HA ALA 95 -12.461 -13.468 -10.540 677 HB1 ALA 95 1HB ALA 95 -13.684 -15.322 -12.347 678 HB2 ALA 95 2HB ALA 95 -12.034 -15.295 -11.723 679 HB3 ALA 95 3HB ALA 95 -13.301 -16.134 -10.828 680 H ARG 96 H ARG 96 -15.595 -13.006 -9.942 681 HA ARG 96 HA ARG 96 -16.755 -12.388 -12.426 682 HB2 ARG 96 1HB ARG 96 -17.301 -11.605 -9.592 683 HB3 ARG 96 2HB ARG 96 -18.126 -10.745 -10.886 684 HG2 ARG 96 1HG ARG 96 -19.527 -12.523 -10.096 685 HG3 ARG 96 2HG ARG 96 -18.978 -12.905 -11.729 686 HD2 ARG 96 1HD ARG 96 -17.388 -14.472 -10.918 687 HD3 ARG 96 2HD ARG 96 -17.613 -13.936 -9.254 688 HE ARG 96 HE ARG 96 -20.035 -14.922 -10.381 689 HH11 ARG 96 1HH1 ARG 96 -17.005 -15.906 -8.975 690 HH12 ARG 96 2HH1 ARG 96 -17.613 -17.426 -8.407 691 HH21 ARG 96 1HH2 ARG 96 -20.847 -16.920 -9.638 692 HH22 ARG 96 2HH2 ARG 96 -19.798 -18.002 -8.786 693 H GLY 97 H GLY 97 -14.577 -10.613 -10.352 694 HA2 GLY 97 1HA GLY 97 -13.377 -8.691 -10.732 695 HA3 GLY 97 2HA GLY 97 -13.862 -8.808 -12.417 696 H ALA 98 H ALA 98 -13.669 -6.510 -10.490 697 HA ALA 98 HA ALA 98 -16.429 -5.526 -10.822 698 HB1 ALA 98 1HB ALA 98 -16.484 -4.702 -8.734 699 HB2 ALA 98 2HB ALA 98 -15.203 -5.877 -8.428 700 HB3 ALA 98 3HB ALA 98 -14.794 -4.197 -8.778 701 H GLY 99 H GLY 99 -14.010 -5.369 -12.591 702 HA2 GLY 99 1HA GLY 99 -14.166 -3.264 -14.055 703 HA3 GLY 99 2HA GLY 99 -13.600 -2.452 -12.602 704 H GLY 100 H GLY 100 -12.205 -2.265 -14.980 705 HA2 GLY 100 1HA GLY 100 -10.204 -4.120 -15.465 706 HA3 GLY 100 2HA GLY 100 -10.044 -2.392 -15.747 707 H VAL 101 H VAL 101 -10.418 -1.732 -12.912 708 HA VAL 101 HA VAL 101 -7.676 -1.973 -12.110 709 HB VAL 101 HB VAL 101 -10.068 -0.792 -10.696 710 HG11 VAL 101 1HG1 VAL 101 -8.789 -1.086 -8.859 711 HG12 VAL 101 2HG1 VAL 101 -7.302 -1.270 -9.790 712 HG13 VAL 101 3HG1 VAL 101 -7.953 0.339 -9.474 713 HG21 VAL 101 3HG2 VAL 101 -8.921 0.198 -12.868 714 HG22 VAL 101 1HG2 VAL 101 -9.471 1.238 -11.554 715 HG23 VAL 101 2HG2 VAL 101 -7.766 0.808 -11.684 716 H ILE 102 H ILE 102 -10.618 -3.662 -11.426 717 HA ILE 102 HA ILE 102 -9.254 -5.182 -9.300 718 HB ILE 102 HB ILE 102 -12.220 -4.822 -9.748 719 HG12 ILE 102 1HG1 ILE 102 -10.486 -3.873 -7.459 720 HG13 ILE 102 2HG1 ILE 102 -10.982 -2.854 -8.806 721 HG21 ILE 102 1HG2 ILE 102 -12.209 -5.942 -7.396 722 HG22 ILE 102 2HG2 ILE 102 -12.095 -6.939 -8.846 723 HG23 ILE 102 3HG2 ILE 102 -10.645 -6.571 -7.912 724 HD11 ILE 102 3HD1 ILE 102 -12.313 -3.166 -6.427 725 HD12 ILE 102 1HD1 ILE 102 -12.980 -2.485 -7.910 726 HD13 ILE 102 2HD1 ILE 102 -13.221 -4.192 -7.536 727 HA PRO 103 HA PRO 103 -9.453 -8.209 -12.695 728 HB2 PRO 103 1HB PRO 103 -7.390 -9.702 -11.753 729 HB3 PRO 103 2HB PRO 103 -7.155 -8.241 -12.719 730 HG2 PRO 103 1HG PRO 103 -6.999 -8.595 -9.751 731 HG3 PRO 103 2HG PRO 103 -5.929 -7.677 -10.826 732 HD2 PRO 103 1HD PRO 103 -7.854 -6.496 -9.332 733 HD3 PRO 103 2HD PRO 103 -7.362 -5.874 -10.921 734 HA PRO 104 HA PRO 104 -11.632 -11.504 -10.763 735 HB2 PRO 104 1HB PRO 104 -10.774 -13.687 -12.130 736 HB3 PRO 104 2HB PRO 104 -11.845 -12.471 -12.837 737 HG2 PRO 104 1HG PRO 104 -8.883 -12.792 -13.136 738 HG3 PRO 104 2HG PRO 104 -10.098 -12.415 -14.371 739 HD2 PRO 104 1HD PRO 104 -8.526 -10.518 -13.249 740 HD3 PRO 104 2HD PRO 104 -10.185 -10.187 -13.787 741 H ASN 105 H ASN 105 -8.223 -11.412 -10.623 742 HA ASN 105 HA ASN 105 -8.194 -13.535 -8.581 743 HB2 ASN 105 1HB ASN 105 -6.002 -14.083 -9.165 744 HB3 ASN 105 2HB ASN 105 -6.738 -13.725 -10.725 745 HD21 ASN 105 2HD2 ASN 105 -6.329 -11.655 -11.673 746 HD22 ASN 105 1HD2 ASN 105 -4.868 -10.809 -11.305 747 H ALA 106 H ALA 106 -8.686 -10.472 -8.556 748 HA ALA 106 HA ALA 106 -6.547 -9.489 -6.890 749 HB1 ALA 106 1HB ALA 106 -7.319 -7.518 -7.548 750 HB2 ALA 106 2HB ALA 106 -8.613 -8.336 -8.425 751 HB3 ALA 106 3HB ALA 106 -8.864 -7.828 -6.755 752 H THR 107 H THR 107 -6.823 -8.750 -4.710 753 HA THR 107 HA THR 107 -8.914 -10.221 -3.240 754 HB THR 107 HB THR 107 -6.088 -9.630 -2.338 755 HG1 THR 107 HG1 THR 107 -6.213 -11.385 -3.782 756 HG21 THR 107 3HG2 THR 107 -6.940 -11.316 -0.491 757 HG22 THR 107 1HG2 THR 107 -8.507 -10.626 -0.912 758 HG23 THR 107 2HG2 THR 107 -7.210 -9.580 -0.336 759 H LEU 108 H LEU 108 -9.856 -9.216 -1.450 760 HA LEU 108 HA LEU 108 -9.276 -6.344 -1.156 761 HB2 LEU 108 1HB LEU 108 -12.009 -7.571 -0.901 762 HB3 LEU 108 2HB LEU 108 -11.593 -5.859 -0.941 763 HG LEU 108 HG LEU 108 -10.969 -7.532 -3.326 764 HD11 LEU 108 1HD1 LEU 108 -13.087 -7.791 -4.038 765 HD12 LEU 108 2HD1 LEU 108 -13.637 -6.292 -3.291 766 HD13 LEU 108 3HD1 LEU 108 -13.457 -7.749 -2.313 767 HD21 LEU 108 3HD2 LEU 108 -11.978 -5.208 -4.215 768 HD22 LEU 108 1HD2 LEU 108 -10.279 -5.434 -3.799 769 HD23 LEU 108 2HD2 LEU 108 -11.380 -4.691 -2.638 770 H VAL 109 H VAL 109 -9.056 -5.595 0.875 771 HA VAL 109 HA VAL 109 -9.477 -7.517 3.065 772 HB VAL 109 HB VAL 109 -7.809 -6.290 4.334 773 HG11 VAL 109 1HG1 VAL 109 -6.227 -7.528 3.386 774 HG12 VAL 109 2HG1 VAL 109 -7.319 -7.802 2.027 775 HG13 VAL 109 3HG1 VAL 109 -6.170 -6.465 1.981 776 HG21 VAL 109 3HG2 VAL 109 -6.560 -4.599 2.529 777 HG22 VAL 109 1HG2 VAL 109 -8.280 -4.281 2.299 778 HG23 VAL 109 2HG2 VAL 109 -7.559 -4.117 3.900 779 H PHE 110 H PHE 110 -10.637 -6.954 4.857 780 HA PHE 110 HA PHE 110 -11.837 -4.267 4.894 781 HB2 PHE 110 1HB PHE 110 -13.163 -6.934 4.985 782 HB3 PHE 110 2HB PHE 110 -13.838 -5.649 5.981 783 HD1 PHE 110 HD2 PHE 110 -12.680 -6.252 2.489 784 HD2 PHE 110 HD1 PHE 110 -15.432 -4.273 5.064 785 HE1 PHE 110 HE2 PHE 110 -13.872 -5.365 0.528 786 HE2 PHE 110 HE1 PHE 110 -16.629 -3.384 3.107 787 HZ PHE 110 HZ PHE 110 -15.848 -3.928 0.835 788 H GLU 111 H GLU 111 -11.873 -3.259 6.826 789 HA GLU 111 HA GLU 111 -10.521 -4.571 9.038 790 HB2 GLU 111 1HB GLU 111 -10.125 -2.150 8.173 791 HB3 GLU 111 2HB GLU 111 -11.564 -1.758 9.104 792 HG2 GLU 111 1HG GLU 111 -9.030 -2.975 10.177 793 HG3 GLU 111 2HG GLU 111 -9.558 -1.305 10.381 794 H VAL 112 H VAL 112 -11.653 -5.687 10.472 795 HA VAL 112 HA VAL 112 -14.469 -5.026 10.925 796 HB VAL 112 HB VAL 112 -12.976 -7.415 12.000 797 HG11 VAL 112 1HG1 VAL 112 -14.974 -7.192 13.182 798 HG12 VAL 112 2HG1 VAL 112 -15.865 -6.648 11.759 799 HG13 VAL 112 3HG1 VAL 112 -15.374 -8.337 11.901 800 HG21 VAL 112 3HG2 VAL 112 -14.392 -7.058 9.368 801 HG22 VAL 112 1HG2 VAL 112 -12.730 -7.578 9.649 802 HG23 VAL 112 2HG2 VAL 112 -14.071 -8.639 10.081 803 H GLU 113 H GLU 113 -15.185 -4.127 12.755 804 HA GLU 113 HA GLU 113 -13.423 -4.110 15.107 805 HB2 GLU 113 1HB GLU 113 -13.091 -1.959 14.106 