NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | in_recoord | stage | position | program | type |
10530 | 1pux | 5899 | cing | recoord | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 1H MET 1 1H MET 1 -6.260 -10.452 21.310 2 HA MET 1 HA MET 1 -5.440 -9.563 19.272 3 1HB MET 1 1HB MET 1 -5.765 -12.552 19.616 4 2HB MET 1 2HB MET 1 -5.087 -11.998 18.098 5 1HG MET 1 1HG MET 1 -3.480 -10.546 19.597 6 2HG MET 1 2HG MET 1 -3.983 -11.602 20.902 7 1HE MET 1 1HE MET 1 -0.626 -11.915 19.952 8 2HE MET 1 2HE MET 1 -0.706 -12.120 18.185 9 3HE MET 1 3HE MET 1 -1.532 -10.747 18.960 10 H MET 2 H MET 2 -5.469 -9.763 16.810 11 HA MET 2 HA MET 2 -8.184 -10.307 15.896 12 1HB MET 2 1HB MET 2 -6.606 -7.805 15.847 13 2HB MET 2 2HB MET 2 -7.116 -8.264 14.234 14 1HG MET 2 1HG MET 2 -8.809 -6.809 15.346 15 2HG MET 2 2HG MET 2 -9.474 -8.384 14.962 16 1HE MET 2 1HE MET 2 -10.428 -10.119 17.132 17 2HE MET 2 2HE MET 2 -11.309 -8.835 17.995 18 3HE MET 2 3HE MET 2 -11.156 -8.774 16.222 19 H ASN 3 H ASN 3 -7.781 -9.736 13.149 20 HA ASN 3 HA ASN 3 -5.487 -11.333 12.417 21 1HB ASN 3 1HB ASN 3 -8.287 -12.226 12.297 22 2HB ASN 3 2HB ASN 3 -7.577 -12.212 10.695 23 1HD2 ASN 3 1HD2 ASN 3 -7.593 -14.433 10.548 24 2HD2 ASN 3 2HD2 ASN 3 -6.489 -15.458 11.404 25 H GLU 4 H GLU 4 -4.743 -9.211 11.579 26 HA GLU 4 HA GLU 4 -5.336 -8.810 8.927 27 1HB GLU 4 1HB GLU 4 -7.507 -7.924 9.685 28 2HB GLU 4 2HB GLU 4 -6.707 -6.807 10.774 29 1HG GLU 4 1HG GLU 4 -7.180 -5.469 8.878 30 2HG GLU 4 2HG GLU 4 -5.491 -5.884 8.664 31 H LYS 5 H LYS 5 -3.780 -7.421 7.982 32 HA LYS 5 HA LYS 5 -2.246 -5.729 9.775 33 1HB LYS 5 1HB LYS 5 -1.167 -8.182 8.409 34 2HB LYS 5 2HB LYS 5 -0.129 -6.792 8.654 35 1HG LYS 5 1HG LYS 5 -0.376 -6.881 11.043 36 2HG LYS 5 2HG LYS 5 -1.769 -7.940 10.944 37 1HD LYS 5 1HD LYS 5 -0.433 -9.768 11.012 38 2HD LYS 5 2HD LYS 5 0.420 -9.235 9.577 39 1HE LYS 5 1HE LYS 5 2.225 -9.092 10.984 40 2HE LYS 5 2HE LYS 5 1.530 -7.547 11.434 41 1HZ LYS 5 1HZ LYS 5 0.930 -10.083 12.793 42 2HZ LYS 5 2HZ LYS 5 2.002 -8.973 13.329 43 3HZ LYS 5 3HZ LYS 5 0.415 -8.600 13.245 44 H ILE 6 H ILE 6 -0.789 -4.244 8.529 45 HA ILE 6 HA ILE 6 -1.181 -4.100 5.705 46 HB ILE 6 HB ILE 6 -2.948 -2.622 7.493 47 1HG1 ILE 6 1HG1 ILE 6 -3.587 -2.294 4.742 48 2HG1 ILE 6 2HG1 ILE 6 -2.977 -3.926 4.931 49 1HG2 ILE 6 1HG2 ILE 6 -2.887 -0.526 6.136 50 2HG2 ILE 6 2HG2 ILE 6 -1.458 -0.776 7.168 51 3HG2 ILE 6 3HG2 ILE 6 -1.359 -1.092 5.419 52 1HD1 ILE 6 1HD1 ILE 6 -4.906 -2.932 7.015 53 2HD1 ILE 6 2HD1 ILE 6 -5.551 -3.320 5.402 54 3HD1 ILE 6 3HD1 ILE 6 -4.704 -4.569 6.346 55 H LEU 7 H LEU 7 0.268 -2.558 4.721 56 HA LEU 7 HA LEU 7 2.169 -1.396 6.631 57 1HB LEU 7 1HB LEU 7 2.704 -3.600 5.119 58 2HB LEU 7 2HB LEU 7 3.253 -2.322 4.053 59 HG LEU 7 HG LEU 7 4.458 -1.498 6.305 60 1HD1 LEU 7 1HD1 LEU 7 3.397 -3.571 7.456 61 2HD1 LEU 7 2HD1 LEU 7 4.701 -4.474 6.649 62 3HD1 LEU 7 3HD1 LEU 7 5.098 -3.161 7.784 63 1HD2 LEU 7 1HD2 LEU 7 5.213 -2.804 3.908 64 2HD2 LEU 7 2HD2 LEU 7 6.211 -1.795 4.982 65 3HD2 LEU 7 3HD2 LEU 7 6.137 -3.556 5.231 66 H ILE 8 H ILE 8 3.043 0.633 6.051 67 HA ILE 8 HA ILE 8 1.847 1.807 3.641 68 HB ILE 8 HB ILE 8 1.958 2.894 6.442 69 1HG1 ILE 8 1HG1 ILE 8 -0.407 3.171 4.658 70 2HG1 ILE 8 2HG1 ILE 8 -0.018 1.547 5.190 71 1HG2 ILE 8 1HG2 ILE 8 2.403 4.363 3.994 72 2HG2 ILE 8 2HG2 ILE 8 0.891 4.885 4.776 73 3HG2 ILE 8 3HG2 ILE 8 2.423 4.927 5.682 74 1HD1 ILE 8 1HD1 ILE 8 -1.183 3.751 6.711 75 2HD1 ILE 8 2HD1 ILE 8 -1.062 2.029 7.142 76 3HD1 ILE 8 3HD1 ILE 8 0.283 3.135 7.510 77 H VAL 9 H VAL 9 3.220 3.017 2.362 78 HA VAL 9 HA VAL 9 5.861 3.606 3.455 79 HB VAL 9 HB VAL 9 5.489 2.292 0.766 80 1HG1 VAL 9 1HG1 VAL 9 7.557 3.278 0.670 81 2HG1 VAL 9 2HG1 VAL 9 7.807 3.191 2.430 82 3HG1 VAL 9 3HG1 VAL 9 8.003 1.732 1.430 83 1HG2 VAL 9 1HG2 VAL 9 6.679 0.350 2.226 84 2HG2 VAL 9 2HG2 VAL 9 5.624 1.067 3.468 85 3HG2 VAL 9 3HG2 VAL 9 4.923 0.444 1.954 86 H ASP 10 H ASP 10 6.568 5.620 2.875 87 HA ASP 10 HA ASP 10 6.450 7.648 2.102 88 1HB ASP 10 1HB ASP 10 7.162 6.243 0.026 89 2HB ASP 10 2HB ASP 10 5.524 6.473 -0.551 90 H ASP 11 H ASP 11 4.902 9.232 0.560 91 HA ASP 11 HA ASP 11 2.949 10.116 0.195 92 1HB ASP 11 1HB ASP 11 2.340 7.702 -0.561 93 2HB ASP 11 2HB ASP 11 1.576 7.520 1.006 94 H GLN 12 H GLN 12 4.155 9.074 3.066 95 HA GLN 12 HA GLN 12 1.949 9.246 4.781 96 1HB GLN 12 1HB GLN 12 3.866 9.650 6.521 97 2HB GLN 12 2HB GLN 12 3.778 8.105 5.699 98 1HG GLN 12 1HG GLN 12 5.702 8.480 4.485 99 2HG GLN 12 2HG GLN 12 5.356 10.183 4.255 100 1HE2 GLN 12 1HE2 GLN 12 5.206 11.350 6.545 101 2HE2 GLN 12 2HE2 GLN 12 6.606 11.146 7.545 102 H TYR 13 H TYR 13 0.747 11.047 5.183 103 HA TYR 13 HA TYR 13 2.119 13.528 5.739 104 1HB TYR 13 1HB TYR 13 1.145 12.889 3.146 105 2HB TYR 13 2HB TYR 13 -0.180 13.796 3.849 106 HD1 TYR 13 HD1 TYR 13 3.386 13.957 2.865 107 HD2 TYR 13 HD2 TYR 13 -0.020 16.172 4.207 108 HE1 TYR 13 HE1 TYR 13 4.574 16.135 2.309 109 HE2 TYR 13 HE2 TYR 13 1.180 18.342 3.647 110 HH TYR 13 HH TYR 13 3.573 19.078 3.461 111 H GLY 14 H GLY 14 0.448 11.474 7.165 112 1HA GLY 14 1HA GLY 14 -0.893 12.014 9.024 113 2HA GLY 14 2HA GLY 14 -1.604 13.346 8.135 114 H ILE 15 H ILE 15 -1.394 10.948 5.847 115 HA ILE 15 HA ILE 15 -4.176 10.232 6.272 116 HB ILE 15 HB ILE 15 -2.285 10.006 3.937 117 1HG1 ILE 15 1HG1 ILE 15 -4.537 11.387 3.151 118 2HG1 ILE 15 2HG1 ILE 15 -4.349 11.912 4.812 119 1HG2 ILE 15 1HG2 ILE 15 -4.010 8.991 2.636 120 2HG2 ILE 15 2HG2 ILE 15 -3.791 8.008 4.104 121 3HG2 ILE 15 3HG2 ILE 15 -5.178 9.116 3.973 122 1HD1 ILE 15 1HD1 ILE 15 -2.126 11.948 2.718 123 2HD1 ILE 15 2HD1 ILE 15 -3.080 13.361 3.228 124 3HD1 ILE 15 3HD1 ILE 15 -2.000 12.552 4.388 125 H ARG 16 H ARG 16 -0.891 8.826 6.195 126 HA ARG 16 HA ARG 16 -1.565 6.198 6.037 127 1HB ARG 16 1HB ARG 16 0.593 5.925 7.544 128 2HB ARG 16 2HB ARG 16 0.749 6.630 5.948 129 1HG ARG 16 1HG ARG 16 1.005 8.823 6.784 130 2HG ARG 16 2HG ARG 16 0.185 8.459 8.290 131 1HD ARG 16 1HD ARG 16 2.495 6.737 8.122 132 2HD ARG 16 2HD ARG 16 3.018 8.362 7.727 133 HE ARG 16 HE ARG 16 1.923 7.448 10.313 134 1HH1 ARG 16 1HH1 ARG 16 2.830 10.189 8.302 135 2HH1 ARG 16 2HH1 ARG 16 2.962 11.287 9.636 136 1HH2 ARG 16 1HH2 ARG 16 2.097 8.895 12.073 137 2HH2 ARG 16 2HH2 ARG 16 2.542 10.546 11.795 138 H ILE 17 H ILE 17 -1.644 8.452 8.823 139 HA ILE 17 HA ILE 17 -2.059 6.434 10.772 140 HB ILE 17 HB ILE 17 -2.568 9.410 10.821 141 1HG1 ILE 17 1HG1 ILE 17 -0.248 8.067 12.159 142 2HG1 ILE 17 2HG1 ILE 17 -0.175 8.340 10.429 143 1HG2 ILE 17 1HG2 ILE 17 -3.205 7.326 12.732 144 2HG2 ILE 17 2HG2 ILE 17 -2.052 8.500 13.410 145 3HG2 ILE 17 3HG2 ILE 17 -3.608 9.060 12.752 146 1HD1 ILE 17 1HD1 ILE 17 0.257 10.540 10.736 147 2HD1 ILE 17 2HD1 ILE 17 -1.194 10.728 11.749 148 3HD1 ILE 17 3HD1 ILE 17 0.346 10.224 12.485 149 H LEU 18 H LEU 18 -4.196 8.633 8.866 150 HA LEU 18 HA LEU 18 -6.580 8.186 10.037 151 1HB LEU 18 1HB LEU 18 -5.877 9.547 7.948 152 2HB LEU 18 2HB LEU 18 -6.301 8.104 7.049 153 HG LEU 18 HG LEU 18 -8.552 8.370 8.516 154 1HD1 LEU 18 1HD1 LEU 18 -7.936 10.346 9.704 155 2HD1 LEU 18 2HD1 LEU 18 -7.449 11.172 8.204 156 3HD1 LEU 18 3HD1 LEU 18 -9.165 10.802 8.500 157 1HD2 LEU 18 1HD2 LEU 18 -9.198 8.260 6.390 158 2HD2 LEU 18 2HD2 LEU 18 -9.065 10.035 6.349 159 3HD2 LEU 18 3HD2 LEU 18 -7.699 9.027 5.813 160 H LEU 19 H LEU 19 -5.140 6.096 7.433 161 HA LEU 19 HA LEU 19 -7.152 4.123 7.777 162 1HB LEU 19 1HB LEU 19 -5.586 2.786 6.309 163 2HB LEU 19 2HB LEU 19 -6.256 4.263 5.646 164 HG LEU 19 HG LEU 19 -3.717 4.820 6.916 165 1HD1 LEU 19 1HD1 LEU 19 -2.938 2.652 6.563 166 2HD1 LEU 19 2HD1 LEU 19 -3.803 2.484 5.016 167 3HD1 LEU 19 3HD1 LEU 19 -2.374 3.540 5.127 168 1HD2 LEU 19 1HD2 LEU 19 -4.127 4.928 3.958 169 2HD2 LEU 19 2HD2 LEU 19 -5.134 5.965 4.997 170 3HD2 LEU 19 3HD2 LEU 19 -3.360 6.100 5.057 171 H ASN 20 H ASN 20 -4.135 4.921 9.370 172 HA ASN 20 HA ASN 20 -3.473 2.384 10.262 173 1HB ASN 20 1HB ASN 20 -2.046 4.514 10.374 174 2HB ASN 20 2HB ASN 20 -3.027 5.034 11.730 175 1HD2 ASN 20 1HD2 ASN 20 -0.750 5.010 12.605 176 2HD2 ASN 20 2HD2 ASN 20 -0.218 3.575 13.418 177 H GLU 21 H GLU 21 -5.077 5.166 12.005 178 HA GLU 21 HA GLU 21 -5.717 3.857 14.284 179 1HB GLU 21 1HB GLU 21 -5.988 6.308 13.860 180 2HB GLU 21 2HB GLU 21 -7.392 5.976 12.865 181 1HG GLU 21 1HG GLU 21 -8.703 5.268 14.706 182 2HG GLU 21 2HG GLU 21 -7.304 4.894 15.692 183 H VAL 22 H VAL 22 -7.185 3.577 11.078 184 HA VAL 22 HA VAL 22 -9.627 2.441 11.929 185 HB VAL 22 HB VAL 22 -8.086 2.520 9.343 186 1HG1 VAL 22 1HG1 VAL 22 -9.240 0.787 8.542 187 2HG1 VAL 22 2HG1 VAL 22 -10.144 0.629 10.067 188 3HG1 VAL 22 3HG1 VAL 22 -10.737 1.717 8.789 189 1HG2 VAL 22 1HG2 VAL 22 -10.185 4.120 10.641 190 2HG2 VAL 22 2HG2 VAL 22 -9.045 4.554 9.345 191 3HG2 VAL 22 3HG2 VAL 22 -10.551 3.688 8.954 192 H PHE 23 H PHE 23 -6.700 0.923 10.385 193 HA PHE 23 HA PHE 23 -7.556 -1.683 10.957 194 1HB PHE 23 1HB PHE 23 -4.858 -0.331 10.381 195 2HB PHE 23 2HB PHE 23 -5.004 -2.073 10.494 196 HD1 PHE 23 HD1 PHE 23 -7.565 -2.544 9.097 197 HD2 PHE 23 HD2 PHE 23 -4.366 0.077 8.147 198 HE1 PHE 23 HE1 PHE 23 -8.200 -2.649 6.670 199 HE2 PHE 23 HE2 PHE 23 -5.001 -0.027 5.721 200 HZ PHE 23 HZ PHE 23 -6.910 -1.389 5.011 201 H ASN 24 H ASN 24 -5.678 0.736 12.784 202 HA ASN 24 HA ASN 24 -4.604 -1.098 14.605 203 1HB ASN 24 1HB ASN 24 -4.093 1.502 14.065 204 2HB ASN 24 2HB ASN 24 -5.198 1.762 15.400 205 1HD2 ASN 24 1HD2 ASN 24 -4.628 1.266 17.458 206 2HD2 ASN 24 2HD2 ASN 24 -3.043 0.768 17.948 207 H LYS 25 H LYS 25 -7.596 0.885 14.382 208 HA LYS 25 HA LYS 25 -8.499 0.727 16.968 209 1HB LYS 25 1HB LYS 25 -9.635 1.239 14.310 210 2HB LYS 25 2HB LYS 25 -10.793 0.551 15.430 211 1HG LYS 25 1HG LYS 25 -10.036 2.311 17.139 212 2HG LYS 25 2HG LYS 25 -9.107 3.059 15.854 213 1HD LYS 25 1HD LYS 25 -10.973 3.913 14.815 214 2HD LYS 25 2HD LYS 25 -11.928 2.474 15.115 215 1HE LYS 25 1HE LYS 25 -11.987 3.228 17.605 216 2HE LYS 25 2HE LYS 25 -11.368 4.767 17.041 217 1HZ LYS 25 1HZ LYS 25 -13.976 3.852 16.951 218 2HZ LYS 25 2HZ LYS 25 -13.400 5.291 16.436 219 3HZ LYS 25 3HZ LYS 25 -13.482 4.028 15.404 220 H GLU 26 H GLU 26 -8.178 -1.791 14.533 221 HA GLU 26 HA GLU 26 -9.925 -3.531 16.025 222 1HB GLU 26 1HB GLU 26 -8.316 -4.019 13.479 223 2HB GLU 26 2HB GLU 26 -9.457 -5.152 14.177 224 1HG GLU 26 1HG GLU 26 -10.269 -2.310 13.437 225 2HG GLU 26 2HG GLU 26 -10.322 -3.617 12.271 226 H GLY 27 H GLY 27 -6.549 -2.687 15.737 227 1HA GLY 27 1HA GLY 27 -5.059 -3.365 17.454 228 2HA GLY 27 2HA GLY 27 -5.871 -4.915 17.545 229 H TYR 28 H TYR 28 -5.605 -3.874 14.279 230 HA TYR 28 HA TYR 28 -3.895 -5.990 13.599 231 1HB TYR 28 1HB TYR 28 -4.574 -3.354 12.153 232 2HB TYR 28 2HB TYR 28 -4.043 -4.825 11.363 233 HD1 TYR 28 HD1 TYR 28 -6.447 -3.566 10.392 234 HD2 TYR 28 HD2 TYR 28 -5.985 -6.280 13.667 235 HE1 TYR 28 HE1 TYR 28 -8.867 -4.301 10.133 236 HE2 TYR 28 HE2 TYR 28 -8.406 -7.006 13.397 237 HH TYR 28 HH TYR 28 -10.536 -5.848 12.441 238 H GLN 29 H GLN 29 -1.729 -5.985 12.777 239 HA GLN 29 HA GLN 29 -0.159 -3.897 14.004 240 1HB GLN 29 1HB GLN 29 0.160 -6.695 13.667 241 2HB GLN 29 2HB GLN 29 1.384 -5.971 12.643 242 1HG GLN 29 1HG GLN 29 2.324 -4.714 14.494 243 2HG GLN 29 2HG GLN 29 0.961 -5.089 15.530 244 1HE2 GLN 29 1HE2 GLN 29 2.172 -6.031 17.113 245 2HE2 GLN 29 2HE2 GLN 29 2.955 -7.568 16.957 246 H THR 30 H THR 30 0.459 -2.147 12.819 247 HA THR 30 HA THR 30 0.924 -2.579 9.942 248 HB THR 30 HB THR 30 -0.046 -0.282 9.630 249 HG1 THR 30 HG1 THR 30 0.479 0.396 11.856 250 1HG2 THR 30 1HG2 THR 30 -1.588 -2.575 10.721 251 2HG2 THR 30 2HG2 THR 30 -2.370 -1.000 10.997 252 3HG2 THR 30 3HG2 THR 30 -1.968 -1.517 9.342 253 H PHE 31 H PHE 31 2.610 -1.377 8.967 254 HA PHE 31 HA PHE 31 4.335 0.032 10.857 255 1HB PHE 31 1HB PHE 31 4.718 -2.590 9.735 256 2HB PHE 31 2HB PHE 31 5.776 -1.538 8.816 257 HD1 PHE 31 HD1 PHE 31 5.071 -2.921 12.137 258 HD2 PHE 31 HD2 PHE 31 7.696 -0.496 9.849 259 HE1 PHE 31 HE1 PHE 31 6.769 -3.018 13.983 260 HE2 PHE 31 HE2 PHE 31 9.395 -0.593 11.695 261 HZ PHE 31 HZ PHE 31 8.911 -1.853 13.740 262 H GLN 32 H GLN 32 6.077 1.317 9.675 263 HA GLN 32 HA GLN 32 5.075 2.084 7.045 264 1HB GLN 32 1HB GLN 32 6.143 3.917 9.237 265 2HB GLN 32 2HB GLN 32 5.768 4.439 7.607 266 1HG GLN 32 1HG GLN 32 3.463 4.235 7.910 267 2HG GLN 32 2HG GLN 32 3.617 2.938 9.079 268 1HE2 GLN 32 1HE2 GLN 32 2.013 4.233 10.218 269 2HE2 GLN 32 2HE2 GLN 32 2.526 5.502 11.279 270 H ALA 33 H ALA 33 6.737 2.970 5.560 271 HA ALA 33 HA ALA 33 9.481 2.395 6.382 272 1HB ALA 33 1HB ALA 33 8.891 1.532 3.640 273 2HB ALA 33 2HB ALA 33 9.757 0.680 4.941 274 3HB ALA 33 3HB ALA 33 7.980 0.608 4.859 275 H ALA 34 H ALA 34 11.047 3.274 4.629 276 HA ALA 34 HA ALA 34 9.844 5.613 3.327 277 1HB ALA 34 1HB ALA 34 12.021 6.803 4.004 278 2HB ALA 34 2HB ALA 34 10.825 6.524 5.292 279 3HB ALA 34 3HB ALA 34 12.256 5.472 5.163 280 H ASN 35 H ASN 35 10.191 3.202 2.002 281 HA ASN 35 HA ASN 35 11.573 3.881 -0.178 282 1HB ASN 35 1HB ASN 35 13.419 3.021 1.935 283 2HB ASN 35 2HB ASN 35 13.518 1.928 0.569 284 1HD2 ASN 35 1HD2 ASN 35 15.669 2.759 0.338 285 2HD2 ASN 35 2HD2 ASN 35 15.964 4.232 -0.524 286 H GLY 36 H GLY 36 12.495 1.531 -1.288 287 1HA GLY 36 1HA GLY 36 10.163 -0.162 -1.240 288 2HA GLY 36 2HA GLY 36 11.574 -0.304 -2.269 289 H LEU 37 H LEU 37 13.732 -0.770 -0.825 290 HA LEU 37 HA LEU 37 13.523 -3.352 0.048 291 1HB LEU 37 1HB LEU 37 15.518 -1.453 -0.300 292 2HB LEU 37 2HB LEU 37 15.624 -1.858 1.402 293 HG LEU 37 HG LEU 37 15.657 -3.910 -0.826 294 1HD1 LEU 37 1HD1 LEU 37 18.122 -4.064 -0.260 295 2HD1 LEU 37 2HD1 LEU 37 17.608 -2.616 -1.158 296 3HD1 LEU 37 3HD1 LEU 37 17.932 -2.512 0.589 297 1HD2 LEU 37 1HD2 LEU 37 15.431 -5.416 0.783 298 2HD2 LEU 37 2HD2 LEU 37 16.932 -4.826 1.536 299 3HD2 LEU 37 3HD2 LEU 37 15.364 -4.130 2.012 300 H GLN 38 H GLN 38 13.722 -0.369 2.119 301 HA GLN 38 HA GLN 38 13.480 -1.570 4.517 302 1HB GLN 38 1HB GLN 38 13.010 1.096 3.409 303 2HB GLN 38 2HB GLN 38 11.900 0.769 4.725 304 1HG GLN 38 1HG GLN 38 14.173 -0.188 5.865 305 2HG GLN 38 2HG GLN 38 14.899 0.974 4.772 306 1HE2 GLN 38 1HE2 GLN 38 15.277 2.840 5.662 307 2HE2 GLN 38 2HE2 GLN 38 14.321 3.658 6.853 308 H ALA 39 H ALA 39 10.984 -1.082 2.038 309 HA ALA 39 HA ALA 39 8.842 -1.763 3.844 310 1HB ALA 39 1HB ALA 39 8.598 -0.121 1.978 311 2HB ALA 39 2HB ALA 39 8.880 -1.440 0.817 312 3HB ALA 39 3HB ALA 39 7.442 -1.470 1.866 313 H LEU 40 H LEU 40 11.009 -3.318 1.491 314 HA LEU 40 HA LEU 40 9.488 -5.640 1.102 315 1HB LEU 40 1HB LEU 40 12.375 -4.900 0.765 316 2HB LEU 40 2HB LEU 40 11.861 -6.563 0.563 317 HG LEU 40 HG LEU 40 11.021 -4.153 -1.056 318 1HD1 LEU 40 1HD1 LEU 40 12.815 -4.804 -2.222 319 2HD1 LEU 40 2HD1 LEU 40 12.888 -6.388 -1.415 320 3HD1 LEU 40 3HD1 LEU 40 11.783 -6.140 -2.788 321 1HD2 LEU 40 1HD2 LEU 40 9.597 -6.708 -0.628 322 2HD2 LEU 40 2HD2 LEU 40 8.992 -5.122 -1.163 323 3HD2 LEU 40 3HD2 LEU 40 9.795 -6.207 -2.324 324 H ASP 41 H ASP 41 12.025 -4.733 3.506 325 HA ASP 41 HA ASP 41 12.036 -7.272 4.691 326 1HB ASP 41 1HB ASP 41 13.802 -5.380 4.832 327 2HB ASP 41 2HB ASP 41 12.765 -4.633 6.031 328 H ILE 42 H ILE 42 10.600 -4.041 5.569 329 HA ILE 42 HA ILE 42 9.335 -4.907 7.903 330 HB ILE 42 HB ILE 42 8.869 -2.599 6.026 331 1HG1 ILE 42 1HG1 ILE 42 10.979 -2.900 7.536 332 2HG1 ILE 42 2HG1 ILE 42 10.178 -1.344 7.439 333 1HG2 ILE 42 1HG2 ILE 42 7.673 -1.896 8.410 334 2HG2 ILE 42 2HG2 ILE 42 6.834 -2.375 6.915 335 3HG2 ILE 42 3HG2 ILE 42 7.154 -3.583 8.182 336 1HD1 ILE 42 1HD1 ILE 42 9.020 -3.097 9.520 337 2HD1 ILE 42 2HD1 ILE 42 10.737 -2.713 9.790 338 3HD1 ILE 42 3HD1 ILE 42 9.547 -1.400 9.628 339 H VAL 43 H VAL 43 8.657 -5.464 4.529 340 HA VAL 43 HA VAL 43 5.869 -5.796 4.734 341 HB VAL 43 HB VAL 43 8.029 -6.307 2.802 342 1HG1 VAL 43 1HG1 VAL 43 5.515 -8.005 2.801 343 2HG1 VAL 43 2HG1 VAL 43 6.552 -7.762 1.374 344 3HG1 VAL 43 3HG1 VAL 43 7.207 -8.559 2.825 345 1HG2 VAL 43 1HG2 VAL 43 5.342 -5.688 1.806 346 2HG2 VAL 43 2HG2 VAL 43 5.900 -4.556 3.061 347 3HG2 VAL 43 3HG2 VAL 43 6.875 -4.809 1.594 348 H THR 44 H THR 44 8.595 -8.203 4.679 349 HA THR 44 HA THR 44 6.859 -10.350 5.379 350 HB THR 44 HB THR 44 9.911 -10.120 5.498 351 HG1 THR 44 HG1 THR 44 9.708 -10.627 3.257 352 1HG2 THR 44 1HG2 THR 44 8.111 -12.512 4.866 353 2HG2 THR 44 2HG2 THR 44 9.879 -12.521 5.067 354 3HG2 THR 44 3HG2 THR 44 8.826 -12.233 6.472 355 H LYS 45 H LYS 45 8.875 -8.031 7.185 356 HA LYS 45 HA LYS 45 8.981 -9.390 9.591 357 1HB LYS 45 1HB LYS 45 9.882 -6.990 8.621 358 2HB LYS 45 2HB LYS 45 8.658 -6.460 9.758 359 1HG LYS 45 1HG LYS 45 10.162 -8.617 10.976 360 2HG LYS 45 2HG LYS 45 11.297 -7.449 10.329 361 1HD LYS 45 1HD LYS 45 10.282 -5.632 11.589 362 2HD LYS 45 2HD LYS 45 8.915 -6.628 12.047 363 1HE LYS 45 1HE LYS 45 11.811 -7.130 12.892 364 2HE LYS 45 2HE LYS 45 10.580 -6.398 13.903 365 1HZ LYS 45 1HZ LYS 45 10.999 -9.124 13.320 366 2HZ LYS 45 2HZ LYS 45 10.079 -8.449 14.488 367 3HZ LYS 45 3HZ LYS 45 9.456 -8.697 12.999 368 H GLU 46 H GLU 46 6.508 -7.029 8.376 369 HA GLU 46 HA GLU 46 4.847 -7.796 10.615 370 1HB GLU 46 1HB GLU 46 4.871 -5.509 8.652 371 2HB GLU 46 2HB GLU 46 3.351 -5.926 9.416 372 1HG GLU 46 1HG GLU 46 4.396 -4.262 10.819 373 2HG GLU 46 2HG GLU 46 4.522 -5.787 11.673 374 H ARG 47 H ARG 47 5.514 -8.967 7.578 375 HA ARG 47 HA ARG 47 4.246 -9.763 5.905 376 1HB ARG 47 1HB ARG 47 3.218 -11.953 6.709 377 2HB ARG 47 2HB ARG 47 4.872 -11.700 7.230 378 1HG ARG 47 1HG ARG 47 4.252 -11.807 9.408 379 2HG ARG 47 2HG ARG 47 3.112 -10.495 9.188 380 1HD ARG 47 1HD ARG 47 1.845 -12.420 9.945 381 2HD ARG 47 2HD ARG 47 1.445 -12.176 8.256 382 HE ARG 47 HE ARG 47 3.652 -13.943 8.298 383 1HH1 ARG 47 1HH1 ARG 47 0.318 -13.920 9.422 384 2HH1 ARG 47 2HH1 ARG 47 0.129 -15.637 9.295 385 1HH2 ARG 47 1HH2 ARG 47 3.404 -16.209 8.131 386 2HH2 ARG 47 2HH2 ARG 47 1.896 -16.948 8.556 387 HA PRO 48 HA PRO 48 0.223 -7.870 7.072 388 1HB PRO 48 1HB PRO 48 0.257 -5.723 5.381 389 2HB PRO 48 2HB PRO 48 0.757 -5.630 7.058 390 1HG PRO 48 1HG PRO 48 2.433 -5.656 4.623 391 2HG PRO 48 2HG PRO 48 2.860 -5.145 6.244 392 1HD PRO 48 1HD PRO 48 3.591 -7.611 4.973 393 2HD PRO 48 2HD PRO 48 3.919 -7.149 6.632 394 H ASP 49 H ASP 49 -1.803 -7.598 5.831 395 HA ASP 49 HA ASP 49 -1.628 -9.487 3.665 396 1HB ASP 49 1HB ASP 49 -3.810 -8.346 5.400 397 2HB ASP 49 2HB ASP 49 -4.274 -8.922 3.811 398 H LEU 50 H LEU 50 -1.111 -6.256 3.962 399 HA LEU 50 HA LEU 50 -1.692 -5.706 1.251 400 1HB LEU 50 1HB LEU 50 -3.853 -5.321 2.974 401 2HB LEU 50 2HB LEU 50 -3.181 -3.718 2.751 402 HG LEU 50 HG LEU 50 -3.242 -4.731 0.167 403 1HD1 LEU 50 1HD1 LEU 50 -4.528 -6.663 0.756 404 2HD1 LEU 50 2HD1 LEU 50 -5.694 -5.677 1.672 405 3HD1 LEU 50 3HD1 LEU 50 -5.597 -5.524 -0.099 406 1HD2 LEU 50 1HD2 LEU 50 -5.005 -2.865 1.733 407 2HD2 LEU 50 2HD2 LEU 50 -3.793 -2.501 0.482 408 3HD2 LEU 50 3HD2 LEU 50 -5.351 -3.230 0.026 409 H VAL 51 H VAL 51 -0.594 -3.814 0.541 410 HA VAL 51 HA VAL 51 0.823 -2.343 2.632 411 HB VAL 51 HB VAL 51 2.167 -3.482 0.177 412 1HG1 VAL 51 1HG1 VAL 51 2.915 -1.517 2.190 413 2HG1 VAL 51 2HG1 VAL 51 4.058 -2.881 2.149 414 3HG1 VAL 51 3HG1 VAL 51 3.724 -1.955 0.666 415 1HG2 VAL 51 1HG2 VAL 51 2.042 -5.448 1.287 416 2HG2 VAL 51 2HG2 VAL 51 3.359 -4.758 2.266 417 3HG2 VAL 51 3HG2 VAL 51 1.678 -4.668 2.845 418 H LEU 52 H LEU 52 1.160 -0.161 2.142 419 HA LEU 52 HA LEU 52 0.090 0.674 -0.464 420 1HB LEU 52 1HB LEU 52 -1.570 1.450 0.847 421 2HB LEU 52 2HB LEU 52 -0.572 1.520 2.285 422 HG LEU 52 HG LEU 52 -0.117 3.508 0.080 423 1HD1 LEU 52 1HD1 LEU 52 -1.772 5.020 1.064 424 2HD1 LEU 52 2HD1 LEU 52 -2.532 3.541 0.428 425 3HD1 LEU 52 3HD1 LEU 52 -2.290 3.734 2.181 426 1HD2 LEU 52 1HD2 LEU 52 0.131 4.817 2.457 427 2HD2 LEU 52 2HD2 LEU 52 0.635 3.170 2.909 428 3HD2 LEU 52 3HD2 LEU 52 1.465 4.023 1.585 429 H LEU 53 H LEU 53 1.614 1.569 -1.734 430 HA LEU 53 HA LEU 53 3.691 3.146 -0.407 431 1HB LEU 53 1HB LEU 53 4.690 1.002 -0.758 432 2HB LEU 53 2HB LEU 53 4.114 0.932 -2.411 433 HG LEU 53 HG LEU 53 5.956 3.158 -1.594 434 1HD1 LEU 53 1HD1 LEU 53 7.106 1.255 -0.709 435 2HD1 LEU 53 2HD1 LEU 53 6.796 0.310 -2.185 436 3HD1 LEU 53 3HD1 LEU 53 7.890 1.713 -2.239 437 1HD2 LEU 53 1HD2 LEU 53 4.841 2.097 -4.050 438 2HD2 LEU 53 2HD2 LEU 53 5.694 3.630 -3.750 439 3HD2 LEU 53 3HD2 LEU 53 6.619 2.154 -4.116 440 H ASP 54 H ASP 54 4.476 4.916 -1.649 441 HA ASP 54 HA ASP 54 2.696 5.521 -3.867 442 1HB ASP 54 1HB ASP 54 2.459 7.360 -2.495 443 2HB ASP 54 2HB ASP 54 4.005 7.104 -1.711 444 H MET 55 H MET 55 3.615 5.808 -5.936 445 HA MET 55 HA MET 55 6.131 4.881 -6.453 446 1HB MET 55 1HB MET 55 4.600 6.959 -8.109 447 2HB MET 55 2HB MET 55 5.744 5.781 -8.722 448 1HG MET 55 1HG MET 55 2.953 5.281 -7.618 449 2HG MET 55 2HG MET 55 3.577 4.867 -9.202 450 1HE MET 55 1HE MET 55 3.144 2.379 -5.711 451 2HE MET 55 2HE MET 55 4.287 3.631 -5.169 452 3HE MET 55 3HE MET 55 2.749 4.100 -5.932 453 H LYS 56 H LYS 56 5.077 8.356 -6.770 454 HA LYS 56 HA LYS 56 7.500 9.480 -7.167 455 1HB LYS 56 1HB LYS 56 4.930 10.370 -6.675 456 2HB LYS 56 2HB LYS 56 5.821 11.026 -5.316 457 1HG LYS 56 1HG LYS 56 7.076 11.264 -8.046 458 2HG LYS 56 2HG LYS 56 5.702 12.294 -7.695 459 1HD LYS 56 1HD LYS 56 6.826 13.474 -6.013 460 2HD LYS 56 2HD LYS 56 7.878 12.130 -5.618 461 1HE LYS 56 1HE LYS 56 8.149 13.324 -8.370 462 2HE LYS 56 2HE LYS 56 8.743 14.275 -7.023 463 1HZ LYS 56 1HZ LYS 56 10.359 12.708 -8.018 464 2HZ LYS 56 2HZ LYS 56 10.175 12.537 -6.404 465 3HZ LYS 56 3HZ LYS 56 9.483 11.464 -7.423 466 H ILE 57 H ILE 57 9.372 8.963 -6.145 467 HA ILE 57 HA ILE 57 9.432 9.409 -3.273 468 HB ILE 57 HB ILE 57 10.109 6.818 -4.635 469 1HG1 ILE 57 1HG1 ILE 57 8.540 7.467 -2.122 470 2HG1 ILE 57 2HG1 ILE 57 7.842 7.125 -3.693 471 1HG2 ILE 57 1HG2 ILE 57 12.052 7.747 -3.246 472 2HG2 ILE 57 2HG2 ILE 57 11.003 7.482 -1.832 473 3HG2 ILE 57 3HG2 ILE 57 11.468 6.109 -2.865 474 1HD1 ILE 57 1HD1 ILE 57 9.118 5.265 -1.734 475 2HD1 ILE 57 2HD1 ILE 57 7.781 4.976 -2.873 476 3HD1 ILE 57 3HD1 ILE 57 9.464 4.945 -3.451 477 HA PRO 58 HA PRO 58 13.094 11.345 -4.514 478 1HB PRO 58 1HB PRO 58 14.200 11.853 -2.067 479 2HB PRO 58 2HB PRO 58 12.955 12.857 -2.782 480 1HG PRO 58 1HG PRO 58 12.717 10.892 -0.586 481 2HG PRO 58 2HG PRO 58 11.620 12.187 -1.024 482 1HD PRO 58 1HD PRO 58 11.279 9.391 -1.565 483 2HD PRO 58 2HD PRO 58 10.242 10.697 -2.103 484 H GLY 59 H GLY 59 14.909 10.651 -5.452 485 1HA GLY 59 1HA GLY 59 16.852 9.499 -5.625 486 2HA GLY 59 2HA GLY 59 16.690 8.968 -3.963 487 H MET 60 H MET 60 15.855 8.284 -7.357 488 HA MET 60 HA MET 60 15.460 6.388 -8.366 489 1HB MET 60 1HB MET 60 16.746 5.533 -6.013 490 2HB MET 60 2HB MET 60 15.265 4.596 -5.996 491 1HG MET 60 1HG MET 60 15.911 4.199 -8.587 492 2HG MET 60 2HG MET 60 17.524 4.545 -7.995 493 1HE MET 60 1HE MET 60 14.782 1.137 -6.563 494 2HE MET 60 2HE MET 60 14.303 2.845 -6.720 495 3HE MET 60 3HE MET 60 14.664 1.884 -8.174 496 H ASP 61 H ASP 61 13.339 7.039 -8.952 497 HA ASP 61 HA ASP 61 11.175 7.159 -7.373 498 1HB ASP 61 1HB ASP 61 10.062 6.161 -9.683 499 2HB ASP 61 2HB ASP 61 10.542 7.832 -9.461 500 H GLY 62 H GLY 62 9.151 5.534 -7.606 501 1HA GLY 62 1HA GLY 62 10.064 2.953 -6.650 502 2HA GLY 62 2HA GLY 62 8.427 3.577 -6.663 503 H ILE 63 H ILE 63 9.502 4.316 -9.709 504 HA ILE 63 HA ILE 63 7.895 2.535 -11.020 505 HB ILE 63 HB ILE 63 10.388 3.925 -12.007 506 1HG1 ILE 63 1HG1 ILE 63 7.687 4.970 -12.635 507 2HG1 ILE 63 2HG1 ILE 63 8.177 5.113 -10.959 508 1HG2 ILE 63 1HG2 ILE 63 8.886 1.958 -13.303 509 2HG2 ILE 63 2HG2 ILE 63 8.302 3.499 -13.974 510 3HG2 ILE 63 3HG2 ILE 63 10.035 3.100 -14.040 511 1HD1 ILE 63 1HD1 ILE 63 9.527 6.852 -11.476 512 2HD1 ILE 63 2HD1 ILE 63 10.431 5.833 -12.622 513 3HD1 ILE 63 3HD1 ILE 63 8.996 6.732 -13.171 514 H GLU 64 H GLU 64 11.331 2.202 -10.032 515 HA GLU 64 HA GLU 64 11.462 -0.352 -11.338 516 1HB GLU 64 1HB GLU 64 13.450 1.290 -9.723 517 2HB GLU 64 2HB GLU 64 13.814 -0.338 -10.262 518 1HG GLU 64 1HG GLU 64 12.852 1.798 -12.207 519 2HG GLU 64 2HG GLU 64 14.547 1.637 -11.793 520 H ILE 65 H ILE 65 11.583 1.004 -7.977 521 HA ILE 65 HA ILE 65 11.954 -1.296 -6.572 522 HB ILE 65 HB ILE 65 10.273 1.129 -5.951 523 1HG1 ILE 65 1HG1 ILE 65 12.800 1.303 -6.391 524 2HG1 ILE 65 2HG1 ILE 65 12.159 2.034 -4.933 525 1HG2 ILE 65 1HG2 ILE 65 11.182 -1.051 -4.052 526 2HG2 ILE 65 2HG2 ILE 65 10.357 0.462 -3.606 527 3HG2 ILE 65 3HG2 ILE 65 9.509 -0.758 -4.586 528 1HD1 ILE 65 1HD1 ILE 65 14.297 0.579 -4.704 529 2HD1 ILE 65 2HD1 ILE 65 12.985 0.288 -3.538 530 3HD1 ILE 65 3HD1 ILE 65 13.213 -0.816 -4.915 531 H LEU 66 H LEU 66 8.687 0.144 -7.281 532 HA LEU 66 HA LEU 66 7.243 -2.048 -6.452 533 1HB LEU 66 1HB LEU 66 6.627 0.039 -8.545 534 2HB LEU 66 2HB LEU 66 5.457 -1.116 -7.939 535 HG LEU 66 HG LEU 66 4.935 0.618 -6.583 536 1HD1 LEU 66 1HD1 LEU 66 7.331 -0.216 -4.952 537 2HD1 LEU 66 2HD1 LEU 66 5.717 0.290 -4.398 538 3HD1 LEU 66 3HD1 LEU 66 5.930 -1.287 -5.194 539 1HD2 LEU 66 1HD2 LEU 66 6.696 2.056 -7.721 540 2HD2 LEU 66 2HD2 LEU 66 6.273 2.482 -6.046 541 3HD2 LEU 66 3HD2 LEU 66 7.783 1.603 -6.386 542 H LYS 67 H LYS 67 9.041 -1.466 -9.459 543 HA LYS 67 HA LYS 67 7.809 -3.523 -10.943 544 1HB LYS 67 1HB LYS 67 9.947 -1.587 -11.271 545 2HB LYS 67 2HB LYS 67 10.421 -3.146 -11.914 546 1HG LYS 67 1HG LYS 67 8.069 -3.182 -13.055 547 2HG LYS 67 2HG LYS 67 7.995 -1.474 -12.669 548 1HD LYS 67 1HD LYS 67 8.958 -1.369 -14.790 549 2HD LYS 67 2HD LYS 67 10.403 -1.402 -13.800 550 1HE LYS 67 1HE LYS 67 10.334 -3.987 -14.056 551 2HE LYS 67 2HE LYS 67 9.133 -3.727 -15.305 552 1HZ LYS 67 1HZ LYS 67 10.731 -2.308 -16.435 553 2HZ LYS 67 2HZ LYS 67 11.852 -2.612 -15.287 554 3HZ LYS 67 3HZ LYS 67 11.312 -3.822 -16.243 555 H ARG 68 H ARG 68 11.099 -3.395 -9.392 556 HA ARG 68 HA ARG 68 11.627 -6.044 -9.740 557 1HB ARG 68 1HB ARG 68 12.613 -3.866 -7.937 558 2HB ARG 68 2HB ARG 68 12.977 -5.494 -7.399 559 1HG ARG 68 1HG ARG 68 14.106 -6.017 -9.505 560 2HG ARG 68 2HG ARG 68 13.570 -4.513 -10.228 561 1HD ARG 68 1HD ARG 68 15.599 -3.695 -9.554 562 2HD ARG 68 2HD ARG 68 14.854 -3.566 -7.973 563 HE ARG 68 HE ARG 68 15.851 -6.239 -8.326 564 1HH1 ARG 68 1HH1 ARG 68 16.988 -2.950 -7.801 565 2HH1 ARG 68 2HH1 ARG 68 18.448 -3.445 -7.012 566 1HH2 ARG 68 1HH2 ARG 68 17.778 -6.892 -7.286 567 2HH2 ARG 68 2HH2 ARG 68 18.901 -5.702 -6.717 568 H MET 69 H MET 69 9.785 -4.344 -7.178 569 HA MET 69 HA MET 69 9.709 -6.313 -5.289 570 1HB MET 69 1HB MET 69 8.312 -3.852 -5.950 571 2HB MET 69 2HB MET 69 7.111 -5.034 -5.468 572 1HG MET 69 1HG MET 69 7.924 -5.189 -3.286 573 2HG MET 69 2HG MET 69 9.579 -4.854 -3.758 574 1HE MET 69 1HE MET 69 5.971 -2.888 -3.877 575 2HE MET 69 2HE MET 69 6.416 -3.757 -2.389 576 3HE MET 69 3HE MET 69 6.384 -1.978 -2.404 577 H LYS 70 H LYS 70 7.318 -5.705 -7.965 578 HA LYS 70 HA LYS 70 5.881 -8.084 -7.377 579 1HB LYS 70 1HB LYS 70 4.418 -7.400 -9.019 580 2HB LYS 70 2HB LYS 70 5.103 -5.870 -8.511 581 1HG LYS 70 1HG LYS 70 5.185 -5.817 -10.900 582 2HG LYS 70 2HG LYS 70 6.832 -6.145 -10.399 583 1HD LYS 70 1HD LYS 70 6.834 -8.093 -11.556 584 2HD LYS 70 2HD LYS 70 5.467 -8.677 -10.628 585 1HE LYS 70 1HE LYS 70 4.142 -6.972 -12.286 586 2HE LYS 70 2HE LYS 70 5.506 -7.345 -13.321 587 1HZ LYS 70 1HZ LYS 70 4.894 -9.499 -13.466 588 2HZ LYS 70 2HZ LYS 70 4.196 -9.559 -11.990 589 3HZ LYS 70 3HZ LYS 70 3.410 -8.857 -13.237 590 H VAL 71 H VAL 71 8.397 -7.112 -9.770 591 HA VAL 71 HA VAL 71 8.356 -9.433 -11.281 592 HB VAL 71 HB VAL 71 10.658 -7.595 -10.593 593 1HG1 VAL 71 1HG1 VAL 71 11.347 -9.782 -11.581 594 2HG1 VAL 71 2HG1 VAL 71 10.333 -9.418 -12.998 595 3HG1 VAL 71 3HG1 VAL 71 11.728 -8.381 -12.612 596 1HG2 VAL 71 1HG2 VAL 71 8.341 -6.827 -11.751 597 2HG2 VAL 71 2HG2 VAL 71 9.923 -6.115 -12.151 598 3HG2 VAL 71 3HG2 VAL 71 9.229 -7.383 -13.190 599 H ILE 72 H ILE 72 9.552 -8.784 -8.027 600 HA ILE 72 HA ILE 72 11.334 -10.977 -7.910 601 HB ILE 72 HB ILE 72 10.178 -8.985 -6.059 602 1HG1 ILE 72 1HG1 ILE 72 12.357 -8.706 -7.206 603 2HG1 ILE 72 2HG1 ILE 72 12.480 -8.648 -5.459 604 1HG2 ILE 72 1HG2 ILE 72 10.860 -11.769 -5.214 605 2HG2 ILE 72 2HG2 ILE 72 11.355 -10.415 -4.170 606 3HG2 ILE 72 3HG2 ILE 72 9.637 -10.641 -4.581 607 1HD1 ILE 72 1HD1 ILE 72 13.445 -10.759 -7.367 608 2HD1 ILE 72 2HD1 ILE 72 14.223 -10.111 -5.902 609 3HD1 ILE 72 3HD1 ILE 72 12.899 -11.292 -5.759 610 H ASP 73 H ASP 73 7.883 -10.465 -6.965 611 HA ASP 73 HA ASP 73 7.519 -13.299 -7.269 612 1HB ASP 73 1HB ASP 73 7.420 -11.845 -4.667 613 2HB ASP 73 2HB ASP 73 6.029 -12.864 -4.978 614 H GLU 74 H GLU 74 5.193 -13.810 -7.599 615 HA GLU 74 HA GLU 74 3.729 -11.438 -8.385 616 1HB GLU 74 1HB GLU 74 2.552 -12.796 -9.906 617 2HB GLU 74 2HB GLU 74 4.158 -13.496 -9.922 618 1HG GLU 74 1HG GLU 74 3.403 -15.191 -8.210 619 2HG GLU 74 2HG GLU 74 1.788 -14.516 -8.286 620 H ASN 75 H ASN 75 4.123 -12.896 -5.567 621 HA ASN 75 HA ASN 75 1.296 -13.228 -5.002 622 1HB ASN 75 1HB ASN 75 3.357 -14.848 -4.293 623 2HB ASN 75 2HB ASN 75 3.438 -13.745 -2.934 624 1HD2 ASN 75 1HD2 ASN 75 1.145 -13.151 -2.071 625 2HD2 ASN 75 2HD2 ASN 75 0.101 -14.491 -1.735 626 H ILE 76 H ILE 76 3.786 -10.922 -4.953 627 HA ILE 76 HA ILE 76 3.230 -9.730 -2.414 628 HB ILE 76 HB ILE 76 5.429 -9.632 -3.460 629 1HG1 ILE 76 1HG1 ILE 76 3.993 -7.029 -2.931 630 2HG1 ILE 76 2HG1 ILE 76 5.008 -7.954 -1.842 631 1HG2 ILE 76 1HG2 ILE 76 4.713 -7.550 -5.418 632 2HG2 ILE 76 2HG2 ILE 76 5.869 -8.898 -5.534 633 3HG2 ILE 76 3HG2 ILE 76 4.136 -9.187 -5.816 634 1HD1 ILE 76 1HD1 ILE 76 5.778 -6.033 -3.969 635 2HD1 ILE 76 2HD1 ILE 76 6.648 -6.498 -2.487 636 3HD1 ILE 76 3HD1 ILE 76 6.752 -7.523 -3.939 637 H ARG 77 H ARG 77 1.689 -8.249 -1.902 638 HA ARG 77 HA ARG 77 0.234 -7.149 -4.173 639 1HB ARG 77 1HB ARG 77 -1.572 -8.217 -3.264 640 2HB ARG 77 2HB ARG 77 -0.695 -8.603 -1.797 641 1HG ARG 77 1HG ARG 77 -1.215 -6.460 -0.801 642 2HG ARG 77 2HG ARG 77 -1.781 -5.806 -2.325 643 1HD ARG 77 1HD ARG 77 -3.759 -6.356 -1.062 644 2HD ARG 77 2HD ARG 77 -3.625 -7.583 -2.306 645 HE ARG 77 HE ARG 77 -3.139 -7.957 0.594 646 1HH1 ARG 77 1HH1 ARG 77 -3.012 -9.329 -2.643 647 2HH1 ARG 77 2HH1 ARG 77 -2.927 -10.966 -2.084 648 1HH2 ARG 77 1HH2 ARG 77 -3.027 -10.117 1.332 649 2HH2 ARG 77 2HH2 ARG 77 -2.936 -11.417 0.192 650 H VAL 78 H VAL 78 0.603 -4.961 -4.345 651 HA VAL 78 HA VAL 78 0.626 -3.402 -1.882 652 HB VAL 78 HB VAL 78 2.980 -4.123 -2.836 653 1HG1 VAL 78 1HG1 VAL 78 2.680 -3.375 -5.110 654 2HG1 VAL 78 2HG1 VAL 78 2.234 -1.741 -4.563 655 3HG1 VAL 78 3HG1 VAL 78 3.895 -2.336 -4.328 656 1HG2 VAL 78 1HG2 VAL 78 1.969 -1.859 -1.346 657 2HG2 VAL 78 2HG2 VAL 78 3.484 -2.769 -1.135 658 3HG2 VAL 78 3HG2 VAL 78 3.420 -1.397 -2.267 659 H ILE 79 H ILE 79 -0.009 -1.180 -2.207 660 HA ILE 79 HA ILE 79 -1.381 -0.826 -4.776 661 HB ILE 79 HB ILE 79 -2.091 -0.286 -1.974 662 1HG1 ILE 79 1HG1 ILE 79 -3.473 -1.023 -4.540 663 2HG1 ILE 79 2HG1 ILE 79 -3.395 -1.904 -3.027 664 1HG2 ILE 79 1HG2 ILE 79 -2.794 1.726 -4.130 665 2HG2 ILE 79 2HG2 ILE 79 -3.481 1.665 -2.489 666 3HG2 ILE 79 3HG2 ILE 79 -1.750 2.013 -2.716 667 1HD1 ILE 79 1HD1 ILE 79 -5.034 0.574 -3.668 668 2HD1 ILE 79 2HD1 ILE 79 -5.602 -1.009 -3.084 669 3HD1 ILE 79 3HD1 ILE 79 -4.715 0.078 -1.988 670 H ILE 80 H ILE 80 -1.110 1.098 -5.954 671 HA ILE 80 HA ILE 80 1.217 2.651 -5.083 672 HB ILE 80 HB ILE 80 1.669 3.098 -7.340 673 1HG1 ILE 80 1HG1 ILE 80 0.093 2.224 -9.164 674 2HG1 ILE 80 2HG1 ILE 80 -1.123 2.088 -7.909 675 1HG2 ILE 80 1HG2 ILE 80 1.978 0.904 -8.304 676 2HG2 ILE 80 2HG2 ILE 80 2.263 0.830 -6.548 677 3HG2 ILE 80 3HG2 ILE 80 0.737 0.217 -7.229 678 1HD1 ILE 80 1HD1 ILE 80 0.265 4.685 -7.816 679 2HD1 ILE 80 2HD1 ILE 80 -0.538 4.393 -9.378 680 3HD1 ILE 80 3HD1 ILE 80 -1.479 4.334 -7.868 681 H MET 81 H MET 81 1.169 4.994 -5.349 682 HA MET 81 HA MET 81 -1.502 6.074 -5.655 683 1HB MET 81 1HB MET 81 0.047 7.380 -3.490 684 2HB MET 81 2HB MET 81 -1.627 6.859 -3.483 685 1HG MET 81 1HG MET 81 -0.910 4.505 -3.072 686 2HG MET 81 2HG MET 81 0.772 4.994 -3.128 687 1HE MET 81 1HE MET 81 1.523 5.627 0.392 688 2HE MET 81 2HE MET 81 1.500 4.254 -0.741 689 3HE MET 81 3HE MET 81 2.077 5.847 -1.285 690 H THR 82 H THR 82 -1.478 7.849 -6.977 691 HA THR 82 HA THR 82 0.413 9.884 -6.858 692 HB THR 82 HB THR 82 2.139 8.523 -7.740 693 HG1 THR 82 HG1 THR 82 1.804 10.327 -9.166 694 1HG2 THR 82 1HG2 THR 82 1.363 7.209 -10.015 695 2HG2 THR 82 2HG2 THR 82 1.377 6.433 -8.413 696 3HG2 THR 82 3HG2 THR 82 -0.140 7.093 -9.069 697 H ALA 83 H ALA 83 -0.059 11.608 -8.301 698 HA ALA 83 HA ALA 83 -2.733 11.818 -8.964 699 1HB ALA 83 1HB ALA 83 -2.154 13.937 -9.740 700 2HB ALA 83 2HB ALA 83 -0.787 13.574 -8.660 701 3HB ALA 83 3HB ALA 83 -0.606 13.381 -10.420 702 H TYR 84 H TYR 84 -3.902 11.672 -10.930 703 HA TYR 84 HA TYR 84 -3.039 9.602 -12.647 704 1HB TYR 84 1HB TYR 84 -5.166 10.422 -13.871 705 2HB TYR 84 2HB TYR 84 -5.415 10.059 -12.175 706 HD1 TYR 84 HD1 TYR 84 -5.773 11.863 -10.538 707 HD2 TYR 84 HD2 TYR 84 -5.267 12.713 -14.700 708 HE1 TYR 84 HE1 TYR 84 -6.688 14.208 -10.178 709 HE2 TYR 84 HE2 TYR 84 -6.184 15.054 -14.326 710 HH TYR 84 HH TYR 84 -6.267 16.541 -11.602 711 H GLY 85 H GLY 85 -0.863 11.084 -12.899 712 1HA GLY 85 1HA GLY 85 -1.230 12.644 -15.387 713 2HA GLY 85 2HA GLY 85 -0.015 12.978 -14.169 714 H GLU 86 H GLU 86 0.558 10.077 -13.642 715 HA GLU 86 HA GLU 86 2.110 9.646 -16.066 716 1HB GLU 86 1HB GLU 86 3.313 8.003 -14.294 717 2HB GLU 86 2HB GLU 86 3.739 9.695 -14.448 718 1HG GLU 86 1HG GLU 86 2.397 10.321 -12.548 719 2HG GLU 86 2HG GLU 86 1.550 8.787 -12.539 720 H LEU 87 H LEU 87 -0.547 8.907 -16.290 721 HA LEU 87 HA LEU 87 -1.388 6.502 -15.396 722 1HB LEU 87 1HB LEU 87 -1.704 7.607 -18.191 723 2HB LEU 87 2HB LEU 87 -2.688 6.347 -17.473 724 HG LEU 87 HG LEU 87 -2.530 8.945 -16.015 725 1HD1 LEU 87 1HD1 LEU 87 -2.786 9.820 -18.211 726 2HD1 LEU 87 2HD1 LEU 87 -3.989 8.580 -18.640 727 3HD1 LEU 87 3HD1 LEU 87 -4.395 9.841 -17.451 728 1HD2 LEU 87 1HD2 LEU 87 -5.135 8.227 -16.069 729 2HD2 LEU 87 2HD2 LEU 87 -4.364 6.635 -16.261 730 3HD2 LEU 87 3HD2 LEU 87 -3.966 7.652 -14.856 731 H ASP 88 H ASP 88 1.096 7.168 -17.883 732 HA ASP 88 HA ASP 88 1.325 4.830 -19.120 733 1HB ASP 88 1HB ASP 88 3.031 7.060 -18.533 734 2HB ASP 88 2HB ASP 88 3.984 5.618 -18.243 735 H MET 89 H MET 89 3.022 5.717 -16.009 736 HA MET 89 HA MET 89 3.980 3.133 -15.576 737 1HB MET 89 1HB MET 89 4.772 5.400 -14.580 738 2HB MET 89 2HB MET 89 3.420 5.289 -13.471 739 1HG MET 89 1HG MET 89 4.880 2.761 -13.490 740 2HG MET 89 2HG MET 89 5.993 4.082 -13.193 741 1HE MET 89 1HE MET 89 6.357 3.547 -10.251 742 2HE MET 89 2HE MET 89 5.086 2.382 -9.810 743 3HE MET 89 3HE MET 89 5.978 2.190 -11.338 744 H ILE 90 H ILE 90 1.229 4.976 -14.074 745 HA ILE 90 HA ILE 90 0.351 3.089 -12.324 746 HB ILE 90 HB ILE 90 -1.101 5.137 -13.979 747 1HG1 ILE 90 1HG1 ILE 90 -1.128 5.479 -11.105 748 2HG1 ILE 90 2HG1 ILE 90 0.516 5.260 -11.671 749 1HG2 ILE 90 1HG2 ILE 90 -3.062 4.215 -13.511 750 2HG2 ILE 90 2HG2 ILE 90 -2.278 2.909 -12.590 751 3HG2 ILE 90 3HG2 ILE 90 -2.716 4.431 -11.778 752 1HD1 ILE 90 1HD1 ILE 90 -1.434 7.198 -12.990 753 2HD1 ILE 90 2HD1 ILE 90 -0.321 7.669 -11.683 754 3HD1 ILE 90 3HD1 ILE 90 0.325 7.094 -13.239 755 H GLN 91 H GLN 91 -0.072 3.214 -15.878 756 HA GLN 91 HA GLN 91 -1.983 1.207 -16.011 757 1HB GLN 91 1HB GLN 91 -0.066 2.508 -17.913 758 2HB GLN 91 2HB GLN 91 -0.742 0.972 -18.415 759 1HG GLN 91 1HG GLN 91 -2.861 2.605 -17.284 760 2HG GLN 91 2HG GLN 91 -1.995 3.550 -18.479 761 1HE2 GLN 91 1HE2 GLN 91 -3.274 3.546 -20.187 762 2HE2 GLN 91 2HE2 GLN 91 -3.886 2.153 -21.015 763 H GLU 92 H GLU 92 1.611 1.060 -16.585 764 HA GLU 92 HA GLU 92 1.829 -1.586 -17.019 765 1HB GLU 92 1HB GLU 92 3.579 0.521 -16.625 766 2HB GLU 92 2HB GLU 92 3.952 -0.498 -15.250 767 1HG GLU 92 1HG GLU 92 3.867 -2.425 -17.159 768 2HG GLU 92 2HG GLU 92 4.285 -1.066 -18.184 769 H SER 93 H SER 93 1.695 0.114 -13.831 770 HA SER 93 HA SER 93 2.266 -1.946 -12.191 771 1HB SER 93 1HB SER 93 0.088 -0.584 -10.968 772 2HB SER 93 2HB SER 93 1.800 -0.300 -10.722 773 HG SER 93 HG SER 93 1.639 1.535 -11.805 774 H LYS 94 H LYS 94 -0.719 -1.326 -14.051 775 HA LYS 94 HA LYS 94 -2.345 -3.170 -12.683 776 1HB LYS 94 1HB LYS 94 -2.692 -1.243 -14.632 777 2HB LYS 94 2HB LYS 94 -2.956 -2.728 -15.523 778 1HG LYS 94 1HG LYS 94 -4.249 -2.638 -12.834 779 2HG LYS 94 2HG LYS 94 -4.872 -1.474 -13.986 780 1HD LYS 94 1HD LYS 94 -4.757 -3.706 -15.581 781 2HD LYS 94 2HD LYS 94 -5.038 -4.461 -14.025 782 1HE LYS 94 1HE LYS 94 -7.005 -2.900 -13.674 783 2HE LYS 94 2HE LYS 94 -6.752 -2.268 -15.288 784 1HZ LYS 94 1HZ LYS 94 -7.387 -5.052 -14.598 785 2HZ LYS 94 2HZ LYS 94 -8.366 -3.985 -15.354 786 3HZ LYS 94 3HZ LYS 94 -7.030 -4.545 -16.109 787 H GLU 95 H GLU 95 -0.537 -3.413 -15.828 788 HA GLU 95 HA GLU 95 -1.120 -6.121 -16.120 789 1HB GLU 95 1HB GLU 95 1.188 -4.509 -17.297 790 2HB GLU 95 2HB GLU 95 0.634 -6.065 -17.884 791 1HG GLU 95 1HG GLU 95 -1.182 -3.619 -17.709 792 2HG GLU 95 2HG GLU 95 -0.260 -4.018 -19.145 793 H LEU 96 H LEU 96 0.925 -4.493 -13.920 794 HA LEU 96 HA LEU 96 2.940 -6.540 -13.792 795 1HB LEU 96 1HB LEU 96 2.471 -3.874 -12.688 796 2HB LEU 96 2HB LEU 96 3.156 -4.986 -11.521 797 HG LEU 96 HG LEU 96 5.101 -5.346 -12.824 798 1HD1 LEU 96 1HD1 LEU 96 5.092 -5.420 -15.039 799 2HD1 LEU 96 2HD1 LEU 96 3.398 -4.873 -15.036 800 3HD1 LEU 96 3HD1 LEU 96 4.718 -3.682 -15.128 801 1HD2 LEU 96 1HD2 LEU 96 5.285 -2.607 -13.545 802 2HD2 LEU 96 2HD2 LEU 96 4.283 -2.709 -12.078 803 3HD2 LEU 96 3HD2 LEU 96 5.915 -3.420 -12.092 804 H GLY 97 H GLY 97 -0.262 -5.979 -12.550 805 1HA GLY 97 1HA GLY 97 -1.467 -7.710 -11.531 806 2HA GLY 97 2HA GLY 97 0.016 -8.377 -10.876 807 H ALA 98 H ALA 98 -0.593 -4.873 -10.777 808 HA ALA 98 HA ALA 98 -0.308 -4.869 -7.948 809 1HB ALA 98 1HB ALA 98 0.470 -3.095 -9.599 810 2HB ALA 98 2HB ALA 98 -1.236 -2.610 -9.759 811 3HB ALA 98 3HB ALA 98 -0.418 -2.483 -8.183 812 H LEU 99 H LEU 99 -1.956 -3.711 -6.507 813 HA LEU 99 HA LEU 99 -4.431 -5.079 -6.776 814 1HB LEU 99 1HB LEU 99 -3.426 -3.006 -4.825 815 2HB LEU 99 2HB LEU 99 -4.993 -3.782 -4.703 816 HG LEU 99 HG LEU 99 -3.155 -4.718 -3.244 817 1HD1 LEU 99 1HD1 LEU 99 -3.736 -7.186 -4.263 818 2HD1 LEU 99 2HD1 LEU 99 -4.798 -6.241 -3.191 819 3HD1 LEU 99 3HD1 LEU 99 -5.041 -6.193 -4.954 820 1HD2 LEU 99 1HD2 LEU 99 -1.522 -6.222 -4.218 821 2HD2 LEU 99 2HD2 LEU 99 -2.137 -5.878 -5.852 822 3HD2 LEU 99 3HD2 LEU 99 -1.343 -4.593 -4.911 823 H THR 100 H THR 100 -3.403 -1.607 -6.966 824 HA THR 100 HA THR 100 -5.205 -1.035 -9.038 825 HB THR 100 HB THR 100 -6.885 -1.380 -7.193 826 HG1 THR 100 HG1 THR 100 -7.848 0.698 -7.690 827 1HG2 THR 100 1HG2 THR 100 -5.171 -0.337 -5.420 828 2HG2 THR 100 2HG2 THR 100 -5.881 1.201 -5.965 829 3HG2 THR 100 3HG2 THR 100 -6.919 -0.052 -5.244 830 H HIS 101 H HIS 101 -5.657 1.699 -8.580 831 HA HIS 101 HA HIS 101 -3.076 2.779 -7.848 832 1HB HIS 101 1HB HIS 101 -4.150 3.567 -10.535 833 2HB HIS 101 2HB HIS 101 -2.521 3.700 -9.903 834 HD1 HIS 101 HD1 HIS 101 -4.420 1.767 -12.236 835 HD2 HIS 101 HD2 HIS 101 -1.373 0.884 -9.491 836 HE1 HIS 101 HE1 HIS 101 -3.402 -0.449 -12.986 837 H PHE 102 H PHE 102 -3.474 4.504 -6.563 838 HA PHE 102 HA PHE 102 -6.073 5.813 -6.894 839 1HB PHE 102 1HB PHE 102 -3.998 5.754 -4.619 840 2HB PHE 102 2HB PHE 102 -5.550 6.561 -4.514 841 HD1 PHE 102 HD1 PHE 102 -7.126 4.352 -5.983 842 HD2 PHE 102 HD2 PHE 102 -4.324 4.257 -2.797 843 HE1 PHE 102 HE1 PHE 102 -8.169 2.235 -5.128 844 HE2 PHE 102 HE2 PHE 102 -5.367 2.140 -1.942 845 HZ PHE 102 HZ PHE 102 -7.277 1.154 -3.118 846 H ALA 103 H ALA 103 -6.178 8.181 -6.657 847 HA ALA 103 HA ALA 103 -3.733 9.410 -7.710 848 1HB ALA 103 1HB ALA 103 -5.921 9.461 -9.019 849 2HB ALA 103 2HB ALA 103 -6.564 10.515 -7.736 850 3HB ALA 103 3HB ALA 103 -5.170 11.045 -8.709 851 H LYS 104 H LYS 104 -2.897 11.326 -6.756 852 HA LYS 104 HA LYS 104 -2.504 11.581 -4.233 853 1HB LYS 104 1HB LYS 104 -2.676 13.467 -6.399 854 2HB LYS 104 2HB LYS 104 -3.232 14.238 -4.927 855 1HG LYS 104 1HG LYS 104 -1.079 13.053 -3.866 856 2HG LYS 104 2HG LYS 104 -0.529 13.025 -5.530 857 1HD LYS 104 1HD LYS 104 -1.665 15.644 -4.829 858 2HD LYS 104 2HD LYS 104 -0.369 15.202 -3.735 859 1HE LYS 104 1HE LYS 104 0.812 16.251 -5.480 860 2HE LYS 104 2HE LYS 104 0.957 14.560 -5.917 861 1HZ LYS 104 1HZ LYS 104 -1.322 15.206 -7.098 862 2HZ LYS 104 2HZ LYS 104 -0.543 16.638 -7.197 863 3HZ LYS 104 3HZ LYS 104 0.133 15.296 -7.835 864 HA PRO 105 HA PRO 105 -6.696 13.387 -3.087 865 1HB PRO 105 1HB PRO 105 -8.620 13.824 -4.979 866 2HB PRO 105 2HB PRO 105 -7.506 15.065 -4.440 867 1HG PRO 105 1HG PRO 105 -7.500 13.543 -6.974 868 2HG PRO 105 2HG PRO 105 -6.684 15.047 -6.595 869 1HD PRO 105 1HD PRO 105 -5.494 12.442 -6.758 870 2HD PRO 105 2HD PRO 105 -4.703 13.927 -6.266 871 H PHE 106 H PHE 106 -6.780 11.401 -2.018 872 HA PHE 106 HA PHE 106 -8.839 9.694 -3.220 873 1HB PHE 106 1HB PHE 106 -7.276 7.944 -1.793 874 2HB PHE 106 2HB PHE 106 -6.980 8.285 -3.486 875 HD1 PHE 106 HD1 PHE 106 -6.206 10.102 -0.308 876 HD2 PHE 106 HD2 PHE 106 -4.731 8.443 -3.925 877 HE1 PHE 106 HE1 PHE 106 -3.900 10.916 0.259 878 HE2 PHE 106 HE2 PHE 106 -2.426 9.257 -3.358 879 HZ PHE 106 HZ PHE 106 -2.038 10.484 -1.273 880 H ASP 107 H ASP 107 -10.102 8.432 -1.657 881 HA ASP 107 HA ASP 107 -10.037 9.717 0.959 882 1HB ASP 107 1HB ASP 107 -12.140 9.465 -0.905 883 2HB ASP 107 2HB ASP 107 -12.491 8.230 0.287 884 H ILE 108 H ILE 108 -10.100 8.316 2.818 885 HA ILE 108 HA ILE 108 -9.089 5.728 2.454 886 HB ILE 108 HB ILE 108 -9.334 7.555 4.514 887 1HG1 ILE 108 1HG1 ILE 108 -7.449 6.037 4.049 888 2HG1 ILE 108 2HG1 ILE 108 -7.911 6.037 5.739 889 1HG2 ILE 108 1HG2 ILE 108 -10.838 5.049 5.313 890 2HG2 ILE 108 2HG2 ILE 108 -10.423 6.436 6.348 891 3HG2 ILE 108 3HG2 ILE 108 -11.586 6.637 5.016 892 1HD1 ILE 108 1HD1 ILE 108 -7.569 3.764 4.237 893 2HD1 ILE 108 2HD1 ILE 108 -8.587 3.848 5.695 894 3HD1 ILE 108 3HD1 ILE 108 -9.325 4.008 4.083 895 H ASP 109 H ASP 109 -12.392 7.011 3.115 896 HA ASP 109 HA ASP 109 -13.687 4.741 3.692 897 1HB ASP 109 1HB ASP 109 -14.455 7.273 3.158 898 2HB ASP 109 2HB ASP 109 -14.931 6.559 1.630 899 H GLU 110 H GLU 110 -12.596 5.972 0.482 900 HA GLU 110 HA GLU 110 -13.928 3.991 -0.997 901 1HB GLU 110 1HB GLU 110 -11.443 5.423 -1.968 902 2HB GLU 110 2HB GLU 110 -12.850 4.928 -2.888 903 1HG GLU 110 1HG GLU 110 -13.794 6.690 -0.830 904 2HG GLU 110 2HG GLU 110 -12.371 7.444 -1.521 905 H ILE 111 H ILE 111 -10.635 4.330 0.410 906 HA ILE 111 HA ILE 111 -9.602 2.015 -0.840 907 HB ILE 111 HB ILE 111 -8.768 3.855 1.356 908 1HG1 ILE 111 1HG1 ILE 111 -7.394 2.941 -1.188 909 2HG1 ILE 111 2HG1 ILE 111 -8.384 4.381 -1.050 910 1HG2 ILE 111 1HG2 ILE 111 -6.613 2.291 1.317 911 2HG2 ILE 111 2HG2 ILE 111 -7.950 2.047 2.467 912 3HG2 ILE 111 3HG2 ILE 111 -7.844 1.044 1.000 913 1HD1 ILE 111 1HD1 ILE 111 -5.632 4.200 -0.519 914 2HD1 ILE 111 2HD1 ILE 111 -6.699 5.557 -0.085 915 3HD1 ILE 111 3HD1 ILE 111 -6.382 4.262 1.094 916 H ARG 112 H ARG 112 -11.736 2.597 1.871 917 HA ARG 112 HA ARG 112 -11.117 0.243 3.254 918 1HB ARG 112 1HB ARG 112 -13.681 1.915 3.247 919 2HB ARG 112 2HB ARG 112 -13.297 0.688 4.438 920 1HG ARG 112 1HG ARG 112 -11.001 2.264 4.474 921 2HG ARG 112 2HG ARG 112 -12.253 3.454 4.175 922 1HD ARG 112 1HD ARG 112 -12.863 1.429 6.301 923 2HD ARG 112 2HD ARG 112 -11.585 2.568 6.677 924 HE ARG 112 HE ARG 112 -13.976 3.846 5.563 925 1HH1 ARG 112 1HH1 ARG 112 -12.426 2.701 8.508 926 2HH1 ARG 112 2HH1 ARG 112 -13.339 3.744 9.546 927 1HH2 ARG 112 1HH2 ARG 112 -15.181 5.222 6.933 928 2HH2 ARG 112 2HH2 ARG 112 -14.917 5.187 8.644 929 H ASP 113 H ASP 113 -12.865 0.947 0.333 930 HA ASP 113 HA ASP 113 -14.679 -1.215 0.528 931 1HB ASP 113 1HB ASP 113 -14.262 1.031 -1.168 932 2HB ASP 113 2HB ASP 113 -14.073 -0.366 -2.209 933 H ALA 114 H ALA 114 -11.624 -0.470 -1.303 934 HA ALA 114 HA ALA 114 -11.452 -2.950 -2.597 935 1HB ALA 114 1HB ALA 114 -9.434 -2.133 -3.402 936 2HB ALA 114 2HB ALA 114 -10.244 -0.616 -2.944 937 3HB ALA 114 3HB ALA 114 -9.022 -1.333 -1.867 938 H VAL 115 H VAL 115 -10.206 -1.705 0.547 939 HA VAL 115 HA VAL 115 -8.705 -4.036 1.112 940 HB VAL 115 HB VAL 115 -9.761 -1.761 2.793 941 1HG1 VAL 115 1HG1 VAL 115 -7.637 -3.696 3.715 942 2HG1 VAL 115 2HG1 VAL 115 -8.591 -2.533 4.668 943 3HG1 VAL 115 3HG1 VAL 115 -9.363 -4.003 4.024 944 1HG2 VAL 115 1HG2 VAL 115 -7.363 -1.078 2.803 945 2HG2 VAL 115 2HG2 VAL 115 -7.016 -2.403 1.665 946 3HG2 VAL 115 3HG2 VAL 115 -8.094 -1.072 1.180 947 H LYS 116 H LYS 116 -12.040 -2.902 1.867 948 HA LYS 116 HA LYS 116 -12.586 -5.192 3.485 949 1HB LYS 116 1HB LYS 116 -13.633 -2.981 3.857 950 2HB LYS 116 2HB LYS 116 -14.450 -3.106 2.312 951 1HG LYS 116 1HG LYS 116 -15.068 -5.545 3.553 952 2HG LYS 116 2HG LYS 116 -15.096 -4.407 4.885 953 1HD LYS 116 1HD LYS 116 -17.329 -4.511 3.889 954 2HD LYS 116 2HD LYS 116 -16.646 -2.928 3.577 955 1HE LYS 116 1HE LYS 116 -15.774 -4.435 1.376 956 2HE LYS 116 2HE LYS 116 -17.386 -5.058 1.666 957 1HZ LYS 116 1HZ LYS 116 -16.877 -2.837 0.325 958 2HZ LYS 116 2HZ LYS 116 -18.295 -3.125 1.082 959 3HZ LYS 116 3HZ LYS 116 -17.157 -2.203 1.804 960 H LYS 117 H LYS 117 -12.336 -4.581 0.112 961 HA LYS 117 HA LYS 117 -14.254 -6.667 -0.552 962 1HB LYS 117 1HB LYS 117 -14.313 -4.604 -1.857 963 2HB LYS 117 2HB LYS 117 -12.625 -4.788 -2.287 964 1HG LYS 117 1HG LYS 117 -14.069 -7.247 -2.904 965 2HG LYS 117 2HG LYS 117 -14.887 -5.881 -3.636 966 1HD LYS 117 1HD LYS 117 -11.980 -5.656 -3.963 967 2HD LYS 117 2HD LYS 117 -12.563 -7.182 -4.596 968 1HE LYS 117 1HE LYS 117 -13.761 -6.183 -6.299 969 2HE LYS 117 2HE LYS 117 -14.240 -4.819 -5.309 970 1HZ LYS 117 1HZ LYS 117 -12.088 -3.881 -5.578 971 2HZ LYS 117 2HZ LYS 117 -11.523 -5.199 -6.359 972 3HZ LYS 117 3HZ LYS 117 -12.657 -4.256 -7.062 973 H TYR 118 H TYR 118 -10.772 -6.013 -0.276 974 HA TYR 118 HA TYR 118 -10.156 -8.577 -1.513 975 1HB TYR 118 1HB TYR 118 -8.983 -6.152 -1.680 976 2HB TYR 118 2HB TYR 118 -8.268 -6.596 -0.143 977 HD1 TYR 118 HD1 TYR 118 -7.819 -6.663 -3.626 978 HD2 TYR 118 HD2 TYR 118 -7.112 -9.010 -0.119 979 HE1 TYR 118 HE1 TYR 118 -5.983 -7.935 -4.839 980 HE2 TYR 118 HE2 TYR 118 -5.278 -10.275 -1.345 981 HH TYR 118 HH TYR 118 -4.452 -9.447 -4.703 982 H LEU 119 H LEU 119 -9.810 -6.823 1.636 983 HA LEU 119 HA LEU 119 -9.134 -9.408 2.847 984 1HB LEU 119 1HB LEU 119 -8.253 -6.630 3.291 985 2HB LEU 119 2HB LEU 119 -8.584 -7.542 4.750 986 HG LEU 119 HG LEU 119 -6.194 -7.556 3.927 987 1HD1 LEU 119 1HD1 LEU 119 -7.561 -10.240 4.266 988 2HD1 LEU 119 2HD1 LEU 119 -5.826 -9.909 4.487 989 3HD1 LEU 119 3HD1 LEU 119 -7.021 -9.160 5.573 990 1HD2 LEU 119 1HD2 LEU 119 -7.157 -9.561 1.882 991 2HD2 LEU 119 2HD2 LEU 119 -6.878 -7.845 1.498 992 3HD2 LEU 119 3HD2 LEU 119 -5.532 -8.859 2.074 993 HA PRO 120 HA PRO 120 -12.852 -9.321 5.033 994 1HB PRO 120 1HB PRO 120 -12.225 -10.605 7.362 995 2HB PRO 120 2HB PRO 120 -12.528 -11.447 5.855 996 1HG PRO 120 1HG PRO 120 -9.949 -10.938 7.208 997 2HG PRO 120 2HG PRO 120 -10.322 -12.112 5.962 998 1HD PRO 120 1HD PRO 120 -8.931 -9.627 5.618 999 2HD PRO 120 2HD PRO 120 -9.406 -10.746 4.356 1000 H LEU 121 H LEU 121 -12.117 -6.838 4.993 1001 HA LEU 121 HA LEU 121 -11.687 -5.908 7.678 1002 1HB LEU 121 1HB LEU 121 -11.377 -4.917 5.017 1003 2HB LEU 121 2HB LEU 121 -12.407 -3.809 5.901 1004 HG LEU 121 HG LEU 121 -9.863 -3.409 5.897 1005 1HD1 LEU 121 1HD1 LEU 121 -11.114 -3.459 8.643 1006 2HD1 LEU 121 2HD1 LEU 121 -9.969 -2.283 7.955 1007 3HD1 LEU 121 3HD1 LEU 121 -11.650 -2.334 7.372 1008 1HD2 LEU 121 1HD2 LEU 121 -8.474 -4.876 6.817 1009 2HD2 LEU 121 2HD2 LEU 121 -9.444 -4.954 8.308 1010 3HD2 LEU 121 3HD2 LEU 121 -9.841 -6.010 6.932 1011 H LYS 122 H LYS 122 -13.198 -4.028 8.459 1012 HA LYS 122 HA LYS 122 -15.973 -4.650 7.793 1013 1HB LYS 122 1HB LYS 122 -14.988 -5.882 9.911 1014 2HB LYS 122 2HB LYS 122 -15.218 -4.324 10.678 1015 1HG LYS 122 1HG LYS 122 -17.442 -4.711 10.870 1016 2HG LYS 122 2HG LYS 122 -17.586 -4.884 9.132 1017 1HD LYS 122 1HD LYS 122 -16.365 -7.245 10.452 1018 2HD LYS 122 2HD LYS 122 -17.999 -6.915 10.992 1019 1HE LYS 122 1HE LYS 122 -18.027 -6.578 8.153 1020 2HE LYS 122 2HE LYS 122 -17.106 -8.038 8.456 1021 1HZ LYS 122 1HZ LYS 122 -19.843 -7.699 8.621 1022 2HZ LYS 122 2HZ LYS 122 -18.984 -9.059 8.906 1023 3HZ LYS 122 3HZ LYS 122 -19.321 -8.034 10.132 1024 H SER 123 H SER 123 -15.516 -2.622 6.526 1025 HA SER 123 HA SER 123 -15.339 -0.301 8.252 1026 1HB SER 123 1HB SER 123 -13.797 -0.335 6.353 1027 2HB SER 123 2HB SER 123 -15.110 -0.628 5.230 1028 HG SER 123 HG SER 123 -15.411 1.666 6.853 1029 H ASN 124 H ASN 124 -17.009 1.275 8.352 1030 HA ASN 124 HA ASN 124 -19.537 0.504 8.301 1031 1HB ASN 124 1HB ASN 124 -18.544 2.773 9.035 1032 2HB ASN 124 2HB ASN 124 -18.684 3.290 7.366 1033 1HD2 ASN 124 1HD2 ASN 124 -20.438 4.334 6.848 1034 2HD2 ASN 124 2HD2 ASN 124 -21.990 4.233 7.611 Start of MODEL 2 1 1H MET 1 1H MET 1 -10.076 -11.471 20.460 2 HA MET 1 HA MET 1 -7.884 -10.336 20.308 3 1HB MET 1 1HB MET 1 -7.225 -13.229 19.863 4 2HB MET 1 2HB MET 1 -6.421 -12.125 18.766 5 1HG MET 1 1HG MET 1 -5.550 -10.813 20.707 6 2HG MET 1 2HG MET 1 -6.375 -11.891 21.816 7 1HE MET 1 1HE MET 1 -3.156 -11.289 21.808 8 2HE MET 1 2HE MET 1 -4.101 -12.207 23.005 9 3HE MET 1 3HE MET 1 -2.649 -12.930 22.272 10 H MET 2 H MET 2 -6.870 -9.885 17.985 11 HA MET 2 HA MET 2 -9.082 -10.199 16.108 12 1HB MET 2 1HB MET 2 -7.488 -7.915 17.004 13 2HB MET 2 2HB MET 2 -7.266 -8.122 15.278 14 1HG MET 2 1HG MET 2 -9.994 -7.986 16.652 15 2HG MET 2 2HG MET 2 -9.216 -6.624 15.871 16 1HE MET 2 1HE MET 2 -12.144 -9.144 14.100 17 2HE MET 2 2HE MET 2 -11.812 -8.515 15.732 18 3HE MET 2 3HE MET 2 -12.162 -7.389 14.398 19 H ASN 3 H ASN 3 -7.691 -9.300 13.771 20 HA ASN 3 HA ASN 3 -5.288 -10.717 13.474 21 1HB ASN 3 1HB ASN 3 -7.713 -12.243 13.114 22 2HB ASN 3 2HB ASN 3 -7.025 -11.991 11.522 23 1HD2 ASN 3 1HD2 ASN 3 -7.252 -14.326 13.431 24 2HD2 ASN 3 2HD2 ASN 3 -5.663 -15.010 13.519 25 H GLU 4 H GLU 4 -4.450 -8.944 12.306 26 HA GLU 4 HA GLU 4 -5.125 -8.639 9.660 27 1HB GLU 4 1HB GLU 4 -7.213 -7.597 10.477 28 2HB GLU 4 2HB GLU 4 -6.296 -6.459 11.443 29 1HG GLU 4 1HG GLU 4 -5.878 -5.108 9.654 30 2HG GLU 4 2HG GLU 4 -5.397 -6.455 8.642 31 H LYS 5 H LYS 5 -3.541 -7.375 8.589 32 HA LYS 5 HA LYS 5 -1.806 -5.758 10.282 33 1HB LYS 5 1HB LYS 5 -0.833 -8.056 8.560 34 2HB LYS 5 2HB LYS 5 0.205 -6.838 9.273 35 1HG LYS 5 1HG LYS 5 -1.724 -8.263 11.099 36 2HG LYS 5 2HG LYS 5 -0.337 -9.167 10.525 37 1HD LYS 5 1HD LYS 5 -0.042 -6.398 11.760 38 2HD LYS 5 2HD LYS 5 -0.064 -7.848 12.745 39 1HE LYS 5 1HE LYS 5 1.761 -8.403 10.630 40 2HE LYS 5 2HE LYS 5 2.113 -6.760 11.126 41 1HZ LYS 5 1HZ LYS 5 2.858 -7.460 13.086 42 2HZ LYS 5 2HZ LYS 5 1.684 -8.576 13.294 43 3HZ LYS 5 3HZ LYS 5 2.992 -8.927 12.382 44 H ILE 6 H ILE 6 -0.342 -4.350 8.935 45 HA ILE 6 HA ILE 6 -0.906 -4.107 6.164 46 HB ILE 6 HB ILE 6 -2.559 -2.628 8.059 47 1HG1 ILE 6 1HG1 ILE 6 -3.257 -2.289 5.292 48 2HG1 ILE 6 2HG1 ILE 6 -2.778 -3.955 5.553 49 1HG2 ILE 6 1HG2 ILE 6 -2.525 -0.503 6.806 50 2HG2 ILE 6 2HG2 ILE 6 -0.990 -0.829 7.645 51 3HG2 ILE 6 3HG2 ILE 6 -1.115 -1.084 5.888 52 1HD1 ILE 6 1HD1 ILE 6 -5.282 -3.138 6.032 53 2HD1 ILE 6 2HD1 ILE 6 -4.510 -4.377 7.050 54 3HD1 ILE 6 3HD1 ILE 6 -4.583 -2.688 7.605 55 H LEU 7 H LEU 7 0.402 -2.349 5.182 56 HA LEU 7 HA LEU 7 2.453 -1.342 7.012 57 1HB LEU 7 1HB LEU 7 2.903 -3.501 5.417 58 2HB LEU 7 2HB LEU 7 3.390 -2.199 4.351 59 HG LEU 7 HG LEU 7 4.724 -1.426 6.549 60 1HD1 LEU 7 1HD1 LEU 7 5.344 -3.062 8.012 61 2HD1 LEU 7 2HD1 LEU 7 3.705 -3.633 7.614 62 3HD1 LEU 7 3HD1 LEU 7 5.121 -4.371 6.827 63 1HD2 LEU 7 1HD2 LEU 7 5.460 -2.120 4.132 64 2HD2 LEU 7 2HD2 LEU 7 6.645 -2.065 5.458 65 3HD2 LEU 7 3HD2 LEU 7 5.967 -3.625 4.935 66 H ILE 8 H ILE 8 3.325 0.695 6.437 67 HA ILE 8 HA ILE 8 1.998 1.953 4.141 68 HB ILE 8 HB ILE 8 2.358 3.027 6.934 69 1HG1 ILE 8 1HG1 ILE 8 -0.177 2.927 5.302 70 2HG1 ILE 8 2HG1 ILE 8 0.354 1.544 6.238 71 1HG2 ILE 8 1HG2 ILE 8 0.994 4.910 5.327 72 2HG2 ILE 8 2HG2 ILE 8 2.579 5.077 6.121 73 3HG2 ILE 8 3HG2 ILE 8 2.479 4.465 4.452 74 1HD1 ILE 8 1HD1 ILE 8 -0.757 2.528 7.970 75 2HD1 ILE 8 2HD1 ILE 8 0.655 3.608 8.071 76 3HD1 ILE 8 3HD1 ILE 8 -0.789 4.113 7.160 77 H VAL 9 H VAL 9 3.594 2.159 2.650 78 HA VAL 9 HA VAL 9 6.227 2.984 3.646 79 HB VAL 9 HB VAL 9 5.502 1.785 0.969 80 1HG1 VAL 9 1HG1 VAL 9 8.184 1.985 2.379 81 2HG1 VAL 9 2HG1 VAL 9 7.874 1.366 0.739 82 3HG1 VAL 9 3HG1 VAL 9 7.623 3.091 1.102 83 1HG2 VAL 9 1HG2 VAL 9 5.366 -0.241 1.889 84 2HG2 VAL 9 2HG2 VAL 9 6.959 -0.032 2.654 85 3HG2 VAL 9 3HG2 VAL 9 5.488 0.502 3.502 86 H ASP 10 H ASP 10 6.984 4.997 3.177 87 HA ASP 10 HA ASP 10 6.935 7.072 2.530 88 1HB ASP 10 1HB ASP 10 5.940 6.041 -0.161 89 2HB ASP 10 2HB ASP 10 6.886 7.488 0.126 90 H ASP 11 H ASP 11 5.414 8.745 0.967 91 HA ASP 11 HA ASP 11 3.491 9.711 0.664 92 1HB ASP 11 1HB ASP 11 2.745 7.324 -0.040 93 2HB ASP 11 2HB ASP 11 2.041 7.185 1.559 94 H GLN 12 H GLN 12 4.801 8.765 3.482 95 HA GLN 12 HA GLN 12 2.633 9.066 5.272 96 1HB GLN 12 1HB GLN 12 4.616 9.285 6.960 97 2HB GLN 12 2HB GLN 12 4.381 7.757 6.134 98 1HG GLN 12 1HG GLN 12 6.280 8.003 4.827 99 2HG GLN 12 2HG GLN 12 6.115 9.743 4.714 100 1HE2 GLN 12 1HE2 GLN 12 6.103 10.728 7.122 101 2HE2 GLN 12 2HE2 GLN 12 7.511 10.326 8.047 102 H TYR 13 H TYR 13 1.611 10.980 5.651 103 HA TYR 13 HA TYR 13 3.186 13.305 6.257 104 1HB TYR 13 1HB TYR 13 2.245 12.755 3.593 105 2HB TYR 13 2HB TYR 13 1.109 13.923 4.239 106 HD1 TYR 13 HD1 TYR 13 4.315 13.458 2.728 107 HD2 TYR 13 HD2 TYR 13 2.086 16.105 5.244 108 HE1 TYR 13 HE1 TYR 13 5.942 15.341 2.202 109 HE2 TYR 13 HE2 TYR 13 3.720 17.978 4.710 110 HH TYR 13 HH TYR 13 5.949 17.754 2.171 111 H GLY 14 H GLY 14 1.185 11.436 7.519 112 1HA GLY 14 1HA GLY 14 -0.201 12.197 9.297 113 2HA GLY 14 2HA GLY 14 -0.767 13.511 8.285 114 H ILE 15 H ILE 15 -0.569 11.033 6.116 115 HA ILE 15 HA ILE 15 -3.399 10.455 6.423 116 HB ILE 15 HB ILE 15 -1.403 10.325 4.208 117 1HG1 ILE 15 1HG1 ILE 15 -3.860 11.228 3.277 118 2HG1 ILE 15 2HG1 ILE 15 -3.801 11.849 4.914 119 1HG2 ILE 15 1HG2 ILE 15 -3.571 9.225 3.009 120 2HG2 ILE 15 2HG2 ILE 15 -2.175 8.298 3.609 121 3HG2 ILE 15 3HG2 ILE 15 -3.644 8.439 4.605 122 1HD1 ILE 15 1HD1 ILE 15 -1.585 12.186 2.839 123 2HD1 ILE 15 2HD1 ILE 15 -2.770 13.434 3.296 124 3HD1 ILE 15 3HD1 ILE 15 -1.579 12.859 4.487 125 H ARG 16 H ARG 16 -0.181 8.880 6.474 126 HA ARG 16 HA ARG 16 -0.989 6.290 6.383 127 1HB ARG 16 1HB ARG 16 1.116 5.919 7.906 128 2HB ARG 16 2HB ARG 16 1.353 6.654 6.333 129 1HG ARG 16 1HG ARG 16 1.605 8.843 7.250 130 2HG ARG 16 2HG ARG 16 0.845 8.399 8.765 131 1HD ARG 16 1HD ARG 16 3.329 6.875 8.042 132 2HD ARG 16 2HD ARG 16 3.552 8.566 8.446 133 HE ARG 16 HE ARG 16 1.854 7.084 10.341 134 1HH1 ARG 16 1HH1 ARG 16 5.121 8.120 9.543 135 2HH1 ARG 16 2HH1 ARG 16 5.708 7.951 11.164 136 1HH2 ARG 16 1HH2 ARG 16 2.628 6.861 12.480 137 2HH2 ARG 16 2HH2 ARG 16 4.280 7.230 12.845 138 H ILE 17 H ILE 17 -0.981 8.619 9.116 139 HA ILE 17 HA ILE 17 -1.567 6.682 11.100 140 HB ILE 17 HB ILE 17 -1.885 9.685 11.060 141 1HG1 ILE 17 1HG1 ILE 17 0.294 8.298 12.552 142 2HG1 ILE 17 2HG1 ILE 17 0.442 8.370 10.807 143 1HG2 ILE 17 1HG2 ILE 17 -1.552 8.255 13.628 144 2HG2 ILE 17 2HG2 ILE 17 -2.540 9.677 13.215 145 3HG2 ILE 17 3HG2 ILE 17 -3.124 8.043 12.819 146 1HD1 ILE 17 1HD1 ILE 17 1.515 10.333 11.891 147 2HD1 ILE 17 2HD1 ILE 17 0.157 10.833 10.854 148 3HD1 ILE 17 3HD1 ILE 17 -0.046 10.778 12.622 149 H LEU 18 H LEU 18 -3.516 8.921 9.054 150 HA LEU 18 HA LEU 18 -5.952 8.676 10.187 151 1HB LEU 18 1HB LEU 18 -5.121 9.908 8.068 152 2HB LEU 18 2HB LEU 18 -5.602 8.456 7.212 153 HG LEU 18 HG LEU 18 -7.848 8.990 8.709 154 1HD1 LEU 18 1HD1 LEU 18 -6.739 11.159 9.398 155 2HD1 LEU 18 2HD1 LEU 18 -6.906 11.681 7.704 156 3HD1 LEU 18 3HD1 LEU 18 -8.355 11.301 8.666 157 1HD2 LEU 18 1HD2 LEU 18 -7.513 10.216 5.986 158 2HD2 LEU 18 2HD2 LEU 18 -7.438 8.450 6.199 159 3HD2 LEU 18 3HD2 LEU 18 -8.901 9.343 6.679 160 H LEU 19 H LEU 19 -4.595 6.399 7.697 161 HA LEU 19 HA LEU 19 -6.730 4.567 8.089 162 1HB LEU 19 1HB LEU 19 -5.251 3.087 6.679 163 2HB LEU 19 2HB LEU 19 -5.807 4.586 5.961 164 HG LEU 19 HG LEU 19 -3.247 4.999 7.243 165 1HD1 LEU 19 1HD1 LEU 19 -3.528 2.557 5.536 166 2HD1 LEU 19 2HD1 LEU 19 -2.061 3.554 5.386 167 3HD1 LEU 19 3HD1 LEU 19 -2.501 2.851 6.960 168 1HD2 LEU 19 1HD2 LEU 19 -2.841 6.258 5.408 169 2HD2 LEU 19 2HD2 LEU 19 -3.516 5.051 4.287 170 3HD2 LEU 19 3HD2 LEU 19 -4.604 6.114 5.211 171 H ASN 20 H ASN 20 -3.715 5.266 9.710 172 HA ASN 20 HA ASN 20 -3.195 2.720 10.688 173 1HB ASN 20 1HB ASN 20 -1.655 4.776 10.739 174 2HB ASN 20 2HB ASN 20 -2.614 5.390 12.072 175 1HD2 ASN 20 1HD2 ASN 20 -0.314 5.255 12.926 176 2HD2 ASN 20 2HD2 ASN 20 0.123 3.824 13.799 177 H GLU 21 H GLU 21 -4.717 5.649 12.255 178 HA GLU 21 HA GLU 21 -5.423 4.506 14.602 179 1HB GLU 21 1HB GLU 21 -5.638 6.905 14.164 180 2HB GLU 21 2HB GLU 21 -6.892 6.623 12.973 181 1HG GLU 21 1HG GLU 21 -8.485 5.953 14.619 182 2HG GLU 21 2HG GLU 21 -7.250 5.633 15.821 183 H VAL 22 H VAL 22 -6.701 3.868 11.414 184 HA VAL 22 HA VAL 22 -9.222 2.862 12.339 185 HB VAL 22 HB VAL 22 -7.747 2.834 9.708 186 1HG1 VAL 22 1HG1 VAL 22 -8.957 0.867 9.478 187 2HG1 VAL 22 2HG1 VAL 22 -10.293 1.441 10.505 188 3HG1 VAL 22 3HG1 VAL 22 -10.103 2.077 8.853 189 1HG2 VAL 22 1HG2 VAL 22 -9.801 4.250 9.082 190 2HG2 VAL 22 2HG2 VAL 22 -10.088 4.380 10.834 191 3HG2 VAL 22 3HG2 VAL 22 -8.573 4.997 10.132 192 H PHE 23 H PHE 23 -6.306 1.340 10.779 193 HA PHE 23 HA PHE 23 -7.130 -1.265 11.392 194 1HB PHE 23 1HB PHE 23 -4.454 0.115 10.786 195 2HB PHE 23 2HB PHE 23 -4.566 -1.627 10.942 196 HD1 PHE 23 HD1 PHE 23 -7.180 -2.102 9.572 197 HD2 PHE 23 HD2 PHE 23 -3.915 0.401 8.532 198 HE1 PHE 23 HE1 PHE 23 -7.817 -2.278 7.151 199 HE2 PHE 23 HE2 PHE 23 -4.552 0.225 6.110 200 HZ PHE 23 HZ PHE 23 -6.495 -1.112 5.449 201 H ASN 24 H ASN 24 -5.199 1.175 13.159 202 HA ASN 24 HA ASN 24 -4.147 -0.629 15.013 203 1HB ASN 24 1HB ASN 24 -3.677 1.993 14.418 204 2HB ASN 24 2HB ASN 24 -4.701 2.223 15.822 205 1HD2 ASN 24 1HD2 ASN 24 -3.537 2.603 17.536 206 2HD2 ASN 24 2HD2 ASN 24 -2.083 1.797 18.024 207 H LYS 25 H LYS 25 -7.148 1.317 14.736 208 HA LYS 25 HA LYS 25 -8.046 1.266 17.326 209 1HB LYS 25 1HB LYS 25 -9.141 1.729 14.676 210 2HB LYS 25 2HB LYS 25 -10.312 0.925 15.702 211 1HG LYS 25 1HG LYS 25 -9.883 2.654 17.492 212 2HG LYS 25 2HG LYS 25 -8.785 3.478 16.402 213 1HD LYS 25 1HD LYS 25 -10.578 4.625 15.612 214 2HD LYS 25 2HD LYS 25 -11.104 3.137 14.850 215 1HE LYS 25 1HE LYS 25 -12.588 2.594 16.627 216 2HE LYS 25 2HE LYS 25 -11.764 3.637 17.768 217 1HZ LYS 25 1HZ LYS 25 -13.499 4.938 17.221 218 2HZ LYS 25 2HZ LYS 25 -12.495 5.427 16.029 219 3HZ LYS 25 3HZ LYS 25 -13.669 4.337 15.712 220 H GLU 26 H GLU 26 -7.575 -1.375 15.088 221 HA GLU 26 HA GLU 26 -9.316 -3.067 16.663 222 1HB GLU 26 1HB GLU 26 -7.742 -3.675 14.121 223 2HB GLU 26 2HB GLU 26 -8.884 -4.760 14.888 224 1HG GLU 26 1HG GLU 26 -9.669 -1.958 13.981 225 2HG GLU 26 2HG GLU 26 -9.770 -3.345 12.914 226 H GLY 27 H GLY 27 -5.963 -2.172 16.254 227 1HA GLY 27 1HA GLY 27 -4.401 -2.726 17.936 228 2HA GLY 27 2HA GLY 27 -5.204 -4.263 18.183 229 H TYR 28 H TYR 28 -5.013 -3.422 14.835 230 HA TYR 28 HA TYR 28 -3.368 -5.616 14.243 231 1HB TYR 28 1HB TYR 28 -4.028 -3.052 12.664 232 2HB TYR 28 2HB TYR 28 -3.537 -4.573 11.946 233 HD1 TYR 28 HD1 TYR 28 -5.429 -5.938 14.305 234 HD2 TYR 28 HD2 TYR 28 -5.966 -3.257 11.015 235 HE1 TYR 28 HE1 TYR 28 -7.867 -6.637 14.124 236 HE2 TYR 28 HE2 TYR 28 -8.402 -3.965 10.845 237 HH TYR 28 HH TYR 28 -9.597 -6.569 11.891 238 H GLN 29 H GLN 29 -1.222 -5.704 13.366 239 HA GLN 29 HA GLN 29 0.430 -3.616 14.467 240 1HB GLN 29 1HB GLN 29 0.677 -6.420 14.197 241 2HB GLN 29 2HB GLN 29 1.863 -5.764 13.087 242 1HG GLN 29 1HG GLN 29 2.812 -4.351 14.904 243 2HG GLN 29 2HG GLN 29 1.598 -4.947 16.020 244 1HE2 GLN 29 1HE2 GLN 29 4.334 -5.834 13.993 245 2HE2 GLN 29 2HE2 GLN 29 4.815 -7.259 14.851 246 H THR 30 H THR 30 0.800 -1.852 13.190 247 HA THR 30 HA THR 30 1.244 -2.367 10.321 248 HB THR 30 HB THR 30 0.292 -0.049 10.018 249 HG1 THR 30 HG1 THR 30 0.825 0.692 12.190 250 1HG2 THR 30 1HG2 THR 30 -2.002 -0.605 10.355 251 2HG2 THR 30 2HG2 THR 30 -1.229 -2.199 10.183 252 3HG2 THR 30 3HG2 THR 30 -1.642 -1.580 11.800 253 H PHE 31 H PHE 31 3.035 -1.514 9.334 254 HA PHE 31 HA PHE 31 4.808 0.016 11.102 255 1HB PHE 31 1HB PHE 31 5.076 -2.620 9.940 256 2HB PHE 31 2HB PHE 31 6.160 -1.579 9.039 257 HD1 PHE 31 HD1 PHE 31 8.104 -0.593 10.096 258 HD2 PHE 31 HD2 PHE 31 5.442 -3.037 12.320 259 HE1 PHE 31 HE1 PHE 31 9.809 -0.781 11.930 260 HE2 PHE 31 HE2 PHE 31 7.146 -3.225 14.153 261 HZ PHE 31 HZ PHE 31 9.309 -2.095 13.936 262 H GLN 32 H GLN 32 6.540 1.236 9.828 263 HA GLN 32 HA GLN 32 5.407 2.051 7.266 264 1HB GLN 32 1HB GLN 32 6.817 3.818 9.315 265 2HB GLN 32 2HB GLN 32 6.233 4.352 7.752 266 1HG GLN 32 1HG GLN 32 4.081 4.517 8.489 267 2HG GLN 32 2HG GLN 32 4.135 2.944 9.259 268 1HE2 GLN 32 1HE2 GLN 32 2.858 4.032 10.894 269 2HE2 GLN 32 2HE2 GLN 32 3.639 4.907 12.169 270 H ALA 33 H ALA 33 6.994 2.817 5.645 271 HA ALA 33 HA ALA 33 9.736 1.966 6.236 272 1HB ALA 33 1HB ALA 33 7.837 0.932 4.175 273 2HB ALA 33 2HB ALA 33 9.514 1.215 3.650 274 3HB ALA 33 3HB ALA 33 9.180 0.112 5.007 275 H ALA 34 H ALA 34 11.264 2.824 4.438 276 HA ALA 34 HA ALA 34 10.242 5.381 3.425 277 1HB ALA 34 1HB ALA 34 12.585 4.816 5.218 278 2HB ALA 34 2HB ALA 34 12.742 6.101 3.997 279 3HB ALA 34 3HB ALA 34 11.454 6.190 5.222 280 H ASN 35 H ASN 35 10.225 3.070 1.891 281 HA ASN 35 HA ASN 35 11.437 3.754 -0.353 282 1HB ASN 35 1HB ASN 35 13.443 2.656 1.516 283 2HB ASN 35 2HB ASN 35 13.377 1.726 0.032 284 1HD2 ASN 35 1HD2 ASN 35 15.518 3.359 0.946 285 2HD2 ASN 35 2HD2 ASN 35 15.787 4.624 -0.207 286 H GLY 36 H GLY 36 12.129 1.441 -1.672 287 1HA GLY 36 1HA GLY 36 9.759 -0.193 -1.400 288 2HA GLY 36 2HA GLY 36 10.992 -0.285 -2.641 289 H LEU 37 H LEU 37 13.363 -0.662 -1.243 290 HA LEU 37 HA LEU 37 13.277 -3.374 -0.674 291 1HB LEU 37 1HB LEU 37 15.198 -1.392 -1.029 292 2HB LEU 37 2HB LEU 37 15.476 -1.964 0.604 293 HG LEU 37 HG LEU 37 15.162 -3.993 -1.576 294 1HD1 LEU 37 1HD1 LEU 37 16.724 -2.142 -2.376 295 2HD1 LEU 37 2HD1 LEU 37 17.824 -2.661 -1.076 296 3HD1 LEU 37 3HD1 LEU 37 17.368 -3.802 -2.365 297 1HD2 LEU 37 1HD2 LEU 37 17.112 -4.954 -0.092 298 2HD2 LEU 37 2HD2 LEU 37 16.468 -3.811 1.110 299 3HD2 LEU 37 3HD2 LEU 37 15.415 -5.074 0.429 300 H GLN 38 H GLN 38 13.557 -0.552 1.600 301 HA GLN 38 HA GLN 38 13.594 -1.948 3.908 302 1HB GLN 38 1HB GLN 38 12.738 0.777 3.080 303 2HB GLN 38 2HB GLN 38 12.069 0.242 4.609 304 1HG GLN 38 1HG GLN 38 14.181 0.048 5.631 305 2HG GLN 38 2HG GLN 38 15.017 -0.192 4.110 306 1HE2 GLN 38 1HE2 GLN 38 14.655 1.874 6.559 307 2HE2 GLN 38 2HE2 GLN 38 14.954 3.401 5.798 308 H ALA 39 H ALA 39 10.905 -1.478 1.669 309 HA ALA 39 HA ALA 39 8.935 -2.316 3.609 310 1HB ALA 39 1HB ALA 39 8.582 -1.995 0.613 311 2HB ALA 39 2HB ALA 39 7.360 -1.837 1.898 312 3HB ALA 39 3HB ALA 39 8.624 -0.598 1.715 313 H LEU 40 H LEU 40 10.980 -3.661 1.032 314 HA LEU 40 HA LEU 40 9.526 -6.021 0.624 315 1HB LEU 40 1HB LEU 40 12.318 -5.092 0.103 316 2HB LEU 40 2HB LEU 40 11.947 -6.797 -0.065 317 HG LEU 40 HG LEU 40 10.825 -4.474 -1.631 318 1HD1 LEU 40 1HD1 LEU 40 11.601 -6.722 -3.212 319 2HD1 LEU 40 2HD1 LEU 40 12.309 -5.090 -3.156 320 3HD1 LEU 40 3HD1 LEU 40 12.909 -6.358 -2.061 321 1HD2 LEU 40 1HD2 LEU 40 9.555 -6.532 -2.780 322 2HD2 LEU 40 2HD2 LEU 40 9.584 -7.123 -1.101 323 3HD2 LEU 40 3HD2 LEU 40 8.837 -5.552 -1.479 324 H ASP 41 H ASP 41 12.112 -5.091 2.951 325 HA ASP 41 HA ASP 41 12.334 -7.694 3.984 326 1HB ASP 41 1HB ASP 41 13.893 -5.514 4.141 327 2HB ASP 41 2HB ASP 41 12.985 -5.233 5.613 328 H ILE 42 H ILE 42 10.864 -4.579 5.187 329 HA ILE 42 HA ILE 42 9.746 -5.653 7.500 330 HB ILE 42 HB ILE 42 9.274 -3.212 5.835 331 1HG1 ILE 42 1HG1 ILE 42 11.152 -3.761 7.680 332 2HG1 ILE 42 2HG1 ILE 42 10.534 -2.149 7.375 333 1HG2 ILE 42 1HG2 ILE 42 7.047 -3.905 6.619 334 2HG2 ILE 42 2HG2 ILE 42 7.657 -3.947 8.291 335 3HG2 ILE 42 3HG2 ILE 42 7.602 -2.406 7.402 336 1HD1 ILE 42 1HD1 ILE 42 10.574 -2.836 9.826 337 2HD1 ILE 42 2HD1 ILE 42 8.987 -2.286 9.235 338 3HD1 ILE 42 3HD1 ILE 42 9.306 -4.025 9.442 339 H VAL 43 H VAL 43 8.797 -5.819 4.109 340 HA VAL 43 HA VAL 43 6.096 -6.233 4.317 341 HB VAL 43 HB VAL 43 8.261 -6.843 2.448 342 1HG1 VAL 43 1HG1 VAL 43 5.909 -8.710 2.686 343 2HG1 VAL 43 2HG1 VAL 43 6.630 -8.364 1.095 344 3HG1 VAL 43 3HG1 VAL 43 7.624 -9.081 2.387 345 1HG2 VAL 43 1HG2 VAL 43 5.431 -6.282 1.640 346 2HG2 VAL 43 2HG2 VAL 43 6.340 -5.016 2.500 347 3HG2 VAL 43 3HG2 VAL 43 6.959 -5.667 0.963 348 H THR 44 H THR 44 8.708 -8.765 4.390 349 HA THR 44 HA THR 44 6.818 -10.740 5.281 350 HB THR 44 HB THR 44 9.872 -10.855 5.113 351 HG1 THR 44 HG1 THR 44 7.795 -11.547 3.166 352 1HG2 THR 44 1HG2 THR 44 7.661 -12.828 5.471 353 2HG2 THR 44 2HG2 THR 44 8.806 -13.230 4.168 354 3HG2 THR 44 3HG2 THR 44 9.396 -12.999 5.832 355 H LYS 45 H LYS 45 9.298 -8.624 6.747 356 HA LYS 45 HA LYS 45 9.461 -9.902 9.201 357 1HB LYS 45 1HB LYS 45 10.487 -7.588 7.990 358 2HB LYS 45 2HB LYS 45 9.641 -7.008 9.410 359 1HG LYS 45 1HG LYS 45 11.001 -9.348 10.273 360 2HG LYS 45 2HG LYS 45 12.146 -8.514 9.242 361 1HD LYS 45 1HD LYS 45 11.020 -6.441 10.772 362 2HD LYS 45 2HD LYS 45 11.144 -7.765 11.913 363 1HE LYS 45 1HE LYS 45 13.415 -6.643 10.203 364 2HE LYS 45 2HE LYS 45 13.223 -6.433 11.932 365 1HZ LYS 45 1HZ LYS 45 14.147 -8.720 10.480 366 2HZ LYS 45 2HZ LYS 45 14.501 -8.237 11.999 367 3HZ LYS 45 3HZ LYS 45 13.130 -9.074 11.707 368 H GLU 46 H GLU 46 7.088 -7.533 7.904 369 HA GLU 46 HA GLU 46 5.650 -7.784 10.418 370 1HB GLU 46 1HB GLU 46 5.963 -5.645 8.398 371 2HB GLU 46 2HB GLU 46 4.301 -5.877 8.904 372 1HG GLU 46 1HG GLU 46 6.173 -5.946 11.184 373 2HG GLU 46 2HG GLU 46 6.272 -4.438 10.296 374 H ARG 47 H ARG 47 5.829 -9.192 7.373 375 HA ARG 47 HA ARG 47 4.289 -9.956 5.937 376 1HB ARG 47 1HB ARG 47 3.194 -11.991 6.983 377 2HB ARG 47 2HB ARG 47 4.906 -11.860 7.333 378 1HG ARG 47 1HG ARG 47 4.538 -11.643 9.571 379 2HG ARG 47 2HG ARG 47 3.306 -10.420 9.332 380 1HD ARG 47 1HD ARG 47 2.296 -12.389 10.402 381 2HD ARG 47 2HD ARG 47 1.636 -12.210 8.788 382 HE ARG 47 HE ARG 47 2.667 -14.219 8.161 383 1HH1 ARG 47 1HH1 ARG 47 4.105 -13.064 11.158 384 2HH1 ARG 47 2HH1 ARG 47 5.029 -14.505 11.420 385 1HH2 ARG 47 1HH2 ARG 47 3.887 -16.120 8.506 386 2HH2 ARG 47 2HH2 ARG 47 4.905 -16.255 9.901 387 HA PRO 48 HA PRO 48 0.649 -7.604 7.485 388 1HB PRO 48 1HB PRO 48 0.688 -5.526 5.711 389 2HB PRO 48 2HB PRO 48 1.392 -5.432 7.312 390 1HG PRO 48 1HG PRO 48 2.753 -5.705 4.703 391 2HG PRO 48 2HG PRO 48 3.419 -5.190 6.239 392 1HD PRO 48 1HD PRO 48 3.749 -7.755 5.000 393 2HD PRO 48 2HD PRO 48 4.317 -7.277 6.587 394 H ASP 49 H ASP 49 -1.494 -7.366 6.602 395 HA ASP 49 HA ASP 49 -1.763 -9.273 4.493 396 1HB ASP 49 1HB ASP 49 -3.674 -7.718 6.266 397 2HB ASP 49 2HB ASP 49 -4.288 -8.577 4.868 398 H LEU 50 H LEU 50 -0.985 -6.041 4.603 399 HA LEU 50 HA LEU 50 -1.719 -5.587 1.911 400 1HB LEU 50 1HB LEU 50 -3.805 -5.112 3.564 401 2HB LEU 50 2HB LEU 50 -3.018 -3.547 3.614 402 HG LEU 50 HG LEU 50 -3.259 -3.235 1.260 403 1HD1 LEU 50 1HD1 LEU 50 -2.904 -5.065 0.011 404 2HD1 LEU 50 2HD1 LEU 50 -3.598 -6.163 1.228 405 3HD1 LEU 50 3HD1 LEU 50 -4.669 -5.268 0.124 406 1HD2 LEU 50 1HD2 LEU 50 -5.341 -2.560 1.605 407 2HD2 LEU 50 2HD2 LEU 50 -5.929 -4.221 1.354 408 3HD2 LEU 50 3HD2 LEU 50 -5.484 -3.672 2.988 409 H VAL 51 H VAL 51 -0.632 -3.723 1.049 410 HA VAL 51 HA VAL 51 1.075 -2.325 2.968 411 HB VAL 51 HB VAL 51 2.024 -3.620 0.404 412 1HG1 VAL 51 1HG1 VAL 51 3.033 -1.357 1.406 413 2HG1 VAL 51 2HG1 VAL 51 3.901 -2.513 2.446 414 3HG1 VAL 51 3HG1 VAL 51 4.059 -2.615 0.676 415 1HG2 VAL 51 1HG2 VAL 51 3.163 -5.234 1.702 416 2HG2 VAL 51 2HG2 VAL 51 2.870 -4.347 3.217 417 3HG2 VAL 51 3HG2 VAL 51 1.521 -5.158 2.385 418 H LEU 52 H LEU 52 1.553 -0.170 2.390 419 HA LEU 52 HA LEU 52 0.179 0.740 -0.042 420 1HB LEU 52 1HB LEU 52 -1.222 1.560 1.555 421 2HB LEU 52 2HB LEU 52 0.036 1.703 2.766 422 HG LEU 52 HG LEU 52 0.224 3.522 0.412 423 1HD1 LEU 52 1HD1 LEU 52 -1.508 4.936 0.953 424 2HD1 LEU 52 2HD1 LEU 52 -2.248 3.347 1.267 425 3HD1 LEU 52 3HD1 LEU 52 -1.636 4.327 2.621 426 1HD2 LEU 52 1HD2 LEU 52 1.924 3.984 1.859 427 2HD2 LEU 52 2HD2 LEU 52 0.682 5.081 2.508 428 3HD2 LEU 52 3HD2 LEU 52 0.986 3.515 3.298 429 H LEU 53 H LEU 53 1.550 1.573 -1.515 430 HA LEU 53 HA LEU 53 3.938 2.923 -0.488 431 1HB LEU 53 1HB LEU 53 4.638 0.712 -1.117 432 2HB LEU 53 2HB LEU 53 3.820 0.833 -2.662 433 HG LEU 53 HG LEU 53 6.334 1.093 -2.690 434 1HD1 LEU 53 1HD1 LEU 53 4.755 1.834 -4.507 435 2HD1 LEU 53 2HD1 LEU 53 4.856 3.476 -3.826 436 3HD1 LEU 53 3HD1 LEU 53 6.319 2.682 -4.458 437 1HD2 LEU 53 1HD2 LEU 53 6.251 3.939 -2.041 438 2HD2 LEU 53 2HD2 LEU 53 5.896 2.899 -0.641 439 3HD2 LEU 53 3HD2 LEU 53 7.409 2.679 -1.552 440 H ASP 54 H ASP 54 4.553 4.776 -1.630 441 HA ASP 54 HA ASP 54 2.557 5.598 -3.576 442 1HB ASP 54 1HB ASP 54 2.562 7.326 -2.043 443 2HB ASP 54 2HB ASP 54 4.188 6.974 -1.494 444 H MET 55 H MET 55 3.299 6.521 -5.623 445 HA MET 55 HA MET 55 5.580 5.349 -6.652 446 1HB MET 55 1HB MET 55 4.122 7.855 -7.659 447 2HB MET 55 2HB MET 55 5.090 6.769 -8.637 448 1HG MET 55 1HG MET 55 2.417 6.172 -7.296 449 2HG MET 55 2HG MET 55 2.773 6.172 -9.012 450 1HE MET 55 1HE MET 55 2.659 4.666 -5.812 451 2HE MET 55 2HE MET 55 2.918 2.925 -6.071 452 3HE MET 55 3HE MET 55 4.294 3.978 -5.665 453 H LYS 56 H LYS 56 4.939 8.831 -5.807 454 HA LYS 56 HA LYS 56 7.553 9.670 -6.372 455 1HB LYS 56 1HB LYS 56 5.085 10.817 -5.524 456 2HB LYS 56 2HB LYS 56 6.317 11.337 -4.392 457 1HG LYS 56 1HG LYS 56 6.265 12.928 -6.235 458 2HG LYS 56 2HG LYS 56 7.769 12.034 -6.332 459 1HD LYS 56 1HD LYS 56 6.394 10.414 -7.922 460 2HD LYS 56 2HD LYS 56 5.302 11.776 -8.074 461 1HE LYS 56 1HE LYS 56 7.376 13.204 -8.667 462 2HE LYS 56 2HE LYS 56 8.266 11.700 -8.788 463 1HZ LYS 56 1HZ LYS 56 7.288 11.232 -10.706 464 2HZ LYS 56 2HZ LYS 56 5.795 11.663 -10.204 465 3HZ LYS 56 3HZ LYS 56 6.830 12.799 -10.757 466 H ILE 57 H ILE 57 9.387 9.943 -5.082 467 HA ILE 57 HA ILE 57 9.320 9.487 -2.293 468 HB ILE 57 HB ILE 57 11.035 7.398 -3.058 469 1HG1 ILE 57 1HG1 ILE 57 8.302 6.881 -4.234 470 2HG1 ILE 57 2HG1 ILE 57 9.625 7.485 -5.212 471 1HG2 ILE 57 1HG2 ILE 57 8.703 7.870 -1.363 472 2HG2 ILE 57 2HG2 ILE 57 8.789 6.204 -1.983 473 3HG2 ILE 57 3HG2 ILE 57 10.158 6.887 -1.073 474 1HD1 ILE 57 1HD1 ILE 57 10.299 5.159 -3.465 475 2HD1 ILE 57 2HD1 ILE 57 9.158 4.830 -4.790 476 3HD1 ILE 57 3HD1 ILE 57 10.770 5.492 -5.149 477 HA PRO 58 HA PRO 58 13.116 11.491 -2.735 478 1HB PRO 58 1HB PRO 58 14.551 10.681 -0.554 479 2HB PRO 58 2HB PRO 58 13.292 11.898 -0.476 480 1HG PRO 58 1HG PRO 58 13.207 9.083 0.422 481 2HG PRO 58 2HG PRO 58 12.149 10.408 0.863 482 1HD PRO 58 1HD PRO 58 11.563 8.283 -0.972 483 2HD PRO 58 2HD PRO 58 10.553 9.670 -0.618 484 H GLY 59 H GLY 59 14.710 11.375 -4.180 485 1HA GLY 59 1HA GLY 59 16.277 10.417 -5.475 486 2HA GLY 59 2HA GLY 59 16.777 9.547 -4.039 487 H MET 60 H MET 60 15.453 9.263 -7.182 488 HA MET 60 HA MET 60 14.885 7.532 -8.377 489 1HB MET 60 1HB MET 60 16.269 5.813 -7.719 490 2HB MET 60 2HB MET 60 16.192 6.316 -6.042 491 1HG MET 60 1HG MET 60 14.229 5.010 -5.612 492 2HG MET 60 2HG MET 60 13.855 4.845 -7.316 493 1HE MET 60 1HE MET 60 14.535 1.248 -6.696 494 2HE MET 60 2HE MET 60 13.367 2.589 -6.761 495 3HE MET 60 3HE MET 60 14.293 2.144 -8.214 496 H ASP 61 H ASP 61 12.801 7.167 -9.008 497 HA ASP 61 HA ASP 61 10.751 7.426 -7.087 498 1HB ASP 61 1HB ASP 61 9.471 6.510 -9.336 499 2HB ASP 61 2HB ASP 61 9.885 8.191 -9.060 500 H GLY 62 H GLY 62 8.828 5.675 -7.238 501 1HA GLY 62 1HA GLY 62 10.016 3.103 -6.591 502 2HA GLY 62 2HA GLY 62 8.358 3.613 -6.345 503 H ILE 63 H ILE 63 10.336 3.763 -9.373 504 HA ILE 63 HA ILE 63 8.189 2.412 -10.758 505 HB ILE 63 HB ILE 63 10.713 3.809 -11.620 506 1HG1 ILE 63 1HG1 ILE 63 8.396 4.916 -10.885 507 2HG1 ILE 63 2HG1 ILE 63 9.408 5.582 -12.152 508 1HG2 ILE 63 1HG2 ILE 63 10.442 1.908 -13.101 509 2HG2 ILE 63 2HG2 ILE 63 8.730 2.321 -13.364 510 3HG2 ILE 63 3HG2 ILE 63 10.009 3.412 -13.949 511 1HD1 ILE 63 1HD1 ILE 63 7.062 3.675 -12.589 512 2HD1 ILE 63 2HD1 ILE 63 7.049 5.429 -12.894 513 3HD1 ILE 63 3HD1 ILE 63 8.086 4.363 -13.873 514 H GLU 64 H GLU 64 11.679 1.921 -9.961 515 HA GLU 64 HA GLU 64 11.560 -0.688 -11.144 516 1HB GLU 64 1HB GLU 64 13.832 0.600 -9.572 517 2HB GLU 64 2HB GLU 64 13.950 -0.805 -10.611 518 1HG GLU 64 1HG GLU 64 12.780 1.621 -11.902 519 2HG GLU 64 2HG GLU 64 14.462 1.772 -11.431 520 H ILE 65 H ILE 65 11.238 0.852 -7.990 521 HA ILE 65 HA ILE 65 11.913 -1.323 -6.374 522 HB ILE 65 HB ILE 65 10.518 1.254 -6.105 523 1HG1 ILE 65 1HG1 ILE 65 12.870 1.066 -5.601 524 2HG1 ILE 65 2HG1 ILE 65 11.986 1.419 -4.130 525 1HG2 ILE 65 1HG2 ILE 65 8.774 -0.066 -5.143 526 2HG2 ILE 65 2HG2 ILE 65 9.941 -1.037 -4.213 527 3HG2 ILE 65 3HG2 ILE 65 9.692 0.680 -3.813 528 1HD1 ILE 65 1HD1 ILE 65 11.945 -1.331 -4.083 529 2HD1 ILE 65 2HD1 ILE 65 13.503 -1.025 -4.888 530 3HD1 ILE 65 3HD1 ILE 65 13.183 -0.337 -3.278 531 H LEU 66 H LEU 66 8.616 -0.152 -7.375 532 HA LEU 66 HA LEU 66 7.293 -2.399 -6.399 533 1HB LEU 66 1HB LEU 66 6.652 -0.219 -8.345 534 2HB LEU 66 2HB LEU 66 5.566 -1.587 -8.199 535 HG LEU 66 HG LEU 66 4.653 0.004 -6.770 536 1HD1 LEU 66 1HD1 LEU 66 6.356 -1.426 -4.746 537 2HD1 LEU 66 2HD1 LEU 66 4.629 -1.000 -4.680 538 3HD1 LEU 66 3HD1 LEU 66 5.181 -2.317 -5.743 539 1HD2 LEU 66 1HD2 LEU 66 5.822 1.787 -6.164 540 2HD2 LEU 66 2HD2 LEU 66 6.664 0.799 -4.946 541 3HD2 LEU 66 3HD2 LEU 66 7.348 0.970 -6.580 542 H LYS 67 H LYS 67 8.999 -1.749 -9.461 543 HA LYS 67 HA LYS 67 7.939 -3.898 -10.904 544 1HB LYS 67 1HB LYS 67 9.971 -1.874 -11.222 545 2HB LYS 67 2HB LYS 67 10.598 -3.420 -11.758 546 1HG LYS 67 1HG LYS 67 8.124 -3.560 -12.886 547 2HG LYS 67 2HG LYS 67 8.303 -1.817 -12.846 548 1HD LYS 67 1HD LYS 67 10.762 -3.136 -13.786 549 2HD LYS 67 2HD LYS 67 9.380 -3.567 -14.775 550 1HE LYS 67 1HE LYS 67 9.331 -1.509 -15.741 551 2HE LYS 67 2HE LYS 67 9.312 -0.710 -14.182 552 1HZ LYS 67 1HZ LYS 67 11.580 -1.409 -15.840 553 2HZ LYS 67 2HZ LYS 67 11.306 -0.053 -14.973 554 3HZ LYS 67 3HZ LYS 67 11.802 -1.415 -14.222 555 H ARG 68 H ARG 68 11.189 -3.645 -9.286 556 HA ARG 68 HA ARG 68 11.789 -6.288 -9.562 557 1HB ARG 68 1HB ARG 68 12.698 -4.036 -7.817 558 2HB ARG 68 2HB ARG 68 13.075 -5.633 -7.203 559 1HG ARG 68 1HG ARG 68 14.244 -6.225 -9.280 560 2HG ARG 68 2HG ARG 68 13.727 -4.737 -10.048 561 1HD ARG 68 1HD ARG 68 15.915 -4.192 -9.365 562 2HD ARG 68 2HD ARG 68 14.958 -3.538 -8.051 563 HE ARG 68 HE ARG 68 15.958 -5.086 -6.624 564 1HH1 ARG 68 1HH1 ARG 68 16.172 -6.302 -9.919 565 2HH1 ARG 68 2HH1 ARG 68 17.113 -7.689 -9.482 566 1HH2 ARG 68 1HH2 ARG 68 17.199 -6.916 -6.047 567 2HH2 ARG 68 2HH2 ARG 68 17.701 -8.041 -7.265 568 H MET 69 H MET 69 9.635 -4.643 -7.292 569 HA MET 69 HA MET 69 9.645 -6.568 -5.283 570 1HB MET 69 1HB MET 69 8.156 -4.156 -6.058 571 2HB MET 69 2HB MET 69 7.050 -5.360 -5.428 572 1HG MET 69 1HG MET 69 8.035 -5.362 -3.296 573 2HG MET 69 2HG MET 69 9.608 -4.881 -3.900 574 1HE MET 69 1HE MET 69 6.106 -2.217 -2.716 575 2HE MET 69 2HE MET 69 5.843 -3.480 -3.942 576 3HE MET 69 3HE MET 69 6.406 -3.925 -2.313 577 H LYS 70 H LYS 70 7.442 -6.050 -8.122 578 HA LYS 70 HA LYS 70 5.960 -8.420 -7.521 579 1HB LYS 70 1HB LYS 70 4.552 -7.776 -9.235 580 2HB LYS 70 2HB LYS 70 5.176 -6.234 -8.683 581 1HG LYS 70 1HG LYS 70 5.374 -6.139 -11.057 582 2HG LYS 70 2HG LYS 70 7.001 -6.470 -10.497 583 1HD LYS 70 1HD LYS 70 7.061 -8.461 -11.591 584 2HD LYS 70 2HD LYS 70 5.553 -8.978 -10.863 585 1HE LYS 70 1HE LYS 70 4.241 -8.116 -12.621 586 2HE LYS 70 2HE LYS 70 5.443 -6.927 -13.080 587 1HZ LYS 70 1HZ LYS 70 5.757 -9.826 -13.440 588 2HZ LYS 70 2HZ LYS 70 5.320 -8.782 -14.617 589 3HZ LYS 70 3HZ LYS 70 6.804 -8.678 -13.942 590 H VAL 71 H VAL 71 8.618 -7.450 -9.735 591 HA VAL 71 HA VAL 71 8.628 -9.800 -11.250 592 HB VAL 71 HB VAL 71 10.932 -7.967 -10.562 593 1HG1 VAL 71 1HG1 VAL 71 10.808 -9.090 -13.262 594 2HG1 VAL 71 2HG1 VAL 71 12.156 -9.045 -12.100 595 3HG1 VAL 71 3HG1 VAL 71 10.938 -10.339 -12.000 596 1HG2 VAL 71 1HG2 VAL 71 10.127 -6.371 -11.934 597 2HG2 VAL 71 2HG2 VAL 71 9.509 -7.554 -13.111 598 3HG2 VAL 71 3HG2 VAL 71 8.554 -7.160 -11.662 599 H ILE 72 H ILE 72 9.799 -9.006 -8.004 600 HA ILE 72 HA ILE 72 11.538 -11.261 -7.837 601 HB ILE 72 HB ILE 72 10.544 -9.131 -6.004 602 1HG1 ILE 72 1HG1 ILE 72 12.608 -9.038 -7.559 603 2HG1 ILE 72 2HG1 ILE 72 12.762 -8.473 -5.907 604 1HG2 ILE 72 1HG2 ILE 72 11.869 -10.292 -4.156 605 2HG2 ILE 72 2HG2 ILE 72 10.252 -10.936 -4.529 606 3HG2 ILE 72 3HG2 ILE 72 11.703 -11.776 -5.125 607 1HD1 ILE 72 1HD1 ILE 72 14.542 -10.169 -6.952 608 2HD1 ILE 72 2HD1 ILE 72 14.057 -10.296 -5.244 609 3HD1 ILE 72 3HD1 ILE 72 13.336 -11.381 -6.457 610 H ASP 73 H ASP 73 8.158 -10.478 -6.875 611 HA ASP 73 HA ASP 73 7.625 -13.288 -6.866 612 1HB ASP 73 1HB ASP 73 7.961 -11.750 -4.393 613 2HB ASP 73 2HB ASP 73 6.328 -12.376 -4.506 614 H GLU 74 H GLU 74 5.174 -13.647 -6.730 615 HA GLU 74 HA GLU 74 3.823 -11.248 -7.681 616 1HB GLU 74 1HB GLU 74 2.476 -12.607 -9.053 617 2HB GLU 74 2HB GLU 74 4.041 -13.391 -9.144 618 1HG GLU 74 1HG GLU 74 3.306 -14.942 -7.267 619 2HG GLU 74 2HG GLU 74 1.714 -14.215 -7.345 620 H ASN 75 H ASN 75 4.154 -13.345 -5.006 621 HA ASN 75 HA ASN 75 1.465 -13.393 -4.188 622 1HB ASN 75 1HB ASN 75 2.636 -13.924 -1.886 623 2HB ASN 75 2HB ASN 75 2.810 -15.077 -3.195 624 1HD2 ASN 75 1HD2 ASN 75 4.758 -15.875 -3.253 625 2HD2 ASN 75 2HD2 ASN 75 6.253 -15.027 -3.038 626 H ILE 76 H ILE 76 3.977 -11.004 -4.253 627 HA ILE 76 HA ILE 76 3.370 -9.607 -1.882 628 HB ILE 76 HB ILE 76 5.488 -9.441 -3.100 629 1HG1 ILE 76 1HG1 ILE 76 4.007 -6.812 -2.797 630 2HG1 ILE 76 2HG1 ILE 76 4.815 -7.691 -1.514 631 1HG2 ILE 76 1HG2 ILE 76 5.585 -7.953 -5.118 632 2HG2 ILE 76 2HG2 ILE 76 4.802 -9.529 -5.382 633 3HG2 ILE 76 3HG2 ILE 76 3.810 -8.061 -5.207 634 1HD1 ILE 76 1HD1 ILE 76 6.799 -7.518 -3.475 635 2HD1 ILE 76 2HD1 ILE 76 5.961 -5.953 -3.599 636 3HD1 ILE 76 3HD1 ILE 76 6.657 -6.468 -2.044 637 H ARG 77 H ARG 77 1.741 -8.220 -1.383 638 HA ARG 77 HA ARG 77 0.088 -7.395 -3.634 639 1HB ARG 77 1HB ARG 77 -1.432 -8.750 -2.512 640 2HB ARG 77 2HB ARG 77 -0.615 -8.576 -0.971 641 1HG ARG 77 1HG ARG 77 -1.726 -6.586 -0.437 642 2HG ARG 77 2HG ARG 77 -1.942 -6.125 -2.114 643 1HD ARG 77 1HD ARG 77 -4.080 -6.848 -0.929 644 2HD ARG 77 2HD ARG 77 -3.750 -7.704 -2.422 645 HE ARG 77 HE ARG 77 -3.465 -8.804 0.329 646 1HH1 ARG 77 1HH1 ARG 77 -3.235 -9.297 -3.147 647 2HH1 ARG 77 2HH1 ARG 77 -3.190 -11.025 -3.028 648 1HH2 ARG 77 1HH2 ARG 77 -3.407 -11.083 0.487 649 2HH2 ARG 77 2HH2 ARG 77 -3.289 -12.048 -0.947 650 H VAL 78 H VAL 78 0.416 -5.213 -3.960 651 HA VAL 78 HA VAL 78 0.273 -3.484 -1.622 652 HB VAL 78 HB VAL 78 2.698 -4.138 -2.348 653 1HG1 VAL 78 1HG1 VAL 78 2.390 -3.677 -4.744 654 2HG1 VAL 78 2HG1 VAL 78 2.044 -1.970 -4.374 655 3HG1 VAL 78 3HG1 VAL 78 3.658 -2.644 -4.040 656 1HG2 VAL 78 1HG2 VAL 78 3.414 -2.307 -1.197 657 2HG2 VAL 78 2HG2 VAL 78 2.417 -1.179 -2.147 658 3HG2 VAL 78 3HG2 VAL 78 1.674 -2.152 -0.854 659 H ILE 79 H ILE 79 -0.290 -1.244 -2.203 660 HA ILE 79 HA ILE 79 -1.525 -1.136 -4.868 661 HB ILE 79 HB ILE 79 -2.593 -0.624 -2.182 662 1HG1 ILE 79 1HG1 ILE 79 -3.690 -1.374 -4.893 663 2HG1 ILE 79 2HG1 ILE 79 -3.565 -2.367 -3.455 664 1HG2 ILE 79 1HG2 ILE 79 -2.325 1.694 -2.943 665 2HG2 ILE 79 2HG2 ILE 79 -3.231 1.311 -4.426 666 3HG2 ILE 79 3HG2 ILE 79 -4.038 1.223 -2.843 667 1HD1 ILE 79 1HD1 ILE 79 -5.842 -1.754 -3.464 668 2HD1 ILE 79 2HD1 ILE 79 -5.129 -0.567 -2.346 669 3HD1 ILE 79 3HD1 ILE 79 -5.494 -0.101 -4.025 670 H ILE 80 H ILE 80 -1.316 0.802 -6.051 671 HA ILE 80 HA ILE 80 0.803 2.534 -5.007 672 HB ILE 80 HB ILE 80 1.340 3.053 -7.249 673 1HG1 ILE 80 1HG1 ILE 80 0.024 2.013 -9.160 674 2HG1 ILE 80 2HG1 ILE 80 -1.238 1.655 -7.998 675 1HG2 ILE 80 1HG2 ILE 80 1.350 0.385 -6.252 676 2HG2 ILE 80 2HG2 ILE 80 1.056 0.320 -8.006 677 3HG2 ILE 80 3HG2 ILE 80 2.490 1.165 -7.375 678 1HD1 ILE 80 1HD1 ILE 80 -1.939 3.822 -7.920 679 2HD1 ILE 80 2HD1 ILE 80 -0.275 4.443 -7.806 680 3HD1 ILE 80 3HD1 ILE 80 -0.969 4.044 -9.396 681 H MET 81 H MET 81 0.609 4.884 -5.399 682 HA MET 81 HA MET 81 -2.139 5.731 -5.782 683 1HB MET 81 1HB MET 81 -1.066 7.418 -3.752 684 2HB MET 81 2HB MET 81 -2.329 6.221 -3.547 685 1HG MET 81 1HG MET 81 -0.792 4.534 -2.835 686 2HG MET 81 2HG MET 81 0.590 5.377 -3.508 687 1HE MET 81 1HE MET 81 2.167 5.714 -1.048 688 2HE MET 81 2HE MET 81 1.117 5.287 0.324 689 3HE MET 81 3HE MET 81 1.096 4.297 -1.155 690 H THR 82 H THR 82 -2.254 7.444 -7.180 691 HA THR 82 HA THR 82 -0.422 9.578 -7.156 692 HB THR 82 HB THR 82 1.259 8.321 -8.209 693 HG1 THR 82 HG1 THR 82 1.114 9.544 -10.046 694 1HG2 THR 82 1HG2 THR 82 0.329 6.805 -10.287 695 2HG2 THR 82 2HG2 THR 82 0.558 6.147 -8.649 696 3HG2 THR 82 3HG2 THR 82 -1.058 6.674 -9.179 697 H ALA 83 H ALA 83 -1.156 11.324 -8.363 698 HA ALA 83 HA ALA 83 -3.867 11.365 -8.913 699 1HB ALA 83 1HB ALA 83 -3.422 13.566 -9.055 700 2HB ALA 83 2HB ALA 83 -1.706 13.164 -8.811 701 3HB ALA 83 3HB ALA 83 -2.357 13.319 -10.460 702 H TYR 84 H TYR 84 -4.977 11.686 -11.020 703 HA TYR 84 HA TYR 84 -4.185 9.660 -12.850 704 1HB TYR 84 1HB TYR 84 -6.233 10.678 -14.058 705 2HB TYR 84 2HB TYR 84 -6.549 10.198 -12.403 706 HD1 TYR 84 HD1 TYR 84 -6.193 13.030 -14.705 707 HD2 TYR 84 HD2 TYR 84 -6.873 11.885 -10.640 708 HE1 TYR 84 HE1 TYR 84 -7.006 15.379 -14.172 709 HE2 TYR 84 HE2 TYR 84 -7.684 14.238 -10.120 710 HH TYR 84 HH TYR 84 -8.605 16.110 -11.243 711 H GLY 85 H GLY 85 -1.945 11.135 -12.864 712 1HA GLY 85 1HA GLY 85 -2.153 12.798 -15.304 713 2HA GLY 85 2HA GLY 85 -1.039 13.109 -13.988 714 H GLU 86 H GLU 86 -0.126 10.483 -13.382 715 HA GLU 86 HA GLU 86 1.417 10.011 -15.791 716 1HB GLU 86 1HB GLU 86 2.847 8.629 -14.109 717 2HB GLU 86 2HB GLU 86 2.890 10.377 -13.992 718 1HG GLU 86 1HG GLU 86 1.605 10.426 -12.030 719 2HG GLU 86 2HG GLU 86 0.792 8.916 -12.392 720 H LEU 87 H LEU 87 -1.139 9.070 -16.096 721 HA LEU 87 HA LEU 87 -1.814 6.628 -15.104 722 1HB LEU 87 1HB LEU 87 -2.225 7.656 -17.916 723 2HB LEU 87 2HB LEU 87 -3.103 6.333 -17.173 724 HG LEU 87 HG LEU 87 -3.147 8.967 -15.768 725 1HD1 LEU 87 1HD1 LEU 87 -4.365 8.458 -18.460 726 2HD1 LEU 87 2HD1 LEU 87 -5.225 9.472 -17.276 727 3HD1 LEU 87 3HD1 LEU 87 -3.590 9.925 -17.814 728 1HD2 LEU 87 1HD2 LEU 87 -4.260 6.750 -15.038 729 2HD2 LEU 87 2HD2 LEU 87 -5.202 8.258 -14.947 730 3HD2 LEU 87 3HD2 LEU 87 -5.466 7.123 -16.293 731 H ASP 88 H ASP 88 0.550 7.428 -17.681 732 HA ASP 88 HA ASP 88 0.959 5.062 -18.820 733 1HB ASP 88 1HB ASP 88 2.436 7.475 -18.447 734 2HB ASP 88 2HB ASP 88 3.548 6.179 -18.054 735 H MET 89 H MET 89 2.321 6.234 -15.661 736 HA MET 89 HA MET 89 3.784 3.907 -15.161 737 1HB MET 89 1HB MET 89 4.105 6.206 -14.098 738 2HB MET 89 2HB MET 89 2.628 5.956 -13.189 739 1HG MET 89 1HG MET 89 3.807 3.711 -12.398 740 2HG MET 89 2HG MET 89 5.279 4.508 -12.918 741 1HE MET 89 1HE MET 89 6.129 4.137 -10.850 742 2HE MET 89 2HE MET 89 6.603 5.826 -10.550 743 3HE MET 89 3HE MET 89 5.723 4.913 -9.301 744 H ILE 90 H ILE 90 0.637 5.117 -13.788 745 HA ILE 90 HA ILE 90 0.045 3.058 -12.138 746 HB ILE 90 HB ILE 90 -1.729 4.723 -13.914 747 1HG1 ILE 90 1HG1 ILE 90 -1.939 5.175 -11.069 748 2HG1 ILE 90 2HG1 ILE 90 -0.260 5.277 -11.562 749 1HG2 ILE 90 1HG2 ILE 90 -3.189 2.995 -13.542 750 2HG2 ILE 90 2HG2 ILE 90 -2.439 2.541 -11.993 751 3HG2 ILE 90 3HG2 ILE 90 -3.476 3.984 -12.090 752 1HD1 ILE 90 1HD1 ILE 90 -1.634 7.448 -11.725 753 2HD1 ILE 90 2HD1 ILE 90 -0.718 6.989 -13.181 754 3HD1 ILE 90 3HD1 ILE 90 -2.471 6.693 -13.102 755 H GLN 91 H GLN 91 -0.496 3.204 -15.712 756 HA GLN 91 HA GLN 91 -1.807 0.831 -15.967 757 1HB GLN 91 1HB GLN 91 -0.132 2.558 -17.734 758 2HB GLN 91 2HB GLN 91 -0.343 0.907 -18.283 759 1HG GLN 91 1HG GLN 91 -2.889 1.958 -17.320 760 2HG GLN 91 2HG GLN 91 -2.204 3.057 -18.500 761 1HE2 GLN 91 1HE2 GLN 91 -2.352 2.609 -20.581 762 2HE2 GLN 91 2HE2 GLN 91 -2.883 1.115 -21.279 763 H GLU 92 H GLU 92 1.772 1.418 -16.275 764 HA GLU 92 HA GLU 92 2.445 -1.219 -16.633 765 1HB GLU 92 1HB GLU 92 3.807 1.303 -16.025 766 2HB GLU 92 2HB GLU 92 4.593 -0.043 -15.225 767 1HG GLU 92 1HG GLU 92 5.647 -0.016 -17.337 768 2HG GLU 92 2HG GLU 92 4.432 -1.263 -17.535 769 H SER 93 H SER 93 1.489 0.547 -13.735 770 HA SER 93 HA SER 93 2.681 -1.188 -11.891 771 1HB SER 93 1HB SER 93 1.772 0.217 -10.332 772 2HB SER 93 2HB SER 93 1.458 1.238 -11.721 773 HG SER 93 HG SER 93 -0.552 1.119 -10.902 774 H LYS 94 H LYS 94 -0.674 -0.910 -13.255 775 HA LYS 94 HA LYS 94 -1.808 -2.989 -11.835 776 1HB LYS 94 1HB LYS 94 -2.539 -1.221 -13.916 777 2HB LYS 94 2HB LYS 94 -2.868 -2.833 -14.520 778 1HG LYS 94 1HG LYS 94 -3.851 -3.105 -11.986 779 2HG LYS 94 2HG LYS 94 -4.097 -1.383 -12.200 780 1HD LYS 94 1HD LYS 94 -5.154 -2.050 -14.518 781 2HD LYS 94 2HD LYS 94 -5.245 -3.665 -13.844 782 1HE LYS 94 1HE LYS 94 -6.336 -2.342 -11.759 783 2HE LYS 94 2HE LYS 94 -6.714 -1.169 -13.004 784 1HZ LYS 94 1HZ LYS 94 -8.460 -2.757 -12.816 785 2HZ LYS 94 2HZ LYS 94 -7.737 -2.969 -14.265 786 3HZ LYS 94 3HZ LYS 94 -7.443 -4.015 -13.045 787 H GLU 95 H GLU 95 0.028 -3.008 -14.944 788 HA GLU 95 HA GLU 95 -0.348 -5.765 -15.321 789 1HB GLU 95 1HB GLU 95 0.744 -5.419 -17.305 790 2HB GLU 95 2HB GLU 95 0.461 -3.732 -16.925 791 1HG GLU 95 1HG GLU 95 2.752 -3.657 -17.313 792 2HG GLU 95 2HG GLU 95 2.763 -3.963 -15.587 793 H LEU 96 H LEU 96 1.757 -3.848 -13.304 794 HA LEU 96 HA LEU 96 3.912 -5.673 -13.161 795 1HB LEU 96 1HB LEU 96 3.165 -3.121 -12.080 796 2HB LEU 96 2HB LEU 96 3.736 -4.153 -10.784 797 HG LEU 96 HG LEU 96 5.787 -4.619 -12.236 798 1HD1 LEU 96 1HD1 LEU 96 4.595 -3.674 -14.313 799 2HD1 LEU 96 2HD1 LEU 96 5.047 -2.077 -13.672 800 3HD1 LEU 96 3HD1 LEU 96 6.310 -3.268 -14.063 801 1HD2 LEU 96 1HD2 LEU 96 6.782 -2.322 -11.667 802 2HD2 LEU 96 2HD2 LEU 96 5.180 -1.942 -10.990 803 3HD2 LEU 96 3HD2 LEU 96 6.123 -3.301 -10.334 804 H GLY 97 H GLY 97 0.663 -5.686 -11.953 805 1HA GLY 97 1HA GLY 97 -0.164 -7.752 -11.091 806 2HA GLY 97 2HA GLY 97 1.351 -7.993 -10.245 807 H ALA 98 H ALA 98 0.176 -4.700 -10.278 808 HA ALA 98 HA ALA 98 -0.091 -4.708 -7.453 809 1HB ALA 98 1HB ALA 98 -1.226 -2.352 -8.515 810 2HB ALA 98 2HB ALA 98 0.440 -2.575 -7.929 811 3HB ALA 98 3HB ALA 98 0.063 -2.812 -9.652 812 H LEU 99 H LEU 99 -2.026 -4.242 -6.209 813 HA LEU 99 HA LEU 99 -4.221 -5.770 -7.023 814 1HB LEU 99 1HB LEU 99 -3.856 -3.738 -4.823 815 2HB LEU 99 2HB LEU 99 -5.313 -4.690 -5.026 816 HG LEU 99 HG LEU 99 -3.803 -5.599 -3.307 817 1HD1 LEU 99 1HD1 LEU 99 -4.725 -7.121 -5.666 818 2HD1 LEU 99 2HD1 LEU 99 -3.534 -7.948 -4.634 819 3HD1 LEU 99 3HD1 LEU 99 -5.059 -7.357 -3.934 820 1HD2 LEU 99 1HD2 LEU 99 -1.873 -6.067 -5.596 821 2HD2 LEU 99 2HD2 LEU 99 -1.665 -4.910 -4.260 822 3HD2 LEU 99 3HD2 LEU 99 -1.684 -6.659 -3.928 823 H THR 100 H THR 100 -3.646 -2.198 -6.938 824 HA THR 100 HA THR 100 -5.281 -1.800 -9.214 825 HB THR 100 HB THR 100 -7.054 -2.256 -7.474 826 HG1 THR 100 HG1 THR 100 -7.842 -0.764 -8.933 827 1HG2 THR 100 1HG2 THR 100 -5.549 -0.021 -6.097 828 2HG2 THR 100 2HG2 THR 100 -7.325 -0.041 -5.975 829 3HG2 THR 100 3HG2 THR 100 -6.377 -1.425 -5.381 830 H HIS 101 H HIS 101 -5.983 0.908 -8.770 831 HA HIS 101 HA HIS 101 -3.517 2.165 -7.924 832 1HB HIS 101 1HB HIS 101 -3.550 3.501 -10.127 833 2HB HIS 101 2HB HIS 101 -2.848 1.896 -10.122 834 HD1 HIS 101 HD1 HIS 101 -3.546 0.513 -12.070 835 HD2 HIS 101 HD2 HIS 101 -6.506 3.274 -10.970 836 HE1 HIS 101 HE1 HIS 101 -5.452 0.221 -13.741 837 H PHE 102 H PHE 102 -4.054 3.883 -6.676 838 HA PHE 102 HA PHE 102 -6.747 4.972 -7.045 839 1HB PHE 102 1HB PHE 102 -4.698 5.048 -4.749 840 2HB PHE 102 2HB PHE 102 -6.280 5.797 -4.662 841 HD1 PHE 102 HD1 PHE 102 -4.932 3.509 -2.967 842 HD2 PHE 102 HD2 PHE 102 -7.812 3.565 -6.083 843 HE1 PHE 102 HE1 PHE 102 -5.904 1.360 -2.107 844 HE2 PHE 102 HE2 PHE 102 -8.783 1.415 -5.224 845 HZ PHE 102 HZ PHE 102 -7.817 0.339 -3.246 846 H ALA 103 H ALA 103 -7.035 7.335 -6.771 847 HA ALA 103 HA ALA 103 -4.691 8.751 -7.821 848 1HB ALA 103 1HB ALA 103 -6.995 8.575 -9.052 849 2HB ALA 103 2HB ALA 103 -7.530 9.783 -7.860 850 3HB ALA 103 3HB ALA 103 -6.181 10.155 -8.960 851 H LYS 104 H LYS 104 -4.017 10.725 -6.861 852 HA LYS 104 HA LYS 104 -3.777 10.950 -4.268 853 1HB LYS 104 1HB LYS 104 -3.719 12.795 -6.483 854 2HB LYS 104 2HB LYS 104 -4.358 13.607 -5.068 855 1HG LYS 104 1HG LYS 104 -2.385 12.647 -3.742 856 2HG LYS 104 2HG LYS 104 -1.719 12.085 -5.262 857 1HD LYS 104 1HD LYS 104 -2.372 14.780 -5.771 858 2HD LYS 104 2HD LYS 104 -1.752 14.804 -4.132 859 1HE LYS 104 1HE LYS 104 0.388 14.336 -4.802 860 2HE LYS 104 2HE LYS 104 -0.134 13.102 -5.931 861 1HZ LYS 104 1HZ LYS 104 0.847 15.310 -6.778 862 2HZ LYS 104 2HZ LYS 104 -0.403 14.628 -7.577 863 3HZ LYS 104 3HZ LYS 104 -0.667 15.887 -6.571 864 HA PRO 105 HA PRO 105 -8.024 12.870 -3.580 865 1HB PRO 105 1HB PRO 105 -9.776 13.199 -5.651 866 2HB PRO 105 2HB PRO 105 -8.703 14.467 -5.093 867 1HG PRO 105 1HG PRO 105 -8.492 12.797 -7.523 868 2HG PRO 105 2HG PRO 105 -7.700 14.319 -7.164 869 1HD PRO 105 1HD PRO 105 -6.520 11.707 -7.072 870 2HD PRO 105 2HD PRO 105 -5.763 13.216 -6.602 871 H PHE 106 H PHE 106 -8.290 11.000 -2.377 872 HA PHE 106 HA PHE 106 -10.168 9.172 -3.696 873 1HB PHE 106 1HB PHE 106 -8.837 7.598 -1.874 874 2HB PHE 106 2HB PHE 106 -8.302 7.760 -3.535 875 HD1 PHE 106 HD1 PHE 106 -7.981 9.900 -0.482 876 HD2 PHE 106 HD2 PHE 106 -6.016 7.914 -3.676 877 HE1 PHE 106 HE1 PHE 106 -5.777 10.799 0.315 878 HE2 PHE 106 HE2 PHE 106 -3.812 8.813 -2.879 879 HZ PHE 106 HZ PHE 106 -3.719 10.245 -0.893 880 H ASP 107 H ASP 107 -11.648 8.043 -2.221 881 HA ASP 107 HA ASP 107 -12.000 9.595 0.220 882 1HB ASP 107 1HB ASP 107 -13.783 9.143 -1.882 883 2HB ASP 107 2HB ASP 107 -14.272 7.931 -0.715 884 H ILE 108 H ILE 108 -12.388 8.397 2.194 885 HA ILE 108 HA ILE 108 -11.283 5.802 2.258 886 HB ILE 108 HB ILE 108 -11.899 7.865 4.062 887 1HG1 ILE 108 1HG1 ILE 108 -9.794 6.716 4.022 888 2HG1 ILE 108 2HG1 ILE 108 -10.512 6.507 5.607 889 1HG2 ILE 108 1HG2 ILE 108 -14.063 6.663 4.429 890 2HG2 ILE 108 2HG2 ILE 108 -13.126 5.265 5.008 891 3HG2 ILE 108 3HG2 ILE 108 -13.043 6.815 5.880 892 1HD1 ILE 108 1HD1 ILE 108 -11.368 4.376 3.783 893 2HD1 ILE 108 2HD1 ILE 108 -9.594 4.462 3.907 894 3HD1 ILE 108 3HD1 ILE 108 -10.580 4.251 5.374 895 H ASP 109 H ASP 109 -14.597 7.126 2.099 896 HA ASP 109 HA ASP 109 -15.938 4.843 2.829 897 1HB ASP 109 1HB ASP 109 -16.515 7.372 1.444 898 2HB ASP 109 2HB ASP 109 -17.483 6.063 0.795 899 H GLU 110 H GLU 110 -14.620 6.002 -0.328 900 HA GLU 110 HA GLU 110 -15.737 3.828 -1.766 901 1HB GLU 110 1HB GLU 110 -14.569 4.761 -3.683 902 2HB GLU 110 2HB GLU 110 -15.275 6.079 -2.770 903 1HG GLU 110 1HG GLU 110 -13.206 6.850 -1.996 904 2HG GLU 110 2HG GLU 110 -12.464 5.264 -2.061 905 H ILE 111 H ILE 111 -12.795 4.463 0.064 906 HA ILE 111 HA ILE 111 -11.310 2.349 -1.191 907 HB ILE 111 HB ILE 111 -10.859 4.358 0.958 908 1HG1 ILE 111 1HG1 ILE 111 -9.231 3.450 -1.435 909 2HG1 ILE 111 2HG1 ILE 111 -10.307 4.833 -1.398 910 1HG2 ILE 111 1HG2 ILE 111 -9.323 1.764 0.704 911 2HG2 ILE 111 2HG2 ILE 111 -8.675 3.221 1.495 912 3HG2 ILE 111 3HG2 ILE 111 -10.133 2.431 2.142 913 1HD1 ILE 111 1HD1 ILE 111 -8.599 5.101 0.876 914 2HD1 ILE 111 2HD1 ILE 111 -7.560 4.656 -0.499 915 3HD1 ILE 111 3HD1 ILE 111 -8.606 6.093 -0.602 916 H ARG 112 H ARG 112 -13.676 2.710 1.360 917 HA ARG 112 HA ARG 112 -12.872 0.538 2.900 918 1HB ARG 112 1HB ARG 112 -15.610 1.843 2.509 919 2HB ARG 112 2HB ARG 112 -15.295 0.626 3.730 920 1HG ARG 112 1HG ARG 112 -13.224 2.637 3.914 921 2HG ARG 112 2HG ARG 112 -14.772 3.456 3.862 922 1HD ARG 112 1HD ARG 112 -14.349 2.993 6.188 923 2HD ARG 112 2HD ARG 112 -15.582 1.852 5.691 924 HE ARG 112 HE ARG 112 -12.822 0.861 5.410 925 1HH1 ARG 112 1HH1 ARG 112 -15.654 1.078 7.488 926 2HH1 ARG 112 2HH1 ARG 112 -15.202 -0.282 8.461 927 1HH2 ARG 112 1HH2 ARG 112 -12.226 -0.933 6.693 928 2HH2 ARG 112 2HH2 ARG 112 -13.239 -1.434 8.006 929 H ASP 113 H ASP 113 -14.561 0.853 -0.171 930 HA ASP 113 HA ASP 113 -15.748 -1.739 0.010 931 1HB ASP 113 1HB ASP 113 -16.085 0.607 -1.581 932 2HB ASP 113 2HB ASP 113 -15.586 -0.650 -2.695 933 H ALA 114 H ALA 114 -13.059 -0.039 -1.726 934 HA ALA 114 HA ALA 114 -12.257 -2.326 -3.201 935 1HB ALA 114 1HB ALA 114 -11.477 0.485 -2.846 936 2HB ALA 114 2HB ALA 114 -10.082 -0.598 -3.070 937 3HB ALA 114 3HB ALA 114 -11.379 -0.552 -4.289 938 H VAL 115 H VAL 115 -11.823 -1.209 0.084 939 HA VAL 115 HA VAL 115 -9.354 -2.533 0.551 940 HB VAL 115 HB VAL 115 -11.476 -1.191 2.169 941 1HG1 VAL 115 1HG1 VAL 115 -9.634 -3.306 3.163 942 2HG1 VAL 115 2HG1 VAL 115 -9.753 -1.825 4.143 943 3HG1 VAL 115 3HG1 VAL 115 -11.216 -2.774 3.782 944 1HG2 VAL 115 1HG2 VAL 115 -9.300 -0.207 0.993 945 2HG2 VAL 115 2HG2 VAL 115 -9.880 0.408 2.560 946 3HG2 VAL 115 3HG2 VAL 115 -8.535 -0.757 2.504 947 H LYS 116 H LYS 116 -12.758 -3.466 0.436 948 HA LYS 116 HA LYS 116 -12.443 -5.827 1.984 949 1HB LYS 116 1HB LYS 116 -14.598 -4.740 1.802 950 2HB LYS 116 2HB LYS 116 -14.594 -4.906 0.058 951 1HG LYS 116 1HG LYS 116 -14.127 -7.504 1.317 952 2HG LYS 116 2HG LYS 116 -15.583 -6.773 1.963 953 1HD LYS 116 1HD LYS 116 -16.728 -7.145 0.036 954 2HD LYS 116 2HD LYS 116 -15.477 -6.389 -0.931 955 1HE LYS 116 1HE LYS 116 -14.243 -8.769 -0.256 956 2HE LYS 116 2HE LYS 116 -15.919 -9.276 -0.328 957 1HZ LYS 116 1HZ LYS 116 -15.354 -7.607 -2.497 958 2HZ LYS 116 2HZ LYS 116 -14.237 -8.797 -2.441 959 3HZ LYS 116 3HZ LYS 116 -15.825 -9.170 -2.509 960 H LYS 117 H LYS 117 -11.951 -4.900 -1.407 961 HA LYS 117 HA LYS 117 -11.618 -7.698 -2.141 962 1HB LYS 117 1HB LYS 117 -11.851 -7.035 -4.347 963 2HB LYS 117 2HB LYS 117 -12.919 -5.928 -3.509 964 1HG LYS 117 1HG LYS 117 -11.234 -4.151 -3.560 965 2HG LYS 117 2HG LYS 117 -10.019 -5.252 -4.180 966 1HD LYS 117 1HD LYS 117 -11.515 -5.611 -6.226 967 2HD LYS 117 2HD LYS 117 -12.546 -4.330 -5.622 968 1HE LYS 117 1HE LYS 117 -11.029 -2.665 -6.147 969 2HE LYS 117 2HE LYS 117 -9.639 -3.651 -5.740 970 1HZ LYS 117 1HZ LYS 117 -9.411 -3.917 -7.904 971 2HZ LYS 117 2HZ LYS 117 -10.737 -4.870 -7.900 972 3HZ LYS 117 3HZ LYS 117 -10.875 -3.281 -8.249 973 H TYR 118 H TYR 118 -9.805 -4.623 -1.739 974 HA TYR 118 HA TYR 118 -7.379 -5.540 -2.783 975 1HB TYR 118 1HB TYR 118 -8.061 -3.158 -2.263 976 2HB TYR 118 2HB TYR 118 -8.145 -3.550 -0.557 977 HD1 TYR 118 HD1 TYR 118 -6.606 -1.566 -0.258 978 HD2 TYR 118 HD2 TYR 118 -5.407 -5.101 -2.348 979 HE1 TYR 118 HE1 TYR 118 -4.165 -0.906 0.011 980 HE2 TYR 118 HE2 TYR 118 -2.971 -4.429 -2.073 981 HH TYR 118 HH TYR 118 -1.868 -2.487 0.055 982 H LEU 119 H LEU 119 -8.712 -5.539 0.585 983 HA LEU 119 HA LEU 119 -6.343 -6.889 1.535 984 1HB LEU 119 1HB LEU 119 -7.968 -5.087 2.665 985 2HB LEU 119 2HB LEU 119 -8.760 -6.546 3.226 986 HG LEU 119 HG LEU 119 -5.837 -6.561 3.599 987 1HD1 LEU 119 1HD1 LEU 119 -6.996 -4.925 5.704 988 2HD1 LEU 119 2HD1 LEU 119 -5.511 -4.688 4.752 989 3HD1 LEU 119 3HD1 LEU 119 -7.074 -4.121 4.117 990 1HD2 LEU 119 1HD2 LEU 119 -7.706 -8.150 4.492 991 2HD2 LEU 119 2HD2 LEU 119 -6.329 -7.717 5.534 992 3HD2 LEU 119 3HD2 LEU 119 -7.899 -6.907 5.752 993 HA PRO 120 HA PRO 120 -7.969 -10.859 1.026 994 1HB PRO 120 1HB PRO 120 -6.351 -12.272 2.715 995 2HB PRO 120 2HB PRO 120 -5.868 -11.799 1.099 996 1HG PRO 120 1HG PRO 120 -5.033 -10.653 3.693 997 2HG PRO 120 2HG PRO 120 -4.265 -10.496 2.126 998 1HD PRO 120 1HD PRO 120 -5.864 -8.523 3.460 999 2HD PRO 120 2HD PRO 120 -5.193 -8.411 1.845 1000 H LEU 121 H LEU 121 -9.823 -9.521 2.267 1001 HA LEU 121 HA LEU 121 -10.250 -10.840 4.822 1002 1HB LEU 121 1HB LEU 121 -10.596 -8.515 4.879 1003 2HB LEU 121 2HB LEU 121 -11.529 -8.522 3.396 1004 HG LEU 121 HG LEU 121 -13.314 -9.825 4.609 1005 1HD1 LEU 121 1HD1 LEU 121 -12.346 -8.945 7.248 1006 2HD1 LEU 121 2HD1 LEU 121 -13.163 -10.449 6.759 1007 3HD1 LEU 121 3HD1 LEU 121 -11.410 -10.268 6.511 1008 1HD2 LEU 121 1HD2 LEU 121 -13.129 -7.242 4.270 1009 2HD2 LEU 121 2HD2 LEU 121 -14.371 -7.915 5.353 1010 3HD2 LEU 121 3HD2 LEU 121 -12.880 -7.219 6.032 1011 H LYS 122 H LYS 122 -12.560 -11.665 5.243 1012 HA LYS 122 HA LYS 122 -13.075 -13.859 3.783 1013 1HB LYS 122 1HB LYS 122 -14.126 -13.496 5.900 1014 2HB LYS 122 2HB LYS 122 -14.976 -12.077 5.322 1015 1HG LYS 122 1HG LYS 122 -15.470 -14.532 3.711 1016 2HG LYS 122 2HG LYS 122 -16.026 -14.640 5.369 1017 1HD LYS 122 1HD LYS 122 -16.796 -12.046 4.457 1018 2HD LYS 122 2HD LYS 122 -17.178 -13.146 3.147 1019 1HE LYS 122 1HE LYS 122 -18.218 -14.657 5.062 1020 2HE LYS 122 2HE LYS 122 -18.214 -13.175 5.997 1021 1HZ LYS 122 1HZ LYS 122 -20.185 -13.808 4.437 1022 2HZ LYS 122 2HZ LYS 122 -19.757 -12.249 4.661 1023 3HZ LYS 122 3HZ LYS 122 -19.284 -13.039 3.313 1024 H SER 123 H SER 123 -12.998 -13.854 1.564 1025 HA SER 123 HA SER 123 -14.006 -11.813 0.006 1026 1HB SER 123 1HB SER 123 -12.950 -14.541 -0.389 1027 2HB SER 123 2HB SER 123 -14.137 -14.099 -1.601 1028 HG SER 123 HG SER 123 -12.058 -12.239 -0.926 1029 H ASN 124 H ASN 124 -16.001 -11.527 -1.112 1030 HA ASN 124 HA ASN 124 -18.239 -12.456 0.203 1031 1HB ASN 124 1HB ASN 124 -17.852 -10.426 -1.478 1032 2HB ASN 124 2HB ASN 124 -18.317 -11.583 -2.709 1033 1HD2 ASN 124 1HD2 ASN 124 -19.338 -9.491 -0.230 1034 2HD2 ASN 124 2HD2 ASN 124 -21.039 -9.819 -0.258 Start of MODEL 3 1 1H MET 1 1H MET 1 -12.646 -13.487 12.003 2 HA MET 1 HA MET 1 -13.015 -14.127 14.649 3 1HB MET 1 1HB MET 1 -10.726 -15.479 13.320 4 2HB MET 1 2HB MET 1 -10.224 -14.543 14.714 5 1HG MET 1 1HG MET 1 -12.586 -16.461 14.868 6 2HG MET 1 2HG MET 1 -10.943 -17.020 15.112 7 1HE MET 1 1HE MET 1 -9.716 -15.035 18.168 8 2HE MET 1 2HE MET 1 -9.606 -16.654 17.437 9 3HE MET 1 3HE MET 1 -9.323 -15.207 16.440 10 H MET 2 H MET 2 -9.888 -13.179 13.080 11 HA MET 2 HA MET 2 -10.341 -10.496 12.946 12 1HB MET 2 1HB MET 2 -10.342 -11.214 15.625 13 2HB MET 2 2HB MET 2 -8.643 -10.852 15.397 14 1HG MET 2 1HG MET 2 -9.028 -8.588 14.984 15 2HG MET 2 2HG MET 2 -10.600 -8.871 14.262 16 1HE MET 2 1HE MET 2 -9.484 -6.826 16.125 17 2HE MET 2 2HE MET 2 -11.179 -6.451 16.521 18 3HE MET 2 3HE MET 2 -10.026 -6.841 17.820 19 H ASN 3 H ASN 3 -7.674 -9.682 14.121 20 HA ASN 3 HA ASN 3 -5.505 -9.900 13.769 21 1HB ASN 3 1HB ASN 3 -6.141 -12.489 13.256 22 2HB ASN 3 2HB ASN 3 -5.748 -12.008 11.617 23 1HD2 ASN 3 1HD2 ASN 3 -4.538 -13.395 14.269 24 2HD2 ASN 3 2HD2 ASN 3 -2.854 -13.006 14.150 25 H GLU 4 H GLU 4 -4.100 -8.905 12.121 26 HA GLU 4 HA GLU 4 -4.544 -8.792 9.472 27 1HB GLU 4 1HB GLU 4 -6.621 -7.344 10.781 28 2HB GLU 4 2HB GLU 4 -5.563 -6.136 10.079 29 1HG GLU 4 1HG GLU 4 -6.057 -6.753 7.911 30 2HG GLU 4 2HG GLU 4 -6.149 -8.459 8.301 31 H LYS 5 H LYS 5 -3.197 -7.090 8.390 32 HA LYS 5 HA LYS 5 -1.625 -5.432 10.155 33 1HB LYS 5 1HB LYS 5 -0.524 -7.882 8.807 34 2HB LYS 5 2HB LYS 5 0.494 -6.468 8.994 35 1HG LYS 5 1HG LYS 5 0.909 -7.120 11.125 36 2HG LYS 5 2HG LYS 5 -0.762 -6.761 11.512 37 1HD LYS 5 1HD LYS 5 -0.951 -8.975 12.020 38 2HD LYS 5 2HD LYS 5 -1.003 -9.241 10.289 39 1HE LYS 5 1HE LYS 5 0.838 -10.553 10.605 40 2HE LYS 5 2HE LYS 5 1.730 -9.049 10.728 41 1HZ LYS 5 1HZ LYS 5 0.808 -10.794 12.853 42 2HZ LYS 5 2HZ LYS 5 2.246 -10.039 12.681 43 3HZ LYS 5 3HZ LYS 5 0.936 -9.198 13.175 44 H ILE 6 H ILE 6 -0.196 -3.941 8.871 45 HA ILE 6 HA ILE 6 -0.588 -3.820 6.059 46 HB ILE 6 HB ILE 6 -2.469 -2.435 7.795 47 1HG1 ILE 6 1HG1 ILE 6 -2.938 -2.173 4.959 48 2HG1 ILE 6 2HG1 ILE 6 -2.418 -3.807 5.321 49 1HG2 ILE 6 1HG2 ILE 6 -2.476 -0.341 6.390 50 2HG2 ILE 6 2HG2 ILE 6 -1.127 -0.493 7.542 51 3HG2 ILE 6 3HG2 ILE 6 -0.860 -0.814 5.812 52 1HD1 ILE 6 1HD1 ILE 6 -4.297 -2.884 7.355 53 2HD1 ILE 6 2HD1 ILE 6 -4.996 -2.716 5.727 54 3HD1 ILE 6 3HD1 ILE 6 -4.407 -4.301 6.284 55 H LEU 7 H LEU 7 0.951 -2.463 5.091 56 HA LEU 7 HA LEU 7 2.756 -1.178 7.020 57 1HB LEU 7 1HB LEU 7 3.278 -3.232 5.228 58 2HB LEU 7 2HB LEU 7 3.887 -1.806 4.410 59 HG LEU 7 HG LEU 7 5.074 -1.315 6.693 60 1HD1 LEU 7 1HD1 LEU 7 5.166 -4.278 7.004 61 2HD1 LEU 7 2HD1 LEU 7 5.362 -2.986 8.212 62 3HD1 LEU 7 3HD1 LEU 7 3.738 -3.417 7.625 63 1HD2 LEU 7 1HD2 LEU 7 5.837 -2.524 4.288 64 2HD2 LEU 7 2HD2 LEU 7 6.898 -1.801 5.522 65 3HD2 LEU 7 3HD2 LEU 7 6.540 -3.544 5.566 66 H ILE 8 H ILE 8 3.545 0.914 6.544 67 HA ILE 8 HA ILE 8 2.198 2.200 4.273 68 HB ILE 8 HB ILE 8 2.566 3.228 7.086 69 1HG1 ILE 8 1HG1 ILE 8 0.006 2.950 5.503 70 2HG1 ILE 8 2HG1 ILE 8 0.633 1.651 6.498 71 1HG2 ILE 8 1HG2 ILE 8 2.415 4.681 4.572 72 2HG2 ILE 8 2HG2 ILE 8 1.070 5.093 5.663 73 3HG2 ILE 8 3HG2 ILE 8 2.752 5.267 6.218 74 1HD1 ILE 8 1HD1 ILE 8 -0.066 2.655 8.410 75 2HD1 ILE 8 2HD1 ILE 8 0.669 4.207 7.943 76 3HD1 ILE 8 3HD1 ILE 8 -0.964 3.788 7.372 77 H VAL 9 H VAL 9 3.768 2.528 2.781 78 HA VAL 9 HA VAL 9 6.383 3.392 3.794 79 HB VAL 9 HB VAL 9 5.661 2.208 1.108 80 1HG1 VAL 9 1HG1 VAL 9 7.924 2.167 0.601 81 2HG1 VAL 9 2HG1 VAL 9 7.778 3.705 1.486 82 3HG1 VAL 9 3HG1 VAL 9 8.419 2.262 2.308 83 1HG2 VAL 9 1HG2 VAL 9 5.379 0.307 2.299 84 2HG2 VAL 9 2HG2 VAL 9 7.158 0.297 2.339 85 3HG2 VAL 9 3HG2 VAL 9 6.241 0.942 3.721 86 H ASP 10 H ASP 10 7.129 5.416 3.312 87 HA ASP 10 HA ASP 10 6.957 7.524 2.769 88 1HB ASP 10 1HB ASP 10 7.424 6.041 0.490 89 2HB ASP 10 2HB ASP 10 6.015 6.955 -0.009 90 H ASP 11 H ASP 11 5.373 9.004 0.905 91 HA ASP 11 HA ASP 11 3.432 9.928 0.626 92 1HB ASP 11 1HB ASP 11 2.895 7.375 0.034 93 2HB ASP 11 2HB ASP 11 1.934 7.448 1.497 94 H GLN 12 H GLN 12 4.712 9.230 3.465 95 HA GLN 12 HA GLN 12 2.440 9.350 5.176 96 1HB GLN 12 1HB GLN 12 4.325 9.678 6.946 97 2HB GLN 12 2HB GLN 12 4.228 8.141 6.110 98 1HG GLN 12 1HG GLN 12 6.149 8.533 4.851 99 2HG GLN 12 2HG GLN 12 5.908 10.268 4.815 100 1HE2 GLN 12 1HE2 GLN 12 5.952 11.313 7.069 101 2HE2 GLN 12 2HE2 GLN 12 7.267 10.865 8.103 102 H TYR 13 H TYR 13 1.311 11.204 5.548 103 HA TYR 13 HA TYR 13 2.741 13.619 6.157 104 1HB TYR 13 1HB TYR 13 1.965 13.018 3.481 105 2HB TYR 13 2HB TYR 13 0.653 14.022 4.065 106 HD1 TYR 13 HD1 TYR 13 3.401 14.246 2.142 107 HD2 TYR 13 HD2 TYR 13 1.843 16.059 5.690 108 HE1 TYR 13 HE1 TYR 13 4.789 16.329 1.696 109 HE2 TYR 13 HE2 TYR 13 3.237 18.135 5.232 110 HH TYR 13 HH TYR 13 5.445 18.575 3.960 111 H GLY 14 H GLY 14 0.823 11.649 7.396 112 1HA GLY 14 1HA GLY 14 -0.636 12.344 9.143 113 2HA GLY 14 2HA GLY 14 -1.255 13.618 8.111 114 H ILE 15 H ILE 15 -0.908 11.191 5.931 115 HA ILE 15 HA ILE 15 -3.696 10.439 6.211 116 HB ILE 15 HB ILE 15 -1.660 10.255 4.006 117 1HG1 ILE 15 1HG1 ILE 15 -4.160 11.413 3.252 118 2HG1 ILE 15 2HG1 ILE 15 -3.671 12.142 4.769 119 1HG2 ILE 15 1HG2 ILE 15 -3.326 9.157 2.607 120 2HG2 ILE 15 2HG2 ILE 15 -2.916 8.148 4.015 121 3HG2 ILE 15 3HG2 ILE 15 -4.445 9.058 3.988 122 1HD1 ILE 15 1HD1 ILE 15 -2.126 12.053 2.153 123 2HD1 ILE 15 2HD1 ILE 15 -2.626 13.478 3.095 124 3HD1 ILE 15 3HD1 ILE 15 -1.324 12.425 3.698 125 H ARG 16 H ARG 16 -0.396 9.065 6.344 126 HA ARG 16 HA ARG 16 -1.035 6.428 6.214 127 1HB ARG 16 1HB ARG 16 1.047 6.152 7.752 128 2HB ARG 16 2HB ARG 16 1.282 6.995 6.234 129 1HG ARG 16 1HG ARG 16 1.290 9.151 7.301 130 2HG ARG 16 2HG ARG 16 0.606 8.513 8.783 131 1HD ARG 16 1HD ARG 16 3.223 7.329 7.890 132 2HD ARG 16 2HD ARG 16 3.267 8.979 8.478 133 HE ARG 16 HE ARG 16 1.767 7.131 10.206 134 1HH1 ARG 16 1HH1 ARG 16 4.904 8.561 9.503 135 2HH1 ARG 16 2HH1 ARG 16 5.535 8.271 11.090 136 1HH2 ARG 16 1HH2 ARG 16 2.598 6.748 12.300 137 2HH2 ARG 16 2HH2 ARG 16 4.215 7.233 12.692 138 H ILE 17 H ILE 17 -1.241 8.731 8.963 139 HA ILE 17 HA ILE 17 -1.773 6.747 10.914 140 HB ILE 17 HB ILE 17 -2.251 9.729 10.881 141 1HG1 ILE 17 1HG1 ILE 17 -0.068 8.451 12.457 142 2HG1 ILE 17 2HG1 ILE 17 0.147 8.524 10.719 143 1HG2 ILE 17 1HG2 ILE 17 -2.216 7.860 13.264 144 2HG2 ILE 17 2HG2 ILE 17 -2.507 9.616 13.269 145 3HG2 ILE 17 3HG2 ILE 17 -3.688 8.520 12.512 146 1HD1 ILE 17 1HD1 ILE 17 -0.057 10.922 10.683 147 2HD1 ILE 17 2HD1 ILE 17 -0.678 10.961 12.350 148 3HD1 ILE 17 3HD1 ILE 17 1.024 10.539 12.044 149 H LEU 18 H LEU 18 -3.789 8.890 8.830 150 HA LEU 18 HA LEU 18 -6.238 8.506 9.884 151 1HB LEU 18 1HB LEU 18 -5.430 9.788 7.798 152 2HB LEU 18 2HB LEU 18 -5.769 8.308 6.922 153 HG LEU 18 HG LEU 18 -7.904 9.499 8.665 154 1HD1 LEU 18 1HD1 LEU 18 -8.644 10.672 6.450 155 2HD1 LEU 18 2HD1 LEU 18 -7.460 11.453 7.525 156 3HD1 LEU 18 3HD1 LEU 18 -6.909 10.606 6.060 157 1HD2 LEU 18 1HD2 LEU 18 -8.202 7.264 7.647 158 2HD2 LEU 18 2HD2 LEU 18 -9.401 8.452 7.083 159 3HD2 LEU 18 3HD2 LEU 18 -8.036 8.000 6.035 160 H LEU 19 H LEU 19 -4.730 6.317 7.399 161 HA LEU 19 HA LEU 19 -6.755 4.368 7.747 162 1HB LEU 19 1HB LEU 19 -5.412 3.022 6.263 163 2HB LEU 19 2HB LEU 19 -5.580 4.656 5.654 164 HG LEU 19 HG LEU 19 -3.180 4.574 7.190 165 1HD1 LEU 19 1HD1 LEU 19 -3.625 2.154 5.472 166 2HD1 LEU 19 2HD1 LEU 19 -1.999 2.864 5.615 167 3HD1 LEU 19 3HD1 LEU 19 -2.852 2.293 7.069 168 1HD2 LEU 19 1HD2 LEU 19 -2.138 5.157 5.045 169 2HD2 LEU 19 2HD2 LEU 19 -3.643 4.725 4.198 170 3HD2 LEU 19 3HD2 LEU 19 -3.624 6.092 5.338 171 H ASN 20 H ASN 20 -3.815 5.214 9.445 172 HA ASN 20 HA ASN 20 -3.210 2.699 10.451 173 1HB ASN 20 1HB ASN 20 -1.772 4.834 10.530 174 2HB ASN 20 2HB ASN 20 -2.783 5.389 11.849 175 1HD2 ASN 20 1HD2 ASN 20 -0.502 5.364 12.751 176 2HD2 ASN 20 2HD2 ASN 20 -0.007 3.949 13.618 177 H GLU 21 H GLU 21 -4.846 5.569 12.014 178 HA GLU 21 HA GLU 21 -5.586 4.360 14.319 179 1HB GLU 21 1HB GLU 21 -5.819 6.766 13.940 180 2HB GLU 21 2HB GLU 21 -7.040 6.502 12.711 181 1HG GLU 21 1HG GLU 21 -8.666 5.772 14.297 182 2HG GLU 21 2HG GLU 21 -7.458 5.434 15.522 183 H VAL 22 H VAL 22 -6.765 3.766 11.091 184 HA VAL 22 HA VAL 22 -9.308 2.732 11.913 185 HB VAL 22 HB VAL 22 -7.734 2.888 9.363 186 1HG1 VAL 22 1HG1 VAL 22 -10.162 1.170 9.902 187 2HG1 VAL 22 2HG1 VAL 22 -9.797 1.803 8.279 188 3HG1 VAL 22 3HG1 VAL 22 -8.636 0.730 9.097 189 1HG2 VAL 22 1HG2 VAL 22 -9.105 4.818 10.258 190 2HG2 VAL 22 2HG2 VAL 22 -9.521 4.279 8.613 191 3HG2 VAL 22 3HG2 VAL 22 -10.551 3.815 9.989 192 H PHE 23 H PHE 23 -6.323 1.242 10.457 193 HA PHE 23 HA PHE 23 -7.162 -1.372 11.036 194 1HB PHE 23 1HB PHE 23 -4.427 -0.046 10.557 195 2HB PHE 23 2HB PHE 23 -4.654 -1.784 10.557 196 HD1 PHE 23 HD1 PHE 23 -3.713 0.250 8.327 197 HD2 PHE 23 HD2 PHE 23 -7.334 -1.822 9.107 198 HE1 PHE 23 HE1 PHE 23 -4.283 0.325 5.884 199 HE2 PHE 23 HE2 PHE 23 -7.903 -1.747 6.664 200 HZ PHE 23 HZ PHE 23 -6.372 -0.674 5.081 201 H ASN 24 H ASN 24 -5.256 1.068 12.833 202 HA ASN 24 HA ASN 24 -4.205 -0.709 14.695 203 1HB ASN 24 1HB ASN 24 -3.794 1.918 14.147 204 2HB ASN 24 2HB ASN 24 -4.893 2.123 15.497 205 1HD2 ASN 24 1HD2 ASN 24 -3.953 2.367 17.361 206 2HD2 ASN 24 2HD2 ASN 24 -2.459 1.669 17.892 207 H LYS 25 H LYS 25 -7.266 1.148 14.405 208 HA LYS 25 HA LYS 25 -8.193 0.976 16.991 209 1HB LYS 25 1HB LYS 25 -9.257 1.557 14.348 210 2HB LYS 25 2HB LYS 25 -10.432 0.698 15.323 211 1HG LYS 25 1HG LYS 25 -9.704 2.404 17.223 212 2HG LYS 25 2HG LYS 25 -9.092 3.357 15.886 213 1HD LYS 25 1HD LYS 25 -11.949 2.289 16.003 214 2HD LYS 25 2HD LYS 25 -11.496 3.876 16.591 215 1HE LYS 25 1HE LYS 25 -10.815 4.610 14.387 216 2HE LYS 25 2HE LYS 25 -10.855 2.978 13.750 217 1HZ LYS 25 1HZ LYS 25 -13.308 3.105 14.469 218 2HZ LYS 25 2HZ LYS 25 -13.084 4.722 14.413 219 3HZ LYS 25 3HZ LYS 25 -12.843 3.818 13.075 220 H GLU 26 H GLU 26 -7.623 -1.543 14.651 221 HA GLU 26 HA GLU 26 -9.399 -3.334 16.064 222 1HB GLU 26 1HB GLU 26 -7.731 -3.682 13.537 223 2HB GLU 26 2HB GLU 26 -8.706 -4.959 14.236 224 1HG GLU 26 1HG GLU 26 -9.978 -2.271 13.657 225 2HG GLU 26 2HG GLU 26 -9.715 -3.397 12.340 226 H GLY 27 H GLY 27 -6.060 -2.348 15.912 227 1HA GLY 27 1HA GLY 27 -4.556 -2.949 17.610 228 2HA GLY 27 2HA GLY 27 -5.366 -4.492 17.798 229 H TYR 28 H TYR 28 -4.973 -3.515 14.483 230 HA TYR 28 HA TYR 28 -3.310 -5.725 13.926 231 1HB TYR 28 1HB TYR 28 -3.987 -3.140 12.387 232 2HB TYR 28 2HB TYR 28 -3.355 -4.594 11.640 233 HD1 TYR 28 HD1 TYR 28 -5.801 -3.407 10.604 234 HD2 TYR 28 HD2 TYR 28 -5.294 -6.168 13.832 235 HE1 TYR 28 HE1 TYR 28 -8.171 -4.260 10.256 236 HE2 TYR 28 HE2 TYR 28 -7.665 -7.012 13.474 237 HH TYR 28 HH TYR 28 -9.725 -5.582 10.954 238 H GLN 29 H GLN 29 -1.128 -5.776 13.136 239 HA GLN 29 HA GLN 29 0.454 -3.695 14.345 240 1HB GLN 29 1HB GLN 29 0.741 -6.487 14.041 241 2HB GLN 29 2HB GLN 29 1.957 -5.807 12.978 242 1HG GLN 29 1HG GLN 29 2.937 -4.508 14.793 243 2HG GLN 29 2HG GLN 29 1.605 -4.889 15.866 244 1HE2 GLN 29 1HE2 GLN 29 1.538 -6.777 16.952 245 2HE2 GLN 29 2HE2 GLN 29 2.788 -7.976 16.941 246 H THR 30 H THR 30 0.970 -1.920 13.143 247 HA THR 30 HA THR 30 1.480 -2.362 10.273 248 HB THR 30 HB THR 30 0.578 -0.005 10.016 249 HG1 THR 30 HG1 THR 30 0.669 0.917 12.054 250 1HG2 THR 30 1HG2 THR 30 -0.963 -2.375 10.695 251 2HG2 THR 30 2HG2 THR 30 -1.746 -0.948 11.415 252 3HG2 THR 30 3HG2 THR 30 -1.443 -1.007 9.662 253 H PHE 31 H PHE 31 3.179 -1.180 9.295 254 HA PHE 31 HA PHE 31 4.941 0.181 11.188 255 1HB PHE 31 1HB PHE 31 5.280 -2.435 10.109 256 2HB PHE 31 2HB PHE 31 6.275 -1.430 9.074 257 HD1 PHE 31 HD1 PHE 31 8.125 -0.082 10.084 258 HD2 PHE 31 HD2 PHE 31 5.952 -2.954 12.329 259 HE1 PHE 31 HE1 PHE 31 9.953 -0.121 11.803 260 HE2 PHE 31 HE2 PHE 31 7.780 -2.993 14.048 261 HZ PHE 31 HZ PHE 31 9.759 -1.576 13.765 262 H GLN 32 H GLN 32 6.705 1.441 9.998 263 HA GLN 32 HA GLN 32 5.621 2.337 7.440 264 1HB GLN 32 1HB GLN 32 7.020 3.989 9.590 265 2HB GLN 32 2HB GLN 32 6.549 4.601 8.017 266 1HG GLN 32 1HG GLN 32 4.328 4.740 8.584 267 2HG GLN 32 2HG GLN 32 4.349 3.220 9.456 268 1HE2 GLN 32 1HE2 GLN 32 3.344 3.853 11.273 269 2HE2 GLN 32 2HE2 GLN 32 3.962 5.004 12.411 270 H ALA 33 H ALA 33 7.213 3.068 5.830 271 HA ALA 33 HA ALA 33 9.957 2.240 6.420 272 1HB ALA 33 1HB ALA 33 9.037 0.312 5.334 273 2HB ALA 33 2HB ALA 33 8.199 1.311 4.122 274 3HB ALA 33 3HB ALA 33 9.975 1.186 4.099 275 H ALA 34 H ALA 34 11.461 3.050 4.581 276 HA ALA 34 HA ALA 34 10.390 5.538 3.457 277 1HB ALA 34 1HB ALA 34 12.702 5.116 5.318 278 2HB ALA 34 2HB ALA 34 12.893 6.314 4.015 279 3HB ALA 34 3HB ALA 34 11.571 6.485 5.195 280 H ASN 35 H ASN 35 10.433 3.173 2.021 281 HA ASN 35 HA ASN 35 11.655 3.781 -0.238 282 1HB ASN 35 1HB ASN 35 13.678 2.893 1.686 283 2HB ASN 35 2HB ASN 35 13.619 1.779 0.334 284 1HD2 ASN 35 1HD2 ASN 35 15.481 3.991 1.304 285 2HD2 ASN 35 2HD2 ASN 35 15.817 4.946 -0.101 286 H GLY 36 H GLY 36 12.473 1.381 -1.390 287 1HA GLY 36 1HA GLY 36 10.106 -0.262 -1.123 288 2HA GLY 36 2HA GLY 36 11.391 -0.412 -2.304 289 H LEU 37 H LEU 37 13.707 -0.794 -0.961 290 HA LEU 37 HA LEU 37 13.627 -3.419 -0.184 291 1HB LEU 37 1HB LEU 37 15.540 -1.451 -0.577 292 2HB LEU 37 2HB LEU 37 15.750 -1.895 1.105 293 HG LEU 37 HG LEU 37 15.584 -4.055 -0.975 294 1HD1 LEU 37 1HD1 LEU 37 17.903 -3.923 -1.493 295 2HD1 LEU 37 2HD1 LEU 37 17.206 -2.310 -1.778 296 3HD1 LEU 37 3HD1 LEU 37 18.163 -2.619 -0.309 297 1HD2 LEU 37 1HD2 LEU 37 17.105 -3.824 1.637 298 2HD2 LEU 37 2HD2 LEU 37 15.555 -4.667 1.400 299 3HD2 LEU 37 3HD2 LEU 37 17.023 -5.257 0.584 300 H GLN 38 H GLN 38 13.805 -0.493 1.966 301 HA GLN 38 HA GLN 38 13.757 -1.770 4.337 302 1HB GLN 38 1HB GLN 38 12.999 0.899 3.333 303 2HB GLN 38 2HB GLN 38 12.119 0.453 4.781 304 1HG GLN 38 1HG GLN 38 14.232 -0.033 5.968 305 2HG GLN 38 2HG GLN 38 15.156 0.267 4.510 306 1HE2 GLN 38 1HE2 GLN 38 14.368 1.538 7.359 307 2HE2 GLN 38 2HE2 GLN 38 14.418 3.239 7.033 308 H ALA 39 H ALA 39 11.123 -1.382 1.996 309 HA ALA 39 HA ALA 39 9.119 -2.219 3.901 310 1HB ALA 39 1HB ALA 39 7.581 -1.682 2.218 311 2HB ALA 39 2HB ALA 39 8.907 -0.537 1.905 312 3HB ALA 39 3HB ALA 39 8.746 -2.005 0.911 313 H LEU 40 H LEU 40 11.267 -3.575 1.430 314 HA LEU 40 HA LEU 40 9.847 -5.943 0.965 315 1HB LEU 40 1HB LEU 40 12.667 -5.019 0.596 316 2HB LEU 40 2HB LEU 40 12.293 -6.720 0.404 317 HG LEU 40 HG LEU 40 11.134 -4.413 -1.177 318 1HD1 LEU 40 1HD1 LEU 40 12.218 -6.210 -2.950 319 2HD1 LEU 40 2HD1 LEU 40 13.001 -4.722 -2.366 320 3HD1 LEU 40 3HD1 LEU 40 13.357 -6.281 -1.584 321 1HD2 LEU 40 1HD2 LEU 40 10.355 -6.769 -2.425 322 2HD2 LEU 40 2HD2 LEU 40 10.059 -7.075 -0.696 323 3HD2 LEU 40 3HD2 LEU 40 9.320 -5.663 -1.489 324 H ASP 41 H ASP 41 12.282 -4.977 3.432 325 HA ASP 41 HA ASP 41 12.428 -7.584 4.496 326 1HB ASP 41 1HB ASP 41 14.216 -5.813 4.708 327 2HB ASP 41 2HB ASP 41 13.155 -4.900 5.762 328 H ILE 42 H ILE 42 10.943 -4.420 5.529 329 HA ILE 42 HA ILE 42 9.718 -5.433 7.832 330 HB ILE 42 HB ILE 42 9.090 -3.032 6.113 331 1HG1 ILE 42 1HG1 ILE 42 11.357 -3.531 7.564 332 2HG1 ILE 42 2HG1 ILE 42 10.746 -1.942 7.149 333 1HG2 ILE 42 1HG2 ILE 42 7.864 -2.154 8.032 334 2HG2 ILE 42 2HG2 ILE 42 7.138 -3.671 7.447 335 3HG2 ILE 42 3HG2 ILE 42 8.139 -3.672 8.919 336 1HD1 ILE 42 1HD1 ILE 42 11.210 -2.097 9.575 337 2HD1 ILE 42 2HD1 ILE 42 9.470 -1.860 9.288 338 3HD1 ILE 42 3HD1 ILE 42 10.090 -3.474 9.709 339 H VAL 43 H VAL 43 9.022 -5.812 4.444 340 HA VAL 43 HA VAL 43 6.262 -6.064 4.500 341 HB VAL 43 HB VAL 43 8.500 -6.752 2.762 342 1HG1 VAL 43 1HG1 VAL 43 6.137 -8.615 2.929 343 2HG1 VAL 43 2HG1 VAL 43 6.960 -8.327 1.378 344 3HG1 VAL 43 3HG1 VAL 43 7.867 -8.996 2.756 345 1HG2 VAL 43 1HG2 VAL 43 6.536 -4.947 2.673 346 2HG2 VAL 43 2HG2 VAL 43 7.290 -5.599 1.198 347 3HG2 VAL 43 3HG2 VAL 43 5.730 -6.246 1.760 348 H THR 44 H THR 44 8.789 -8.668 4.775 349 HA THR 44 HA THR 44 6.803 -10.570 5.600 350 HB THR 44 HB THR 44 9.862 -10.725 5.611 351 HG1 THR 44 HG1 THR 44 9.569 -10.910 3.413 352 1HG2 THR 44 1HG2 THR 44 9.617 -13.031 5.747 353 2HG2 THR 44 2HG2 THR 44 8.109 -12.595 6.587 354 3HG2 THR 44 3HG2 THR 44 8.075 -13.014 4.858 355 H LYS 45 H LYS 45 9.181 -8.428 7.176 356 HA LYS 45 HA LYS 45 9.178 -9.646 9.668 357 1HB LYS 45 1HB LYS 45 10.297 -7.370 8.470 358 2HB LYS 45 2HB LYS 45 9.357 -6.747 9.811 359 1HG LYS 45 1HG LYS 45 10.618 -9.040 10.870 360 2HG LYS 45 2HG LYS 45 11.846 -8.315 9.852 361 1HD LYS 45 1HD LYS 45 11.500 -6.117 10.997 362 2HD LYS 45 2HD LYS 45 10.266 -6.838 12.012 363 1HE LYS 45 1HE LYS 45 12.174 -6.971 13.388 364 2HE LYS 45 2HE LYS 45 12.127 -8.572 12.676 365 1HZ LYS 45 1HZ LYS 45 13.545 -7.214 10.882 366 2HZ LYS 45 2HZ LYS 45 14.009 -6.464 12.256 367 3HZ LYS 45 3HZ LYS 45 14.201 -8.078 12.102 368 H GLU 46 H GLU 46 6.928 -7.268 8.172 369 HA GLU 46 HA GLU 46 5.308 -7.482 10.576 370 1HB GLU 46 1HB GLU 46 5.792 -5.362 8.567 371 2HB GLU 46 2HB GLU 46 4.097 -5.566 8.962 372 1HG GLU 46 1HG GLU 46 5.625 -5.690 11.420 373 2HG GLU 46 2HG GLU 46 6.137 -4.274 10.523 374 H ARG 47 H ARG 47 5.691 -8.926 7.572 375 HA ARG 47 HA ARG 47 4.261 -9.695 6.034 376 1HB ARG 47 1HB ARG 47 2.927 -11.634 7.118 377 2HB ARG 47 2HB ARG 47 4.658 -11.629 7.390 378 1HG ARG 47 1HG ARG 47 4.444 -11.196 9.640 379 2HG ARG 47 2HG ARG 47 3.115 -10.077 9.406 380 1HD ARG 47 1HD ARG 47 2.466 -12.204 10.627 381 2HD ARG 47 2HD ARG 47 1.506 -11.888 9.196 382 HE ARG 47 HE ARG 47 3.627 -13.452 8.269 383 1HH1 ARG 47 1HH1 ARG 47 1.128 -13.822 10.719 384 2HH1 ARG 47 2HH1 ARG 47 1.065 -15.547 10.577 385 1HH2 ARG 47 1HH2 ARG 47 3.545 -15.728 8.082 386 2HH2 ARG 47 2HH2 ARG 47 2.449 -16.639 9.068 387 HA PRO 48 HA PRO 48 0.565 -7.219 7.210 388 1HB PRO 48 1HB PRO 48 0.809 -5.188 5.397 389 2HB PRO 48 2HB PRO 48 1.378 -5.070 7.051 390 1HG PRO 48 1HG PRO 48 2.947 -5.443 4.573 391 2HG PRO 48 2HG PRO 48 3.494 -4.905 6.149 392 1HD PRO 48 1HD PRO 48 3.859 -7.509 5.002 393 2HD PRO 48 2HD PRO 48 4.303 -7.005 6.621 394 H ASP 49 H ASP 49 -1.490 -6.965 6.151 395 HA ASP 49 HA ASP 49 -1.615 -8.900 4.049 396 1HB ASP 49 1HB ASP 49 -3.543 -7.456 5.836 397 2HB ASP 49 2HB ASP 49 -4.171 -7.948 4.275 398 H LEU 50 H LEU 50 -1.058 -5.555 4.334 399 HA LEU 50 HA LEU 50 -1.362 -5.121 1.558 400 1HB LEU 50 1HB LEU 50 -3.742 -4.910 2.766 401 2HB LEU 50 2HB LEU 50 -3.147 -3.290 3.070 402 HG LEU 50 HG LEU 50 -2.646 -3.239 0.512 403 1HD1 LEU 50 1HD1 LEU 50 -3.157 -5.047 -0.664 404 2HD1 LEU 50 2HD1 LEU 50 -3.847 -5.836 0.775 405 3HD1 LEU 50 3HD1 LEU 50 -4.871 -4.802 -0.251 406 1HD2 LEU 50 1HD2 LEU 50 -4.293 -1.761 0.621 407 2HD2 LEU 50 2HD2 LEU 50 -5.489 -3.075 0.526 408 3HD2 LEU 50 3HD2 LEU 50 -4.896 -2.525 2.111 409 H VAL 51 H VAL 51 -0.037 -3.435 0.911 410 HA VAL 51 HA VAL 51 0.970 -1.701 3.045 411 HB VAL 51 HB VAL 51 2.728 -3.151 3.000 412 1HG1 VAL 51 1HG1 VAL 51 1.735 -3.823 0.297 413 2HG1 VAL 51 2HG1 VAL 51 3.498 -3.948 0.507 414 3HG1 VAL 51 3HG1 VAL 51 2.408 -4.870 1.570 415 1HG2 VAL 51 1HG2 VAL 51 4.561 -2.173 1.750 416 2HG2 VAL 51 2HG2 VAL 51 3.423 -1.380 0.634 417 3HG2 VAL 51 3HG2 VAL 51 3.492 -0.877 2.340 418 H LEU 52 H LEU 52 1.042 0.431 2.467 419 HA LEU 52 HA LEU 52 0.348 0.999 -0.317 420 1HB LEU 52 1HB LEU 52 -1.065 2.468 0.503 421 2HB LEU 52 2HB LEU 52 -0.679 1.894 2.113 422 HG LEU 52 HG LEU 52 1.079 3.982 0.874 423 1HD1 LEU 52 1HD1 LEU 52 -0.336 5.767 1.290 424 2HD1 LEU 52 2HD1 LEU 52 -1.438 4.554 0.596 425 3HD1 LEU 52 3HD1 LEU 52 -1.398 4.817 2.356 426 1HD2 LEU 52 1HD2 LEU 52 1.998 3.608 2.888 427 2HD2 LEU 52 2HD2 LEU 52 0.690 4.660 3.481 428 3HD2 LEU 52 3HD2 LEU 52 0.511 2.890 3.553 429 H LEU 53 H LEU 53 1.877 1.739 -1.685 430 HA LEU 53 HA LEU 53 4.181 3.096 -0.477 431 1HB LEU 53 1HB LEU 53 4.670 0.726 -1.084 432 2HB LEU 53 2HB LEU 53 4.300 1.114 -2.753 433 HG LEU 53 HG LEU 53 6.552 2.272 -1.089 434 1HD1 LEU 53 1HD1 LEU 53 6.328 -0.023 -2.886 435 2HD1 LEU 53 2HD1 LEU 53 7.631 1.100 -3.343 436 3HD1 LEU 53 3HD1 LEU 53 7.593 0.399 -1.707 437 1HD2 LEU 53 1HD2 LEU 53 5.347 3.153 -3.649 438 2HD2 LEU 53 2HD2 LEU 53 6.251 4.070 -2.419 439 3HD2 LEU 53 3HD2 LEU 53 7.124 3.067 -3.602 440 H ASP 54 H ASP 54 4.807 4.984 -1.476 441 HA ASP 54 HA ASP 54 3.031 5.844 -3.578 442 1HB ASP 54 1HB ASP 54 3.173 7.658 -2.183 443 2HB ASP 54 2HB ASP 54 4.681 7.114 -1.475 444 H MET 55 H MET 55 3.757 6.118 -5.723 445 HA MET 55 HA MET 55 6.069 4.923 -6.550 446 1HB MET 55 1HB MET 55 4.632 7.249 -7.940 447 2HB MET 55 2HB MET 55 5.565 5.991 -8.726 448 1HG MET 55 1HG MET 55 2.860 5.742 -7.358 449 2HG MET 55 2HG MET 55 3.278 5.334 -9.010 450 1HE MET 55 1HE MET 55 2.847 2.759 -5.610 451 2HE MET 55 2HE MET 55 4.202 3.799 -5.108 452 3HE MET 55 3HE MET 55 2.692 4.530 -5.704 453 H LYS 56 H LYS 56 5.447 8.509 -6.715 454 HA LYS 56 HA LYS 56 8.065 9.215 -7.193 455 1HB LYS 56 1HB LYS 56 5.570 10.511 -6.660 456 2HB LYS 56 2HB LYS 56 6.797 11.270 -5.666 457 1HG LYS 56 1HG LYS 56 7.634 10.689 -8.473 458 2HG LYS 56 2HG LYS 56 6.356 11.878 -8.315 459 1HD LYS 56 1HD LYS 56 7.862 13.446 -7.678 460 2HD LYS 56 2HD LYS 56 8.320 12.470 -6.296 461 1HE LYS 56 1HE LYS 56 9.445 11.468 -8.851 462 2HE LYS 56 2HE LYS 56 9.972 13.092 -8.457 463 1HZ LYS 56 1HZ LYS 56 10.181 11.822 -6.112 464 2HZ LYS 56 2HZ LYS 56 10.593 10.636 -7.157 465 3HZ LYS 56 3HZ LYS 56 11.413 12.048 -7.159 466 H ILE 57 H ILE 57 9.774 8.498 -6.014 467 HA ILE 57 HA ILE 57 9.715 9.144 -3.168 468 HB ILE 57 HB ILE 57 9.548 6.508 -4.245 469 1HG1 ILE 57 1HG1 ILE 57 9.906 7.471 -1.392 470 2HG1 ILE 57 2HG1 ILE 57 8.381 7.431 -2.254 471 1HG2 ILE 57 1HG2 ILE 57 12.166 7.167 -2.887 472 2HG2 ILE 57 2HG2 ILE 57 11.473 5.527 -2.916 473 3HG2 ILE 57 3HG2 ILE 57 11.897 6.342 -4.441 474 1HD1 ILE 57 1HD1 ILE 57 8.117 5.265 -1.661 475 2HD1 ILE 57 2HD1 ILE 57 9.581 4.846 -2.581 476 3HD1 ILE 57 3HD1 ILE 57 9.706 5.281 -0.860 477 HA PRO 58 HA PRO 58 13.691 10.570 -4.046 478 1HB PRO 58 1HB PRO 58 14.894 10.473 -1.594 479 2HB PRO 58 2HB PRO 58 13.793 11.750 -2.072 480 1HG PRO 58 1HG PRO 58 13.312 9.475 -0.247 481 2HG PRO 58 2HG PRO 58 12.403 10.965 -0.407 482 1HD PRO 58 1HD PRO 58 11.660 8.385 -1.416 483 2HD PRO 58 2HD PRO 58 10.811 9.896 -1.675 484 H GLY 59 H GLY 59 15.329 9.782 -5.202 485 1HA GLY 59 1HA GLY 59 17.064 8.416 -5.691 486 2HA GLY 59 2HA GLY 59 16.935 7.688 -4.102 487 H MET 60 H MET 60 16.497 7.186 -7.440 488 HA MET 60 HA MET 60 15.527 5.660 -8.661 489 1HB MET 60 1HB MET 60 16.831 4.393 -6.447 490 2HB MET 60 2HB MET 60 15.331 3.513 -6.663 491 1HG MET 60 1HG MET 60 16.022 3.579 -9.248 492 2HG MET 60 2HG MET 60 17.630 3.844 -8.603 493 1HE MET 60 1HE MET 60 14.587 1.622 -7.116 494 2HE MET 60 2HE MET 60 14.582 1.639 -8.896 495 3HE MET 60 3HE MET 60 14.981 0.141 -8.022 496 H ASP 61 H ASP 61 13.421 6.395 -9.054 497 HA ASP 61 HA ASP 61 11.398 6.568 -7.301 498 1HB ASP 61 1HB ASP 61 10.031 5.791 -9.548 499 2HB ASP 61 2HB ASP 61 10.677 7.402 -9.306 500 H GLY 62 H GLY 62 9.230 5.079 -7.565 501 1HA GLY 62 1HA GLY 62 10.020 2.418 -6.726 502 2HA GLY 62 2HA GLY 62 8.420 3.131 -6.675 503 H ILE 63 H ILE 63 9.453 3.925 -9.718 504 HA ILE 63 HA ILE 63 7.722 2.283 -11.050 505 HB ILE 63 HB ILE 63 10.224 3.696 -11.957 506 1HG1 ILE 63 1HG1 ILE 63 7.495 4.560 -12.756 507 2HG1 ILE 63 2HG1 ILE 63 7.906 4.768 -11.065 508 1HG2 ILE 63 1HG2 ILE 63 8.783 3.426 -14.230 509 2HG2 ILE 63 2HG2 ILE 63 10.115 2.345 -13.756 510 3HG2 ILE 63 3HG2 ILE 63 8.429 1.871 -13.440 511 1HD1 ILE 63 1HD1 ILE 63 9.548 6.342 -11.503 512 2HD1 ILE 63 2HD1 ILE 63 9.984 5.606 -13.064 513 3HD1 ILE 63 3HD1 ILE 63 8.524 6.615 -12.933 514 H GLU 64 H GLU 64 11.220 1.772 -10.324 515 HA GLU 64 HA GLU 64 11.100 -0.780 -11.630 516 1HB GLU 64 1HB GLU 64 13.325 0.689 -10.154 517 2HB GLU 64 2HB GLU 64 13.531 -0.904 -10.857 518 1HG GLU 64 1HG GLU 64 12.573 1.511 -12.459 519 2HG GLU 64 2HG GLU 64 14.260 1.054 -12.337 520 H ILE 65 H ILE 65 11.496 0.572 -8.299 521 HA ILE 65 HA ILE 65 11.927 -1.739 -6.916 522 HB ILE 65 HB ILE 65 10.204 0.582 -6.043 523 1HG1 ILE 65 1HG1 ILE 65 13.183 0.291 -6.326 524 2HG1 ILE 65 2HG1 ILE 65 12.148 1.620 -6.808 525 1HG2 ILE 65 1HG2 ILE 65 11.986 -0.798 -4.133 526 2HG2 ILE 65 2HG2 ILE 65 10.330 -0.177 -3.930 527 3HG2 ILE 65 3HG2 ILE 65 10.600 -1.750 -4.717 528 1HD1 ILE 65 1HD1 ILE 65 13.066 0.866 -4.016 529 2HD1 ILE 65 2HD1 ILE 65 13.218 2.428 -4.854 530 3HD1 ILE 65 3HD1 ILE 65 11.630 1.889 -4.259 531 H LEU 66 H LEU 66 8.670 -0.220 -7.491 532 HA LEU 66 HA LEU 66 7.217 -2.357 -6.510 533 1HB LEU 66 1HB LEU 66 6.595 -0.183 -8.496 534 2HB LEU 66 2HB LEU 66 5.403 -1.381 -8.034 535 HG LEU 66 HG LEU 66 4.910 0.397 -6.641 536 1HD1 LEU 66 1HD1 LEU 66 6.835 -0.875 -4.738 537 2HD1 LEU 66 2HD1 LEU 66 5.127 -0.429 -4.515 538 3HD1 LEU 66 3HD1 LEU 66 5.553 -1.872 -5.466 539 1HD2 LEU 66 1HD2 LEU 66 6.506 1.827 -5.509 540 2HD2 LEU 66 2HD2 LEU 66 7.859 0.832 -6.098 541 3HD2 LEU 66 3HD2 LEU 66 6.872 1.762 -7.250 542 H LYS 67 H LYS 67 8.868 -1.879 -9.609 543 HA LYS 67 HA LYS 67 7.477 -3.911 -10.995 544 1HB LYS 67 1HB LYS 67 9.534 -1.985 -11.519 545 2HB LYS 67 2HB LYS 67 10.104 -3.555 -12.049 546 1HG LYS 67 1HG LYS 67 7.481 -3.599 -12.946 547 2HG LYS 67 2HG LYS 67 7.869 -1.897 -13.105 548 1HD LYS 67 1HD LYS 67 9.545 -2.274 -14.696 549 2HD LYS 67 2HD LYS 67 9.910 -3.879 -14.095 550 1HE LYS 67 1HE LYS 67 7.563 -4.575 -14.952 551 2HE LYS 67 2HE LYS 67 7.519 -3.035 -15.787 552 1HZ LYS 67 1HZ LYS 67 8.674 -5.293 -16.700 553 2HZ LYS 67 2HZ LYS 67 8.912 -3.795 -17.304 554 3HZ LYS 67 3HZ LYS 67 9.958 -4.412 -16.212 555 H ARG 68 H ARG 68 10.851 -3.851 -9.631 556 HA ARG 68 HA ARG 68 11.315 -6.505 -9.987 557 1HB ARG 68 1HB ARG 68 12.406 -4.345 -8.226 558 2HB ARG 68 2HB ARG 68 12.760 -5.977 -7.696 559 1HG ARG 68 1HG ARG 68 13.803 -6.528 -9.837 560 2HG ARG 68 2HG ARG 68 13.266 -5.018 -10.548 561 1HD ARG 68 1HD ARG 68 15.502 -4.523 -9.990 562 2HD ARG 68 2HD ARG 68 14.637 -3.873 -8.612 563 HE ARG 68 HE ARG 68 16.351 -6.270 -8.639 564 1HH1 ARG 68 1HH1 ARG 68 13.907 -4.438 -6.892 565 2HH1 ARG 68 2HH1 ARG 68 14.283 -5.153 -5.360 566 1HH2 ARG 68 1HH2 ARG 68 16.847 -7.214 -6.618 567 2HH2 ARG 68 2HH2 ARG 68 15.967 -6.742 -5.203 568 H MET 69 H MET 69 9.566 -4.784 -7.382 569 HA MET 69 HA MET 69 9.540 -6.765 -5.489 570 1HB MET 69 1HB MET 69 8.244 -4.248 -6.023 571 2HB MET 69 2HB MET 69 6.967 -5.380 -5.626 572 1HG MET 69 1HG MET 69 7.676 -5.635 -3.434 573 2HG MET 69 2HG MET 69 9.373 -5.507 -3.852 574 1HE MET 69 1HE MET 69 6.106 -2.665 -3.674 575 2HE MET 69 2HE MET 69 6.283 -4.209 -2.806 576 3HE MET 69 3HE MET 69 6.700 -2.680 -1.996 577 H LYS 70 H LYS 70 7.137 -6.109 -8.135 578 HA LYS 70 HA LYS 70 5.611 -8.421 -7.486 579 1HB LYS 70 1HB LYS 70 4.132 -7.666 -9.055 580 2HB LYS 70 2HB LYS 70 4.956 -6.165 -8.685 581 1HG LYS 70 1HG LYS 70 4.893 -6.294 -11.081 582 2HG LYS 70 2HG LYS 70 6.546 -6.665 -10.632 583 1HD LYS 70 1HD LYS 70 6.404 -8.700 -11.620 584 2HD LYS 70 2HD LYS 70 5.039 -9.133 -10.609 585 1HE LYS 70 1HE LYS 70 3.509 -8.694 -12.263 586 2HE LYS 70 2HE LYS 70 4.328 -7.231 -12.771 587 1HZ LYS 70 1HZ LYS 70 5.909 -8.553 -13.951 588 2HZ LYS 70 2HZ LYS 70 5.258 -9.946 -13.403 589 3HZ LYS 70 3HZ LYS 70 4.409 -8.994 -14.423 590 H VAL 71 H VAL 71 8.118 -7.570 -9.937 591 HA VAL 71 HA VAL 71 7.970 -9.939 -11.383 592 HB VAL 71 HB VAL 71 10.398 -8.216 -10.856 593 1HG1 VAL 71 1HG1 VAL 71 10.961 -8.924 -13.222 594 2HG1 VAL 71 2HG1 VAL 71 11.051 -10.208 -11.992 595 3HG1 VAL 71 3HG1 VAL 71 9.652 -10.123 -13.091 596 1HG2 VAL 71 1HG2 VAL 71 9.536 -6.555 -12.089 597 2HG2 VAL 71 2HG2 VAL 71 8.911 -7.681 -13.318 598 3HG2 VAL 71 3HG2 VAL 71 7.958 -7.344 -11.853 599 H ILE 72 H ILE 72 9.484 -9.128 -8.264 600 HA ILE 72 HA ILE 72 11.065 -11.494 -8.174 601 HB ILE 72 HB ILE 72 10.313 -9.336 -6.231 602 1HG1 ILE 72 1HG1 ILE 72 12.130 -9.208 -8.114 603 2HG1 ILE 72 2HG1 ILE 72 12.452 -8.557 -6.520 604 1HG2 ILE 72 1HG2 ILE 72 11.793 -11.903 -5.608 605 2HG2 ILE 72 2HG2 ILE 72 11.848 -10.442 -4.591 606 3HG2 ILE 72 3HG2 ILE 72 10.304 -11.288 -4.851 607 1HD1 ILE 72 1HD1 ILE 72 14.255 -10.099 -7.600 608 2HD1 ILE 72 2HD1 ILE 72 13.823 -10.394 -5.899 609 3HD1 ILE 72 3HD1 ILE 72 13.157 -11.436 -7.179 610 H ASP 73 H ASP 73 7.927 -10.432 -6.708 611 HA ASP 73 HA ASP 73 7.303 -13.259 -6.477 612 1HB ASP 73 1HB ASP 73 5.999 -11.799 -4.353 613 2HB ASP 73 2HB ASP 73 7.102 -13.154 -4.222 614 H GLU 74 H GLU 74 5.140 -13.702 -7.120 615 HA GLU 74 HA GLU 74 3.694 -11.410 -8.109 616 1HB GLU 74 1HB GLU 74 2.929 -14.334 -8.439 617 2HB GLU 74 2HB GLU 74 2.427 -12.978 -9.428 618 1HG GLU 74 1HG GLU 74 5.212 -12.834 -9.583 619 2HG GLU 74 2HG GLU 74 4.927 -14.562 -9.537 620 H ASN 75 H ASN 75 3.746 -13.615 -5.415 621 HA ASN 75 HA ASN 75 0.978 -13.458 -4.861 622 1HB ASN 75 1HB ASN 75 1.858 -14.308 -2.527 623 2HB ASN 75 2HB ASN 75 2.032 -15.364 -3.915 624 1HD2 ASN 75 1HD2 ASN 75 3.809 -16.461 -3.388 625 2HD2 ASN 75 2HD2 ASN 75 5.384 -15.784 -3.137 626 H ILE 76 H ILE 76 3.725 -11.378 -4.509 627 HA ILE 76 HA ILE 76 3.173 -10.129 -2.076 628 HB ILE 76 HB ILE 76 5.281 -10.017 -3.384 629 1HG1 ILE 76 1HG1 ILE 76 3.925 -7.571 -2.284 630 2HG1 ILE 76 2HG1 ILE 76 5.199 -8.546 -1.580 631 1HG2 ILE 76 1HG2 ILE 76 5.530 -8.903 -5.349 632 2HG2 ILE 76 2HG2 ILE 76 3.830 -9.397 -5.534 633 3HG2 ILE 76 3HG2 ILE 76 4.224 -7.747 -4.995 634 1HD1 ILE 76 1HD1 ILE 76 6.340 -6.607 -2.311 635 2HD1 ILE 76 2HD1 ILE 76 6.645 -7.770 -3.623 636 3HD1 ILE 76 3HD1 ILE 76 5.402 -6.512 -3.820 637 H ARG 77 H ARG 77 1.747 -8.555 -1.445 638 HA ARG 77 HA ARG 77 0.007 -7.591 -3.572 639 1HB ARG 77 1HB ARG 77 -1.418 -8.884 -2.199 640 2HB ARG 77 2HB ARG 77 -0.549 -8.479 -0.733 641 1HG ARG 77 1HG ARG 77 -1.661 -6.455 -0.453 642 2HG ARG 77 2HG ARG 77 -1.850 -6.191 -2.175 643 1HD ARG 77 1HD ARG 77 -4.058 -6.678 -1.470 644 2HD ARG 77 2HD ARG 77 -3.510 -8.211 -2.118 645 HE ARG 77 HE ARG 77 -3.009 -7.836 0.765 646 1HH1 ARG 77 1HH1 ARG 77 -5.184 -9.099 -1.696 647 2HH1 ARG 77 2HH1 ARG 77 -5.979 -10.193 -0.614 648 1HH2 ARG 77 1HH2 ARG 77 -4.057 -9.280 2.193 649 2HH2 ARG 77 2HH2 ARG 77 -5.334 -10.297 1.613 650 H VAL 78 H VAL 78 0.389 -5.437 -3.988 651 HA VAL 78 HA VAL 78 0.728 -3.666 -1.701 652 HB VAL 78 HB VAL 78 2.939 -4.542 -2.912 653 1HG1 VAL 78 1HG1 VAL 78 3.694 -3.217 -4.701 654 2HG1 VAL 78 2HG1 VAL 78 2.010 -3.607 -5.124 655 3HG1 VAL 78 3HG1 VAL 78 2.414 -2.004 -4.465 656 1HG2 VAL 78 1HG2 VAL 78 3.107 -1.641 -2.410 657 2HG2 VAL 78 2HG2 VAL 78 2.313 -2.569 -1.115 658 3HG2 VAL 78 3HG2 VAL 78 3.962 -2.995 -1.632 659 H ILE 79 H ILE 79 0.076 -1.475 -2.148 660 HA ILE 79 HA ILE 79 -1.465 -1.277 -4.642 661 HB ILE 79 HB ILE 79 -2.124 -0.720 -1.834 662 1HG1 ILE 79 1HG1 ILE 79 -3.536 -1.546 -4.353 663 2HG1 ILE 79 2HG1 ILE 79 -3.399 -2.394 -2.826 664 1HG2 ILE 79 1HG2 ILE 79 -1.865 1.582 -2.672 665 2HG2 ILE 79 2HG2 ILE 79 -3.017 1.224 -3.980 666 3HG2 ILE 79 3HG2 ILE 79 -3.556 1.185 -2.284 667 1HD1 ILE 79 1HD1 ILE 79 -4.781 -0.485 -1.782 668 2HD1 ILE 79 2HD1 ILE 79 -5.108 0.046 -3.449 669 3HD1 ILE 79 3HD1 ILE 79 -5.646 -1.561 -2.906 670 H ILE 80 H ILE 80 -1.291 0.621 -5.873 671 HA ILE 80 HA ILE 80 0.970 2.307 -5.072 672 HB ILE 80 HB ILE 80 1.386 2.704 -7.348 673 1HG1 ILE 80 1HG1 ILE 80 -0.138 1.679 -9.133 674 2HG1 ILE 80 2HG1 ILE 80 -1.339 1.503 -7.869 675 1HG2 ILE 80 1HG2 ILE 80 0.617 -0.221 -7.183 676 2HG2 ILE 80 2HG2 ILE 80 1.870 0.520 -8.207 677 3HG2 ILE 80 3HG2 ILE 80 2.074 0.482 -6.439 678 1HD1 ILE 80 1HD1 ILE 80 -1.837 3.723 -7.885 679 2HD1 ILE 80 2HD1 ILE 80 -0.119 4.187 -7.870 680 3HD1 ILE 80 3HD1 ILE 80 -0.921 3.792 -9.409 681 H MET 81 H MET 81 0.804 4.636 -5.431 682 HA MET 81 HA MET 81 -1.916 5.571 -5.768 683 1HB MET 81 1HB MET 81 -0.765 7.184 -3.706 684 2HB MET 81 2HB MET 81 -2.099 6.060 -3.533 685 1HG MET 81 1HG MET 81 -0.549 4.212 -3.027 686 2HG MET 81 2HG MET 81 0.837 5.227 -3.368 687 1HE MET 81 1HE MET 81 1.740 4.454 -0.978 688 2HE MET 81 2HE MET 81 2.166 6.100 -1.505 689 3HE MET 81 3HE MET 81 1.681 5.803 0.181 690 H THR 82 H THR 82 -1.995 7.360 -7.083 691 HA THR 82 HA THR 82 -0.121 9.430 -7.038 692 HB THR 82 HB THR 82 1.557 8.080 -8.028 693 HG1 THR 82 HG1 THR 82 1.600 9.409 -9.796 694 1HG2 THR 82 1HG2 THR 82 -0.365 6.950 -10.091 695 2HG2 THR 82 2HG2 THR 82 1.208 6.305 -9.562 696 3HG2 THR 82 3HG2 THR 82 -0.215 6.159 -8.503 697 H ALA 83 H ALA 83 -0.802 11.194 -8.250 698 HA ALA 83 HA ALA 83 -3.498 11.261 -8.881 699 1HB ALA 83 1HB ALA 83 -2.019 13.252 -10.358 700 2HB ALA 83 2HB ALA 83 -3.000 13.450 -8.886 701 3HB ALA 83 3HB ALA 83 -1.274 13.033 -8.757 702 H TYR 84 H TYR 84 -4.534 11.624 -11.019 703 HA TYR 84 HA TYR 84 -3.610 9.651 -12.877 704 1HB TYR 84 1HB TYR 84 -5.727 10.545 -14.066 705 2HB TYR 84 2HB TYR 84 -6.011 9.992 -12.428 706 HD1 TYR 84 HD1 TYR 84 -5.803 12.934 -14.624 707 HD2 TYR 84 HD2 TYR 84 -6.531 11.572 -10.634 708 HE1 TYR 84 HE1 TYR 84 -6.797 15.196 -14.024 709 HE2 TYR 84 HE2 TYR 84 -7.522 13.839 -10.048 710 HH TYR 84 HH TYR 84 -8.384 15.711 -10.952 711 H GLY 85 H GLY 85 -1.532 11.440 -12.731 712 1HA GLY 85 1HA GLY 85 -1.854 13.150 -15.120 713 2HA GLY 85 2HA GLY 85 -0.725 13.428 -13.808 714 H GLU 86 H GLU 86 -0.167 10.398 -13.647 715 HA GLU 86 HA GLU 86 1.436 10.251 -16.080 716 1HB GLU 86 1HB GLU 86 3.055 8.900 -14.489 717 2HB GLU 86 2HB GLU 86 3.102 10.652 -14.502 718 1HG GLU 86 1HG GLU 86 1.792 10.807 -12.478 719 2HG GLU 86 2HG GLU 86 1.324 9.120 -12.561 720 H LEU 87 H LEU 87 -1.043 9.164 -16.215 721 HA LEU 87 HA LEU 87 -1.575 6.731 -15.157 722 1HB LEU 87 1HB LEU 87 -2.087 7.637 -17.993 723 2HB LEU 87 2HB LEU 87 -2.894 6.308 -17.185 724 HG LEU 87 HG LEU 87 -3.010 9.026 -15.928 725 1HD1 LEU 87 1HD1 LEU 87 -4.079 8.353 -18.580 726 2HD1 LEU 87 2HD1 LEU 87 -5.291 8.994 -17.444 727 3HD1 LEU 87 3HD1 LEU 87 -3.824 9.935 -17.803 728 1HD2 LEU 87 1HD2 LEU 87 -3.915 7.023 -14.781 729 2HD2 LEU 87 2HD2 LEU 87 -5.150 8.260 -15.119 730 3HD2 LEU 87 3HD2 LEU 87 -5.054 6.799 -16.130 731 H ASP 88 H ASP 88 0.719 7.539 -17.789 732 HA ASP 88 HA ASP 88 1.195 5.142 -18.854 733 1HB ASP 88 1HB ASP 88 2.490 7.619 -18.774 734 2HB ASP 88 2HB ASP 88 3.702 6.540 -18.113 735 H MET 89 H MET 89 2.292 6.438 -15.676 736 HA MET 89 HA MET 89 3.947 4.190 -15.150 737 1HB MET 89 1HB MET 89 4.051 6.686 -14.249 738 2HB MET 89 2HB MET 89 2.863 6.150 -13.077 739 1HG MET 89 1HG MET 89 5.289 4.407 -13.416 740 2HG MET 89 2HG MET 89 5.544 5.962 -12.648 741 1HE MET 89 1HE MET 89 6.289 3.600 -11.449 742 2HE MET 89 2HE MET 89 6.023 4.474 -9.922 743 3HE MET 89 3HE MET 89 5.299 2.867 -10.165 744 H ILE 90 H ILE 90 0.707 5.376 -14.057 745 HA ILE 90 HA ILE 90 0.224 3.415 -12.169 746 HB ILE 90 HB ILE 90 -1.626 4.992 -13.953 747 1HG1 ILE 90 1HG1 ILE 90 -1.746 5.699 -11.187 748 2HG1 ILE 90 2HG1 ILE 90 -0.057 5.653 -11.654 749 1HG2 ILE 90 1HG2 ILE 90 -2.253 2.705 -12.367 750 2HG2 ILE 90 2HG2 ILE 90 -2.936 4.144 -11.573 751 3HG2 ILE 90 3HG2 ILE 90 -3.350 3.782 -13.266 752 1HD1 ILE 90 1HD1 ILE 90 -0.474 7.168 -13.540 753 2HD1 ILE 90 2HD1 ILE 90 -2.224 7.126 -13.222 754 3HD1 ILE 90 3HD1 ILE 90 -1.125 7.893 -12.051 755 H GLN 91 H GLN 91 -0.435 3.449 -15.726 756 HA GLN 91 HA GLN 91 -1.778 1.105 -15.897 757 1HB GLN 91 1HB GLN 91 -0.022 2.689 -17.725 758 2HB GLN 91 2HB GLN 91 -0.321 1.031 -18.208 759 1HG GLN 91 1HG GLN 91 -2.804 2.262 -17.286 760 2HG GLN 91 2HG GLN 91 -2.064 3.263 -18.520 761 1HE2 GLN 91 1HE2 GLN 91 -2.161 2.690 -20.586 762 2HE2 GLN 91 2HE2 GLN 91 -2.808 1.208 -21.206 763 H GLU 92 H GLU 92 1.819 1.593 -16.071 764 HA GLU 92 HA GLU 92 2.454 -1.056 -16.406 765 1HB GLU 92 1HB GLU 92 3.828 1.395 -16.023 766 2HB GLU 92 2HB GLU 92 4.430 0.335 -14.764 767 1HG GLU 92 1HG GLU 92 5.338 -1.199 -16.281 768 2HG GLU 92 2HG GLU 92 4.173 -0.820 -17.534 769 H SER 93 H SER 93 2.046 0.890 -13.381 770 HA SER 93 HA SER 93 2.836 -1.076 -11.632 771 1HB SER 93 1HB SER 93 0.699 0.453 -10.449 772 2HB SER 93 2HB SER 93 2.423 0.595 -10.172 773 HG SER 93 HG SER 93 2.249 2.495 -11.136 774 H LYS 94 H LYS 94 -0.344 -0.392 -13.176 775 HA LYS 94 HA LYS 94 -1.833 -2.208 -11.649 776 1HB LYS 94 1HB LYS 94 -2.330 -0.310 -13.619 777 2HB LYS 94 2HB LYS 94 -2.763 -1.819 -14.397 778 1HG LYS 94 1HG LYS 94 -3.786 -1.993 -11.736 779 2HG LYS 94 2HG LYS 94 -4.171 -0.376 -12.291 780 1HD LYS 94 1HD LYS 94 -5.224 -1.308 -14.344 781 2HD LYS 94 2HD LYS 94 -4.793 -2.932 -13.847 782 1HE LYS 94 1HE LYS 94 -6.231 -1.508 -11.711 783 2HE LYS 94 2HE LYS 94 -7.166 -1.547 -13.193 784 1HZ LYS 94 1HZ LYS 94 -7.379 -3.500 -11.664 785 2HZ LYS 94 2HZ LYS 94 -7.084 -3.857 -13.230 786 3HZ LYS 94 3HZ LYS 94 -5.881 -3.954 -12.129 787 H GLU 95 H GLU 95 -0.283 -2.520 -14.919 788 HA GLU 95 HA GLU 95 -0.979 -5.214 -15.151 789 1HB GLU 95 1HB GLU 95 1.332 -3.775 -16.524 790 2HB GLU 95 2HB GLU 95 0.517 -5.220 -17.087 791 1HG GLU 95 1HG GLU 95 -1.269 -2.883 -16.557 792 2HG GLU 95 2HG GLU 95 -0.142 -2.672 -17.882 793 H LEU 96 H LEU 96 1.304 -3.619 -13.157 794 HA LEU 96 HA LEU 96 3.353 -5.576 -13.194 795 1HB LEU 96 1HB LEU 96 2.794 -3.052 -11.934 796 2HB LEU 96 2HB LEU 96 3.350 -4.199 -10.731 797 HG LEU 96 HG LEU 96 5.381 -4.629 -12.039 798 1HD1 LEU 96 1HD1 LEU 96 5.000 -2.360 -13.883 799 2HD1 LEU 96 2HD1 LEU 96 5.753 -3.951 -14.147 800 3HD1 LEU 96 3HD1 LEU 96 3.982 -3.782 -14.215 801 1HD2 LEU 96 1HD2 LEU 96 5.777 -3.014 -10.438 802 2HD2 LEU 96 2HD2 LEU 96 6.287 -2.186 -11.928 803 3HD2 LEU 96 3HD2 LEU 96 4.700 -1.826 -11.209 804 H GLY 97 H GLY 97 0.140 -5.451 -11.900 805 1HA GLY 97 1HA GLY 97 -0.805 -7.500 -11.131 806 2HA GLY 97 2HA GLY 97 0.713 -7.897 -10.350 807 H ALA 98 H ALA 98 -0.434 -4.554 -10.216 808 HA ALA 98 HA ALA 98 -0.564 -4.714 -7.360 809 1HB ALA 98 1HB ALA 98 0.414 -2.764 -8.410 810 2HB ALA 98 2HB ALA 98 -1.055 -2.490 -9.378 811 3HB ALA 98 3HB ALA 98 -1.097 -2.263 -7.613 812 H LEU 99 H LEU 99 -2.402 -4.511 -6.033 813 HA LEU 99 HA LEU 99 -4.712 -5.719 -6.918 814 1HB LEU 99 1HB LEU 99 -4.709 -3.750 -4.657 815 2HB LEU 99 2HB LEU 99 -5.596 -5.252 -4.818 816 HG LEU 99 HG LEU 99 -4.042 -5.934 -3.316 817 1HD1 LEU 99 1HD1 LEU 99 -3.629 -6.953 -5.779 818 2HD1 LEU 99 2HD1 LEU 99 -2.003 -6.318 -5.431 819 3HD1 LEU 99 3HD1 LEU 99 -2.756 -7.490 -4.324 820 1HD2 LEU 99 1HD2 LEU 99 -2.687 -4.295 -2.636 821 2HD2 LEU 99 2HD2 LEU 99 -1.516 -4.955 -3.803 822 3HD2 LEU 99 3HD2 LEU 99 -2.563 -3.592 -4.266 823 H THR 100 H THR 100 -4.028 -2.185 -6.457 824 HA THR 100 HA THR 100 -5.691 -1.549 -8.695 825 HB THR 100 HB THR 100 -7.453 -1.928 -7.000 826 HG1 THR 100 HG1 THR 100 -8.317 0.068 -7.552 827 1HG2 THR 100 1HG2 THR 100 -7.544 -0.588 -4.946 828 2HG2 THR 100 2HG2 THR 100 -6.001 -1.475 -4.951 829 3HG2 THR 100 3HG2 THR 100 -6.036 0.252 -5.381 830 H HIS 101 H HIS 101 -5.959 1.015 -8.727 831 HA HIS 101 HA HIS 101 -3.454 2.125 -7.702 832 1HB HIS 101 1HB HIS 101 -3.055 3.265 -9.791 833 2HB HIS 101 2HB HIS 101 -3.157 1.537 -10.066 834 HD1 HIS 101 HD1 HIS 101 -5.423 0.644 -11.209 835 HD2 HIS 101 HD2 HIS 101 -4.891 4.805 -11.198 836 HE1 HIS 101 HE1 HIS 101 -7.069 1.579 -12.919 837 H PHE 102 H PHE 102 -3.850 3.844 -6.409 838 HA PHE 102 HA PHE 102 -6.425 5.191 -6.773 839 1HB PHE 102 1HB PHE 102 -4.401 5.111 -4.454 840 2HB PHE 102 2HB PHE 102 -5.971 5.885 -4.376 841 HD1 PHE 102 HD1 PHE 102 -4.851 3.672 -2.570 842 HD2 PHE 102 HD2 PHE 102 -7.354 3.576 -5.995 843 HE1 PHE 102 HE1 PHE 102 -5.870 1.523 -1.766 844 HE2 PHE 102 HE2 PHE 102 -8.373 1.428 -5.191 845 HZ PHE 102 HZ PHE 102 -7.619 0.427 -3.086 846 H ALA 103 H ALA 103 -6.491 7.563 -6.476 847 HA ALA 103 HA ALA 103 -3.959 8.778 -7.346 848 1HB ALA 103 1HB ALA 103 -5.173 10.196 -8.738 849 2HB ALA 103 2HB ALA 103 -6.133 8.701 -8.842 850 3HB ALA 103 3HB ALA 103 -6.666 10.029 -7.783 851 H LYS 104 H LYS 104 -3.344 10.799 -6.394 852 HA LYS 104 HA LYS 104 -3.306 11.125 -3.831 853 1HB LYS 104 1HB LYS 104 -3.229 12.949 -6.075 854 2HB LYS 104 2HB LYS 104 -3.930 13.744 -4.680 855 1HG LYS 104 1HG LYS 104 -1.974 13.643 -3.459 856 2HG LYS 104 2HG LYS 104 -1.536 12.065 -4.084 857 1HD LYS 104 1HD LYS 104 -0.295 12.947 -5.794 858 2HD LYS 104 2HD LYS 104 -1.497 14.167 -6.167 859 1HE LYS 104 1HE LYS 104 -0.666 15.246 -3.863 860 2HE LYS 104 2HE LYS 104 0.770 14.288 -4.168 861 1HZ LYS 104 1HZ LYS 104 0.813 16.536 -5.128 862 2HZ LYS 104 2HZ LYS 104 1.052 15.362 -6.239 863 3HZ LYS 104 3HZ LYS 104 -0.392 16.119 -6.148 864 HA PRO 105 HA PRO 105 -7.652 12.886 -3.403 865 1HB PRO 105 1HB PRO 105 -9.291 13.152 -5.574 866 2HB PRO 105 2HB PRO 105 -8.296 14.457 -4.960 867 1HG PRO 105 1HG PRO 105 -7.888 12.790 -7.367 868 2HG PRO 105 2HG PRO 105 -7.170 14.338 -6.969 869 1HD PRO 105 1HD PRO 105 -5.910 11.767 -6.798 870 2HD PRO 105 2HD PRO 105 -5.233 13.302 -6.291 871 H PHE 106 H PHE 106 -7.920 11.009 -2.211 872 HA PHE 106 HA PHE 106 -9.687 9.136 -3.613 873 1HB PHE 106 1HB PHE 106 -8.359 7.575 -1.774 874 2HB PHE 106 2HB PHE 106 -7.794 7.767 -3.421 875 HD1 PHE 106 HD1 PHE 106 -7.591 9.872 -0.333 876 HD2 PHE 106 HD2 PHE 106 -5.512 7.995 -3.521 877 HE1 PHE 106 HE1 PHE 106 -5.428 10.819 0.519 878 HE2 PHE 106 HE2 PHE 106 -3.349 8.942 -2.669 879 HZ PHE 106 HZ PHE 106 -3.333 10.343 -0.659 880 H ASP 107 H ASP 107 -11.169 7.939 -2.190 881 HA ASP 107 HA ASP 107 -11.692 9.500 0.209 882 1HB ASP 107 1HB ASP 107 -13.365 8.824 -1.904 883 2HB ASP 107 2HB ASP 107 -13.750 7.571 -0.741 884 H ILE 108 H ILE 108 -12.016 8.353 2.225 885 HA ILE 108 HA ILE 108 -10.714 5.828 2.370 886 HB ILE 108 HB ILE 108 -11.359 7.959 4.099 887 1HG1 ILE 108 1HG1 ILE 108 -9.187 6.921 3.971 888 2HG1 ILE 108 2HG1 ILE 108 -9.789 6.799 5.612 889 1HG2 ILE 108 1HG2 ILE 108 -12.427 5.323 5.146 890 2HG2 ILE 108 2HG2 ILE 108 -12.264 6.842 6.059 891 3HG2 ILE 108 3HG2 ILE 108 -13.408 6.739 4.700 892 1HD1 ILE 108 1HD1 ILE 108 -10.763 4.463 4.404 893 2HD1 ILE 108 2HD1 ILE 108 -9.137 4.660 3.706 894 3HD1 ILE 108 3HD1 ILE 108 -9.344 4.577 5.472 895 H ASP 109 H ASP 109 -14.098 7.011 2.403 896 HA ASP 109 HA ASP 109 -15.239 4.636 3.237 897 1HB ASP 109 1HB ASP 109 -16.118 7.119 1.831 898 2HB ASP 109 2HB ASP 109 -17.144 5.725 1.560 899 H GLU 110 H GLU 110 -14.351 5.974 -0.001 900 HA GLU 110 HA GLU 110 -15.550 3.911 -1.462 901 1HB GLU 110 1HB GLU 110 -15.161 5.866 -2.700 902 2HB GLU 110 2HB GLU 110 -13.552 6.094 -2.046 903 1HG GLU 110 1HG GLU 110 -12.573 4.734 -3.618 904 2HG GLU 110 2HG GLU 110 -13.870 3.558 -3.559 905 H ILE 111 H ILE 111 -12.371 4.352 0.089 906 HA ILE 111 HA ILE 111 -11.087 2.234 -1.269 907 HB ILE 111 HB ILE 111 -10.552 3.945 1.106 908 1HG1 ILE 111 1HG1 ILE 111 -8.913 3.240 -1.346 909 2HG1 ILE 111 2HG1 ILE 111 -9.964 4.635 -1.206 910 1HG2 ILE 111 1HG2 ILE 111 -9.352 1.236 0.641 911 2HG2 ILE 111 2HG2 ILE 111 -8.351 2.549 1.306 912 3HG2 ILE 111 3HG2 ILE 111 -9.824 2.031 2.162 913 1HD1 ILE 111 1HD1 ILE 111 -7.249 4.407 -0.356 914 2HD1 ILE 111 2HD1 ILE 111 -8.342 5.796 -0.139 915 3HD1 ILE 111 3HD1 ILE 111 -8.236 4.542 1.120 916 H ARG 112 H ARG 112 -13.398 2.438 1.373 917 HA ARG 112 HA ARG 112 -12.738 0.037 2.600 918 1HB ARG 112 1HB ARG 112 -15.410 1.518 2.421 919 2HB ARG 112 2HB ARG 112 -15.110 0.181 3.513 920 1HG ARG 112 1HG ARG 112 -12.945 1.818 4.064 921 2HG ARG 112 2HG ARG 112 -14.175 3.004 3.673 922 1HD ARG 112 1HD ARG 112 -15.268 2.645 5.640 923 2HD ARG 112 2HD ARG 112 -15.298 0.912 5.386 924 HE ARG 112 HE ARG 112 -12.659 1.410 6.087 925 1HH1 ARG 112 1HH1 ARG 112 -15.769 2.132 7.566 926 2HH1 ARG 112 2HH1 ARG 112 -15.154 2.089 9.184 927 1HH2 ARG 112 1HH2 ARG 112 -11.846 1.353 8.222 928 2HH2 ARG 112 2HH2 ARG 112 -12.908 1.643 9.560 929 H ASP 113 H ASP 113 -14.311 0.811 -0.422 930 HA ASP 113 HA ASP 113 -15.881 -1.528 -0.570 931 1HB ASP 113 1HB ASP 113 -15.513 0.868 -2.068 932 2HB ASP 113 2HB ASP 113 -15.104 -0.433 -3.169 933 H ALA 114 H ALA 114 -12.835 -0.353 -2.202 934 HA ALA 114 HA ALA 114 -12.272 -2.714 -3.556 935 1HB ALA 114 1HB ALA 114 -11.180 -0.705 -4.213 936 2HB ALA 114 2HB ALA 114 -10.586 -0.394 -2.564 937 3HB ALA 114 3HB ALA 114 -9.898 -1.728 -3.521 938 H VAL 115 H VAL 115 -11.645 -1.657 -0.198 939 HA VAL 115 HA VAL 115 -9.758 -3.590 0.465 940 HB VAL 115 HB VAL 115 -11.812 -2.026 2.013 941 1HG1 VAL 115 1HG1 VAL 115 -9.852 -4.083 3.058 942 2HG1 VAL 115 2HG1 VAL 115 -10.514 -2.780 4.073 943 3HG1 VAL 115 3HG1 VAL 115 -11.606 -3.980 3.341 944 1HG2 VAL 115 1HG2 VAL 115 -8.862 -1.793 2.422 945 2HG2 VAL 115 2HG2 VAL 115 -9.542 -1.155 0.906 946 3HG2 VAL 115 3HG2 VAL 115 -10.130 -0.545 2.471 947 H LYS 116 H LYS 116 -13.346 -3.671 0.322 948 HA LYS 116 HA LYS 116 -13.676 -6.114 1.620 949 1HB LYS 116 1HB LYS 116 -15.458 -4.441 1.136 950 2HB LYS 116 2HB LYS 116 -15.392 -4.884 -0.558 951 1HG LYS 116 1HG LYS 116 -15.607 -7.308 1.019 952 2HG LYS 116 2HG LYS 116 -16.842 -6.185 1.554 953 1HD LYS 116 1HD LYS 116 -16.357 -6.930 -1.369 954 2HD LYS 116 2HD LYS 116 -17.573 -7.679 -0.355 955 1HE LYS 116 1HE LYS 116 -18.869 -5.694 -0.205 956 2HE LYS 116 2HE LYS 116 -17.517 -4.660 -0.623 957 1HZ LYS 116 1HZ LYS 116 -19.001 -6.445 -2.411 958 2HZ LYS 116 2HZ LYS 116 -18.860 -4.821 -2.508 959 3HZ LYS 116 3HZ LYS 116 -17.575 -5.772 -2.837 960 H LYS 117 H LYS 117 -12.164 -5.336 -1.379 961 HA LYS 117 HA LYS 117 -12.552 -8.084 -2.326 962 1HB LYS 117 1HB LYS 117 -11.728 -5.555 -3.778 963 2HB LYS 117 2HB LYS 117 -11.676 -7.151 -4.497 964 1HG LYS 117 1HG LYS 117 -13.949 -7.248 -4.760 965 2HG LYS 117 2HG LYS 117 -14.260 -6.577 -3.171 966 1HD LYS 117 1HD LYS 117 -14.910 -4.690 -4.271 967 2HD LYS 117 2HD LYS 117 -13.200 -4.381 -4.499 968 1HE LYS 117 1HE LYS 117 -14.192 -6.279 -6.506 969 2HE LYS 117 2HE LYS 117 -15.137 -4.803 -6.525 970 1HZ LYS 117 1HZ LYS 117 -12.656 -5.163 -7.591 971 2HZ LYS 117 2HZ LYS 117 -13.450 -3.745 -7.434 972 3HZ LYS 117 3HZ LYS 117 -12.397 -4.223 -6.281 973 H TYR 118 H TYR 118 -10.233 -5.683 -1.131 974 HA TYR 118 HA TYR 118 -7.954 -7.274 -1.870 975 1HB TYR 118 1HB TYR 118 -7.165 -5.103 -1.589 976 2HB TYR 118 2HB TYR 118 -8.693 -4.619 -0.880 977 HD1 TYR 118 HD1 TYR 118 -8.186 -3.326 0.993 978 HD2 TYR 118 HD2 TYR 118 -6.082 -7.000 0.379 979 HE1 TYR 118 HE1 TYR 118 -7.048 -3.060 3.251 980 HE2 TYR 118 HE2 TYR 118 -4.951 -6.722 2.638 981 HH TYR 118 HH TYR 118 -6.026 -4.821 4.968 982 H LEU 119 H LEU 119 -9.695 -6.389 1.188 983 HA LEU 119 HA LEU 119 -8.537 -8.811 2.361 984 1HB LEU 119 1HB LEU 119 -7.860 -6.163 3.053 985 2HB LEU 119 2HB LEU 119 -8.896 -6.751 4.338 986 HG LEU 119 HG LEU 119 -6.216 -7.097 4.257 987 1HD1 LEU 119 1HD1 LEU 119 -8.433 -8.111 5.773 988 2HD1 LEU 119 2HD1 LEU 119 -7.182 -9.369 5.631 989 3HD1 LEU 119 3HD1 LEU 119 -6.766 -7.771 6.295 990 1HD2 LEU 119 1HD2 LEU 119 -7.206 -9.805 3.382 991 2HD2 LEU 119 2HD2 LEU 119 -6.596 -8.610 2.212 992 3HD2 LEU 119 3HD2 LEU 119 -5.536 -9.202 3.513 993 HA PRO 120 HA PRO 120 -12.653 -9.527 3.456 994 1HB PRO 120 1HB PRO 120 -12.341 -11.422 5.400 995 2HB PRO 120 2HB PRO 120 -12.268 -11.785 3.688 996 1HG PRO 120 1HG PRO 120 -10.054 -11.593 5.636 997 2HG PRO 120 2HG PRO 120 -10.064 -12.354 4.058 998 1HD PRO 120 1HD PRO 120 -8.899 -9.822 4.734 999 2HD PRO 120 2HD PRO 120 -9.011 -10.530 3.136 1000 H LEU 121 H LEU 121 -12.128 -7.113 4.296 1001 HA LEU 121 HA LEU 121 -12.509 -7.113 7.174 1002 1HB LEU 121 1HB LEU 121 -10.864 -5.612 6.399 1003 2HB LEU 121 2HB LEU 121 -11.897 -4.999 5.122 1004 HG LEU 121 HG LEU 121 -13.400 -4.035 6.907 1005 1HD1 LEU 121 1HD1 LEU 121 -12.088 -5.646 8.641 1006 2HD1 LEU 121 2HD1 LEU 121 -11.215 -4.117 8.899 1007 3HD1 LEU 121 3HD1 LEU 121 -12.980 -4.181 9.115 1008 1HD2 LEU 121 1HD2 LEU 121 -10.766 -3.133 6.040 1009 2HD2 LEU 121 2HD2 LEU 121 -12.304 -2.245 6.163 1010 3HD2 LEU 121 3HD2 LEU 121 -11.257 -2.415 7.593 1011 H LYS 122 H LYS 122 -14.221 -5.534 8.052 1012 HA LYS 122 HA LYS 122 -16.711 -6.433 7.383 1013 1HB LYS 122 1HB LYS 122 -16.199 -5.329 9.485 1014 2HB LYS 122 2HB LYS 122 -15.884 -3.813 8.665 1015 1HG LYS 122 1HG LYS 122 -18.416 -4.420 7.719 1016 2HG LYS 122 2HG LYS 122 -18.485 -5.099 9.333 1017 1HD LYS 122 1HD LYS 122 -19.156 -2.888 9.736 1018 2HD LYS 122 2HD LYS 122 -17.443 -2.797 10.093 1019 1HE LYS 122 1HE LYS 122 -17.545 -2.336 7.323 1020 2HE LYS 122 2HE LYS 122 -18.973 -1.512 7.918 1021 1HZ LYS 122 1HZ LYS 122 -17.714 0.026 8.849 1022 2HZ LYS 122 2HZ LYS 122 -16.726 -1.053 9.574 1023 3HZ LYS 122 3HZ LYS 122 -16.437 -0.586 8.036 1024 H SER 123 H SER 123 -18.006 -6.201 5.645 1025 HA SER 123 HA SER 123 -17.211 -4.542 3.542 1026 1HB SER 123 1HB SER 123 -19.993 -5.717 3.867 1027 2HB SER 123 2HB SER 123 -19.123 -5.403 2.379 1028 HG SER 123 HG SER 123 -18.428 -7.416 2.500 1029 H ASN 124 H ASN 124 -17.787 -2.436 3.026 1030 HA ASN 124 HA ASN 124 -19.430 -1.099 4.973 1031 1HB ASN 124 1HB ASN 124 -17.374 0.055 4.403 1032 2HB ASN 124 2HB ASN 124 -17.640 -0.161 2.685 1033 1HD2 ASN 124 1HD2 ASN 124 -19.023 1.318 5.595 1034 2HD2 ASN 124 2HD2 ASN 124 -19.714 2.713 4.835 Start of MODEL 4 1 1H MET 1 1H MET 1 -12.134 -14.641 18.926 2 HA MET 1 HA MET 1 -11.314 -12.511 18.324 3 1HB MET 1 1HB MET 1 -9.529 -14.934 18.268 4 2HB MET 1 2HB MET 1 -8.785 -13.445 17.720 5 1HG MET 1 1HG MET 1 -9.378 -12.315 19.839 6 2HG MET 1 2HG MET 1 -10.267 -13.725 20.380 7 1HE MET 1 1HE MET 1 -8.924 -13.679 22.565 8 2HE MET 1 2HE MET 1 -7.157 -13.852 22.698 9 3HE MET 1 3HE MET 1 -7.858 -12.344 22.064 10 H MET 2 H MET 2 -9.197 -11.792 16.698 11 HA MET 2 HA MET 2 -9.972 -12.553 14.015 12 1HB MET 2 1HB MET 2 -10.219 -9.826 15.299 13 2HB MET 2 2HB MET 2 -9.661 -9.866 13.638 14 1HG MET 2 1HG MET 2 -11.674 -10.886 12.852 15 2HG MET 2 2HG MET 2 -12.133 -11.435 14.452 16 1HE MET 2 1HE MET 2 -14.631 -10.305 14.489 17 2HE MET 2 2HE MET 2 -14.880 -8.818 13.543 18 3HE MET 2 3HE MET 2 -14.164 -10.254 12.773 19 H ASN 3 H ASN 3 -8.391 -10.832 12.526 20 HA ASN 3 HA ASN 3 -5.861 -10.465 13.680 21 1HB ASN 3 1HB ASN 3 -6.233 -13.098 13.010 22 2HB ASN 3 2HB ASN 3 -5.684 -12.490 11.460 23 1HD2 ASN 3 1HD2 ASN 3 -4.265 -14.338 12.941 24 2HD2 ASN 3 2HD2 ASN 3 -2.772 -13.653 13.490 25 H GLU 4 H GLU 4 -4.311 -9.584 11.956 26 HA GLU 4 HA GLU 4 -4.788 -9.356 9.340 27 1HB GLU 4 1HB GLU 4 -6.809 -7.865 10.747 28 2HB GLU 4 2HB GLU 4 -5.769 -6.712 9.934 29 1HG GLU 4 1HG GLU 4 -6.451 -7.368 7.842 30 2HG GLU 4 2HG GLU 4 -6.453 -9.069 8.263 31 H LYS 5 H LYS 5 -3.437 -7.635 8.295 32 HA LYS 5 HA LYS 5 -1.840 -6.041 10.098 33 1HB LYS 5 1HB LYS 5 -0.753 -8.430 8.625 34 2HB LYS 5 2HB LYS 5 0.268 -7.036 8.916 35 1HG LYS 5 1HG LYS 5 0.671 -7.890 10.982 36 2HG LYS 5 2HG LYS 5 -0.971 -7.444 11.401 37 1HD LYS 5 1HD LYS 5 -1.133 -9.698 11.869 38 2HD LYS 5 2HD LYS 5 -1.525 -9.783 10.163 39 1HE LYS 5 1HE LYS 5 0.360 -10.970 9.704 40 2HE LYS 5 2HE LYS 5 1.375 -9.795 10.516 41 1HZ LYS 5 1HZ LYS 5 0.376 -12.266 11.485 42 2HZ LYS 5 2HZ LYS 5 1.632 -11.374 12.023 43 3HZ LYS 5 3HZ LYS 5 0.118 -11.047 12.540 44 H ILE 6 H ILE 6 -0.403 -4.524 8.844 45 HA ILE 6 HA ILE 6 -0.879 -4.300 6.041 46 HB ILE 6 HB ILE 6 -2.579 -2.842 7.931 47 1HG1 ILE 6 1HG1 ILE 6 -3.339 -2.594 5.182 48 2HG1 ILE 6 2HG1 ILE 6 -2.774 -4.232 5.444 49 1HG2 ILE 6 1HG2 ILE 6 -2.613 -0.760 6.597 50 2HG2 ILE 6 2HG2 ILE 6 -1.072 -1.014 7.451 51 3HG2 ILE 6 3HG2 ILE 6 -1.184 -1.334 5.704 52 1HD1 ILE 6 1HD1 ILE 6 -5.308 -3.474 5.993 53 2HD1 ILE 6 2HD1 ILE 6 -4.477 -4.742 6.926 54 3HD1 ILE 6 3HD1 ILE 6 -4.564 -3.082 7.561 55 H LEU 7 H LEU 7 0.373 -2.452 5.115 56 HA LEU 7 HA LEU 7 2.382 -1.448 6.992 57 1HB LEU 7 1HB LEU 7 2.864 -3.521 5.230 58 2HB LEU 7 2HB LEU 7 3.439 -2.118 4.351 59 HG LEU 7 HG LEU 7 4.636 -1.606 6.687 60 1HD1 LEU 7 1HD1 LEU 7 4.943 -4.573 6.732 61 2HD1 LEU 7 2HD1 LEU 7 5.108 -3.378 8.040 62 3HD1 LEU 7 3HD1 LEU 7 3.490 -3.865 7.479 63 1HD2 LEU 7 1HD2 LEU 7 6.531 -1.982 5.546 64 2HD2 LEU 7 2HD2 LEU 7 6.105 -3.673 5.188 65 3HD2 LEU 7 3HD2 LEU 7 5.439 -2.357 4.191 66 H ILE 8 H ILE 8 3.188 0.634 6.501 67 HA ILE 8 HA ILE 8 1.767 1.944 4.288 68 HB ILE 8 HB ILE 8 2.379 2.967 7.059 69 1HG1 ILE 8 1HG1 ILE 8 -0.308 2.861 5.694 70 2HG1 ILE 8 2HG1 ILE 8 0.328 1.467 6.544 71 1HG2 ILE 8 1HG2 ILE 8 0.833 4.831 5.565 72 2HG2 ILE 8 2HG2 ILE 8 2.450 5.040 6.280 73 3HG2 ILE 8 3HG2 ILE 8 2.285 4.436 4.614 74 1HD1 ILE 8 1HD1 ILE 8 -0.023 2.403 8.598 75 2HD1 ILE 8 2HD1 ILE 8 0.581 3.994 8.075 76 3HD1 ILE 8 3HD1 ILE 8 -1.099 3.521 7.725 77 H VAL 9 H VAL 9 3.262 2.120 2.685 78 HA VAL 9 HA VAL 9 5.985 2.836 3.478 79 HB VAL 9 HB VAL 9 4.925 1.887 0.811 80 1HG1 VAL 9 1HG1 VAL 9 7.109 3.181 0.882 81 2HG1 VAL 9 2HG1 VAL 9 7.774 1.834 1.838 82 3HG1 VAL 9 3HG1 VAL 9 7.193 1.548 0.180 83 1HG2 VAL 9 1HG2 VAL 9 5.281 -0.301 1.387 84 2HG2 VAL 9 2HG2 VAL 9 6.525 0.100 2.595 85 3HG2 VAL 9 3HG2 VAL 9 4.803 0.339 2.978 86 H ASP 10 H ASP 10 6.805 4.845 3.086 87 HA ASP 10 HA ASP 10 6.714 6.995 2.705 88 1HB ASP 10 1HB ASP 10 7.143 5.733 0.372 89 2HB ASP 10 2HB ASP 10 5.615 6.473 -0.060 90 H ASP 11 H ASP 11 5.095 8.615 0.923 91 HA ASP 11 HA ASP 11 3.195 9.650 0.798 92 1HB ASP 11 1HB ASP 11 2.474 7.171 0.169 93 2HB ASP 11 2HB ASP 11 1.660 7.203 1.721 94 H GLN 12 H GLN 12 4.628 8.856 3.527 95 HA GLN 12 HA GLN 12 2.482 9.057 5.391 96 1HB GLN 12 1HB GLN 12 4.491 9.242 7.038 97 2HB GLN 12 2HB GLN 12 4.261 7.732 6.180 98 1HG GLN 12 1HG GLN 12 6.144 8.021 4.866 99 2HG GLN 12 2HG GLN 12 5.944 9.759 4.765 100 1HE2 GLN 12 1HE2 GLN 12 6.015 10.796 7.103 101 2HE2 GLN 12 2HE2 GLN 12 7.420 10.393 8.033 102 H TYR 13 H TYR 13 1.487 10.965 5.865 103 HA TYR 13 HA TYR 13 3.056 13.271 6.476 104 1HB TYR 13 1HB TYR 13 2.146 12.769 3.785 105 2HB TYR 13 2HB TYR 13 1.036 13.961 4.432 106 HD1 TYR 13 HD1 TYR 13 2.049 16.107 5.459 107 HD2 TYR 13 HD2 TYR 13 4.262 13.416 2.976 108 HE1 TYR 13 HE1 TYR 13 3.744 17.939 4.972 109 HE2 TYR 13 HE2 TYR 13 5.949 15.257 2.497 110 HH TYR 13 HH TYR 13 6.338 17.852 4.284 111 H GLY 14 H GLY 14 1.026 11.413 7.683 112 1HA GLY 14 1HA GLY 14 -0.389 12.177 9.441 113 2HA GLY 14 2HA GLY 14 -0.939 13.489 8.418 114 H ILE 15 H ILE 15 -0.724 11.062 6.222 115 HA ILE 15 HA ILE 15 -3.546 10.438 6.522 116 HB ILE 15 HB ILE 15 -1.563 10.179 4.272 117 1HG1 ILE 15 1HG1 ILE 15 -4.068 11.586 3.777 118 2HG1 ILE 15 2HG1 ILE 15 -3.193 12.282 5.127 119 1HG2 ILE 15 1HG2 ILE 15 -3.334 9.259 2.885 120 2HG2 ILE 15 2HG2 ILE 15 -3.011 8.191 4.272 121 3HG2 ILE 15 3HG2 ILE 15 -4.446 9.244 4.276 122 1HD1 ILE 15 1HD1 ILE 15 -2.095 13.408 3.446 123 2HD1 ILE 15 2HD1 ILE 15 -1.112 11.925 3.406 124 3HD1 ILE 15 3HD1 ILE 15 -2.437 12.146 2.238 125 H ARG 16 H ARG 16 -0.305 8.896 6.469 126 HA ARG 16 HA ARG 16 -1.073 6.305 6.321 127 1HB ARG 16 1HB ARG 16 1.044 5.897 7.788 128 2HB ARG 16 2HB ARG 16 1.266 6.751 6.275 129 1HG ARG 16 1HG ARG 16 1.414 8.888 7.370 130 2HG ARG 16 2HG ARG 16 0.756 8.259 8.868 131 1HD ARG 16 1HD ARG 16 3.314 7.042 7.808 132 2HD ARG 16 2HD ARG 16 3.396 8.623 8.559 133 HE ARG 16 HE ARG 16 1.908 6.612 10.115 134 1HH1 ARG 16 1HH1 ARG 16 5.026 8.132 9.524 135 2HH1 ARG 16 2HH1 ARG 16 5.677 7.691 11.067 136 1HH2 ARG 16 1HH2 ARG 16 2.767 6.028 12.151 137 2HH2 ARG 16 2HH2 ARG 16 4.384 6.486 12.571 138 H ILE 17 H ILE 17 -1.097 8.548 9.124 139 HA ILE 17 HA ILE 17 -1.637 6.547 11.054 140 HB ILE 17 HB ILE 17 -2.016 9.543 11.086 141 1HG1 ILE 17 1HG1 ILE 17 0.173 8.126 12.548 142 2HG1 ILE 17 2HG1 ILE 17 0.333 8.303 10.812 143 1HG2 ILE 17 1HG2 ILE 17 -2.513 7.436 13.138 144 2HG2 ILE 17 2HG2 ILE 17 -1.768 8.963 13.667 145 3HG2 ILE 17 3HG2 ILE 17 -3.348 8.980 12.847 146 1HD1 ILE 17 1HD1 ILE 17 -0.595 10.788 12.104 147 2HD1 ILE 17 2HD1 ILE 17 0.987 10.240 12.709 148 3HD1 ILE 17 3HD1 ILE 17 0.753 10.535 10.970 149 H LEU 18 H LEU 18 -3.656 8.834 9.120 150 HA LEU 18 HA LEU 18 -6.078 8.452 10.248 151 1HB LEU 18 1HB LEU 18 -5.283 9.822 8.192 152 2HB LEU 18 2HB LEU 18 -5.757 8.412 7.264 153 HG LEU 18 HG LEU 18 -8.013 8.746 8.700 154 1HD1 LEU 18 1HD1 LEU 18 -7.697 11.594 8.156 155 2HD1 LEU 18 2HD1 LEU 18 -8.352 10.761 9.586 156 3HD1 LEU 18 3HD1 LEU 18 -6.597 11.012 9.428 157 1HD2 LEU 18 1HD2 LEU 18 -7.418 8.781 6.117 158 2HD2 LEU 18 2HD2 LEU 18 -8.995 9.338 6.727 159 3HD2 LEU 18 3HD2 LEU 18 -7.731 10.522 6.317 160 H LEU 19 H LEU 19 -4.628 6.350 7.660 161 HA LEU 19 HA LEU 19 -6.722 4.441 7.933 162 1HB LEU 19 1HB LEU 19 -5.192 3.087 6.446 163 2HB LEU 19 2HB LEU 19 -5.807 4.600 5.811 164 HG LEU 19 HG LEU 19 -3.234 4.973 7.126 165 1HD1 LEU 19 1HD1 LEU 19 -1.988 3.797 5.195 166 2HD1 LEU 19 2HD1 LEU 19 -2.564 2.816 6.564 167 3HD1 LEU 19 3HD1 LEU 19 -3.469 2.823 5.031 168 1HD2 LEU 19 1HD2 LEU 19 -3.688 5.372 4.198 169 2HD2 LEU 19 2HD2 LEU 19 -4.611 6.364 5.352 170 3HD2 LEU 19 3HD2 LEU 19 -2.832 6.393 5.378 171 H ASN 20 H ASN 20 -3.699 5.121 9.565 172 HA ASN 20 HA ASN 20 -3.085 2.561 10.399 173 1HB ASN 20 1HB ASN 20 -1.642 4.663 10.617 174 2HB ASN 20 2HB ASN 20 -2.660 5.168 11.951 175 1HD2 ASN 20 1HD2 ASN 20 -0.351 5.080 12.828 176 2HD2 ASN 20 2HD2 ASN 20 0.117 3.630 13.653 177 H GLU 21 H GLU 21 -4.837 5.282 12.089 178 HA GLU 21 HA GLU 21 -5.488 3.947 14.362 179 1HB GLU 21 1HB GLU 21 -5.837 6.427 13.718 180 2HB GLU 21 2HB GLU 21 -7.354 5.925 13.000 181 1HG GLU 21 1HG GLU 21 -8.357 5.534 15.041 182 2HG GLU 21 2HG GLU 21 -6.890 4.906 15.765 183 H VAL 22 H VAL 22 -6.920 3.718 11.116 184 HA VAL 22 HA VAL 22 -9.332 2.501 11.863 185 HB VAL 22 HB VAL 22 -7.693 2.375 9.326 186 1HG1 VAL 22 1HG1 VAL 22 -10.466 2.006 8.808 187 2HG1 VAL 22 2HG1 VAL 22 -9.129 0.863 8.537 188 3HG1 VAL 22 3HG1 VAL 22 -10.006 0.857 10.086 189 1HG2 VAL 22 1HG2 VAL 22 -8.988 4.179 8.525 190 2HG2 VAL 22 2HG2 VAL 22 -10.181 4.018 9.836 191 3HG2 VAL 22 3HG2 VAL 22 -8.548 4.632 10.189 192 H PHE 23 H PHE 23 -6.282 1.029 10.528 193 HA PHE 23 HA PHE 23 -7.132 -1.591 11.078 194 1HB PHE 23 1HB PHE 23 -4.296 -0.423 10.848 195 2HB PHE 23 2HB PHE 23 -4.751 -2.079 10.498 196 HD1 PHE 23 HD1 PHE 23 -3.585 0.543 8.876 197 HD2 PHE 23 HD2 PHE 23 -7.109 -1.821 8.828 198 HE1 PHE 23 HE1 PHE 23 -3.964 1.156 6.472 199 HE2 PHE 23 HE2 PHE 23 -7.487 -1.208 6.424 200 HZ PHE 23 HZ PHE 23 -5.911 0.274 5.275 201 H ASN 24 H ASN 24 -5.058 0.772 12.852 202 HA ASN 24 HA ASN 24 -4.132 -0.954 14.765 203 1HB ASN 24 1HB ASN 24 -3.723 1.664 14.248 204 2HB ASN 24 2HB ASN 24 -4.896 1.875 15.533 205 1HD2 ASN 24 1HD2 ASN 24 -3.770 2.508 17.225 206 2HD2 ASN 24 2HD2 ASN 24 -2.403 1.703 17.920 207 H LYS 25 H LYS 25 -7.207 0.885 14.445 208 HA LYS 25 HA LYS 25 -8.186 0.662 17.002 209 1HB LYS 25 1HB LYS 25 -9.266 1.140 14.308 210 2HB LYS 25 2HB LYS 25 -10.424 0.422 15.409 211 1HG LYS 25 1HG LYS 25 -9.797 2.210 17.118 212 2HG LYS 25 2HG LYS 25 -8.808 2.969 15.886 213 1HD LYS 25 1HD LYS 25 -10.659 4.080 15.191 214 2HD LYS 25 2HD LYS 25 -11.281 2.553 14.598 215 1HE LYS 25 1HE LYS 25 -12.998 3.311 16.047 216 2HE LYS 25 2HE LYS 25 -12.130 2.147 17.029 217 1HZ LYS 25 1HZ LYS 25 -12.632 4.490 17.929 218 2HZ LYS 25 2HZ LYS 25 -11.194 3.792 18.267 219 3HZ LYS 25 3HZ LYS 25 -11.295 4.931 17.101 220 H GLU 26 H GLU 26 -7.558 -1.822 14.632 221 HA GLU 26 HA GLU 26 -9.329 -3.652 16.000 222 1HB GLU 26 1HB GLU 26 -7.589 -4.002 13.519 223 2HB GLU 26 2HB GLU 26 -8.644 -5.241 14.168 224 1HG GLU 26 1HG GLU 26 -9.699 -2.477 13.450 225 2HG GLU 26 2HG GLU 26 -9.572 -3.746 12.248 226 H GLY 27 H GLY 27 -6.001 -2.622 15.918 227 1HA GLY 27 1HA GLY 27 -4.490 -3.216 17.596 228 2HA GLY 27 2HA GLY 27 -5.316 -4.745 17.823 229 H TYR 28 H TYR 28 -4.977 -3.945 14.478 230 HA TYR 28 HA TYR 28 -3.265 -6.146 14.025 231 1HB TYR 28 1HB TYR 28 -4.050 -3.695 12.326 232 2HB TYR 28 2HB TYR 28 -3.418 -5.193 11.671 233 HD1 TYR 28 HD1 TYR 28 -5.966 -4.012 10.726 234 HD2 TYR 28 HD2 TYR 28 -5.208 -6.733 13.940 235 HE1 TYR 28 HE1 TYR 28 -8.330 -4.924 10.521 236 HE2 TYR 28 HE2 TYR 28 -7.575 -7.636 13.724 237 HH TYR 28 HH TYR 28 -9.339 -7.740 12.335 238 H GLN 29 H GLN 29 -1.103 -6.188 13.191 239 HA GLN 29 HA GLN 29 0.472 -4.064 14.280 240 1HB GLN 29 1HB GLN 29 0.829 -6.820 13.908 241 2HB GLN 29 2HB GLN 29 1.911 -6.111 12.727 242 1HG GLN 29 1HG GLN 29 3.161 -4.940 14.375 243 2HG GLN 29 2HG GLN 29 1.872 -5.029 15.559 244 1HE2 GLN 29 1HE2 GLN 29 1.786 -6.659 16.957 245 2HE2 GLN 29 2HE2 GLN 29 2.838 -8.035 16.984 246 H THR 30 H THR 30 1.165 -2.304 13.144 247 HA THR 30 HA THR 30 1.379 -2.597 10.222 248 HB THR 30 HB THR 30 0.514 -0.171 10.192 249 HG1 THR 30 HG1 THR 30 -0.305 -1.046 12.867 250 1HG2 THR 30 1HG2 THR 30 -1.872 -0.766 10.637 251 2HG2 THR 30 2HG2 THR 30 -1.072 -2.041 9.686 252 3HG2 THR 30 3HG2 THR 30 -1.345 -2.270 11.430 253 H PHE 31 H PHE 31 3.023 -1.394 9.189 254 HA PHE 31 HA PHE 31 4.889 -0.074 11.007 255 1HB PHE 31 1HB PHE 31 5.179 -2.680 9.932 256 2HB PHE 31 2HB PHE 31 6.075 -1.692 8.796 257 HD1 PHE 31 HD1 PHE 31 6.098 -3.245 12.026 258 HD2 PHE 31 HD2 PHE 31 7.942 -0.223 9.686 259 HE1 PHE 31 HE1 PHE 31 8.067 -3.242 13.582 260 HE2 PHE 31 HE2 PHE 31 9.911 -0.219 11.243 261 HZ PHE 31 HZ PHE 31 9.950 -1.729 13.172 262 H GLN 32 H GLN 32 6.598 1.191 9.737 263 HA GLN 32 HA GLN 32 5.455 2.043 7.193 264 1HB GLN 32 1HB GLN 32 4.976 3.991 8.275 265 2HB GLN 32 2HB GLN 32 6.029 3.616 9.625 266 1HG GLN 32 1HG GLN 32 8.009 4.330 8.357 267 2HG GLN 32 2HG GLN 32 7.056 4.538 6.901 268 1HE2 GLN 32 1HE2 GLN 32 5.505 6.200 6.778 269 2HE2 GLN 32 2HE2 GLN 32 5.599 7.620 7.765 270 H ALA 33 H ALA 33 6.948 2.506 5.517 271 HA ALA 33 HA ALA 33 9.762 2.024 6.216 272 1HB ALA 33 1HB ALA 33 7.971 0.564 4.411 273 2HB ALA 33 2HB ALA 33 9.432 1.158 3.584 274 3HB ALA 33 3HB ALA 33 9.583 0.119 5.021 275 H ALA 34 H ALA 34 11.244 2.873 4.374 276 HA ALA 34 HA ALA 34 10.044 5.290 3.215 277 1HB ALA 34 1HB ALA 34 12.853 5.162 4.352 278 2HB ALA 34 2HB ALA 34 11.901 6.599 3.906 279 3HB ALA 34 3HB ALA 34 11.454 5.646 5.341 280 H ASN 35 H ASN 35 10.156 2.861 1.840 281 HA ASN 35 HA ASN 35 11.407 3.561 -0.447 282 1HB ASN 35 1HB ASN 35 13.269 2.316 1.485 283 2HB ASN 35 2HB ASN 35 13.190 1.411 -0.014 284 1HD2 ASN 35 1HD2 ASN 35 15.480 2.674 0.777 285 2HD2 ASN 35 2HD2 ASN 35 15.849 4.003 -0.271 286 H GLY 36 H GLY 36 11.997 1.178 -1.717 287 1HA GLY 36 1HA GLY 36 9.505 -0.288 -1.496 288 2HA GLY 36 2HA GLY 36 10.742 -0.449 -2.727 289 H LEU 37 H LEU 37 13.071 -1.000 -1.348 290 HA LEU 37 HA LEU 37 12.736 -3.701 -0.713 291 1HB LEU 37 1HB LEU 37 14.823 -1.962 -1.291 292 2HB LEU 37 2HB LEU 37 15.153 -2.476 0.352 293 HG LEU 37 HG LEU 37 14.546 -4.487 -1.812 294 1HD1 LEU 37 1HD1 LEU 37 17.208 -4.646 -1.737 295 2HD1 LEU 37 2HD1 LEU 37 16.340 -3.604 -2.890 296 3HD1 LEU 37 3HD1 LEU 37 17.036 -2.905 -1.408 297 1HD2 LEU 37 1HD2 LEU 37 14.453 -5.504 0.290 298 2HD2 LEU 37 2HD2 LEU 37 16.096 -5.861 -0.294 299 3HD2 LEU 37 3HD2 LEU 37 15.839 -4.574 0.910 300 H GLN 38 H GLN 38 13.570 -0.883 1.431 301 HA GLN 38 HA GLN 38 13.575 -2.188 3.780 302 1HB GLN 38 1HB GLN 38 13.151 0.577 2.879 303 2HB GLN 38 2HB GLN 38 12.304 0.249 4.378 304 1HG GLN 38 1HG GLN 38 14.377 -0.562 5.435 305 2HG GLN 38 2HG GLN 38 15.248 -0.420 3.921 306 1HE2 GLN 38 1HE2 GLN 38 15.103 0.918 6.760 307 2HE2 GLN 38 2HE2 GLN 38 15.329 2.602 6.427 308 H ALA 39 H ALA 39 10.794 -1.392 1.736 309 HA ALA 39 HA ALA 39 8.873 -1.879 3.814 310 1HB ALA 39 1HB ALA 39 8.408 -0.277 2.029 311 2HB ALA 39 2HB ALA 39 8.639 -1.540 0.797 312 3HB ALA 39 3HB ALA 39 7.263 -1.636 1.922 313 H LEU 40 H LEU 40 10.330 -3.635 1.028 314 HA LEU 40 HA LEU 40 8.658 -5.829 1.030 315 1HB LEU 40 1HB LEU 40 11.554 -5.455 0.304 316 2HB LEU 40 2HB LEU 40 10.749 -7.000 0.123 317 HG LEU 40 HG LEU 40 10.018 -4.405 -1.258 318 1HD1 LEU 40 1HD1 LEU 40 10.472 -6.296 -3.195 319 2HD1 LEU 40 2HD1 LEU 40 11.636 -5.064 -2.652 320 3HD1 LEU 40 3HD1 LEU 40 11.694 -6.706 -1.967 321 1HD2 LEU 40 1HD2 LEU 40 7.937 -5.385 -0.958 322 2HD2 LEU 40 2HD2 LEU 40 8.440 -6.003 -2.550 323 3HD2 LEU 40 3HD2 LEU 40 8.575 -7.040 -1.109 324 H ASP 41 H ASP 41 11.679 -5.221 2.932 325 HA ASP 41 HA ASP 41 11.710 -7.677 4.171 326 1HB ASP 41 1HB ASP 41 13.321 -5.480 4.174 327 2HB ASP 41 2HB ASP 41 12.558 -5.256 5.736 328 H ILE 42 H ILE 42 10.610 -4.440 5.463 329 HA ILE 42 HA ILE 42 9.529 -5.332 7.819 330 HB ILE 42 HB ILE 42 8.780 -3.021 6.033 331 1HG1 ILE 42 1HG1 ILE 42 11.117 -3.372 7.249 332 2HG1 ILE 42 2HG1 ILE 42 10.364 -1.796 7.108 333 1HG2 ILE 42 1HG2 ILE 42 6.886 -2.971 7.259 334 2HG2 ILE 42 2HG2 ILE 42 7.572 -3.959 8.572 335 3HG2 ILE 42 3HG2 ILE 42 7.953 -2.223 8.471 336 1HD1 ILE 42 1HD1 ILE 42 9.549 -3.431 9.482 337 2HD1 ILE 42 2HD1 ILE 42 11.216 -2.806 9.475 338 3HD1 ILE 42 3HD1 ILE 42 9.843 -1.680 9.354 339 H VAL 43 H VAL 43 8.136 -5.313 4.512 340 HA VAL 43 HA VAL 43 5.529 -5.987 5.283 341 HB VAL 43 HB VAL 43 7.170 -6.050 2.798 342 1HG1 VAL 43 1HG1 VAL 43 6.006 -8.213 2.723 343 2HG1 VAL 43 2HG1 VAL 43 4.453 -7.393 3.014 344 3HG1 VAL 43 3HG1 VAL 43 5.355 -7.085 1.510 345 1HG2 VAL 43 1HG2 VAL 43 4.609 -4.740 3.724 346 2HG2 VAL 43 2HG2 VAL 43 6.135 -3.980 3.212 347 3HG2 VAL 43 3HG2 VAL 43 5.084 -4.763 2.008 348 H THR 44 H THR 44 8.443 -7.951 4.466 349 HA THR 44 HA THR 44 7.096 -10.435 4.623 350 HB THR 44 HB THR 44 10.017 -9.540 4.762 351 HG1 THR 44 HG1 THR 44 9.004 -9.319 2.702 352 1HG2 THR 44 1HG2 THR 44 10.261 -12.067 3.968 353 2HG2 THR 44 2HG2 THR 44 10.209 -11.703 5.709 354 3HG2 THR 44 3HG2 THR 44 8.750 -12.296 4.880 355 H LYS 45 H LYS 45 8.768 -8.362 7.019 356 HA LYS 45 HA LYS 45 8.648 -10.362 9.044 357 1HB LYS 45 1HB LYS 45 9.941 -7.882 8.645 358 2HB LYS 45 2HB LYS 45 8.922 -7.666 10.054 359 1HG LYS 45 1HG LYS 45 10.093 -10.256 10.329 360 2HG LYS 45 2HG LYS 45 11.386 -9.201 9.797 361 1HD LYS 45 1HD LYS 45 11.040 -7.680 11.654 362 2HD LYS 45 2HD LYS 45 9.521 -8.441 12.084 363 1HE LYS 45 1HE LYS 45 11.221 -9.226 13.642 364 2HE LYS 45 2HE LYS 45 10.774 -10.571 12.610 365 1HZ LYS 45 1HZ LYS 45 13.163 -10.309 12.852 366 2HZ LYS 45 2HZ LYS 45 12.707 -10.169 11.290 367 3HZ LYS 45 3HZ LYS 45 13.101 -8.837 12.149 368 H GLU 46 H GLU 46 6.816 -7.305 8.351 369 HA GLU 46 HA GLU 46 4.997 -7.861 10.446 370 1HB GLU 46 1HB GLU 46 5.238 -5.778 8.276 371 2HB GLU 46 2HB GLU 46 3.707 -5.939 9.113 372 1HG GLU 46 1HG GLU 46 5.826 -5.997 11.084 373 2HG GLU 46 2HG GLU 46 6.098 -4.627 10.026 374 H ARG 47 H ARG 47 5.453 -9.227 7.397 375 HA ARG 47 HA ARG 47 4.053 -10.010 5.840 376 1HB ARG 47 1HB ARG 47 2.887 -12.061 6.781 377 2HB ARG 47 2HB ARG 47 4.566 -11.920 7.263 378 1HG ARG 47 1HG ARG 47 4.046 -11.541 9.477 379 2HG ARG 47 2HG ARG 47 2.641 -10.566 9.093 380 1HD ARG 47 1HD ARG 47 2.036 -12.742 10.199 381 2HD ARG 47 2HD ARG 47 1.298 -12.562 8.619 382 HE ARG 47 HE ARG 47 3.793 -13.868 8.231 383 1HH1 ARG 47 1HH1 ARG 47 0.696 -14.497 9.778 384 2HH1 ARG 47 2HH1 ARG 47 0.798 -16.214 9.574 385 1HH2 ARG 47 1HH2 ARG 47 3.929 -16.133 7.962 386 2HH2 ARG 47 2HH2 ARG 47 2.650 -17.151 8.534 387 HA PRO 48 HA PRO 48 0.266 -7.708 7.084 388 1HB PRO 48 1HB PRO 48 0.436 -5.614 5.336 389 2HB PRO 48 2HB PRO 48 0.997 -5.526 6.993 390 1HG PRO 48 1HG PRO 48 2.583 -5.762 4.510 391 2HG PRO 48 2HG PRO 48 3.107 -5.254 6.103 392 1HD PRO 48 1HD PRO 48 3.572 -7.805 4.876 393 2HD PRO 48 2HD PRO 48 3.994 -7.335 6.511 394 H ASP 49 H ASP 49 -1.788 -7.415 5.980 395 HA ASP 49 HA ASP 49 -1.765 -9.209 3.709 396 1HB ASP 49 1HB ASP 49 -4.407 -8.274 4.539 397 2HB ASP 49 2HB ASP 49 -3.788 -9.912 4.476 398 H LEU 50 H LEU 50 -1.414 -5.962 4.272 399 HA LEU 50 HA LEU 50 -2.172 -5.223 1.661 400 1HB LEU 50 1HB LEU 50 -4.346 -5.305 3.252 401 2HB LEU 50 2HB LEU 50 -3.800 -3.675 3.591 402 HG LEU 50 HG LEU 50 -5.188 -3.228 1.852 403 1HD1 LEU 50 1HD1 LEU 50 -2.761 -2.686 1.229 404 2HD1 LEU 50 2HD1 LEU 50 -2.875 -4.062 0.106 405 3HD1 LEU 50 3HD1 LEU 50 -3.975 -2.674 -0.072 406 1HD2 LEU 50 1HD2 LEU 50 -4.867 -5.191 -0.157 407 2HD2 LEU 50 2HD2 LEU 50 -4.994 -6.056 1.393 408 3HD2 LEU 50 3HD2 LEU 50 -6.269 -4.915 0.904 409 H VAL 51 H VAL 51 -0.562 -3.862 1.117 410 HA VAL 51 HA VAL 51 0.368 -2.019 3.205 411 HB VAL 51 HB VAL 51 2.087 -3.556 3.138 412 1HG1 VAL 51 1HG1 VAL 51 1.654 -3.768 0.142 413 2HG1 VAL 51 2HG1 VAL 51 2.998 -4.540 1.018 414 3HG1 VAL 51 3HG1 VAL 51 1.318 -5.005 1.378 415 1HG2 VAL 51 1HG2 VAL 51 2.902 -1.639 0.931 416 2HG2 VAL 51 2HG2 VAL 51 2.843 -1.213 2.659 417 3HG2 VAL 51 3HG2 VAL 51 3.964 -2.474 2.091 418 H LEU 52 H LEU 52 0.950 0.085 2.487 419 HA LEU 52 HA LEU 52 0.074 0.634 -0.263 420 1HB LEU 52 1HB LEU 52 -1.415 1.987 0.628 421 2HB LEU 52 2HB LEU 52 -0.802 1.689 2.242 422 HG LEU 52 HG LEU 52 0.688 3.629 0.522 423 1HD1 LEU 52 1HD1 LEU 52 -1.197 4.766 0.069 424 2HD1 LEU 52 2HD1 LEU 52 -2.129 3.947 1.347 425 3HD1 LEU 52 3HD1 LEU 52 -1.056 5.306 1.759 426 1HD2 LEU 52 1HD2 LEU 52 1.595 3.099 2.692 427 2HD2 LEU 52 2HD2 LEU 52 0.985 4.771 2.703 428 3HD2 LEU 52 3HD2 LEU 52 0.043 3.475 3.479 429 H LEU 53 H LEU 53 1.367 1.969 -1.561 430 HA LEU 53 HA LEU 53 3.767 3.070 -0.363 431 1HB LEU 53 1HB LEU 53 4.522 0.872 -0.869 432 2HB LEU 53 2HB LEU 53 3.783 0.903 -2.457 433 HG LEU 53 HG LEU 53 6.321 1.182 -2.305 434 1HD1 LEU 53 1HD1 LEU 53 4.724 3.253 -3.838 435 2HD1 LEU 53 2HD1 LEU 53 6.385 2.723 -4.198 436 3HD1 LEU 53 3HD1 LEU 53 5.033 1.576 -4.349 437 1HD2 LEU 53 1HD2 LEU 53 6.141 4.076 -2.027 438 2HD2 LEU 53 2HD2 LEU 53 5.666 3.221 -0.540 439 3HD2 LEU 53 3HD2 LEU 53 7.260 2.916 -1.271 440 H ASP 54 H ASP 54 4.518 4.897 -1.457 441 HA ASP 54 HA ASP 54 2.681 5.806 -3.496 442 1HB ASP 54 1HB ASP 54 3.004 7.402 -1.733 443 2HB ASP 54 2HB ASP 54 4.739 7.153 -1.712 444 H MET 55 H MET 55 3.660 6.959 -5.451 445 HA MET 55 HA MET 55 5.863 5.421 -6.417 446 1HB MET 55 1HB MET 55 3.865 7.413 -7.513 447 2HB MET 55 2HB MET 55 5.349 7.197 -8.420 448 1HG MET 55 1HG MET 55 3.967 5.561 -9.391 449 2HG MET 55 2HG MET 55 4.832 4.615 -8.196 450 1HE MET 55 1HE MET 55 2.846 3.210 -5.994 451 2HE MET 55 2HE MET 55 4.270 4.278 -6.033 452 3HE MET 55 3HE MET 55 2.797 4.789 -5.174 453 H LYS 56 H LYS 56 5.182 8.816 -5.450 454 HA LYS 56 HA LYS 56 7.769 9.715 -6.291 455 1HB LYS 56 1HB LYS 56 5.295 10.899 -5.697 456 2HB LYS 56 2HB LYS 56 6.374 11.467 -4.438 457 1HG LYS 56 1HG LYS 56 7.962 12.331 -6.060 458 2HG LYS 56 2HG LYS 56 7.151 11.521 -7.386 459 1HD LYS 56 1HD LYS 56 5.149 12.947 -7.082 460 2HD LYS 56 2HD LYS 56 5.870 13.706 -5.676 461 1HE LYS 56 1HE LYS 56 7.849 14.049 -7.617 462 2HE LYS 56 2HE LYS 56 6.377 14.209 -8.553 463 1HZ LYS 56 1HZ LYS 56 7.391 15.901 -6.466 464 2HZ LYS 56 2HZ LYS 56 6.494 16.284 -7.776 465 3HZ LYS 56 3HZ LYS 56 5.775 15.670 -6.445 466 H ILE 57 H ILE 57 9.623 9.321 -5.221 467 HA ILE 57 HA ILE 57 9.554 9.395 -2.320 468 HB ILE 57 HB ILE 57 11.211 7.215 -2.945 469 1HG1 ILE 57 1HG1 ILE 57 8.464 6.817 -4.160 470 2HG1 ILE 57 2HG1 ILE 57 9.918 7.096 -5.098 471 1HG2 ILE 57 1HG2 ILE 57 8.523 6.694 -1.809 472 2HG2 ILE 57 2HG2 ILE 57 10.139 6.269 -1.197 473 3HG2 ILE 57 3HG2 ILE 57 9.511 7.920 -0.979 474 1HD1 ILE 57 1HD1 ILE 57 10.339 4.875 -5.002 475 2HD1 ILE 57 2HD1 ILE 57 10.598 5.044 -3.249 476 3HD1 ILE 57 3HD1 ILE 57 8.984 4.631 -3.874 477 HA PRO 58 HA PRO 58 13.412 11.242 -2.901 478 1HB PRO 58 1HB PRO 58 14.867 10.479 -0.717 479 2HB PRO 58 2HB PRO 58 13.646 11.736 -0.664 480 1HG PRO 58 1HG PRO 58 13.498 8.963 0.352 481 2HG PRO 58 2HG PRO 58 12.488 10.337 0.758 482 1HD PRO 58 1HD PRO 58 11.803 8.156 -0.975 483 2HD PRO 58 2HD PRO 58 10.841 9.586 -0.660 484 H GLY 59 H GLY 59 14.971 11.020 -4.371 485 1HA GLY 59 1HA GLY 59 16.509 9.977 -5.632 486 2HA GLY 59 2HA GLY 59 16.970 9.105 -4.184 487 H MET 60 H MET 60 15.771 8.778 -7.332 488 HA MET 60 HA MET 60 15.123 7.053 -8.491 489 1HB MET 60 1HB MET 60 16.625 5.874 -6.543 490 2HB MET 60 2HB MET 60 15.079 5.158 -6.133 491 1HG MET 60 1HG MET 60 16.227 5.096 -8.962 492 2HG MET 60 2HG MET 60 16.521 3.825 -7.792 493 1HE MET 60 1HE MET 60 13.128 3.366 -6.437 494 2HE MET 60 2HE MET 60 13.692 1.895 -7.266 495 3HE MET 60 3HE MET 60 14.851 2.921 -6.387 496 H ASP 61 H ASP 61 13.027 7.148 -9.166 497 HA ASP 61 HA ASP 61 10.928 7.560 -7.422 498 1HB ASP 61 1HB ASP 61 9.625 6.609 -9.588 499 2HB ASP 61 2HB ASP 61 10.333 8.212 -9.552 500 H GLY 62 H GLY 62 8.834 5.883 -7.834 501 1HA GLY 62 1HA GLY 62 9.732 3.366 -6.669 502 2HA GLY 62 2HA GLY 62 8.094 3.984 -6.753 503 H ILE 63 H ILE 63 8.958 4.669 -9.784 504 HA ILE 63 HA ILE 63 7.499 2.761 -11.027 505 HB ILE 63 HB ILE 63 9.883 4.313 -12.032 506 1HG1 ILE 63 1HG1 ILE 63 7.147 5.021 -12.879 507 2HG1 ILE 63 2HG1 ILE 63 7.449 5.238 -11.167 508 1HG2 ILE 63 1HG2 ILE 63 7.833 2.712 -13.586 509 2HG2 ILE 63 2HG2 ILE 63 8.965 3.886 -14.299 510 3HG2 ILE 63 3HG2 ILE 63 9.587 2.424 -13.496 511 1HD1 ILE 63 1HD1 ILE 63 8.422 6.819 -13.419 512 2HD1 ILE 63 2HD1 ILE 63 8.480 7.189 -11.679 513 3HD1 ILE 63 3HD1 ILE 63 9.779 6.231 -12.429 514 H GLU 64 H GLU 64 10.907 2.584 -9.963 515 HA GLU 64 HA GLU 64 11.197 0.036 -11.258 516 1HB GLU 64 1HB GLU 64 13.047 1.808 -9.626 517 2HB GLU 64 2HB GLU 64 13.507 0.173 -10.059 518 1HG GLU 64 1HG GLU 64 12.499 2.074 -12.199 519 2HG GLU 64 2HG GLU 64 14.161 2.179 -11.653 520 H ILE 65 H ILE 65 11.215 1.400 -7.894 521 HA ILE 65 HA ILE 65 11.625 -0.866 -6.467 522 HB ILE 65 HB ILE 65 10.186 1.680 -6.033 523 1HG1 ILE 65 1HG1 ILE 65 12.576 1.517 -5.639 524 2HG1 ILE 65 2HG1 ILE 65 11.731 1.823 -4.135 525 1HG2 ILE 65 1HG2 ILE 65 9.681 -0.784 -4.370 526 2HG2 ILE 65 2HG2 ILE 65 9.577 0.855 -3.682 527 3HG2 ILE 65 3HG2 ILE 65 8.514 0.386 -5.031 528 1HD1 ILE 65 1HD1 ILE 65 12.772 0.011 -3.265 529 2HD1 ILE 65 2HD1 ILE 65 11.805 -1.002 -4.363 530 3HD1 ILE 65 3HD1 ILE 65 13.418 -0.439 -4.861 531 H LEU 66 H LEU 66 8.326 0.400 -7.340 532 HA LEU 66 HA LEU 66 6.930 -1.810 -6.508 533 1HB LEU 66 1HB LEU 66 6.430 0.277 -8.609 534 2HB LEU 66 2HB LEU 66 5.284 -1.022 -8.342 535 HG LEU 66 HG LEU 66 4.423 0.695 -7.055 536 1HD1 LEU 66 1HD1 LEU 66 6.084 -0.376 -4.825 537 2HD1 LEU 66 2HD1 LEU 66 4.320 -0.177 -4.957 538 3HD1 LEU 66 3HD1 LEU 66 5.127 -1.534 -5.779 539 1HD2 LEU 66 1HD2 LEU 66 5.538 2.445 -6.134 540 2HD2 LEU 66 2HD2 LEU 66 6.917 1.446 -5.615 541 3HD2 LEU 66 3HD2 LEU 66 6.769 1.945 -7.317 542 H LYS 67 H LYS 67 8.682 -1.216 -9.583 543 HA LYS 67 HA LYS 67 7.696 -3.462 -10.929 544 1HB LYS 67 1HB LYS 67 9.539 -1.338 -11.397 545 2HB LYS 67 2HB LYS 67 10.369 -2.838 -11.758 546 1HG LYS 67 1HG LYS 67 7.891 -3.311 -12.901 547 2HG LYS 67 2HG LYS 67 8.048 -1.581 -13.135 548 1HD LYS 67 1HD LYS 67 10.581 -2.873 -13.763 549 2HD LYS 67 2HD LYS 67 9.291 -3.665 -14.645 550 1HE LYS 67 1HE LYS 67 8.612 -1.623 -15.717 551 2HE LYS 67 2HE LYS 67 9.508 -0.631 -14.584 552 1HZ LYS 67 1HZ LYS 67 11.434 -2.146 -15.588 553 2HZ LYS 67 2HZ LYS 67 10.450 -2.048 -16.888 554 3HZ LYS 67 3HZ LYS 67 11.025 -0.686 -16.194 555 H ARG 68 H ARG 68 10.933 -3.001 -9.331 556 HA ARG 68 HA ARG 68 11.645 -5.630 -9.515 557 1HB ARG 68 1HB ARG 68 12.469 -3.279 -7.848 558 2HB ARG 68 2HB ARG 68 12.948 -4.844 -7.221 559 1HG ARG 68 1HG ARG 68 14.118 -5.401 -9.294 560 2HG ARG 68 2HG ARG 68 13.473 -3.986 -10.102 561 1HD ARG 68 1HD ARG 68 14.786 -3.107 -7.679 562 2HD ARG 68 2HD ARG 68 15.875 -4.190 -8.523 563 HE ARG 68 HE ARG 68 14.590 -2.187 -10.254 564 1HH1 ARG 68 1HH1 ARG 68 17.364 -2.933 -8.221 565 2HH1 ARG 68 2HH1 ARG 68 18.393 -1.761 -8.975 566 1HH2 ARG 68 1HH2 ARG 68 15.947 -0.641 -11.249 567 2HH2 ARG 68 2HH2 ARG 68 17.581 -0.448 -10.709 568 H MET 69 H MET 69 9.538 -3.936 -7.205 569 HA MET 69 HA MET 69 9.622 -5.795 -5.154 570 1HB MET 69 1HB MET 69 7.977 -3.493 -6.024 571 2HB MET 69 2HB MET 69 7.004 -4.700 -5.208 572 1HG MET 69 1HG MET 69 9.295 -4.541 -3.593 573 2HG MET 69 2HG MET 69 9.051 -2.880 -4.095 574 1HE MET 69 1HE MET 69 7.346 -1.571 -3.895 575 2HE MET 69 2HE MET 69 5.660 -2.092 -3.668 576 3HE MET 69 3HE MET 69 6.585 -1.448 -2.290 577 H LYS 70 H LYS 70 7.329 -5.447 -7.949 578 HA LYS 70 HA LYS 70 5.895 -7.796 -7.232 579 1HB LYS 70 1HB LYS 70 4.485 -7.245 -8.947 580 2HB LYS 70 2HB LYS 70 5.184 -5.674 -8.614 581 1HG LYS 70 1HG LYS 70 5.309 -5.927 -10.993 582 2HG LYS 70 2HG LYS 70 6.942 -6.189 -10.415 583 1HD LYS 70 1HD LYS 70 6.971 -8.309 -11.228 584 2HD LYS 70 2HD LYS 70 5.487 -8.713 -10.388 585 1HE LYS 70 1HE LYS 70 4.152 -8.276 -12.232 586 2HE LYS 70 2HE LYS 70 5.163 -6.959 -12.792 587 1HZ LYS 70 1HZ LYS 70 5.899 -8.427 -14.252 588 2HZ LYS 70 2HZ LYS 70 6.747 -9.121 -13.042 589 3HZ LYS 70 3HZ LYS 70 5.283 -9.713 -13.458 590 H VAL 71 H VAL 71 8.519 -6.972 -9.562 591 HA VAL 71 HA VAL 71 8.582 -9.442 -10.847 592 HB VAL 71 HB VAL 71 10.869 -7.538 -10.315 593 1HG1 VAL 71 1HG1 VAL 71 11.792 -8.393 -12.406 594 2HG1 VAL 71 2HG1 VAL 71 11.523 -9.727 -11.258 595 3HG1 VAL 71 3HG1 VAL 71 10.391 -9.472 -12.608 596 1HG2 VAL 71 1HG2 VAL 71 8.453 -6.890 -11.509 597 2HG2 VAL 71 2HG2 VAL 71 9.997 -6.033 -11.730 598 3HG2 VAL 71 3HG2 VAL 71 9.501 -7.287 -12.892 599 H ILE 72 H ILE 72 9.740 -8.362 -7.680 600 HA ILE 72 HA ILE 72 11.495 -10.590 -7.330 601 HB ILE 72 HB ILE 72 10.555 -8.270 -5.727 602 1HG1 ILE 72 1HG1 ILE 72 12.584 -8.226 -7.187 603 2HG1 ILE 72 2HG1 ILE 72 12.885 -7.818 -5.510 604 1HG2 ILE 72 1HG2 ILE 72 10.284 -9.568 -3.904 605 2HG2 ILE 72 2HG2 ILE 72 11.232 -10.914 -4.580 606 3HG2 ILE 72 3HG2 ILE 72 12.062 -9.513 -3.862 607 1HD1 ILE 72 1HD1 ILE 72 13.912 -10.073 -7.095 608 2HD1 ILE 72 2HD1 ILE 72 14.520 -9.395 -5.565 609 3HD1 ILE 72 3HD1 ILE 72 13.210 -10.600 -5.546 610 H ASP 73 H ASP 73 8.112 -9.731 -6.474 611 HA ASP 73 HA ASP 73 7.641 -12.537 -6.076 612 1HB ASP 73 1HB ASP 73 6.178 -11.306 -3.982 613 2HB ASP 73 2HB ASP 73 7.523 -12.417 -3.817 614 H GLU 74 H GLU 74 5.778 -12.928 -7.281 615 HA GLU 74 HA GLU 74 4.209 -10.714 -8.117 616 1HB GLU 74 1HB GLU 74 3.191 -12.224 -9.627 617 2HB GLU 74 2HB GLU 74 4.830 -12.826 -9.477 618 1HG GLU 74 1HG GLU 74 4.037 -14.458 -7.721 619 2HG GLU 74 2HG GLU 74 2.397 -13.889 -7.964 620 H ASN 75 H ASN 75 4.171 -12.970 -5.470 621 HA ASN 75 HA ASN 75 1.363 -12.919 -5.102 622 1HB ASN 75 1HB ASN 75 2.119 -13.823 -2.742 623 2HB ASN 75 2HB ASN 75 2.401 -14.828 -4.150 624 1HD2 ASN 75 1HD2 ASN 75 4.312 -15.699 -4.265 625 2HD2 ASN 75 2HD2 ASN 75 5.802 -15.067 -3.648 626 H ILE 76 H ILE 76 4.006 -10.766 -4.532 627 HA ILE 76 HA ILE 76 3.354 -9.624 -2.092 628 HB ILE 76 HB ILE 76 5.431 -9.341 -3.494 629 1HG1 ILE 76 1HG1 ILE 76 4.020 -7.197 -1.967 630 2HG1 ILE 76 2HG1 ILE 76 5.483 -8.079 -1.577 631 1HG2 ILE 76 1HG2 ILE 76 4.131 -6.976 -4.782 632 2HG2 ILE 76 2HG2 ILE 76 5.547 -7.927 -5.291 633 3HG2 ILE 76 3HG2 ILE 76 3.907 -8.585 -5.510 634 1HD1 ILE 76 1HD1 ILE 76 5.129 -5.689 -3.379 635 2HD1 ILE 76 2HD1 ILE 76 6.381 -6.006 -2.155 636 3HD1 ILE 76 3HD1 ILE 76 6.447 -6.831 -3.731 637 H ARG 77 H ARG 77 1.882 -8.096 -1.409 638 HA ARG 77 HA ARG 77 0.072 -7.170 -3.493 639 1HB ARG 77 1HB ARG 77 -1.393 -8.512 -2.288 640 2HB ARG 77 2HB ARG 77 -0.444 -8.414 -0.818 641 1HG ARG 77 1HG ARG 77 -1.265 -6.125 -0.386 642 2HG ARG 77 2HG ARG 77 -2.117 -6.106 -1.917 643 1HD ARG 77 1HD ARG 77 -3.509 -6.660 0.205 644 2HD ARG 77 2HD ARG 77 -3.734 -7.698 -1.188 645 HE ARG 77 HE ARG 77 -1.642 -8.606 0.674 646 1HH1 ARG 77 1HH1 ARG 77 -5.043 -8.783 -0.209 647 2HH1 ARG 77 2HH1 ARG 77 -5.305 -10.294 0.596 648 1HH2 ARG 77 1HH2 ARG 77 -1.987 -10.599 1.737 649 2HH2 ARG 77 2HH2 ARG 77 -3.555 -11.334 1.711 650 H VAL 78 H VAL 78 0.399 -4.984 -3.783 651 HA VAL 78 HA VAL 78 0.505 -3.321 -1.398 652 HB VAL 78 HB VAL 78 2.833 -4.045 -2.573 653 1HG1 VAL 78 1HG1 VAL 78 3.648 -2.353 -4.050 654 2HG1 VAL 78 2HG1 VAL 78 2.088 -2.908 -4.704 655 3HG1 VAL 78 3HG1 VAL 78 2.186 -1.362 -3.828 656 1HG2 VAL 78 1HG2 VAL 78 1.902 -1.983 -0.768 657 2HG2 VAL 78 2HG2 VAL 78 3.434 -2.889 -0.761 658 3HG2 VAL 78 3HG2 VAL 78 3.286 -1.399 -1.723 659 H ILE 79 H ILE 79 -0.041 -1.051 -1.874 660 HA ILE 79 HA ILE 79 -1.618 -0.894 -4.345 661 HB ILE 79 HB ILE 79 -2.157 -0.223 -1.562 662 1HG1 ILE 79 1HG1 ILE 79 -3.417 -1.772 -3.162 663 2HG1 ILE 79 2HG1 ILE 79 -4.365 -0.700 -2.151 664 1HG2 ILE 79 1HG2 ILE 79 -3.615 1.791 -2.375 665 2HG2 ILE 79 2HG2 ILE 79 -1.904 2.033 -1.948 666 3HG2 ILE 79 3HG2 ILE 79 -2.386 1.910 -3.657 667 1HD1 ILE 79 1HD1 ILE 79 -5.326 0.179 -3.999 668 2HD1 ILE 79 2HD1 ILE 79 -3.732 0.755 -4.543 669 3HD1 ILE 79 3HD1 ILE 79 -4.309 -0.857 -5.029 670 H ILE 80 H ILE 80 -1.379 0.886 -5.718 671 HA ILE 80 HA ILE 80 0.940 2.565 -5.065 672 HB ILE 80 HB ILE 80 1.461 2.671 -7.341 673 1HG1 ILE 80 1HG1 ILE 80 -0.057 1.517 -9.066 674 2HG1 ILE 80 2HG1 ILE 80 -1.310 1.577 -7.842 675 1HG2 ILE 80 1HG2 ILE 80 1.390 0.251 -5.991 676 2HG2 ILE 80 2HG2 ILE 80 0.701 -0.133 -7.586 677 3HG2 ILE 80 3HG2 ILE 80 2.311 0.617 -7.469 678 1HD1 ILE 80 1HD1 ILE 80 -0.718 3.619 -9.628 679 2HD1 ILE 80 2HD1 ILE 80 -1.631 3.818 -8.112 680 3HD1 ILE 80 3HD1 ILE 80 0.117 4.150 -8.148 681 H MET 81 H MET 81 0.836 4.839 -5.685 682 HA MET 81 HA MET 81 -1.844 5.782 -6.238 683 1HB MET 81 1HB MET 81 -0.739 7.580 -4.301 684 2HB MET 81 2HB MET 81 -2.120 6.523 -4.083 685 1HG MET 81 1HG MET 81 -0.751 4.739 -3.200 686 2HG MET 81 2HG MET 81 0.730 5.499 -3.745 687 1HE MET 81 1HE MET 81 0.828 4.461 -1.246 688 2HE MET 81 2HE MET 81 2.021 5.779 -1.167 689 3HE MET 81 3HE MET 81 0.832 5.576 0.142 690 H THR 82 H THR 82 -1.863 7.544 -7.621 691 HA THR 82 HA THR 82 0.093 9.513 -7.735 692 HB THR 82 HB THR 82 1.729 7.978 -8.541 693 HG1 THR 82 HG1 THR 82 1.812 9.473 -10.188 694 1HG2 THR 82 1HG2 THR 82 0.669 5.924 -9.036 695 2HG2 THR 82 2HG2 THR 82 -0.632 6.711 -9.961 696 3HG2 THR 82 3HG2 THR 82 0.992 6.549 -10.671 697 H ALA 83 H ALA 83 -0.402 11.144 -9.256 698 HA ALA 83 HA ALA 83 -3.083 11.375 -9.861 699 1HB ALA 83 1HB ALA 83 -1.044 13.076 -9.769 700 2HB ALA 83 2HB ALA 83 -1.006 12.777 -11.523 701 3HB ALA 83 3HB ALA 83 -2.480 13.423 -10.762 702 H TYR 84 H TYR 84 -4.155 11.482 -12.014 703 HA TYR 84 HA TYR 84 -3.436 9.149 -13.545 704 1HB TYR 84 1HB TYR 84 -5.602 9.897 -14.725 705 2HB TYR 84 2HB TYR 84 -5.793 9.662 -13.000 706 HD1 TYR 84 HD1 TYR 84 -6.232 11.531 -11.514 707 HD2 TYR 84 HD2 TYR 84 -5.564 12.176 -15.690 708 HE1 TYR 84 HE1 TYR 84 -7.117 13.904 -11.296 709 HE2 TYR 84 HE2 TYR 84 -6.452 14.547 -15.459 710 HH TYR 84 HH TYR 84 -8.261 15.607 -13.491 711 H GLY 85 H GLY 85 -1.409 11.183 -13.674 712 1HA GLY 85 1HA GLY 85 -1.806 12.403 -16.320 713 2HA GLY 85 2HA GLY 85 -0.591 12.833 -15.132 714 H GLU 86 H GLU 86 0.289 10.136 -14.446 715 HA GLU 86 HA GLU 86 1.693 9.572 -16.930 716 1HB GLU 86 1HB GLU 86 3.323 8.369 -15.353 717 2HB GLU 86 2HB GLU 86 3.256 10.115 -15.216 718 1HG GLU 86 1HG GLU 86 1.949 10.027 -13.205 719 2HG GLU 86 2HG GLU 86 1.510 8.349 -13.460 720 H LEU 87 H LEU 87 -0.770 8.562 -17.136 721 HA LEU 87 HA LEU 87 -1.501 6.268 -15.908 722 1HB LEU 87 1HB LEU 87 -1.747 6.886 -18.855 723 2HB LEU 87 2HB LEU 87 -2.699 5.714 -17.966 724 HG LEU 87 HG LEU 87 -2.758 8.482 -16.901 725 1HD1 LEU 87 1HD1 LEU 87 -2.846 8.421 -19.577 726 2HD1 LEU 87 2HD1 LEU 87 -4.551 8.046 -19.232 727 3HD1 LEU 87 3HD1 LEU 87 -3.822 9.542 -18.598 728 1HD2 LEU 87 1HD2 LEU 87 -4.607 6.148 -17.182 729 2HD2 LEU 87 2HD2 LEU 87 -4.207 7.131 -15.753 730 3HD2 LEU 87 3HD2 LEU 87 -5.298 7.779 -17.001 731 H ASP 88 H ASP 88 1.021 6.711 -18.417 732 HA ASP 88 HA ASP 88 1.454 4.203 -19.207 733 1HB ASP 88 1HB ASP 88 3.194 6.575 -18.683 734 2HB ASP 88 2HB ASP 88 4.051 5.052 -18.818 735 H MET 89 H MET 89 2.749 5.809 -16.208 736 HA MET 89 HA MET 89 4.122 3.552 -15.312 737 1HB MET 89 1HB MET 89 4.315 6.072 -14.621 738 2HB MET 89 2HB MET 89 2.945 5.776 -13.569 739 1HG MET 89 1HG MET 89 5.492 4.095 -13.464 740 2HG MET 89 2HG MET 89 5.266 5.531 -12.485 741 1HE MET 89 1HE MET 89 5.546 2.383 -10.955 742 2HE MET 89 2HE MET 89 5.877 4.111 -10.680 743 3HE MET 89 3HE MET 89 4.697 3.256 -9.657 744 H ILE 90 H ILE 90 0.961 5.011 -14.248 745 HA ILE 90 HA ILE 90 0.300 3.142 -12.364 746 HB ILE 90 HB ILE 90 -1.498 4.649 -14.266 747 1HG1 ILE 90 1HG1 ILE 90 -1.383 5.685 -11.578 748 2HG1 ILE 90 2HG1 ILE 90 0.242 5.570 -12.226 749 1HG2 ILE 90 1HG2 ILE 90 -2.065 2.816 -12.015 750 2HG2 ILE 90 2HG2 ILE 90 -2.950 4.360 -12.001 751 3HG2 ILE 90 3HG2 ILE 90 -3.068 3.280 -13.411 752 1HD1 ILE 90 1HD1 ILE 90 -2.125 6.937 -13.587 753 2HD1 ILE 90 2HD1 ILE 90 -0.748 7.750 -12.806 754 3HD1 ILE 90 3HD1 ILE 90 -0.494 6.790 -14.283 755 H GLN 91 H GLN 91 -0.391 3.075 -15.922 756 HA GLN 91 HA GLN 91 -1.825 0.794 -16.007 757 1HB GLN 91 1HB GLN 91 -0.079 2.288 -17.875 758 2HB GLN 91 2HB GLN 91 -0.249 0.594 -18.289 759 1HG GLN 91 1HG GLN 91 -2.833 1.747 -17.506 760 2HG GLN 91 2HG GLN 91 -2.108 2.663 -18.813 761 1HE2 GLN 91 1HE2 GLN 91 -2.000 1.849 -20.818 762 2HE2 GLN 91 2HE2 GLN 91 -2.602 0.301 -21.308 763 H GLU 92 H GLU 92 1.793 1.082 -16.190 764 HA GLU 92 HA GLU 92 2.232 -1.646 -16.354 765 1HB GLU 92 1HB GLU 92 3.784 0.732 -16.272 766 2HB GLU 92 2HB GLU 92 4.391 -0.265 -14.965 767 1HG GLU 92 1HG GLU 92 5.194 -1.900 -16.389 768 2HG GLU 92 2HG GLU 92 3.875 -1.714 -17.527 769 H SER 93 H SER 93 1.580 0.520 -13.617 770 HA SER 93 HA SER 93 2.580 -1.114 -11.614 771 1HB SER 93 1HB SER 93 1.657 0.431 -10.163 772 2HB SER 93 2HB SER 93 1.628 1.380 -11.636 773 HG SER 93 HG SER 93 -0.557 -0.074 -10.425 774 H LYS 94 H LYS 94 -0.611 -0.942 -13.277 775 HA LYS 94 HA LYS 94 -1.888 -2.789 -11.564 776 1HB LYS 94 1HB LYS 94 -2.619 -1.064 -13.643 777 2HB LYS 94 2HB LYS 94 -2.971 -2.664 -14.264 778 1HG LYS 94 1HG LYS 94 -3.887 -2.820 -11.626 779 2HG LYS 94 2HG LYS 94 -4.278 -1.170 -12.068 780 1HD LYS 94 1HD LYS 94 -5.100 -2.480 -14.338 781 2HD LYS 94 2HD LYS 94 -5.371 -3.736 -13.147 782 1HE LYS 94 1HE LYS 94 -6.934 -2.430 -11.924 783 2HE LYS 94 2HE LYS 94 -6.340 -0.919 -12.583 784 1HZ LYS 94 1HZ LYS 94 -7.174 -2.435 -14.718 785 2HZ LYS 94 2HZ LYS 94 -8.346 -2.579 -13.589 786 3HZ LYS 94 3HZ LYS 94 -7.893 -1.099 -14.111 787 H GLU 95 H GLU 95 -0.177 -3.060 -14.735 788 HA GLU 95 HA GLU 95 -0.671 -5.835 -14.883 789 1HB GLU 95 1HB GLU 95 0.434 -5.743 -16.938 790 2HB GLU 95 2HB GLU 95 -0.126 -4.091 -16.777 791 1HG GLU 95 1HG GLU 95 2.040 -3.470 -17.091 792 2HG GLU 95 2HG GLU 95 2.321 -4.007 -15.447 793 H LEU 96 H LEU 96 1.470 -3.894 -13.032 794 HA LEU 96 HA LEU 96 3.695 -5.662 -13.007 795 1HB LEU 96 1HB LEU 96 2.929 -3.109 -11.875 796 2HB LEU 96 2HB LEU 96 3.715 -4.116 -10.675 797 HG LEU 96 HG LEU 96 5.693 -4.329 -12.027 798 1HD1 LEU 96 1HD1 LEU 96 4.845 -2.498 -14.184 799 2HD1 LEU 96 2HD1 LEU 96 5.863 -3.958 -14.238 800 3HD1 LEU 96 3HD1 LEU 96 4.090 -4.110 -14.204 801 1HD2 LEU 96 1HD2 LEU 96 5.884 -2.417 -10.737 802 2HD2 LEU 96 2HD2 LEU 96 6.216 -1.806 -12.375 803 3HD2 LEU 96 3HD2 LEU 96 4.616 -1.551 -11.637 804 H GLY 97 H GLY 97 0.523 -5.696 -11.612 805 1HA GLY 97 1HA GLY 97 -0.207 -7.757 -10.649 806 2HA GLY 97 2HA GLY 97 1.355 -7.933 -9.873 807 H ALA 98 H ALA 98 -0.224 -4.751 -10.043 808 HA ALA 98 HA ALA 98 -0.335 -4.719 -7.150 809 1HB ALA 98 1HB ALA 98 -0.504 -2.368 -7.386 810 2HB ALA 98 2HB ALA 98 0.594 -2.869 -8.695 811 3HB ALA 98 3HB ALA 98 -1.108 -2.492 -9.056 812 H LEU 99 H LEU 99 -2.257 -4.304 -5.932 813 HA LEU 99 HA LEU 99 -4.506 -5.662 -6.837 814 1HB LEU 99 1HB LEU 99 -4.573 -3.562 -4.691 815 2HB LEU 99 2HB LEU 99 -5.506 -5.039 -4.816 816 HG LEU 99 HG LEU 99 -4.058 -5.767 -3.255 817 1HD1 LEU 99 1HD1 LEU 99 -3.482 -6.852 -5.601 818 2HD1 LEU 99 2HD1 LEU 99 -1.905 -6.083 -5.300 819 3HD1 LEU 99 3HD1 LEU 99 -2.562 -7.253 -4.131 820 1HD2 LEU 99 1HD2 LEU 99 -2.613 -3.366 -3.994 821 2HD2 LEU 99 2HD2 LEU 99 -2.715 -4.204 -2.427 822 3HD2 LEU 99 3HD2 LEU 99 -1.501 -4.706 -3.628 823 H THR 100 H THR 100 -3.866 -2.100 -6.565 824 HA THR 100 HA THR 100 -5.363 -1.584 -8.923 825 HB THR 100 HB THR 100 -7.239 -2.039 -7.320 826 HG1 THR 100 HG1 THR 100 -7.842 -0.414 -8.738 827 1HG2 THR 100 1HG2 THR 100 -6.198 -1.319 -5.183 828 2HG2 THR 100 2HG2 THR 100 -6.004 0.332 -5.820 829 3HG2 THR 100 3HG2 THR 100 -7.633 -0.320 -5.519 830 H HIS 101 H HIS 101 -5.539 0.840 -9.315 831 HA HIS 101 HA HIS 101 -3.257 2.120 -7.994 832 1HB HIS 101 1HB HIS 101 -3.171 3.409 -10.266 833 2HB HIS 101 2HB HIS 101 -2.426 1.830 -10.107 834 HD1 HIS 101 HD1 HIS 101 -2.687 1.025 -12.504 835 HD2 HIS 101 HD2 HIS 101 -6.300 2.315 -10.807 836 HE1 HIS 101 HE1 HIS 101 -4.524 0.374 -14.152 837 H PHE 102 H PHE 102 -3.638 4.069 -7.022 838 HA PHE 102 HA PHE 102 -6.330 5.157 -7.399 839 1HB PHE 102 1HB PHE 102 -4.182 5.462 -5.214 840 2HB PHE 102 2HB PHE 102 -5.752 6.239 -5.149 841 HD1 PHE 102 HD1 PHE 102 -4.618 4.375 -3.066 842 HD2 PHE 102 HD2 PHE 102 -7.101 3.648 -6.430 843 HE1 PHE 102 HE1 PHE 102 -5.572 2.353 -1.925 844 HE2 PHE 102 HE2 PHE 102 -8.055 1.626 -5.289 845 HZ PHE 102 HZ PHE 102 -7.279 1.003 -3.050 846 H ALA 103 H ALA 103 -6.577 7.539 -7.393 847 HA ALA 103 HA ALA 103 -4.260 8.783 -8.694 848 1HB ALA 103 1HB ALA 103 -5.882 10.265 -9.738 849 2HB ALA 103 2HB ALA 103 -6.404 8.580 -9.979 850 3HB ALA 103 3HB ALA 103 -7.195 9.589 -8.745 851 H LYS 104 H LYS 104 -3.533 10.854 -8.006 852 HA LYS 104 HA LYS 104 -3.083 11.418 -5.536 853 1HB LYS 104 1HB LYS 104 -3.479 13.048 -7.899 854 2HB LYS 104 2HB LYS 104 -3.935 13.940 -6.461 855 1HG LYS 104 1HG LYS 104 -1.746 13.375 -5.403 856 2HG LYS 104 2HG LYS 104 -1.290 12.451 -6.821 857 1HD LYS 104 1HD LYS 104 -1.223 14.419 -8.215 858 2HD LYS 104 2HD LYS 104 -2.067 15.388 -7.023 859 1HE LYS 104 1HE LYS 104 -0.132 15.905 -5.941 860 2HE LYS 104 2HE LYS 104 0.353 14.223 -5.856 861 1HZ LYS 104 1HZ LYS 104 1.226 16.208 -7.633 862 2HZ LYS 104 2HZ LYS 104 1.827 14.708 -7.397 863 3HZ LYS 104 3HZ LYS 104 0.626 14.945 -8.478 864 HA PRO 105 HA PRO 105 -7.334 13.128 -4.472 865 1HB PRO 105 1HB PRO 105 -9.319 13.277 -6.344 866 2HB PRO 105 2HB PRO 105 -8.254 14.617 -5.968 867 1HG PRO 105 1HG PRO 105 -8.233 12.838 -8.329 868 2HG PRO 105 2HG PRO 105 -7.481 14.409 -8.132 869 1HD PRO 105 1HD PRO 105 -6.172 11.858 -8.056 870 2HD PRO 105 2HD PRO 105 -5.442 13.420 -7.744 871 H PHE 106 H PHE 106 -7.150 11.163 -3.288 872 HA PHE 106 HA PHE 106 -9.167 9.255 -4.245 873 1HB PHE 106 1HB PHE 106 -7.528 7.790 -2.607 874 2HB PHE 106 2HB PHE 106 -7.207 7.962 -4.322 875 HD1 PHE 106 HD1 PHE 106 -4.980 8.284 -4.770 876 HD2 PHE 106 HD2 PHE 106 -6.626 10.106 -1.309 877 HE1 PHE 106 HE1 PHE 106 -2.749 9.311 -4.250 878 HE2 PHE 106 HE2 PHE 106 -4.395 11.132 -0.789 879 HZ PHE 106 HZ PHE 106 -2.483 10.722 -2.265 880 H ASP 107 H ASP 107 -10.368 8.099 -2.553 881 HA ASP 107 HA ASP 107 -10.454 9.699 -0.119 882 1HB ASP 107 1HB ASP 107 -12.487 9.236 -1.917 883 2HB ASP 107 2HB ASP 107 -12.743 7.902 -0.809 884 H ILE 108 H ILE 108 -10.557 8.526 1.915 885 HA ILE 108 HA ILE 108 -9.370 5.945 1.835 886 HB ILE 108 HB ILE 108 -9.704 8.059 3.683 887 1HG1 ILE 108 1HG1 ILE 108 -7.602 6.958 3.190 888 2HG1 ILE 108 2HG1 ILE 108 -7.943 6.865 4.906 889 1HG2 ILE 108 1HG2 ILE 108 -10.579 5.421 4.885 890 2HG2 ILE 108 2HG2 ILE 108 -10.409 6.993 5.702 891 3HG2 ILE 108 3HG2 ILE 108 -11.686 6.756 4.486 892 1HD1 ILE 108 1HD1 ILE 108 -9.154 4.555 3.764 893 2HD1 ILE 108 2HD1 ILE 108 -7.548 4.700 3.011 894 3HD1 ILE 108 3HD1 ILE 108 -7.696 4.619 4.783 895 H ASP 109 H ASP 109 -12.661 7.249 2.100 896 HA ASP 109 HA ASP 109 -13.832 4.976 3.174 897 1HB ASP 109 1HB ASP 109 -15.076 6.959 1.213 898 2HB ASP 109 2HB ASP 109 -15.947 5.932 2.335 899 H GLU 110 H GLU 110 -13.102 6.088 -0.182 900 HA GLU 110 HA GLU 110 -14.500 3.981 -1.417 901 1HB GLU 110 1HB GLU 110 -13.536 4.814 -3.479 902 2HB GLU 110 2HB GLU 110 -13.964 6.195 -2.489 903 1HG GLU 110 1HG GLU 110 -11.768 6.818 -2.156 904 2HG GLU 110 2HG GLU 110 -11.201 5.164 -2.048 905 H ILE 111 H ILE 111 -11.347 4.323 0.077 906 HA ILE 111 HA ILE 111 -10.115 2.195 -1.372 907 HB ILE 111 HB ILE 111 -9.427 4.063 0.798 908 1HG1 ILE 111 1HG1 ILE 111 -7.691 2.862 -1.368 909 2HG1 ILE 111 2HG1 ILE 111 -8.788 4.195 -1.669 910 1HG2 ILE 111 1HG2 ILE 111 -7.462 2.705 1.503 911 2HG2 ILE 111 2HG2 ILE 111 -9.027 2.043 2.032 912 3HG2 ILE 111 3HG2 ILE 111 -8.172 1.311 0.654 913 1HD1 ILE 111 1HD1 ILE 111 -6.667 4.241 0.523 914 2HD1 ILE 111 2HD1 ILE 111 -6.416 4.899 -1.112 915 3HD1 ILE 111 3HD1 ILE 111 -7.653 5.609 -0.047 916 H ARG 112 H ARG 112 -12.043 2.564 1.610 917 HA ARG 112 HA ARG 112 -11.420 0.105 2.697 918 1HB ARG 112 1HB ARG 112 -13.920 1.850 2.900 919 2HB ARG 112 2HB ARG 112 -13.709 0.402 3.865 920 1HG ARG 112 1HG ARG 112 -11.458 1.412 4.643 921 2HG ARG 112 2HG ARG 112 -11.974 2.909 3.893 922 1HD ARG 112 1HD ARG 112 -12.990 3.372 5.884 923 2HD ARG 112 2HD ARG 112 -14.220 