806 HB3 GLU 113 2HB GLU 113 -14.820 -1.737 13.872 807 HG2 GLU 113 1HG GLU 113 -15.198 -1.252 16.086 808 HG3 GLU 113 2HG GLU 113 -13.751 -2.100 16.629 809 H LEU 114 H LEU 114 -14.568 -5.412 16.423 810 HA LEU 114 HA LEU 114 -17.411 -5.471 16.515 811 HB2 LEU 114 1HB LEU 114 -15.475 -7.168 17.304 812 HB3 LEU 114 2HB LEU 114 -15.888 -6.436 18.853 813 HG LEU 114 HG LEU 114 -17.235 -8.304 18.828 814 HD11 LEU 114 1HD1 LEU 114 -18.558 -6.240 19.167 815 HD12 LEU 114 2HD1 LEU 114 -19.504 -7.575 18.510 816 HD13 LEU 114 3HD1 LEU 114 -18.977 -6.265 17.454 817 HD21 LEU 114 3HD2 LEU 114 -17.104 -9.425 16.880 818 HD22 LEU 114 1HD2 LEU 114 -17.129 -7.953 15.909 819 HD23 LEU 114 2HD2 LEU 114 -18.636 -8.619 16.539 820 H LEU 115 H LEU 115 -18.794 -4.279 17.663 821 HA LEU 115 HA LEU 115 -17.684 -2.366 19.599 822 HB2 LEU 115 1HB LEU 115 -20.454 -2.151 18.524 823 HB3 LEU 115 2HB LEU 115 -19.352 -0.880 19.052 824 HG LEU 115 HG LEU 115 -19.180 -2.419 16.461 825 HD11 LEU 115 1HD1 LEU 115 -20.196 -0.690 15.416 826 HD12 LEU 115 2HD1 LEU 115 -19.572 0.509 16.549 827 HD13 LEU 115 3HD1 LEU 115 -20.953 -0.492 16.997 828 HD21 LEU 115 3HD2 LEU 115 -17.426 -0.316 17.698 829 HD22 LEU 115 1HD2 LEU 115 -17.468 -0.603 15.958 830 HD23 LEU 115 2HD2 LEU 115 -16.968 -1.893 17.053 831 H ASP 116 H ASP 116 -20.364 -4.628 19.093 832 HA ASP 116 HA ASP 116 -20.380 -5.428 21.817 833 HB2 ASP 116 1HB ASP 116 -21.515 -3.194 21.976 834 HB3 ASP 116 2HB ASP 116 -22.791 -3.828 20.940 835 H VAL 117 H VAL 117 -22.183 -6.971 22.273 836 HA VAL 117 HA VAL 117 -22.991 -8.338 19.789 837 HB VAL 117 HB VAL 117 -23.114 -10.405 21.270 838 HG11 VAL 117 1HG1 VAL 117 -20.386 -10.276 21.379 839 HG12 VAL 117 2HG1 VAL 117 -21.328 -10.708 19.951 840 HG13 VAL 117 3HG1 VAL 117 -20.767 -9.050 20.171 841 HG21 VAL 117 3HG2 VAL 117 -23.085 -9.279 23.428 842 HG22 VAL 117 1HG2 VAL 117 -21.714 -10.380 23.285 843 HG23 VAL 117 2HG2 VAL 117 -21.475 -8.643 23.092 844 H13 JZF 130 1H3 JZF 130 -17.475 -5.168 -0.212 845 H23 JZF 130 2H3 JZF 130 -17.858 -4.124 1.144 846 H4 JZF 130 H4 JZF 130 -19.461 -4.474 -1.414 847 H15 JZF 130 1H5 JZF 130 -21.006 -2.784 -0.590 848 H25 JZF 130 2H5 JZF 130 -20.099 -2.600 0.904 849 H17 JZF 130 1H7 JZF 130 -18.003 -1.947 -0.590 850 H27 JZF 130 2H7 JZF 130 -17.297 -3.183 -1.581 851 H8 JZF 130 H8 JZF 130 -19.599 -2.623 -2.928 852 H9 JZF 130 H9 JZF 130 -16.973 -2.700 -3.654 853 H1OH JZF 130 1HO JZF 130 -18.732 -0.290 -1.649 854 H11 JZF 130 H11 JZF 130 -16.783 -3.235 -6.181 855 H112 JZF 130 1H12 JZF 130 -17.648 -0.386 -6.887 856 H212 JZF 130 2H12 JZF 130 -16.173 -1.174 -7.428 857 H13A JZF 130 H13 JZF 130 -15.875 0.455 -5.523 858 H114 JZF 130 1H14 JZF 130 -16.591 -0.208 -3.259 859 H214 JZF 130 2H14 JZF 130 -17.921 0.141 -4.332 860 H115 JZF 130 1H15 JZF 130 -21.865 -6.261 2.637 861 H215 JZF 130 2H15 JZF 130 -20.646 -7.449 2.175 862 H116 JZF 130 1H16 JZF 130 -20.066 -7.337 -1.471 863 H216 JZF 130 2H16 JZF 130 -20.124 -8.264 0.058 864 H117 JZF 130 2H17 JZF 130 -22.009 -9.010 -2.218 865 H217 JZF 130 3H17 JZF 130 -20.324 -9.562 -2.279 866 H317 JZF 130 1H17 JZF 130 -21.364 -10.038 -0.926 867 H118 JZF 130 1H18 JZF 130 -19.363 -2.585 -7.592 868 H218 JZF 130 2H18 JZF 130 -17.868 -2.470 -8.530 869 H318 JZF 130 3H18 JZF 130 -18.312 -4.000 -7.756 870 H119 JZF 130 3H19 JZF 130 -14.074 -0.717 -4.633 871 H219 JZF 130 1H19 JZF 130 -15.046 -2.159 -4.324 872 H319 JZF 130 2H19 JZF 130 -14.468 -1.820 -5.955 Start of MODEL 20 1 H1 GLY 1 H GLY 1 11.682 -17.095 18.647 2 HA2 GLY 1 1HA GLY 1 9.923 -15.718 19.709 3 HA3 GLY 1 2HA GLY 1 11.167 -14.505 19.976 4 HA PRO 2 HA PRO 2 8.848 -13.517 16.053 5 HB2 PRO 2 1HB PRO 2 8.284 -10.949 16.730 6 HB3 PRO 2 2HB PRO 2 7.241 -12.309 17.166 7 HG2 PRO 2 1HG PRO 2 9.280 -10.877 18.826 8 HG3 PRO 2 2HG PRO 2 7.654 -11.422 19.275 9 HD2 PRO 2 1HD PRO 2 9.888 -12.794 19.951 10 HD3 PRO 2 2HD PRO 2 8.340 -13.595 19.618 11 H GLY 3 H GLY 3 9.260 -11.473 14.651 12 HA2 GLY 3 1HA GLY 3 11.736 -10.088 15.045 13 HA3 GLY 3 2HA GLY 3 11.886 -11.379 13.862 14 H SER 4 H SER 4 9.919 -11.346 12.243 15 HA SER 4 HA SER 4 9.703 -8.571 11.280 16 HB2 SER 4 1HB SER 4 10.087 -11.178 9.872 17 HB3 SER 4 2HB SER 4 9.197 -9.901 9.044 18 HG SER 4 HG SER 4 11.880 -9.970 9.857 19 H MET 5 H MET 5 7.794 -8.064 12.361 20 HA MET 5 HA MET 5 5.485 -9.667 12.404 21 HB2 MET 5 1HB MET 5 4.299 -7.592 13.029 22 HB3 MET 5 2HB MET 5 5.771 -7.830 13.961 23 HG2 MET 5 1HG MET 5 6.808 -6.322 12.071 24 HG3 MET 5 2HG MET 5 5.136 -5.793 11.897 25 HE1 MET 5 3HE MET 5 8.125 -4.494 14.992 26 HE2 MET 5 1HE MET 5 8.210 -6.103 14.274 27 HE3 MET 5 2HE MET 5 8.279 -4.673 13.244 28 H THR 6 H THR 6 3.957 -10.063 10.935 29 HA THR 6 HA THR 6 3.462 -8.205 8.759 30 HB THR 6 HB THR 6 3.641 -10.023 7.038 31 HG1 THR 6 HG1 THR 6 4.836 -11.356 9.243 32 HG21 THR 6 3HG2 THR 6 6.301 -9.544 8.354 33 HG22 THR 6 1HG2 THR 6 5.417 -8.250 7.546 34 HG23 THR 6 2HG2 THR 6 5.931 -9.670 6.634 35 H VAL 7 H VAL 7 1.783 -9.456 7.190 36 HA VAL 7 HA VAL 7 -0.515 -9.902 8.837 37 HB VAL 7 HB VAL 7 -0.294 -10.326 5.857 38 HG11 VAL 7 1HG1 VAL 7 -2.759 -9.369 7.202 39 HG12 VAL 7 2HG1 VAL 7 -2.569 -10.399 5.782 40 HG13 VAL 7 3HG1 VAL 7 -2.326 -11.067 7.397 41 HG21 VAL 7 3HG2 VAL 7 -1.515 -7.869 6.334 42 HG22 VAL 7 1HG2 VAL 7 -0.117 -7.897 7.409 43 HG23 VAL 7 2HG2 VAL 7 0.099 -8.141 5.676 44 H VAL 8 H VAL 8 -1.035 -11.763 9.758 45 HA VAL 8 HA VAL 8 0.200 -14.237 8.961 46 HB VAL 8 HB VAL 8 -2.014 -13.854 10.976 47 HG11 VAL 8 1HG1 VAL 8 -1.793 -16.146 10.471 48 HG12 VAL 8 2HG1 VAL 8 -0.031 -16.051 10.446 49 HG13 VAL 8 3HG1 VAL 8 -0.901 -15.903 11.973 50 HG21 VAL 8 3HG2 VAL 8 0.451 -14.170 12.284 51 HG22 VAL 8 1HG2 VAL 8 0.702 -12.936 11.050 52 HG23 VAL 8 2HG2 VAL 8 -0.575 -12.735 12.249 53 H THR 9 H THR 9 -0.561 -15.653 7.542 54 HA THR 9 HA THR 9 -3.345 -15.378 6.639 55 HB THR 9 HB THR 9 -1.077 -16.808 5.242 56 HG1 THR 9 HG1 THR 9 -0.552 -14.690 5.091 57 HG21 THR 9 3HG2 THR 9 -3.951 -16.423 4.687 58 HG22 THR 9 1HG2 THR 9 -2.863 -17.716 4.184 59 HG23 THR 9 2HG2 THR 9 -2.863 -16.177 3.322 60 H THR 10 H THR 10 -4.694 -17.166 6.468 61 HA THR 10 HA THR 10 -3.926 -19.427 8.165 62 HB THR 10 HB THR 10 -6.308 -19.962 8.272 63 HG1 THR 10 HG1 THR 10 -6.949 -17.593 6.895 64 HG21 THR 10 3HG2 THR 10 -5.205 -17.375 9.089 65 HG22 THR 10 1HG2 THR 10 -6.093 -18.574 10.028 66 HG23 THR 10 2HG2 THR 10 -6.966 -17.416 9.025 67 H GLU 11 H GLU 11 -5.249 -21.516 7.432 68 HA GLU 11 HA GLU 11 -4.035 -22.345 4.989 69 HB2 GLU 11 1HB GLU 11 -5.902 -23.653 6.948 