2.227 5.387 924 HE ARG 112 HE ARG 112 -12.074 0.748 6.549 925 1HH1 ARG 112 1HH1 ARG 112 -14.561 3.045 7.509 926 2HH1 ARG 112 2HH1 ARG 112 -14.660 2.455 9.134 927 1HH2 ARG 112 1HH2 ARG 112 -12.204 -0.031 8.693 928 2HH2 ARG 112 2HH2 ARG 112 -13.309 0.693 9.812 929 H ASP 113 H ASP 113 -13.292 0.992 -0.100 930 HA ASP 113 HA ASP 113 -15.057 -1.209 -0.025 931 1HB ASP 113 1HB ASP 113 -14.714 1.150 -1.564 932 2HB ASP 113 2HB ASP 113 -14.496 -0.159 -2.707 933 H ALA 114 H ALA 114 -11.960 -0.341 -1.697 934 HA ALA 114 HA ALA 114 -11.831 -2.825 -3.109 935 1HB ALA 114 1HB ALA 114 -10.171 -0.348 -2.794 936 2HB ALA 114 2HB ALA 114 -9.361 -1.826 -3.368 937 3HB ALA 114 3HB ALA 114 -10.741 -1.159 -4.272 938 H VAL 115 H VAL 115 -11.010 -1.649 0.083 939 HA VAL 115 HA VAL 115 -9.018 -3.684 0.528 940 HB VAL 115 HB VAL 115 -10.216 -1.409 2.045 941 1HG1 VAL 115 1HG1 VAL 115 -8.592 -2.386 3.954 942 2HG1 VAL 115 2HG1 VAL 115 -10.335 -2.739 3.888 943 3HG1 VAL 115 3HG1 VAL 115 -9.164 -3.919 3.253 944 1HG2 VAL 115 1HG2 VAL 115 -8.283 -0.866 0.781 945 2HG2 VAL 115 2HG2 VAL 115 -7.739 -1.000 2.471 946 3HG2 VAL 115 3HG2 VAL 115 -7.421 -2.325 1.326 947 H LYS 116 H LYS 116 -12.490 -3.088 1.128 948 HA LYS 116 HA LYS 116 -12.729 -5.374 2.840 949 1HB LYS 116 1HB LYS 116 -14.970 -4.746 3.087 950 2HB LYS 116 2HB LYS 116 -14.109 -3.228 2.937 951 1HG LYS 116 1HG LYS 116 -15.460 -2.687 1.201 952 2HG LYS 116 2HG LYS 116 -14.721 -3.974 0.270 953 1HD LYS 116 1HD LYS 116 -16.401 -5.563 1.499 954 2HD LYS 116 2HD LYS 116 -17.249 -4.100 1.958 955 1HE LYS 116 1HE LYS 116 -17.016 -3.553 -0.667 956 2HE LYS 116 2HE LYS 116 -16.874 -5.295 -0.788 957 1HZ LYS 116 1HZ LYS 116 -19.172 -3.835 -0.456 958 2HZ LYS 116 2HZ LYS 116 -19.029 -5.462 -0.466 959 3HZ LYS 116 3HZ LYS 116 -18.967 -4.645 0.947 960 H LYS 117 H LYS 117 -12.516 -4.795 -0.558 961 HA LYS 117 HA LYS 117 -14.030 -7.191 -1.202 962 1HB LYS 117 1HB LYS 117 -14.215 -6.363 -3.307 963 2HB LYS 117 2HB LYS 117 -13.950 -4.848 -2.468 964 1HG LYS 117 1HG LYS 117 -11.528 -4.945 -2.984 965 2HG LYS 117 2HG LYS 117 -11.726 -6.515 -3.738 966 1HD LYS 117 1HD LYS 117 -13.158 -5.558 -5.493 967 2HD LYS 117 2HD LYS 117 -13.171 -3.999 -4.692 968 1HE LYS 117 1HE LYS 117 -11.442 -3.536 -6.135 969 2HE LYS 117 2HE LYS 117 -10.473 -4.345 -4.920 970 1HZ LYS 117 1HZ LYS 117 -10.073 -5.971 -6.331 971 2HZ LYS 117 2HZ LYS 117 -11.654 -6.212 -6.664 972 3HZ LYS 117 3HZ LYS 117 -10.800 -5.108 -7.512 973 H TYR 118 H TYR 118 -10.697 -5.945 -0.952 974 HA TYR 118 HA TYR 118 -9.660 -8.442 -2.032 975 1HB TYR 118 1HB TYR 118 -8.911 -5.861 -2.341 976 2HB TYR 118 2HB TYR 118 -8.117 -6.108 -0.799 977 HD1 TYR 118 HD1 TYR 118 -6.848 -8.631 -0.847 978 HD2 TYR 118 HD2 TYR 118 -7.437 -5.940 -4.121 979 HE1 TYR 118 HE1 TYR 118 -4.846 -9.640 -2.046 980 HE2 TYR 118 HE2 TYR 118 -5.433 -6.957 -5.309 981 HH TYR 118 HH TYR 118 -3.493 -9.475 -3.735 982 H LEU 119 H LEU 119 -9.617 -6.463 1.000 983 HA LEU 119 HA LEU 119 -8.501 -8.808 2.362 984 1HB LEU 119 1HB LEU 119 -7.858 -6.044 2.423 985 2HB LEU 119 2HB LEU 119 -8.534 -6.454 3.987 986 HG LEU 119 HG LEU 119 -5.919 -6.724 3.306 987 1HD1 LEU 119 1HD1 LEU 119 -7.629 -7.448 5.479 988 2HD1 LEU 119 2HD1 LEU 119 -6.422 -8.735 5.248 989 3HD1 LEU 119 3HD1 LEU 119 -5.893 -7.054 5.497 990 1HD2 LEU 119 1HD2 LEU 119 -5.297 -8.914 2.793 991 2HD2 LEU 119 2HD2 LEU 119 -6.905 -9.568 3.186 992 3HD2 LEU 119 3HD2 LEU 119 -6.676 -8.597 1.712 993 HA PRO 120 HA PRO 120 -12.268 -9.319 4.405 994 1HB PRO 120 1HB PRO 120 -11.485 -10.710 6.623 995 2HB PRO 120 2HB PRO 120 -11.708 -11.456 5.054 996 1HG PRO 120 1HG PRO 120 -9.188 -10.780 6.443 997 2HG PRO 120 2HG PRO 120 -9.442 -11.884 5.106 998 1HD PRO 120 1HD PRO 120 -8.332 -9.243 4.963 999 2HD PRO 120 2HD PRO 120 -8.694 -10.302 3.615 1000 H LEU 121 H LEU 121 -11.747 -6.767 4.570 1001 HA LEU 121 HA LEU 121 -11.571 -6.104 7.388 1002 1HB LEU 121 1HB LEU 121 -10.923 -4.842 4.897 1003 2HB LEU 121 2HB LEU 121 -12.044 -3.822 5.777 1004 HG LEU 121 HG LEU 121 -10.242 -4.519 7.744 1005 1HD1 LEU 121 1HD1 LEU 121 -8.872 -4.601 5.095 1006 2HD1 LEU 121 2HD1 LEU 121 -8.042 -3.797 6.448 1007 3HD1 LEU 121 3HD1 LEU 121 -8.537 -5.501 6.594 1008 1HD2 LEU 121 1HD2 LEU 121 -9.397 -2.214 7.494 1009 2HD2 LEU 121 2HD2 LEU 121 -10.221 -2.099 5.920 1010 3HD2 LEU 121 3HD2 LEU 121 -11.172 -2.308 7.410 1011 H LYS 122 H LYS 122 -13.192 -4.296 8.127 1012 HA LYS 122 HA LYS 122 -15.673 -5.412 8.328 1013 1HB LYS 122 1HB LYS 122 -14.929 -3.727 9.859 1014 2HB LYS 122 2HB LYS 122 -14.767 -2.536 8.585 1015 1HG LYS 122 1HG LYS 122 -17.473 -3.769 8.775 1016 2HG LYS 122 2HG LYS 122 -17.005 -2.837 10.183 1017 1HD LYS 122 1HD LYS 122 -16.193 -1.231 8.010 1018 2HD LYS 122 2HD LYS 122 -17.725 -1.903 7.486 1019 1HE LYS 122 1HE LYS 122 -18.342 -1.220 10.085 1020 2HE LYS 122 2HE LYS 122 -17.155 0.012 9.706 1021 1HZ LYS 122 1HZ LYS 122 -18.597 1.007 8.388 1022 2HZ LYS 122 2HZ LYS 122 -18.974 -0.360 7.579 1023 3HZ LYS 122 3HZ LYS 122 -19.759 0.013 8.961 1024 H SER 123 H SER 123 -17.251 -5.829 6.887 1025 HA SER 123 HA SER 123 -17.077 -4.903 4.277 1026 1HB SER 123 1HB SER 123 -19.425 -6.122 5.796 1027 2HB SER 123 2HB SER 123 -19.394 -5.895 4.059 1028 HG SER 123 HG SER 123 -17.271 -7.332 5.362 1029 H ASN 124 H ASN 124 -17.276 -2.738 3.773 1030 HA ASN 124 HA ASN 124 -19.245 -1.218 5.246 1031 1HB ASN 124 1HB ASN 124 -16.745 -0.497 4.699 1032 2HB ASN 124 2HB ASN 124 -17.384 -0.088 3.119 1033 1HD2 ASN 124 1HD2 ASN 124 -17.432 0.598 6.534 1034 2HD2 ASN 124 2HD2 ASN 124 -18.229 2.135 6.472 Start of MODEL 5 1 1H MET 1 1H MET 1 -3.033 -13.282 19.066 2 HA MET 1 HA MET 1 -2.967 -10.754 19.428 3 1HB MET 1 1HB MET 1 -0.645 -11.427 17.667 4 2HB MET 1 2HB MET 1 -1.619 -10.098 17.072 5 1HG MET 1 1HG MET 1 -0.317 -8.828 18.475 6 2HG MET 1 2HG MET 1 -1.426 -9.382 19.714 7 1HE MET 1 1HE MET 1 -0.459 -9.588 21.678 8 2HE MET 1 2HE MET 1 -0.659 -11.356 21.629 9 3HE MET 1 3HE MET 1 0.881 -10.649 22.175 10 H MET 2 H MET 2 -3.820 -9.324 17.420 11 HA MET 2 HA MET 2 -5.933 -10.864 16.348 12 1HB MET 2 1HB MET 2 -5.293 -8.101 16.823 13 2HB MET 2 2HB MET 2 -5.600 -8.233 15.103 14 1HG MET 2 1HG MET 2 -7.705 -7.744 16.294 15 2HG MET 2 2HG MET 2 -7.793 -9.335 15.565 16 1HE MET 2 1HE MET 2 -8.049 -11.238 16.410 17 2HE MET 2 2HE MET 2 -7.910 -11.826 18.084 18 3HE MET 2 3HE MET 2 -9.391 -10.993 17.553 19 H ASN 3 H ASN 3 -6.525 -10.464 13.873 20 HA ASN 3 HA ASN 3 -4.214 -11.412 12.439 21 1HB ASN 3 1HB ASN 3 -6.934 -12.088 12.397 22 2HB ASN 3 2HB ASN 3 -6.771 -11.114 10.949 23 1HD2 ASN 3 1HD2 ASN 3 -6.388 -14.138 12.326 24 2HD2 ASN 3 2HD2 ASN 3 -5.450 -14.923 11.100 25 H GLU 4 H GLU 4 -4.935 -10.592 9.790 26 HA GLU 4 HA GLU 4 -4.773 -8.957 8.372 27 1HB GLU 4 1HB GLU 4 -6.892 -8.161 9.513 28 2HB GLU 4 2HB GLU 4 -5.911 -7.114 10.519 29 1HG GLU 4 1HG GLU 4 -5.699 -5.568 8.865 30 2HG GLU 4 2HG GLU 4 -5.195 -6.778 7.701 31 H LYS 5 H LYS 5 -3.188 -7.454 7.658 32 HA LYS 5 HA LYS 5 -1.586 -6.106 9.640 33 1HB LYS 5 1HB LYS 5 -0.399 -8.287 7.898 34 2HB LYS 5 2HB LYS 5 0.537 -7.118 8.807 35 1HG LYS 5 1HG LYS 5 -0.637 -7.901 10.919 36 2HG LYS 5 2HG LYS 5 -1.430 -9.144 9.972 37 1HD LYS 5 1HD LYS 5 0.429 -10.320 10.771 38 2HD LYS 5 2HD LYS 5 1.026 -9.779 9.215 39 1HE LYS 5 1HE LYS 5 2.789 -9.162 10.646 40 2HE LYS 5 2HE LYS 5 1.887 -7.665 10.527 41 1HZ LYS 5 1HZ LYS 5 1.785 -9.617 12.712 42 2HZ LYS 5 2HZ LYS 5 2.291 -8.066 12.783 43 3HZ LYS 5 3HZ LYS 5 0.707 -8.399 12.568 44 H ILE 6 H ILE 6 -0.533 -4.288 8.783 45 HA ILE 6 HA ILE 6 -0.534 -3.962 5.909 46 HB ILE 6 HB ILE 6 -2.488 -2.684 7.691 47 1HG1 ILE 6 1HG1 ILE 6 -2.882 -2.389 4.832 48 2HG1 ILE 6 2HG1 ILE 6 -2.445 -4.039 5.227 49 1HG2 ILE 6 1HG2 ILE 6 -1.176 -0.733 7.504 50 2HG2 ILE 6 2HG2 ILE 6 -0.811 -1.042 5.790 51 3HG2 ILE 6 3HG2 ILE 6 -2.457 -0.572 6.278 52 1HD1 ILE 6 1HD1 ILE 6 -4.991 -3.053 5.419 53 2HD1 ILE 6 2HD1 ILE 6 -4.393 -4.428 6.379 54 3HD1 ILE 6 3HD1 ILE 6 -4.418 -2.793 7.084 55 H LEU 7 H LEU 7 0.913 -2.274 5.212 56 HA LEU 7 HA LEU 7 2.515 -1.127 7.379 57 1HB LEU 7 1HB LEU 7 3.366 -3.280 5.957 58 2HB LEU 7 2HB LEU 7 3.979 -1.974 4.963 59 HG LEU 7 HG LEU 7 4.698 -1.220 7.548 60 1HD1 LEU 7 1HD1 LEU 7 4.947 -4.215 7.225 61 2HD1 LEU 7 2HD1 LEU 7 5.960 -3.267 8.339 62 3HD1 LEU 7 3HD1 LEU 7 4.194 -3.301 8.554 63 1HD2 LEU 7 1HD2 LEU 7 6.879 -1.334 6.760 64 2HD2 LEU 7 2HD2 LEU 7 6.552 -2.763 5.751 65 3HD2 LEU 7 3HD2 LEU 7 5.922 -1.170 5.268 66 H ILE 8 H ILE 8 3.409 0.938 6.924 67 HA ILE 8 HA ILE 8 2.205 2.175 4.550 68 HB ILE 8 HB ILE 8 3.098 3.537 7.088 69 1HG1 ILE 8 1HG1 ILE 8 0.270 2.724 6.364 70 2HG1 ILE 8 2HG1 ILE 8 1.288 1.827 7.473 71 1HG2 ILE 8 1HG2 ILE 8 2.136 4.448 4.506 72 2HG2 ILE 8 2HG2 ILE 8 1.079 4.995 5.830 73 3HG2 ILE 8 3HG2 ILE 8 2.818 5.372 5.866 74 1HD1 ILE 8 1HD1 ILE 8 -0.063 4.461 7.843 75 2HD1 ILE 8 2HD1 ILE 8 0.319 3.199 9.039 76 3HD1 ILE 8 3HD1 ILE 8 1.581 4.340 8.515 77 H VAL 9 H VAL 9 3.486 3.592 3.253 78 HA VAL 9 HA VAL 9 6.295 3.802 3.893 79 HB VAL 9 HB VAL 9 5.490 2.540 1.279 80 1HG1 VAL 9 1HG1 VAL 9 8.014 3.328 2.607 81 2HG1 VAL 9 2HG1 VAL 9 8.031 1.724 1.835 82 3HG1 VAL 9 3HG1 VAL 9 7.623 3.169 0.878 83 1HG2 VAL 9 1HG2 VAL 9 4.751 1.018 3.040 84 2HG2 VAL 9 2HG2 VAL 9 6.182 0.361 2.210 85 3HG2 VAL 9 3HG2 VAL 9 6.350 1.109 3.816 86 H ASP 10 H ASP 10 6.956 5.821 3.347 87 HA ASP 10 HA ASP 10 6.815 7.871 2.627 88 1HB ASP 10 1HB ASP 10 7.439 6.378 0.518 89 2HB ASP 10 2HB ASP 10 5.855 6.852 -0.061 90 H ASP 11 H ASP 11 5.238 9.327 0.829 91 HA ASP 11 HA ASP 11 3.308 10.273 0.551 92 1HB ASP 11 1HB ASP 11 2.758 7.769 -0.140 93 2HB ASP 11 2HB ASP 11 1.824 7.749 1.342 94 H GLN 12 H GLN 12 4.538 9.482 3.398 95 HA GLN 12 HA GLN 12 2.278 9.525 5.099 96 1HB GLN 12 1HB GLN 12 4.131 9.944 6.874 97 2HB GLN 12 2HB GLN 12 4.152 8.420 6.009 98 1HG GLN 12 1HG GLN 12 6.129 8.898 4.961 99 2HG GLN 12 2HG GLN 12 5.649 10.544 4.597 100 1HE2 GLN 12 1HE2 GLN 12 5.368 11.926 6.682 101 2HE2 GLN 12 2HE2 GLN 12 6.695 11.886 7.794 102 H TYR 13 H TYR 13 1.028 11.309 5.432 103 HA TYR 13 HA TYR 13 2.348 13.823 5.989 104 1HB TYR 13 1HB TYR 13 1.459 13.154 3.392 105 2HB TYR 13 2HB TYR 13 0.058 13.969 4.056 106 HD1 TYR 13 HD1 TYR 13 3.265 14.393 2.528 107 HD2 TYR 13 HD2 TYR 13 0.411 16.329 5.060 108 HE1 TYR 13 HE1 TYR 13 4.319 16.647 2.005 109 HE2 TYR 13 HE2 TYR 13 1.474 18.576 4.528 110 HH TYR 13 HH TYR 13 2.832 19.494 2.522 111 H GLY 14 H GLY 14 0.678 11.728 7.393 112 1HA GLY 14 1HA GLY 14 -0.680 12.286 9.247 113 2HA GLY 14 2HA GLY 14 -1.424 13.572 8.318 114 H ILE 15 H ILE 15 -1.127 11.157 6.074 115 HA ILE 15 HA ILE 15 -3.883 10.350 6.495 116 HB ILE 15 HB ILE 15 -1.967 10.087 4.180 117 1HG1 ILE 15 1HG1 ILE 15 -4.502 11.503 3.794 118 2HG1 ILE 15 2HG1 ILE 15 -3.505 12.237 5.035 119 1HG2 ILE 15 1HG2 ILE 15 -3.498 8.115 4.382 120 2HG2 ILE 15 2HG2 ILE 15 -4.872 9.236 4.225 121 3HG2 ILE 15 3HG2 ILE 15 -3.703 9.069 2.893 122 1HD1 ILE 15 1HD1 ILE 15 -3.202 12.676 2.331 123 2HD1 ILE 15 2HD1 ILE 15 -1.917 12.923 3.537 124 3HD1 ILE 15 3HD1 ILE 15 -1.993 11.402 2.617 125 H ARG 16 H ARG 16 -0.554 9.023 6.406 126 HA ARG 16 HA ARG 16 -1.116 6.388 6.306 127 1HB ARG 16 1HB ARG 16 0.997 6.203 7.874 128 2HB ARG 16 2HB ARG 16 1.181 6.936 6.293 129 1HG ARG 16 1HG ARG 16 1.224 9.150 7.183 130 2HG ARG 16 2HG ARG 16 0.498 8.657 8.700 131 1HD ARG 16 1HD ARG 16 3.107 7.345 8.021 132 2HD ARG 16 2HD ARG 16 3.187 9.059 8.375 133 HE ARG 16 HE ARG 16 2.441 6.908 10.256 134 1HH1 ARG 16 1HH1 ARG 16 2.546 10.371 9.635 135 2HH1 ARG 16 2HH1 ARG 16 2.429 10.803 11.309 136 1HH2 ARG 16 1HH2 ARG 16 2.287 7.479 12.463 137 2HH2 ARG 16 2HH2 ARG 16 2.282 9.147 12.928 138 H ILE 17 H ILE 17 -1.367 8.655 9.076 139 HA ILE 17 HA ILE 17 -1.776 6.639 11.024 140 HB ILE 17 HB ILE 17 -2.394 9.595 11.019 141 1HG1 ILE 17 1HG1 ILE 17 -0.091 8.307 12.453 142 2HG1 ILE 17 2HG1 ILE 17 0.042 8.638 10.737 143 1HG2 ILE 17 1HG2 ILE 17 -3.327 7.655 12.802 144 2HG2 ILE 17 2HG2 ILE 17 -1.934 8.402 13.620 145 3HG2 ILE 17 3HG2 ILE 17 -3.280 9.417 13.049 146 1HD1 ILE 17 1HD1 ILE 17 -0.919 10.786 12.658 147 2HD1 ILE 17 2HD1 ILE 17 0.817 10.490 12.394 148 3HD1 ILE 17 3HD1 ILE 17 -0.219 10.984 11.033 149 H LEU 18 H LEU 18 -3.943 8.762 9.059 150 HA LEU 18 HA LEU 18 -6.341 8.201 10.147 151 1HB LEU 18 1HB LEU 18 -5.620 9.601 8.082 152 2HB LEU 18 2HB LEU 18 -5.979 8.150 7.169 153 HG LEU 18 HG LEU 18 -8.286 8.260 8.430 154 1HD1 LEU 18 1HD1 LEU 18 -8.467 11.076 8.337 155 2HD1 LEU 18 2HD1 LEU 18 -8.609 10.009 9.754 156 3HD1 LEU 18 3HD1 LEU 18 -7.026 10.689 9.307 157 1HD2 LEU 18 1HD2 LEU 18 -9.224 9.118 6.514 158 2HD2 LEU 18 2HD2 LEU 18 -7.956 10.350 6.308 159 3HD2 LEU 18 3HD2 LEU 18 -7.611 8.646 5.927 160 H LEU 19 H LEU 19 -4.698 6.185 7.606 161 HA LEU 19 HA LEU 19 -6.645 4.129 7.856 162 1HB LEU 19 1HB LEU 19 -5.165 2.894 6.352 163 2HB LEU 19 2HB LEU 19 -5.556 4.498 5.765 164 HG LEU 19 HG LEU 19 -3.208 5.010 7.047 165 1HD1 LEU 19 1HD1 LEU 19 -1.652 3.155 6.235 166 2HD1 LEU 19 2HD1 LEU 19 -2.626 2.827 7.688 167 3HD1 LEU 19 3HD1 LEU 19 -3.110 2.140 6.119 168 1HD2 LEU 19 1HD2 LEU 19 -3.875 5.684 4.766 169 2HD2 LEU 19 2HD2 LEU 19 -2.193 5.105 4.852 170 3HD2 LEU 19 3HD2 LEU 19 -3.463 4.053 4.183 171 H ASN 20 H ASN 20 -3.705 5.036 9.544 172 HA ASN 20 HA ASN 20 -2.966 2.532 10.450 173 1HB ASN 20 1HB ASN 20 -1.654 4.729 10.636 174 2HB ASN 20 2HB ASN 20 -2.709 5.184 11.959 175 1HD2 ASN 20 1HD2 ASN 20 -0.428 5.252 12.877 176 2HD2 ASN 20 2HD2 ASN 20 0.131 3.840 13.710 177 H GLU 21 H GLU 21 -4.800 5.211 12.128 178 HA GLU 21 HA GLU 21 -5.467 3.785 14.360 179 1HB GLU 21 1HB GLU 21 -5.729 6.268 14.001 180 2HB GLU 21 2HB GLU 21 -7.141 5.950 13.014 181 1HG GLU 21 1HG GLU 21 -8.453 5.311 14.830 182 2HG GLU 21 2HG GLU 21 -7.092 4.676 15.734 183 H VAL 22 H VAL 22 -6.682 3.522 11.087 184 HA VAL 22 HA VAL 22 -9.204 2.399 11.769 185 HB VAL 22 HB VAL 22 -7.545 2.749 9.307 186 1HG1 VAL 22 1HG1 VAL 22 -8.253 0.661 8.668 187 2HG1 VAL 22 2HG1 VAL 22 -9.707 0.715 9.694 188 3HG1 VAL 22 3HG1 VAL 22 -9.664 1.622 8.162 189 1HG2 VAL 22 1HG2 VAL 22 -8.822 4.600 9.361 190 2HG2 VAL 22 2HG2 VAL 22 -10.123 3.540 8.768 191 3HG2 VAL 22 3HG2 VAL 22 -9.981 3.886 10.508 192 H PHE 23 H PHE 23 -6.127 0.991 10.430 193 HA PHE 23 HA PHE 23 -7.011 -1.656 10.814 194 1HB PHE 23 1HB PHE 23 -4.275 -0.289 10.489 195 2HB PHE 23 2HB PHE 23 -4.460 -2.031 10.456 196 HD1 PHE 23 HD1 PHE 23 -6.861 -2.420 8.847 197 HD2 PHE 23 HD2 PHE 23 -3.699 0.365 8.347 198 HE1 PHE 23 HE1 PHE 23 -7.336 -2.324 6.384 199 HE2 PHE 23 HE2 PHE 23 -4.174 0.462 5.884 200 HZ PHE 23 HZ PHE 23 -5.987 -0.884 4.932 201 H ASN 24 H ASN 24 -5.091 0.660 12.778 202 HA ASN 24 HA ASN 24 -4.162 -1.204 14.604 203 1HB ASN 24 1HB ASN 24 -3.686 1.429 14.199 204 2HB ASN 24 2HB ASN 24 -4.855 1.604 15.493 205 1HD2 ASN 24 1HD2 ASN 24 -4.426 0.799 17.542 206 2HD2 ASN 24 2HD2 ASN 24 -2.833 0.390 18.082 207 H LYS 25 H LYS 25 -7.192 0.696 14.283 208 HA LYS 25 HA LYS 25 -8.226 0.438 16.813 209 1HB LYS 25 1HB LYS 25 -9.217 1.027 14.124 210 2HB LYS 25 2HB LYS 25 -10.418 0.227 15.116 211 1HG LYS 25 1HG LYS 25 -9.923 1.913 16.960 212 2HG LYS 25 2HG LYS 25 -8.867 2.756 15.844 213 1HD LYS 25 1HD LYS 25 -10.758 3.134 14.286 214 2HD LYS 25 2HD LYS 25 -11.826 2.203 15.318 215 1HE LYS 25 1HE LYS 25 -11.418 3.859 17.182 216 2HE LYS 25 2HE LYS 25 -10.425 4.807 16.093 217 1HZ LYS 25 1HZ LYS 25 -12.969 5.235 16.360 218 2HZ LYS 25 2HZ LYS 25 -12.220 5.471 14.928 219 3HZ LYS 25 3HZ LYS 25 -13.080 4.107 15.184 220 H GLU 26 H GLU 26 -7.575 -2.014 14.417 221 HA GLU 26 HA GLU 26 -9.384 -3.846 15.737 222 1HB GLU 26 1HB GLU 26 -7.628 -4.236 13.272 223 2HB GLU 26 2HB GLU 26 -8.799 -5.393 13.874 224 1HG GLU 26 1HG GLU 26 -9.503 -2.544 13.024 225 2HG GLU 26 2HG GLU 26 -9.654 -3.941 11.977 226 H GLY 27 H GLY 27 -6.033 -2.871 15.643 227 1HA GLY 27 1HA GLY 27 -4.594 -3.539 17.400 228 2HA GLY 27 2HA GLY 27 -5.364 -5.113 17.435 229 H TYR 28 H TYR 28 -5.083 -4.180 14.184 230 HA TYR 28 HA TYR 28 -3.181 -6.165 13.622 231 1HB TYR 28 1HB TYR 28 -4.055 -3.679 12.025 232 2HB TYR 28 2HB TYR 28 -3.430 -5.161 11.330 233 HD1 TYR 28 HD1 TYR 28 -5.925 -4.090 10.315 234 HD2 TYR 28 HD2 TYR 28 -5.260 -6.623 13.699 235 HE1 TYR 28 HE1 TYR 28 -8.292 -4.996 10.112 236 HE2 TYR 28 HE2 TYR 28 -7.629 -7.520 13.483 237 HH TYR 28 HH TYR 28 -9.930 -6.251 12.266 238 H GLN 29 H GLN 29 -0.987 -6.081 13.090 239 HA GLN 29 HA GLN 29 0.411 -3.917 14.245 240 1HB GLN 29 1HB GLN 29 0.962 -6.600 13.605 241 2HB GLN 29 2HB GLN 29 2.020 -5.693 12.544 242 1HG GLN 29 1HG GLN 29 3.183 -4.683 14.326 243 2HG GLN 29 2HG GLN 29 1.844 -4.859 15.442 244 1HE2 GLN 29 1HE2 GLN 29 2.303 -6.184 17.011 245 2HE2 GLN 29 2HE2 GLN 29 3.171 -7.680 16.911 246 H THR 30 H THR 30 1.425 -2.164 13.268 247 HA THR 30 HA THR 30 1.421 -2.107 10.331 248 HB THR 30 HB THR 30 0.607 0.292 10.539 249 HG1 THR 30 HG1 THR 30 0.079 -0.696 13.251 250 1HG2 THR 30 1HG2 THR 30 -1.748 -0.261 11.337 251 2HG2 THR 30 2HG2 THR 30 -1.147 -1.369 10.080 252 3HG2 THR 30 3HG2 THR 30 -1.157 -1.879 11.785 253 H PHE 31 H PHE 31 3.045 -0.797 9.365 254 HA PHE 31 HA PHE 31 5.017 0.291 11.206 255 1HB PHE 31 1HB PHE 31 5.189 -2.265 9.954 256 2HB PHE 31 2HB PHE 31 6.152 -1.230 8.918 257 HD1 PHE 31 HD1 PHE 31 5.793 -2.474 12.378 258 HD2 PHE 31 HD2 PHE 31 8.298 -0.477 9.595 259 HE1 PHE 31 HE1 PHE 31 7.723 -2.678 13.969 260 HE2 PHE 31 HE2 PHE 31 10.228 -0.681 11.186 261 HZ PHE 31 HZ PHE 31 9.918 -1.779 13.354 262 H GLN 32 H GLN 32 6.717 1.592 9.995 263 HA GLN 32 HA GLN 32 5.580 2.579 7.497 264 1HB GLN 32 1HB GLN 32 5.103 4.414 8.815 265 2HB GLN 32 2HB GLN 32 6.367 4.055 9.974 266 1HG GLN 32 1HG GLN 32 8.038 5.109 8.702 267 2HG GLN 32 2HG GLN 32 7.195 4.860 7.186 268 1HE2 GLN 32 1HE2 GLN 32 6.639 6.698 6.321 269 2HE2 GLN 32 2HE2 GLN 32 5.971 8.081 7.121 270 H ALA 33 H ALA 33 7.069 3.077 5.830 271 HA ALA 33 HA ALA 33 9.879 2.517 6.485 272 1HB ALA 33 1HB ALA 33 8.414 1.689 3.949 273 2HB ALA 33 2HB ALA 33 10.085 1.284 4.411 274 3HB ALA 33 3HB ALA 33 8.718 0.604 5.327 275 H ALA 34 H ALA 34 11.370 3.426 4.696 276 HA ALA 34 HA ALA 34 10.208 5.928 3.681 277 1HB ALA 34 1HB ALA 34 11.590 6.955 5.142 278 2HB ALA 34 2HB ALA 34 12.460 5.445 5.504 279 3HB ALA 34 3HB ALA 34 12.918 6.419 4.086 280 H ASN 35 H ASN 35 10.171 3.528 2.203 281 HA ASN 35 HA ASN 35 11.085 4.208 -0.162 282 1HB ASN 35 1HB ASN 35 13.382 3.435 1.509 283 2HB ASN 35 2HB ASN 35 13.258 2.391 0.106 284 1HD2 ASN 35 1HD2 ASN 35 15.325 3.467 -0.363 285 2HD2 ASN 35 2HD2 ASN 35 15.323 4.948 -1.262 286 H GLY 36 H GLY 36 11.863 1.929 -1.482 287 1HA GLY 36 1HA GLY 36 9.762 0.033 -0.798 288 2HA GLY 36 2HA GLY 36 10.716 0.094 -2.267 289 H LEU 37 H LEU 37 13.362 0.206 -1.108 290 HA LEU 37 HA LEU 37 13.889 -2.488 -0.813 291 1HB LEU 37 1HB LEU 37 15.315 -0.080 -0.986 292 2HB LEU 37 2HB LEU 37 15.853 -0.826 0.506 293 HG LEU 37 HG LEU 37 15.754 -2.463 -2.012 294 1HD1 LEU 37 1HD1 LEU 37 17.064 -0.927 -3.014 295 2HD1 LEU 37 2HD1 LEU 37 17.549 -0.170 -1.477 296 3HD1 LEU 37 3HD1 LEU 37 18.337 -1.672 -2.017 297 1HD2 LEU 37 1HD2 LEU 37 16.541 -2.926 0.648 298 2HD2 LEU 37 2HD2 LEU 37 16.760 -3.993 -0.760 299 3HD2 LEU 37 3HD2 LEU 37 18.044 -2.848 -0.302 300 H GLN 38 H GLN 38 13.661 0.092 1.732 301 HA GLN 38 HA GLN 38 14.092 -1.658 3.834 302 1HB GLN 38 1HB GLN 38 13.121 1.129 3.478 303 2HB GLN 38 2HB GLN 38 12.556 0.353 4.944 304 1HG GLN 38 1HG GLN 38 14.702 0.142 5.839 305 2HG GLN 38 2HG GLN 38 15.469 0.024 4.268 306 1HE2 GLN 38 1HE2 GLN 38 15.199 1.891 6.895 307 2HE2 GLN 38 2HE2 GLN 38 15.489 3.472 6.247 308 H ALA 39 H ALA 39 11.273 -1.023 1.831 309 HA ALA 39 HA ALA 39 9.431 -2.144 3.751 310 1HB ALA 39 1HB ALA 39 7.869 -1.874 1.710 311 2HB ALA 39 2HB ALA 39 8.542 -0.392 2.429 312 3HB ALA 39 3HB ALA 39 9.241 -1.050 0.931 313 H LEU 40 H LEU 40 11.497 -3.165 1.082 314 HA LEU 40 HA LEU 40 10.099 -5.478 0.357 315 1HB LEU 40 1HB LEU 40 12.899 -4.473 0.067 316 2HB LEU 40 2HB LEU 40 12.559 -6.152 -0.304 317 HG LEU 40 HG LEU 40 11.421 -3.690 -1.638 318 1HD1 LEU 40 1HD1 LEU 40 12.637 -5.947 -3.145 319 2HD1 LEU 40 2HD1 LEU 40 12.708 -4.192 -3.436 320 3HD1 LEU 40 3HD1 LEU 40 13.729 -4.928 -2.177 321 1HD2 LEU 40 1HD2 LEU 40 9.508 -4.988 -1.579 322 2HD2 LEU 40 2HD2 LEU 40 10.252 -5.486 -3.117 323 3HD2 LEU 40 3HD2 LEU 40 10.410 -6.519 -1.676 324 H ASP 41 H ASP 41 12.532 -4.777 2.911 325 HA ASP 41 HA ASP 41 12.738 -7.490 3.650 326 1HB ASP 41 1HB ASP 41 14.266 -5.307 4.107 327 2HB ASP 41 2HB ASP 41 13.332 -5.259 5.589 328 H ILE 42 H ILE 42 11.257 -4.512 5.154 329 HA ILE 42 HA ILE 42 10.042 -5.822 7.284 330 HB ILE 42 HB ILE 42 9.416 -3.241 5.858 331 1HG1 ILE 42 1HG1 ILE 42 11.369 -4.076 7.853 332 2HG1 ILE 42 2HG1 ILE 42 11.303 -2.620 6.881 333 1HG2 ILE 42 1HG2 ILE 42 8.016 -2.622 7.734 334 2HG2 ILE 42 2HG2 ILE 42 7.394 -4.110 6.979 335 3HG2 ILE 42 3HG2 ILE 42 8.302 -4.199 8.508 336 1HD1 ILE 42 1HD1 ILE 42 9.701 -3.121 9.432 337 2HD1 ILE 42 2HD1 ILE 42 11.127 -2.066 9.282 338 3HD1 ILE 42 3HD1 ILE 42 9.616 -1.646 8.441 339 H VAL 43 H VAL 43 9.270 -5.710 3.868 340 HA VAL 43 HA VAL 43 6.547 -6.067 3.897 341 HB VAL 43 HB VAL 43 8.795 -6.540 2.104 342 1HG1 VAL 43 1HG1 VAL 43 6.442 -8.431 2.042 343 2HG1 VAL 43 2HG1 VAL 43 7.325 -7.999 0.558 344 3HG1 VAL 43 3HG1 VAL 43 8.180 -8.793 1.902 345 1HG2 VAL 43 1HG2 VAL 43 6.159 -6.032 0.929 346 2HG2 VAL 43 2HG2 VAL 43 6.570 -4.897 2.238 347 3HG2 VAL 43 3HG2 VAL 43 7.658 -5.076 0.840 348 H THR 44 H THR 44 9.119 -8.640 3.951 349 HA THR 44 HA THR 44 7.137 -10.634 4.588 350 HB THR 44 HB THR 44 10.191 -10.821 4.527 351 HG1 THR 44 HG1 THR 44 9.646 -10.145 2.455 352 1HG2 THR 44 1HG2 THR 44 9.867 -13.083 4.632 353 2HG2 THR 44 2HG2 THR 44 8.174 -12.751 5.072 354 3HG2 THR 44 3HG2 THR 44 8.617 -13.004 3.367 355 H LYS 45 H LYS 45 9.564 -8.664 6.305 356 HA LYS 45 HA LYS 45 9.621 -10.137 8.660 357 1HB LYS 45 1HB LYS 45 10.729 -7.755 7.667 358 2HB LYS 45 2HB LYS 45 9.842 -7.275 9.100 359 1HG LYS 45 1HG LYS 45 11.092 -9.654 9.901 360 2HG LYS 45 2HG LYS 45 12.296 -8.905 8.872 361 1HD LYS 45 1HD LYS 45 11.333 -6.759 10.412 362 2HD LYS 45 2HD LYS 45 11.356 -8.093 11.548 363 1HE LYS 45 1HE LYS 45 13.712 -7.191 9.821 364 2HE LYS 45 2HE LYS 45 13.531 -6.885 11.536 365 1HZ LYS 45 1HZ LYS 45 14.884 -8.779 11.241 366 2HZ LYS 45 2HZ LYS 45 13.460 -9.314 11.836 367 3HZ LYS 45 3HZ LYS 45 13.809 -9.510 10.252 368 H GLU 46 H GLU 46 7.336 -7.645 7.446 369 HA GLU 46 HA GLU 46 5.800 -8.039 9.881 370 1HB GLU 46 1HB GLU 46 6.129 -5.795 7.942 371 2HB GLU 46 2HB GLU 46 4.504 -6.017 8.559 372 1HG GLU 46 1HG GLU 46 6.678 -6.164 10.607 373 2HG GLU 46 2HG GLU 46 6.458 -4.593 9.862 374 H ARG 47 H ARG 47 6.064 -9.180 6.708 375 HA ARG 47 HA ARG 47 4.589 -9.866 5.191 376 1HB ARG 47 1HB ARG 47 3.342 -11.905 6.111 377 2HB ARG 47 2HB ARG 47 5.061 -11.878 6.448 378 1HG ARG 47 1HG ARG 47 4.759 -11.420 8.726 379 2HG ARG 47 2HG ARG 47 3.230 -10.602 8.473 380 1HD ARG 47 1HD ARG 47 2.884 -12.799 9.579 381 2HD ARG 47 2HD ARG 47 2.109 -12.766 8.008 382 HE ARG 47 HE ARG 47 4.782 -13.761 7.696 383 1HH1 ARG 47 1HH1 ARG 47 1.667 -14.718 9.026 384 2HH1 ARG 47 2HH1 ARG 47 1.951 -16.412 8.807 385 1HH2 ARG 47 1HH2 ARG 47 5.156 -15.997 7.407 386 2HH2 ARG 47 2HH2 ARG 47 3.948 -17.145 7.880 387 HA PRO 48 HA PRO 48 0.938 -7.492 6.669 388 1HB PRO 48 1HB PRO 48 1.111 -5.346 4.986 389 2HB PRO 48 2HB PRO 48 1.744 -5.336 6.620 390 1HG PRO 48 1HG PRO 48 3.215 -5.542 4.064 391 2HG PRO 48 2HG PRO 48 3.824 -5.107 5.649 392 1HD PRO 48 1HD PRO 48 4.143 -7.629 4.319 393 2HD PRO 48 2HD PRO 48 4.650 -7.231 5.949 394 H ASP 49 H ASP 49 -1.152 -7.118 5.680 395 HA ASP 49 HA ASP 49 -1.356 -8.922 3.461 396 1HB ASP 49 1HB ASP 49 -3.405 -7.411 5.141 397 2HB ASP 49 2HB ASP 49 -3.865 -8.418 3.783 398 H LEU 50 H LEU 50 -0.892 -5.575 4.026 399 HA LEU 50 HA LEU 50 -1.216 -4.921 1.302 400 1HB LEU 50 1HB LEU 50 -3.616 -4.971 2.413 401 2HB LEU 50 2HB LEU 50 -3.139 -3.386 2.989 402 HG LEU 50 HG LEU 50 -2.527 -2.990 0.443 403 1HD1 LEU 50 1HD1 LEU 50 -4.828 -4.433 -0.440 404 2HD1 LEU 50 2HD1 LEU 50 -3.143 -4.552 -1.002 405 3HD1 LEU 50 3HD1 LEU 50 -3.708 -5.573 0.343 406 1HD2 LEU 50 1HD2 LEU 50 -4.641 -2.295 2.131 407 2HD2 LEU 50 2HD2 LEU 50 -4.199 -1.533 0.584 408 3HD2 LEU 50 3HD2 LEU 50 -5.417 -2.831 0.621 409 H VAL 51 H VAL 51 0.149 -3.243 0.837 410 HA VAL 51 HA VAL 51 0.937 -1.535 3.082 411 HB VAL 51 HB VAL 51 2.686 -3.067 3.062 412 1HG1 VAL 51 1HG1 VAL 51 2.881 -2.942 0.039 413 2HG1 VAL 51 2HG1 VAL 51 3.709 -4.064 1.146 414 3HG1 VAL 51 3HG1 VAL 51 1.947 -4.179 0.915 415 1HG2 VAL 51 1HG2 VAL 51 3.261 -0.542 2.661 416 2HG2 VAL 51 2HG2 VAL 51 4.548 -1.770 2.583 417 3HG2 VAL 51 3HG2 VAL 51 3.844 -1.121 1.082 418 H LEU 52 H LEU 52 1.078 0.621 2.558 419 HA LEU 52 HA LEU 52 0.379 1.267 -0.194 420 1HB LEU 52 1HB LEU 52 -0.344 3.356 0.623 421 2HB LEU 52 2HB LEU 52 -0.969 2.123 1.700 422 HG LEU 52 HG LEU 52 1.560 3.063 2.712 423 1HD1 LEU 52 1HD1 LEU 52 0.380 5.078 1.263 424 2HD1 LEU 52 2HD1 LEU 52 -0.249 5.363 2.904 425 3HD1 LEU 52 3HD1 LEU 52 1.508 5.295 2.624 426 1HD2 LEU 52 1HD2 LEU 52 0.039 2.011 4.171 427 2HD2 LEU 52 2HD2 LEU 52 0.054 3.724 4.653 428 3HD2 LEU 52 3HD2 LEU 52 -1.298 3.083 3.688 429 H LEU 53 H LEU 53 1.753 2.273 -1.608 430 HA LEU 53 HA LEU 53 4.214 3.390 -0.519 431 1HB LEU 53 1HB LEU 53 4.803 1.115 -1.010 432 2HB LEU 53 2HB LEU 53 4.073 1.209 -2.600 433 HG LEU 53 HG LEU 53 6.398 2.967 -1.804 434 1HD1 LEU 53 1HD1 LEU 53 6.521 0.191 -1.893 435 2HD1 LEU 53 2HD1 LEU 53 7.116 0.707 -3.489 436 3HD1 LEU 53 3HD1 LEU 53 7.887 1.326 -2.009 437 1HD2 LEU 53 1HD2 LEU 53 5.638 3.889 -3.738 438 2HD2 LEU 53 2HD2 LEU 53 6.676 2.621 -4.433 439 3HD2 LEU 53 3HD2 LEU 53 4.918 2.368 -4.319 440 H ASP 54 H ASP 54 4.826 5.259 -1.546 441 HA ASP 54 HA ASP 54 3.036 6.097 -3.651 442 1HB ASP 54 1HB ASP 54 3.186 7.836 -2.106 443 2HB ASP 54 2HB ASP 54 4.831 7.437 -1.655 444 H MET 55 H MET 55 3.764 6.290 -5.796 445 HA MET 55 HA MET 55 6.099 5.123 -6.585 446 1HB MET 55 1HB MET 55 4.652 7.396 -8.049 447 2HB MET 55 2HB MET 55 5.580 6.106 -8.788 448 1HG MET 55 1HG MET 55 2.878 5.911 -7.403 449 2HG MET 55 2HG MET 55 3.284 5.459 -9.047 450 1HE MET 55 1HE MET 55 2.673 4.718 -5.738 451 2HE MET 55 2HE MET 55 2.867 2.955 -5.587 452 3HE MET 55 3HE MET 55 4.196 4.040 -5.112 453 H LYS 56 H LYS 56 5.417 8.695 -6.816 454 HA LYS 56 HA LYS 56 8.056 9.403 -7.280 455 1HB LYS 56 1HB LYS 56 5.517 10.712 -6.807 456 2HB LYS 56 2HB LYS 56 6.800 11.563 -5.971 457 1HG LYS 56 1HG LYS 56 8.134 11.311 -8.227 458 2HG LYS 56 2HG LYS 56 6.573 10.952 -8.938 459 1HD LYS 56 1HD LYS 56 6.440 13.230 -9.185 460 2HD LYS 56 2HD LYS 56 5.909 13.189 -7.516 461 1HE LYS 56 1HE LYS 56 7.944 13.978 -6.692 462 2HE LYS 56 2HE LYS 56 8.878 13.244 -7.980 463 1HZ LYS 56 1HZ LYS 56 7.397 15.744 -8.013 464 2HZ LYS 56 2HZ LYS 56 8.911 15.434 -8.540 465 3HZ LYS 56 3HZ LYS 56 7.624 14.948 -9.421 466 H ILE 57 H ILE 57 9.742 8.834 -6.002 467 HA ILE 57 HA ILE 57 9.546 9.606 -3.196 468 HB ILE 57 HB ILE 57 9.487 6.913 -4.144 469 1HG1 ILE 57 1HG1 ILE 57 9.775 7.846 -1.284 470 2HG1 ILE 57 2HG1 ILE 57 8.296 8.084 -2.192 471 1HG2 ILE 57 1HG2 ILE 57 12.022 7.714 -2.710 472 2HG2 ILE 57 2HG2 ILE 57 11.368 6.060 -2.662 473 3HG2 ILE 57 3HG2 ILE 57 11.840 6.785 -4.218 474 1HD1 ILE 57 1HD1 ILE 57 9.383 5.331 -2.403 475 2HD1 ILE 57 2HD1 ILE 57 8.909 5.806 -0.755 476 3HD1 ILE 57 3HD1 ILE 57 7.720 5.875 -2.078 477 HA PRO 58 HA PRO 58 13.520 11.083 -3.997 478 1HB PRO 58 1HB PRO 58 14.610 11.176 -1.493 479 2HB PRO 58 2HB PRO 58 13.504 12.391 -2.102 480 1HG PRO 58 1HG PRO 58 12.990 10.227 -0.155 481 2HG PRO 58 2HG PRO 58 12.056 11.679 -0.454 482 1HD PRO 58 1HD PRO 58 11.420 9.021 -1.323 483 2HD PRO 58 2HD PRO 58 10.550 10.490 -1.719 484 H GLY 59 H GLY 59 15.221 10.260 -5.030 485 1HA GLY 59 1HA GLY 59 16.957 8.876 -5.417 486 2HA GLY 59 2HA GLY 59 16.885 8.352 -3.746 487 H MET 60 H MET 60 16.414 7.412 -6.985 488 HA MET 60 HA MET 60 15.644 5.625 -7.954 489 1HB MET 60 1HB MET 60 16.871 4.724 -5.669 490 2HB MET 60 2HB MET 60 15.259 4.103 -5.377 491 1HG MET 60 1HG MET 60 15.482 3.266 -7.921 492 2HG MET 60 2HG MET 60 17.196 3.390 -7.582 493 1HE MET 60 1HE MET 60 14.028 2.434 -5.438 494 2HE MET 60 2HE MET 60 13.896 1.523 -6.962 495 3HE MET 60 3HE MET 60 14.177 0.660 -5.431 496 H ASP 61 H ASP 61 13.621 6.287 -8.718 497 HA ASP 61 HA ASP 61 11.426 6.805 -7.243 498 1HB ASP 61 1HB ASP 61 10.272 5.722 -9.471 499 2HB ASP 61 2HB ASP 61 10.983 7.323 -9.430 500 H GLY 62 H GLY 62 9.245 5.309 -7.580 501 1HA GLY 62 1HA GLY 62 9.884 2.766 -6.293 502 2HA GLY 62 2HA GLY 62 8.320 3.551 -6.393 503 H ILE 63 H ILE 63 9.477 3.932 -9.465 504 HA ILE 63 HA ILE 63 7.724 2.173 -10.633 505 HB ILE 63 HB ILE 63 10.281 3.354 -11.722 506 1HG1 ILE 63 1HG1 ILE 63 7.505 4.395 -12.229 507 2HG1 ILE 63 2HG1 ILE 63 8.349 4.836 -10.757 508 1HG2 ILE 63 1HG2 ILE 63 9.582 1.477 -13.095 509 2HG2 ILE 63 2HG2 ILE 63 7.927 2.126 -13.183 510 3HG2 ILE 63 3HG2 ILE 63 9.273 3.012 -13.940 511 1HD1 ILE 63 1HD1 ILE 63 8.838 6.532 -12.420 512 2HD1 ILE 63 2HD1 ILE 63 10.320 5.574 -12.187 513 3HD1 ILE 63 3HD1 ILE 63 9.298 5.299 -13.618 514 H GLU 64 H GLU 64 11.095 1.687 -9.541 515 HA GLU 64 HA GLU 64 11.136 -0.923 -10.730 516 1HB GLU 64 1HB GLU 64 13.117 0.728 -9.134 517 2HB GLU 64 2HB GLU 64 13.416 -0.973 -9.434 518 1HG GLU 64 1HG GLU 64 12.660 0.819 -11.755 519 2HG GLU 64 2HG GLU 64 14.299 0.873 -11.138 520 H ILE 65 H ILE 65 11.063 0.577 -7.439 521 HA ILE 65 HA ILE 65 11.275 -1.639 -5.887 522 HB ILE 65 HB ILE 65 9.765 0.930 -5.624 523 1HG1 ILE 65 1HG1 ILE 65 12.150 1.074 -5.395 524 2HG1 ILE 65 2HG1 ILE 65 11.424 1.291 -3.815 525 1HG2 ILE 65 1HG2 ILE 65 9.082 0.404 -3.379 526 2HG2 ILE 65 2HG2 ILE 65 8.410 -0.818 -4.486 527 3HG2 ILE 65 3HG2 ILE 65 9.826 -1.210 -3.481 528 1HD1 ILE 65 1HD1 ILE 65 13.141 -0.922 -4.824 529 2HD1 ILE 65 2HD1 ILE 65 12.958 -0.285 -3.171 530 3HD1 ILE 65 3HD1 ILE 65 11.763 -1.435 -3.820 531 H LEU 66 H LEU 66 8.115 -0.245 -7.034 532 HA LEU 66 HA LEU 66 6.575 -2.378 -6.195 533 1HB LEU 66 1HB LEU 66 6.179 -0.418 -8.456 534 2HB LEU 66 2HB LEU 66 4.947 -1.534 -7.902 535 HG LEU 66 HG LEU 66 4.314 0.297 -6.722 536 1HD1 LEU 66 1HD1 LEU 66 5.042 0.191 -4.411 537 2HD1 LEU 66 2HD1 LEU 66 4.880 -1.450 -5.080 538 3HD1 LEU 66 3HD1 LEU 66 6.494 -0.725 -4.881 539 1HD2 LEU 66 1HD2 LEU 66 7.127 1.250 -6.203 540 2HD2 LEU 66 2HD2 LEU 66 6.273 1.612 -7.722 541 3HD2 LEU 66 3HD2 LEU 66 5.604 2.170 -6.170 542 H LYS 67 H LYS 67 8.509 -1.901 -9.170 543 HA LYS 67 HA LYS 67 7.456 -4.072 -10.584 544 1HB LYS 67 1HB LYS 67 9.552 -2.118 -10.879 545 2HB LYS 67 2HB LYS 67 10.173 -3.698 -11.308 546 1HG LYS 67 1HG LYS 67 7.880 -3.930 -12.637 547 2HG LYS 67 2HG LYS 67 7.854 -2.182 -12.531 548 1HD LYS 67 1HD LYS 67 10.452 -2.582 -13.342 549 2HD LYS 67 2HD LYS 67 9.676 -3.961 -14.094 550 1HE LYS 67 1HE LYS 67 7.902 -2.288 -14.985 551 2HE LYS 67 2HE LYS 67 8.995 -1.015 -14.477 552 1HZ LYS 67 1HZ LYS 67 9.118 -2.485 -16.790 553 2HZ LYS 67 2HZ LYS 67 10.193 -1.372 -16.270 554 3HZ LYS 67 3HZ LYS 67 10.413 -2.950 -15.911 555 H ARG 68 H ARG 68 10.636 -3.856 -8.828 556 HA ARG 68 HA ARG 68 11.217 -6.490 -8.977 557 1HB ARG 68 1HB ARG 68 11.971 -4.226 -7.183 558 2HB ARG 68 2HB ARG 68 12.265 -5.813 -6.501 559 1HG ARG 68 1HG ARG 68 13.637 -6.461 -8.426 560 2HG ARG 68 2HG ARG 68 13.210 -4.995 -9.286 561 1HD ARG 68 1HD ARG 68 15.245 -4.301 -8.416 562 2HD ARG 68 2HD ARG 68 14.218 -3.822 -7.079 563 HE ARG 68 HE ARG 68 14.940 -6.529 -6.629 564 1HH1 ARG 68 1HH1 ARG 68 16.515 -3.388 -6.823 565 2HH1 ARG 68 2HH1 ARG 68 17.799 -3.823 -5.745 566 1HH2 ARG 68 1HH2 ARG 68 16.634 -7.103 -5.207 567 2HH2 ARG 68 2HH2 ARG 68 17.868 -5.950 -4.820 568 H MET 69 H MET 69 9.022 -4.766 -6.743 569 HA MET 69 HA MET 69 8.786 -6.649 -4.778 570 1HB MET 69 1HB MET 69 7.507 -4.238 -5.597 571 2HB MET 69 2HB MET 69 6.207 -5.409 -5.499 572 1HG MET 69 1HG MET 69 7.278 -6.046 -3.167 573 2HG MET 69 2HG MET 69 8.089 -4.498 -3.297 574 1HE MET 69 1HE MET 69 6.693 -2.083 -2.748 575 2HE MET 69 2HE MET 69 5.717 -2.598 -1.352 576 3HE MET 69 3HE MET 69 7.338 -3.287 -1.607 577 H LYS 70 H LYS 70 6.652 -6.240 -7.702 578 HA LYS 70 HA LYS 70 5.291 -8.675 -7.191 579 1HB LYS 70 1HB LYS 70 3.990 -8.132 -9.025 580 2HB LYS 70 2HB LYS 70 4.501 -6.556 -8.457 581 1HG LYS 70 1HG LYS 70 4.879 -6.481 -10.807 582 2HG LYS 70 2HG LYS 70 6.471 -6.743 -10.123 583 1HD LYS 70 1HD LYS 70 6.685 -8.674 -11.288 584 2HD LYS 70 2HD LYS 70 5.261 -9.331 -10.504 585 1HE LYS 70 1HE LYS 70 3.789 -8.335 -12.196 586 2HE LYS 70 2HE LYS 70 5.126 -7.457 -12.912 587 1HZ LYS 70 1HZ LYS 70 5.205 -10.371 -12.709 588 2HZ LYS 70 2HZ LYS 70 4.433 -9.642 -13.949 589 3HZ LYS 70 3HZ LYS 70 6.032 -9.398 -13.727 590 H VAL 71 H VAL 71 8.031 -7.652 -9.287 591 HA VAL 71 HA VAL 71 8.250 -10.000 -10.748 592 HB VAL 71 HB VAL 71 10.439 -8.121 -9.840 593 1HG1 VAL 71 1HG1 VAL 71 11.222 -8.849 -12.278 594 2HG1 VAL 71 2HG1 VAL 71 11.629 -9.809 -10.835 595 3HG1 VAL 71 3HG1 VAL 71 10.275 -10.303 -11.880 596 1HG2 VAL 71 1HG2 VAL 71 8.172 -7.386 -11.197 597 2HG2 VAL 71 2HG2 VAL 71 9.744 -6.559 -11.307 598 3HG2 VAL 71 3HG2 VAL 71 9.287 -7.767 -12.531 599 H ILE 72 H ILE 72 9.165 -9.181 -7.416 600 HA ILE 72 HA ILE 72 10.847 -11.477 -7.119 601 HB ILE 72 HB ILE 72 9.858 -9.256 -5.401 602 1HG1 ILE 72 1HG1 ILE 72 12.005 -9.304 -6.828 603 2HG1 ILE 72 2HG1 ILE 72 12.105 -8.720 -5.178 604 1HG2 ILE 72 1HG2 ILE 72 9.520 -10.646 -3.671 605 2HG2 ILE 72 2HG2 ILE 72 10.401 -11.989 -4.438 606 3HG2 ILE 72 3HG2 ILE 72 11.297 -10.702 -3.597 607 1HD1 ILE 72 1HD1 ILE 72 13.821 -10.554 -6.132 608 2HD1 ILE 72 2HD1 ILE 72 13.290 -10.573 -4.433 609 3HD1 ILE 72 3HD1 ILE 72 12.529 -11.665 -5.615 610 H ASP 73 H ASP 73 7.478 -10.534 -6.219 611 HA ASP 73 HA ASP 73 6.932 -13.374 -6.020 612 1HB ASP 73 1HB ASP 73 5.264 -12.063 -4.108 613 2HB ASP 73 2HB ASP 73 6.509 -13.256 -3.799 614 H GLU 74 H GLU 74 5.051 -13.846 -7.196 615 HA GLU 74 HA GLU 74 3.617 -11.596 -8.260 616 1HB GLU 74 1HB GLU 74 2.794 -13.083 -9.902 617 2HB GLU 74 2HB GLU 74 4.415 -13.671 -9.590 618 1HG GLU 74 1HG GLU 74 3.461 -15.350 -7.965 619 2HG GLU 74 2HG GLU 74 1.849 -14.792 -8.367 620 H ASN 75 H ASN 75 3.479 -13.038 -5.366 621 HA ASN 75 HA ASN 75 0.572 -13.215 -5.372 622 1HB ASN 75 1HB ASN 75 2.297 -15.113 -4.480 623 2HB ASN 75 2HB ASN 75 2.230 -14.143 -3.023 624 1HD2 ASN 75 1HD2 ASN 75 1.215 -15.815 -1.917 625 2HD2 ASN 75 2HD2 ASN 75 -0.462 -16.197 -2.120 626 H ILE 76 H ILE 76 3.187 -11.188 -4.693 627 HA ILE 76 HA ILE 76 2.464 -10.194 -2.146 628 HB ILE 76 HB ILE 76 4.710 -10.065 -3.208 629 1HG1 ILE 76 1HG1 ILE 76 3.299 -7.763 -1.934 630 2HG1 ILE 76 2HG1 ILE 76 4.603 -8.761 -1.322 631 1HG2 ILE 76 1HG2 ILE 76 3.730 -7.670 -4.743 632 2HG2 ILE 76 2HG2 ILE 76 5.238 -8.598 -4.931 633 3HG2 ILE 76 3HG2 ILE 76 3.689 -9.300 -5.457 634 1HD1 ILE 76 1HD1 ILE 76 6.167 -7.692 -2.981 635 2HD1 ILE 76 2HD1 ILE 76 4.836 -6.625 -3.491 636 3HD1 ILE 76 3HD1 ILE 76 5.469 -6.526 -1.831 637 H ARG 77 H ARG 77 1.006 -8.646 -1.540 638 HA ARG 77 HA ARG 77 -0.516 -7.511 -3.742 639 1HB ARG 77 1HB ARG 77 -2.075 -8.713 -2.447 640 2HB ARG 77 2HB ARG 77 -1.234 -8.393 -0.943 641 1HG ARG 77 1HG ARG 77 -2.156 -6.239 -0.715 642 2HG ARG 77 2HG ARG 77 -2.422 -6.052 -2.437 643 1HD ARG 77 1HD ARG 77 -4.043 -7.724 -0.474 644 2HD ARG 77 2HD ARG 77 -4.600 -6.384 -1.456 645 HE ARG 77 HE ARG 77 -4.558 -7.798 -3.408 646 1HH1 ARG 77 1HH1 ARG 77 -3.630 -9.492 -0.466 647 2HH1 ARG 77 2HH1 ARG 77 -3.862 -11.067 -1.147 648 1HH2 ARG 77 1HH2 ARG 77 -4.864 -9.877 -4.308 649 2HH2 ARG 77 2HH2 ARG 77 -4.568 -11.288 -3.347 650 H VAL 78 H VAL 78 -0.050 -5.370 -4.133 651 HA VAL 78 HA VAL 78 0.318 -3.628 -1.825 652 HB VAL 78 HB VAL 78 2.285 -4.088 -4.054 653 1HG1 VAL 78 1HG1 VAL 78 1.897 -1.582 -2.401 654 2HG1 VAL 78 2HG1 VAL 78 3.456 -2.003 -3.149 655 3HG1 VAL 78 3HG1 VAL 78 2.022 -1.739 -4.170 656 1HG2 VAL 78 1HG2 VAL 78 2.188 -4.525 -1.163 657 2HG2 VAL 78 2HG2 VAL 78 3.282 -5.209 -2.389 658 3HG2 VAL 78 3HG2 VAL 78 3.632 -3.618 -1.672 659 H ILE 79 H ILE 79 -0.160 -1.376 -2.306 660 HA ILE 79 HA ILE 79 -1.635 -1.088 -4.831 661 HB ILE 79 HB ILE 79 -2.419 -0.582 -2.036 662 1HG1 ILE 79 1HG1 ILE 79 -3.703 -1.415 -4.618 663 2HG1 ILE 79 2HG1 ILE 79 -3.657 -2.246 -3.076 664 1HG2 ILE 79 1HG2 ILE 79 -3.827 1.326 -2.536 665 2HG2 ILE 79 2HG2 ILE 79 -2.123 1.725 -2.861 666 3HG2 ILE 79 3HG2 ILE 79 -3.226 1.368 -4.211 667 1HD1 ILE 79 1HD1 ILE 79 -5.211 0.320 -3.645 668 2HD1 ILE 79 2HD1 ILE 79 -5.910 -1.312 -3.514 669 3HD1 ILE 79 3HD1 ILE 79 -5.174 -0.541 -2.088 670 H ILE 80 H ILE 80 -1.348 0.839 -5.986 671 HA ILE 80 HA ILE 80 0.909 2.436 -5.019 672 HB ILE 80 HB ILE 80 1.510 2.826 -7.205 673 1HG1 ILE 80 1HG1 ILE 80 -0.113 2.150 -9.130 674 2HG1 ILE 80 2HG1 ILE 80 -1.362 2.245 -7.904 675 1HG2 ILE 80 1HG2 ILE 80 1.289 0.255 -6.370 676 2HG2 ILE 80 2HG2 ILE 80 0.383 0.185 -7.900 677 3HG2 ILE 80 3HG2 ILE 80 2.068 0.757 -7.889 678 1HD1 ILE 80 1HD1 ILE 80 -1.261 4.528 -7.789 679 2HD1 ILE 80 2HD1 ILE 80 0.516 4.549 -7.892 680 3HD1 ILE 80 3HD1 ILE 80 -0.459 4.392 -9.373 681 H MET 81 H MET 81 0.820 4.787 -5.289 682 HA MET 81 HA MET 81 -1.873 5.803 -5.628 683 1HB MET 81 1HB MET 81 -0.679 7.316 -3.510 684 2HB MET 81 2HB MET 81 -2.058 6.242 -3.384 685 1HG MET 81 1HG MET 81 -0.592 4.319 -2.922 686 2HG MET 81 2HG MET 81 0.840 5.282 -3.227 687 1HE MET 81 1HE MET 81 1.765 6.063 0.228 688 2HE MET 81 2HE MET 81 1.834 4.614 -0.804 689 3HE MET 81 3HE MET 81 2.153 6.220 -1.502 690 H THR 82 H THR 82 -1.895 7.616 -6.907 691 HA THR 82 HA THR 82 -0.086 9.698 -6.785 692 HB THR 82 HB THR 82 1.722 8.366 -7.573 693 HG1 THR 82 HG1 THR 82 1.630 10.081 -9.043 694 1HG2 THR 82 1HG2 THR 82 0.593 7.225 -10.011 695 2HG2 THR 82 2HG2 THR 82 1.430 6.389 -8.681 696 3HG2 THR 82 3HG2 THR 82 -0.328 6.657 -8.598 697 H ALA 83 H ALA 83 -0.661 11.407 -8.154 698 HA ALA 83 HA ALA 83 -3.296 11.409 -8.996 699 1HB ALA 83 1HB ALA 83 -1.589 13.303 -10.432 700 2HB ALA 83 2HB ALA 83 -2.855 13.608 -9.218 701 3HB ALA 83 3HB ALA 83 -1.195 13.232 -8.698 702 H TYR 84 H TYR 84 -4.164 11.664 -11.228 703 HA TYR 84 HA TYR 84 -3.288 9.542 -12.862 704 1HB TYR 84 1HB TYR 84 -5.073 10.549 -14.358 705 2HB TYR 84 2HB TYR 84 -5.630 10.430 -12.701 706 HD1 TYR 84 HD1 TYR 84 -5.874 12.452 -11.304 707 HD2 TYR 84 HD2 TYR 84 -4.672 12.708 -15.402 708 HE1 TYR 84 HE1 TYR 84 -6.403 14.939 -11.311 709 HE2 TYR 84 HE2 TYR 84 -5.205 15.194 -15.395 710 HH TYR 84 HH TYR 84 -7.006 16.644 -13.764 711 H GLY 85 H GLY 85 -3.776 11.022 -15.442 712 1HA GLY 85 1HA GLY 85 -2.656 12.246 -16.986 713 2HA GLY 85 2HA GLY 85 -1.636 12.912 -15.726 714 H GLU 86 H GLU 86 -0.355 10.782 -14.573 715 HA GLU 86 HA GLU 86 1.304 9.940 -16.761 716 1HB GLU 86 1HB GLU 86 2.732 9.019 -14.820 717 2HB GLU 86 2HB GLU 86 2.548 10.759 -14.914 718 1HG GLU 86 1HG GLU 86 1.175 10.867 -13.035 719 2HG GLU 86 2HG GLU 86 0.486 9.279 -13.308 720 H LEU 87 H LEU 87 -1.239 8.760 -16.921 721 HA LEU 87 HA LEU 87 -1.707 6.432 -15.619 722 1HB LEU 87 1HB LEU 87 -2.128 7.043 -18.548 723 2HB LEU 87 2HB LEU 87 -2.870 5.712 -17.682 724 HG LEU 87 HG LEU 87 -3.258 8.571 -16.795 725 1HD1 LEU 87 1HD1 LEU 87 -5.125 7.119 -18.677 726 2HD1 LEU 87 2HD1 LEU 87 -5.172 8.822 -18.159 727 3HD1 LEU 87 3HD1 LEU 87 -3.871 8.254 -19.233 728 1HD2 LEU 87 1HD2 LEU 87 -3.844 6.413 -15.415 729 2HD2 LEU 87 2HD2 LEU 87 -4.966 7.794 -15.471 730 3HD2 LEU 87 3HD2 LEU 87 -5.262 6.365 -16.491 731 H ASP 88 H ASP 88 0.751 7.113 -18.111 732 HA ASP 88 HA ASP 88 1.400 4.700 -19.000 733 1HB ASP 88 1HB ASP 88 2.876 7.187 -18.381 734 2HB ASP 88 2HB ASP 88 3.913 5.775 -18.359 735 H MET 89 H MET 89 2.363 6.188 -15.832 736 HA MET 89 HA MET 89 3.871 3.947 -15.032 737 1HB MET 89 1HB MET 89 3.712 6.553 -14.235 738 2HB MET 89 2HB MET 89 2.651 5.855 -13.027 739 1HG MET 89 1HG MET 89 5.204 4.365 -13.449 740 2HG MET 89 2HG MET 89 5.400 5.980 -12.798 741 1HE MET 89 1HE MET 89 5.643 4.153 -9.473 742 2HE MET 89 2HE MET 89 6.262 3.463 -10.992 743 3HE MET 89 3HE MET 89 6.390 5.213 -10.693 744 H ILE 90 H ILE 90 0.573 5.208 -14.198 745 HA ILE 90 HA ILE 90 -0.072 3.293 -12.318 746 HB ILE 90 HB ILE 90 -1.787 4.832 -14.265 747 1HG1 ILE 90 1HG1 ILE 90 -2.047 5.664 -11.545 748 2HG1 ILE 90 2HG1 ILE 90 -0.336 5.575 -11.913 749 1HG2 ILE 90 1HG2 ILE 90 -3.692 4.301 -12.856 750 2HG2 ILE 90 2HG2 ILE 90 -2.962 2.810 -13.498 751 3HG2 ILE 90 3HG2 ILE 90 -2.667 3.290 -11.809 752 1HD1 ILE 90 1HD1 ILE 90 -1.248 7.806 -12.484 753 2HD1 ILE 90 2HD1 ILE 90 -0.684 6.966 -13.949 754 3HD1 ILE 90 3HD1 ILE 90 -2.425 7.049 -13.585 755 H GLN 91 H GLN 91 -0.094 3.172 -15.892 756 HA GLN 91 HA GLN 91 -1.597 0.875 -16.146 757 1HB GLN 91 1HB GLN 91 0.320 2.416 -17.820 758 2HB GLN 91 2HB GLN 91 0.152 0.732 -18.273 759 1HG GLN 91 1HG GLN 91 -2.472 1.892 -17.704 760 2HG GLN 91 2HG GLN 91 -1.625 2.863 -18.891 761 1HE2 GLN 91 1HE2 GLN 91 -3.919 1.454 -19.478 762 2HE2 GLN 91 2HE2 GLN 91 -3.577 0.176 -20.596 763 H GLU 92 H GLU 92 2.026 1.248 -16.142 764 HA GLU 92 HA GLU 92 2.677 -1.361 -16.305 765 1HB GLU 92 1HB GLU 92 3.952 1.103 -15.341 766 2HB GLU 92 2HB GLU 92 4.546 -0.305 -14.484 767 1HG GLU 92 1HG GLU 92 5.919 -0.629 -16.272 768 2HG GLU 92 2HG GLU 92 4.498 -1.221 -17.109 769 H SER 93 H SER 93 1.982 0.526 -13.283 770 HA SER 93 HA SER 93 2.500 -1.382 -11.458 771 1HB SER 93 1HB SER 93 0.221 -0.204 -10.414 772 2HB SER 93 2HB SER 93 1.842 0.450 -10.293 773 HG SER 93 HG SER 93 1.328 2.033 -11.647 774 H LYS 94 H LYS 94 -0.302 -1.098 -13.660 775 HA LYS 94 HA LYS 94 -1.911 -3.011 -12.358 776 1HB LYS 94 1HB LYS 94 -2.202 -1.195 -14.437 777 2HB LYS 94 2HB LYS 94 -2.306 -2.744 -15.249 778 1HG LYS 94 1HG LYS 94 -3.812 -2.909 -12.781 779 2HG LYS 94 2HG LYS 94 -4.301 -1.455 -13.627 780 1HD LYS 94 1HD LYS 94 -4.122 -3.418 -15.656 781 2HD LYS 94 2HD LYS 94 -4.839 -4.262 -14.299 782 1HE LYS 94 1HE LYS 94 -6.769 -3.360 -15.222 783 2HE LYS 94 2HE LYS 94 -6.348 -2.046 -14.142 784 1HZ LYS 94 1HZ LYS 94 -4.960 -1.336 -16.229 785 2HZ LYS 94 2HZ LYS 94 -6.112 -2.184 -17.016 786 3HZ LYS 94 3HZ LYS 94 -6.532 -0.925 -16.065 787 H GLU 95 H GLU 95 0.322 -3.193 -15.213 788 HA GLU 95 HA GLU 95 -0.061 -5.941 -15.526 789 1HB GLU 95 1HB GLU 95 1.345 -5.714 -17.329 790 2HB GLU 95 2HB GLU 95 1.022 -4.011 -17.071 791 1HG GLU 95 1HG GLU 95 3.081 -4.010 -15.495 792 2HG GLU 95 2HG GLU 95 3.450 -5.597 -16.138 793 H LEU 96 H LEU 96 1.636 -4.100 -13.164 794 HA LEU 96 HA LEU 96 3.740 -5.967 -12.694 795 1HB LEU 96 1HB LEU 96 2.852 -3.382 -11.699 796 2HB LEU 96 2HB LEU 96 3.381 -4.434 -10.401 797 HG LEU 96 HG LEU 96 5.541 -4.777 -11.590 798 1HD1 LEU 96 1HD1 LEU 96 4.892 -2.473 -13.396 799 2HD1 LEU 96 2HD1 LEU 96 6.129 -3.742 -13.562 800 3HD1 LEU 96 3HD1 LEU 96 4.416 -4.124 -13.860 801 1HD2 LEU 96 1HD2 LEU 96 6.424 -2.471 -11.171 802 2HD2 LEU 96 2HD2 LEU 96 4.747 -1.940 -10.896 803 3HD2 LEU 96 3HD2 LEU 96 5.480 -3.164 -9.830 804 H GLY 97 H GLY 97 0.345 -5.798 -11.971 805 1HA GLY 97 1HA GLY 97 -0.786 -7.694 -11.173 806 2HA GLY 97 2HA GLY 97 0.634 -8.174 -10.266 807 H ALA 98 H ALA 98 -0.433 -4.779 -10.311 808 HA ALA 98 HA ALA 98 -0.746 -4.865 -7.456 809 1HB ALA 98 1HB ALA 98 0.399 -2.990 -8.506 810 2HB ALA 98 2HB ALA 98 -1.018 -2.652 -9.529 811 3HB ALA 98 3HB ALA 98 -1.112 -2.407 -7.769 812 H LEU 99 H LEU 99 -2.679 -4.420 -6.284 813 HA LEU 99 HA LEU 99 -4.982 -5.554 -7.385 814 1HB LEU 99 1HB LEU 99 -5.123 -3.698 -5.054 815 2HB LEU 99 2HB LEU 99 -5.937 -5.227 -5.325 816 HG LEU 99 HG LEU 99 -4.470 -5.880 -3.720 817 1HD1 LEU 99 1HD1 LEU 99 -3.144 -7.411 -4.686 818 2HD1 LEU 99 2HD1 LEU 99 -3.840 -6.799 -6.206 819 3HD1 LEU 99 3HD1 LEU 99 -2.261 -6.199 -5.645 820 1HD2 LEU 99 1HD2 LEU 99 -1.953 -4.853 -3.971 821 2HD2 LEU 99 2HD2 LEU 99 -2.951 -3.507 -4.574 822 3HD2 LEU 99 3HD2 LEU 99 -3.240 -4.171 -2.948 823 H THR 100 H THR 100 -4.140 -2.095 -6.668 824 HA THR 100 HA THR 100 -5.556 -1.235 -8.995 825 HB THR 100 HB THR 100 -7.475 -1.650 -7.462 826 HG1 THR 100 HG1 THR 100 -8.243 0.476 -7.841 827 1HG2 THR 100 1HG2 THR 100 -7.402 0.338 -5.568 828 2HG2 THR 100 2HG2 THR 100 -6.971 -1.353 -5.217 829 3HG2 THR 100 3HG2 THR 100 -5.694 -0.163 -5.565 830 H HIS 101 H HIS 101 -5.839 1.412 -8.600 831 HA HIS 101 HA HIS 101 -3.398 2.320 -7.316 832 1HB HIS 101 1HB HIS 101 -3.959 3.279 -10.104 833 2HB HIS 101 2HB HIS 101 -2.461 3.315 -9.195 834 HD1 HIS 101 HD1 HIS 101 -3.813 1.673 -11.997 835 HD2 HIS 101 HD2 HIS 101 -1.684 0.329 -8.641 836 HE1 HIS 101 HE1 HIS 101 -2.807 -0.582 -12.644 837 H PHE 102 H PHE 102 -3.761 4.179 -6.187 838 HA PHE 102 HA PHE 102 -6.313 5.512 -6.721 839 1HB PHE 102 1HB PHE 102 -4.397 5.561 -4.313 840 2HB PHE 102 2HB PHE 102 -5.992 6.287 -4.341 841 HD1 PHE 102 HD1 PHE 102 -4.625 3.984 -2.594 842 HD2 PHE 102 HD2 PHE 102 -7.494 4.073 -5.719 843 HE1 PHE 102 HE1 PHE 102 -5.615 1.840 -1.746 844 HE2 PHE 102 HE2 PHE 102 -8.484 1.928 -4.871 845 HZ PHE 102 HZ PHE 102 -7.533 0.837 -2.894 846 H ALA 103 H ALA 103 -6.394 7.888 -6.556 847 HA ALA 103 HA ALA 103 -3.838 9.061 -7.404 848 1HB ALA 103 1HB ALA 103 -6.550 10.304 -7.867 849 2HB ALA 103 2HB ALA 103 -5.049 10.487 -8.806 850 3HB ALA 103 3HB ALA 103 -5.986 8.978 -8.912 851 H LYS 104 H LYS 104 -3.193 11.094 -6.501 852 HA LYS 104 HA LYS 104 -3.126 11.492 -3.958 853 1HB LYS 104 1HB LYS 104 -3.088 13.262 -6.243 854 2HB LYS 104 2HB LYS 104 -3.783 14.088 -4.863 855 1HG LYS 104 1HG LYS 104 -1.833 13.495 -3.468 856 2HG LYS 104 2HG LYS 104 -1.156 12.532 -4.766 857 1HD LYS 104 1HD LYS 104 -0.865 14.521 -6.176 858 2HD LYS 104 2HD LYS 104 -1.725 15.521 -5.021 859 1HE LYS 104 1HE LYS 104 0.362 14.233 -3.549 860 2HE LYS 104 2HE LYS 104 1.091 14.775 -5.047 861 1HZ LYS 104 1HZ LYS 104 -0.003 16.952 -4.589 862 2HZ LYS 104 2HZ LYS 104 -0.362 16.405 -3.093 863 3HZ LYS 104 3HZ LYS 104 1.197 16.549 -3.557 864 HA PRO 105 HA PRO 105 -7.470 13.247 -3.489 865 1HB PRO 105 1HB PRO 105 -9.143 13.482 -5.637 866 2HB PRO 105 2HB PRO 105 -8.139 14.796 -5.056 867 1HG PRO 105 1HG PRO 105 -7.768 13.097 -7.447 868 2HG PRO 105 2HG PRO 105 -7.045 14.651 -7.082 869 1HD PRO 105 1HD PRO 105 -5.780 12.083 -6.895 870 2HD PRO 105 2HD PRO 105 -5.097 13.625 -6.420 871 H PHE 106 H PHE 106 -7.684 11.366 -2.278 872 HA PHE 106 HA PHE 106 -9.500 9.491 -3.613 873 1HB PHE 106 1HB PHE 106 -8.116 7.925 -1.828 874 2HB PHE 106 2HB PHE 106 -7.593 8.129 -3.488 875 HD1 PHE 106 HD1 PHE 106 -5.312 8.345 -3.635 876 HD2 PHE 106 HD2 PHE 106 -7.314 10.225 -0.400 877 HE1 PHE 106 HE1 PHE 106 -3.129 9.288 -2.831 878 HE2 PHE 106 HE2 PHE 106 -5.131 11.167 0.403 879 HZ PHE 106 HZ PHE 106 -3.065 10.688 -0.822 880 H ASP 107 H ASP 107 -10.929 8.296 -2.132 881 HA ASP 107 HA ASP 107 -11.302 9.814 0.327 882 1HB ASP 107 1HB ASP 107 -13.095 9.496 -1.710 883 2HB ASP 107 2HB ASP 107 -13.490 8.074 -0.766 884 H ILE 108 H ILE 108 -11.646 8.582 2.291 885 HA ILE 108 HA ILE 108 -10.525 5.967 2.252 886 HB ILE 108 HB ILE 108 -11.431 7.939 4.262 887 1HG1 ILE 108 1HG1 ILE 108 -9.271 7.698 5.112 888 2HG1 ILE 108 2HG1 ILE 108 -9.071 6.085 4.458 889 1HG2 ILE 108 1HG2 ILE 108 -11.212 6.179 6.072 890 2HG2 ILE 108 2HG2 ILE 108 -12.711 6.143 5.112 891 3HG2 ILE 108 3HG2 ILE 108 -11.418 4.963 4.788 892 1HD1 ILE 108 1HD1 ILE 108 -7.853 8.051 3.256 893 2HD1 ILE 108 2HD1 ILE 108 -8.729 6.877 2.245 894 3HD1 ILE 108 3HD1 ILE 108 -9.459 8.460 2.606 895 H ASP 109 H ASP 109 -13.735 7.340 1.963 896 HA ASP 109 HA ASP 109 -15.119 5.112 2.946 897 1HB ASP 109 1HB ASP 109 -15.742 7.692 2.005 898 2HB ASP 109 2HB ASP 109 -16.494 6.636 0.826 899 H GLU 110 H GLU 110 -13.844 6.183 -0.241 900 HA GLU 110 HA GLU 110 -15.173 4.136 -1.676 901 1HB GLU 110 1HB GLU 110 -13.907 4.951 -3.596 902 2HB GLU 110 2HB GLU 110 -14.501 6.324 -2.683 903 1HG GLU 110 1HG GLU 110 -12.388 6.967 -1.993 904 2HG GLU 110 2HG GLU 110 -11.806 5.319 -1.866 905 H ILE 111 H ILE 111 -12.196 4.427 0.166 906 HA ILE 111 HA ILE 111 -10.898 2.226 -1.132 907 HB ILE 111 HB ILE 111 -10.324 4.059 1.148 908 1HG1 ILE 111 1HG1 ILE 111 -8.520 3.188 -1.111 909 2HG1 ILE 111 2HG1 ILE 111 -9.734 4.432 -1.332 910 1HG2 ILE 111 1HG2 ILE 111 -8.971 1.388 0.707 911 2HG2 ILE 111 2HG2 ILE 111 -8.268 2.722 1.653 912 3HG2 ILE 111 3HG2 ILE 111 -9.794 1.969 2.174 913 1HD1 ILE 111 1HD1 ILE 111 -7.685 5.558 -0.737 914 2HD1 ILE 111 2HD1 ILE 111 -8.739 5.637 0.695 915 3HD1 ILE 111 3HD1 ILE 111 -7.407 4.459 0.635 916 H ARG 112 H ARG 112 -13.337 2.678 1.314 917 HA ARG 112 HA ARG 112 -12.767 0.321 2.734 918 1HB ARG 112 1HB ARG 112 -15.372 1.915 2.515 919 2HB ARG 112 2HB ARG 112 -15.049 0.688 3.724 920 1HG ARG 112 1HG ARG 112 -12.833 2.517 3.778 921 2HG ARG 112 2HG ARG 112 -14.292 3.487 3.741 922 1HD ARG 112 1HD ARG 112 -14.157 3.131 6.033 923 2HD ARG 112 2HD ARG 112 -15.113 1.727 5.599 924 HE ARG 112 HE ARG 112 -12.289 1.130 5.387 925 1HH1 ARG 112 1HH1 ARG 112 -14.875 1.551 7.736 926 2HH1 ARG 112 2HH1 ARG 112 -14.132 0.536 8.926 927 1HH2 ARG 112 1HH2 ARG 112 -11.308 -0.210 6.957 928 2HH2 ARG 112 2HH2 ARG 112 -12.090 -0.473 8.480 929 H ASP 113 H ASP 113 -14.269 1.052 -0.321 930 HA ASP 113 HA ASP 113 -15.958 -1.244 -0.316 931 1HB ASP 113 1HB ASP 113 -15.703 1.152 -1.830 932 2HB ASP 113 2HB ASP 113 -15.361 -0.141 -2.962 933 H ALA 114 H ALA 114 -12.955 -0.086 -2.021 934 HA ALA 114 HA ALA 114 -12.516 -2.436 -3.473 935 1HB ALA 114 1HB ALA 114 -11.176 -0.851 -4.367 936 2HB ALA 114 2HB ALA 114 -11.142 0.090 -2.856 937 3HB ALA 114 3HB ALA 114 -10.024 -1.277 -3.079 938 H VAL 115 H VAL 115 -11.897 -1.507 -0.112 939 HA VAL 115 HA VAL 115 -9.903 -3.385 0.450 940 HB VAL 115 HB VAL 115 -11.939 -1.863 2.045 941 1HG1 VAL 115 1HG1 VAL 115 -10.528 -4.294 2.888 942 2HG1 VAL 115 2HG1 VAL 115 -10.219 -2.896 3.946 943 3HG1 VAL 115 3HG1 VAL 115 -11.889 -3.435 3.647 944 1HG2 VAL 115 1HG2 VAL 115 -10.244 -0.429 2.512 945 2HG2 VAL 115 2HG2 VAL 115 -9.026 -1.724 2.604 946 3HG2 VAL 115 3HG2 VAL 115 -9.552 -1.108 1.019 947 H LYS 116 H LYS 116 -13.494 -3.555 0.407 948 HA LYS 116 HA LYS 116 -13.696 -6.072 1.602 949 1HB LYS 116 1HB LYS 116 -15.564 -4.497 1.379 950 2HB LYS 116 2HB LYS 116 -15.537 -4.677 -0.364 951 1HG LYS 116 1HG LYS 116 -15.691 -7.242 1.156 952 2HG LYS 116 2HG LYS 116 -17.088 -6.199 1.334 953 1HD LYS 116 1HD LYS 116 -17.078 -5.994 -1.253 954 2HD LYS 116 2HD LYS 116 -15.926 -7.314 -1.252 955 1HE LYS 116 1HE LYS 116 -17.688 -8.558 0.260 956 2HE LYS 116 2HE LYS 116 -18.814 -7.342 -0.310 957 1HZ LYS 116 1HZ LYS 116 -17.365 -8.343 -2.475 958 2HZ LYS 116 2HZ LYS 116 -17.983 -9.601 -1.636 959 3HZ LYS 116 3HZ LYS 116 -18.973 -8.430 -2.199 960 H LYS 117 H LYS 117 -12.334 -5.100 -1.399 961 HA LYS 117 HA LYS 117 -12.719 -7.798 -2.484 962 1HB LYS 117 1HB LYS 117 -12.150 -5.138 -3.804 963 2HB LYS 117 2HB LYS 117 -11.915 -6.662 -4.636 964 1HG LYS 117 1HG LYS 117 -14.143 -6.886 -5.008 965 2HG LYS 117 2HG LYS 117 -14.506 -6.678 -3.306 966 1HD LYS 117 1HD LYS 117 -15.618 -4.861 -4.379 967 2HD LYS 117 2HD LYS 117 -14.182 -4.143 -3.678 968 1HE LYS 117 1HE LYS 117 -13.919 -3.280 -5.797 969 2HE LYS 117 2HE LYS 117 -13.155 -4.828 -6.102 970 1HZ LYS 117 1HZ LYS 117 -14.786 -4.460 -7.744 971 2HZ LYS 117 2HZ LYS 117 -15.367 -5.641 -6.777 972 3HZ LYS 117 3HZ LYS 117 -15.950 -4.121 -6.650 973 H TYR 118 H TYR 118 -10.427 -5.435 -1.212 974 HA TYR 118 HA TYR 118 -8.137 -6.887 -2.195 975 1HB TYR 118 1HB TYR 118 -7.418 -4.704 -1.831 976 2HB TYR 118 2HB TYR 118 -8.902 -4.327 -0.980 977 HD1 TYR 118 HD1 TYR 118 -8.291 -3.143 0.934 978 HD2 TYR 118 HD2 TYR 118 -6.134 -6.694 -0.086 979 HE1 TYR 118 HE1 TYR 118 -6.994 -2.991 3.116 980 HE2 TYR 118 HE2 TYR 118 -4.844 -6.530 2.099 981 HH TYR 118 HH TYR 118 -4.676 -5.518 4.015 982 H LEU 119 H LEU 119 -9.737 -6.246 0.998 983 HA LEU 119 HA LEU 119 -8.494 -8.719 1.947 984 1HB LEU 119 1HB LEU 119 -7.703 -6.139 2.727 985 2HB LEU 119 2HB LEU 119 -8.677 -6.750 4.049 986 HG LEU 119 HG LEU 119 -6.024 -7.170 3.800 987 1HD1 LEU 119 1HD1 LEU 119 -6.520 -7.904 5.834 988 2HD1 LEU 119 2HD1 LEU 119 -8.197 -8.263 5.357 989 3HD1 LEU 119 3HD1 LEU 119 -6.922 -9.482 5.114 990 1HD2 LEU 119 1HD2 LEU 119 -6.577 -8.564 1.699 991 2HD2 LEU 119 2HD2 LEU 119 -5.435 -9.230 2.891 992 3HD2 LEU 119 3HD2 LEU 119 -7.118 -9.809 2.850 993 HA PRO 120 HA PRO 120 -12.526 -9.457 3.306 994 1HB PRO 120 1HB PRO 120 -12.096 -11.483 5.089 995 2HB PRO 120 2HB PRO 120 -12.165 -11.730 3.355 996 1HG PRO 120 1HG PRO 120 -9.801 -11.698 5.130 997 2HG PRO 120 2HG PRO 120 -9.949 -12.350 3.510 998 1HD PRO 120 1HD PRO 120 -8.690 -9.884 4.260 999 2HD PRO 120 2HD PRO 120 -8.940 -10.481 2.631 1000 H LEU 121 H LEU 121 -11.925 -7.113 4.255 1001 HA LEU 121 HA LEU 121 -12.102 -7.317 7.153 1002 1HB LEU 121 1HB LEU 121 -10.440 -5.825 6.387 1003 2HB LEU 121 2HB LEU 121 -11.523 -5.073 5.232 1004 HG LEU 121 HG LEU 121 -12.864 -4.179 7.160 1005 1HD1 LEU 121 1HD1 LEU 121 -11.478 -6.003 8.674 1006 2HD1 LEU 121 2HD1 LEU 121 -10.662 -4.473 9.075 1007 3HD1 LEU 121 3HD1 LEU 121 -12.420 -4.631 9.304 1008 1HD2 LEU 121 1HD2 LEU 121 -11.622 -2.273 7.246 1009 2HD2 LEU 121 2HD2 LEU 121 -10.093 -3.141 7.525 1010 3HD2 LEU 121 3HD2 LEU 121 -10.799 -3.084 5.892 1011 H LYS 122 H LYS 122 -13.693 -5.740 8.241 1012 HA LYS 122 HA LYS 122 -16.254 -6.492 7.654 1013 1HB LYS 122 1HB LYS 122 -15.681 -5.609 9.801 1014 2HB LYS 122 2HB LYS 122 -15.172 -4.077 9.120 1015 1HG LYS 122 1HG LYS 122 -17.941 -4.782 8.362 1016 2HG LYS 122 2HG LYS 122 -17.730 -4.674 10.098 1017 1HD LYS 122 1HD LYS 122 -16.806 -2.403 9.903 1018 2HD LYS 122 2HD LYS 122 -16.805 -2.509 8.154 1019 1HE LYS 122 1HE LYS 122 -19.378 -2.929 8.363 1020 2HE LYS 122 2HE LYS 122 -19.209 -2.367 10.014 1021 1HZ LYS 122 1HZ LYS 122 -17.991 -0.725 7.983 1022 2HZ LYS 122 2HZ LYS 122 -19.624 -0.753 7.999 1023 3HZ LYS 122 3HZ LYS 122 -18.802 -0.285 9.331 1024 H SER 123 H SER 123 -17.638 -6.074 6.023 1025 HA SER 123 HA SER 123 -16.970 -4.561 3.879 1026 1HB SER 123 1HB SER 123 -18.841 -6.278 4.093 1027 2HB SER 123 2HB SER 123 -19.818 -5.038 4.853 1028 HG SER 123 HG SER 123 -19.552 -5.495 2.238 1029 H ASN 124 H ASN 124 -17.484 -2.420 3.140 1030 HA ASN 124 HA ASN 124 -17.420 -0.482 5.098 1031 1HB ASN 124 1HB ASN 124 -16.642 -0.077 2.785 1032 2HB ASN 124 2HB ASN 124 -18.258 -0.329 2.156 1033 1HD2 ASN 124 1HD2 ASN 124 -18.172 1.725 1.206 1034 2HD2 ASN 124 2HD2 ASN 124 -18.434 3.178 2.112 Start of MODEL 6 1 1H MET 1 1H MET 1 -4.589 -17.636 11.841 2 HA MET 1 HA MET 1 -7.129 -17.849 12.123 3 1HB MET 1 1HB MET 1 -4.965 -17.789 14.259 4 2HB MET 1 2HB MET 1 -6.620 -18.089 14.753 5 1HG MET 1 1HG MET 1 -6.749 -20.000 13.125 6 2HG MET 1 2HG MET 1 -5.085 -19.708 12.661 7 1HE MET 1 1HE MET 1 -4.021 -22.612 14.409 8 2HE MET 1 2HE MET 1 -5.777 -22.843 14.230 9 3HE MET 1 3HE MET 1 -4.857 -21.996 12.963 10 H MET 2 H MET 2 -7.895 -15.598 11.460 11 HA MET 2 HA MET 2 -9.057 -13.819 11.925 12 1HB MET 2 1HB MET 2 -9.168 -15.384 14.433 13 2HB MET 2 2HB MET 2 -9.317 -13.667 14.751 14 1HG MET 2 1HG MET 2 -11.080 -13.675 12.798 15 2HG MET 2 2HG MET 2 -11.100 -15.414 13.015 16 1HE MET 2 1HE MET 2 -11.852 -11.959 14.416 17 2HE MET 2 2HE MET 2 -13.280 -12.721 13.676 18 3HE MET 2 3HE MET 2 -13.275 -12.343 15.415 19 H ASN 3 H ASN 3 -7.652 -12.160 11.355 20 HA ASN 3 HA ASN 3 -6.766 -10.478 13.331 21 1HB ASN 3 1HB ASN 3 -4.330 -10.747 13.276 22 2HB ASN 3 2HB ASN 3 -5.033 -12.292 13.711 23 1HD2 ASN 3 1HD2 ASN 3 -4.356 -13.998 12.669 24 2HD2 ASN 3 2HD2 ASN 3 -3.606 -14.048 11.108 25 H GLU 4 H GLU 4 -4.477 -9.316 11.964 26 HA GLU 4 HA GLU 4 -4.819 -9.230 9.212 27 1HB GLU 4 1HB GLU 4 -6.759 -7.679 10.627 28 2HB GLU 4 2HB GLU 4 -5.625 -6.538 9.932 29 1HG GLU 4 1HG GLU 4 -6.266 -7.007 7.778 30 2HG GLU 4 2HG GLU 4 -6.383 -8.729 8.078 31 H LYS 5 H LYS 5 -3.293 -7.698 8.195 32 HA LYS 5 HA LYS 5 -1.616 -6.192 10.011 33 1HB LYS 5 1HB LYS 5 -0.695 -8.670 8.572 34 2HB LYS 5 2HB LYS 5 0.426 -7.355 8.862 35 1HG LYS 5 1HG LYS 5 0.723 -8.140 10.967 36 2HG LYS 5 2HG LYS 5 -0.932 -7.690 11.327 37 1HD LYS 5 1HD LYS 5 -1.017 -9.967 11.821 38 2HD LYS 5 2HD LYS 5 -1.517 -10.002 10.142 39 1HE LYS 5 1HE LYS 5 0.454 -10.979 9.424 40 2HE LYS 5 2HE LYS 5 1.438 -10.108 10.584 41 1HZ LYS 5 1HZ LYS 5 1.456 -12.217 11.403 42 2HZ LYS 5 2HZ LYS 5 0.210 -11.600 12.260 43 3HZ LYS 5 3HZ LYS 5 -0.082 -12.557 10.970 44 H ILE 6 H ILE 6 -0.642 -4.425 9.001 45 HA ILE 6 HA ILE 6 -0.841 -4.299 6.099 46 HB ILE 6 HB ILE 6 -2.568 -2.884 7.955 47 1HG1 ILE 6 1HG1 ILE 6 -3.599 -2.304 5.609 48 2HG1 ILE 6 2HG1 ILE 6 -2.459 -3.494 5.014 49 1HG2 ILE 6 1HG2 ILE 6 -2.427 -0.676 6.993 50 2HG2 ILE 6 2HG2 ILE 6 -0.846 -1.124 7.677 51 3HG2 ILE 6 3HG2 ILE 6 -1.105 -1.186 5.917 52 1HD1 ILE 6 1HD1 ILE 6 -3.645 -5.235 5.882 53 2HD1 ILE 6 2HD1 ILE 6 -3.891 -4.402 7.436 54 3HD1 ILE 6 3HD1 ILE 6 -4.970 -4.060 6.062 55 H LEU 7 H LEU 7 0.476 -2.471 5.209 56 HA LEU 7 HA LEU 7 2.516 -1.585 7.113 57 1HB LEU 7 1HB LEU 7 2.900 -3.601 5.225 58 2HB LEU 7 2HB LEU 7 3.601 -2.175 4.487 59 HG LEU 7 HG LEU 7 5.015 -1.831 6.484 60 1HD1 LEU 7 1HD1 LEU 7 5.039 -4.200 7.860 61 2HD1 LEU 7 2HD1 LEU 7 4.243 -2.701 8.396 62 3HD1 LEU 7 3HD1 LEU 7 3.301 -3.960 7.562 63 1HD2 LEU 7 1HD2 LEU 7 5.172 -4.092 4.640 64 2HD2 LEU 7 2HD2 LEU 7 6.417 -2.920 5.135 65 3HD2 LEU 7 3HD2 LEU 7 6.093 -4.352 6.141 66 H ILE 8 H ILE 8 3.406 0.476 6.669 67 HA ILE 8 HA ILE 8 2.093 1.882 4.451 68 HB ILE 8 HB ILE 8 2.458 2.751 7.310 69 1HG1 ILE 8 1HG1 ILE 8 -0.059 2.991 5.693 70 2HG1 ILE 8 2HG1 ILE 8 0.395 1.427 6.340 71 1HG2 ILE 8 1HG2 ILE 8 1.936 4.981 6.756 72 2HG2 ILE 8 2HG2 ILE 8 3.223 4.497 5.625 73 3HG2 ILE 8 3HG2 ILE 8 1.531 4.558 5.075 74 1HD1 ILE 8 1HD1 ILE 8 0.562 3.758 8.224 75 2HD1 ILE 8 2HD1 ILE 8 -1.063 3.198 7.759 76 3HD1 ILE 8 3HD1 ILE 8 0.076 2.075 8.540 77 H VAL 9 H VAL 9 3.436 3.031 3.123 78 HA VAL 9 HA VAL 9 6.156 3.505 4.097 79 HB VAL 9 HB VAL 9 5.458 2.364 1.385 80 1HG1 VAL 9 1HG1 VAL 9 8.183 1.974 2.051 81 2HG1 VAL 9 2HG1 VAL 9 7.501 3.031 0.793 82 3HG1 VAL 9 3HG1 VAL 9 7.804 3.672 2.426 83 1HG2 VAL 9 1HG2 VAL 9 5.107 0.793 3.352 84 2HG2 VAL 9 2HG2 VAL 9 6.258 0.246 2.108 85 3HG2 VAL 9 3HG2 VAL 9 6.859 0.913 3.645 86 H ASP 10 H ASP 10 6.929 5.527 3.606 87 HA ASP 10 HA ASP 10 6.705 7.655 3.137 88 1HB ASP 10 1HB ASP 10 5.870 7.301 0.333 89 2HB ASP 10 2HB ASP 10 7.352 7.986 0.970 90 H ASP 11 H ASP 11 5.122 9.007 1.062 91 HA ASP 11 HA ASP 11 3.174 9.898 0.731 92 1HB ASP 11 1HB ASP 11 2.640 7.417 0.148 93 2HB ASP 11 2HB ASP 11 1.851 7.334 1.711 94 H GLN 12 H GLN 12 4.433 9.384 3.622 95 HA GLN 12 HA GLN 12 2.126 9.605 5.286 96 1HB GLN 12 1HB GLN 12 3.989 9.997 7.073 97 2HB GLN 12 2HB GLN 12 3.868 8.417 6.324 98 1HG GLN 12 1HG GLN 12 5.811 8.701 5.060 99 2HG GLN 12 2HG GLN 12 5.623 10.440 4.955 100 1HE2 GLN 12 1HE2 GLN 12 5.591 11.513 7.241 101 2HE2 GLN 12 2HE2 GLN 12 6.904 11.084 8.285 102 H TYR 13 H TYR 13 1.026 11.496 5.544 103 HA TYR 13 HA TYR 13 2.423 13.896 6.160 104 1HB TYR 13 1HB TYR 13 1.901 13.198 3.410 105 2HB TYR 13 2HB TYR 13 0.676 14.381 3.824 106 HD1 TYR 13 HD1 TYR 13 1.507 16.606 4.905 107 HD2 TYR 13 HD2 TYR 13 4.048 13.899 2.780 108 HE1 TYR 13 HE1 TYR 13 3.193 18.471 4.530 109 HE2 TYR 13 HE2 TYR 13 5.725 15.773 2.412 110 HH TYR 13 HH TYR 13 5.462 18.424 2.287 111 H GLY 14 H GLY 14 0.339 12.076 7.263 112 1HA GLY 14 1HA GLY 14 -1.324 12.911 8.749 113 2HA GLY 14 2HA GLY 14 -1.794 14.095 7.546 114 H ILE 15 H ILE 15 -1.205 11.522 5.614 115 HA ILE 15 HA ILE 15 -4.007 10.750 5.651 116 HB ILE 15 HB ILE 15 -1.772 10.529 3.655 117 1HG1 ILE 15 1HG1 ILE 15 -4.282 11.555 2.679 118 2HG1 ILE 15 2HG1 ILE 15 -3.839 12.406 4.146 119 1HG2 ILE 15 1HG2 ILE 15 -2.728 8.435 3.338 120 2HG2 ILE 15 2HG2 ILE 15 -4.368 9.009 3.728 121 3HG2 ILE 15 3HG2 ILE 15 -3.611 9.461 2.182 122 1HD1 ILE 15 1HD1 ILE 15 -2.785 13.605 2.356 123 2HD1 ILE 15 2HD1 ILE 15 -1.483 12.673 3.135 124 3HD1 ILE 15 3HD1 ILE 15 -2.191 12.104 1.604 125 H ARG 16 H ARG 16 -0.694 9.382 5.978 126 HA ARG 16 HA ARG 16 -1.296 6.759 5.971 127 1HB ARG 16 1HB ARG 16 0.659 6.593 7.701 128 2HB ARG 16 2HB ARG 16 1.004 7.329 6.149 129 1HG ARG 16 1HG ARG 16 0.996 9.536 7.044 130 2HG ARG 16 2HG ARG 16 0.092 9.060 8.468 131 1HD ARG 16 1HD ARG 16 2.776 7.757 8.050 132 2HD ARG 16 2HD ARG 16 2.772 9.444 8.522 133 HE ARG 16 HE ARG 16 0.997 7.748 10.141 134 1HH1 ARG 16 1HH1 ARG 16 4.241 9.068 9.796 135 2HH1 ARG 16 2HH1 ARG 16 4.633 8.881 11.473 136 1HH2 ARG 16 1HH2 ARG 16 1.515 7.500 12.353 137 2HH2 ARG 16 2HH2 ARG 16 3.072 7.983 12.937 138 H ILE 17 H ILE 17 -1.768 9.173 8.585 139 HA ILE 17 HA ILE 17 -2.379 7.295 10.602 140 HB ILE 17 HB ILE 17 -2.998 10.235 10.307 141 1HG1 ILE 17 1HG1 ILE 17 -0.928 9.089 12.148 142 2HG1 ILE 17 2HG1 ILE 17 -0.554 9.230 10.442 143 1HG2 ILE 17 1HG2 ILE 17 -3.318 10.170 12.786 144 2HG2 ILE 17 2HG2 ILE 17 -4.585 9.335 11.855 145 3HG2 ILE 17 3HG2 ILE 17 -3.325 8.392 12.687 146 1HD1 ILE 17 1HD1 ILE 17 -0.362 11.497 10.556 147 2HD1 ILE 17 2HD1 ILE 17 -1.852 11.656 11.517 148 3HD1 ILE 17 3HD1 ILE 17 -0.311 11.269 12.320 149 H LEU 18 H LEU 18 -4.379 9.266 8.317 150 HA LEU 18 HA LEU 18 -6.859 8.667 9.208 151 1HB LEU 18 1HB LEU 18 -5.965 10.043 7.178 152 2HB LEU 18 2HB LEU 18 -6.248 8.567 6.275 153 HG LEU 18 HG LEU 18 -8.643 8.753 7.465 154 1HD1 LEU 18 1HD1 LEU 18 -7.556 11.568 7.437 155 2HD1 LEU 18 2HD1 LEU 18 -9.300 11.220 7.344 156 3HD1 LEU 18 3HD1 LEU 18 -8.360 10.690 8.760 157 1HD2 LEU 18 1HD2 LEU 18 -8.613 10.572 5.199 158 2HD2 LEU 18 2HD2 LEU 18 -7.610 9.130 4.907 159 3HD2 LEU 18 3HD2 LEU 18 -9.322 8.947 5.356 160 H LEU 19 H LEU 19 -4.873 6.646 6.936 161 HA LEU 19 HA LEU 19 -6.796 4.537 7.030 162 1HB LEU 19 1HB LEU 19 -5.454 3.457 5.483 163 2HB LEU 19 2HB LEU 19 -5.284 5.159 5.101 164 HG LEU 19 HG LEU 19 -3.187 4.589 6.894 165 1HD1 LEU 19 1HD1 LEU 19 -3.347 2.248 6.657 166 2HD1 LEU 19 2HD1 LEU 19 -3.608 2.360 4.900 167 3HD1 LEU 19 3HD1 LEU 19 -2.015 2.751 5.589 168 1HD2 LEU 19 1HD2 LEU 19 -3.257 4.974 3.892 169 2HD2 LEU 19 2HD2 LEU 19 -3.011 6.212 5.147 170 3HD2 LEU 19 3HD2 LEU 19 -1.768 4.968 4.868 171 H ASN 20 H ASN 20 -4.172 5.633 9.028 172 HA ASN 20 HA ASN 20 -3.365 3.157 10.013 173 1HB ASN 20 1HB ASN 20 -2.135 5.366 10.292 174 2HB ASN 20 2HB ASN 20 -3.363 5.872 11.435 175 1HD2 ASN 20 1HD2 ASN 20 -1.165 6.030 12.587 176 2HD2 ASN 20 2HD2 ASN 20 -0.720 4.688 13.587 177 H GLU 21 H GLU 21 -5.418 5.783 11.515 178 HA GLU 21 HA GLU 21 -6.240 4.393 13.689 179 1HB GLU 21 1HB GLU 21 -6.642 6.810 13.310 180 2HB GLU 21 2HB GLU 21 -7.820 6.437 12.067 181 1HG GLU 21 1HG GLU 21 -9.390 5.574 13.617 182 2HG GLU 21 2HG GLU 21 -8.169 5.250 14.831 183 H VAL 22 H VAL 22 -7.077 3.878 10.341 184 HA VAL 22 HA VAL 22 -9.602 2.666 10.779 185 HB VAL 22 HB VAL 22 -7.609 2.590 8.510 186 1HG1 VAL 22 1HG1 VAL 22 -8.726 0.723 7.883 187 2HG1 VAL 22 2HG1 VAL 22 -10.125 1.078 8.925 188 3HG1 VAL 22 3HG1 VAL 22 -9.961 1.888 7.349 189 1HG2 VAL 22 1HG2 VAL 22 -10.300 3.928 8.434 190 2HG2 VAL 22 2HG2 VAL 22 -8.935 4.735 9.243 191 3HG2 VAL 22 3HG2 VAL 22 -8.817 4.300 7.521 192 H PHE 23 H PHE 23 -6.376 1.243 9.870 193 HA PHE 23 HA PHE 23 -7.257 -1.363 10.572 194 1HB PHE 23 1HB PHE 23 -5.081 -1.938 9.748 195 2HB PHE 23 2HB PHE 23 -5.411 -0.443 8.895 196 HD1 PHE 23 HD1 PHE 23 -3.736 1.135 8.859 197 HD2 PHE 23 HD2 PHE 23 -3.923 -1.544 12.144 198 HE1 PHE 23 HE1 PHE 23 -1.630 2.132 9.791 199 HE2 PHE 23 HE2 PHE 23 -1.817 -0.548 13.077 200 HZ PHE 23 HZ PHE 23 -0.695 1.279 11.889 201 H ASN 24 H ASN 24 -5.330 1.223 12.158 202 HA ASN 24 HA ASN 24 -4.283 -0.294 14.186 203 1HB ASN 24 1HB ASN 24 -4.033 2.290 13.488 204 2HB ASN 24 2HB ASN 24 -5.255 2.529 14.721 205 1HD2 ASN 24 1HD2 ASN 24 -4.789 2.261 16.848 206 2HD2 ASN 24 2HD2 ASN 24 -3.199 1.995 17.480 207 H LYS 25 H LYS 25 -7.514 1.139 13.658 208 HA LYS 25 HA LYS 25 -8.524 1.169 16.205 209 1HB LYS 25 1HB LYS 25 -9.530 1.250 13.495 210 2HB LYS 25 2HB LYS 25 -10.603 0.298 14.502 211 1HG LYS 25 1HG LYS 25 -10.228 2.322 16.230 212 2HG LYS 25 2HG LYS 25 -9.828 3.204 14.769 213 1HD LYS 25 1HD LYS 25 -12.039 2.347 13.775 214 2HD LYS 25 2HD LYS 25 -12.438 1.743 15.371 215 1HE LYS 25 1HE LYS 25 -13.424 3.851 15.490 216 2HE LYS 25 2HE LYS 25 -11.840 4.229 16.137 217 1HZ LYS 25 1HZ LYS 25 -11.454 5.530 14.419 218 2HZ LYS 25 2HZ LYS 25 -11.831 4.374 13.328 219 3HZ LYS 25 3HZ LYS 25 -13.003 5.334 13.939 220 H GLU 26 H GLU 26 -7.764 -1.574 14.091 221 HA GLU 26 HA GLU 26 -9.201 -3.364 15.824 222 1HB GLU 26 1HB GLU 26 -7.558 -3.791 13.294 223 2HB GLU 26 2HB GLU 26 -8.271 -5.113 14.197 224 1HG GLU 26 1HG GLU 26 -10.019 -2.780 13.377 225 2HG GLU 26 2HG GLU 26 -9.596 -3.989 12.181 226 H GLY 27 H GLY 27 -6.010 -2.006 15.435 227 1HA GLY 27 1HA GLY 27 -4.283 -2.172 16.930 228 2HA GLY 27 2HA GLY 27 -5.056 -3.543 17.702 229 H TYR 28 H TYR 28 -4.852 -3.600 14.191 230 HA TYR 28 HA TYR 28 -3.396 -5.998 14.194 231 1HB TYR 28 1HB TYR 28 -3.919 -3.800 12.095 232 2HB TYR 28 2HB TYR 28 -3.333 -5.400 11.685 233 HD1 TYR 28 HD1 TYR 28 -5.095 -6.952 13.676 234 HD2 TYR 28 HD2 TYR 28 -5.966 -3.839 10.874 235 HE1 TYR 28 HE1 TYR 28 -7.493 -7.778 13.493 236 HE2 TYR 28 HE2 TYR 28 -8.361 -4.674 10.701 237 HH TYR 28 HH TYR 28 -9.750 -6.269 11.216 238 H GLN 29 H GLN 29 -1.253 -6.460 13.404 239 HA GLN 29 HA GLN 29 0.624 -4.580 14.331 240 1HB GLN 29 1HB GLN 29 0.756 -7.183 14.285 241 2HB GLN 29 2HB GLN 29 1.268 -7.005 12.619 242 1HG GLN 29 1HG GLN 29 3.079 -5.384 13.465 243 2HG GLN 29 2HG GLN 29 2.644 -5.867 15.092 244 1HE2 GLN 29 1HE2 GLN 29 4.176 -7.129 15.828 245 2HE2 GLN 29 2HE2 GLN 29 4.872 -8.502 15.034 246 H THR 30 H THR 30 1.312 -2.795 13.241 247 HA THR 30 HA THR 30 1.572 -3.027 10.320 248 HB THR 30 HB THR 30 0.788 -0.555 10.349 249 HG1 THR 30 HG1 THR 30 -0.139 -1.575 12.941 250 1HG2 THR 30 1HG2 THR 30 -1.401 -2.281 11.527 251 2HG2 THR 30 2HG2 THR 30 -1.484 -1.140 10.163 252 3HG2 THR 30 3HG2 THR 30 -0.726 -2.736 9.945 253 H PHE 31 H PHE 31 3.131 -1.504 9.362 254 HA PHE 31 HA PHE 31 5.037 -0.426 11.270 255 1HB PHE 31 1HB PHE 31 5.312 -2.955 9.998 256 2HB PHE 31 2HB PHE 31 6.256 -1.886 8.980 257 HD1 PHE 31 HD1 PHE 31 8.099 -0.511 10.064 258 HD2 PHE 31 HD2 PHE 31 6.165 -3.723 12.051 259 HE1 PHE 31 HE1 PHE 31 10.016 -0.668 11.676 260 HE2 PHE 31 HE2 PHE 31 8.082 -3.880 13.663 261 HZ PHE 31 HZ PHE 31 9.985 -2.351 13.456 262 H GLN 32 H GLN 32 6.765 0.905 10.096 263 HA GLN 32 HA GLN 32 5.669 1.909 7.590 264 1HB GLN 32 1HB GLN 32 5.102 3.750 8.828 265 2HB GLN 32 2HB GLN 32 6.215 3.357 10.123 266 1HG GLN 32 1HG GLN 32 8.099 4.284 8.926 267 2HG GLN 32 2HG GLN 32 7.199 4.371 7.425 268 1HE2 GLN 32 1HE2 GLN 32 5.941 6.077 6.976 269 2HE2 GLN 32 2HE2 GLN 32 5.727 7.463 7.993 270 H ALA 33 H ALA 33 7.247 2.725 6.060 271 HA ALA 33 HA ALA 33 10.034 2.222 6.800 272 1HB ALA 33 1HB ALA 33 9.719 1.406 4.107 273 2HB ALA 33 2HB ALA 33 10.081 0.379 5.515 274 3HB ALA 33 3HB ALA 33 8.393 0.637 5.011 275 H ALA 34 H ALA 34 11.533 3.187 5.042 276 HA ALA 34 HA ALA 34 10.252 5.589 3.929 277 1HB ALA 34 1HB ALA 34 13.106 5.557 4.910 278 2HB ALA 34 2HB ALA 34 11.995 6.934 4.714 279 3HB ALA 34 3HB ALA 34 11.772 5.795 6.063 280 H ASN 35 H ASN 35 10.425 3.163 2.505 281 HA ASN 35 HA ASN 35 11.651 3.993 0.218 282 1HB ASN 35 1HB ASN 35 13.449 2.467 2.065 283 2HB ASN 35 2HB ASN 35 13.434 1.885 0.412 284 1HD2 ASN 35 1HD2 ASN 35 15.088 3.742 2.413 285 2HD2 ASN 35 2HD2 ASN 35 15.705 4.977 1.367 286 H GLY 36 H GLY 36 12.019 1.827 -1.300 287 1HA GLY 36 1HA GLY 36 9.583 0.290 -0.992 288 2HA GLY 36 2HA GLY 36 10.695 0.284 -2.347 289 H LEU 37 H LEU 37 13.165 -0.292 -1.095 290 HA LEU 37 HA LEU 37 12.963 -3.073 -0.832 291 1HB LEU 37 1HB LEU 37 14.957 -1.168 -1.229 292 2HB LEU 37 2HB LEU 37 15.375 -1.917 0.299 293 HG LEU 37 HG LEU 37 14.766 -3.553 -2.167 294 1HD1 LEU 37 1HD1 LEU 37 17.474 -3.651 -2.003 295 2HD1 LEU 37 2HD1 LEU 37 16.567 -2.580 -3.098 296 3HD1 LEU 37 3HD1 LEU 37 17.172 -1.958 -1.544 297 1HD2 LEU 37 1HD2 LEU 37 16.649 -4.847 -0.578 298 2HD2 LEU 37 2HD2 LEU 37 15.508 -4.131 0.585 299 3HD2 LEU 37 3HD2 LEU 37 14.912 -5.215 -0.695 300 H GLN 38 H GLN 38 13.685 -0.493 1.624 301 HA GLN 38 HA GLN 38 13.859 -2.118 3.782 302 1HB GLN 38 1HB GLN 38 13.508 0.704 3.264 303 2HB GLN 38 2HB GLN 38 12.475 0.258 4.608 304 1HG GLN 38 1HG GLN 38 14.673 -1.066 5.413 305 2HG GLN 38 2HG GLN 38 15.482 0.104 4.390 306 1HE2 GLN 38 1HE2 GLN 38 16.220 1.753 5.465 307 2HE2 GLN 38 2HE2 GLN 38 15.479 2.559 6.808 308 H ALA 39 H ALA 39 11.049 -1.373 1.845 309 HA ALA 39 HA ALA 39 9.172 -2.063 3.927 310 1HB ALA 39 1HB ALA 39 8.585 -1.756 0.972 311 2HB ALA 39 2HB ALA 39 7.523 -1.430 2.363 312 3HB ALA 39 3HB ALA 39 8.884 -0.340 2.007 313 H LEU 40 H LEU 40 10.887 -3.559 1.189 314 HA LEU 40 HA LEU 40 9.255 -5.790 0.871 315 1HB LEU 40 1HB LEU 40 12.108 -5.121 0.276 316 2HB LEU 40 2HB LEU 40 11.573 -6.782 0.116 317 HG LEU 40 HG LEU 40 10.506 -4.370 -1.370 318 1HD1 LEU 40 1HD1 LEU 40 12.479 -6.466 -1.960 319 2HD1 LEU 40 2HD1 LEU 40 11.255 -6.234 -3.230 320 3HD1 LEU 40 3HD1 LEU 40 12.247 -4.859 -2.689 321 1HD2 LEU 40 1HD2 LEU 40 9.238 -6.942 -0.812 322 2HD2 LEU 40 2HD2 LEU 40 8.555 -5.443 -1.487 323 3HD2 LEU 40 3HD2 LEU 40 9.385 -6.603 -2.553 324 H ASP 41 H ASP 41 11.979 -5.101 3.124 325 HA ASP 41 HA ASP 41 12.037 -7.703 4.148 326 1HB ASP 41 1HB ASP 41 13.908 -6.065 4.354 327 2HB ASP 41 2HB ASP 41 12.917 -5.050 5.383 328 H ILE 42 H ILE 42 10.807 -4.528 5.468 329 HA ILE 42 HA ILE 42 9.613 -5.593 7.739 330 HB ILE 42 HB ILE 42 9.132 -3.087 6.141 331 1HG1 ILE 42 1HG1 ILE 42 11.296 -3.667 7.546 332 2HG1 ILE 42 2HG1 ILE 42 10.612 -2.054 7.534 333 1HG2 ILE 42 1HG2 ILE 42 7.152 -2.914 7.160 334 2HG2 ILE 42 2HG2 ILE 42 7.514 -4.231 8.301 335 3HG2 ILE 42 3HG2 ILE 42 8.092 -2.581 8.634 336 1HD1 ILE 42 1HD1 ILE 42 11.160 -3.455 9.820 337 2HD1 ILE 42 2HD1 ILE 42 9.923 -2.178 9.721 338 3HD1 ILE 42 3HD1 ILE 42 9.450 -3.888 9.579 339 H VAL 43 H VAL 43 8.703 -5.725 4.366 340 HA VAL 43 HA VAL 43 5.932 -5.986 4.688 341 HB VAL 43 HB VAL 43 7.975 -6.461 2.612 342 1HG1 VAL 43 1HG1 VAL 43 5.383 -8.015 2.688 343 2HG1 VAL 43 2HG1 VAL 43 6.190 -7.603 1.156 344 3HG1 VAL 43 3HG1 VAL 43 7.031 -8.604 2.364 345 1HG2 VAL 43 1HG2 VAL 43 5.180 -5.457 2.151 346 2HG2 VAL 43 2HG2 VAL 43 6.348 -4.441 3.031 347 3HG2 VAL 43 3HG2 VAL 43 6.706 -4.976 1.371 348 H THR 44 H THR 44 8.527 -8.503 4.281 349 HA THR 44 HA THR 44 6.721 -10.622 4.883 350 HB THR 44 HB THR 44 9.783 -10.560 4.888 351 HG1 THR 44 HG1 THR 44 9.487 -10.353 2.699 352 1HG2 THR 44 1HG2 THR 44 9.505 -12.899 4.058 353 2HG2 THR 44 2HG2 THR 44 8.777 -12.716 5.671 354 3HG2 THR 44 3HG2 THR 44 7.740 -12.746 4.225 355 H LYS 45 H LYS 45 8.912 -8.552 6.781 356 HA LYS 45 HA LYS 45 9.069 -10.126 9.053 357 1HB LYS 45 1HB LYS 45 10.004 -7.662 8.243 358 2HB LYS 45 2HB LYS 45 8.894 -7.227 9.526 359 1HG LYS 45 1HG LYS 45 10.356 -9.532 10.428 360 2HG LYS 45 2HG LYS 45 11.525 -8.420 9.743 361 1HD LYS 45 1HD LYS 45 9.896 -6.702 11.203 362 2HD LYS 45 2HD LYS 45 9.869 -8.146 12.194 363 1HE LYS 45 1HE LYS 45 12.376 -6.696 11.216 364 2HE LYS 45 2HE LYS 45 11.748 -6.670 12.852 365 1HZ LYS 45 1HZ LYS 45 12.134 -9.301 11.827 366 2HZ LYS 45 2HZ LYS 45 13.518 -8.439 11.918 367 3HZ LYS 45 3HZ LYS 45 12.604 -8.661 13.253 368 H GLU 46 H GLU 46 6.652 -7.570 8.161 369 HA GLU 46 HA GLU 46 5.057 -8.474 10.400 370 1HB GLU 46 1HB GLU 46 5.079 -6.006 8.659 371 2HB GLU 46 2HB GLU 46 3.609 -6.424 9.516 372 1HG GLU 46 1HG GLU 46 5.051 -4.878 10.843 373 2HG GLU 46 2HG GLU 46 4.790 -6.399 11.673 374 H ARG 47 H ARG 47 5.538 -9.385 7.252 375 HA ARG 47 HA ARG 47 4.169 -9.943 5.562 376 1HB ARG 47 1HB ARG 47 3.047 -12.139 6.193 377 2HB ARG 47 2HB ARG 47 4.725 -12.026 6.686 378 1HG ARG 47 1HG ARG 47 4.160 -12.289 8.867 379 2HG ARG 47 2HG ARG 47 3.068 -10.921 8.794 380 1HD ARG 47 1HD ARG 47 1.766 -12.885 9.419 381 2HD ARG 47 2HD ARG 47 1.300 -12.427 7.793 382 HE ARG 47 HE ARG 47 3.430 -14.273 7.525 383 1HH1 ARG 47 1HH1 ARG 47 0.141 -14.246 8.776 384 2HH1 ARG 47 2HH1 ARG 47 -0.133 -15.925 8.450 385 1HH2 ARG 47 1HH2 ARG 47 3.069 -16.488 7.095 386 2HH2 ARG 47 2HH2 ARG 47 1.544 -17.209 7.488 387 HA PRO 48 HA PRO 48 0.313 -7.928 7.014 388 1HB PRO 48 1HB PRO 48 0.387 -5.706 5.424 389 2HB PRO 48 2HB PRO 48 0.977 -5.723 7.074 390 1HG PRO 48 1HG PRO 48 2.522 -5.726 4.554 391 2HG PRO 48 2HG PRO 48 3.061 -5.320 6.171 392 1HD PRO 48 1HD PRO 48 3.579 -7.758 4.752 393 2HD PRO 48 2HD PRO 48 4.017 -7.397 6.409 394 H ASP 49 H ASP 49 -1.766 -7.585 5.952 395 HA ASP 49 HA ASP 49 -1.775 -9.291 3.629 396 1HB ASP 49 1HB ASP 49 -3.838 -8.268 5.586 397 2HB ASP 49 2HB ASP 49 -4.388 -8.799 4.009 398 H LEU 50 H LEU 50 -1.237 -6.089 4.182 399 HA LEU 50 HA LEU 50 -2.028 -5.309 1.577 400 1HB LEU 50 1HB LEU 50 -4.014 -5.047 3.539 401 2HB LEU 50 2HB LEU 50 -3.356 -3.435 3.333 402 HG LEU 50 HG LEU 50 -5.310 -3.849 1.903 403 1HD1 LEU 50 1HD1 LEU 50 -3.779 -3.496 -0.362 404 2HD1 LEU 50 2HD1 LEU 50 -4.285 -2.221 0.772 405 3HD1 LEU 50 3HD1 LEU 50 -2.685 -2.983 0.944 406 1HD2 LEU 50 1HD2 LEU 50 -3.586 -5.963 0.583 407 2HD2 LEU 50 2HD2 LEU 50 -5.064 -6.237 1.536 408 3HD2 LEU 50 3HD2 LEU 50 -5.155 -5.377 -0.020 409 H VAL 51 H VAL 51 -0.788 -3.568 0.889 410 HA VAL 51 HA VAL 51 0.689 -2.136 2.968 411 HB VAL 51 HB VAL 51 1.923 -3.392 0.510 412 1HG1 VAL 51 1HG1 VAL 51 3.195 -1.482 0.914 413 2HG1 VAL 51 2HG1 VAL 51 2.979 -1.586 2.678 414 3HG1 VAL 51 3HG1 VAL 51 4.060 -2.729 1.845 415 1HG2 VAL 51 1HG2 VAL 51 1.439 -4.446 3.184 416 2HG2 VAL 51 2HG2 VAL 51 2.023 -5.271 1.718 417 3HG2 VAL 51 3HG2 VAL 51 3.172 -4.425 2.781 418 H LEU 52 H LEU 52 1.192 0.026 2.430 419 HA LEU 52 HA LEU 52 0.004 0.914 -0.107 420 1HB LEU 52 1HB LEU 52 -1.456 1.995 1.155 421 2HB LEU 52 2HB LEU 52 -0.559 1.679 2.627 422 HG LEU 52 HG LEU 52 0.520 3.791 0.822 423 1HD1 LEU 52 1HD1 LEU 52 -1.023 5.477 1.510 424 2HD1 LEU 52 2HD1 LEU 52 -1.963 4.134 0.819 425 3HD1 LEU 52 3HD1 LEU 52 -1.878 4.344 2.584 426 1HD2 LEU 52 1HD2 LEU 52 1.811 3.964 2.629 427 2HD2 LEU 52 2HD2 LEU 52 0.413 4.721 3.431 428 3HD2 LEU 52 3HD2 LEU 52 0.707 2.975 3.615 429 H LEU 53 H LEU 53 1.585 1.490 -1.493 430 HA LEU 53 HA LEU 53 3.884 2.903 -0.332 431 1HB LEU 53 1HB LEU 53 4.591 0.696 -0.924 432 2HB LEU 53 2HB LEU 53 3.829 0.805 -2.498 433 HG LEU 53 HG LEU 53 6.353 1.039 -2.424 434 1HD1 LEU 53 1HD1 LEU 53 6.417 2.682 -4.196 435 2HD1 LEU 53 2HD1 LEU 53 4.954 1.680 -4.360 436 3HD1 LEU 53 3HD1 LEU 53 4.834 3.329 -3.701 437 1HD2 LEU 53 1HD2 LEU 53 6.281 3.899 -1.880 438 2HD2 LEU 53 2HD2 LEU 53 5.820 2.928 -0.460 439 3HD2 LEU 53 3HD2 LEU 53 7.380 2.640 -1.268 440 H ASP 54 H ASP 54 4.612 4.740 -1.440 441 HA ASP 54 HA ASP 54 2.704 5.665 -3.416 442 1HB ASP 54 1HB ASP 54 2.870 7.378 -1.863 443 2HB ASP 54 2HB ASP 54 4.501 6.939 -1.393 444 H MET 55 H MET 55 3.503 6.557 -5.469 445 HA MET 55 HA MET 55 5.668 5.188 -6.523 446 1HB MET 55 1HB MET 55 4.398 7.794 -7.530 447 2HB MET 55 2HB MET 55 5.263 6.628 -8.511 448 1HG MET 55 1HG MET 55 2.569 6.256 -7.133 449 2HG MET 55 2HG MET 55 2.903 6.213 -8.853 450 1HE MET 55 1HE MET 55 4.264 3.914 -5.499 451 2HE MET 55 2HE MET 55 2.701 4.753 -5.642 452 3HE MET 55 3HE MET 55 2.793 2.994 -5.894 453 H LYS 56 H LYS 56 5.332 8.778 -5.987 454 HA LYS 56 HA LYS 56 7.999 9.352 -6.479 455 1HB LYS 56 1HB LYS 56 5.701 10.779 -5.963 456 2HB LYS 56 2HB LYS 56 6.651 11.094 -4.524 457 1HG LYS 56 1HG LYS 56 8.624 11.648 -6.075 458 2HG LYS 56 2HG LYS 56 7.500 11.560 -7.417 459 1HD LYS 56 1HD LYS 56 6.093 13.337 -6.358 460 2HD LYS 56 2HD LYS 56 7.210 13.422 -5.011 461 1HE LYS 56 1HE LYS 56 9.037 13.859 -6.877 462 2HE LYS 56 2HE LYS 56 7.665 14.256 -7.892 463 1HZ LYS 56 1HZ LYS 56 8.726 16.088 -6.528 464 2HZ LYS 56 2HZ LYS 56 7.095 16.006 -6.529 465 3HZ LYS 56 3HZ LYS 56 7.939 15.457 -5.244 466 H ILE 57 H ILE 57 9.852 9.490 -5.206 467 HA ILE 57 HA ILE 57 9.782 9.235 -2.405 468 HB ILE 57 HB ILE 57 9.654 6.777 -3.895 469 1HG1 ILE 57 1HG1 ILE 57 9.999 6.727 -0.958 470 2HG1 ILE 57 2HG1 ILE 57 8.712 7.770 -1.531 471 1HG2 ILE 57 1HG2 ILE 57 12.111 6.911 -3.883 472 2HG2 ILE 57 2HG2 ILE 57 12.086 7.066 -2.110 473 3HG2 ILE 57 3HG2 ILE 57 11.502 5.572 -2.881 474 1HD1 ILE 57 1HD1 ILE 57 7.408 5.944 -1.816 475 2HD1 ILE 57 2HD1 ILE 57 8.529 5.375 -3.075 476 3HD1 ILE 57 3HD1 ILE 57 8.765 4.878 -1.382 477 HA PRO 58 HA PRO 58 13.728 10.807 -3.172 478 1HB PRO 58 1HB PRO 58 14.907 10.526 -0.723 479 2HB PRO 58 2HB PRO 58 13.801 11.829 -1.110 480 1HG PRO 58 1HG PRO 58 13.319 9.413 0.525 481 2HG PRO 58 2HG PRO 58 12.401 10.905 0.473 482 1HD PRO 58 1HD PRO 58 11.688 8.408 -0.744 483 2HD PRO 58 2HD PRO 58 10.830 9.928 -0.892 484 H GLY 59 H GLY 59 15.384 10.125 -4.369 485 1HA GLY 59 1HA GLY 59 17.134 8.814 -4.946 486 2HA GLY 59 2HA GLY 59 16.995 7.962 -3.422 487 H MET 60 H MET 60 16.020 8.061 -6.824 488 HA MET 60 HA MET 60 15.167 6.571 -8.157 489 1HB MET 60 1HB MET 60 16.772 5.108 -6.373 490 2HB MET 60 2HB MET 60 15.255 4.234 -6.311 491 1HG MET 60 1HG MET 60 15.301 4.273 -8.910 492 2HG MET 60 2HG MET 60 16.964 4.810 -8.770 493 1HE MET 60 1HE MET 60 14.366 2.586 -7.524 494 2HE MET 60 2HE MET 60 14.856 1.112 -8.395 495 3HE MET 60 3HE MET 60 15.210 1.280 -6.658 496 H ASP 61 H ASP 61 13.012 6.773 -8.579 497 HA ASP 61 HA ASP 61 11.109 6.816 -6.573 498 1HB ASP 61 1HB ASP 61 10.358 6.017 -9.383 499 2HB ASP 61 2HB ASP 61 9.554 7.144 -8.309 500 H GLY 62 H GLY 62 8.978 5.222 -7.062 501 1HA GLY 62 1HA GLY 62 9.946 2.560 -6.445 502 2HA GLY 62 2HA GLY 62 8.296 3.147 -6.381 503 H ILE 63 H ILE 63 9.253 4.311 -9.300 504 HA ILE 63 HA ILE 63 7.709 2.705 -10.836 505 HB ILE 63 HB ILE 63 10.218 4.202 -11.598 506 1HG1 ILE 63 1HG1 ILE 63 8.066 5.300 -10.472 507 2HG1 ILE 63 2HG1 ILE 63 8.988 6.103 -11.727 508 1HG2 ILE 63 1HG2 ILE 63 9.140 4.264 -13.879 509 2HG2 ILE 63 2HG2 ILE 63 9.793 2.687 -13.374 510 3HG2 ILE 63 3HG2 ILE 63 8.040 2.987 -13.308 511 1HD1 ILE 63 1HD1 ILE 63 7.397 5.610 -13.407 512 2HD1 ILE 63 2HD1 ILE 63 6.692 4.268 -12.474 513 3HD1 ILE 63 3HD1 ILE 63 6.385 5.951 -11.983 514 H GLU 64 H GLU 64 11.189 2.259 -10.000 515 HA GLU 64 HA GLU 64 11.212 -0.181 -11.518 516 1HB GLU 64 1HB GLU 64 13.361 1.183 -9.837 517 2HB GLU 64 2HB GLU 64 13.621 -0.272 -10.778 518 1HG GLU 64 1HG GLU 64 12.521 2.262 -12.056 519 2HG GLU 64 2HG GLU 64 14.245 2.010 -11.871 520 H ILE 65 H ILE 65 11.571 0.910 -8.079 521 HA ILE 65 HA ILE 65 12.027 -1.481 -6.876 522 HB ILE 65 HB ILE 65 10.229 0.726 -5.867 523 1HG1 ILE 65 1HG1 ILE 65 13.236 0.473 -5.969 524 2HG1 ILE 65 2HG1 ILE 65 12.231 1.780 -6.562 525 1HG2 ILE 65 1HG2 ILE 65 11.054 -1.764 -4.713 526 2HG2 ILE 65 2HG2 ILE 65 11.805 -0.425 -3.814 527 3HG2 ILE 65 3HG2 ILE 65 10.037 -0.480 -4.017 528 1HD1 ILE 65 1HD1 ILE 65 13.102 1.168 -3.761 529 2HD1 ILE 65 2HD1 ILE 65 12.875 2.741 -4.563 530 3HD1 ILE 65 3HD1 ILE 65 11.464 1.837 -3.961 531 H LEU 66 H LEU 66 8.716 -0.026 -7.283 532 HA LEU 66 HA LEU 66 7.299 -2.224 -6.504 533 1HB LEU 66 1HB LEU 66 6.757 0.071 -8.340 534 2HB LEU 66 2HB LEU 66 5.587 -1.230 -8.239 535 HG LEU 66 HG LEU 66 4.779 0.293 -6.703 536 1HD1 LEU 66 1HD1 LEU 66 5.236 -2.043 -5.749 537 2HD1 LEU 66 2HD1 LEU 66 6.553 -1.272 -4.833 538 3HD1 LEU 66 3HD1 LEU 66 4.873 -0.732 -4.601 539 1HD2 LEU 66 1HD2 LEU 66 5.982 2.027 -6.028 540 2HD2 LEU 66 2HD2 LEU 66 6.946 0.968 -4.971 541 3HD2 LEU 66 3HD2 LEU 66 7.457 1.250 -6.653 542 H LYS 67 H LYS 67 8.743 -1.484 -9.714 543 HA LYS 67 HA LYS 67 7.565 -3.608 -11.083 544 1HB LYS 67 1HB LYS 67 9.402 -1.519 -11.611 545 2HB LYS 67 2HB LYS 67 10.207 -3.005 -12.075 546 1HG LYS 67 1HG LYS 67 7.708 -3.482 -13.104 547 2HG LYS 67 2HG LYS 67 7.754 -1.734 -13.223 548 1HD LYS 67 1HD LYS 67 10.240 -3.123 -14.125 549 2HD LYS 67 2HD LYS 67 8.820 -3.441 -15.102 550 1HE LYS 67 1HE LYS 67 8.492 -0.805 -14.999 551 2HE LYS 67 2HE LYS 67 10.191 -0.791 -14.567 552 1HZ LYS 67 1HZ LYS 67 10.096 -0.664 -16.874 553 2HZ LYS 67 2HZ LYS 67 10.520 -2.213 -16.581 554 3HZ LYS 67 3HZ LYS 67 8.987 -1.854 -17.016 555 H ARG 68 H ARG 68 10.945 -3.382 -9.753 556 HA ARG 68 HA ARG 68 11.545 -6.004 -10.171 557 1HB ARG 68 1HB ARG 68 12.563 -3.809 -8.416 558 2HB ARG 68 2HB ARG 68 13.000 -5.422 -7.890 559 1HG ARG 68 1HG ARG 68 14.023 -5.926 -10.059 560 2HG ARG 68 2HG ARG 68 13.424 -4.429 -10.745 561 1HD ARG 68 1HD ARG 68 15.689 -3.937 -10.208 562 2HD ARG 68 2HD ARG 68 14.785 -3.215 -8.891 563 HE ARG 68 HE ARG 68 15.564 -5.986 -8.352 564 1HH1 ARG 68 1HH1 ARG 68 16.600 -2.626 -8.194 565 2HH1 ARG 68 2HH1 ARG 68 17.762 -2.911 -6.941 566 1HH2 ARG 68 1HH2 ARG 68 17.097 -6.361 -6.700 567 2HH2 ARG 68 2HH2 ARG 68 18.047 -5.049 -6.086 568 H MET 69 H MET 69 9.812 -4.410 -7.465 569 HA MET 69 HA MET 69 9.919 -6.401 -5.608 570 1HB MET 69 1HB MET 69 8.402 -3.991 -6.143 571 2HB MET 69 2HB MET 69 7.258 -5.224 -5.652 572 1HG MET 69 1HG MET 69 8.064 -5.308 -3.493 573 2HG MET 69 2HG MET 69 9.733 -5.135 -3.996 574 1HE MET 69 1HE MET 69 6.323 -3.380 -3.710 575 2HE MET 69 2HE MET 69 7.011 -3.428 -2.069 576 3HE MET 69 3HE MET 69 6.763 -1.865 -2.885 577 H LYS 70 H LYS 70 7.279 -5.851 -8.058 578 HA LYS 70 HA LYS 70 5.982 -8.274 -7.441 579 1HB LYS 70 1HB LYS 70 4.442 -7.648 -9.030 580 2HB LYS 70 2HB LYS 70 5.121 -6.093 -8.593 581 1HG LYS 70 1HG LYS 70 5.101 -6.108 -10.984 582 2HG LYS 70 2HG LYS 70 6.773 -6.392 -10.544 583 1HD LYS 70 1HD LYS 70 6.767 -8.382 -11.629 584 2HD LYS 70 2HD LYS 70 5.430 -8.951 -10.649 585 1HE LYS 70 1HE LYS 70 3.962 -8.688 -12.364 586 2HE LYS 70 2HE LYS 70 4.453 -7.023 -12.608 587 1HZ LYS 70 1HZ LYS 70 5.768 -7.616 -14.274 588 2HZ LYS 70 2HZ LYS 70 6.386 -8.916 -13.503 589 3HZ LYS 70 3HZ LYS 70 4.961 -9.036 -14.291 590 H VAL 71 H VAL 71 8.390 -7.282 -9.933 591 HA VAL 71 HA VAL 71 8.353 -9.652 -11.384 592 HB VAL 71 HB VAL 71 10.647 -7.746 -10.881 593 1HG1 VAL 71 1HG1 VAL 71 10.303 -9.164 -13.479 594 2HG1 VAL 71 2HG1 VAL 71 11.785 -8.698 -12.610 595 3HG1 VAL 71 3HG1 VAL 71 10.867 -10.133 -12.096 596 1HG2 VAL 71 1HG2 VAL 71 9.737 -6.248 -12.307 597 2HG2 VAL 71 2HG2 VAL 71 9.056 -7.508 -13.364 598 3HG2 VAL 71 3HG2 VAL 71 8.206 -7.044 -11.870 599 H ILE 72 H ILE 72 9.724 -8.824 -8.233 600 HA ILE 72 HA ILE 72 11.416 -11.159 -8.206 601 HB ILE 72 HB ILE 72 10.865 -8.861 -6.376 602 1HG1 ILE 72 1HG1 ILE 72 12.574 -8.759 -8.205 603 2HG1 ILE 72 2HG1 ILE 72 13.194 -8.441 -6.597 604 1HG2 ILE 72 1HG2 ILE 72 12.262 -9.893 -4.636 605 2HG2 ILE 72 2HG2 ILE 72 10.745 -10.786 -4.897 606 3HG2 ILE 72 3HG2 ILE 72 12.273 -11.416 -5.556 607 1HD1 ILE 72 1HD1 ILE 72 14.272 -10.267 -8.376 608 2HD1 ILE 72 2HD1 ILE 72 14.538 -10.287 -6.616 609 3HD1 ILE 72 3HD1 ILE 72 13.272 -11.311 -7.336 610 H ASP 73 H ASP 73 8.418 -9.979 -6.545 611 HA ASP 73 HA ASP 73 7.871 -12.790 -5.995 612 1HB ASP 73 1HB ASP 73 6.367 -11.278 -4.156 613 2HB ASP 73 2HB ASP 73 7.792 -12.233 -3.799 614 H GLU 74 H GLU 74 5.915 -13.471 -6.909 615 HA GLU 74 HA GLU 74 4.269 -11.405 -8.075 616 1HB GLU 74 1HB GLU 74 3.454 -13.054 -9.545 617 2HB GLU 74 2HB GLU 74 5.120 -13.539 -9.300 618 1HG GLU 74 1HG GLU 74 4.351 -15.122 -7.482 619 2HG GLU 74 2HG GLU 74 2.693 -14.684 -7.841 620 H ASN 75 H ASN 75 4.490 -12.709 -5.094 621 HA ASN 75 HA ASN 75 1.622 -13.104 -4.825 622 1HB ASN 75 1HB ASN 75 3.611 -14.718 -3.913 623 2HB ASN 75 2HB ASN 75 3.537 -13.621 -2.548 624 1HD2 ASN 75 1HD2 ASN 75 2.958 -15.932 -1.762 625 2HD2 ASN 75 2HD2 ASN 75 1.267 -16.276 -1.606 626 H ILE 76 H ILE 76 4.085 -10.791 -4.527 627 HA ILE 76 HA ILE 76 3.472 -9.619 -2.043 628 HB ILE 76 HB ILE 76 5.580 -9.312 -3.233 629 1HG1 ILE 76 1HG1 ILE 76 4.022 -6.769 -2.688 630 2HG1 ILE 76 2HG1 ILE 76 4.947 -7.702 -1.528 631 1HG2 ILE 76 1HG2 ILE 76 4.249 -9.072 -5.508 632 2HG2 ILE 76 2HG2 ILE 76 4.358 -7.339 -5.114 633 3HG2 ILE 76 3HG2 ILE 76 5.841 -8.311 -5.270 634 1HD1 ILE 76 1HD1 ILE 76 6.393 -6.809 -4.005 635 2HD1 ILE 76 2HD1 ILE 76 5.989 -5.566 -2.796 636 3HD1 ILE 76 3HD1 ILE 76 6.991 -6.964 -2.335 637 H ARG 77 H ARG 77 1.920 -8.168 -1.421 638 HA ARG 77 HA ARG 77 0.172 -7.269 -3.570 639 1HB ARG 77 1HB ARG 77 -1.278 -8.682 -2.408 640 2HB ARG 77 2HB ARG 77 -0.425 -8.489 -0.890 641 1HG ARG 77 1HG ARG 77 -1.541 -6.500 -0.344 642 2HG ARG 77 2HG ARG 77 -1.831 -6.072 -2.018 643 1HD ARG 77 1HD ARG 77 -3.976 -6.725 -1.216 644 2HD ARG 77 2HD ARG 77 -3.421 -8.126 -2.110 645 HE ARG 77 HE ARG 77 -3.581 -7.882 0.850 646 1HH1 ARG 77 1HH1 ARG 77 -2.738 -9.827 -1.959 647 2HH1 ARG 77 2HH1 ARG 77 -2.690 -11.315 -1.074 648 1HH2 ARG 77 1HH2 ARG 77 -3.518 -9.845 2.018 649 2HH2 ARG 77 2HH2 ARG 77 -3.137 -11.325 1.203 650 H VAL 78 H VAL 78 0.561 -5.087 -3.849 651 HA VAL 78 HA VAL 78 0.491 -3.420 -1.461 652 HB VAL 78 HB VAL 78 2.891 -4.110 -2.355 653 1HG1 VAL 78 1HG1 VAL 78 2.259 -1.666 -4.043 654 2HG1 VAL 78 2HG1 VAL 78 3.816 -2.521 -3.931 655 3HG1 VAL 78 3HG1 VAL 78 2.410 -3.325 -4.671 656 1HG2 VAL 78 1HG2 VAL 78 1.785 -1.896 -0.889 657 2HG2 VAL 78 2HG2 VAL 78 3.362 -2.698 -0.696 658 3HG2 VAL 78 3HG2 VAL 78 3.188 -1.339 -1.832 659 H ILE 79 H ILE 79 -0.325 -1.306 -1.862 660 HA ILE 79 HA ILE 79 -1.613 -1.099 -4.484 661 HB ILE 79 HB ILE 79 -2.366 -0.397 -1.719 662 1HG1 ILE 79 1HG1 ILE 79 -3.650 -1.481 -4.199 663 2HG1 ILE 79 2HG1 ILE 79 -3.607 -2.145 -2.578 664 1HG2 ILE 79 1HG2 ILE 79 -3.243 1.360 -4.027 665 2HG2 ILE 79 2HG2 ILE 79 -3.811 1.443 -2.343 666 3HG2 ILE 79 3HG2 ILE 79 -2.120 1.842 -2.732 667 1HD1 ILE 79 1HD1 ILE 79 -5.083 -0.207 -1.824 668 2HD1 ILE 79 2HD1 ILE 79 -5.249 0.237 -3.540 669 3HD1 ILE 79 3HD1 ILE 79 -5.856 -1.334 -2.964 670 H ILE 80 H ILE 80 -1.404 0.782 -5.749 671 HA ILE 80 HA ILE 80 0.881 2.434 -4.954 672 HB ILE 80 HB ILE 80 1.331 2.777 -7.212 673 1HG1 ILE 80 1HG1 ILE 80 -0.270 1.914 -9.015 674 2HG1 ILE 80 2HG1 ILE 80 -1.483 1.814 -7.755 675 1HG2 ILE 80 1HG2 ILE 80 2.146 0.738 -7.528 676 2HG2 ILE 80 2HG2 ILE 80 1.127 0.172 -6.182 677 3HG2 ILE 80 3HG2 ILE 80 0.524 0.081 -7.854 678 1HD1 ILE 80 1HD1 ILE 80 -0.777 4.108 -9.246 679 2HD1 ILE 80 2HD1 ILE 80 -1.838 4.051 -7.819 680 3HD1 ILE 80 3HD1 ILE 80 -0.101 4.386 -7.623 681 H MET 81 H MET 81 0.771 4.763 -5.296 682 HA MET 81 HA MET 81 -1.921 5.773 -5.633 683 1HB MET 81 1HB MET 81 -0.541 7.246 -3.513 684 2HB MET 81 2HB MET 81 -2.108 6.464 -3.448 685 1HG MET 81 1HG MET 81 -0.879 4.236 -3.115 686 2HG MET 81 2HG MET 81 0.607 5.152 -2.960 687 1HE MET 81 1HE MET 81 1.277 6.590 -1.000 688 2HE MET 81 2HE MET 81 0.742 6.012 0.596 689 3HE MET 81 3HE MET 81 1.378 4.858 -0.602 690 H THR 82 H THR 82 -1.915 7.500 -7.015 691 HA THR 82 HA THR 82 -0.025 9.563 -6.918 692 HB THR 82 HB THR 82 1.670 8.196 -7.846 693 HG1 THR 82 HG1 THR 82 1.682 8.965 -10.060 694 1HG2 THR 82 1HG2 THR 82 1.040 6.746 -9.954 695 2HG2 THR 82 2HG2 THR 82 0.640 6.100 -8.344 696 3HG2 THR 82 3HG2 THR 82 -0.626 6.863 -9.337 697 H ALA 83 H ALA 83 -0.572 11.299 -8.286 698 HA ALA 83 HA ALA 83 -3.256 11.484 -8.911 699 1HB ALA 83 1HB ALA 83 -1.141 13.195 -8.715 700 2HB ALA 83 2HB ALA 83 -1.366 13.159 -10.480 701 3HB ALA 83 3HB ALA 83 -2.714 13.638 -9.421 702 H TYR 84 H TYR 84 -4.298 11.751 -11.063 703 HA TYR 84 HA TYR 84 -3.546 9.574 -12.762 704 1HB TYR 84 1HB TYR 84 -5.615 10.469 -13.985 705 2HB TYR 84 2HB TYR 84 -5.908 10.173 -12.283 706 HD1 TYR 84 HD1 TYR 84 -6.178 12.049 -10.705 707 HD2 TYR 84 HD2 TYR 84 -5.587 12.731 -14.887 708 HE1 TYR 84 HE1 TYR 84 -6.966 14.450 -10.432 709 HE2 TYR 84 HE2 TYR 84 -6.378 15.130 -14.600 710 HH TYR 84 HH TYR 84 -7.966 16.183 -11.818 711 H GLY 85 H GLY 85 -1.338 11.205 -12.779 712 1HA GLY 85 1HA GLY 85 -1.563 12.740 -15.294 713 2HA GLY 85 2HA GLY 85 -0.395 13.029 -14.020 714 H GLU 86 H GLU 86 0.416 10.344 -13.430 715 HA GLU 86 HA GLU 86 1.865 9.810 -15.889 716 1HB GLU 86 1HB GLU 86 3.330 8.419 -14.246 717 2HB GLU 86 2HB GLU 86 3.426 10.167 -14.163 718 1HG GLU 86 1HG GLU 86 2.162 10.282 -12.166 719 2HG GLU 86 2HG GLU 86 1.396 8.729 -12.438 720 H LEU 87 H LEU 87 -0.661 8.919 -16.180 721 HA LEU 87 HA LEU 87 -1.489 6.586 -15.099 722 1HB LEU 87 1HB LEU 87 -1.672 7.436 -17.993 723 2HB LEU 87 2HB LEU 87 -2.642 6.183 -17.242 724 HG LEU 87 HG LEU 87 -2.668 8.962 -16.098 725 1HD1 LEU 87 1HD1 LEU 87 -3.488 9.863 -17.951 726 2HD1 LEU 87 2HD1 LEU 87 -3.468 8.291 -18.785 727 3HD1 LEU 87 3HD1 LEU 87 -4.884 8.766 -17.818 728 1HD2 LEU 87 1HD2 LEU 87 -5.093 7.260 -16.313 729 2HD2 LEU 87 2HD2 LEU 87 -3.808 6.702 -15.214 730 3HD2 LEU 87 3HD2 LEU 87 -4.533 8.312 -14.991 731 H ASP 88 H ASP 88 1.133 7.095 -17.473 732 HA ASP 88 HA ASP 88 1.489 4.650 -18.464 733 1HB ASP 88 1HB ASP 88 3.183 6.957 -17.842 734 2HB ASP 88 2HB ASP 88 4.098 5.471 -17.679 735 H MET 89 H MET 89 2.934 5.913 -15.357 736 HA MET 89 HA MET 89 4.010 3.461 -14.606 737 1HB MET 89 1HB MET 89 4.892 5.429 -13.556 738 2HB MET 89 2HB MET 89 3.299 6.066 -13.199 739 1HG MET 89 1HG MET 89 4.579 5.121 -11.189 740 2HG MET 89 2HG MET 89 2.953 4.503 -11.398 741 1HE MET 89 1HE MET 89 5.990 1.831 -10.319 742 2HE MET 89 2HE MET 89 5.960 3.602 -10.148 743 3HE MET 89 3HE MET 89 4.582 2.630 -9.581 744 H ILE 90 H ILE 90 0.938 5.147 -13.678 745 HA ILE 90 HA ILE 90 0.062 3.346 -11.795 746 HB ILE 90 HB ILE 90 -1.395 5.119 -13.744 747 1HG1 ILE 90 1HG1 ILE 90 -1.602 5.709 -10.899 748 2HG1 ILE 90 2HG1 ILE 90 0.070 5.647 -11.419 749 1HG2 ILE 90 1HG2 ILE 90 -3.235 3.917 -13.348 750 2HG2 ILE 90 2HG2 ILE 90 -2.477 3.017 -12.013 751 3HG2 ILE 90 3HG2 ILE 90 -3.185 4.622 -11.715 752 1HD1 ILE 90 1HD1 ILE 90 -0.928 7.928 -11.678 753 2HD1 ILE 90 2HD1 ILE 90 -0.380 7.253 -13.232 754 3HD1 ILE 90 3HD1 ILE 90 -2.113 7.255 -12.824 755 H GLN 91 H GLN 91 -0.541 3.344 -15.375 756 HA GLN 91 HA GLN 91 -2.065 1.079 -15.423 757 1HB GLN 91 1HB GLN 91 -0.396 2.597 -17.370 758 2HB GLN 91 2HB GLN 91 -0.725 0.936 -17.822 759 1HG GLN 91 1HG GLN 91 -3.163 2.132 -16.788 760 2HG GLN 91 2HG GLN 91 -2.486 3.188 -18.011 761 1HE2 GLN 91 1HE2 GLN 91 -4.894 1.793 -18.264 762 2HE2 GLN 91 2HE2 GLN 91 -4.770 0.639 -19.550 763 H GLU 92 H GLU 92 1.532 1.397 -15.834 764 HA GLU 92 HA GLU 92 2.074 -1.237 -16.237 765 1HB GLU 92 1HB GLU 92 3.540 1.167 -15.469 766 2HB GLU 92 2HB GLU 92 4.202 -0.234 -14.651 767 1HG GLU 92 1HG GLU 92 5.389 -0.259 -16.680 768 2HG GLU 92 2HG GLU 92 4.094 -1.391 -17.011 769 H SER 93 H SER 93 1.541 0.541 -13.156 770 HA SER 93 HA SER 93 2.387 -1.428 -11.444 771 1HB SER 93 1HB SER 93 0.084 -0.093 -10.323 772 2HB SER 93 2HB SER 93 1.778 0.139 -9.937 773 HG SER 93 HG SER 93 1.621 2.040 -10.890 774 H LYS 94 H LYS 94 -0.916 -0.777 -12.809 775 HA LYS 94 HA LYS 94 -2.200 -2.873 -11.508 776 1HB LYS 94 1HB LYS 94 -2.864 -0.826 -13.309 777 2HB LYS 94 2HB LYS 94 -3.293 -2.306 -14.143 778 1HG LYS 94 1HG LYS 94 -4.062 -2.345 -11.286 779 2HG LYS 94 2HG LYS 94 -4.819 -1.035 -12.170 780 1HD LYS 94 1HD LYS 94 -5.381 -2.862 -13.974 781 2HD LYS 94 2HD LYS 94 -5.005 -4.019 -12.713 782 1HE LYS 94 1HE LYS 94 -6.688 -2.844 -11.212 783 2HE LYS 94 2HE LYS 94 -7.121 -1.820 -12.566 784 1HZ LYS 94 1HZ LYS 94 -8.566 -3.453 -12.950 785 2HZ LYS 94 2HZ LYS 94 -7.312 -4.226 -13.654 786 3HZ LYS 94 3HZ LYS 94 -7.732 -4.583 -12.117 787 H GLU 95 H GLU 95 -0.581 -2.714 -14.743 788 HA GLU 95 HA GLU 95 -1.156 -5.411 -15.296 789 1HB GLU 95 1HB GLU 95 1.007 -3.649 -16.527 790 2HB GLU 95 2HB GLU 95 0.323 -5.100 -17.232 791 1HG GLU 95 1HG GLU 95 -1.295 -2.596 -16.565 792 2HG GLU 95 2HG GLU 95 -0.653 -2.955 -18.156 793 H LEU 96 H LEU 96 1.013 -3.910 -13.132 794 HA LEU 96 HA LEU 96 3.152 -5.794 -13.415 795 1HB LEU 96 1HB LEU 96 2.622 -3.322 -12.017 796 2HB LEU 96 2HB LEU 96 3.317 -4.506 -10.928 797 HG LEU 96 HG LEU 96 5.219 -4.817 -12.475 798 1HD1 LEU 96 1HD1 LEU 96 4.445 -2.400 -14.047 799 2HD1 LEU 96 2HD1 LEU 96 5.466 -3.787 -14.496 800 3HD1 LEU 96 3HD1 LEU 96 3.695 -3.959 -14.466 801 1HD2 LEU 96 1HD2 LEU 96 6.220 -2.517 -12.152 802 2HD2 LEU 96 2HD2 LEU 96 4.645 -2.017 -11.490 803 3HD2 LEU 96 3HD2 LEU 96 5.579 -3.304 -10.689 804 H GLY 97 H GLY 97 0.012 -5.747 -11.961 805 1HA GLY 97 1HA GLY 97 -0.849 -7.847 -11.207 806 2HA GLY 97 2HA GLY 97 0.703 -8.205 -10.476 807 H ALA 98 H ALA 98 -0.371 -4.879 -10.219 808 HA ALA 98 HA ALA 98 -0.428 -5.049 -7.393 809 1HB ALA 98 1HB ALA 98 0.277 -2.973 -8.082 810 2HB ALA 98 2HB ALA 98 -0.783 -2.967 -9.512 811 3HB ALA 98 3HB ALA 98 -1.458 -2.615 -7.903 812 H LEU 99 H LEU 99 -2.475 -3.774 -6.317 813 HA LEU 99 HA LEU 99 -4.711 -5.519 -6.936 814 1HB LEU 99 1HB LEU 99 -4.579 -3.547 -4.677 815 2HB LEU 99 2HB LEU 99 -5.518 -5.022 -4.802 816 HG LEU 99 HG LEU 99 -3.787 -5.418 -3.228 817 1HD1 LEU 99 1HD1 LEU 99 -3.283 -7.457 -3.978 818 2HD1 LEU 99 2HD1 LEU 99 -4.131 -6.989 -5.472 819 3HD1 LEU 99 3HD1 LEU 99 -2.362 -6.820 -5.362 820 1HD2 LEU 99 1HD2 LEU 99 -2.354 -3.492 -4.406 821 2HD2 LEU 99 2HD2 LEU 99 -1.635 -4.708 -3.323 822 3HD2 LEU 99 3HD2 LEU 99 -1.522 -4.910 -5.088 823 H THR 100 H THR 100 -4.012 -1.983 -6.507 824 HA THR 100 HA THR 100 -5.680 -1.309 -8.700 825 HB THR 100 HB THR 100 -7.499 -1.819 -7.129 826 HG1 THR 100 HG1 THR 100 -6.854 1.041 -7.082 827 1HG2 THR 100 1HG2 THR 100 -5.677 -0.885 -5.139 828 2HG2 THR 100 2HG2 THR 100 -6.993 0.313 -5.198 829 3HG2 THR 100 3HG2 THR 100 -7.362 -1.400 -4.887 830 H HIS 101 H HIS 101 -5.749 1.055 -9.068 831 HA HIS 101 HA HIS 101 -3.463 2.301 -7.721 832 1HB HIS 101 1HB HIS 101 -3.023 3.504 -9.805 833 2HB HIS 101 2HB HIS 101 -2.921 1.767 -10.019 834 HD1 HIS 101 HD1 HIS 101 -4.224 0.813 -11.939 835 HD2 HIS 101 HD2 HIS 101 -5.644 4.583 -10.771 836 HE1 HIS 101 HE1 HIS 101 -6.019 1.458 -13.634 837 H PHE 102 H PHE 102 -3.914 4.106 -6.556 838 HA PHE 102 HA PHE 102 -6.552 5.298 -6.989 839 1HB PHE 102 1HB PHE 102 -4.510 5.362 -4.686 840 2HB PHE 102 2HB PHE 102 -6.049 6.198 -4.636 841 HD1 PHE 102 HD1 PHE 102 -4.752 3.826 -2.932 842 HD2 PHE 102 HD2 PHE 102 -7.776 4.080 -5.898 843 HE1 PHE 102 HE1 PHE 102 -5.841 1.766 -1.998 844 HE2 PHE 102 HE2 PHE 102 -8.865 2.021 -4.964 845 HZ PHE 102 HZ PHE 102 -7.885 0.888 -3.026 846 H ALA 103 H ALA 103 -6.748 7.676 -6.821 847 HA ALA 103 HA ALA 103 -4.360 8.950 -7.941 848 1HB ALA 103 1HB ALA 103 -6.866 8.850 -8.946 849 2HB ALA 103 2HB ALA 103 -7.022 10.305 -7.933 850 3HB ALA 103 3HB ALA 103 -5.778 10.235 -9.204 851 H LYS 104 H LYS 104 -3.502 10.850 -7.020 852 HA LYS 104 HA LYS 104 -3.130 11.173 -4.494 853 1HB LYS 104 1HB LYS 104 -3.280 13.013 -6.726 854 2HB LYS 104 2HB LYS 104 -3.742 13.822 -5.242 855 1HG LYS 104 1HG LYS 104 -1.666 13.171 -4.142 856 2HG LYS 104 2HG LYS 104 -1.240 12.089 -5.453 857 1HD LYS 104 1HD LYS 104 -1.558 14.444 -6.843 858 2HD LYS 104 2HD LYS 104 -1.012 15.064 -5.297 859 1HE LYS 104 1HE LYS 104 1.075 13.979 -5.436 860 2HE LYS 104 2HE LYS 104 0.474 12.724 -6.501 861 1HZ LYS 104 1HZ LYS 104 0.730 14.033 -8.294 862 2HZ LYS 104 2HZ LYS 104 0.396 15.428 -7.513 863 3HZ LYS 104 3HZ LYS 104 1.872 14.744 -7.368 864 HA PRO 105 HA PRO 105 -7.284 13.128 -3.471 865 1HB PRO 105 1HB PRO 105 -9.160 13.581 -5.406 866 2HB PRO 105 2HB PRO 105 -8.016 14.798 -4.878 867 1HG PRO 105 1HG PRO 105 -8.016 13.215 -7.374 868 2HG PRO 105 2HG PRO 105 -7.158 14.700 -7.017 869 1HD PRO 105 1HD PRO 105 -6.051 12.055 -7.096 870 2HD PRO 105 2HD PRO 105 -5.221 13.525 -6.626 871 H PHE 106 H PHE 106 -7.406 11.140 -2.382 872 HA PHE 106 HA PHE 106 -9.499 9.470 -3.584 873 1HB PHE 106 1HB PHE 106 -8.043 7.722 -2.057 874 2HB PHE 106 2HB PHE 106 -7.657 8.019 -3.740 875 HD1 PHE 106 HD1 PHE 106 -5.385 8.104 -4.067 876 HD2 PHE 106 HD2 PHE 106 -6.991 9.892 -0.571 877 HE1 PHE 106 HE1 PHE 106 -3.089 8.872 -3.406 878 HE2 PHE 106 HE2 PHE 106 -4.696 10.660 0.091 879 HZ PHE 106 HZ PHE 106 -2.772 10.141 -1.334 880 H ASP 107 H ASP 107 -10.835 8.274 -2.019 881 HA ASP 107 HA ASP 107 -10.843 9.657 0.547 882 1HB ASP 107 1HB ASP 107 -12.882 9.363 -1.383 883 2HB ASP 107 2HB ASP 107 -13.297 8.186 -0.153 884 H ILE 108 H ILE 108 -10.759 8.336 2.419 885 HA ILE 108 HA ILE 108 -9.792 5.783 2.271 886 HB ILE 108 HB ILE 108 -10.299 7.622 4.228 887 1HG1 ILE 108 1HG1 ILE 108 -8.410 6.063 4.109 888 2HG1 ILE 108 2HG1 ILE 108 -9.130 6.093 5.707 889 1HG2 ILE 108 1HG2 ILE 108 -11.639 6.530 5.949 890 2HG2 ILE 108 2HG2 ILE 108 -12.610 6.851 4.493 891 3HG2 ILE 108 3HG2 ILE 108 -12.025 5.203 4.827 892 1HD1 ILE 108 1HD1 ILE 108 -9.639 3.885 5.607 893 2HD1 ILE 108 2HD1 ILE 108 -10.434 4.080 4.026 894 3HD1 ILE 108 3HD1 ILE 108 -8.676 3.815 4.112 895 H ASP 109 H ASP 109 -13.222 6.875 2.636 896 HA ASP 109 HA ASP 109 -14.432 4.534 3.036 897 1HB ASP 109 1HB ASP 109 -15.139 7.116 1.983 898 2HB ASP 109 2HB ASP 109 -15.886 5.921 0.942 899 H GLU 110 H GLU 110 -13.066 5.853 -0.024 900 HA GLU 110 HA GLU 110 -14.144 3.815 -1.643 901 1HB GLU 110 1HB GLU 110 -11.682 5.401 -2.394 902 2HB GLU 110 2HB GLU 110 -12.995 4.862 -3.420 903 1HG GLU 110 1HG GLU 110 -14.203 6.523 -1.443 904 2HG GLU 110 2HG GLU 110 -12.740 7.356 -1.926 905 H ILE 111 H ILE 111 -11.087 4.319 0.155 906 HA ILE 111 HA ILE 111 -9.752 2.118 -1.037 907 HB ILE 111 HB ILE 111 -9.281 3.936 1.291 908 1HG1 ILE 111 1HG1 ILE 111 -7.018 3.816 -0.287 909 2HG1 ILE 111 2HG1 ILE 111 -8.301 3.596 -1.460 910 1HG2 ILE 111 1HG2 ILE 111 -6.997 2.533 1.331 911 2HG2 ILE 111 2HG2 ILE 111 -8.378 2.177 2.395 912 3HG2 ILE 111 3HG2 ILE 111 -8.128 1.224 0.913 913 1HD1 ILE 111 1HD1 ILE 111 -9.246 5.643 0.253 914 2HD1 ILE 111 2HD1 ILE 111 -7.525 6.011 -0.017 915 3HD1 ILE 111 3HD1 ILE 111 -8.627 5.837 -1.405 916 H ARG 112 H ARG 112 -12.070 2.555 1.597 917 HA ARG 112 HA ARG 112 -11.468 0.166 2.905 918 1HB ARG 112 1HB ARG 112 -14.026 1.841 2.810 919 2HB ARG 112 2HB ARG 112 -13.804 0.488 3.902 920 1HG ARG 112 1HG ARG 112 -11.630 1.702 4.682 921 2HG ARG 112 2HG ARG 112 -12.252 3.106 3.838 922 1HD ARG 112 1HD ARG 112 -14.393 2.902 5.201 923 2HD ARG 112 2HD ARG 112 -13.640 1.608 6.112 924 HE ARG 112 HE ARG 112 -11.800 3.710 6.235 925 1HH1 ARG 112 1HH1 ARG 112 -15.176 3.272 7.126 926 2HH1 ARG 112 2HH1 ARG 112 -15.117 4.425 8.418 927 1HH2 ARG 112 1HH2 ARG 112 -11.722 5.231 7.939 928 2HH2 ARG 112 2HH2 ARG 112 -13.140 5.546 8.883 929 H ASP 113 H ASP 113 -13.070 0.916 -0.088 930 HA ASP 113 HA ASP 113 -14.813 -1.315 -0.070 931 1HB ASP 113 1HB ASP 113 -14.397 1.011 -1.653 932 2HB ASP 113 2HB ASP 113 -14.094 -0.333 -2.735 933 H ALA 114 H ALA 114 -11.685 -0.387 -1.680 934 HA ALA 114 HA ALA 114 -11.365 -2.851 -3.021 935 1HB ALA 114 1HB ALA 114 -9.344 -0.711 -2.235 936 2HB ALA 114 2HB ALA 114 -9.087 -1.994 -3.441 937 3HB ALA 114 3HB ALA 114 -10.311 -0.734 -3.729 938 H VAL 115 H VAL 115 -10.433 -1.574 0.194 939 HA VAL 115 HA VAL 115 -8.737 -3.790 0.783 940 HB VAL 115 HB VAL 115 -9.764 -1.360 2.139 941 1HG1 VAL 115 1HG1 VAL 115 -8.927 -3.859 3.622 942 2HG1 VAL 115 2HG1 VAL 115 -8.749 -2.233 4.325 943 3HG1 VAL 115 3HG1 VAL 115 -10.362 -2.838 3.878 944 1HG2 VAL 115 1HG2 VAL 115 -7.050 -2.245 2.736 945 2HG2 VAL 115 2HG2 VAL 115 -7.364 -2.185 0.985 946 3HG2 VAL 115 3HG2 VAL 115 -7.621 -0.736 1.986 947 H LYS 116 H LYS 116 -12.188 -3.018 1.049 948 HA LYS 116 HA LYS 116 -12.692 -5.177 2.875 949 1HB LYS 116 1HB LYS 116 -14.059 -3.221 3.060 950 2HB LYS 116 2HB LYS 116 -14.469 -3.255 1.357 951 1HG LYS 116 1HG LYS 116 -15.554 -5.535 1.742 952 2HG LYS 116 2HG LYS 116 -15.278 -5.316 3.459 953 1HD LYS 116 1HD LYS 116 -17.450 -4.475 3.265 954 2HD LYS 116 2HD LYS 116 -16.519 -3.000 3.096 955 1HE LYS 116 1HE LYS 116 -16.682 -4.119 0.473 956 2HE LYS 116 2HE LYS 116 -18.286 -4.278 1.160 957 1HZ LYS 116 1HZ LYS 116 -18.524 -2.058 1.285 958 2HZ LYS 116 2HZ LYS 116 -16.944 -1.752 1.562 959 3HZ LYS 116 3HZ LYS 116 -17.458 -2.076 0.047 960 H LYS 117 H LYS 117 -12.187 -4.786 -0.528 961 HA LYS 117 HA LYS 117 -13.754 -7.140 -1.181 962 1HB LYS 117 1HB LYS 117 -13.426 -4.890 -2.558 963 2HB LYS 117 2HB LYS 117 -12.005 -5.723 -3.156 964 1HG LYS 117 1HG LYS 117 -13.767 -7.754 -3.429 965 2HG LYS 117 2HG LYS 117 -14.913 -6.430 -3.507 966 1HD LYS 117 1HD LYS 117 -12.391 -6.444 -5.212 967 2HD LYS 117 2HD LYS 117 -13.853 -7.251 -5.741 968 1HE LYS 117 1HE LYS 117 -15.124 -5.125 -5.575 969 2HE LYS 117 2HE LYS 117 -13.709 -4.302 -4.950 970 1HZ LYS 117 1HZ LYS 117 -14.262 -5.177 -7.640 971 2HZ LYS 117 2HZ LYS 117 -13.468 -3.849 -7.119 972 3HZ LYS 117 3HZ LYS 117 -12.708 -5.294 -7.154 973 H TYR 118 H TYR 118 -10.361 -6.046 -0.800 974 HA TYR 118 HA TYR 118 -9.420 -8.697 -1.552 975 1HB TYR 118 1HB TYR 118 -8.545 -6.027 -1.811 976 2HB TYR 118 2HB TYR 118 -7.604 -6.580 -0.441 977 HD1 TYR 118 HD1 TYR 118 -7.707 -6.362 -3.957 978 HD2 TYR 118 HD2 TYR 118 -6.376 -8.915 -0.792 979 HE1 TYR 118 HE1 TYR 118 -6.046 -7.464 -5.535 980 HE2 TYR 118 HE2 TYR 118 -4.719 -10.008 -2.381 981 HH TYR 118 HH TYR 118 -3.569 -9.527 -4.389 982 H LEU 119 H LEU 119 -9.467 -6.426 1.264 983 HA LEU 119 HA LEU 119 -8.447 -8.611 2.919 984 1HB LEU 119 1HB LEU 119 -8.095 -5.746 2.859 985 2HB LEU 119 2HB LEU 119 -8.694 -6.253 4.426 986 HG LEU 119 HG LEU 119 -6.192 -7.255 3.042 987 1HD1 LEU 119 1HD1 LEU 119 -6.547 -5.573 5.539 988 2HD1 LEU 119 2HD1 LEU 119 -5.003 -6.159 4.875 989 3HD1 LEU 119 3HD1 LEU 119 -5.984 -4.995 3.952 990 1HD2 LEU 119 1HD2 LEU 119 -7.590 -8.190 5.539 991 2HD2 LEU 119 2HD2 LEU 119 -6.925 -9.142 4.190 992 3HD2 LEU 119 3HD2 LEU 119 -5.828 -8.356 5.350 993 HA PRO 120 HA PRO 120 -12.525 -9.171 4.315 994 1HB PRO 120 1HB PRO 120 -12.035 -11.177 6.105 995 2HB PRO 120 2HB PRO 120 -12.263 -11.457 4.390 996 1HG PRO 120 1HG PRO 120 -9.757 -11.498 5.958 997 2HG PRO 120 2HG PRO 120 -10.072 -12.177 4.373 998 1HD PRO 120 1HD PRO 120 -8.644 -9.758 4.951 999 2HD PRO 120 2HD PRO 120 -9.059 -10.376 3.365 1000 H LEU 121 H LEU 121 -11.738 -6.838 5.150 1001 HA LEU 121 HA LEU 121 -11.627 -6.954 8.049 1002 1HB LEU 121 1HB LEU 121 -10.059 -5.495 7.072 1003 2HB LEU 121 2HB LEU 121 -11.248 -4.786 5.998 1004 HG LEU 121 HG LEU 121 -12.394 -3.816 8.024 1005 1HD1 LEU 121 1HD1 LEU 121 -11.676 -4.112 10.129 1006 2HD1 LEU 121 2HD1 LEU 121 -10.883 -5.562 9.468 1007 3HD1 LEU 121 3HD1 LEU 121 -9.958 -4.055 9.666 1008 1HD2 LEU 121 1HD2 LEU 121 -11.274 -1.921 7.652 1009 2HD2 LEU 121 2HD2 LEU 121 -9.731 -2.614 8.204 1010 3HD2 LEU 121 3HD2 LEU 121 -10.277 -2.878 6.531 1011 H LYS 122 H LYS 122 -13.074 -5.328 9.262 1012 HA LYS 122 HA LYS 122 -15.675 -6.081 9.055 1013 1HB LYS 122 1HB LYS 122 -14.797 -5.009 11.023 1014 2HB LYS 122 2HB LYS 122 -14.470 -3.526 10.148 1015 1HG LYS 122 1HG LYS 122 -17.277 -4.361 9.846 1016 2HG LYS 122 2HG LYS 122 -16.841 -4.169 11.532 1017 1HD LYS 122 1HD LYS 122 -15.912 -1.884 11.003 1018 2HD LYS 122 2HD LYS 122 -16.434 -2.078 9.341 1019 1HE LYS 122 1HE LYS 122 -18.796 -2.280 10.070 1020 2HE LYS 122 2HE LYS 122 -18.310 -2.201 11.752 1021 1HZ LYS 122 1HZ LYS 122 -18.847 -0.052 11.278 1022 2HZ LYS 122 2HZ LYS 122 -17.236 -0.005 11.016 1023 3HZ LYS 122 3HZ LYS 122 -18.267 -0.088 9.752 1024 H SER 123 H SER 123 -17.469 -5.527 7.869 1025 HA SER 123 HA SER 123 -17.050 -4.300 5.425 1026 1HB SER 123 1HB SER 123 -19.639 -4.266 5.383 1027 2HB SER 123 2HB SER 123 -18.854 -5.825 5.541 1028 HG SER 123 HG SER 123 -19.303 -4.624 8.015 1029 H ASN 124 H ASN 124 -17.574 -2.202 4.624 1030 HA ASN 124 HA ASN 124 -17.556 -0.199 6.653 1031 1HB ASN 124 1HB ASN 124 -16.375 -0.254 4.255 1032 2HB ASN 124 2HB ASN 124 -17.911 0.373 3.691 1033 1HD2 ASN 124 1HD2 ASN 124 -17.334 2.392 3.176 1034 2HD2 ASN 124 2HD2 ASN 124 -16.754 3.589 4.286 Start of MODEL 7 1 1H MET 1 1H MET 1 -12.224 -15.010 17.445 2 HA MET 1 HA MET 1 -9.850 -15.754 15.961 3 1HB MET 1 1HB MET 1 -12.735 -16.200 15.745 4 2HB MET 1 2HB MET 1 -12.155 -15.474 14.260 5 1HG MET 1 1HG MET 1 -11.251 -17.452 13.611 6 2HG MET 1 2HG MET 1 -10.245 -17.492 15.046 7 1HE MET 1 1HE MET 1 -10.099 -19.067 16.276 8 2HE MET 1 2HE MET 1 -11.357 -19.920 17.203 9 3HE MET 1 3HE MET 1 -10.803 -20.575 15.644 10 H MET 2 H MET 2 -8.609 -14.127 15.143 11 HA MET 2 HA MET 2 -9.685 -12.203 13.472 12 1HB MET 2 1HB MET 2 -9.925 -11.547 16.246 13 2HB MET 2 2HB MET 2 -8.569 -10.596 15.672 14 1HG MET 2 1HG MET 2 -9.885 -9.419 14.092 15 2HG MET 2 2HG MET 2 -11.109 -10.670 14.022 16 1HE MET 2 1HE MET 2 -9.620 -7.780 16.498 17 2HE MET 2 2HE MET 2 -10.335 -7.414 14.910 18 3HE MET 2 3HE MET 2 -11.194 -6.955 16.399 19 H ASN 3 H ASN 3 -7.987 -10.731 12.596 20 HA ASN 3 HA ASN 3 -5.431 -10.629 13.499 21 1HB ASN 3 1HB ASN 3 -6.023 -13.208 12.273 22 2HB ASN 3 2HB ASN 3 -4.871 -12.355 11.265 23 1HD2 ASN 3 1HD2 ASN 3 -4.350 -14.705 12.716 24 2HD2 ASN 3 2HD2 ASN 3 -3.137 -14.388 13.910 25 H GLU 4 H GLU 4 -4.189 -9.268 12.040 26 HA GLU 4 HA GLU 4 -4.692 -9.059 9.340 27 1HB GLU 4 1HB GLU 4 -6.895 -8.103 10.252 28 2HB GLU 4 2HB GLU 4 -5.964 -6.755 10.873 29 1HG GLU 4 1HG GLU 4 -5.455 -5.929 8.738 30 2HG GLU 4 2HG GLU 4 -5.573 -7.504 7.979 31 H LYS 5 H LYS 5 -3.269 -7.480 8.328 32 HA LYS 5 HA LYS 5 -1.696 -5.829 10.113 33 1HB LYS 5 1HB LYS 5 -0.600 -8.230 8.665 34 2HB LYS 5 2HB LYS 5 0.416 -6.833 8.953 35 1HG LYS 5 1HG LYS 5 0.796 -7.624 11.044 36 2HG LYS 5 2HG LYS 5 -0.875 -7.261 11.428 37 1HD LYS 5 1HD LYS 5 -0.938 -9.521 11.889 38 2HD LYS 5 2HD LYS 5 -1.279 -9.624 10.173 39 1HE LYS 5 1HE LYS 5 0.641 -10.778 9.812 40 2HE LYS 5 2HE LYS 5 1.594 -9.489 10.521 41 1HZ LYS 5 1HZ LYS 5 1.994 -11.074 12.026 42 2HZ LYS 5 2HZ LYS 5 0.585 -10.582 12.689 43 3HZ LYS 5 3HZ LYS 5 0.620 -11.907 11.736 44 H ILE 6 H ILE 6 -0.280 -4.311 8.851 45 HA ILE 6 HA ILE 6 -0.653 -4.130 6.048 46 HB ILE 6 HB ILE 6 -2.575 -2.787 7.795 47 1HG1 ILE 6 1HG1 ILE 6 -3.050 -2.628 4.940 48 2HG1 ILE 6 2HG1 ILE 6 -2.539 -4.244 5.386 49 1HG2 ILE 6 1HG2 ILE 6 -1.088 -1.176 5.706 50 2HG2 ILE 6 2HG2 ILE 6 -2.657 -0.716 6.410 51 3HG2 ILE 6 3HG2 ILE 6 -1.217 -0.840 7.449 52 1HD1 ILE 6 1HD1 ILE 6 -4.262 -3.984 7.367 53 2HD1 ILE 6 2HD1 ILE 6 -4.941 -2.681 6.361 54 3HD1 ILE 6 3HD1 ILE 6 -4.864 -4.344 5.731 55 H LEU 7 H LEU 7 0.651 -2.398 5.128 56 HA LEU 7 HA LEU 7 2.370 -1.079 7.097 57 1HB LEU 7 1HB LEU 7 3.152 -3.275 5.599 58 2HB LEU 7 2HB LEU 7 3.771 -1.916 4.682 59 HG LEU 7 HG LEU 7 4.510 -1.273 7.268 60 1HD1 LEU 7 1HD1 LEU 7 4.979 -4.245 6.924 61 2HD1 LEU 7 2HD1 LEU 7 5.502 -3.217 8.280 62 3HD1 LEU 7 3HD1 LEU 7 3.769 -3.526 8.013 63 1HD2 LEU 7 1HD2 LEU 7 6.622 -1.293 6.429 64 2HD2 LEU 7 2HD2 LEU 7 6.420 -2.875 5.637 65 3HD2 LEU 7 3HD2 LEU 7 5.722 -1.413 4.898 66 H ILE 8 H ILE 8 3.116 0.992 6.479 67 HA ILE 8 HA ILE 8 1.850 1.994 4.023 68 HB ILE 8 HB ILE 8 2.172 3.269 6.732 69 1HG1 ILE 8 1HG1 ILE 8 -0.352 3.174 5.111 70 2HG1 ILE 8 2HG1 ILE 8 0.168 1.734 5.964 71 1HG2 ILE 8 1HG2 ILE 8 2.406 5.266 5.799 72 2HG2 ILE 8 2HG2 ILE 8 2.344 4.552 4.170 73 3HG2 ILE 8 3HG2 ILE 8 0.840 5.046 4.983 74 1HD1 ILE 8 1HD1 ILE 8 -0.925 2.646 7.748 75 2HD1 ILE 8 2HD1 ILE 8 0.522 3.669 7.911 76 3HD1 ILE 8 3HD1 ILE 8 -0.905 4.279 7.040 77 H VAL 9 H VAL 9 3.158 2.977 2.541 78 HA VAL 9 HA VAL 9 5.863 3.664 3.438 79 HB VAL 9 HB VAL 9 5.200 2.245 0.854 80 1HG1 VAL 9 1HG1 VAL 9 7.789 3.060 2.197 81 2HG1 VAL 9 2HG1 VAL 9 7.715 1.844 0.899 82 3HG1 VAL 9 3HG1 VAL 9 7.187 3.514 0.584 83 1HG2 VAL 9 1HG2 VAL 9 5.491 1.171 3.531 84 2HG2 VAL 9 2HG2 VAL 9 5.067 0.342 2.014 85 3HG2 VAL 9 3HG2 VAL 9 6.776 0.561 2.461 86 H ASP 10 H ASP 10 6.571 5.643 2.729 87 HA ASP 10 HA ASP 10 6.389 7.668 1.954 88 1HB ASP 10 1HB ASP 10 5.629 6.019 -0.483 89 2HB ASP 10 2HB ASP 10 5.716 7.766 -0.589 90 H ASP 11 H ASP 11 4.718 9.155 0.352 91 HA ASP 11 HA ASP 11 2.774 10.100 0.188 92 1HB ASP 11 1HB ASP 11 2.183 7.588 -0.490 93 2HB ASP 11 2HB ASP 11 1.306 7.587 1.026 94 H GLN 12 H GLN 12 4.159 9.219 2.948 95 HA GLN 12 HA GLN 12 1.949 9.355 4.744 96 1HB GLN 12 1HB GLN 12 3.919 9.497 6.457 97 2HB GLN 12 2HB GLN 12 3.683 8.006 5.568 98 1HG GLN 12 1HG GLN 12 5.584 8.308 4.263 99 2HG GLN 12 2HG GLN 12 5.445 10.055 4.265 100 1HE2 GLN 12 1HE2 GLN 12 5.507 10.951 6.658 101 2HE2 GLN 12 2HE2 GLN 12 6.877 10.443 7.588 102 H TYR 13 H TYR 13 0.920 11.261 5.156 103 HA TYR 13 HA TYR 13 2.512 13.558 5.862 104 1HB TYR 13 1HB TYR 13 1.572 13.119 3.197 105 2HB TYR 13 2HB TYR 13 0.379 14.199 3.890 106 HD1 TYR 13 HD1 TYR 13 3.508 14.012 2.247 107 HD2 TYR 13 HD2 TYR 13 1.341 16.332 5.116 108 HE1 TYR 13 HE1 TYR 13 5.038 15.995 1.811 109 HE2 TYR 13 HE2 TYR 13 2.879 18.306 4.670 110 HH TYR 13 HH TYR 13 5.438 18.427 3.772 111 H GLY 14 H GLY 14 0.513 11.620 7.058 112 1HA GLY 14 1HA GLY 14 -0.834 12.301 8.900 113 2HA GLY 14 2HA GLY 14 -1.409 13.667 7.965 114 H ILE 15 H ILE 15 -1.166 11.080 5.813 115 HA ILE 15 HA ILE 15 -4.035 10.658 5.974 116 HB ILE 15 HB ILE 15 -1.917 10.278 3.901 117 1HG1 ILE 15 1HG1 ILE 15 -4.145 11.312 2.699 118 2HG1 ILE 15 2HG1 ILE 15 -4.323 11.942 4.325 119 1HG2 ILE 15 1HG2 ILE 15 -4.464 8.714 4.139 120 2HG2 ILE 15 2HG2 ILE 15 -3.879 9.211 2.533 121 3HG2 ILE 15 3HG2 ILE 15 -2.854 8.200 3.580 122 1HD1 ILE 15 1HD1 ILE 15 -1.652 12.117 2.891 123 2HD1 ILE 15 2HD1 ILE 15 -2.924 13.332 2.620 124 3HD1 ILE 15 3HD1 ILE 15 -2.250 13.098 4.250 125 H ARG 16 H ARG 16 -0.916 8.866 6.161 126 HA ARG 16 HA ARG 16 -1.842 6.347 6.206 127 1HB ARG 16 1HB ARG 16 0.152 5.827 7.669 128 2HB ARG 16 2HB ARG 16 0.551 6.856 6.308 129 1HG ARG 16 1HG ARG 16 0.074 8.842 7.993 130 2HG ARG 16 2HG ARG 16 0.274 7.617 9.231 131 1HD ARG 16 1HD ARG 16 2.495 7.032 7.851 132 2HD ARG 16 2HD ARG 16 2.313 8.671 7.260 133 HE ARG 16 HE ARG 16 2.911 9.482 9.376 134 1HH1 ARG 16 1HH1 ARG 16 2.034 6.084 9.643 135 2HH1 ARG 16 2HH1 ARG 16 2.545 5.950 11.292 136 1HH2 ARG 16 1HH2 ARG 16 3.586 9.305 11.552 137 2HH2 ARG 16 2HH2 ARG 16 3.434 7.794 12.385 138 H ILE 17 H ILE 17 -1.530 8.617 9.028 139 HA ILE 17 HA ILE 17 -2.430 6.893 10.985 140 HB ILE 17 HB ILE 17 -2.704 9.889 10.735 141 1HG1 ILE 17 1HG1 ILE 17 -0.636 8.298 12.268 142 2HG1 ILE 17 2HG1 ILE 17 -0.388 8.841 10.620 143 1HG2 ILE 17 1HG2 ILE 17 -3.583 8.013 12.827 144 2HG2 ILE 17 2HG2 ILE 17 -2.590 9.370 13.410 145 3HG2 ILE 17 3HG2 ILE 17 -4.081 9.689 12.493 146 1HD1 ILE 17 1HD1 ILE 17 -0.561 10.451 13.150 147 2HD1 ILE 17 2HD1 ILE 17 0.507 10.660 11.741 148 3HD1 ILE 17 3HD1 ILE 17 -1.188 11.196 11.660 149 H LEU 18 H LEU 18 -4.326 9.240 8.965 150 HA LEU 18 HA LEU 18 -6.792 8.856 9.965 151 1HB LEU 18 1HB LEU 18 -5.916 10.271 7.990 152 2HB LEU 18 2HB LEU 18 -6.321 8.885 6.997 153 HG LEU 18 HG LEU 18 -8.660 9.166 8.317 154 1HD1 LEU 18 1HD1 LEU 18 -7.305 11.839 8.422 155 2HD1 LEU 18 2HD1 LEU 18 -9.065 11.746 8.167 156 3HD1 LEU 18 3HD1 LEU 18 -8.337 11.032 9.627 157 1HD2 LEU 18 1HD2 LEU 18 -9.477 9.586 6.273 158 2HD2 LEU 18 2HD2 LEU 18 -8.457 11.027 6.047 159 3HD2 LEU 18 3HD2 LEU 18 -7.789 9.407 5.740 160 H LEU 19 H LEU 19 -5.352 6.823 7.313 161 HA LEU 19 HA LEU 19 -7.456 4.933 7.490 162 1HB LEU 19 1HB LEU 19 -6.143 3.657 5.911 163 2HB LEU 19 2HB LEU 19 -6.270 5.337 5.430 164 HG LEU 19 HG LEU 19 -3.949 5.653 6.487 165 1HD1 LEU 19 1HD1 LEU 19 -2.656 3.365 6.255 166 2HD1 LEU 19 2HD1 LEU 19 -3.468 3.821 7.773 167 3HD1 LEU 19 3HD1 LEU 19 -4.252 2.682 6.651 168 1HD2 LEU 19 1HD2 LEU 19 -2.820 4.952 4.456 169 2HD2 LEU 19 2HD2 LEU 19 -4.188 3.896 4.029 170 3HD2 LEU 19 3HD2 LEU 19 -4.405 5.663 4.066 171 H ASN 20 H ASN 20 -4.513 5.529 9.278 172 HA ASN 20 HA ASN 20 -3.987 2.922 10.065 173 1HB ASN 20 1HB ASN 20 -2.526 5.040 10.359 174 2HB ASN 20 2HB ASN 20 -3.528 5.439 11.741 175 1HD2 ASN 20 1HD2 ASN 20 -1.232 5.286 12.610 176 2HD2 ASN 20 2HD2 ASN 20 -0.750 3.773 13.302 177 H GLU 21 H GLU 21 -5.510 5.671 11.931 178 HA GLU 21 HA GLU 21 -6.363 4.200 14.049 179 1HB GLU 21 1HB GLU 21 -6.434 6.595 14.159 180 2HB GLU 21 2HB GLU 21 -7.475 6.713 12.754 181 1HG GLU 21 1HG GLU 21 -9.326 5.621 14.006 182 2HG GLU 21 2HG GLU 21 -8.287 5.424 15.403 183 H VAL 22 H VAL 22 -7.600 4.283 10.766 184 HA VAL 22 HA VAL 22 -10.223 3.396 11.357 185 HB VAL 22 HB VAL 22 -8.520 3.305 8.862 186 1HG1 VAL 22 1HG1 VAL 22 -10.213 2.390 7.660 187 2HG1 VAL 22 2HG1 VAL 22 -10.657 1.691 9.236 188 3HG1 VAL 22 3HG1 VAL 22 -11.479 3.156 8.649 189 1HG2 VAL 22 1HG2 VAL 22 -10.878 5.093 9.069 190 2HG2 VAL 22 2HG2 VAL 22 -9.498 5.503 10.116 191 3HG2 VAL 22 3HG2 VAL 22 -9.273 5.381 8.354 192 H PHE 23 H PHE 23 -7.167 1.744 10.320 193 HA PHE 23 HA PHE 23 -8.445 -0.821 10.660 194 1HB PHE 23 1HB PHE 23 -5.690 0.263 9.861 195 2HB PHE 23 2HB PHE 23 -5.934 -1.457 10.085 196 HD1 PHE 23 HD1 PHE 23 -7.857 1.271 8.392 197 HD2 PHE 23 HD2 PHE 23 -6.107 -2.583 8.093 198 HE1 PHE 23 HE1 PHE 23 -8.680 1.081 6.028 199 HE2 PHE 23 HE2 PHE 23 -6.930 -2.774 5.729 200 HZ PHE 23 HZ PHE 23 -8.207 -0.940 4.725 201 H ASN 24 H ASN 24 -6.619 1.462 12.555 202 HA ASN 24 HA ASN 24 -5.247 -0.319 14.177 203 1HB ASN 24 1HB ASN 24 -5.287 2.386 13.941 204 2HB ASN 24 2HB ASN 24 -6.345 2.249 15.331 205 1HD2 ASN 24 1HD2 ASN 24 -5.311 2.580 17.133 206 2HD2 ASN 24 2HD2 ASN 24 -3.726 2.027 17.559 207 H LYS 25 H LYS 25 -8.604 0.866 14.058 208 HA LYS 25 HA LYS 25 -9.440 0.396 16.633 209 1HB LYS 25 1HB LYS 25 -10.802 0.334 13.951 210 2HB LYS 25 2HB LYS 25 -11.688 -0.112 15.395 211 1HG LYS 25 1HG LYS 25 -11.339 2.044 16.411 212 2HG LYS 25 2HG LYS 25 -10.083 2.470 15.266 213 1HD LYS 25 1HD LYS 25 -11.750 2.516 13.420 214 2HD LYS 25 2HD LYS 25 -13.015 2.025 14.529 215 1HE LYS 25 1HE LYS 25 -12.802 4.100 15.808 216 2HE LYS 25 2HE LYS 25 -11.363 4.562 14.921 217 1HZ LYS 25 1HZ LYS 25 -12.699 4.675 12.928 218 2HZ LYS 25 2HZ LYS 25 -14.041 4.242 13.753 219 3HZ LYS 25 3HZ LYS 25 -13.306 5.664 14.077 220 H GLU 26 H GLU 26 -8.291 -1.846 14.241 221 HA GLU 26 HA GLU 26 -9.652 -4.049 15.505 222 1HB GLU 26 1HB GLU 26 -7.793 -3.857 13.101 223 2HB GLU 26 2HB GLU 26 -8.385 -5.387 13.717 224 1HG GLU 26 1HG GLU 26 -10.384 -3.191 13.150 225 2HG GLU 26 2HG GLU 26 -9.703 -4.073 11.796 226 H GLY 27 H GLY 27 -6.630 -2.309 15.636 227 1HA GLY 27 1HA GLY 27 -5.042 -2.542 17.283 228 2HA GLY 27 2HA GLY 27 -5.659 -4.133 17.683 229 H TYR 28 H TYR 28 -5.304 -3.646 14.268 230 HA TYR 28 HA TYR 28 -3.370 -5.672 14.055 231 1HB TYR 28 1HB TYR 28 -3.671 -5.176 11.697 232 2HB TYR 28 2HB TYR 28 -5.203 -4.724 12.417 233 HD1 TYR 28 HD1 TYR 28 -3.695 -3.752 9.792 234 HD2 TYR 28 HD2 TYR 28 -4.276 -2.095 13.694 235 HE1 TYR 28 HE1 TYR 28 -3.455 -1.407 8.840 236 HE2 TYR 28 HE2 TYR 28 -4.034 0.245 12.728 237 HH TYR 28 HH TYR 28 -3.750 0.737 9.247 238 H GLN 29 H GLN 29 -1.167 -5.579 13.324 239 HA GLN 29 HA GLN 29 0.178 -3.298 14.391 240 1HB GLN 29 1HB GLN 29 0.776 -6.044 14.034 241 2HB GLN 29 2HB GLN 29 1.899 -5.199 12.987 242 1HG GLN 29 1HG GLN 29 2.865 -3.979 14.779 243 2HG GLN 29 2HG GLN 29 1.473 -4.206 15.818 244 1HE2 GLN 29 1HE2 GLN 29 3.204 -4.816 17.325 245 2HE2 GLN 29 2HE2 GLN 29 3.729 -6.466 17.390 246 H THR 30 H THR 30 1.301 -1.700 13.247 247 HA THR 30 HA THR 30 1.273 -1.952 10.317 248 HB THR 30 HB THR 30 0.628 0.503 10.293 249 HG1 THR 30 HG1 THR 30 1.254 1.090 12.425 250 1HG2 THR 30 1HG2 THR 30 -1.099 -1.719 11.165 251 2HG2 THR 30 2HG2 THR 30 -1.647 -0.162 11.832 252 3HG2 THR 30 3HG2 THR 30 -1.481 -0.367 10.072 253 H PHE 31 H PHE 31 2.861 -0.543 9.220 254 HA PHE 31 HA PHE 31 4.986 0.431 10.920 255 1HB PHE 31 1HB PHE 31 4.988 -2.201 9.876 256 2HB PHE 31 2HB PHE 31 5.907 -1.312 8.677 257 HD1 PHE 31 HD1 PHE 31 7.813 0.225 9.648 258 HD2 PHE 31 HD2 PHE 31 6.092 -3.051 11.723 259 HE1 PHE 31 HE1 PHE 31 9.855 0.072 11.100 260 HE2 PHE 31 HE2 PHE 31 8.134 -3.205 13.175 261 HZ PHE 31 HZ PHE 31 9.991 -1.642 12.845 262 H GLN 32 H GLN 32 6.410 1.904 9.825 263 HA GLN 32 HA GLN 32 5.396 2.639 7.190 264 1HB GLN 32 1HB GLN 32 6.567 4.407 9.381 265 2HB GLN 32 2HB GLN 32 6.190 4.973 7.766 266 1HG GLN 32 1HG GLN 32 4.251 5.528 9.019 267 2HG GLN 32 2HG GLN 32 3.791 4.062 8.175 268 1HE2 GLN 32 1HE2 GLN 32 2.617 2.814 9.398 269 2HE2 GLN 32 2HE2 GLN 32 2.853 2.456 11.076 270 H ALA 33 H ALA 33 6.956 3.312 5.576 271 HA ALA 33 HA ALA 33 9.751 2.848 6.289 272 1HB ALA 33 1HB ALA 33 9.346 0.741 5.406 273 2HB ALA 33 2HB ALA 33 8.075 1.328 4.306 274 3HB ALA 33 3HB ALA 33 9.788 1.635 3.931 275 H ALA 34 H ALA 34 11.204 3.606 4.391 276 HA ALA 34 HA ALA 34 9.890 5.811 2.970 277 1HB ALA 34 1HB ALA 34 12.682 6.139 4.031 278 2HB ALA 34 2HB ALA 34 11.432 7.367 3.716 279 3HB ALA 34 3HB ALA 34 11.318 6.330 5.158 280 H ASN 35 H ASN 35 10.199 3.320 1.813 281 HA ASN 35 HA ASN 35 11.629 3.918 -0.432 282 1HB ASN 35 1HB ASN 35 13.257 2.665 1.716 283 2HB ASN 35 2HB ASN 35 13.316 1.770 0.210 284 1HD2 ASN 35 1HD2 ASN 35 15.616 2.575 0.650 285 2HD2 ASN 35 2HD2 ASN 35 16.090 4.044 -0.137 286 H GLY 36 H GLY 36 12.183 1.525 -1.605 287 1HA GLY 36 1HA GLY 36 9.681 0.039 -1.330 288 2HA GLY 36 2HA GLY 36 10.828 -0.036 -2.653 289 H LEU 37 H LEU 37 13.244 -0.326 -0.976 290 HA LEU 37 HA LEU 37 13.133 -3.142 -0.660 291 1HB LEU 37 1HB LEU 37 15.086 -1.168 -1.017 292 2HB LEU 37 2HB LEU 37 15.428 -1.862 0.556 293 HG LEU 37 HG LEU 37 15.135 -3.450 -2.009 294 1HD1 LEU 37 1HD1 LEU 37 17.432 -2.058 -0.785 295 2HD1 LEU 37 2HD1 LEU 37 17.732 -3.744 -1.269 296 3HD1 LEU 37 3HD1 LEU 37 17.149 -2.565 -2.468 297 1HD2 LEU 37 1HD2 LEU 37 16.493 -5.055 -0.295 298 2HD2 LEU 37 2HD2 LEU 37 15.409 -4.206 0.833 299 3HD2 LEU 37 3HD2 LEU 37 14.731 -5.107 -0.544 300 H GLN 38 H GLN 38 13.505 -0.363 1.648 301 HA GLN 38 HA GLN 38 13.635 -1.832 3.927 302 1HB GLN 38 1HB GLN 38 12.741 0.938 3.226 303 2HB GLN 38 2HB GLN 38 12.275 0.355 4.812 304 1HG GLN 38 1HG GLN 38 14.424 0.413 5.609 305 2HG GLN 38 2HG GLN 38 15.095 -0.257 4.135 306 1HE2 GLN 38 1HE2 GLN 38 14.904 2.416 6.059 307 2HE2 GLN 38 2HE2 GLN 38 15.381 3.660 4.951 308 H ALA 39 H ALA 39 10.898 -1.292 1.787 309 HA ALA 39 HA ALA 39 8.950 -2.037 3.780 310 1HB ALA 39 1HB ALA 39 8.540 -1.807 0.784 311 2HB ALA 39 2HB ALA 39 7.356 -1.561 2.090 312 3HB ALA 39 3HB ALA 39 8.655 -0.372 1.831 313 H LEU 40 H LEU 40 11.024 -3.541 1.363 314 HA LEU 40 HA LEU 40 9.460 -5.882 1.034 315 1HB LEU 40 1HB LEU 40 12.241 -5.019 0.352 316 2HB LEU 40 2HB LEU 40 11.829 -6.720 0.261 317 HG LEU 40 HG LEU 40 10.655 -4.431 -1.322 318 1HD1 LEU 40 1HD1 LEU 40 12.840 -5.894 -1.862 319 2HD1 LEU 40 2HD1 LEU 40 11.600 -6.948 -2.583 320 3HD1 LEU 40 3HD1 LEU 40 11.753 -5.258 -3.120 321 1HD2 LEU 40 1HD2 LEU 40 9.454 -7.073 -0.678 322 2HD2 LEU 40 2HD2 LEU 40 8.682 -5.517 -1.065 323 3HD2 LEU 40 3HD2 LEU 40 9.354 -6.526 -2.369 324 H ASP 41 H ASP 41 12.200 -4.913 3.170 325 HA ASP 41 HA ASP 41 12.482 -7.448 4.296 326 1HB ASP 41 1HB ASP 41 13.773 -4.961 4.458 327 2HB ASP 41 2HB ASP 41 13.127 -5.174 6.073 328 H ILE 42 H ILE 42 10.785 -4.394 5.301 329 HA ILE 42 HA ILE 42 9.779 -5.483 7.709 330 HB ILE 42 HB ILE 42 9.129 -3.042 6.071 331 1HG1 ILE 42 1HG1 ILE 42 11.015 -3.711 8.210 332 2HG1 ILE 42 2HG1 ILE 42 11.032 -2.388 7.061 333 1HG2 ILE 42 1HG2 ILE 42 7.980 -3.730 8.788 334 2HG2 ILE 42 2HG2 ILE 42 7.681 -2.263 7.827 335 3HG2 ILE 42 3HG2 ILE 42 7.092 -3.840 7.250 336 1HD1 ILE 42 1HD1 ILE 42 10.788 -1.505 9.342 337 2HD1 ILE 42 2HD1 ILE 42 9.296 -1.196 8.422 338 3HD1 ILE 42 3HD1 ILE 42 9.352 -2.523 9.607 339 H VAL 43 H VAL 43 8.872 -5.708 4.334 340 HA VAL 43 HA VAL 43 6.147 -6.098 4.550 341 HB VAL 43 HB VAL 43 8.287 -6.580 2.646 342 1HG1 VAL 43 1HG1 VAL 43 6.022 -8.584 2.793 343 2HG1 VAL 43 2HG1 VAL 43 6.907 -8.242 1.287 344 3HG1 VAL 43 3HG1 VAL 43 7.772 -8.893 2.701 345 1HG2 VAL 43 1HG2 VAL 43 5.578 -6.322 1.585 346 2HG2 VAL 43 2HG2 VAL 43 5.938 -5.097 2.826 347 3HG2 VAL 43 3HG2 VAL 43 6.988 -5.251 1.397 348 H THR 44 H THR 44 8.827 -8.548 4.684 349 HA THR 44 HA THR 44 6.981 -10.615 5.440 350 HB THR 44 HB THR 44 10.043 -10.560 5.462 351 HG1 THR 44 HG1 THR 44 8.105 -11.388 3.425 352 1HG2 THR 44 1HG2 THR 44 9.658 -12.718 6.195 353 2HG2 THR 44 2HG2 THR 44 7.940 -12.662 5.732 354 3HG2 THR 44 3HG2 THR 44 9.181 -13.010 4.504 355 H LYS 45 H LYS 45 9.191 -8.354 7.090 356 HA LYS 45 HA LYS 45 9.234 -9.672 9.549 357 1HB LYS 45 1HB LYS 45 10.268 -7.300 8.420 358 2HB LYS 45 2HB LYS 45 9.346 -6.794 9.822 359 1HG LYS 45 1HG LYS 45 10.699 -9.091 10.722 360 2HG LYS 45 2HG LYS 45 11.877 -8.301 9.694 361 1HD LYS 45 1HD LYS 45 10.716 -6.193 11.187 362 2HD LYS 45 2HD LYS 45 10.893 -7.500 12.341 363 1HE LYS 45 1HE LYS 45 13.235 -7.001 10.528 364 2HE LYS 45 2HE LYS 45 12.911 -5.773 11.735 365 1HZ LYS 45 1HZ LYS 45 14.290 -7.959 12.221 366 2HZ LYS 45 2HZ LYS 45 13.462 -7.160 13.380 367 3HZ LYS 45 3HZ LYS 45 12.814 -8.485 12.680 368 H GLU 46 H GLU 46 6.917 -7.356 8.071 369 HA GLU 46 HA GLU 46 5.301 -7.622 10.471 370 1HB GLU 46 1HB GLU 46 5.615 -5.532 8.361 371 2HB GLU 46 2HB GLU 46 3.981 -5.765 8.950 372 1HG GLU 46 1HG GLU 46 5.726 -5.783 11.241 373 2HG GLU 46 2HG GLU 46 6.187 -4.415 10.248 374 H ARG 47 H ARG 47 5.742 -9.071 7.472 375 HA ARG 47 HA ARG 47 4.335 -9.900 5.941 376 1HB ARG 47 1HB ARG 47 3.173 -11.930 6.975 377 2HB ARG 47 2HB ARG 47 4.875 -11.783 7.364 378 1HG ARG 47 1HG ARG 47 4.472 -11.392 9.592 379 2HG ARG 47 2HG ARG 47 3.092 -10.362 9.269 380 1HD ARG 47 1HD ARG 47 2.443 -12.486 10.435 381 2HD ARG 47 2HD ARG 47 1.644 -12.308 8.886 382 HE ARG 47 HE ARG 47 4.017 -13.719 8.344 383 1HH1 ARG 47 1HH1 ARG 47 1.143 -14.206 10.315 384 2HH1 ARG 47 2HH1 ARG 47 1.207 -15.934 10.210 385 1HH2 ARG 47 1HH2 ARG 47 4.102 -15.999 8.205 386 2HH2 ARG 47 2HH2 ARG 47 2.902 -16.960 9.001 387 HA PRO 48 HA PRO 48 0.531 -7.616 7.158 388 1HB PRO 48 1HB PRO 48 0.649 -5.580 5.340 389 2HB PRO 48 2HB PRO 48 1.231 -5.429 6.986 390 1HG PRO 48 1HG PRO 48 2.787 -5.728 4.489 391 2HG PRO 48 2HG PRO 48 3.325 -5.159 6.057 392 1HD PRO 48 1HD PRO 48 3.809 -7.743 4.910 393 2HD PRO 48 2HD PRO 48 4.246 -7.214 6.522 394 H ASP 49 H ASP 49 -1.538 -7.361 6.057 395 HA ASP 49 HA ASP 49 -1.543 -9.273 3.891 396 1HB ASP 49 1HB ASP 49 -3.651 -8.100 5.732 397 2HB ASP 49 2HB ASP 49 -4.142 -8.893 4.248 398 H LEU 50 H LEU 50 -1.202 -5.972 4.303 399 HA LEU 50 HA LEU 50 -1.856 -5.384 1.625 400 1HB LEU 50 1HB LEU 50 -4.108 -5.436 3.024 401 2HB LEU 50 2HB LEU 50 -3.591 -3.825 3.482 402 HG LEU 50 HG LEU 50 -4.832 -3.274 1.670 403 1HD1 LEU 50 1HD1 LEU 50 -2.497 -2.598 1.184 404 2HD1 LEU 50 2HD1 LEU 50 -2.299 -4.079 0.215 405 3HD1 LEU 50 3HD1 LEU 50 -3.480 -2.842 -0.280 406 1HD2 LEU 50 1HD2 LEU 50 -4.331 -5.256 -0.344 407 2HD2 LEU 50 2HD2 LEU 50 -4.777 -6.058 1.182 408 3HD2 LEU 50 3HD2 LEU 50 -5.856 -4.833 0.472 409 H VAL 51 H VAL 51 -0.225 -4.051 1.076 410 HA VAL 51 HA VAL 51 0.661 -2.146 3.133 411 HB VAL 51 HB VAL 51 2.454 -3.543 3.052 412 1HG1 VAL 51 1HG1 VAL 51 3.249 -4.655 0.899 413 2HG1 VAL 51 2HG1 VAL 51 1.692 -5.216 1.555 414 3HG1 VAL 51 3HG1 VAL 51 1.724 -4.101 0.167 415 1HG2 VAL 51 1HG2 VAL 51 4.221 -2.564 1.693 416 2HG2 VAL 51 2HG2 VAL 51 3.016 -1.790 0.636 417 3HG2 VAL 51 3HG2 VAL 51 3.167 -1.282 2.336 418 H LEU 52 H LEU 52 0.750 -0.011 2.533 419 HA LEU 52 HA LEU 52 0.036 0.523 -0.262 420 1HB LEU 52 1HB LEU 52 -1.665 1.529 0.774 421 2HB LEU 52 2HB LEU 52 -0.835 1.606 2.315 422 HG LEU 52 HG LEU 52 -0.198 3.488 0.035 423 1HD1 LEU 52 1HD1 LEU 52 -2.513 3.471 1.860 424 2HD1 LEU 52 2HD1 LEU 52 -1.626 5.013 1.784 425 3HD1 LEU 52 3HD1 LEU 52 -2.279 4.287 0.296 426 1HD2 LEU 52 1HD2 LEU 52 1.503 3.980 1.394 427 2HD2 LEU 52 2HD2 LEU 52 0.288 4.777 2.421 428 3HD2 LEU 52 3HD2 LEU 52 0.785 3.103 2.766 429 H LEU 53 H LEU 53 1.494 1.519 -1.559 430 HA LEU 53 HA LEU 53 3.634 3.021 -0.250 431 1HB LEU 53 1HB LEU 53 4.695 0.971 -0.576 432 2HB LEU 53 2HB LEU 53 3.920 0.694 -2.123 433 HG LEU 53 HG LEU 53 5.829 2.996 -1.798 434 1HD1 LEU 53 1HD1 LEU 53 6.868 0.860 -0.901 435 2HD1 LEU 53 2HD1 LEU 53 6.748 0.221 -2.558 436 3HD1 LEU 53 3HD1 LEU 53 7.730 1.669 -2.232 437 1HD2 LEU 53 1HD2 LEU 53 4.256 2.247 -3.874 438 2HD2 LEU 53 2HD2 LEU 53 5.794 3.128 -4.044 439 3HD2 LEU 53 3HD2 LEU 53 5.751 1.361 -4.258 440 H ASP 54 H ASP 54 4.537 4.716 -1.567 441 HA ASP 54 HA ASP 54 2.690 5.441 -3.690 442 1HB ASP 54 1HB ASP 54 2.693 7.361 -2.450 443 2HB ASP 54 2HB ASP 54 4.146 6.903 -1.585 444 H MET 55 H MET 55 3.537 5.931 -5.798 445 HA MET 55 HA MET 55 5.858 4.658 -6.534 446 1HB MET 55 1HB MET 55 4.506 7.022 -7.947 447 2HB MET 55 2HB MET 55 5.488 5.790 -8.714 448 1HG MET 55 1HG MET 55 2.737 5.448 -7.449 449 2HG MET 55 2HG MET 55 3.184 5.183 -9.122 450 1HE MET 55 1HE MET 55 4.351 3.489 -5.383 451 2HE MET 55 2HE MET 55 2.743 4.134 -5.792 452 3HE MET 55 3HE MET 55 3.018 2.375 -5.772 453 H LYS 56 H LYS 56 5.326 8.252 -6.755 454 HA LYS 56 HA LYS 56 7.914 8.974 -7.123 455 1HB LYS 56 1HB LYS 56 7.199 11.117 -6.784 456 2HB LYS 56 2HB LYS 56 5.652 10.326 -7.013 457 1HG LYS 56 1HG LYS 56 5.558 10.024 -4.457 458 2HG LYS 56 2HG LYS 56 6.958 11.074 -4.359 459 1HD LYS 56 1HD LYS 56 4.715 12.114 -6.037 460 2HD LYS 56 2HD LYS 56 4.355 11.965 -4.328 461 1HE LYS 56 1HE LYS 56 6.291 13.358 -3.735 462 2HE LYS 56 2HE LYS 56 6.839 13.382 -5.400 463 1HZ LYS 56 1HZ LYS 56 4.244 14.448 -4.528 464 2HZ LYS 56 2HZ LYS 56 5.585 15.359 -4.730 465 3HZ LYS 56 3HZ LYS 56 4.913 14.599 -6.011 466 H ILE 57 H ILE 57 9.736 8.513 -6.025 467 HA ILE 57 HA ILE 57 9.609 8.678 -3.113 468 HB ILE 57 HB ILE 57 10.570 6.330 -4.730 469 1HG1 ILE 57 1HG1 ILE 57 8.895 6.238 -2.235 470 2HG1 ILE 57 2HG1 ILE 57 8.151 6.650 -3.767 471 1HG2 ILE 57 1HG2 ILE 57 12.347 7.035 -3.139 472 2HG2 ILE 57 2HG2 ILE 57 11.181 6.842 -1.808 473 3HG2 ILE 57 3HG2 ILE 57 11.658 5.432 -2.784 474 1HD1 ILE 57 1HD1 ILE 57 9.964 4.235 -3.635 475 2HD1 ILE 57 2HD1 ILE 57 8.304 4.117 -3.005 476 3HD1 ILE 57 3HD1 ILE 57 8.581 4.546 -4.711 477 HA PRO 58 HA PRO 58 13.162 11.011 -3.970 478 1HB PRO 58 1HB PRO 58 13.887 11.602 -1.402 479 2HB PRO 58 2HB PRO 58 12.670 12.501 -2.286 480 1HG PRO 58 1HG PRO 58 12.304 10.519 -0.123 481 2HG PRO 58 2HG PRO 58 11.172 11.720 -0.715 482 1HD PRO 58 1HD PRO 58 11.137 8.906 -1.272 483 2HD PRO 58 2HD PRO 58 10.077 10.123 -1.955 484 H GLY 59 H GLY 59 15.245 10.635 -4.495 485 1HA GLY 59 1HA GLY 59 17.321 9.716 -4.193 486 2HA GLY 59 2HA GLY 59 16.742 8.808 -2.811 487 H MET 60 H MET 60 14.330 8.223 -4.949 488 HA MET 60 HA MET 60 15.186 6.766 -6.994 489 1HB MET 60 1HB MET 60 15.989 5.491 -4.489 490 2HB MET 60 2HB MET 60 14.839 4.453 -5.308 491 1HG MET 60 1HG MET 60 16.248 4.725 -7.435 492 2HG MET 60 2HG MET 60 17.447 5.550 -6.458 493 1HE MET 60 1HE MET 60 15.072 2.786 -6.593 494 2HE MET 60 2HE MET 60 16.110 1.347 -6.728 495 3HE MET 60 3HE MET 60 15.513 1.866 -5.134 496 H ASP 61 H ASP 61 13.291 6.512 -8.090 497 HA ASP 61 HA ASP 61 10.861 6.621 -6.671 498 1HB ASP 61 1HB ASP 61 10.878 5.678 -9.512 499 2HB ASP 61 2HB ASP 61 9.889 6.914 -8.760 500 H GLY 62 H GLY 62 9.097 4.902 -6.939 501 1HA GLY 62 1HA GLY 62 10.246 2.249 -6.581 502 2HA GLY 62 2HA GLY 62 8.605 2.761 -6.243 503 H ILE 63 H ILE 63 10.355 3.440 -9.306 504 HA ILE 63 HA ILE 63 8.215 2.196 -10.763 505 HB ILE 63 HB ILE 63 10.736 3.611 -11.632 506 1HG1 ILE 63 1HG1 ILE 63 7.922 4.659 -11.866 507 2HG1 ILE 63 2HG1 ILE 63 8.817 4.843 -10.371 508 1HG2 ILE 63 1HG2 ILE 63 10.139 2.107 -13.387 509 2HG2 ILE 63 2HG2 ILE 63 8.417 2.539 -13.255 510 3HG2 ILE 63 3HG2 ILE 63 9.590 3.734 -13.859 511 1HD1 ILE 63 1HD1 ILE 63 10.222 6.420 -11.253 512 2HD1 ILE 63 2HD1 ILE 63 10.371 5.557 -12.803 513 3HD1 ILE 63 3HD1 ILE 63 8.957 6.593 -12.493 514 H GLU 64 H GLU 64 11.761 1.667 -10.261 515 HA GLU 64 HA GLU 64 11.553 -0.801 -11.714 516 1HB GLU 64 1HB GLU 64 13.990 0.227 -10.216 517 2HB GLU 64 2HB GLU 64 13.952 -0.895 -11.562 518 1HG GLU 64 1HG GLU 64 12.892 1.942 -11.852 519 2HG GLU 64 2HG GLU 64 14.596 1.588 -12.052 520 H ILE 65 H ILE 65 11.501 0.393 -8.404 521 HA ILE 65 HA ILE 65 12.338 -1.962 -7.122 522 HB ILE 65 HB ILE 65 10.541 0.261 -6.148 523 1HG1 ILE 65 1HG1 ILE 65 13.553 -0.050 -6.135 524 2HG1 ILE 65 2HG1 ILE 65 12.611 1.199 -6.926 525 1HG2 ILE 65 1HG2 ILE 65 12.033 -0.782 -4.025 526 2HG2 ILE 65 2HG2 ILE 65 10.288 -0.973 -4.319 527 3HG2 ILE 65 3HG2 ILE 65 11.430 -2.203 -4.912 528 1HD1 ILE 65 1HD1 ILE 65 13.323 0.896 -4.038 529 2HD1 ILE 65 2HD1 ILE 65 13.116 2.372 -5.011 530 3HD1 ILE 65 3HD1 ILE 65 11.689 1.514 -4.382 531 H LEU 66 H LEU 66 8.990 -0.610 -7.576 532 HA LEU 66 HA LEU 66 7.710 -2.921 -6.704 533 1HB LEU 66 1HB LEU 66 6.946 -0.495 -8.262 534 2HB LEU 66 2HB LEU 66 5.836 -1.851 -8.239 535 HG LEU 66 HG LEU 66 5.236 -0.238 -6.538 536 1HD1 LEU 66 1HD1 LEU 66 5.310 -2.894 -6.176 537 2HD1 LEU 66 2HD1 LEU 66 6.346 -2.391 -4.818 538 3HD1 LEU 66 3HD1 LEU 66 4.687 -1.760 -4.954 539 1HD2 LEU 66 1HD2 LEU 66 8.125 -0.409 -5.844 540 2HD2 LEU 66 2HD2 LEU 66 7.020 0.986 -5.849 541 3HD2 LEU 66 3HD2 LEU 66 6.969 -0.185 -4.510 542 H LYS 67 H LYS 67 9.226 -2.060 -9.779 543 HA LYS 67 HA LYS 67 7.881 -3.926 -11.382 544 1HB LYS 67 1HB LYS 67 10.018 -2.019 -11.630 545 2HB LYS 67 2HB LYS 67 10.528 -3.534 -12.347 546 1HG LYS 67 1HG LYS 67 8.076 -3.498 -13.414 547 2HG LYS 67 2HG LYS 67 8.181 -1.778 -13.092 548 1HD LYS 67 1HD LYS 67 9.656 -1.437 -14.798 549 2HD LYS 67 2HD LYS 67 10.655 -2.795 -14.319 550 1HE LYS 67 1HE LYS 67 9.051 -4.369 -15.421 551 2HE LYS 67 2HE LYS 67 8.042 -3.015 -15.891 552 1HZ LYS 67 1HZ LYS 67 9.493 -2.399 -17.468 553 2HZ LYS 67 2HZ LYS 67 10.823 -2.851 -16.635 554 3HZ LYS 67 3HZ LYS 67 9.932 -3.971 -17.421 555 H ARG 68 H ARG 68 11.241 -4.109 -9.994 556 HA ARG 68 HA ARG 68 11.594 -6.742 -10.608 557 1HB ARG 68 1HB ARG 68 12.811 -4.785 -8.701 558 2HB ARG 68 2HB ARG 68 13.100 -6.468 -8.309 559 1HG ARG 68 1HG ARG 68 14.062 -6.888 -10.527 560 2HG ARG 68 2HG ARG 68 13.611 -5.286 -11.077 561 1HD ARG 68 1HD ARG 68 15.834 -4.884 -10.508 562 2HD ARG 68 2HD ARG 68 15.073 -4.492 -8.980 563 HE ARG 68 HE ARG 68 16.194 -6.302 -8.040 564 1HH1 ARG 68 1HH1 ARG 68 15.812 -6.903 -11.486 565 2HH1 ARG 68 2HH1 ARG 68 16.693 -8.394 -11.454 566 1HH2 ARG 68 1HH2 ARG 68 17.357 -8.269 -7.996 567 2HH2 ARG 68 2HH2 ARG 68 17.578 -9.176 -9.455 568 H MET 69 H MET 69 9.955 -5.183 -7.839 569 HA MET 69 HA MET 69 9.885 -7.321 -6.119 570 1HB MET 69 1HB MET 69 8.589 -4.728 -6.477 571 2HB MET 69 2HB MET 69 7.382 -5.891 -5.964 572 1HG MET 69 1HG MET 69 8.171 -5.811 -3.837 573 2HG MET 69 2HG MET 69 9.751 -6.344 -4.378 574 1HE MET 69 1HE MET 69 8.523 -3.420 -2.194 575 2HE MET 69 2HE MET 69 8.212 -2.211 -3.464 576 3HE MET 69 3HE MET 69 7.371 -3.779 -3.503 577 H LYS 70 H LYS 70 7.412 -6.306 -8.587 578 HA LYS 70 HA LYS 70 5.826 -8.617 -8.125 579 1HB LYS 70 1HB LYS 70 4.343 -7.686 -9.618 580 2HB LYS 70 2HB LYS 70 5.172 -6.259 -9.030 581 1HG LYS 70 1HG LYS 70 5.134 -6.017 -11.409 582 2HG LYS 70 2HG LYS 70 6.775 -6.502 -11.028 583 1HD LYS 70 1HD LYS 70 6.579 -8.391 -12.270 584 2HD LYS 70 2HD LYS 70 5.140 -8.879 -11.397 585 1HE LYS 70 1HE LYS 70 4.279 -6.737 -13.041 586 2HE LYS 70 2HE LYS 70 5.367 -7.661 -14.058 587 1HZ LYS 70 1HZ LYS 70 3.769 -9.443 -12.657 588 2HZ LYS 70 2HZ LYS 70 2.786 -8.310 -13.303 589 3HZ LYS 70 3HZ LYS 70 3.794 -9.162 -14.265 590 H VAL 71 H VAL 71 8.324 -7.635 -10.526 591 HA VAL 71 HA VAL 71 8.019 -9.837 -12.209 592 HB VAL 71 HB VAL 71 10.486 -8.200 -11.589 593 1HG1 VAL 71 1HG1 VAL 71 9.822 -10.227 -13.685 594 2HG1 VAL 71 2HG1 VAL 71 10.787 -8.811 -14.165 595 3HG1 VAL 71 3HG1 VAL 71 11.366 -9.885 -12.868 596 1HG2 VAL 71 1HG2 VAL 71 8.876 -7.613 -14.005 597 2HG2 VAL 71 2HG2 VAL 71 8.114 -7.189 -12.453 598 3HG2 VAL 71 3HG2 VAL 71 9.705 -6.513 -12.878 599 H ILE 72 H ILE 72 9.461 -9.460 -9.015 600 HA ILE 72 HA ILE 72 11.010 -11.870 -9.230 601 HB ILE 72 HB ILE 72 10.486 -9.798 -7.146 602 1HG1 ILE 72 1HG1 ILE 72 12.321 -9.726 -8.943 603 2HG1 ILE 72 2HG1 ILE 72 12.773 -9.385 -7.284 604 1HG2 ILE 72 1HG2 ILE 72 10.239 -11.601 -5.712 605 2HG2 ILE 72 2HG2 ILE 72 11.371 -12.624 -6.628 606 3HG2 ILE 72 3HG2 ILE 72 11.989 -11.281 -5.636 607 1HD1 ILE 72 1HD1 ILE 72 13.942 -11.310 -8.960 608 2HD1 ILE 72 2HD1 ILE 72 14.167 -11.176 -7.199 609 3HD1 ILE 72 3HD1 ILE 72 12.919 -12.262 -7.857 610 H ASP 73 H ASP 73 7.857 -10.808 -7.876 611 HA ASP 73 HA ASP 73 7.121 -13.594 -7.801 612 1HB ASP 73 1HB ASP 73 7.115 -11.702 -5.429 613 2HB ASP 73 2HB ASP 73 5.927 -12.986 -5.517 614 H GLU 74 H GLU 74 4.787 -13.852 -8.072 615 HA GLU 74 HA GLU 74 3.499 -11.365 -8.849 616 1HB GLU 74 1HB GLU 74 2.174 -12.618 -10.360 617 2HB GLU 74 2HB GLU 74 3.760 -13.355 -10.476 618 1HG GLU 74 1HG GLU 74 3.033 -15.102 -8.801 619 2HG GLU 74 2HG GLU 74 1.432 -14.388 -8.787 620 H ASN 75 H ASN 75 3.850 -12.787 -6.057 621 HA ASN 75 HA ASN 75 1.013 -13.008 -5.460 622 1HB ASN 75 1HB ASN 75 2.969 -14.770 -4.815 623 2HB ASN 75 2HB ASN 75 3.160 -13.695 -3.445 624 1HD2 ASN 75 1HD2 ASN 75 2.528 -15.850 -2.470 625 2HD2 ASN 75 2HD2 ASN 75 0.848 -16.113 -2.140 626 H ILE 76 H ILE 76 3.671 -10.880 -5.386 627 HA ILE 76 HA ILE 76 3.486 -9.728 -2.855 628 HB ILE 76 HB ILE 76 5.333 -9.467 -4.485 629 1HG1 ILE 76 1HG1 ILE 76 4.461 -6.691 -3.821 630 2HG1 ILE 76 2HG1 ILE 76 4.597 -7.831 -2.497 631 1HG2 ILE 76 1HG2 ILE 76 4.039 -9.113 -6.515 632 2HG2 ILE 76 2HG2 ILE 76 3.425 -7.569 -5.877 633 3HG2 ILE 76 3HG2 ILE 76 5.158 -7.757 -6.238 634 1HD1 ILE 76 1HD1 ILE 76 6.779 -7.109 -4.504 635 2HD1 ILE 76 2HD1 ILE 76 6.745 -6.713 -2.769 636 3HD1 ILE 76 3HD1 ILE 76 6.933 -8.403 -3.292 637 H ARG 77 H ARG 77 2.092 -8.291 -1.921 638 HA ARG 77 HA ARG 77 0.035 -7.256 -3.703 639 1HB ARG 77 1HB ARG 77 -1.234 -8.694 -2.368 640 2HB ARG 77 2HB ARG 77 -0.136 -8.576 -1.007 641 1HG ARG 77 1HG ARG 77 -0.982 -6.365 -0.413 642 2HG ARG 77 2HG ARG 77 -1.907 -6.256 -1.897 643 1HD ARG 77 1HD ARG 77 -3.266 -6.887 0.172 644 2HD ARG 77 2HD ARG 77 -3.449 -7.977 -1.188 645 HE ARG 77 HE ARG 77 -1.329 -8.719 0.728 646 1HH1 ARG 77 1HH1 ARG 77 -4.681 -9.136 -0.257 647 2HH1 ARG 77 2HH1 ARG 77 -4.870 -10.647 0.569 648 1HH2 ARG 77 1HH2 ARG 77 -1.577 -10.712 1.818 649 2HH2 ARG 77 2HH2 ARG 77 -3.092 -11.549 1.757 650 H VAL 78 H VAL 78 0.435 -5.073 -3.955 651 HA VAL 78 HA VAL 78 0.787 -3.506 -1.531 652 HB VAL 78 HB VAL 78 2.667 -3.390 -3.899 653 1HG1 VAL 78 1HG1 VAL 78 2.512 -1.172 -3.211 654 2HG1 VAL 78 2HG1 VAL 78 2.278 -1.608 -1.501 655 3HG1 VAL 78 3HG1 VAL 78 3.883 -1.776 -2.251 656 1HG2 VAL 78 1HG2 VAL 78 3.004 -5.312 -2.306 657 2HG2 VAL 78 2HG2 VAL 78 4.383 -4.193 -2.431 658 3HG2 VAL 78 3HG2 VAL 78 3.298 -4.115 -1.022 659 H ILE 79 H ILE 79 0.343 -1.172 -1.928 660 HA ILE 79 HA ILE 79 -1.399 -0.874 -4.276 661 HB ILE 79 HB ILE 79 -1.889 -0.508 -1.464 662 1HG1 ILE 79 1HG1 ILE 79 -3.277 -1.133 -3.895 663 2HG1 ILE 79 2HG1 ILE 79 -3.761 -1.423 -2.236 664 1HG2 ILE 79 1HG2 ILE 79 -2.477 1.922 -3.175 665 2HG2 ILE 79 2HG2 ILE 79 -2.910 1.675 -1.466 666 3HG2 ILE 79 3HG2 ILE 79 -1.200 1.828 -1.938 667 1HD1 ILE 79 1HD1 ILE 79 -4.620 0.928 -2.085 668 2HD1 ILE 79 2HD1 ILE 79 -4.178 1.171 -3.792 669 3HD1 ILE 79 3HD1 ILE 79 -5.434 -0.013 -3.358 670 H ILE 80 H ILE 80 -1.237 1.032 -5.502 671 HA ILE 80 HA ILE 80 1.161 2.602 -4.872 672 HB ILE 80 HB ILE 80 1.422 2.990 -7.193 673 1HG1 ILE 80 1HG1 ILE 80 -0.208 1.880 -8.837 674 2HG1 ILE 80 2HG1 ILE 80 -1.323 1.762 -7.490 675 1HG2 ILE 80 1HG2 ILE 80 2.341 0.997 -7.595 676 2HG2 ILE 80 2HG2 ILE 80 1.653 0.497 -6.031 677 3HG2 ILE 80 3HG2 ILE 80 0.772 0.160 -7.541 678 1HD1 ILE 80 1HD1 ILE 80 -1.806 3.989 -7.544 679 2HD1 ILE 80 2HD1 ILE 80 -0.093 4.441 -7.717 680 3HD1 ILE 80 3HD1 ILE 80 -1.040 3.973 -9.150 681 H MET 81 H MET 81 1.074 4.930 -5.239 682 HA MET 81 HA MET 81 -1.621 5.976 -5.431 683 1HB MET 81 1HB MET 81 0.124 7.321 -3.409 684 2HB MET 81 2HB MET 81 -1.589 6.961 -3.320 685 1HG MET 81 1HG MET 81 -1.088 4.576 -2.819 686 2HG MET 81 2HG MET 81 0.630 4.885 -2.976 687 1HE MET 81 1HE MET 81 1.483 4.267 -0.589 688 2HE MET 81 2HE MET 81 2.104 5.777 -1.296 689 3HE MET 81 3HE MET 81 1.663 5.717 0.427 690 H THR 82 H THR 82 -1.706 7.720 -6.798 691 HA THR 82 HA THR 82 0.199 9.746 -6.901 692 HB THR 82 HB THR 82 1.815 8.261 -7.854 693 HG1 THR 82 HG1 THR 82 1.963 9.547 -9.656 694 1HG2 THR 82 1HG2 THR 82 1.264 6.763 -9.787 695 2HG2 THR 82 2HG2 THR 82 0.336 6.309 -8.337 696 3HG2 THR 82 3HG2 THR 82 -0.449 7.228 -9.645 697 H ALA 83 H ALA 83 -0.498 11.472 -8.154 698 HA ALA 83 HA ALA 83 -3.203 11.558 -8.718 699 1HB ALA 83 1HB ALA 83 -1.172 13.358 -8.493 700 2HB ALA 83 2HB ALA 83 -1.409 13.365 -10.257 701 3HB ALA 83 3HB ALA 83 -2.768 13.751 -9.175 702 H TYR 84 H TYR 84 -4.300 11.841 -10.838 703 HA TYR 84 HA TYR 84 -3.536 9.743 -12.606 704 1HB TYR 84 1HB TYR 84 -5.591 10.705 -13.823 705 2HB TYR 84 2HB TYR 84 -5.895 10.330 -12.138 706 HD1 TYR 84 HD1 TYR 84 -6.167 12.130 -10.474 707 HD2 TYR 84 HD2 TYR 84 -5.550 13.007 -14.616 708 HE1 TYR 84 HE1 TYR 84 -6.949 14.518 -10.092 709 HE2 TYR 84 HE2 TYR 84 -6.334 15.393 -14.220 710 HH TYR 84 HH TYR 84 -7.336 16.445 -10.973 711 H GLY 85 H GLY 85 -1.292 11.234 -12.654 712 1HA GLY 85 1HA GLY 85 -1.506 12.865 -15.113 713 2HA GLY 85 2HA GLY 85 -0.338 13.123 -13.832 714 H GLU 86 H GLU 86 0.337 10.336 -13.311 715 HA GLU 86 HA GLU 86 1.836 9.859 -15.758 716 1HB GLU 86 1HB GLU 86 3.155 8.318 -14.024 717 2HB GLU 86 2HB GLU 86 3.460 10.041 -14.121 718 1HG GLU 86 1HG GLU 86 2.121 10.507 -12.183 719 2HG GLU 86 2HG GLU 86 1.345 8.937 -12.235 720 H LEU 87 H LEU 87 -0.740 9.042 -16.039 721 HA LEU 87 HA LEU 87 -1.594 6.683 -15.038 722 1HB LEU 87 1HB LEU 87 -1.809 7.645 -17.894 723 2HB LEU 87 2HB LEU 87 -2.793 6.388 -17.171 724 HG LEU 87 HG LEU 87 -2.739 9.117 -15.917 725 1HD1 LEU 87 1HD1 LEU 87 -4.787 8.550 -18.019 726 2HD1 LEU 87 2HD1 LEU 87 -4.151 10.102 -17.421 727 3HD1 LEU 87 3HD1 LEU 87 -3.172 9.104 -18.524 728 1HD2 LEU 87 1HD2 LEU 87 -4.227 6.662 -15.597 729 2HD2 LEU 87 2HD2 LEU 87 -4.198 8.119 -14.575 730 3HD2 LEU 87 3HD2 LEU 87 -5.322 8.019 -15.952 731 H ASP 88 H ASP 88 0.979 7.235 -17.463 732 HA ASP 88 HA ASP 88 1.248 4.760 -18.480 733 1HB ASP 88 1HB ASP 88 2.792 7.124 -18.333 734 2HB ASP 88 2HB ASP 88 3.858 5.880 -17.709 735 H MET 89 H MET 89 2.951 6.108 -15.543 736 HA MET 89 HA MET 89 4.106 3.691 -14.821 737 1HB MET 89 1HB MET 89 4.985 5.771 -13.930 738 2HB MET 89 2HB MET 89 3.415 6.271 -13.335 739 1HG MET 89 1HG MET 89 4.701 5.521 -11.418 740 2HG MET 89 2HG MET 89 3.464 4.316 -11.712 741 1HE MET 89 1HE MET 89 6.969 3.775 -10.363 742 2HE MET 89 2HE MET 89 5.243 3.593 -9.968 743 3HE MET 89 3HE MET 89 6.204 2.169 -10.436 744 H ILE 90 H ILE 90 1.038 5.306 -13.802 745 HA ILE 90 HA ILE 90 0.356 3.539 -11.782 746 HB ILE 90 HB ILE 90 -1.240 5.294 -13.629 747 1HG1 ILE 90 1HG1 ILE 90 -1.237 5.764 -10.725 748 2HG1 ILE 90 2HG1 ILE 90 0.352 5.873 -11.456 749 1HG2 ILE 90 1HG2 ILE 90 -3.015 4.825 -11.680 750 2HG2 ILE 90 2HG2 ILE 90 -2.964 3.888 -13.192 751 3HG2 ILE 90 3HG2 ILE 90 -2.212 3.237 -11.716 752 1HD1 ILE 90 1HD1 ILE 90 -0.616 7.423 -13.211 753 2HD1 ILE 90 2HD1 ILE 90 -2.149 7.398 -12.308 754 3HD1 ILE 90 3HD1 ILE 90 -0.684 8.074 -11.556 755 H GLN 91 H GLN 91 -0.646 3.506 -15.276 756 HA GLN 91 HA GLN 91 -2.082 1.208 -15.180 757 1HB GLN 91 1HB GLN 91 -0.586 2.702 -17.290 758 2HB GLN 91 2HB GLN 91 -0.990 1.043 -17.684 759 1HG GLN 91 1HG GLN 91 -3.289 2.317 -16.434 760 2HG GLN 91 2HG GLN 91 -2.714 3.325 -17.748 761 1HE2 GLN 91 1HE2 GLN 91 -4.793 2.749 -18.676 762 2HE2 GLN 91 2HE2 GLN 91 -4.955 1.295 -19.603 763 H GLU 92 H GLU 92 1.466 1.589 -15.841 764 HA GLU 92 HA GLU 92 2.013 -1.048 -16.284 765 1HB GLU 92 1HB GLU 92 3.468 1.295 -16.144 766 2HB GLU 92 2HB GLU 92 4.081 0.434 -14.746 767 1HG GLU 92 1HG GLU 92 5.407 -0.761 -16.144 768 2HG GLU 92 2HG GLU 92 3.964 -1.534 -16.769 769 H SER 93 H SER 93 1.972 0.791 -13.163 770 HA SER 93 HA SER 93 2.855 -1.270 -11.577 771 1HB SER 93 1HB SER 93 2.067 0.030 -9.725 772 2HB SER 93 2HB SER 93 2.548 1.181 -10.955 773 HG SER 93 HG SER 93 -0.144 0.321 -10.327 774 H LYS 94 H LYS 94 -0.504 -0.295 -12.533 775 HA LYS 94 HA LYS 94 -1.792 -2.271 -11.018 776 1HB LYS 94 1HB LYS 94 -2.515 -0.100 -12.643 777 2HB LYS 94 2HB LYS 94 -3.232 -1.497 -13.420 778 1HG LYS 94 1HG LYS 94 -3.476 -1.107 -10.416 779 2HG LYS 94 2HG LYS 94 -4.570 -0.286 -11.512 780 1HD LYS 94 1HD LYS 94 -4.117 -3.307 -11.512 781 2HD LYS 94 2HD LYS 94 -5.427 -2.519 -10.656 782 1HE LYS 94 1HE LYS 94 -5.706 -1.406 -13.172 783 2HE LYS 94 2HE LYS 94 -5.092 -2.996 -13.580 784 1HZ LYS 94 1HZ LYS 94 -7.590 -2.649 -13.227 785 2HZ LYS 94 2HZ LYS 94 -6.893 -4.003 -12.637 786 3HZ LYS 94 3HZ LYS 94 -7.246 -2.762 -11.635 787 H GLU 95 H GLU 95 -0.671 -2.158 -14.455 788 HA GLU 95 HA GLU 95 -1.626 -4.755 -14.973 789 1HB GLU 95 1HB GLU 95 -0.974 -4.340 -17.136 790 2HB GLU 95 2HB GLU 95 -0.921 -2.687 -16.557 791 1HG GLU 95 1HG GLU 95 1.201 -2.839 -17.503 792 2HG GLU 95 2HG GLU 95 1.574 -3.321 -15.860 793 H LEU 96 H LEU 96 0.995 -3.578 -13.141 794 HA LEU 96 HA LEU 96 2.882 -5.612 -13.814 795 1HB LEU 96 1HB LEU 96 2.752 -3.226 -12.182 796 2HB LEU 96 2HB LEU 96 3.497 -4.545 -11.299 797 HG LEU 96 HG LEU 96 5.210 -4.809 -12.961 798 1HD1 LEU 96 1HD1 LEU 96 3.379 -3.943 -14.788 799 2HD1 LEU 96 2HD1 LEU 96 4.456 -2.531 -14.668 800 3HD1 LEU 96 3HD1 LEU 96 5.123 -4.126 -15.095 801 1HD2 LEU 96 1HD2 LEU 96 4.849 -1.849 -12.425 802 2HD2 LEU 96 2HD2 LEU 96 5.495 -3.031 -11.261 803 3HD2 LEU 96 3HD2 LEU 96 6.372 -2.701 -12.775 804 H GLY 97 H GLY 97 -0.024 -5.441 -11.947 805 1HA GLY 97 1HA GLY 97 -0.953 -7.525 -11.225 806 2HA GLY 97 2HA GLY 97 0.645 -8.048 -10.731 807 H ALA 98 H ALA 98 -0.426 -4.702 -10.167 808 HA ALA 98 HA ALA 98 -0.110 -5.128 -7.330 809 1HB ALA 98 1HB ALA 98 -0.493 -2.743 -9.154 810 2HB ALA 98 2HB ALA 98 -0.615 -2.582 -7.386 811 3HB ALA 98 3HB ALA 98 0.900 -3.151 -8.125 812 H LEU 99 H LEU 99 -1.839 -3.856 -5.909 813 HA LEU 99 HA LEU 99 -4.251 -5.268 -6.235 814 1HB LEU 99 1HB LEU 99 -3.552 -2.935 -4.446 815 2HB LEU 99 2HB LEU 99 -4.993 -3.923 -4.306 816 HG LEU 99 HG LEU 99 -3.920 -5.585 -3.238 817 1HD1 LEU 99 1HD1 LEU 99 -1.860 -6.584 -3.851 818 2HD1 LEU 99 2HD1 LEU 99 -2.678 -6.139 -5.368 819 3HD1 LEU 99 3HD1 LEU 99 -1.341 -5.139 -4.751 820 1HD2 LEU 99 1HD2 LEU 99 -3.010 -4.410 -1.592 821 2HD2 LEU 99 2HD2 LEU 99 -1.470 -4.422 -2.484 822 3HD2 LEU 99 3HD2 LEU 99 -2.613 -3.075 -2.700 823 H THR 100 H THR 100 -3.359 -1.781 -6.679 824 HA THR 100 HA THR 100 -5.031 -1.475 -8.905 825 HB THR 100 HB THR 100 -6.843 -1.756 -7.200 826 HG1 THR 100 HG1 THR 100 -7.807 -0.080 -8.297 827 1HG2 THR 100 1HG2 THR 100 -6.231 -0.916 -5.110 828 2HG2 THR 100 2HG2 THR 100 -5.209 0.360 -5.814 829 3HG2 THR 100 3HG2 THR 100 -6.977 0.556 -5.776 830 H HIS 101 H HIS 101 -5.716 1.338 -8.328 831 HA HIS 101 HA HIS 101 -3.135 2.509 -7.767 832 1HB HIS 101 1HB HIS 101 -3.424 3.873 -9.967 833 2HB HIS 101 2HB HIS 101 -2.667 2.293 -10.002 834 HD1 HIS 101 HD1 HIS 101 -3.332 1.854 -12.467 835 HD2 HIS 101 HD2 HIS 101 -6.594 2.523 -9.917 836 HE1 HIS 101 HE1 HIS 101 -5.415 1.193 -13.783 837 H PHE 102 H PHE 102 -3.437 4.318 -6.556 838 HA PHE 102 HA PHE 102 -6.121 5.502 -6.660 839 1HB PHE 102 1HB PHE 102 -3.949 5.261 -4.496 840 2HB PHE 102 2HB PHE 102 -5.369 6.267 -4.283 841 HD1 PHE 102 HD1 PHE 102 -4.755 4.158 -2.372 842 HD2 PHE 102 HD2 PHE 102 -6.930 3.946 -6.010 843 HE1 PHE 102 HE1 PHE 102 -6.027 2.179 -1.497 844 HE2 PHE 102 HE2 PHE 102 -8.201 1.967 -5.135 845 HZ PHE 102 HZ PHE 102 -7.735 1.107 -2.889 846 H ALA 103 H ALA 103 -6.242 7.872 -6.266 847 HA ALA 103 HA ALA 103 -3.838 9.189 -7.326 848 1HB ALA 103 1HB ALA 103 -5.447 10.903 -8.168 849 2HB ALA 103 2HB ALA 103 -5.744 9.286 -8.851 850 3HB ALA 103 3HB ALA 103 -6.788 9.909 -7.551 851 H LYS 104 H LYS 104 -3.152 11.165 -6.350 852 HA LYS 104 HA LYS 104 -2.868 11.412 -3.801 853 1HB LYS 104 1HB LYS 104 -3.107 13.335 -5.966 854 2HB LYS 104 2HB LYS 104 -3.615 14.042 -4.445 855 1HG LYS 104 1HG LYS 104 -1.502 13.964 -3.547 856 2HG LYS 104 2HG LYS 104 -1.161 12.383 -4.221 857 1HD LYS 104 1HD LYS 104 0.325 13.793 -5.404 858 2HD LYS 104 2HD LYS 104 -1.006 13.595 -6.527 859 1HE LYS 104 1HE LYS 104 -1.681 15.816 -4.840 860 2HE LYS 104 2HE LYS 104 -0.009 16.037 -5.313 861 1HZ LYS 104 1HZ LYS 104 -1.962 16.782 -6.836 862 2HZ LYS 104 2HZ LYS 104 -0.575 16.208 -7.479 863 3HZ LYS 104 3HZ LYS 104 -1.885 15.240 -7.370 864 HA PRO 105 HA PRO 105 -7.184 13.039 -2.855 865 1HB PRO 105 1HB PRO 105 -9.042 13.363 -4.833 866 2HB PRO 105 2HB PRO 105 -8.013 14.662 -4.262 867 1HG PRO 105 1HG PRO 105 -7.823 13.116 -6.774 868 2HG PRO 105 2HG PRO 105 -7.098 14.661 -6.379 869 1HD PRO 105 1HD PRO 105 -5.778 12.116 -6.458 870 2HD PRO 105 2HD PRO 105 -5.082 13.642 -5.951 871 H PHE 106 H PHE 106 -7.238 11.073 -1.757 872 HA PHE 106 HA PHE 106 -9.143 9.247 -3.035 873 1HB PHE 106 1HB PHE 106 -7.575 7.601 -1.493 874 2HB PHE 106 2HB PHE 106 -7.207 7.927 -3.175 875 HD1 PHE 106 HD1 PHE 106 -4.948 8.189 -3.498 876 HD2 PHE 106 HD2 PHE 106 -6.692 9.836 0.002 877 HE1 PHE 106 HE1 PHE 106 -2.718 9.126 -2.829 878 HE2 PHE 106 HE2 PHE 106 -4.462 10.773 0.672 879 HZ PHE 106 HZ PHE 106 -2.502 10.407 -0.752 880 H ASP 107 H ASP 107 -10.405 7.927 -1.508 881 HA ASP 107 HA ASP 107 -10.590 9.293 1.058 882 1HB ASP 107 1HB ASP 107 -12.548 8.835 -0.887 883 2HB ASP 107 2HB ASP 107 -12.842 7.541 0.257 884 H ILE 108 H ILE 108 -10.733 7.949 2.978 885 HA ILE 108 HA ILE 108 -9.470 5.427 2.749 886 HB ILE 108 HB ILE 108 -9.906 7.342 4.723 887 1HG1 ILE 108 1HG1 ILE 108 -7.846 6.090 4.348 888 2HG1 ILE 108 2HG1 ILE 108 -8.347 5.991 6.025 889 1HG2 ILE 108 1HG2 ILE 108 -12.000 6.331 5.375 890 2HG2 ILE 108 2HG2 ILE 108 -11.234 4.728 5.486 891 3HG2 ILE 108 3HG2 ILE 108 -10.772 6.016 6.625 892 1HD1 ILE 108 1HD1 ILE 108 -8.518 3.733 5.921 893 2HD1 ILE 108 2HD1 ILE 108 -9.547 3.821 4.471 894 3HD1 ILE 108 3HD1 ILE 108 -7.774 3.828 4.307 895 H ASP 109 H ASP 109 -12.850 6.555 3.206 896 HA ASP 109 HA ASP 109 -13.957 4.145 3.865 897 1HB ASP 109 1HB ASP 109 -14.961 6.585 2.373 898 2HB ASP 109 2HB ASP 109 -16.006 5.187 2.525 899 H GLU 110 H GLU 110 -13.269 5.673 0.650 900 HA GLU 110 HA GLU 110 -14.458 3.616 -0.834 901 1HB GLU 110 1HB GLU 110 -13.526 4.725 -2.763 902 2HB GLU 110 2HB GLU 110 -14.008 5.975 -1.632 903 1HG GLU 110 1HG GLU 110 -11.835 6.627 -1.204 904 2HG GLU 110 2HG GLU 110 -11.211 4.992 -1.288 905 H ILE 111 H ILE 111 -11.395 3.958 0.818 906 HA ILE 111 HA ILE 111 -10.058 1.992 -0.806 907 HB ILE 111 HB ILE 111 -9.371 3.696 1.547 908 1HG1 ILE 111 1HG1 ILE 111 -7.961 3.184 -1.088 909 2HG1 ILE 111 2HG1 ILE 111 -9.103 4.483 -0.808 910 1HG2 ILE 111 1HG2 ILE 111 -7.761 1.285 0.662 911 2HG2 ILE 111 2HG2 ILE 111 -7.223 2.540 1.804 912 3HG2 ILE 111 3HG2 ILE 111 -8.596 1.487 2.221 913 1HD1 ILE 111 1HD1 ILE 111 -7.641 5.293 1.097 914 2HD1 ILE 111 2HD1 ILE 111 -6.449 4.054 0.635 915 3HD1 ILE 111 3HD1 ILE 111 -6.854 5.365 -0.498 916 H ARG 112 H ARG 112 -12.300 2.058 1.832 917 HA ARG 112 HA ARG 112 -11.385 -0.337 3.021 918 1HB ARG 112 1HB ARG 112 -14.091 1.078 3.236 919 2HB ARG 112 2HB ARG 112 -13.545 -0.206 4.297 920 1HG ARG 112 1HG ARG 112 -11.417 1.508 4.512 921 2HG ARG 112 2HG ARG 112 -12.695 2.663 4.191 922 1HD ARG 112 1HD ARG 112 -13.520 0.626 6.162 923 2HD ARG 112 2HD ARG 112 -12.096 1.505 6.683 924 HE ARG 112 HE ARG 112 -13.744 3.528 5.793 925 1HH1 ARG 112 1HH1 ARG 112 -14.222 0.852 8.028 926 2HH1 ARG 112 2HH1 ARG 112 -15.395 1.694 8.985 927 1HH2 ARG 112 1HH2 ARG 112 -15.292 4.638 7.055 928 2HH2 ARG 112 2HH2 ARG 112 -16.008 3.862 8.427 929 H ASP 113 H ASP 113 -13.241 0.501 0.210 930 HA ASP 113 HA ASP 113 -14.841 -1.846 0.217 931 1HB ASP 113 1HB ASP 113 -14.729 0.621 -1.213 932 2HB ASP 113 2HB ASP 113 -14.482 -0.630 -2.415 933 H ALA 114 H ALA 114 -11.916 -0.567 -1.511 934 HA ALA 114 HA ALA 114 -11.564 -2.849 -3.136 935 1HB ALA 114 1HB ALA 114 -9.514 -1.788 -3.774 936 2HB ALA 114 2HB ALA 114 -10.689 -0.480 -3.498 937 3HB ALA 114 3HB ALA 114 -9.455 -0.842 -2.267 938 H VAL 115 H VAL 115 -10.456 -1.859 0.126 939 HA VAL 115 HA VAL 115 -8.657 -4.081 0.337 940 HB VAL 115 HB VAL 115 -9.664 -1.937 2.197 941 1HG1 VAL 115 1HG1 VAL 115 -9.385 -4.019 3.504 942 2HG1 VAL 115 2HG1 VAL 115 -7.714 -4.156 2.905 943 3HG1 VAL 115 3HG1 VAL 115 -8.180 -2.782 3.937 944 1HG2 VAL 115 1HG2 VAL 115 -7.845 -1.651 0.320 945 2HG2 VAL 115 2HG2 VAL 115 -7.596 -0.938 1.931 946 3HG2 VAL 115 3HG2 VAL 115 -6.790 -2.465 1.499 947 H LYS 116 H LYS 116 -12.070 -3.521 0.698 948 HA LYS 116 HA LYS 116 -12.439 -5.655 2.596 949 1HB LYS 116 1HB LYS 116 -13.959 -3.890 2.851 950 2HB LYS 116 2HB LYS 116 -14.250 -3.747 1.129 951 1HG LYS 116 1HG LYS 116 -14.913 -6.447 1.991 952 2HG LYS 116 2HG LYS 116 -15.728 -5.293 3.029 953 1HD LYS 116 1HD LYS 116 -17.253 -4.912 1.398 954 2HD LYS 116 2HD LYS 116 -15.984 -4.280 0.367 955 1HE LYS 116 1HE LYS 116 -16.011 -7.245 0.514 956 2HE LYS 116 2HE LYS 116 -17.487 -6.570 -0.147 957 1HZ LYS 116 1HZ LYS 116 -14.948 -5.535 -1.106 958 2HZ LYS 116 2HZ LYS 116 -15.446 -6.994 -1.645 959 3HZ LYS 116 3HZ LYS 116 -16.373 -5.673 -1.892 960 H LYS 117 H LYS 117 -12.449 -5.139 -0.921 961 HA LYS 117 HA LYS 117 -13.653 -7.715 -1.401 962 1HB LYS 117 1HB LYS 117 -13.645 -7.110 -3.680 963 2HB LYS 117 2HB LYS 117 -14.047 -5.647 -2.804 964 1HG LYS 117 1HG LYS 117 -12.259 -4.585 -3.705 965 2HG LYS 117 2HG LYS 117 -11.175 -5.767 -2.998 966 1HD LYS 117 1HD LYS 117 -10.713 -6.500 -5.093 967 2HD LYS 117 2HD LYS 117 -12.348 -7.124 -5.183 968 1HE LYS 117 1HE LYS 117 -12.117 -4.193 -5.681 969 2HE LYS 117 2HE LYS 117 -11.313 -5.196 -6.871 970 1HZ LYS 117 1HZ LYS 117 -13.919 -4.657 -6.859 971 2HZ LYS 117 2HZ LYS 117 -13.252 -5.938 -7.622 972 3HZ LYS 117 3HZ LYS 117 -13.914 -6.124 -6.141 973 H TYR 118 H TYR 118 -10.443 -6.237 -1.122 974 HA TYR 118 HA TYR 118 -9.199 -8.646 -2.193 975 1HB TYR 118 1HB TYR 118 -8.665 -5.975 -2.437 976 2HB TYR 118 2HB TYR 118 -7.800 -6.248 -0.938 977 HD1 TYR 118 HD1 TYR 118 -6.326 -8.605 -1.104 978 HD2 TYR 118 HD2 TYR 118 -7.326 -5.968 -4.321 979 HE1 TYR 118 HE1 TYR 118 -4.318 -9.439 -2.421 980 HE2 TYR 118 HE2 TYR 118 -5.314 -6.810 -5.627 981 HH TYR 118 HH TYR 118 -2.833 -8.173 -4.430 982 H LEU 119 H LEU 119 -9.376 -6.667 0.833 983 HA LEU 119 HA LEU 119 -8.149 -8.942 2.224 984 1HB LEU 119 1HB LEU 119 -7.648 -6.120 2.283 985 2HB LEU 119 2HB LEU 119 -8.203 -6.634 3.864 986 HG LEU 119 HG LEU 119 -5.618 -6.721 2.989 987 1HD1 LEU 119 1HD1 LEU 119 -7.082 -7.417 5.288 988 2HD1 LEU 119 2HD1 LEU 119 -6.004 -8.794 4.954 989 3HD1 LEU 119 3HD1 LEU 119 -5.327 -7.159 5.143 990 1HD2 LEU 119 1HD2 LEU 119 -6.451 -9.615 2.918 991 2HD2 LEU 119 2HD2 LEU 119 -6.388 -8.627 1.438 992 3HD2 LEU 119 3HD2 LEU 119 -4.917 -8.869 2.411 993 HA PRO 120 HA PRO 120 -11.877 -9.510 4.321 994 1HB PRO 120 1HB PRO 120 -11.043 -10.708 6.631 995 2HB PRO 120 2HB PRO 120 -11.209 -11.566 5.112 996 1HG PRO 120 1HG PRO 120 -8.744 -10.664 6.473 997 2HG PRO 120 2HG PRO 120 -8.924 -11.865 5.209 998 1HD PRO 120 1HD PRO 120 -7.957 -9.182 4.902 999 2HD PRO 120 2HD PRO 120 -8.246 -10.345 3.623 1000 H LEU 121 H LEU 121 -11.511 -6.931 4.320 1001 HA LEU 121 HA LEU 121 -11.225 -5.972 7.003 1002 1HB LEU 121 1HB LEU 121 -11.240 -4.909 4.326 1003 2HB LEU 121 2HB LEU 121 -12.328 -3.983 5.341 1004 HG LEU 121 HG LEU 121 -9.951 -3.143 5.179 1005 1HD1 LEU 121 1HD1 LEU 121 -11.496 -2.407 6.930 1006 2HD1 LEU 121 2HD1 LEU 121 -10.994 -3.774 7.954 1007 3HD1 LEU 121 3HD1 LEU 121 -9.823 -2.502 7.530 1008 1HD2 LEU 121 1HD2 LEU 121 -8.940 -5.454 5.335 1009 2HD2 LEU 121 2HD2 LEU 121 -8.188 -4.204 6.355 1010 3HD2 LEU 121 3HD2 LEU 121 -9.290 -5.400 7.080 1011 H LYS 122 H LYS 122 -13.019 -4.398 7.851 1012 HA LYS 122 HA LYS 122 -15.178 -5.851 8.600 1013 1HB LYS 122 1HB LYS 122 -14.222 -3.407 9.202 1014 2HB LYS 122 2HB LYS 122 -15.601 -2.926 8.234 1015 1HG LYS 122 1HG LYS 122 -17.100 -4.332 9.646 1016 2HG LYS 122 2HG LYS 122 -15.727 -4.858 10.599 1017 1HD LYS 122 1HD LYS 122 -16.695 -3.084 11.869 1018 2HD LYS 122 2HD LYS 122 -15.287 -2.366 11.111 1019 1HE LYS 122 1HE LYS 122 -17.142 -1.867 9.164 1020 2HE LYS 122 2HE LYS 122 -18.194 -1.879 10.565 1021 1HZ LYS 122 1HZ LYS 122 -16.444 -0.354 11.566 1022 2HZ LYS 122 2HZ LYS 122 -15.917 -0.133 10.036 1023 3HZ LYS 122 3HZ LYS 122 -17.446 0.274 10.439 1024 H SER 123 H SER 123 -17.005 -6.618 7.668 1025 HA SER 123 HA SER 123 -17.357 -6.275 4.924 1026 1HB SER 123 1HB SER 123 -19.339 -7.664 5.204 1027 2HB SER 123 2HB SER 123 -18.062 -8.292 6.226 1028 HG SER 123 HG SER 123 -20.087 -6.465 7.192 1029 H ASN 124 H ASN 124 -17.994 -4.346 4.018 1030 HA ASN 124 HA ASN 124 -19.294 -2.370 5.429 1031 1HB ASN 124 1HB ASN 124 -17.997 -2.038 3.293 1032 2HB ASN 124 2HB ASN 124 -19.262 -2.861 2.403 1033 1HD2 ASN 124 1HD2 ASN 124 -21.201 -1.878 2.001 1034 2HD2 ASN 124 2HD2 ASN 124 -21.507 -0.193 2.264 Start of MODEL 8 1 1H MET 1 1H MET 1 -12.766 -9.633 17.808 2 HA MET 1 HA MET 1 -10.342 -10.819 18.639 3 1HB MET 1 1HB MET 1 -13.117 -11.463 18.573 4 2HB MET 1 2HB MET 1 -12.368 -12.663 17.539 5 1HG MET 1 1HG MET 1 -10.616 -12.904 19.514 6 2HG MET 1 2HG MET 1 -11.852 -12.123 20.481 7 1HE MET 1 1HE MET 1 -12.452 -15.660 17.791 8 2HE MET 1 2HE MET 1 -11.056 -14.560 17.900 9 3HE MET 1 3HE MET 1 -11.131 -16.009 18.932 10 H MET 2 H MET 2 -11.139 -9.582 15.688 11 HA MET 2 HA MET 2 -10.387 -11.785 14.056 12 1HB MET 2 1HB MET 2 -11.131 -8.879 13.710 13 2HB MET 2 2HB MET 2 -10.197 -9.599 12.413 14 1HG MET 2 1HG MET 2 -12.395 -11.360 13.300 15 2HG MET 2 2HG MET 2 -12.981 -9.800 12.759 16 1HE MET 2 1HE MET 2 -13.621 -12.397 11.823 17 2HE MET 2 2HE MET 2 -13.872 -11.970 10.113 18 3HE MET 2 3HE MET 2 -12.660 -13.196 10.556 19 H ASN 3 H ASN 3 -8.649 -10.815 12.151 20 HA ASN 3 HA ASN 3 -6.377 -9.773 13.600 21 1HB ASN 3 1HB ASN 3 -6.625 -12.530 13.065 22 2HB ASN 3 2HB ASN 3 -5.622 -11.958 11.747 23 1HD2 ASN 3 1HD2 ASN 3 -3.684 -12.699 12.306 24 2HD2 ASN 3 2HD2 ASN 3 -2.817 -12.298 13.751 25 H GLU 4 H GLU 4 -4.999 -8.528 12.195 26 HA GLU 4 HA GLU 4 -5.201 -8.821 9.389 27 1HB GLU 4 1HB GLU 4 -7.170 -7.196 10.497 28 2HB GLU 4 2HB GLU 4 -5.933 -6.033 10.063 29 1HG GLU 4 1HG GLU 4 -6.374 -6.255 7.843 30 2HG GLU 4 2HG GLU 4 -6.270 -8.003 7.925 31 H LYS 5 H LYS 5 -3.539 -7.575 8.268 32 HA LYS 5 HA LYS 5 -1.782 -6.027 10.002 33 1HB LYS 5 1HB LYS 5 -0.849 -8.392 8.349 34 2HB LYS 5 2HB LYS 5 0.199 -7.250 9.165 35 1HG LYS 5 1HG LYS 5 -1.963 -8.681 10.737 36 2HG LYS 5 2HG LYS 5 -0.471 -9.520 10.361 37 1HD LYS 5 1HD LYS 5 -0.451 -6.756 11.635 38 2HD LYS 5 2HD LYS 5 -0.593 -8.206 12.609 39 1HE LYS 5 1HE LYS 5 1.561 -8.607 10.720 40 2HE LYS 5 2HE LYS 5 1.793 -7.046 11.483 41 1HZ LYS 5 1HZ LYS 5 1.506 -9.642 12.814 42 2HZ LYS 5 2HZ LYS 5 2.791 -8.635 12.851 43 3HZ LYS 5 3HZ LYS 5 1.412 -8.228 13.626 44 H ILE 6 H ILE 6 -0.809 -4.299 8.957 45 HA ILE 6 HA ILE 6 -0.846 -4.232 6.072 46 HB ILE 6 HB ILE 6 -2.748 -2.704 7.760 47 1HG1 ILE 6 1HG1 ILE 6 -3.626 -2.856 5.116 48 2HG1 ILE 6 2HG1 ILE 6 -2.755 -4.358 5.355 49 1HG2 ILE 6 1HG2 ILE 6 -1.419 -0.861 7.060 50 2HG2 ILE 6 2HG2 ILE 6 -1.281 -1.500 5.404 51 3HG2 ILE 6 3HG2 ILE 6 -2.849 -0.906 6.001 52 1HD1 ILE 6 1HD1 ILE 6 -4.134 -5.021 7.179 53 2HD1 ILE 6 2HD1 ILE 6 -4.748 -3.368 7.425 54 3HD1 ILE 6 3HD1 ILE 6 -5.269 -4.310 6.007 55 H LEU 7 H LEU 7 0.518 -2.511 5.219 56 HA LEU 7 HA LEU 7 2.134 -1.191 7.272 57 1HB LEU 7 1HB LEU 7 2.989 -3.416 5.870 58 2HB LEU 7 2HB LEU 7 3.659 -2.085 4.947 59 HG LEU 7 HG LEU 7 4.429 -1.248 7.351 60 1HD1 LEU 7 1HD1 LEU 7 3.609 -2.778 8.850 61 2HD1 LEU 7 2HD1 LEU 7 3.796 -4.149 7.730 62 3HD1 LEU 7 3HD1 LEU 7 5.224 -3.458 8.537 63 1HD2 LEU 7 1HD2 LEU 7 6.017 -3.505 6.166 64 2HD2 LEU 7 2HD2 LEU 7 5.746 -2.011 5.237 65 3HD2 LEU 7 3HD2 LEU 7 6.568 -1.942 6.815 66 H ILE 8 H ILE 8 2.945 0.862 6.669 67 HA ILE 8 HA ILE 8 1.783 1.860 4.162 68 HB ILE 8 HB ILE 8 2.153 3.189 6.841 69 1HG1 ILE 8 1HG1 ILE 8 -0.399 3.137 5.275 70 2HG1 ILE 8 2HG1 ILE 8 0.099 1.677 6.107 71 1HG2 ILE 8 1HG2 ILE 8 0.876 5.033 5.253 72 2HG2 ILE 8 2HG2 ILE 8 2.593 5.073 5.721 73 3HG2 ILE 8 3HG2 ILE 8 2.113 4.370 4.158 74 1HD1 ILE 8 1HD1 ILE 8 0.479 3.243 8.180 75 2HD1 ILE 8 2HD1 ILE 8 -0.539 4.396 7.285 76 3HD1 ILE 8 3HD1 ILE 8 -1.188 2.802 7.737 77 H VAL 9 H VAL 9 3.060 3.279 2.870 78 HA VAL 9 HA VAL 9 5.779 3.764 3.720 79 HB VAL 9 HB VAL 9 5.255 2.230 1.175 80 1HG1 VAL 9 1HG1 VAL 9 7.858 1.783 1.936 81 2HG1 VAL 9 2HG1 VAL 9 7.326 3.005 0.757 82 3HG1 VAL 9 3HG1 VAL 9 7.602 3.466 2.454 83 1HG2 VAL 9 1HG2 VAL 9 4.626 0.769 3.002 84 2HG2 VAL 9 2HG2 VAL 9 6.202 0.252 2.356 85 3HG2 VAL 9 3HG2 VAL 9 6.122 1.163 3.882 86 H ASP 10 H ASP 10 6.502 5.701 2.914 87 HA ASP 10 HA ASP 10 6.350 7.669 2.002 88 1HB ASP 10 1HB ASP 10 5.316 6.218 -0.476 89 2HB ASP 10 2HB ASP 10 6.155 7.756 -0.444 90 H ASP 11 H ASP 11 4.715 9.082 0.318 91 HA ASP 11 HA ASP 11 2.780 10.026 0.075 92 1HB ASP 11 1HB ASP 11 2.167 7.567 -0.600 93 2HB ASP 11 2HB ASP 11 1.371 7.479 0.959 94 H GLN 12 H GLN 12 4.103 9.265 2.897 95 HA GLN 12 HA GLN 12 1.892 9.402 4.665 96 1HB GLN 12 1HB GLN 12 3.819 9.778 6.376 97 2HB GLN 12 2HB GLN 12 3.738 8.237 5.547 98 1HG GLN 12 1HG GLN 12 5.615 8.671 4.239 99 2HG GLN 12 2HG GLN 12 5.324 10.398 4.194 100 1HE2 GLN 12 1HE2 GLN 12 5.347 11.420 6.492 101 2HE2 GLN 12 2HE2 GLN 12 6.720 11.033 7.475 102 H TYR 13 H TYR 13 0.736 11.234 5.060 103 HA TYR 13 HA TYR 13 2.131 13.683 5.607 104 1HB TYR 13 1HB TYR 13 1.250 13.034 2.963 105 2HB TYR 13 2HB TYR 13 -0.025 14.058 3.593 106 HD1 TYR 13 HD1 TYR 13 3.192 13.992 2.061 107 HD2 TYR 13 HD2 TYR 13 0.699 16.342 4.624 108 HE1 TYR 13 HE1 TYR 13 4.577 16.057 1.527 109 HE2 TYR 13 HE2 TYR 13 2.092 18.399 4.081 110 HH TYR 13 HH TYR 13 3.876 18.760 1.596 111 H GLY 14 H GLY 14 0.302 11.685 6.927 112 1HA GLY 14 1HA GLY 14 -1.118 12.357 8.711 113 2HA GLY 14 2HA GLY 14 -1.794 13.614 7.695 114 H ILE 15 H ILE 15 -1.479 11.200 5.505 115 HA ILE 15 HA ILE 15 -4.237 10.384 5.888 116 HB ILE 15 HB ILE 15 -2.284 10.225 3.605 117 1HG1 ILE 15 1HG1 ILE 15 -4.632 11.412 2.753 118 2HG1 ILE 15 2HG1 ILE 15 -4.490 11.992 4.401 119 1HG2 ILE 15 1HG2 ILE 15 -4.846 9.409 2.726 120 2HG2 ILE 15 2HG2 ILE 15 -3.334 8.470 2.753 121 3HG2 ILE 15 3HG2 ILE 15 -4.441 8.415 4.146 122 1HD1 ILE 15 1HD1 ILE 15 -1.863 12.162 3.367 123 2HD1 ILE 15 2HD1 ILE 15 -2.921 12.727 2.051 124 3HD1 ILE 15 3HD1 ILE 15 -2.989 13.512 3.647 125 H ARG 16 H ARG 16 -0.904 9.075 5.865 126 HA ARG 16 HA ARG 16 -1.484 6.430 5.756 127 1HB ARG 16 1HB ARG 16 0.652 6.209 7.245 128 2HB ARG 16 2HB ARG 16 0.818 7.029 5.705 129 1HG ARG 16 1HG ARG 16 0.828 9.200 6.728 130 2HG ARG 16 2HG ARG 16 0.186 8.587 8.239 131 1HD ARG 16 1HD ARG 16 2.823 7.476 7.274 132 2HD ARG 16 2HD ARG 16 2.810 9.100 7.931 133 HE ARG 16 HE ARG 16 1.421 7.092 9.584 134 1HH1 ARG 16 1HH1 ARG 16 4.436 8.792 8.952 135 2HH1 ARG 16 2HH1 ARG 16 5.086 8.489 10.529 136 1HH2 ARG 16 1HH2 ARG 16 2.277 6.691 11.664 137 2HH2 ARG 16 2HH2 ARG 16 3.850 7.286 12.082 138 H ILE 17 H ILE 17 -1.670 8.716 8.519 139 HA ILE 17 HA ILE 17 -2.116 6.682 10.458 140 HB ILE 17 HB ILE 17 -2.571 9.667 10.524 141 1HG1 ILE 17 1HG1 ILE 17 -0.338 8.545 12.054 142 2HG1 ILE 17 2HG1 ILE 17 -0.178 8.276 10.330 143 1HG2 ILE 17 1HG2 ILE 17 -3.925 8.759 12.234 144 2HG2 ILE 17 2HG2 ILE 17 -2.684 7.570 12.696 145 3HG2 ILE 17 3HG2 ILE 17 -2.426 9.299 13.029 146 1HD1 ILE 17 1HD1 ILE 17 -0.448 10.914 11.805 147 2HD1 ILE 17 2HD1 ILE 17 0.815 10.403 10.660 148 3HD1 ILE 17 3HD1 ILE 17 -0.817 10.796 10.068 149 H LEU 18 H LEU 18 -4.123 8.677 8.284 150 HA LEU 18 HA LEU 18 -6.569 8.401 9.474 151 1HB LEU 18 1HB LEU 18 -5.787 9.651 7.349 152 2HB LEU 18 2HB LEU 18 -6.188 8.169 6.503 153 HG LEU 18 HG LEU 18 -8.489 8.524 7.880 154 1HD1 LEU 18 1HD1 LEU 18 -7.135 11.164 7.817 155 2HD1 LEU 18 2HD1 LEU 18 -8.855 11.134 7.360 156 3HD1 LEU 18 3HD1 LEU 18 -8.345 10.512 8.948 157 1HD2 LEU 18 1HD2 LEU 18 -9.374 9.599 5.788 158 2HD2 LEU 18 2HD2 LEU 18 -7.697 9.680 5.198 159 3HD2 LEU 18 3HD2 LEU 18 -8.446 8.101 5.536 160 H LEU 19 H LEU 19 -5.182 6.195 6.933 161 HA LEU 19 HA LEU 19 -7.199 4.257 7.391 162 1HB LEU 19 1HB LEU 19 -6.435 3.373 5.512 163 2HB LEU 19 2HB LEU 19 -5.461 4.824 5.381 164 HG LEU 19 HG LEU 19 -4.126 2.852 4.930 165 1HD1 LEU 19 1HD1 LEU 19 -2.270 3.582 6.002 166 2HD1 LEU 19 2HD1 LEU 19 -3.353 4.923 6.444 167 3HD1 LEU 19 3HD1 LEU 19 -3.056 3.602 7.598 168 1HD2 LEU 19 1HD2 LEU 19 -5.658 1.570 6.794 169 2HD2 LEU 19 2HD2 LEU 19 -4.140 0.944 6.106 170 3HD2 LEU 19 3HD2 LEU 19 -4.125 1.788 7.673 171 H ASN 20 H ASN 20 -4.215 5.117 8.972 172 HA ASN 20 HA ASN 20 -3.492 2.616 9.911 173 1HB ASN 20 1HB ASN 20 -2.122 4.773 10.020 174 2HB ASN 20 2HB ASN 20 -3.154 5.310 11.330 175 1HD2 ASN 20 1HD2 ASN 20 -0.814 5.336 12.169 176 2HD2 ASN 20 2HD2 ASN 20 -0.304 3.952 13.077 177 H GLU 21 H GLU 21 -5.282 5.358 11.530 178 HA GLU 21 HA GLU 21 -5.883 4.123 13.853 179 1HB GLU 21 1HB GLU 21 -6.353 6.541 13.090 180 2HB GLU 21 2HB GLU 21 -7.839 5.935 12.385 181 1HG GLU 21 1HG GLU 21 -8.836 5.557 14.441 182 2HG GLU 21 2HG GLU 21 -7.330 5.108 15.216 183 H VAL 22 H VAL 22 -7.386 3.691 10.647 184 HA VAL 22 HA VAL 22 -9.715 2.403 11.472 185 HB VAL 22 HB VAL 22 -8.075 2.081 8.951 186 1HG1 VAL 22 1HG1 VAL 22 -10.319 0.611 9.818 187 2HG1 VAL 22 2HG1 VAL 22 -10.930 1.768 8.612 188 3HG1 VAL 22 3HG1 VAL 22 -9.609 0.653 8.186 189 1HG2 VAL 22 1HG2 VAL 22 -9.996 4.155 9.907 190 2HG2 VAL 22 2HG2 VAL 22 -8.571 4.308 8.851 191 3HG2 VAL 22 3HG2 VAL 22 -10.098 3.665 8.199 192 H PHE 23 H PHE 23 -6.640 0.926 10.201 193 HA PHE 23 HA PHE 23 -7.397 -1.662 10.995 194 1HB PHE 23 1HB PHE 23 -4.821 -0.194 10.229 195 2HB PHE 23 2HB PHE 23 -4.755 -1.886 10.680 196 HD1 PHE 23 HD1 PHE 23 -4.281 -0.244 7.957 197 HD2 PHE 23 HD2 PHE 23 -7.288 -2.855 9.422 198 HE1 PHE 23 HE1 PHE 23 -4.862 -0.894 5.604 199 HE2 PHE 23 HE2 PHE 23 -7.869 -3.506 7.069 200 HZ PHE 23 HZ PHE 23 -6.650 -2.517 5.187 201 H ASN 24 H ASN 24 -5.497 0.963 12.544 202 HA ASN 24 HA ASN 24 -4.405 -0.588 14.553 203 1HB ASN 24 1HB ASN 24 -4.103 1.992 13.796 204 2HB ASN 24 2HB ASN 24 -5.235 2.269 15.105 205 1HD2 ASN 24 1HD2 ASN 24 -4.733 1.328 17.212 206 2HD2 ASN 24 2HD2 ASN 24 -3.085 1.235 17.737 207 H LYS 25 H LYS 25 -7.544 1.122 14.152 208 HA LYS 25 HA LYS 25 -8.457 1.102 16.741 209 1HB LYS 25 1HB LYS 25 -9.632 1.256 14.038 210 2HB LYS 25 2HB LYS 25 -10.729 0.664 15.268 211 1HG LYS 25 1HG LYS 25 -10.089 2.653 16.716 212 2HG LYS 25 2HG LYS 25 -9.130 3.264 15.382 213 1HD LYS 25 1HD LYS 25 -10.983 3.878 14.137 214 2HD LYS 25 2HD LYS 25 -11.946 2.526 14.697 215 1HE LYS 25 1HE LYS 25 -12.348 3.623 16.858 216 2HE LYS 25 2HE LYS 25 -11.227 4.911 16.464 217 1HZ LYS 25 1HZ LYS 25 -13.794 4.348 15.162 218 2HZ LYS 25 2HZ LYS 25 -13.378 5.680 16.010 219 3HZ LYS 25 3HZ LYS 25 -12.706 5.399 14.549 220 H GLU 26 H GLU 26 -7.802 -1.570 14.591 221 HA GLU 26 HA GLU 26 -9.474 -3.320 16.169 222 1HB GLU 26 1HB GLU 26 -7.778 -3.856 13.691 223 2HB GLU 26 2HB GLU 26 -8.797 -5.048 14.474 224 1HG GLU 26 1HG GLU 26 -9.784 -2.402 13.304 225 2HG GLU 26 2HG GLU 26 -9.924 -3.961 12.515 226 H GLY 27 H GLY 27 -6.177 -2.211 15.880 227 1HA GLY 27 1HA GLY 27 -4.610 -2.594 17.573 228 2HA GLY 27 2HA GLY 27 -5.376 -4.123 17.957 229 H TYR 28 H TYR 28 -5.046 -3.470 14.542 230 HA TYR 28 HA TYR 28 -3.337 -5.706 14.207 231 1HB TYR 28 1HB TYR 28 -4.126 -3.360 12.367 232 2HB TYR 28 2HB TYR 28 -3.513 -4.904 11.807 233 HD1 TYR 28 HD1 TYR 28 -6.152 -3.534 11.023 234 HD2 TYR 28 HD2 TYR 28 -5.209 -6.500 13.959 235 HE1 TYR 28 HE1 TYR 28 -8.527 -4.431 10.891 236 HE2 TYR 28 HE2 TYR 28 -7.587 -7.387 13.816 237 HH TYR 28 HH TYR 28 -9.467 -7.317 12.710 238 H GLN 29 H GLN 29 -1.173 -5.783 13.398 239 HA GLN 29 HA GLN 29 0.407 -3.644 14.403 240 1HB GLN 29 1HB GLN 29 0.764 -6.417 13.845 241 2HB GLN 29 2HB GLN 29 1.915 -5.571 12.830 242 1HG GLN 29 1HG GLN 29 3.047 -4.615 14.661 243 2HG GLN 29 2HG GLN 29 1.652 -4.717 15.717 244 1HE2 GLN 29 1HE2 GLN 29 4.182 -6.542 14.094 245 2HE2 GLN 29 2HE2 GLN 29 4.206 -7.913 15.153 246 H THR 30 H THR 30 1.144 -1.891 13.275 247 HA THR 30 HA THR 30 1.292 -2.138 10.350 248 HB THR 30 HB THR 30 0.407 0.333 10.436 249 HG1 THR 30 HG1 THR 30 -0.524 -0.861 12.951 250 1HG2 THR 30 1HG2 THR 30 -1.208 -2.178 10.948 251 2HG2 THR 30 2HG2 THR 30 -2.029 -0.602 11.049 252 3HG2 THR 30 3HG2 THR 30 -1.236 -1.096 9.534 253 H PHE 31 H PHE 31 2.958 -1.014 9.335 254 HA PHE 31 HA PHE 31 4.765 0.410 11.143 255 1HB PHE 31 1HB PHE 31 5.112 -2.201 10.072 256 2HB PHE 31 2HB PHE 31 6.021 -1.189 8.967 257 HD1 PHE 31 HD1 PHE 31 5.975 -2.751 12.196 258 HD2 PHE 31 HD2 PHE 31 7.845 0.293 9.906 259 HE1 PHE 31 HE1 PHE 31 7.902 -2.724 13.805 260 HE2 PHE 31 HE2 PHE 31 9.771 0.320 11.515 261 HZ PHE 31 HZ PHE 31 9.777 -1.188 13.445 262 H GLN 32 H GLN 32 6.446 1.706 9.874 263 HA GLN 32 HA GLN 32 5.302 2.499 7.312 264 1HB GLN 32 1HB GLN 32 4.741 4.410 8.453 265 2HB GLN 32 2HB GLN 32 5.919 4.132 9.720 266 1HG GLN 32 1HG GLN 32 7.713 5.044 8.422 267 2HG GLN 32 2HG GLN 32 6.815 4.912 6.923 268 1HE2 GLN 32 1HE2 GLN 32 5.192 6.372 6.426 269 2HE2 GLN 32 2HE2 GLN 32 5.015 7.900 7.221 270 H ALA 33 H ALA 33 6.826 3.157 5.676 271 HA ALA 33 HA ALA 33 9.637 2.734 6.388 272 1HB ALA 33 1HB ALA 33 8.534 0.675 5.344 273 2HB ALA 33 2HB ALA 33 8.355 1.642 3.860 274 3HB ALA 33 3HB ALA 33 9.977 1.298 4.509 275 H ALA 34 H ALA 34 11.100 3.605 4.566 276 HA ALA 34 HA ALA 34 9.784 5.892 3.274 277 1HB ALA 34 1HB ALA 34 11.119 6.453 5.380 278 2HB ALA 34 2HB ALA 34 12.569 5.936 4.486 279 3HB ALA 34 3HB ALA 34 11.604 7.311 3.898 280 H ASN 35 H ASN 35 10.028 3.429 1.995 281 HA ASN 35 HA ASN 35 11.461 4.162 -0.246 282 1HB ASN 35 1HB ASN 35 13.089 2.889 1.768 283 2HB ASN 35 2HB ASN 35 12.870 1.723 0.479 284 1HD2 ASN 35 1HD2 ASN 35 14.992 3.781 1.534 285 2HD2 ASN 35 2HD2 ASN 35 15.663 4.454 0.086 286 H GLY 36 H GLY 36 12.018 1.577 -1.355 287 1HA GLY 36 1HA GLY 36 9.339 0.344 -1.256 288 2HA GLY 36 2HA GLY 36 10.435 0.328 -2.624 289 H LEU 37 H LEU 37 12.867 -0.201 -0.948 290 HA LEU 37 HA LEU 37 12.536 -3.055 -0.832 291 1HB LEU 37 1HB LEU 37 14.632 -1.226 -1.323 292 2HB LEU 37 2HB LEU 37 15.077 -2.111 0.123 293 HG LEU 37 HG LEU 37 14.233 -3.450 -2.459 294 1HD1 LEU 37 1HD1 LEU 37 16.244 -2.105 -2.843 295 2HD1 LEU 37 2HD1 LEU 37 17.043 -2.899 -1.465 296 3HD1 LEU 37 3HD1 LEU 37 16.598 -3.848 -2.904 297 1HD2 LEU 37 1HD2 LEU 37 15.735 -4.590 -0.091 298 2HD2 LEU 37 2HD2 LEU 37 13.981 -4.753 -0.343 299 3HD2 LEU 37 3HD2 LEU 37 15.118 -5.464 -1.513 300 H GLN 38 H GLN 38 13.301 -0.353 1.454 301 HA GLN 38 HA GLN 38 13.588 -1.940 3.680 302 1HB GLN 38 1HB GLN 38 13.321 0.891 3.065 303 2HB GLN 38 2HB GLN 38 12.419 0.519 4.521 304 1HG GLN 38 1HG GLN 38 14.574 -0.809 5.248 305 2HG GLN 38 2HG GLN 38 15.380 0.102 3.986 306 1HE2 GLN 38 1HE2 GLN 38 16.295 1.901 4.585 307 2HE2 GLN 38 2HE2 GLN 38 15.845 2.925 5.907 308 H ALA 39 H ALA 39 10.780 -1.287 1.783 309 HA ALA 39 HA ALA 39 8.906 -1.587 3.949 310 1HB ALA 39 1HB ALA 39 7.250 -1.516 2.075 311 2HB ALA 39 2HB ALA 39 8.373 -0.135 2.064 312 3HB ALA 39 3HB ALA 39 8.605 -1.479 0.921 313 H LEU 40 H LEU 40 10.378 -3.555 1.330 314 HA LEU 40 HA LEU 40 8.692 -5.765 1.606 315 1HB LEU 40 1HB LEU 40 11.536 -5.501 0.628 316 2HB LEU 40 2HB LEU 40 10.599 -6.978 0.516 317 HG LEU 40 HG LEU 40 9.990 -4.338 -0.837 318 1HD1 LEU 40 1HD1 LEU 40 11.288 -5.102 -2.464 319 2HD1 LEU 40 2HD1 LEU 40 11.550 -6.634 -1.597 320 3HD1 LEU 40 3HD1 LEU 40 10.155 -6.457 -2.688 321 1HD2 LEU 40 1HD2 LEU 40 8.252 -6.620 -0.231 322 2HD2 LEU 40 2HD2 LEU 40 7.847 -4.965 -0.745 323 3HD2 LEU 40 3HD2 LEU 40 8.295 -6.189 -1.957 324 H ASP 41 H ASP 41 11.941 -5.046 3.058 325 HA ASP 41 HA ASP 41 12.269 -7.318 4.451 326 1HB ASP 41 1HB ASP 41 13.307 -4.646 4.495 327 2HB ASP 41 2HB ASP 41 12.962 -5.068 6.160 328 H ILE 42 H ILE 42 10.694 -4.243 5.634 329 HA ILE 42 HA ILE 42 9.840 -5.317 8.071 330 HB ILE 42 HB ILE 42 8.940 -2.949 6.438 331 1HG1 ILE 42 1HG1 ILE 42 11.253 -3.420 7.940 332 2HG1 ILE 42 2HG1 ILE 42 10.681 -1.884 7.318 333 1HG2 ILE 42 1HG2 ILE 42 7.078 -3.698 7.844 334 2HG2 ILE 42 2HG2 ILE 42 8.139 -3.662 9.273 335 3HG2 ILE 42 3HG2 ILE 42 7.752 -2.152 8.413 336 1HD1 ILE 42 1HD1 ILE 42 9.363 -1.507 9.387 337 2HD1 ILE 42 2HD1 ILE 42 9.899 -3.083 10.016 338 3HD1 ILE 42 3HD1 ILE 42 11.081 -1.776 9.768 339 H VAL 43 H VAL 43 8.191 -4.934 4.872 340 HA VAL 43 HA VAL 43 5.704 -5.821 5.593 341 HB VAL 43 HB VAL 43 7.345 -5.933 3.090 342 1HG1 VAL 43 1HG1 VAL 43 5.958 -8.001 3.118 343 2HG1 VAL 43 2HG1 VAL 43 4.506 -6.988 3.295 344 3HG1 VAL 43 3HG1 VAL 43 5.502 -6.866 1.825 345 1HG2 VAL 43 1HG2 VAL 43 6.145 -3.853 4.081 346 2HG2 VAL 43 2HG2 VAL 43 5.968 -4.202 2.345 347 3HG2 VAL 43 3HG2 VAL 43 4.658 -4.621 3.475 348 H THR 44 H THR 44 8.736 -7.627 5.180 349 HA THR 44 HA THR 44 7.400 -10.182 5.194 350 HB THR 44 HB THR 44 10.356 -9.434 5.493 351 HG1 THR 44 HG1 THR 44 9.977 -8.830 3.397 352 1HG2 THR 44 1HG2 THR 44 10.711 -11.662 4.438 353 2HG2 THR 44 2HG2 THR 44 9.832 -11.843 5.975 354 3HG2 THR 44 3HG2 THR 44 8.953 -11.943 4.431 355 H LYS 45 H LYS 45 8.976 -7.998 7.536 356 HA LYS 45 HA LYS 45 8.934 -9.991 9.595 357 1HB LYS 45 1HB LYS 45 10.252 -7.544 9.133 358 2HB LYS 45 2HB LYS 45 9.239 -7.267 10.536 359 1HG LYS 45 1HG LYS 45 10.388 -9.873 10.865 360 2HG LYS 45 2HG LYS 45 11.687 -8.820 10.342 361 1HD LYS 45 1HD LYS 45 10.443 -7.203 12.197 362 2HD LYS 45 2HD LYS 45 10.122 -8.784 12.883 363 1HE LYS 45 1HE LYS 45 12.889 -7.772 12.066 364 2HE LYS 45 2HE LYS 45 12.277 -7.785 13.708 365 1HZ LYS 45 1HZ LYS 45 11.892 -10.313 12.702 366 2HZ LYS 45 2HZ LYS 45 13.406 -9.888 12.263 367 3HZ LYS 45 3HZ LYS 45 12.972 -9.853 13.837 368 H GLU 46 H GLU 46 6.766 -7.548 8.272 369 HA GLU 46 HA GLU 46 5.052 -7.885 10.596 370 1HB GLU 46 1HB GLU 46 5.268 -5.767 8.445 371 2HB GLU 46 2HB GLU 46 3.768 -5.947 9.333 372 1HG GLU 46 1HG GLU 46 5.941 -6.011 11.237 373 2HG GLU 46 2HG GLU 46 6.193 -4.638 10.178 374 H ARG 47 H ARG 47 5.618 -9.196 7.547 375 HA ARG 47 HA ARG 47 4.267 -9.951 5.927 376 1HB ARG 47 1HB ARG 47 3.075 -12.035 6.829 377 2HB ARG 47 2HB ARG 47 4.771 -11.907 7.252 378 1HG ARG 47 1HG ARG 47 4.318 -11.741 9.482 379 2HG ARG 47 2HG ARG 47 3.058 -10.551 9.226 380 1HD ARG 47 1HD ARG 47 1.947 -12.470 10.150 381 2HD ARG 47 2HD ARG 47 1.541 -12.473 8.445 382 HE ARG 47 HE ARG 47 2.715 -14.478 8.204 383 1HH1 ARG 47 1HH1 ARG 47 3.792 -12.880 11.148 384 2HH1 ARG 47 2HH1 ARG 47 4.788 -14.203 11.654 385 1HH2 ARG 47 1HH2 ARG 47 4.029 -16.224 8.871 386 2HH2 ARG 47 2HH2 ARG 47 4.924 -16.119 10.350 387 HA PRO 48 HA PRO 48 0.409 -7.754 7.121 388 1HB PRO 48 1HB PRO 48 0.560 -5.650 5.383 389 2HB PRO 48 2HB PRO 48 1.096 -5.558 7.048 390 1HG PRO 48 1HG PRO 48 2.721 -5.752 4.586 391 2HG PRO 48 2HG PRO 48 3.213 -5.239 6.188 392 1HD PRO 48 1HD PRO 48 3.747 -7.775 4.959 393 2HD PRO 48 2HD PRO 48 4.136 -7.303 6.601 394 H ASP 49 H ASP 49 -1.644 -7.682 6.089 395 HA ASP 49 HA ASP 49 -1.617 -9.507 3.898 396 1HB ASP 49 1HB ASP 49 -4.198 -8.991 4.072 397 2HB ASP 49 2HB ASP 49 -3.419 -9.931 5.329 398 H LEU 50 H LEU 50 -1.173 -6.187 4.247 399 HA LEU 50 HA LEU 50 -1.614 -5.686 1.494 400 1HB LEU 50 1HB LEU 50 -3.882 -5.398 3.060 401 2HB LEU 50 2HB LEU 50 -3.257 -3.765 2.947 402 HG LEU 50 HG LEU 50 -3.124 -4.784 0.326 403 1HD1 LEU 50 1HD1 LEU 50 -4.585 -6.629 0.997 404 2HD1 LEU 50 2HD1 LEU 50 -5.789 -5.465 1.599 405 3HD1 LEU 50 3HD1 LEU 50 -5.403 -5.527 -0.137 406 1HD2 LEU 50 1HD2 LEU 50 -4.474 -2.654 1.816 407 2HD2 LEU 50 2HD2 LEU 50 -3.691 -2.627 0.217 408 3HD2 LEU 50 3HD2 LEU 50 -5.371 -3.193 0.376 409 H VAL 51 H VAL 51 -0.546 -3.763 0.823 410 HA VAL 51 HA VAL 51 0.702 -2.220 2.967 411 HB VAL 51 HB VAL 51 2.176 -3.459 0.634 412 1HG1 VAL 51 1HG1 VAL 51 4.070 -2.547 2.401 413 2HG1 VAL 51 2HG1 VAL 51 3.538 -1.691 0.934 414 3HG1 VAL 51 3HG1 VAL 51 2.823 -1.282 2.512 415 1HG2 VAL 51 1HG2 VAL 51 1.483 -5.001 2.555 416 2HG2 VAL 51 2HG2 VAL 51 3.216 -4.944 2.151 417 3HG2 VAL 51 3HG2 VAL 51 2.603 -4.059 3.569 418 H LEU 52 H LEU 52 1.135 -0.041 2.405 419 HA LEU 52 HA LEU 52 0.074 0.725 -0.226 420 1HB LEU 52 1HB LEU 52 -1.584 1.587 1.011 421 2HB LEU 52 2HB LEU 52 -0.638 1.609 2.486 422 HG LEU 52 HG LEU 52 -0.035 3.607 0.327 423 1HD1 LEU 52 1HD1 LEU 52 -1.698 5.080 1.794 424 2HD1 LEU 52 2HD1 LEU 52 -2.241 4.161 0.370 425 3HD1 LEU 52 3HD1 LEU 52 -2.496 3.503 2.004 426 1HD2 LEU 52 1HD2 LEU 52 0.658 3.173 3.133 427 2HD2 LEU 52 2HD2 LEU 52 1.468 4.148 1.883 428 3HD2 LEU 52 3HD2 LEU 52 0.102 4.831 2.798 429 H LEU 53 H LEU 53 1.635 1.532 -1.509 430 HA LEU 53 HA LEU 53 3.678 3.190 -0.235 431 1HB LEU 53 1HB LEU 53 4.734 1.074 -0.394 432 2HB LEU 53 2HB LEU 53 4.145 0.812 -2.024 433 HG LEU 53 HG LEU 53 5.950 3.149 -1.491 434 1HD1 LEU 53 1HD1 LEU 53 6.896 0.288 -1.815 435 2HD1 LEU 53 2HD1 LEU 53 7.927 1.738 -1.877 436 3HD1 LEU 53 3HD1 LEU 53 7.079 1.311 -0.371 437 1HD2 LEU 53 1HD2 LEU 53 5.792 3.341 -3.692 438 2HD2 LEU 53 2HD2 LEU 53 6.570 1.751 -3.876 439 3HD2 LEU 53 3HD2 LEU 53 4.796 1.868 -3.778 440 H ASP 54 H ASP 54 4.556 4.832 -1.621 441 HA ASP 54 HA ASP 54 2.807 5.299 -3.899 442 1HB ASP 54 1HB ASP 54 2.614 7.143 -2.423 443 2HB ASP 54 2HB ASP 54 4.310 7.097 -1.985 444 H MET 55 H MET 55 3.768 5.504 -5.969 445 HA MET 55 HA MET 55 6.285 4.491 -6.370 446 1HB MET 55 1HB MET 55 4.823 6.460 -8.208 447 2HB MET 55 2HB MET 55 5.940 5.202 -8.702 448 1HG MET 55 1HG MET 55 3.120 4.874 -7.606 449 2HG MET 55 2HG MET 55 3.750 4.321 -9.145 450 1HE MET 55 1HE MET 55 3.140 2.103 -5.530 451 2HE MET 55 2HE MET 55 4.316 3.335 -5.014 452 3HE MET 55 3HE MET 55 2.830 3.823 -5.864 453 H LYS 56 H LYS 56 5.292 7.930 -7.044 454 HA LYS 56 HA LYS 56 7.773 8.966 -7.397 455 1HB LYS 56 1HB LYS 56 5.151 9.934 -7.104 456 2HB LYS 56 2HB LYS 56 6.091 10.813 -5.915 457 1HG LYS 56 1HG LYS 56 7.596 11.678 -7.559 458 2HG LYS 56 2HG LYS 56 7.132 10.478 -8.749 459 1HD LYS 56 1HD LYS 56 4.959 11.511 -9.081 460 2HD LYS 56 2HD LYS 56 5.163 12.547 -7.682 461 1HE LYS 56 1HE LYS 56 7.307 12.785 -9.751 462 2HE LYS 56 2HE LYS 56 5.719 13.318 -10.265 463 1HZ LYS 56 1HZ LYS 56 5.683 14.602 -8.123 464 2HZ LYS 56 2HZ LYS 56 7.283 14.301 -7.996 465 3HZ LYS 56 3HZ LYS 56 6.711 15.145 -9.271 466 H ILE 57 H ILE 57 9.583 9.104 -6.191 467 HA ILE 57 HA ILE 57 9.544 9.889 -3.504 468 HB ILE 57 HB ILE 57 8.856 7.235 -3.771 469 1HG1 ILE 57 1HG1 ILE 57 9.341 7.152 -1.304 470 2HG1 ILE 57 2HG1 ILE 57 10.092 8.730 -1.443 471 1HG2 ILE 57 1HG2 ILE 57 11.805 7.409 -3.101 472 2HG2 ILE 57 2HG2 ILE 57 10.776 5.981 -2.839 473 3HG2 ILE 57 3HG2 ILE 57 11.065 6.579 -4.491 474 1HD1 ILE 57 1HD1 ILE 57 7.730 8.940 -0.735 475 2HD1 ILE 57 2HD1 ILE 57 7.970 9.678 -2.337 476 3HD1 ILE 57 3HD1 ILE 57 7.206 8.076 -2.200 477 HA PRO 58 HA PRO 58 13.544 10.705 -4.949 478 1HB PRO 58 1HB PRO 58 14.577 11.883 -2.710 479 2HB PRO 58 2HB PRO 58 13.585 12.740 -3.873 480 1HG PRO 58 1HG PRO 58 12.855 11.758 -1.181 481 2HG PRO 58 2HG PRO 58 12.047 12.959 -2.168 482 1HD PRO 58 1HD PRO 58 11.224 10.243 -1.753 483 2HD PRO 58 2HD PRO 58 10.482 11.410 -2.829 484 H GLY 59 H GLY 59 15.413 9.626 -5.264 485 1HA GLY 59 1HA GLY 59 17.225 8.394 -4.502 486 2HA GLY 59 2HA GLY 59 16.373 8.019 -3.017 487 H MET 60 H MET 60 15.942 7.533 -6.601 488 HA MET 60 HA MET 60 15.657 5.677 -7.740 489 1HB MET 60 1HB MET 60 16.895 4.627 -5.567 490 2HB MET 60 2HB MET 60 15.311 3.933 -5.283 491 1HG MET 60 1HG MET 60 15.722 3.453 -8.017 492 2HG MET 60 2HG MET 60 17.322 3.235 -7.337 493 1HE MET 60 1HE MET 60 14.466 0.038 -7.631 494 2HE MET 60 2HE MET 60 13.840 1.690 -7.848 495 3HE MET 60 3HE MET 60 15.289 1.163 -8.738 496 H ASP 61 H ASP 61 13.613 6.406 -8.467 497 HA ASP 61 HA ASP 61 11.333 6.547 -7.069 498 1HB ASP 61 1HB ASP 61 10.364 5.669 -9.478 499 2HB ASP 61 2HB ASP 61 10.919 7.306 -9.186 500 H GLY 62 H GLY 62 9.279 4.976 -7.655 501 1HA GLY 62 1HA GLY 62 10.068 2.316 -6.727 502 2HA GLY 62 2HA GLY 62 8.463 3.018 -6.712 503 H ILE 63 H ILE 63 9.659 3.880 -9.697 504 HA ILE 63 HA ILE 63 7.966 2.278 -11.138 505 HB ILE 63 HB ILE 63 10.502 3.708 -11.916 506 1HG1 ILE 63 1HG1 ILE 63 7.644 4.496 -12.494 507 2HG1 ILE 63 2HG1 ILE 63 8.449 4.960 -11.008 508 1HG2 ILE 63 1HG2 ILE 63 9.021 3.483 -14.220 509 2HG2 ILE 63 2HG2 ILE 63 10.457 2.516 -13.805 510 3HG2 ILE 63 3HG2 ILE 63 8.828 1.877 -13.477 511 1HD1 ILE 63 1HD1 ILE 63 10.365 5.620 -12.899 512 2HD1 ILE 63 2HD1 ILE 63 8.849 5.971 -13.762 513 3HD1 ILE 63 3HD1 ILE 63 9.187 6.758 -12.202 514 H GLU 64 H GLU 64 11.419 1.746 -10.251 515 HA GLU 64 HA GLU 64 11.375 -0.762 -11.645 516 1HB GLU 64 1HB GLU 64 13.572 0.416 -9.890 517 2HB GLU 64 2HB GLU 64 13.743 -0.905 -11.029 518 1HG GLU 64 1HG GLU 64 12.722 1.789 -11.980 519 2HG GLU 64 2HG GLU 64 14.441 1.537 -11.755 520 H ILE 65 H ILE 65 11.548 0.495 -8.262 521 HA ILE 65 HA ILE 65 11.933 -1.852 -6.921 522 HB ILE 65 HB ILE 65 10.146 0.442 -6.104 523 1HG1 ILE 65 1HG1 ILE 65 13.148 0.113 -6.046 524 2HG1 ILE 65 2HG1 ILE 65 12.207 1.410 -6.756 525 1HG2 ILE 65 1HG2 ILE 65 11.588 -0.635 -3.922 526 2HG2 ILE 65 2HG2 ILE 65 9.833 -0.676 -4.215 527 3HG2 ILE 65 3HG2 ILE 65 10.864 -2.008 -4.793 528 1HD1 ILE 65 1HD1 ILE 65 12.616 2.516 -4.804 529 2HD1 ILE 65 2HD1 ILE 65 11.343 1.477 -4.120 530 3HD1 ILE 65 3HD1 ILE 65 13.054 1.018 -3.947 531 H LEU 66 H LEU 66 8.694 -0.353 -7.634 532 HA LEU 66 HA LEU 66 7.218 -2.539 -6.810 533 1HB LEU 66 1HB LEU 66 6.665 -0.331 -8.784 534 2HB LEU 66 2HB LEU 66 5.467 -1.540 -8.365 535 HG LEU 66 HG LEU 66 4.876 0.132 -6.927 536 1HD1 LEU 66 1HD1 LEU 66 5.467 -0.449 -4.698 537 2HD1 LEU 66 2HD1 LEU 66 5.495 -1.950 -5.654 538 3HD1 LEU 66 3HD1 LEU 66 7.021 -1.144 -5.218 539 1HD2 LEU 66 1HD2 LEU 66 6.727 1.632 -7.652 540 2HD2 LEU 66 2HD2 LEU 66 6.323 1.765 -5.924 541 3HD2 LEU 66 3HD2 LEU 66 7.773 0.866 -6.432 542 H LYS 67 H LYS 67 8.921 -1.869 -9.872 543 HA LYS 67 HA LYS 67 7.676 -3.895 -11.365 544 1HB LYS 67 1HB LYS 67 9.784 -1.950 -11.695 545 2HB LYS 67 2HB LYS 67 10.307 -3.498 -12.328 546 1HG LYS 67 1HG LYS 67 7.901 -3.566 -13.438 547 2HG LYS 67 2HG LYS 67 7.905 -1.838 -13.147 548 1HD LYS 67 1HD LYS 67 9.068 -1.608 -15.083 549 2HD LYS 67 2HD LYS 67 10.444 -2.312 -14.256 550 1HE LYS 67 1HE LYS 67 9.502 -4.623 -14.891 551 2HE LYS 67 2HE LYS 67 8.346 -3.788 -15.909 552 1HZ LYS 67 1HZ LYS 67 10.241 -2.745 -17.028 553 2HZ LYS 67 2HZ LYS 67 11.271 -3.647 -16.137 554 3HZ LYS 67 3HZ LYS 67 10.244 -4.371 -17.180 555 H ARG 68 H ARG 68 10.994 -3.842 -9.872 556 HA ARG 68 HA ARG 68 11.464 -6.499 -10.282 557 1HB ARG 68 1HB ARG 68 12.552 -4.363 -8.488 558 2HB ARG 68 2HB ARG 68 12.902 -6.003 -7.982 559 1HG ARG 68 1HG ARG 68 13.940 -6.521 -10.140 560 2HG ARG 68 2HG ARG 68 13.425 -4.987 -10.813 561 1HD ARG 68 1HD ARG 68 15.545 -4.318 -10.211 562 2HD ARG 68 2HD ARG 68 14.800 -4.060 -8.646 563 HE ARG 68 HE ARG 68 16.104 -5.799 -7.813 564 1HH1 ARG 68 1HH1 ARG 68 15.706 -6.272 -11.277 565 2HH1 ARG 68 2HH1 ARG 68 16.731 -7.667 -11.334 566 1HH2 ARG 68 1HH2 ARG 68 17.456 -7.640 -7.888 567 2HH2 ARG 68 2HH2 ARG 68 17.733 -8.450 -9.393 568 H MET 69 H MET 69 9.556 -4.830 -7.800 569 HA MET 69 HA MET 69 9.559 -6.817 -5.874 570 1HB MET 69 1HB MET 69 8.104 -4.344 -6.527 571 2HB MET 69 2HB MET 69 7.005 -5.530 -5.851 572 1HG MET 69 1HG MET 69 7.969 -5.432 -3.762 573 2HG MET 69 2HG MET 69 9.597 -5.338 -4.404 574 1HE MET 69 1HE MET 69 6.272 -3.426 -3.785 575 2HE MET 69 2HE MET 69 7.250 -3.555 -2.303 576 3HE MET 69 3HE MET 69 6.940 -1.959 -3.029 577 H LYS 70 H LYS 70 7.205 -6.135 -8.557 578 HA LYS 70 HA LYS 70 5.692 -8.479 -7.957 579 1HB LYS 70 1HB LYS 70 4.221 -7.741 -9.576 580 2HB LYS 70 2HB LYS 70 4.925 -6.237 -9.020 581 1HG LYS 70 1HG LYS 70 4.996 -6.093 -11.402 582 2HG LYS 70 2HG LYS 70 6.641 -6.474 -10.932 583 1HD LYS 70 1HD LYS 70 6.596 -8.411 -12.112 584 2HD LYS 70 2HD LYS 70 5.162 -8.952 -11.262 585 1HE LYS 70 1HE LYS 70 3.871 -8.538 -13.080 586 2HE LYS 70 2HE LYS 70 4.383 -6.862 -13.109 587 1HZ LYS 70 1HZ LYS 70 6.217 -8.877 -14.112 588 2HZ LYS 70 2HZ LYS 70 4.949 -8.448 -15.048 589 3HZ LYS 70 3HZ LYS 70 6.034 -7.322 -14.575 590 H VAL 71 H VAL 71 8.263 -7.533 -10.280 591 HA VAL 71 HA VAL 71 8.120 -9.832 -11.860 592 HB VAL 71 HB VAL 71 10.488 -8.063 -11.218 593 1HG1 VAL 71 1HG1 VAL 71 11.492 -9.777 -12.360 594 2HG1 VAL 71 2HG1 VAL 71 10.004 -10.224 -13.228 595 3HG1 VAL 71 3HG1 VAL 71 10.938 -8.797 -13.739 596 1HG2 VAL 71 1HG2 VAL 71 8.955 -7.681 -13.730 597 2HG2 VAL 71 2HG2 VAL 71 8.133 -7.183 -12.232 598 3HG2 VAL 71 3HG2 VAL 71 9.716 -6.486 -12.653 599 H ILE 72 H ILE 72 9.466 -9.190 -8.650 600 HA ILE 72 HA ILE 72 11.118 -11.518 -8.638 601 HB ILE 72 HB ILE 72 10.314 -9.402 -6.697 602 1HG1 ILE 72 1HG1 ILE 72 12.276 -9.274 -8.325 603 2HG1 ILE 72 2HG1 ILE 72 12.598 -8.897 -6.645 604 1HG2 ILE 72 1HG2 ILE 72 10.059 -11.101 -5.167 605 2HG2 ILE 72 2HG2 ILE 72 11.238 -12.161 -5.974 606 3HG2 ILE 72 3HG2 ILE 72 11.801 -10.765 -5.025 607 1HD1 ILE 72 1HD1 ILE 72 13.851 -10.895 -8.264 608 2HD1 ILE 72 2HD1 ILE 72 14.146 -10.542 -6.545 609 3HD1 ILE 72 3HD1 ILE 72 12.921 -11.748 -7.008 610 H ASP 73 H ASP 73 7.871 -10.604 -7.339 611 HA ASP 73 HA ASP 73 7.222 -13.408 -7.391 612 1HB ASP 73 1HB ASP 73 7.707 -11.884 -4.941 613 2HB ASP 73 2HB ASP 73 6.041 -12.424 -4.992 614 H GLU 74 H GLU 74 4.757 -13.679 -7.127 615 HA GLU 74 HA GLU 74 3.455 -11.244 -8.058 616 1HB GLU 74 1HB GLU 74 2.030 -12.558 -9.387 617 2HB GLU 74 2HB GLU 74 3.555 -13.411 -9.511 618 1HG GLU 74 1HG GLU 74 2.814 -14.929 -7.628 619 2HG GLU 74 2HG GLU 74 1.262 -14.115 -7.619 620 H ASN 75 H ASN 75 3.787 -13.399 -5.410 621 HA ASN 75 HA ASN 75 1.131 -13.313 -4.495 622 1HB ASN 75 1HB ASN 75 2.363 -13.934 -2.242 623 2HB ASN 75 2HB ASN 75 2.407 -15.081 -3.566 624 1HD2 ASN 75 1HD2 ASN 75 4.294 -15.933 -3.935 625 2HD2 ASN 75 2HD2 ASN 75 5.848 -15.204 -3.704 626 H ILE 76 H ILE 76 3.816 -11.093 -4.562 627 HA ILE 76 HA ILE 76 3.318 -9.691 -2.170 628 HB ILE 76 HB ILE 76 5.443 -9.610 -3.303 629 1HG1 ILE 76 1HG1 ILE 76 4.066 -6.909 -3.242 630 2HG1 ILE 76 2HG1 ILE 76 4.805 -7.721 -1.877 631 1HG2 ILE 76 1HG2 ILE 76 5.665 -8.253 -5.417 632 2HG2 ILE 76 2HG2 ILE 76 4.873 -9.837 -5.595 633 3HG2 ILE 76 3HG2 ILE 76 3.894 -8.350 -5.574 634 1HD1 ILE 76 1HD1 ILE 76 6.191 -6.654 -4.370 635 2HD1 ILE 76 2HD1 ILE 76 6.437 -6.150 -2.681 636 3HD1 ILE 76 3HD1 ILE 76 6.996 -7.751 -3.222 637 H ARG 77 H ARG 77 1.712 -8.311 -1.632 638 HA ARG 77 HA ARG 77 0.180 -7.244 -3.868 639 1HB ARG 77 1HB ARG 77 -1.535 -8.451 -2.928 640 2HB ARG 77 2HB ARG 77 -0.666 -8.686 -1.425 641 1HG ARG 77 1HG ARG 77 -1.386 -6.583 -0.536 642 2HG ARG 77 2HG ARG 77 -1.849 -5.972 -2.112 643 1HD ARG 77 1HD ARG 77 -3.907 -6.550 -1.008 644 2HD ARG 77 2HD ARG 77 -3.638 -7.811 -2.194 645 HE ARG 77 HE ARG 77 -3.354 -8.077 0.749 646 1HH1 ARG 77 1HH1 ARG 77 -3.023 -9.554 -2.428 647 2HH1 ARG 77 2HH1 ARG 77 -2.962 -11.171 -1.810 648 1HH2 ARG 77 1HH2 ARG 77 -3.274 -10.210 1.564 649 2HH2 ARG 77 2HH2 ARG 77 -3.106 -11.547 0.475 650 H VAL 78 H VAL 78 0.615 -5.064 -4.031 651 HA VAL 78 HA VAL 78 0.530 -3.504 -1.570 652 HB VAL 78 HB VAL 78 2.925 -4.223 -2.463 653 1HG1 VAL 78 1HG1 VAL 78 2.186 -3.026 -4.718 654 2HG1 VAL 78 2HG1 VAL 78 2.766 -1.580 -3.859 655 3HG1 VAL 78 3HG1 VAL 78 3.864 -2.954 -4.130 656 1HG2 VAL 78 1HG2 VAL 78 3.491 -2.878 -0.779 657 2HG2 VAL 78 2HG2 VAL 78 3.200 -1.446 -1.796 658 3HG2 VAL 78 3HG2 VAL 78 1.871 -2.140 -0.837 659 H ILE 79 H ILE 79 -0.077 -1.273 -1.928 660 HA ILE 79 HA ILE 79 -1.391 -0.944 -4.529 661 HB ILE 79 HB ILE 79 -2.110 -0.308 -1.747 662 1HG1 ILE 79 1HG1 ILE 79 -3.460 -1.149 -4.289 663 2HG1 ILE 79 2HG1 ILE 79 -3.460 -1.920 -2.716 664 1HG2 ILE 79 1HG2 ILE 79 -2.829 1.632 -3.962 665 2HG2 ILE 79 2HG2 ILE 79 -3.426 1.659 -2.285 666 3HG2 ILE 79 3HG2 ILE 79 -1.704 1.958 -2.622 667 1HD1 ILE 79 1HD1 ILE 79 -5.633 -0.972 -2.899 668 2HD1 ILE 79 2HD1 ILE 79 -4.746 0.181 -1.874 669 3HD1 ILE 79 3HD1 ILE 79 -5.006 0.541 -3.597 670 H ILE 80 H ILE 80 -1.071 0.944 -5.753 671 HA ILE 80 HA ILE 80 1.279 2.473 -4.898 672 HB ILE 80 HB ILE 80 1.718 2.891 -7.187 673 1HG1 ILE 80 1HG1 ILE 80 0.190 1.856 -8.966 674 2HG1 ILE 80 2HG1 ILE 80 -1.023 1.727 -7.708 675 1HG2 ILE 80 1HG2 ILE 80 1.825 0.387 -6.053 676 2HG2 ILE 80 2HG2 ILE 80 1.019 0.077 -7.609 677 3HG2 ILE 80 3HG2 ILE 80 2.607 0.879 -7.574 678 1HD1 ILE 80 1HD1 ILE 80 -1.413 3.986 -7.662 679 2HD1 ILE 80 2HD1 ILE 80 0.309 4.387 -7.868 680 3HD1 ILE 80 3HD1 ILE 80 -0.678 3.947 -9.282 681 H MET 81 H MET 81 1.280 4.809 -5.247 682 HA MET 81 HA MET 81 -1.372 5.925 -5.596 683 1HB MET 81 1HB MET 81 0.193 7.294 -3.487 684 2HB MET 81 2HB MET 81 -1.481 6.778 -3.450 685 1HG MET 81 1HG MET 81 -0.767 4.440 -2.953 686 2HG MET 81 2HG MET 81 0.916 4.922 -3.040 687 1HE MET 81 1HE MET 81 2.239 5.699 -1.178 688 2HE MET 81 2HE MET 81 1.642 5.540 0.491 689 3HE MET 81 3HE MET 81 1.551 4.154 -0.622 690 H THR 82 H THR 82 -1.323 7.657 -6.976 691 HA THR 82 HA THR 82 0.665 9.626 -6.938 692 HB THR 82 HB THR 82 2.279 8.202 -7.904 693 HG1 THR 82 HG1 THR 82 2.169 8.832 -10.201 694 1HG2 THR 82 1HG2 THR 82 1.517 6.723 -9.957 695 2HG2 THR 82 2HG2 THR 82 1.188 6.125 -8.313 696 3HG2 THR 82 3HG2 THR 82 -0.111 6.894 -9.257 697 H ALA 83 H ALA 83 0.110 11.402 -8.204 698 HA ALA 83 HA ALA 83 -2.567 11.656 -8.826 699 1HB ALA 83 1HB ALA 83 -0.653 13.347 -10.344 700 2HB ALA 83 2HB ALA 83 -1.984 13.815 -9.259 701 3HB ALA 83 3HB ALA 83 -0.415 13.318 -8.580 702 H TYR 84 H TYR 84 -3.608 12.002 -10.965 703 HA TYR 84 HA TYR 84 -2.843 9.886 -12.751 704 1HB TYR 84 1HB TYR 84 -4.971 10.717 -13.877 705 2HB TYR 84 2HB TYR 84 -5.213 10.430 -12.165 706 HD1 TYR 84 HD1 TYR 84 -5.042 12.964 -14.802 707 HD2 TYR 84 HD2 TYR 84 -5.467 12.319 -10.594 708 HE1 TYR 84 HE1 TYR 84 -5.883 15.346 -14.515 709 HE2 TYR 84 HE2 TYR 84 -6.307 14.703 -10.321 710 HH TYR 84 HH TYR 84 -7.428 16.509 -12.764 711 H GLY 85 H GLY 85 -0.704 11.646 -12.704 712 1HA GLY 85 1HA GLY 85 -1.023 13.282 -15.138 713 2HA GLY 85 2HA GLY 85 0.186 13.508 -13.890 714 H GLU 86 H GLU 86 0.471 10.402 -13.752 715 HA GLU 86 HA GLU 86 1.959 10.128 -16.243 716 1HB GLU 86 1HB GLU 86 3.566 8.692 -14.701 717 2HB GLU 86 2HB GLU 86 3.746 10.433 -14.788 718 1HG GLU 86 1HG GLU 86 2.510 10.748 -12.710 719 2HG GLU 86 2HG GLU 86 2.018 9.067 -12.678 720 H LEU 87 H LEU 87 -0.589 9.206 -16.211 721 HA LEU 87 HA LEU 87 -1.212 6.830 -15.071 722 1HB LEU 87 1HB LEU 87 -1.841 7.681 -17.901 723 2HB LEU 87 2HB LEU 87 -2.702 6.472 -16.968 724 HG LEU 87 HG LEU 87 -2.527 9.129 -15.683 725 1HD1 LEU 87 1HD1 LEU 87 -4.351 8.825 -18.074 726 2HD1 LEU 87 2HD1 LEU 87 -4.054 10.273 -17.082 727 3HD1 LEU 87 3HD1 LEU 87 -2.774 9.647 -18.148 728 1HD2 LEU 87 1HD2 LEU 87 -4.849 7.254 -16.209 729 2HD2 LEU 87 2HD2 LEU 87 -3.821 7.250 -14.756 730 3HD2 LEU 87 3HD2 LEU 87 -4.842 8.662 -15.120 731 H ASP 88 H ASP 88 0.919 7.433 -17.898 732 HA ASP 88 HA ASP 88 1.178 4.975 -18.901 733 1HB ASP 88 1HB ASP 88 2.614 7.384 -19.007 734 2HB ASP 88 2HB ASP 88 3.813 6.238 -18.441 735 H MET 89 H MET 89 2.724 6.352 -15.935 736 HA MET 89 HA MET 89 4.234 4.004 -15.443 737 1HB MET 89 1HB MET 89 4.768 6.427 -14.711 738 2HB MET 89 2HB MET 89 3.498 6.272 -13.513 739 1HG MET 89 1HG MET 89 5.659 4.153 -13.622 740 2HG MET 89 2HG MET 89 6.033 5.701 -12.891 741 1HE MET 89 1HE MET 89 5.363 3.368 -9.813 742 2HE MET 89 2HE MET 89 6.138 2.951 -11.360 743 3HE MET 89 3HE MET 89 6.499 4.507 -10.575 744 H ILE 90 H ILE 90 1.206 5.477 -14.126 745 HA ILE 90 HA ILE 90 0.790 3.666 -12.074 746 HB ILE 90 HB ILE 90 -1.056 5.350 -13.749 747 1HG1 ILE 90 1HG1 ILE 90 -0.940 5.963 -10.934 748 2HG1 ILE 90 2HG1 ILE 90 0.687 5.881 -11.578 749 1HG2 ILE 90 1HG2 ILE 90 -2.603 4.819 -11.637 750 2HG2 ILE 90 2HG2 ILE 90 -2.651 3.856 -13.133 751 3HG2 ILE 90 3HG2 ILE 90 -1.728 3.271 -11.728 752 1HD1 ILE 90 1HD1 ILE 90 0.184 7.509 -13.307 753 2HD1 ILE 90 2HD1 ILE 90 -1.554 7.449 -12.928 754 3HD1 ILE 90 3HD1 ILE 90 -0.414 8.165 -11.764 755 H GLN 91 H GLN 91 -0.250 3.564 -15.540 756 HA GLN 91 HA GLN 91 -1.745 1.309 -15.425 757 1HB GLN 91 1HB GLN 91 -0.116 2.676 -17.527 758 2HB GLN 91 2HB GLN 91 -0.579 1.022 -17.877 759 1HG GLN 91 1HG GLN 91 -2.883 2.362 -16.768 760 2HG GLN 91 2HG GLN 91 -2.208 3.401 -18.008 761 1HE2 GLN 91 1HE2 GLN 91 -2.979 3.099 -19.941 762 2HE2 GLN 91 2HE2 GLN 91 -3.563 1.620 -20.628 763 H GLU 92 H GLU 92 1.827 1.540 -16.060 764 HA GLU 92 HA GLU 92 2.325 -1.102 -16.373 765 1HB GLU 92 1HB GLU 92 3.841 1.302 -15.788 766 2HB GLU 92 2HB GLU 92 4.504 -0.032 -14.865 767 1HG GLU 92 1HG GLU 92 5.617 -0.580 -16.779 768 2HG GLU 92 2HG GLU 92 4.086 -1.235 -17.326 769 H SER 93 H SER 93 2.440 0.780 -13.261 770 HA SER 93 HA SER 93 3.109 -1.259 -11.617 771 1HB SER 93 1HB SER 93 1.205 0.261 -10.173 772 2HB SER 93 2HB SER 93 2.943 0.484 -10.195 773 HG SER 93 HG SER 93 2.752 2.202 -11.489 774 H LYS 94 H LYS 94 -0.144 -0.349 -12.886 775 HA LYS 94 HA LYS 94 -1.570 -2.213 -11.335 776 1HB LYS 94 1HB LYS 94 -3.052 -0.711 -12.116 777 2HB LYS 94 2HB LYS 94 -2.095 -0.335 -13.534 778 1HG LYS 94 1HG LYS 94 -2.935 -2.243 -14.743 779 2HG LYS 94 2HG LYS 94 -3.590 -2.975 -13.292 780 1HD LYS 94 1HD LYS 94 -5.398 -1.442 -13.169 781 2HD LYS 94 2HD LYS 94 -4.583 -0.245 -14.156 782 1HE LYS 94 1HE LYS 94 -4.706 -2.046 -16.067 783 2HE LYS 94 2HE LYS 94 -5.897 -2.836 -15.053 784 1HZ LYS 94 1HZ LYS 94 -7.375 -1.370 -15.718 785 2HZ LYS 94 2HZ LYS 94 -6.477 -0.112 -15.189 786 3HZ LYS 94 3HZ LYS 94 -6.280 -0.673 -16.710 787 H GLU 95 H GLU 95 -0.848 -2.298 -14.900 788 HA GLU 95 HA GLU 95 -1.568 -4.896 -15.247 789 1HB GLU 95 1HB GLU 95 -1.190 -4.014 -17.309 790 2HB GLU 95 2HB GLU 95 0.006 -2.882 -16.709 791 1HG GLU 95 1HG GLU 95 1.172 -4.373 -18.202 792 2HG GLU 95 2HG GLU 95 1.664 -4.816 -16.579 793 H LEU 96 H LEU 96 1.177 -3.610 -13.544 794 HA LEU 96 HA LEU 96 2.975 -5.735 -13.940 795 1HB LEU 96 1HB LEU 96 2.759 -3.323 -12.337 796 2HB LEU 96 2HB LEU 96 3.479 -4.637 -11.428 797 HG LEU 96 HG LEU 96 5.333 -4.785 -12.823 798 1HD1 LEU 96 1HD1 LEU 96 4.887 -4.973 -15.005 799 2HD1 LEU 96 2HD1 LEU 96 3.470 -3.900 -14.909 800 3HD1 LEU 96 3HD1 LEU 96 5.103 -3.207 -15.057 801 1HD2 LEU 96 1HD2 LEU 96 4.756 -2.385 -11.671 802 2HD2 LEU 96 2HD2 LEU 96 6.310 -2.803 -12.432 803 3HD2 LEU 96 3HD2 LEU 96 5.084 -1.896 -13.351 804 H GLY 97 H GLY 97 -0.031 -5.477 -12.236 805 1HA GLY 97 1HA GLY 97 -1.047 -7.511 -11.515 806 2HA GLY 97 2HA GLY 97 0.514 -8.083 -10.961 807 H ALA 98 H ALA 98 -0.323 -4.688 -10.435 808 HA ALA 98 HA ALA 98 -0.114 -5.069 -7.608 809 1HB ALA 98 1HB ALA 98 -0.640 -2.687 -9.420 810 2HB ALA 98 2HB ALA 98 -0.564 -2.559 -7.646 811 3HB ALA 98 3HB ALA 98 0.863 -3.101 -8.561 812 H LEU 99 H LEU 99 -1.876 -3.731 -6.242 813 HA LEU 99 HA LEU 99 -4.304 -5.175 -6.648 814 1HB LEU 99 1HB LEU 99 -3.459 -3.096 -4.627 815 2HB LEU 99 2HB LEU 99 -5.008 -3.916 -4.602 816 HG LEU 99 HG LEU 99 -3.173 -4.792 -3.059 817 1HD1 LEU 99 1HD1 LEU 99 -5.102 -6.239 -4.707 818 2HD1 LEU 99 2HD1 LEU 99 -3.772 -7.272 -4.130 819 3HD1 LEU 99 3HD1 LEU 99 -4.758 -6.357 -2.964 820 1HD2 LEU 99 1HD2 LEU 99 -2.130 -5.982 -5.645 821 2HD2 LEU 99 2HD2 LEU 99 -1.333 -4.713 -4.684 822 3HD2 LEU 99 3HD2 LEU 99 -1.550 -6.342 -4.001 823 H THR 100 H THR 100 -3.296 -1.697 -6.782 824 HA THR 100 HA THR 100 -5.025 -1.148 -8.931 825 HB THR 100 HB THR 100 -6.763 -1.449 -7.141 826 HG1 THR 100 HG1 THR 100 -7.702 0.585 -7.734 827 1HG2 THR 100 1HG2 THR 100 -5.287 -0.598 -5.216 828 2HG2 THR 100 2HG2 THR 100 -5.489 1.036 -5.892 829 3HG2 THR 100 3HG2 THR 100 -6.905 0.139 -5.296 830 H HIS 101 H HIS 101 -5.462 1.590 -8.554 831 HA HIS 101 HA HIS 101 -2.889 2.660 -7.767 832 1HB HIS 101 1HB HIS 101 -2.581 3.829 -9.905 833 2HB HIS 101 2HB HIS 101 -2.487 2.087 -10.073 834 HD1 HIS 101 HD1 HIS 101 -4.149 0.949 -11.643 835 HD2 HIS 101 HD2 HIS 101 -5.012 5.000 -10.977 836 HE1 HIS 101 HE1 HIS 101 -5.979 1.573 -13.308 837 H PHE 102 H PHE 102 -3.320 4.373 -6.478 838 HA PHE 102 HA PHE 102 -5.875 5.737 -6.917 839 1HB PHE 102 1HB PHE 102 -3.930 5.605 -4.534 840 2HB PHE 102 2HB PHE 102 -5.473 6.435 -4.503 841 HD1 PHE 102 HD1 PHE 102 -6.831 4.139 -6.209 842 HD2 PHE 102 HD2 PHE 102 -4.547 4.222 -2.633 843 HE1 PHE 102 HE1 PHE 102 -7.951 2.027 -5.444 844 HE2 PHE 102 HE2 PHE 102 -5.667 2.110 -1.869 845 HZ PHE 102 HZ PHE 102 -7.356 1.038 -3.283 846 H ALA 103 H ALA 103 -5.930 8.109 -6.620 847 HA ALA 103 HA ALA 103 -3.394 9.291 -7.506 848 1HB ALA 103 1HB ALA 103 -4.611 10.633 -8.892 849 2HB ALA 103 2HB ALA 103 -5.833 9.350 -8.720 850 3HB ALA 103 3HB ALA 103 -5.938 10.818 -7.719 851 H LYS 104 H LYS 104 -2.604 11.191 -6.479 852 HA LYS 104 HA LYS 104 -2.377 11.438 -3.946 853 1HB LYS 104 1HB LYS 104 -2.503 13.380 -6.094 854 2HB LYS 104 2HB LYS 104 -3.044 14.098 -4.590 855 1HG LYS 104 1HG LYS 104 -0.968 13.949 -3.611 856 2HG LYS 104 2HG LYS 104 -0.637 12.374 -4.304 857 1HD LYS 104 1HD LYS 104 0.736 13.392 -5.793 858 2HD LYS 104 2HD LYS 104 -0.682 14.109 -6.532 859 1HE LYS 104 1HE LYS 104 -0.388 15.835 -4.450 860 2HE LYS 104 2HE LYS 104 1.282 15.326 -4.610 861 1HZ LYS 104 1HZ LYS 104 0.470 17.259 -6.007 862 2HZ LYS 104 2HZ LYS 104 1.377 16.124 -6.753 863 3HZ LYS 104 3HZ LYS 104 -0.243 16.144 -6.963 864 HA PRO 105 HA PRO 105 -6.638 13.205 -3.019 865 1HB PRO 105 1HB PRO 105 -8.444 13.686 -5.012 866 2HB PRO 105 2HB PRO 105 -7.367 14.914 -4.378 867 1HG PRO 105 1HG PRO 105 -7.205 13.452 -6.942 868 2HG PRO 105 2HG PRO 105 -6.416 14.946 -6.479 869 1HD PRO 105 1HD PRO 105 -5.214 12.346 -6.631 870 2HD PRO 105 2HD PRO 105 -4.457 13.818 -6.058 871 H PHE 106 H PHE 106 -6.597 11.077 -2.115 872 HA PHE 106 HA PHE 106 -8.625 9.427 -3.452 873 1HB PHE 106 1HB PHE 106 -7.154 7.665 -1.951 874 2HB PHE 106 2HB PHE 106 -6.725 8.055 -3.604 875 HD1 PHE 106 HD1 PHE 106 -4.471 8.361 -3.903 876 HD2 PHE 106 HD2 PHE 106 -6.223 9.689 -0.274 877 HE1 PHE 106 HE1 PHE 106 -2.233 9.190 -3.126 878 HE2 PHE 106 HE2 PHE 106 -3.985 10.518 0.503 879 HZ PHE 106 HZ PHE 106 -2.016 10.259 -0.932 880 H ASP 107 H ASP 107 -9.974 8.101 -2.012 881 HA ASP 107 HA ASP 107 -10.158 9.356 0.612 882 1HB ASP 107 1HB ASP 107 -12.093 9.050 -1.408 883 2HB ASP 107 2HB ASP 107 -12.483 7.768 -0.279 884 H ILE 108 H ILE 108 -10.451 7.921 2.458 885 HA ILE 108 HA ILE 108 -9.350 5.316 2.075 886 HB ILE 108 HB ILE 108 -9.574 7.190 4.153 887 1HG1 ILE 108 1HG1 ILE 108 -7.610 5.820 3.529 888 2HG1 ILE 108 2HG1 ILE 108 -7.951 5.793 5.248 889 1HG2 ILE 108 1HG2 ILE 108 -11.000 4.602 4.813 890 2HG2 ILE 108 2HG2 ILE 108 -10.351 5.729 6.029 891 3HG2 ILE 108 3HG2 ILE 108 -11.640 6.259 4.921 892 1HD1 ILE 108 1HD1 ILE 108 -8.514 3.562 5.247 893 2HD1 ILE 108 2HD1 ILE 108 -9.290 3.654 3.648 894 3HD1 ILE 108 3HD1 ILE 108 -7.518 3.542 3.773 895 H ASP 109 H ASP 109 -12.585 6.743 2.652 896 HA ASP 109 HA ASP 109 -13.941 4.518 3.377 897 1HB ASP 109 1HB ASP 109 -14.559 7.125 2.545 898 2HB ASP 109 2HB ASP 109 -15.372 6.133 1.351 899 H GLU 110 H GLU 110 -13.018 5.715 0.085 900 HA GLU 110 HA GLU 110 -14.391 3.664 -1.265 901 1HB GLU 110 1HB GLU 110 -13.247 4.515 -3.263 902 2HB GLU 110 2HB GLU 110 -13.843 5.853 -2.301 903 1HG GLU 110 1HG GLU 110 -11.710 6.533 -1.650 904 2HG GLU 110 2HG GLU 110 -11.051 4.911 -1.711 905 H ILE 111 H ILE 111 -11.228 3.975 0.270 906 HA ILE 111 HA ILE 111 -10.081 1.765 -1.151 907 HB ILE 111 HB ILE 111 -9.254 3.626 1.025 908 1HG1 ILE 111 1HG1 ILE 111 -7.868 2.713 -1.512 909 2HG1 ILE 111 2HG1 ILE 111 -8.918 4.112 -1.408 910 1HG2 ILE 111 1HG2 ILE 111 -7.079 2.175 1.076 911 2HG2 ILE 111 2HG2 ILE 111 -8.460 1.763 2.121 912 3HG2 ILE 111 3HG2 ILE 111 -8.182 0.856 0.615 913 1HD1 ILE 111 1HD1 ILE 111 -7.260 5.379 -0.524 914 2HD1 ILE 111 2HD1 ILE 111 -6.947 4.173 0.747 915 3HD1 ILE 111 3HD1 ILE 111 -6.151 4.023 -0.837 916 H ARG 112 H ARG 112 -12.083 2.290 1.699 917 HA ARG 112 HA ARG 112 -11.389 -0.070 3.008 918 1HB ARG 112 1HB ARG 112 -13.847 1.733 3.097 919 2HB ARG 112 2HB ARG 112 -13.731 0.304 4.105 920 1HG ARG 112 1HG ARG 112 -11.443 1.240 4.902 921 2HG ARG 112 2HG ARG 112 -11.904 2.742 4.126 922 1HD ARG 112 1HD ARG 112 -12.838 3.211 6.176 923 2HD ARG 112 2HD ARG 112 -14.184 2.273 5.559 924 HE ARG 112 HE ARG 112 -12.515 0.346 6.653 925 1HH1 ARG 112 1HH1 ARG 112 -13.975 3.303 7.880 926 2HH1 ARG 112 2HH1 ARG 112 -14.059 2.735 9.514 927 1HH2 ARG 112 1HH2 ARG 112 -12.626 -0.404 8.809 928 2HH2 ARG 112 2HH2 ARG 112 -13.287 0.613 10.046 929 H ASP 113 H ASP 113 -13.308 0.636 0.178 930 HA ASP 113 HA ASP 113 -15.061 -1.552 0.396 931 1HB ASP 113 1HB ASP 113 -14.680 0.677 -1.324 932 2HB ASP 113 2HB ASP 113 -14.479 -0.725 -2.356 933 H ALA 114 H ALA 114 -12.009 -0.826 -1.444 934 HA ALA 114 HA ALA 114 -11.859 -3.341 -2.702 935 1HB ALA 114 1HB ALA 114 -9.275 -2.374 -2.598 936 2HB ALA 114 2HB ALA 114 -10.486 -1.932 -3.826 937 3HB ALA 114 3HB ALA 114 -10.239 -0.890 -2.405 938 H VAL 115 H VAL 115 -10.569 -1.987 0.376 939 HA VAL 115 HA VAL 115 -9.011 -4.276 0.970 940 HB VAL 115 HB VAL 115 -10.056 -1.959 2.597 941 1HG1 VAL 115 1HG1 VAL 115 -9.361 -2.884 4.509 942 2HG1 VAL 115 2HG1 VAL 115 -9.215 -4.425 3.630 943 3HG1 VAL 115 3HG1 VAL 115 -7.802 -3.354 3.789 944 1HG2 VAL 115 1HG2 VAL 115 -8.442 -1.206 1.035 945 2HG2 VAL 115 2HG2 VAL 115 -7.571 -1.379 2.578 946 3HG2 VAL 115 3HG2 VAL 115 -7.396 -2.619 1.313 947 H LYS 116 H LYS 116 -12.386 -3.254 1.566 948 HA LYS 116 HA LYS 116 -12.873 -5.410 3.384 949 1HB LYS 116 1HB LYS 116 -14.064 -3.317 3.642 950 2HB LYS 116 2HB LYS 116 -14.699 -3.418 2.013 951 1HG LYS 116 1HG LYS 116 -15.223 -5.772 3.805 952 2HG LYS 116 2HG LYS 116 -16.075 -4.290 4.191 953 1HD LYS 116 1HD LYS 116 -16.044 -5.425 1.365 954 2HD LYS 116 2HD LYS 116 -17.231 -5.937 2.548 955 1HE LYS 116 1HE LYS 116 -18.445 -4.029 2.290 956 2HE LYS 116 2HE LYS 116 -17.032 -3.016 2.505 957 1HZ LYS 116 1HZ LYS 116 -18.281 -3.180 0.235 958 2HZ LYS 116 2HZ LYS 116 -16.667 -2.942 0.297 959 3HZ LYS 116 3HZ LYS 116 -17.262 -4.433 -0.005 960 H LYS 117 H LYS 117 -12.554 -5.076 -0.023 961 HA LYS 117 HA LYS 117 -14.329 -7.331 -0.532 962 1HB LYS 117 1HB LYS 117 -13.221 -5.095 -2.117 963 2HB LYS 117 2HB LYS 117 -13.270 -6.632 -2.955 964 1HG LYS 117 1HG LYS 117 -15.702 -6.872 -2.256 965 2HG LYS 117 2HG LYS 117 -15.622 -5.262 -1.569 966 1HD LYS 117 1HD LYS 117 -14.816 -5.729 -4.460 967 2HD LYS 117 2HD LYS 117 -16.508 -5.564 -4.032 968 1HE LYS 117 1HE LYS 117 -16.173 -3.333 -3.155 969 2HE LYS 117 2HE LYS 117 -14.430 -3.510 -3.165 970 1HZ LYS 117 1HZ LYS 117 -15.347 -2.245 -5.047 971 2HZ LYS 117 2HZ LYS 117 -14.438 -3.519 -5.513 972 3HZ LYS 117 3HZ LYS 117 -16.066 -3.602 -5.601 973 H TYR 118 H TYR 118 -10.909 -6.391 -0.308 974 HA TYR 118 HA TYR 118 -10.090 -8.989 -1.340 975 1HB TYR 118 1HB TYR 118 -9.115 -6.479 -1.670 976 2HB TYR 118 2HB TYR 118 -8.343 -6.794 -0.128 977 HD1 TYR 118 HD1 TYR 118 -7.169 -9.280 -0.080 978 HD2 TYR 118 HD2 TYR 118 -7.807 -6.848 -3.542 979 HE1 TYR 118 HE1 TYR 118 -5.273 -10.477 -1.280 980 HE2 TYR 118 HE2 TYR 118 -5.910 -8.053 -4.729 981 HH TYR 118 HH TYR 118 -3.976 -9.298 -4.224 982 H LEU 119 H LEU 119 -9.912 -6.973 1.661 983 HA LEU 119 HA LEU 119 -9.168 -9.435 3.083 984 1HB LEU 119 1HB LEU 119 -8.197 -6.641 3.261 985 2HB LEU 119 2HB LEU 119 -8.422 -7.484 4.780 986 HG LEU 119 HG LEU 119 -6.118 -7.643 3.965 987 1HD1 LEU 119 1HD1 LEU 119 -5.850 -10.097 4.147 988 2HD1 LEU 119 2HD1 LEU 119 -6.931 -9.417 5.387 989 3HD1 LEU 119 3HD1 LEU 119 -7.614 -10.278 3.986 990 1HD2 LEU 119 1HD2 LEU 119 -5.529 -8.140 1.873 991 2HD2 LEU 119 2HD2 LEU 119 -6.612 -9.551 1.810 992 3HD2 LEU 119 3HD2 LEU 119 -7.246 -7.926 1.456 993 HA PRO 120 HA PRO 120 -12.759 -8.953 5.425 994 1HB PRO 120 1HB PRO 120 -12.055 -9.942 7.874 995 2HB PRO 120 2HB PRO 120 -12.446 -10.963 6.505 996 1HG PRO 120 1HG PRO 120 -9.797 -10.357 7.668 997 2HG PRO 120 2HG PRO 120 -10.253 -11.672 6.603 998 1HD PRO 120 1HD PRO 120 -8.823 -9.293 5.878 999 2HD PRO 120 2HD PRO 120 -9.381 -10.553 4.794 1000 H LEU 121 H LEU 121 -11.941 -6.518 5.029 1001 HA LEU 121 HA LEU 121 -11.316 -5.239 7.504 1002 1HB LEU 121 1HB LEU 121 -10.415 -4.311 5.533 1003 2HB LEU 121 2HB LEU 121 -11.970 -4.290 4.724 1004 HG LEU 121 HG LEU 121 -12.735 -2.566 6.399 1005 1HD1 LEU 121 1HD1 LEU 121 -9.919 -1.891 7.051 1006 2HD1 LEU 121 2HD1 LEU 121 -11.407 -1.690 8.007 1007 3HD1 LEU 121 3HD1 LEU 121 -10.626 -3.286 7.900 1008 1HD2 LEU 121 1HD2 LEU 121 -12.176 -0.960 4.940 1009 2HD2 LEU 121 2HD2 LEU 121 -10.431 -1.267 5.111 1010 3HD2 LEU 121 3HD2 LEU 121 -11.411 -2.282 4.026 1011 H LYS 122 H LYS 122 -12.740 -3.353 8.297 1012 HA LYS 122 HA LYS 122 -15.047 -4.293 9.335 1013 1HB LYS 122 1HB LYS 122 -13.944 -2.264 10.096 1014 2HB LYS 122 2HB LYS 122 -14.342 -1.437 8.603 1015 1HG LYS 122 1HG LYS 122 -16.844 -2.244 9.321 1016 2HG LYS 122 2HG LYS 122 -16.120 -2.151 10.914 1017 1HD LYS 122 1HD LYS 122 -16.361 0.100 10.890 1018 2HD LYS 122 2HD LYS 122 -15.279 0.200 9.516 1019 1HE LYS 122 1HE LYS 122 -16.993 0.517 8.026 1020 2HE LYS 122 2HE LYS 122 -18.000 -0.707 8.773 1021 1HZ LYS 122 1HZ LYS 122 -18.192 1.050 10.627 1022 2HZ LYS 122 2HZ LYS 122 -17.752 2.106 9.461 1023 3HZ LYS 122 3HZ LYS 122 -19.100 1.202 9.278 1024 H SER 123 H SER 123 -17.114 -4.698 8.682 1025 HA SER 123 HA SER 123 -17.601 -4.476 5.886 1026 1HB SER 123 1HB SER 123 -19.539 -5.821 6.297 1027 2HB SER 123 2HB SER 123 -18.292 -6.436 7.364 1028 HG SER 123 HG SER 123 -19.274 -5.488 9.140 1029 H ASN 124 H ASN 124 -18.478 -2.683 4.925 1030 HA ASN 124 HA ASN 124 -19.757 -0.764 6.652 1031 1HB ASN 124 1HB ASN 124 -17.997 -0.447 4.576 1032 2HB ASN 124 2HB ASN 124 -19.502 -0.285 3.691 1033 1HD2 ASN 124 1HD2 ASN 124 -21.137 1.201 4.621 1034 2HD2 ASN 124 2HD2 ASN 124 -20.602 2.690 5.326 Start of MODEL 9 1 1H MET 1 1H MET 1 -3.532 -11.879 22.018 2 HA MET 1 HA MET 1 -2.396 -10.020 21.960 3 1HB MET 1 1HB MET 1 -0.922 -11.692 19.968 4 2HB MET 1 2HB MET 1 -0.705 -9.969 19.736 5 1HG MET 1 1HG MET 1 0.014 -9.718 22.108 6 2HG MET 1 2HG MET 1 -0.258 -11.426 22.387 7 1HE MET 1 1HE MET 1 3.397 -10.123 22.374 8 2HE MET 1 2HE MET 1 1.943 -10.507 23.327 9 3HE MET 1 3HE MET 1 3.044 -11.810 22.819 10 H MET 2 H MET 2 -2.784 -10.908 18.446 11 HA MET 2 HA MET 2 -4.907 -9.235 17.997 12 1HB MET 2 1HB MET 2 -2.223 -7.922 17.973 13 2HB MET 2 2HB MET 2 -3.162 -7.620 16.524 14 1HG MET 2 1HG MET 2 -4.553 -6.190 17.623 15 2HG MET 2 2HG MET 2 -4.859 -7.357 18.894 16 1HE MET 2 1HE MET 2 -3.745 -4.823 21.416 17 2HE MET 2 2HE MET 2 -5.057 -4.979 20.223 18 3HE MET 2 3HE MET 2 -4.564 -6.388 21.193 19 H ASN 3 H ASN 3 -5.416 -9.030 15.633 20 HA ASN 3 HA ASN 3 -3.841 -10.959 14.115 21 1HB ASN 3 1HB ASN 3 -6.005 -11.512 12.915 22 2HB ASN 3 2HB ASN 3 -6.035 -11.934 14.615 23 1HD2 ASN 3 1HD2 ASN 3 -8.333 -11.882 14.396 24 2HD2 ASN 3 2HD2 ASN 3 -9.208 -10.391 14.504 25 H GLU 4 H GLU 4 -4.362 -10.598 11.590 26 HA GLU 4 HA GLU 4 -4.324 -9.322 9.832 27 1HB GLU 4 1HB GLU 4 -6.507 -8.443 10.555 28 2HB GLU 4 2HB GLU 4 -5.728 -7.261 11.588 29 1HG GLU 4 1HG GLU 4 -4.515 -6.478 9.378 30 2HG GLU 4 2HG GLU 4 -5.782 -7.366 8.555 31 H LYS 5 H LYS 5 -2.873 -7.845 8.795 32 HA LYS 5 HA LYS 5 -1.311 -6.117 10.528 33 1HB LYS 5 1HB LYS 5 -0.244 -8.556 9.140 34 2HB LYS 5 2HB LYS 5 0.774 -7.136 9.272 35 1HG LYS 5 1HG LYS 5 1.179 -7.540 11.469 36 2HG LYS 5 2HG LYS 5 -0.534 -7.624 11.828 37 1HD LYS 5 1HD LYS 5 -0.362 -9.866 12.093 38 2HD LYS 5 2HD LYS 5 0.092 -10.025 10.407 39 1HE LYS 5 1HE LYS 5 2.059 -10.850 11.248 40 2HE LYS 5 2HE LYS 5 2.477 -9.161 11.459 41 1HZ LYS 5 1HZ LYS 5 1.139 -10.789 13.506 42 2HZ LYS 5 2HZ LYS 5 2.743 -10.482 13.472 43 3HZ LYS 5 3HZ LYS 5 1.682 -9.260 13.689 44 H ILE 6 H ILE 6 0.071 -4.604 9.216 45 HA ILE 6 HA ILE 6 -0.356 -4.456 6.422 46 HB ILE 6 HB ILE 6 -2.348 -3.255 8.121 47 1HG1 ILE 6 1HG1 ILE 6 -2.479 -2.847 5.204 48 2HG1 ILE 6 2HG1 ILE 6 -2.216 -4.512 5.683 49 1HG2 ILE 6 1HG2 ILE 6 -1.180 -1.218 8.152 50 2HG2 ILE 6 2HG2 ILE 6 -0.667 -1.383 6.456 51 3HG2 ILE 6 3HG2 ILE 6 -2.372 -1.046 6.841 52 1HD1 ILE 6 1HD1 ILE 6 -4.663 -3.799 5.504 53 2HD1 ILE 6 2HD1 ILE 6 -4.204 -4.539 7.057 54 3HD1 ILE 6 3HD1 ILE 6 -4.385 -2.773 6.932 55 H LEU 7 H LEU 7 0.985 -2.828 5.455 56 HA LEU 7 HA LEU 7 2.652 -1.369 7.370 57 1HB LEU 7 1HB LEU 7 3.490 -3.649 6.067 58 2HB LEU 7 2HB LEU 7 4.082 -2.372 5.024 59 HG LEU 7 HG LEU 7 4.834 -1.452 7.504 60 1HD1 LEU 7 1HD1 LEU 7 4.172 -3.435 8.682 61 2HD1 LEU 7 2HD1 LEU 7 5.046 -4.473 7.530 62 3HD1 LEU 7 3HD1 LEU 7 5.951 -3.387 8.612 63 1HD2 LEU 7 1HD2 LEU 7 6.719 -3.266 6.068 64 2HD2 LEU 7 2HD2 LEU 7 6.051 -1.873 5.184 65 3HD2 LEU 7 3HD2 LEU 7 6.958 -1.617 6.694 66 H ILE 8 H ILE 8 3.401 0.664 6.635 67 HA ILE 8 HA ILE 8 2.175 1.500 4.098 68 HB ILE 8 HB ILE 8 2.435 2.954 6.724 69 1HG1 ILE 8 1HG1 ILE 8 -0.071 2.731 5.095 70 2HG1 ILE 8 2HG1 ILE 8 0.462 1.335 6.011 71 1HG2 ILE 8 1HG2 ILE 8 2.724 4.858 5.619 72 2HG2 ILE 8 2HG2 ILE 8 2.542 4.048 4.044 73 3HG2 ILE 8 3HG2 ILE 8 1.104 4.625 4.919 74 1HD1 ILE 8 1HD1 ILE 8 0.781 3.301 7.902 75 2HD1 ILE 8 2HD1 ILE 8 -0.599 3.943 6.978 76 3HD1 ILE 8 3HD1 ILE 8 -0.699 2.328 7.719 77 H VAL 9 H VAL 9 3.444 2.665 2.653 78 HA VAL 9 HA VAL 9 6.178 3.237 3.539 79 HB VAL 9 HB VAL 9 5.444 1.927 0.916 80 1HG1 VAL 9 1HG1 VAL 9 8.200 2.069 2.124 81 2HG1 VAL 9 2HG1 VAL 9 7.719 1.843 0.426 82 3HG1 VAL 9 3HG1 VAL 9 7.548 3.439 1.194 83 1HG2 VAL 9 1HG2 VAL 9 6.026 -0.158 1.746 84 2HG2 VAL 9 2HG2 VAL 9 6.950 0.521 3.108 85 3HG2 VAL 9 3HG2 VAL 9 5.171 0.558 3.133 86 H ASP 10 H ASP 10 6.839 5.269 3.004 87 HA ASP 10 HA ASP 10 6.666 7.330 2.326 88 1HB ASP 10 1HB ASP 10 6.746 5.637 0.006 89 2HB ASP 10 2HB ASP 10 5.660 6.959 -0.373 90 H ASP 11 H ASP 11 5.044 8.853 0.674 91 HA ASP 11 HA ASP 11 3.083 9.741 0.405 92 1HB ASP 11 1HB ASP 11 2.526 7.211 -0.209 93 2HB ASP 11 2HB ASP 11 1.639 7.233 1.302 94 H GLN 12 H GLN 12 4.405 8.840 3.234 95 HA GLN 12 HA GLN 12 2.176 9.057 4.979 96 1HB GLN 12 1HB GLN 12 4.112 9.250 6.724 97 2HB GLN 12 2HB GLN 12 3.908 7.738 5.861 98 1HG GLN 12 1HG GLN 12 5.835 8.025 4.598 99 2HG GLN 12 2HG GLN 12 5.673 9.769 4.541 100 1HE2 GLN 12 1HE2 GLN 12 5.666 10.734 6.914 101 2HE2 GLN 12 2HE2 GLN 12 7.026 10.277 7.884 102 H TYR 13 H TYR 13 1.136 10.962 5.361 103 HA TYR 13 HA TYR 13 2.724 13.295 5.979 104 1HB TYR 13 1HB TYR 13 1.769 12.786 3.355 105 2HB TYR 13 2HB TYR 13 0.504 13.789 4.036 106 HD1 TYR 13 HD1 TYR 13 3.490 13.858 2.232 107 HD2 TYR 13 HD2 TYR 13 1.456 15.949 5.362 108 HE1 TYR 13 HE1 TYR 13 4.871 15.938 1.751 109 HE2 TYR 13 HE2 TYR 13 2.844 18.021 4.870 110 HH TYR 13 HH TYR 13 4.857 18.644 3.885 111 H GLY 14 H GLY 14 0.809 11.377 7.314 112 1HA GLY 14 1HA GLY 14 -0.489 12.100 9.174 113 2HA GLY 14 2HA GLY 14 -1.124 13.418 8.210 114 H ILE 15 H ILE 15 -1.061 11.068 5.947 115 HA ILE 15 HA ILE 15 -3.846 10.430 6.396 116 HB ILE 15 HB ILE 15 -1.936 10.201 4.095 117 1HG1 ILE 15 1HG1 ILE 15 -4.296 11.358 3.248 118 2HG1 ILE 15 2HG1 ILE 15 -4.169 11.936 4.897 119 1HG2 ILE 15 1HG2 ILE 15 -2.937 8.286 3.497 120 2HG2 ILE 15 2HG2 ILE 15 -4.301 8.524 4.615 121 3HG2 ILE 15 3HG2 ILE 15 -4.295 9.337 3.031 122 1HD1 ILE 15 1HD1 ILE 15 -2.750 13.510 4.072 123 2HD1 ILE 15 2HD1 ILE 15 -1.550 12.199 3.965 124 3HD1 ILE 15 3HD1 ILE 15 -2.534 12.624 2.543 125 H ARG 16 H ARG 16 -0.636 8.817 6.201 126 HA ARG 16 HA ARG 16 -1.388 6.250 6.140 127 1HB ARG 16 1HB ARG 16 0.700 5.893 7.702 128 2HB ARG 16 2HB ARG 16 0.945 6.642 6.137 129 1HG ARG 16 1HG ARG 16 1.098 8.844 7.083 130 2HG ARG 16 2HG ARG 16 0.401 8.331 8.607 131 1HD ARG 16 1HD ARG 16 2.950 6.983 7.726 132 2HD ARG 16 2HD ARG 16 3.065 8.639 8.287 133 HE ARG 16 HE ARG 16 1.476 6.973 10.082 134 1HH1 ARG 16 1HH1 ARG 16 4.755 7.926 9.232 135 2HH1 ARG 16 2HH1 ARG 16 5.404 7.558 10.796 136 1HH2 ARG 16 1HH2 ARG 16 2.331 6.488 12.144 137 2HH2 ARG 16 2HH2 ARG 16 4.016 6.735 12.463 138 H ILE 17 H ILE 17 -1.462 8.512 8.928 139 HA ILE 17 HA ILE 17 -2.077 6.495 10.837 140 HB ILE 17 HB ILE 17 -2.330 9.503 10.921 141 1HG1 ILE 17 1HG1 ILE 17 -0.189 7.904 12.291 142 2HG1 ILE 17 2HG1 ILE 17 -0.028 8.273 10.586 143 1HG2 ILE 17 1HG2 ILE 17 -3.519 7.680 12.638 144 2HG2 ILE 17 2HG2 ILE 17 -2.011 8.126 13.471 145 3HG2 ILE 17 3HG2 ILE 17 -3.166 9.390 12.982 146 1HD1 ILE 17 1HD1 ILE 17 -0.462 10.315 12.815 147 2HD1 ILE 17 2HD1 ILE 17 1.061 10.021 11.941 148 3HD1 ILE 17 3HD1 ILE 17 -0.341 10.704 11.083 149 H LEU 18 H LEU 18 -3.972 8.937 8.960 150 HA LEU 18 HA LEU 18 -6.418 8.631 10.045 151 1HB LEU 18 1HB LEU 18 -5.536 10.011 8.029 152 2HB LEU 18 2HB LEU 18 -6.075 8.651 7.064 153 HG LEU 18 HG LEU 18 -8.031 9.796 9.004 154 1HD1 LEU 18 1HD1 LEU 18 -7.673 11.178 6.358 155 2HD1 LEU 18 2HD1 LEU 18 -8.545 11.717 7.813 156 3HD1 LEU 18 3HD1 LEU 18 -6.765 11.710 7.794 157 1HD2 LEU 18 1HD2 LEU 18 -9.347 8.423 7.865 158 2HD2 LEU 18 2HD2 LEU 18 -9.118 9.443 6.425 159 3HD2 LEU 18 3HD2 LEU 18 -8.039 8.058 6.714 160 H LEU 19 H LEU 19 -5.029 6.525 7.429 161 HA LEU 19 HA LEU 19 -7.215 4.715 7.605 162 1HB LEU 19 1HB LEU 19 -5.969 3.398 6.015 163 2HB LEU 19 2HB LEU 19 -6.019 5.083 5.537 164 HG LEU 19 HG LEU 19 -3.666 5.180 6.740 165 1HD1 LEU 19 1HD1 LEU 19 -2.514 2.909 6.098 166 2HD1 LEU 19 2HD1 LEU 19 -3.330 3.106 7.667 167 3HD1 LEU 19 3HD1 LEU 19 -4.150 2.251 6.339 168 1HD2 LEU 19 1HD2 LEU 19 -2.660 5.113 4.653 169 2HD2 LEU 19 2HD2 LEU 19 -3.717 3.807 4.066 170 3HD2 LEU 19 3HD2 LEU 19 -4.361 5.455 4.256 171 H ASN 20 H ASN 20 -4.216 5.210 9.344 172 HA ASN 20 HA ASN 20 -3.768 2.602 10.144 173 1HB ASN 20 1HB ASN 20 -2.204 4.600 10.434 174 2HB ASN 20 2HB ASN 20 -3.231 5.162 11.739 175 1HD2 ASN 20 1HD2 ASN 20 -0.971 4.926 12.698 176 2HD2 ASN 20 2HD2 ASN 20 -0.619 3.444 13.523 177 H GLU 21 H GLU 21 -5.254 5.392 11.979 178 HA GLU 21 HA GLU 21 -6.101 4.000 14.137 179 1HB GLU 21 1HB GLU 21 -6.224 6.394 14.144 180 2HB GLU 21 2HB GLU 21 -7.260 6.431 12.732 181 1HG GLU 21 1HG GLU 21 -9.109 5.398 14.006 182 2HG GLU 21 2HG GLU 21 -8.076 5.204 15.408 183 H VAL 22 H VAL 22 -7.455 4.070 10.863 184 HA VAL 22 HA VAL 22 -10.015 3.108 11.494 185 HB VAL 22 HB VAL 22 -8.279 3.300 9.075 186 1HG1 VAL 22 1HG1 VAL 22 -9.196 1.103 8.747 187 2HG1 VAL 22 2HG1 VAL 22 -10.819 1.648 9.234 188 3HG1 VAL 22 3HG1 VAL 22 -10.102 2.235 7.714 189 1HG2 VAL 22 1HG2 VAL 22 -10.691 4.304 8.386 190 2HG2 VAL 22 2HG2 VAL 22 -10.759 4.534 10.150 191 3HG2 VAL 22 3HG2 VAL 22 -9.430 5.252 9.209 192 H PHE 23 H PHE 23 -6.986 1.422 10.407 193 HA PHE 23 HA PHE 23 -8.213 -1.131 10.865 194 1HB PHE 23 1HB PHE 23 -5.489 -0.002 10.048 195 2HB PHE 23 2HB PHE 23 -5.637 -1.711 10.407 196 HD1 PHE 23 HD1 PHE 23 -8.249 -2.374 9.238 197 HD2 PHE 23 HD2 PHE 23 -5.161 0.132 7.757 198 HE1 PHE 23 HE1 PHE 23 -9.030 -2.800 6.891 199 HE2 PHE 23 HE2 PHE 23 -5.942 -0.294 5.409 200 HZ PHE 23 HZ PHE 23 -7.866 -1.755 5.004 201 H ASN 24 H ASN 24 -6.247 1.189 12.652 202 HA ASN 24 HA ASN 24 -4.971 -0.517 14.376 203 1HB ASN 24 1HB ASN 24 -5.042 2.186 14.060 204 2HB ASN 24 2HB ASN 24 -6.097 2.069 15.455 205 1HD2 ASN 24 1HD2 ASN 24 -5.330 1.324 17.413 206 2HD2 ASN 24 2HD2 ASN 24 -3.645 1.194 17.791 207 H LYS 25 H LYS 25 -8.335 0.640 14.183 208 HA LYS 25 HA LYS 25 -9.201 0.243 16.759 209 1HB LYS 25 1HB LYS 25 -10.503 0.130 14.057 210 2HB LYS 25 2HB LYS 25 -11.420 -0.366 15.465 211 1HG LYS 25 1HG LYS 25 -11.036 1.801 16.556 212 2HG LYS 25 2HG LYS 25 -9.937 2.297 15.284 213 1HD LYS 25 1HD LYS 25 -11.720 3.204 14.213 214 2HD LYS 25 2HD LYS 25 -12.272 1.573 13.890 215 1HE LYS 25 1HE LYS 25 -13.132 1.901 16.496 216 2HE LYS 25 2HE LYS 25 -13.259 3.544 15.900 217 1HZ LYS 25 1HZ LYS 25 -15.211 2.023 15.542 218 2HZ LYS 25 2HZ LYS 25 -14.713 2.877 14.242 219 3HZ LYS 25 3HZ LYS 25 -14.337 1.293 14.371 220 H GLU 26 H GLU 26 -8.032 -2.070 14.432 221 HA GLU 26 HA GLU 26 -9.376 -4.241 15.761 222 1HB GLU 26 1HB GLU 26 -7.799 -3.889 13.241 223 2HB GLU 26 2HB GLU 26 -7.707 -5.469 13.993 224 1HG GLU 26 1HG GLU 26 -10.421 -4.969 14.158 225 2HG GLU 26 2HG GLU 26 -10.019 -4.131 12.672 226 H GLY 27 H GLY 27 -6.367 -2.474 15.865 227 1HA GLY 27 1HA GLY 27 -4.807 -2.642 17.552 228 2HA GLY 27 2HA GLY 27 -5.404 -4.234 17.977 229 H TYR 28 H TYR 28 -5.007 -3.811 14.557 230 HA TYR 28 HA TYR 28 -3.021 -5.801 14.428 231 1HB TYR 28 1HB TYR 28 -3.331 -5.410 12.055 232 2HB TYR 28 2HB TYR 28 -4.876 -4.963 12.751 233 HD1 TYR 28 HD1 TYR 28 -3.343 -4.066 10.100 234 HD2 TYR 28 HD2 TYR 28 -4.050 -2.264 13.915 235 HE1 TYR 28 HE1 TYR 28 -3.151 -1.758 9.053 236 HE2 TYR 28 HE2 TYR 28 -3.856 0.039 12.855 237 HH TYR 28 HH TYR 28 -2.577 0.922 10.695 238 H GLN 29 H GLN 29 -0.815 -5.673 13.740 239 HA GLN 29 HA GLN 29 0.447 -3.304 14.707 240 1HB GLN 29 1HB GLN 29 1.149 -6.070 14.353 241 2HB GLN 29 2HB GLN 29 2.317 -5.114 13.462 242 1HG GLN 29 1HG GLN 29 3.146 -4.075 15.371 243 2HG GLN 29 2HG GLN 29 1.605 -4.122 16.204 244 1HE2 GLN 29 1HE2 GLN 29 0.990 -5.897 17.370 245 2HE2 GLN 29 2HE2 GLN 29 2.052 -7.201 17.783 246 H THR 30 H THR 30 1.558 -1.738 13.501 247 HA THR 30 HA THR 30 1.562 -2.120 10.585 248 HB THR 30 HB THR 30 0.870 0.335 10.466 249 HG1 THR 30 HG1 THR 30 0.273 -0.290 13.271 250 1HG2 THR 30 1HG2 THR 30 -1.415 -0.473 11.999 251 2HG2 THR 30 2HG2 THR 30 -1.243 -0.498 10.228 252 3HG2 THR 30 3HG2 THR 30 -0.806 -1.934 11.184 253 H PHE 31 H PHE 31 3.138 -0.768 9.436 254 HA PHE 31 HA PHE 31 5.216 0.349 11.119 255 1HB PHE 31 1HB PHE 31 5.288 -2.315 10.152 256 2HB PHE 31 2HB PHE 31 6.202 -1.438 8.942 257 HD1 PHE 31 HD1 PHE 31 8.016 0.231 9.955 258 HD2 PHE 31 HD2 PHE 31 6.429 -3.147 11.976 259 HE1 PHE 31 HE1 PHE 31 10.041 0.166 11.436 260 HE2 PHE 31 HE2 PHE 31 8.454 -3.212 13.457 261 HZ PHE 31 HZ PHE 31 10.236 -1.555 13.170 262 H GLN 32 H GLN 32 6.622 1.810 9.977 263 HA GLN 32 HA GLN 32 5.619 2.422 7.306 264 1HB GLN 32 1HB GLN 32 6.759 4.367 9.361 265 2HB GLN 32 2HB GLN 32 6.171 4.795 7.767 266 1HG GLN 32 1HG GLN 32 4.076 4.989 8.605 267 2HG GLN 32 2HG GLN 32 4.081 3.279 8.989 268 1HE2 GLN 32 1HE2 GLN 32 2.830 3.663 10.819 269 2HE2 GLN 32 2HE2 GLN 32 3.484 4.315 12.284 270 H ALA 33 H ALA 33 7.212 3.231 5.738 271 HA ALA 33 HA ALA 33 9.995 2.825 6.520 272 1HB ALA 33 1HB ALA 33 9.951 1.679 4.031 273 2HB ALA 33 2HB ALA 33 9.890 0.767 5.558 274 3HB ALA 33 3HB ALA 33 8.385 1.141 4.685 275 H ALA 34 H ALA 34 11.478 3.636 4.673 276 HA ALA 34 HA ALA 34 10.139 5.852 3.282 277 1HB ALA 34 1HB ALA 34 12.335 5.857 5.250 278 2HB ALA 34 2HB ALA 34 12.723 6.727 3.746 279 3HB ALA 34 3HB ALA 34 11.292 7.190 4.698 280 H ASN 35 H ASN 35 10.414 3.329 2.112 281 HA ASN 35 HA ASN 35 11.722 3.952 -0.199 282 1HB ASN 35 1HB ASN 35 13.463 2.677 1.863 283 2HB ASN 35 2HB ASN 35 13.491 1.861 0.313 284 1HD2 ASN 35 1HD2 ASN 35 15.635 3.256 1.535 285 2HD2 ASN 35 2HD2 ASN 35 16.094 4.583 0.521 286 H GLY 36 H GLY 36 12.274 1.560 -1.389 287 1HA GLY 36 1HA GLY 36 9.792 0.075 -1.088 288 2HA GLY 36 2HA GLY 36 10.984 -0.073 -2.364 289 H LEU 37 H LEU 37 13.376 -0.502 -0.942 290 HA LEU 37 HA LEU 37 13.165 -3.230 -0.374 291 1HB LEU 37 1HB LEU 37 15.177 -1.350 -0.838 292 2HB LEU 37 2HB LEU 37 15.500 -1.950 0.776 293 HG LEU 37 HG LEU 37 15.035 -3.827 -1.543 294 1HD1 LEU 37 1HD1 LEU 37 16.849 -2.302 -2.176 295 2HD1 LEU 37 2HD1 LEU 37 17.699 -2.682 -0.659 296 3HD1 LEU 37 3HD1 LEU 37 17.446 -3.952 -1.879 297 1HD2 LEU 37 1HD2 LEU 37 15.657 -5.498 -0.162 298 2HD2 LEU 37 2HD2 LEU 37 16.854 -4.499 0.696 299 3HD2 LEU 37 3HD2 LEU 37 15.126 -4.362 1.100 300 H GLN 38 H GLN 38 13.732 -0.395 1.829 301 HA GLN 38 HA GLN 38 13.798 -1.741 4.160 302 1HB GLN 38 1HB GLN 38 13.341 0.985 3.294 303 2HB GLN 38 2HB GLN 38 12.271 0.635 4.638 304 1HG GLN 38 1HG GLN 38 14.396 -0.399 5.786 305 2HG GLN 38 2HG GLN 38 15.304 0.467 4.563 306 1HE2 GLN 38 1HE2 GLN 38 15.928 2.424 5.036 307 2HE2 GLN 38 2HE2 GLN 38 15.222 3.504 6.192 308 H ALA 39 H ALA 39 11.046 -1.234 2.024 309 HA ALA 39 HA ALA 39 9.112 -1.876 4.068 310 1HB ALA 39 1HB ALA 39 7.507 -1.386 2.410 311 2HB ALA 39 2HB ALA 39 8.846 -0.271 2.045 312 3HB ALA 39 3HB ALA 39 8.633 -1.752 1.081 313 H LEU 40 H LEU 40 10.913 -3.445 1.409 314 HA LEU 40 HA LEU 40 9.349 -5.789 1.357 315 1HB LEU 40 1HB LEU 40 12.113 -5.074 0.411 316 2HB LEU 40 2HB LEU 40 11.486 -6.703 0.264 317 HG LEU 40 HG LEU 40 10.558 -4.191 -1.109 318 1HD1 LEU 40 1HD1 LEU 40 12.173 -5.280 -2.388 319 2HD1 LEU 40 2HD1 LEU 40 11.557 -6.898 -1.972 320 3HD1 LEU 40 3HD1 LEU 40 10.635 -5.852 -3.078 321 1HD2 LEU 40 1HD2 LEU 40 8.469 -4.944 -0.440 322 2HD2 LEU 40 2HD2 LEU 40 8.678 -5.721 -2.028 323 3HD2 LEU 40 3HD2 LEU 40 8.938 -6.659 -0.537 324 H ASP 41 H ASP 41 12.372 -4.835 3.094 325 HA ASP 41 HA ASP 41 12.824 -7.304 4.229 326 1HB ASP 41 1HB ASP 41 13.881 -4.652 4.395 327 2HB ASP 41 2HB ASP 41 13.533 -5.133 6.044 328 H ILE 42 H ILE 42 11.131 -4.332 5.487 329 HA ILE 42 HA ILE 42 10.361 -5.519 7.922 330 HB ILE 42 HB ILE 42 9.510 -3.072 6.398 331 1HG1 ILE 42 1HG1 ILE 42 11.532 -3.728 8.392 332 2HG1 ILE 42 2HG1 ILE 42 11.397 -2.332 7.341 333 1HG2 ILE 42 1HG2 ILE 42 7.569 -4.033 7.670 334 2HG2 ILE 42 2HG2 ILE 42 8.520 -3.815 9.159 335 3HG2 ILE 42 3HG2 ILE 42 8.071 -2.402 8.174 336 1HD1 ILE 42 1HD1 ILE 42 9.639 -1.386 8.897 337 2HD1 ILE 42 2HD1 ILE 42 9.949 -2.753 9.994 338 3HD1 ILE 42 3HD1 ILE 42 11.240 -1.575 9.653 339 H VAL 43 H VAL 43 9.028 -5.498 4.634 340 HA VAL 43 HA VAL 43 6.406 -6.134 5.156 341 HB VAL 43 HB VAL 43 8.329 -6.422 2.955 342 1HG1 VAL 43 1HG1 VAL 43 6.040 -8.358 3.278 343 2HG1 VAL 43 2HG1 VAL 43 6.574 -7.835 1.663 344 3HG1 VAL 43 3HG1 VAL 43 7.712 -8.665 2.751 345 1HG2 VAL 43 1HG2 VAL 43 6.205 -4.788 3.562 346 2HG2 VAL 43 2HG2 VAL 43 6.941 -4.962 1.951 347 3HG2 VAL 43 3HG2 VAL 43 5.490 -5.902 2.373 348 H THR 44 H THR 44 9.245 -8.364 4.772 349 HA THR 44 HA THR 44 7.694 -10.665 5.412 350 HB THR 44 HB THR 44 10.726 -10.234 5.434 351 HG1 THR 44 HG1 THR 44 10.472 -10.594 3.172 352 1HG2 THR 44 1HG2 THR 44 10.925 -12.536 5.340 353 2HG2 THR 44 2HG2 THR 44 9.326 -12.517 6.122 354 3HG2 THR 44 3HG2 THR 44 9.451 -12.712 4.357 355 H LYS 45 H LYS 45 9.676 -8.346 7.271 356 HA LYS 45 HA LYS 45 9.838 -9.888 9.599 357 1HB LYS 45 1HB LYS 45 10.697 -7.356 8.695 358 2HB LYS 45 2HB LYS 45 9.744 -7.045 10.132 359 1HG LYS 45 1HG LYS 45 11.251 -9.305 10.843 360 2HG LYS 45 2HG LYS 45 12.372 -8.365 9.879 361 1HD LYS 45 1HD LYS 45 11.008 -6.511 11.591 362 2HD LYS 45 2HD LYS 45 11.461 -7.876 12.591 363 1HE LYS 45 1HE LYS 45 13.781 -7.555 11.161 364 2HE LYS 45 2HE LYS 45 13.205 -5.900 11.172 365 1HZ LYS 45 1HZ LYS 45 13.952 -7.578 13.420 366 2HZ LYS 45 2HZ LYS 45 14.327 -6.017 13.124 367 3HZ LYS 45 3HZ LYS 45 12.837 -6.411 13.664 368 H GLU 46 H GLU 46 7.488 -7.322 8.570 369 HA GLU 46 HA GLU 46 5.880 -7.965 10.863 370 1HB GLU 46 1HB GLU 46 5.978 -5.786 8.819 371 2HB GLU 46 2HB GLU 46 4.388 -6.157 9.456 372 1HG GLU 46 1HG GLU 46 6.126 -6.137 11.714 373 2HG GLU 46 2HG GLU 46 6.601 -4.756 10.746 374 H ARG 47 H ARG 47 6.366 -9.314 7.844 375 HA ARG 47 HA ARG 47 4.985 -10.180 6.299 376 1HB ARG 47 1HB ARG 47 4.031 -12.330 7.259 377 2HB ARG 47 2HB ARG 47 5.705 -12.046 7.692 378 1HG ARG 47 1HG ARG 47 5.183 -12.069 9.897 379 2HG ARG 47 2HG ARG 47 4.044 -10.756 9.675 380 1HD ARG 47 1HD ARG 47 2.789 -12.624 10.567 381 2HD ARG 47 2HD ARG 47 2.327 -12.467 8.884 382 HE ARG 47 HE ARG 47 4.468 -14.244 8.817 383 1HH1 ARG 47 1HH1 ARG 47 1.385 -14.148 10.513 384 2HH1 ARG 47 2HH1 ARG 47 1.229 -15.871 10.590 385 1HH2 ARG 47 1HH2 ARG 47 4.262 -16.518 8.919 386 2HH2 ARG 47 2HH2 ARG 47 2.876 -17.228 9.677 387 HA PRO 48 HA PRO 48 1.053 -8.221 7.666 388 1HB PRO 48 1HB PRO 48 0.982 -6.125 5.915 389 2HB PRO 48 2HB PRO 48 1.588 -5.985 7.553 390 1HG PRO 48 1HG PRO 48 3.105 -6.088 5.018 391 2HG PRO 48 2HG PRO 48 3.635 -5.532 6.593 392 1HD PRO 48 1HD PRO 48 4.281 -8.036 5.351 393 2HD PRO 48 2HD PRO 48 4.714 -7.527 6.971 394 H ASP 49 H ASP 49 -1.045 -7.945 6.527 395 HA ASP 49 HA ASP 49 -1.002 -9.894 4.399 396 1HB ASP 49 1HB ASP 49 -3.199 -8.638 6.090 397 2HB ASP 49 2HB ASP 49 -3.582 -9.607 4.682 398 H LEU 50 H LEU 50 -0.577 -6.622 4.669 399 HA LEU 50 HA LEU 50 -1.329 -6.121 1.982 400 1HB LEU 50 1HB LEU 50 -3.447 -5.890 3.641 401 2HB LEU 50 2HB LEU 50 -2.786 -4.273 3.777 402 HG LEU 50 HG LEU 50 -2.835 -4.155 1.239 403 1HD1 LEU 50 1HD1 LEU 50 -3.753 -6.887 1.607 404 2HD1 LEU 50 2HD1 LEU 50 -4.906 -5.922 0.654 405 3HD1 LEU 50 3HD1 LEU 50 -3.208 -6.048 0.134 406 1HD2 LEU 50 1HD2 LEU 50 -5.585 -4.221 1.478 407 2HD2 LEU 50 2HD2 LEU 50 -5.037 -3.979 3.155 408 3HD2 LEU 50 3HD2 LEU 50 -4.525 -2.848 1.879 409 H VAL 51 H VAL 51 -0.275 -4.262 1.174 410 HA VAL 51 HA VAL 51 1.209 -2.701 3.150 411 HB VAL 51 HB VAL 51 2.489 -3.810 0.655 412 1HG1 VAL 51 1HG1 VAL 51 3.692 -1.930 1.380 413 2HG1 VAL 51 2HG1 VAL 51 3.470 -2.332 3.100 414 3HG1 VAL 51 3HG1 VAL 51 4.572 -3.303 2.093 415 1HG2 VAL 51 1HG2 VAL 51 2.796 -4.931 3.459 416 2HG2 VAL 51 2HG2 VAL 51 1.772 -5.657 2.197 417 3HG2 VAL 51 3HG2 VAL 51 3.532 -5.542 1.957 418 H LEU 52 H LEU 52 1.518 -0.532 2.562 419 HA LEU 52 HA LEU 52 0.269 0.206 0.006 420 1HB LEU 52 1HB LEU 52 -1.291 1.018 1.423 421 2HB LEU 52 2HB LEU 52 -0.175 1.173 2.765 422 HG LEU 52 HG LEU 52 0.085 3.044 0.433 423 1HD1 LEU 52 1HD1 LEU 52 -2.222 2.882 2.267 424 2HD1 LEU 52 2HD1 LEU 52 -1.483 4.494 2.113 425 3HD1 LEU 52 3HD1 LEU 52 -2.068 3.642 0.664 426 1HD2 LEU 52 1HD2 LEU 52 1.755 3.658 1.798 427 2HD2 LEU 52 2HD2 LEU 52 0.471 4.483 2.715 428 3HD2 LEU 52 3HD2 LEU 52 1.028 2.869 3.219 429 H LEU 53 H LEU 53 1.730 0.993 -1.402 430 HA LEU 53 HA LEU 53 3.937 2.559 -0.269 431 1HB LEU 53 1HB LEU 53 4.768 0.358 -0.828 432 2HB LEU 53 2HB LEU 53 4.082 0.463 -2.437 433 HG LEU 53 HG LEU 53 6.086 2.521 -1.562 434 1HD1 LEU 53 1HD1 LEU 53 7.949 1.188 -2.028 435 2HD1 LEU 53 2HD1 LEU 53 6.909 0.150 -1.023 436 3HD1 LEU 53 3HD1 LEU 53 6.968 -0.089 -2.786 437 1HD2 LEU 53 1HD2 LEU 53 6.617 1.878 -4.157 438 2HD2 LEU 53 2HD2 LEU 53 4.863 1.586 -4.075 439 3HD2 LEU 53 3HD2 LEU 53 5.522 3.179 -3.631 440 H ASP 54 H ASP 54 4.632 4.351 -1.537 441 HA ASP 54 HA ASP 54 2.631 5.083 -3.516 442 1HB ASP 54 1HB ASP 54 2.581 6.987 -2.274 443 2HB ASP 54 2HB ASP 54 3.993 6.499 -1.359 444 H MET 55 H MET 55 3.325 5.320 -5.665 445 HA MET 55 HA MET 55 5.800 4.433 -6.433 446 1HB MET 55 1HB MET 55 4.040 6.426 -7.961 447 2HB MET 55 2HB MET 55 5.139 5.255 -8.664 448 1HG MET 55 1HG MET 55 2.484 4.744 -7.277 449 2HG MET 55 2HG MET 55 2.979 4.256 -8.886 450 1HE MET 55 1HE MET 55 2.797 1.911 -5.323 451 2HE MET 55 2HE MET 55 3.960 3.174 -4.854 452 3HE MET 55 3HE MET 55 2.391 3.627 -5.563 453 H LYS 56 H LYS 56 4.594 7.868 -6.634 454 HA LYS 56 HA LYS 56 6.989 9.016 -7.299 455 1HB LYS 56 1HB LYS 56 4.610 10.068 -5.755 456 2HB LYS 56 2HB LYS 56 5.971 11.084 -6.186 457 1HG LYS 56 1HG LYS 56 4.832 9.414 -8.400 458 2HG LYS 56 2HG LYS 56 3.802 10.702 -7.806 459 1HD LYS 56 1HD LYS 56 5.985 12.192 -8.022 460 2HD LYS 56 2HD LYS 56 6.543 10.914 -9.082 461 1HE LYS 56 1HE LYS 56 4.940 11.367 -10.718 462 2HE LYS 56 2HE LYS 56 3.761 11.951 -9.561 463 1HZ LYS 56 1HZ LYS 56 6.063 13.364 -10.662 464 2HZ LYS 56 2HZ LYS 56 4.502 13.841 -10.598 465 3HZ LYS 56 3HZ LYS 56 5.413 13.844 -9.243 466 H ILE 57 H ILE 57 8.920 8.682 -6.326 467 HA ILE 57 HA ILE 57 9.052 9.247 -3.475 468 HB ILE 57 HB ILE 57 9.973 6.678 -4.758 469 1HG1 ILE 57 1HG1 ILE 57 8.219 7.111 -2.327 470 2HG1 ILE 57 2HG1 ILE 57 7.584 6.908 -3.948 471 1HG2 ILE 57 1HG2 ILE 57 11.322 6.172 -2.962 472 2HG2 ILE 57 2HG2 ILE 57 11.633 7.914 -3.156 473 3HG2 ILE 57 3HG2 ILE 57 10.524 7.344 -1.886 474 1HD1 ILE 57 1HD1 ILE 57 8.063 4.664 -4.005 475 2HD1 ILE 57 2HD1 ILE 57 9.601 4.868 -3.134 476 3HD1 ILE 57 3HD1 ILE 57 8.066 4.830 -2.233 477 HA PRO 58 HA PRO 58 12.563 11.341 -4.875 478 1HB PRO 58 1HB PRO 58 13.787 11.882 -2.492 479 2HB PRO 58 2HB PRO 58 12.453 12.828 -3.120 480 1HG PRO 58 1HG PRO 58 12.444 10.836 -0.937 481 2HG PRO 58 2HG PRO 58 11.261 12.078 -1.294 482 1HD PRO 58 1HD PRO 58 11.025 9.273 -1.846 483 2HD PRO 58 2HD PRO 58 9.895 10.530 -2.307 484 H GLY 59 H GLY 59 14.331 10.724 -5.943 485 1HA GLY 59 1HA GLY 59 16.312 9.670 -6.253 486 2HA GLY 59 2HA GLY 59 16.295 9.141 -4.582 487 H MET 60 H MET 60 15.478 8.332 -7.914 488 HA MET 60 HA MET 60 14.976 6.457 -8.892 489 1HB MET 60 1HB MET 60 16.714 5.688 -6.933 490 2HB MET 60 2HB MET 60 15.311 4.789 -6.391 491 1HG MET 60 1HG MET 60 15.230 4.155 -9.047 492 2HG MET 60 2HG MET 60 16.953 4.430 -8.878 493 1HE MET 60 1HE MET 60 14.239 1.270 -7.520 494 2HE MET 60 2HE MET 60 14.405 2.259 -6.050 495 3HE MET 60 3HE MET 60 13.883 3.013 -7.576 496 H ASP 61 H ASP 61 12.736 7.109 -9.090 497 HA ASP 61 HA ASP 61 10.809 6.915 -7.252 498 1HB ASP 61 1HB ASP 61 9.461 6.008 -9.477 499 2HB ASP 61 2HB ASP 61 9.844 7.690 -9.170 500 H GLY 62 H GLY 62 8.871 5.155 -7.403 501 1HA GLY 62 1HA GLY 62 10.071 2.596 -6.758 502 2HA GLY 62 2HA GLY 62 8.401 3.084 -6.549 503 H ILE 63 H ILE 63 9.224 4.082 -9.645 504 HA ILE 63 HA ILE 63 7.545 2.372 -10.949 505 HB ILE 63 HB ILE 63 9.968 3.843 -11.990 506 1HG1 ILE 63 1HG1 ILE 63 7.125 4.757 -12.295 507 2HG1 ILE 63 2HG1 ILE 63 7.950 5.028 -10.772 508 1HG2 ILE 63 1HG2 ILE 63 9.189 2.007 -13.493 509 2HG2 ILE 63 2HG2 ILE 63 7.601 2.808 -13.571 510 3HG2 ILE 63 3HG2 ILE 63 9.048 3.638 -14.192 511 1HD1 ILE 63 1HD1 ILE 63 9.896 5.838 -12.538 512 2HD1 ILE 63 2HD1 ILE 63 8.421 6.277 -13.431 513 3HD1 ILE 63 3HD1 ILE 63 8.702 6.932 -11.800 514 H GLU 64 H GLU 64 11.038 1.986 -10.209 515 HA GLU 64 HA GLU 64 11.072 -0.494 -11.654 516 1HB GLU 64 1HB GLU 64 13.252 0.764 -9.934 517 2HB GLU 64 2HB GLU 64 13.461 -0.545 -11.079 518 1HG GLU 64 1HG GLU 64 12.360 2.163 -11.934 519 2HG GLU 64 2HG GLU 64 14.083 1.851 -11.873 520 H ILE 65 H ILE 65 11.423 0.678 -8.242 521 HA ILE 65 HA ILE 65 11.882 -1.685 -6.984 522 HB ILE 65 HB ILE 65 10.075 0.533 -6.017 523 1HG1 ILE 65 1HG1 ILE 65 13.071 0.329 -6.226 524 2HG1 ILE 65 2HG1 ILE 65 12.017 1.647 -6.699 525 1HG2 ILE 65 1HG2 ILE 65 10.031 -0.468 -4.033 526 2HG2 ILE 65 2HG2 ILE 65 10.716 -1.908 -4.825 527 3HG2 ILE 65 3HG2 ILE 65 11.793 -0.724 -4.046 528 1HD1 ILE 65 1HD1 ILE 65 11.415 1.564 -4.048 529 2HD1 ILE 65 2HD1 ILE 65 13.081 0.939 -3.994 530 3HD1 ILE 65 3HD1 ILE 65 12.753 2.537 -4.704 531 H LEU 66 H LEU 66 8.583 -0.244 -7.519 532 HA LEU 66 HA LEU 66 7.182 -2.466 -6.675 533 1HB LEU 66 1HB LEU 66 6.480 -0.310 -8.667 534 2HB LEU 66 2HB LEU 66 5.336 -1.501 -8.079 535 HG LEU 66 HG LEU 66 4.833 0.135 -6.611 536 1HD1 LEU 66 1HD1 LEU 66 5.801 -0.191 -4.476 537 2HD1 LEU 66 2HD1 LEU 66 5.908 -1.756 -5.317 538 3HD1 LEU 66 3HD1 LEU 66 7.350 -0.722 -5.173 539 1HD2 LEU 66 1HD2 LEU 66 6.109 2.038 -6.097 540 2HD2 LEU 66 2HD2 LEU 66 7.643 1.231 -6.502 541 3HD2 LEU 66 3HD2 LEU 66 6.499 1.667 -7.794 542 H LYS 67 H LYS 67 8.732 -1.726 -9.808 543 HA LYS 67 HA LYS 67 7.486 -3.748 -11.281 544 1HB LYS 67 1HB LYS 67 9.509 -1.764 -11.660 545 2HB LYS 67 2HB LYS 67 10.148 -3.294 -12.226 546 1HG LYS 67 1HG LYS 67 7.641 -3.462 -13.285 547 2HG LYS 67 2HG LYS 67 7.807 -1.718 -13.246 548 1HD LYS 67 1HD LYS 67 9.578 -1.701 -14.777 549 2HD LYS 67 2HD LYS 67 10.130 -3.302 -14.325 550 1HE LYS 67 1HE LYS 67 8.135 -4.312 -15.446 551 2HE LYS 67 2HE LYS 67 7.571 -2.713 -15.890 552 1HZ LYS 67 1HZ LYS 67 9.041 -4.114 -17.483 553 2HZ LYS 67 2HZ LYS 67 9.200 -2.490 -17.421 554 3HZ LYS 67 3HZ LYS 67 10.272 -3.446 -16.643 555 H ARG 68 H ARG 68 10.825 -3.715 -9.833 556 HA ARG 68 HA ARG 68 11.342 -6.336 -10.305 557 1HB ARG 68 1HB ARG 68 12.334 -4.259 -8.393 558 2HB ARG 68 2HB ARG 68 12.694 -5.912 -7.935 559 1HG ARG 68 1HG ARG 68 13.819 -6.335 -10.067 560 2HG ARG 68 2HG ARG 68 13.291 -4.793 -10.711 561 1HD ARG 68 1HD ARG 68 15.418 -4.166 -10.033 562 2HD ARG 68 2HD ARG 68 14.570 -3.845 -8.534 563 HE ARG 68 HE ARG 68 15.263 -6.504 -8.273 564 1HH1 ARG 68 1HH1 ARG 68 17.091 -3.602 -9.058 565 2HH1 ARG 68 2HH1 ARG 68 18.568 -4.193 -8.373 566 1HH2 ARG 68 1HH2 ARG 68 17.211 -7.284 -7.368 567 2HH2 ARG 68 2HH2 ARG 68 18.637 -6.301 -7.405 568 H MET 69 H MET 69 9.426 -4.799 -7.715 569 HA MET 69 HA MET 69 9.384 -6.842 -5.896 570 1HB MET 69 1HB MET 69 7.980 -4.377 -6.443 571 2HB MET 69 2HB MET 69 6.758 -5.589 -6.114 572 1HG MET 69 1HG MET 69 7.172 -5.312 -3.898 573 2HG MET 69 2HG MET 69 8.741 -6.053 -4.148 574 1HE MET 69 1HE MET 69 7.390 -3.674 -2.264 575 2HE MET 69 2HE MET 69 8.105 -2.067 -2.536 576 3HE MET 69 3HE MET 69 6.802 -2.652 -3.598 577 H LYS 70 H LYS 70 7.052 -6.195 -8.612 578 HA LYS 70 HA LYS 70 5.645 -8.619 -8.133 579 1HB LYS 70 1HB LYS 70 4.204 -7.907 -9.780 580 2HB LYS 70 2HB LYS 70 4.850 -6.381 -9.211 581 1HG LYS 70 1HG LYS 70 4.995 -6.233 -11.584 582 2HG LYS 70 2HG LYS 70 6.632 -6.593 -11.073 583 1HD LYS 70 1HD LYS 70 6.643 -8.550 -12.225 584 2HD LYS 70 2HD LYS 70 5.161 -9.081 -11.455 585 1HE LYS 70 1HE LYS 70 3.822 -8.350 -13.195 586 2HE LYS 70 2HE LYS 70 4.820 -6.947 -13.521 587 1HZ LYS 70 1HZ LYS 70 6.486 -8.572 -14.401 588 2HZ LYS 70 2HZ LYS 70 5.321 -9.715 -14.338 589 3HZ LYS 70 3HZ LYS 70 5.128 -8.404 -15.292 590 H VAL 71 H VAL 71 8.215 -7.517 -10.404 591 HA VAL 71 HA VAL 71 8.248 -9.809 -11.984 592 HB VAL 71 HB VAL 71 10.563 -8.003 -11.267 593 1HG1 VAL 71 1HG1 VAL 71 11.694 -9.317 -12.676 594 2HG1 VAL 71 2HG1 VAL 71 10.221 -10.207 -13.129 595 3HG1 VAL 71 3HG1 VAL 71 10.649 -8.703 -13.980 596 1HG2 VAL 71 1HG2 VAL 71 8.111 -7.197 -12.315 597 2HG2 VAL 71 2HG2 VAL 71 9.650 -6.307 -12.407 598 3HG2 VAL 71 3HG2 VAL 71 9.156 -7.371 -13.746 599 H ILE 72 H ILE 72 9.538 -9.101 -8.750 600 HA ILE 72 HA ILE 72 11.273 -11.358 -8.704 601 HB ILE 72 HB ILE 72 10.321 -9.300 -6.767 602 1HG1 ILE 72 1HG1 ILE 72 12.282 -8.991 -8.327 603 2HG1 ILE 72 2HG1 ILE 72 12.606 -8.720 -6.626 604 1HG2 ILE 72 1HG2 ILE 72 10.118 -11.056 -5.278 605 2HG2 ILE 72 2HG2 ILE 72 11.418 -12.000 -6.044 606 3HG2 ILE 72 3HG2 ILE 72 11.817 -10.572 -5.059 607 1HD1 ILE 72 1HD1 ILE 72 14.173 -10.293 -8.183 608 2HD1 ILE 72 2HD1 ILE 72 13.968 -10.575 -6.438 609 3HD1 ILE 72 3HD1 ILE 72 13.018 -11.520 -7.610 610 H ASP 73 H ASP 73 8.018 -10.596 -7.295 611 HA ASP 73 HA ASP 73 7.499 -13.442 -7.408 612 1HB ASP 73 1HB ASP 73 7.774 -11.815 -4.978 613 2HB ASP 73 2HB ASP 73 6.174 -12.521 -5.078 614 H GLU 74 H GLU 74 5.054 -13.857 -7.246 615 HA GLU 74 HA GLU 74 3.622 -11.488 -8.168 616 1HB GLU 74 1HB GLU 74 2.394 -12.816 -9.672 617 2HB GLU 74 2HB GLU 74 3.997 -13.517 -9.762 618 1HG GLU 74 1HG GLU 74 3.296 -15.234 -8.037 619 2HG GLU 74 2HG GLU 74 1.675 -14.567 -8.077 620 H ASN 75 H ASN 75 4.057 -13.575 -5.561 621 HA ASN 75 HA ASN 75 1.309 -13.809 -4.845 622 1HB ASN 75 1HB ASN 75 3.488 -15.292 -4.209 623 2HB ASN 75 2HB ASN 75 3.545 -14.193 -2.845 624 1HD2 ASN 75 1HD2 ASN 75 3.192 -16.735 -2.267 625 2HD2 ASN 75 2HD2 ASN 75 1.572 -17.102 -1.778 626 H ILE 76 H ILE 76 3.750 -11.395 -4.727 627 HA ILE 76 HA ILE 76 3.202 -10.257 -2.201 628 HB ILE 76 HB ILE 76 5.287 -9.851 -3.254 629 1HG1 ILE 76 1HG1 ILE 76 3.586 -7.344 -3.195 630 2HG1 ILE 76 2HG1 ILE 76 4.472 -8.045 -1.856 631 1HG2 ILE 76 1HG2 ILE 76 5.252 -9.958 -5.500 632 2HG2 ILE 76 2HG2 ILE 76 3.624 -9.248 -5.619 633 3HG2 ILE 76 3HG2 ILE 76 5.039 -8.194 -5.387 634 1HD1 ILE 76 1HD1 ILE 76 6.555 -7.818 -3.506 635 2HD1 ILE 76 2HD1 ILE 76 5.526 -6.588 -4.277 636 3HD1 ILE 76 3HD1 ILE 76 5.986 -6.417 -2.566 637 H ARG 77 H ARG 77 1.659 -8.810 -1.541 638 HA ARG 77 HA ARG 77 -0.134 -7.907 -3.650 639 1HB ARG 77 1HB ARG 77 -1.592 -9.288 -2.484 640 2HB ARG 77 2HB ARG 77 -0.669 -9.189 -0.998 641 1HG ARG 77 1HG ARG 77 -1.697 -7.187 -0.320 642 2HG ARG 77 2HG ARG 77 -2.077 -6.698 -1.959 643 1HD ARG 77 1HD ARG 77 -4.174 -7.345 -0.978 644 2HD ARG 77 2HD ARG 77 -3.737 -8.658 -2.053 645 HE ARG 77 HE ARG 77 -3.613 -8.711 0.921 646 1HH1 ARG 77 1HH1 ARG 77 -3.145 -10.383 -2.139 647 2HH1 ARG 77 2HH1 ARG 77 -3.079 -11.956 -1.416 648 1HH2 ARG 77 1HH2 ARG 77 -3.526 -10.785 1.876 649 2HH2 ARG 77 2HH2 ARG 77 -3.297 -12.186 0.883 650 H VAL 78 H VAL 78 0.254 -5.724 -3.927 651 HA VAL 78 HA VAL 78 0.191 -4.061 -1.542 652 HB VAL 78 HB VAL 78 2.427 -4.069 -3.575 653 1HG1 VAL 78 1HG1 VAL 78 3.325 -2.183 -2.081 654 2HG1 VAL 78 2HG1 VAL 78 2.003 -1.780 -3.203 655 3HG1 VAL 78 3HG1 VAL 78 1.658 -2.033 -1.476 656 1HG2 VAL 78 1HG2 VAL 78 3.601 -4.108 -1.116 657 2HG2 VAL 78 2HG2 VAL 78 2.127 -5.054 -0.802 658 3HG2 VAL 78 3HG2 VAL 78 3.250 -5.557 -2.088 659 H ILE 79 H ILE 79 -0.316 -1.787 -2.062 660 HA ILE 79 HA ILE 79 -1.577 -1.580 -4.708 661 HB ILE 79 HB ILE 79 -2.600 -1.067 -1.989 662 1HG1 ILE 79 1HG1 ILE 79 -3.644 -2.008 -4.642 663 2HG1 ILE 79 2HG1 ILE 79 -3.664 -2.816 -3.087 664 1HG2 ILE 79 1HG2 ILE 79 -3.275 0.809 -4.273 665 2HG2 ILE 79 2HG2 ILE 79 -4.082 0.745 -2.687 666 3HG2 ILE 79 3HG2 ILE 79 -2.373 1.232 -2.798 667 1HD1 ILE 79 1HD1 ILE 79 -5.926 -2.010 -3.692 668 2HD1 ILE 79 2HD1 ILE 79 -5.332 -1.175 -2.237 669 3HD1 ILE 79 3HD1 ILE 79 -5.307 -0.345 -3.811 670 H ILE 80 H ILE 80 -1.290 0.353 -5.858 671 HA ILE 80 HA ILE 80 0.866 2.010 -4.785 672 HB ILE 80 HB ILE 80 1.347 2.615 -7.023 673 1HG1 ILE 80 1HG1 ILE 80 -0.038 1.650 -8.929 674 2HG1 ILE 80 2HG1 ILE 80 -1.273 1.284 -7.742 675 1HG2 ILE 80 1HG2 ILE 80 0.765 -0.279 -7.445 676 2HG2 ILE 80 2HG2 ILE 80 2.260 0.648 -7.717 677 3HG2 ILE 80 3HG2 ILE 80 1.794 0.176 -6.066 678 1HD1 ILE 80 1HD1 ILE 80 -1.031 3.693 -9.081 679 2HD1 ILE 80 2HD1 ILE 80 -1.911 3.468 -7.550 680 3HD1 ILE 80 3HD1 ILE 80 -0.229 4.051 -7.533 681 H MET 81 H MET 81 0.726 4.363 -4.986 682 HA MET 81 HA MET 81 -1.988 5.323 -5.336 683 1HB MET 81 1HB MET 81 -0.777 6.786 -3.159 684 2HB MET 81 2HB MET 81 -2.211 5.781 -3.099 685 1HG MET 81 1HG MET 81 -0.857 3.772 -2.661 686 2HG MET 81 2HG MET 81 0.629 4.669 -2.903 687 1HE MET 81 1HE MET 81 1.493 5.243 0.615 688 2HE MET 81 2HE MET 81 1.545 3.890 -0.541 689 3HE MET 81 3HE MET 81 1.943 5.539 -1.081 690 H THR 82 H THR 82 -2.028 7.134 -6.611 691 HA THR 82 HA THR 82 -0.183 9.226 -6.408 692 HB THR 82 HB THR 82 1.549 7.974 -7.410 693 HG1 THR 82 HG1 THR 82 1.388 8.674 -9.721 694 1HG2 THR 82 1HG2 THR 82 0.716 6.680 -9.683 695 2HG2 THR 82 2HG2 THR 82 0.850 5.872 -8.102 696 3HG2 THR 82 3HG2 THR 82 -0.728 6.477 -8.661 697 H ALA 83 H ALA 83 -0.835 11.033 -7.579 698 HA ALA 83 HA ALA 83 -3.510 11.125 -8.270 699 1HB ALA 83 1HB ALA 83 -3.048 13.329 -8.340 700 2HB ALA 83 2HB ALA 83 -1.363 12.898 -7.963 701 3HB ALA 83 3HB ALA 83 -1.870 13.109 -9.656 702 H TYR 84 H TYR 84 -4.515 11.524 -10.410 703 HA TYR 84 HA TYR 84 -3.568 9.594 -12.297 704 1HB TYR 84 1HB TYR 84 -5.638 10.747 -13.523 705 2HB TYR 84 2HB TYR 84 -5.951 9.824 -12.067 706 HD1 TYR 84 HD1 TYR 84 -4.660 13.311 -12.610 707 HD2 TYR 84 HD2 TYR 84 -7.681 10.821 -10.885 708 HE1 TYR 84 HE1 TYR 84 -5.742 15.350 -11.545 709 HE2 TYR 84 HE2 TYR 84 -8.753 12.869 -9.826 710 HH TYR 84 HH TYR 84 -8.836 15.307 -10.306 711 H GLY 85 H GLY 85 -1.465 11.315 -12.111 712 1HA GLY 85 1HA GLY 85 -1.739 13.102 -14.451 713 2HA GLY 85 2HA GLY 85 -0.622 13.332 -13.120 714 H GLU 86 H GLU 86 -0.296 10.180 -13.169 715 HA GLU 86 HA GLU 86 1.395 10.107 -15.538 716 1HB GLU 86 1HB GLU 86 2.968 8.668 -13.974 717 2HB GLU 86 2HB GLU 86 3.068 10.417 -13.949 718 1HG GLU 86 1HG GLU 86 1.819 10.583 -11.913 719 2HG GLU 86 2HG GLU 86 1.193 8.952 -12.058 720 H LEU 87 H LEU 87 -1.121 9.090 -15.690 721 HA LEU 87 HA LEU 87 -1.699 6.633 -14.708 722 1HB LEU 87 1HB LEU 87 -2.225 7.640 -17.508 723 2HB LEU 87 2HB LEU 87 -3.059 6.315 -16.722 724 HG LEU 87 HG LEU 87 -3.094 8.924 -15.293 725 1HD1 LEU 87 1HD1 LEU 87 -3.856 10.142 -16.983 726 2HD1 LEU 87 2HD1 LEU 87 -3.863 8.731 -18.068 727 3HD1 LEU 87 3HD1 LEU 87 -5.281 9.077 -17.048 728 1HD2 LEU 87 1HD2 LEU 87 -4.359 7.403 -14.156 729 2HD2 LEU 87 2HD2 LEU 87 -5.608 8.089 -15.224 730 3HD2 LEU 87 3HD2 LEU 87 -4.847 6.531 -15.630 731 H ASP 88 H ASP 88 0.564 7.480 -17.360 732 HA ASP 88 HA ASP 88 0.977 5.118 -18.511 733 1HB ASP 88 1HB ASP 88 3.478 5.857 -18.595 734 2HB ASP 88 2HB ASP 88 2.279 6.911 -19.319 735 H MET 89 H MET 89 2.267 6.297 -15.343 736 HA MET 89 HA MET 89 3.797 3.947 -14.921 737 1HB MET 89 1HB MET 89 4.122 6.387 -13.982 738 2HB MET 89 2HB MET 89 2.896 5.961 -12.804 739 1HG MET 89 1HG MET 89 5.420 4.298 -13.244 740 2HG MET 89 2HG MET 89 5.321 5.584 -12.056 741 1HE MET 89 1HE MET 89 5.139 3.410 -9.414 742 2HE MET 89 2HE MET 89 5.587 2.200 -10.640 743 3HE MET 89 3HE MET 89 6.221 3.859 -10.754 744 H ILE 90 H ILE 90 0.673 5.283 -13.676 745 HA ILE 90 HA ILE 90 0.155 3.317 -11.804 746 HB ILE 90 HB ILE 90 -1.634 5.064 -13.483 747 1HG1 ILE 90 1HG1 ILE 90 -1.665 5.551 -10.644 748 2HG1 ILE 90 2HG1 ILE 90 -0.006 5.525 -11.206 749 1HG2 ILE 90 1HG2 ILE 90 -2.346 2.831 -11.682 750 2HG2 ILE 90 2HG2 ILE 90 -3.209 4.360 -11.392 751 3HG2 ILE 90 3HG2 ILE 90 -3.269 3.595 -12.998 752 1HD1 ILE 90 1HD1 ILE 90 -0.644 7.121 -13.056 753 2HD1 ILE 90 2HD1 ILE 90 -2.277 7.212 -12.352 754 3HD1 ILE 90 3HD1 ILE 90 -0.874 7.798 -11.426 755 H GLN 91 H GLN 91 -0.594 3.437 -15.339 756 HA GLN 91 HA GLN 91 -2.063 1.149 -15.472 757 1HB GLN 91 1HB GLN 91 -0.370 2.721 -17.367 758 2HB GLN 91 2HB GLN 91 -0.742 1.083 -17.867 759 1HG GLN 91 1HG GLN 91 -3.146 2.308 -16.788 760 2HG GLN 91 2HG GLN 91 -2.446 3.385 -17.980 761 1HE2 GLN 91 1HE2 GLN 91 -4.509 0.882 -17.523 762 2HE2 GLN 91 2HE2 GLN 91 -4.549 0.176 -19.105 763 H GLU 92 H GLU 92 1.532 1.526 -15.858 764 HA GLU 92 HA GLU 92 2.069 -1.124 -16.292 765 1HB GLU 92 1HB GLU 92 3.537 1.221 -16.057 766 2HB GLU 92 2HB GLU 92 4.100 0.303 -14.674 767 1HG GLU 92 1HG GLU 92 5.289 -1.115 -15.994 768 2HG GLU 92 2HG GLU 92 3.900 -1.437 -17.012 769 H SER 93 H SER 93 1.529 0.685 -13.248 770 HA SER 93 HA SER 93 2.506 -1.209 -11.509 771 1HB SER 93 1HB SER 93 1.530 0.083 -9.835 772 2HB SER 93 2HB SER 93 1.593 1.244 -11.145 773 HG SER 93 HG SER 93 -0.551 1.302 -11.232 774 H LYS 94 H LYS 94 -0.799 -0.758 -12.924 775 HA LYS 94 HA LYS 94 -1.983 -2.873 -11.516 776 1HB LYS 94 1HB LYS 94 -2.797 -0.858 -13.270 777 2HB LYS 94 2HB LYS 94 -3.155 -2.339 -14.134 778 1HG LYS 94 1HG LYS 94 -3.979 -2.917 -11.514 779 2HG LYS 94 2HG LYS 94 -4.424 -1.233 -11.708 780 1HD LYS 94 1HD LYS 94 -5.409 -2.021 -14.034 781 2HD LYS 94 2HD LYS 94 -5.341 -3.625 -13.332 782 1HE LYS 94 1HE LYS 94 -6.493 -2.014 -11.306 783 2HE LYS 94 2HE LYS 94 -7.229 -1.443 -12.790 784 1HZ LYS 94 1HZ LYS 94 -8.494 -3.225 -12.697 785 2HZ LYS 94 2HZ LYS 94 -7.193 -4.173 -12.971 786 3HZ LYS 94 3HZ LYS 94 -7.666 -3.859 -11.440 787 H GLU 95 H GLU 95 -0.509 -2.665 -14.820 788 HA GLU 95 HA GLU 95 -0.978 -5.377 -15.348 789 1HB GLU 95 1HB GLU 95 -0.027 -4.939 -17.409 790 2HB GLU 95 2HB GLU 95 -0.401 -3.298 -16.922 791 1HG GLU 95 1HG GLU 95 1.818 -2.940 -17.413 792 2HG GLU 95 2HG GLU 95 2.056 -3.518 -15.775 793 H LEU 96 H LEU 96 1.172 -3.817 -13.215 794 HA LEU 96 HA LEU 96 3.403 -5.563 -13.555 795 1HB LEU 96 1HB LEU 96 2.721 -3.197 -12.065 796 2HB LEU 96 2HB LEU 96 3.435 -4.384 -10.993 797 HG LEU 96 HG LEU 96 5.407 -4.547 -12.459 798 1HD1 LEU 96 1HD1 LEU 96 5.674 -3.483 -14.457 799 2HD1 LEU 96 2HD1 LEU 96 3.913 -3.739 -14.497 800 3HD1 LEU 96 3HD1 LEU 96 4.572 -2.152 -14.031 801 1HD2 LEU 96 1HD2 LEU 96 6.325 -2.283 -12.009 802 2HD2 LEU 96 2HD2 LEU 96 4.690 -1.745 -11.557 803 3HD2 LEU 96 3HD2 LEU 96 5.504 -3.011 -10.607 804 H GLY 97 H GLY 97 0.266 -5.787 -12.093 805 1HA GLY 97 1HA GLY 97 -0.517 -7.918 -11.422 806 2HA GLY 97 2HA GLY 97 1.083 -8.321 -10.830 807 H ALA 98 H ALA 98 -0.266 -5.085 -10.257 808 HA ALA 98 HA ALA 98 -0.167 -5.609 -7.413 809 1HB ALA 98 1HB ALA 98 0.861 -3.576 -8.273 810 2HB ALA 98 2HB ALA 98 -0.659 -3.101 -9.067 811 3HB ALA 98 3HB ALA 98 -0.557 -3.138 -7.291 812 H LEU 99 H LEU 99 -2.027 -4.705 -6.033 813 HA LEU 99 HA LEU 99 -4.368 -6.064 -6.736 814 1HB LEU 99 1HB LEU 99 -3.746 -4.006 -4.622 815 2HB LEU 99 2HB LEU 99 -5.306 -4.793 -4.760 816 HG LEU 99 HG LEU 99 -3.827 -5.794 -3.042 817 1HD1 LEU 99 1HD1 LEU 99 -3.996 -8.095 -4.801 818 2HD1 LEU 99 2HD1 LEU 99 -4.919 -7.708 -3.329 819 3HD1 LEU 99 3HD1 LEU 99 -5.455 -7.082 -4.907 820 1HD2 LEU 99 1HD2 LEU 99 -1.930 -7.217 -3.778 821 2HD2 LEU 99 2HD2 LEU 99 -2.097 -6.539 -5.415 822 3HD2 LEU 99 3HD2 LEU 99 -1.664 -5.479 -4.053 823 H THR 100 H THR 100 -3.475 -2.559 -6.813 824 HA THR 100 HA THR 100 -5.023 -2.057 -9.088 825 HB THR 100 HB THR 100 -6.902 -2.486 -7.447 826 HG1 THR 100 HG1 THR 100 -7.251 -0.971 -9.160 827 1HG2 THR 100 1HG2 THR 100 -6.803 0.084 -6.136 828 2HG2 THR 100 2HG2 THR 100 -6.863 -1.524 -5.377 829 3HG2 THR 100 3HG2 THR 100 -5.292 -0.777 -5.757 830 H HIS 101 H HIS 101 -5.707 0.687 -8.485 831 HA HIS 101 HA HIS 101 -3.183 1.809 -7.609 832 1HB HIS 101 1HB HIS 101 -3.237 3.299 -9.709 833 2HB HIS 101 2HB HIS 101 -2.589 1.676 -9.840 834 HD1 HIS 101 HD1 HIS 101 -3.337 0.557 -11.931 835 HD2 HIS 101 HD2 HIS 101 -6.276 3.127 -10.398 836 HE1 HIS 101 HE1 HIS 101 -5.315 0.420 -13.537 837 H PHE 102 H PHE 102 -3.560 3.557 -6.328 838 HA PHE 102 HA PHE 102 -6.266 4.674 -6.449 839 1HB PHE 102 1HB PHE 102 -5.883 3.925 -4.232 840 2HB PHE 102 2HB PHE 102 -4.146 4.115 -4.369 841 HD1 PHE 102 HD1 PHE 102 -7.059 5.425 -2.925 842 HD2 PHE 102 HD2 PHE 102 -3.319 6.621 -4.532 843 HE1 PHE 102 HE1 PHE 102 -7.193 7.574 -1.636 844 HE2 PHE 102 HE2 PHE 102 -3.453 8.771 -3.243 845 HZ PHE 102 HZ PHE 102 -5.388 9.222 -1.811 846 H ALA 103 H ALA 103 -6.457 7.052 -5.947 847 HA ALA 103 HA ALA 103 -4.106 8.496 -6.964 848 1HB ALA 103 1HB ALA 103 -6.875 9.549 -7.413 849 2HB ALA 103 2HB ALA 103 -5.421 9.692 -8.429 850 3HB ALA 103 3HB ALA 103 -6.344 8.170 -8.405 851 H LYS 104 H LYS 104 -3.619 10.486 -5.949 852 HA LYS 104 HA LYS 104 -4.031 10.681 -3.280 853 1HB LYS 104 1HB LYS 104 -3.078 12.439 -5.426 854 2HB LYS 104 2HB LYS 104 -3.764 13.323 -4.077 855 1HG LYS 104 1HG LYS 104 -2.115 12.647 -2.606 856 2HG LYS 104 2HG LYS 104 -1.982 11.050 -3.315 857 1HD LYS 104 1HD LYS 104 0.072 12.092 -3.892 858 2HD LYS 104 2HD LYS 104 -0.880 12.215 -5.357 859 1HE LYS 104 1HE LYS 104 -1.314 14.497 -3.523 860 2HE LYS 104 2HE LYS 104 0.358 14.344 -4.028 861 1HZ LYS 104 1HZ LYS 104 -1.169 15.642 -5.509 862 2HZ LYS 104 2HZ LYS 104 -0.255 14.509 -6.248 863 3HZ LYS 104 3HZ LYS 104 -1.837 14.222 -5.961 864 HA PRO 105 HA PRO 105 -7.859 13.335 -4.060 865 1HB PRO 105 1HB PRO 105 -8.880 13.585 -6.582 866 2HB PRO 105 2HB PRO 105 -7.798 14.763 -5.865 867 1HG PRO 105 1HG PRO 105 -7.218 12.732 -7.933 868 2HG PRO 105 2HG PRO 105 -6.302 14.166 -7.516 869 1HD PRO 105 1HD PRO 105 -5.673 11.460 -6.802 870 2HD PRO 105 2HD PRO 105 -4.823 12.904 -6.289 871 H PHE 106 H PHE 106 -8.158 11.163 -2.963 872 HA PHE 106 HA PHE 106 -10.408 9.913 -4.366 873 1HB PHE 106 1HB PHE 106 -7.828 8.842 -3.256 874 2HB PHE 106 2HB PHE 106 -9.241 7.919 -2.786 875 HD1 PHE 106 HD1 PHE 106 -8.361 9.627 -5.990 876 HD2 PHE 106 HD2 PHE 106 -9.274 5.976 -4.029 877 HE1 PHE 106 HE1 PHE 106 -8.314 8.431 -8.196 878 HE2 PHE 106 HE2 PHE 106 -9.226 4.780 -6.235 879 HZ PHE 106 HZ PHE 106 -8.747 6.022 -8.292 880 H ASP 107 H ASP 107 -11.861 8.658 -2.839 881 HA ASP 107 HA ASP 107 -12.133 10.238 -0.443 882 1HB ASP 107 1HB ASP 107 -14.045 9.697 -2.099 883 2HB ASP 107 2HB ASP 107 -13.989 8.056 -1.487 884 H ILE 108 H ILE 108 -12.188 9.244 1.687 885 HA ILE 108 HA ILE 108 -10.650 6.849 1.886 886 HB ILE 108 HB ILE 108 -11.346 9.075 3.523 887 1HG1 ILE 108 1HG1 ILE 108 -9.079 8.369 3.113 888 2HG1 ILE 108 2HG1 ILE 108 -9.405 8.292 4.833 889 1HG2 ILE 108 1HG2 ILE 108 -12.020 6.377 4.707 890 2HG2 ILE 108 2HG2 ILE 108 -11.587 7.792 5.696 891 3HG2 ILE 108 3HG2 ILE 108 -13.024 7.846 4.647 892 1HD1 ILE 108 1HD1 ILE 108 -10.150 5.747 4.005 893 2HD1 ILE 108 2HD1 ILE 108 -8.771 6.111 2.940 894 3HD1 ILE 108 3HD1 ILE 108 -8.571 6.174 4.707 895 H ASP 109 H ASP 109 -14.073 7.740 1.902 896 HA ASP 109 HA ASP 109 -14.956 5.419 3.193 897 1HB ASP 109 1HB ASP 109 -16.204 7.656 2.742 898 2HB ASP 109 2HB ASP 109 -16.511 7.035 1.132 899 H GLU 110 H GLU 110 -14.570 6.474 -0.255 900 HA GLU 110 HA GLU 110 -15.678 4.181 -1.370 901 1HB GLU 110 1HB GLU 110 -15.148 5.154 -3.395 902 2HB GLU 110 2HB GLU 110 -14.986 6.567 -2.372 903 1HG GLU 110 1HG GLU 110 -12.486 5.848 -2.098 904 2HG GLU 110 2HG GLU 110 -12.774 4.785 -3.461 905 H ILE 111 H ILE 111 -12.399 5.004 -0.217 906 HA ILE 111 HA ILE 111 -11.051 2.888 -1.459 907 HB ILE 111 HB ILE 111 -10.545 4.773 0.784 908 1HG1 ILE 111 1HG1 ILE 111 -8.960 4.014 -1.688 909 2HG1 ILE 111 2HG1 ILE 111 -10.087 5.352 -1.583 910 1HG2 ILE 111 1HG2 ILE 111 -9.525 3.153 1.978 911 2HG2 ILE 111 2HG2 ILE 111 -9.336 2.076 0.574 912 3HG2 ILE 111 3HG2 ILE 111 -8.207 3.430 0.815 913 1HD1 ILE 111 1HD1 ILE 111 -8.157 5.392 0.636 914 2HD1 ILE 111 2HD1 ILE 111 -7.358 5.441 -0.954 915 3HD1 ILE 111 3HD1 ILE 111 -8.570 6.674 -0.528 916 H ARG 112 H ARG 112 -13.140 3.102 1.396 917 HA ARG 112 HA ARG 112 -12.275 0.825 2.673 918 1HB ARG 112 1HB ARG 112 -15.100 1.995 2.534 919 2HB ARG 112 2HB ARG 112 -14.559 0.839 3.735 920 1HG ARG 112 1HG ARG 112 -12.607 2.722 4.035 921 2HG ARG 112 2HG ARG 112 -13.907 3.755 3.473 922 1HD ARG 112 1HD ARG 112 -15.034 1.960 5.424 923 2HD ARG 112 2HD ARG 112 -13.545 2.590 6.100 924 HE ARG 112 HE ARG 112 -14.725 4.859 5.078 925 1HH1 ARG 112 1HH1 ARG 112 -15.894 2.302 7.195 926 2HH1 ARG 112 2HH1 ARG 112 -17.008 3.330 8.033 927 1HH2 ARG 112 1HH2 ARG 112 -16.195 6.215 6.183 928 2HH2 ARG 112 2HH2 ARG 112 -17.181 5.571 7.453 929 H ASP 113 H ASP 113 -14.079 1.281 -0.295 930 HA ASP 113 HA ASP 113 -15.330 -1.270 -0.208 931 1HB ASP 113 1HB ASP 113 -15.546 1.121 -1.745 932 2HB ASP 113 2HB ASP 113 -15.074 -0.124 -2.885 933 H ALA 114 H ALA 114 -12.617 0.354 -2.004 934 HA ALA 114 HA ALA 114 -11.878 -1.883 -3.518 935 1HB ALA 114 1HB ALA 114 -11.105 0.829 -3.180 936 2HB ALA 114 2HB ALA 114 -9.642 -0.149 -2.916 937 3HB ALA 114 3HB ALA 114 -10.559 -0.312 -4.433 938 H VAL 115 H VAL 115 -11.303 -0.918 -0.162 939 HA VAL 115 HA VAL 115 -9.020 -2.485 0.286 940 HB VAL 115 HB VAL 115 -11.177 -1.291 2.004 941 1HG1 VAL 115 1HG1 VAL 115 -8.872 -3.036 2.925 942 2HG1 VAL 115 2HG1 VAL 115 -9.794 -1.951 3.993 943 3HG1 VAL 115 3HG1 VAL 115 -10.612 -3.309 3.183 944 1HG2 VAL 115 1HG2 VAL 115 -9.789 0.456 2.180 945 2HG2 VAL 115 2HG2 VAL 115 -8.395 -0.589 2.546 946 3HG2 VAL 115 3HG2 VAL 115 -8.854 -0.277 0.854 947 H LYS 116 H LYS 116 -12.490 -3.200 0.074 948 HA LYS 116 HA LYS 116 -12.484 -5.626 1.440 949 1HB LYS 116 1HB LYS 116 -14.502 -4.350 0.815 950 2HB LYS 116 2HB LYS 116 -14.222 -4.720 -0.875 951 1HG LYS 116 1HG LYS 116 -14.195 -7.112 0.887 952 2HG LYS 116 2HG LYS 116 -15.730 -6.267 0.874 953 1HD LYS 116 1HD LYS 116 -14.357 -6.800 -1.766 954 2HD LYS 116 2HD LYS 116 -15.165 -8.131 -0.961 955 1HE LYS 116 1HE LYS 116 -17.176 -6.395 -0.736 956 2HE LYS 116 2HE LYS 116 -16.362 -5.573 -2.051 957 1HZ LYS 116 1HZ LYS 116 -17.571 -8.214 -2.033 958 2HZ LYS 116 2HZ LYS 116 -17.690 -7.029 -3.151 959 3HZ LYS 116 3HZ LYS 116 -16.332 -7.932 -3.060 960 H LYS 117 H LYS 117 -11.971 -4.870 -2.069 961 HA LYS 117 HA LYS 117 -11.456 -7.596 -2.693 962 1HB LYS 117 1HB LYS 117 -10.877 -6.718 -4.908 963 2HB LYS 117 2HB LYS 117 -12.410 -6.090 -4.340 964 1HG LYS 117 1HG LYS 117 -11.385 -3.960 -3.704 965 2HG LYS 117 2HG LYS 117 -9.776 -4.584 -4.008 966 1HD LYS 117 1HD LYS 117 -11.183 -5.042 -6.423 967 2HD LYS 117 2HD LYS 117 -11.713 -3.456 -5.900 968 1HE LYS 117 1HE LYS 117 -9.777 -2.925 -7.123 969 2HE LYS 117 2HE LYS 117 -9.152 -2.986 -5.487 970 1HZ LYS 117 1HZ LYS 117 -8.797 -4.888 -7.642 971 2HZ LYS 117 2HZ LYS 117 -7.714 -4.344 -6.548 972 3HZ LYS 117 3HZ LYS 117 -8.813 -5.472 -6.117 973 H TYR 118 H TYR 118 -9.589 -4.864 -1.479 974 HA TYR 118 HA TYR 118 -7.052 -5.821 -2.293 975 1HB TYR 118 1HB TYR 118 -7.966 -3.475 -1.442 976 2HB TYR 118 2HB TYR 118 -7.804 -4.145 0.169 977 HD1 TYR 118 HD1 TYR 118 -6.350 -1.840 0.011 978 HD2 TYR 118 HD2 TYR 118 -5.239 -5.627 -1.639 979 HE1 TYR 118 HE1 TYR 118 -3.903 -1.149 0.054 980 HE2 TYR 118 HE2 TYR 118 -2.796 -4.924 -1.591 981 HH TYR 118 HH TYR 118 -1.537 -2.909 0.125 982 H LEU 119 H LEU 119 -9.048 -6.164 0.697 983 HA LEU 119 HA LEU 119 -7.528 -8.529 1.352 984 1HB LEU 119 1HB LEU 119 -6.670 -6.152 2.423 985 2HB LEU 119 2HB LEU 119 -7.760 -6.738 3.664 986 HG LEU 119 HG LEU 119 -5.196 -7.342 3.679 987 1HD1 LEU 119 1HD1 LEU 119 -6.158 -9.767 4.538 988 2HD1 LEU 119 2HD1 LEU 119 -6.115 -8.267 5.495 989 3HD1 LEU 119 3HD1 LEU 119 -7.600 -8.728 4.629 990 1HD2 LEU 119 1HD2 LEU 119 -4.514 -9.248 2.532 991 2HD2 LEU 119 2HD2 LEU 119 -6.182 -9.752 2.170 992 3HD2 LEU 119 3HD2 LEU 119 -5.470 -8.359 1.322 993 HA PRO 120 HA PRO 120 -11.523 -9.600 2.609 994 1HB PRO 120 1HB PRO 120 -10.998 -11.965 3.875 995 2HB PRO 120 2HB PRO 120 -11.144 -11.821 2.134 996 1HG PRO 120 1HG PRO 120 -8.703 -12.145 3.769 997 2HG PRO 120 2HG PRO 120 -8.919 -12.423 2.052 998 1HD PRO 120 1HD PRO 120 -7.644 -10.165 3.278 999 2HD PRO 120 2HD PRO 120 -7.964 -10.388 1.570 1000 H LEU 121 H LEU 121 -10.873 -7.517 4.034 1001 HA LEU 121 HA LEU 121 -10.571 -8.137 6.779 1002 1HB LEU 121 1HB LEU 121 -10.586 -5.837 5.087 1003 2HB LEU 121 2HB LEU 121 -11.708 -5.556 6.404 1004 HG LEU 121 HG LEU 121 -9.279 -4.802 6.702 1005 1HD1 LEU 121 1HD1 LEU 121 -9.676 -4.728 8.906 1006 2HD1 LEU 121 2HD1 LEU 121 -11.221 -5.509 8.491 1007 3HD1 LEU 121 3HD1 LEU 121 -9.845 -6.495 9.041 1008 1HD2 LEU 121 1HD2 LEU 121 -8.616 -7.307 5.940 1009 2HD2 LEU 121 2HD2 LEU 121 -7.573 -6.259 6.931 1010 3HD2 LEU 121 3HD2 LEU 121 -8.585 -7.498 7.710 1011 H LYS 122 H LYS 122 -12.282 -7.228 8.420 1012 HA LYS 122 HA LYS 122 -14.412 -8.847 8.499 1013 1HB LYS 122 1HB LYS 122 -13.454 -6.969 10.128 1014 2HB LYS 122 2HB LYS 122 -14.805 -6.052 9.493 1015 1HG LYS 122 1HG LYS 122 -16.118 -8.366 9.989 1016 2HG LYS 122 2HG LYS 122 -14.824 -8.563 11.154 1017 1HD LYS 122 1HD LYS 122 -16.552 -7.430 12.351 1018 2HD LYS 122 2HD LYS 122 -15.372 -6.186 11.988 1019 1HE LYS 122 1HE LYS 122 -16.737 -5.572 9.932 1020 2HE LYS 122 2HE LYS 122 -17.952 -6.728 10.442 1021 1HZ LYS 122 1HZ LYS 122 -18.190 -4.323 11.159 1022 2HZ LYS 122 2HZ LYS 122 -18.449 -5.473 12.289 1023 3HZ LYS 122 3HZ LYS 122 -17.042 -4.645 12.276 1024 H SER 123 H SER 123 -16.534 -8.943 7.745 1025 HA SER 123 HA SER 123 -16.958 -7.710 5.275 1026 1HB SER 123 1HB SER 123 -18.116 -9.807 6.806 1027 2HB SER 123 2HB SER 123 -19.420 -8.675 6.509 1028 HG SER 123 HG SER 123 -18.563 -8.735 4.169 1029 H ASN 124 H ASN 124 -17.405 -5.551 5.020 1030 HA ASN 124 HA ASN 124 -18.508 -4.083 7.174 1031 1HB ASN 124 1HB ASN 124 -16.843 -3.327 5.253 1032 2HB ASN 124 2HB ASN 124 -18.297 -3.076 4.307 1033 1HD2 ASN 124 1HD2 ASN 124 -18.494 -0.954 4.192 1034 2HD2 ASN 124 2HD2 ASN 124 -18.580 0.148 5.525 Start of MODEL 10 1 1H MET 1 1H MET 1 0.357 -12.330 16.392 2 HA MET 1 HA MET 1 -0.485 -13.558 18.881 3 1HB MET 1 1HB MET 1 0.889 -10.873 18.478 4 2HB MET 1 2HB MET 1 -0.267 -11.041 19.784 5 1HG MET 1 1HG MET 1 1.024 -12.966 20.704 6 2HG MET 1 2HG MET 1 2.163 -12.854 19.377 7 1HE MET 1 1HE MET 1 4.744 -11.485 21.153 8 2HE MET 1 2HE MET 1 3.789 -12.177 22.486 9 3HE MET 1 3HE MET 1 3.804 -12.974 20.895 10 H MET 2 H MET 2 -0.853 -10.803 16.557 11 HA MET 2 HA MET 2 -3.689 -10.805 17.234 12 1HB MET 2 1HB MET 2 -1.778 -8.711 16.096 13 2HB MET 2 2HB MET 2 -3.511 -8.509 15.932 14 1HG MET 2 1HG MET 2 -2.540 -9.199 18.683 15 2HG MET 2 2HG MET 2 -2.084 -7.614 18.092 16 1HE MET 2 1HE MET 2 -5.081 -8.309 20.555 17 2HE MET 2 2HE MET 2 -3.353 -7.904 20.422 18 3HE MET 2 3HE MET 2 -4.578 -6.613 20.361 19 H ASN 3 H ASN 3 -4.841 -9.632 15.032 20 HA ASN 3 HA ASN 3 -4.092 -11.479 12.903 21 1HB ASN 3 1HB ASN 3 -6.876 -10.331 13.458 22 2HB ASN 3 2HB ASN 3 -6.480 -11.554 12.267 23 1HD2 ASN 3 1HD2 ASN 3 -8.393 -12.243 13.871 24 2HD2 ASN 3 2HD2 ASN 3 -7.913 -13.368 15.098 25 H GLU 4 H GLU 4 -4.771 -10.601 10.647 26 HA GLU 4 HA GLU 4 -4.665 -9.080 9.103 27 1HB GLU 4 1HB GLU 4 -6.758 -8.273 10.358 28 2HB GLU 4 2HB GLU 4 -5.745 -7.047 11.095 29 1HG GLU 4 1HG GLU 4 -5.695 -5.782 9.195 30 2HG GLU 4 2HG GLU 4 -5.367 -7.168 8.174 31 H LYS 5 H LYS 5 -3.197 -7.532 8.215 32 HA LYS 5 HA LYS 5 -1.551 -6.021 10.038 33 1HB LYS 5 1HB LYS 5 -0.452 -8.335 8.430 34 2HB LYS 5 2HB LYS 5 0.555 -7.009 8.976 35 1HG LYS 5 1HG LYS 5 -0.221 -7.445 11.344 36 2HG LYS 5 2HG LYS 5 -1.131 -8.825 10.764 37 1HD LYS 5 1HD LYS 5 0.730 -10.103 10.940 38 2HD LYS 5 2HD LYS 5 1.497 -9.134 9.697 39 1HE LYS 5 1HE LYS 5 2.983 -8.923 11.529 40 2HE LYS 5 2HE LYS 5 2.049 -7.441 11.607 41 1HZ LYS 5 1HZ LYS 5 2.151 -8.446 13.744 42 2HZ LYS 5 2HZ LYS 5 0.608 -8.548 13.219 43 3HZ LYS 5 3HZ LYS 5 1.569 -9.868 13.191 44 H ILE 6 H ILE 6 -0.467 -4.276 8.987 45 HA ILE 6 HA ILE 6 -0.780 -4.072 6.119 46 HB ILE 6 HB ILE 6 -2.578 -2.783 7.994 47 1HG1 ILE 6 1HG1 ILE 6 -2.738 -2.513 5.015 48 2HG1 ILE 6 2HG1 ILE 6 -2.888 -4.112 5.717 49 1HG2 ILE 6 1HG2 ILE 6 -2.541 -0.568 6.754 50 2HG2 ILE 6 2HG2 ILE 6 -1.226 -0.849 7.921 51 3HG2 ILE 6 3HG2 ILE 6 -0.921 -1.028 6.177 52 1HD1 ILE 6 1HD1 ILE 6 -4.561 -2.789 7.389 53 2HD1 ILE 6 2HD1 ILE 6 -4.719 -1.751 5.952 54 3HD1 ILE 6 3HD1 ILE 6 -5.107 -3.485 5.844 55 H LEU 7 H LEU 7 0.618 -2.454 5.192 56 HA LEU 7 HA LEU 7 2.470 -1.252 7.114 57 1HB LEU 7 1HB LEU 7 3.099 -3.496 5.673 58 2HB LEU 7 2HB LEU 7 3.693 -2.222 4.627 59 HG LEU 7 HG LEU 7 4.659 -1.441 7.090 60 1HD1 LEU 7 1HD1 LEU 7 5.350 -3.201 8.382 61 2HD1 LEU 7 2HD1 LEU 7 3.800 -3.837 7.782 62 3HD1 LEU 7 3HD1 LEU 7 5.327 -4.356 7.028 63 1HD2 LEU 7 1HD2 LEU 7 6.614 -1.487 6.004 64 2HD2 LEU 7 2HD2 LEU 7 6.475 -3.218 5.617 65 3HD2 LEU 7 3HD2 LEU 7 5.653 -2.010 4.600 66 H ILE 8 H ILE 8 3.319 0.774 6.483 67 HA ILE 8 HA ILE 8 2.106 1.842 4.029 68 HB ILE 8 HB ILE 8 2.359 3.066 6.766 69 1HG1 ILE 8 1HG1 ILE 8 -0.110 3.299 5.147 70 2HG1 ILE 8 2HG1 ILE 8 0.309 1.669 5.638 71 1HG2 ILE 8 1HG2 ILE 8 1.751 5.210 5.866 72 2HG2 ILE 8 2HG2 ILE 8 3.233 4.647 5.056 73 3HG2 ILE 8 3HG2 ILE 8 1.666 4.547 4.216 74 1HD1 ILE 8 1HD1 ILE 8 -0.399 4.047 7.340 75 2HD1 ILE 8 2HD1 ILE 8 -0.890 2.344 7.511 76 3HD1 ILE 8 3HD1 ILE 8 0.741 2.854 8.007 77 H VAL 9 H VAL 9 3.440 3.013 2.662 78 HA VAL 9 HA VAL 9 6.176 3.451 3.615 79 HB VAL 9 HB VAL 9 5.516 2.405 0.866 80 1HG1 VAL 9 1HG1 VAL 9 8.139 1.935 2.185 81 2HG1 VAL 9 2HG1 VAL 9 7.757 2.328 0.492 82 3HG1 VAL 9 3HG1 VAL 9 7.770 3.613 1.724 83 1HG2 VAL 9 1HG2 VAL 9 4.803 0.591 2.134 84 2HG2 VAL 9 2HG2 VAL 9 6.522 0.214 1.865 85 3HG2 VAL 9 3HG2 VAL 9 5.992 0.890 3.424 86 H ASP 10 H ASP 10 6.865 5.506 3.259 87 HA ASP 10 HA ASP 10 6.701 7.621 2.742 88 1HB ASP 10 1HB ASP 10 7.474 6.288 0.542 89 2HB ASP 10 2HB ASP 10 5.960 6.898 -0.097 90 H ASP 11 H ASP 11 5.216 9.120 0.817 91 HA ASP 11 HA ASP 11 3.275 9.986 0.380 92 1HB ASP 11 1HB ASP 11 2.759 7.454 -0.188 93 2HB ASP 11 2HB ASP 11 1.815 7.484 1.289 94 H GLN 12 H GLN 12 4.411 9.241 3.327 95 HA GLN 12 HA GLN 12 2.111 9.435 4.945 96 1HB GLN 12 1HB GLN 12 3.916 9.908 6.756 97 2HB GLN 12 2HB GLN 12 3.937 8.345 5.964 98 1HG GLN 12 1HG GLN 12 5.885 8.803 4.780 99 2HG GLN 12 2HG GLN 12 5.534 10.515 4.644 100 1HE2 GLN 12 1HE2 GLN 12 5.258 11.524 7.002 101 2HE2 GLN 12 2HE2 GLN 12 6.613 11.267 8.049 102 H TYR 13 H TYR 13 0.878 11.253 5.125 103 HA TYR 13 HA TYR 13 2.218 13.768 5.627 104 1HB TYR 13 1HB TYR 13 1.326 12.953 3.033 105 2HB TYR 13 2HB TYR 13 0.026 13.967 3.627 106 HD1 TYR 13 HD1 TYR 13 2.580 14.151 1.490 107 HD2 TYR 13 HD2 TYR 13 1.333 16.097 5.091 108 HE1 TYR 13 HE1 TYR 13 3.891 16.227 0.831 109 HE2 TYR 13 HE2 TYR 13 2.649 18.166 4.420 110 HH TYR 13 HH TYR 13 3.512 19.203 2.501 111 H GLY 14 H GLY 14 0.465 11.777 7.066 112 1HA GLY 14 1HA GLY 14 -0.960 12.452 8.830 113 2HA GLY 14 2HA GLY 14 -1.652 13.690 7.801 114 H ILE 15 H ILE 15 -1.293 11.156 5.705 115 HA ILE 15 HA ILE 15 -4.067 10.377 6.083 116 HB ILE 15 HB ILE 15 -2.093 10.132 3.826 117 1HG1 ILE 15 1HG1 ILE 15 -4.586 11.262 3.066 118 2HG1 ILE 15 2HG1 ILE 15 -4.127 12.023 4.576 119 1HG2 ILE 15 1HG2 ILE 15 -3.374 8.026 3.985 120 2HG2 ILE 15 2HG2 ILE 15 -4.887 8.960 3.902 121 3HG2 ILE 15 3HG2 ILE 15 -3.763 8.961 2.521 122 1HD1 ILE 15 1HD1 ILE 15 -2.023 11.677 2.436 123 2HD1 ILE 15 2HD1 ILE 15 -3.225 12.980 2.272 124 3HD1 ILE 15 3HD1 ILE 15 -2.155 12.929 3.694 125 H ARG 16 H ARG 16 -0.738 9.092 6.216 126 HA ARG 16 HA ARG 16 -1.322 6.433 6.183 127 1HB ARG 16 1HB ARG 16 0.805 6.256 7.670 128 2HB ARG 16 2HB ARG 16 0.982 7.054 6.120 129 1HG ARG 16 1HG ARG 16 0.936 9.250 7.127 130 2HG ARG 16 2HG ARG 16 0.359 8.619 8.657 131 1HD ARG 16 1HD ARG 16 3.008 7.632 7.565 132 2HD ARG 16 2HD ARG 16 2.937 9.205 8.334 133 HE ARG 16 HE ARG 16 2.391 8.168 10.420 134 1HH1 ARG 16 1HH1 ARG 16 2.690 5.815 7.820 135 2HH1 ARG 16 2HH1 ARG 16 2.788 4.456 8.890 136 1HH2 ARG 16 1HH2 ARG 16 2.520 6.376 11.831 137 2HH2 ARG 16 2HH2 ARG 16 2.690 4.777 11.186 138 H ILE 17 H ILE 17 -1.497 8.833 8.853 139 HA ILE 17 HA ILE 17 -1.930 6.923 10.894 140 HB ILE 17 HB ILE 17 -2.485 9.886 10.737 141 1HG1 ILE 17 1HG1 ILE 17 -0.255 8.701 12.330 142 2HG1 ILE 17 2HG1 ILE 17 -0.067 8.750 10.588 143 1HG2 ILE 17 1HG2 ILE 17 -3.253 9.903 12.843 144 2HG2 ILE 17 2HG2 ILE 17 -3.617 8.186 12.549 145 3HG2 ILE 17 3HG2 ILE 17 -2.113 8.647 13.381 146 1HD1 ILE 17 1HD1 ILE 17 0.815 10.806 11.750 147 2HD1 ILE 17 2HD1 ILE 17 -0.444 11.168 10.545 148 3HD1 ILE 17 3HD1 ILE 17 -0.846 11.170 12.279 149 H LEU 18 H LEU 18 -4.079 8.957 8.822 150 HA LEU 18 HA LEU 18 -6.479 8.506 9.954 151 1HB LEU 18 1HB LEU 18 -5.766 9.768 7.812 152 2HB LEU 18 2HB LEU 18 -6.108 8.263 6.983 153 HG LEU 18 HG LEU 18 -8.368 8.751 8.594 154 1HD1 LEU 18 1HD1 LEU 18 -9.091 10.984 7.955 155 2HD1 LEU 18 2HD1 LEU 18 -7.581 11.061 8.895 156 3HD1 LEU 18 3HD1 LEU 18 -7.541 11.273 7.128 157 1HD2 LEU 18 1HD2 LEU 18 -9.115 9.502 6.058 158 2HD2 LEU 18 2HD2 LEU 18 -7.671 8.506 5.756 159 3HD2 LEU 18 3HD2 LEU 18 -9.042 7.832 6.671 160 H LEU 19 H LEU 19 -4.940 6.315 7.490 161 HA LEU 19 HA LEU 19 -6.898 4.308 7.918 162 1HB LEU 19 1HB LEU 19 -5.264 2.936 6.555 163 2HB LEU 19 2HB LEU 19 -5.974 4.347 5.798 164 HG LEU 19 HG LEU 19 -3.465 5.044 7.073 165 1HD1 LEU 19 1HD1 LEU 19 -3.435 2.696 5.171 166 2HD1 LEU 19 2HD1 LEU 19 -2.027 3.753 5.432 167 3HD1 LEU 19 3HD1 LEU 19 -2.706 2.823 6.790 168 1HD2 LEU 19 1HD2 LEU 19 -4.844 6.164 5.182 169 2HD2 LEU 19 2HD2 LEU 19 -3.066 6.191 5.099 170 3HD2 LEU 19 3HD2 LEU 19 -3.986 5.029 4.112 171 H ASN 20 H ASN 20 -3.927 5.276 9.507 172 HA ASN 20 HA ASN 20 -3.206 2.816 10.548 173 1HB ASN 20 1HB ASN 20 -1.861 5.007 10.571 174 2HB ASN 20 2HB ASN 20 -2.875 5.546 11.894 175 1HD2 ASN 20 1HD2 ASN 20 -0.600 5.642 12.782 176 2HD2 ASN 20 2HD2 ASN 20 -0.027 4.265 13.663 177 H GLU 21 H GLU 21 -4.986 5.623 12.064 178 HA GLU 21 HA GLU 21 -5.612 4.421 14.417 179 1HB GLU 21 1HB GLU 21 -5.960 6.826 13.899 180 2HB GLU 21 2HB GLU 21 -7.287 6.418 12.830 181 1HG GLU 21 1HG GLU 21 -8.683 5.702 14.620 182 2HG GLU 21 2HG GLU 21 -7.332 5.476 15.714 183 H VAL 22 H VAL 22 -6.912 3.825 11.205 184 HA VAL 22 HA VAL 22 -9.346 2.641 12.102 185 HB VAL 22 HB VAL 22 -7.842 2.676 9.486 186 1HG1 VAL 22 1HG1 VAL 22 -9.747 1.624 8.424 187 2HG1 VAL 22 2HG1 VAL 22 -9.146 0.565 9.723 188 3HG1 VAL 22 3HG1 VAL 22 -10.615 1.538 9.976 189 1HG2 VAL 22 1HG2 VAL 22 -9.645 4.489 10.791 190 2HG2 VAL 22 2HG2 VAL 22 -8.837 4.651 9.214 191 3HG2 VAL 22 3HG2 VAL 22 -10.424 3.853 9.322 192 H PHE 23 H PHE 23 -6.315 1.291 10.605 193 HA PHE 23 HA PHE 23 -7.010 -1.361 11.167 194 1HB PHE 23 1HB PHE 23 -4.216 -0.106 10.934 195 2HB PHE 23 2HB PHE 23 -4.659 -1.741 10.488 196 HD1 PHE 23 HD1 PHE 23 -3.256 0.355 8.761 197 HD2 PHE 23 HD2 PHE 23 -7.330 -0.775 9.124 198 HE1 PHE 23 HE1 PHE 23 -3.675 1.111 6.404 199 HE2 PHE 23 HE2 PHE 23 -7.750 -0.019 6.767 200 HZ PHE 23 HZ PHE 23 -5.917 0.915 5.436 201 H ASN 24 H ASN 24 -5.077 1.103 12.951 202 HA ASN 24 HA ASN 24 -4.026 -0.615 14.826 203 1HB ASN 24 1HB ASN 24 -3.721 2.022 14.315 204 2HB ASN 24 2HB ASN 24 -4.868 2.179 15.630 205 1HD2 ASN 24 1HD2 ASN 24 -3.919 2.587 17.463 206 2HD2 ASN 24 2HD2 ASN 24 -2.439 1.913 18.060 207 H LYS 25 H LYS 25 -7.162 1.132 14.572 208 HA LYS 25 HA LYS 25 -8.087 0.851 17.145 209 1HB LYS 25 1HB LYS 25 -9.184 1.424 14.503 210 2HB LYS 25 2HB LYS 25 -10.322 0.538 15.499 211 1HG LYS 25 1HG LYS 25 -9.674 2.246 17.388 212 2HG LYS 25 2HG LYS 25 -8.996 3.208 16.089 213 1HD LYS 25 1HD LYS 25 -11.888 2.236 16.260 214 2HD LYS 25 2HD LYS 25 -11.342 3.873 16.566 215 1HE LYS 25 1HE LYS 25 -11.570 4.330 14.357 216 2HE LYS 25 2HE LYS 25 -10.284 3.192 14.010 217 1HZ LYS 25 1HZ LYS 25 -12.279 1.530 14.352 218 2HZ LYS 25 2HZ LYS 25 -13.135 2.821 13.836 219 3HZ LYS 25 3HZ LYS 25 -11.944 2.204 12.903 220 H GLU 26 H GLU 26 -7.428 -1.583 14.735 221 HA GLU 26 HA GLU 26 -9.142 -3.477 16.078 222 1HB GLU 26 1HB GLU 26 -7.336 -3.836 13.645 223 2HB GLU 26 2HB GLU 26 -8.490 -5.014 14.239 224 1HG GLU 26 1HG GLU 26 -9.265 -2.191 13.369 225 2HG GLU 26 2HG GLU 26 -9.322 -3.580 12.301 226 H GLY 27 H GLY 27 -5.838 -2.361 16.024 227 1HA GLY 27 1HA GLY 27 -4.307 -2.920 17.686 228 2HA GLY 27 2HA GLY 27 -5.118 -4.452 17.945 229 H TYR 28 H TYR 28 -4.874 -3.825 14.587 230 HA TYR 28 HA TYR 28 -3.133 -5.981 14.163 231 1HB TYR 28 1HB TYR 28 -3.910 -3.550 12.433 232 2HB TYR 28 2HB TYR 28 -3.277 -5.054 11.796 233 HD1 TYR 28 HD1 TYR 28 -5.111 -6.481 14.158 234 HD2 TYR 28 HD2 TYR 28 -5.783 -3.974 10.757 235 HE1 TYR 28 HE1 TYR 28 -7.478 -7.386 13.949 236 HE2 TYR 28 HE2 TYR 28 -8.147 -4.887 10.559 237 HH TYR 28 HH TYR 28 -9.821 -5.902 12.149 238 H GLN 29 H GLN 29 -0.971 -6.049 13.335 239 HA GLN 29 HA GLN 29 0.623 -3.938 14.408 240 1HB GLN 29 1HB GLN 29 0.961 -6.728 13.787 241 2HB GLN 29 2HB GLN 29 2.191 -5.837 12.911 242 1HG GLN 29 1HG GLN 29 3.218 -5.051 14.852 243 2HG GLN 29 2HG GLN 29 1.728 -5.045 15.774 244 1HE2 GLN 29 1HE2 GLN 29 1.043 -6.841 16.842 245 2HE2 GLN 29 2HE2 GLN 29 1.985 -8.281 17.040 246 H THR 30 H THR 30 1.258 -2.155 13.280 247 HA THR 30 HA THR 30 1.505 -2.434 10.360 248 HB THR 30 HB THR 30 0.578 -0.034 10.320 249 HG1 THR 30 HG1 THR 30 1.026 0.157 12.708 250 1HG2 THR 30 1HG2 THR 30 -0.856 -2.504 10.584 251 2HG2 THR 30 2HG2 THR 30 -1.677 -1.322 11.632 252 3HG2 THR 30 3HG2 THR 30 -1.460 -0.975 9.900 253 H PHE 31 H PHE 31 3.088 -1.100 9.341 254 HA PHE 31 HA PHE 31 4.901 0.261 11.167 255 1HB PHE 31 1HB PHE 31 5.296 -2.365 10.191 256 2HB PHE 31 2HB PHE 31 6.178 -1.392 9.030 257 HD1 PHE 31 HD1 PHE 31 6.203 -2.824 12.314 258 HD2 PHE 31 HD2 PHE 31 7.982 0.171 9.891 259 HE1 PHE 31 HE1 PHE 31 8.148 -2.700 13.896 260 HE2 PHE 31 HE2 PHE 31 9.927 0.295 11.473 261 HZ PHE 31 HZ PHE 31 9.987 -1.142 13.456 262 H GLN 32 H GLN 32 6.592 1.550 9.910 263 HA GLN 32 HA GLN 32 5.499 2.282 7.308 264 1HB GLN 32 1HB GLN 32 4.880 4.208 8.389 265 2HB GLN 32 2HB GLN 32 6.017 3.968 9.700 266 1HG GLN 32 1HG GLN 32 7.840 4.889 8.455 267 2HG GLN 32 2HG GLN 32 7.008 4.705 6.924 268 1HE2 GLN 32 1HE2 GLN 32 7.338 6.562 9.840 269 2HE2 GLN 32 2HE2 GLN 32 6.421 7.953 9.365 270 H ALA 33 H ALA 33 7.051 2.911 5.694 271 HA ALA 33 HA ALA 33 9.845 2.476 6.487 272 1HB ALA 33 1HB ALA 33 9.317 1.655 3.757 273 2HB ALA 33 2HB ALA 33 10.012 0.716 5.100 274 3HB ALA 33 3HB ALA 33 8.247 0.779 4.878 275 H ALA 34 H ALA 34 11.365 3.377 4.700 276 HA ALA 34 HA ALA 34 10.140 5.798 3.570 277 1HB ALA 34 1HB ALA 34 11.674 7.114 4.592 278 2HB ALA 34 2HB ALA 34 11.917 5.730 5.686 279 3HB ALA 34 3HB ALA 34 12.997 5.961 4.290 280 H ASN 35 H ASN 35 10.228 3.378 2.153 281 HA ASN 35 HA ASN 35 11.429 4.132 -0.151 282 1HB ASN 35 1HB ASN 35 13.301 2.752 1.710 283 2HB ASN 35 2HB ASN 35 13.225 2.006 0.126 284 1HD2 ASN 35 1HD2 ASN 35 15.469 3.298 1.198 285 2HD2 ASN 35 2HD2 ASN 35 15.851 4.689 0.239 286 H GLY 36 H GLY 36 11.890 1.854 -1.557 287 1HA GLY 36 1HA GLY 36 9.450 0.312 -1.176 288 2HA GLY 36 2HA GLY 36 10.522 0.300 -2.563 289 H LEU 37 H LEU 37 13.033 -0.074 -1.088 290 HA LEU 37 HA LEU 37 12.900 -2.903 -0.834 291 1HB LEU 37 1HB LEU 37 14.844 -0.966 -1.365 292 2HB LEU 37 2HB LEU 37 15.329 -1.676 0.163 293 HG LEU 37 HG LEU 37 14.680 -3.336 -2.282 294 1HD1 LEU 37 1HD1 LEU 37 16.573 -1.663 -2.620 295 2HD1 LEU 37 2HD1 LEU 37 17.470 -2.596 -1.398 296 3HD1 LEU 37 3HD1 LEU 37 16.946 -3.379 -2.908 297 1HD2 LEU 37 1HD2 LEU 37 16.565 -4.586 -0.589 298 2HD2 LEU 37 2HD2 LEU 37 15.270 -3.958 0.459 299 3HD2 LEU 37 3HD2 LEU 37 14.872 -5.049 -0.889 300 H GLN 38 H GLN 38 13.617 -0.191 1.475 301 HA GLN 38 HA GLN 38 13.884 -1.747 3.696 302 1HB GLN 38 1HB GLN 38 13.529 1.064 3.077 303 2HB GLN 38 2HB GLN 38 12.585 0.669 4.500 304 1HG GLN 38 1HG GLN 38 14.887 -0.667 5.114 305 2HG GLN 38 2HG GLN 38 15.557 0.604 4.111 306 1HE2 GLN 38 1HE2 GLN 38 16.344 2.145 5.315 307 2HE2 GLN 38 2HE2 GLN 38 15.621 2.862 6.716 308 H ALA 39 H ALA 39 11.042 -1.104 1.799 309 HA ALA 39 HA ALA 39 9.185 -1.562 3.947 310 1HB ALA 39 1HB ALA 39 8.488 -0.078 2.210 311 2HB ALA 39 2HB ALA 39 8.962 -1.228 0.937 312 3HB ALA 39 3HB ALA 39 7.558 -1.577 1.973 313 H LEU 40 H LEU 40 10.748 -3.385 1.283 314 HA LEU 40 HA LEU 40 9.136 -5.648 1.400 315 1HB LEU 40 1HB LEU 40 12.005 -5.216 0.584 316 2HB LEU 40 2HB LEU 40 11.204 -6.768 0.440 317 HG LEU 40 HG LEU 40 10.429 -4.195 -0.957 318 1HD1 LEU 40 1HD1 LEU 40 12.196 -4.955 -2.194 319 2HD1 LEU 40 2HD1 LEU 40 11.911 -6.660 -1.771 320 3HD1 LEU 40 3HD1 LEU 40 10.868 -5.853 -2.966 321 1HD2 LEU 40 1HD2 LEU 40 8.355 -5.000 -1.039 322 2HD2 LEU 40 2HD2 LEU 40 8.989 -6.262 -2.122 323 3HD2 LEU 40 3HD2 LEU 40 8.853 -6.574 -0.375 324 H ASP 41 H ASP 41 12.246 -4.882 3.105 325 HA ASP 41 HA ASP 41 12.480 -7.229 4.448 326 1HB ASP 41 1HB ASP 41 13.750 -4.745 4.444 327 2HB ASP 41 2HB ASP 41 13.119 -4.830 6.076 328 H ILE 42 H ILE 42 11.039 -4.098 5.663 329 HA ILE 42 HA ILE 42 10.047 -5.137 8.039 330 HB ILE 42 HB ILE 42 9.307 -2.760 6.349 331 1HG1 ILE 42 1HG1 ILE 42 11.506 -3.222 7.899 332 2HG1 ILE 42 2HG1 ILE 42 10.869 -1.640 7.498 333 1HG2 ILE 42 1HG2 ILE 42 7.281 -3.086 7.429 334 2HG2 ILE 42 2HG2 ILE 42 8.046 -3.744 8.896 335 3HG2 ILE 42 3HG2 ILE 42 8.150 -2.002 8.543 336 1HD1 ILE 42 1HD1 ILE 42 9.800 -1.382 9.586 337 2HD1 ILE 42 2HD1 ILE 42 9.765 -3.136 9.891 338 3HD1 ILE 42 3HD1 ILE 42 11.298 -2.241 10.021 339 H VAL 43 H VAL 43 8.833 -5.258 4.706 340 HA VAL 43 HA VAL 43 6.178 -5.927 5.360 341 HB VAL 43 HB VAL 43 7.947 -5.988 2.972 342 1HG1 VAL 43 1HG1 VAL 43 6.143 -7.094 1.631 343 2HG1 VAL 43 2HG1 VAL 43 6.970 -8.181 2.772 344 3HG1 VAL 43 3HG1 VAL 43 5.351 -7.550 3.159 345 1HG2 VAL 43 1HG2 VAL 43 5.088 -5.032 3.186 346 2HG2 VAL 43 2HG2 VAL 43 6.452 -4.054 3.777 347 3HG2 VAL 43 3HG2 VAL 43 6.362 -4.509 2.058 348 H THR 44 H THR 44 9.130 -7.885 4.615 349 HA THR 44 HA THR 44 7.798 -10.369 4.878 350 HB THR 44 HB THR 44 10.764 -9.646 5.142 351 HG1 THR 44 HG1 THR 44 10.648 -9.814 2.834 352 1HG2 THR 44 1HG2 THR 44 10.140 -12.047 5.705 353 2HG2 THR 44 2HG2 THR 44 9.378 -12.172 4.102 354 3HG2 THR 44 3HG2 THR 44 11.133 -11.905 4.234 355 H LYS 45 H LYS 45 9.373 -8.148 7.177 356 HA LYS 45 HA LYS 45 9.399 -10.085 9.272 357 1HB LYS 45 1HB LYS 45 10.537 -7.544 8.773 358 2HB LYS 45 2HB LYS 45 9.529 -7.350 10.193 359 1HG LYS 45 1HG LYS 45 10.834 -9.845 10.560 360 2HG LYS 45 2HG LYS 45 12.068 -8.783 9.912 361 1HD LYS 45 1HD LYS 45 11.958 -7.302 11.732 362 2HD LYS 45 2HD LYS 45 10.297 -7.713 12.108 363 1HE LYS 45 1HE LYS 45 12.800 -9.344 12.697 364 2HE LYS 45 2HE LYS 45 11.643 -8.703 13.846 365 1HZ LYS 45 1HZ LYS 45 11.377 -10.995 12.087 366 2HZ LYS 45 2HZ LYS 45 10.963 -10.841 13.659 367 3HZ LYS 45 3HZ LYS 45 10.022 -10.182 12.498 368 H GLU 46 H GLU 46 7.386 -7.171 8.479 369 HA GLU 46 HA GLU 46 5.601 -7.815 10.599 370 1HB GLU 46 1HB GLU 46 5.702 -5.687 8.446 371 2HB GLU 46 2HB GLU 46 4.245 -5.900 9.395 372 1HG GLU 46 1HG GLU 46 6.559 -5.907 11.164 373 2HG GLU 46 2HG GLU 46 6.617 -4.489 10.136 374 H ARG 47 H ARG 47 6.140 -9.169 7.591 375 HA ARG 47 HA ARG 47 4.792 -9.962 5.987 376 1HB ARG 47 1HB ARG 47 3.644 -12.039 6.899 377 2HB ARG 47 2HB ARG 47 5.310 -11.866 7.413 378 1HG ARG 47 1HG ARG 47 4.732 -11.629 9.612 379 2HG ARG 47 2HG ARG 47 3.437 -10.507 9.245 380 1HD ARG 47 1HD ARG 47 2.448 -12.519 10.212 381 2HD ARG 47 2HD ARG 47 1.996 -12.450 8.520 382 HE ARG 47 HE ARG 47 4.413 -13.924 8.652 383 1HH1 ARG 47 1HH1 ARG 47 1.096 -14.230 9.787 384 2HH1 ARG 47 2HH1 ARG 47 1.116 -15.962 9.772 385 1HH2 ARG 47 1HH2 ARG 47 4.439 -16.209 8.631 386 2HH2 ARG 47 2HH2 ARG 47 3.030 -17.095 9.111 387 HA PRO 48 HA PRO 48 0.930 -7.743 7.139 388 1HB PRO 48 1HB PRO 48 1.093 -5.651 5.387 389 2HB PRO 48 2HB PRO 48 1.616 -5.547 7.056 390 1HG PRO 48 1HG PRO 48 3.260 -5.757 4.608 391 2HG PRO 48 2HG PRO 48 3.739 -5.232 6.210 392 1HD PRO 48 1HD PRO 48 4.284 -7.777 5.004 393 2HD PRO 48 2HD PRO 48 4.661 -7.293 6.645 394 H ASP 49 H ASP 49 -1.113 -7.590 6.044 395 HA ASP 49 HA ASP 49 -0.999 -9.359 3.765 396 1HB ASP 49 1HB ASP 49 -3.560 -8.279 4.957 397 2HB ASP 49 2HB ASP 49 -3.278 -9.832 4.196 398 H LEU 50 H LEU 50 -0.708 -6.110 4.286 399 HA LEU 50 HA LEU 50 -1.488 -5.420 1.660 400 1HB LEU 50 1HB LEU 50 -3.640 -5.475 3.267 401 2HB LEU 50 2HB LEU 50 -3.081 -3.849 3.608 402 HG LEU 50 HG LEU 50 -4.826 -4.127 1.777 403 1HD1 LEU 50 1HD1 LEU 50 -3.825 -2.019 1.958 404 2HD1 LEU 50 2HD1 LEU 50 -2.248 -2.613 1.385 405 3HD1 LEU 50 3HD1 LEU 50 -3.610 -2.467 0.249 406 1HD2 LEU 50 1HD2 LEU 50 -2.574 -4.814 -0.078 407 2HD2 LEU 50 2HD2 LEU 50 -3.427 -6.113 0.791 408 3HD2 LEU 50 3HD2 LEU 50 -4.331 -5.019 -0.284 409 H VAL 51 H VAL 51 0.144 -4.103 1.076 410 HA VAL 51 HA VAL 51 1.126 -2.240 3.125 411 HB VAL 51 HB VAL 51 2.895 -3.661 3.023 412 1HG1 VAL 51 1HG1 VAL 51 3.599 -4.673 0.685 413 2HG1 VAL 51 2HG1 VAL 51 2.287 -5.401 1.642 414 3HG1 VAL 51 3HG1 VAL 51 1.902 -4.329 0.273 415 1HG2 VAL 51 1HG2 VAL 51 3.310 -1.771 0.689 416 2HG2 VAL 51 2HG2 VAL 51 3.814 -1.552 2.382 417 3HG2 VAL 51 3HG2 VAL 51 4.601 -2.788 1.372 418 H LEU 52 H LEU 52 1.158 -0.112 2.534 419 HA LEU 52 HA LEU 52 0.438 0.429 -0.255 420 1HB LEU 52 1HB LEU 52 -1.227 1.456 0.825 421 2HB LEU 52 2HB LEU 52 -0.349 1.545 2.339 422 HG LEU 52 HG LEU 52 0.239 3.388 0.015 423 1HD1 LEU 52 1HD1 LEU 52 -1.116 5.072 1.393 424 2HD1 LEU 52 2HD1 LEU 52 -2.013 3.869 0.434 425 3HD1 LEU 52 3HD1 LEU 52 -1.831 3.651 2.191 426 1HD2 LEU 52 1HD2 LEU 52 1.179 3.128 2.819 427 2HD2 LEU 52 2HD2 LEU 52 2.027 3.705 1.364 428 3HD2 LEU 52 3HD2 LEU 52 0.892 4.778 2.217 429 H LEU 53 H LEU 53 1.761 1.647 -1.562 430 HA LEU 53 HA LEU 53 4.015 2.990 -0.294 431 1HB LEU 53 1HB LEU 53 5.049 0.961 -0.746 432 2HB LEU 53 2HB LEU 53 4.177 0.723 -2.247 433 HG LEU 53 HG LEU 53 6.156 2.978 -1.958 434 1HD1 LEU 53 1HD1 LEU 53 7.706 1.230 -3.188 435 2HD1 LEU 53 2HD1 LEU 53 7.634 1.318 -1.412 436 3HD1 LEU 53 3HD1 LEU 53 6.722 0.059 -2.279 437 1HD2 LEU 53 1HD2 LEU 53 5.690 3.369 -4.090 438 2HD2 LEU 53 2HD2 LEU 53 6.057 1.683 -4.528 439 3HD2 LEU 53 3HD2 LEU 53 4.416 2.129 -4.003 440 H ASP 54 H ASP 54 4.926 4.695 -1.618 441 HA ASP 54 HA ASP 54 3.002 5.530 -3.635 442 1HB ASP 54 1HB ASP 54 3.051 7.300 -2.130 443 2HB ASP 54 2HB ASP 54 4.685 6.948 -1.605 444 H MET 55 H MET 55 3.780 5.979 -5.756 445 HA MET 55 HA MET 55 6.127 4.798 -6.550 446 1HB MET 55 1HB MET 55 4.237 6.863 -7.750 447 2HB MET 55 2HB MET 55 5.691 6.430 -8.628 448 1HG MET 55 1HG MET 55 4.074 4.914 -9.475 449 2HG MET 55 2HG MET 55 4.944 3.951 -8.298 450 1HE MET 55 1HE MET 55 3.003 2.691 -6.024 451 2HE MET 55 2HE MET 55 4.492 3.661 -6.126 452 3HE MET 55 3HE MET 55 3.108 4.252 -5.176 453 H LYS 56 H LYS 56 5.396 8.364 -6.369 454 HA LYS 56 HA LYS 56 8.068 9.104 -6.836 455 1HB LYS 56 1HB LYS 56 5.516 10.432 -6.140 456 2HB LYS 56 2HB LYS 56 6.958 11.275 -5.611 457 1HG LYS 56 1HG LYS 56 7.812 11.478 -7.826 458 2HG LYS 56 2HG LYS 56 6.795 10.189 -8.440 459 1HD LYS 56 1HD LYS 56 4.771 11.610 -8.096 460 2HD LYS 56 2HD LYS 56 5.774 12.895 -7.453 461 1HE LYS 56 1HE LYS 56 7.062 12.450 -9.833 462 2HE LYS 56 2HE LYS 56 5.434 11.987 -10.287 463 1HZ LYS 56 1HZ LYS 56 5.823 14.463 -8.813 464 2HZ LYS 56 2HZ LYS 56 6.168 14.434 -10.409 465 3HZ LYS 56 3HZ LYS 56 4.660 14.076 -9.892 466 H ILE 57 H ILE 57 9.811 9.192 -5.511 467 HA ILE 57 HA ILE 57 9.454 9.573 -2.695 468 HB ILE 57 HB ILE 57 11.051 7.220 -2.886 469 1HG1 ILE 57 1HG1 ILE 57 8.254 6.819 -3.983 470 2HG1 ILE 57 2HG1 ILE 57 9.703 6.815 -4.968 471 1HG2 ILE 57 1HG2 ILE 57 8.371 7.073 -1.643 472 2HG2 ILE 57 2HG2 ILE 57 9.979 6.706 -0.973 473 3HG2 ILE 57 3HG2 ILE 57 9.420 8.393 -1.072 474 1HD1 ILE 57 1HD1 ILE 57 10.549 4.841 -3.958 475 2HD1 ILE 57 2HD1 ILE 57 9.502 5.018 -2.529 476 3HD1 ILE 57 3HD1 ILE 57 8.802 4.527 -4.090 477 HA PRO 58 HA PRO 58 13.412 11.203 -3.230 478 1HB PRO 58 1HB PRO 58 14.535 10.973 -0.749 479 2HB PRO 58 2HB PRO 58 13.382 12.224 -1.166 480 1HG PRO 58 1HG PRO 58 12.967 9.787 0.454 481 2HG PRO 58 2HG PRO 58 11.982 11.235 0.377 482 1HD PRO 58 1HD PRO 58 11.419 8.709 -0.860 483 2HD PRO 58 2HD PRO 58 10.496 10.189 -1.031 484 H GLY 59 H GLY 59 15.134 10.602 -4.378 485 1HA GLY 59 1HA GLY 59 16.783 9.268 -5.115 486 2HA GLY 59 2HA GLY 59 16.984 8.740 -3.457 487 H MET 60 H MET 60 16.340 7.673 -6.566 488 HA MET 60 HA MET 60 15.662 5.796 -7.425 489 1HB MET 60 1HB MET 60 17.086 4.670 -5.778 490 2HB MET 60 2HB MET 60 15.900 4.894 -4.508 491 1HG MET 60 1HG MET 60 15.437 2.683 -5.073 492 2HG MET 60 2HG MET 60 14.325 3.491 -6.160 493 1HE MET 60 1HE MET 60 15.108 0.671 -6.568 494 2HE MET 60 2HE MET 60 14.290 1.401 -7.970 495 3HE MET 60 3HE MET 60 15.784 0.463 -8.201 496 H ASP 61 H ASP 61 13.623 6.078 -8.270 497 HA ASP 61 HA ASP 61 11.405 6.522 -6.620 498 1HB ASP 61 1HB ASP 61 10.243 5.828 -8.956 499 2HB ASP 61 2HB ASP 61 10.992 7.394 -8.714 500 H GLY 62 H GLY 62 9.302 4.974 -7.292 501 1HA GLY 62 1HA GLY 62 10.129 2.261 -6.517 502 2HA GLY 62 2HA GLY 62 8.547 2.983 -6.295 503 H ILE 63 H ILE 63 10.438 3.284 -9.323 504 HA ILE 63 HA ILE 63 8.240 2.122 -10.766 505 HB ILE 63 HB ILE 63 10.887 3.262 -11.669 506 1HG1 ILE 63 1HG1 ILE 63 8.249 4.615 -12.080 507 2HG1 ILE 63 2HG1 ILE 63 8.978 4.688 -10.488 508 1HG2 ILE 63 1HG2 ILE 63 8.996 3.376 -13.746 509 2HG2 ILE 63 2HG2 ILE 63 10.465 2.375 -13.658 510 3HG2 ILE 63 3HG2 ILE 63 8.908 1.722 -13.095 511 1HD1 ILE 63 1HD1 ILE 63 9.829 5.988 -13.014 512 2HD1 ILE 63 2HD1 ILE 63 10.126 6.474 -11.328 513 3HD1 ILE 63 3HD1 ILE 63 11.159 5.243 -12.095 514 H GLU 64 H GLU 64 11.745 1.380 -10.207 515 HA GLU 64 HA GLU 64 11.366 -1.160 -11.483 516 1HB GLU 64 1HB GLU 64 13.847 -0.142 -10.039 517 2HB GLU 64 2HB GLU 64 13.767 -1.432 -11.222 518 1HG GLU 64 1HG GLU 64 12.796 1.331 -11.992 519 2HG GLU 64 2HG GLU 64 14.519 1.017 -11.946 520 H ILE 65 H ILE 65 11.235 0.238 -8.285 521 HA ILE 65 HA ILE 65 11.948 -2.060 -6.816 522 HB ILE 65 HB ILE 65 10.206 0.274 -6.019 523 1HG1 ILE 65 1HG1 ILE 65 13.215 -0.062 -6.009 524 2HG1 ILE 65 2HG1 ILE 65 12.275 1.146 -6.863 525 1HG2 ILE 65 1HG2 ILE 65 9.961 -0.810 -4.098 526 2HG2 ILE 65 2HG2 ILE 65 11.055 -2.110 -4.627 527 3HG2 ILE 65 3HG2 ILE 65 11.716 -0.654 -3.844 528 1HD1 ILE 65 1HD1 ILE 65 13.115 1.074 -4.024 529 2HD1 ILE 65 2HD1 ILE 65 12.689 2.466 -5.049 530 3HD1 ILE 65 3HD1 ILE 65 11.407 1.519 -4.256 531 H LEU 66 H LEU 66 8.686 -0.579 -7.462 532 HA LEU 66 HA LEU 66 7.275 -2.778 -6.490 533 1HB LEU 66 1HB LEU 66 6.642 -0.429 -8.232 534 2HB LEU 66 2HB LEU 66 5.464 -1.716 -8.065 535 HG LEU 66 HG LEU 66 5.097 -1.288 -5.806 536 1HD1 LEU 66 1HD1 LEU 66 6.543 -0.225 -4.284 537 2HD1 LEU 66 2HD1 LEU 66 7.589 -1.270 -5.276 538 3HD1 LEU 66 3HD1 LEU 66 7.533 0.483 -5.583 539 1HD2 LEU 66 1HD2 LEU 66 5.746 1.482 -6.833 540 2HD2 LEU 66 2HD2 LEU 66 4.332 0.539 -7.364 541 3HD2 LEU 66 3HD2 LEU 66 4.500 1.006 -5.654 542 H LYS 67 H LYS 67 8.869 -2.131 -9.584 543 HA LYS 67 HA LYS 67 7.470 -4.051 -11.089 544 1HB LYS 67 1HB LYS 67 9.700 -2.229 -11.428 545 2HB LYS 67 2HB LYS 67 10.066 -3.784 -12.147 546 1HG LYS 67 1HG LYS 67 7.681 -3.655 -13.204 547 2HG LYS 67 2HG LYS 67 7.702 -1.964 -12.744 548 1HD LYS 67 1HD LYS 67 9.433 -1.426 -14.239 549 2HD LYS 67 2HD LYS 67 10.092 -3.050 -14.233 550 1HE LYS 67 1HE LYS 67 7.947 -3.804 -15.445 551 2HE LYS 67 2HE LYS 67 7.548 -2.108 -15.630 552 1HZ LYS 67 1HZ LYS 67 10.140 -3.154 -16.495 553 2HZ LYS 67 2HZ LYS 67 8.832 -3.205 -17.472 554 3HZ LYS 67 3HZ LYS 67 9.406 -1.768 -16.949 555 H ARG 68 H ARG 68 10.837 -4.204 -9.714 556 HA ARG 68 HA ARG 68 11.156 -6.868 -10.188 557 1HB ARG 68 1HB ARG 68 12.400 -4.829 -8.385 558 2HB ARG 68 2HB ARG 68 12.670 -6.494 -7.908 559 1HG ARG 68 1HG ARG 68 13.632 -7.037 -10.095 560 2HG ARG 68 2HG ARG 68 13.183 -5.470 -10.738 561 1HD ARG 68 1HD ARG 68 15.409 -5.040 -10.201 562 2HD ARG 68 2HD ARG 68 14.653 -4.555 -8.696 563 HE ARG 68 HE ARG 68 16.268 -6.982 -9.149 564 1HH1 ARG 68 1HH1 ARG 68 14.040 -5.295 -7.011 565 2HH1 ARG 68 2HH1 ARG 68 14.493 -6.207 -5.610 566 1HH2 ARG 68 1HH2 ARG 68 16.866 -8.186 -7.301 567 2HH2 ARG 68 2HH2 ARG 68 16.111 -7.862 -5.776 568 H MET 69 H MET 69 9.375 -5.174 -7.636 569 HA MET 69 HA MET 69 9.336 -7.194 -5.744 570 1HB MET 69 1HB MET 69 8.044 -4.632 -6.279 571 2HB MET 69 2HB MET 69 6.826 -5.765 -5.727 572 1HG MET 69 1HG MET 69 7.621 -5.726 -3.589 573 2HG MET 69 2HG MET 69 9.270 -5.999 -4.117 574 1HE MET 69 1HE MET 69 6.423 -3.526 -3.601 575 2HE MET 69 2HE MET 69 7.336 -3.631 -2.076 576 3HE MET 69 3HE MET 69 7.284 -2.098 -2.979 577 H LYS 70 H LYS 70 6.941 -6.360 -8.349 578 HA LYS 70 HA LYS 70 5.362 -8.664 -7.764 579 1HB LYS 70 1HB LYS 70 3.879 -7.839 -9.336 580 2HB LYS 70 2HB LYS 70 4.638 -6.376 -8.742 581 1HG LYS 70 1HG LYS 70 4.683 -6.132 -11.109 582 2HG LYS 70 2HG LYS 70 6.316 -6.618 -10.699 583 1HD LYS 70 1HD LYS 70 6.140 -8.561 -11.874 584 2HD LYS 70 2HD LYS 70 4.607 -8.964 -11.128 585 1HE LYS 70 1HE LYS 70 3.348 -7.753 -12.754 586 2HE LYS 70 2HE LYS 70 4.734 -6.809 -13.263 587 1HZ LYS 70 1HZ LYS 70 3.901 -9.359 -14.148 588 2HZ LYS 70 2HZ LYS 70 4.952 -8.318 -14.839 589 3HZ LYS 70 3HZ LYS 70 5.473 -9.373 -13.707 590 H VAL 71 H VAL 71 7.910 -7.755 -10.126 591 HA VAL 71 HA VAL 71 7.634 -10.013 -11.754 592 HB VAL 71 HB VAL 71 10.107 -8.374 -11.167 593 1HG1 VAL 71 1HG1 VAL 71 10.293 -10.582 -12.473 594 2HG1 VAL 71 2HG1 VAL 71 9.397 -9.747 -13.765 595 3HG1 VAL 71 3HG1 VAL 71 10.973 -9.119 -13.225 596 1HG2 VAL 71 1HG2 VAL 71 8.528 -7.731 -13.572 597 2HG2 VAL 71 2HG2 VAL 71 7.709 -7.361 -12.036 598 3HG2 VAL 71 3HG2 VAL 71 9.306 -6.657 -12.385 599 H ILE 72 H ILE 72 9.088 -9.481 -8.574 600 HA ILE 72 HA ILE 72 10.694 -11.835 -8.654 601 HB ILE 72 HB ILE 72 9.946 -9.770 -6.639 602 1HG1 ILE 72 1HG1 ILE 72 11.917 -9.721 -8.328 603 2HG1 ILE 72 2HG1 ILE 72 12.192 -9.231 -6.668 604 1HG2 ILE 72 1HG2 ILE 72 11.260 -11.081 -4.925 605 2HG2 ILE 72 2HG2 ILE 72 9.629 -11.693 -5.292 606 3HG2 ILE 72 3HG2 ILE 72 11.058 -12.502 -5.978 607 1HD1 ILE 72 1HD1 ILE 72 13.232 -11.324 -6.102 608 2HD1 ILE 72 2HD1 ILE 72 12.658 -12.092 -7.602 609 3HD1 ILE 72 3HD1 ILE 72 13.923 -10.842 -7.669 610 H ASP 73 H ASP 73 7.392 -10.955 -7.576 611 HA ASP 73 HA ASP 73 6.703 -13.707 -7.664 612 1HB ASP 73 1HB ASP 73 7.267 -12.369 -5.098 613 2HB ASP 73 2HB ASP 73 5.629 -12.990 -5.156 614 H GLU 74 H GLU 74 4.269 -13.938 -7.474 615 HA GLU 74 HA GLU 74 3.007 -11.386 -8.074 616 1HB GLU 74 1HB GLU 74 1.502 -12.528 -9.472 617 2HB GLU 74 2HB GLU 74 2.997 -13.408 -9.724 618 1HG GLU 74 1HG GLU 74 2.260 -15.068 -7.953 619 2HG GLU 74 2HG GLU 74 0.729 -14.221 -7.845 620 H ASN 75 H ASN 75 3.382 -13.728 -5.620 621 HA ASN 75 HA ASN 75 0.749 -13.690 -4.624 622 1HB ASN 75 1HB ASN 75 2.019 -14.526 -2.474 623 2HB ASN 75 2HB ASN 75 2.040 -15.548 -3.898 624 1HD2 ASN 75 1HD2 ASN 75 3.921 -16.408 -4.276 625 2HD2 ASN 75 2HD2 ASN 75 5.480 -15.693 -4.035 626 H ILE 76 H ILE 76 3.447 -11.497 -4.619 627 HA ILE 76 HA ILE 76 3.049 -10.291 -2.098 628 HB ILE 76 HB ILE 76 5.145 -10.164 -3.293 629 1HG1 ILE 76 1HG1 ILE 76 3.780 -7.498 -2.837 630 2HG1 ILE 76 2HG1 ILE 76 4.713 -8.427 -1.680 631 1HG2 ILE 76 1HG2 ILE 76 4.291 -8.142 -5.254 632 2HG2 ILE 76 2HG2 ILE 76 5.422 -9.507 -5.418 633 3HG2 ILE 76 3HG2 ILE 76 3.668 -9.781 -5.559 634 1HD1 ILE 76 1HD1 ILE 76 5.887 -7.398 -4.299 635 2HD1 ILE 76 2HD1 ILE 76 5.967 -6.495 -2.768 636 3HD1 ILE 76 3HD1 ILE 76 6.770 -8.076 -2.911 637 H ARG 77 H ARG 77 1.653 -8.714 -1.424 638 HA ARG 77 HA ARG 77 -0.073 -7.651 -3.515 639 1HB ARG 77 1HB ARG 77 -1.532 -8.988 -2.223 640 2HB ARG 77 2HB ARG 77 -0.674 -8.667 -0.729 641 1HG ARG 77 1HG ARG 77 -1.709 -6.586 -0.408 642 2HG ARG 77 2HG ARG 77 -1.988 -6.336 -2.119 643 1HD ARG 77 1HD ARG 77 -3.520 -8.188 -0.244 644 2HD ARG 77 2HD ARG 77 -4.144 -6.804 -1.119 645 HE ARG 77 HE ARG 77 -3.165 -8.479 -3.121 646 1HH1 ARG 77 1HH1 ARG 77 -5.487 -8.831 -0.500 647 2HH1 ARG 77 2HH1 ARG 77 -6.442 -10.011 -1.333 648 1HH2 ARG 77 1HH2 ARG 77 -4.424 -10.037 -4.221 649 2HH2 ARG 77 2HH2 ARG 77 -5.833 -10.702 -3.464 650 H VAL 78 H VAL 78 0.428 -5.502 -3.835 651 HA VAL 78 HA VAL 78 0.739 -3.843 -1.455 652 HB VAL 78 HB VAL 78 2.964 -4.675 -2.535 653 1HG1 VAL 78 1HG1 VAL 78 2.160 -2.452 -4.442 654 2HG1 VAL 78 2HG1 VAL 78 3.792 -3.149 -4.310 655 3HG1 VAL 78 3HG1 VAL 78 2.432 -4.163 -4.850 656 1HG2 VAL 78 1HG2 VAL 78 3.064 -3.114 -0.772 657 2HG2 VAL 78 2HG2 VAL 78 3.963 -2.350 -2.105 658 3HG2 VAL 78 3HG2 VAL 78 2.299 -1.834 -1.743 659 H ILE 79 H ILE 79 -0.062 -1.728 -1.714 660 HA ILE 79 HA ILE 79 -1.574 -1.377 -4.198 661 HB ILE 79 HB ILE 79 -2.056 -0.793 -1.360 662 1HG1 ILE 79 1HG1 ILE 79 -3.589 -1.611 -3.793 663 2HG1 ILE 79 2HG1 ILE 79 -3.507 -2.363 -2.212 664 1HG2 ILE 79 1HG2 ILE 79 -3.409 1.185 -1.732 665 2HG2 ILE 79 2HG2 ILE 79 -1.723 1.496 -2.208 666 3HG2 ILE 79 3HG2 ILE 79 -2.959 1.202 -3.454 667 1HD1 ILE 79 1HD1 ILE 79 -4.770 -0.356 -1.275 668 2HD1 ILE 79 2HD1 ILE 79 -5.000 0.190 -2.953 669 3HD1 ILE 79 3HD1 ILE 79 -5.699 -1.357 -2.417 670 H ILE 80 H ILE 80 -1.389 0.526 -5.428 671 HA ILE 80 HA ILE 80 0.985 2.108 -4.744 672 HB ILE 80 HB ILE 80 1.355 2.443 -7.027 673 1HG1 ILE 80 1HG1 ILE 80 -0.291 1.534 -8.762 674 2HG1 ILE 80 2HG1 ILE 80 -1.461 1.433 -7.462 675 1HG2 ILE 80 1HG2 ILE 80 0.635 -0.232 -7.687 676 2HG2 ILE 80 2HG2 ILE 80 2.224 0.414 -7.213 677 3HG2 ILE 80 3HG2 ILE 80 1.103 -0.191 -5.970 678 1HD1 ILE 80 1HD1 ILE 80 -1.037 3.677 -9.003 679 2HD1 ILE 80 2HD1 ILE 80 -1.756 3.701 -7.375 680 3HD1 ILE 80 3HD1 ILE 80 -0.019 4.029 -7.585 681 H MET 81 H MET 81 0.901 4.436 -5.110 682 HA MET 81 HA MET 81 -1.785 5.483 -5.371 683 1HB MET 81 1HB MET 81 -0.607 7.082 -3.363 684 2HB MET 81 2HB MET 81 -1.868 5.892 -3.109 685 1HG MET 81 1HG MET 81 -0.178 4.129 -2.699 686 2HG MET 81 2HG MET 81 1.120 5.246 -3.070 687 1HE MET 81 1HE MET 81 2.493 5.739 -1.163 688 2HE MET 81 2HE MET 81 1.973 5.611 0.534 689 3HE MET 81 3HE MET 81 1.882 4.190 -0.534 690 H THR 82 H THR 82 -1.865 7.425 -6.505 691 HA THR 82 HA THR 82 0.065 9.375 -6.576 692 HB THR 82 HB THR 82 1.720 7.964 -7.538 693 HG1 THR 82 HG1 THR 82 0.122 8.856 -9.823 694 1HG2 THR 82 1HG2 THR 82 0.610 5.916 -8.084 695 2HG2 THR 82 2HG2 THR 82 -0.621 6.749 -9.063 696 3HG2 THR 82 3HG2 THR 82 1.044 6.591 -9.673 697 H ALA 83 H ALA 83 -0.568 11.135 -7.831 698 HA ALA 83 HA ALA 83 -3.264 11.248 -8.464 699 1HB ALA 83 1HB ALA 83 -1.743 13.181 -9.974 700 2HB ALA 83 2HB ALA 83 -2.719 13.426 -8.506 701 3HB ALA 83 3HB ALA 83 -1.002 12.975 -8.369 702 H TYR 84 H TYR 84 -4.286 11.607 -10.613 703 HA TYR 84 HA TYR 84 -3.370 9.593 -12.446 704 1HB TYR 84 1HB TYR 84 -5.512 10.450 -13.621 705 2HB TYR 84 2HB TYR 84 -5.770 9.901 -11.977 706 HD1 TYR 84 HD1 TYR 84 -6.346 11.463 -10.201 707 HD2 TYR 84 HD2 TYR 84 -5.580 12.854 -14.174 708 HE1 TYR 84 HE1 TYR 84 -7.364 13.718 -9.615 709 HE2 TYR 84 HE2 TYR 84 -6.600 15.104 -13.575 710 HH TYR 84 HH TYR 84 -6.861 16.304 -10.888 711 H GLY 85 H GLY 85 -1.349 11.503 -12.285 712 1HA GLY 85 1HA GLY 85 -1.716 13.176 -14.686 713 2HA GLY 85 2HA GLY 85 -0.551 13.441 -13.404 714 H GLU 86 H GLU 86 -0.155 10.307 -13.404 715 HA GLU 86 HA GLU 86 1.458 10.238 -15.830 716 1HB GLU 86 1HB GLU 86 3.050 8.778 -14.286 717 2HB GLU 86 2HB GLU 86 3.172 10.526 -14.291 718 1HG GLU 86 1HG GLU 86 1.792 10.692 -12.268 719 2HG GLU 86 2HG GLU 86 1.441 8.976 -12.311 720 H LEU 87 H LEU 87 -0.990 9.205 -16.071 721 HA LEU 87 HA LEU 87 -1.654 6.788 -15.068 722 1HB LEU 87 1HB LEU 87 -1.977 7.717 -17.925 723 2HB LEU 87 2HB LEU 87 -2.871 6.414 -17.169 724 HG LEU 87 HG LEU 87 -2.964 9.136 -15.916 725 1HD1 LEU 87 1HD1 LEU 87 -3.984 8.451 -18.602 726 2HD1 LEU 87 2HD1 LEU 87 -5.155 9.231 -17.512 727 3HD1 LEU 87 3HD1 LEU 87 -3.607 10.032 -17.876 728 1HD2 LEU 87 1HD2 LEU 87 -5.487 8.038 -15.894 729 2HD2 LEU 87 2HD2 LEU 87 -4.436 6.607 -15.761 730 3HD2 LEU 87 3HD2 LEU 87 -4.290 7.931 -14.581 731 H ASP 88 H ASP 88 0.816 7.525 -17.557 732 HA ASP 88 HA ASP 88 1.268 5.115 -18.608 733 1HB ASP 88 1HB ASP 88 2.754 7.552 -18.201 734 2HB ASP 88 2HB ASP 88 3.840 6.218 -17.869 735 H MET 89 H MET 89 2.463 6.416 -15.438 736 HA MET 89 HA MET 89 3.901 4.070 -14.819 737 1HB MET 89 1HB MET 89 4.552 6.209 -13.824 738 2HB MET 89 2HB MET 89 2.933 6.494 -13.217 739 1HG MET 89 1HG MET 89 4.145 5.755 -11.303 740 2HG MET 89 2HG MET 89 3.242 4.339 -11.803 741 1HE MET 89 1HE MET 89 5.526 3.270 -10.071 742 2HE MET 89 2HE MET 89 7.161 3.779 -10.559 743 3HE MET 89 3HE MET 89 5.944 5.000 -10.118 744 H ILE 90 H ILE 90 0.814 5.516 -13.545 745 HA ILE 90 HA ILE 90 0.164 3.525 -11.784 746 HB ILE 90 HB ILE 90 -1.602 5.271 -13.499 747 1HG1 ILE 90 1HG1 ILE 90 -1.448 5.894 -10.666 748 2HG1 ILE 90 2HG1 ILE 90 0.148 5.897 -11.391 749 1HG2 ILE 90 1HG2 ILE 90 -3.124 4.748 -11.342 750 2HG2 ILE 90 2HG2 ILE 90 -3.210 3.819 -12.858 751 3HG2 ILE 90 3HG2 ILE 90 -2.264 3.196 -11.485 752 1HD1 ILE 90 1HD1 ILE 90 -1.621 8.008 -11.506 753 2HD1 ILE 90 2HD1 ILE 90 -0.288 7.752 -12.658 754 3HD1 ILE 90 3HD1 ILE 90 -1.933 7.204 -13.063 755 H GLN 91 H GLN 91 -0.400 3.690 -15.341 756 HA GLN 91 HA GLN 91 -1.993 1.508 -15.594 757 1HB GLN 91 1HB GLN 