70 HB3 GLU 11 2HB GLU 11 -5.486 -24.441 5.432 71 HG2 GLU 11 1HG GLU 11 -3.187 -24.537 6.015 72 HG3 GLU 11 2HG GLU 11 -3.436 -23.495 7.415 73 H SER 12 H SER 12 -7.179 -21.170 5.889 74 HA SER 12 HA SER 12 -8.589 -22.104 3.604 75 HB2 SER 12 1HB SER 12 -10.325 -20.481 4.283 76 HB3 SER 12 2HB SER 12 -9.767 -21.450 5.646 77 HG SER 12 HG SER 12 -8.973 -19.719 6.555 78 H GLY 13 H GLY 13 -6.754 -19.196 4.333 79 HA2 GLY 13 1HA GLY 13 -5.660 -18.324 2.212 80 HA3 GLY 13 2HA GLY 13 -7.306 -18.217 1.603 81 H LEU 14 H LEU 14 -8.425 -17.324 4.133 82 HA LEU 14 HA LEU 14 -8.036 -14.529 3.792 83 HB2 LEU 14 1HB LEU 14 -10.179 -15.214 4.467 84 HB3 LEU 14 2HB LEU 14 -9.540 -16.193 5.785 85 HG LEU 14 HG LEU 14 -9.059 -13.275 5.938 86 HD11 LEU 14 1HD1 LEU 14 -11.764 -14.428 6.580 87 HD12 LEU 14 2HD1 LEU 14 -11.412 -13.508 5.117 88 HD13 LEU 14 3HD1 LEU 14 -11.250 -12.745 6.699 89 HD21 LEU 14 3HD2 LEU 14 -8.761 -13.729 8.108 90 HD22 LEU 14 1HD2 LEU 14 -8.702 -15.418 7.602 91 HD23 LEU 14 2HD2 LEU 14 -10.213 -14.728 8.195 92 H LYS 15 H LYS 15 -6.989 -13.045 5.067 93 HA LYS 15 HA LYS 15 -5.104 -14.165 7.032 94 HB2 LYS 15 1HB LYS 15 -4.827 -11.498 5.658 95 HB3 LYS 15 2HB LYS 15 -3.590 -12.417 6.506 96 HG2 LYS 15 1HG LYS 15 -3.698 -14.134 4.740 97 HG3 LYS 15 2HG LYS 15 -4.868 -13.134 3.875 98 HD2 LYS 15 1HD LYS 15 -3.180 -11.315 3.803 99 HD3 LYS 15 2HD LYS 15 -2.015 -12.414 4.544 100 HE2 LYS 15 1HE LYS 15 -1.666 -12.393 2.164 101 HE3 LYS 15 2HE LYS 15 -2.328 -13.959 2.632 102 HZ1 LYS 15 3HZ LYS 15 -4.415 -13.407 1.760 103 HZ2 LYS 15 1HZ LYS 15 -3.314 -12.866 0.595 104 HZ3 LYS 15 2HZ LYS 15 -4.045 -11.760 1.646 105 H TYR 16 H TYR 16 -4.537 -12.745 8.858 106 HA TYR 16 HA TYR 16 -6.506 -10.726 9.571 107 HB2 TYR 16 1HB TYR 16 -7.263 -11.754 11.553 108 HB3 TYR 16 2HB TYR 16 -7.331 -13.026 10.338 109 HD1 TYR 16 HD1 TYR 16 -4.870 -14.272 10.155 110 HD2 TYR 16 HD2 TYR 16 -6.563 -12.474 13.620 111 HE1 TYR 16 HE1 TYR 16 -3.472 -15.711 11.578 112 HE2 TYR 16 HE2 TYR 16 -5.169 -13.907 15.052 113 HH TYR 16 HH TYR 16 -3.937 -15.916 15.002 114 H GLU 17 H GLU 17 -5.676 -9.146 10.830 115 HA GLU 17 HA GLU 17 -3.107 -9.617 12.167 116 HB2 GLU 17 1HB GLU 17 -3.145 -8.357 9.785 117 HB3 GLU 17 2HB GLU 17 -3.438 -6.986 10.845 118 HG2 GLU 17 1HG GLU 17 -1.398 -7.352 12.013 119 HG3 GLU 17 2HG GLU 17 -1.143 -8.893 11.197 120 H ASP 18 H ASP 18 -3.319 -9.108 14.232 121 HA ASP 18 HA ASP 18 -5.504 -7.835 15.378 122 HB2 ASP 18 1HB ASP 18 -4.167 -7.690 17.419 123 HB3 ASP 18 2HB ASP 18 -3.931 -9.250 16.637 124 H LEU 19 H LEU 19 -5.995 -5.767 15.941 125 HA LEU 19 HA LEU 19 -4.071 -3.673 15.171 126 HB2 LEU 19 1HB LEU 19 -7.007 -3.885 14.615 127 HB3 LEU 19 2HB LEU 19 -6.212 -2.314 14.684 128 HG LEU 19 HG LEU 19 -5.555 -4.551 12.767 129 HD11 LEU 19 1HD1 LEU 19 -7.600 -2.619 12.706 130 HD12 LEU 19 2HD1 LEU 19 -7.091 -3.706 11.414 131 HD13 LEU 19 3HD1 LEU 19 -6.374 -2.101 11.548 132 HD21 LEU 19 3HD2 LEU 19 -4.152 -2.098 13.534 133 HD22 LEU 19 1HD2 LEU 19 -4.400 -2.281 11.798 134 HD23 LEU 19 2HD2 LEU 19 -3.557 -3.538 12.705 135 H THR 20 H THR 20 -6.719 -4.639 17.277 136 HA THR 20 HA THR 20 -5.659 -2.985 19.397 137 HB THR 20 HB THR 20 -8.559 -2.560 18.729 138 HG1 THR 20 HG1 THR 20 -6.304 -1.117 17.760 139 HG21 THR 20 3HG2 THR 20 -6.520 -1.300 20.516 140 HG22 THR 20 1HG2 THR 20 -8.171 -1.799 20.878 141 HG23 THR 20 2HG2 THR 20 -7.879 -0.340 19.932 142 H GLU 21 H GLU 21 -5.722 -4.179 21.176 143 HA GLU 21 HA GLU 21 -6.877 -6.672 21.410 144 HB2 GLU 21 1HB GLU 21 -6.523 -6.466 23.828 145 HB3 GLU 21 2HB GLU 21 -5.138 -5.871 22.923 146 HG2 GLU 21 1HG GLU 21 -5.554 -3.669 23.471 147 HG3 GLU 21 2HG GLU 21 -7.254 -3.971 23.827 148 H GLY 22 H GLY 22 -8.622 -7.397 22.866 149 HA2 GLY 22 1HA GLY 22 -10.713 -5.517 23.521 150 HA3 GLY 22 2HA GLY 22 -11.106 -6.569 22.169 151 H SER 23 H SER 23 -11.812 -6.219 25.231 152 HA SER 23 HA SER 23 -11.684 -9.095 25.860 153 HB2 SER 23 1HB SER 23 -11.989 -6.790 27.798 154 HB3 SER 23 2HB SER 23 -11.807 -8.494 28.216 155 HG SER 23 HG SER 23 -9.901 -6.707 27.805 156 H GLY 24 H GLY 24 -13.583 -9.678 24.804 157 HA2 GLY 24 1HA GLY 24 -16.015 -8.963 26.256 158 HA3 GLY 24 2HA GLY 24 -15.989 -8.615 24.533 159 H ALA 25 H ALA 25 -17.110 -10.079 23.449 160 HA ALA 25 HA ALA 25 -16.639 -12.916 24.021 161 HB1 ALA 25 1HB ALA 25 -18.719 -12.192 25.183 162 HB2 ALA 25 2HB ALA 25 -19.403 -11.787 23.608 163 HB3 ALA 25 3HB ALA 25 -18.972 -13.456 23.980 164 H GLU 26 H GLU 26 -16.784 -14.276 22.252 165 HA GLU 26 HA GLU 26 -16.435 -13.024 19.695 166 HB2 GLU 26 1HB GLU 26 -15.299 -15.163 20.612 167 HB3 GLU 26 2HB GLU 26 -16.773 -15.980 20.111 168 HG2 GLU 26 1HG GLU 26 -16.392 -15.019 17.817 169 HG3 GLU 26 2HG GLU 26 -14.802 -14.513 18.385 170 H ALA 27 H ALA 27 -17.847 -12.831 18.053 171 HA ALA 27 HA ALA 27 -20.606 -13.011 18.497 172 HB1 ALA 27 1HB ALA 27 -20.770 -11.930 16.548 173 HB2 ALA 27 2HB ALA 27 -19.007 -11.878 16.583 174 HB3 ALA 27 3HB ALA 27 -19.834 -13.151 15.686 175 H ARG 28 H ARG 28 -22.189 -14.376 17.506 176 HA ARG 28 HA ARG 28 -21.206 -16.993 16.608 177 HB2 ARG 28 1HB ARG 28 -23.373 -16.565 18.673 178 HB3 ARG 28 2HB ARG 28 -22.908 -18.116 17.989 179 HG2 ARG 28 1HG ARG 28 -20.833 -16.452 19.324 180 HG3 ARG 28 2HG ARG 28 -21.994 -17.342 20.312 181 HD2 ARG 28 1HD ARG 28 -20.471 -18.683 18.104 182 HD3 ARG 28 2HD ARG 28 -19.768 -18.483 19.709 183 HE ARG 28 HE ARG 28 -21.839 -20.319 18.941 184 HH11 ARG 28 1HH1 ARG 28 -20.432 -18.537 21.580 185 HH12 ARG 28 2HH1 ARG 28 -21.014 -19.624 22.796 186 HH21 ARG 28 1HH2 ARG 28 -22.612 -21.758 20.534 187 HH22 ARG 28 2HH2 ARG 28 -22.253 -21.456 22.200 188 H ALA 29 H ALA 29 -22.397 -17.954 15.024 189 HA ALA 29 HA ALA 29 -24.036 -16.397 13.392 190 HB1 ALA 29 1HB ALA 29 -23.451 -19.317 13.561 191 HB2 ALA 29 2HB ALA 29 -24.732 -18.749 12.489 192 HB3 ALA 29 3HB ALA 29 -23.081 -18.166 12.277 193 H GLY 30 H GLY 30 -26.056 -15.723 13.653 194 HA2 GLY 30 1HA GLY 30 -28.401 -16.438 13.877 195 HA3 GLY 30 2HA GLY 30 -27.888 -17.400 15.255 196 H GLN 31 H GLN 31 -26.072 -15.087 16.036 197 HA GLN 31 HA GLN 31 -28.152 -13.586 17.457 198 HB2 GLN 31 1HB GLN 31 -26.696 -13.329 19.212 199 HB3 GLN 31 2HB GLN 31 -26.119 -14.857 18.560 200 HG2 GLN 31 1HG GLN 31 -24.373 -13.643 17.324 201 HG3 GLN 31 2HG GLN 31 -24.931 -12.139 18.054 202 HE21 GLN 31 2HE2 GLN 31 -24.680 -11.854 20.311 203 HE22 GLN 31 1HE2 GLN 31 -23.480 -12.735 21.188 204 H THR 32 H THR 32 -28.177 -11.345 17.511 205 HA THR 32 HA THR 32 -26.904 -10.068 15.223 206 HB THR 32 