91 -0.033 2.933 -17.345 758 2HB GLN 91 2HB GLN 91 -0.496 1.327 -17.872 759 1HG GLN 91 1HG GLN 91 -2.870 2.754 -16.990 760 2HG GLN 91 2HG GLN 91 -1.992 3.757 -18.128 761 1HE2 GLN 91 1HE2 GLN 91 -4.518 2.038 -18.160 762 2HE2 GLN 91 2HE2 GLN 91 -4.410 1.111 -19.620 763 H GLU 92 H GLU 92 1.639 1.586 -15.831 764 HA GLU 92 HA GLU 92 1.975 -1.107 -16.137 765 1HB GLU 92 1HB GLU 92 3.619 1.209 -15.540 766 2HB GLU 92 2HB GLU 92 4.161 -0.145 -14.570 767 1HG GLU 92 1HG GLU 92 4.929 -1.315 -16.390 768 2HG GLU 92 2HG GLU 92 3.548 -0.883 -17.378 769 H SER 93 H SER 93 1.516 0.849 -13.163 770 HA SER 93 HA SER 93 2.258 -1.014 -11.315 771 1HB SER 93 1HB SER 93 1.231 0.375 -9.749 772 2HB SER 93 2HB SER 93 1.425 1.480 -11.095 773 HG SER 93 HG SER 93 -0.972 0.023 -10.373 774 H LYS 94 H LYS 94 -0.796 -0.657 -13.169 775 HA LYS 94 HA LYS 94 -2.225 -2.590 -11.674 776 1HB LYS 94 1HB LYS 94 -2.805 -0.683 -13.624 777 2HB LYS 94 2HB LYS 94 -3.109 -2.207 -14.432 778 1HG LYS 94 1HG LYS 94 -4.219 -2.617 -11.892 779 2HG LYS 94 2HG LYS 94 -4.586 -0.933 -12.210 780 1HD LYS 94 1HD LYS 94 -5.103 -2.345 -14.648 781 2HD LYS 94 2HD LYS 94 -5.803 -3.309 -13.362 782 1HE LYS 94 1HE LYS 94 -6.827 -1.065 -12.491 783 2HE LYS 94 2HE LYS 94 -6.403 -0.408 -14.059 784 1HZ LYS 94 1HZ LYS 94 -7.987 -1.601 -15.050 785 2HZ LYS 94 2HZ LYS 94 -7.769 -2.931 -14.128 786 3HZ LYS 94 3HZ LYS 94 -8.659 -1.682 -13.564 787 H GLU 95 H GLU 95 -0.523 -2.666 -14.880 788 HA GLU 95 HA GLU 95 -0.995 -5.393 -15.236 789 1HB GLU 95 1HB GLU 95 0.238 -5.164 -17.205 790 2HB GLU 95 2HB GLU 95 -0.276 -3.512 -16.932 791 1HG GLU 95 1HG GLU 95 1.925 -2.949 -17.058 792 2HG GLU 95 2HG GLU 95 2.085 -3.639 -15.455 793 H LEU 96 H LEU 96 1.014 -3.735 -13.037 794 HA LEU 96 HA LEU 96 3.172 -5.621 -13.042 795 1HB LEU 96 1HB LEU 96 2.558 -3.054 -11.882 796 2HB LEU 96 2HB LEU 96 3.145 -4.148 -10.645 797 HG LEU 96 HG LEU 96 5.075 -4.648 -12.326 798 1HD1 LEU 96 1HD1 LEU 96 3.888 -3.376 -14.178 799 2HD1 LEU 96 2HD1 LEU 96 4.361 -1.888 -13.324 800 3HD1 LEU 96 3HD1 LEU 96 5.610 -3.003 -13.928 801 1HD2 LEU 96 1HD2 LEU 96 5.649 -3.665 -10.292 802 2HD2 LEU 96 2HD2 LEU 96 6.262 -2.514 -11.503 803 3HD2 LEU 96 3HD2 LEU 96 4.743 -2.173 -10.641 804 H GLY 97 H GLY 97 -0.057 -5.468 -11.789 805 1HA GLY 97 1HA GLY 97 -1.032 -7.441 -10.921 806 2HA GLY 97 2HA GLY 97 0.497 -7.875 -10.182 807 H ALA 98 H ALA 98 -0.622 -4.508 -10.076 808 HA ALA 98 HA ALA 98 -0.617 -4.603 -7.213 809 1HB ALA 98 1HB ALA 98 -1.088 -2.168 -7.459 810 2HB ALA 98 2HB ALA 98 0.312 -2.691 -8.426 811 3HB ALA 98 3HB ALA 98 -1.256 -2.399 -9.215 812 H LEU 99 H LEU 99 -2.405 -4.266 -5.812 813 HA LEU 99 HA LEU 99 -4.766 -5.504 -6.592 814 1HB LEU 99 1HB LEU 99 -4.559 -3.557 -4.312 815 2HB LEU 99 2HB LEU 99 -5.565 -4.985 -4.450 816 HG LEU 99 HG LEU 99 -3.970 -5.737 -2.995 817 1HD1 LEU 99 1HD1 LEU 99 -2.810 -6.349 -5.724 818 2HD1 LEU 99 2HD1 LEU 99 -2.308 -7.146 -4.214 819 3HD1 LEU 99 3HD1 LEU 99 -3.981 -7.316 -4.796 820 1HD2 LEU 99 1HD2 LEU 99 -2.270 -4.406 -2.491 821 2HD2 LEU 99 2HD2 LEU 99 -1.409 -5.013 -3.925 822 3HD2 LEU 99 3HD2 LEU 99 -2.419 -3.552 -4.046 823 H THR 100 H THR 100 -4.000 -1.985 -6.143 824 HA THR 100 HA THR 100 -5.673 -1.265 -8.317 825 HB THR 100 HB THR 100 -7.513 -1.720 -6.789 826 HG1 THR 100 HG1 THR 100 -7.896 0.286 -7.754 827 1HG2 THR 100 1HG2 THR 100 -6.161 -1.646 -4.635 828 2HG2 THR 100 2HG2 THR 100 -6.092 0.125 -4.800 829 3HG2 THR 100 3HG2 THR 100 -7.658 -0.687 -4.561 830 H HIS 101 H HIS 101 -5.591 1.033 -8.782 831 HA HIS 101 HA HIS 101 -3.284 2.232 -7.438 832 1HB HIS 101 1HB HIS 101 -3.288 3.633 -9.645 833 2HB HIS 101 2HB HIS 101 -2.586 2.027 -9.607 834 HD1 HIS 101 HD1 HIS 101 -2.998 1.501 -12.087 835 HD2 HIS 101 HD2 HIS 101 -6.487 2.510 -9.988 836 HE1 HIS 101 HE1 HIS 101 -4.949 0.947 -13.635 837 H PHE 102 H PHE 102 -3.710 3.918 -6.111 838 HA PHE 102 HA PHE 102 -6.277 5.274 -6.497 839 1HB PHE 102 1HB PHE 102 -4.297 5.091 -4.147 840 2HB PHE 102 2HB PHE 102 -5.829 5.938 -4.073 841 HD1 PHE 102 HD1 PHE 102 -7.210 3.670 -5.825 842 HD2 PHE 102 HD2 PHE 102 -4.930 3.699 -2.246 843 HE1 PHE 102 HE1 PHE 102 -8.342 1.556 -5.087 844 HE2 PHE 102 HE2 PHE 102 -6.063 1.584 -1.507 845 HZ PHE 102 HZ PHE 102 -7.755 0.538 -2.936 846 H ALA 103 H ALA 103 -6.353 7.638 -6.151 847 HA ALA 103 HA ALA 103 -3.802 8.876 -6.927 848 1HB ALA 103 1HB ALA 103 -5.054 10.447 -8.211 849 2HB ALA 103 2HB ALA 103 -5.757 8.856 -8.585 850 3HB ALA 103 3HB ALA 103 -6.589 9.954 -7.459 851 H LYS 104 H LYS 104 -3.234 10.892 -5.927 852 HA LYS 104 HA LYS 104 -3.304 11.153 -3.343 853 1HB LYS 104 1HB LYS 104 -3.089 13.018 -5.552 854 2HB LYS 104 2HB LYS 104 -3.821 13.798 -4.164 855 1HG LYS 104 1HG LYS 104 -1.826 12.432 -2.895 856 2HG LYS 104 2HG LYS 104 -1.071 12.637 -4.463 857 1HD LYS 104 1HD LYS 104 -2.282 14.914 -2.824 858 2HD LYS 104 2HD LYS 104 -0.575 14.517 -2.853 859 1HE LYS 104 1HE LYS 104 -0.362 15.865 -4.667 860 2HE LYS 104 2HE LYS 104 -1.286 14.691 -5.583 861 1HZ LYS 104 1HZ LYS 104 -3.133 15.930 -5.428 862 2HZ LYS 104 2HZ LYS 104 -2.808 16.499 -3.932 863 3HZ LYS 104 3HZ LYS 104 -2.076 17.159 -5.234 864 HA PRO 105 HA PRO 105 -7.624 13.007 -3.101 865 1HB PRO 105 1HB PRO 105 -9.135 13.381 -5.347 866 2HB PRO 105 2HB PRO 105 -8.141 14.639 -4.640 867 1HG PRO 105 1HG PRO 105 -7.647 13.034 -7.073 868 2HG PRO 105 2HG PRO 105 -6.911 14.549 -6.590 869 1HD PRO 105 1HD PRO 105 -5.730 11.940 -6.430 870 2HD PRO 105 2HD PRO 105 -5.041 13.440 -5.841 871 H PHE 106 H PHE 106 -7.865 11.016 -2.027 872 HA PHE 106 HA PHE 106 -9.590 9.226 -3.591 873 1HB PHE 106 1HB PHE 106 -8.504 7.637 -1.640 874 2HB PHE 106 2HB PHE 106 -7.716 7.867 -3.189 875 HD1 PHE 106 HD1 PHE 106 -7.939 9.825 -0.006 876 HD2 PHE 106 HD2 PHE 106 -5.447 8.161 -3.011 877 HE1 PHE 106 HE1 PHE 106 -5.917 10.747 1.161 878 HE2 PHE 106 HE2 PHE 106 -3.425 9.083 -1.844 879 HZ PHE 106 HZ PHE 106 -3.684 10.364 0.228 880 H ASP 107 H ASP 107 -11.225 8.030 -2.335 881 HA ASP 107 HA ASP 107 -12.049 9.632 -0.057 882 1HB ASP 107 1HB ASP 107 -13.519 9.137 -2.198 883 2HB ASP 107 2HB ASP 107 -13.761 7.561 -1.470 884 H ILE 108 H ILE 108 -12.627 8.538 1.947 885 HA ILE 108 HA ILE 108 -11.253 6.062 2.340 886 HB ILE 108 HB ILE 108 -12.196 8.246 3.912 887 1HG1 ILE 108 1HG1 ILE 108 -9.924 7.462 3.962 888 2HG1 ILE 108 2HG1 ILE 108 -10.616 7.294 5.564 889 1HG2 ILE 108 1HG2 ILE 108 -14.137 6.892 4.469 890 2HG2 ILE 108 2HG2 ILE 108 -13.084 5.532 4.927 891 3HG2 ILE 108 3HG2 ILE 108 -13.053 7.039 5.874 892 1HD1 ILE 108 1HD1 ILE 108 -9.353 5.273 4.069 893 2HD1 ILE 108 2HD1 ILE 108 -10.306 5.047 5.555 894 3HD1 ILE 108 3HD1 ILE 108 -11.086 4.883 3.964 895 H ASP 109 H ASP 109 -14.560 7.133 1.680 896 HA ASP 109 HA ASP 109 -15.767 4.768 2.603 897 1HB ASP 109 1HB ASP 109 -17.084 6.801 2.383 898 2HB ASP 109 2HB ASP 109 -16.647 6.976 0.695 899 H GLU 110 H GLU 110 -14.725 6.097 -0.609 900 HA GLU 110 HA GLU 110 -15.666 3.929 -2.090 901 1HB GLU 110 1HB GLU 110 -14.712 5.004 -3.932 902 2HB GLU 110 2HB GLU 110 -14.924 6.344 -2.822 903 1HG GLU 110 1HG GLU 110 -12.552 6.098 -2.066 904 2HG GLU 110 2HG GLU 110 -12.338 4.752 -3.168 905 H ILE 111 H ILE 111 -12.709 4.533 -0.229 906 HA ILE 111 HA ILE 111 -11.142 2.531 -1.457 907 HB ILE 111 HB ILE 111 -11.000 4.253 0.953 908 1HG1 ILE 111 1HG1 ILE 111 -9.213 3.618 -1.401 909 2HG1 ILE 111 2HG1 ILE 111 -10.059 5.114 -1.057 910 1HG2 ILE 111 1HG2 ILE 111 -10.466 2.189 2.015 911 2HG2 ILE 111 2HG2 ILE 111 -9.428 1.685 0.660 912 3HG2 ILE 111 3HG2 ILE 111 -8.933 3.039 1.704 913 1HD1 ILE 111 1HD1 ILE 111 -8.663 5.194 1.141 914 2HD1 ILE 111 2HD1 ILE 111 -7.648 3.949 0.376 915 3HD1 ILE 111 3HD1 ILE 111 -7.821 5.548 -0.386 916 H ARG 112 H ARG 112 -13.762 2.526 0.886 917 HA ARG 112 HA ARG 112 -13.132 0.199 2.211 918 1HB ARG 112 1HB ARG 112 -15.863 1.382 1.497 919 2HB ARG 112 2HB ARG 112 -15.637 0.089 2.658 920 1HG ARG 112 1HG ARG 112 -13.837 1.854 3.668 921 2HG ARG 112 2HG ARG 112 -14.909 2.997 2.884 922 1HD ARG 112 1HD ARG 112 -16.376 0.919 4.400 923 2HD ARG 112 2HD ARG 112 -15.300 1.860 5.414 924 HE ARG 112 HE ARG 112 -16.886 3.517 3.594 925 1HH1 ARG 112 1HH1 ARG 112 -16.855 1.906 6.723 926 2HH1 ARG 112 2HH1 ARG 112 -18.053 2.947 7.414 927 1HH2 ARG 112 1HH2 ARG 112 -18.467 4.891 4.506 928 2HH2 ARG 112 2HH2 ARG 112 -18.977 4.657 6.145 929 H ASP 113 H ASP 113 -14.316 0.798 -1.049 930 HA ASP 113 HA ASP 113 -15.485 -1.741 -1.406 931 1HB ASP 113 1HB ASP 113 -15.284 0.698 -2.845 932 2HB ASP 113 2HB ASP 113 -14.490 -0.486 -3.864 933 H ALA 114 H ALA 114 -12.443 -0.119 -2.605 934 HA ALA 114 HA ALA 114 -11.347 -2.336 -3.851 935 1HB ALA 114 1HB ALA 114 -9.822 -0.771 -4.371 936 2HB ALA 114 2HB ALA 114 -10.655 0.355 -3.272 937 3HB ALA 114 3HB ALA 114 -9.314 -0.649 -2.669 938 H VAL 115 H VAL 115 -11.497 -1.377 -0.426 939 HA VAL 115 HA VAL 115 -9.449 -2.939 0.572 940 HB VAL 115 HB VAL 115 -12.060 -1.918 1.641 941 1HG1 VAL 115 1HG1 VAL 115 -10.278 -3.969 2.881 942 2HG1 VAL 115 2HG1 VAL 115 -10.908 -2.678 3.931 943 3HG1 VAL 115 3HG1 VAL 115 -12.034 -3.728 3.038 944 1HG2 VAL 115 1HG2 VAL 115 -9.431 -0.892 1.377 945 2HG2 VAL 115 2HG2 VAL 115 -10.829 -0.140 2.181 946 3HG2 VAL 115 3HG2 VAL 115 -9.708 -1.159 3.115 947 H LYS 116 H LYS 116 -12.845 -3.773 -0.292 948 HA LYS 116 HA LYS 116 -13.000 -6.270 0.794 949 1HB LYS 116 1HB LYS 116 -14.638 -4.762 -0.683 950 2HB LYS 116 2HB LYS 116 -14.102 -5.845 -1.951 951 1HG LYS 116 1HG LYS 116 -14.879 -7.796 -0.762 952 2HG LYS 116 2HG LYS 116 -15.075 -6.903 0.733 953 1HD LYS 116 1HD LYS 116 -17.173 -6.237 0.164 954 2HD LYS 116 2HD LYS 116 -16.637 -5.652 -1.399 955 1HE LYS 116 1HE LYS 116 -16.587 -8.159 -2.124 956 2HE LYS 116 2HE LYS 116 -17.502 -8.477 -0.663 957 1HZ LYS 116 1HZ LYS 116 -19.075 -8.105 -2.292 958 2HZ LYS 116 2HZ LYS 116 -19.033 -6.675 -1.505 959 3HZ LYS 116 3HZ LYS 116 -18.287 -6.833 -2.949 960 H LYS 117 H LYS 117 -10.937 -5.120 -1.798 961 HA LYS 117 HA LYS 117 -10.210 -7.905 -2.381 962 1HB LYS 117 1HB LYS 117 -9.522 -7.208 -4.552 963 2HB LYS 117 2HB LYS 117 -11.129 -6.564 -4.283 964 1HG LYS 117 1HG LYS 117 -10.378 -4.357 -4.102 965 2HG LYS 117 2HG LYS 117 -8.802 -4.824 -3.494 966 1HD LYS 117 1HD LYS 117 -7.938 -4.679 -5.582 967 2HD LYS 117 2HD LYS 117 -9.032 -5.932 -6.133 968 1HE LYS 117 1HE LYS 117 -10.642 -3.601 -5.917 969 2HE LYS 117 2HE LYS 117 -9.137 -3.046 -6.621 970 1HZ LYS 117 1HZ LYS 117 -9.371 -4.501 -8.387 971 2HZ LYS 117 2HZ LYS 117 -10.479 -5.437 -7.637 972 3HZ LYS 117 3HZ LYS 117 -10.891 -3.947 -8.164 973 H TYR 118 H TYR 118 -9.169 -4.720 -1.235 974 HA TYR 118 HA TYR 118 -6.385 -5.287 -1.385 975 1HB TYR 118 1HB TYR 118 -6.529 -3.005 -0.971 976 2HB TYR 118 2HB TYR 118 -8.257 -3.172 -0.739 977 HD1 TYR 118 HD1 TYR 118 -8.761 -4.409 1.714 978 HD2 TYR 118 HD2 TYR 118 -5.456 -1.875 0.735 979 HE1 TYR 118 HE1 TYR 118 -8.482 -3.812 4.169 980 HE2 TYR 118 HE2 TYR 118 -5.188 -1.286 3.194 981 HH TYR 118 HH TYR 118 -6.966 -1.265 5.242 982 H LEU 119 H LEU 119 -8.981 -6.117 0.829 983 HA LEU 119 HA LEU 119 -7.574 -7.952 2.241 984 1HB LEU 119 1HB LEU 119 -6.612 -5.416 2.937 985 2HB LEU 119 2HB LEU 119 -7.653 -5.886 4.267 986 HG LEU 119 HG LEU 119 -5.043 -6.514 4.113 987 1HD1 LEU 119 1HD1 LEU 119 -6.094 -8.706 5.482 988 2HD1 LEU 119 2HD1 LEU 119 -5.683 -7.111 6.156 989 3HD1 LEU 119 3HD1 LEU 119 -7.345 -7.447 5.614 990 1HD2 LEU 119 1HD2 LEU 119 -5.646 -7.938 2.038 991 2HD2 LEU 119 2HD2 LEU 119 -4.568 -8.627 3.275 992 3HD2 LEU 119 3HD2 LEU 119 -6.281 -9.107 3.221 993 HA PRO 120 HA PRO 120 -11.657 -8.400 3.577 994 1HB PRO 120 1HB PRO 120 -11.368 -10.435 5.378 995 2HB PRO 120 2HB PRO 120 -11.451 -10.692 3.646 996 1HG PRO 120 1HG PRO 120 -9.093 -10.805 5.426 997 2HG PRO 120 2HG PRO 120 -9.283 -11.460 3.811 998 1HD PRO 120 1HD PRO 120 -7.860 -9.079 4.541 999 2HD PRO 120 2HD PRO 120 -8.148 -9.671 2.917 1000 H LEU 121 H LEU 121 -10.896 -6.094 4.506 1001 HA LEU 121 HA LEU 121 -11.046 -6.244 7.402 1002 1HB LEU 121 1HB LEU 121 -9.360 -4.817 6.582 1003 2HB LEU 121 2HB LEU 121 -10.436 -4.061 5.425 1004 HG LEU 121 HG LEU 121 -11.723 -3.091 7.364 1005 1HD1 LEU 121 1HD1 LEU 121 -9.375 -3.576 9.140 1006 2HD1 LEU 121 2HD1 LEU 121 -11.087 -3.298 9.543 1007 3HD1 LEU 121 3HD1 LEU 121 -10.562 -4.887 8.935 1008 1HD2 LEU 121 1HD2 LEU 121 -9.964 -1.364 7.886 1009 2HD2 LEU 121 2HD2 LEU 121 -8.820 -2.351 6.944 1010 3HD2 LEU 121 3HD2 LEU 121 -10.259 -1.661 6.156 1011 H LYS 122 H LYS 122 -12.554 -4.585 8.498 1012 HA LYS 122 HA LYS 122 -15.126 -5.266 8.153 1013 1HB LYS 122 1HB LYS 122 -14.375 -4.039 10.078 1014 2HB LYS 122 2HB LYS 122 -13.961 -2.639 9.108 1015 1HG LYS 122 1HG LYS 122 -16.063 -2.019 9.949 1016 2HG LYS 122 2HG LYS 122 -16.495 -2.677 8.383 1017 1HD LYS 122 1HD LYS 122 -16.646 -4.973 9.786 1018 2HD LYS 122 2HD LYS 122 -16.899 -3.869 11.124 1019 1HE LYS 122 1HE LYS 122 -18.593 -2.784 9.226 1020 2HE LYS 122 2HE LYS 122 -18.680 -4.485 8.812 1021 1HZ LYS 122 1HZ LYS 122 -19.097 -3.411 11.516 1022 2HZ LYS 122 2HZ LYS 122 -20.290 -3.844 10.488 1023 3HZ LYS 122 3HZ LYS 122 -19.263 -4.973 11.069 1024 H SER 123 H SER 123 -16.574 -5.140 6.530 1025 HA SER 123 HA SER 123 -15.991 -3.261 4.418 1026 1HB SER 123 1HB SER 123 -18.156 -5.403 4.491 1027 2HB SER 123 2HB SER 123 -17.553 -4.564 3.076 1028 HG SER 123 HG SER 123 -16.421 -6.452 3.019 1029 H ASN 124 H ASN 124 -17.518 -1.665 3.694 1030 HA ASN 124 HA ASN 124 -18.797 -0.232 5.499 1031 1HB ASN 124 1HB ASN 124 -18.626 0.597 3.235 1032 2HB ASN 124 2HB ASN 124 -19.522 -0.762 2.584 1033 1HD2 ASN 124 1HD2 ASN 124 -19.860 1.843 4.989 1034 2HD2 ASN 124 2HD2 ASN 124 -21.503 2.259 4.635 Start of MODEL 11 1 1H MET 1 1H MET 1 -9.101 -14.347 17.120 2 HA MET 1 HA MET 1 -10.885 -12.916 18.151 3 1HB MET 1 1HB MET 1 -8.489 -12.613 20.004 4 2HB MET 1 2HB MET 1 -9.585 -11.260 19.811 5 1HG MET 1 1HG MET 1 -11.511 -12.778 20.441 6 2HG MET 1 2HG MET 1 -10.364 -14.073 20.721 7 1HE MET 1 1HE MET 1 -11.154 -13.244 24.367 8 2HE MET 1 2HE MET 1 -12.018 -13.784 22.907 9 3HE MET 1 3HE MET 1 -10.459 -14.524 23.344 10 H MET 2 H MET 2 -10.638 -12.311 15.902 11 HA MET 2 HA MET 2 -10.021 -11.059 14.233 12 1HB MET 2 1HB MET 2 -9.377 -9.223 16.591 13 2HB MET 2 2HB MET 2 -9.174 -8.664 14.943 14 1HG MET 2 1HG MET 2 -11.798 -9.881 15.908 15 2HG MET 2 2HG MET 2 -11.453 -8.172 16.089 16 1HE MET 2 1HE MET 2 -13.965 -9.496 13.981 17 2HE MET 2 2HE MET 2 -13.645 -8.042 14.956 18 3HE MET 2 3HE MET 2 -13.835 -7.906 13.192 19 H ASN 3 H ASN 3 -8.111 -9.775 13.142 20 HA ASN 3 HA ASN 3 -5.587 -9.808 14.096 21 1HB ASN 3 1HB ASN 3 -4.644 -11.854 12.819 22 2HB ASN 3 2HB ASN 3 -5.510 -12.205 14.302 23 1HD2 ASN 3 1HD2 ASN 3 -5.026 -13.848 11.935 24 2HD2 ASN 3 2HD2 ASN 3 -6.569 -14.362 11.339 25 H GLU 4 H GLU 4 -4.263 -8.782 12.500 26 HA GLU 4 HA GLU 4 -4.577 -9.161 9.781 27 1HB GLU 4 1HB GLU 4 -6.610 -7.493 10.836 28 2HB GLU 4 2HB GLU 4 -5.474 -6.395 10.078 29 1HG GLU 4 1HG GLU 4 -5.923 -7.172 7.956 30 2HG GLU 4 2HG GLU 4 -6.066 -8.838 8.479 31 H LYS 5 H LYS 5 -3.069 -7.789 8.532 32 HA LYS 5 HA LYS 5 -1.384 -6.069 10.178 33 1HB LYS 5 1HB LYS 5 -0.468 -8.529 8.685 34 2HB LYS 5 2HB LYS 5 0.623 -7.199 9.018 35 1HG LYS 5 1HG LYS 5 0.754 -7.696 11.252 36 2HG LYS 5 2HG LYS 5 -0.964 -8.012 11.384 37 1HD LYS 5 1HD LYS 5 -0.454 -10.221 11.497 38 2HD LYS 5 2HD LYS 5 -0.038 -10.137 9.796 39 1HE LYS 5 1HE LYS 5 2.146 -10.508 10.278 40 2HE LYS 5 2HE LYS 5 2.192 -9.079 11.292 41 1HZ LYS 5 1HZ LYS 5 2.689 -10.863 12.670 42 2HZ LYS 5 2HZ LYS 5 1.132 -10.523 13.028 43 3HZ LYS 5 3HZ LYS 5 1.491 -11.808 12.087 44 H ILE 6 H ILE 6 -0.282 -4.431 8.975 45 HA ILE 6 HA ILE 6 -0.696 -4.366 6.123 46 HB ILE 6 HB ILE 6 -2.502 -3.041 7.921 47 1HG1 ILE 6 1HG1 ILE 6 -3.052 -2.379 5.227 48 2HG1 ILE 6 2HG1 ILE 6 -2.348 -3.983 5.195 49 1HG2 ILE 6 1HG2 ILE 6 -0.995 -1.196 6.047 50 2HG2 ILE 6 2HG2 ILE 6 -2.440 -0.787 7.002 51 3HG2 ILE 6 3HG2 ILE 6 -0.910 -1.175 7.824 52 1HD1 ILE 6 1HD1 ILE 6 -4.966 -3.614 5.636 53 2HD1 ILE 6 2HD1 ILE 6 -4.073 -4.929 6.437 54 3HD1 ILE 6 3HD1 ILE 6 -4.410 -3.418 7.315 55 H LEU 7 H LEU 7 0.668 -2.779 5.078 56 HA LEU 7 HA LEU 7 2.679 -1.665 6.908 57 1HB LEU 7 1HB LEU 7 3.104 -3.733 5.180 58 2HB LEU 7 2HB LEU 7 3.547 -2.361 4.183 59 HG LEU 7 HG LEU 7 4.943 -1.690 6.357 60 1HD1 LEU 7 1HD1 LEU 7 3.971 -3.823 7.480 61 2HD1 LEU 7 2HD1 LEU 7 5.205 -4.679 6.525 62 3HD1 LEU 7 3HD1 LEU 7 5.693 -3.426 7.692 63 1HD2 LEU 7 1HD2 LEU 7 6.413 -3.767 4.940 64 2HD2 LEU 7 2HD2 LEU 7 5.507 -2.705 3.836 65 3HD2 LEU 7 3HD2 LEU 7 6.670 -2.006 4.988 66 H ILE 8 H ILE 8 3.470 0.420 6.414 67 HA ILE 8 HA ILE 8 2.066 1.747 4.205 68 HB ILE 8 HB ILE 8 2.380 2.661 7.058 69 1HG1 ILE 8 1HG1 ILE 8 -0.148 2.751 5.444 70 2HG1 ILE 8 2HG1 ILE 8 0.392 1.216 6.093 71 1HG2 ILE 8 1HG2 ILE 8 1.022 4.631 5.543 72 2HG2 ILE 8 2HG2 ILE 8 2.575 4.768 6.401 73 3HG2 ILE 8 3HG2 ILE 8 2.543 4.271 4.692 74 1HD1 ILE 8 1HD1 ILE 8 -0.444 3.713 7.573 75 2HD1 ILE 8 2HD1 ILE 8 -0.925 2.022 7.854 76 3HD1 ILE 8 3HD1 ILE 8 0.691 2.582 8.348 77 H VAL 9 H VAL 9 3.579 2.253 2.717 78 HA VAL 9 HA VAL 9 6.184 3.141 3.750 79 HB VAL 9 HB VAL 9 5.634 1.918 1.048 80 1HG1 VAL 9 1HG1 VAL 9 7.734 3.335 1.567 81 2HG1 VAL 9 2HG1 VAL 9 8.248 1.949 2.558 82 3HG1 VAL 9 3HG1 VAL 9 7.959 1.738 0.815 83 1HG2 VAL 9 1HG2 VAL 9 5.641 0.606 3.623 84 2HG2 VAL 9 2HG2 VAL 9 5.363 -0.079 2.004 85 3HG2 VAL 9 3HG2 VAL 9 7.019 0.048 2.644 86 H ASP 10 H ASP 10 6.936 5.138 3.115 87 HA ASP 10 HA ASP 10 6.752 7.207 2.459 88 1HB ASP 10 1HB ASP 10 5.768 5.973 -0.157 89 2HB ASP 10 2HB ASP 10 6.491 7.560 0.016 90 H ASP 11 H ASP 11 5.076 8.696 0.772 91 HA ASP 11 HA ASP 11 3.102 9.565 0.519 92 1HB ASP 11 1HB ASP 11 2.435 7.102 0.029 93 2HB ASP 11 2HB ASP 11 1.818 7.052 1.669 94 H GLN 12 H GLN 12 4.599 8.928 3.317 95 HA GLN 12 HA GLN 12 2.463 9.340 5.160 96 1HB GLN 12 1HB GLN 12 4.513 9.583 6.777 97 2HB GLN 12 2HB GLN 12 4.160 8.014 6.080 98 1HG GLN 12 1HG GLN 12 6.000 8.068 4.650 99 2HG GLN 12 2HG GLN 12 5.972 9.814 4.496 100 1HE2 GLN 12 1HE2 GLN 12 6.179 10.894 6.820 101 2HE2 GLN 12 2HE2 GLN 12 7.565 10.386 7.726 102 H TYR 13 H TYR 13 1.548 11.316 5.493 103 HA TYR 13 HA TYR 13 3.196 13.588 5.980 104 1HB TYR 13 1HB TYR 13 2.401 12.951 3.296 105 2HB TYR 13 2HB TYR 13 1.268 14.187 3.805 106 HD1 TYR 13 HD1 TYR 13 1.974 16.478 4.148 107 HD2 TYR 13 HD2 TYR 13 4.828 13.449 3.158 108 HE1 TYR 13 HE1 TYR 13 3.707 18.267 3.636 109 HE2 TYR 13 HE2 TYR 13 6.551 15.248 2.650 110 HH TYR 13 HH TYR 13 6.229 17.876 1.863 111 H GLY 14 H GLY 14 1.021 11.896 7.206 112 1HA GLY 14 1HA GLY 14 -0.411 12.849 8.864 113 2HA GLY 14 2HA GLY 14 -0.866 14.106 7.731 114 H ILE 15 H ILE 15 -0.675 11.511 5.727 115 HA ILE 15 HA ILE 15 -3.532 11.023 5.969 116 HB ILE 15 HB ILE 15 -1.484 10.708 3.807 117 1HG1 ILE 15 1HG1 ILE 15 -3.961 11.777 2.920 118 2HG1 ILE 15 2HG1 ILE 15 -3.604 12.545 4.454 119 1HG2 ILE 15 1HG2 ILE 15 -4.113 9.250 4.030 120 2HG2 ILE 15 2HG2 ILE 15 -3.401 9.665 2.452 121 3HG2 ILE 15 3HG2 ILE 15 -2.509 8.620 3.584 122 1HD1 ILE 15 1HD1 ILE 15 -2.064 12.640 1.874 123 2HD1 ILE 15 2HD1 ILE 15 -2.393 13.937 3.047 124 3HD1 ILE 15 3HD1 ILE 15 -1.138 12.723 3.392 125 H ARG 16 H ARG 16 -0.352 9.382 6.152 126 HA ARG 16 HA ARG 16 -1.192 6.809 6.116 127 1HB ARG 16 1HB ARG 16 0.832 6.489 7.792 128 2HB ARG 16 2HB ARG 16 1.146 7.084 6.174 129 1HG ARG 16 1HG ARG 16 1.520 9.291 6.900 130 2HG ARG 16 2HG ARG 16 0.538 9.100 8.339 131 1HD ARG 16 1HD ARG 16 2.872 7.272 8.284 132 2HD ARG 16 2HD ARG 16 3.328 8.963 8.249 133 HE ARG 16 HE ARG 16 1.911 7.567 10.441 134 1HH1 ARG 16 1HH1 ARG 16 3.009 10.631 9.103 135 2HH1 ARG 16 2HH1 ARG 16 2.895 11.476 10.611 136 1HH2 ARG 16 1HH2 ARG 16 1.760 8.682 12.430 137 2HH2 ARG 16 2HH2 ARG 16 2.180 10.360 12.516 138 H ILE 17 H ILE 17 -1.290 9.218 8.774 139 HA ILE 17 HA ILE 17 -1.921 7.401 10.824 140 HB ILE 17 HB ILE 17 -2.390 10.368 10.531 141 1HG1 ILE 17 1HG1 ILE 17 -0.312 9.180 12.317 142 2HG1 ILE 17 2HG1 ILE 17 -0.004 9.162 10.592 143 1HG2 ILE 17 1HG2 ILE 17 -3.058 10.522 12.729 144 2HG2 ILE 17 2HG2 ILE 17 -3.842 9.004 12.229 145 3HG2 ILE 17 3HG2 ILE 17 -2.336 8.957 13.176 146 1HD1 ILE 17 1HD1 ILE 17 0.132 11.398 12.441 147 2HD1 ILE 17 2HD1 ILE 17 0.639 11.326 10.736 148 3HD1 ILE 17 3HD1 ILE 17 -1.039 11.754 11.148 149 H LEU 18 H LEU 18 -3.928 9.435 8.608 150 HA LEU 18 HA LEU 18 -6.388 8.977 9.653 151 1HB LEU 18 1HB LEU 18 -5.564 10.326 7.594 152 2HB LEU 18 2HB LEU 18 -5.915 8.866 6.692 153 HG LEU 18 HG LEU 18 -8.071 9.886 8.477 154 1HD1 LEU 18 1HD1 LEU 18 -8.326 11.206 5.944 155 2HD1 LEU 18 2HD1 LEU 18 -8.294 11.901 7.583 156 3HD1 LEU 18 3HD1 LEU 18 -6.774 11.656 6.690 157 1HD2 LEU 18 1HD2 LEU 18 -8.808 8.039 7.353 158 2HD2 LEU 18 2HD2 LEU 18 -9.307 9.310 6.211 159 3HD2 LEU 18 3HD2 LEU 18 -7.821 8.377 5.911 160 H LEU 19 H LEU 19 -4.679 6.877 7.228 161 HA LEU 19 HA LEU 19 -6.684 4.862 7.460 162 1HB LEU 19 1HB LEU 19 -5.435 3.678 5.867 163 2HB LEU 19 2HB LEU 19 -5.355 5.370 5.415 164 HG LEU 19 HG LEU 19 -3.090 4.867 7.049 165 1HD1 LEU 19 1HD1 LEU 19 -2.001 3.002 6.164 166 2HD1 LEU 19 2HD1 LEU 19 -3.665 2.435 6.441 167 3HD1 LEU 19 3HD1 LEU 19 -3.134 2.866 4.797 168 1HD2 LEU 19 1HD2 LEU 19 -1.863 5.345 4.924 169 2HD2 LEU 19 2HD2 LEU 19 -3.426 5.317 4.074 170 3HD2 LEU 19 3HD2 LEU 19 -3.120 6.536 5.334 171 H ASN 20 H ASN 20 -3.905 5.825 9.299 172 HA ASN 20 HA ASN 20 -3.132 3.312 10.211 173 1HB ASN 20 1HB ASN 20 -1.821 5.487 10.438 174 2HB ASN 20 2HB ASN 20 -2.954 5.999 11.673 175 1HD2 ASN 20 1HD2 ASN 20 -0.498 5.986 12.477 176 2HD2 ASN 20 2HD2 ASN 20 -0.089 4.639 13.485 177 H GLU 21 H GLU 21 -5.023 5.986 11.835 178 HA GLU 21 HA GLU 21 -5.760 4.603 14.048 179 1HB GLU 21 1HB GLU 21 -6.126 7.001 13.830 180 2HB GLU 21 2HB GLU 21 -7.251 6.766 12.507 181 1HG GLU 21 1HG GLU 21 -8.908 5.772 13.945 182 2HG GLU 21 2HG GLU 21 -7.756 5.537 15.245 183 H VAL 22 H VAL 22 -6.772 4.116 10.753 184 HA VAL 22 HA VAL 22 -9.312 2.977 11.334 185 HB VAL 22 HB VAL 22 -7.475 2.926 8.938 186 1HG1 VAL 22 1HG1 VAL 22 -8.741 1.400 7.907 187 2HG1 VAL 22 2HG1 VAL 22 -9.508 1.073 9.480 188 3HG1 VAL 22 3HG1 VAL 22 -10.240 2.246 8.360 189 1HG2 VAL 22 1HG2 VAL 22 -9.390 4.814 9.976 190 2HG2 VAL 22 2HG2 VAL 22 -8.329 4.949 8.554 191 3HG2 VAL 22 3HG2 VAL 22 -9.939 4.207 8.395 192 H PHE 23 H PHE 23 -6.187 1.502 10.186 193 HA PHE 23 HA PHE 23 -7.072 -1.101 10.866 194 1HB PHE 23 1HB PHE 23 -4.943 -1.684 9.936 195 2HB PHE 23 2HB PHE 23 -5.274 -0.154 9.148 196 HD1 PHE 23 HD1 PHE 23 -3.684 -1.402 12.295 197 HD2 PHE 23 HD2 PHE 23 -3.574 1.396 9.105 198 HE1 PHE 23 HE1 PHE 23 -1.524 -0.478 13.179 199 HE2 PHE 23 HE2 PHE 23 -1.414 2.319 9.990 200 HZ PHE 23 HZ PHE 23 -0.415 1.371 12.016 201 H ASN 24 H ASN 24 -5.050 1.409 12.455 202 HA ASN 24 HA ASN 24 -3.979 -0.214 14.405 203 1HB ASN 24 1HB ASN 24 -3.638 2.378 13.735 204 2HB ASN 24 2HB ASN 24 -4.769 2.639 15.047 205 1HD2 ASN 24 1HD2 ASN 24 -3.713 3.255 16.768 206 2HD2 ASN 24 2HD2 ASN 24 -2.268 2.557 17.420 207 H LYS 25 H LYS 25 -7.145 1.395 14.018 208 HA LYS 25 HA LYS 25 -8.053 1.425 16.609 209 1HB LYS 25 1HB LYS 25 -9.199 1.522 13.915 210 2HB LYS 25 2HB LYS 25 -10.284 0.789 15.079 211 1HG LYS 25 1HG LYS 25 -10.120 2.732 16.562 212 2HG LYS 25 2HG LYS 25 -8.848 3.435 15.582 213 1HD LYS 25 1HD LYS 25 -10.377 4.430 14.238 214 2HD LYS 25 2HD LYS 25 -11.095 2.879 13.853 215 1HE LYS 25 1HE LYS 25 -12.446 2.999 15.975 216 2HE LYS 25 2HE LYS 25 -11.755 4.573 16.311 217 1HZ LYS 25 1HZ LYS 25 -13.948 4.510 15.124 218 2HZ LYS 25 2HZ LYS 25 -12.807 5.476 14.467 219 3HZ LYS 25 3HZ LYS 25 -13.139 4.027 13.790 220 H GLU 26 H GLU 26 -7.404 -1.295 14.474 221 HA GLU 26 HA GLU 26 -8.931 -3.049 16.183 222 1HB GLU 26 1HB GLU 26 -7.546 -3.340 13.511 223 2HB GLU 26 2HB GLU 26 -7.928 -4.777 14.439 224 1HG GLU 26 1HG GLU 26 -10.080 -2.689 14.023 225 2HG GLU 26 2HG GLU 26 -9.687 -3.775 12.705 226 H GLY 27 H GLY 27 -5.682 -1.861 15.700 227 1HA GLY 27 1HA GLY 27 -3.943 -2.147 17.179 228 2HA GLY 27 2HA GLY 27 -4.739 -3.542 17.880 229 H TYR 28 H TYR 28 -4.557 -3.311 14.359 230 HA TYR 28 HA TYR 28 -3.221 -5.773 14.153 231 1HB TYR 28 1HB TYR 28 -3.637 -3.386 12.245 232 2HB TYR 28 2HB TYR 28 -3.142 -4.978 11.704 233 HD1 TYR 28 HD1 TYR 28 -4.982 -6.582 13.584 234 HD2 TYR 28 HD2 TYR 28 -5.685 -3.219 11.034 235 HE1 TYR 28 HE1 TYR 28 -7.423 -7.257 13.354 236 HE2 TYR 28 HE2 TYR 28 -8.123 -3.905 10.812 237 HH TYR 28 HH TYR 28 -9.440 -5.942 10.993 238 H GLN 29 H GLN 29 -1.101 -6.273 13.347 239 HA GLN 29 HA GLN 29 0.832 -4.402 14.295 240 1HB GLN 29 1HB GLN 29 0.683 -7.228 13.917 241 2HB GLN 29 2HB GLN 29 1.994 -6.668 12.898 242 1HG GLN 29 1HG GLN 29 3.146 -5.647 14.756 243 2HG GLN 29 2HG GLN 29 1.740 -5.766 15.795 244 1HE2 GLN 29 1HE2 GLN 29 1.939 -7.231 17.290 245 2HE2 GLN 29 2HE2 GLN 29 2.714 -8.774 17.163 246 H THR 30 H THR 30 1.175 -2.635 12.978 247 HA THR 30 HA THR 30 1.717 -3.226 10.142 248 HB THR 30 HB THR 30 0.689 -1.063 9.631 249 HG1 THR 30 HG1 THR 30 0.323 -0.930 12.537 250 1HG2 THR 30 1HG2 THR 30 -1.099 -2.174 11.833 251 2HG2 THR 30 2HG2 THR 30 -1.583 -1.400 10.305 252 3HG2 THR 30 3HG2 THR 30 -0.901 -3.045 10.294 253 H PHE 31 H PHE 31 3.289 -1.790 9.084 254 HA PHE 31 HA PHE 31 5.119 -0.533 10.978 255 1HB PHE 31 1HB PHE 31 5.444 -3.066 9.618 256 2HB PHE 31 2HB PHE 31 6.495 -1.933 8.792 257 HD1 PHE 31 HD1 PHE 31 5.774 -3.516 12.040 258 HD2 PHE 31 HD2 PHE 31 8.485 -1.116 9.827 259 HE1 PHE 31 HE1 PHE 31 7.497 -3.799 13.844 260 HE2 PHE 31 HE2 PHE 31 10.208 -1.398 11.631 261 HZ PHE 31 HZ PHE 31 9.693 -2.736 13.618 262 H GLN 32 H GLN 32 6.774 0.862 9.821 263 HA GLN 32 HA GLN 32 5.624 1.812 7.313 264 1HB GLN 32 1HB GLN 32 5.158 3.645 8.627 265 2HB GLN 32 2HB GLN 32 6.413 3.272 9.792 266 1HG GLN 32 1HG GLN 32 8.123 4.263 8.468 267 2HG GLN 32 2HG GLN 32 7.178 4.165 6.996 268 1HE2 GLN 32 1HE2 GLN 32 6.168 5.902 6.328 269 2HE2 GLN 32 2HE2 GLN 32 5.792 7.315 7.257 270 H ALA 33 H ALA 33 7.111 2.478 5.661 271 HA ALA 33 HA ALA 33 9.922 1.866 6.252 272 1HB ALA 33 1HB ALA 33 9.424 -0.029 5.038 273 2HB ALA 33 2HB ALA 33 8.088 0.752 4.158 274 3HB ALA 33 3HB ALA 33 9.774 1.083 3.693 275 H ALA 34 H ALA 34 11.374 2.818 4.431 276 HA ALA 34 HA ALA 34 10.191 5.341 3.498 277 1HB ALA 34 1HB ALA 34 12.626 4.815 5.162 278 2HB ALA 34 2HB ALA 34 12.733 6.089 3.924 279 3HB ALA 34 3HB ALA 34 11.494 6.188 5.197 280 H ASN 35 H ASN 35 10.196 2.996 1.955 281 HA ASN 35 HA ASN 35 11.173 3.762 -0.372 282 1HB ASN 35 1HB ASN 35 13.409 2.902 1.325 283 2HB ASN 35 2HB ASN 35 13.292 1.869 -0.086 284 1HD2 ASN 35 1HD2 ASN 35 15.433 3.539 0.348 285 2HD2 ASN 35 2HD2 ASN 35 15.474 4.800 -0.838 286 H GLY 36 H GLY 36 11.995 1.476 -1.714 287 1HA GLY 36 1HA GLY 36 9.774 -0.332 -1.277 288 2HA GLY 36 2HA GLY 36 10.915 -0.331 -2.607 289 H LEU 37 H LEU 37 13.406 -0.475 -1.341 290 HA LEU 37 HA LEU 37 13.617 -3.184 -0.810 291 1HB LEU 37 1HB LEU 37 15.313 -1.024 -1.222 292 2HB LEU 37 2HB LEU 37 15.714 -1.563 0.396 293 HG LEU 37 HG LEU 37 15.623 -3.421 -1.992 294 1HD1 LEU 37 1HD1 LEU 37 17.399 -2.251 -2.724 295 2HD1 LEU 37 2HD1 LEU 37 17.700 -1.501 -1.138 296 3HD1 LEU 37 3HD1 LEU 37 18.269 -3.156 -1.463 297 1HD2 LEU 37 1HD2 LEU 37 17.407 -4.398 -0.098 298 2HD2 LEU 37 2HD2 LEU 37 16.043 -3.781 0.865 299 3HD2 LEU 37 3HD2 LEU 37 15.756 -4.985 -0.414 300 H GLN 38 H GLN 38 13.772 -0.392 1.515 301 HA GLN 38 HA GLN 38 13.945 -1.942 3.767 302 1HB GLN 38 1HB GLN 38 13.433 0.849 3.101 303 2HB GLN 38 2HB GLN 38 12.443 0.369 4.465 304 1HG GLN 38 1HG GLN 38 14.744 -0.763 5.288 305 2HG GLN 38 2HG GLN 38 15.449 0.446 4.233 306 1HE2 GLN 38 1HE2 GLN 38 16.097 2.129 5.319 307 2HE2 GLN 38 2HE2 GLN 38 15.284 2.917 6.630 308 H ALA 39 H ALA 39 11.218 -1.304 1.645 309 HA ALA 39 HA ALA 39 9.262 -2.071 3.624 310 1HB ALA 39 1HB ALA 39 9.009 -1.566 0.631 311 2HB ALA 39 2HB ALA 39 7.673 -1.686 1.801 312 3HB ALA 39 3HB ALA 39 8.821 -0.330 1.899 313 H LEU 40 H LEU 40 11.131 -3.478 0.932 314 HA LEU 40 HA LEU 40 9.597 -5.765 0.545 315 1HB LEU 40 1HB LEU 40 12.476 -5.051 0.095 316 2HB LEU 40 2HB LEU 40 11.914 -6.687 -0.189 317 HG LEU 40 HG LEU 40 11.039 -4.156 -1.592 318 1HD1 LEU 40 1HD1 LEU 40 12.796 -4.767 -2.850 319 2HD1 LEU 40 2HD1 LEU 40 12.802 -6.434 -2.227 320 3HD1 LEU 40 3HD1 LEU 40 11.668 -5.971 -3.518 321 1HD2 LEU 40 1HD2 LEU 40 9.687 -6.044 -2.941 322 2HD2 LEU 40 2HD2 LEU 40 9.616 -6.747 -1.307 323 3HD2 LEU 40 3HD2 LEU 40 8.986 -5.107 -1.599 324 H ASP 41 H ASP 41 12.280 -5.043 2.850 325 HA ASP 41 HA ASP 41 12.303 -7.651 3.878 326 1HB ASP 41 1HB ASP 41 14.158 -5.899 4.031 327 2HB ASP 41 2HB ASP 41 13.199 -5.069 5.240 328 H ILE 42 H ILE 42 11.082 -4.442 5.113 329 HA ILE 42 HA ILE 42 9.919 -5.417 7.437 330 HB ILE 42 HB ILE 42 9.394 -2.997 5.725 331 1HG1 ILE 42 1HG1 ILE 42 11.567 -3.473 7.147 332 2HG1 ILE 42 2HG1 ILE 42 10.851 -1.875 7.076 333 1HG2 ILE 42 1HG2 ILE 42 7.853 -4.029 8.030 334 2HG2 ILE 42 2HG2 ILE 42 8.317 -2.313 8.111 335 3HG2 ILE 42 3HG2 ILE 42 7.377 -2.916 6.725 336 1HD1 ILE 42 1HD1 ILE 42 11.424 -3.211 9.410 337 2HD1 ILE 42 2HD1 ILE 42 10.207 -1.919 9.273 338 3HD1 ILE 42 3HD1 ILE 42 9.707 -3.626 9.192 339 H VAL 43 H VAL 43 8.976 -5.711 4.080 340 HA VAL 43 HA VAL 43 6.213 -6.014 4.455 341 HB VAL 43 HB VAL 43 8.233 -6.516 2.363 342 1HG1 VAL 43 1HG1 VAL 43 5.701 -8.145 2.569 343 2HG1 VAL 43 2HG1 VAL 43 6.400 -7.725 0.987 344 3HG1 VAL 43 3HG1 VAL 43 7.350 -8.673 2.156 345 1HG2 VAL 43 1HG2 VAL 43 6.993 -5.023 1.160 346 2HG2 VAL 43 2HG2 VAL 43 5.443 -5.621 1.798 347 3HG2 VAL 43 3HG2 VAL 43 6.463 -4.554 2.793 348 H THR 44 H THR 44 8.877 -8.469 4.135 349 HA THR 44 HA THR 44 7.107 -10.599 4.861 350 HB THR 44 HB THR 44 10.164 -10.529 4.714 351 HG1 THR 44 HG1 THR 44 9.738 -10.892 2.452 352 1HG2 THR 44 1HG2 THR 44 8.030 -12.694 4.382 353 2HG2 THR 44 2HG2 THR 44 9.693 -12.883 3.775 354 3HG2 THR 44 3HG2 THR 44 9.399 -12.691 5.520 355 H LYS 45 H LYS 45 9.415 -8.470 6.555 356 HA LYS 45 HA LYS 45 9.681 -9.958 8.873 357 1HB LYS 45 1HB LYS 45 10.528 -7.482 7.911 358 2HB LYS 45 2HB LYS 45 9.577 -7.074 9.324 359 1HG LYS 45 1HG LYS 45 11.120 -9.358 10.063 360 2HG LYS 45 2HG LYS 45 12.215 -8.308 9.187 361 1HD LYS 45 1HD LYS 45 10.866 -6.488 10.794 362 2HD LYS 45 2HD LYS 45 10.914 -7.901 11.829 363 1HE LYS 45 1HE LYS 45 12.952 -6.840 12.353 364 2HE LYS 45 2HE LYS 45 13.456 -8.034 11.173 365 1HZ LYS 45 1HZ LYS 45 14.344 -6.229 10.229 366 2HZ LYS 45 2HZ LYS 45 12.856 -6.025 9.588 367 3HZ LYS 45 3HZ LYS 45 13.299 -5.175 10.910 368 H GLU 46 H GLU 46 7.142 -7.605 7.856 369 HA GLU 46 HA GLU 46 5.703 -8.316 10.278 370 1HB GLU 46 1HB GLU 46 5.772 -5.921 8.491 371 2HB GLU 46 2HB GLU 46 4.203 -6.325 9.157 372 1HG GLU 46 1HG GLU 46 6.580 -6.316 11.020 373 2HG GLU 46 2HG GLU 46 5.932 -4.773 10.499 374 H ARG 47 H ARG 47 6.022 -9.334 7.115 375 HA ARG 47 HA ARG 47 4.558 -9.993 5.547 376 1HB ARG 47 1HB ARG 47 3.562 -12.201 6.315 377 2HB ARG 47 2HB ARG 47 5.261 -12.017 6.703 378 1HG ARG 47 1HG ARG 47 4.830 -12.244 8.917 379 2HG ARG 47 2HG ARG 47 3.711 -10.896 8.875 380 1HD ARG 47 1HD ARG 47 2.424 -12.790 9.614 381 2HD ARG 47 2HD ARG 47 1.944 -12.510 7.953 382 HE ARG 47 HE ARG 47 4.141 -14.331 7.929 383 1HH1 ARG 47 1HH1 ARG 47 0.773 -14.221 8.942 384 2HH1 ARG 47 2HH1 ARG 47 0.522 -15.922 8.733 385 1HH2 ARG 47 1HH2 ARG 47 3.810 -16.575 7.653 386 2HH2 ARG 47 2HH2 ARG 47 2.261 -17.270 7.995 387 HA PRO 48 HA PRO 48 0.749 -8.058 7.233 388 1HB PRO 48 1HB PRO 48 0.664 -5.838 5.641 389 2HB PRO 48 2HB PRO 48 1.350 -5.835 7.254 390 1HG PRO 48 1HG PRO 48 2.744 -5.797 4.647 391 2HG PRO 48 2HG PRO 48 3.365 -5.373 6.230 392 1HD PRO 48 1HD PRO 48 3.869 -7.797 4.782 393 2HD PRO 48 2HD PRO 48 4.394 -7.421 6.411 394 H ASP 49 H ASP 49 -1.399 -7.860 6.337 395 HA ASP 49 HA ASP 49 -1.544 -9.620 4.096 396 1HB ASP 49 1HB ASP 49 -3.316 -8.631 6.216 397 2HB ASP 49 2HB ASP 49 -4.123 -8.583 4.661 398 H LEU 50 H LEU 50 -1.002 -6.331 4.496 399 HA LEU 50 HA LEU 50 -1.754 -5.753 1.802 400 1HB LEU 50 1HB LEU 50 -3.654 -5.223 3.821 401 2HB LEU 50 2HB LEU 50 -2.958 -3.675 3.383 402 HG LEU 50 HG LEU 50 -3.495 -4.136 0.996 403 1HD1 LEU 50 1HD1 LEU 50 -4.746 -6.634 2.152 404 2HD1 LEU 50 2HD1 LEU 50 -5.185 -5.967 0.561 405 3HD1 LEU 50 3HD1 LEU 50 -3.515 -6.501 0.872 406 1HD2 LEU 50 1HD2 LEU 50 -5.534 -3.854 3.146 407 2HD2 LEU 50 2HD2 LEU 50 -5.089 -2.748 1.825 408 3HD2 LEU 50 3HD2 LEU 50 -6.119 -4.160 1.493 409 H VAL 51 H VAL 51 -0.699 -3.837 1.017 410 HA VAL 51 HA VAL 51 1.051 -2.524 2.952 411 HB VAL 51 HB VAL 51 2.076 -3.509 0.297 412 1HG1 VAL 51 1HG1 VAL 51 3.972 -2.476 0.869 413 2HG1 VAL 51 2HG1 VAL 51 3.091 -1.749 2.235 414 3HG1 VAL 51 3HG1 VAL 51 3.991 -3.268 2.463 415 1HG2 VAL 51 1HG2 VAL 51 3.284 -5.231 1.913 416 2HG2 VAL 51 2HG2 VAL 51 1.809 -4.997 2.883 417 3HG2 VAL 51 3HG2 VAL 51 1.688 -5.584 1.207 418 H LEU 52 H LEU 52 1.431 -0.343 2.492 419 HA LEU 52 HA LEU 52 0.075 0.637 0.077 420 1HB LEU 52 1HB LEU 52 -1.347 1.446 1.627 421 2HB LEU 52 2HB LEU 52 -0.158 1.419 2.914 422 HG LEU 52 HG LEU 52 0.286 3.440 0.782 423 1HD1 LEU 52 1HD1 LEU 52 -2.131 3.579 0.980 424 2HD1 LEU 52 2HD1 LEU 52 -2.003 3.688 2.753 425 3HD1 LEU 52 3HD1 LEU 52 -1.365 4.999 1.732 426 1HD2 LEU 52 1HD2 LEU 52 0.541 4.776 3.072 427 2HD2 LEU 52 2HD2 LEU 52 0.751 3.127 3.708 428 3HD2 LEU 52 3HD2 LEU 52 1.829 3.729 2.427 429 H LEU 53 H LEU 53 1.501 1.421 -1.369 430 HA LEU 53 HA LEU 53 3.805 2.876 -0.295 431 1HB LEU 53 1HB LEU 53 4.662 0.720 -0.807 432 2HB LEU 53 2HB LEU 53 3.826 0.669 -2.347 433 HG LEU 53 HG LEU 53 6.325 1.083 -2.414 434 1HD1 LEU 53 1HD1 LEU 53 4.787 1.505 -4.310 435 2HD1 LEU 53 2HD1 LEU 53 4.598 3.184 -3.750 436 3HD1 LEU 53 3HD1 LEU 53 6.191 2.599 -4.287 437 1HD2 LEU 53 1HD2 LEU 53 7.280 2.806 -1.384 438 2HD2 LEU 53 2HD2 LEU 53 6.100 3.956 -2.056 439 3HD2 LEU 53 3HD2 LEU 53 5.727 3.073 -0.556 440 H ASP 54 H ASP 54 4.418 4.702 -1.490 441 HA ASP 54 HA ASP 54 2.447 5.419 -3.498 442 1HB ASP 54 1HB ASP 54 2.449 7.173 -1.970 443 2HB ASP 54 2HB ASP 54 4.119 6.911 -1.509 444 H MET 55 H MET 55 3.328 6.696 -5.434 445 HA MET 55 HA MET 55 5.649 5.380 -6.411 446 1HB MET 55 1HB MET 55 3.705 7.475 -7.494 447 2HB MET 55 2HB MET 55 5.113 6.998 -8.422 448 1HG MET 55 1HG MET 55 3.274 5.609 -9.170 449 2HG MET 55 2HG MET 55 4.340 4.579 -8.237 450 1HE MET 55 1HE MET 55 2.797 4.105 -4.923 451 2HE MET 55 2HE MET 55 2.930 2.894 -6.220 452 3HE MET 55 3HE MET 55 4.221 4.097 -5.989 453 H LYS 56 H LYS 56 4.829 8.915 -6.555 454 HA LYS 56 HA LYS 56 7.324 9.870 -6.908 455 1HB LYS 56 1HB LYS 56 4.834 10.941 -6.454 456 2HB LYS 56 2HB LYS 56 5.713 11.480 -5.037 457 1HG LYS 56 1HG LYS 56 6.175 13.186 -6.599 458 2HG LYS 56 2HG LYS 56 7.602 12.175 -6.713 459 1HD LYS 56 1HD LYS 56 6.421 10.942 -8.649 460 2HD LYS 56 2HD LYS 56 5.217 12.215 -8.613 461 1HE LYS 56 1HE LYS 56 6.955 13.925 -9.046 462 2HE LYS 56 2HE LYS 56 8.213 12.707 -8.968 463 1HZ LYS 56 1HZ LYS 56 7.728 12.990 -11.206 464 2HZ LYS 56 2HZ LYS 56 6.972 11.594 -10.824 465 3HZ LYS 56 3HZ LYS 56 6.110 12.972 -10.987 466 H ILE 57 H ILE 57 9.169 9.298 -5.884 467 HA ILE 57 HA ILE 57 9.159 9.531 -2.973 468 HB ILE 57 HB ILE 57 10.107 7.151 -4.561 469 1HG1 ILE 57 1HG1 ILE 57 8.392 7.041 -2.103 470 2HG1 ILE 57 2HG1 ILE 57 7.660 7.511 -3.624 471 1HG2 ILE 57 1HG2 ILE 57 11.714 8.112 -2.734 472 2HG2 ILE 57 2HG2 ILE 57 10.541 7.394 -1.604 473 3HG2 ILE 57 3HG2 ILE 57 11.366 6.367 -2.800 474 1HD1 ILE 57 1HD1 ILE 57 8.082 4.894 -2.782 475 2HD1 ILE 57 2HD1 ILE 57 7.763 5.395 -4.460 476 3HD1 ILE 57 3HD1 ILE 57 9.438 5.168 -3.902 477 HA PRO 58 HA PRO 58 12.771 11.730 -3.860 478 1HB PRO 58 1HB PRO 58 13.868 11.891 -1.363 479 2HB PRO 58 2HB PRO 58 12.584 12.947 -1.915 480 1HG PRO 58 1HG PRO 58 12.428 10.658 -0.051 481 2HG PRO 58 2HG PRO 58 11.282 11.964 -0.284 482 1HD PRO 58 1HD PRO 58 11.041 9.275 -1.254 483 2HD PRO 58 2HD PRO 58 9.955 10.609 -1.584 484 H GLY 59 H GLY 59 14.596 11.247 -4.903 485 1HA GLY 59 1HA GLY 59 16.503 10.146 -5.369 486 2HA GLY 59 2HA GLY 59 16.531 9.555 -3.719 487 H MET 60 H MET 60 15.468 8.911 -7.049 488 HA MET 60 HA MET 60 15.111 7.019 -8.081 489 1HB MET 60 1HB MET 60 16.794 6.111 -6.265 490 2HB MET 60 2HB MET 60 15.376 5.473 -5.457 491 1HG MET 60 1HG MET 60 14.887 4.551 -7.982 492 2HG MET 60 2HG MET 60 16.638 4.614 -8.042 493 1HE MET 60 1HE MET 60 14.152 2.289 -4.949 494 2HE MET 60 2HE MET 60 13.880 3.964 -5.485 495 3HE MET 60 3HE MET 60 13.538 2.610 -6.589 496 H ASP 61 H ASP 61 12.922 7.609 -8.487 497 HA ASP 61 HA ASP 61 10.875 7.529 -6.742 498 1HB ASP 61 1HB ASP 61 9.613 6.669 -9.011 499 2HB ASP 61 2HB ASP 61 10.100 8.331 -8.743 500 H GLY 62 H GLY 62 8.881 5.798 -7.153 501 1HA GLY 62 1HA GLY 62 10.016 3.188 -6.461 502 2HA GLY 62 2HA GLY 62 8.379 3.745 -6.177 503 H ILE 63 H ILE 63 10.431 3.730 -9.177 504 HA ILE 63 HA ILE 63 8.180 2.597 -10.610 505 HB ILE 63 HB ILE 63 10.809 3.817 -11.416 506 1HG1 ILE 63 1HG1 ILE 63 7.993 4.628 -12.165 507 2HG1 ILE 63 2HG1 ILE 63 8.794 5.222 -10.724 508 1HG2 ILE 63 1HG2 ILE 63 8.783 2.506 -13.250 509 2HG2 ILE 63 2HG2 ILE 63 10.219 3.431 -13.750 510 3HG2 ILE 63 3HG2 ILE 63 10.411 1.891 -12.880 511 1HD1 ILE 63 1HD1 ILE 63 9.358 6.879 -12.281 512 2HD1 ILE 63 2HD1 ILE 63 10.773 5.805 -12.395 513 3HD1 ILE 63 3HD1 ILE 63 9.487 5.716 -13.623 514 H GLU 64 H GLU 64 11.642 1.843 -9.862 515 HA GLU 64 HA GLU 64 11.305 -0.753 -11.021 516 1HB GLU 64 1HB GLU 64 13.722 -1.027 -10.172 517 2HB GLU 64 2HB GLU 64 13.450 0.196 -11.396 518 1HG GLU 64 1HG GLU 64 13.928 1.933 -9.966 519 2HG GLU 64 2HG GLU 64 13.106 1.183 -8.611 520 H ILE 65 H ILE 65 11.119 0.806 -7.866 521 HA ILE 65 HA ILE 65 11.661 -1.367 -6.227 522 HB ILE 65 HB ILE 65 10.258 1.227 -6.004 523 1HG1 ILE 65 1HG1 ILE 65 12.607 1.160 -5.560 524 2HG1 ILE 65 2HG1 ILE 65 11.776 1.422 -4.039 525 1HG2 ILE 65 1HG2 ILE 65 8.571 -0.071 -4.950 526 2HG2 ILE 65 2HG2 ILE 65 9.772 -1.053 -4.078 527 3HG2 ILE 65 3HG2 ILE 65 9.548 0.661 -3.654 528 1HD1 ILE 65 1HD1 ILE 65 13.489 -0.812 -4.852 529 2HD1 ILE 65 2HD1 ILE 65 12.939 -0.347 -3.225 530 3HD1 ILE 65 3HD1 ILE 65 11.915 -1.383 -4.248 531 H LEU 66 H LEU 66 8.412 -0.125 -7.297 532 HA LEU 66 HA LEU 66 7.001 -2.303 -6.312 533 1HB LEU 66 1HB LEU 66 6.479 -0.191 -8.370 534 2HB LEU 66 2HB LEU 66 5.344 -1.512 -8.175 535 HG LEU 66 HG LEU 66 4.487 0.228 -6.863 536 1HD1 LEU 66 1HD1 LEU 66 6.013 -1.332 -4.780 537 2HD1 LEU 66 2HD1 LEU 66 4.363 -0.668 -4.699 538 3HD1 LEU 66 3HD1 LEU 66 4.710 -2.062 -5.750 539 1HD2 LEU 66 1HD2 LEU 66 7.150 1.107 -6.704 540 2HD2 LEU 66 2HD2 LEU 66 5.693 1.920 -6.084 541 3HD2 LEU 66 3HD2 LEU 66 6.627 0.836 -5.025 542 H LYS 67 H LYS 67 8.429 -1.681 -9.577 543 HA LYS 67 HA LYS 67 7.474 -3.902 -10.861 544 1HB LYS 67 1HB LYS 67 9.411 -1.875 -11.313 545 2HB LYS 67 2HB LYS 67 10.197 -3.404 -11.650 546 1HG LYS 67 1HG LYS 67 7.716 -3.789 -12.832 547 2HG LYS 67 2HG LYS 67 7.959 -2.073 -13.086 548 1HD LYS 67 1HD LYS 67 10.358 -3.752 -13.644 549 2HD LYS 67 2HD LYS 67 8.996 -4.062 -14.702 550 1HE LYS 67 1HE LYS 67 8.892 -1.731 -15.396 551 2HE LYS 67 2HE LYS 67 10.021 -1.242 -14.148 552 1HZ LYS 67 1HZ LYS 67 10.903 -3.261 -16.028 553 2HZ LYS 67 2HZ LYS 67 10.792 -1.725 -16.571 554 3HZ LYS 67 3HZ LYS 67 11.757 -2.074 -15.301 555 H ARG 68 H ARG 68 10.720 -3.645 -9.236 556 HA ARG 68 HA ARG 68 11.343 -6.273 -9.460 557 1HB ARG 68 1HB ARG 68 12.150 -4.015 -7.676 558 2HB ARG 68 2HB ARG 68 12.509 -5.607 -7.037 559 1HG ARG 68 1HG ARG 68 13.785 -6.199 -9.047 560 2HG ARG 68 2HG ARG 68 13.289 -4.725 -9.854 561 1HD ARG 68 1HD ARG 68 15.576 -4.460 -8.973 562 2HD ARG 68 2HD ARG 68 14.493 -3.367 -8.134 563 HE ARG 68 HE ARG 68 14.485 -5.705 -6.590 564 1HH1 ARG 68 1HH1 ARG 68 16.918 -3.416 -7.696 565 2HH1 ARG 68 2HH1 ARG 68 17.954 -3.662 -6.331 566 1HH2 ARG 68 1HH2 ARG 68 15.852 -6.030 -4.788 567 2HH2 ARG 68 2HH2 ARG 68 17.344 -5.159 -4.665 568 H MET 69 H MET 69 9.292 -4.593 -7.047 569 HA MET 69 HA MET 69 9.171 -6.517 -5.120 570 1HB MET 69 1HB MET 69 7.878 -4.087 -5.760 571 2HB MET 69 2HB MET 69 6.558 -5.239 -5.715 572 1HG MET 69 1HG MET 69 7.608 -6.036 -3.440 573 2HG MET 69 2HG MET 69 8.503 -4.530 -3.487 574 1HE MET 69 1HE MET 69 6.784 -3.095 -1.185 575 2HE MET 69 2HE MET 69 8.028 -2.897 -2.443 576 3HE MET 69 3HE MET 69 6.544 -1.916 -2.496 577 H LYS 70 H LYS 70 6.911 -6.078 -7.941 578 HA LYS 70 HA LYS 70 5.568 -8.520 -7.384 579 1HB LYS 70 1HB LYS 70 4.158 -7.939 -9.112 580 2HB LYS 70 2HB LYS 70 4.730 -6.368 -8.588 581 1HG LYS 70 1HG LYS 70 4.948 -6.316 -10.961 582 2HG LYS 70 2HG LYS 70 6.579 -6.587 -10.380 583 1HD LYS 70 1HD LYS 70 6.703 -8.542 -11.519 584 2HD LYS 70 2HD LYS 70 5.304 -9.163 -10.667 585 1HE LYS 70 1HE LYS 70 3.886 -8.737 -12.420 586 2HE LYS 70 2HE LYS 70 4.601 -7.171 -12.747 587 1HZ LYS 70 1HZ LYS 70 6.147 -9.548 -13.376 588 2HZ LYS 70 2HZ LYS 70 4.922 -9.132 -14.373 589 3HZ LYS 70 3HZ LYS 70 6.150 -8.088 -14.108 590 H VAL 71 H VAL 71 8.161 -7.451 -9.646 591 HA VAL 71 HA VAL 71 8.309 -9.813 -11.107 592 HB VAL 71 HB VAL 71 10.505 -7.855 -10.406 593 1HG1 VAL 71 1HG1 VAL 71 10.940 -8.711 -12.985 594 2HG1 VAL 71 2HG1 VAL 71 11.771 -9.331 -11.538 595 3HG1 VAL 71 3HG1 VAL 71 10.355 -10.192 -12.189 596 1HG2 VAL 71 1HG2 VAL 71 9.095 -7.630 -13.001 597 2HG2 VAL 71 2HG2 VAL 71 8.139 -7.183 -11.567 598 3HG2 VAL 71 3HG2 VAL 71 9.684 -6.364 -11.896 599 H ILE 72 H ILE 72 9.381 -8.962 -7.848 600 HA ILE 72 HA ILE 72 11.177 -11.194 -7.665 601 HB ILE 72 HB ILE 72 10.207 -9.041 -5.824 602 1HG1 ILE 72 1HG1 ILE 72 12.145 -8.853 -7.535 603 2HG1 ILE 72 2HG1 ILE 72 12.378 -8.249 -5.907 604 1HG2 ILE 72 1HG2 ILE 72 11.047 -11.720 -5.024 605 2HG2 ILE 72 2HG2 ILE 72 12.078 -10.440 -4.342 606 3HG2 ILE 72 3HG2 ILE 72 10.320 -10.407 -4.067 607 1HD1 ILE 72 1HD1 ILE 72 13.990 -9.792 -5.438 608 2HD1 ILE 72 2HD1 ILE 72 13.057 -11.116 -6.177 609 3HD1 ILE 72 3HD1 ILE 72 14.050 -10.049 -7.198 610 H ASP 73 H ASP 73 7.930 -10.299 -6.318 611 HA ASP 73 HA ASP 73 7.471 -13.163 -6.078 612 1HB ASP 73 1HB ASP 73 5.858 -11.908 -4.123 613 2HB ASP 73 2HB ASP 73 7.256 -12.924 -3.835 614 H GLU 74 H GLU 74 5.410 -13.796 -6.876 615 HA GLU 74 HA GLU 74 3.871 -11.647 -8.046 616 1HB GLU 74 1HB GLU 74 3.012 -13.238 -9.552 617 2HB GLU 74 2HB GLU 74 4.650 -13.802 -9.288 618 1HG GLU 74 1HG GLU 74 3.779 -15.371 -7.503 619 2HG GLU 74 2HG GLU 74 2.148 -14.853 -7.885 620 H ASN 75 H ASN 75 3.976 -13.412 -5.170 621 HA ASN 75 HA ASN 75 1.111 -13.582 -4.914 622 1HB ASN 75 1HB ASN 75 3.054 -15.236 -3.994 623 2HB ASN 75 2HB ASN 75 2.997 -14.150 -2.620 624 1HD2 ASN 75 1HD2 ASN 75 2.358 -16.365 -1.755 625 2HD2 ASN 75 2HD2 ASN 75 0.664 -16.708 -1.644 626 H ILE 76 H ILE 76 3.637 -11.329 -4.487 627 HA ILE 76 HA ILE 76 2.952 -10.176 -2.018 628 HB ILE 76 HB ILE 76 5.099 -9.943 -3.286 629 1HG1 ILE 76 1HG1 ILE 76 3.605 -7.688 -2.007 630 2HG1 ILE 76 2HG1 ILE 76 5.004 -8.574 -1.435 631 1HG2 ILE 76 1HG2 ILE 76 5.329 -8.355 -5.041 632 2HG2 ILE 76 2HG2 ILE 76 3.987 -9.436 -5.487 633 3HG2 ILE 76 3HG2 ILE 76 3.645 -7.806 -4.858 634 1HD1 ILE 76 1HD1 ILE 76 6.281 -7.507 -3.441 635 2HD1 ILE 76 2HD1 ILE 76 4.898 -6.391 -3.543 636 3HD1 ILE 76 3HD1 ILE 76 5.881 -6.457 -2.060 637 H ARG 77 H ARG 77 1.457 -8.634 -1.436 638 HA ARG 77 HA ARG 77 -0.240 -7.730 -3.623 639 1HB ARG 77 1HB ARG 77 -1.804 -8.985 -2.469 640 2HB ARG 77 2HB ARG 77 -0.888 -8.945 -0.976 641 1HG ARG 77 1HG ARG 77 -1.808 -6.893 -0.294 642 2HG ARG 77 2HG ARG 77 -2.138 -6.371 -1.934 643 1HD ARG 77 1HD ARG 77 -4.274 -6.904 -0.923 644 2HD ARG 77 2HD ARG 77 -3.931 -8.173 -2.083 645 HE ARG 77 HE ARG 77 -3.789 -8.421 0.881 646 1HH1 ARG 77 1HH1 ARG 77 -3.456 -9.924 -2.283 647 2HH1 ARG 77 2HH1 ARG 77 -3.489 -11.540 -1.660 648 1HH2 ARG 77 1HH2 ARG 77 -3.832 -10.552 1.703 649 2HH2 ARG 77 2HH2 ARG 77 -3.704 -11.900 0.623 650 H VAL 78 H VAL 78 0.141 -5.558 -3.952 651 HA VAL 78 HA VAL 78 0.164 -3.839 -1.602 652 HB VAL 78 HB VAL 78 2.309 -3.847 -3.736 653 1HG1 VAL 78 1HG1 VAL 78 3.321 -2.048 -2.243 654 2HG1 VAL 78 2HG1 VAL 78 1.898 -1.572 -3.200 655 3HG1 VAL 78 3HG1 VAL 78 1.724 -1.931 -1.465 656 1HG2 VAL 78 1HG2 VAL 78 2.138 -4.969 -1.001 657 2HG2 VAL 78 2HG2 VAL 78 3.174 -5.430 -2.373 658 3HG2 VAL 78 3HG2 VAL 78 3.613 -4.038 -1.354 659 H ILE 79 H ILE 79 -0.325 -1.568 -2.158 660 HA ILE 79 HA ILE 79 -1.667 -1.397 -4.767 661 HB ILE 79 HB ILE 79 -2.610 -0.816 -2.027 662 1HG1 ILE 79 1HG1 ILE 79 -3.791 -1.778 -4.630 663 2HG1 ILE 79 2HG1 ILE 79 -3.639 -2.635 -3.109 664 1HG2 ILE 79 1HG2 ILE 79 -4.125 0.962 -2.747 665 2HG2 ILE 79 2HG2 ILE 79 -2.423 1.454 -2.917 666 3HG2 ILE 79 3HG2 ILE 79 -3.359 0.977 -4.354 667 1HD1 ILE 79 1HD1 ILE 79 -5.575 -0.423 -3.845 668 2HD1 ILE 79 2HD1 ILE 79 -5.917 -2.020 -3.138 669 3HD1 ILE 79 3HD1 ILE 79 -5.184 -0.743 -2.139 670 H ILE 80 H ILE 80 -1.417 0.532 -5.941 671 HA ILE 80 HA ILE 80 0.795 2.174 -4.966 672 HB ILE 80 HB ILE 80 1.244 2.716 -7.197 673 1HG1 ILE 80 1HG1 ILE 80 -0.310 1.903 -9.066 674 2HG1 ILE 80 2HG1 ILE 80 -1.526 1.680 -7.824 675 1HG2 ILE 80 1HG2 ILE 80 1.179 0.061 -6.330 676 2HG2 ILE 80 2HG2 ILE 80 0.529 0.020 -7.986 677 3HG2 ILE 80 3HG2 ILE 80 2.129 0.735 -7.675 678 1HD1 ILE 80 1HD1 ILE 80 -1.105 4.040 -9.172 679 2HD1 ILE 80 2HD1 ILE 80 -1.869 3.930 -7.568 680 3HD1 ILE 80 3HD1 ILE 80 -0.135 4.307 -7.704 681 H MET 81 H MET 81 0.671 4.531 -5.182 682 HA MET 81 HA MET 81 -2.043 5.521 -5.410 683 1HB MET 81 1HB MET 81 -0.510 6.835 -3.244 684 2HB MET 81 2HB MET 81 -2.155 6.230 -3.213 685 1HG MET 81 1HG MET 81 -1.168 3.861 -3.028 686 2HG MET 81 2HG MET 81 0.400 4.610 -2.802 687 1HE MET 81 1HE MET 81 1.254 4.710 -0.384 688 2HE MET 81 2HE MET 81 0.930 6.350 -0.995 689 3HE MET 81 3HE MET 81 0.468 5.911 0.667 690 H THR 82 H THR 82 -2.115 7.340 -6.672 691 HA THR 82 HA THR 82 -0.330 9.450 -6.540 692 HB THR 82 HB THR 82 1.458 8.117 -7.405 693 HG1 THR 82 HG1 THR 82 1.499 9.804 -8.859 694 1HG2 THR 82 1HG2 THR 82 -0.197 7.147 -9.749 695 2HG2 THR 82 2HG2 THR 82 1.270 6.430 -9.041 696 3HG2 THR 82 3HG2 THR 82 -0.295 6.257 -8.210 697 H ALA 83 H ALA 83 -0.812 11.136 -8.075 698 HA ALA 83 HA ALA 83 -3.505 11.262 -8.702 699 1HB ALA 83 1HB ALA 83 -1.080 12.861 -9.041 700 2HB ALA 83 2HB ALA 83 -2.196 13.050 -10.415 701 3HB ALA 83 3HB ALA 83 -2.757 13.387 -8.759 702 H TYR 84 H TYR 84 -4.541 11.424 -10.869 703 HA TYR 84 HA TYR 84 -3.652 9.221 -12.507 704 1HB TYR 84 1HB TYR 84 -5.855 9.875 -13.671 705 2HB TYR 84 2HB TYR 84 -6.044 9.536 -11.962 706 HD1 TYR 84 HD1 TYR 84 -6.003 12.186 -14.522 707 HD2 TYR 84 HD2 TYR 84 -6.598 11.301 -10.379 708 HE1 TYR 84 HE1 TYR 84 -7.059 14.473 -14.178 709 HE2 TYR 84 HE2 TYR 84 -7.652 13.590 -10.049 710 HH TYR 84 HH TYR 84 -7.907 15.866 -12.769 711 H GLY 85 H GLY 85 -1.742 11.330 -12.530 712 1HA GLY 85 1HA GLY 85 -2.209 12.668 -15.112 713 2HA GLY 85 2HA GLY 85 -1.058 13.147 -13.881 714 H GLU 86 H GLU 86 -0.132 10.344 -13.344 715 HA GLU 86 HA GLU 86 1.480 10.104 -15.756 716 1HB GLU 86 1HB GLU 86 3.039 8.795 -14.176 717 2HB GLU 86 2HB GLU 86 2.911 10.522 -13.908 718 1HG GLU 86 1HG GLU 86 1.493 10.247 -12.000 719 2HG GLU 86 2HG GLU 86 1.088 8.596 -12.425 720 H LEU 87 H LEU 87 -0.932 9.028 -16.212 721 HA LEU 87 HA LEU 87 -1.607 6.581 -15.269 722 1HB LEU 87 1HB LEU 87 -1.768 7.537 -18.130 723 2HB LEU 87 2HB LEU 87 -2.681 6.209 -17.442 724 HG LEU 87 HG LEU 87 -2.935 8.857 -16.098 725 1HD1 LEU 87 1HD1 LEU 87 -4.883 8.735 -18.200 726 2HD1 LEU 87 2HD1 LEU 87 -3.699 10.011 -17.829 727 3HD1 LEU 87 3HD1 LEU 87 -3.249 8.665 -18.903 728 1HD2 LEU 87 1HD2 LEU 87 -5.066 6.852 -16.855 729 2HD2 LEU 87 2HD2 LEU 87 -4.081 6.718 -15.378 730 3HD2 LEU 87 3HD2 LEU 87 -5.136 8.132 -15.620 731 H ASP 88 H ASP 88 0.965 7.408 -17.633 732 HA ASP 88 HA ASP 88 1.557 5.032 -18.666 733 1HB ASP 88 1HB ASP 88 2.860 7.495 -18.361 734 2HB ASP 88 2HB ASP 88 3.976 6.372 -17.610 735 H MET 89 H MET 89 2.653 6.336 -15.449 736 HA MET 89 HA MET 89 4.067 4.015 -14.766 737 1HB MET 89 1HB MET 89 4.611 6.130 -13.688 738 2HB MET 89 2HB MET 89 2.946 6.398 -13.211 739 1HG MET 89 1HG MET 89 4.100 5.666 -11.224 740 2HG MET 89 2HG MET 89 3.119 4.309 -11.741 741 1HE MET 89 1HE MET 89 5.425 4.714 -9.898 742 2HE MET 89 2HE MET 89 5.867 2.992 -9.989 743 3HE MET 89 3HE MET 89 7.058 4.241 -10.425 744 H ILE 90 H ILE 90 0.856 5.335 -13.679 745 HA ILE 90 HA ILE 90 0.132 3.390 -11.941 746 HB ILE 90 HB ILE 90 -1.508 4.943 -13.936 747 1HG1 ILE 90 1HG1 ILE 90 -1.835 5.580 -11.121 748 2HG1 ILE 90 2HG1 ILE 90 -0.152 5.696 -11.595 749 1HG2 ILE 90 1HG2 ILE 90 -2.872 3.077 -13.460 750 2HG2 ILE 90 2HG2 ILE 90 -2.414 3.077 -11.740 751 3HG2 ILE 90 3HG2 ILE 90 -3.439 4.380 -12.388 752 1HD1 ILE 90 1HD1 ILE 90 -0.563 7.370 -13.191 753 2HD1 ILE 90 2HD1 ILE 90 -2.267 6.896 -13.394 754 3HD1 ILE 90 3HD1 ILE 90 -1.754 7.770 -11.931 755 H GLN 91 H GLN 91 0.050 3.277 -15.535 756 HA GLN 91 HA GLN 91 -1.326 0.879 -15.701 757 1HB GLN 91 1HB GLN 91 0.343 2.565 -17.503 758 2HB GLN 91 2HB GLN 91 0.243 0.876 -17.961 759 1HG GLN 91 1HG GLN 91 -2.399 1.800 -17.177 760 2HG GLN 91 2HG GLN 91 -1.728 2.919 -18.347 761 1HE2 GLN 91 1HE2 GLN 91 -1.780 2.427 -20.418 762 2HE2 GLN 91 2HE2 GLN 91 -2.159 0.884 -21.107 763 H GLU 92 H GLU 92 2.220 1.618 -15.629 764 HA GLU 92 HA GLU 92 2.990 -1.049 -15.896 765 1HB GLU 92 1HB GLU 92 4.246 1.511 -15.651 766 2HB GLU 92 2HB GLU 92 4.951 0.487 -14.416 767 1HG GLU 92 1HG GLU 92 5.959 -0.911 -15.948 768 2HG GLU 92 2HG GLU 92 4.614 -0.832 -17.069 769 H SER 93 H SER 93 1.684 0.786 -13.238 770 HA SER 93 HA SER 93 2.875 -0.846 -11.230 771 1HB SER 93 1HB SER 93 0.485 0.651 -10.410 772 2HB SER 93 2HB SER 93 2.127 0.761 -9.809 773 HG SER 93 HG SER 93 2.245 2.614 -10.861 774 H LYS 94 H LYS 94 -0.431 -0.381 -12.662 775 HA LYS 94 HA LYS 94 -1.643 -2.409 -11.154 776 1HB LYS 94 1HB LYS 94 -3.503 -2.142 -12.654 777 2HB LYS 94 2HB LYS 94 -2.837 -0.562 -12.294 778 1HG LYS 94 1HG LYS 94 -1.474 -0.750 -14.459 779 2HG LYS 94 2HG LYS 94 -2.387 -2.199 -14.831 780 1HD LYS 94 1HD LYS 94 -4.413 -0.408 -14.185 781 2HD LYS 94 2HD LYS 94 -3.235 0.647 -14.939 782 1HE LYS 94 1HE LYS 94 -3.118 -1.201 -16.816 783 2HE LYS 94 2HE LYS 94 -4.628 -1.773 -16.135 784 1HZ LYS 94 1HZ LYS 94 -4.312 1.053 -16.781 785 2HZ LYS 94 2HZ LYS 94 -4.679 -0.017 -17.959 786 3HZ LYS 94 3HZ LYS 94 -5.683 0.171 -16.684 787 H GLU 95 H GLU 95 -0.498 -2.399 -14.607 788 HA GLU 95 HA GLU 95 -0.979 -5.062 -15.035 789 1HB GLU 95 1HB GLU 95 -0.496 -4.054 -17.032 790 2HB GLU 95 2HB GLU 95 0.624 -2.917 -16.309 791 1HG GLU 95 1HG GLU 95 1.916 -4.373 -17.749 792 2HG GLU 95 2HG GLU 95 2.316 -4.795 -16.096 793 H LEU 96 H LEU 96 1.398 -3.540 -13.022 794 HA LEU 96 HA LEU 96 3.440 -5.469 -13.220 795 1HB LEU 96 1HB LEU 96 2.906 -3.050 -11.812 796 2HB LEU 96 2HB LEU 96 3.382 -4.261 -10.638 797 HG LEU 96 HG LEU 96 5.503 -4.560 -11.606 798 1HD1 LEU 96 1HD1 LEU 96 5.650 -4.737 -13.817 799 2HD1 LEU 96 2HD1 LEU 96 4.163 -3.790 -14.066 800 3HD1 LEU 96 3HD1 LEU 96 5.726 -2.959 -13.875 801 1HD2 LEU 96 1HD2 LEU 96 6.326 -2.133 -11.962 802 2HD2 LEU 96 2HD2 LEU 96 4.654 -1.673 -11.560 803 3HD2 LEU 96 3HD2 LEU 96 5.633 -2.587 -10.387 804 H GLY 97 H GLY 97 0.253 -5.516 -11.854 805 1HA GLY 97 1HA GLY 97 -0.644 -7.636 -11.242 806 2HA GLY 97 2HA GLY 97 0.899 -8.079 -10.541 807 H ALA 98 H ALA 98 -0.362 -4.791 -10.098 808 HA ALA 98 HA ALA 98 -0.385 -5.203 -7.256 809 1HB ALA 98 1HB ALA 98 -1.146 -2.764 -8.912 810 2HB ALA 98 2HB ALA 98 -0.746 -2.797 -7.177 811 3HB ALA 98 3HB ALA 98 0.510 -3.153 -8.387 812 H LEU 99 H LEU 99 -2.293 -4.502 -5.908 813 HA LEU 99 HA LEU 99 -4.560 -5.952 -6.682 814 1HB LEU 99 1HB LEU 99 -4.084 -3.935 -4.488 815 2HB LEU 99 2HB LEU 99 -5.571 -4.845 -4.663 816 HG LEU 99 HG LEU 99 -4.001 -5.769 -2.972 817 1HD1 LEU 99 1HD1 LEU 99 -5.100 -7.311 -5.260 818 2HD1 LEU 99 2HD1 LEU 99 -3.969 -8.164 -4.182 819 3HD1 LEU 99 3HD1 LEU 99 -5.445 -7.424 -3.517 820 1HD2 LEU 99 1HD2 LEU 99 -2.250 -6.381 -5.369 821 2HD2 LEU 99 2HD2 LEU 99 -1.887 -5.241 -4.052 822 3HD2 LEU 99 3HD2 LEU 99 -1.998 -6.985 -3.714 823 H THR 100 H THR 100 -3.824 -2.412 -6.631 824 HA THR 100 HA THR 100 -5.386 -1.893 -8.890 825 HB THR 100 HB THR 100 -7.310 -2.427 -7.434 826 HG1 THR 100 HG1 THR 100 -6.873 0.467 -7.544 827 1HG2 THR 100 1HG2 THR 100 -6.138 -1.848 -5.223 828 2HG2 THR 100 2HG2 THR 100 -6.338 -0.133 -5.657 829 3HG2 THR 100 3HG2 THR 100 -7.770 -1.159 -5.400 830 H HIS 101 H HIS 101 -5.761 0.582 -9.122 831 HA HIS 101 HA HIS 101 -3.517 1.907 -7.780 832 1HB HIS 101 1HB HIS 101 -3.170 3.187 -9.869 833 2HB HIS 101 2HB HIS 101 -2.854 1.472 -10.039 834 HD1 HIS 101 HD1 HIS 101 -4.506 0.071 -11.523 835 HD2 HIS 101 HD2 HIS 101 -5.340 4.179 -11.380 836 HE1 HIS 101 HE1 HIS 101 -6.169 0.528 -13.403 837 H PHE 102 H PHE 102 -4.084 3.672 -6.607 838 HA PHE 102 HA PHE 102 -6.771 4.732 -7.083 839 1HB PHE 102 1HB PHE 102 -4.794 4.885 -4.728 840 2HB PHE 102 2HB PHE 102 -6.390 5.608 -4.706 841 HD1 PHE 102 HD1 PHE 102 -5.108 3.421 -2.879 842 HD2 PHE 102 HD2 PHE 102 -7.788 3.278 -6.166 843 HE1 PHE 102 HE1 PHE 102 -6.068 1.274 -2.003 844 HE2 PHE 102 HE2 PHE 102 -8.749 1.131 -5.289 845 HZ PHE 102 HZ PHE 102 -7.877 0.155 -3.218 846 H ALA 103 H ALA 103 -7.091 7.095 -6.881 847 HA ALA 103 HA ALA 103 -4.752 8.503 -7.941 848 1HB ALA 103 1HB ALA 103 -7.461 9.750 -7.933 849 2HB ALA 103 2HB ALA 103 -6.214 9.729 -9.203 850 3HB ALA 103 3HB ALA 103 -7.257 8.308 -8.956 851 H LYS 104 H LYS 104 -4.072 10.507 -7.026 852 HA LYS 104 HA LYS 104 -3.768 10.738 -4.430 853 1HB LYS 104 1HB LYS 104 -3.731 12.560 -6.663 854 2HB LYS 104 2HB LYS 104 -4.340 13.393 -5.247 855 1HG LYS 104 1HG LYS 104 -2.372 12.957 -3.981 856 2HG LYS 104 2HG LYS 104 -1.882 11.629 -5.014 857 1HD LYS 104 1HD LYS 104 -0.433 13.453 -5.587 858 2HD LYS 104 2HD LYS 104 -1.584 13.339 -6.904 859 1HE LYS 104 1HE LYS 104 -2.146 15.508 -6.555 860 2HE LYS 104 2HE LYS 104 -2.805 15.060 -4.994 861 1HZ LYS 104 1HZ LYS 104 -0.839 16.735 -5.226 862 2HZ LYS 104 2HZ LYS 104 -0.944 15.732 -3.942 863 3HZ LYS 104 3HZ LYS 104 0.065 15.376 -5.176 864 HA PRO 105 HA PRO 105 -7.987 12.701 -3.688 865 1HB PRO 105 1HB PRO 105 -9.776 13.011 -5.730 866 2HB PRO 105 2HB PRO 105 -8.685 14.280 -5.211 867 1HG PRO 105 1HG PRO 105 -8.531 12.574 -7.621 868 2HG PRO 105 2HG PRO 105 -7.722 14.095 -7.299 869 1HD PRO 105 1HD PRO 105 -6.557 11.477 -7.191 870 2HD PRO 105 2HD PRO 105 -5.782 12.988 -6.758 871 H PHE 106 H PHE 106 -8.291 10.884 -2.435 872 HA PHE 106 HA PHE 106 -10.186 9.037 -3.699 873 1HB PHE 106 1HB PHE 106 -8.837 7.486 -1.867 874 2HB PHE 106 2HB PHE 106 -8.333 7.609 -3.540 875 HD1 PHE 106 HD1 PHE 106 -6.045 7.718 -3.713 876 HD2 PHE 106 HD2 PHE 106 -7.937 9.829 -0.554 877 HE1 PHE 106 HE1 PHE 106 -3.819 8.613 -2.976 878 HE2 PHE 106 HE2 PHE 106 -5.711 10.723 0.182 879 HZ PHE 106 HZ PHE 106 -3.678 10.104 -1.038 880 H ASP 107 H ASP 107 -11.649 7.942 -2.178 881 HA ASP 107 HA ASP 107 -11.948 9.540 0.241 882 1HB ASP 107 1HB ASP 107 -13.770 9.054 -1.830 883 2HB ASP 107 2HB ASP 107 -14.257 7.893 -0.612 884 H ILE 108 H ILE 108 -12.344 8.374 2.239 885 HA ILE 108 HA ILE 108 -11.236 5.789 2.351 886 HB ILE 108 HB ILE 108 -11.913 7.870 4.121 887 1HG1 ILE 108 1HG1 ILE 108 -9.782 6.791 4.135 888 2HG1 ILE 108 2HG1 ILE 108 -10.523 6.536 5.703 889 1HG2 ILE 108 1HG2 ILE 108 -12.897 6.542 6.008 890 2HG2 ILE 108 2HG2 ILE 108 -14.014 6.879 4.664 891 3HG2 ILE 108 3HG2 ILE 108 -13.281 5.265 4.829 892 1HD1 ILE 108 1HD1 ILE 108 -9.745 4.383 5.190 893 2HD1 ILE 108 2HD1 ILE 108 -11.430 4.295 4.622 894 3HD1 ILE 108 3HD1 ILE 108 -10.111 4.555 3.456 895 H ASP 109 H ASP 109 -14.587 7.079 2.272 896 HA ASP 109 HA ASP 109 -15.893 4.783 2.960 897 1HB ASP 109 1HB ASP 109 -16.504 7.258 1.426 898 2HB ASP 109 2HB ASP 109 -17.534 5.901 1.016 899 H GLU 110 H GLU 110 -14.673 5.979 -0.234 900 HA GLU 110 HA GLU 110 -15.735 3.773 -1.648 901 1HB GLU 110 1HB GLU 110 -14.607 4.723 -3.575 902 2HB GLU 110 2HB GLU 110 -15.303 6.038 -2.650 903 1HG GLU 110 1HG GLU 110 -13.218 6.796 -1.879 904 2HG GLU 110 2HG GLU 110 -12.470 5.217 -2.016 905 H ILE 111 H ILE 111 -12.774 4.469 0.140 906 HA ILE 111 HA ILE 111 -11.283 2.357 -1.112 907 HB ILE 111 HB ILE 111 -10.821 4.389 1.017 908 1HG1 ILE 111 1HG1 ILE 111 -9.252 3.514 -1.427 909 2HG1 ILE 111 2HG1 ILE 111 -10.337 4.888 -1.342 910 1HG2 ILE 111 1HG2 ILE 111 -9.135 1.894 0.675 911 2HG2 ILE 111 2HG2 ILE 111 -8.668 3.336 1.607 912 3HG2 ILE 111 3HG2 ILE 111 -10.070 2.364 2.115 913 1HD1 ILE 111 1HD1 ILE 111 -8.878 5.725 0.632 914 2HD1 ILE 111 2HD1 ILE 111 -7.697 4.498 0.114 915 3HD1 ILE 111 3HD1 ILE 111 -8.164 5.808 -0.996 916 H ARG 112 H ARG 112 -13.651 2.696 1.421 917 HA ARG 112 HA ARG 112 -12.775 0.541 2.976 918 1HB ARG 112 1HB ARG 112 -15.515 1.866 2.674 919 2HB ARG 112 2HB ARG 112 -15.174 0.641 3.880 920 1HG ARG 112 1HG ARG 112 -13.068 2.579 4.063 921 2HG ARG 112 2HG ARG 112 -14.567 3.479 3.956 922 1HD ARG 112 1HD ARG 112 -14.681 3.101 6.218 923 2HD ARG 112 2HD ARG 112 -15.318 1.538 5.745 924 HE ARG 112 HE ARG 112 -12.550 1.189 5.694 925 1HH1 ARG 112 1HH1 ARG 112 -14.891 2.223 8.109 926 2HH1 ARG 112 2HH1 ARG 112 -13.966 1.627 9.446 927 1HH2 ARG 112 1HH2 ARG 112 -11.329 0.403 7.458 928 2HH2 ARG 112 2HH2 ARG 112 -11.925 0.585 9.074 929 H ASP 113 H ASP 113 -14.518 0.851 -0.055 930 HA ASP 113 HA ASP 113 -15.746 -1.717 0.168 931 1HB ASP 113 1HB ASP 113 -16.081 0.616 -1.430 932 2HB ASP 113 2HB ASP 113 -15.593 -0.640 -2.549 933 H ALA 114 H ALA 114 -13.031 -0.085 -1.583 934 HA ALA 114 HA ALA 114 -12.298 -2.338 -3.117 935 1HB ALA 114 1HB ALA 114 -11.203 -0.640 -4.101 936 2HB ALA 114 2HB ALA 114 -11.459 0.409 -2.686 937 3HB ALA 114 3HB ALA 114 -10.047 -0.672 -2.749 938 H VAL 115 H VAL 115 -11.683 -1.263 0.202 939 HA VAL 115 HA VAL 115 -9.363 -2.763 0.661 940 HB VAL 115 HB VAL 115 -11.507 -1.501 2.320 941 1HG1 VAL 115 1HG1 VAL 115 -11.197 -3.429 3.637 942 2HG1 VAL 115 2HG1 VAL 115 -9.449 -3.484 3.307 943 3HG1 VAL 115 3HG1 VAL 115 -10.117 -2.213 4.359 944 1HG2 VAL 115 1HG2 VAL 115 -9.953 0.100 2.748 945 2HG2 VAL 115 2HG2 VAL 115 -8.607 -1.064 2.806 946 3HG2 VAL 115 3HG2 VAL 115 -9.240 -0.512 1.237 947 H LYS 116 H LYS 116 -12.840 -3.562 0.623 948 HA LYS 116 HA LYS 116 -12.691 -5.983 1.986 949 1HB LYS 116 1HB LYS 116 -14.791 -4.856 1.551 950 2HB LYS 116 2HB LYS 116 -14.579 -5.019 -0.180 951 1HG LYS 116 1HG LYS 116 -14.276 -7.651 0.830 952 2HG LYS 116 2HG LYS 116 -15.605 -6.972 1.750 953 1HD LYS 116 1HD LYS 116 -16.634 -7.913 -0.186 954 2HD LYS 116 2HD LYS 116 -16.599 -6.189 -0.499 955 1HE LYS 116 1HE LYS 116 -14.124 -7.500 -1.407 956 2HE LYS 116 2HE LYS 116 -15.540 -8.215 -2.152 957 1HZ LYS 116 1HZ LYS 116 -16.107 -5.643 -2.354 958 2HZ LYS 116 2HZ LYS 116 -14.479 -5.566 -2.446 959 3HZ LYS 116 3HZ LYS 116 -15.315 -6.479 -3.511 960 H LYS 117 H LYS 117 -12.204 -5.153 -1.492 961 HA LYS 117 HA LYS 117 -11.695 -7.905 -2.141 962 1HB LYS 117 1HB LYS 117 -11.310 -7.040 -4.401 963 2HB LYS 117 2HB LYS 117 -12.831 -6.473 -3.741 964 1HG LYS 117 1HG LYS 117 -11.855 -4.289 -3.195 965 2HG LYS 117 2HG LYS 117 -10.251 -4.846 -3.628 966 1HD LYS 117 1HD LYS 117 -11.772 -5.405 -5.925 967 2HD LYS 117 2HD LYS 117 -12.428 -3.878 -5.368 968 1HE LYS 117 1HE LYS 117 -10.631 -2.810 -6.247 969 2HE LYS 117 2HE LYS 117 -9.596 -3.641 -5.102 970 1HZ LYS 117 1HZ LYS 117 -9.235 -3.958 -7.602 971 2HZ LYS 117 2HZ LYS 117 -9.108 -5.257 -6.621 972 3HZ LYS 117 3HZ LYS 117 -10.460 -5.034 -7.509 973 H TYR 118 H TYR 118 -9.830 -4.880 -1.574 974 HA TYR 118 HA TYR 118 -7.352 -5.720 -2.397 975 1HB TYR 118 1HB TYR 118 -8.275 -3.464 -1.430 976 2HB TYR 118 2HB TYR 118 -8.074 -4.167 0.162 977 HD1 TYR 118 HD1 TYR 118 -6.711 -1.801 0.044 978 HD2 TYR 118 HD2 TYR 118 -5.469 -5.508 -1.696 979 HE1 TYR 118 HE1 TYR 118 -4.292 -1.019 0.085 980 HE2 TYR 118 HE2 TYR 118 -3.055 -4.712 -1.649 981 HH TYR 118 HH TYR 118 -1.935 -2.463 0.175 982 H LEU 119 H LEU 119 -8.934 -6.189 0.831 983 HA LEU 119 HA LEU 119 -6.683 -7.840 1.638 984 1HB LEU 119 1HB LEU 119 -8.457 -6.084 2.943 985 2HB LEU 119 2HB LEU 119 -8.841 -7.686 3.542 986 HG LEU 119 HG LEU 119 -5.981 -7.360 3.517 987 1HD1 LEU 119 1HD1 LEU 119 -6.985 -5.417 5.484 988 2HD1 LEU 119 2HD1 LEU 119 -5.536 -5.373 4.451 989 3HD1 LEU 119 3HD1 LEU 119 -7.115 -4.887 3.789 990 1HD2 LEU 119 1HD2 LEU 119 -7.848 -8.675 5.001 991 2HD2 LEU 119 2HD2 LEU 119 -6.146 -8.452 5.469 992 3HD2 LEU 119 3HD2 LEU 119 -7.394 -7.353 6.103 993 HA PRO 120 HA PRO 120 -8.745 -11.539 0.812 994 1HB PRO 120 1HB PRO 120 -7.562 -13.247 2.587 995 2HB PRO 120 2HB PRO 120 -6.814 -12.765 1.078 996 1HG PRO 120 1HG PRO 120 -6.180 -11.880 3.826 997 2HG PRO 120 2HG PRO 120 -5.201 -11.752 2.378 998 1HD PRO 120 1HD PRO 120 -6.685 -9.645 3.638 999 2HD PRO 120 2HD PRO 120 -5.801 -9.547 2.128 1000 H LEU 121 H LEU 121 -10.555 -10.023 1.901 1001 HA LEU 121 HA LEU 121 -11.497 -11.452 4.261 1002 1HB LEU 121 1HB LEU 121 -11.449 -9.116 4.550 1003 2HB LEU 121 2HB LEU 121 -12.181 -8.815 2.987 1004 HG LEU 121 HG LEU 121 -14.292 -9.895 3.853 1005 1HD1 LEU 121 1HD1 LEU 121 -12.694 -10.782 5.913 1006 2HD1 LEU 121 2HD1 LEU 121 -13.591 -9.438 6.659 1007 3HD1 LEU 121 3HD1 LEU 121 -14.474 -10.781 5.894 1008 1HD2 LEU 121 1HD2 LEU 121 -15.016 -7.830 4.247 1009 2HD2 LEU 121 2HD2 LEU 121 -14.027 -7.685 5.719 1010 3HD2 LEU 121 3HD2 LEU 121 -13.322 -7.298 4.131 1011 H LYS 122 H LYS 122 -13.950 -11.877 4.323 1012 HA LYS 122 HA LYS 122 -14.625 -13.785 2.545 1013 1HB LYS 122 1HB LYS 122 -15.805 -13.373 4.641 1014 2HB LYS 122 2HB LYS 122 -16.472 -11.880 4.013 1015 1HG LYS 122 1HG LYS 122 -17.092 -13.873 2.070 1016 2HG LYS 122 2HG LYS 122 -17.413 -14.615 3.625 1017 1HD LYS 122 1HD LYS 122 -18.394 -11.797 3.200 1018 2HD LYS 122 2HD LYS 122 -19.243 -13.082 2.364 1019 1HE LYS 122 1HE LYS 122 -19.515 -14.288 4.572 1020 2HE LYS 122 2HE LYS 122 -18.750 -12.933 5.377 1021 1HZ LYS 122 1HZ LYS 122 -21.042 -12.451 3.645 1022 2HZ LYS 122 2HZ LYS 122 -21.284 -13.010 5.160 1023 3HZ LYS 122 3HZ LYS 122 -20.522 -11.584 4.927 1024 H SER 123 H SER 123 -14.713 -13.774 0.368 1025 HA SER 123 HA SER 123 -14.768 -11.504 -1.141 1026 1HB SER 123 1HB SER 123 -15.026 -12.942 -3.030 1027 2HB SER 123 2HB SER 123 -14.152 -13.886 -1.840 1028 HG SER 123 HG SER 123 -16.669 -14.413 -1.276 1029 H ASN 124 H ASN 124 -16.364 -10.043 -1.651 1030 HA ASN 124 HA ASN 124 -18.787 -10.027 -0.522 1031 1HB ASN 124 1HB ASN 124 -17.551 -8.247 -2.019 1032 2HB ASN 124 2HB ASN 124 -18.394 -8.990 -3.363 1033 1HD2 ASN 124 1HD2 ASN 124 -19.028 -7.856 -0.045 1034 2HD2 ASN 124 2HD2 ASN 124 -20.540 -7.074 -0.365 Start of MODEL 12 1 1H MET 1 1H MET 1 1.527 -9.856 18.589 2 HA MET 1 HA MET 1 -0.109 -11.383 18.871 3 1HB MET 1 1HB MET 1 -0.343 -9.310 21.115 4 2HB MET 1 2HB MET 1 -1.137 -10.870 21.212 5 1HG MET 1 1HG MET 1 1.040 -12.035 21.012 6 2HG MET 1 2HG MET 1 1.869 -10.509 20.781 7 1HE MET 1 1HE MET 1 3.500 -10.745 23.455 8 2HE MET 1 2HE MET 1 2.717 -12.159 24.200 9 3HE MET 1 3HE MET 1 3.024 -12.133 22.447 10 H MET 2 H MET 2 -1.137 -9.614 16.901 11 HA MET 2 HA MET 2 -3.936 -9.670 17.679 12 1HB MET 2 1HB MET 2 -4.140 -7.483 16.268 13 2HB MET 2 2HB MET 2 -3.419 -7.325 17.858 14 1HG MET 2 1HG MET 2 -1.386 -7.997 15.846 15 2HG MET 2 2HG MET 2 -2.263 -6.549 15.392 16 1HE MET 2 1HE MET 2 1.132 -6.973 17.931 17 2HE MET 2 2HE MET 2 0.545 -7.622 16.382 18 3HE MET 2 3HE MET 2 1.071 -5.925 16.493 19 H ASN 3 H ASN 3 -5.145 -8.860 15.334 20 HA ASN 3 HA ASN 3 -4.098 -10.838 13.470 21 1HB ASN 3 1HB ASN 3 -6.595 -10.770 14.598 22 2HB ASN 3 2HB ASN 3 -6.901 -9.778 13.186 23 1HD2 ASN 3 1HD2 ASN 3 -7.039 -12.809 14.341 24 2HD2 ASN 3 2HD2 ASN 3 -6.893 -13.750 12.895 25 H GLU 4 H GLU 4 -4.711 -10.254 11.063 26 HA GLU 4 HA GLU 4 -4.523 -8.929 9.355 27 1HB GLU 4 1HB GLU 4 -6.638 -7.946 10.074 28 2HB GLU 4 2HB GLU 4 -5.823 -6.896 11.216 29 1HG GLU 4 1HG GLU 4 -4.912 -5.521 9.514 30 2HG GLU 4 2HG GLU 4 -5.062 -6.764 8.287 31 H LYS 5 H LYS 5 -2.939 -7.612 8.353 32 HA LYS 5 HA LYS 5 -1.264 -6.021 10.133 33 1HB LYS 5 1HB LYS 5 -0.241 -8.245 8.345 34 2HB LYS 5 2HB LYS 5 0.777 -7.024 9.080 35 1HG LYS 5 1HG LYS 5 -1.055 -8.297 11.023 36 2HG LYS 5 2HG LYS 5 0.019 -9.449 10.254 37 1HD LYS 5 1HD LYS 5 1.417 -6.968 11.040 38 2HD LYS 5 2HD LYS 5 0.667 -7.768 12.406 39 1HE LYS 5 1HE LYS 5 2.215 -9.477 10.460 40 2HE LYS 5 2HE LYS 5 3.127 -8.446 11.545 41 1HZ LYS 5 1HZ LYS 5 0.999 -10.168 12.568 42 2HZ LYS 5 2HZ LYS 5 2.506 -10.751 12.331 43 3HZ LYS 5 3HZ LYS 5 2.261 -9.521 13.377 44 H ILE 6 H ILE 6 0.139 -4.490 8.897 45 HA ILE 6 HA ILE 6 -0.278 -4.158 6.126 46 HB ILE 6 HB ILE 6 -2.254 -3.003 7.885 47 1HG1 ILE 6 1HG1 ILE 6 -2.444 -2.429 5.019 48 2HG1 ILE 6 2HG1 ILE 6 -2.099 -4.116 5.345 49 1HG2 ILE 6 1HG2 ILE 6 -0.756 -1.051 6.115 50 2HG2 ILE 6 2HG2 ILE 6 -2.276 -0.733 6.985 51 3HG2 ILE 6 3HG2 ILE 6 -0.779 -1.050 7.895 52 1HD1 ILE 6 1HD1 ILE 6 -4.143 -4.491 6.322 53 2HD1 ILE 6 2HD1 ILE 6 -4.170 -2.897 7.113 54 3HD1 ILE 6 3HD1 ILE 6 -4.616 -3.047 5.396 55 H LEU 7 H LEU 7 1.011 -2.370 5.281 56 HA LEU 7 HA LEU 7 2.747 -1.148 7.296 57 1HB LEU 7 1HB LEU 7 3.524 -3.286 5.719 58 2HB LEU 7 2HB LEU 7 4.136 -1.898 4.842 59 HG LEU 7 HG LEU 7 4.868 -1.370 7.476 60 1HD1 LEU 7 1HD1 LEU 7 4.182 -3.751 7.975 61 2HD1 LEU 7 2HD1 LEU 7 5.530 -4.270 6.934 62 3HD1 LEU 7 3HD1 LEU 7 5.855 -3.315 8.401 63 1HD2 LEU 7 1HD2 LEU 7 6.085 -1.146 5.200 64 2HD2 LEU 7 2HD2 LEU 7 7.045 -1.428 6.672 65 3HD2 LEU 7 3HD2 LEU 7 6.710 -2.774 5.557 66 H ILE 8 H ILE 8 3.521 0.938 6.744 67 HA ILE 8 HA ILE 8 2.276 2.035 4.319 68 HB ILE 8 HB ILE 8 2.489 3.189 7.091 69 1HG1 ILE 8 1HG1 ILE 8 0.046 3.088 5.332 70 2HG1 ILE 8 2HG1 ILE 8 0.537 1.679 6.252 71 1HG2 ILE 8 1HG2 ILE 8 2.742 5.230 6.265 72 2HG2 ILE 8 2HG2 ILE 8 2.747 4.596 4.601 73 3HG2 ILE 8 3HG2 ILE 8 1.209 5.040 5.380 74 1HD1 ILE 8 1HD1 ILE 8 -0.242 4.422 7.305 75 2HD1 ILE 8 2HD1 ILE 8 -0.972 2.844 7.685 76 3HD1 ILE 8 3HD1 ILE 8 0.643 3.251 8.313 77 H VAL 9 H VAL 9 3.903 2.240 2.861 78 HA VAL 9 HA VAL 9 6.521 3.044 3.867 79 HB VAL 9 HB VAL 9 5.770 2.205 1.069 80 1HG1 VAL 9 1HG1 VAL 9 8.410 1.531 2.215 81 2HG1 VAL 9 2HG1 VAL 9 7.981 2.185 0.616 82 3HG1 VAL 9 3HG1 VAL 9 8.097 3.272 2.021 83 1HG2 VAL 9 1HG2 VAL 9 6.719 0.373 3.296 84 2HG2 VAL 9 2HG2 VAL 9 5.035 0.485 2.728 85 3HG2 VAL 9 3HG2 VAL 9 6.312 -0.081 1.624 86 H ASP 10 H ASP 10 7.327 5.074 3.576 87 HA ASP 10 HA ASP 10 7.223 7.229 3.222 88 1HB ASP 10 1HB ASP 10 6.370 7.075 0.400 89 2HB ASP 10 2HB ASP 10 7.869 7.683 1.074 90 H ASP 11 H ASP 11 5.731 8.859 1.356 91 HA ASP 11 HA ASP 11 3.827 9.856 1.081 92 1HB ASP 11 1HB ASP 11 3.203 7.403 0.324 93 2HB ASP 11 2HB ASP 11 2.296 7.340 1.822 94 H GLN 12 H GLN 12 5.029 8.987 3.916 95 HA GLN 12 HA GLN 12 2.705 9.199 5.569 96 1HB GLN 12 1HB GLN 12 4.564 9.238 7.408 97 2HB GLN 12 2HB GLN 12 4.306 7.761 6.502 98 1HG GLN 12 1HG GLN 12 6.289 7.981 5.289 99 2HG GLN 12 2HG GLN 12 6.268 9.732 5.356 100 1HE2 GLN 12 1HE2 GLN 12 6.173 10.478 7.835 101 2HE2 GLN 12 2HE2 GLN 12 7.466 9.858 8.808 102 H TYR 13 H TYR 13 1.745 11.175 5.815 103 HA TYR 13 HA TYR 13 3.425 13.386 6.640 104 1HB TYR 13 1HB TYR 13 2.596 12.981 3.945 105 2HB TYR 13 2HB TYR 13 1.387 14.082 4.574 106 HD1 TYR 13 HD1 TYR 13 2.057 16.336 5.412 107 HD2 TYR 13 HD2 TYR 13 4.856 13.707 3.526 108 HE1 TYR 13 HE1 TYR 13 3.648 18.284 5.042 109 HE2 TYR 13 HE2 TYR 13 6.438 15.664 3.163 110 HH TYR 13 HH TYR 13 5.661 18.619 3.096 111 H GLY 14 H GLY 14 1.283 11.547 7.758 112 1HA GLY 14 1HA GLY 14 -0.089 12.319 9.555 113 2HA GLY 14 2HA GLY 14 -0.577 13.689 8.577 114 H ILE 15 H ILE 15 -0.479 11.367 6.280 115 HA ILE 15 HA ILE 15 -3.323 10.885 6.521 116 HB ILE 15 HB ILE 15 -1.275 10.613 4.348 117 1HG1 ILE 15 1HG1 ILE 15 -3.663 11.876 3.505 118 2HG1 ILE 15 2HG1 ILE 15 -3.315 12.513 5.100 119 1HG2 ILE 15 1HG2 ILE 15 -2.408 8.611 3.974 120 2HG2 ILE 15 2HG2 ILE 15 -3.973 9.282 4.491 121 3HG2 ILE 15 3HG2 ILE 15 -3.264 9.777 2.936 122 1HD1 ILE 15 1HD1 ILE 15 -1.042 13.139 4.425 123 2HD1 ILE 15 2HD1 ILE 15 -1.264 12.353 2.844 124 3HD1 ILE 15 3HD1 ILE 15 -2.203 13.809 3.254 125 H ARG 16 H ARG 16 -0.196 9.156 6.668 126 HA ARG 16 HA ARG 16 -1.095 6.610 6.445 127 1HB ARG 16 1HB ARG 16 0.885 6.109 8.099 128 2HB ARG 16 2HB ARG 16 1.255 6.870 6.565 129 1HG ARG 16 1HG ARG 16 1.514 9.031 7.558 130 2HG ARG 16 2HG ARG 16 0.664 8.564 9.017 131 1HD ARG 16 1HD ARG 16 3.165 7.028 8.331 132 2HD ARG 16 2HD ARG 16 3.365 8.674 8.900 133 HE ARG 16 HE ARG 16 1.548 7.024 10.533 134 1HH1 ARG 16 1HH1 ARG 16 4.843 8.167 10.065 135 2HH1 ARG 16 2HH1 ARG 16 5.317 7.863 11.703 136 1HH2 ARG 16 1HH2 ARG 16 2.172 6.623 12.694 137 2HH2 ARG 16 2HH2 ARG 16 3.787 6.979 13.209 138 H ILE 17 H ILE 17 -1.212 8.856 9.238 139 HA ILE 17 HA ILE 17 -2.039 6.853 11.089 140 HB ILE 17 HB ILE 17 -2.083 9.870 11.203 141 1HG1 ILE 17 1HG1 ILE 17 -0.179 8.616 12.948 142 2HG1 ILE 17 2HG1 ILE 17 0.060 8.001 11.325 143 1HG2 ILE 17 1HG2 ILE 17 -3.372 7.978 12.896 144 2HG2 ILE 17 2HG2 ILE 17 -1.993 8.667 13.786 145 3HG2 ILE 17 3HG2 ILE 17 -3.232 9.741 13.093 146 1HD1 ILE 17 1HD1 ILE 17 -0.152 10.965 12.032 147 2HD1 ILE 17 2HD1 ILE 17 1.373 10.088 11.762 148 3HD1 ILE 17 3HD1 ILE 17 0.214 10.289 10.426 149 H LEU 18 H LEU 18 -3.584 8.942 8.699 150 HA LEU 18 HA LEU 18 -6.154 8.969 9.785 151 1HB LEU 18 1HB LEU 18 -5.057 10.282 7.827 152 2HB LEU 18 2HB LEU 18 -5.594 8.939 6.838 153 HG LEU 18 HG LEU 18 -7.887 9.561 8.228 154 1HD1 LEU 18 1HD1 LEU 18 -8.041 12.104 7.803 155 2HD1 LEU 18 2HD1 LEU 18 -7.213 11.529 9.270 156 3HD1 LEU 18 3HD1 LEU 18 -6.262 12.069 7.865 157 1HD2 LEU 18 1HD2 LEU 18 -8.498 10.793 6.052 158 2HD2 LEU 18 2HD2 LEU 18 -6.863 10.351 5.507 159 3HD2 LEU 18 3HD2 LEU 18 -8.028 9.080 5.950 160 H LEU 19 H LEU 19 -4.863 6.879 7.099 161 HA LEU 19 HA LEU 19 -7.077 5.138 7.241 162 1HB LEU 19 1HB LEU 19 -6.200 4.190 5.414 163 2HB LEU 19 2HB LEU 19 -5.266 5.672 5.377 164 HG LEU 19 HG LEU 19 -3.833 3.791 4.913 165 1HD1 LEU 19 1HD1 LEU 19 -3.423 5.595 7.127 166 2HD1 LEU 19 2HD1 LEU 19 -2.559 4.064 7.403 167 3HD1 LEU 19 3HD1 LEU 19 -2.263 4.996 5.916 168 1HD2 LEU 19 1HD2 LEU 19 -3.871 1.806 5.948 169 2HD2 LEU 19 2HD2 LEU 19 -3.955 2.537 7.569 170 3HD2 LEU 19 3HD2 LEU 19 -5.436 2.348 6.600 171 H ASN 20 H ASN 20 -4.175 5.513 9.131 172 HA ASN 20 HA ASN 20 -3.781 2.888 9.881 173 1HB ASN 20 1HB ASN 20 -2.094 4.519 10.447 174 2HB ASN 20 2HB ASN 20 -3.252 5.562 11.247 175 1HD2 ASN 20 1HD2 ASN 20 -1.522 5.412 12.902 176 2HD2 ASN 20 2HD2 ASN 20 -1.618 4.158 14.093 177 H GLU 21 H GLU 21 -5.420 5.607 11.692 178 HA GLU 21 HA GLU 21 -6.390 4.187 13.760 179 1HB GLU 21 1HB GLU 21 -6.599 6.589 13.703 180 2HB GLU 21 2HB GLU 21 -7.593 6.544 12.260 181 1HG GLU 21 1HG GLU 21 -9.423 5.444 13.498 182 2HG GLU 21 2HG GLU 21 -8.423 5.319 14.932 183 H VAL 22 H VAL 22 -7.728 4.442 10.436 184 HA VAL 22 HA VAL 22 -10.201 3.309 10.868 185 HB VAL 22 HB VAL 22 -8.286 3.378 8.555 186 1HG1 VAL 22 1HG1 VAL 22 -10.567 1.571 8.878 187 2HG1 VAL 22 2HG1 VAL 22 -10.719 2.626 7.452 188 3HG1 VAL 22 3HG1 VAL 22 -9.284 1.589 7.643 189 1HG2 VAL 22 1HG2 VAL 22 -10.480 4.644 7.696 190 2HG2 VAL 22 2HG2 VAL 22 -10.717 4.865 9.447 191 3HG2 VAL 22 3HG2 VAL 22 -9.229 5.456 8.668 192 H PHE 23 H PHE 23 -7.147 1.623 9.829 193 HA PHE 23 HA PHE 23 -8.318 -0.927 10.263 194 1HB PHE 23 1HB PHE 23 -5.551 0.260 9.723 195 2HB PHE 23 2HB PHE 23 -5.699 -1.454 10.057 196 HD1 PHE 23 HD1 PHE 23 -6.096 -2.921 8.306 197 HD2 PHE 23 HD2 PHE 23 -7.076 1.177 7.804 198 HE1 PHE 23 HE1 PHE 23 -6.633 -3.345 5.891 199 HE2 PHE 23 HE2 PHE 23 -7.614 0.753 5.389 200 HZ PHE 23 HZ PHE 23 -7.386 -1.503 4.462 201 H ASN 24 H ASN 24 -6.168 1.276 12.117 202 HA ASN 24 HA ASN 24 -5.189 -0.382 13.974 203 1HB ASN 24 1HB ASN 24 -5.209 2.311 13.674 204 2HB ASN 24 2HB ASN 24 -6.400 2.209 14.956 205 1HD2 ASN 24 1HD2 ASN 24 -5.841 1.098 16.922 206 2HD2 ASN 24 2HD2 ASN 24 -4.205 1.080 17.491 207 H LYS 25 H LYS 25 -8.530 0.764 13.529 208 HA LYS 25 HA LYS 25 -9.589 0.357 16.031 209 1HB LYS 25 1HB LYS 25 -10.696 0.218 13.240 210 2HB LYS 25 2HB LYS 25 -11.708 -0.229 14.598 211 1HG LYS 25 1HG LYS 25 -11.397 1.957 15.647 212 2HG LYS 25 2HG LYS 25 -10.168 2.403 14.480 213 1HD LYS 25 1HD LYS 25 -12.063 3.486 13.609 214 2HD LYS 25 2HD LYS 25 -12.046 2.000 12.679 215 1HE LYS 25 1HE LYS 25 -13.497 1.340 15.017 216 2HE LYS 25 2HE LYS 25 -14.042 2.956 14.613 217 1HZ LYS 25 1HZ LYS 25 -14.129 1.910 12.243 218 2HZ LYS 25 2HZ LYS 25 -14.290 0.515 13.077 219 3HZ LYS 25 3HZ LYS 25 -15.368 1.723 13.291 220 H GLU 26 H GLU 26 -8.214 -1.940 13.814 221 HA GLU 26 HA GLU 26 -9.642 -4.118 15.063 222 1HB GLU 26 1HB GLU 26 -7.828 -3.851 12.659 223 2HB GLU 26 2HB GLU 26 -8.074 -5.432 13.374 224 1HG GLU 26 1HG GLU 26 -10.665 -4.239 13.194 225 2HG GLU 26 2HG GLU 26 -9.871 -3.898 11.670 226 H GLY 27 H GLY 27 -6.647 -2.343 15.282 227 1HA GLY 27 1HA GLY 27 -5.146 -2.512 17.020 228 2HA GLY 27 2HA GLY 27 -5.753 -4.107 17.419 229 H TYR 28 H TYR 28 -5.234 -3.668 14.017 230 HA TYR 28 HA TYR 28 -3.261 -5.664 13.932 231 1HB TYR 28 1HB TYR 28 -3.436 -5.195 11.553 232 2HB TYR 28 2HB TYR 28 -5.016 -4.776 12.185 233 HD1 TYR 28 HD1 TYR 28 -4.217 -2.114 13.488 234 HD2 TYR 28 HD2 TYR 28 -3.403 -3.787 9.635 235 HE1 TYR 28 HE1 TYR 28 -3.983 0.223 12.515 236 HE2 TYR 28 HE2 TYR 28 -3.171 -1.444 8.675 237 HH TYR 28 HH TYR 28 -2.871 0.701 9.223 238 H GLN 29 H GLN 29 -1.023 -5.556 13.355 239 HA GLN 29 HA GLN 29 0.227 -3.232 14.440 240 1HB GLN 29 1HB GLN 29 0.873 -5.894 14.431 241 2HB GLN 29 2HB GLN 29 1.887 -5.332 13.117 242 1HG GLN 29 1HG GLN 29 2.840 -3.561 14.605 243 2HG GLN 29 2HG GLN 29 1.822 -4.115 15.920 244 1HE2 GLN 29 1HE2 GLN 29 4.395 -4.043 16.429 245 2HE2 GLN 29 2HE2 GLN 29 5.131 -5.611 16.458 246 H THR 30 H THR 30 1.296 -1.601 13.323 247 HA THR 30 HA THR 30 1.475 -1.931 10.403 248 HB THR 30 HB THR 30 0.774 0.490 10.270 249 HG1 THR 30 HG1 THR 30 0.804 1.500 12.237 250 1HG2 THR 30 1HG2 THR 30 -1.559 -0.035 11.675 251 2HG2 THR 30 2HG2 THR 30 -1.268 -0.551 9.996 252 3HG2 THR 30 3HG2 THR 30 -0.969 -1.680 11.340 253 H PHE 31 H PHE 31 3.227 -0.906 9.359 254 HA PHE 31 HA PHE 31 5.223 0.221 11.172 255 1HB PHE 31 1HB PHE 31 5.242 -2.384 10.041 256 2HB PHE 31 2HB PHE 31 6.240 -1.463 8.933 257 HD1 PHE 31 HD1 PHE 31 6.057 -3.030 12.168 258 HD2 PHE 31 HD2 PHE 31 8.269 -0.272 9.821 259 HE1 PHE 31 HE1 PHE 31 8.007 -3.264 13.731 260 HE2 PHE 31 HE2 PHE 31 10.219 -0.506 11.384 261 HZ PHE 31 HZ PHE 31 10.065 -1.999 13.320 262 H GLN 32 H GLN 32 6.757 1.657 10.134 263 HA GLN 32 HA GLN 32 5.766 2.548 7.539 264 1HB GLN 32 1HB GLN 32 7.200 4.150 9.704 265 2HB GLN 32 2HB GLN 32 6.676 4.791 8.159 266 1HG GLN 32 1HG GLN 32 4.772 5.348 9.309 267 2HG GLN 32 2HG GLN 32 4.324 3.681 9.008 268 1HE2 GLN 32 1HE2 GLN 32 3.747 2.523 10.673 269 2HE2 GLN 32 2HE2 GLN 32 4.171 2.781 12.333 270 H ALA 33 H ALA 33 7.374 3.291 5.952 271 HA ALA 33 HA ALA 33 10.104 2.411 6.538 272 1HB ALA 33 1HB ALA 33 9.854 1.649 3.945 273 2HB ALA 33 2HB ALA 33 9.578 0.551 5.319 274 3HB ALA 33 3HB ALA 33 8.197 1.336 4.516 275 H ALA 34 H ALA 34 11.623 3.240 4.707 276 HA ALA 34 HA ALA 34 10.607 5.803 3.701 277 1HB ALA 34 1HB ALA 34 12.541 5.385 5.767 278 2HB ALA 34 2HB ALA 34 13.404 5.992 4.333 279 3HB ALA 34 3HB ALA 34 12.045 6.919 5.014 280 H ASN 35 H ASN 35 10.502 3.520 2.154 281 HA ASN 35 HA ASN 35 11.670 4.171 -0.112 282 1HB ASN 35 1HB ASN 35 13.728 3.125 1.700 283 2HB ASN 35 2HB ASN 35 13.592 2.097 0.288 284 1HD2 ASN 35 1HD2 ASN 35 15.793 3.745 0.993 285 2HD2 ASN 35 2HD2 ASN 35 16.029 4.928 -0.250 286 H GLY 36 H GLY 36 12.324 1.835 -1.430 287 1HA GLY 36 1HA GLY 36 9.952 0.201 -1.036 288 2HA GLY 36 2HA GLY 36 11.079 0.153 -2.377 289 H LEU 37 H LEU 37 13.563 -0.124 -0.999 290 HA LEU 37 HA LEU 37 13.606 -2.877 -0.592 291 1HB LEU 37 1HB LEU 37 15.433 -0.789 -0.888 292 2HB LEU 37 2HB LEU 37 15.789 -1.459 0.692 293 HG LEU 37 HG LEU 37 15.472 -3.356 -1.601 294 1HD1 LEU 37 1HD1 LEU 37 17.745 -3.057 -2.342 295 2HD1 LEU 37 2HD1 LEU 37 16.877 -1.510 -2.480 296 3HD1 LEU 37 3HD1 LEU 37 18.014 -1.775 -1.137 297 1HD2 LEU 37 1HD2 LEU 37 16.493 -4.822 -0.250 298 2HD2 LEU 37 2HD2 LEU 37 17.703 -3.637 0.295 299 3HD2 LEU 37 3HD2 LEU 37 16.089 -3.669 1.044 300 H GLN 38 H GLN 38 13.801 -0.148 1.798 301 HA GLN 38 HA GLN 38 13.984 -1.646 4.040 302 1HB GLN 38 1HB GLN 38 13.203 1.078 3.344 303 2HB GLN 38 2HB GLN 38 12.257 0.507 4.704 304 1HG GLN 38 1HG GLN 38 14.362 -0.171 5.881 305 2HG GLN 38 2HG GLN 38 15.306 0.406 4.522 306 1HE2 GLN 38 1HE2 GLN 38 16.077 2.364 4.652 307 2HE2 GLN 38 2HE2 GLN 38 15.470 3.673 5.609 308 H ALA 39 H ALA 39 11.199 -1.176 1.912 309 HA ALA 39 HA ALA 39 9.341 -2.220 3.862 310 1HB ALA 39 1HB ALA 39 9.079 -0.458 1.828 311 2HB ALA 39 2HB ALA 39 8.623 -1.953 0.977 312 3HB ALA 39 3HB ALA 39 7.728 -1.448 2.430 313 H LEU 40 H LEU 40 11.424 -3.334 1.234 314 HA LEU 40 HA LEU 40 10.049 -5.713 0.662 315 1HB LEU 40 1HB LEU 40 12.786 -4.625 0.191 316 2HB LEU 40 2HB LEU 40 12.524 -6.342 -0.040 317 HG LEU 40 HG LEU 40 11.173 -4.060 -1.495 318 1HD1 LEU 40 1HD1 LEU 40 13.203 -6.150 -2.226 319 2HD1 LEU 40 2HD1 LEU 40 12.131 -5.462 -3.469 320 3HD1 LEU 40 3HD1 LEU 40 13.209 -4.397 -2.536 321 1HD2 LEU 40 1HD2 LEU 40 10.125 -6.047 -2.816 322 2HD2 LEU 40 2HD2 LEU 40 10.402 -6.956 -1.311 323 3HD2 LEU 40 3HD2 LEU 40 9.379 -5.500 -1.296 324 H ASP 41 H ASP 41 12.570 -4.820 3.068 325 HA ASP 41 HA ASP 41 12.868 -7.484 3.941 326 1HB ASP 41 1HB ASP 41 14.643 -5.779 4.222 327 2HB ASP 41 2HB ASP 41 13.589 -4.814 5.236 328 H ILE 42 H ILE 42 11.291 -4.467 5.234 329 HA ILE 42 HA ILE 42 10.231 -5.675 7.528 330 HB ILE 42 HB ILE 42 9.558 -3.179 5.986 331 1HG1 ILE 42 1HG1 ILE 42 11.472 -3.910 8.058 332 2HG1 ILE 42 2HG1 ILE 42 11.418 -2.499 7.020 333 1HG2 ILE 42 1HG2 ILE 42 7.501 -3.898 7.048 334 2HG2 ILE 42 2HG2 ILE 42 8.347 -4.127 8.597 335 3HG2 ILE 42 3HG2 ILE 42 8.175 -2.494 7.910 336 1HD1 ILE 42 1HD1 ILE 42 9.772 -1.412 8.491 337 2HD1 ILE 42 2HD1 ILE 42 9.684 -2.872 9.506 338 3HD1 ILE 42 3HD1 ILE 42 11.186 -1.918 9.446 339 H VAL 43 H VAL 43 9.326 -5.765 4.144 340 HA VAL 43 HA VAL 43 6.616 -6.174 4.297 341 HB VAL 43 HB VAL 43 8.806 -6.709 2.448 342 1HG1 VAL 43 1HG1 VAL 43 7.459 -8.309 1.037 343 2HG1 VAL 43 2HG1 VAL 43 8.141 -9.006 2.526 344 3HG1 VAL 43 3HG1 VAL 43 6.415 -8.575 2.454 345 1HG2 VAL 43 1HG2 VAL 43 7.579 -5.381 1.107 346 2HG2 VAL 43 2HG2 VAL 43 6.082 -6.298 1.401 347 3HG2 VAL 43 3HG2 VAL 43 6.612 -5.061 2.567 348 H THR 44 H THR 44 9.238 -8.695 4.386 349 HA THR 44 HA THR 44 7.336 -10.698 5.185 350 HB THR 44 HB THR 44 10.394 -10.794 5.102 351 HG1 THR 44 HG1 THR 44 8.347 -11.403 3.091 352 1HG2 THR 44 1HG2 THR 44 8.884 -12.769 6.036 353 2HG2 THR 44 2HG2 THR 44 8.438 -12.985 4.326 354 3HG2 THR 44 3HG2 THR 44 10.139 -13.137 4.827 355 H LYS 45 H LYS 45 9.747 -8.583 6.759 356 HA LYS 45 HA LYS 45 9.843 -9.916 9.195 357 1HB LYS 45 1HB LYS 45 10.934 -7.603 8.056 358 2HB LYS 45 2HB LYS 45 10.032 -7.020 9.440 359 1HG LYS 45 1HG LYS 45 11.337 -9.381 10.343 360 2HG LYS 45 2HG LYS 45 12.532 -8.537 9.378 361 1HD LYS 45 1HD LYS 45 11.068 -6.655 11.082 362 2HD LYS 45 2HD LYS 45 11.761 -7.946 12.044 363 1HE LYS 45 1HE LYS 45 13.426 -6.183 11.878 364 2HE LYS 45 2HE LYS 45 13.991 -7.533 10.914 365 1HZ LYS 45 1HZ LYS 45 14.097 -5.314 9.840 366 2HZ LYS 45 2HZ LYS 45 13.322 -6.452 8.963 367 3HZ LYS 45 3HZ LYS 45 12.466 -5.311 9.758 368 H GLU 46 H GLU 46 7.516 -7.530 7.856 369 HA GLU 46 HA GLU 46 6.007 -7.795 10.327 370 1HB GLU 46 1HB GLU 46 6.328 -5.655 8.284 371 2HB GLU 46 2HB GLU 46 4.687 -5.869 8.859 372 1HG GLU 46 1HG GLU 46 6.637 -5.952 11.067 373 2HG GLU 46 2HG GLU 46 6.741 -4.453 10.164 374 H ARG 47 H ARG 47 6.261 -9.137 7.241 375 HA ARG 47 HA ARG 47 4.774 -9.913 5.773 376 1HB ARG 47 1HB ARG 47 3.726 -11.971 6.689 377 2HB ARG 47 2HB ARG 47 5.348 -11.774 7.323 378 1HG ARG 47 1HG ARG 47 4.600 -11.557 9.467 379 2HG ARG 47 2HG ARG 47 3.363 -10.404 9.008 380 1HD ARG 47 1HD ARG 47 3.193 -13.443 8.961 381 2HD ARG 47 2HD ARG 47 2.181 -12.322 9.849 382 HE ARG 47 HE ARG 47 1.777 -11.584 7.205 383 1HH1 ARG 47 1HH1 ARG 47 1.514 -14.619 8.968 384 2HH1 ARG 47 2HH1 ARG 47 0.271 -15.254 7.943 385 1HH2 ARG 47 1HH2 ARG 47 0.137 -12.422 5.853 386 2HH2 ARG 47 2HH2 ARG 47 -0.518 -13.996 6.159 387 HA PRO 48 HA PRO 48 1.104 -7.521 7.192 388 1HB PRO 48 1HB PRO 48 1.245 -5.423 5.446 389 2HB PRO 48 2HB PRO 48 1.881 -5.356 7.078 390 1HG PRO 48 1HG PRO 48 3.350 -5.617 4.527 391 2HG PRO 48 2HG PRO 48 3.955 -5.128 6.097 392 1HD PRO 48 1HD PRO 48 4.308 -7.683 4.841 393 2HD PRO 48 2HD PRO 48 4.811 -7.231 6.458 394 H ASP 49 H ASP 49 -0.999 -7.435 6.319 395 HA ASP 49 HA ASP 49 -1.191 -9.246 4.144 396 1HB ASP 49 1HB ASP 49 -3.385 -7.577 5.457 397 2HB ASP 49 2HB ASP 49 -3.624 -9.009 4.476 398 H LEU 50 H LEU 50 -0.533 -5.951 4.394 399 HA LEU 50 HA LEU 50 -1.051 -5.479 1.654 400 1HB LEU 50 1HB LEU 50 -3.327 -5.218 2.924 401 2HB LEU 50 2HB LEU 50 -2.656 -3.680 3.429 402 HG LEU 50 HG LEU 50 -2.281 -3.157 0.970 403 1HD1 LEU 50 1HD1 LEU 50 -3.156 -5.862 0.697 404 2HD1 LEU 50 2HD1 LEU 50 -4.336 -4.798 -0.105 405 3HD1 LEU 50 3HD1 LEU 50 -2.617 -4.723 -0.560 406 1HD2 LEU 50 1HD2 LEU 50 -4.126 -1.934 1.149 407 2HD2 LEU 50 2HD2 LEU 50 -5.167 -3.374 1.044 408 3HD2 LEU 50 3HD2 LEU 50 -4.521 -2.856 2.620 409 H VAL 51 H VAL 51 -0.016 -3.520 0.927 410 HA VAL 51 HA VAL 51 1.463 -2.100 3.013 411 HB VAL 51 HB VAL 51 2.641 -3.335 0.516 412 1HG1 VAL 51 1HG1 VAL 51 3.727 -1.245 0.789 413 2HG1 VAL 51 2HG1 VAL 51 3.805 -1.426 2.558 414 3HG1 VAL 51 3HG1 VAL 51 4.816 -2.453 1.512 415 1HG2 VAL 51 1HG2 VAL 51 2.312 -4.983 2.271 416 2HG2 VAL 51 2HG2 VAL 51 4.045 -4.608 2.119 417 3HG2 VAL 51 3HG2 VAL 51 3.100 -3.919 3.461 418 H LEU 52 H LEU 52 1.851 0.096 2.545 419 HA LEU 52 HA LEU 52 0.573 1.017 0.064 420 1HB LEU 52 1HB LEU 52 -0.908 1.793 1.590 421 2HB LEU 52 2HB LEU 52 0.270 1.868 2.885 422 HG LEU 52 HG LEU 52 0.662 3.815 0.680 423 1HD1 LEU 52 1HD1 LEU 52 -1.073 5.343 1.749 424 2HD1 LEU 52 2HD1 LEU 52 -1.682 4.031 0.712 425 3HD1 LEU 52 3HD1 LEU 52 -1.759 3.874 2.483 426 1HD2 LEU 52 1HD2 LEU 52 0.684 5.156 3.083 427 2HD2 LEU 52 2HD2 LEU 52 1.257 3.532 3.534 428 3HD2 LEU 52 3HD2 LEU 52 2.100 4.452 2.265 429 H LEU 53 H LEU 53 2.155 1.582 -1.335 430 HA LEU 53 HA LEU 53 4.393 3.114 -0.205 431 1HB LEU 53 1HB LEU 53 5.095 0.865 -0.823 432 2HB LEU 53 2HB LEU 53 4.451 1.081 -2.439 433 HG LEU 53 HG LEU 53 6.550 2.975 -1.422 434 1HD1 LEU 53 1HD1 LEU 53 7.157 0.263 -2.629 435 2HD1 LEU 53 2HD1 LEU 53 8.330 1.522 -2.177 436 3HD1 LEU 53 3HD1 LEU 53 7.377 0.701 -0.918 437 1HD2 LEU 53 1HD2 LEU 53 5.895 3.750 -3.460 438 2HD2 LEU 53 2HD2 LEU 53 7.146 2.598 -3.988 439 3HD2 LEU 53 3HD2 LEU 53 5.427 2.139 -4.054 440 H ASP 54 H ASP 54 5.090 4.937 -1.389 441 HA ASP 54 HA ASP 54 3.091 5.806 -3.299 442 1HB ASP 54 1HB ASP 54 3.328 7.509 -1.716 443 2HB ASP 54 2HB ASP 54 5.020 7.154 -1.429 444 H MET 55 H MET 55 3.655 5.819 -5.485 445 HA MET 55 HA MET 55 6.037 4.831 -6.380 446 1HB MET 55 1HB MET 55 4.244 6.836 -7.855 447 2HB MET 55 2HB MET 55 5.265 5.617 -8.594 448 1HG MET 55 1HG MET 55 2.695 5.215 -7.023 449 2HG MET 55 2HG MET 55 3.069 4.673 -8.646 450 1HE MET 55 1HE MET 55 3.085 2.442 -5.001 451 2HE MET 55 2HE MET 55 4.324 3.675 -4.666 452 3HE MET 55 3HE MET 55 2.720 4.164 -5.262 453 H LYS 56 H LYS 56 4.953 8.306 -6.314 454 HA LYS 56 HA LYS 56 7.418 9.294 -7.231 455 1HB LYS 56 1HB LYS 56 4.888 10.394 -6.140 456 2HB LYS 56 2HB LYS 56 6.303 11.408 -5.941 457 1HG LYS 56 1HG LYS 56 6.574 10.501 -8.572 458 2HG LYS 56 2HG LYS 56 4.839 10.687 -8.411 459 1HD LYS 56 1HD LYS 56 4.963 12.974 -8.287 460 2HD LYS 56 2HD LYS 56 6.365 12.942 -7.237 461 1HE LYS 56 1HE LYS 56 7.857 12.516 -9.151 462 2HE LYS 56 2HE LYS 56 6.488 12.354 -10.232 463 1HZ LYS 56 1HZ LYS 56 7.542 14.755 -8.984 464 2HZ LYS 56 2HZ LYS 56 7.074 14.513 -10.529 465 3HZ LYS 56 3HZ LYS 56 5.953 14.707 -9.358 466 H ILE 57 H ILE 57 9.315 8.951 -6.196 467 HA ILE 57 HA ILE 57 9.376 9.631 -3.355 468 HB ILE 57 HB ILE 57 10.617 7.144 -4.536 469 1HG1 ILE 57 1HG1 ILE 57 8.110 7.090 -4.296 470 2HG1 ILE 57 2HG1 ILE 57 8.983 5.861 -3.401 471 1HG2 ILE 57 1HG2 ILE 57 11.840 8.370 -2.655 472 2HG2 ILE 57 2HG2 ILE 57 10.472 7.898 -1.618 473 3HG2 ILE 57 3HG2 ILE 57 11.465 6.648 -2.406 474 1HD1 ILE 57 1HD1 ILE 57 8.223 8.504 -2.105 475 2HD1 ILE 57 2HD1 ILE 57 7.097 7.126 -2.151 476 3HD1 ILE 57 3HD1 ILE 57 8.660 6.971 -1.313 477 HA PRO 58 HA PRO 58 12.747 11.895 -4.883 478 1HB PRO 58 1HB PRO 58 13.572 13.011 -2.529 479 2HB PRO 58 2HB PRO 58 12.269 13.671 -3.497 480 1HG PRO 58 1HG PRO 58 12.111 12.145 -0.970 481 2HG PRO 58 2HG PRO 58 10.894 13.160 -1.717 482 1HD PRO 58 1HD PRO 58 10.967 10.293 -1.709 483 2HD PRO 58 2HD PRO 58 9.816 11.309 -2.552 484 H GLY 59 H GLY 59 14.855 11.575 -5.395 485 1HA GLY 59 1HA GLY 59 16.989 10.828 -4.989 486 2HA GLY 59 2HA GLY 59 16.467 10.083 -3.491 487 H MET 60 H MET 60 14.045 8.924 -5.149 488 HA MET 60 HA MET 60 14.935 7.304 -7.129 489 1HB MET 60 1HB MET 60 16.162 6.521 -4.721 490 2HB MET 60 2HB MET 60 14.797 5.427 -4.822 491 1HG MET 60 1HG MET 60 15.620 5.152 -7.362 492 2HG MET 60 2HG MET 60 17.146 5.708 -6.704 493 1HE MET 60 1HE MET 60 15.154 2.338 -7.286 494 2HE MET 60 2HE MET 60 14.786 1.971 -5.584 495 3HE MET 60 3HE MET 60 14.196 3.482 -6.316 496 H ASP 61 H ASP 61 12.915 7.223 -8.039 497 HA ASP 61 HA ASP 61 10.594 7.207 -6.526 498 1HB ASP 61 1HB ASP 61 9.683 6.272 -8.880 499 2HB ASP 61 2HB ASP 61 10.159 7.946 -8.670 500 H GLY 62 H GLY 62 8.854 5.266 -7.366 501 1HA GLY 62 1HA GLY 62 10.182 2.723 -6.637 502 2HA GLY 62 2HA GLY 62 8.570 3.186 -6.129 503 H ILE 63 H ILE 63 10.188 3.523 -9.359 504 HA ILE 63 HA ILE 63 7.850 2.334 -10.575 505 HB ILE 63 HB ILE 63 10.346 3.510 -11.801 506 1HG1 ILE 63 1HG1 ILE 63 7.669 4.876 -11.702 507 2HG1 ILE 63 2HG1 ILE 63 8.751 4.980 -10.328 508 1HG2 ILE 63 1HG2 ILE 63 9.073 1.876 -13.218 509 2HG2 ILE 63 2HG2 ILE 63 7.673 2.969 -13.112 510 3HG2 ILE 63 3HG2 ILE 63 9.180 3.524 -13.880 511 1HD1 ILE 63 1HD1 ILE 63 10.571 5.819 -11.840 512 2HD1 ILE 63 2HD1 ILE 63 9.422 5.775 -13.198 513 3HD1 ILE 63 3HD1 ILE 63 9.143 6.881 -11.832 514 H GLU 64 H GLU 64 11.382 1.690 -10.189 515 HA GLU 64 HA GLU 64 11.046 -0.825 -11.530 516 1HB GLU 64 1HB GLU 64 13.516 -1.053 -11.100 517 2HB GLU 64 2HB GLU 64 13.089 0.396 -11.987 518 1HG GLU 64 1HG GLU 64 14.073 1.671 -10.395 519 2HG GLU 64 2HG GLU 64 12.939 1.068 -9.203 520 H ILE 65 H ILE 65 11.234 0.503 -8.251 521 HA ILE 65 HA ILE 65 11.948 -1.829 -6.898 522 HB ILE 65 HB ILE 65 10.263 0.510 -5.996 523 1HG1 ILE 65 1HG1 ILE 65 13.257 0.043 -5.864 524 2HG1 ILE 65 2HG1 ILE 65 12.432 1.217 -6.871 525 1HG2 ILE 65 1HG2 ILE 65 10.727 -1.925 -4.691 526 2HG2 ILE 65 2HG2 ILE 65 11.855 -0.768 -3.945 527 3HG2 ILE 65 3HG2 ILE 65 10.111 -0.413 -3.982 528 1HD1 ILE 65 1HD1 ILE 65 12.493 2.703 -5.168 529 2HD1 ILE 65 2HD1 ILE 65 11.482 1.611 -4.192 530 3HD1 ILE 65 3HD1 ILE 65 13.256 1.483 -4.120 531 H LEU 66 H LEU 66 8.641 -0.375 -7.336 532 HA LEU 66 HA LEU 66 7.287 -2.583 -6.340 533 1HB LEU 66 1HB LEU 66 6.584 -0.249 -8.071 534 2HB LEU 66 2HB LEU 66 5.426 -1.551 -7.890 535 HG LEU 66 HG LEU 66 4.755 -0.088 -6.246 536 1HD1 LEU 66 1HD1 LEU 66 6.729 -1.551 -4.520 537 2HD1 LEU 66 2HD1 LEU 66 5.013 -1.178 -4.226 538 3HD1 LEU 66 3HD1 LEU 66 5.461 -2.446 -5.392 539 1HD2 LEU 66 1HD2 LEU 66 7.530 0.797 -6.317 540 2HD2 LEU 66 2HD2 LEU 66 6.048 1.693 -5.908 541 3HD2 LEU 66 3HD2 LEU 66 6.880 0.732 -4.662 542 H LYS 67 H LYS 67 8.709 -1.910 -9.528 543 HA LYS 67 HA LYS 67 7.311 -3.857 -10.965 544 1HB LYS 67 1HB LYS 67 9.427 -1.986 -11.402 545 2HB LYS 67 2HB LYS 67 9.964 -3.547 -11.989 546 1HG LYS 67 1HG LYS 67 7.424 -3.577 -12.974 547 2HG LYS 67 2HG LYS 67 7.680 -1.844 -12.933 548 1HD LYS 67 1HD LYS 67 8.409 -2.608 -15.108 549 2HD LYS 67 2HD LYS 67 9.853 -2.193 -14.206 550 1HE LYS 67 1HE LYS 67 9.485 -4.876 -13.529 551 2HE LYS 67 2HE LYS 67 8.947 -4.837 -15.196 552 1HZ LYS 67 1HZ LYS 67 11.111 -4.976 -15.613 553 2HZ LYS 67 2HZ LYS 67 11.167 -3.375 -15.298 554 3HZ LYS 67 3HZ LYS 67 11.571 -4.449 -14.137 555 H ARG 68 H ARG 68 10.691 -4.014 -9.624 556 HA ARG 68 HA ARG 68 11.058 -6.652 -10.116 557 1HB ARG 68 1HB ARG 68 12.203 -4.638 -8.227 558 2HB ARG 68 2HB ARG 68 12.472 -6.306 -7.761 559 1HG ARG 68 1HG ARG 68 13.531 -6.811 -9.910 560 2HG ARG 68 2HG ARG 68 13.088 -5.242 -10.555 561 1HD ARG 68 1HD ARG 68 15.265 -4.753 -9.917 562 2HD ARG 68 2HD ARG 68 14.459 -4.358 -8.412 563 HE ARG 68 HE ARG 68 15.081 -7.148 -8.377 564 1HH1 ARG 68 1HH1 ARG 68 16.715 -4.033 -8.283 565 2HH1 ARG 68 2HH1 ARG 68 18.075 -4.629 -7.390 566 1HH2 ARG 68 1HH2 ARG 68 16.874 -7.935 -7.199 567 2HH2 ARG 68 2HH2 ARG 68 18.165 -6.864 -6.770 568 H MET 69 H MET 69 9.177 -5.056 -7.565 569 HA MET 69 HA MET 69 9.100 -7.098 -5.721 570 1HB MET 69 1HB MET 69 7.932 -4.552 -6.111 571 2HB MET 69 2HB MET 69 6.547 -5.623 -6.057 572 1HG MET 69 1HG MET 69 7.624 -6.636 -3.909 573 2HG MET 69 2HG MET 69 8.689 -5.245 -3.924 574 1HE MET 69 1HE MET 69 6.871 -3.169 -1.640 575 2HE MET 69 2HE MET 69 8.340 -4.007 -2.195 576 3HE MET 69 3HE MET 69 7.697 -2.630 -3.121 577 H LYS 70 H LYS 70 6.741 -6.323 -8.382 578 HA LYS 70 HA LYS 70 5.242 -8.686 -7.906 579 1HB LYS 70 1HB LYS 70 3.828 -7.917 -9.564 580 2HB LYS 70 2HB LYS 70 4.511 -6.426 -8.948 581 1HG LYS 70 1HG LYS 70 4.678 -6.212 -11.314 582 2HG LYS 70 2HG LYS 70 6.300 -6.637 -10.804 583 1HD LYS 70 1HD LYS 70 6.259 -8.587 -11.975 584 2HD LYS 70 2HD LYS 70 4.717 -9.052 -11.286 585 1HE LYS 70 1HE LYS 70 3.475 -8.028 -13.006 586 2HE LYS 70 2HE LYS 70 4.744 -6.881 -13.389 587 1HZ LYS 70 1HZ LYS 70 4.677 -8.520 -15.064 588 2HZ LYS 70 2HZ LYS 70 6.043 -8.789 -14.211 589 3HZ LYS 70 3HZ LYS 70 4.743 -9.753 -13.996 590 H VAL 71 H VAL 71 7.876 -7.709 -10.148 591 HA VAL 71 HA VAL 71 7.777 -9.964 -11.779 592 HB VAL 71 HB VAL 71 10.203 -8.338 -10.999 593 1HG1 VAL 71 1HG1 VAL 71 9.687 -9.479 -13.729 594 2HG1 VAL 71 2HG1 VAL 71 11.229 -9.095 -12.927 595 3HG1 VAL 71 3HG1 VAL 71 10.306 -10.538 -12.439 596 1HG2 VAL 71 1HG2 VAL 71 9.402 -6.547 -12.071 597 2HG2 VAL 71 2HG2 VAL 71 8.887 -7.526 -13.465 598 3HG2 VAL 71 3HG2 VAL 71 7.812 -7.348 -12.057 599 H ILE 72 H ILE 72 9.087 -9.408 -8.521 600 HA ILE 72 HA ILE 72 10.681 -11.758 -8.498 601 HB ILE 72 HB ILE 72 9.825 -9.671 -6.569 602 1HG1 ILE 72 1HG1 ILE 72 11.924 -9.653 -8.022 603 2HG1 ILE 72 2HG1 ILE 72 12.121 -9.301 -6.317 604 1HG2 ILE 72 1HG2 ILE 72 10.536 -12.481 -5.795 605 2HG2 ILE 72 2HG2 ILE 72 11.068 -11.118 -4.782 606 3HG2 ILE 72 3HG2 ILE 72 9.334 -11.372 -5.093 607 1HD1 ILE 72 1HD1 ILE 72 12.317 -12.192 -7.004 608 2HD1 ILE 72 2HD1 ILE 72 13.603 -11.165 -7.683 609 3HD1 ILE 72 3HD1 ILE 72 13.333 -11.207 -5.924 610 H ASP 73 H ASP 73 7.323 -10.905 -7.546 611 HA ASP 73 HA ASP 73 6.643 -13.656 -7.745 612 1HB ASP 73 1HB ASP 73 7.161 -12.438 -5.134 613 2HB ASP 73 2HB ASP 73 5.484 -12.933 -5.247 614 H GLU 74 H GLU 74 4.190 -13.893 -7.600 615 HA GLU 74 HA GLU 74 2.952 -11.330 -8.208 616 1HB GLU 74 1HB GLU 74 1.489 -12.446 -9.676 617 2HB GLU 74 2HB GLU 74 2.999 -13.304 -9.907 618 1HG GLU 74 1HG GLU 74 2.234 -15.027 -8.222 619 2HG GLU 74 2HG GLU 74 0.699 -14.190 -8.102 620 H ASN 75 H ASN 75 3.210 -13.783 -5.825 621 HA ASN 75 HA ASN 75 0.557 -13.752 -4.914 622 1HB ASN 75 1HB ASN 75 1.776 -14.610 -2.728 623 2HB ASN 75 2HB ASN 75 1.804 -15.619 -4.161 624 1HD2 ASN 75 1HD2 ASN 75 3.679 -16.522 -4.463 625 2HD2 ASN 75 2HD2 ASN 75 5.243 -15.820 -4.215 626 H ILE 76 H ILE 76 3.221 -11.532 -4.777 627 HA ILE 76 HA ILE 76 2.761 -10.393 -2.241 628 HB ILE 76 HB ILE 76 4.845 -10.245 -3.593 629 1HG1 ILE 76 1HG1 ILE 76 3.521 -7.836 -2.377 630 2HG1 ILE 76 2HG1 ILE 76 4.797 -8.846 -1.728 631 1HG2 ILE 76 1HG2 ILE 76 5.067 -8.679 -5.380 632 2HG2 ILE 76 2HG2 ILE 76 3.689 -9.740 -5.760 633 3HG2 ILE 76 3HG2 ILE 76 3.403 -8.090 -5.154 634 1HD1 ILE 76 1HD1 ILE 76 4.978 -6.703 -3.858 635 2HD1 ILE 76 2HD1 ILE 76 5.977 -6.925 -2.402 636 3HD1 ILE 76 3HD1 ILE 76 6.193 -8.002 -3.802 637 H ARG 77 H ARG 77 1.380 -8.790 -1.553 638 HA ARG 77 HA ARG 77 -0.380 -7.753 -3.628 639 1HB ARG 77 1HB ARG 77 -1.823 -9.121 -2.357 640 2HB ARG 77 2HB ARG 77 -0.962 -8.822 -0.860 641 1HG ARG 77 1HG ARG 77 -1.906 -6.612 -0.634 642 2HG ARG 77 2HG ARG 77 -2.481 -6.603 -2.289 643 1HD ARG 77 1HD ARG 77 -3.591 -8.921 -0.937 644 2HD ARG 77 2HD ARG 77 -3.874 -7.505 0.056 645 HE ARG 77 HE ARG 77 -5.244 -6.577 -1.648 646 1HH1 ARG 77 1HH1 ARG 77 -3.689 -9.532 -2.757 647 2HH1 ARG 77 2HH1 ARG 77 -4.690 -9.683 -4.162 648 1HH2 ARG 77 1HH2 ARG 77 -6.565 -6.776 -3.501 649 2HH2 ARG 77 2HH2 ARG 77 -6.337 -8.105 -4.588 650 H VAL 78 H VAL 78 0.172 -5.610 -3.934 651 HA VAL 78 HA VAL 78 0.360 -3.946 -1.548 652 HB VAL 78 HB VAL 78 2.649 -4.773 -2.419 653 1HG1 VAL 78 1HG1 VAL 78 2.165 -2.571 -4.449 654 2HG1 VAL 78 2HG1 VAL 78 3.619 -3.581 -4.265 655 3HG1 VAL 78 3HG1 VAL 78 2.095 -4.310 -4.825 656 1HG2 VAL 78 1HG2 VAL 78 2.835 -1.845 -2.372 657 2HG2 VAL 78 2HG2 VAL 78 1.819 -2.509 -1.070 658 3HG2 VAL 78 3HG2 VAL 78 3.503 -3.056 -1.251 659 H ILE 79 H ILE 79 -0.234 -1.735 -1.934 660 HA ILE 79 HA ILE 79 -1.572 -1.389 -4.527 661 HB ILE 79 HB ILE 79 -2.406 -0.892 -1.744 662 1HG1 ILE 79 1HG1 ILE 79 -3.653 -1.694 -4.356 663 2HG1 ILE 79 2HG1 ILE 79 -3.623 -2.550 -2.827 664 1HG2 ILE 79 1HG2 ILE 79 -2.088 1.416 -2.539 665 2HG2 ILE 79 2HG2 ILE 79 -3.149 1.076 -3.926 666 3HG2 ILE 79 3HG2 ILE 79 -3.803 1.022 -2.272 667 1HD1 ILE 79 1HD1 ILE 79 -5.199 -0.004 -3.425 668 2HD1 ILE 79 2HD1 ILE 79 -5.870 -1.639 -3.213 669 3HD1 ILE 79 3HD1 ILE 79 -5.124 -0.798 -1.834 670 H ILE 80 H ILE 80 -1.279 0.561 -5.654 671 HA ILE 80 HA ILE 80 0.953 2.159 -4.621 672 HB ILE 80 HB ILE 80 1.581 2.605 -6.827 673 1HG1 ILE 80 1HG1 ILE 80 0.162 1.728 -8.779 674 2HG1 ILE 80 2HG1 ILE 80 -1.149 1.586 -7.624 675 1HG2 ILE 80 1HG2 ILE 80 2.265 0.534 -7.548 676 2HG2 ILE 80 2HG2 ILE 80 1.814 0.174 -5.864 677 3HG2 ILE 80 3HG2 ILE 80 0.701 -0.235 -7.191 678 1HD1 ILE 80 1HD1 ILE 80 0.181 4.183 -7.364 679 2HD1 ILE 80 2HD1 ILE 80 -0.395 3.909 -9.026 680 3HD1 ILE 80 3HD1 ILE 80 -1.536 3.820 -7.663 681 H MET 81 H MET 81 0.865 4.509 -4.959 682 HA MET 81 HA MET 81 -1.823 5.494 -5.412 683 1HB MET 81 1HB MET 81 -0.781 7.090 -3.309 684 2HB MET 81 2HB MET 81 -2.071 5.913 -3.167 685 1HG MET 81 1HG MET 81 -0.386 4.116 -2.714 686 2HG MET 81 2HG MET 81 0.908 5.288 -2.865 687 1HE MET 81 1HE MET 81 1.923 4.925 -0.666 688 2HE MET 81 2HE MET 81 1.784 6.686 -0.879 689 3HE MET 81 3HE MET 81 1.422 5.950 0.700 690 H THR 82 H THR 82 -1.826 7.293 -6.716 691 HA THR 82 HA THR 82 0.078 9.332 -6.587 692 HB THR 82 HB THR 82 1.786 8.024 -7.541 693 HG1 THR 82 HG1 THR 82 1.855 9.007 -9.567 694 1HG2 THR 82 1HG2 THR 82 1.036 6.571 -9.688 695 2HG2 THR 82 2HG2 THR 82 0.955 5.889 -8.045 696 3HG2 THR 82 3HG2 THR 82 -0.515 6.536 -8.814 697 H ALA 83 H ALA 83 -0.517 11.112 -7.830 698 HA ALA 83 HA ALA 83 -3.186 11.252 -8.538 699 1HB ALA 83 1HB ALA 83 -2.560 13.424 -9.516 700 2HB ALA 83 