HB THR 32 -28.833 -8.783 17.154 207 HG1 THR 32 HG1 THR 32 -30.127 -10.313 16.387 208 HG21 THR 32 3HG2 THR 32 -28.679 -8.146 14.254 209 HG22 THR 32 1HG2 THR 32 -27.379 -7.567 15.294 210 HG23 THR 32 2HG2 THR 32 -29.046 -7.097 15.623 211 H VAL 33 H VAL 33 -25.356 -8.529 15.334 212 HA VAL 33 HA VAL 33 -24.673 -7.317 17.891 213 HB VAL 33 HB VAL 33 -22.345 -7.930 17.823 214 HG11 VAL 33 1HG1 VAL 33 -24.067 -9.484 18.847 215 HG12 VAL 33 2HG1 VAL 33 -23.873 -10.486 17.407 216 HG13 VAL 33 3HG1 VAL 33 -22.497 -10.192 18.471 217 HG21 VAL 33 3HG2 VAL 33 -21.600 -8.169 15.690 218 HG22 VAL 33 1HG2 VAL 33 -21.858 -9.874 16.064 219 HG23 VAL 33 2HG2 VAL 33 -23.071 -8.978 15.148 220 H SER 34 H SER 34 -22.999 -5.613 17.641 221 HA SER 34 HA SER 34 -23.267 -4.327 15.007 222 HB2 SER 34 1HB SER 34 -23.504 -3.345 17.736 223 HB3 SER 34 2HB SER 34 -22.355 -2.394 16.795 224 HG SER 34 HG SER 34 -24.793 -1.937 16.745 225 H VAL 35 H VAL 35 -21.513 -4.094 13.793 226 HA VAL 35 HA VAL 35 -18.879 -3.956 15.072 227 HB VAL 35 HB VAL 35 -17.889 -5.575 13.656 228 HG11 VAL 35 1HG1 VAL 35 -18.841 -7.543 14.443 229 HG12 VAL 35 2HG1 VAL 35 -19.412 -6.337 15.598 230 HG13 VAL 35 3HG1 VAL 35 -20.483 -6.915 14.321 231 HG21 VAL 35 3HG2 VAL 35 -20.468 -5.437 12.135 232 HG22 VAL 35 1HG2 VAL 35 -18.818 -5.230 11.548 233 HG23 VAL 35 2HG2 VAL 35 -19.401 -6.834 11.992 234 H HIS 36 H HIS 36 -17.187 -3.162 13.608 235 HA HIS 36 HA HIS 36 -18.312 -1.318 11.607 236 HB2 HIS 36 1HB HIS 36 -16.178 -1.048 13.640 237 HB3 HIS 36 2HB HIS 36 -15.848 -0.303 12.078 238 HD1 HIS 36 HD1 HIS 36 -18.540 0.869 11.359 239 HD2 HIS 36 HD2 HIS 36 -16.946 1.033 15.192 240 HE1 HIS 36 HE1 HIS 36 -19.682 2.810 12.479 241 H TYR 37 H TYR 37 -17.653 -1.435 9.546 242 HA TYR 37 HA TYR 37 -15.438 -3.278 8.926 243 HB2 TYR 37 1HB TYR 37 -16.573 -3.856 6.866 244 HB3 TYR 37 2HB TYR 37 -17.674 -4.100 8.217 245 HD1 TYR 37 HD2 TYR 37 -19.417 -2.309 8.680 246 HD2 TYR 37 HD1 TYR 37 -17.154 -2.445 5.080 247 HE1 TYR 37 HE2 TYR 37 -21.088 -0.876 7.583 248 HE2 TYR 37 HE1 TYR 37 -18.817 -1.011 3.973 249 HH TYR 37 HH TYR 37 -21.855 -0.238 5.458 250 H THR 38 H THR 38 -13.779 -2.506 7.784 251 HA THR 38 HA THR 38 -14.113 0.071 6.396 252 HB THR 38 HB THR 38 -11.406 -0.442 7.396 253 HG1 THR 38 HG1 THR 38 -13.230 0.402 9.365 254 HG21 THR 38 3HG2 THR 38 -13.257 1.918 7.737 255 HG22 THR 38 1HG2 THR 38 -12.199 1.669 6.349 256 HG23 THR 38 2HG2 THR 38 -11.508 1.904 7.955 257 H GLY 39 H GLY 39 -13.991 -0.392 4.289 258 HA2 GLY 39 1HA GLY 39 -12.572 -2.628 3.242 259 HA3 GLY 39 2HA GLY 39 -13.294 -1.328 2.305 260 H TRP 40 H TRP 40 -10.418 -2.741 3.321 261 HA TRP 40 HA TRP 40 -8.887 -0.354 2.520 262 HB2 TRP 40 1HB TRP 40 -8.115 -2.599 4.393 263 HB3 TRP 40 2HB TRP 40 -6.998 -1.361 3.825 264 HD1 TRP 40 HD1 TRP 40 -9.741 0.748 4.178 265 HE1 TRP 40 HE1 TRP 40 -9.985 1.764 6.530 266 HE3 TRP 40 HE3 TRP 40 -6.755 -2.490 6.772 267 HZ2 TRP 40 HZ2 TRP 40 -9.036 1.259 9.140 268 HZ3 TRP 40 HZ3 TRP 40 -6.475 -2.154 9.193 269 HH2 TRP 40 HH2 TRP 40 -7.592 -0.317 10.351 270 H LEU 41 H LEU 41 -7.139 -0.614 1.112 271 HA LEU 41 HA LEU 41 -7.399 -2.857 -0.696 272 HB2 LEU 41 1HB LEU 41 -6.425 -0.164 -0.825 273 HB3 LEU 41 2HB LEU 41 -5.195 -1.271 -1.432 274 HG LEU 41 HG LEU 41 -7.338 -2.184 -2.778 275 HD11 LEU 41 1HD1 LEU 41 -7.912 0.632 -3.224 276 HD12 LEU 41 2HD1 LEU 41 -8.368 0.084 -1.611 277 HD13 LEU 41 3HD1 LEU 41 -9.012 -0.735 -3.034 278 HD21 LEU 41 3HD2 LEU 41 -5.057 -0.514 -3.311 279 HD22 LEU 41 1HD2 LEU 41 -6.413 -0.059 -4.343 280 HD23 LEU 41 2HD2 LEU 41 -5.828 -1.723 -4.340 281 H THR 42 H THR 42 -5.468 -4.019 -1.480 282 HA THR 42 HA THR 42 -4.073 -5.229 0.654 283 HB THR 42 HB THR 42 -2.988 -6.580 -0.951 284 HG1 THR 42 HG1 THR 42 -3.331 -4.341 -2.614 285 HG21 THR 42 3HG2 THR 42 -5.721 -6.230 -1.017 286 HG22 THR 42 1HG2 THR 42 -4.835 -7.563 -1.755 287 HG23 THR 42 2HG2 THR 42 -5.267 -6.151 -2.719 288 H ASP 43 H ASP 43 -3.506 -2.346 -1.024 289 HA ASP 43 HA ASP 43 -0.629 -2.357 -0.626 290 HB2 ASP 43 1HB ASP 43 -2.474 -0.197 -1.671 291 HB3 ASP 43 2HB ASP 43 -0.715 -0.103 -1.641 292 H GLY 44 H GLY 44 -3.460 -1.371 1.042 293 HA2 GLY 44 1HA GLY 44 -3.229 -0.900 3.416 294 HA3 GLY 44 2HA GLY 44 -1.767 -0.002 3.035 295 H GLN 45 H GLN 45 -4.042 0.630 0.694 296 HA GLN 45 HA GLN 45 -4.646 3.214 1.919 297 HB2 GLN 45 1HB GLN 45 -5.290 3.922 -0.330 298 HB3 GLN 45 2HB GLN 45 -3.675 3.227 -0.331 299 HG2 GLN 45 1HG GLN 45 -4.861 1.042 -1.012 300 HG3 GLN 45 2HG GLN 45 -6.213 2.095 -1.427 301 HE21 GLN 45 2HE2 GLN 45 -2.726 1.747 -1.944 302 HE22 GLN 45 1HE2 GLN 45 -2.737 2.303 -3.579 303 H LYS 46 H LYS 46 -6.654 3.864 2.463 304 HA LYS 46 HA LYS 46 -8.723 1.876 2.624 305 HB2 LYS 46 1HB LYS 46 -8.443 3.419 4.463 306 HB3 LYS 46 2HB LYS 46 -8.661 4.798 3.394 307 HG2 LYS 46 1HG LYS 46 -10.980 3.986 2.949 308 HG3 LYS 46 2HG LYS 46 -10.730 2.769 4.203 309 HD2 LYS 46 1HD LYS 46 -11.119 4.251 5.823 310 HD3 LYS 46 2HD LYS 46 -9.982 5.407 5.125 311 HE2 LYS 46 1HE LYS 46 -12.756 5.005 4.038 312 HE3 LYS 46 2HE LYS 46 -12.403 6.154 5.327 313 HZ1 LYS 46 3HZ LYS 46 -12.059 6.468 2.551 314 HZ2 LYS 46 1HZ LYS 46 -10.549 6.594 3.304 315 HZ3 LYS 46 2HZ LYS 46 -11.819 7.605 3.781 316 H PHE 47 H PHE 47 -10.742 1.906 1.631 317 HA PHE 47 HA PHE 47 -11.257 3.900 -0.429 318 HB2 PHE 47 1HB PHE 47 -11.497 2.346 -2.216 319 HB3 PHE 47 2HB PHE 47 -9.945 1.992 -1.463 320 HD1 PHE 47 HD1 PHE 47 -9.770 0.039 0.097 321 HD2 PHE 47 HD2 PHE 47 -13.185 0.723 -2.349 322 HE1 PHE 47 HE1 PHE 47 -10.448 -2.308 0.393 323 HE2 PHE 47 HE2 PHE 47 -13.869 -1.622 -2.055 324 HZ PHE 47 HZ PHE 47 -12.501 -3.140 -0.682 325 H ASP 48 H ASP 48 -12.368 2.712 2.186 326 HA ASP 48 HA ASP 48 -15.073 3.201 1.691 327 HB2 ASP 48 1HB ASP 48 -14.325 0.644 0.817 328 HB3 ASP 48 2HB ASP 48 -15.142 0.385 2.356 329 H SER 49 H SER 49 -15.908 3.795 3.579 330 HA SER 49 HA SER 49 -15.090 2.421 6.027 331 HB2 SER 49 1HB SER 49 -14.482 5.238 5.330 332 HB3 SER 49 2HB SER 49 -15.082 4.954 6.964 333 HG SER 49 HG SER 49 -12.958 3.463 5.833 334 H SER 50 H SER 50 -16.755 2.065 7.350 335 HA SER 50 HA SER 50 -19.386 2.819 6.597 336 HB2 SER 50 1HB SER 50 -18.649 0.724 7.888 337 HB3 SER 50 2HB SER 50 -18.617 1.760 9.314 338 HG SER 50 HG SER 50 -20.880 1.543 7.628 339 H LYS 51 H LYS 51 -16.974 4.403 8.365 340 HA LYS 51 HA LYS 51 -18.420 5.814 10.291 341 HB2 LYS 51 1HB LYS 51 -15.910 6.427 8.757 342 HB3 LYS 51 2HB LYS 51 -16.576 7.588 9.897 343 HG2 LYS 51 1HG LYS 51 -16.043 6.326 11.713 344 HG3 LYS 51 2HG LYS 51 -16.186 4.801 10.835 345 HD2 LYS 51 1HD LYS 51 -13.917 4.889 11.045 346 HD3 LYS 51 2HD LYS 51 -14.092 5.789 9.537 347 HE2 LYS 51 1HE LYS 51 -14.147 7.213 12.169 348 HE3 LYS 51 2HE LYS 51 -12.610 6.753 11.437 349 HZ1 LYS 51 3HZ LYS 51 -14.278 8.937 10.808 350 HZ2 LYS 51 1HZ LYS 51 -14.127 7.947 9.444 351 HZ3 LYS 51 2HZ LYS 51 -12.745 8.565 10.197 352 H ASP 52 H ASP 52 -18.387 6.110 6.868 353 HA ASP 52 HA ASP 52 -19.023 8.760 6.433 354 HB2 ASP 52 1HB ASP 52 -18.634 7.067 4.652 355 HB3 ASP 52 2HB ASP 52 -20.225 6.390 4.987 356 H ARG 53 H ARG 53 -21.002 6.209 7.747 357 HA ARG 53 HA ARG 53 -23.372 7.927 7.696 358 HB2 ARG 53 1HB ARG 53 -23.476 5.502 6.978 359 HB3 ARG 53 2HB ARG 53 -23.193 5.073 8.659 360 HG2 ARG 53 1HG ARG 53 -25.525 4.938 8.285 361 HG3 ARG 53 2HG ARG 53 -25.241 6.392 9.244 362 HD2 ARG 53 1HD ARG 53 -25.690 7.807 7.468 363 HD3 ARG 53 2HD ARG 53 -25.342 6.568 6.263 364 HE ARG 53 HE ARG 53 -27.584 5.788 7.764 365 HH11 ARG 53 1HH1 ARG 53 -26.629 8.156 5.398 366 HH12 ARG 53 2HH1 ARG 53 -28.218 8.317 4.727 367 HH21 ARG 53 1HH2 ARG 53 -29.680 5.990 6.889 368 HH22 ARG 53 2HH2 ARG 53 -29.953 7.085 5.576 369 H ASN 54 H ASN 54 -20.870 6.898 9.773 370 HA ASN 54 HA ASN 54 -20.395 7.322 11.957 371 HB2 ASN 54 1HB ASN 54 -22.794 9.142 12.061 372 HB3 ASN 54 2HB ASN 54 -21.289 9.262 12.967 373 HD21 ASN 54 2HD2 ASN 54 -19.311 9.565 11.584 374 HD22 ASN 54 1HD2 ASN 54 -19.453 10.661 10.256 375 H ASP 55 H ASP 55 -21.352 5.006 11.929 376 HA ASP 55 HA ASP 55 -22.747 4.611 14.321 377 HB2 ASP 55 1HB ASP 55 -24.806 5.225 13.492 378 HB3 ASP 55 2HB ASP 55 -24.416 4.718 11.850 379 HA PRO 56 HA PRO 56 -20.937 0.655 13.671 380 HB2 PRO 56 1HB PRO 56 -22.285 -0.764 15.552 381 HB3 PRO 56 2HB PRO 56 -21.021 0.406 15.953 382 HG2 PRO 56 1HG PRO 56 -23.996 0.737 16.011 383 HG3 PRO 56 2HG PRO 56 -22.787 1.276 17.191 384 HD2 PRO 56 1HD PRO 56 -23.885 2.945 15.363 385 HD3 PRO 56 2HD PRO 56 -22.220 3.133 15.948 386 H PHE 57 H PHE 57 -21.285 -1.075 12.390 387 HA PHE 57 HA PHE 57 -23.813 -1.336 11.067 388 HB2 PHE 57 1HB PHE 57 -21.417 -1.730 10.124 389 HB3 PHE 57 2HB PHE 57 -21.589 -3.338 10.820 390 HD1 PHE 57 HD1 PHE 57 -23.660 -0.994 8.777 391 HD2 PHE 57 HD2 PHE 57 -22.260 -4.970 9.368 392 HE1 PHE 57 HE1 PHE 57 -24.893 -1.722 6.777 393 HE2 PHE 57 HE2 PHE 57 -23.490 -5.704 7.368 394 HZ PHE 57 HZ PHE 57 -24.808 -4.080 6.069 395 H ALA 58 H ALA 58 -25.427 -2.131 12.299 396 HA ALA 58 HA ALA 58 -24.939 -4.504 13.942 397 HB1 ALA 58 1HB ALA 58 -26.818 -3.957 15.170 398 HB2 ALA 58 2HB ALA 58 -26.198 -2.369 14.718 399 HB3 ALA 58 3HB ALA 58 -27.558 -3.068 13.839 400 H PHE 59 H PHE 59 -25.471 -6.464 13.251 401 HA PHE 59 HA PHE 59 -27.803 -6.913 11.620 402 HB2 PHE 59 1HB PHE 59 -26.736 -7.815 9.701 403 HB3 PHE 59 2HB PHE 59 -25.945 -6.273 10.007 404 HD1 PHE 59 HD2 PHE 59 -23.805 -6.438 11.550 405 HD2 PHE 59 HD1 PHE 59 -25.425 -9.646 9.269 406 HE1 PHE 59 HE2 PHE 59 -21.620 -7.567 11.593 407 HE2 PHE 59 HE1 PHE 59 -23.242 -10.781 9.309 408 HZ PHE 59 HZ PHE 59 -21.336 -9.741 10.471 409 H VAL 60 H VAL 60 -27.881 -9.349 11.000 410 HA VAL 60 HA VAL 60 -27.261 -10.830 13.439 411 HB VAL 60 HB VAL 60 -28.978 -11.607 11.077 412 HG11 VAL 60 1HG1 VAL 60 -28.510 -12.964 13.727 413 HG12 VAL 60 2HG1 VAL 60 -29.798 -13.394 12.601 414 HG13 VAL 60 3HG1 VAL 60 -28.110 -13.583 12.126 415 HG21 VAL 60 3HG2 VAL 60 -29.473 -9.926 13.348 416 HG22 VAL 60 1HG2 VAL 60 -30.537 -10.320 11.998 417 HG23 VAL 60 2HG2 VAL 60 -30.501 -11.357 13.424 418 H LEU 61 H LEU 61 -25.698 -12.305 13.565 419 HA LEU 61 HA LEU 61 -23.917 -12.737 11.387 420 HB2 LEU 61 1HB LEU 61 -23.264 -12.712 13.788 421 HB3 LEU 61 2HB LEU 61 -24.095 -14.254 13.985 422 HG LEU 61 HG LEU 61 -22.511 -15.348 12.535 423 HD11 LEU 61 1HD1 LEU 61 -20.447 -13.648 12.041 424 HD12 LEU 61 2HD1 LEU 61 -21.839 -12.590 11.812 425 HD13 LEU 61 3HD1 LEU 61 -21.701 -14.079 10.877 426 HD21 LEU 61 3HD2 LEU 61 -21.866 -14.140 15.012 427 HD22 LEU 61 1HD2 LEU 61 -20.430 -14.062 13.990 428 HD23 LEU 61 2HD2 LEU 61 -21.203 -15.615 14.306 429 H GLY 62 H GLY 62 -23.455 -14.679 10.285 430 HA2 GLY 62 1HA GLY 62 -23.954 -16.651 9.219 431 HA3 GLY 62 2HA GLY 62 -24.906 -17.079 10.632 432 H GLY 63 H GLY 63 -25.518 -14.217 8.703 433 HA2 GLY 63 1HA GLY 63 -28.230 -15.101 8.243 434 HA3 GLY 63 2HA GLY 63 -27.544 -13.549 7.785 435 H GLY 64 H GLY 64 -25.549 -14.089 6.114 436 HA2 GLY 64 1HA GLY 64 -25.020 -15.516 4.196 437 HA3 GLY 64 2HA GLY 64 -26.746 -15.796 4.021 438 H MET 65 H MET 65 -25.723 -12.604 4.816 439 HA MET 65 HA MET 65 -26.505 -11.725 2.132 440 HB2 MET 65 1HB MET 65 -27.484 -10.837 4.413 441 HB3 MET 65 2HB MET 65 -26.044 -9.828 4.395 442 HG2 MET 65 1HG MET 65 -26.770 -9.152 2.041 443 HG3 MET 65 2HG MET 65 -28.325 -9.868 2.457 444 HE1 MET 65 3HE MET 65 -27.027 -5.934 2.633 445 HE2 MET 65 1HE MET 65 -26.062 -6.417 4.028 446 HE3 MET 65 2HE MET 65 -25.925 -7.307 2.512 447 H VAL 66 H VAL 66 -23.841 -11.738 4.380 448 HA VAL 66 HA VAL 66 -22.250 -9.976 2.683 449 HB VAL 66 HB VAL 66 -20.576 -10.030 4.412 450 HG11 VAL 66 1HG1 VAL 66 -23.381 -9.710 5.456 451 HG12 VAL 66 2HG1 VAL 66 -21.946 -9.248 6.374 452 HG13 VAL 66 3HG1 VAL 66 -22.304 -8.458 4.838 453 HG21 VAL 66 3HG2 VAL 66 -21.297 -11.373 6.562 454 HG22 VAL 66 1HG2 VAL 66 -22.150 -12.364 5.379 455 HG23 VAL 66 2HG2 VAL 66 -20.404 -12.154 5.257 456 H ILE 67 H ILE 67 -19.839 -10.753 2.522 457 HA ILE 67 HA ILE 67 -19.914 -13.212 1.005 458 HB ILE 67 HB ILE 67 -17.684 -12.682 0.292 459 HG12 ILE 67 1HG1 ILE 67 -17.750 -10.538 2.425 460 HG13 ILE 67 2HG1 ILE 67 -16.725 -11.969 2.406 461 HG21 ILE 67 1HG2 ILE 67 -19.887 -11.066 -0.143 462 HG22 ILE 67 2HG2 ILE 67 -18.584 -9.929 0.201 463 HG23 ILE 67 3HG2 ILE 67 -18.408 -11.103 -1.103 464 HD11 ILE 67 3HD1 ILE 67 -15.572 -11.123 0.437 465 HD12 ILE 67 1HD1 ILE 67 -16.607 -9.695 0.439 466 HD13 ILE 67 2HD1 ILE 67 -15.489 -9.976 1.774 467 H LYS 68 H LYS 68 -18.200 -14.858 1.268 468 HA LYS 68 HA LYS 68 -18.262 -16.133 3.684 469 HB2 LYS 68 1HB LYS 68 -16.236 -16.197 1.464 470 HB3 LYS 68 2HB LYS 68 -16.031 -17.190 2.901 471 HG2 LYS 68 1HG LYS 68 -18.455 -17.974 2.376 472 HG3 LYS 68 2HG LYS 68 -18.099 -17.364 0.758 473 HD2 LYS 68 1HD LYS 68 -17.456 -19.586 0.610 474 HD3 LYS 68 2HD LYS 68 -15.932 -18.773 0.975 475 HE2 LYS 68 1HE LYS 68 -15.895 -20.546 2.454 476 HE3 LYS 68 2HE LYS 68 -16.574 -19.258 3.448 477 HZ1 LYS 68 3HZ LYS 68 -18.805 -20.243 2.508 478 HZ2 LYS 68 1HZ LYS 68 -18.056 -20.908 3.871 479 HZ3 LYS 68 2HZ LYS 68 -17.868 -21.644 2.360 480 H GLY 