2HB ALA 83 -1.735 13.173 -7.959 701 3HB ALA 83 3HB ALA 83 -0.843 12.954 -9.484 702 H TYR 84 H TYR 84 -4.161 11.618 -10.704 703 HA TYR 84 HA TYR 84 -3.237 9.597 -12.519 704 1HB TYR 84 1HB TYR 84 -5.333 10.456 -13.738 705 2HB TYR 84 2HB TYR 84 -5.644 9.991 -12.077 706 HD1 TYR 84 HD1 TYR 84 -6.114 11.683 -10.358 707 HD2 TYR 84 HD2 TYR 84 -5.413 12.798 -14.429 708 HE1 TYR 84 HE1 TYR 84 -7.077 13.991 -9.899 709 HE2 TYR 84 HE2 TYR 84 -6.378 15.102 -13.956 710 HH TYR 84 HH TYR 84 -6.714 16.339 -10.987 711 H GLY 85 H GLY 85 -1.164 11.423 -12.327 712 1HA GLY 85 1HA GLY 85 -1.436 13.136 -14.713 713 2HA GLY 85 2HA GLY 85 -0.276 13.338 -13.415 714 H GLU 86 H GLU 86 0.239 10.333 -13.287 715 HA GLU 86 HA GLU 86 1.775 10.168 -15.762 716 1HB GLU 86 1HB GLU 86 3.344 8.701 -14.213 717 2HB GLU 86 2HB GLU 86 3.478 10.448 -14.204 718 1HG GLU 86 1HG GLU 86 2.263 10.654 -12.151 719 2HG GLU 86 2HG GLU 86 1.603 9.035 -12.274 720 H LEU 87 H LEU 87 -0.745 9.183 -15.904 721 HA LEU 87 HA LEU 87 -1.369 6.746 -14.909 722 1HB LEU 87 1HB LEU 87 -1.856 7.745 -17.719 723 2HB LEU 87 2HB LEU 87 -2.712 6.430 -16.940 724 HG LEU 87 HG LEU 87 -2.721 9.079 -15.563 725 1HD1 LEU 87 1HD1 LEU 87 -3.092 9.626 -17.956 726 2HD1 LEU 87 2HD1 LEU 87 -4.486 8.520 -17.961 727 3HD1 LEU 87 3HD1 LEU 87 -4.501 9.966 -16.922 728 1HD2 LEU 87 1HD2 LEU 87 -4.266 8.063 -14.343 729 2HD2 LEU 87 2HD2 LEU 87 -5.276 7.815 -15.787 730 3HD2 LEU 87 3HD2 LEU 87 -4.069 6.592 -15.325 731 H ASP 88 H ASP 88 0.931 7.526 -17.549 732 HA ASP 88 HA ASP 88 1.301 5.112 -18.643 733 1HB ASP 88 1HB ASP 88 2.659 7.558 -18.602 734 2HB ASP 88 2HB ASP 88 3.863 6.447 -17.978 735 H MET 89 H MET 89 2.488 6.374 -15.488 736 HA MET 89 HA MET 89 4.080 4.053 -15.014 737 1HB MET 89 1HB MET 89 4.463 6.506 -14.180 738 2HB MET 89 2HB MET 89 3.210 6.185 -12.998 739 1HG MET 89 1HG MET 89 5.278 4.058 -13.121 740 2HG MET 89 2HG MET 89 5.920 5.623 -12.663 741 1HE MET 89 1HE MET 89 6.440 4.707 -9.954 742 2HE MET 89 2HE MET 89 5.331 3.424 -9.413 743 3HE MET 89 3HE MET 89 6.153 3.285 -10.985 744 H ILE 90 H ILE 90 0.965 5.446 -13.820 745 HA ILE 90 HA ILE 90 0.470 3.535 -11.866 746 HB ILE 90 HB ILE 90 -1.363 5.248 -13.540 747 1HG1 ILE 90 1HG1 ILE 90 -1.197 5.889 -10.728 748 2HG1 ILE 90 2HG1 ILE 90 0.412 5.838 -11.419 749 1HG2 ILE 90 1HG2 ILE 90 -3.096 4.083 -12.794 750 2HG2 ILE 90 2HG2 ILE 90 -2.035 3.028 -11.829 751 3HG2 ILE 90 3HG2 ILE 90 -2.648 4.549 -11.136 752 1HD1 ILE 90 1HD1 ILE 90 -0.032 7.558 -12.954 753 2HD1 ILE 90 2HD1 ILE 90 -1.786 7.255 -12.938 754 3HD1 ILE 90 3HD1 ILE 90 -1.010 8.065 -11.556 755 H GLN 91 H GLN 91 -0.237 3.582 -15.399 756 HA GLN 91 HA GLN 91 -1.814 1.356 -15.485 757 1HB GLN 91 1HB GLN 91 -0.077 2.842 -17.394 758 2HB GLN 91 2HB GLN 91 -0.430 1.190 -17.859 759 1HG GLN 91 1HG GLN 91 -2.869 2.408 -16.873 760 2HG GLN 91 2HG GLN 91 -2.147 3.485 -18.052 761 1HE2 GLN 91 1HE2 GLN 91 -4.315 2.729 -18.990 762 2HE2 GLN 91 2HE2 GLN 91 -4.259 1.397 -20.096 763 H GLU 92 H GLU 92 1.797 1.608 -15.724 764 HA GLU 92 HA GLU 92 2.276 -1.054 -16.157 765 1HB GLU 92 1HB GLU 92 3.798 1.314 -15.314 766 2HB GLU 92 2HB GLU 92 4.429 -0.150 -14.587 767 1HG GLU 92 1HG GLU 92 5.032 -1.088 -16.636 768 2HG GLU 92 2HG GLU 92 3.746 -0.281 -17.512 769 H SER 93 H SER 93 2.107 0.775 -13.025 770 HA SER 93 HA SER 93 2.715 -1.315 -11.381 771 1HB SER 93 1HB SER 93 0.992 0.069 -9.811 772 2HB SER 93 2HB SER 93 2.617 0.623 -10.162 773 HG SER 93 HG SER 93 0.123 1.567 -11.155 774 H LYS 94 H LYS 94 -0.335 -0.465 -13.036 775 HA LYS 94 HA LYS 94 -1.966 -2.223 -11.532 776 1HB LYS 94 1HB LYS 94 -2.313 -0.221 -13.483 777 2HB LYS 94 2HB LYS 94 -2.948 -1.686 -14.206 778 1HG LYS 94 1HG LYS 94 -3.680 -1.177 -11.336 779 2HG LYS 94 2HG LYS 94 -4.404 -0.118 -12.529 780 1HD LYS 94 1HD LYS 94 -4.439 -3.112 -12.992 781 2HD LYS 94 2HD LYS 94 -5.590 -2.405 -11.876 782 1HE LYS 94 1HE LYS 94 -5.822 -0.677 -14.021 783 2HE LYS 94 2HE LYS 94 -5.447 -2.177 -14.846 784 1HZ LYS 94 1HZ LYS 94 -7.718 -2.213 -14.596 785 2HZ LYS 94 2HZ LYS 94 -7.232 -3.149 -13.349 786 3HZ LYS 94 3HZ LYS 94 -7.700 -1.608 -13.079 787 H GLU 95 H GLU 95 -0.339 -2.446 -14.765 788 HA GLU 95 HA GLU 95 -1.211 -5.100 -15.126 789 1HB GLU 95 1HB GLU 95 1.084 -3.656 -16.520 790 2HB GLU 95 2HB GLU 95 0.236 -5.071 -17.109 791 1HG GLU 95 1HG GLU 95 -1.350 -2.574 -16.463 792 2HG GLU 95 2HG GLU 95 -0.440 -2.639 -17.959 793 H LEU 96 H LEU 96 1.150 -3.687 -13.111 794 HA LEU 96 HA LEU 96 3.142 -5.706 -13.318 795 1HB LEU 96 1HB LEU 96 2.661 -3.248 -11.823 796 2HB LEU 96 2HB LEU 96 3.407 -4.492 -10.840 797 HG LEU 96 HG LEU 96 5.355 -4.527 -12.090 798 1HD1 LEU 96 1HD1 LEU 96 5.155 -4.817 -14.287 799 2HD1 LEU 96 2HD1 LEU 96 3.578 -3.991 -14.333 800 3HD1 LEU 96 3HD1 LEU 96 5.082 -3.043 -14.423 801 1HD2 LEU 96 1HD2 LEU 96 6.151 -2.450 -11.766 802 2HD2 LEU 96 2HD2 LEU 96 4.905 -1.695 -12.788 803 3HD2 LEU 96 3HD2 LEU 96 4.528 -2.134 -11.105 804 H GLY 97 H GLY 97 -0.015 -5.509 -11.903 805 1HA GLY 97 1HA GLY 97 -1.005 -7.556 -11.176 806 2HA GLY 97 2HA GLY 97 0.521 -8.024 -10.453 807 H ALA 98 H ALA 98 -0.630 -4.668 -10.215 808 HA ALA 98 HA ALA 98 -0.678 -4.931 -7.344 809 1HB ALA 98 1HB ALA 98 -1.224 -2.524 -9.127 810 2HB ALA 98 2HB ALA 98 -0.853 -2.505 -7.386 811 3HB ALA 98 3HB ALA 98 0.390 -3.013 -8.555 812 H LEU 99 H LEU 99 -2.502 -4.605 -5.998 813 HA LEU 99 HA LEU 99 -4.869 -5.688 -6.860 814 1HB LEU 99 1HB LEU 99 -4.699 -3.668 -4.640 815 2HB LEU 99 2HB LEU 99 -5.762 -5.054 -4.782 816 HG LEU 99 HG LEU 99 -4.291 -5.855 -3.240 817 1HD1 LEU 99 1HD1 LEU 99 -3.001 -7.544 -4.181 818 2HD1 LEU 99 2HD1 LEU 99 -4.202 -7.196 -5.449 819 3HD1 LEU 99 3HD1 LEU 99 -2.547 -6.556 -5.590 820 1HD2 LEU 99 1HD2 LEU 99 -2.652 -3.697 -4.136 821 2HD2 LEU 99 2HD2 LEU 99 -2.556 -4.625 -2.620 822 3HD2 LEU 99 3HD2 LEU 99 -1.655 -5.169 -4.056 823 H THR 100 H THR 100 -4.005 -2.183 -6.498 824 HA THR 100 HA THR 100 -5.582 -1.506 -8.769 825 HB THR 100 HB THR 100 -7.431 -1.827 -7.162 826 HG1 THR 100 HG1 THR 100 -8.198 0.320 -7.501 827 1HG2 THR 100 1HG2 THR 100 -5.536 -0.671 -5.285 828 2HG2 THR 100 2HG2 THR 100 -6.970 0.380 -5.382 829 3HG2 THR 100 3HG2 THR 100 -7.153 -1.337 -4.949 830 H HIS 101 H HIS 101 -5.881 1.140 -8.595 831 HA HIS 101 HA HIS 101 -3.332 2.136 -7.578 832 1HB HIS 101 1HB HIS 101 -2.825 3.272 -9.605 833 2HB HIS 101 2HB HIS 101 -3.127 1.592 -10.002 834 HD1 HIS 101 HD1 HIS 101 -5.433 1.043 -11.233 835 HD2 HIS 101 HD2 HIS 101 -4.533 5.118 -10.812 836 HE1 HIS 101 HE1 HIS 101 -6.985 2.286 -12.831 837 H PHE 102 H PHE 102 -3.673 3.843 -6.251 838 HA PHE 102 HA PHE 102 -6.227 5.243 -6.552 839 1HB PHE 102 1HB PHE 102 -4.181 4.953 -4.271 840 2HB PHE 102 2HB PHE 102 -5.637 5.918 -4.137 841 HD1 PHE 102 HD1 PHE 102 -7.491 4.004 -5.625 842 HD2 PHE 102 HD2 PHE 102 -4.619 3.379 -2.564 843 HE1 PHE 102 HE1 PHE 102 -8.759 1.982 -4.848 844 HE2 PHE 102 HE2 PHE 102 -5.887 1.357 -1.787 845 HZ PHE 102 HZ PHE 102 -7.942 0.683 -2.938 846 H ALA 103 H ALA 103 -6.243 7.610 -6.170 847 HA ALA 103 HA ALA 103 -3.693 8.803 -7.021 848 1HB ALA 103 1HB ALA 103 -5.469 8.912 -8.731 849 2HB ALA 103 2HB ALA 103 -6.555 9.699 -7.559 850 3HB ALA 103 3HB ALA 103 -5.082 10.534 -8.108 851 H LYS 104 H LYS 104 -3.051 10.785 -6.015 852 HA LYS 104 HA LYS 104 -3.041 11.063 -3.449 853 1HB LYS 104 1HB LYS 104 -2.910 12.931 -5.655 854 2HB LYS 104 2HB LYS 104 -3.611 13.709 -4.250 855 1HG LYS 104 1HG LYS 104 -1.700 13.322 -2.908 856 2HG LYS 104 2HG LYS 104 -1.147 11.985 -3.897 857 1HD LYS 104 1HD LYS 104 0.173 13.397 -5.077 858 2HD LYS 104 2HD LYS 104 -1.244 14.277 -5.614 859 1HE LYS 104 1HE LYS 104 0.085 15.920 -4.510 860 2HE LYS 104 2HE LYS 104 -1.162 15.522 -3.345 861 1HZ LYS 104 1HZ LYS 104 0.447 14.969 -1.973 862 2HZ LYS 104 2HZ LYS 104 0.887 13.735 -2.948 863 3HZ LYS 104 3HZ LYS 104 1.600 15.196 -3.107 864 HA PRO 105 HA PRO 105 -7.362 12.889 -3.035 865 1HB PRO 105 1HB PRO 105 -8.970 13.229 -5.218 866 2HB PRO 105 2HB PRO 105 -7.960 14.503 -4.564 867 1HG PRO 105 1HG PRO 105 -7.551 12.882 -7.002 868 2HG PRO 105 2HG PRO 105 -6.812 14.409 -6.562 869 1HD PRO 105 1HD PRO 105 -5.598 11.813 -6.432 870 2HD PRO 105 2HD PRO 105 -4.901 13.324 -5.884 871 H PHE 106 H PHE 106 -7.654 10.977 -1.895 872 HA PHE 106 HA PHE 106 -9.447 9.172 -3.353 873 1HB PHE 106 1HB PHE 106 -8.162 7.542 -1.547 874 2HB PHE 106 2HB PHE 106 -7.575 7.771 -3.183 875 HD1 PHE 106 HD1 PHE 106 -7.374 9.785 -0.034 876 HD2 PHE 106 HD2 PHE 106 -5.288 7.964 -3.250 877 HE1 PHE 106 HE1 PHE 106 -5.207 10.673 0.869 878 HE2 PHE 106 HE2 PHE 106 -3.121 8.852 -2.347 879 HZ PHE 106 HZ PHE 106 -3.106 10.196 -0.299 880 H ASP 107 H ASP 107 -10.959 7.965 -1.970 881 HA ASP 107 HA ASP 107 -11.418 9.426 0.509 882 1HB ASP 107 1HB ASP 107 -13.121 9.023 -1.665 883 2HB ASP 107 2HB ASP 107 -13.625 7.756 -0.564 884 H ILE 108 H ILE 108 -11.893 8.150 2.424 885 HA ILE 108 HA ILE 108 -10.770 5.539 2.395 886 HB ILE 108 HB ILE 108 -11.484 7.556 4.304 887 1HG1 ILE 108 1HG1 ILE 108 -9.242 6.660 3.995 888 2HG1 ILE 108 2HG1 ILE 108 -9.780 6.433 5.647 889 1HG2 ILE 108 1HG2 ILE 108 -12.187 6.065 6.156 890 2HG2 ILE 108 2HG2 ILE 108 -13.412 6.225 4.875 891 3HG2 ILE 108 3HG2 ILE 108 -12.416 4.753 4.975 892 1HD1 ILE 108 1HD1 ILE 108 -9.384 4.215 5.454 893 2HD1 ILE 108 2HD1 ILE 108 -10.628 4.118 4.184 894 3HD1 ILE 108 3HD1 ILE 108 -8.932 4.433 3.746 895 H ASP 109 H ASP 109 -14.026 6.939 2.189 896 HA ASP 109 HA ASP 109 -15.437 4.688 2.939 897 1HB ASP 109 1HB ASP 109 -16.523 6.858 2.704 898 2HB ASP 109 2HB ASP 109 -16.076 6.963 1.013 899 H GLU 110 H GLU 110 -14.070 5.831 -0.201 900 HA GLU 110 HA GLU 110 -15.257 3.729 -1.679 901 1HB GLU 110 1HB GLU 110 -13.987 4.614 -3.560 902 2HB GLU 110 2HB GLU 110 -14.657 5.956 -2.654 903 1HG GLU 110 1HG GLU 110 -12.577 6.620 -1.810 904 2HG GLU 110 2HG GLU 110 -11.906 5.002 -1.881 905 H ILE 111 H ILE 111 -12.332 4.168 0.228 906 HA ILE 111 HA ILE 111 -10.912 2.021 -1.032 907 HB ILE 111 HB ILE 111 -10.459 3.955 1.168 908 1HG1 ILE 111 1HG1 ILE 111 -8.662 2.903 -1.036 909 2HG1 ILE 111 2HG1 ILE 111 -9.710 4.299 -1.190 910 1HG2 ILE 111 1HG2 ILE 111 -10.016 1.883 2.342 911 2HG2 ILE 111 2HG2 ILE 111 -8.990 1.309 1.006 912 3HG2 ILE 111 3HG2 ILE 111 -8.485 2.713 1.977 913 1HD1 ILE 111 1HD1 ILE 111 -7.079 4.150 -0.009 914 2HD1 ILE 111 2HD1 ILE 111 -8.100 5.586 -0.261 915 3HD1 ILE 111 3HD1 ILE 111 -8.241 4.647 1.245 916 H ARG 112 H ARG 112 -13.366 2.400 1.434 917 HA ARG 112 HA ARG 112 -12.728 0.078 2.860 918 1HB ARG 112 1HB ARG 112 -15.372 1.593 2.572 919 2HB ARG 112 2HB ARG 112 -15.090 0.331 3.755 920 1HG ARG 112 1HG ARG 112 -12.902 2.183 3.967 921 2HG ARG 112 2HG ARG 112 -14.373 3.135 3.900 922 1HD ARG 112 1HD ARG 112 -13.922 2.589 6.238 923 2HD ARG 112 2HD ARG 112 -15.350 1.705 5.737 924 HE ARG 112 HE ARG 112 -12.881 0.185 5.345 925 1HH1 ARG 112 1HH1 ARG 112 -15.392 1.037 7.658 926 2HH1 ARG 112 2HH1 ARG 112 -15.140 -0.367 8.641 927 1HH2 ARG 112 1HH2 ARG 112 -12.548 -1.667 6.642 928 2HH2 ARG 112 2HH2 ARG 112 -13.512 -1.915 8.059 929 H ASP 113 H ASP 113 -14.209 0.698 -0.231 930 HA ASP 113 HA ASP 113 -15.803 -1.655 -0.237 931 1HB ASP 113 1HB ASP 113 -15.543 0.706 -1.811 932 2HB ASP 113 2HB ASP 113 -15.137 -0.615 -2.889 933 H ALA 114 H ALA 114 -12.824 -0.454 -1.967 934 HA ALA 114 HA ALA 114 -12.254 -2.856 -3.269 935 1HB ALA 114 1HB ALA 114 -10.050 -1.827 -3.640 936 2HB ALA 114 2HB ALA 114 -11.347 -0.632 -3.881 937 3HB ALA 114 3HB ALA 114 -10.390 -0.617 -2.380 938 H VAL 115 H VAL 115 -11.827 -1.785 0.059 939 HA VAL 115 HA VAL 115 -9.750 -3.596 0.710 940 HB VAL 115 HB VAL 115 -11.729 -1.928 2.236 941 1HG1 VAL 115 1HG1 VAL 115 -10.808 -2.649 4.340 942 2HG1 VAL 115 2HG1 VAL 115 -11.381 -4.087 3.462 943 3HG1 VAL 115 3HG1 VAL 115 -9.641 -3.716 3.523 944 1HG2 VAL 115 1HG2 VAL 115 -9.399 -1.244 1.062 945 2HG2 VAL 115 2HG2 VAL 115 -10.014 -0.467 2.541 946 3HG2 VAL 115 3HG2 VAL 115 -8.789 -1.754 2.655 947 H LYS 116 H LYS 116 -13.192 -3.879 0.159 948 HA LYS 116 HA LYS 116 -13.518 -6.215 1.775 949 1HB LYS 116 1HB LYS 116 -15.282 -4.451 1.086 950 2HB LYS 116 2HB LYS 116 -15.361 -5.313 -0.437 951 1HG LYS 116 1HG LYS 116 -15.438 -7.307 1.615 952 2HG LYS 116 2HG LYS 116 -16.529 -6.035 2.128 953 1HD LYS 116 1HD LYS 116 -17.278 -6.184 -0.480 954 2HD LYS 116 2HD LYS 116 -16.692 -7.824 -0.282 955 1HE LYS 116 1HE LYS 116 -18.668 -8.355 0.698 956 2HE LYS 116 2HE LYS 116 -18.227 -7.330 2.049 957 1HZ LYS 116 1HZ LYS 116 -20.349 -6.844 0.731 958 2HZ LYS 116 2HZ LYS 116 -19.412 -5.590 1.198 959 3HZ LYS 116 3HZ LYS 116 -19.358 -6.120 -0.346 960 H LYS 117 H LYS 117 -12.037 -5.510 -1.242 961 HA LYS 117 HA LYS 117 -12.366 -8.308 -2.072 962 1HB LYS 117 1HB LYS 117 -12.059 -7.629 -4.318 963 2HB LYS 117 2HB LYS 117 -13.220 -6.515 -3.624 964 1HG LYS 117 1HG LYS 117 -11.682 -4.730 -3.548 965 2HG LYS 117 2HG LYS 117 -10.288 -5.792 -3.507 966 1HD LYS 117 1HD LYS 117 -11.102 -6.520 -5.925 967 2HD LYS 117 2HD LYS 117 -12.002 -5.016 -5.884 968 1HE LYS 117 1HE LYS 117 -10.126 -3.783 -6.255 969 2HE LYS 117 2HE LYS 117 -9.265 -4.576 -4.952 970 1HZ LYS 117 1HZ LYS 117 -9.604 -5.651 -7.666 971 2HZ LYS 117 2HZ LYS 117 -8.233 -5.007 -7.055 972 3HZ LYS 117 3HZ LYS 117 -8.817 -6.407 -6.451 973 H TYR 118 H TYR 118 -10.177 -5.771 -1.000 974 HA TYR 118 HA TYR 118 -7.811 -7.117 -1.896 975 1HB TYR 118 1HB TYR 118 -7.240 -4.892 -1.510 976 2HB TYR 118 2HB TYR 118 -8.740 -4.622 -0.645 977 HD1 TYR 118 HD1 TYR 118 -8.178 -3.423 1.276 978 HD2 TYR 118 HD2 TYR 118 -5.840 -6.841 0.204 979 HE1 TYR 118 HE1 TYR 118 -6.881 -3.228 3.454 980 HE2 TYR 118 HE2 TYR 118 -4.550 -6.635 2.385 981 HH TYR 118 HH TYR 118 -5.573 -5.037 4.937 982 H LEU 119 H LEU 119 -9.503 -6.615 1.274 983 HA LEU 119 HA LEU 119 -8.146 -9.028 2.214 984 1HB LEU 119 1HB LEU 119 -7.448 -6.435 3.015 985 2HB LEU 119 2HB LEU 119 -8.425 -7.069 4.324 986 HG LEU 119 HG LEU 119 -5.761 -7.415 4.125 987 1HD1 LEU 119 1HD1 LEU 119 -6.611 -9.758 5.413 988 2HD1 LEU 119 2HD1 LEU 119 -6.277 -8.170 6.147 989 3HD1 LEU 119 3HD1 LEU 119 -7.930 -8.583 5.633 990 1HD2 LEU 119 1HD2 LEU 119 -6.772 -10.073 3.127 991 2HD2 LEU 119 2HD2 LEU 119 -6.206 -8.807 2.010 992 3HD2 LEU 119 3HD2 LEU 119 -5.100 -9.471 3.236 993 HA PRO 120 HA PRO 120 -12.157 -9.939 3.531 994 1HB PRO 120 1HB PRO 120 -11.658 -11.993 5.263 995 2HB PRO 120 2HB PRO 120 -11.716 -12.199 3.524 996 1HG PRO 120 1HG PRO 120 -9.357 -12.128 5.303 997 2HG PRO 120 2HG PRO 120 -9.480 -12.744 3.667 998 1HD PRO 120 1HD PRO 120 -8.309 -10.255 4.481 999 2HD PRO 120 2HD PRO 120 -8.536 -10.819 2.837 1000 H LEU 121 H LEU 121 -11.588 -7.597 4.551 1001 HA LEU 121 HA LEU 121 -11.765 -7.876 7.437 1002 1HB LEU 121 1HB LEU 121 -10.176 -6.296 6.679 1003 2HB LEU 121 2HB LEU 121 -11.313 -5.559 5.567 1004 HG LEU 121 HG LEU 121 -12.652 -4.780 7.544 1005 1HD1 LEU 121 1HD1 LEU 121 -11.480 -6.587 9.040 1006 2HD1 LEU 121 2HD1 LEU 121 -10.273 -5.302 9.289 1007 3HD1 LEU 121 3HD1 LEU 121 -11.975 -5.021 9.727 1008 1HD2 LEU 121 1HD2 LEU 121 -10.739 -3.518 6.271 1009 2HD2 LEU 121 2HD2 LEU 121 -11.445 -2.834 7.755 1010 3HD2 LEU 121 3HD2 LEU 121 -9.879 -3.677 7.821 1011 H LYS 122 H LYS 122 -13.412 -6.383 8.569 1012 HA LYS 122 HA LYS 122 -15.939 -7.241 8.019 1013 1HB LYS 122 1HB LYS 122 -15.500 -6.348 10.148 1014 2HB LYS 122 2HB LYS 122 -14.870 -4.846 9.504 1015 1HG LYS 122 1HG LYS 122 -17.699 -5.511 8.762 1016 2HG LYS 122 2HG LYS 122 -17.417 -5.120 10.447 1017 1HD LYS 122 1HD LYS 122 -16.089 -3.048 9.522 1018 2HD LYS 122 2HD LYS 122 -16.904 -3.383 8.007 1019 1HE LYS 122 1HE LYS 122 -18.613 -2.116 8.829 1020 2HE LYS 122 2HE LYS 122 -19.013 -3.511 9.812 1021 1HZ LYS 122 1HZ LYS 122 -16.974 -1.682 10.779 1022 2HZ LYS 122 2HZ LYS 122 -18.539 -1.231 10.893 1023 3HZ LYS 122 3HZ LYS 122 -18.027 -2.598 11.626 1024 H SER 123 H SER 123 -17.724 -6.503 6.843 1025 HA SER 123 HA SER 123 -16.990 -4.861 4.617 1026 1HB SER 123 1HB SER 123 -18.896 -5.710 3.559 1027 2HB SER 123 2HB SER 123 -18.472 -7.028 4.633 1028 HG SER 123 HG SER 123 -20.628 -5.161 4.814 1029 H ASN 124 H ASN 124 -17.612 -2.722 4.287 1030 HA ASN 124 HA ASN 124 -18.196 -1.101 6.307 1031 1HB ASN 124 1HB ASN 124 -17.611 -0.265 4.066 1032 2HB ASN 124 2HB ASN 124 -19.106 -0.882 3.392 1033 1HD2 ASN 124 1HD2 ASN 124 -20.195 0.844 2.783 1034 2HD2 ASN 124 2HD2 ASN 124 -20.617 2.203 3.770 Start of MODEL 13 1 1H MET 1 1H MET 1 -1.640 -13.678 13.859 2 HA MET 1 HA MET 1 -1.707 -15.417 15.374 3 1HB MET 1 1HB MET 1 -0.556 -13.270 17.117 4 2HB MET 1 2HB MET 1 -1.657 -14.350 17.948 5 1HG MET 1 1HG MET 1 -0.305 -16.302 16.899 6 2HG MET 1 2HG MET 1 0.886 -15.100 16.443 7 1HE MET 1 1HE MET 1 2.633 -15.873 17.402 8 2HE MET 1 2HE MET 1 3.145 -15.497 19.065 9 3HE MET 1 3HE MET 1 2.433 -17.085 18.690 10 H MET 2 H MET 2 -2.947 -12.112 16.140 11 HA MET 2 HA MET 2 -5.601 -13.074 15.876 12 1HB MET 2 1HB MET 2 -4.492 -13.283 18.438 13 2HB MET 2 2HB MET 2 -5.261 -11.710 18.513 14 1HG MET 2 1HG MET 2 -7.347 -12.944 17.457 15 2HG MET 2 2HG MET 2 -6.548 -14.410 17.989 16 1HE MET 2 1HE MET 2 -6.604 -15.262 20.505 17 2HE MET 2 2HE MET 2 -8.130 -14.746 21.262 18 3HE MET 2 3HE MET 2 -8.110 -15.256 19.557 19 H ASN 3 H ASN 3 -3.802 -11.094 14.631 20 HA ASN 3 HA ASN 3 -5.614 -8.919 14.712 21 1HB ASN 3 1HB ASN 3 -3.807 -7.198 15.239 22 2HB ASN 3 2HB ASN 3 -4.263 -8.191 16.609 23 1HD2 ASN 3 1HD2 ASN 3 -1.896 -7.729 14.047 24 2HD2 ASN 3 2HD2 ASN 3 -0.559 -8.519 14.812 25 H GLU 4 H GLU 4 -5.613 -8.040 12.612 26 HA GLU 4 HA GLU 4 -4.216 -9.216 10.608 27 1HB GLU 4 1HB GLU 4 -6.085 -7.082 10.895 28 2HB GLU 4 2HB GLU 4 -4.772 -6.445 9.924 29 1HG GLU 4 1HG GLU 4 -5.998 -7.432 8.227 30 2HG GLU 4 2HG GLU 4 -5.014 -8.813 8.668 31 H LYS 5 H LYS 5 -2.838 -7.592 8.964 32 HA LYS 5 HA LYS 5 -0.870 -6.123 10.501 33 1HB LYS 5 1HB LYS 5 -0.131 -8.562 8.857 34 2HB LYS 5 2HB LYS 5 1.012 -7.401 9.499 35 1HG LYS 5 1HG LYS 5 -0.981 -8.866 11.281 36 2HG LYS 5 2HG LYS 5 0.597 -9.530 10.908 37 1HD LYS 5 1HD LYS 5 0.242 -6.735 12.074 38 2HD LYS 5 2HD LYS 5 0.411 -8.156 13.085 39 1HE LYS 5 1HE LYS 5 2.537 -8.525 11.383 40 2HE LYS 5 2HE LYS 5 2.456 -6.774 11.396 41 1HZ LYS 5 1HZ LYS 5 3.051 -6.704 13.536 42 2HZ LYS 5 2HZ LYS 5 2.221 -8.043 13.965 43 3HZ LYS 5 3HZ LYS 5 3.682 -8.182 13.247 44 H ILE 6 H ILE 6 0.015 -4.432 9.329 45 HA ILE 6 HA ILE 6 -0.224 -4.445 6.460 46 HB ILE 6 HB ILE 6 -2.253 -3.244 8.090 47 1HG1 ILE 6 1HG1 ILE 6 -2.279 -2.774 5.179 48 2HG1 ILE 6 2HG1 ILE 6 -2.031 -4.449 5.632 49 1HG2 ILE 6 1HG2 ILE 6 -0.829 -1.257 8.117 50 2HG2 ILE 6 2HG2 ILE 6 -0.726 -1.296 6.340 51 3HG2 ILE 6 3HG2 ILE 6 -2.290 -0.995 7.134 52 1HD1 ILE 6 1HD1 ILE 6 -4.055 -4.446 7.011 53 2HD1 ILE 6 2HD1 ILE 6 -4.269 -2.699 6.748 54 3HD1 ILE 6 3HD1 ILE 6 -4.459 -3.833 5.390 55 H LEU 7 H LEU 7 1.052 -2.731 5.474 56 HA LEU 7 HA LEU 7 2.743 -1.293 7.379 57 1HB LEU 7 1HB LEU 7 3.583 -3.568 6.065 58 2HB LEU 7 2HB LEU 7 4.165 -2.285 5.023 59 HG LEU 7 HG LEU 7 4.992 -1.314 7.403 60 1HD1 LEU 7 1HD1 LEU 7 4.853 -4.313 7.732 61 2HD1 LEU 7 2HD1 LEU 7 6.004 -3.296 8.633 62 3HD1 LEU 7 3HD1 LEU 7 4.252 -3.042 8.824 63 1HD2 LEU 7 1HD2 LEU 7 6.204 -2.000 5.167 64 2HD2 LEU 7 2HD2 LEU 7 7.119 -1.747 6.673 65 3HD2 LEU 7 3HD2 LEU 7 6.725 -3.398 6.138 66 H ILE 8 H ILE 8 3.482 0.743 6.639 67 HA ILE 8 HA ILE 8 2.235 1.576 4.111 68 HB ILE 8 HB ILE 8 2.497 3.023 6.740 69 1HG1 ILE 8 1HG1 ILE 8 0.004 2.746 5.083 70 2HG1 ILE 8 2HG1 ILE 8 0.535 1.410 6.085 71 1HG2 ILE 8 1HG2 ILE 8 2.869 4.896 5.587 72 2HG2 ILE 8 2HG2 ILE 8 2.502 4.119 4.028 73 3HG2 ILE 8 3HG2 ILE 8 1.181 4.750 5.040 74 1HD1 ILE 8 1HD1 ILE 8 -0.819 2.574 7.591 75 2HD1 ILE 8 2HD1 ILE 8 0.768 3.291 7.958 76 3HD1 ILE 8 3HD1 ILE 8 -0.383 4.162 6.916 77 H VAL 9 H VAL 9 3.447 2.975 2.750 78 HA VAL 9 HA VAL 9 6.143 3.621 3.597 79 HB VAL 9 HB VAL 9 5.692 2.061 1.057 80 1HG1 VAL 9 1HG1 VAL 9 8.088 3.046 2.592 81 2HG1 VAL 9 2HG1 VAL 9 8.221 1.626 1.529 82 3HG1 VAL 9 3HG1 VAL 9 7.714 3.195 0.859 83 1HG2 VAL 9 1HG2 VAL 9 6.431 1.018 3.807 84 2HG2 VAL 9 2HG2 VAL 9 5.054 0.536 2.787 85 3HG2 VAL 9 3HG2 VAL 9 6.713 0.116 2.299 86 H ASP 10 H ASP 10 6.793 5.568 2.750 87 HA ASP 10 HA ASP 10 6.594 7.502 1.784 88 1HB ASP 10 1HB ASP 10 5.653 5.754 -0.534 89 2HB ASP 10 2HB ASP 10 5.982 7.466 -0.712 90 H ASP 11 H ASP 11 4.903 8.965 0.316 91 HA ASP 11 HA ASP 11 2.943 9.875 0.136 92 1HB ASP 11 1HB ASP 11 2.390 7.215 -0.320 93 2HB ASP 11 2HB ASP 11 1.336 7.524 1.046 94 H GLN 12 H GLN 12 4.358 8.973 2.897 95 HA GLN 12 HA GLN 12 2.168 9.160 4.711 96 1HB GLN 12 1HB GLN 12 4.140 9.263 6.412 97 2HB GLN 12 2HB GLN 12 3.900 7.781 5.507 98 1HG GLN 12 1HG GLN 12 5.837 8.046 4.285 99 2HG GLN 12 2HG GLN 12 5.646 9.782 4.152 100 1HE2 GLN 12 1HE2 GLN 12 5.531 10.731 6.611 101 2HE2 GLN 12 2HE2 GLN 12 6.952 10.381 7.537 102 H TYR 13 H TYR 13 1.157 11.103 5.010 103 HA TYR 13 HA TYR 13 2.801 13.375 5.723 104 1HB TYR 13 1HB TYR 13 1.780 12.914 3.079 105 2HB TYR 13 2HB TYR 13 0.657 14.056 3.790 106 HD1 TYR 13 HD1 TYR 13 1.195 16.352 3.933 107 HD2 TYR 13 HD2 TYR 13 4.279 13.514 3.079 108 HE1 TYR 13 HE1 TYR 13 2.806 18.249 3.414 109 HE2 TYR 13 HE2 TYR 13 5.880 15.420 2.562 110 HH TYR 13 HH TYR 13 4.983 18.382 1.851 111 H GLY 14 H GLY 14 0.836 11.505 7.019 112 1HA GLY 14 1HA GLY 14 -0.469 12.270 8.868 113 2HA GLY 14 2HA GLY 14 -1.091 13.572 7.874 114 H ILE 15 H ILE 15 -1.014 11.200 5.643 115 HA ILE 15 HA ILE 15 -3.803 10.577 6.065 116 HB ILE 15 HB ILE 15 -1.874 10.115 3.796 117 1HG1 ILE 15 1HG1 ILE 15 -4.271 11.659 3.243 118 2HG1 ILE 15 2HG1 ILE 15 -3.374 12.356 4.577 119 1HG2 ILE 15 1HG2 ILE 15 -3.553 9.083 2.524 120 2HG2 ILE 15 2HG2 ILE 15 -3.620 8.274 4.108 121 3HG2 ILE 15 3HG2 ILE 15 -4.828 9.512 3.689 122 1HD1 ILE 15 1HD1 ILE 15 -2.501 11.923 1.721 123 2HD1 ILE 15 2HD1 ILE 15 -2.309 13.360 2.754 124 3HD1 ILE 15 3HD1 ILE 15 -1.268 11.938 3.005 125 H ARG 16 H ARG 16 -0.613 8.904 5.879 126 HA ARG 16 HA ARG 16 -1.367 6.358 5.888 127 1HB ARG 16 1HB ARG 16 0.678 5.999 7.482 128 2HB ARG 16 2HB ARG 16 0.970 6.777 5.939 129 1HG ARG 16 1HG ARG 16 0.985 8.990 6.966 130 2HG ARG 16 2HG ARG 16 0.409 8.350 8.493 131 1HD ARG 16 1HD ARG 16 2.956 7.174 7.399 132 2HD ARG 16 2HD ARG 16 3.038 8.815 8.010 133 HE ARG 16 HE ARG 16 1.657 6.965 9.821 134 1HH1 ARG 16 1HH1 ARG 16 4.772 8.303 8.878 135 2HH1 ARG 16 2HH1 ARG 16 5.523 7.963 10.401 136 1HH2 ARG 16 1HH2 ARG 16 2.647 6.516 11.831 137 2HH2 ARG 16 2HH2 ARG 16 4.306 6.940 12.092 138 H ILE 17 H ILE 17 -1.469 8.654 8.654 139 HA ILE 17 HA ILE 17 -2.120 6.701 10.592 140 HB ILE 17 HB ILE 17 -2.462 9.701 10.541 141 1HG1 ILE 17 1HG1 ILE 17 -0.377 8.257 12.134 142 2HG1 ILE 17 2HG1 ILE 17 -0.123 8.449 10.411 143 1HG2 ILE 17 1HG2 ILE 17 -2.827 7.703 12.781 144 2HG2 ILE 17 2HG2 ILE 17 -2.551 9.440 13.050 145 3HG2 ILE 17 3HG2 ILE 17 -3.994 8.896 12.163 146 1HD1 ILE 17 1HD1 ILE 17 -1.060 10.898 11.844 147 2HD1 ILE 17 2HD1 ILE 17 0.581 10.337 12.245 148 3HD1 ILE 17 3HD1 ILE 17 0.161 10.728 10.560 149 H LEU 18 H LEU 18 -4.045 8.985 8.557 150 HA LEU 18 HA LEU 18 -6.512 8.629 9.583 151 1HB LEU 18 1HB LEU 18 -5.634 9.973 7.551 152 2HB LEU 18 2HB LEU 18 -6.056 8.553 6.615 153 HG LEU 18 HG LEU 18 -8.382 8.888 7.932 154 1HD1 LEU 18 1HD1 LEU 18 -6.953 11.477 8.137 155 2HD1 LEU 18 2HD1 LEU 18 -8.648 11.547 7.600 156 3HD1 LEU 18 3HD1 LEU 18 -8.238 10.782 9.154 157 1HD2 LEU 18 1HD2 LEU 18 -9.186 9.215 5.874 158 2HD2 LEU 18 2HD2 LEU 18 -8.234 10.700 5.635 159 3HD2 LEU 18 3HD2 LEU 18 -7.492 9.109 5.339 160 H LEU 19 H LEU 19 -4.997 6.493 7.059 161 HA LEU 19 HA LEU 19 -7.105 4.602 7.266 162 1HB LEU 19 1HB LEU 19 -6.016 3.444 5.599 163 2HB LEU 19 2HB LEU 19 -5.605 5.116 5.275 164 HG LEU 19 HG LEU 19 -3.585 3.977 6.978 165 1HD1 LEU 19 1HD1 LEU 19 -2.787 2.408 4.981 166 2HD1 LEU 19 2HD1 LEU 19 -3.797 1.811 6.319 167 3HD1 LEU 19 3HD1 LEU 19 -4.544 2.233 4.760 168 1HD2 LEU 19 1HD2 LEU 19 -2.102 4.662 5.154 169 2HD2 LEU 19 2HD2 LEU 19 -3.511 4.921 4.098 170 3HD2 LEU 19 3HD2 LEU 19 -3.286 5.932 5.546 171 H ASN 20 H ASN 20 -4.159 5.271 9.041 172 HA ASN 20 HA ASN 20 -3.632 2.713 9.946 173 1HB ASN 20 1HB ASN 20 -2.159 4.793 10.191 174 2HB ASN 20 2HB ASN 20 -3.225 5.340 11.470 175 1HD2 ASN 20 1HD2 ASN 20 -0.990 5.234 12.483 176 2HD2 ASN 20 2HD2 ASN 20 -0.577 3.787 13.340 177 H GLU 21 H GLU 21 -5.235 5.509 11.672 178 HA GLU 21 HA GLU 21 -6.088 4.137 13.846 179 1HB GLU 21 1HB GLU 21 -6.256 6.525 13.820 180 2HB GLU 21 2HB GLU 21 -7.255 6.527 12.380 181 1HG GLU 21 1HG GLU 21 -9.100 5.418 13.647 182 2HG GLU 21 2HG GLU 21 -8.100 5.384 15.086 183 H VAL 22 H VAL 22 -7.399 4.147 10.549 184 HA VAL 22 HA VAL 22 -9.951 3.164 11.132 185 HB VAL 22 HB VAL 22 -8.140 3.277 8.762 186 1HG1 VAL 22 1HG1 VAL 22 -9.878 2.146 7.376 187 2HG1 VAL 22 2HG1 VAL 22 -9.065 1.055 8.524 188 3HG1 VAL 22 3HG1 VAL 22 -10.704 1.655 8.874 189 1HG2 VAL 22 1HG2 VAL 22 -9.381 5.068 8.281 190 2HG2 VAL 22 2HG2 VAL 22 -10.878 4.108 8.355 191 3HG2 VAL 22 3HG2 VAL 22 -10.223 4.850 9.834 192 H PHE 23 H PHE 23 -6.896 1.451 10.161 193 HA PHE 23 HA PHE 23 -8.115 -1.089 10.677 194 1HB PHE 23 1HB PHE 23 -5.382 0.042 9.908 195 2HB PHE 23 2HB PHE 23 -5.507 -1.650 10.346 196 HD1 PHE 23 HD1 PHE 23 -7.107 -3.117 9.009 197 HD2 PHE 23 HD2 PHE 23 -5.940 0.762 7.744 198 HE1 PHE 23 HE1 PHE 23 -7.802 -3.673 6.662 199 HE2 PHE 23 HE2 PHE 23 -6.634 0.205 5.397 200 HZ PHE 23 HZ PHE 23 -7.557 -2.006 4.884 201 H ASN 24 H ASN 24 -5.979 1.218 12.371 202 HA ASN 24 HA ASN 24 -4.844 -0.394 14.211 203 1HB ASN 24 1HB ASN 24 -4.895 2.287 13.823 204 2HB ASN 24 2HB ASN 24 -6.023 2.224 15.163 205 1HD2 ASN 24 1HD2 ASN 24 -5.350 1.031 17.101 206 2HD2 ASN 24 2HD2 ASN 24 -3.694 1.095 17.604 207 H LYS 25 H LYS 25 -8.213 0.708 13.895 208 HA LYS 25 HA LYS 25 -9.144 0.391 16.458 209 1HB LYS 25 1HB LYS 25 -10.371 0.146 13.728 210 2HB LYS 25 2HB LYS 25 -11.317 -0.299 15.134 211 1HG LYS 25 1HG LYS 25 -10.960 1.925 16.140 212 2HG LYS 25 2HG LYS 25 -9.872 2.376 14.843 213 1HD LYS 25 1HD LYS 25 -11.806 3.330 14.003 214 2HD LYS 25 2HD LYS 25 -11.992 1.730 13.313 215 1HE LYS 25 1HE LYS 25 -13.343 1.072 15.371 216 2HE LYS 25 2HE LYS 25 -13.258 2.739 15.904 217 1HZ LYS 25 1HZ LYS 25 -14.096 2.576 13.219 218 2HZ LYS 25 2HZ LYS 25 -15.072 1.685 14.179 219 3HZ LYS 25 3HZ LYS 25 -14.846 3.272 14.493 220 H GLU 26 H GLU 26 -7.853 -1.984 14.270 221 HA GLU 26 HA GLU 26 -9.194 -4.124 15.665 222 1HB GLU 26 1HB GLU 26 -7.333 -4.036 13.260 223 2HB GLU 26 2HB GLU 26 -7.832 -5.547 13.994 224 1HG GLU 26 1HG GLU 26 -10.272 -4.693 13.719 225 2HG GLU 26 2HG GLU 26 -9.605 -3.445 12.685 226 H GLY 27 H GLY 27 -6.210 -2.310 15.695 227 1HA GLY 27 1HA GLY 27 -4.655 -2.386 17.396 228 2HA GLY 27 2HA GLY 27 -5.221 -3.974 17.874 229 H TYR 28 H TYR 28 -4.833 -3.674 14.444 230 HA TYR 28 HA TYR 28 -2.818 -5.629 14.375 231 1HB TYR 28 1HB TYR 28 -3.099 -5.282 11.986 232 2HB TYR 28 2HB TYR 28 -4.662 -4.864 12.661 233 HD1 TYR 28 HD1 TYR 28 -3.167 -3.971 10.003 234 HD2 TYR 28 HD2 TYR 28 -3.875 -2.126 13.797 235 HE1 TYR 28 HE1 TYR 28 -3.024 -1.674 8.921 236 HE2 TYR 28 HE2 TYR 28 -3.730 0.164 12.703 237 HH TYR 28 HH TYR 28 -3.528 0.488 9.221 238 H GLN 29 H GLN 29 -0.600 -5.514 13.828 239 HA GLN 29 HA GLN 29 0.623 -3.101 14.702 240 1HB GLN 29 1HB GLN 29 1.389 -5.892 14.292 241 2HB GLN 29 2HB GLN 29 2.606 -4.819 13.629 242 1HG GLN 29 1HG GLN 29 3.122 -3.877 15.703 243 2HG GLN 29 2HG GLN 29 1.509 -4.125 16.343 244 1HE2 GLN 29 1HE2 GLN 29 4.668 -5.390 15.939 245 2HE2 GLN 29 2HE2 GLN 29 4.486 -6.875 16.812 246 H THR 30 H THR 30 1.582 -1.497 13.464 247 HA THR 30 HA THR 30 1.691 -1.988 10.562 248 HB THR 30 HB THR 30 1.011 0.488 10.404 249 HG1 THR 30 HG1 THR 30 0.228 -0.131 13.158 250 1HG2 THR 30 1HG2 THR 30 -0.653 -1.795 10.887 251 2HG2 THR 30 2HG2 THR 30 -1.292 -0.480 11.902 252 3HG2 THR 30 3HG2 THR 30 -1.135 -0.251 10.143 253 H PHE 31 H PHE 31 3.278 -0.682 9.390 254 HA PHE 31 HA PHE 31 5.337 0.488 11.067 255 1HB PHE 31 1HB PHE 31 5.439 -2.186 10.193 256 2HB PHE 31 2HB PHE 31 6.289 -1.357 8.904 257 HD1 PHE 31 HD1 PHE 31 6.562 -2.748 12.156 258 HD2 PHE 31 HD2 PHE 31 8.228 0.206 9.605 259 HE1 PHE 31 HE1 PHE 31 8.649 -2.721 13.550 260 HE2 PHE 31 HE2 PHE 31 10.316 0.232 10.999 261 HZ PHE 31 HZ PHE 31 10.501 -1.232 12.955 262 H GLN 32 H GLN 32 6.825 1.862 9.863 263 HA GLN 32 HA GLN 32 5.726 2.537 7.246 264 1HB GLN 32 1HB GLN 32 5.335 4.494 8.406 265 2HB GLN 32 2HB GLN 32 6.623 4.204 9.558 266 1HG GLN 32 1HG GLN 32 8.306 5.016 8.083 267 2HG GLN 32 2HG GLN 32 7.302 4.803 6.663 268 1HE2 GLN 32 1HE2 GLN 32 8.282 6.872 9.183 269 2HE2 GLN 32 2HE2 GLN 32 7.288 8.245 8.830 270 H ALA 33 H ALA 33 7.212 3.022 5.522 271 HA ALA 33 HA ALA 33 10.025 2.488 6.123 272 1HB ALA 33 1HB ALA 33 10.178 0.965 4.223 273 2HB ALA 33 2HB ALA 33 8.932 0.378 5.349 274 3HB ALA 33 3HB ALA 33 8.455 1.209 3.849 275 H ALA 34 H ALA 34 11.412 3.113 4.126 276 HA ALA 34 HA ALA 34 10.123 5.290 2.649 277 1HB ALA 34 1HB ALA 34 12.533 6.388 3.054 278 2HB ALA 34 2HB ALA 34 11.190 6.619 4.200 279 3HB ALA 34 3HB ALA 34 12.449 5.407 4.537 280 H ASN 35 H ASN 35 10.340 2.820 1.532 281 HA ASN 35 HA ASN 35 11.668 3.221 -0.745 282 1HB ASN 35 1HB ASN 35 13.530 2.344 1.395 283 2HB ASN 35 2HB ASN 35 13.577 1.295 -0.008 284 1HD2 ASN 35 1HD2 ASN 35 15.383 3.419 1.195 285 2HD2 ASN 35 2HD2 ASN 35 15.826 4.446 -0.127 286 H GLY 36 H GLY 36 12.401 0.761 -1.696 287 1HA GLY 36 1HA GLY 36 10.025 -0.849 -1.259 288 2HA GLY 36 2HA GLY 36 11.254 -1.059 -2.491 289 H LEU 37 H LEU 37 13.634 -1.176 -0.995 290 HA LEU 37 HA LEU 37 13.625 -3.827 -0.167 291 1HB LEU 37 1HB LEU 37 15.488 -1.823 -0.688 292 2HB LEU 37 2HB LEU 37 15.755 -2.229 0.995 293 HG LEU 37 HG LEU 37 15.678 -4.291 -1.220 294 1HD1 LEU 37 1HD1 LEU 37 18.258 -4.247 -0.699 295 2HD1 LEU 37 2HD1 LEU 37 17.538 -3.125 -1.878 296 3HD1 LEU 37 3HD1 LEU 37 17.913 -2.565 -0.231 297 1HD2 LEU 37 1HD2 LEU 37 16.133 -5.867 0.320 298 2HD2 LEU 37 2HD2 LEU 37 17.169 -4.786 1.283 299 3HD2 LEU 37 3HD2 LEU 37 15.399 -4.698 1.444 300 H GLN 38 H GLN 38 13.801 -0.787 1.818 301 HA GLN 38 HA GLN 38 13.801 -1.983 4.251 302 1HB GLN 38 1HB GLN 38 13.039 0.673 3.167 303 2HB GLN 38 2HB GLN 38 12.291 0.293 4.705 304 1HG GLN 38 1HG GLN 38 14.353 0.136 5.834 305 2HG GLN 38 2HG GLN 38 15.245 -0.251 4.376 306 1HE2 GLN 38 1HE2 GLN 38 14.594 2.081 6.607 307 2HE2 GLN 38 2HE2 GLN 38 15.046 3.511 5.741 308 H ALA 39 H ALA 39 11.105 -1.499 1.977 309 HA ALA 39 HA ALA 39 9.128 -2.233 3.943 310 1HB ALA 39 1HB ALA 39 8.958 -1.809 0.931 311 2HB ALA 39 2HB ALA 39 7.577 -1.979 2.042 312 3HB ALA 39 3HB ALA 39 8.658 -0.571 2.175 313 H LEU 40 H LEU 40 11.085 -3.723 1.366 314 HA LEU 40 HA LEU 40 9.546 -6.083 1.175 315 1HB LEU 40 1HB LEU 40 12.315 -5.266 0.351 316 2HB LEU 40 2HB LEU 40 11.792 -6.931 0.198 317 HG LEU 40 HG LEU 40 11.306 -4.707 -1.545 318 1HD1 LEU 40 1HD1 LEU 40 10.103 -6.807 -2.750 319 2HD1 LEU 40 2HD1 LEU 40 11.862 -6.540 -2.730 320 3HD1 LEU 40 3HD1 LEU 40 11.119 -7.659 -1.563 321 1HD2 LEU 40 1HD2 LEU 40 8.740 -6.095 -0.753 322 2HD2 LEU 40 2HD2 LEU 40 9.221 -4.500 -0.125 323 3HD2 LEU 40 3HD2 LEU 40 8.962 -4.728 -1.872 324 H ASP 41 H ASP 41 12.396 -5.073 3.136 325 HA ASP 41 HA ASP 41 12.842 -7.584 4.226 326 1HB ASP 41 1HB ASP 41 13.749 -4.832 4.617 327 2HB ASP 41 2HB ASP 41 13.552 -5.622 6.168 328 H ILE 42 H ILE 42 11.029 -4.650 5.386 329 HA ILE 42 HA ILE 42 10.149 -5.907 7.774 330 HB ILE 42 HB ILE 42 9.346 -3.388 6.325 331 1HG1 ILE 42 1HG1 ILE 42 11.381 -4.110 8.337 332 2HG1 ILE 42 2HG1 ILE 42 11.359 -2.806 7.166 333 1HG2 ILE 42 1HG2 ILE 42 7.471 -4.409 7.683 334 2HG2 ILE 42 2HG2 ILE 42 8.491 -4.160 9.120 335 3HG2 ILE 42 3HG2 ILE 42 7.968 -2.764 8.147 336 1HD1 ILE 42 1HD1 ILE 42 9.964 -2.897 9.870 337 2HD1 ILE 42 2HD1 ILE 42 11.210 -1.754 9.316 338 3HD1 ILE 42 3HD1 ILE 42 9.568 -1.679 8.635 339 H VAL 43 H VAL 43 9.152 -5.960 4.424 340 HA VAL 43 HA VAL 43 6.435 -6.412 4.706 341 HB VAL 43 HB VAL 43 8.525 -6.751 2.699 342 1HG1 VAL 43 1HG1 VAL 43 8.006 -9.021 2.501 343 2HG1 VAL 43 2HG1 VAL 43 6.280 -8.760 2.852 344 3HG1 VAL 43 3HG1 VAL 43 6.956 -8.257 1.284 345 1HG2 VAL 43 1HG2 VAL 43 7.158 -5.424 1.475 346 2HG2 VAL 43 2HG2 VAL 43 5.696 -6.338 1.915 347 3HG2 VAL 43 3HG2 VAL 43 6.368 -5.136 3.043 348 H THR 44 H THR 44 9.257 -8.620 5.013 349 HA THR 44 HA THR 44 7.461 -10.851 5.544 350 HB THR 44 HB THR 44 10.519 -10.716 5.465 351 HG1 THR 44 HG1 THR 44 10.118 -10.499 3.302 352 1HG2 THR 44 1HG2 THR 44 8.434 -12.935 5.290 353 2HG2 THR 44 2HG2 THR 44 10.049 -13.128 4.568 354 3HG2 THR 44 3HG2 THR 44 9.884 -12.868 6.321 355 H LYS 45 H LYS 45 9.660 -8.601 7.219 356 HA LYS 45 HA LYS 45 9.772 -10.055 9.620 357 1HB LYS 45 1HB LYS 45 10.881 -7.698 8.559 358 2HB LYS 45 2HB LYS 45 9.988 -7.183 9.975 359 1HG LYS 45 1HG LYS 45 11.299 -9.598 10.736 360 2HG LYS 45 2HG LYS 45 12.487 -8.685 9.827 361 1HD LYS 45 1HD LYS 45 12.248 -6.752 11.284 362 2HD LYS 45 2HD LYS 45 10.830 -7.431 12.059 363 1HE LYS 45 1HE LYS 45 12.579 -7.867 13.608 364 2HE LYS 45 2HE LYS 45 12.363 -9.400 12.788 365 1HZ LYS 45 1HZ LYS 45 14.654 -8.864 12.854 366 2HZ LYS 45 2HZ LYS 45 14.175 -8.734 11.298 367 3HZ LYS 45 3HZ LYS 45 14.418 -7.389 12.192 368 H GLU 46 H GLU 46 7.445 -7.720 8.234 369 HA GLU 46 HA GLU 46 5.917 -7.941 10.698 370 1HB GLU 46 1HB GLU 46 6.073 -5.891 8.498 371 2HB GLU 46 2HB GLU 46 4.554 -6.055 9.357 372 1HG GLU 46 1HG GLU 46 7.169 -5.806 10.885 373 2HG GLU 46 2HG GLU 46 6.356 -4.378 10.277 374 H ARG 47 H ARG 47 6.228 -9.375 7.666 375 HA ARG 47 HA ARG 47 4.757 -10.192 6.193 376 1HB ARG 47 1HB ARG 47 3.689 -12.240 7.195 377 2HB ARG 47 2HB ARG 47 5.359 -12.046 7.690 378 1HG ARG 47 1HG ARG 47 4.793 -11.795 9.885 379 2HG ARG 47 2HG ARG 47 3.531 -10.637 9.513 380 1HD ARG 47 1HD ARG 47 2.560 -12.667 10.546 381 2HD ARG 47 2HD ARG 47 1.980 -12.484 8.903 382 HE ARG 47 HE ARG 47 4.401 -14.144 9.165 383 1HH1 ARG 47 1HH1 ARG 47 0.884 -14.097 9.055 384 2HH1 ARG 47 2HH1 ARG 47 0.748 -15.763 8.603 385 1HH2 ARG 47 1HH2 ARG 47 4.222 -16.343 8.569 386 2HH2 ARG 47 2HH2 ARG 47 2.660 -17.050 8.326 387 HA PRO 48 HA PRO 48 1.027 -7.872 7.579 388 1HB PRO 48 1HB PRO 48 1.119 -5.792 5.810 389 2HB PRO 48 2HB PRO 48 1.750 -5.690 7.442 390 1HG PRO 48 1HG PRO 48 3.230 -5.943 4.896 391 2HG PRO 48 2HG PRO 48 3.820 -5.421 6.461 392 1HD PRO 48 1HD PRO 48 4.238 -7.981 5.236 393 2HD PRO 48 2HD PRO 48 4.728 -7.498 6.848 394 H ASP 49 H ASP 49 -1.060 -8.027 6.784 395 HA ASP 49 HA ASP 49 -1.198 -9.802 4.601 396 1HB ASP 49 1HB ASP 49 -2.962 -8.717 6.651 397 2HB ASP 49 2HB ASP 49 -3.766 -8.638 5.096 398 H LEU 50 H LEU 50 -0.676 -6.476 4.814 399 HA LEU 50 HA LEU 50 -1.298 -6.076 2.062 400 1HB LEU 50 1HB LEU 50 -3.432 -5.667 3.688 401 2HB LEU 50 2HB LEU 50 -2.704 -4.073 3.715 402 HG LEU 50 HG LEU 50 -2.703 -4.210 1.145 403 1HD1 LEU 50 1HD1 LEU 50 -3.315 -6.141 0.234 404 2HD1 LEU 50 2HD1 LEU 50 -3.882 -6.775 1.798 405 3HD1 LEU 50 3HD1 LEU 50 -4.973 -5.800 0.784 406 1HD2 LEU 50 1HD2 LEU 50 -4.987 -3.736 2.986 407 2HD2 LEU 50 2HD2 LEU 50 -4.173 -2.636 1.847 408 3HD2 LEU 50 3HD2 LEU 50 -5.354 -3.825 1.246 409 H VAL 51 H VAL 51 -0.247 -4.185 1.225 410 HA VAL 51 HA VAL 51 1.356 -2.722 3.185 411 HB VAL 51 HB VAL 51 2.413 -4.005 0.658 412 1HG1 VAL 51 1HG1 VAL 51 4.630 -3.217 1.531 413 2HG1 VAL 51 2HG1 VAL 51 3.533 -1.909 1.027 414 3HG1 VAL 51 3HG1 VAL 51 3.753 -2.270 2.756 415 1HG2 VAL 51 1HG2 VAL 51 3.898 -4.954 2.795 416 2HG2 VAL 51 2HG2 VAL 51 2.234 -4.943 3.428 417 3HG2 VAL 51 3HG2 VAL 51 2.614 -5.837 1.936 418 H LEU 52 H LEU 52 1.848 -0.562 2.565 419 HA LEU 52 HA LEU 52 0.443 0.298 0.131 420 1HB LEU 52 1HB LEU 52 -0.898 0.986 1.940 421 2HB LEU 52 2HB LEU 52 0.483 1.503 2.887 422 HG LEU 52 HG LEU 52 0.161 2.915 0.311 423 1HD1 LEU 52 1HD1 LEU 52 -2.055 2.766 2.277 424 2HD1 LEU 52 2HD1 LEU 52 -1.619 4.389 1.688 425 3HD1 LEU 52 3HD1 LEU 52 -2.079 3.116 0.532 426 1HD2 LEU 52 1HD2 LEU 52 1.854 3.695 1.755 427 2HD2 LEU 52 2HD2 LEU 52 0.534 4.883 1.876 428 3HD2 LEU 52 3HD2 LEU 52 0.772 3.681 3.168 429 H LEU 53 H LEU 53 1.806 1.088 -1.371 430 HA LEU 53 HA LEU 53 4.173 2.511 -0.396 431 1HB LEU 53 1HB LEU 53 4.833 0.229 -0.958 432 2HB LEU 53 2HB LEU 53 4.132 0.399 -2.555 433 HG LEU 53 HG LEU 53 6.626 0.604 -2.451 434 1HD1 LEU 53 1HD1 LEU 53 6.733 2.126 -4.190 435 2HD1 LEU 53 2HD1 LEU 53 5.019 1.644 -4.212 436 3HD1 LEU 53 3HD1 LEU 53 5.499 3.193 -3.478 437 1HD2 LEU 53 1HD2 LEU 53 7.519 2.847 -1.724 438 2HD2 LEU 53 2HD2 LEU 53 5.955 3.125 -0.922 439 3HD2 LEU 53 3HD2 LEU 53 6.987 1.767 -0.414 440 H ASP 54 H ASP 54 4.632 4.398 -1.492 441 HA ASP 54 HA ASP 54 2.668 5.077 -3.512 442 1HB ASP 54 1HB ASP 54 2.635 7.032 -2.368 443 2HB ASP 54 2HB ASP 54 3.941 6.481 -1.337 444 H MET 55 H MET 55 3.337 5.584 -5.654 445 HA MET 55 HA MET 55 5.755 4.595 -6.522 446 1HB MET 55 1HB MET 55 4.028 6.745 -7.868 447 2HB MET 55 2HB MET 55 5.112 5.636 -8.684 448 1HG MET 55 1HG MET 55 2.494 4.985 -7.273 449 2HG MET 55 2HG MET 55 2.905 4.712 -8.954 450 1HE MET 55 1HE MET 55 2.677 3.747 -5.607 451 2HE MET 55 2HE MET 55 3.075 2.012 -5.577 452 3HE MET 55 3HE MET 55 4.324 3.219 -5.187 453 H LYS 56 H LYS 56 4.732 8.089 -6.648 454 HA LYS 56 HA LYS 56 7.135 9.176 -7.238 455 1HB LYS 56 1HB LYS 56 4.648 10.120 -6.602 456 2HB LYS 56 2HB LYS 56 5.578 10.685 -5.229 457 1HG LYS 56 1HG LYS 56 6.890 12.106 -6.512 458 2HG LYS 56 2HG LYS 56 6.866 11.049 -7.910 459 1HD LYS 56 1HD LYS 56 4.466 11.688 -8.326 460 2HD LYS 56 2HD LYS 56 4.535 12.782 -6.959 461 1HE LYS 56 1HE LYS 56 6.702 13.708 -8.282 462 2HE LYS 56 2HE LYS 56 5.857 13.024 -9.656 463 1HZ LYS 56 1HZ LYS 56 5.280 15.343 -9.160 464 2HZ LYS 56 2HZ LYS 56 3.980 14.355 -9.168 465 3HZ LYS 56 3HZ LYS 56 4.604 14.873 -7.750 466 H ILE 57 H ILE 57 8.990 8.288 -6.360 467 HA ILE 57 HA ILE 57 9.243 8.640 -3.455 468 HB ILE 57 HB ILE 57 10.227 6.384 -5.197 469 1HG1 ILE 57 1HG1 ILE 57 8.761 5.945 -2.647 470 2HG1 ILE 57 2HG1 ILE 57 7.831 6.620 -3.969 471 1HG2 ILE 57 1HG2 ILE 57 10.912 6.876 -2.288 472 2HG2 ILE 57 2HG2 ILE 57 11.443 5.519 -3.309 473 3HG2 ILE 57 3HG2 ILE 57 12.011 7.169 -3.657 474 1HD1 ILE 57 1HD1 ILE 57 7.742 4.607 -4.999 475 2HD1 ILE 57 2HD1 ILE 57 9.518 4.483 -4.987 476 3HD1 ILE 57 3HD1 ILE 57 8.575 3.900 -3.594 477 HA PRO 58 HA PRO 58 12.445 11.246 -4.869 478 1HB PRO 58 1HB PRO 58 13.086 12.342 -2.449 479 2HB PRO 58 2HB PRO 58 11.798 12.955 -3.468 480 1HG PRO 58 1HG PRO 58 11.599 11.356 -0.990 481 2HG PRO 58 2HG PRO 58 10.366 12.323 -1.775 482 1HD PRO 58 1HD PRO 58 10.599 9.464 -1.831 483 2HD PRO 58 2HD PRO 58 9.437 10.438 -2.709 484 H GLY 59 H GLY 59 14.538 10.936 -5.367 485 1HA GLY 59 1HA GLY 59 16.700 10.307 -4.893 486 2HA GLY 59 2HA GLY 59 16.181 9.575 -3.388 487 H MET 60 H MET 60 13.862 8.413 -5.355 488 HA MET 60 HA MET 60 14.993 6.715 -7.128 489 1HB MET 60 1HB MET 60 15.815 5.980 -4.526 490 2HB MET 60 2HB MET 60 14.483 4.886 -4.844 491 1HG MET 60 1HG MET 60 15.771 4.658 -7.228 492 2HG MET 60 2HG MET 60 17.144 5.096 -6.232 493 1HE MET 60 1HE MET 60 14.066 2.410 -4.733 494 2HE MET 60 2HE MET 60 13.959 3.310 -6.265 495 3HE MET 60 3HE MET 60 14.425 1.592 -6.273 496 H ASP 61 H ASP 61 13.000 7.113 -8.170 497 HA ASP 61 HA ASP 61 10.550 7.079 -7.104 498 1HB ASP 61 1HB ASP 61 10.064 5.847 -9.524 499 2HB ASP 61 2HB ASP 61 10.311 7.570 -9.319 500 H GLY 62 H GLY 62 8.769 5.253 -7.641 501 1HA GLY 62 1HA GLY 62 9.795 2.747 -6.509 502 2HA GLY 62 2HA GLY 62 8.131 3.297 -6.528 503 H ILE 63 H ILE 63 9.057 4.152 -9.549 504 HA ILE 63 HA ILE 63 7.587 2.316 -10.893 505 HB ILE 63 HB ILE 63 10.047 3.760 -11.886 506 1HG1 ILE 63 1HG1 ILE 63 7.434 4.910 -12.521 507 2HG1 ILE 63 2HG1 ILE 63 7.734 4.859 -10.795 508 1HG2 ILE 63 1HG2 ILE 63 9.159 3.524 -14.089 509 2HG2 ILE 63 2HG2 ILE 63 9.196 1.907 -13.346 510 3HG2 ILE 63 3HG2 ILE 63 7.658 2.793 -13.473 511 1HD1 ILE 63 1HD1 ILE 63 8.817 6.845 -11.248 512 2HD1 ILE 63 2HD1 ILE 63 10.170 5.746 -11.606 513 3HD1 ILE 63 3HD1 ILE 63 9.170 6.388 -12.932 514 H GLU 64 H GLU 64 10.996 2.070 -9.825 515 HA GLU 64 HA GLU 64 11.262 -0.435 -11.202 516 1HB GLU 64 1HB GLU 64 13.198 0.980 -9.316 517 2HB GLU 64 2HB GLU 64 13.581 -0.395 -10.333 518 1HG GLU 64 1HG GLU 64 12.505 2.208 -11.494 519 2HG GLU 64 2HG GLU 64 14.219 1.956 -11.226 520 H ILE 65 H ILE 65 11.303 0.803 -7.788 521 HA ILE 65 HA ILE 65 11.666 -1.536 -6.460 522 HB ILE 65 HB ILE 65 10.095 0.943 -5.855 523 1HG1 ILE 65 1HG1 ILE 65 12.517 1.127 -5.864 524 2HG1 ILE 65 2HG1 ILE 65 11.896 1.308 -4.235 525 1HG2 ILE 65 1HG2 ILE 65 9.952 0.069 -3.478 526 2HG2 ILE 65 2HG2 ILE 65 8.827 -0.648 -4.655 527 3HG2 ILE 65 3HG2 ILE 65 10.279 -1.546 -4.151 528 1HD1 ILE 65 1HD1 ILE 65 13.547 -0.222 -3.754 529 2HD1 ILE 65 2HD1 ILE 65 12.296 -1.389 -4.249 530 3HD1 ILE 65 3HD1 ILE 65 13.553 -0.887 -5.406 531 H LEU 66 H LEU 66 8.406 -0.126 -7.254 532 HA LEU 66 HA LEU 66 6.969 -2.362 -6.509 533 1HB LEU 66 1HB LEU 66 6.404 -0.182 -8.515 534 2HB LEU 66 2HB LEU 66 5.230 -1.406 -8.077 535 HG LEU 66 HG LEU 66 4.577 0.238 -6.654 536 1HD1 LEU 66 1HD1 LEU 66 6.818 -0.710 -4.877 537 2HD1 LEU 66 2HD1 LEU 66 5.140 -0.295 -4.454 538 3HD1 LEU 66 3HD1 LEU 66 5.486 -1.790 -5.357 539 1HD2 LEU 66 1HD2 LEU 66 5.765 2.100 -6.010 540 2HD2 LEU 66 2HD2 LEU 66 7.317 1.231 -5.952 541 3HD2 LEU 66 3HD2 LEU 66 6.597 1.664 -7.521 542 H LYS 67 H LYS 67 8.859 -1.674 -9.432 543 HA LYS 67 HA LYS 67 7.695 -3.702 -11.015 544 1HB LYS 67 1HB LYS 67 9.787 -1.711 -11.235 545 2HB LYS 67 2HB LYS 67 10.340 -3.243 -11.881 546 1HG LYS 67 1HG LYS 67 7.932 -3.281 -13.036 547 2HG LYS 67 2HG LYS 67 7.990 -1.552 -12.760 548 1HD LYS 67 1HD LYS 67 9.521 -1.227 -14.420 549 2HD LYS 67 2HD LYS 67 10.526 -2.553 -13.871 550 1HE LYS 67 1HE LYS 67 8.819 -4.153 -14.934 551 2HE LYS 67 2HE LYS 67 8.047 -2.748 -15.642 552 1HZ LYS 67 1HZ LYS 67 10.832 -2.704 -16.077 553 2HZ LYS 67 2HZ LYS 67 10.184 -4.092 -16.643 554 3HZ LYS 67 3HZ LYS 67 9.617 -2.654 -17.168 555 H ARG 68 H ARG 68 10.954 -3.570 -9.399 556 HA ARG 68 HA ARG 68 11.496 -6.217 -9.791 557 1HB ARG 68 1HB ARG 68 12.477 -4.055 -7.965 558 2HB ARG 68 2HB ARG 68 12.849 -5.688 -7.449 559 1HG ARG 68 1HG ARG 68 13.974 -6.180 -9.565 560 2HG ARG 68 2HG ARG 68 13.433 -4.668 -10.265 561 1HD ARG 68 1HD ARG 68 14.749 -3.428 -8.482 562 2HD ARG 68 2HD ARG 68 15.361 -4.967 -7.911 563 HE ARG 68 HE ARG 68 15.782 -4.634 -10.774 564 1HH1 ARG 68 1HH1 ARG 68 17.065 -3.800 -7.606 565 2HH1 ARG 68 2HH1 ARG 68 18.683 -3.567 -8.181 566 1HH2 ARG 68 1HH2 ARG 68 17.915 -4.328 -11.533 567 2HH2 ARG 68 2HH2 ARG 68 19.169 -3.869 -10.430 568 H MET 69 H MET 69 9.411 -4.608 -7.435 569 HA MET 69 HA MET 69 9.414 -6.593 -5.487 570 1HB MET 69 1HB MET 69 7.926 -4.147 -6.189 571 2HB MET 69 2HB MET 69 6.842 -5.356 -5.529 572 1HG MET 69 1HG MET 69 7.846 -5.323 -3.429 573 2HG MET 69 2HG MET 69 9.439 -4.976 -4.071 574 1HE MET 69 1HE MET 69 6.718 -3.025 -1.907 575 2HE MET 69 2HE MET 69 5.963 -2.190 -3.286 576 3HE MET 69 3HE MET 69 6.048 -3.968 -3.260 577 H LYS 70 H LYS 70 7.204 -5.965 -8.296 578 HA LYS 70 HA LYS 70 5.683 -8.325 -7.741 579 1HB LYS 70 1HB LYS 70 4.265 -7.606 -9.412 580 2HB LYS 70 2HB LYS 70 4.930 -6.090 -8.838 581 1HG LYS 70 1HG LYS 70 5.097 -5.947 -11.211 582 2HG LYS 70 2HG LYS 70 6.724 -6.330 -10.685 583 1HD LYS 70 1HD LYS 70 6.718 -8.298 -11.821 584 2HD LYS 70 2HD LYS 70 5.207 -8.793 -11.083 585 1HE LYS 70 1HE LYS 70 4.073 -8.345 -12.997 586 2HE LYS 70 2HE LYS 70 4.634 -6.685 -12.985 587 1HZ LYS 70 1HZ LYS 70 6.238 -8.932 -13.987 588 2HZ LYS 70 2HZ LYS 70 5.328 -7.965 -14.937 589 3HZ LYS 70 3HZ LYS 70 6.595 -7.344 -14.115 590 H VAL 71 H VAL 71 8.310 -7.328 -9.987 591 HA VAL 71 HA VAL 71 8.274 -9.635 -11.556 592 HB VAL 71 HB VAL 71 10.630 -7.880 -10.842 593 1HG1 VAL 71 1HG1 VAL 71 11.376 -9.814 -12.027 594 2HG1 VAL 71 2HG1 VAL 71 10.036 -9.699 -13.193 595 3HG1 VAL 71 3HG1 VAL 71 11.328 -8.475 -13.199 596 1HG2 VAL 71 1HG2 VAL 71 8.221 -7.017 -11.913 597 2HG2 VAL 71 2HG2 VAL 71 9.791 -6.189 -12.050 598 3HG2 VAL 71 3HG2 VAL 71 9.243 -7.276 -13.347 599 H ILE 72 H ILE 72 9.578 -8.927 -8.325 600 HA ILE 72 HA ILE 72 11.288 -11.177 -8.219 601 HB ILE 72 HB ILE 72 10.210 -9.162 -6.310 602 1HG1 ILE 72 1HG1 ILE 72 12.320 -8.966 -7.778 603 2HG1 ILE 72 2HG1 ILE 72 12.426 -8.509 -6.090 604 1HG2 ILE 72 1HG2 ILE 72 11.550 -10.444 -4.504 605 2HG2 ILE 72 2HG2 ILE 72 9.889 -10.962 -4.879 606 3HG2 ILE 72 3HG2 ILE 72 11.273 -11.868 -5.536 607 1HD1 ILE 72 1HD1 ILE 72 14.286 -10.060 -7.091 608 2HD1 ILE 72 2HD1 ILE 72 13.619 -10.462 -5.490 609 3HD1 ILE 72 3HD1 ILE 72 13.070 -11.351 -6.931 610 H ASP 73 H ASP 73 7.862 -10.540 -7.319 611 HA ASP 73 HA ASP 73 7.358 -13.326 -7.537 612 1HB ASP 73 1HB ASP 73 7.734 -12.063 -4.907 613 2HB ASP 73 2HB ASP 73 6.127 -12.746 -5.057 614 H GLU 74 H GLU 74 4.914 -13.716 -7.370 615 HA GLU 74 HA GLU 74 3.541 -11.262 -8.094 616 1HB GLU 74 1HB GLU 74 2.050 -12.582 -9.376 617 2HB GLU 74 2HB GLU 74 3.610 -13.340 -9.633 618 1HG GLU 74 1HG GLU 74 3.069 -14.981 -7.781 619 2HG GLU 74 2HG GLU 74 1.477 -14.260 -7.648 620 H ASN 75 H ASN 75 3.931 -13.536 -5.532 621 HA ASN 75 HA ASN 75 1.313 -13.486 -4.541 622 1HB ASN 75 1HB ASN 75 2.593 -14.150 -2.337 623 2HB ASN 75 2HB ASN 75 2.655 -15.253 -3.697 624 1HD2 ASN 75 1HD2 ASN 75 4.568 -16.110 -3.895 625 2HD2 ASN 75 2HD2 ASN 75 6.101 -15.320 -3.732 626 H ILE 76 H ILE 76 3.928 -11.200 -4.650 627 HA ILE 76 HA ILE 76 3.506 -9.870 -2.206 628 HB ILE 76 HB ILE 76 5.544 -9.768 -3.618 629 1HG1 ILE 76 1HG1 ILE 76 4.261 -7.124 -2.871 630 2HG1 ILE 76 2HG1 ILE 76 5.170 -8.175 -1.804 631 1HG2 ILE 76 1HG2 ILE 76 4.409 -7.607 -5.299 632 2HG2 ILE 76 2HG2 ILE 76 5.649 -8.829 -5.669 633 3HG2 ILE 76 3HG2 ILE 76 3.926 -9.270 -5.712 634 1HD1 ILE 76 1HD1 ILE 76 6.146 -6.265 -3.834 635 2HD1 ILE 76 2HD1 ILE 76 6.983 -6.941 -2.416 636 3HD1 ILE 76 3HD1 ILE 76 6.928 -7.861 -3.938 637 H ARG 77 H ARG 77 1.950 -8.467 -1.558 638 HA ARG 77 HA ARG 77 0.226 -7.461 -3.679 639 1HB ARG 77 1HB ARG 77 -1.174 -8.968 -2.501 640 2HB ARG 77 2HB ARG 77 -0.428 -8.616 -0.956 641 1HG ARG 77 1HG ARG 77 -1.615 -6.591 -0.682 642 2HG ARG 77 2HG ARG 77 -1.893 -6.398 -2.401 643 1HD ARG 77 1HD ARG 77 -3.311 -8.259 -0.464 644 2HD ARG 77 2HD ARG 77 -4.015 -7.060 -1.530 645 HE ARG 77 HE ARG 77 -2.867 -8.739 -3.343 646 1HH1 ARG 77 1HH1 ARG 77 -4.867 -9.404 -0.525 647 2HH1 ARG 77 2HH1 ARG 77 -5.544 -10.854 -1.189 648 1HH2 ARG 77 1HH2 ARG 77 -3.759 -10.651 -4.219 649 2HH2 ARG 77 2HH2 ARG 77 -4.909 -11.568 -3.305 650 H VAL 78 H VAL 78 0.626 -5.277 -3.890 651 HA VAL 78 HA VAL 78 0.635 -3.686 -1.453 652 HB VAL 78 HB VAL 78 3.005 -4.411 -2.514 653 1HG1 VAL 78 1HG1 VAL 78 2.474 -1.707 -3.776 654 2HG1 VAL 78 2HG1 VAL 78 3.918 -2.734 -3.943 655 3HG1 VAL 78 3HG1 VAL 78 2.376 -3.242 -4.672 656 1HG2 VAL 78 1HG2 VAL 78 3.244 -1.675 -1.619 657 2HG2 VAL 78 2HG2 VAL 78 2.044 -2.541 -0.630 658 3HG2 VAL 78 3HG2 VAL 78 3.697 -3.181 -0.786 659 H ILE 79 H ILE 79 -0.128 -1.537 -1.779 660 HA ILE 79 HA ILE 79 -1.432 -1.213 -4.383 661 HB ILE 79 HB ILE 79 -2.256 -0.828 -1.636 662 1HG1 ILE 79 1HG1 ILE 79 -3.345 -2.147 -3.536 663 2HG1 ILE 79 2HG1 ILE 79 -4.394 -1.192 -2.507 664 1HG2 ILE 79 1HG2 ILE 79 -2.367 1.547 -3.485 665 2HG2 ILE 79 2HG2 ILE 79 -3.603 1.286 -2.232 666 3HG2 ILE 79 3HG2 ILE 79 -1.894 1.471 -1.771 667 1HD1 ILE 79 1HD1 ILE 79 -4.260 -1.061 -5.303 668 2HD1 ILE 79 2HD1 ILE 79 -5.055 0.123 -4.237 669 3HD1 ILE 79 3HD1 ILE 79 -3.377 0.389 -4.767 670 H ILE 80 H ILE 80 -1.187 0.706 -5.577 671 HA ILE 80 HA ILE 80 1.147 2.261 -4.753 672 HB ILE 80 HB ILE 80 1.381 2.859 -7.051 673 1HG1 ILE 80 1HG1 ILE 80 -0.210 1.834 -8.765 674 2HG1 ILE 80 2HG1 ILE 80 -1.311 1.534 -7.435 675 1HG2 ILE 80 1HG2 ILE 80 1.014 0.191 -7.859 676 2HG2 ILE 80 2HG2 ILE 80 2.497 0.951 -7.234 677 3HG2 ILE 80 3HG2 ILE 80 1.379 0.131 -6.118 678 1HD1 ILE 80 1HD1 ILE 80 -1.966 3.705 -7.379 679 2HD1 ILE 80 2HD1 ILE 80 -0.280 4.274 -7.327 680 3HD1 ILE 80 3HD1 ILE 80 -1.055 3.931 -8.892 681 H MET 81 H MET 81 1.100 4.613 -4.945 682 HA MET 81 HA MET 81 -1.587 5.704 -5.022 683 1HB MET 81 1HB MET 81 0.261 6.865 -2.963 684 2HB MET 81 2HB MET 81 -1.468 6.598 -2.866 685 1HG MET 81 1HG MET 81 -1.096 4.160 -2.524 686 2HG MET 81 2HG MET 81 0.634 4.384 -2.689 687 1HE MET 81 1HE MET 81 2.137 5.338 -1.205 688 2HE MET 81 2HE MET 81 1.890 5.496 0.551 689 3HE MET 81 3HE MET 81 1.743 3.903 -0.229 690 H THR 82 H THR 82 -1.681 7.509 -6.303 691 HA THR 82 HA THR 82 0.166 9.562 -6.320 692 HB THR 82 HB THR 82 1.855 8.125 -7.251 693 HG1 THR 82 HG1 THR 82 1.467 10.117 -8.469 694 1HG2 THR 82 1HG2 THR 82 0.428 7.259 -9.678 695 2HG2 THR 82 2HG2 THR 82 1.420 6.294 -8.558 696 3HG2 THR 82 3HG2 THR 82 -0.304 6.571 -8.209 697 H ALA 83 H ALA 83 -0.472 11.284 -7.661 698 HA ALA 83 HA ALA 83 -3.175 11.355 -8.251 699 1HB ALA 83 1HB ALA 83 -2.136 13.421 -7.904 700 2HB ALA 83 2HB ALA 83 -0.767 13.027 -8.972 701 3HB ALA 83 3HB ALA 83 -2.360 13.408 -9.670 702 H TYR 84 H TYR 84 -4.245 11.611 -10.389 703 HA TYR 84 HA TYR 84 -3.353 9.528 -12.155 704 1HB TYR 84 1HB TYR 84 -5.575 9.858 -13.044 705 2HB TYR 84 2HB TYR 84 -5.763 10.295 -11.358 706 HD1 TYR 84 HD1 TYR 84 -6.039 11.416 -14.767 707 HD2 TYR 84 HD2 TYR 84 -5.684 12.774 -10.725 708 HE1 TYR 84 HE1 TYR 84 -6.916 13.703 -15.450 709 HE2 TYR 84 HE2 TYR 84 -6.562 15.056 -11.422 710 HH TYR 84 HH TYR 84 -8.179 15.602 -14.165 711 H GLY 85 H GLY 85 -1.350 11.472 -12.109 712 1HA GLY 85 1HA GLY 85 -1.776 13.026 -14.579 713 2HA GLY 85 2HA GLY 85 -0.595 13.365 -13.330 714 H GLU 86 H GLU 86 -0.540 10.053 -13.510 715 HA GLU 86 HA GLU 86 1.175 9.970 -15.838 716 1HB GLU 86 1HB GLU 86 2.727 8.482 -14.215 717 2HB GLU 86 2HB GLU 86 2.963 10.207 -14.411 718 1HG GLU 86 1HG GLU 86 1.618 10.669 -12.393 719 2HG GLU 86 2HG GLU 86 1.222 8.969 -12.228 720 H LEU 87 H LEU 87 -1.348 8.983 -15.895 721 HA LEU 87 HA LEU 87 -1.921 6.550 -14.840 722 1HB LEU 87 1HB LEU 87 -2.544 7.547 -17.623 723 2HB LEU 87 2HB LEU 87 -3.346 6.213 -16.820 724 HG LEU 87 HG LEU 87 -3.326 8.912 -15.506 725 1HD1 LEU 87 1HD1 LEU 87 -5.140 8.093 -17.789 726 2HD1 LEU 87 2HD1 LEU 87 -5.437 9.468 -16.697 727 3HD1 LEU 87 3HD1 LEU 87 -4.000 9.460 -17.748 728 1HD2 LEU 87 1HD2 LEU 87 -5.070 8.133 -14.262 729 2HD2 LEU 87 2HD2 LEU 87 -5.667 7.063 -15.553 730 3HD2 LEU 87 3HD2 LEU 87 -4.241 6.594 -14.597 731 H ASP 88 H ASP 88 0.261 7.328 -17.576 732 HA ASP 88 HA ASP 88 0.589 4.909 -18.678 733 1HB ASP 88 1HB ASP 88 2.109 7.367 -18.449 734 2HB ASP 88 2HB ASP 88 3.223 6.019 -18.326 735 H MET 89 H MET 89 2.087 6.241 -15.663 736 HA MET 89 HA MET 89 3.653 3.922 -15.229 737 1HB MET 89 1HB MET 89 4.061 6.367 -14.416 738 2HB MET 89 2HB MET 89 2.844 6.063 -13.193 739 1HG MET 89 1HG MET 89 4.905 3.931 -13.350 740 2HG MET 89 2HG MET 89 5.562 5.501 -12.934 741 1HE MET 89 1HE MET 89 5.986 4.387 -9.963 742 2HE MET 89 2HE MET 89 4.908 2.971 -9.929 743 3HE MET 89 3HE MET 89 5.921 3.284 -11.359 744 H ILE 90 H ILE 90 0.588 5.274 -13.862 745 HA ILE 90 HA ILE 90 0.218 3.357 -11.893 746 HB ILE 90 HB ILE 90 -1.650 5.118 -13.459 747 1HG1 ILE 90 1HG1 ILE 90 -1.596 5.581 -10.633 748 2HG1 ILE 90 2HG1 ILE 90 0.059 5.478 -11.200 749 1HG2 ILE 90 1HG2 ILE 90 -3.222 3.553 -12.956 750 2HG2 ILE 90 2HG2 ILE 90 -2.312 2.912 -11.567 751 3HG2 ILE 90 3HG2 ILE 90 -3.213 4.440 -11.413 752 1HD1 ILE 90 1HD1 ILE 90 -2.093 7.442 -11.956 753 2HD1 ILE 90 2HD1 ILE 90 -0.367 7.724 -11.627 754 3HD1 ILE 90 3HD1 ILE 90 -0.873 7.024 -13.183 755 H GLN 91 H GLN 91 -0.822 3.418 -15.358 756 HA GLN 91 HA GLN 91 -2.286 1.125 -15.332 757 1HB GLN 91 1HB GLN 91 -0.728 2.637 -17.398 758 2HB GLN 91 2HB GLN 91 -1.210 1.007 -17.826 759 1HG GLN 91 1HG GLN 91 -3.440 2.382 -16.545 760 2HG GLN 91 2HG GLN 91 -2.823 3.361 -17.861 761 1HE2 GLN 91 1HE2 GLN 91 -4.746 2.993 -18.997 762 2HE2 GLN 91 2HE2 GLN 91 -5.054 1.516 -19.848 763 H GLU 92 H GLU 92 1.264 1.501 -16.011 764 HA GLU 92 HA GLU 92 1.774 -1.152 -16.452 765 1HB GLU 92 1HB GLU 92 3.301 1.282 -15.906 766 2HB GLU 92 2HB GLU 92 4.069 -0.107 -15.164 767 1HG GLU 92 1HG GLU 92 3.824 -1.320 -17.412 768 2HG GLU 92 2HG GLU 92 3.299 0.204 -18.101 769 H SER 93 H SER 93 1.466 0.689 -13.394 770 HA SER 93 HA SER 93 2.557 -1.237 -11.736 771 1HB SER 93 1HB SER 93 1.949 0.191 -10.048 772 2HB SER 93 2HB SER 93 1.657 1.292 -11.380 773 HG SER 93 HG SER 93 -0.179 -0.020 -9.686 774 H LYS 94 H LYS 94 -0.803 -0.675 -12.936 775 HA LYS 94 HA LYS 94 -1.977 -2.697 -11.368 776 1HB LYS 94 1HB LYS 94 -2.824 -0.678 -13.132 777 2HB LYS 94 2HB LYS 94 -3.365 -2.175 -13.864 778 1HG LYS 94 1HG LYS 94 -4.042 -2.688 -11.268 779 2HG LYS 94 2HG LYS 94 -4.162 -0.939 -11.250 780 1HD LYS 94 1HD LYS 94 -6.282 -1.323 -12.040 781 2HD LYS 94 2HD LYS 94 -5.477 -1.452 -13.592 782 1HE LYS 94 1HE LYS 94 -5.650 -3.926 -11.865 783 2HE LYS 94 2HE LYS 94 -7.097 -3.396 -12.700 784 1HZ LYS 94 1HZ LYS 94 -5.363 -3.236 -14.656 785 2HZ LYS 94 2HZ LYS 94 -4.637 -4.420 -13.796 786 3HZ LYS 94 3HZ LYS 94 -6.172 -4.614 -14.319 787 H GLU 95 H GLU 95 -0.719 -2.599 -14.761 788 HA GLU 95 HA GLU 95 -1.377 -5.288 -15.225 789 1HB GLU 95 1HB GLU 95 -0.580 -4.907 -17.355 790 2HB GLU 95 2HB GLU 95 -0.786 -3.241 -16.854 791 1HG GLU 95 1HG GLU 95 1.635 -3.226 -16.090 792 2HG GLU 95 2HG GLU 95 1.812 -4.844 -16.739 793 H LEU 96 H LEU 96 0.999 -3.822 -13.273 794 HA LEU 96 HA LEU 96 3.091 -5.714 -13.744 795 1HB LEU 96 1HB LEU 96 2.695 -3.258 -12.301 796 2HB LEU 96 2HB LEU 96 3.412 -4.454 -11.240 797 HG LEU 96 HG LEU 96 5.266 -4.787 -12.784 798 1HD1 LEU 96 1HD1 LEU 96 3.687 -4.128 -14.801 799 2HD1 LEU 96 2HD1 LEU 96 4.410 -2.523 -14.535 800 3HD1 LEU 96 3HD1 LEU 96 5.453 -3.921 -14.890 801 1HD2 LEU 96 1HD2 LEU 96 4.642 -1.983 -11.893 802 2HD2 LEU 96 2HD2 LEU 96 5.788 -3.162 -11.211 803 3HD2 LEU 96 3HD2 LEU 96 6.155 -2.354 -12.754 804 H GLY 97 H GLY 97 0.069 -5.707 -12.067 805 1HA GLY 97 1HA GLY 97 -0.738 -7.813 -11.283 806 2HA GLY 97 2HA GLY 97 0.866 -8.192 -10.688 807 H ALA 98 H ALA 98 -0.462 -4.913 -10.328 808 HA ALA 98 HA ALA 98 -0.327 -5.244 -7.452 809 1HB ALA 98 1HB ALA 98 0.524 -3.263 -9.032 810 2HB ALA 98 2HB ALA 98 -1.144 -2.687 -8.794 811 3HB ALA 98 3HB ALA 98 -0.083 -2.949 -7.389 812 H LEU 99 H LEU 99 -2.118 -4.597 -6.038 813 HA LEU 99 HA LEU 99 -4.505 -5.799 -6.727 814 1HB LEU 99 1HB LEU 99 -4.289 -3.600 -4.692 815 2HB LEU 99 2HB LEU 99 -5.326 -5.013 -4.679 816 HG LEU 99 HG LEU 99 -3.750 -5.549 -3.085 817 1HD1 LEU 99 1HD1 LEU 99 -2.892 -6.715 -5.725 818 2HD1 LEU 99 2HD1 LEU 99 -2.080 -7.163 -4.206 819 3HD1 LEU 99 3HD1 LEU 99 -3.822 -7.466 -4.406 820 1HD2 LEU 99 1HD2 LEU 99 -1.827 -4.472 -2.816 821 2HD2 LEU 99 2HD2 LEU 99 -1.207 -5.055 -4.379 822 3HD2 LEU 99 3HD2 LEU 99 -2.193 -3.574 -4.309 823 H THR 100 H THR 100 -3.634 -2.277 -6.690 824 HA THR 100 HA THR 100 -5.162 -1.739 -8.988 825 HB THR 100 HB THR 100 -6.998 -2.206 -7.248 826 HG1 THR 100 HG1 THR 100 -7.541 -0.862 -9.009 827 1HG2 THR 100 1HG2 THR 100 -5.710 0.299 -6.076 828 2HG2 THR 100 2HG2 THR 100 -7.440 -0.049 -5.848 829 3HG2 THR 100 3HG2 THR 100 -6.215 -1.177 -5.220 830 H HIS 101 H HIS 101 -5.809 0.983 -8.445 831 HA HIS 101 HA HIS 101 -3.330 2.111 -7.463 832 1HB HIS 101 1HB HIS 101 -3.283 3.560 -9.608 833 2HB HIS 101 2HB HIS 101 -2.588 1.952 -9.638 834 HD1 HIS 101 HD1 HIS 101 -3.113 0.857 -11.810 835 HD2 HIS 101 HD2 HIS 101 -6.320 3.170 -10.409 836 HE1 HIS 101 HE1 HIS 101 -4.992 0.581 -13.514 837 H PHE 102 H PHE 102 -3.715 3.976 -6.337 838 HA PHE 102 HA PHE 102 -6.405 5.107 -6.653 839 1HB PHE 102 1HB PHE 102 -4.412 5.073 -4.306 840 2HB PHE 102 2HB PHE 102 -5.997 5.817 -4.239 841 HD1 PHE 102 HD1 PHE 102 -7.592 3.714 -5.663 842 HD2 PHE 102 HD2 PHE 102 -4.585 3.394 -2.686 843 HE1 PHE 102 HE1 PHE 102 -8.582 1.538 -4.897 844 HE2 PHE 102 HE2 PHE 102 -5.574 1.218 -1.920 845 HZ PHE 102 HZ PHE 102 -7.561 0.316 -3.035 846 H ALA 103 H ALA 103 -6.609 7.469 -6.324 847 HA ALA 103 HA ALA 103 -4.186 8.821 -7.273 848 1HB ALA 103 1HB ALA 103 -5.545 10.139 -8.557 849 2HB ALA 103 2HB ALA 103 -6.651 8.753 -8.403 850 3HB ALA 103 3HB ALA 103 -6.845 10.168 -7.341 851 H LYS 104 H LYS 104 -3.498 10.783 -6.264 852 HA LYS 104 HA LYS 104 -3.278 10.915 -3.658 853 1HB LYS 104 1HB LYS 104 -3.088 12.790 -5.810 854 2HB LYS 104 2HB LYS 104 -3.823 13.608 -4.447 855 1HG LYS 104 1HG LYS 104 -1.646 13.876 -3.765 856 2HG LYS 104 2HG LYS 104 -1.855 12.257 -3.127 857 1HD LYS 104 1HD LYS 104 0.008 11.794 -4.387 858 2HD LYS 104 2HD LYS 104 -1.153 11.630 -5.690 859 1HE LYS 104 1HE LYS 104 -0.805 14.012 -6.329 860 2HE LYS 104 2HE LYS 104 0.313 14.221 -4.995 861 1HZ LYS 104 1HZ LYS 104 1.800 13.643 -6.525 862 2HZ LYS 104 2HZ LYS 104 1.338 12.105 -6.227 863 3HZ LYS 104 3HZ LYS 104 0.719 12.911 -7.505 864 HA PRO 105 HA PRO 105 -7.492 12.907 -2.965 865 1HB PRO 105 1HB PRO 105 -9.212 13.327 -5.046 866 2HB PRO 105 2HB PRO 105 -8.121 14.558 -4.442 867 1HG PRO 105 1HG PRO 105 -7.915 12.949 -6.914 868 2HG PRO 105 2HG PRO 105 -7.096 14.444 -6.506 869 1HD PRO 105 1HD PRO 105 -5.971 11.806 -6.470 870 2HD PRO 105 2HD PRO 105 -5.189 13.286 -5.951 871 H PHE 106 H PHE 106 -7.880 11.059 -1.791 872 HA PHE 106 HA PHE 106 -9.749 9.286 -3.192 873 1HB PHE 106 1HB PHE 106 -8.486 7.651 -1.370 874 2HB PHE 106 2HB PHE 106 -7.927 7.822 -3.022 875 HD1 PHE 106 HD1 PHE 106 -5.636 7.923 -3.135 876 HD2 PHE 106 HD2 PHE 106 -7.590 9.911 0.065 877 HE1 PHE 106 HE1 PHE 106 -3.421 8.757 -2.300 878 HE2 PHE 106 HE2 PHE 106 -5.375 10.744 0.900 879 HZ PHE 106 HZ PHE 106 -3.317 10.157 -0.292 880 H ASP 107 H ASP 107 -11.289 8.170 -1.775 881 HA ASP 107 HA ASP 107 -11.643 9.669 0.699 882 1HB ASP 107 1HB ASP 107 -13.397 9.333 -1.450 883 2HB ASP 107 2HB ASP 107 -13.950 8.109 -0.324 884 H ILE 108 H ILE 108 -12.154 8.426 2.628 885 HA ILE 108 HA ILE 108 -11.102 5.813 2.666 886 HB ILE 108 HB ILE 108 -12.280 7.733 4.575 887 1HG1 ILE 108 1HG1 ILE 108 -10.275 7.383 5.760 888 2HG1 ILE 108 2HG1 ILE 108 -9.971 5.838 4.993 889 1HG2 ILE 108 1HG2 ILE 108 -12.484 6.050 6.361 890 2HG2 ILE 108 2HG2 ILE 108 -13.676 5.808 5.061 891 3HG2 ILE 108 3HG2 ILE 108 -12.241 4.759 5.159 892 1HD1 ILE 108 1HD1 ILE 108 -8.667 7.992 4.180 893 2HD1 ILE 108 2HD1 ILE 108 -9.248 6.810 2.982 894 3HD1 ILE 108 3HD1 ILE 108 -10.159 8.312 3.265 895 H ASP 109 H ASP 109 -14.382 7.191 2.367 896 HA ASP 109 HA ASP 109 -15.780 4.891 2.956 897 1HB ASP 109 1HB ASP 109 -16.333 7.510 2.028 898 2HB ASP 109 2HB ASP 109 -16.992 6.462 0.788 899 H GLU 110 H GLU 110 -14.371 6.207 -0.106 900 HA GLU 110 HA GLU 110 -15.432 4.108 -1.681 901 1HB GLU 110 1HB GLU 110 -14.186 5.123 -3.506 902 2HB GLU 110 2HB GLU 110 -14.921 6.400 -2.557 903 1HG GLU 110 1HG GLU 110 -12.869 7.077 -1.612 904 2HG GLU 110 2HG GLU 110 -12.121 5.510 -1.848 905 H ILE 111 H ILE 111 -12.540 4.641 0.265 906 HA ILE 111 HA ILE 111 -11.016 2.591 -1.034 907 HB ILE 111 HB ILE 111 -10.666 4.453 1.261 908 1HG1 ILE 111 1HG1 ILE 111 -9.016 3.710 -1.171 909 2HG1 ILE 111 2HG1 ILE 111 -9.978 5.159 -0.954 910 1HG2 ILE 111 1HG2 ILE 111 -9.358 1.771 1.022 911 2HG2 ILE 111 2HG2 ILE 111 -8.401 3.156 1.598 912 3HG2 ILE 111 3HG2 ILE 111 -9.876 2.670 2.468 913 1HD1 ILE 111 1HD1 ILE 111 -7.308 4.465 0.181 914 2HD1 ILE 111 2HD1 ILE 111 -7.977 6.053 -0.267 915 3HD1 ILE 111 3HD1 ILE 111 -8.418 5.308 1.288 916 H ARG 112 H ARG 112 -13.501 2.795 1.419 917 HA ARG 112 HA ARG 112 -12.768 0.504 2.830 918 1HB ARG 112 1HB ARG 112 -15.468 1.892 2.463 919 2HB ARG 112 2HB ARG 112 -15.214 0.577 3.593 920 1HG ARG 112 1HG ARG 112 -13.115 2.534 3.985 921 2HG ARG 112 2HG ARG 112 -14.654 3.372 3.972 922 1HD ARG 112 1HD ARG 112 -14.239 2.698 6.262 923 2HD ARG 112 2HD ARG 112 -15.525 1.672 5.657 924 HE ARG 112 HE ARG 112 -12.886 0.502 5.225 925 1HH1 ARG 112 1HH1 ARG 112 -15.468 0.920 7.579 926 2HH1 ARG 112 2HH1 ARG 112 -15.038 -0.489 8.491 927 1HH2 ARG 112 1HH2 ARG 112 -12.319 -1.356 6.427 928 2HH2 ARG 112 2HH2 ARG 112 -13.235 -1.792 7.831 929 H ASP 113 H ASP 113 -14.309 1.072 -0.270 930 HA ASP 113 HA ASP 113 -15.575 -1.490 -0.319 931 1HB ASP 113 1HB ASP 113 -15.801 0.968 -1.743 932 2HB ASP 113 2HB ASP 113 -15.266 -0.206 -2.929 933 H ALA 114 H ALA 114 -12.743 0.243 -1.756 934 HA ALA 114 HA ALA 114 -11.944 -1.887 -3.432 935 1HB ALA 114 1HB ALA 114 -9.788 -0.534 -3.482 936 2HB ALA 114 2HB ALA 114 -11.259 0.354 -3.948 937 3HB ALA 114 3HB ALA 114 -10.557 0.582 -2.328 938 H VAL 115 H VAL 115 -11.510 -1.085 -0.009 939 HA VAL 115 HA VAL 115 -9.233 -2.659 0.447 940 HB VAL 115 HB VAL 115 -11.418 -1.444 2.083 941 1HG1 VAL 115 1HG1 VAL 115 -10.135 -2.359 4.132 942 2HG1 VAL 115 2HG1 VAL 115 -11.274 -3.443 3.298 943 3HG1 VAL 115 3HG1 VAL 115 -9.523 -3.602 3.016 944 1HG2 VAL 115 1HG2 VAL 115 -9.884 0.138 2.458 945 2HG2 VAL 115 2HG2 VAL 115 -8.674 -1.063 2.967 946 3HG2 VAL 115 3HG2 VAL 115 -8.863 -0.666 1.242 947 H LYS 116 H LYS 116 -12.685 -3.383 0.064 948 HA LYS 116 HA LYS 116 -12.678 -5.889 1.305 949 1HB LYS 116 1HB LYS 116 -14.706 -4.600 0.768 950 2HB LYS 116 2HB LYS 116 -14.414 -4.827 -0.945 951 1HG LYS 116 1HG LYS 116 -14.303 -7.427 -0.180 952 2HG LYS 116 2HG LYS 116 -15.323 -6.826 1.112 953 1HD LYS 116 1HD LYS 116 -17.113 -6.776 -0.276 954 2HD LYS 116 2HD LYS 116 -16.277 -5.684 -1.362 955 1HE LYS 116 1HE LYS 116 -15.620 -7.381 -2.797 956 2HE LYS 116 2HE LYS 116 -15.407 -8.544 -1.504 957 1HZ LYS 116 1HZ LYS 116 -17.581 -9.105 -1.560 958 2HZ LYS 116 2HZ LYS 116 -18.102 -7.644 -2.070 959 3HZ LYS 116 3HZ LYS 116 -17.411 -8.679 -3.127 960 H LYS 117 H LYS 117 -12.081 -4.870 -2.116 961 HA LYS 117 HA LYS 117 -11.563 -7.562 -2.921 962 1HB LYS 117 1HB LYS 117 -11.326 -4.863 -4.257 963 2HB LYS 117 2HB LYS 117 -10.764 -6.329 -5.035 964 1HG LYS 117 1HG LYS 117 -12.886 -7.037 -5.493 965 2HG LYS 117 2HG LYS 117 -13.454 -6.665 -3.878 966 1HD LYS 117 1HD LYS 117 -14.627 -4.986 -4.890 967 2HD LYS 117 2HD LYS 117 -13.102 -4.123 -4.885 968 1HE LYS 117 1HE LYS 117 -13.045 -4.140 -7.152 969 2HE LYS 117 2HE LYS 117 -13.102 -5.891 -7.168 970 1HZ LYS 117 1HZ LYS 117 -15.586 -5.500 -6.715 971 2HZ LYS 117 2HZ LYS 117 -15.311 -4.004 -7.311 972 3HZ LYS 117 3HZ LYS 117 -15.015 -5.318 -8.235 973 H TYR 118 H TYR 118 -9.661 -4.708 -1.882 974 HA TYR 118 HA TYR 118 -7.150 -5.691 -2.627 975 1HB TYR 118 1HB TYR 118 -7.969 -3.341 -1.839 976 2HB TYR 118 2HB TYR 118 -7.993 -3.981 -0.208 977 HD1 TYR 118 HD1 TYR 118 -6.442 -1.698 -0.356 978 HD2 TYR 118 HD2 TYR 118 -5.320 -5.625 -1.630 979 HE1 TYR 118 HE1 TYR 118 -3.988 -1.094 -0.082 980 HE2 TYR 118 HE2 TYR 118 -2.870 -5.007 -1.352 981 HH TYR 118 HH TYR 118 -1.452 -3.416 -0.955 982 H LEU 119 H LEU 119 -9.034 -5.958 0.455 983 HA LEU 119 HA LEU 119 -7.498 -8.337 1.074 984 1HB LEU 119 1HB LEU 119 -6.700 -5.919 2.136 985 2HB LEU 119 2HB LEU 119 -7.730 -6.571 3.394 986 HG LEU 119 HG LEU 119 -5.131 -7.065 3.305 987 1HD1 LEU 119 1HD1 LEU 119 -5.993 -9.519 4.212 988 2HD1 LEU 119 2HD1 LEU 119 -5.923 -8.016 5.164 989 3HD1 LEU 119 3HD1 LEU 119 -7.445 -8.503 4.380 990 1HD2 LEU 119 1HD2 LEU 119 -4.450 -8.980 2.156 991 2HD2 LEU 119 2HD2 LEU 119 -6.121 -9.505 1.838 992 3HD2 LEU 119 3HD2 LEU 119 -5.449 -8.101 0.973 993 HA PRO 120 HA PRO 120 -11.456 -9.474 2.389 994 1HB PRO 120 1HB PRO 120 -10.872 -11.811 3.680 995 2HB PRO 120 2HB PRO 120 -11.036 -11.693 1.939 996 1HG PRO 120 1HG PRO 120 -8.574 -11.946 3.556 997 2HG PRO 120 2HG PRO 120 -8.800 -12.250 1.845 998 1HD PRO 120 1HD PRO 120 -7.561 -9.951 3.030 999 2HD PRO 120 2HD PRO 120 -7.891 -10.202 1.328 1000 H LEU 121 H LEU 121 -10.890 -7.360 3.772 1001 HA LEU 121 HA LEU 121 -10.774 -8.117 6.565 1002 1HB LEU 121 1HB LEU 121 -9.407 -6.293 5.942 1003 2HB LEU 121 2HB LEU 121 -10.709 -5.502 5.076 1004 HG LEU 121 HG LEU 121 -11.891 -5.186 7.277 1005 1HD1 LEU 121 1HD1 LEU 121 -11.040 -5.815 9.275 1006 2HD1 LEU 121 2HD1 LEU 121 -10.233 -7.051 8.279 1007 3HD1 LEU 121 3HD1 LEU 121 -9.352 -5.581 8.760 1008 1HD2 LEU 121 1HD2 LEU 121 -11.043 -3.135 7.240 1009 2HD2 LEU 121 2HD2 LEU 121 -9.468 -3.712 7.835 1010 3HD2 LEU 121 3HD2 LEU 121 -9.817 -3.719 6.090 1011 H LYS 122 H LYS 122 -12.395 -6.995 8.090 1012 HA LYS 122 HA LYS 122 -14.879 -7.997 7.704 1013 1HB LYS 122 1HB LYS 122 -14.120 -7.238 9.857 1014 2HB LYS 122 2HB LYS 122 -13.992 -5.582 9.301 1015 1HG LYS 122 1HG LYS 122 -16.606 -6.048 8.672 1016 2HG LYS 122 2HG LYS 122 -16.439 -7.166 10.011 1017 1HD LYS 122 1HD LYS 122 -17.044 -5.222 11.156 1018 2HD LYS 122 2HD LYS 122 -15.297 -5.109 11.240 1019 1HE LYS 122 1HE LYS 122 -15.186 -3.449 9.543 1020 2HE LYS 122 2HE LYS 122 -16.758 -3.868 8.890 1021 1HZ LYS 122 1HZ LYS 122 -17.780 -2.608 10.398 1022 2HZ LYS 122 2HZ LYS 122 -16.780 -3.008 11.626 1023 3HZ LYS 122 3HZ LYS 122 -16.338 -1.858 10.554 1024 H SER 123 H SER 123 -16.179 -7.748 5.962 1025 HA SER 123 HA SER 123 -16.064 -5.725 4.179 1026 1HB SER 123 1HB SER 123 -17.484 -8.010 4.350 1027 2HB SER 123 2HB SER 123 -18.768 -6.899 4.784 1028 HG SER 123 HG SER 123 -17.994 -5.668 2.753 1029 H ASN 124 H ASN 124 -16.808 -3.609 4.057 1030 HA ASN 124 HA ASN 124 -17.519 -2.313 6.369 1031 1HB ASN 124 1HB ASN 124 -16.563 -1.250 4.275 1032 2HB ASN 124 2HB ASN 124 -18.112 -1.465 3.484 1033 1HD2 ASN 124 1HD2 ASN 124 -18.705 0.590 3.198 1034 2HD2 ASN 124 2HD2 ASN 124 -19.005 1.741 4.458 Start of MODEL 14 1 1H MET 1 1H MET 1 -10.216 -15.977 15.128 2 HA MET 1 HA MET 1 -7.376 -16.384 14.665 3 1HB MET 1 1HB MET 1 -9.599 -16.252 12.675 4 2HB MET 1 2HB MET 1 -8.275 -15.164 12.311 5 1HG MET 1 1HG MET 1 -6.705 -17.207 12.696 6 2HG MET 1 2HG MET 1 -8.154 -18.190 12.644 7 1HE MET 1 1HE MET 1 -5.547 -17.088 9.495 8 2HE MET 1 2HE MET 1 -5.457 -17.719 11.157 9 3HE MET 1 3HE MET 1 -6.034 -18.765 9.837 10 H MET 2 H MET 2 -9.859 -13.992 13.518 11 HA MET 2 HA MET 2 -9.720 -11.790 13.466 12 1HB MET 2 1HB MET 2 -9.519 -12.595 16.397 13 2HB MET 2 2HB MET 2 -9.560 -10.893 15.981 14 1HG MET 2 1HG MET 2 -11.687 -11.419 14.603 15 2HG MET 2 2HG MET 2 -11.685 -12.995 15.369 16 1HE MET 2 1HE MET 2 -14.309 -11.384 15.934 17 2HE MET 2 2HE MET 2 -14.111 -9.901 16.899 18 3HE MET 2 3HE MET 2 -13.355 -10.025 15.293 19 H ASN 3 H ASN 3 -7.849 -11.202 12.306 20 HA ASN 3 HA ASN 3 -5.876 -9.924 13.865 21 1HB ASN 3 1HB ASN 3 -5.368 -12.654 12.895 22 2HB ASN 3 2HB ASN 3 -4.226 -11.528 12.188 23 1HD2 ASN 3 1HD2 ASN 3 -2.424 -11.404 13.264 24 2HD2 ASN 3 2HD2 ASN 3 -2.211 -11.461 14.982 25 H GLU 4 H GLU 4 -4.157 -8.916 12.261 26 HA GLU 4 HA GLU 4 -4.553 -9.021 9.537 27 1HB GLU 4 1HB GLU 4 -6.713 -7.749 10.543 28 2HB GLU 4 2HB GLU 4 -5.630 -6.373 10.464 29 1HG GLU 4 1HG GLU 4 -5.921 -6.218 8.222 30 2HG GLU 4 2HG GLU 4 -5.358 -7.863 8.002 31 H LYS 5 H LYS 5 -3.108 -7.506 8.388 32 HA LYS 5 HA LYS 5 -1.445 -5.866 10.126 33 1HB LYS 5 1HB LYS 5 -0.486 -8.239 8.532 34 2HB LYS 5 2HB LYS 5 0.579 -6.887 8.860 35 1HG LYS 5 1HG LYS 5 0.953 -7.663 10.955 36 2HG LYS 5 2HG LYS 5 -0.754 -7.529 11.327 37 1HD LYS 5 1HD LYS 5 -0.382 -9.823 11.661 38 2HD LYS 5 2HD LYS 5 -0.986 -9.803 10.015 39 1HE LYS 5 1HE LYS 5 0.911 -11.067 9.637 40 2HE LYS 5 2HE LYS 5 1.643 -9.485 9.456 41 1HZ LYS 5 1HZ LYS 5 2.986 -10.297 11.028 42 2HZ LYS 5 2HZ LYS 5 1.823 -9.800 12.061 43 3HZ LYS 5 3HZ LYS 5 1.901 -11.368 11.612 44 H ILE 6 H ILE 6 -0.378 -4.142 9.006 45 HA ILE 6 HA ILE 6 -0.742 -3.932 6.168 46 HB ILE 6 HB ILE 6 -2.644 -2.728 8.015 47 1HG1 ILE 6 1HG1 ILE 6 -2.895 -2.524 5.054 48 2HG1 ILE 6 2HG1 ILE 6 -2.797 -4.140 5.727 49 1HG2 ILE 6 1HG2 ILE 6 -2.722 -0.591 6.533 50 2HG2 ILE 6 2HG2 ILE 6 -1.583 -0.677 7.898 51 3HG2 ILE 6 3HG2 ILE 6 -1.003 -0.948 6.237 52 1HD1 ILE 6 1HD1 ILE 6 -5.132 -3.582 5.693 53 2HD1 ILE 6 2HD1 ILE 6 -4.627 -3.431 7.393 54 3HD1 ILE 6 3HD1 ILE 6 -4.830 -1.973 6.392 55 H LEU 7 H LEU 7 0.941 -2.792 5.312 56 HA LEU 7 HA LEU 7 2.602 -1.356 7.258 57 1HB LEU 7 1HB LEU 7 3.226 -3.428 5.519 58 2HB LEU 7 2HB LEU 7 3.831 -2.003 4.698 59 HG LEU 7 HG LEU 7 4.791 -1.559 7.207 60 1HD1 LEU 7 1HD1 LEU 7 3.809 -3.924 7.733 61 2HD1 LEU 7 2HD1 LEU 7 5.273 -4.504 6.904 62 3HD1 LEU 7 3HD1 LEU 7 5.417 -3.464 8.341 63 1HD2 LEU 7 1HD2 LEU 7 6.465 -3.319 5.493 64 2HD2 LEU 7 2HD2 LEU 7 5.844 -1.821 4.760 65 3HD2 LEU 7 3HD2 LEU 7 6.832 -1.745 6.238 66 H ILE 8 H ILE 8 3.296 0.759 6.817 67 HA ILE 8 HA ILE 8 1.980 1.979 4.490 68 HB ILE 8 HB ILE 8 2.330 3.019 7.297 69 1HG1 ILE 8 1HG1 ILE 8 -0.243 3.029 5.768 70 2HG1 ILE 8 2HG1 ILE 8 0.336 1.502 6.405 71 1HG2 ILE 8 1HG2 ILE 8 2.380 5.115 6.580 72 2HG2 ILE 8 2HG2 ILE 8 2.509 4.524 4.906 73 3HG2 ILE 8 3HG2 ILE 8 0.909 4.852 5.613 74 1HD1 ILE 8 1HD1 ILE 8 -1.027 2.426 8.138 75 2HD1 ILE 8 2HD1 ILE 8 0.647 2.720 8.665 76 3HD1 ILE 8 3HD1 ILE 8 -0.306 4.042 7.950 77 H VAL 9 H VAL 9 3.554 2.245 2.983 78 HA VAL 9 HA VAL 9 6.180 3.109 3.951 79 HB VAL 9 HB VAL 9 5.354 1.978 1.271 80 1HG1 VAL 9 1HG1 VAL 9 7.744 1.703 0.868 81 2HG1 VAL 9 2HG1 VAL 9 7.369 3.410 1.205 82 3HG1 VAL 9 3HG1 VAL 9 8.116 2.398 2.464 83 1HG2 VAL 9 1HG2 VAL 9 5.035 0.310 3.021 84 2HG2 VAL 9 2HG2 VAL 9 6.453 -0.104 2.027 85 3HG2 VAL 9 3HG2 VAL 9 6.676 0.614 3.641 86 H ASP 10 H ASP 10 6.903 5.153 3.556 87 HA ASP 10 HA ASP 10 6.731 7.277 3.079 88 1HB ASP 10 1HB ASP 10 7.310 5.916 0.797 89 2HB ASP 10 2HB ASP 10 5.825 6.686 0.273 90 H ASP 11 H ASP 11 5.150 8.766 1.177 91 HA ASP 11 HA ASP 11 3.201 9.661 0.862 92 1HB ASP 11 1HB ASP 11 2.475 7.417 0.072 93 2HB ASP 11 2HB ASP 11 2.088 6.947 1.715 94 H GLN 12 H GLN 12 4.499 8.956 3.738 95 HA GLN 12 HA GLN 12 2.266 9.209 5.464 96 1HB GLN 12 1HB GLN 12 4.172 9.576 7.198 97 2HB GLN 12 2HB GLN 12 4.066 8.016 6.406 98 1HG GLN 12 1HG GLN 12 5.971 8.375 5.110 99 2HG GLN 12 2HG GLN 12 5.735 10.110 5.042 100 1HE2 GLN 12 1HE2 GLN 12 5.714 11.123 7.369 101 2HE2 GLN 12 2HE2 GLN 12 7.072 10.716 8.364 102 H TYR 13 H TYR 13 1.152 11.088 5.751 103 HA TYR 13 HA TYR 13 2.589 13.503 6.305 104 1HB TYR 13 1HB TYR 13 1.791 12.802 3.623 105 2HB TYR 13 2HB TYR 13 0.601 13.968 4.168 106 HD1 TYR 13 HD1 TYR 13 3.927 13.502 2.891 107 HD2 TYR 13 HD2 TYR 13 1.435 16.232 5.045 108 HE1 TYR 13 HE1 TYR 13 5.530 15.401 2.354 109 HE2 TYR 13 HE2 TYR 13 3.047 18.122 4.501 110 HH TYR 13 HH TYR 13 5.960 17.849 3.776 111 H GLY 14 H GLY 14 0.618 11.611 7.559 112 1HA GLY 14 1HA GLY 14 -0.890 12.389 9.228 113 2HA GLY 14 2HA GLY 14 -1.467 13.620 8.123 114 H ILE 15 H ILE 15 -1.064 11.090 6.069 115 HA ILE 15 HA ILE 15 -3.865 10.359 6.304 116 HB ILE 15 HB ILE 15 -1.781 10.179 4.156 117 1HG1 ILE 15 1HG1 ILE 15 -4.042 11.172 3.028 118 2HG1 ILE 15 2HG1 ILE 15 -4.267 11.712 4.680 119 1HG2 ILE 15 1HG2 ILE 15 -2.606 8.228 3.463 120 2HG2 ILE 15 2HG2 ILE 15 -3.979 8.308 4.594 121 3HG2 ILE 15 3HG2 ILE 15 -4.074 9.131 3.018 122 1HD1 ILE 15 1HD1 ILE 15 -3.025 13.469 3.692 123 2HD1 ILE 15 2HD1 ILE 15 -1.781 12.523 4.544 124 3HD1 ILE 15 3HD1 ILE 15 -1.985 12.346 2.784 125 H ARG 16 H ARG 16 -0.564 8.939 6.419 126 HA ARG 16 HA ARG 16 -1.197 6.324 6.405 127 1HB ARG 16 1HB ARG 16 0.842 6.101 8.019 128 2HB ARG 16 2HB ARG 16 1.116 6.880 6.473 129 1HG ARG 16 1HG ARG 16 1.066 9.086 7.456 130 2HG ARG 16 2HG ARG 16 0.395 8.484 8.960 131 1HD ARG 16 1HD ARG 16 3.056 7.377 8.051 132 2HD ARG 16 2HD ARG 16 3.021 9.002 8.707 133 HE ARG 16 HE ARG 16 1.590 7.023 10.345 134 1HH1 ARG 16 1HH1 ARG 16 4.673 8.603 9.725 135 2HH1 ARG 16 2HH1 ARG 16 5.305 8.272 11.303 136 1HH2 ARG 16 1HH2 ARG 16 2.424 6.586 12.427 137 2HH2 ARG 16 2HH2 ARG 16 4.018 7.117 12.850 138 H ILE 17 H ILE 17 -1.494 8.698 9.082 139 HA ILE 17 HA ILE 17 -2.036 6.791 11.092 140 HB ILE 17 HB ILE 17 -2.623 9.746 10.891 141 1HG1 ILE 17 1HG1 ILE 17 -0.460 8.535 12.578 142 2HG1 ILE 17 2HG1 ILE 17 -0.188 8.709 10.856 143 1HG2 ILE 17 1HG2 ILE 17 -3.398 9.789 13.021 144 2HG2 ILE 17 2HG2 ILE 17 -3.921 8.142 12.595 145 3HG2 ILE 17 3HG2 ILE 17 -2.426 8.387 13.529 146 1HD1 ILE 17 1HD1 ILE 17 0.001 10.981 10.989 147 2HD1 ILE 17 2HD1 ILE 17 -1.382 11.120 12.101 148 3HD1 ILE 17 3HD1 ILE 17 0.229 10.700 12.732 149 H LEU 18 H LEU 18 -4.117 8.855 8.967 150 HA LEU 18 HA LEU 18 -6.557 8.291 9.965 151 1HB LEU 18 1HB LEU 18 -5.769 9.685 7.927 152 2HB LEU 18 2HB LEU 18 -6.060 8.224 7.005 153 HG LEU 18 HG LEU 18 -8.398 8.529 8.487 154 1HD1 LEU 18 1HD1 LEU 18 -8.926 10.987 7.618 155 2HD1 LEU 18 2HD1 LEU 18 -8.247 10.674 9.234 156 3HD1 LEU 18 3HD1 LEU 18 -7.180 11.187 7.905 157 1HD2 LEU 18 1HD2 LEU 18 -9.340 9.285 6.250 158 2HD2 LEU 18 2HD2 LEU 18 -7.672 9.204 5.634 159 3HD2 LEU 18 3HD2 LEU 18 -8.459 7.739 6.268 160 H LEU 19 H LEU 19 -4.759 6.255 7.552 161 HA LEU 19 HA LEU 19 -6.714 4.186 7.737 162 1HB LEU 19 1HB LEU 19 -4.917 2.938 6.412 163 2HB LEU 19 2HB LEU 19 -5.723 4.306 5.671 164 HG LEU 19 HG LEU 19 -3.282 5.101 7.067 165 1HD1 LEU 19 1HD1 LEU 19 -2.106 3.231 6.572 166 2HD1 LEU 19 2HD1 LEU 19 -3.183 2.767 5.233 167 3HD1 LEU 19 3HD1 LEU 19 -1.959 4.036 4.991 168 1HD2 LEU 19 1HD2 LEU 19 -3.923 5.353 4.129 169 2HD2 LEU 19 2HD2 LEU 19 -4.683 6.384 5.365 170 3HD2 LEU 19 3HD2 LEU 19 -2.916 6.408 5.149 171 H ASN 20 H ASN 20 -3.833 5.140 9.501 172 HA ASN 20 HA ASN 20 -3.051 2.678 10.441 173 1HB ASN 20 1HB ASN 20 -1.834 4.903 10.724 174 2HB ASN 20 2HB ASN 20 -2.999 5.340 11.958 175 1HD2 ASN 20 1HD2 ASN 20 -0.780 5.494 13.024 176 2HD2 ASN 20 2HD2 ASN 20 -0.245 4.114 13.924 177 H GLU 21 H GLU 21 -5.245 5.204 11.892 178 HA GLU 21 HA GLU 21 -5.903 3.782 14.148 179 1HB GLU 21 1HB GLU 21 -6.362 6.206 13.775 180 2HB GLU 21 2HB GLU 21 -7.607 5.794 12.613 181 1HG GLU 21 1HG GLU 21 -9.011 4.805 14.288 182 2HG GLU 21 2HG GLU 21 -7.699 4.689 15.444 183 H VAL 22 H VAL 22 -7.191 3.646 10.816 184 HA VAL 22 HA VAL 22 -9.545 2.282 11.307 185 HB VAL 22 HB VAL 22 -7.629 2.497 9.017 186 1HG1 VAL 22 1HG1 VAL 22 -9.613 1.259 7.747 187 2HG1 VAL 22 2HG1 VAL 22 -8.254 0.360 8.463 188 3HG1 VAL 22 3HG1 VAL 22 -9.805 0.467 9.330 189 1HG2 VAL 22 1HG2 VAL 22 -10.575 3.144 9.036 190 2HG2 VAL 22 2HG2 VAL 22 -9.384 4.259 9.750 191 3HG2 VAL 22 3HG2 VAL 22 -9.277 3.826 8.027 192 H PHE 23 H PHE 23 -6.193 1.030 10.737 193 HA PHE 23 HA PHE 23 -7.092 -1.662 11.205 194 1HB PHE 23 1HB PHE 23 -4.209 -0.669 11.164 195 2HB PHE 23 2HB PHE 23 -4.835 -2.175 10.522 196 HD1 PHE 23 HD1 PHE 23 -6.937 -1.452 8.729 197 HD2 PHE 23 HD2 PHE 23 -3.290 0.587 9.470 198 HE1 PHE 23 HE1 PHE 23 -7.041 -0.433 6.438 199 HE2 PHE 23 HE2 PHE 23 -3.394 1.606 7.178 200 HZ PHE 23 HZ PHE 23 -5.269 1.084 5.690 201 H ASN 24 H ASN 24 -4.844 0.702 12.810 202 HA ASN 24 HA ASN 24 -4.128 -0.858 14.905 203 1HB ASN 24 1HB ASN 24 -3.630 1.722 14.166 204 2HB ASN 24 2HB ASN 24 -4.740 2.038 15.485 205 1HD2 ASN 24 1HD2 ASN 24 -4.140 1.737 17.554 206 2HD2 ASN 24 2HD2 ASN 24 -2.560 1.256 18.075 207 H LYS 25 H LYS 25 -7.229 0.558 14.117 208 HA LYS 25 HA LYS 25 -8.395 1.093 16.509 209 1HB LYS 25 1HB LYS 25 -9.229 0.544 13.824 210 2HB LYS 25 2HB LYS 25 -10.293 -0.322 14.914 211 1HG LYS 25 1HG LYS 25 -10.801 1.724 16.159 212 2HG LYS 25 2HG LYS 25 -9.578 2.622 15.283 213 1HD LYS 25 1HD LYS 25 -11.189 3.202 13.794 214 2HD LYS 25 2HD LYS 25 -11.191 1.538 13.244 215 1HE LYS 25 1HE LYS 25 -12.750 1.383 15.547 216 2HE LYS 25 2HE LYS 25 -13.171 2.969 14.932 217 1HZ LYS 25 1HZ LYS 25 -14.525 1.183 14.012 218 2HZ LYS 25 2HZ LYS 25 -13.722 1.994 12.844 219 3HZ LYS 25 3HZ LYS 25 -13.208 0.517 13.313 220 H GLU 26 H GLU 26 -7.312 -2.014 15.245 221 HA GLU 26 HA GLU 26 -8.596 -3.281 17.537 222 1HB GLU 26 1HB GLU 26 -9.278 -4.879 16.101 223 2HB GLU 26 2HB GLU 26 -8.525 -4.016 14.775 224 1HG GLU 26 1HG GLU 26 -6.477 -5.229 14.980 225 2HG GLU 26 2HG GLU 26 -6.848 -5.764 16.607 226 H GLY 27 H GLY 27 -5.588 -2.411 15.963 227 1HA GLY 27 1HA GLY 27 -3.600 -2.314 17.236 228 2HA GLY 27 2HA GLY 27 -4.111 -3.719 18.150 229 H TYR 28 H TYR 28 -4.418 -3.422 14.586 230 HA TYR 28 HA TYR 28 -3.189 -5.904 14.149 231 1HB TYR 28 1HB TYR 28 -3.862 -3.398 12.502 232 2HB TYR 28 2HB TYR 28 -3.173 -4.812 11.730 233 HD1 TYR 28 HD1 TYR 28 -4.604 -6.996 13.204 234 HD2 TYR 28 HD2 TYR 28 -6.034 -3.290 11.614 235 HE1 TYR 28 HE1 TYR 28 -6.931 -7.990 12.960 236 HE2 TYR 28 HE2 TYR 28 -8.356 -4.297 11.375 237 HH TYR 28 HH TYR 28 -9.664 -6.028 12.250 238 H GLN 29 H GLN 29 -1.165 -6.436 13.146 239 HA GLN 29 HA GLN 29 0.938 -4.821 14.093 240 1HB GLN 29 1HB GLN 29 0.597 -7.477 12.881 241 2HB GLN 29 2HB GLN 29 2.043 -6.678 12.295 242 1HG GLN 29 1HG GLN 29 2.997 -6.511 14.455 243 2HG GLN 29 2HG GLN 29 1.448 -6.646 15.263 244 1HE2 GLN 29 1HE2 GLN 29 3.863 -8.377 13.368 245 2HE2 GLN 29 2HE2 GLN 29 3.513 -9.973 13.941 246 H THR 30 H THR 30 1.201 -2.821 13.129 247 HA THR 30 HA THR 30 1.541 -2.854 10.203 248 HB THR 30 HB THR 30 0.478 -0.599 10.208 249 HG1 THR 30 HG1 THR 30 0.015 -1.279 13.022 250 1HG2 THR 30 1HG2 THR 30 -1.334 -2.291 11.964 251 2HG2 THR 30 2HG2 THR 30 -1.772 -1.247 10.590 252 3HG2 THR 30 3HG2 THR 30 -0.982 -2.816 10.300 253 H PHE 31 H PHE 31 3.103 -1.383 9.329 254 HA PHE 31 HA PHE 31 4.865 -0.155 11.287 255 1HB PHE 31 1HB PHE 31 5.336 -2.700 10.190 256 2HB PHE 31 2HB PHE 31 6.180 -1.666 9.055 257 HD1 PHE 31 HD1 PHE 31 7.944 -0.072 9.969 258 HD2 PHE 31 HD2 PHE 31 6.298 -3.239 12.264 259 HE1 PHE 31 HE1 PHE 31 9.907 0.039 11.530 260 HE2 PHE 31 HE2 PHE 31 8.261 -3.128 13.825 261 HZ PHE 31 HZ PHE 31 10.042 -1.491 13.439 262 H GLN 32 H GLN 32 6.544 1.263 10.177 263 HA GLN 32 HA GLN 32 5.441 2.206 7.645 264 1HB GLN 32 1HB GLN 32 6.028 3.635 10.157 265 2HB GLN 32 2HB GLN 32 6.786 4.388 8.768 266 1HG GLN 32 1HG GLN 32 4.075 3.604 8.064 267 2HG GLN 32 2HG GLN 32 4.037 4.529 9.552 268 1HE2 GLN 32 1HE2 GLN 32 4.435 4.575 6.174 269 2HE2 GLN 32 2HE2 GLN 32 4.774 6.258 5.947 270 H ALA 33 H ALA 33 7.035 3.206 6.146 271 HA ALA 33 HA ALA 33 9.810 2.536 6.750 272 1HB ALA 33 1HB ALA 33 10.034 1.459 4.519 273 2HB ALA 33 2HB ALA 33 8.916 0.574 5.584 274 3HB ALA 33 3HB ALA 33 8.276 1.612 4.287 275 H ALA 34 H ALA 34 11.280 3.522 4.974 276 HA ALA 34 HA ALA 34 10.032 5.985 3.967 277 1HB ALA 34 1HB ALA 34 12.274 5.593 5.840 278 2HB ALA 34 2HB ALA 34 12.675 6.646 4.461 279 3HB ALA 34 3HB ALA 34 11.297 7.045 5.515 280 H ASN 35 H ASN 35 10.138 3.638 2.446 281 HA ASN 35 HA ASN 35 11.248 4.457 0.158 282 1HB ASN 35 1HB ASN 35 13.317 3.383 1.954 283 2HB ASN 35 2HB ASN 35 13.222 2.431 0.485 284 1HD2 ASN 35 1HD2 ASN 35 15.476 3.529 0.597 285 2HD2 ASN 35 2HD2 ASN 35 15.657 4.981 -0.330 286 H GLY 36 H GLY 36 11.997 2.151 -1.196 287 1HA GLY 36 1HA GLY 36 9.665 0.436 -0.830 288 2HA GLY 36 2HA GLY 36 10.747 0.492 -2.207 289 H LEU 37 H LEU 37 13.276 0.320 -0.781 290 HA LEU 37 HA LEU 37 13.448 -2.469 -0.539 291 1HB LEU 37 1HB LEU 37 15.178 -0.304 -0.824 292 2HB LEU 37 2HB LEU 37 15.607 -0.997 0.728 293 HG LEU 37 HG LEU 37 15.362 -2.712 -1.743 294 1HD1 LEU 37 1HD1 LEU 37 17.101 -1.682 -2.664 295 2HD1 LEU 37 2HD1 LEU 37 17.346 -0.663 -1.225 296 3HD1 LEU 37 3HD1 LEU 37 18.087 -2.279 -1.308 297 1HD2 LEU 37 1HD2 LEU 37 15.840 -3.256 0.984 298 2HD2 LEU 37 2HD2 LEU 37 15.940 -4.376 -0.396 299 3HD2 LEU 37 3HD2 LEU 37 17.390 -3.494 0.140 300 H GLN 38 H GLN 38 13.683 0.165 1.955 301 HA GLN 38 HA GLN 38 13.932 -1.459 4.114 302 1HB GLN 38 1HB GLN 38 12.954 1.313 3.622 303 2HB GLN 38 2HB GLN 38 12.440 0.608 5.142 304 1HG GLN 38 1HG GLN 38 14.619 0.441 5.974 305 2HG GLN 38 2HG GLN 38 15.334 0.275 4.382 306 1HE2 GLN 38 1HE2 GLN 38 15.259 2.206 6.926 307 2HE2 GLN 38 2HE2 GLN 38 15.460 3.775 6.220 308 H ALA 39 H ALA 39 11.122 -0.891 2.076 309 HA ALA 39 HA ALA 39 9.271 -1.910 4.046 310 1HB ALA 39 1HB ALA 39 8.351 -0.226 2.689 311 2HB ALA 39 2HB ALA 39 9.105 -0.870 1.211 312 3HB ALA 39 3HB ALA 39 7.729 -1.722 1.952 313 H LEU 40 H LEU 40 11.273 -3.039 1.356 314 HA LEU 40 HA LEU 40 9.844 -5.383 0.790 315 1HB LEU 40 1HB LEU 40 12.601 -4.356 0.297 316 2HB LEU 40 2HB LEU 40 12.293 -6.064 0.050 317 HG LEU 40 HG LEU 40 11.023 -3.722 -1.376 318 1HD1 LEU 40 1HD1 LEU 40 11.962 -4.712 -3.368 319 2HD1 LEU 40 2HD1 LEU 40 13.244 -4.498 -2.151 320 3HD1 LEU 40 3HD1 LEU 40 12.552 -6.112 -2.440 321 1HD2 LEU 40 1HD2 LEU 40 9.963 -5.884 -2.634 322 2HD2 LEU 40 2HD2 LEU 40 9.950 -6.437 -0.942 323 3HD2 LEU 40 3HD2 LEU 40 9.125 -4.925 -1.390 324 H ASP 41 H ASP 41 12.386 -4.560 3.193 325 HA ASP 41 HA ASP 41 12.695 -7.228 4.022 326 1HB ASP 41 1HB ASP 41 14.422 -5.470 4.369 327 2HB ASP 41 2HB ASP 41 13.333 -4.589 5.422 328 H ILE 42 H ILE 42 11.088 -4.268 5.418 329 HA ILE 42 HA ILE 42 9.995 -5.564 7.638 330 HB ILE 42 HB ILE 42 9.323 -3.026 6.167 331 1HG1 ILE 42 1HG1 ILE 42 11.396 -3.689 7.888 332 2HG1 ILE 42 2HG1 ILE 42 10.874 -2.074 7.450 333 1HG2 ILE 42 1HG2 ILE 42 7.819 -2.408 7.950 334 2HG2 ILE 42 2HG2 ILE 42 7.269 -3.933 7.215 335 3HG2 ILE 42 3HG2 ILE 42 8.109 -3.954 8.784 336 1HD1 ILE 42 1HD1 ILE 42 9.847 -3.698 9.823 337 2HD1 ILE 42 2HD1 ILE 42 10.944 -2.299 9.900 338 3HD1 ILE 42 3HD1 ILE 42 9.260 -2.081 9.365 339 H VAL 43 H VAL 43 9.133 -5.547 4.239 340 HA VAL 43 HA VAL 43 6.424 -6.011 4.363 341 HB VAL 43 HB VAL 43 8.618 -6.352 2.492 342 1HG1 VAL 43 1HG1 VAL 43 6.393 -8.404 2.475 343 2HG1 VAL 43 2HG1 VAL 43 7.298 -7.959 1.008 344 3HG1 VAL 43 3HG1 VAL 43 8.151 -8.671 2.399 345 1HG2 VAL 43 1HG2 VAL 43 7.073 -5.428 0.939 346 2HG2 VAL 43 2HG2 VAL 43 5.674 -5.927 1.919 347 3HG2 VAL 43 3HG2 VAL 43 6.748 -4.631 2.496 348 H THR 44 H THR 44 9.108 -8.467 4.333 349 HA THR 44 HA THR 44 7.259 -10.561 5.005 350 HB THR 44 HB THR 44 10.320 -10.477 4.874 351 HG1 THR 44 HG1 THR 44 9.697 -10.186 2.759 352 1HG2 THR 44 1HG2 THR 44 9.207 -12.531 5.989 353 2HG2 THR 44 2HG2 THR 44 8.412 -12.822 4.423 354 3HG2 THR 44 3HG2 THR 44 10.187 -12.874 4.543 355 H LYS 45 H LYS 45 9.569 -8.454 6.729 356 HA LYS 45 HA LYS 45 9.686 -9.902 9.092 357 1HB LYS 45 1HB LYS 45 10.646 -7.451 8.094 358 2HB LYS 45 2HB LYS 45 9.740 -7.037 9.535 359 1HG LYS 45 1HG LYS 45 11.146 -9.346 10.301 360 2HG LYS 45 2HG LYS 45 12.293 -8.496 9.284 361 1HD LYS 45 1HD LYS 45 11.299 -6.410 10.798 362 2HD LYS 45 2HD LYS 45 11.188 -7.730 11.945 363 1HE LYS 45 1HE LYS 45 13.686 -6.787 10.468 364 2HE LYS 45 2HE LYS 45 13.382 -6.696 12.192 365 1HZ LYS 45 1HZ LYS 45 14.641 -8.705 10.959 366 2HZ LYS 45 2HZ LYS 45 13.969 -8.806 12.444 367 3HZ LYS 45 3HZ LYS 45 13.144 -9.333 11.137 368 H GLU 46 H GLU 46 7.278 -7.533 7.861 369 HA GLU 46 HA GLU 46 5.743 -8.021 10.281 370 1HB GLU 46 1HB GLU 46 5.916 -5.768 8.313 371 2HB GLU 46 2HB GLU 46 4.340 -6.066 9.018 372 1HG GLU 46 1HG GLU 46 6.668 -6.051 10.915 373 2HG GLU 46 2HG GLU 46 6.229 -4.508 10.210 374 H ARG 47 H ARG 47 6.117 -9.225 7.174 375 HA ARG 47 HA ARG 47 4.672 -9.938 5.614 376 1HB ARG 47 1HB ARG 47 3.599 -12.077 6.488 377 2HB ARG 47 2HB ARG 47 5.301 -11.917 6.875 378 1HG ARG 47 1HG ARG 47 4.864 -11.984 9.100 379 2HG ARG 47 2HG ARG 47 3.744 -10.643 8.969 380 1HD ARG 47 1HD ARG 47 2.455 -12.494 9.811 381 2HD ARG 47 2HD ARG 47 1.986 -12.313 8.132 382 HE ARG 47 HE ARG 47 4.207 -14.139 8.321 383 1HH1 ARG 47 1HH1 ARG 47 0.754 -13.936 8.968 384 2HH1 ARG 47 2HH1 ARG 47 0.489 -15.637 8.780 385 1HH2 ARG 47 1HH2 ARG 47 3.858 -16.384 8.074 386 2HH2 ARG 47 2HH2 ARG 47 2.266 -17.039 8.268 387 HA PRO 48 HA PRO 48 0.872 -7.843 7.141 388 1HB PRO 48 1HB PRO 48 0.890 -5.662 5.495 389 2HB PRO 48 2HB PRO 48 1.526 -5.636 7.127 390 1HG PRO 48 1HG PRO 48 2.999 -5.696 4.565 391 2HG PRO 48 2HG PRO 48 3.582 -5.247 6.155 392 1HD PRO 48 1HD PRO 48 4.071 -7.718 4.783 393 2HD PRO 48 2HD PRO 48 4.554 -7.314 6.418 394 H ASP 49 H ASP 49 -1.243 -7.637 6.184 395 HA ASP 49 HA ASP 49 -1.333 -9.406 3.936 396 1HB ASP 49 1HB ASP 49 -2.968 -8.996 6.118 397 2HB ASP 49 2HB ASP 49 -3.827 -8.074 4.901 398 H LEU 50 H LEU 50 -0.825 -6.126 4.371 399 HA LEU 50 HA LEU 50 -1.468 -5.502 1.687 400 1HB LEU 50 1HB LEU 50 -3.671 -5.364 3.194 401 2HB LEU 50 2HB LEU 50 -3.017 -3.777 3.548 402 HG LEU 50 HG LEU 50 -4.702 -3.965 1.643 403 1HD1 LEU 50 1HD1 LEU 50 -2.016 -2.626 1.274 404 2HD1 LEU 50 2HD1 LEU 50 -3.409 -2.344 0.202 405 3HD1 LEU 50 3HD1 LEU 50 -3.517 -1.930 1.930 406 1HD2 LEU 50 1HD2 LEU 50 -4.188 -4.921 -0.372 407 2HD2 LEU 50 2HD2 LEU 50 -2.431 -4.759 -0.133 408 3HD2 LEU 50 3HD2 LEU 50 -3.333 -6.027 0.730 409 H VAL 51 H VAL 51 -0.299 -3.693 0.996 410 HA VAL 51 HA VAL 51 1.035 -2.156 3.095 411 HB VAL 51 HB VAL 51 2.445 -3.391 0.722 412 1HG1 VAL 51 1HG1 VAL 51 4.336 -2.649 2.607 413 2HG1 VAL 51 2HG1 VAL 51 3.923 -1.753 1.125 414 3HG1 VAL 51 3HG1 VAL 51 3.153 -1.320 2.671 415 1HG2 VAL 51 1HG2 VAL 51 1.917 -4.419 3.440 416 2HG2 VAL 51 2HG2 VAL 51 2.369 -5.282 1.950 417 3HG2 VAL 51 3HG2 VAL 51 3.622 -4.488 2.934 418 H LEU 52 H LEU 52 1.524 0.003 2.496 419 HA LEU 52 HA LEU 52 0.377 0.777 -0.097 420 1HB LEU 52 1HB LEU 52 -1.156 1.707 1.267 421 2HB LEU 52 2HB LEU 52 -0.072 1.785 2.641 422 HG LEU 52 HG LEU 52 0.596 3.627 0.423 423 1HD1 LEU 52 1HD1 LEU 52 -1.342 5.098 1.738 424 2HD1 LEU 52 2HD1 LEU 52 -1.466 4.408 0.102 425 3HD1 LEU 52 3HD1 LEU 52 -2.117 3.514 1.497 426 1HD2 LEU 52 1HD2 LEU 52 0.636 5.186 2.521 427 2HD2 LEU 52 2HD2 LEU 52 0.574 3.653 3.423 428 3HD2 LEU 52 3HD2 LEU 52 1.909 3.964 2.288 429 H LEU 53 H LEU 53 1.904 1.460 -1.490 430 HA LEU 53 HA LEU 53 4.185 2.901 -0.334 431 1HB LEU 53 1HB LEU 53 4.906 0.668 -0.879 432 2HB LEU 53 2HB LEU 53 4.213 0.784 -2.485 433 HG LEU 53 HG LEU 53 6.728 1.028 -2.304 434 1HD1 LEU 53 1HD1 LEU 53 6.862 2.538 -4.115 435 2HD1 LEU 53 2HD1 LEU 53 5.268 1.757 -4.247 436 3HD1 LEU 53 3HD1 LEU 53 5.398 3.411 -3.601 437 1HD2 LEU 53 1HD2 LEU 53 7.713 2.642 -1.121 438 2HD2 LEU 53 2HD2 LEU 53 6.587 3.887 -1.714 439 3HD2 LEU 53 3HD2 LEU 53 6.134 2.864 -0.329 440 H ASP 54 H ASP 54 4.820 4.765 -1.416 441 HA ASP 54 HA ASP 54 2.929 5.602 -3.435 442 1HB ASP 54 1HB ASP 54 3.112 7.312 -1.851 443 2HB ASP 54 2HB ASP 54 4.794 6.960 -1.508 444 H MET 55 H MET 55 3.617 6.121 -5.580 445 HA MET 55 HA MET 55 5.890 4.886 -6.518 446 1HB MET 55 1HB MET 55 4.412 7.263 -7.775 447 2HB MET 55 2HB MET 55 5.339 6.053 -8.639 448 1HG MET 55 1HG MET 55 2.677 5.699 -7.207 449 2HG MET 55 2HG MET 55 3.043 5.398 -8.895 450 1HE MET 55 1HE MET 55 4.239 3.630 -5.145 451 2HE MET 55 2HE MET 55 2.713 4.444 -5.564 452 3HE MET 55 3HE MET 55 2.810 2.667 -5.589 453 H LYS 56 H LYS 56 5.270 8.478 -6.459 454 HA LYS 56 HA LYS 56 7.915 9.161 -6.976 455 1HB LYS 56 1HB LYS 56 5.652 10.519 -7.029 456 2HB LYS 56 2HB LYS 56 6.103 10.956 -5.394 457 1HG LYS 56 1HG LYS 56 8.483 11.446 -6.528 458 2HG LYS 56 2HG LYS 56 7.521 11.585 -7.986 459 1HD LYS 56 1HD LYS 56 6.415 13.498 -7.255 460 2HD LYS 56 2HD LYS 56 6.487 13.032 -5.568 461 1HE LYS 56 1HE LYS 56 8.995 13.486 -5.620 462 2HE LYS 56 2HE LYS 56 8.802 14.103 -7.249 463 1HZ LYS 56 1HZ LYS 56 7.497 15.160 -4.838 464 2HZ LYS 56 2HZ LYS 56 8.688 15.879 -5.693 465 3HZ LYS 56 3HZ LYS 56 7.205 15.699 -6.352 466 H ILE 57 H ILE 57 9.701 8.799 -5.787 467 HA ILE 57 HA ILE 57 9.545 9.272 -2.931 468 HB ILE 57 HB ILE 57 9.491 6.647 -4.046 469 1HG1 ILE 57 1HG1 ILE 57 9.798 7.558 -1.170 470 2HG1 ILE 57 2HG1 ILE 57 8.280 7.521 -2.046 471 1HG2 ILE 57 1HG2 ILE 57 11.981 6.938 -4.127 472 2HG2 ILE 57 2HG2 ILE 57 11.956 7.129 -2.357 473 3HG2 ILE 57 3HG2 ILE 57 11.414 5.603 -3.095 474 1HD1 ILE 57 1HD1 ILE 57 8.546 5.470 -0.697 475 2HD1 ILE 57 2HD1 ILE 57 8.555 5.069 -2.431 476 3HD1 ILE 57 3HD1 ILE 57 10.083 5.113 -1.521 477 HA PRO 58 HA PRO 58 13.473 10.865 -3.737 478 1HB PRO 58 1HB PRO 58 14.633 10.806 -1.263 479 2HB PRO 58 2HB PRO 58 13.491 12.041 -1.757 480 1HG PRO 58 1HG PRO 58 13.066 9.740 0.051 481 2HG PRO 58 2HG PRO 58 12.103 11.194 -0.121 482 1HD PRO 58 1HD PRO 58 11.482 8.591 -1.153 483 2HD PRO 58 2HD PRO 58 10.578 10.068 -1.423 484 H GLY 59 H GLY 59 15.162 10.147 -4.865 485 1HA GLY 59 1HA GLY 59 16.937 8.841 -5.355 486 2HA GLY 59 2HA GLY 59 16.853 8.143 -3.750 487 H MET 60 H MET 60 16.277 7.632 -7.106 488 HA MET 60 HA MET 60 15.406 6.016 -8.277 489 1HB MET 60 1HB MET 60 16.983 4.855 -6.325 490 2HB MET 60 2HB MET 60 15.469 4.026 -6.023 491 1HG MET 60 1HG MET 60 15.482 3.712 -8.688 492 2HG MET 60 2HG MET 60 17.206 3.962 -8.496 493 1HE MET 60 1HE MET 60 14.495 0.700 -7.063 494 2HE MET 60 2HE MET 60 14.904 1.707 -5.654 495 3HE MET 60 3HE MET 60 14.178 2.451 -7.099 496 H ASP 61 H ASP 61 13.257 6.575 -8.661 497 HA ASP 61 HA ASP 61 11.274 6.641 -6.812 498 1HB ASP 61 1HB ASP 61 9.858 5.936 -9.025 499 2HB ASP 61 2HB ASP 61 10.513 7.543 -8.782 500 H GLY 62 H GLY 62 9.143 5.036 -7.295 501 1HA GLY 62 1HA GLY 62 10.056 2.410 -6.457 502 2HA GLY 62 2HA GLY 62 8.414 3.022 -6.474 503 H ILE 63 H ILE 63 9.532 3.961 -9.440 504 HA ILE 63 HA ILE 63 7.976 2.332 -10.930 505 HB ILE 63 HB ILE 63 10.414 3.951 -11.461 506 1HG1 ILE 63 1HG1 ILE 63 7.912 4.704 -11.274 507 2HG1 ILE 63 2HG1 ILE 63 8.964 5.401 -12.490 508 1HG2 ILE 63 1HG2 ILE 63 11.080 2.499 -13.055 509 2HG2 ILE 63 2HG2 ILE 63 9.484 1.721 -13.176 510 3HG2 ILE 63 3HG2 ILE 63 9.781 3.274 -13.993 511 1HD1 ILE 63 1HD1 ILE 63 7.471 2.898 -13.237 512 2HD1 ILE 63 2HD1 ILE 63 6.547 4.414 -13.118 513 3HD1 ILE 63 3HD1 ILE 63 7.919 4.294 -14.245 514 H GLU 64 H GLU 64 11.361 1.738 -9.851 515 HA GLU 64 HA GLU 64 11.325 -0.794 -11.210 516 1HB GLU 64 1HB GLU 64 13.474 0.409 -9.412 517 2HB GLU 64 2HB GLU 64 13.667 -0.975 -10.470 518 1HG GLU 64 1HG GLU 64 12.928 1.830 -11.430 519 2HG GLU 64 2HG GLU 64 14.555 1.180 -11.447 520 H ILE 65 H ILE 65 11.542 0.502 -7.831 521 HA ILE 65 HA ILE 65 11.770 -1.826 -6.452 522 HB ILE 65 HB ILE 65 10.084 0.572 -5.722 523 1HG1 ILE 65 1HG1 ILE 65 13.050 0.057 -5.615 524 2HG1 ILE 65 2HG1 ILE 65 12.193 1.445 -6.254 525 1HG2 ILE 65 1HG2 ILE 65 9.752 -0.324 -3.716 526 2HG2 ILE 65 2HG2 ILE 65 10.343 -1.863 -4.388 527 3HG2 ILE 65 3HG2 ILE 65 11.468 -0.767 -3.550 528 1HD1 ILE 65 1HD1 ILE 65 12.777 0.729 -3.383 529 2HD1 ILE 65 2HD1 ILE 65 12.932 2.297 -4.210 530 3HD1 ILE 65 3HD1 ILE 65 11.324 1.691 -3.745 531 H LEU 66 H LEU 66 8.594 -0.205 -7.181 532 HA LEU 66 HA LEU 66 7.020 -2.312 -6.370 533 1HB LEU 66 1HB LEU 66 6.615 -0.097 -8.365 534 2HB LEU 66 2HB LEU 66 5.359 -1.271 -8.028 535 HG LEU 66 HG LEU 66 4.725 0.344 -6.567 536 1HD1 LEU 66 1HD1 LEU 66 5.317 -0.201 -4.316 537 2HD1 LEU 66 2HD1 LEU 66 5.323 -1.708 -5.265 538 3HD1 LEU 66 3HD1 LEU 66 6.861 -0.921 -4.835 539 1HD2 LEU 66 1HD2 LEU 66 7.336 1.254 -5.533 540 2HD2 LEU 66 2HD2 LEU 66 7.045 1.574 -7.260 541 3HD2 LEU 66 3HD2 LEU 66 5.904 2.183 -6.037 542 H LYS 67 H LYS 67 8.829 -1.799 -9.395 543 HA LYS 67 HA LYS 67 7.516 -3.814 -10.862 544 1HB LYS 67 1HB LYS 67 9.714 -1.957 -11.212 545 2HB LYS 67 2HB LYS 67 10.144 -3.535 -11.839 546 1HG LYS 67 1HG LYS 67 7.875 -3.554 -13.048 547 2HG LYS 67 2HG LYS 67 7.690 -1.877 -12.574 548 1HD LYS 67 1HD LYS 67 9.870 -1.342 -13.728 549 2HD LYS 67 2HD LYS 67 9.979 -3.010 -14.252 550 1HE LYS 67 1HE LYS 67 7.347 -1.987 -14.932 551 2HE LYS 67 2HE LYS 67 8.557 -0.860 -15.512 552 1HZ LYS 67 1HZ LYS 67 9.549 -3.308 -16.128 553 2HZ LYS 67 2HZ LYS 67 7.955 -3.451 -16.452 554 3HZ LYS 67 3HZ LYS 67 8.831 -2.272 -17.166 555 H ARG 68 H ARG 68 10.822 -3.814 -9.340 556 HA ARG 68 HA ARG 68 11.268 -6.468 -9.688 557 1HB ARG 68 1HB ARG 68 12.294 -4.333 -7.866 558 2HB ARG 68 2HB ARG 68 12.580 -5.968 -7.303 559 1HG ARG 68 1HG ARG 68 13.728 -6.557 -9.387 560 2HG ARG 68 2HG ARG 68 13.288 -5.027 -10.119 561 1HD ARG 68 1HD ARG 68 15.334 -4.309 -9.388 562 2HD ARG 68 2HD ARG 68 14.559 -4.155 -7.824 563 HE ARG 68 HE ARG 68 15.855 -5.939 -7.074 564 1HH1 ARG 68 1HH1 ARG 68 15.578 -6.159 -10.575 565 2HH1 ARG 68 2HH1 ARG 68 16.634 -7.526 -10.700 566 1HH2 ARG 68 1HH2 ARG 68 17.249 -7.742 -7.239 567 2HH2 ARG 68 2HH2 ARG 68 17.591 -8.433 -8.790 568 H MET 69 H MET 69 9.348 -4.763 -7.210 569 HA MET 69 HA MET 69 9.213 -6.712 -5.298 570 1HB MET 69 1HB MET 69 7.962 -4.226 -5.914 571 2HB MET 69 2HB MET 69 6.630 -5.353 -5.748 572 1HG MET 69 1HG MET 69 7.848 -6.121 -3.540 573 2HG MET 69 2HG MET 69 8.738 -4.618 -3.685 574 1HE MET 69 1HE MET 69 7.205 -3.176 -1.273 575 2HE MET 69 2HE MET 69 8.339 -2.966 -2.628 576 3HE MET 69 3HE MET 69 6.850 -1.994 -2.555 577 H LYS 70 H LYS 70 6.889 -6.125 -8.040 578 HA LYS 70 HA LYS 70 5.472 -8.527 -7.491 579 1HB LYS 70 1HB LYS 70 4.044 -7.872 -9.192 580 2HB LYS 70 2HB LYS 70 4.649 -6.338 -8.599 581 1HG LYS 70 1HG LYS 70 4.840 -6.163 -10.966 582 2HG LYS 70 2HG LYS 70 6.473 -6.507 -10.429 583 1HD LYS 70 1HD LYS 70 6.530 -8.426 -11.636 584 2HD LYS 70 2HD LYS 70 5.083 -9.020 -10.845 585 1HE LYS 70 1HE LYS 70 3.904 -8.689 -12.753 586 2HE LYS 70 2HE LYS 70 4.228 -6.969 -12.655 587 1HZ LYS 70 1HZ LYS 70 5.975 -8.970 -13.910 588 2HZ LYS 70 2HZ LYS 70 5.062 -7.863 -14.689 589 3HZ LYS 70 3HZ LYS 70 6.329 -7.381 -13.778 590 H VAL 71 H VAL 71 8.067 -7.513 -9.765 591 HA VAL 71 HA VAL 71 8.069 -9.831 -11.310 592 HB VAL 71 HB VAL 71 10.363 -7.993 -10.597 593 1HG1 VAL 71 1HG1 VAL 71 11.446 -8.741 -12.574 594 2HG1 VAL 71 2HG1 VAL 71 10.906 -10.209 -11.724 595 3HG1 VAL 71 3HG1 VAL 71 9.996 -9.609 -13.132 596 1HG2 VAL 71 1HG2 VAL 71 8.022 -7.166 -11.677 597 2HG2 VAL 71 2HG2 VAL 71 9.600 -6.438 -12.060 598 3HG2 VAL 71 3HG2 VAL 71 8.892 -7.651 -13.153 599 H ILE 72 H ILE 72 9.304 -9.108 -8.066 600 HA ILE 72 HA ILE 72 11.081 -11.299 -7.929 601 HB ILE 72 HB ILE 72 9.922 -9.296 -6.082 602 1HG1 ILE 72 1HG1 ILE 72 12.072 -9.000 -7.308 603 2HG1 ILE 72 2HG1 ILE 72 12.214 -8.861 -5.567 604 1HG2 ILE 72 1HG2 ILE 72 10.637 -12.060 -5.243 605 2HG2 ILE 72 2HG2 ILE 72 11.233 -10.717 -4.239 606 3HG2 ILE 72 3HG2 ILE 72 9.487 -10.899 -4.536 607 1HD1 ILE 72 1HD1 ILE 72 14.025 -10.262 -6.075 608 2HD1 ILE 72 2HD1 ILE 72 12.764 -11.452 -5.670 609 3HD1 ILE 72 3HD1 ILE 72 13.141 -11.100 -7.373 610 H ASP 73 H ASP 73 7.650 -10.779 -6.902 611 HA ASP 73 HA ASP 73 7.261 -13.604 -7.210 612 1HB ASP 73 1HB ASP 73 7.429 -12.255 -4.593 613 2HB ASP 73 2HB ASP 73 5.885 -13.055 -4.810 614 H GLU 74 H GLU 74 4.843 -14.106 -7.188 615 HA GLU 74 HA GLU 74 3.374 -11.706 -7.931 616 1HB GLU 74 1HB GLU 74 2.119 -13.010 -9.432 617 2HB GLU 74 2HB GLU 74 3.716 -13.721 -9.553 618 1HG GLU 74 1HG GLU 74 3.031 -15.456 -7.843 619 2HG GLU 74 2HG GLU 74 1.417 -14.774 -7.838 620 H ASN 75 H ASN 75 3.930 -13.231 -5.185 621 HA ASN 75 HA ASN 75 1.152 -13.649 -4.472 622 1HB ASN 75 1HB ASN 75 3.248 -15.222 -3.884 623 2HB ASN 75 2HB ASN 75 3.475 -14.085 -2.570 624 1HD2 ASN 75 1HD2 ASN 75 3.069 -16.316 -1.554 625 2HD2 ASN 75 2HD2 ASN 75 1.447 -16.651 -1.048 626 H ILE 76 H ILE 76 3.657 -11.301 -4.445 627 HA ILE 76 HA ILE 76 3.112 -10.118 -1.912 628 HB ILE 76 HB ILE 76 5.270 -10.009 -3.159 629 1HG1 ILE 76 1HG1 ILE 76 3.867 -7.609 -2.033 630 2HG1 ILE 76 2HG1 ILE 76 5.170 -8.562 -1.352 631 1HG2 ILE 76 1HG2 ILE 76 5.597 -8.720 -5.048 632 2HG2 ILE 76 2HG2 ILE 76 4.007 -9.452 -5.368 633 3HG2 ILE 76 3HG2 ILE 76 4.113 -7.771 -4.793 634 1HD1 ILE 76 1HD1 ILE 76 6.179 -6.505 -2.051 635 2HD1 ILE 76 2HD1 ILE 76 6.642 -7.699 -3.287 636 3HD1 ILE 76 3HD1 ILE 76 5.334 -6.538 -3.617 637 H ARG 77 H ARG 77 1.600 -8.612 -1.353 638 HA ARG 77 HA ARG 77 -0.006 -7.620 -3.571 639 1HB ARG 77 1HB ARG 77 -1.552 -8.921 -2.386 640 2HB ARG 77 2HB ARG 77 -0.742 -8.683 -0.851 641 1HG ARG 77 1HG ARG 77 -1.755 -6.596 -0.470 642 2HG ARG 77 2HG ARG 77 -1.998 -6.280 -2.177 643 1HD ARG 77 1HD ARG 77 -4.154 -6.792 -1.043 