69 H GLY 69 -15.666 -13.984 2.525 481 HA2 GLY 69 1HA GLY 69 -13.965 -14.118 4.698 482 HA3 GLY 69 2HA GLY 69 -14.161 -12.694 3.688 483 H TRP 70 H TRP 70 -16.863 -12.129 4.316 484 HA TRP 70 HA TRP 70 -16.501 -10.641 6.702 485 HB2 TRP 70 1HB TRP 70 -18.763 -11.105 4.806 486 HB3 TRP 70 2HB TRP 70 -19.116 -10.391 6.378 487 HD1 TRP 70 HD1 TRP 70 -16.231 -9.674 3.868 488 HE1 TRP 70 HE1 TRP 70 -16.174 -7.136 3.444 489 HE3 TRP 70 HE3 TRP 70 -20.227 -8.282 6.737 490 HZ2 TRP 70 HZ2 TRP 70 -17.630 -4.847 4.223 491 HZ3 TRP 70 HZ3 TRP 70 -20.828 -5.898 6.844 492 HH2 TRP 70 HH2 TRP 70 -19.555 -4.218 5.613 493 H ASP 71 H ASP 71 -18.720 -13.333 5.953 494 HA ASP 71 HA ASP 71 -19.760 -13.693 8.497 495 HB2 ASP 71 1HB ASP 71 -20.590 -14.803 6.424 496 HB3 ASP 71 2HB ASP 71 -19.196 -15.878 6.482 497 H GLU 72 H GLU 72 -16.864 -15.143 7.048 498 HA GLU 72 HA GLU 72 -16.183 -16.809 9.199 499 HB2 GLU 72 1HB GLU 72 -15.216 -16.634 6.768 500 HB3 GLU 72 2HB GLU 72 -14.076 -15.519 7.507 501 HG2 GLU 72 1HG GLU 72 -13.107 -17.159 8.808 502 HG3 GLU 72 2HG GLU 72 -14.516 -18.213 8.712 503 H GLY 73 H GLY 73 -15.306 -13.453 8.479 504 HA2 GLY 73 1HA GLY 73 -13.531 -13.152 10.680 505 HA3 GLY 73 2HA GLY 73 -14.255 -11.849 9.749 506 H VAL 74 H VAL 74 -16.884 -12.045 10.195 507 HA VAL 74 HA VAL 74 -17.241 -10.895 12.709 508 HB VAL 74 HB VAL 74 -19.369 -12.273 11.067 509 HG11 VAL 74 1HG1 VAL 74 -19.618 -9.992 13.022 510 HG12 VAL 74 2HG1 VAL 74 -20.927 -10.832 12.187 511 HG13 VAL 74 3HG1 VAL 74 -19.972 -11.676 13.406 512 HG21 VAL 74 3HG2 VAL 74 -19.379 -9.447 10.748 513 HG22 VAL 74 1HG2 VAL 74 -17.753 -10.040 10.411 514 HG23 VAL 74 2HG2 VAL 74 -19.131 -10.693 9.525 515 H GLN 75 H GLN 75 -17.514 -14.235 11.664 516 HA GLN 75 HA GLN 75 -18.663 -15.138 14.143 517 HB2 GLN 75 1HB GLN 75 -17.510 -16.616 11.776 518 HB3 GLN 75 2HB GLN 75 -18.202 -17.420 13.178 519 HG2 GLN 75 1HG GLN 75 -20.357 -16.512 12.732 520 HG3 GLN 75 2HG GLN 75 -19.712 -15.457 11.475 521 HE21 GLN 75 2HE2 GLN 75 -18.167 -17.059 9.997 522 HE22 GLN 75 1HE2 GLN 75 -19.092 -18.335 9.290 523 H GLY 76 H GLY 76 -15.682 -14.029 13.427 524 HA2 GLY 76 1HA GLY 76 -14.403 -15.832 15.389 525 HA3 GLY 76 2HA GLY 76 -13.541 -15.174 14.007 526 H MET 77 H MET 77 -15.298 -12.647 14.648 527 HA MET 77 HA MET 77 -13.230 -11.361 16.195 528 HB2 MET 77 1HB MET 77 -15.775 -10.357 14.923 529 HB3 MET 77 2HB MET 77 -14.712 -9.326 15.871 530 HG2 MET 77 1HG MET 77 -13.662 -10.887 13.547 531 HG3 MET 77 2HG MET 77 -14.478 -9.343 13.313 532 HE1 MET 77 3HE MET 77 -13.505 -7.737 16.000 533 HE2 MET 77 1HE MET 77 -12.193 -6.851 15.222 534 HE3 MET 77 2HE MET 77 -13.712 -7.107 14.365 535 H LYS 78 H LYS 78 -13.650 -10.099 18.114 536 HA LYS 78 HA LYS 78 -15.925 -11.091 19.699 537 HB2 LYS 78 1HB LYS 78 -13.122 -10.583 20.714 538 HB3 LYS 78 2HB LYS 78 -14.489 -11.122 21.681 539 HG2 LYS 78 1HG LYS 78 -14.414 -13.252 20.857 540 HG3 LYS 78 2HG LYS 78 -13.688 -12.752 19.327 541 HD2 LYS 78 1HD LYS 78 -11.565 -12.349 20.450 542 HD3 LYS 78 2HD LYS 78 -12.285 -12.787 22.000 543 HE2 LYS 78 1HE LYS 78 -12.142 -14.642 19.631 544 HE3 LYS 78 2HE LYS 78 -10.930 -14.593 20.910 545 HZ1 LYS 78 3HZ LYS 78 -13.279 -16.042 20.893 546 HZ2 LYS 78 1HZ LYS 78 -13.529 -14.801 22.015 547 HZ3 LYS 78 2HZ LYS 78 -12.211 -15.846 22.190 548 H VAL 79 H VAL 79 -16.838 -9.650 21.182 549 HA VAL 79 HA VAL 79 -17.076 -7.009 20.447 550 HB VAL 79 HB VAL 79 -17.419 -8.156 23.221 551 HG11 VAL 79 1HG1 VAL 79 -17.424 -5.895 23.635 552 HG12 VAL 79 2HG1 VAL 79 -18.057 -5.494 22.038 553 HG13 VAL 79 3HG1 VAL 79 -19.126 -6.172 23.267 554 HG21 VAL 79 3HG2 VAL 79 -18.938 -8.417 20.777 555 HG22 VAL 79 1HG2 VAL 79 -19.136 -9.249 22.319 556 HG23 VAL 79 2HG2 VAL 79 -19.903 -7.683 22.057 557 H GLY 80 H GLY 80 -15.863 -5.238 20.643 558 HA2 GLY 80 1HA GLY 80 -14.372 -3.734 21.618 559 HA3 GLY 80 2HA GLY 80 -14.007 -4.933 22.850 560 H GLY 81 H GLY 81 -13.787 -6.517 19.984 561 HA2 GLY 81 1HA GLY 81 -10.867 -6.202 19.973 562 HA3 GLY 81 2HA GLY 81 -11.757 -7.565 19.310 563 H VAL 82 H VAL 82 -9.727 -5.508 18.250 564 HA VAL 82 HA VAL 82 -11.174 -5.002 15.742 565 HB VAL 82 HB VAL 82 -9.186 -3.049 16.892 566 HG11 VAL 82 1HG1 VAL 82 -10.692 -3.289 14.398 567 HG12 VAL 82 2HG1 VAL 82 -10.827 -1.706 15.165 568 HG13 VAL 82 3HG1 VAL 82 -9.239 -2.359 14.761 569 HG21 VAL 82 3HG2 VAL 82 -11.444 -1.685 17.119 570 HG22 VAL 82 1HG2 VAL 82 -12.114 -3.303 17.327 571 HG23 VAL 82 2HG2 VAL 82 -10.855 -2.723 18.417 572 H ARG 83 H ARG 83 -10.117 -5.628 13.960 573 HA ARG 83 HA ARG 83 -7.264 -5.668 13.769 574 HB2 ARG 83 1HB ARG 83 -7.078 -8.126 13.389 575 HB3 ARG 83 2HB ARG 83 -7.465 -7.693 15.049 576 HG2 ARG 83 1HG ARG 83 -9.622 -8.497 14.898 577 HG3 ARG 83 2HG ARG 83 -9.657 -8.366 13.139 578 HD2 ARG 83 1HD ARG 83 -9.502 -10.708 14.077 579 HD3 ARG 83 2HD ARG 83 -8.290 -10.273 12.872 580 HE ARG 83 HE ARG 83 -6.664 -10.480 14.476 581 HH11 ARG 83 1HH1 ARG 83 -9.791 -10.408 16.003 582 HH12 ARG 83 2HH1 ARG 83 -9.182 -10.833 17.568 583 HH21 ARG 83 1HH2 ARG 83 -5.849 -11.040 16.531 584 HH22 ARG 83 2HH2 ARG 83 -6.939 -11.191 17.868 585 H ARG 84 H ARG 84 -6.529 -6.037 11.651 586 HA ARG 84 HA ARG 84 -8.603 -5.699 9.630 587 HB2 ARG 84 1HB ARG 84 -6.633 -5.238 8.123 588 HB3 ARG 84 2HB ARG 84 -6.837 -4.115 9.461 589 HG2 ARG 84 1HG ARG 84 -5.071 -5.189 10.695 590 HG3 ARG 84 2HG ARG 84 -4.921 -6.436 9.456 591 HD2 ARG 84 1HD ARG 84 -3.181 -4.953 8.983 592 HD3 ARG 84 2HD ARG 84 -4.447 -4.506 7.842 593 HE ARG 84 HE ARG 84 -4.872 -2.882 9.989 594 HH11 ARG 84 1HH1 ARG 84 -2.156 -3.545 7.914 595 HH12 ARG 84 2HH1 ARG 84 -1.481 -1.957 8.073 596 HH21 ARG 84 1HH2 ARG 84 -3.993 -0.788 10.206 597 HH22 ARG 84 2HH2 ARG 84 -2.526 -0.391 9.377 598 H LEU 85 H LEU 85 -9.333 -7.359 8.492 599 HA LEU 85 HA LEU 85 -7.636 -9.752 8.242 600 HB2 LEU 85 1HB LEU 85 -10.629 -9.441 8.258 601 HB3 LEU 85 2HB LEU 85 -9.815 -10.934 7.795 602 HG LEU 85 HG LEU 85 -8.714 -10.484 10.234 603 HD11 LEU 85 1HD1 LEU 85 -10.309 -8.514 10.449 604 HD12 LEU 85 2HD1 LEU 85 -10.291 -9.679 11.772 605 HD13 LEU 85 3HD1 LEU 85 -11.595 -9.714 10.585 606 HD21 LEU 85 3HD2 LEU 85 -11.351 -11.882 10.038 607 HD22 LEU 85 1HD2 LEU 85 -9.896 -12.351 10.917 608 HD23 LEU 85 2HD2 LEU 85 -9.949 -12.497 9.160 609 H THR 86 H THR 86 -7.028 -10.411 6.278 610 HA THR 86 HA THR 86 -7.816 -8.834 3.977 611 HB THR 86 HB THR 86 -5.927 -11.187 3.991 612 HG1 THR 86 HG1 THR 86 -5.402 -9.415 5.525 613 HG21 THR 86 3HG2 THR 86 -5.015 -9.343 2.188 614 HG22 THR 86 1HG2 THR 86 -6.763 -9.168 2.039 615 HG23 THR 86 2HG2 THR 86 -6.009 -10.743 1.789 616 H ILE 87 H ILE 87 -9.596 -9.348 2.894 617 HA ILE 87 HA ILE 87 -10.512 -12.125 2.841 618 HB ILE 87 HB ILE 87 -11.890 -9.591 1.945 619 HG12 ILE 87 1HG1 ILE 87 -12.477 -11.397 4.300 620 HG13 ILE 87 2HG1 ILE 87 -11.579 -9.886 4.410 621 HG21 ILE 87 1HG2 ILE 87 -13.855 -11.433 2.158 622 HG22 ILE 87 2HG2 ILE 87 -13.042 -11.025 0.648 623 HG23 ILE 87 3HG2 ILE 87 -12.530 -12.437 1.572 624 HD11 ILE 87 3HD1 ILE 87 -13.457 -8.735 4.565 625 HD12 ILE 87 1HD1 ILE 87 -14.066 -9.440 3.068 626 HD13 ILE 87 2HD1 ILE 87 -14.342 -10.260 4.605 627 HA PRO 88 HA PRO 88 -8.589 -12.326 -1.226 628 HB2 PRO 88 1HB PRO 88 -8.884 -15.013 -1.477 629 HB3 PRO 88 2HB PRO 88 -7.590 -14.273 -0.527 630 HG2 PRO 88 1HG PRO 88 -10.193 -15.431 0.395 631 HG3 PRO 88 2HG PRO 88 -8.576 -15.609 1.101 632 HD2 PRO 88 1HD PRO 88 -10.418 -13.889 2.092 633 HD3 PRO 88 2HD PRO 88 -8.674 -13.562 2.156 634 HA PRO 89 HA PRO 89 -11.982 -12.556 -4.012 635 HB2 PRO 89 1HB PRO 89 -10.975 -13.941 -6.119 636 HB3 PRO 89 2HB PRO 89 -10.491 -12.284 -5.739 637 HG2 PRO 89 1HG PRO 89 -9.094 -14.856 -5.112 638 HG3 PRO 89 2HG PRO 89 -8.415 -13.330 -5.707 639 HD2 PRO 89 1HD PRO 89 -8.282 -14.068 -3.105 640 HD3 PRO 89 2HD PRO 89 -8.408 -12.371 -3.611 641 H GLN 90 H GLN 90 -10.385 -15.652 -3.402 642 HA GLN 90 HA GLN 90 -12.463 -17.293 -4.394 643 HB2 GLN 90 1HB GLN 90 -11.357 -19.076 -3.002 644 HB3 GLN 90 2HB GLN 90 -10.298 -18.256 -4.141 645 HG2 GLN 90 1HG GLN 90 -9.087 -17.241 -2.508 646 HG3 GLN 90 2HG GLN 90 -10.441 -17.190 -1.380 647 HE21 GLN 90 2HE2 GLN 90 -8.080 -17.918 -0.392 648 HE22 GLN 90 1HE2 GLN 90 -8.032 -19.614 -0.066 649 H LEU 91 H LEU 91 -12.312 -15.324 -1.676 650 HA LEU 91 HA LEU 91 -14.561 -16.773 -0.446 651 HB2 LEU 91 1HB LEU 91 -12.143 -15.555 0.796 652 HB3 LEU 91 2HB LEU 91 -13.663 -15.517 1.688 653 HG LEU 91 HG LEU 91 -13.663 -18.093 1.199 654 HD11 LEU 91 1HD1 LEU 91 -10.768 -17.333 0.883 655 HD12 LEU 91 2HD1 LEU 91 -11.781 -18.231 -0.246 656 HD13 LEU 91 3HD1 LEU 91 -11.313 -18.961 1.289 657 HD21 LEU 91 3HD2 LEU 91 -13.510 -16.921 3.407 658 HD22 LEU 91 1HD2 LEU 91 -11.755 -16.960 3.237 659 HD23 LEU 91 2HD2 LEU 91 -12.666 -18.468 3.331 660 H GLY 92 H GLY 92 -13.921 -14.233 -2.252 661 HA2 GLY 92 1HA GLY 92 -15.940 -12.561 -0.897 662 HA3 GLY 92 2HA GLY 92 -14.499 -11.843 -1.601 663 H TYR 93 H TYR 93 -14.354 -11.572 -3.810 664 HA TYR 93 HA TYR 93 -16.897 -11.673 -5.214 665 HB2 TYR 93 1HB TYR 93 -14.229 -10.420 -5.856 666 HB3 TYR 93 2HB TYR 93 -15.558 -10.452 -7.009 667 HD1 TYR 93 HD2 TYR 93 -17.872 -9.936 -5.257 668 HD2 TYR 93 HD1 TYR 93 -13.999 -8.176 -5.273 669 HE1 TYR 93 HE2 TYR 93 -18.802 -7.895 -4.247 670 HE2 TYR 93 HE1 TYR 93 -14.917 -6.131 -4.262 671 HH TYR 93 HH TYR 93 -16.730 -5.263 -3.186 672 H GLY 94 H GLY 94 -13.559 -12.440 -6.224 673 HA2 GLY 94 1HA GLY 94 -12.968 -14.688 -6.931 674 HA3 GLY 94 2HA GLY 94 -14.618 -14.878 -7.505 675 H ALA 95 H ALA 95 -13.182 -15.614 -9.396 676 HA ALA 95 HA ALA 95 -11.794 -13.743 -10.967 677 HB1 ALA 95 1HB ALA 95 -11.854 -16.331 -11.095 678 HB2 ALA 95 2HB ALA 95 -13.215 -16.074 -12.187 679 HB3 ALA 95 3HB ALA 95 -11.634 -15.398 -12.575 680 H ARG 96 H ARG 96 -15.136 -14.171 -10.432 681 HA ARG 96 HA ARG 96 -16.148 -13.250 -12.911 682 HB2 ARG 96 1HB ARG 96 -17.361 -14.430 -10.931 683 HB3 ARG 96 2HB ARG 96 -17.562 -12.800 -10.303 684 HG2 ARG 96 1HG ARG 96 -19.530 -13.158 -11.458 685 HG3 ARG 96 2HG ARG 96 -18.550 -12.269 -12.626 686 HD2 ARG 96 1HD ARG 96 -18.431 -15.245 -12.621 687 HD3 ARG 96 2HD ARG 96 -19.848 -14.456 -13.311 688 HE ARG 96 HE ARG 96 -17.281 -14.654 -14.492 689 HH11 ARG 96 1HH1 ARG 96 -19.991 -12.497 -14.142 690 HH12 ARG 96 2HH1 ARG 96 -19.692 -11.669 -15.634 691 HH21 ARG 96 1HH2 ARG 96 -16.877 -13.572 -16.459 692 HH22 ARG 96 2HH2 ARG 96 -17.921 -12.282 -16.952 693 H GLY 97 H GLY 97 -14.551 -11.661 -10.358 694 HA2 GLY 97 1HA GLY 97 -14.165 -9.447 -9.876 695 HA3 GLY 97 2HA GLY 97 -14.322 -9.214 -11.611 696 H ALA 98 H ALA 98 -15.113 -7.080 -10.698 697 HA ALA 98 HA ALA 98 -18.021 -7.255 -10.246 698 HB1 ALA 98 1HB ALA 98 -16.225 -5.086 -9.177 699 HB2 ALA 98 2HB ALA 98 -17.934 -5.338 -8.823 700 HB3 ALA 98 3HB ALA 98 -16.734 -6.494 -8.246 701 H GLY 99 H GLY 99 -17.295 -7.230 -12.799 702 HA2 GLY 99 1HA GLY 99 -17.811 -6.109 -14.747 703 HA3 GLY 99 2HA GLY 99 -18.386 -4.771 -13.763 704 H GLY 100 H GLY 100 -17.432 -3.029 -14.644 705 HA2 GLY 100 1HA GLY 100 -14.908 -2.963 -15.855 706 HA3 GLY 100 2HA GLY 100 -15.775 -1.561 -15.246 707 H VAL 101 H VAL 101 -15.734 -3.049 -12.535 708 HA VAL 101 HA VAL 101 -12.963 -2.325 -11.829 709 HB VAL 101 HB VAL 101 -14.677 -0.697 -11.000 710 HG11 VAL 101 1HG1 VAL 101 -15.590 -2.216 -8.761 711 HG12 VAL 101 2HG1 VAL 101 -16.534 -1.391 -10.002 712 HG13 VAL 101 3HG1 VAL 101 -16.019 -3.060 -10.248 713 HG21 VAL 101 3HG2 VAL 101 -12.425 -1.567 -9.813 714 HG22 VAL 101 1HG2 VAL 101 -13.430 -0.272 -9.164 715 HG23 VAL 101 2HG2 VAL 101 -13.593 -1.913 -8.539 716 H ILE 102 H ILE 102 -12.051 -3.449 -10.004 717 HA ILE 102 HA ILE 102 -11.596 -5.275 -8.718 718 HB ILE 102 HB ILE 102 -14.443 -6.176 -9.113 719 HG12 ILE 102 1HG1 ILE 102 -14.624 -3.909 -8.374 720 HG13 ILE 102 2HG1 ILE 102 -14.888 -4.928 -6.963 721 HG21 ILE 102 1HG2 ILE 102 -14.096 -7.619 -7.410 722 HG22 ILE 102 2HG2 ILE 102 -12.417 -7.472 -7.925 723 HG23 ILE 102 3HG2 ILE 102 -13.006 -6.524 -6.560 724 HD11 ILE 102 3HD1 ILE 102 -12.466 -3.306 -7.660 725 HD12 ILE 102 1HD1 ILE 102 -13.509 -3.175 -6.244 726 HD13 ILE 102 2HD1 ILE 102 -12.441 -4.567 -6.428 727 HA PRO 103 HA PRO 103 -10.988 -7.739 -12.532 728 HB2 PRO 103 1HB PRO 103 -8.389 -8.309 -11.992 729 HB3 PRO 103 2HB PRO 103 -8.901 -6.808 -12.772 730 HG2 PRO 103 1HG PRO 103 -8.204 -7.310 -9.904 731 HG3 PRO 103 2HG PRO 103 -7.756 -5.944 -10.942 732 HD2 PRO 103 1HD PRO 103 -9.766 -5.801 -9.134 733 HD3 PRO 103 2HD PRO 103 -9.792 -4.902 -10.664 734 HA PRO 104 HA PRO 104 -11.303 -11.808 -10.896 735 HB2 PRO 104 1HB PRO 104 -9.707 -13.284 -12.523 736 HB3 PRO 104 2HB PRO 104 -11.254 -12.610 -13.049 737 HG2 PRO 104 1HG PRO 104 -8.483 -11.576 -13.510 738 HG3 PRO 104 2HG PRO 104 -9.843 -11.678 -14.644 739 HD2 PRO 104 1HD PRO 104 -9.154 -9.375 -13.397 740 HD3 PRO 104 2HD PRO 104 -10.832 -9.765 -13.824 741 H ASN 105 H ASN 105 -10.495 -12.660 -9.091 742 HA ASN 105 HA ASN 105 -9.000 -13.601 -7.630 743 HB2 ASN 105 1HB ASN 105 -7.712 -14.036 -9.934 744 HB3 ASN 105 2HB ASN 105 -6.606 -12.858 -9.233 745 HD21 ASN 105 2HD2 ASN 105 -8.360 -15.821 -8.401 746 HD22 ASN 105 1HD2 ASN 105 -7.100 -16.499 -7.432 747 H ALA 106 H ALA 106 -9.498 -10.559 -8.296 748 HA ALA 106 HA ALA 106 -7.291 -9.195 -7.121 749 HB1 ALA 106 1HB ALA 106 -8.464 -7.262 -7.487 750 HB2 ALA 106 2HB ALA 106 -9.232 -8.328 -8.664 751 HB3 ALA 106 3HB ALA 106 -10.021 -8.006 -7.120 752 H THR 107 H THR 107 -6.720 -9.524 -5.071 753 HA THR 107 HA THR 107 -8.580 -10.335 -3.050 754 HB THR 107 HB THR 107 -5.722 -9.407 -2.712 755 HG1 THR 107 HG1 THR 107 -5.219 -11.611 -2.848 756 HG21 THR 107 3HG2 THR 107 -7.777 -10.399 -0.872 757 HG22 THR 107 1HG2 THR 107 -6.299 -9.497 -0.539 758 HG23 THR 107 2HG2 THR 107 -6.234 -11.245 -0.758 759 H LEU 108 H LEU 108 -9.304 -9.183 -1.267 760 HA LEU 108 HA LEU 108 -8.783 -6.291 -1.252 761 HB2 LEU 108 1HB LEU 108 -11.513 -7.445 -0.758 762 HB3 LEU 108 2HB LEU 108 -11.070 -5.756 -0.999 763 HG LEU 108 HG LEU 108 -10.857 -7.846 -3.159 764 HD11 LEU 108 1HD1 LEU 108 -13.126 -5.979 -2.500 765 HD12 LEU 108 2HD1 LEU 108 -13.168 -7.741 -2.566 766 HD13 LEU 108 3HD1 LEU 108 -12.944 -6.809 -4.046 767 HD21 LEU 108 3HD2 LEU 108 -11.127 -4.889 -3.525 768 HD22 LEU 108 1HD2 LEU 108 -10.453 -6.096 -4.620 769 HD23 LEU 108 2HD2 LEU 108 -9.553 -5.608 -3.184 770 H VAL 109 H VAL 109 -8.668 -5.347 0.743 771 HA VAL 109 HA VAL 109 -8.718 -7.188 3.030 772 HB VAL 109 HB VAL 109 -7.564 -4.449 3.252 773 HG11 VAL 109 1HG1 VAL 109 -7.590 -6.861 4.762 774 HG12 VAL 109 2HG1 VAL 109 -5.923 -6.497 4.314 775 HG13 VAL 109 3HG1 VAL 109 -6.884 -5.302 5.185 776 HG21 VAL 109 3HG2 VAL 109 -5.382 -5.372 2.406 777 HG22 VAL 109 1HG2 VAL 109 -6.296 -6.731 1.751 778 HG23 VAL 109 2HG2 VAL 109 -6.609 -5.095 1.171 779 H PHE 110 H PHE 110 -9.723 -6.606 4.979 780 HA PHE 110 HA PHE 110 -11.385 -4.214 5.015 781 HB2 PHE 110 1HB PHE 110 -12.427 -7.020 4.952 782 HB3 PHE 110 2HB PHE 110 -13.291 -5.803 5.886 783 HD1 PHE 110 HD1 PHE 110 -12.189 -6.773 2.514 784 HD2 PHE 110 HD2 PHE 110 -14.573 -4.109 4.823 785 HE1 PHE 110 HE1 PHE 110 -13.311 -6.006 0.463 786 HE2 PHE 110 HE2 PHE 110 -15.700 -3.338 2.776 787 HZ PHE 110 HZ PHE 110 -15.070 -4.287 0.593 788 H GLU 111 H GLU 111 -11.520 -3.337 6.995 789 HA GLU 111 HA GLU 111 -10.242 -4.774 9.194 790 HB2 GLU 111 1HB GLU 111 -9.420 -2.529 8.729 791 HB3 GLU 111 2HB GLU 111 -11.041 -1.873 8.912 792 HG2 GLU 111 1HG GLU 111 -10.070 -3.390 11.222 793 HG3 GLU 111 2HG GLU 111 -9.158 -1.926 10.858 794 H VAL 112 H VAL 112 -11.358 -5.646 10.809 795 HA VAL 112 HA VAL 112 -14.206 -4.947 11.072 796 HB VAL 112 HB VAL 112 -12.974 -7.440 12.207 797 HG11 VAL 112 1HG1 VAL 112 -15.307 -8.274 11.861 798 HG12 VAL 112 2HG1 VAL 112 -15.166 -6.950 13.019 799 HG13 VAL 112 3HG1 VAL 112 -15.760 -6.637 11.388 800 HG21 VAL 112 3HG2 VAL 112 -14.003 -7.039 9.401 801 HG22 VAL 112 1HG2 VAL 112 -12.369 -7.496 9.881 802 HG23 VAL 112 2HG2 VAL 112 -13.709 -8.612 10.142 803 H GLU 113 H GLU 113 -14.928 -4.070 12.910 804 HA GLU 113 HA GLU 113 -13.252 -4.247 15.316 805 HB2 GLU 113 1HB GLU 113 -12.715 -2.092 14.534 806 HB3 GLU 113 2HB GLU 113 -14.368 -1.767 14.033 807 HG2 GLU 113 1HG GLU 113 -15.079 -1.343 16.196 808 HG3 GLU 113 2HG GLU 113 -13.717 -2.199 16.917 809 H LEU 114 H LEU 114 -14.515 -5.510 16.556 810 HA LEU 114 HA LEU 114 -17.360 -5.401 16.548 811 HB2 LEU 114 1HB LEU 114 -15.576 -7.249 17.324 812 HB3 LEU 114 2HB LEU 114 -15.958 -6.537 18.891 813 HG LEU 114 HG LEU 114 -17.425 -8.317 18.775 814 HD11 LEU 114 1HD1 LEU 114 -18.606 -6.209 19.239 815 HD12 LEU 114 2HD1 LEU 114 -19.642 -7.406 18.462 816 HD13 LEU 114 3HD1 LEU 114 -18.988 -6.064 17.523 817 HD21 LEU 114 3HD2 LEU 114 -17.281 -7.838 15.878 818 HD22 LEU 114 1HD2 LEU 114 -18.841 -8.406 16.472 819 HD23 LEU 114 2HD2 LEU 114 -17.384 -9.351 16.779 820 H LEU 115 H LEU 115 -18.701 -4.145 17.672 821 HA LEU 115 HA LEU 115 -17.548 -2.339 19.676 822 HB2 LEU 115 1HB LEU 115 -20.191 -2.179 18.236 823 HB3 LEU 115 2HB LEU 115 -19.535 -0.969 19.336 824 HG LEU 115 HG LEU 115 -17.557 -1.135 17.468 825 HD11 LEU 115 1HD1 LEU 115 -19.888 -2.310 16.289 826 HD12 LEU 115 2HD1 LEU 115 -18.284 -2.072 15.597 827 HD13 LEU 115 3HD1 LEU 115 -19.497 -0.798 15.469 828 HD21 LEU 115 3HD2 LEU 115 -19.852 0.663 17.980 829 HD22 LEU 115 1HD2 LEU 115 -18.980 0.886 16.463 830 HD23 LEU 115 2HD2 LEU 115 -18.119 0.996 17.998 831 H ASP 116 H ASP 116 -20.338 -4.465 19.138 832 HA ASP 116 HA ASP 116 -20.348 -5.481 21.753 833 HB2 ASP 116 1HB ASP 116 -21.258 -2.973 21.897 834 HB3 ASP 116 2HB ASP 116 -22.763 -3.770 21.447 835 H VAL 117 H VAL 117 -22.459 -6.680 22.223 836 HA VAL 117 HA VAL 117 -23.484 -7.763 19.682 837 HB VAL 117 HB VAL 117 -23.916 -9.851 20.847 838 HG11 VAL 117 1HG1 VAL 117 -21.224 -9.681 21.805 839 HG12 VAL 117 2HG1 VAL 117 -21.842 -10.473 20.354 840 HG13 VAL 117 3HG1 VAL 117 -21.375 -8.772 20.302 841 HG21 VAL 117 3HG2 VAL 117 -24.462 -9.072 23.045 842 HG22 VAL 117 1HG2 VAL 117 -23.073 -10.151 23.178 843 HG23 VAL 117 2HG2 VAL 117 -22.845 -8.404 23.266 844 H13 JZF 130 1H3 JZF 130 -18.309 -6.367 -1.174 845 H23 JZF 130 2H3 JZF 130 -18.592 -5.787 0.457 846 H4 JZF 130 H4 JZF 130 -19.994 -4.885 -2.085 847 H15 JZF 130 1H5 JZF 130 -21.232 -3.275 -0.742 848 H25 JZF 130 2H5 JZF 130 -20.446 -3.814 0.733 849 H17 JZF 130 1H7 JZF 130 -18.126 -3.186 -0.407 850 H27 JZF 130 2H7 JZF 130 -17.612 -4.126 -1.770 851 H8 JZF 130 H8 JZF 130 -19.779 -2.370 -2.472 852 H9 JZF 130 H9 JZF 130 -17.156 -3.061 -3.691 853 H1OH JZF 130 1HO JZF 130 -17.679 -1.285 -1.030 854 H11 JZF 130 H11 JZF 130 -17.535 -4.012 -6.070 855 H112 JZF 130 1H12 JZF 130 -18.931 -1.425 -6.921 856 H212 JZF 130 2H12 JZF 130 -17.546 -2.153 -7.720 857 H13A JZF 130 H13 JZF 130 -17.004 -0.194 -6.223 858 H114 JZF 130 1H14 JZF 130 -17.031 -0.515 -3.778 859 H214 JZF 130 2H14 JZF 130 -18.624 -0.485 -4.491 860 H115 JZF 130 1H15 JZF 130 -23.259 -7.202 0.847 861 H215 JZF 130 2H15 JZF 130 -22.090 -8.483 0.526 862 H116 JZF 130 1H16 JZF 130 -22.497 -9.371 -3.583 863 H216 JZF 130 2H16 JZF 130 -21.267 -8.551 -2.576 864 H117 JZF 130 2H17 JZF 130 -21.605 -11.441 -3.123 865 H217 JZF 130 3H17 JZF 130 -20.220 -10.598 -2.402 866 H317 JZF 130 1H17 JZF 130 -21.577 -11.106 -1.383 867 H118 JZF 130 1H18 JZF 130 -20.448 -3.806 -6.858 868 H218 JZF 130 2H18 JZF 130 -19.222 -3.832 -8.132 869 H318 JZF 130 3H18 JZF 130 -19.342 -5.183 -6.991 870 H119 JZF 130 3H19 JZF 130 -15.653 -2.876 -5.911 871 H219 JZF 130 1H19 JZF 130 -15.052 -1.355 -6.576 872 H319 JZF 130 2H19 JZF 130 -15.171 -1.565 -4.829
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