644 2HD ARG 77 2HD ARG 77 -3.794 -7.980 -2.279 645 HE ARG 77 HE ARG 77 -3.629 -8.406 0.663 646 1HH1 ARG 77 1HH1 ARG 77 -3.292 -9.707 -2.589 647 2HH1 ARG 77 2HH1 ARG 77 -3.293 -11.358 -2.066 648 1HH2 ARG 77 1HH2 ARG 77 -3.630 -10.584 1.354 649 2HH2 ARG 77 2HH2 ARG 77 -3.486 -11.861 0.192 650 H VAL 78 H VAL 78 0.445 -5.462 -3.899 651 HA VAL 78 HA VAL 78 0.538 -3.749 -1.541 652 HB VAL 78 HB VAL 78 2.858 -4.574 -2.594 653 1HG1 VAL 78 1HG1 VAL 78 3.767 -3.044 -4.192 654 2HG1 VAL 78 2HG1 VAL 78 2.211 -3.617 -4.840 655 3HG1 VAL 78 3HG1 VAL 78 2.328 -2.000 -4.107 656 1HG2 VAL 78 1HG2 VAL 78 3.539 -3.240 -0.945 657 2HG2 VAL 78 2HG2 VAL 78 3.270 -1.817 -1.979 658 3HG2 VAL 78 3HG2 VAL 78 1.958 -2.423 -0.940 659 H ILE 79 H ILE 79 -0.236 -1.628 -1.931 660 HA ILE 79 HA ILE 79 -1.532 -1.362 -4.550 661 HB ILE 79 HB ILE 79 -2.357 -0.804 -1.779 662 1HG1 ILE 79 1HG1 ILE 79 -3.663 -1.617 -4.372 663 2HG1 ILE 79 2HG1 ILE 79 -3.502 -2.534 -2.887 664 1HG2 ILE 79 1HG2 ILE 79 -3.070 1.118 -4.012 665 2HG2 ILE 79 2HG2 ILE 79 -3.840 1.054 -2.408 666 3HG2 ILE 79 3HG2 ILE 79 -2.120 1.488 -2.553 667 1HD1 ILE 79 1HD1 ILE 79 -4.981 -0.797 -1.746 668 2HD1 ILE 79 2HD1 ILE 79 -5.270 -0.095 -3.356 669 3HD1 ILE 79 3HD1 ILE 79 -5.791 -1.760 -3.005 670 H ILE 80 H ILE 80 -1.260 0.526 -5.764 671 HA ILE 80 HA ILE 80 0.951 2.199 -4.820 672 HB ILE 80 HB ILE 80 1.487 2.619 -7.057 673 1HG1 ILE 80 1HG1 ILE 80 0.031 1.719 -8.946 674 2HG1 ILE 80 2HG1 ILE 80 -1.235 1.496 -7.755 675 1HG2 ILE 80 1HG2 ILE 80 2.186 0.421 -6.287 676 2HG2 ILE 80 2HG2 ILE 80 0.648 -0.286 -6.840 677 3HG2 ILE 80 3HG2 ILE 80 1.799 0.380 -8.024 678 1HD1 ILE 80 1HD1 ILE 80 -0.671 3.864 -9.153 679 2HD1 ILE 80 2HD1 ILE 80 -1.729 3.711 -7.730 680 3HD1 ILE 80 3HD1 ILE 80 -0.018 4.158 -7.524 681 H MET 81 H MET 81 0.821 4.542 -5.200 682 HA MET 81 HA MET 81 -1.896 5.486 -5.566 683 1HB MET 81 1HB MET 81 -0.924 7.157 -3.552 684 2HB MET 81 2HB MET 81 -2.026 5.822 -3.286 685 1HG MET 81 1HG MET 81 -0.290 4.349 -2.597 686 2HG MET 81 2HG MET 81 0.961 5.296 -3.377 687 1HE MET 81 1HE MET 81 0.921 7.802 -3.001 688 2HE MET 81 2HE MET 81 -0.225 8.517 -1.842 689 3HE MET 81 3HE MET 81 1.487 8.324 -1.397 690 H THR 82 H THR 82 -1.963 7.234 -6.929 691 HA THR 82 HA THR 82 -0.071 9.301 -6.905 692 HB THR 82 HB THR 82 1.600 8.023 -7.937 693 HG1 THR 82 HG1 THR 82 0.610 9.764 -9.382 694 1HG2 THR 82 1HG2 THR 82 -0.702 6.336 -8.773 695 2HG2 THR 82 2HG2 THR 82 0.540 6.525 -10.034 696 3HG2 THR 82 3HG2 THR 82 0.982 5.862 -8.442 697 H ALA 83 H ALA 83 -0.753 11.064 -8.116 698 HA ALA 83 HA ALA 83 -3.451 11.167 -8.710 699 1HB ALA 83 1HB ALA 83 -2.179 13.158 -10.241 700 2HB ALA 83 2HB ALA 83 -2.796 13.316 -8.579 701 3HB ALA 83 3HB ALA 83 -1.095 12.874 -8.859 702 H TYR 84 H TYR 84 -4.516 11.523 -10.839 703 HA TYR 84 HA TYR 84 -3.730 9.474 -12.657 704 1HB TYR 84 1HB TYR 84 -5.770 10.487 -13.872 705 2HB TYR 84 2HB TYR 84 -6.096 10.028 -12.213 706 HD1 TYR 84 HD1 TYR 84 -5.729 12.827 -14.550 707 HD2 TYR 84 HD2 TYR 84 -6.405 11.741 -10.467 708 HE1 TYR 84 HE1 TYR 84 -6.532 15.186 -14.048 709 HE2 TYR 84 HE2 TYR 84 -7.206 14.104 -9.979 710 HH TYR 84 HH TYR 84 -8.324 16.035 -11.790 711 H GLY 85 H GLY 85 -1.491 10.972 -12.634 712 1HA GLY 85 1HA GLY 85 -1.681 12.679 -15.042 713 2HA GLY 85 2HA GLY 85 -0.525 12.894 -13.743 714 H GLU 86 H GLU 86 -0.049 9.951 -13.389 715 HA GLU 86 HA GLU 86 1.503 9.577 -15.831 716 1HB GLU 86 1HB GLU 86 2.868 8.030 -14.132 717 2HB GLU 86 2HB GLU 86 3.173 9.752 -14.243 718 1HG GLU 86 1HG GLU 86 1.968 10.232 -12.252 719 2HG GLU 86 2HG GLU 86 1.070 8.728 -12.314 720 H LEU 87 H LEU 87 -1.103 8.756 -15.999 721 HA LEU 87 HA LEU 87 -1.880 6.368 -14.997 722 1HB LEU 87 1HB LEU 87 -2.265 7.342 -17.832 723 2HB LEU 87 2HB LEU 87 -3.223 6.115 -17.025 724 HG LEU 87 HG LEU 87 -3.059 8.780 -15.700 725 1HD1 LEU 87 1HD1 LEU 87 -3.339 9.570 -17.918 726 2HD1 LEU 87 2HD1 LEU 87 -4.526 8.300 -18.300 727 3HD1 LEU 87 3HD1 LEU 87 -4.948 9.599 -17.159 728 1HD2 LEU 87 1HD2 LEU 87 -4.497 7.565 -14.471 729 2HD2 LEU 87 2HD2 LEU 87 -5.670 8.039 -15.722 730 3HD2 LEU 87 3HD2 LEU 87 -4.871 6.451 -15.808 731 H ASP 88 H ASP 88 0.515 6.991 -17.591 732 HA ASP 88 HA ASP 88 0.764 4.565 -18.680 733 1HB ASP 88 1HB ASP 88 2.535 6.864 -18.168 734 2HB ASP 88 2HB ASP 88 3.437 5.364 -18.251 735 H MET 89 H MET 89 2.490 5.794 -15.710 736 HA MET 89 HA MET 89 3.712 3.355 -15.147 737 1HB MET 89 1HB MET 89 4.657 5.317 -14.145 738 2HB MET 89 2HB MET 89 3.097 5.910 -13.611 739 1HG MET 89 1HG MET 89 2.956 4.173 -11.880 740 2HG MET 89 2HG MET 89 4.393 3.379 -12.492 741 1HE MET 89 1HE MET 89 5.004 3.566 -9.819 742 2HE MET 89 2HE MET 89 6.344 3.513 -10.990 743 3HE MET 89 3HE MET 89 6.402 4.649 -9.620 744 H ILE 90 H ILE 90 0.712 4.935 -13.868 745 HA ILE 90 HA ILE 90 0.089 3.064 -11.947 746 HB ILE 90 HB ILE 90 -1.637 4.829 -13.675 747 1HG1 ILE 90 1HG1 ILE 90 -1.404 5.374 -10.803 748 2HG1 ILE 90 2HG1 ILE 90 0.135 5.445 -11.637 749 1HG2 ILE 90 1HG2 ILE 90 -3.117 4.292 -11.420 750 2HG2 ILE 90 2HG2 ILE 90 -3.375 3.582 -13.031 751 3HG2 ILE 90 3HG2 ILE 90 -2.417 2.704 -11.815 752 1HD1 ILE 90 1HD1 ILE 90 -2.218 6.776 -12.962 753 2HD1 ILE 90 2HD1 ILE 90 -1.500 7.567 -11.538 754 3HD1 ILE 90 3HD1 ILE 90 -0.500 7.240 -12.973 755 H GLN 91 H GLN 91 -0.983 3.170 -15.417 756 HA GLN 91 HA GLN 91 -2.467 0.925 -15.427 757 1HB GLN 91 1HB GLN 91 -0.876 2.429 -17.440 758 2HB GLN 91 2HB GLN 91 -1.235 0.774 -17.892 759 1HG GLN 91 1HG GLN 91 -3.620 1.961 -16.740 760 2HG GLN 91 2HG GLN 91 -2.991 3.042 -17.968 761 1HE2 GLN 91 1HE2 GLN 91 -5.121 2.363 -18.890 762 2HE2 GLN 91 2HE2 GLN 91 -5.155 0.991 -19.946 763 H GLU 92 H GLU 92 1.116 1.158 -15.965 764 HA GLU 92 HA GLU 92 1.533 -1.516 -16.406 765 1HB GLU 92 1HB GLU 92 3.125 0.855 -15.871 766 2HB GLU 92 2HB GLU 92 3.803 -0.507 -15.001 767 1HG GLU 92 1HG GLU 92 4.370 -1.650 -16.934 768 2HG GLU 92 2HG GLU 92 2.970 -1.074 -17.818 769 H SER 93 H SER 93 1.694 0.362 -13.302 770 HA SER 93 HA SER 93 2.447 -1.687 -11.683 771 1HB SER 93 1HB SER 93 0.574 -0.135 -10.202 772 2HB SER 93 2HB SER 93 2.319 0.028 -10.224 773 HG SER 93 HG SER 93 2.209 1.682 -11.661 774 H LYS 94 H LYS 94 -0.749 -0.909 -13.078 775 HA LYS 94 HA LYS 94 -2.200 -2.683 -11.404 776 1HB LYS 94 1HB LYS 94 -2.781 -0.669 -13.275 777 2HB LYS 94 2HB LYS 94 -3.446 -2.134 -13.970 778 1HG LYS 94 1HG LYS 94 -4.382 -2.558 -11.526 779 2HG LYS 94 2HG LYS 94 -4.098 -0.843 -11.305 780 1HD LYS 94 1HD LYS 94 -5.568 -0.283 -13.178 781 2HD LYS 94 2HD LYS 94 -5.710 -1.967 -13.639 782 1HE LYS 94 1HE LYS 94 -6.609 -2.253 -11.133 783 2HE LYS 94 2HE LYS 94 -6.941 -0.538 -11.276 784 1HZ LYS 94 1HZ LYS 94 -7.772 -2.049 -13.546 785 2HZ LYS 94 2HZ LYS 94 -8.535 -2.485 -12.169 786 3HZ LYS 94 3HZ LYS 94 -8.594 -0.935 -12.679 787 H GLU 95 H GLU 95 -0.847 -2.870 -14.757 788 HA GLU 95 HA GLU 95 -1.740 -5.531 -15.064 789 1HB GLU 95 1HB GLU 95 0.381 -4.020 -16.653 790 2HB GLU 95 2HB GLU 95 -0.451 -5.474 -17.167 791 1HG GLU 95 1HG GLU 95 -1.917 -2.888 -16.479 792 2HG GLU 95 2HG GLU 95 -1.375 -3.268 -18.101 793 H LEU 96 H LEU 96 0.779 -4.103 -13.265 794 HA LEU 96 HA LEU 96 2.759 -6.111 -13.671 795 1HB LEU 96 1HB LEU 96 2.468 -3.611 -12.267 796 2HB LEU 96 2HB LEU 96 3.165 -4.817 -11.204 797 HG LEU 96 HG LEU 96 5.037 -5.154 -12.621 798 1HD1 LEU 96 1HD1 LEU 96 4.197 -5.311 -14.789 799 2HD1 LEU 96 2HD1 LEU 96 3.415 -3.714 -14.710 800 3HD1 LEU 96 3HD1 LEU 96 5.187 -3.832 -14.828 801 1HD2 LEU 96 1HD2 LEU 96 6.105 -3.229 -12.169 802 2HD2 LEU 96 2HD2 LEU 96 4.917 -2.235 -13.047 803 3HD2 LEU 96 3HD2 LEU 96 4.569 -2.781 -11.388 804 H GLY 97 H GLY 97 -0.247 -5.931 -11.971 805 1HA GLY 97 1HA GLY 97 -1.121 -8.006 -11.147 806 2HA GLY 97 2HA GLY 97 0.465 -8.403 -10.517 807 H ALA 98 H ALA 98 -0.777 -5.079 -10.290 808 HA ALA 98 HA ALA 98 -0.648 -5.279 -7.412 809 1HB ALA 98 1HB ALA 98 -1.009 -2.813 -7.558 810 2HB ALA 98 2HB ALA 98 0.368 -3.367 -8.541 811 3HB ALA 98 3HB ALA 98 -1.181 -2.969 -9.323 812 H LEU 99 H LEU 99 -2.432 -4.595 -6.006 813 HA LEU 99 HA LEU 99 -4.834 -5.834 -6.699 814 1HB LEU 99 1HB LEU 99 -4.645 -3.736 -4.571 815 2HB LEU 99 2HB LEU 99 -5.577 -5.220 -4.593 816 HG LEU 99 HG LEU 99 -3.956 -5.792 -3.095 817 1HD1 LEU 99 1HD1 LEU 99 -1.948 -6.719 -4.837 818 2HD1 LEU 99 2HD1 LEU 99 -3.332 -7.624 -4.178 819 3HD1 LEU 99 3HD1 LEU 99 -3.473 -6.800 -5.750 820 1HD2 LEU 99 1HD2 LEU 99 -1.430 -4.981 -4.011 821 2HD2 LEU 99 2HD2 LEU 99 -2.512 -3.597 -4.292 822 3HD2 LEU 99 3HD2 LEU 99 -2.372 -4.300 -2.663 823 H THR 100 H THR 100 -3.944 -2.321 -6.486 824 HA THR 100 HA THR 100 -5.610 -1.704 -8.707 825 HB THR 100 HB THR 100 -7.348 -2.032 -6.921 826 HG1 THR 100 HG1 THR 100 -7.845 -0.395 -8.423 827 1HG2 THR 100 1HG2 THR 100 -6.547 0.504 -5.568 828 2HG2 THR 100 2HG2 THR 100 -7.280 -0.962 -4.875 829 3HG2 THR 100 3HG2 THR 100 -5.526 -0.898 -5.170 830 H HIS 101 H HIS 101 -6.004 1.029 -8.249 831 HA HIS 101 HA HIS 101 -3.418 2.039 -7.430 832 1HB HIS 101 1HB HIS 101 -2.914 3.118 -9.487 833 2HB HIS 101 2HB HIS 101 -3.199 1.425 -9.837 834 HD1 HIS 101 HD1 HIS 101 -4.885 0.907 -11.634 835 HD2 HIS 101 HD2 HIS 101 -5.244 4.825 -10.179 836 HE1 HIS 101 HE1 HIS 101 -6.608 2.065 -13.117 837 H PHE 102 H PHE 102 -3.779 3.784 -6.159 838 HA PHE 102 HA PHE 102 -6.351 5.141 -6.505 839 1HB PHE 102 1HB PHE 102 -4.303 5.033 -4.209 840 2HB PHE 102 2HB PHE 102 -5.844 5.864 -4.117 841 HD1 PHE 102 HD1 PHE 102 -4.622 3.487 -2.447 842 HD2 PHE 102 HD2 PHE 102 -7.489 3.733 -5.566 843 HE1 PHE 102 HE1 PHE 102 -5.708 1.382 -1.616 844 HE2 PHE 102 HE2 PHE 102 -8.574 1.628 -4.735 845 HZ PHE 102 HZ PHE 102 -7.671 0.478 -2.769 846 H ALA 103 H ALA 103 -6.400 7.518 -6.210 847 HA ALA 103 HA ALA 103 -3.891 8.707 -7.169 848 1HB ALA 103 1HB ALA 103 -6.588 10.022 -7.430 849 2HB ALA 103 2HB ALA 103 -5.155 10.156 -8.477 850 3HB ALA 103 3HB ALA 103 -6.161 8.688 -8.528 851 H LYS 104 H LYS 104 -3.184 10.703 -6.227 852 HA LYS 104 HA LYS 104 -3.042 10.964 -3.638 853 1HB LYS 104 1HB LYS 104 -2.925 12.819 -5.870 854 2HB LYS 104 2HB LYS 104 -3.488 13.625 -4.420 855 1HG LYS 104 1HG LYS 104 -1.474 13.384 -3.337 856 2HG LYS 104 2HG LYS 104 -1.221 11.761 -3.948 857 1HD LYS 104 1HD LYS 104 0.323 12.651 -5.357 858 2HD LYS 104 2HD LYS 104 -1.017 13.331 -6.258 859 1HE LYS 104 1HE LYS 104 -0.684 15.115 -4.097 860 2HE LYS 104 2HE LYS 104 0.955 14.690 -4.547 861 1HZ LYS 104 1HZ LYS 104 -0.769 16.388 -5.870 862 2HZ LYS 104 2HZ LYS 104 0.750 15.973 -6.303 863 3HZ LYS 104 3HZ LYS 104 -0.522 15.116 -6.864 864 HA PRO 105 HA PRO 105 -7.251 13.005 -3.104 865 1HB PRO 105 1HB PRO 105 -8.910 13.409 -5.238 866 2HB PRO 105 2HB PRO 105 -7.817 14.635 -4.629 867 1HG PRO 105 1HG PRO 105 -7.570 12.976 -7.063 868 2HG PRO 105 2HG PRO 105 -6.741 14.467 -6.662 869 1HD PRO 105 1HD PRO 105 -5.655 11.815 -6.546 870 2HD PRO 105 2HD PRO 105 -4.866 13.294 -6.035 871 H PHE 106 H PHE 106 -7.671 11.169 -1.913 872 HA PHE 106 HA PHE 106 -9.531 9.397 -3.329 873 1HB PHE 106 1HB PHE 106 -8.351 7.786 -1.435 874 2HB PHE 106 2HB PHE 106 -7.727 7.921 -3.067 875 HD1 PHE 106 HD1 PHE 106 -5.434 8.017 -3.107 876 HD2 PHE 106 HD2 PHE 106 -7.486 10.043 0.006 877 HE1 PHE 106 HE1 PHE 106 -3.244 8.844 -2.202 878 HE2 PHE 106 HE2 PHE 106 -5.296 10.871 0.911 879 HZ PHE 106 HZ PHE 106 -3.201 10.261 -0.204 880 H ASP 107 H ASP 107 -11.122 8.319 -1.931 881 HA ASP 107 HA ASP 107 -11.552 9.893 0.484 882 1HB ASP 107 1HB ASP 107 -13.235 9.761 -1.604 883 2HB ASP 107 2HB ASP 107 -13.726 8.263 -0.839 884 H ILE 108 H ILE 108 -12.218 8.703 2.421 885 HA ILE 108 HA ILE 108 -11.136 6.093 2.585 886 HB ILE 108 HB ILE 108 -11.950 8.172 4.334 887 1HG1 ILE 108 1HG1 ILE 108 -9.787 7.172 4.450 888 2HG1 ILE 108 2HG1 ILE 108 -10.603 6.849 5.966 889 1HG2 ILE 108 1HG2 ILE 108 -13.186 5.494 5.027 890 2HG2 ILE 108 2HG2 ILE 108 -13.046 6.890 6.122 891 3HG2 ILE 108 3HG2 ILE 108 -14.056 7.003 4.661 892 1HD1 ILE 108 1HD1 ILE 108 -9.747 4.959 3.839 893 2HD1 ILE 108 2HD1 ILE 108 -9.956 4.687 5.585 894 3HD1 ILE 108 3HD1 ILE 108 -11.368 4.644 4.503 895 H ASP 109 H ASP 109 -14.361 7.463 2.002 896 HA ASP 109 HA ASP 109 -15.775 5.144 2.633 897 1HB ASP 109 1HB ASP 109 -16.539 7.644 2.154 898 2HB ASP 109 2HB ASP 109 -16.657 7.101 0.492 899 H GLU 110 H GLU 110 -14.458 6.572 -0.435 900 HA GLU 110 HA GLU 110 -15.440 4.493 -2.050 901 1HB GLU 110 1HB GLU 110 -14.312 5.587 -3.835 902 2HB GLU 110 2HB GLU 110 -14.785 6.880 -2.751 903 1HG GLU 110 1HG GLU 110 -12.545 7.033 -1.813 904 2HG GLU 110 2HG GLU 110 -12.042 5.555 -2.611 905 H ILE 111 H ILE 111 -12.500 5.018 -0.131 906 HA ILE 111 HA ILE 111 -10.929 3.056 -1.414 907 HB ILE 111 HB ILE 111 -10.808 4.678 1.068 908 1HG1 ILE 111 1HG1 ILE 111 -9.050 4.171 -1.332 909 2HG1 ILE 111 2HG1 ILE 111 -9.839 5.660 -0.848 910 1HG2 ILE 111 1HG2 ILE 111 -9.041 2.250 0.659 911 2HG2 ILE 111 2HG2 ILE 111 -8.893 3.472 1.944 912 3HG2 ILE 111 3HG2 ILE 111 -10.319 2.408 1.888 913 1HD1 ILE 111 1HD1 ILE 111 -7.475 4.290 0.494 914 2HD1 ILE 111 2HD1 ILE 111 -7.533 5.913 -0.235 915 3HD1 ILE 111 3HD1 ILE 111 -8.399 5.589 1.286 916 H ARG 112 H ARG 112 -13.562 2.977 0.919 917 HA ARG 112 HA ARG 112 -12.954 0.590 2.145 918 1HB ARG 112 1HB ARG 112 -15.669 1.838 1.486 919 2HB ARG 112 2HB ARG 112 -15.465 0.484 2.580 920 1HG ARG 112 1HG ARG 112 -13.581 2.496 3.387 921 2HG ARG 112 2HG ARG 112 -15.107 3.312 3.114 922 1HD ARG 112 1HD ARG 112 -15.316 2.629 5.361 923 2HD ARG 112 2HD ARG 112 -16.160 1.347 4.515 924 HE ARG 112 HE ARG 112 -14.478 -0.152 5.152 925 1HH1 ARG 112 1HH1 ARG 112 -13.296 3.139 5.542 926 2HH1 ARG 112 2HH1 ARG 112 -11.831 2.656 6.330 927 1HH2 ARG 112 1HH2 ARG 112 -12.546 -0.790 6.193 928 2HH2 ARG 112 2HH2 ARG 112 -11.402 0.406 6.703 929 H ASP 113 H ASP 113 -14.101 1.335 -1.092 930 HA ASP 113 HA ASP 113 -15.317 -1.164 -1.560 931 1HB ASP 113 1HB ASP 113 -15.045 1.325 -2.902 932 2HB ASP 113 2HB ASP 113 -14.273 0.160 -3.958 933 H ALA 114 H ALA 114 -12.242 0.441 -2.701 934 HA ALA 114 HA ALA 114 -11.175 -1.749 -4.008 935 1HB ALA 114 1HB ALA 114 -10.374 0.588 -4.192 936 2HB ALA 114 2HB ALA 114 -9.748 0.499 -2.528 937 3HB ALA 114 3HB ALA 114 -9.046 -0.531 -3.799 938 H VAL 115 H VAL 115 -11.250 -0.868 -0.545 939 HA VAL 115 HA VAL 115 -9.272 -2.535 0.395 940 HB VAL 115 HB VAL 115 -11.839 -1.451 1.497 941 1HG1 VAL 115 1HG1 VAL 115 -10.996 -2.336 3.764 942 2HG1 VAL 115 2HG1 VAL 115 -11.813 -3.484 2.675 943 3HG1 VAL 115 3HG1 VAL 115 -10.037 -3.491 2.808 944 1HG2 VAL 115 1HG2 VAL 115 -9.368 -0.927 2.951 945 2HG2 VAL 115 2HG2 VAL 115 -9.240 -0.468 1.236 946 3HG2 VAL 115 3HG2 VAL 115 -10.541 0.210 2.244 947 H LYS 116 H LYS 116 -12.700 -3.243 -0.462 948 HA LYS 116 HA LYS 116 -12.935 -5.760 0.538 949 1HB LYS 116 1HB LYS 116 -14.706 -4.419 -0.587 950 2HB LYS 116 2HB LYS 116 -13.974 -4.780 -2.138 951 1HG LYS 116 1HG LYS 116 -14.174 -7.299 -1.393 952 2HG LYS 116 2HG LYS 116 -15.303 -6.700 -0.194 953 1HD LYS 116 1HD LYS 116 -15.565 -6.104 -3.177 954 2HD LYS 116 2HD LYS 116 -16.351 -7.463 -2.399 955 1HE LYS 116 1HE LYS 116 -17.280 -5.634 -0.720 956 2HE LYS 116 2HE LYS 116 -16.861 -4.501 -1.990 957 1HZ LYS 116 1HZ LYS 116 -18.846 -6.614 -2.022 958 2HZ LYS 116 2HZ LYS 116 -18.952 -5.084 -2.581 959 3HZ LYS 116 3HZ LYS 116 -18.137 -6.212 -3.437 960 H LYS 117 H LYS 117 -10.829 -4.612 -2.027 961 HA LYS 117 HA LYS 117 -10.188 -7.400 -2.683 962 1HB LYS 117 1HB LYS 117 -9.804 -4.860 -4.293 963 2HB LYS 117 2HB LYS 117 -9.189 -6.432 -4.762 964 1HG LYS 117 1HG LYS 117 -11.529 -7.350 -4.700 965 2HG LYS 117 2HG LYS 117 -12.130 -5.760 -4.273 966 1HD LYS 117 1HD LYS 117 -10.423 -6.097 -6.757 967 2HD LYS 117 2HD LYS 117 -12.120 -6.531 -6.809 968 1HE LYS 117 1HE LYS 117 -11.129 -3.811 -5.838 969 2HE LYS 117 2HE LYS 117 -11.579 -4.124 -7.502 970 1HZ LYS 117 1HZ LYS 117 -13.500 -4.942 -5.526 971 2HZ LYS 117 2HZ LYS 117 -13.283 -3.329 -5.664 972 3HZ LYS 117 3HZ LYS 117 -13.733 -4.207 -6.965 973 H TYR 118 H TYR 118 -9.017 -4.281 -1.451 974 HA TYR 118 HA TYR 118 -6.265 -4.984 -1.552 975 1HB TYR 118 1HB TYR 118 -6.315 -2.705 -1.102 976 2HB TYR 118 2HB TYR 118 -8.051 -2.797 -0.884 977 HD1 TYR 118 HD1 TYR 118 -5.187 -1.683 0.637 978 HD2 TYR 118 HD2 TYR 118 -8.645 -4.037 1.537 979 HE1 TYR 118 HE1 TYR 118 -4.911 -1.157 3.109 980 HE2 TYR 118 HE2 TYR 118 -8.356 -3.503 4.006 981 HH TYR 118 HH TYR 118 -7.335 -2.178 5.451 982 H LEU 119 H LEU 119 -8.942 -5.725 0.600 983 HA LEU 119 HA LEU 119 -7.629 -7.649 2.002 984 1HB LEU 119 1HB LEU 119 -6.607 -5.167 2.777 985 2HB LEU 119 2HB LEU 119 -7.719 -5.607 4.059 986 HG LEU 119 HG LEU 119 -5.136 -6.333 4.017 987 1HD1 LEU 119 1HD1 LEU 119 -5.922 -6.919 6.015 988 2HD1 LEU 119 2HD1 LEU 119 -7.547 -7.248 5.370 989 3HD1 LEU 119 3HD1 LEU 119 -6.291 -8.507 5.301 990 1HD2 LEU 119 1HD2 LEU 119 -5.678 -7.694 1.887 991 2HD2 LEU 119 2HD2 LEU 119 -4.695 -8.450 3.164 992 3HD2 LEU 119 3HD2 LEU 119 -6.419 -8.861 3.007 993 HA PRO 120 HA PRO 120 -11.766 -8.011 3.192 994 1HB PRO 120 1HB PRO 120 -11.592 -10.101 4.945 995 2HB PRO 120 2HB PRO 120 -11.628 -10.309 3.205 996 1HG PRO 120 1HG PRO 120 -9.331 -10.539 5.052 997 2HG PRO 120 2HG PRO 120 -9.488 -11.145 3.416 998 1HD PRO 120 1HD PRO 120 -8.021 -8.827 4.254 999 2HD PRO 120 2HD PRO 120 -8.275 -9.367 2.607 1000 H LEU 121 H LEU 121 -10.973 -5.754 4.207 1001 HA LEU 121 HA LEU 121 -11.295 -5.999 7.093 1002 1HB LEU 121 1HB LEU 121 -9.426 -4.707 6.448 1003 2HB LEU 121 2HB LEU 121 -10.350 -3.801 5.266 1004 HG LEU 121 HG LEU 121 -11.666 -2.793 7.155 1005 1HD1 LEU 121 1HD1 LEU 121 -9.525 -3.649 9.060 1006 2HD1 LEU 121 2HD1 LEU 121 -11.204 -3.146 9.370 1007 3HD1 LEU 121 3HD1 LEU 121 -10.867 -4.766 8.714 1008 1HD2 LEU 121 1HD2 LEU 121 -9.695 -1.714 6.014 1009 2HD2 LEU 121 2HD2 LEU 121 -10.045 -1.131 7.659 1010 3HD2 LEU 121 3HD2 LEU 121 -8.697 -2.260 7.383 1011 H LYS 122 H LYS 122 -12.734 -4.255 8.143 1012 HA LYS 122 HA LYS 122 -15.317 -4.678 7.597 1013 1HB LYS 122 1HB LYS 122 -14.367 -3.477 9.565 1014 2HB LYS 122 2HB LYS 122 -14.175 -2.045 8.574 1015 1HG LYS 122 1HG LYS 122 -16.887 -3.175 8.347 1016 2HG LYS 122 2HG LYS 122 -16.482 -2.786 10.007 1017 1HD LYS 122 1HD LYS 122 -15.780 -0.743 7.911 1018 2HD LYS 122 2HD LYS 122 -17.479 -0.946 8.289 1019 1HE LYS 122 1HE LYS 122 -16.615 -0.813 10.818 1020 2HE LYS 122 2HE LYS 122 -15.235 -0.014 10.090 1021 1HZ LYS 122 1HZ LYS 122 -18.020 0.799 9.631 1022 2HZ LYS 122 2HZ LYS 122 -17.028 1.497 10.723 1023 3HZ LYS 122 3HZ LYS 122 -16.682 1.589 9.129 1024 H SER 123 H SER 123 -16.383 -4.608 5.692 1025 HA SER 123 HA SER 123 -15.616 -2.560 3.814 1026 1HB SER 123 1HB SER 123 -17.458 -4.978 3.595 1027 2HB SER 123 2HB SER 123 -17.216 -3.838 2.286 1028 HG SER 123 HG SER 123 -14.755 -4.449 3.009 1029 H ASN 124 H ASN 124 -16.754 -0.663 3.628 1030 HA ASN 124 HA ASN 124 -19.578 -0.739 4.185 1031 1HB ASN 124 1HB ASN 124 -18.080 -0.024 6.288 1032 2HB ASN 124 2HB ASN 124 -17.956 1.502 5.437 1033 1HD2 ASN 124 1HD2 ASN 124 -19.488 2.945 5.698 1034 2HD2 ASN 124 2HD2 ASN 124 -21.069 2.681 6.354 Start of MODEL 15 1 1H MET 1 1H MET 1 -10.523 -7.480 18.958 2 HA MET 1 HA MET 1 -9.679 -9.923 19.755 3 1HB MET 1 1HB MET 1 -12.099 -8.820 18.332 4 2HB MET 1 2HB MET 1 -11.946 -10.565 18.345 5 1HG MET 1 1HG MET 1 -11.734 -10.531 20.841 6 2HG MET 1 2HG MET 1 -11.882 -8.785 20.831 7 1HE MET 1 1HE MET 1 -15.335 -9.884 22.238 8 2HE MET 1 2HE MET 1 -13.886 -10.900 22.431 9 3HE MET 1 3HE MET 1 -13.755 -9.130 22.561 10 H MET 2 H MET 2 -10.611 -9.022 16.350 11 HA MET 2 HA MET 2 -9.716 -11.460 15.316 12 1HB MET 2 1HB MET 2 -10.032 -10.292 13.115 13 2HB MET 2 2HB MET 2 -11.387 -9.995 14.186 14 1HG MET 2 1HG MET 2 -9.257 -7.997 14.566 15 2HG MET 2 2HG MET 2 -9.807 -8.040 12.902 16 1HE MET 2 1HE MET 2 -13.117 -8.319 12.832 17 2HE MET 2 2HE MET 2 -13.044 -6.543 12.735 18 3HE MET 2 3HE MET 2 -11.745 -7.527 12.018 19 H ASN 3 H ASN 3 -8.170 -10.788 13.041 20 HA ASN 3 HA ASN 3 -5.773 -9.655 14.238 21 1HB ASN 3 1HB ASN 3 -6.175 -12.400 13.495 22 2HB ASN 3 2HB ASN 3 -5.116 -11.717 12.278 23 1HD2 ASN 3 1HD2 ASN 3 -5.631 -11.801 15.794 24 2HD2 ASN 3 2HD2 ASN 3 -3.964 -11.844 16.263 25 H GLU 4 H GLU 4 -4.294 -8.697 12.586 26 HA GLU 4 HA GLU 4 -4.679 -8.821 9.895 27 1HB GLU 4 1HB GLU 4 -6.829 -7.418 11.004 28 2HB GLU 4 2HB GLU 4 -5.753 -6.136 10.482 29 1HG GLU 4 1HG GLU 4 -5.992 -6.650 8.239 30 2HG GLU 4 2HG GLU 4 -6.103 -8.375 8.531 31 H LYS 5 H LYS 5 -3.250 -7.307 8.730 32 HA LYS 5 HA LYS 5 -1.703 -5.521 10.418 33 1HB LYS 5 1HB LYS 5 -0.651 -8.043 9.188 34 2HB LYS 5 2HB LYS 5 0.387 -6.632 9.219 35 1HG LYS 5 1HG LYS 5 0.736 -6.807 11.465 36 2HG LYS 5 2HG LYS 5 -0.973 -7.005 11.797 37 1HD LYS 5 1HD LYS 5 -0.656 -9.218 12.158 38 2HD LYS 5 2HD LYS 5 -0.106 -9.415 10.506 39 1HE LYS 5 1HE LYS 5 1.948 -9.913 11.337 40 2HE LYS 5 2HE LYS 5 2.098 -8.230 11.802 41 1HZ LYS 5 1HZ LYS 5 1.287 -10.496 13.431 42 2HZ LYS 5 2HZ LYS 5 2.350 -9.305 13.774 43 3HZ LYS 5 3HZ LYS 5 0.745 -9.009 13.831 44 H ILE 6 H ILE 6 -0.266 -4.091 9.063 45 HA ILE 6 HA ILE 6 -0.745 -4.057 6.252 46 HB ILE 6 HB ILE 6 -2.526 -2.593 7.997 47 1HG1 ILE 6 1HG1 ILE 6 -3.306 -2.133 5.400 48 2HG1 ILE 6 2HG1 ILE 6 -2.383 -3.614 5.237 49 1HG2 ILE 6 1HG2 ILE 6 -1.053 -0.947 5.921 50 2HG2 ILE 6 2HG2 ILE 6 -2.456 -0.432 6.888 51 3HG2 ILE 6 3HG2 ILE 6 -0.902 -0.771 7.686 52 1HD1 ILE 6 1HD1 ILE 6 -5.015 -3.204 6.444 53 2HD1 ILE 6 2HD1 ILE 6 -4.212 -4.725 5.984 54 3HD1 ILE 6 3HD1 ILE 6 -3.906 -4.005 7.582 55 H LEU 7 H LEU 7 0.566 -2.377 5.183 56 HA LEU 7 HA LEU 7 2.540 -1.183 6.987 57 1HB LEU 7 1HB LEU 7 3.019 -3.414 5.386 58 2HB LEU 7 2HB LEU 7 3.686 -2.076 4.472 59 HG LEU 7 HG LEU 7 4.733 -1.502 6.892 60 1HD1 LEU 7 1HD1 LEU 7 3.566 -3.673 7.716 61 2HD1 LEU 7 2HD1 LEU 7 4.919 -4.501 6.907 62 3HD1 LEU 7 3HD1 LEU 7 5.242 -3.334 8.212 63 1HD2 LEU 7 1HD2 LEU 7 6.238 -3.578 5.402 64 2HD2 LEU 7 2HD2 LEU 7 5.706 -2.157 4.471 65 3HD2 LEU 7 3HD2 LEU 7 6.723 -1.945 5.917 66 H ILE 8 H ILE 8 3.330 0.848 6.330 67 HA ILE 8 HA ILE 8 2.061 1.903 3.902 68 HB ILE 8 HB ILE 8 2.231 3.109 6.652 69 1HG1 ILE 8 1HG1 ILE 8 -0.167 3.070 4.838 70 2HG1 ILE 8 2HG1 ILE 8 0.270 1.630 5.736 71 1HG2 ILE 8 1HG2 ILE 8 1.045 4.958 4.861 72 2HG2 ILE 8 2HG2 ILE 8 2.533 5.140 5.819 73 3HG2 ILE 8 3HG2 ILE 8 2.613 4.481 4.168 74 1HD1 ILE 8 1HD1 ILE 8 -0.825 4.215 6.718 75 2HD1 ILE 8 2HD1 ILE 8 -0.989 2.578 7.398 76 3HD1 ILE 8 3HD1 ILE 8 0.481 3.530 7.715 77 H VAL 9 H VAL 9 3.616 2.295 2.427 78 HA VAL 9 HA VAL 9 6.207 3.217 3.465 79 HB VAL 9 HB VAL 9 5.545 1.638 0.971 80 1HG1 VAL 9 1HG1 VAL 9 7.488 3.364 0.908 81 2HG1 VAL 9 2HG1 VAL 9 8.331 2.211 1.971 82 3HG1 VAL 9 3HG1 VAL 9 7.794 1.701 0.352 83 1HG2 VAL 9 1HG2 VAL 9 7.428 0.360 2.724 84 2HG2 VAL 9 2HG2 VAL 9 5.973 0.799 3.651 85 3HG2 VAL 9 3HG2 VAL 9 5.827 -0.207 2.190 86 H ASP 10 H ASP 10 6.964 5.181 2.775 87 HA ASP 10 HA ASP 10 6.893 7.178 1.926 88 1HB ASP 10 1HB ASP 10 5.755 5.952 -0.619 89 2HB ASP 10 2HB ASP 10 6.763 7.379 -0.489 90 H ASP 11 H ASP 11 5.324 8.792 0.458 91 HA ASP 11 HA ASP 11 3.401 9.771 0.210 92 1HB ASP 11 1HB ASP 11 2.681 7.334 -0.482 93 2HB ASP 11 2HB ASP 11 1.898 7.278 1.085 94 H GLN 12 H GLN 12 4.737 8.791 2.995 95 HA GLN 12 HA GLN 12 2.564 9.068 4.797 96 1HB GLN 12 1HB GLN 12 4.539 9.181 6.495 97 2HB GLN 12 2HB GLN 12 4.282 7.687 5.616 98 1HG GLN 12 1HG GLN 12 6.163 7.987 4.259 99 2HG GLN 12 2HG GLN 12 6.089 9.735 4.348 100 1HE2 GLN 12 1HE2 GLN 12 6.308 10.597 6.679 101 2HE2 GLN 12 2HE2 GLN 12 7.623 9.961 7.611 102 H TYR 13 H TYR 13 1.606 10.990 5.285 103 HA TYR 13 HA TYR 13 3.219 13.248 5.968 104 1HB TYR 13 1HB TYR 13 2.343 12.811 3.253 105 2HB TYR 13 2HB TYR 13 1.255 14.023 3.901 106 HD1 TYR 13 HD1 TYR 13 2.603 15.924 5.350 107 HD2 TYR 13 HD2 TYR 13 4.193 13.612 2.120 108 HE1 TYR 13 HE1 TYR 13 4.354 17.716 4.920 109 HE2 TYR 13 HE2 TYR 13 5.939 15.413 1.700 110 HH TYR 13 HH TYR 13 6.821 17.590 3.804 111 H GLY 14 H GLY 14 1.096 11.401 7.071 112 1HA GLY 14 1HA GLY 14 -0.318 12.199 8.833 113 2HA GLY 14 2HA GLY 14 -0.839 13.513 7.796 114 H ILE 15 H ILE 15 -0.609 11.084 5.608 115 HA ILE 15 HA ILE 15 -3.441 10.489 5.855 116 HB ILE 15 HB ILE 15 -1.470 9.959 3.628 117 1HG1 ILE 15 1HG1 ILE 15 -3.555 11.909 3.091 118 2HG1 ILE 15 2HG1 ILE 15 -2.590 12.392 4.472 119 1HG2 ILE 15 1HG2 ILE 15 -3.044 8.832 2.528 120 2HG2 ILE 15 2HG2 ILE 15 -3.913 8.724 4.077 121 3HG2 ILE 15 3HG2 ILE 15 -4.298 10.029 2.930 122 1HD1 ILE 15 1HD1 ILE 15 -1.563 11.666 1.693 123 2HD1 ILE 15 2HD1 ILE 15 -1.520 13.265 2.474 124 3HD1 ILE 15 3HD1 ILE 15 -0.503 11.943 3.096 125 H ARG 16 H ARG 16 -0.219 8.924 5.940 126 HA ARG 16 HA ARG 16 -1.024 6.333 5.783 127 1HB ARG 16 1HB ARG 16 1.066 5.900 7.264 128 2HB ARG 16 2HB ARG 16 1.326 6.770 5.766 129 1HG ARG 16 1HG ARG 16 1.443 8.901 6.904 130 2HG ARG 16 2HG ARG 16 0.809 8.225 8.392 131 1HD ARG 16 1HD ARG 16 3.358 7.051 7.271 132 2HD ARG 16 2HD ARG 16 3.444 8.617 8.052 133 HE ARG 16 HE ARG 16 2.839 6.039 9.347 134 1HH1 ARG 16 1HH1 ARG 16 2.794 9.546 9.636 135 2HH1 ARG 16 2HH1 ARG 16 2.742 9.531 11.367 136 1HH2 ARG 16 1HH2 ARG 16 2.770 6.018 11.631 137 2HH2 ARG 16 2HH2 ARG 16 2.728 7.510 12.510 138 H ILE 17 H ILE 17 -1.016 8.600 8.574 139 HA ILE 17 HA ILE 17 -1.622 6.641 10.516 140 HB ILE 17 HB ILE 17 -1.964 9.641 10.492 141 1HG1 ILE 17 1HG1 ILE 17 0.159 8.276 12.069 142 2HG1 ILE 17 2HG1 ILE 17 0.369 8.298 10.330 143 1HG2 ILE 17 1HG2 ILE 17 -3.281 8.021 12.193 144 2HG2 ILE 17 2HG2 ILE 17 -1.731 8.169 13.056 145 3HG2 ILE 17 3HG2 ILE 17 -2.661 9.629 12.640 146 1HD1 ILE 17 1HD1 ILE 17 0.767 10.550 10.277 147 2HD1 ILE 17 2HD1 ILE 17 -0.519 10.898 11.457 148 3HD1 ILE 17 3HD1 ILE 17 1.082 10.360 12.019 149 H LEU 18 H LEU 18 -3.590 8.892 8.496 150 HA LEU 18 HA LEU 18 -6.032 8.568 9.598 151 1HB LEU 18 1HB LEU 18 -5.201 9.875 7.522 152 2HB LEU 18 2HB LEU 18 -5.655 8.442 6.622 153 HG LEU 18 HG LEU 18 -7.939 8.827 8.019 154 1HD1 LEU 18 1HD1 LEU 18 -7.001 11.646 7.457 155 2HD1 LEU 18 2HD1 LEU 18 -8.499 11.118 8.261 156 3HD1 LEU 18 3HD1 LEU 18 -6.928 10.890 9.067 157 1HD2 LEU 18 1HD2 LEU 18 -7.595 8.550 5.549 158 2HD2 LEU 18 2HD2 LEU 18 -8.897 9.674 6.006 159 3HD2 LEU 18 3HD2 LEU 18 -7.328 10.307 5.451 160 H LEU 19 H LEU 19 -4.602 6.392 7.059 161 HA LEU 19 HA LEU 19 -6.706 4.508 7.371 162 1HB LEU 19 1HB LEU 19 -5.077 3.095 5.976 163 2HB LEU 19 2HB LEU 19 -5.822 4.512 5.263 164 HG LEU 19 HG LEU 19 -3.232 5.083 6.527 165 1HD1 LEU 19 1HD1 LEU 19 -3.370 3.100 4.243 166 2HD1 LEU 19 2HD1 LEU 19 -1.912 4.019 4.688 167 3HD1 LEU 19 3HD1 LEU 19 -2.629 2.871 5.845 168 1HD2 LEU 19 1HD2 LEU 19 -4.067 5.525 3.660 169 2HD2 LEU 19 2HD2 LEU 19 -4.639 6.558 4.992 170 3HD2 LEU 19 3HD2 LEU 19 -2.898 6.443 4.639 171 H ASN 20 H ASN 20 -3.725 5.218 9.048 172 HA ASN 20 HA ASN 20 -3.162 2.656 9.954 173 1HB ASN 20 1HB ASN 20 -1.671 4.746 10.089 174 2HB ASN 20 2HB ASN 20 -2.657 5.290 11.432 175 1HD2 ASN 20 1HD2 ASN 20 -0.345 5.173 12.283 176 2HD2 ASN 20 2HD2 ASN 20 0.112 3.726 13.118 177 H GLU 21 H GLU 21 -4.751 5.501 11.606 178 HA GLU 21 HA GLU 21 -5.484 4.198 13.883 179 1HB GLU 21 1HB GLU 21 -5.605 6.656 13.538 180 2HB GLU 21 2HB GLU 21 -6.956 6.449 12.442 181 1HG GLU 21 1HG GLU 21 -8.436 5.789 14.165 182 2HG GLU 21 2HG GLU 21 -7.139 5.278 15.227 183 H VAL 22 H VAL 22 -6.772 3.908 10.637 184 HA VAL 22 HA VAL 22 -9.347 2.974 11.376 185 HB VAL 22 HB VAL 22 -7.700 2.777 8.851 186 1HG1 VAL 22 1HG1 VAL 22 -9.958 1.226 9.542 187 2HG1 VAL 22 2HG1 VAL 22 -10.540 2.478 8.419 188 3HG1 VAL 22 3HG1 VAL 22 -9.204 1.404 7.939 189 1HG2 VAL 22 1HG2 VAL 22 -8.541 4.777 8.254 190 2HG2 VAL 22 2HG2 VAL 22 -10.161 4.394 8.883 191 3HG2 VAL 22 3HG2 VAL 22 -8.892 4.976 9.987 192 H PHE 23 H PHE 23 -6.279 1.355 10.304 193 HA PHE 23 HA PHE 23 -7.390 -1.227 10.821 194 1HB PHE 23 1HB PHE 23 -4.641 -0.036 10.157 195 2HB PHE 23 2HB PHE 23 -4.831 -1.758 10.426 196 HD1 PHE 23 HD1 PHE 23 -7.227 -2.505 9.061 197 HD2 PHE 23 HD2 PHE 23 -4.332 0.378 7.916 198 HE1 PHE 23 HE1 PHE 23 -7.876 -2.809 6.655 199 HE2 PHE 23 HE2 PHE 23 -4.980 0.074 5.510 200 HZ PHE 23 HZ PHE 23 -6.744 -1.516 4.909 201 H ASN 24 H ASN 24 -5.499 1.196 12.590 202 HA ASN 24 HA ASN 24 -4.479 -0.610 14.483 203 1HB ASN 24 1HB ASN 24 -3.936 1.991 13.839 204 2HB ASN 24 2HB ASN 24 -4.962 2.268 15.233 205 1HD2 ASN 24 1HD2 ASN 24 -4.416 1.288 17.251 206 2HD2 ASN 24 2HD2 ASN 24 -2.771 0.925 17.654 207 H LYS 25 H LYS 25 -7.438 1.362 14.081 208 HA LYS 25 HA LYS 25 -8.379 1.418 16.663 209 1HB LYS 25 1HB LYS 25 -9.462 1.744 13.958 210 2HB LYS 25 2HB LYS 25 -10.646 1.128 15.093 211 1HG LYS 25 1HG LYS 25 -9.925 2.998 16.701 212 2HG LYS 25 2HG LYS 25 -8.975 3.664 15.387 213 1HD LYS 25 1HD LYS 25 -10.931 4.836 15.005 214 2HD LYS 25 2HD LYS 25 -11.301 3.414 14.050 215 1HE LYS 25 1HE LYS 25 -12.237 2.494 16.396 216 2HE LYS 25 2HE LYS 25 -12.355 4.202 16.768 217 1HZ LYS 25 1HZ LYS 25 -13.907 4.512 15.167 218 2HZ LYS 25 2HZ LYS 25 -13.385 3.294 14.213 219 3HZ LYS 25 3HZ LYS 25 -14.259 2.965 15.552 220 H GLU 26 H GLU 26 -7.902 -1.295 14.524 221 HA GLU 26 HA GLU 26 -9.745 -2.907 16.056 222 1HB GLU 26 1HB GLU 26 -8.018 -3.595 13.636 223 2HB GLU 26 2HB GLU 26 -9.175 -4.681 14.380 224 1HG GLU 26 1HG GLU 26 -10.419 -2.090 13.819 225 2HG GLU 26 2HG GLU 26 -9.691 -2.747 12.366 226 H GLY 27 H GLY 27 -6.374 -2.043 15.888 227 1HA GLY 27 1HA GLY 27 -4.944 -2.560 17.690 228 2HA GLY 27 2HA GLY 27 -5.777 -4.084 17.923 229 H TYR 28 H TYR 28 -5.101 -3.066 14.613 230 HA TYR 28 HA TYR 28 -3.423 -5.368 14.252 231 1HB TYR 28 1HB TYR 28 -4.175 -2.988 12.444 232 2HB TYR 28 2HB TYR 28 -3.554 -4.525 11.875 233 HD1 TYR 28 HD1 TYR 28 -6.047 -3.378 10.794 234 HD2 TYR 28 HD2 TYR 28 -5.434 -5.898 14.196 235 HE1 TYR 28 HE1 TYR 28 -8.422 -4.259 10.578 236 HE2 TYR 28 HE2 TYR 28 -7.811 -6.771 13.969 237 HH TYR 28 HH TYR 28 -9.596 -6.447 11.254 238 H GLN 29 H GLN 29 -1.235 -5.368 13.494 239 HA GLN 29 HA GLN 29 0.210 -3.086 14.494 240 1HB GLN 29 1HB GLN 29 0.670 -5.895 14.399 241 2HB GLN 29 2HB GLN 29 1.896 -5.177 13.373 242 1HG GLN 29 1HG GLN 29 2.737 -3.793 15.147 243 2HG GLN 29 2HG GLN 29 1.310 -4.043 16.134 244 1HE2 GLN 29 1HE2 GLN 29 1.005 -5.956 17.246 245 2HE2 GLN 29 2HE2 GLN 29 2.273 -7.100 17.537 246 H THR 30 H THR 30 0.857 -1.450 13.168 247 HA THR 30 HA THR 30 1.266 -2.118 10.327 248 HB THR 30 HB THR 30 0.434 0.287 9.961 249 HG1 THR 30 HG1 THR 30 0.273 1.310 11.918 250 1HG2 THR 30 1HG2 THR 30 -1.088 -2.059 10.359 251 2HG2 THR 30 2HG2 THR 30 -1.861 -0.853 11.416 252 3HG2 THR 30 3HG2 THR 30 -1.688 -0.529 9.674 253 H PHE 31 H PHE 31 3.018 -1.185 9.256 254 HA PHE 31 HA PHE 31 4.853 0.275 11.017 255 1HB PHE 31 1HB PHE 31 5.073 -2.359 9.934 256 2HB PHE 31 2HB PHE 31 6.059 -1.378 8.868 257 HD1 PHE 31 HD1 PHE 31 8.058 -0.244 9.714 258 HD2 PHE 31 HD2 PHE 31 5.723 -2.738 12.232 259 HE1 PHE 31 HE1 PHE 31 9.941 -0.335 11.371 260 HE2 PHE 31 HE2 PHE 31 7.606 -2.828 13.889 261 HZ PHE 31 HZ PHE 31 9.692 -1.625 13.439 262 H GLN 32 H GLN 32 6.597 1.464 9.714 263 HA GLN 32 HA GLN 32 5.477 2.279 7.149 264 1HB GLN 32 1HB GLN 32 4.988 4.220 8.278 265 2HB GLN 32 2HB GLN 32 6.174 3.922 9.534 266 1HG GLN 32 1HG GLN 32 7.977 4.759 8.203 267 2HG GLN 32 2HG GLN 32 7.064 4.620 6.714 268 1HE2 GLN 32 1HE2 GLN 32 7.641 6.456 9.600 269 2HE2 GLN 32 2HE2 GLN 32 6.764 7.888 9.176 270 H ALA 33 H ALA 33 7.023 2.841 5.503 271 HA ALA 33 HA ALA 33 9.809 2.259 6.222 272 1HB ALA 33 1HB ALA 33 9.274 1.430 3.530 273 2HB ALA 33 2HB ALA 33 9.786 0.435 4.914 274 3HB ALA 33 3HB ALA 33 8.054 0.687 4.591 275 H ALA 34 H ALA 34 11.319 3.064 4.376 276 HA ALA 34 HA ALA 34 10.176 5.509 3.215 277 1HB ALA 34 1HB ALA 34 11.699 5.700 5.358 278 2HB ALA 34 2HB ALA 34 13.021 5.389 4.207 279 3HB ALA 34 3HB ALA 34 11.959 6.800 3.983 280 H ASN 35 H ASN 35 10.189 3.102 1.822 281 HA ASN 35 HA ASN 35 11.356 3.721 -0.489 282 1HB ASN 35 1HB ASN 35 13.374 2.690 1.392 283 2HB ASN 35 2HB ASN 35 13.263 1.664 -0.024 284 1HD2 ASN 35 1HD2 ASN 35 12.876 3.088 -2.118 285 2HD2 ASN 35 2HD2 ASN 35 14.042 4.345 -2.362 286 H GLY 36 H GLY 36 12.046 1.310 -1.684 287 1HA GLY 36 1HA GLY 36 9.638 -0.270 -1.314 288 2HA GLY 36 2HA GLY 36 10.829 -0.409 -2.592 289 H LEU 37 H LEU 37 13.239 -0.813 -1.343 290 HA LEU 37 HA LEU 37 13.172 -3.482 -0.680 291 1HB LEU 37 1HB LEU 37 15.081 -1.524 -1.124 292 2HB LEU 37 2HB LEU 37 15.385 -2.018 0.529 293 HG LEU 37 HG LEU 37 15.091 -4.088 -1.636 294 1HD1 LEU 37 1HD1 LEU 37 16.721 -2.761 -2.654 295 2HD1 LEU 37 2HD1 LEU 37 17.485 -2.337 -1.104 296 3HD1 LEU 37 3HD1 LEU 37 17.656 -3.983 -1.760 297 1HD2 LEU 37 1HD2 LEU 37 15.440 -5.438 0.090 298 2HD2 LEU 37 2HD2 LEU 37 17.086 -4.772 0.217 299 3HD2 LEU 37 3HD2 LEU 37 15.761 -4.063 1.173 300 H GLN 38 H GLN 38 13.562 -0.648 1.566 301 HA GLN 38 HA GLN 38 13.597 -2.039 3.880 302 1HB GLN 38 1HB GLN 38 12.825 0.714 3.058 303 2HB GLN 38 2HB GLN 38 12.170 0.209 4.603 304 1HG GLN 38 1HG GLN 38 14.303 -0.087 5.573 305 2HG GLN 38 2HG GLN 38 15.093 -0.313 4.025 306 1HE2 GLN 38 1HE2 GLN 38 15.320 1.588 6.426 307 2HE2 GLN 38 2HE2 GLN 38 15.471 3.165 5.726 308 H ALA 39 H ALA 39 10.890 -1.499 1.685 309 HA ALA 39 HA ALA 39 8.917 -2.223 3.663 310 1HB ALA 39 1HB ALA 39 7.373 -1.554 2.075 311 2HB ALA 39 2HB ALA 39 8.784 -0.600 1.557 312 3HB ALA 39 3HB ALA 39 8.371 -2.111 0.711 313 H LEU 40 H LEU 40 10.862 -3.707 1.078 314 HA LEU 40 HA LEU 40 9.334 -6.023 0.753 315 1HB LEU 40 1HB LEU 40 12.161 -5.219 0.209 316 2HB LEU 40 2HB LEU 40 11.719 -6.910 0.082 317 HG LEU 40 HG LEU 40 10.689 -4.582 -1.538 318 1HD1 LEU 40 1HD1 LEU 40 12.654 -6.643 -1.929 319 2HD1 LEU 40 2HD1 LEU 40 11.351 -6.818 -3.129 320 3HD1 LEU 40 3HD1 LEU 40 12.223 -5.274 -2.981 321 1HD2 LEU 40 1HD2 LEU 40 8.662 -5.566 -1.412 322 2HD2 LEU 40 2HD2 LEU 40 9.361 -6.662 -2.628 323 3HD2 LEU 40 3HD2 LEU 40 9.329 -7.140 -0.914 324 H ASP 41 H ASP 41 11.961 -5.135 3.051 325 HA ASP 41 HA ASP 41 12.093 -7.713 4.151 326 1HB ASP 41 1HB ASP 41 13.625 -5.437 4.298 327 2HB ASP 41 2HB ASP 41 12.810 -5.352 5.847 328 H ILE 42 H ILE 42 10.732 -4.527 5.300 329 HA ILE 42 HA ILE 42 9.569 -5.511 7.624 330 HB ILE 42 HB ILE 42 8.904 -3.138 5.884 331 1HG1 ILE 42 1HG1 ILE 42 11.158 -3.627 7.367 332 2HG1 ILE 42 2HG1 ILE 42 10.561 -2.044 6.911 333 1HG2 ILE 42 1HG2 ILE 42 7.605 -2.243 7.696 334 2HG2 ILE 42 2HG2 ILE 42 6.962 -3.847 7.271 335 3HG2 ILE 42 3HG2 ILE 42 7.975 -3.650 8.721 336 1HD1 ILE 42 1HD1 ILE 42 10.993 -2.140 9.342 337 2HD1 ILE 42 2HD1 ILE 42 9.255 -1.914 9.032 338 3HD1 ILE 42 3HD1 ILE 42 9.875 -3.516 9.497 339 H VAL 43 H VAL 43 8.628 -5.755 4.238 340 HA VAL 43 HA VAL 43 5.905 -6.113 4.495 341 HB VAL 43 HB VAL 43 8.033 -6.763 2.577 342 1HG1 VAL 43 1HG1 VAL 43 5.581 -8.498 2.816 343 2HG1 VAL 43 2HG1 VAL 43 6.305 -8.167 1.224 344 3HG1 VAL 43 3HG1 VAL 43 7.269 -8.962 2.492 345 1HG2 VAL 43 1HG2 VAL 43 5.274 -6.076 1.713 346 2HG2 VAL 43 2HG2 VAL 43 6.099 -4.880 2.742 347 3HG2 VAL 43 3HG2 VAL 43 6.841 -5.398 1.209 348 H THR 44 H THR 44 8.511 -8.654 4.490 349 HA THR 44 HA THR 44 6.642 -10.649 5.360 350 HB THR 44 HB THR 44 9.698 -10.745 5.258 351 HG1 THR 44 HG1 THR 44 9.383 -10.904 3.034 352 1HG2 THR 44 1HG2 THR 44 9.451 -13.072 5.056 353 2HG2 THR 44 2HG2 THR 44 8.080 -12.714 6.133 354 3HG2 THR 44 3HG2 THR 44 7.806 -12.937 4.388 355 H LYS 45 H LYS 45 9.082 -8.524 6.883 356 HA LYS 45 HA LYS 45 9.224 -9.825 9.325 357 1HB LYS 45 1HB LYS 45 10.229 -7.476 8.153 358 2HB LYS 45 2HB LYS 45 9.370 -6.937 9.581 359 1HG LYS 45 1HG LYS 45 10.743 -9.258 10.432 360 2HG LYS 45 2HG LYS 45 11.886 -8.442 9.384 361 1HD LYS 45 1HD LYS 45 11.834 -6.431 10.696 362 2HD LYS 45 2HD LYS 45 10.369 -6.911 11.530 363 1HE LYS 45 1HE LYS 45 11.864 -7.513 13.181 364 2HE LYS 45 2HE LYS 45 11.935 -9.001 12.259 365 1HZ LYS 45 1HZ LYS 45 13.734 -7.558 10.989 366 2HZ LYS 45 2HZ LYS 45 13.890 -6.908 12.478 367 3HZ LYS 45 3HZ LYS 45 14.101 -8.513 12.262 368 H GLU 46 H GLU 46 6.849 -7.454 8.030 369 HA GLU 46 HA GLU 46 5.378 -7.755 10.519 370 1HB GLU 46 1HB GLU 46 5.619 -5.611 8.462 371 2HB GLU 46 2HB GLU 46 4.005 -5.841 9.104 372 1HG GLU 46 1HG GLU 46 5.935 -5.933 11.284 373 2HG GLU 46 2HG GLU 46 6.192 -4.479 10.339 374 H ARG 47 H ARG 47 5.617 -9.146 7.476 375 HA ARG 47 HA ARG 47 4.098 -9.900 6.005 376 1HB ARG 47 1HB ARG 47 3.002 -11.958 7.033 377 2HB ARG 47 2HB ARG 47 4.721 -11.824 7.350 378 1HG ARG 47 1HG ARG 47 4.364 -11.764 9.589 379 2HG ARG 47 2HG ARG 47 3.281 -10.396 9.425 380 1HD ARG 47 1HD ARG 47 1.970 -12.159 10.412 381 2HD ARG 47 2HD ARG 47 1.442 -12.049 8.745 382 HE ARG 47 HE ARG 47 3.612 -13.935 8.948 383 1HH1 ARG 47 1HH1 ARG 47 0.194 -13.585 9.709 384 2HH1 ARG 47 2HH1 ARG 47 -0.131 -15.284 9.620 385 1HH2 ARG 47 1HH2 ARG 47 3.184 -16.176 8.831 386 2HH2 ARG 47 2HH2 ARG 47 1.581 -16.768 9.118 387 HA PRO 48 HA PRO 48 0.409 -7.622 7.542 388 1HB PRO 48 1HB PRO 48 0.422 -5.539 5.772 389 2HB PRO 48 2HB PRO 48 1.118 -5.438 7.377 390 1HG PRO 48 1HG PRO 48 2.494 -5.683 4.772 391 2HG PRO 48 2HG PRO 48 3.146 -5.161 6.313 392 1HD PRO 48 1HD PRO 48 3.522 -7.718 5.068 393 2HD PRO 48 2HD PRO 48 4.075 -7.235 6.659 394 H ASP 49 H ASP 49 -1.727 -7.298 6.580 395 HA ASP 49 HA ASP 49 -1.983 -9.267 4.521 396 1HB ASP 49 1HB ASP 49 -3.970 -7.587 6.109 397 2HB ASP 49 2HB ASP 49 -4.486 -8.658 4.821 398 H LEU 50 H LEU 50 -1.323 -5.951 4.687 399 HA LEU 50 HA LEU 50 -1.987 -5.577 1.927 400 1HB LEU 50 1HB LEU 50 -3.661 -4.421 4.074 401 2HB LEU 50 2HB LEU 50 -3.163 -3.309 2.815 402 HG LEU 50 HG LEU 50 -4.965 -5.690 2.652 403 1HD1 LEU 50 1HD1 LEU 50 -5.019 -2.814 1.781 404 2HD1 LEU 50 2HD1 LEU 50 -6.105 -4.009 1.034 405 3HD1 LEU 50 3HD1 LEU 50 -6.174 -3.720 2.788 406 1HD2 LEU 50 1HD2 LEU 50 -3.112 -4.776 0.470 407 2HD2 LEU 50 2HD2 LEU 50 -3.550 -6.426 0.974 408 3HD2 LEU 50 3HD2 LEU 50 -4.721 -5.429 0.078 409 H VAL 51 H VAL 51 -0.825 -3.797 1.005 410 HA VAL 51 HA VAL 51 0.969 -2.427 2.866 411 HB VAL 51 HB VAL 51 1.866 -3.711 0.282 412 1HG1 VAL 51 1HG1 VAL 51 3.490 -2.555 2.573 413 2HG1 VAL 51 2HG1 VAL 51 4.105 -3.177 1.023 414 3HG1 VAL 51 3HG1 VAL 51 3.118 -1.696 1.059 415 1HG2 VAL 51 1HG2 VAL 51 2.593 -4.712 3.037 416 2HG2 VAL 51 2HG2 VAL 51 1.155 -5.313 2.178 417 3HG2 VAL 51 3HG2 VAL 51 2.771 -5.524 1.463 418 H LEU 52 H LEU 52 1.352 -0.279 2.342 419 HA LEU 52 HA LEU 52 0.104 0.621 -0.162 420 1HB LEU 52 1HB LEU 52 -1.370 1.438 1.372 421 2HB LEU 52 2HB LEU 52 -0.165 1.591 2.635 422 HG LEU 52 HG LEU 52 0.063 3.402 0.267 423 1HD1 LEU 52 1HD1 LEU 52 -2.134 3.520 2.317 424 2HD1 LEU 52 2HD1 LEU 52 -1.482 5.008 1.589 425 3HD1 LEU 52 3HD1 LEU 52 -2.212 3.756 0.555 426 1HD2 LEU 52 1HD2 LEU 52 0.550 4.960 2.356 427 2HD2 LEU 52 2HD2 LEU 52 0.852 3.394 3.146 428 3HD2 LEU 52 3HD2 LEU 52 1.780 3.855 1.698 429 H LEU 53 H LEU 53 1.581 1.367 -1.575 430 HA LEU 53 HA LEU 53 3.863 2.823 -0.462 431 1HB LEU 53 1HB LEU 53 4.714 0.640 -0.859 432 2HB LEU 53 2HB LEU 53 3.942 0.541 -2.428 433 HG LEU 53 HG LEU 53 6.455 0.935 -2.383 434 1HD1 LEU 53 1HD1 LEU 53 5.022 1.240 -4.378 435 2HD1 LEU 53 2HD1 LEU 53 4.795 2.947 -3.925 436 3HD1 LEU 53 3HD1 LEU 53 6.417 2.345 -4.344 437 1HD2 LEU 53 1HD2 LEU 53 6.302 3.803 -2.241 438 2HD2 LEU 53 2HD2 LEU 53 5.708 3.089 -0.723 439 3HD2 LEU 53 3HD2 LEU 53 7.331 2.675 -1.326 440 H ASP 54 H ASP 54 4.618 4.548 -1.764 441 HA ASP 54 HA ASP 54 2.714 5.226 -3.856 442 1HB ASP 54 1HB ASP 54 2.666 7.062 -2.445 443 2HB ASP 54 2HB ASP 54 4.281 6.767 -1.832 444 H MET 55 H MET 55 3.744 6.520 -5.754 445 HA MET 55 HA MET 55 6.033 5.081 -6.632 446 1HB MET 55 1HB MET 55 4.257 7.282 -7.795 447 2HB MET 55 2HB MET 55 5.674 6.723 -8.661 448 1HG MET 55 1HG MET 55 3.795 5.440 -9.491 449 2HG MET 55 2HG MET 55 4.754 4.351 -8.508 450 1HE MET 55 1HE MET 55 3.169 2.740 -6.622 451 2HE MET 55 2HE MET 55 4.489 3.877 -6.257 452 3HE MET 55 3HE MET 55 2.992 3.914 -5.296 453 H LYS 56 H LYS 56 5.646 8.566 -7.327 454 HA LYS 56 HA LYS 56 8.185 9.306 -7.315 455 1HB LYS 56 1HB LYS 56 5.649 10.617 -6.941 456 2HB LYS 56 2HB LYS 56 6.850 11.392 -5.928 457 1HG LYS 56 1HG LYS 56 8.392 11.518 -7.940 458 2HG LYS 56 2HG LYS 56 7.097 10.868 -8.927 459 1HD LYS 56 1HD LYS 56 5.637 12.809 -8.226 460 2HD LYS 56 2HD LYS 56 6.991 13.472 -7.332 461 1HE LYS 56 1HE LYS 56 8.148 14.094 -9.254 462 2HE LYS 56 2HE LYS 56 7.513 12.765 -10.203 463 1HZ LYS 56 1HZ LYS 56 5.319 13.982 -9.993 464 2HZ LYS 56 2HZ LYS 56 6.193 15.280 -9.525 465 3HZ LYS 56 3HZ LYS 56 6.436 14.621 -11.000 466 H ILE 57 H ILE 57 9.896 9.644 -5.933 467 HA ILE 57 HA ILE 57 9.731 10.151 -3.244 468 HB ILE 57 HB ILE 57 8.860 7.567 -3.688 469 1HG1 ILE 57 1HG1 ILE 57 9.098 7.364 -1.197 470 2HG1 ILE 57 2HG1 ILE 57 9.989 8.873 -1.197 471 1HG2 ILE 57 1HG2 ILE 57 11.085 6.783 -4.235 472 2HG2 ILE 57 2HG2 ILE 57 11.736 7.488 -2.737 473 3HG2 ILE 57 3HG2 ILE 57 10.585 6.133 -2.656 474 1HD1 ILE 57 1HD1 ILE 57 7.669 9.387 -0.707 475 2HD1 ILE 57 2HD1 ILE 57 8.007 9.969 -2.355 476 3HD1 ILE 57 3HD1 ILE 57 7.111 8.450 -2.114 477 HA PRO 58 HA PRO 58 13.888 10.666 -4.333 478 1HB PRO 58 1HB PRO 58 14.860 11.581 -1.948 479 2HB PRO 58 2HB PRO 58 14.034 12.608 -3.103 480 1HG PRO 58 1HG PRO 58 13.030 11.511 -0.548 481 2HG PRO 58 2HG PRO 58 12.404 12.850 -1.489 482 1HD PRO 58 1HD PRO 58 11.314 10.201 -1.338 483 2HD PRO 58 2HD PRO 58 10.758 11.506 -2.367 484 H GLY 59 H GLY 59 15.453 9.249 -4.759 485 1HA GLY 59 1HA GLY 59 17.087 7.751 -4.143 486 2HA GLY 59 2HA GLY 59 16.383 7.605 -2.545 487 H MET 60 H MET 60 16.408 6.386 -5.850 488 HA MET 60 HA MET 60 15.594 4.596 -6.775 489 1HB MET 60 1HB MET 60 16.529 3.257 -5.002 490 2HB MET 60 2HB MET 60 15.359 3.833 -3.831 491 1HG MET 60 1HG MET 60 13.990 2.086 -4.306 492 2HG MET 60 2HG MET 60 13.885 2.597 -5.979 493 1HE MET 60 1HE MET 60 13.724 0.945 -7.167 494 2HE MET 60 2HE MET 60 15.127 0.088 -7.849 495 3HE MET 60 3HE MET 60 14.123 -0.696 -6.606 496 H ASP 61 H ASP 61 13.813 5.598 -7.822 497 HA ASP 61 HA ASP 61 11.473 6.297 -6.608 498 1HB ASP 61 1HB ASP 61 10.582 5.618 -9.088 499 2HB ASP 61 2HB ASP 61 11.479 7.089 -8.763 500 H GLY 62 H GLY 62 9.243 5.102 -7.492 501 1HA GLY 62 1HA GLY 62 9.363 2.421 -6.363 502 2HA GLY 62 2HA GLY 62 7.935 3.364 -6.740 503 H ILE 63 H ILE 63 9.101 4.062 -9.501 504 HA ILE 63 HA ILE 63 7.747 2.297 -11.028 505 HB ILE 63 HB ILE 63 9.763 4.329 -11.407 506 1HG1 ILE 63 1HG1 ILE 63 7.195 4.145 -11.977 507 2HG1 ILE 63 2HG1 ILE 63 8.276 5.127 -12.945 508 1HG2 ILE 63 1HG2 ILE 63 11.217 2.746 -12.366 509 2HG2 ILE 63 2HG2 ILE 63 9.890 1.902 -13.198 510 3HG2 ILE 63 3HG2 ILE 63 10.392 3.521 -13.739 511 1HD1 ILE 63 1HD1 ILE 63 6.638 3.377 -14.101 512 2HD1 ILE 63 2HD1 ILE 63 8.283 3.623 -14.735 513 3HD1 ILE 63 3HD1 ILE 63 7.931 2.223 -13.694 514 H GLU 64 H GLU 64 11.154 2.011 -9.877 515 HA GLU 64 HA GLU 64 11.355 -0.538 -11.185 516 1HB GLU 64 1HB GLU 64 13.247 1.277 -9.690 517 2HB GLU 64 2HB GLU 64 13.672 -0.414 -9.868 518 1HG GLU 64 1HG GLU 64 12.811 1.261 -12.260 519 2HG GLU 64 2HG GLU 64 14.476 1.242 -11.713 520 H ILE 65 H ILE 65 11.327 0.831 -7.833 521 HA ILE 65 HA ILE 65 11.751 -1.431 -6.390 522 HB ILE 65 HB ILE 65 10.354 1.129 -5.988 523 1HG1 ILE 65 1HG1 ILE 65 12.699 0.911 -5.465 524 2HG1 ILE 65 2HG1 ILE 65 11.795 1.175 -3.987 525 1HG2 ILE 65 1HG2 ILE 65 9.472 0.440 -3.765 526 2HG2 ILE 65 2HG2 ILE 65 8.604 -0.282 -5.141 527 3HG2 ILE 65 3HG2 ILE 65 9.771 -1.256 -4.215 528 1HD1 ILE 65 1HD1 ILE 65 11.737 -1.525 -3.981 529 2HD1 ILE 65 2HD1 ILE 65 13.224 -1.290 -4.930 530 3HD1 ILE 65 3HD1 ILE 65 13.097 -0.607 -3.291 531 H LEU 66 H LEU 66 8.467 -0.188 -7.347 532 HA LEU 66 HA LEU 66 7.092 -2.438 -6.520 533 1HB LEU 66 1HB LEU 66 6.538 -0.303 -8.564 534 2HB LEU 66 2HB LEU 66 5.407 -1.612 -8.284 535 HG LEU 66 HG LEU 66 4.524 -0.047 -6.889 536 1HD1 LEU 66 1HD1 LEU 66 4.848 -0.678 -4.675 537 2HD1 LEU 66 2HD1 LEU 66 5.408 -2.099 -5.590 538 3HD1 LEU 66 3HD1 LEU 66 6.591 -0.961 -4.902 539 1HD2 LEU 66 1HD2 LEU 66 7.016 1.062 -5.720 540 2HD2 LEU 66 2HD2 LEU 66 6.705 1.424 -7.435 541 3HD2 LEU 66 3HD2 LEU 66 5.504 1.870 -6.199 542 H LYS 67 H LYS 67 8.839 -1.730 -9.568 543 HA LYS 67 HA LYS 67 7.856 -3.887 -11.032 544 1HB LYS 67 1HB LYS 67 9.843 -1.829 -11.306 545 2HB LYS 67 2HB LYS 67 10.546 -3.357 -11.795 546 1HG LYS 67 1HG LYS 67 8.149 -3.619 -13.034 547 2HG LYS 67 2HG LYS 67 8.216 -1.869 -12.983 548 1HD LYS 67 1HD LYS 67 10.107 -1.752 -14.370 549 2HD LYS 67 2HD LYS 67 10.679 -3.344 -13.910 550 1HE LYS 67 1HE LYS 67 9.014 -4.448 -15.275 551 2HE LYS 67 2HE LYS 67 8.107 -2.966 -15.500 552 1HZ LYS 67 1HZ LYS 67 9.874 -2.087 -16.792 553 2HZ LYS 67 2HZ LYS 67 10.854 -3.352 -16.466 554 3HZ LYS 67 3HZ LYS 67 9.522 -3.567 -17.387 555 H ARG 68 H ARG 68 11.068 -3.618 -9.342 556 HA ARG 68 HA ARG 68 11.708 -6.247 -9.625 557 1HB ARG 68 1HB ARG 68 12.530 -4.007 -7.824 558 2HB ARG 68 2HB ARG 68 12.908 -5.607 -7.217 559 1HG ARG 68 1HG ARG 68 14.154 -6.158 -9.258 560 2HG ARG 68 2HG ARG 68 13.639 -4.671 -10.029 561 1HD ARG 68 1HD ARG 68 15.745 -4.013 -9.276 562 2HD ARG 68 2HD ARG 68 14.777 -3.525 -7.900 563 HE ARG 68 HE ARG 68 16.658 -5.787 -8.008 564 1HH1 ARG 68 1HH1 ARG 68 13.990 -4.288 -6.272 565 2HH1 ARG 68 2HH1 ARG 68 14.338 -5.097 -4.781 566 1HH2 ARG 68 1HH2 ARG 68 17.117 -6.856 -6.041 567 2HH2 ARG 68 2HH2 ARG 68 16.129 -6.568 -4.649 568 H MET 69 H MET 69 9.695 -4.592 -7.160 569 HA MET 69 HA MET 69 9.601 -6.557 -5.266 570 1HB MET 69 1HB MET 69 8.121 -4.156 -6.028 571 2HB MET 69 2HB MET 69 6.979 -5.380 -5.511 572 1HG MET 69 1HG MET 69 7.798 -5.433 -3.323 573 2HG MET 69 2HG MET 69 9.428 -5.005 -3.802 574 1HE MET 69 1HE MET 69 6.266 -3.953 -2.268 575 2HE MET 69 2HE MET 69 6.005 -2.240 -2.676 576 3HE MET 69 3HE MET 69 5.717 -3.501 -3.900 577 H LYS 70 H LYS 70 7.312 -6.030 -8.046 578 HA LYS 70 HA LYS 70 5.908 -8.436 -7.508 579 1HB LYS 70 1HB LYS 70 4.510 -7.794 -9.212 580 2HB LYS 70 2HB LYS 70 5.167 -6.242 -8.731 581 1HG LYS 70 1HG LYS 70 5.341 -6.276 -11.116 582 2HG LYS 70 2HG LYS 70 6.969 -6.571 -10.540 583 1HD LYS 70 1HD LYS 70 7.031 -8.560 -11.622 584 2HD LYS 70 2HD LYS 70 5.630 -9.121 -10.731 585 1HE LYS 70 1HE LYS 70 4.831 -7.197 -12.791 586 2HE LYS 70 2HE LYS 70 5.760 -8.504 -13.499 587 1HZ LYS 70 1HZ LYS 70 3.148 -8.563 -12.464 588 2HZ LYS 70 2HZ LYS 70 3.926 -9.690 -13.355 589 3HZ LYS 70 3HZ LYS 70 4.065 -9.697 -11.728 590 H VAL 71 H VAL 71 8.526 -7.440 -9.779 591 HA VAL 71 HA VAL 71 8.612 -9.813 -11.227 592 HB VAL 71 HB VAL 71 10.857 -7.904 -10.546 593 1HG1 VAL 71 1HG1 VAL 71 11.023 -8.953 -13.197 594 2HG1 VAL 71 2HG1 VAL 71 12.153 -9.175 -11.839 595 3HG1 VAL 71 3HG1 VAL 71 10.810 -10.319 -12.076 596 1HG2 VAL 71 1HG2 VAL 71 10.041 -6.391 -12.005 597 2HG2 VAL 71 2HG2 VAL 71 9.482 -7.639 -13.145 598 3HG2 VAL 71 3HG2 VAL 71 8.487 -7.215 -11.731 599 H ILE 72 H ILE 72 9.745 -8.958 -7.985 600 HA ILE 72 HA ILE 72 11.451 -11.266 -7.805 601 HB ILE 72 HB ILE 72 10.658 -9.012 -6.006 602 1HG1 ILE 72 1HG1 ILE 72 12.516 -8.809 -7.672 603 2HG1 ILE 72 2HG1 ILE 72 12.983 -8.510 -6.010 604 1HG2 ILE 72 1HG2 ILE 72 11.358 -11.717 -5.135 605 2HG2 ILE 72 2HG2 ILE 72 12.446 -10.464 -4.493 606 3HG2 ILE 72 3HG2 ILE 72 10.692 -10.346 -4.217 607 1HD1 ILE 72 1HD1 ILE 72 14.648 -10.017 -6.380 608 2HD1 ILE 72 2HD1 ILE 72 13.379 -11.259 -6.248 609 3HD1 ILE 72 3HD1 ILE 72 13.860 -10.645 -7.848 610 H ASP 73 H ASP 73 8.296 -10.174 -6.386 611 HA ASP 73 HA ASP 73 7.707 -13.006 -6.048 612 1HB ASP 73 1HB ASP 73 6.232 -11.421 -4.134 613 2HB ASP 73 2HB ASP 73 7.360 -12.726 -3.826 614 H GLU 74 H GLU 74 5.720 -13.556 -7.000 615 HA GLU 74 HA GLU 74 4.189 -11.358 -8.073 616 1HB GLU 74 1HB GLU 74 3.327 -12.887 -9.638 617 2HB GLU 74 2HB GLU 74 4.958 -13.475 -9.386 618 1HG GLU 74 1HG GLU 74 4.055 -15.092 -7.654 619 2HG GLU 74 2HG GLU 74 2.434 -14.554 -8.046 620 H ASN 75 H ASN 75 4.294 -12.935 -5.181 621 HA ASN 75 HA ASN 75 1.417 -13.209 -4.966 622 1HB ASN 75 1HB ASN 75 3.349 -14.878 -4.056 623 2HB ASN 75 2HB ASN 75 3.296 -13.804 -2.673 624 1HD2 ASN 75 1HD2 ASN 75 1.110 -13.305 -1.797 625 2HD2 ASN 75 2HD2 ASN 75 -0.052 -14.586 -1.700 626 H ILE 76 H ILE 76 3.971 -10.985 -4.479 627 HA ILE 76 HA ILE 76 3.297 -9.851 -2.011 628 HB ILE 76 HB ILE 76 5.413 -9.589 -3.358 629 1HG1 ILE 76 1HG1 ILE 76 3.990 -7.281 -2.039 630 2HG1 ILE 76 2HG1 ILE 76 5.230 -8.329 -1.379 631 1HG2 ILE 76 1HG2 ILE 76 3.855 -8.780 -5.391 632 2HG2 ILE 76 2HG2 ILE 76 4.274 -7.196 -4.695 633 3HG2 ILE 76 3HG2 ILE 76 5.562 -8.309 -5.216 634 1HD1 ILE 76 1HD1 ILE 76 6.603 -6.564 -1.907 635 2HD1 ILE 76 2HD1 ILE 76 6.592 -7.316 -3.520 636 3HD1 ILE 76 3HD1 ILE 76 5.503 -5.954 -3.167 637 H ARG 77 H ARG 77 1.820 -8.301 -1.387 638 HA ARG 77 HA ARG 77 0.066 -7.396 -3.530 639 1HB ARG 77 1HB ARG 77 -1.312 -8.856 -2.269 640 2HB ARG 77 2HB ARG 77 -0.547 -8.434 -0.750 641 1HG ARG 77 1HG ARG 77 -1.753 -6.420 -0.535 642 2HG ARG 77 2HG ARG 77 -2.027 -6.274 -2.260 643 1HD ARG 77 1HD ARG 77 -4.115 -6.907 -1.046 644 2HD ARG 77 2HD ARG 77 -3.652 -8.130 -2.213 645 HE ARG 77 HE ARG 77 -3.421 -8.352 0.747 646 1HH1 ARG 77 1HH1 ARG 77 -2.970 -9.812 -2.423 647 2HH1 ARG 77 2HH1 ARG 77 -2.796 -11.419 -1.799 648 1HH2 ARG 77 1HH2 ARG 77 -3.192 -10.472 1.570 649 2HH2 ARG 77 2HH2 ARG 77 -2.924 -11.797 0.487 650 H VAL 78 H VAL 78 0.488 -5.227 -3.846 651 HA VAL 78 HA VAL 78 0.478 -3.520 -1.489 652 HB VAL 78 HB VAL 78 2.859 -4.280 -2.330 653 1HG1 VAL 78 1HG1 VAL 78 2.697 -1.800 -3.993 654 2HG1 VAL 78 2HG1 VAL 78 3.776 -3.209 -4.136 655 3HG1 VAL 78 3HG1 VAL 78 2.088 -3.320 -4.693 656 1HG2 VAL 78 1HG2 VAL 78 3.051 -1.415 -1.969 657 2HG2 VAL 78 2HG2 VAL 78 1.829 -2.101 -0.873 658 3HG2 VAL 78 3HG2 VAL 78 3.493 -2.731 -0.854 659 H ILE 79 H ILE 79 -0.394 -1.460 -1.894 660 HA ILE 79 HA ILE 79 -1.583 -1.222 -4.560 661 HB ILE 79 HB ILE 79 -2.486 -0.696 -1.833 662 1HG1 ILE 79 1HG1 ILE 79 -3.744 -1.266 -4.515 663 2HG1 ILE 79 2HG1 ILE 79 -3.656 -2.301 -3.105 664 1HG2 ILE 79 1HG2 ILE 79 -3.812 1.279 -2.332 665 2HG2 ILE 79 2HG2 ILE 79 -2.077 1.630 -2.524 666 3HG2 ILE 79 3HG2 ILE 79 -3.098 1.375 -3.960 667 1HD1 ILE 79 1HD1 ILE 79 -5.458 0.059 -3.621 668 2HD1 ILE 79 2HD1 ILE 79 -5.849 -1.532 -2.924 669 3HD1 ILE 79 3HD1 ILE 79 -5.005 -0.312 -1.940 670 H ILE 80 H ILE 80 -1.357 0.687 -5.782 671 HA ILE 80 HA ILE 80 0.914 2.313 -4.917 672 HB ILE 80 HB ILE 80 1.266 2.826 -7.196 673 1HG1 ILE 80 1HG1 ILE 80 -0.286 1.861 -8.976 674 2HG1 ILE 80 2HG1 ILE 80 -1.452 1.596 -7.696 675 1HG2 ILE 80 1HG2 ILE 80 1.420 0.253 -6.181 676 2HG2 ILE 80 2HG2 ILE 80 0.641 0.036 -7.767 677 3HG2 ILE 80 3HG2 ILE 80 2.213 0.863 -7.653 678 1HD1 ILE 80 1HD1 ILE 80 -1.967 3.816 -7.533 679 2HD1 ILE 80 2HD1 ILE 80 -0.263 4.314 -7.665 680 3HD1 ILE 80 3HD1 ILE 80 -1.198 3.943 -9.133 681 H MET 81 H MET 81 0.818 4.659 -5.167 682 HA MET 81 HA MET 81 -1.884 5.686 -5.382 683 1HB MET 81 1HB MET 81 -0.522 7.166 -3.312 684 2HB MET 81 2HB MET 81 -1.969 6.191 -3.146 685 1HG MET 81 1HG MET 81 -0.629 4.166 -2.739 686 2HG MET 81 2HG MET 81 0.857 5.029 -3.086 687 1HE MET 81 1HE MET 81 1.849 5.388 0.452 688 2HE MET 81 2HE MET 81 1.652 4.013 -0.661 689 3HE MET 81 3HE MET 81 2.315 5.553 -1.258 690 H THR 82 H THR 82 -1.945 7.463 -6.703 691 HA THR 82 HA THR 82 -0.073 9.526 -6.649 692 HB THR 82 HB THR 82 1.619 8.205 -7.640 693 HG1 THR 82 HG1 THR 82 1.646 9.513 -9.424 694 1HG2 THR 82 1HG2 THR 82 1.287 6.441 -9.218 695 2HG2 THR 82 2HG2 THR 82 -0.067 6.233 -8.081 696 3HG2 THR 82 3HG2 THR 82 -0.338 7.024 -9.652 697 H ALA 83 H ALA 83 -0.670 11.272 -7.989 698 HA ALA 83 HA ALA 83 -3.370 11.437 -8.535 699 1HB ALA 83 1HB ALA 83 -2.641 13.484 -9.871 700 2HB ALA 83 2HB ALA 83 -2.067 13.416 -8.187 701 3HB ALA 83 3HB ALA 83 -0.962 13.006 -9.521 702 H TYR 84 H TYR 84 -4.478 11.711 -10.654 703 HA TYR 84 HA TYR 84 -3.692 9.577 -12.417 704 1HB TYR 84 1HB TYR 84 -5.938 9.914 -13.207 705 2HB TYR 84 2HB TYR 84 -6.058 10.443 -11.541 706 HD1 TYR 84 HD1 TYR 84 -5.854 12.961 -11.054 707 HD2 TYR 84 HD2 TYR 84 -6.467 11.380 -14.982 708 HE1 TYR 84 HE1 TYR 84 -6.700 15.226 -11.841 709 HE2 TYR 84 HE2 TYR 84 -7.311 13.650 -15.756 710 HH TYR 84 HH TYR 84 -7.125 15.938 -15.153 711 H GLY 85 H GLY 85 -1.682 11.569 -12.404 712 1HA GLY 85 1HA GLY 85 -2.138 13.034 -14.923 713 2HA GLY 85 2HA GLY 85 -0.963 13.436 -13.686 714 H GLU 86 H GLU 86 -0.507 10.301 -13.471 715 HA GLU 86 HA GLU 86 1.130 10.130 -15.878 716 1HB GLU 86 1HB GLU 86 2.772 8.818 -14.351 717 2HB GLU 86 2HB GLU 86 2.745 10.564 -14.216 718 1HG GLU 86 1HG GLU 86 1.393 10.485 -12.204 719 2HG GLU 86 2HG GLU 86 1.044 8.781 -12.422 720 H LEU 87 H LEU 87 -1.336 9.082 -16.075 721 HA LEU 87 HA LEU 87 -1.955 6.678 -14.993 722 1HB LEU 87 1HB LEU 87 -2.358 7.533 -17.863 723 2HB LEU 87 2HB LEU 87 -3.229 6.253 -17.042 724 HG LEU 87 HG LEU 87 -3.309 8.963 -15.798 725 1HD1 LEU 87 1HD1 LEU 87 -5.317 8.508 -17.935 726 2HD1 LEU 87 2HD1 LEU 87 -4.576 10.016 -17.347 727 3HD1 LEU 87 3HD1 LEU 87 -3.676 8.957 -18.459 728 1HD2 LEU 87 1HD2 LEU 87 -5.855 7.950 -15.869 729 2HD2 LEU 87 2HD2 LEU 87 -4.866 6.472 -15.788 730 3HD2 LEU 87 3HD2 LEU 87 -4.690 7.730 -14.541 731 H ASP 88 H ASP 88 0.389 7.377 -17.626 732 HA ASP 88 HA ASP 88 0.856 4.954 -18.609 733 1HB ASP 88 1HB ASP 88 2.326 7.421 -18.308 734 2HB ASP 88 2HB ASP 88 3.439 6.103 -17.997 735 H MET 89 H MET 89 2.527 6.389 -15.695 736 HA MET 89 HA MET 89 3.865 4.052 -15.027 737 1HB MET 89 1HB MET 89 4.691 6.076 -14.067 738 2HB MET 89 2HB MET 89 3.092 6.625 -13.607 739 1HG MET 89 1HG MET 89 4.553 5.834 -11.668 740 2HG MET 89 2HG MET 89 2.975 5.078 -11.755 741 1HE MET 89 1HE MET 89 4.246 3.178 -10.071 742 2HE MET 89 2HE MET 89 5.775 2.419 -10.577 743 3HE MET 89 3HE MET 89 5.702 4.175 -10.301 744 H ILE 90 H ILE 90 0.766 5.482 -13.807 745 HA ILE 90 HA ILE 90 0.233 3.669 -11.822 746 HB ILE 90 HB ILE 90 -1.539 5.241 -13.675 747 1HG1 ILE 90 1HG1 ILE 90 -1.526 5.793 -10.788 748 2HG1 ILE 90 2HG1 ILE 90 0.042 6.002 -11.543 749 1HG2 ILE 90 1HG2 ILE 90 -3.161 3.764 -13.161 750 2HG2 ILE 90 2HG2 ILE 90 -2.288 3.124 -11.748 751 3HG2 ILE 90 3HG2 ILE 90 -3.192 4.652 -11.618 752 1HD1 ILE 90 1HD1 ILE 90 -1.759 7.979 -11.527 753 2HD1 ILE 90 2HD1 ILE 90 -0.685 7.732 -12.925 754 3HD1 ILE 90 3HD1 ILE 90 -2.360 7.130 -12.972 755 H GLN 91 H GLN 91 -0.666 3.472 -15.333 756 HA GLN 91 HA GLN 91 -1.996 1.117 -15.235 757 1HB GLN 91 1HB GLN 91 -0.427 2.589 -17.309 758 2HB GLN 91 2HB GLN 91 -0.748 0.902 -17.659 759 1HG GLN 91 1HG GLN 91 -3.166 2.117 -16.605 760 2HG GLN 91 2HG GLN 91 -2.547 3.122 -17.900 761 1HE2 GLN 91 1HE2 GLN 91 -1.932 2.036 -19.923 762 2HE2 GLN 91 2HE2 GLN 91 -2.879 0.700 -20.487 763 H GLU 92 H GLU 92 1.569 1.627 -15.681 764 HA GLU 92 HA GLU 92 2.295 -0.958 -16.030 765 1HB GLU 92 1HB GLU 92 3.583 1.536 -15.161 766 2HB GLU 92 2HB GLU 92 4.336 0.133 -14.428 767 1HG GLU 92 1HG GLU 92 5.054 -0.736 -16.469 768 2HG GLU 92 2HG GLU 92 3.707 -0.055 -17.361 769 H SER 93 H SER 93 2.048 0.834 -12.875 770 HA SER 93 HA SER 93 2.789 -1.180 -11.234 771 1HB SER 93 1HB SER 93 0.692 0.094 -9.857 772 2HB SER 93 2HB SER 93 2.387 0.536 -9.822 773 HG SER 93 HG SER 93 0.244 1.827 -11.038 774 H LYS 94 H LYS 94 -0.243 -0.749 -13.032 775 HA LYS 94 HA LYS 94 -1.682 -2.702 -11.519 776 1HB LYS 94 1HB LYS 94 -2.306 -0.665 -13.346 777 2HB LYS 94 2HB LYS 94 -2.739 -2.149 -14.170 778 1HG LYS 94 1HG LYS 94 -3.695 -2.641 -11.610 779 2HG LYS 94 2HG LYS 94 -3.942 -0.911 -11.747 780 1HD LYS 94 1HD LYS 94 -5.933 -1.688 -12.683 781 2HD LYS 94 2HD LYS 94 -4.956 -1.522 -14.128 782 1HE LYS 94 1HE LYS 94 -4.521 -4.142 -12.887 783 2HE LYS 94 2HE LYS 94 -6.227 -3.879 -13.190 784 1HZ LYS 94 1HZ LYS 94 -5.705 -4.485 -15.242 785 2HZ LYS 94 2HZ LYS 94 -5.090 -2.986 -15.439 786 3HZ LYS 94 3HZ LYS 94 -4.103 -4.229 -15.055 787 H GLU 95 H GLU 95 0.069 -2.581 -14.677 788 HA GLU 95 HA GLU 95 -0.544 -5.285 -15.230 789 1HB GLU 95 1HB GLU 95 0.511 -4.917 -17.262 790 2HB GLU 95 2HB GLU 95 0.123 -3.265 -16.825 791 1HG GLU 95 1HG GLU 95 2.369 -2.962 -17.278 792 2HG GLU 95 2HG GLU 95 2.519 -3.413 -15.592 793 H LEU 96 H LEU 96 1.598 -3.757 -13.061 794 HA LEU 96 HA LEU 96 3.764 -5.605 -13.306 795 1HB LEU 96 1HB LEU 96 3.181 -3.150 -11.939 796 2HB LEU 96 2HB LEU 96 3.786 -4.323 -10.786 797 HG LEU 96 HG LEU 96 5.857 -4.521 -11.864 798 1HD1 LEU 96 1HD1 LEU 96 5.981 -3.063 -14.173 799 2HD1 LEU 96 2HD1 LEU 96 5.758 -4.826 -14.081 800 3HD1 LEU 96 3HD1 LEU 96 4.346 -3.759 -14.270 801 1HD2 LEU 96 1HD2 LEU 96 6.758 -2.384 -11.733 802 2HD2 LEU 96 2HD2 LEU 96 5.305 -1.616 -12.416 803 3HD2 LEU 96 3HD2 LEU 96 5.276 -2.256 -10.755 804 H GLY 97 H GLY 97 0.590 -5.652 -11.931 805 1HA GLY 97 1HA GLY 97 -0.241 -7.782 -11.229 806 2HA GLY 97 2HA GLY 97 1.301 -8.115 -10.465 807 H ALA 98 H ALA 98 -0.163 -4.875 -10.282 808 HA ALA 98 HA ALA 98 -0.212 -5.088 -7.415 809 1HB ALA 98 1HB ALA 98 0.611 -3.063 -8.534 810 2HB ALA 98 2HB ALA 98 -0.964 -2.846 -9.335 811 3HB ALA 98 3HB ALA 98 -0.836 -2.689 -7.567 812 H LEU 99 H LEU 99 -2.297 -3.956 -6.355 813 HA LEU 99 HA LEU 99 -4.483 -5.675 -7.143 814 1HB LEU 99 1HB LEU 99 -4.534 -3.721 -4.869 815 2HB LEU 99 2HB LEU 99 -5.395 -5.237 -5.049 816 HG LEU 99 HG LEU 99 -3.762 -5.626 -3.406 817 1HD1 LEU 99 1HD1 LEU 99 -3.952 -7.365 -5.207 818 2HD1 LEU 99 2HD1 LEU 99 -2.472 -6.688 -5.928 819 3HD1 LEU 99 3HD1 LEU 99 -2.426 -7.388 -4.292 820 1HD2 LEU 99 1HD2 LEU 99 -1.355 -4.905 -4.954 821 2HD2 LEU 99 2HD2 LEU 99 -2.383 -3.537 -4.464 822 3HD2 LEU 99 3HD2 LEU 99 -1.744 -4.654 -3.235 823 H THR 100 H THR 100 -3.873 -2.131 -6.644 824 HA THR 100 HA THR 100 -5.443 -1.472 -8.918 825 HB THR 100 HB THR 100 -7.344 -1.980 -7.482 826 HG1 THR 100 HG1 THR 100 -6.697 0.863 -7.197 827 1HG2 THR 100 1HG2 THR 100 -7.047 -1.876 -5.210 828 2HG2 THR 100 2HG2 THR 100 -5.588 -0.872 -5.385 829 3HG2 THR 100 3HG2 THR 100 -7.197 -0.110 -5.377 830 H HIS 101 H HIS 101 -5.735 1.010 -9.036 831 HA HIS 101 HA HIS 101 -3.451 2.236 -7.673 832 1HB HIS 101 1HB HIS 101 -3.347 3.632 -9.890 833 2HB HIS 101 2HB HIS 101 -2.548 2.078 -9.765 834 HD1 HIS 101 HD1 HIS 101 -2.749 1.088 -12.060 835 HD2 HIS 101 HD2 HIS 101 -6.373 2.711 -10.706 836 HE1 HIS 101 HE1 HIS 101 -4.498 0.505 -13.824 837 H PHE 102 H PHE 102 -4.047 3.935 -6.429 838 HA PHE 102 HA PHE 102 -6.654 5.133 -7.015 839 1HB PHE 102 1HB PHE 102 -4.823 5.039 -4.543 840 2HB PHE 102 2HB PHE 102 -6.346 5.904 -4.573 841 HD1 PHE 102 HD1 PHE 102 -7.845 3.776 -6.237 842 HD2 PHE 102 HD2 PHE 102 -5.388 3.533 -2.786 843 HE1 PHE 102 HE1 PHE 102 -9.045 1.688 -5.531 844 HE2 PHE 102 HE2 PHE 102 -6.588 1.445 -2.079 845 HZ PHE 102 HZ PHE 102 -8.402 0.547 -3.460 846 H ALA 103 H ALA 103 -6.886 7.496 -6.718 847 HA ALA 103 HA ALA 103 -4.459 8.842 -7.628 848 1HB ALA 103 1HB ALA 103 -5.845 10.176 -8.842 849 2HB ALA 103 2HB ALA 103 -7.026 8.870 -8.583 850 3HB ALA 103 3HB ALA 103 -7.038 10.303 -7.528 851 H LYS 104 H LYS 104 -3.686 10.763 -6.595 852 HA LYS 104 HA LYS 104 -3.405 10.765 -3.958 853 1HB LYS 104 1HB LYS 104 -3.045 12.657 -6.076 854 2HB LYS 104 2HB LYS 104 -3.696 13.510 -4.691 855 1HG LYS 104 1HG LYS 104 -1.852 13.036 -3.342 856 2HG LYS 104 2HG LYS 104 -1.512 11.516 -4.146 857 1HD LYS 104 1HD LYS 104 -0.242 12.510 -5.811 858 2HD LYS 104 2HD LYS 104 -1.215 13.967 -5.840 859 1HE LYS 104 1HE LYS 104 0.815 14.716 -4.887 860 2HE LYS 104 2HE LYS 104 -0.201 14.469 -3.481 861 1HZ LYS 104 1HZ LYS 104 1.337 13.084 -2.774 862 2HZ LYS 104 2HZ LYS 104 0.981 12.054 -3.990 863 3HZ LYS 104 3HZ LYS 104 2.174 13.154 -4.174 864 HA PRO 105 HA PRO 105 -7.422 13.121 -3.231 865 1HB PRO 105 1HB PRO 105 -9.103 13.710 -5.304 866 2HB PRO 105 2HB PRO 105 -7.906 14.834 -4.691 867 1HG PRO 105 1HG PRO 105 -7.847 13.237 -7.178 868 2HG PRO 105 2HG PRO 105 -6.900 14.650 -6.759 869 1HD PRO 105 1HD PRO 105 -6.009 11.924 -6.750 870 2HD PRO 105 2HD PRO 105 -5.100 13.325 -6.220 871 H PHE 106 H PHE 106 -7.653 11.046 -2.232 872 HA PHE 106 HA PHE 106 -9.930 9.672 -3.464 873 1HB PHE 106 1HB PHE 106 -7.194 8.789 -3.025 874 2HB PHE 106 2HB PHE 106 -8.203 7.916 -1.889 875 HD1 PHE 106 HD1 PHE 106 -8.846 5.835 -2.609 876 HD2 PHE 106 HD2 PHE 106 -8.450 8.931 -5.483 877 HE1 PHE 106 HE1 PHE 106 -9.503 4.232 -4.425 878 HE2 PHE 106 HE2 PHE 106 -9.107 7.328 -7.300 879 HZ PHE 106 HZ PHE 106 -9.626 4.998 -6.749 880 H ASP 107 H ASP 107 -11.136 8.270 -1.850 881 HA ASP 107 HA ASP 107 -10.997 9.574 0.754 882 1HB ASP 107 1HB ASP 107 -13.152 9.324 -1.043 883 2HB ASP 107 2HB ASP 107 -13.470 8.082 0.150 884 H ILE 108 H ILE 108 -11.136 8.173 2.640 885 HA ILE 108 HA ILE 108 -10.145 5.549 2.216 886 HB ILE 108 HB ILE 108 -10.724 7.340 4.490 887 1HG1 ILE 108 1HG1 ILE 108 -8.503 6.765 5.140 888 2HG1 ILE 108 2HG1 ILE 108 -8.471 5.362 4.091 889 1HG2 ILE 108 1HG2 ILE 108 -11.901 5.700 5.549 890 2HG2 ILE 108 2HG2 ILE 108 -11.113 4.385 4.645 891 3HG2 ILE 108 3HG2 ILE 108 -10.249 5.192 5.975 892 1HD1 ILE 108 1HD1 ILE 108 -8.590 6.804 2.089 893 2HD1 ILE 108 2HD1 ILE 108 -8.719 8.248 3.122 894 3HD1 ILE 108 3HD1 ILE 108 -7.219 7.289 3.116 895 H ASP 109 H ASP 109 -13.337 7.009 2.912 896 HA ASP 109 HA ASP 109 -14.678 4.800 3.722 897 1HB ASP 109 1HB ASP 109 -15.692 7.031 3.653 898 2HB ASP 109 2HB ASP 109 -15.568 7.084 1.906 899 H GLU 110 H GLU 110 -13.807 5.929 0.404 900 HA GLU 110 HA GLU 110 -15.302 3.939 -0.904 901 1HB GLU 110 1HB GLU 110 -12.900 5.308 -2.135 902 2HB GLU 110 2HB GLU 110 -14.398 4.823 -2.905 903 1HG GLU 110 1HG GLU 110 -15.109 6.644 -0.805 904 2HG GLU 110 2HG GLU 110 -13.744 7.355 -1.644 905 H ILE 111 H ILE 111 -11.920 4.244 0.255 906 HA ILE 111 HA ILE 111 -10.960 1.949 -1.064 907 HB ILE 111 HB ILE 111 -10.044 3.728 1.146 908 1HG1 ILE 111 1HG1 ILE 111 -8.554 2.835 -1.322 909 2HG1 ILE 111 2HG1 ILE 111 -9.757 4.107 -1.392 910 1HG2 ILE 111 1HG2 ILE 111 -9.466 1.599 2.070 911 2HG2 ILE 111 2HG2 ILE 111 -8.839 1.025 0.505 912 3HG2 ILE 111 3HG2 ILE 111 -7.990 2.320 1.383 913 1HD1 ILE 111 1HD1 ILE 111 -8.539 5.478 0.192 914 2HD1 ILE 111 2HD1 ILE 111 -7.433 4.139 0.581 915 3HD1 ILE 111 3HD1 ILE 111 -7.368 4.909 -1.022 916 H ARG 112 H ARG 112 -12.947 2.478 1.786 917 HA ARG 112 HA ARG 112 -12.323 0.153 3.137 918 1HB ARG 112 1HB ARG 112 -14.925 1.756 3.005 919 2HB ARG 112 2HB ARG 112 -14.650 0.467 4.160 920 1HG ARG 112 1HG ARG 112 -12.364 1.979 4.515 921 2HG ARG 112 2HG ARG 112 -13.522 3.226 4.095 922 1HD ARG 112 1HD ARG 112 -14.691 1.317 5.995 923 2HD ARG 112 2HD ARG 112 -13.201 1.990 6.626 924 HE ARG 112 HE ARG 112 -14.579 4.194 5.595 925 1HH1 ARG 112 1HH1 ARG 112 -15.252 1.707 7.992 926 2HH1 ARG 112 2HH1 ARG 112 -16.291 2.719 8.938 927 1HH2 ARG 112 1HH2 ARG 112 -15.949 5.531 6.844 928 2HH2 ARG 112 2HH2 ARG 112 -16.690 4.909 8.281 929 H ASP 113 H ASP 113 -14.214 0.783 0.231 930 HA ASP 113 HA ASP 113 -15.635 -1.690 0.417 931 1HB ASP 113 1HB ASP 113 -15.897 0.754 -1.022 932 2HB ASP 113 2HB ASP 113 -15.602 -0.469 -2.242 933 H ALA 114 H ALA 114 -12.907 -0.178 -1.411 934 HA ALA 114 HA ALA 114 -12.486 -2.390 -3.128 935 1HB ALA 114 1HB ALA 114 -10.570 -0.175 -2.298 936 2HB ALA 114 2HB ALA 114 -10.474 -1.182 -3.763 937 3HB ALA 114 3HB ALA 114 -11.805 -0.016 -3.569 938 H VAL 115 H VAL 115 -11.714 -1.665 0.211 939 HA VAL 115 HA VAL 115 -9.414 -3.283 0.422 940 HB VAL 115 HB VAL 115 -11.405 -2.079 2.314 941 1HG1 VAL 115 1HG1 VAL 115 -9.105 -3.882 3.142 942 2HG1 VAL 115 2HG1 VAL 115 -10.177 -2.965 4.227 943 3HG1 VAL 115 3HG1 VAL 115 -10.833 -4.297 3.245 944 1HG2 VAL 115 1HG2 VAL 115 -9.178 -1.069 1.101 945 2HG2 VAL 115 2HG2 VAL 115 -9.842 -0.483 2.645 946 3HG2 VAL 115 3HG2 VAL 115 -8.498 -1.651 2.640 947 H LYS 116 H LYS 116 -12.897 -3.902 0.343 948 HA LYS 116 HA LYS 116 -12.865 -6.402 1.601 949 1HB LYS 116 1HB LYS 116 -14.874 -4.985 1.169 950 2HB LYS 116 2HB LYS 116 -14.759 -5.380 -0.534 951 1HG LYS 116 1HG LYS 116 -14.867 -7.853 0.126 952 2HG LYS 116 2HG LYS 116 -15.210 -7.336 1.765 953 1HD LYS 116 1HD LYS 116 -17.352 -7.727 0.769 954 2HD LYS 116 2HD LYS 116 -17.178 -5.984 0.813 955 1HE LYS 116 1HE LYS 116 -16.754 -5.831 -1.521 956 2HE LYS 116 2HE LYS 116 -16.276 -7.512 -1.646 957 1HZ LYS 116 1HZ LYS 116 -18.801 -7.657 -0.743 958 2HZ LYS 116 2HZ LYS 116 -18.877 -6.377 -1.754 959 3HZ LYS 116 3HZ LYS 116 -18.351 -7.822 -2.304 960 H LYS 117 H LYS 117 -12.021 -5.305 -1.676 961 HA LYS 117 HA LYS 117 -11.697 -8.095 -2.488 962 1HB LYS 117 1HB LYS 117 -11.879 -5.497 -4.024 963 2HB LYS 117 2HB LYS 117 -11.325 -6.983 -4.769 964 1HG LYS 117 1HG LYS 117 -13.465 -8.109 -4.012 965 2HG LYS 117 2HG LYS 117 -14.019 -6.568 -3.389 966 1HD LYS 117 1HD LYS 117 -13.216 -7.022 -6.300 967 2HD LYS 117 2HD LYS 117 -14.866 -7.134 -5.721 968 1HE LYS 117 1HE LYS 117 -13.795 -4.653 -4.735 969 2HE LYS 117 2HE LYS 117 -13.363 -4.761 -6.430 970 1HZ LYS 117 1HZ LYS 117 -15.535 -3.789 -6.095 971 2HZ LYS 117 2HZ LYS 117 -15.656 -5.177 -6.948 972 3HZ LYS 117 3HZ LYS 117 -16.076 -5.149 -5.370 973 H TYR 118 H TYR 118 -9.946 -4.960 -2.133 974 HA TYR 118 HA TYR 118 -7.470 -5.949 -3.024 975 1HB TYR 118 1HB TYR 118 -8.038 -3.543 -2.868 976 2HB TYR 118 2HB TYR 118 -8.465 -3.702 -1.176 977 HD1 TYR 118 HD1 TYR 118 -5.437 -5.324 -2.502 978 HD2 TYR 118 HD2 TYR 118 -6.996 -1.873 -0.510 979 HE1 TYR 118 HE1 TYR 118 -3.081 -4.633 -1.839 980 HE2 TYR 118 HE2 TYR 118 -4.635 -1.194 0.146 981 HH TYR 118 HH TYR 118 -2.543 -1.894 0.307 982 H LEU 119 H LEU 119 -9.119 -5.924 0.155 983 HA LEU 119 HA LEU 119 -6.753 -7.256 1.273 984 1HB LEU 119 1HB LEU 119 -7.554 -5.037 2.230 985 2HB LEU 119 2HB LEU 119 -8.960 -5.904 2.816 986 HG LEU 119 HG LEU 119 -6.227 -6.927 3.513 987 1HD1 LEU 119 1HD1 LEU 119 -6.839 -5.367 5.677 988 2HD1 LEU 119 2HD1 LEU 119 -5.667 -4.950 4.403 989 3HD1 LEU 119 3HD1 LEU 119 -7.332 -4.326 4.320 990 1HD2 LEU 119 1HD2 LEU 119 -8.775 -7.787 4.080 991 2HD2 LEU 119 2HD2 LEU 119 -7.305 -8.210 4.991 992 3HD2 LEU 119 3HD2 LEU 119 -8.341 -6.871 5.544 993 HA PRO 120 HA PRO 120 -9.233 -10.807 1.408 994 1HB PRO 120 1HB PRO 120 -7.555 -12.433 2.825 995 2HB PRO 120 2HB PRO 120 -7.405 -12.172 1.099 996 1HG PRO 120 1HG PRO 120 -5.746 -11.082 3.289 997 2HG PRO 120 2HG PRO 120 -5.375 -11.188 1.579 998 1HD PRO 120 1HD PRO 120 -6.176 -8.840 3.020 999 2HD PRO 120 2HD PRO 120 -5.918 -8.972 1.292 1000 H LEU 121 H LEU 121 -10.410 -9.016 2.895 1001 HA LEU 121 HA LEU 121 -10.467 -10.109 5.594 1002 1HB LEU 121 1HB LEU 121 -10.222 -7.767 5.529 1003 2HB LEU 121 2HB LEU 121 -11.480 -7.577 4.325 1004 HG LEU 121 HG LEU 121 -13.147 -8.365 6.043 1005 1HD1 LEU 121 1HD1 LEU 121 -11.204 -7.738 8.214 1006 2HD1 LEU 121 2HD1 LEU 121 -12.622 -8.814 8.210 1007 3HD1 LEU 121 3HD1 LEU 121 -11.103 -9.340 7.445 1008 1HD2 LEU 121 1HD2 LEU 121 -12.369 -5.903 5.468 1009 2HD2 LEU 121 2HD2 LEU 121 -13.522 -6.235 6.783 1010 3HD2 LEU 121 3HD2 LEU 121 -11.808 -5.936 7.157 1011 H LYS 122 H LYS 122 -12.732 -10.315 6.610 1012 HA LYS 122 HA LYS 122 -14.122 -12.280 5.251 1013 1HB LYS 122 1HB LYS 122 -14.354 -12.271 7.567 1014 2HB LYS 122 2HB LYS 122 -14.693 -10.553 7.643 1015 1HG LYS 122 1HG LYS 122 -16.666 -12.016 6.001 1016 2HG LYS 122 2HG LYS 122 -16.597 -12.613 7.647 1017 1HD LYS 122 1HD LYS 122 -16.780 -10.176 8.433 1018 2HD LYS 122 2HD LYS 122 -17.090 -9.733 6.766 1019 1HE LYS 122 1HE LYS 122 -19.248 -10.469 6.861 1020 2HE LYS 122 2HE LYS 122 -18.784 -11.988 7.600 1021 1HZ LYS 122 1HZ LYS 122 -18.525 -9.744 9.342 1022 2HZ LYS 122 2HZ LYS 122 -20.061 -10.010 8.853 1023 3HZ LYS 122 3HZ LYS 122 -19.228 -11.194 9.609 1024 H SER 123 H SER 123 -15.933 -12.327 3.923 1025 HA SER 123 HA SER 123 -16.321 -10.108 2.321 1026 1HB SER 123 1HB SER 123 -18.108 -12.545 2.743 1027 2HB SER 123 2HB SER 123 -18.274 -11.413 1.416 1028 HG SER 123 HG SER 123 -16.968 -13.462 1.054 1029 H ASN 124 H ASN 124 -17.433 -8.236 2.731 1030 HA ASN 124 HA ASN 124 -19.210 -8.232 4.991 1031 1HB ASN 124 1HB ASN 124 -17.404 -6.409 4.331 1032 2HB ASN 124 2HB ASN 124 -18.614 -5.843 3.197 1033 1HD2 ASN 124 1HD2 ASN 124 -18.121 -3.971 4.760 1034 2HD2 ASN 124 2HD2 ASN 124 -19.210 -3.772 6.091 Start of MODEL 16 1 1H MET 1 1H MET 1 -9.881 -14.492 19.006 2 HA MET 1 HA MET 1 -9.092 -15.448 17.197 3 1HB MET 1 1HB MET 1 -11.977 -16.101 16.974 4 2HB MET 1 2HB MET 1 -11.221 -15.940 15.401 5 1HG MET 1 1HG MET 1 -9.508 -17.607 15.988 6 2HG MET 1 2HG MET 1 -10.082 -17.677 17.642 7 1HE MET 1 1HE MET 1 -9.712 -20.002 16.969 8 2HE MET 1 2HE MET 1 -11.173 -21.013 16.861 9 3HE MET 1 3HE MET 1 -10.260 -20.608 15.388 10 H MET 2 H MET 2 -7.996 -14.186 15.757 11 HA MET 2 HA MET 2 -9.174 -12.841 13.692 12 1HB MET 2 1HB MET 2 -9.590 -11.449 16.118 13 2HB MET 2 2HB MET 2 -8.205 -10.632 15.422 14 1HG MET 2 1HG MET 2 -9.667 -9.473 14.120 15 2HG MET 2 2HG MET 2 -9.931 -10.957 13.225 16 1HE MET 2 1HE MET 2 -13.072 -8.741 14.210 17 2HE MET 2 2HE MET 2 -11.683 -8.908 13.109 18 3HE MET 2 3HE MET 2 -13.069 -10.016 12.967 19 H ASN 3 H ASN 3 -7.533 -11.080 12.743 20 HA ASN 3 HA ASN 3 -4.962 -10.944 13.605 21 1HB ASN 3 1HB ASN 3 -5.414 -13.568 12.771 22 2HB ASN 3 2HB ASN 3 -4.773 -12.841 11.311 23 1HD2 ASN 3 1HD2 ASN 3 -3.038 -14.386 11.736 24 2HD2 ASN 3 2HD2 ASN 3 -1.716 -13.931 12.758 25 H GLU 4 H GLU 4 -3.517 -10.014 11.807 26 HA GLU 4 HA GLU 4 -4.143 -9.711 9.237 27 1HB GLU 4 1HB GLU 4 -6.085 -8.257 10.815 28 2HB GLU 4 2HB GLU 4 -5.131 -7.105 9.902 29 1HG GLU 4 1HG GLU 4 -5.977 -7.800 7.883 30 2HG GLU 4 2HG GLU 4 -5.925 -9.494 8.328 31 H LYS 5 H LYS 5 -2.956 -7.824 8.187 32 HA LYS 5 HA LYS 5 -1.198 -6.392 9.994 33 1HB LYS 5 1HB LYS 5 -0.273 -8.526 8.085 34 2HB LYS 5 2HB LYS 5 0.757 -7.153 8.433 35 1HG LYS 5 1HG LYS 5 1.450 -8.426 10.209 36 2HG LYS 5 2HG LYS 5 0.001 -7.813 10.981 37 1HD LYS 5 1HD LYS 5 -0.293 -10.108 11.298 38 2HD LYS 5 2HD LYS 5 -1.177 -9.881 9.802 39 1HE LYS 5 1HE LYS 5 1.154 -10.381 8.645 40 2HE LYS 5 2HE LYS 5 1.588 -11.066 10.198 41 1HZ LYS 5 1HZ LYS 5 0.125 -12.737 9.944 42 2HZ LYS 5 2HZ LYS 5 -0.960 -11.861 9.094 43 3HZ LYS 5 3HZ LYS 5 0.374 -12.447 8.356 44 H ILE 6 H ILE 6 0.034 -4.666 8.805 45 HA ILE 6 HA ILE 6 -0.693 -4.084 6.130 46 HB ILE 6 HB ILE 6 -2.425 -3.114 8.259 47 1HG1 ILE 6 1HG1 ILE 6 -3.263 -2.394 5.615 48 2HG1 ILE 6 2HG1 ILE 6 -2.567 -4.001 5.552 49 1HG2 ILE 6 1HG2 ILE 6 -1.284 -1.067 6.337 50 2HG2 ILE 6 2HG2 ILE 6 -2.655 -0.821 7.445 51 3HG2 ILE 6 3HG2 ILE 6 -1.025 -1.115 8.097 52 1HD1 ILE 6 1HD1 ILE 6 -4.240 -4.925 6.822 53 2HD1 ILE 6 2HD1 ILE 6 -4.342 -3.509 7.895 54 3HD1 ILE 6 3HD1 ILE 6 -5.149 -3.484 6.309 55 H LEU 7 H LEU 7 0.571 -2.348 5.284 56 HA LEU 7 HA LEU 7 2.401 -1.126 7.211 57 1HB LEU 7 1HB LEU 7 3.122 -3.241 5.578 58 2HB LEU 7 2HB LEU 7 3.665 -1.838 4.679 59 HG LEU 7 HG LEU 7 4.583 -1.247 7.195 60 1HD1 LEU 7 1HD1 LEU 7 4.858 -4.246 6.851 61 2HD1 LEU 7 2HD1 LEU 7 5.654 -3.252 8.095 62 3HD1 LEU 7 3HD1 LEU 7 3.881 -3.413 8.085 63 1HD2 LEU 7 1HD2 LEU 7 6.591 -1.228 6.181 64 2HD2 LEU 7 2HD2 LEU 7 6.424 -2.892 5.573 65 3HD2 LEU 7 3HD2 LEU 7 5.635 -1.547 4.714 66 H ILE 8 H ILE 8 3.078 0.984 6.665 67 HA ILE 8 HA ILE 8 1.646 2.092 4.350 68 HB ILE 8 HB ILE 8 2.278 3.345 7.023 69 1HG1 ILE 8 1HG1 ILE 8 -0.469 3.009 5.855 70 2HG1 ILE 8 2HG1 ILE 8 0.302 1.652 6.652 71 1HG2 ILE 8 1HG2 ILE 8 0.522 4.931 5.411 72 2HG2 ILE 8 2HG2 ILE 8 2.105 5.355 6.105 73 3HG2 ILE 8 3HG2 ILE 8 2.012 4.601 4.495 74 1HD1 ILE 8 1HD1 ILE 8 -0.841 4.102 7.821 75 2HD1 ILE 8 2HD1 ILE 8 -0.484 2.538 8.593 76 3HD1 ILE 8 3HD1 ILE 8 0.799 3.759 8.419 77 H VAL 9 H VAL 9 3.097 2.280 2.715 78 HA VAL 9 HA VAL 9 5.792 3.176 3.440 79 HB VAL 9 HB VAL 9 4.897 1.998 0.814 80 1HG1 VAL 9 1HG1 VAL 9 7.025 2.286 0.218 81 2HG1 VAL 9 2HG1 VAL 9 7.340 3.088 1.775 82 3HG1 VAL 9 3HG1 VAL 9 7.573 1.331 1.616 83 1HG2 VAL 9 1HG2 VAL 9 5.856 0.521 3.288 84 2HG2 VAL 9 2HG2 VAL 9 4.269 0.375 2.495 85 3HG2 VAL 9 3HG2 VAL 9 5.736 -0.191 1.661 86 H ASP 10 H ASP 10 6.375 5.239 2.994 87 HA ASP 10 HA ASP 10 6.186 7.311 2.355 88 1HB ASP 10 1HB ASP 10 5.275 6.140 -0.314 89 2HB ASP 10 2HB ASP 10 6.019 7.709 -0.075 90 H ASP 11 H ASP 11 4.544 8.843 0.718 91 HA ASP 11 HA ASP 11 2.577 9.723 0.475 92 1HB ASP 11 1HB ASP 11 2.003 7.277 -0.257 93 2HB ASP 11 2HB ASP 11 1.244 7.120 1.315 94 H GLN 12 H GLN 12 3.928 8.836 3.279 95 HA GLN 12 HA GLN 12 1.710 8.981 5.045 96 1HB GLN 12 1HB GLN 12 3.644 9.197 6.778 97 2HB GLN 12 2HB GLN 12 3.490 7.695 5.889 98 1HG GLN 12 1HG GLN 12 5.441 8.029 4.712 99 2HG GLN 12 2HG GLN 12 5.159 9.748 4.524 100 1HE2 GLN 12 1HE2 GLN 12 4.954 10.771 6.940 101 2HE2 GLN 12 2HE2 GLN 12 6.370 10.522 7.906 102 H TYR 13 H TYR 13 0.603 10.876 5.304 103 HA TYR 13 HA TYR 13 2.185 13.264 5.862 104 1HB TYR 13 1HB TYR 13 0.986 12.692 3.375 105 2HB TYR 13 2HB TYR 13 -0.288 13.579 4.187 106 HD1 TYR 13 HD1 TYR 13 2.550 13.888 2.141 107 HD2 TYR 13 HD2 TYR 13 0.520 15.847 5.357 108 HE1 TYR 13 HE1 TYR 13 3.677 16.083 1.525 109 HE2 TYR 13 HE2 TYR 13 1.654 18.035 4.731 110 HH TYR 13 HH TYR 13 4.264 18.143 2.521 111 H GLY 14 H GLY 14 0.544 11.292 7.451 112 1HA GLY 14 1HA GLY 14 -0.561 11.934 9.440 113 2HA GLY 14 2HA GLY 14 -1.313 13.272 8.594 114 H ILE 15 H ILE 15 -1.531 11.012 6.265 115 HA ILE 15 HA ILE 15 -4.245 10.380 6.973 116 HB ILE 15 HB ILE 15 -2.639 9.616 4.533 117 1HG1 ILE 15 1HG1 ILE 15 -4.493 11.724 4.019 118 2HG1 ILE 15 2HG1 ILE 15 -3.524 12.198 5.399 119 1HG2 ILE 15 1HG2 ILE 15 -4.424 8.442 3.943 120 2HG2 ILE 15 2HG2 ILE 15 -5.281 8.931 5.424 121 3HG2 ILE 15 3HG2 ILE 15 -5.387 9.939 3.961 122 1HD1 ILE 15 1HD1 ILE 15 -2.159 12.914 3.645 123 2HD1 ILE 15 2HD1 ILE 15 -1.503 11.283 3.921 124 3HD1 ILE 15 3HD1 ILE 15 -2.642 11.570 2.584 125 H ARG 16 H ARG 16 -1.068 8.749 6.733 126 HA ARG 16 HA ARG 16 -1.826 6.176 6.729 127 1HB ARG 16 1HB ARG 16 0.297 5.802 8.176 128 2HB ARG 16 2HB ARG 16 0.515 6.655 6.661 129 1HG ARG 16 1HG ARG 16 0.512 8.826 7.812 130 2HG ARG 16 2HG ARG 16 0.089 8.067 9.334 131 1HD ARG 16 1HD ARG 16 2.503 6.864 8.132 132 2HD ARG 16 2HD ARG 16 2.694 8.583 8.411 133 HE ARG 16 HE ARG 16 2.456 8.236 10.756 134 1HH1 ARG 16 1HH1 ARG 16 1.965 5.250 8.960 135 2HH1 ARG 16 2HH1 ARG 16 2.087 4.237 10.360 136 1HH2 ARG 16 1HH2 ARG 16 2.616 6.901 12.604 137 2HH2 ARG 16 2HH2 ARG 16 2.459 5.183 12.447 138 H ILE 17 H ILE 17 -1.732 8.466 9.511 139 HA ILE 17 HA ILE 17 -2.286 6.544 11.487 140 HB ILE 17 HB ILE 17 -2.684 9.535 11.401 141 1HG1 ILE 17 1HG1 ILE 17 -0.537 8.208 12.989 142 2HG1 ILE 17 2HG1 ILE 17 -0.335 8.243 11.249 143 1HG2 ILE 17 1HG2 ILE 17 -2.952 9.506 13.778 144 2HG2 ILE 17 2HG2 ILE 17 -4.148 8.391 13.074 145 3HG2 ILE 17 3HG2 ILE 17 -2.677 7.748 13.845 146 1HD1 ILE 17 1HD1 ILE 17 -0.871 10.763 11.362 147 2HD1 ILE 17 2HD1 ILE 17 -0.691 10.611 13.127 148 3HD1 ILE 17 3HD1 ILE 17 0.687 10.255 12.058 149 H LEU 18 H LEU 18 -4.366 8.755 9.523 150 HA LEU 18 HA LEU 18 -6.768 8.332 10.686 151 1HB LEU 18 1HB LEU 18 -6.025 9.712 8.617 152 2HB LEU 18 2HB LEU 18 -6.478 8.290 7.699 153 HG LEU 18 HG LEU 18 -8.712 8.625 9.228 154 1HD1 LEU 18 1HD1 LEU 18 -7.441 10.860 9.937 155 2HD1 LEU 18 2HD1 LEU 18 -8.207 11.453 8.443 156 3HD1 LEU 18 3HD1 LEU 18 -9.210 10.779 9.751 157 1HD2 LEU 18 1HD2 LEU 18 -9.085 10.236 6.921 158 2HD2 LEU 18 2HD2 LEU 18 -7.931 8.950 6.496 159 3HD2 LEU 18 3HD2 LEU 18 -9.524 8.529 7.169 160 H LEU 19 H LEU 19 -5.322 6.261 8.069 161 HA LEU 19 HA LEU 19 -7.365 4.307 8.374 162 1HB LEU 19 1HB LEU 19 -6.354 3.207 6.625 163 2HB LEU 19 2HB LEU 19 -6.002 4.894 6.302 164 HG LEU 19 HG LEU 19 -3.847 3.827 7.854 165 1HD1 LEU 19 1HD1 LEU 19 -4.428 1.609 7.189 166 2HD1 LEU 19 2HD1 LEU 19 -4.658 2.110 5.496 167 3HD1 LEU 19 3HD1 LEU 19 -3.029 2.116 6.213 168 1HD2 LEU 19 1HD2 LEU 19 -3.734 5.743 6.323 169 2HD2 LEU 19 2HD2 LEU 19 -2.510 4.510 5.938 170 3HD2 LEU 19 3HD2 LEU 19 -3.977 4.650 4.940 171 H ASN 20 H ASN 20 -4.347 5.056 9.982 172 HA ASN 20 HA ASN 20 -3.654 2.517 10.809 173 1HB ASN 20 1HB ASN 20 -2.286 4.670 11.040 174 2HB ASN 20 2HB ASN 20 -3.318 5.125 12.381 175 1HD2 ASN 20 1HD2 ASN 20 -0.953 5.094 13.189 176 2HD2 ASN 20 2HD2 ASN 20 -0.449 3.661 14.020 177 H GLU 21 H GLU 21 -5.322 5.179 12.679 178 HA GLU 21 HA GLU 21 -6.025 3.617 14.818 179 1HB GLU 21 1HB GLU 21 -6.160 5.982 15.058 180 2HB GLU 21 2HB GLU 21 -7.177 6.164 13.642 181 1HG GLU 21 1HG GLU 21 -9.021 4.931 14.830 182 2HG GLU 21 2HG GLU 21 -8.004 4.807 16.252 183 H VAL 22 H VAL 22 -7.364 3.774 11.579 184 HA VAL 22 HA VAL 22 -9.957 2.850 12.191 185 HB VAL 22 HB VAL 22 -8.228 3.053 9.755 186 1HG1 VAL 22 1HG1 VAL 22 -9.302 0.945 9.365 187 2HG1 VAL 22 2HG1 VAL 22 -10.871 1.573 9.926 188 3HG1 VAL 22 3HG1 VAL 22 -10.164 2.173 8.406 189 1HG2 VAL 22 1HG2 VAL 22 -9.448 4.888 9.306 190 2HG2 VAL 22 2HG2 VAL 22 -10.982 4.086 9.723 191 3HG2 VAL 22 3HG2 VAL 22 -9.965 4.783 11.006 192 H PHE 23 H PHE 23 -6.916 1.196 11.107 193 HA PHE 23 HA PHE 23 -8.184 -1.368 11.486 194 1HB PHE 23 1HB PHE 23 -5.536 -0.212 10.519 195 2HB PHE 23 2HB PHE 23 -5.579 -1.910 10.952 196 HD1 PHE 23 HD1 PHE 23 -7.282 -3.399 9.761 197 HD2 PHE 23 HD2 PHE 23 -6.286 0.500 8.415 198 HE1 PHE 23 HE1 PHE 23 -8.176 -3.957 7.483 199 HE2 PHE 23 HE2 PHE 23 -7.179 -0.058 6.137 200 HZ PHE 23 HZ PHE 23 -8.114 -2.280 5.698 201 H ASN 24 H ASN 24 -6.023 0.858 13.202 202 HA ASN 24 HA ASN 24 -4.647 -0.782 14.813 203 1HB ASN 24 1HB ASN 24 -4.878 1.866 14.722 204 2HB ASN 24 2HB ASN 24 -6.063 1.639 15.992 205 1HD2 ASN 24 1HD2 ASN 24 -5.448 1.208 18.021 206 2HD2 ASN 24 2HD2 ASN 24 -3.812 1.044 18.564 207 H LYS 25 H LYS 25 -8.107 0.188 14.979 208 HA LYS 25 HA LYS 25 -8.740 -0.658 17.514 209 1HB LYS 25 1HB LYS 25 -10.406 -0.721 14.981 210 2HB LYS 25 2HB LYS 25 -11.047 -0.932 16.598 211 1HG LYS 25 1HG LYS 25 -10.546 1.300 17.236 212 2HG LYS 25 2HG LYS 25 -9.338 1.494 15.981 213 1HD LYS 25 1HD LYS 25 -11.040 2.649 14.938 214 2HD LYS 25 2HD LYS 25 -11.484 1.046 14.387 215 1HE LYS 25 1HE LYS 25 -13.415 1.057 15.597 216 2HE LYS 25 2HE LYS 25 -12.591 1.577 17.054 217 1HZ LYS 25 1HZ LYS 25 -14.261 3.100 15.710 218 2HZ LYS 25 2HZ LYS 25 -13.053 3.707 16.625 219 3HZ LYS 25 3HZ LYS 25 -12.866 3.578 15.008 220 H GLU 26 H GLU 26 -7.677 -2.511 14.768 221 HA GLU 26 HA GLU 26 -8.859 -4.926 15.783 222 1HB GLU 26 1HB GLU 26 -7.023 -4.396 13.407 223 2HB GLU 26 2HB GLU 26 -7.684 -5.970 13.801 224 1HG GLU 26 1HG GLU 26 -10.001 -4.578 13.817 225 2HG GLU 26 2HG GLU 26 -9.093 -3.525 12.750 226 H GLY 27 H GLY 27 -5.899 -3.079 16.038 227 1HA GLY 27 1HA GLY 27 -4.218 -3.430 17.553 228 2HA GLY 27 2HA GLY 27 -4.804 -5.053 17.858 229 H TYR 28 H TYR 28 -4.629 -4.358 14.478 230 HA TYR 28 HA TYR 28 -2.668 -6.318 14.043 231 1HB TYR 28 1HB TYR 28 -3.071 -5.658 11.729 232 2HB TYR 28 2HB TYR 28 -4.590 -5.353 12.549 233 HD1 TYR 28 HD1 TYR 28 -3.373 -4.096 9.937 234 HD2 TYR 28 HD2 TYR 28 -3.644 -2.779 13.998 235 HE1 TYR 28 HE1 TYR 28 -3.309 -1.675 9.164 236 HE2 TYR 28 HE2 TYR 28 -3.579 -0.362 13.212 237 HH TYR 28 HH TYR 28 -2.870 0.437 9.902 238 H GLN 29 H GLN 29 -0.504 -6.140 13.235 239 HA GLN 29 HA GLN 29 0.859 -3.916 14.376 240 1HB GLN 29 1HB GLN 29 1.489 -6.582 13.902 241 2HB GLN 29 2HB GLN 29 2.428 -5.761 12.671 242 1HG GLN 29 1HG GLN 29 3.552 -4.376 14.322 243 2HG GLN 29 2HG GLN 29 2.450 -4.879 15.590 244 1HE2 GLN 29 1HE2 GLN 29 4.190 -5.553 16.851 245 2HE2 GLN 29 2HE2 GLN 29 5.033 -7.039 16.567 246 H THR 30 H THR 30 1.680 -2.123 13.328 247 HA THR 30 HA THR 30 1.535 -2.154 10.386 248 HB THR 30 HB THR 30 0.799 0.237 10.584 249 HG1 THR 30 HG1 THR 30 1.762 0.664 12.665 250 1HG2 THR 30 1HG2 THR 30 -0.775 -1.930 12.014 251 2HG2 THR 30 2HG2 THR 30 -1.362 -0.250 12.058 252 3HG2 THR 30 3HG2 THR 30 -1.166 -1.084 10.498 253 H PHE 31 H PHE 31 3.015 -0.623 9.306 254 HA PHE 31 HA PHE 31 5.224 0.297 10.912 255 1HB PHE 31 1HB PHE 31 5.241 -2.294 9.800 256 2HB PHE 31 2HB PHE 31 6.028 -1.355 8.548 257 HD1 PHE 31 HD1 PHE 31 6.564 -3.205 11.453 258 HD2 PHE 31 HD2 PHE 31 7.918 0.291 9.465 259 HE1 PHE 31 HE1 PHE 31 8.725 -3.318 12.726 260 HE2 PHE 31 HE2 PHE 31 10.079 0.178 10.737 261 HZ PHE 31 HZ PHE 31 10.456 -1.625 12.352 262 H GLN 32 H GLN 32 6.588 1.812 9.770 263 HA GLN 32 HA GLN 32 5.417 2.613 7.220 264 1HB GLN 32 1HB GLN 32 4.858 4.460 8.475 265 2HB GLN 32 2HB GLN 32 6.120 4.179 9.658 266 1HG GLN 32 1HG GLN 32 7.777 5.249 8.355 267 2HG GLN 32 2HG GLN 32 6.906 5.003 6.855 268 1HE2 GLN 32 1HE2 GLN 32 7.629 7.123 9.351 269 2HE2 GLN 32 2HE2 GLN 32 6.484 8.381 9.030 270 H ALA 33 H ALA 33 6.839 3.091 5.507 271 HA ALA 33 HA ALA 33 9.696 2.842 6.132 272 1HB ALA 33 1HB ALA 33 8.924 1.763 3.519 273 2HB ALA 33 2HB ALA 33 9.927 1.039 4.798 274 3HB ALA 33 3HB ALA 33 8.155 0.889 4.865 275 H ALA 34 H ALA 34 11.073 3.747 4.295 276 HA ALA 34 HA ALA 34 9.622 5.920 2.949 277 1HB ALA 34 1HB ALA 34 12.100 6.976 3.324 278 2HB ALA 34 2HB ALA 34 10.746 7.220 4.453 279 3HB ALA 34 3HB ALA 34 11.966 5.967 4.785 280 H ASN 35 H ASN 35 9.964 3.407 1.763 281 HA ASN 35 HA ASN 35 11.091 4.042 -0.601 282 1HB ASN 35 1HB ASN 35 13.146 3.370 1.342 283 2HB ASN 35 2HB ASN 35 13.100 2.103 0.132 284 1HD2 ASN 35 1HD2 ASN 35 14.882 4.506 0.832 285 2HD2 ASN 35 2HD2 ASN 35 15.200 5.276 -0.687 286 H GLY 36 H GLY 36 11.984 1.613 -1.640 287 1HA GLY 36 1HA GLY 36 9.703 -0.148 -1.115 288 2HA GLY 36 2HA GLY 36 10.763 -0.167 -2.510 289 H LEU 37 H LEU 37 13.323 -0.122 -1.203 290 HA LEU 37 HA LEU 37 13.699 -2.824 -0.744 291 1HB LEU 37 1HB LEU 37 15.257 -0.531 -1.036 292 2HB LEU 37 2HB LEU 37 15.674 -1.136 0.555 293 HG LEU 37 HG LEU 37 15.630 -3.060 -1.743 294 1HD1 LEU 37 1HD1 LEU 37 16.922 -0.809 -2.249 295 2HD1 LEU 37 2HD1 LEU 37 18.165 -1.565 -1.224 296 3HD1 LEU 37 3HD1 LEU 37 17.598 -2.394 -2.694 297 1HD2 LEU 37 1HD2 LEU 37 17.670 -2.932 0.457 298 2HD2 LEU 37 2HD2 LEU 37 16.042 -3.575 0.779 299 3HD2 LEU 37 3HD2 LEU 37 17.069 -4.334 -0.461 300 H GLN 38 H GLN 38 13.645 -0.101 1.666 301 HA GLN 38 HA GLN 38 13.870 -1.706 3.873 302 1HB GLN 38 1HB GLN 38 12.896 1.062 3.312 303 2HB GLN 38 2HB GLN 38 12.384 0.375 4.841 304 1HG GLN 38 1HG GLN 38 14.506 0.415 5.726 305 2HG GLN 38 2HG GLN 38 15.256 -0.084 4.223 306 1HE2 GLN 38 1HE2 GLN 38 15.059 2.335 6.381 307 2HE2 GLN 38 2HE2 GLN 38 15.448 3.714 5.407 308 H ALA 39 H ALA 39 11.116 -1.094 1.753 309 HA ALA 39 HA ALA 39 9.209 -2.110 3.670 310 1HB ALA 39 1HB ALA 39 8.964 -1.327 0.736 311 2HB ALA 39 2HB ALA 39 7.608 -1.722 1.819 312 3HB ALA 39 3HB ALA 39 8.608 -0.283 2.133 313 H LEU 40 H LEU 40 11.273 -3.245 1.035 314 HA LEU 40 HA LEU 40 9.836 -5.553 0.378 315 1HB LEU 40 1HB LEU 40 12.650 -4.604 0.060 316 2HB LEU 40 2HB LEU 40 12.288 -6.289 -0.255 317 HG LEU 40 HG LEU 40 11.200 -3.856 -1.677 318 1HD1 LEU 40 1HD1 LEU 40 13.461 -4.889 -2.265 319 2HD1 LEU 40 2HD1 LEU 40 12.536 -6.282 -2.874 320 3HD1 LEU 40 3HD1 LEU 40 12.292 -4.670 -3.589 321 1HD2 LEU 40 1HD2 LEU 40 10.027 -6.576 -1.447 322 2HD2 LEU 40 2HD2 LEU 40 9.247 -5.002 -1.733 323 3HD2 LEU 40 3HD2 LEU 40 10.068 -5.845 -3.069 324 H ASP 41 H ASP 41 12.303 -4.835 2.899 325 HA ASP 41 HA ASP 41 12.449 -7.524 3.722 326 1HB ASP 41 1HB ASP 41 14.175 -5.642 4.085 327 2HB ASP 41 2HB ASP 41 13.127 -5.036 5.352 328 H ILE 42 H ILE 42 10.971 -4.478 5.076 329 HA ILE 42 HA ILE 42 9.747 -5.707 7.265 330 HB ILE 42 HB ILE 42 9.189 -3.151 5.769 331 1HG1 ILE 42 1HG1 ILE 42 11.118 -3.977 7.773 332 2HG1 ILE 42 2HG1 ILE 42 11.051 -2.511 6.815 333 1HG2 ILE 42 1HG2 ILE 42 7.165 -4.098 6.978 334 2HG2 ILE 42 2HG2 ILE 42 8.077 -3.857 8.488 335 3HG2 ILE 42 3HG2 ILE 42 7.686 -2.463 7.452 336 1HD1 ILE 42 1HD1 ILE 42 10.858 -1.835 9.120 337 2HD1 ILE 42 2HD1 ILE 42 9.233 -1.667 8.412 338 3HD1 ILE 42 3HD1 ILE 42 9.614 -3.067 9.443 339 H VAL 43 H VAL 43 9.007 -5.704 3.848 340 HA VAL 43 HA VAL 43 6.261 -6.018 3.910 341 HB VAL 43 HB VAL 43 8.490 -6.516 2.082 342 1HG1 VAL 43 1HG1 VAL 43 7.752 -8.754 1.909 343 2HG1 VAL 43 2HG1 VAL 43 6.036 -8.284 1.979 344 3HG1 VAL 43 3HG1 VAL 43 7.004 -7.910 0.532 345 1HG2 VAL 43 1HG2 VAL 43 5.863 -5.889 0.949 346 2HG2 VAL 43 2HG2 VAL 43 6.328 -4.793 2.271 347 3HG2 VAL 43 3HG2 VAL 43 7.395 -4.988 0.860 348 H THR 44 H THR 44 8.831 -8.593 3.881 349 HA THR 44 HA THR 44 6.880 -10.606 4.511 350 HB THR 44 HB THR 44 9.939 -10.731 4.488 351 HG1 THR 44 HG1 THR 44 9.518 -10.254 2.363 352 1HG2 THR 44 1HG2 THR 44 8.669 -12.770 5.354 353 2HG2 THR 44 2HG2 THR 44 7.818 -12.827 3.791 354 3HG2 THR 44 3HG2 THR 44 9.580 -13.073 3.856 355 H LYS 45 H LYS 45 9.267 -8.628 6.283 356 HA LYS 45 HA LYS 45 9.310 -10.104 8.626 357 1HB LYS 45 1HB LYS 45 10.372 -7.689 7.672 358 2HB LYS 45 2HB LYS 45 9.441 -7.236 9.086 359 1HG LYS 45 1HG LYS 45 10.784 -9.632 9.821 360 2HG LYS 45 2HG LYS 45 11.972 -8.697 8.934 361 1HD LYS 45 1HD LYS 45 11.428 -6.701 10.395 362 2HD LYS 45 2HD LYS 45 10.341 -7.715 11.324 363 1HE LYS 45 1HE LYS 45 12.423 -7.706 12.530 364 2HE LYS 45 2HE LYS 45 12.320 -9.280 11.765 365 1HZ LYS 45 1HZ LYS 45 13.733 -7.008 10.558 366 2HZ LYS 45 2HZ LYS 45 14.466 -8.127 11.494 367 3HZ LYS 45 3HZ LYS 45 13.783 -8.568 10.078 368 H GLU 46 H GLU 46 6.982 -7.651 7.406 369 HA GLU 46 HA GLU 46 5.410 -8.134 9.804 370 1HB GLU 46 1HB GLU 46 5.827 -5.814 8.023 371 2HB GLU 46 2HB GLU 46 4.136 -6.100 8.381 372 1HG GLU 46 1HG GLU 46 5.357 -6.452 10.874 373 2HG GLU 46 2HG GLU 46 6.299 -5.156 10.165 374 H ARG 47 H ARG 47 5.763 -9.197 6.617 375 HA ARG 47 HA ARG 47 4.325 -9.860 5.048 376 1HB ARG 47 1HB ARG 47 2.973 -11.902 6.073 377 2HB ARG 47 2HB ARG 47 4.724 -11.955 6.035 378 1HG ARG 47 1HG ARG 47 4.934 -11.584 8.340 379 2HG ARG 47 2HG ARG 47 3.423 -10.702 8.448 380 1HD ARG 47 1HD ARG 47 2.621 -12.656 9.350 381 2HD ARG 47 2HD ARG 47 2.472 -13.159 7.678 382 HE ARG 47 HE ARG 47 4.464 -14.097 9.616 383 1HH1 ARG 47 1HH1 ARG 47 3.689 -13.768 6.199 384 2HH1 ARG 47 2HH1 ARG 47 4.751 -15.044 5.705 385 1HH2 ARG 47 1HH2 ARG 47 5.866 -15.779 8.964 386 2HH2 ARG 47 2HH2 ARG 47 5.998 -16.195 7.288 387 HA PRO 48 HA PRO 48 0.589 -7.639 6.569 388 1HB PRO 48 1HB PRO 48 0.749 -5.396 5.016 389 2HB PRO 48 2HB PRO 48 1.341 -5.464 6.664 390 1HG PRO 48 1HG PRO 48 2.879 -5.487 4.140 391 2HG PRO 48 2HG PRO 48 3.437 -5.130 5.762 392 1HD PRO 48 1HD PRO 48 3.854 -7.563 4.301 393 2HD PRO 48 2HD PRO 48 4.310 -7.247 5.963 394 H ASP 49 H ASP 49 -1.490 -7.561 5.674 395 HA ASP 49 HA ASP 49 -1.486 -8.960 3.153 396 1HB ASP 49 1HB ASP 49 -3.999 -8.181 4.637 397 2HB ASP 49 2HB ASP 49 -3.691 -9.616 3.680 398 H LEU 50 H LEU 50 -1.324 -5.798 4.158 399 HA LEU 50 HA LEU 50 -2.398 -4.809 1.705 400 1HB LEU 50 1HB LEU 50 -4.258 -5.058 3.677 401 2HB LEU 50 2HB LEU 50 -3.669 -3.436 3.982 402 HG LEU 50 HG LEU 50 -5.478 -3.092 2.573 403 1HD1 LEU 50 1HD1 LEU 50 -4.523 -2.480 0.314 404 2HD1 LEU 50 2HD1 LEU 50 -3.693 -1.785 1.727 405 3HD1 LEU 50 3HD1 LEU 50 -2.981 -3.173 0.871 406 1HD2 LEU 50 1HD2 LEU 50 -6.411 -4.745 1.431 407 2HD2 LEU 50 2HD2 LEU 50 -5.057 -4.731 0.276 408 3HD2 LEU 50 3HD2 LEU 50 -4.980 -5.762 1.725 409 H VAL 51 H VAL 51 -0.737 -3.546 1.077 410 HA VAL 51 HA VAL 51 0.383 -1.751 3.108 411 HB VAL 51 HB VAL 51 1.988 -3.459 2.934 412 1HG1 VAL 51 1HG1 VAL 51 1.734 -4.868 1.195 413 2HG1 VAL 51 2HG1 VAL 51 1.097 -3.594 0.128 414 3HG1 VAL 51 3HG1 VAL 51 2.854 -3.774 0.348 415 1HG2 VAL 51 1HG2 VAL 51 2.680 -0.960 2.505 416 2HG2 VAL 51 2HG2 VAL 51 3.876 -2.267 2.333 417 3HG2 VAL 51 3HG2 VAL 51 3.109 -1.567 0.887 418 H LEU 52 H LEU 52 0.982 0.327 2.340 419 HA LEU 52 HA LEU 52 0.066 0.855 -0.402 420 1HB LEU 52 1HB LEU 52 -0.708 3.010 0.337 421 2HB LEU 52 2HB LEU 52 -1.493 1.726 1.236 422 HG LEU 52 HG LEU 52 0.889 2.703 2.611 423 1HD1 LEU 52 1HD1 LEU 52 0.708 4.894 2.311 424 2HD1 LEU 52 2HD1 LEU 52 -0.776 4.697 1.348 425 3HD1 LEU 52 3HD1 LEU 52 -0.875 4.825 3.120 426 1HD2 LEU 52 1HD2 LEU 52 -1.425 3.193 4.125 427 2HD2 LEU 52 2HD2 LEU 52 -1.763 1.719 3.187 428 3HD2 LEU 52 3HD2 LEU 52 -0.325 1.798 4.233 429 H LEU 53 H LEU 53 1.510 1.806 -1.767 430 HA LEU 53 HA LEU 53 3.833 3.100 -0.557 431 1HB LEU 53 1HB LEU 53 4.538 0.838 -0.965 432 2HB LEU 53 2HB LEU 53 3.912 0.881 -2.601 433 HG LEU 53 HG LEU 53 6.126 2.713 -1.660 434 1HD1 LEU 53 1HD1 LEU 53 6.985 0.504 -3.350 435 2HD1 LEU 53 2HD1 LEU 53 7.669 1.117 -1.825 436 3HD1 LEU 53 3HD1 LEU 53 6.329 -0.054 -1.792 437 1HD2 LEU 53 1HD2 LEU 53 5.387 3.647 -3.612 438 2HD2 LEU 53 2HD2 LEU 53 6.574 2.486 -4.253 439 3HD2 LEU 53 3HD2 LEU 53 4.838 2.093 -4.285 440 H ASP 54 H ASP 54 4.391 4.989 -1.565 441 HA ASP 54 HA ASP 54 2.716 5.689 -3.810 442 1HB ASP 54 1HB ASP 54 2.708 7.366 -2.115 443 2HB ASP 54 2HB ASP 54 4.433 7.225 -1.838 444 H MET 55 H MET 55 3.593 5.958 -5.899 445 HA MET 55 HA MET 55 6.045 4.897 -6.494 446 1HB MET 55 1HB MET 55 4.564 7.053 -8.094 447 2HB MET 55 2HB MET 55 5.636 5.830 -8.746 448 1HG MET 55 1HG MET 55 2.854 5.454 -7.579 449 2HG MET 55 2HG MET 55 3.429 5.003 -9.171 450 1HE MET 55 1HE MET 55 4.101 3.718 -5.140 451 2HE MET 55 2HE MET 55 2.598 4.286 -5.906 452 3HE MET 55 3HE MET 55 2.890 2.542 -5.703 453 H LYS 56 H LYS 56 5.174 8.415 -6.861 454 HA LYS 56 HA LYS 56 7.682 9.373 -7.246 455 1HB LYS 56 1HB LYS 56 5.335 10.521 -7.233 456 2HB LYS 56 2HB LYS 56 5.704 10.892 -5.562 457 1HG LYS 56 1HG LYS 56 6.940 12.654 -6.271 458 2HG LYS 56 2HG LYS 56 8.076 11.526 -6.984 459 1HD LYS 56 1HD LYS 56 6.328 11.454 -8.985 460 2HD LYS 56 2HD LYS 56 5.762 12.967 -8.305 461 1HE LYS 56 1HE LYS 56 7.417 13.567 -9.943 462 2HE LYS 56 2HE LYS 56 8.184 13.804 -8.386 463 1HZ LYS 56 1HZ LYS 56 8.498 11.454 -10.121 464 2HZ LYS 56 2HZ LYS 56 9.623 12.601 -9.827 465 3HZ LYS 56 3HZ LYS 56 9.153 11.592 -8.632 466 H ILE 57 H ILE 57 9.533 9.118 -6.129 467 HA ILE 57 HA ILE 57 9.574 9.703 -3.336 468 HB ILE 57 HB ILE 57 8.991 7.076 -3.986 469 1HG1 ILE 57 1HG1 ILE 57 9.436 6.664 -1.573 470 2HG1 ILE 57 2HG1 ILE 57 10.213 8.230 -1.462 471 1HG2 ILE 57 1HG2 ILE 57 11.302 6.768 -4.794 472 2HG2 ILE 57 2HG2 ILE 57 11.910 7.237 -3.188 473 3HG2 ILE 57 3HG2 ILE 57 10.931 5.762 -3.373 474 1HD1 ILE 57 1HD1 ILE 57 8.139 9.376 -2.098 475 2HD1 ILE 57 2HD1 ILE 57 7.336 7.816 -2.396 476 3HD1 ILE 57 3HD1 ILE 57 7.806 8.273 -0.741 477 HA PRO 58 HA PRO 58 13.494 10.868 -4.748 478 1HB PRO 58 1HB PRO 58 14.605 11.654 -2.378 479 2HB PRO 58 2HB PRO 58 13.539 12.675 -3.322 480 1HG PRO 58 1HG PRO 58 12.962 11.200 -0.826 481 2HG PRO 58 2HG PRO 58 12.079 12.533 -1.542 482 1HD PRO 58 1HD PRO 58 11.341 9.762 -1.593 483 2HD PRO 58 2HD PRO 58 10.521 11.080 -2.406 484 H GLY 59 H GLY 59 15.171 9.728 -5.479 485 1HA GLY 59 1HA GLY 59 17.084 8.458 -5.081 486 2HA GLY 59 2HA GLY 59 16.423 7.905 -3.556 487 H MET 60 H MET 60 15.885 7.719 -7.135 488 HA MET 60 HA MET 60 15.392 6.022 -8.415 489 1HB MET 60 1HB MET 60 16.802 4.741 -6.539 490 2HB MET 60 2HB MET 60 15.244 4.102 -6.055 491 1HG MET 60 1HG MET 60 15.039 3.608 -8.706 492 2HG MET 60 2HG MET 60 16.788 3.620 -8.598 493 1HE MET 60 1HE MET 60 13.688 0.846 -7.093 494 2HE MET 60 2HE MET 60 14.148 1.799 -5.661 495 3HE MET 60 3HE MET 60 13.607 2.623 -7.142 496 H ASP 61 H ASP 61 13.321 6.651 -9.040 497 HA ASP 61 HA ASP 61 11.129 6.874 -7.563 498 1HB ASP 61 1HB ASP 61 10.057 5.767 -9.860 499 2HB ASP 61 2HB ASP 61 10.538 7.443 -9.689 500 H GLY 62 H GLY 62 9.064 5.343 -7.659 501 1HA GLY 62 1HA GLY 62 9.836 2.788 -6.561 502 2HA GLY 62 2HA GLY 62 8.224 3.465 -6.680 503 H ILE 63 H ILE 63 9.367 3.986 -9.723 504 HA ILE 63 HA ILE 63 7.776 2.136 -10.956 505 HB ILE 63 HB ILE 63 10.239 3.594 -11.895 506 1HG1 ILE 63 1HG1 ILE 63 7.405 4.152 -12.724 507 2HG1 ILE 63 2HG1 ILE 63 7.988 4.736 -11.178 508 1HG2 ILE 63 1HG2 ILE 63 8.311 1.902 -13.504 509 2HG2 ILE 63 2HG2 ILE 63 9.458 3.070 -14.203 510 3HG2 ILE 63 3HG2 ILE 63 10.063 1.659 -13.302 511 1HD1 ILE 63 1HD1 ILE 63 10.030 5.670 -12.518 512 2HD1 ILE 63 2HD1 ILE 63 9.008 5.415 -13.953 513 3HD1 ILE 63 3HD1 ILE 63 8.472 6.518 -12.663 514 H GLU 64 H GLU 64 11.132 1.823 -9.769 515 HA GLU 64 HA GLU 64 11.348 -0.766 -10.993 516 1HB GLU 64 1HB GLU 64 13.204 0.984 -9.353 517 2HB GLU 64 2HB GLU 64 13.603 -0.697 -9.649 518 1HG GLU 64 1HG GLU 64 12.755 0.934 -12.029 519 2HG GLU 64 2HG GLU 64 14.325 1.298 -11.340 520 H ILE 65 H ILE 65 11.246 0.677 -7.666 521 HA ILE 65 HA ILE 65 11.496 -1.577 -6.174 522 HB ILE 65 HB ILE 65 10.099 1.024 -5.851 523 1HG1 ILE 65 1HG1 ILE 65 12.066 -0.325 -4.000 524 2HG1 ILE 65 2HG1 ILE 65 12.595 0.486 -5.461 525 1HG2 ILE 65 1HG2 ILE 65 8.488 -0.571 -4.897 526 2HG2 ILE 65 2HG2 ILE 65 9.772 -1.239 -3.861 527 3HG2 ILE 65 3HG2 ILE 65 9.245 0.448 -3.649 528 1HD1 ILE 65 1HD1 ILE 65 12.648 1.986 -3.455 529 2HD1 ILE 65 2HD1 ILE 65 11.562 2.597 -4.727 530 3HD1 ILE 65 3HD1 ILE 65 10.886 1.790 -3.292 531 H LEU 66 H LEU 66 8.317 -0.179 -7.264 532 HA LEU 66 HA LEU 66 6.793 -2.331 -6.450 533 1HB LEU 66 1HB LEU 66 6.399 -0.296 -8.640 534 2HB LEU 66 2HB LEU 66 5.176 -1.469 -8.196 535 HG LEU 66 HG LEU 66 4.484 0.333 -6.975 536 1HD1 LEU 66 1HD1 LEU 66 4.948 -0.011 -4.647 537 2HD1 LEU 66 2HD1 LEU 66 4.936 -1.595 -5.460 538 3HD1 LEU 66 3HD1 LEU 66 6.483 -0.832 -5.021 539 1HD2 LEU 66 1HD2 LEU 66 7.315 1.126 -6.262 540 2HD2 LEU 66 2HD2 LEU 66 6.450 1.727 -7.697 541 3HD2 LEU 66 3HD2 LEU 66 5.823 2.078 -6.069 542 H LYS 67 H LYS 67 8.831 -1.866 -9.328 543 HA LYS 67 HA LYS 67 7.747 -3.972 -10.835 544 1HB LYS 67 1HB LYS 67 9.833 -2.032 -11.068 545 2HB LYS 67 2HB LYS 67 10.523 -3.603 -11.420 546 1HG LYS 67 1HG LYS 67 8.144 -3.797 -12.789 547 2HG LYS 67 2HG LYS 67 8.432 -2.072 -12.907 548 1HD LYS 67 1HD LYS 67 9.514 -3.022 -14.820 549 2HD LYS 67 2HD LYS 67 10.809 -2.629 -13.707 550 1HE LYS 67 1HE LYS 67 10.551 -5.089 -12.843 551 2HE LYS 67 2HE LYS 67 9.623 -5.366 -14.304 552 1HZ LYS 67 1HZ LYS 67 11.764 -5.840 -14.919 553 2HZ LYS 67 2HZ LYS 67 11.622 -4.301 -15.444 554 3HZ LYS 67 3HZ LYS 67 12.432 -4.621 -14.062 555 H ARG 68 H ARG 68 10.855 -3.850 -8.945 556 HA ARG 68 HA ARG 68 11.378 -6.507 -9.138 557 1HB ARG 68 1HB ARG 68 12.158 -4.286 -7.295 558 2HB ARG 68 2HB ARG 68 12.405 -5.894 -6.643 559 1HG ARG 68 1HG ARG 68 13.788 -6.534 -8.565 560 2HG ARG 68 2HG ARG 68 13.411 -5.037 -9.395 561 1HD ARG 68 1HD ARG 68 15.443 -4.406 -8.478 562 2HD ARG 68 2HD ARG 68 14.413 -3.951 -7.136 563 HE ARG 68 HE ARG 68 15.343 -6.743 -7.050 564 1HH1 ARG 68 1HH1 ARG 68 15.995 -3.421 -6.089 565 2HH1 ARG 68 2HH1 ARG 68 17.031 -3.869 -4.775 566 1HH2 ARG 68 1HH2 ARG 68 16.710 -7.335 -5.317 567 2HH2 ARG 68 2HH2 ARG 68 17.441 -6.111 -4.333 568 H MET 69 H MET 69 9.232 -4.731 -6.884 569 HA MET 69 HA MET 69 8.892 -6.647 -4.970 570 1HB MET 69 1HB MET 69 7.649 -4.187 -5.838 571 2HB MET 69 2HB MET 69 6.355 -5.340 -5.578 572 1HG MET 69 1HG MET 69 6.521 -4.934 -3.349 573 2HG MET 69 2HG MET 69 8.091 -5.713 -3.368 574 1HE MET 69 1HE MET 69 6.189 -2.373 -2.894 575 2HE MET 69 2HE MET 69 6.855 -3.356 -1.567 576 3HE MET 69 3HE MET 69 7.511 -1.733 -1.888 577 H LYS 70 H LYS 70 6.866 -6.101 -7.945 578 HA LYS 70 HA LYS 70 5.353 -8.459 -7.491 579 1HB LYS 70 1HB LYS 70 4.124 -7.816 -9.329 580 2HB LYS 70 2HB LYS 70 4.750 -6.274 -8.781 581 1HG LYS 70 1HG LYS 70 5.157 -6.279 -11.130 582 2HG LYS 70 2HG LYS 70 6.717 -6.636 -10.416 583 1HD LYS 70 1HD LYS 70 6.812 -8.630 -11.491 584 2HD LYS 70 2HD LYS 70 5.289 -9.130 -10.782 585 1HE LYS 70 1HE LYS 70 4.037 -8.459 -12.629 586 2HE LYS 70 2HE LYS 70 5.124 -7.145 -13.031 587 1HZ LYS 70 1HZ LYS 70 6.341 -8.480 -14.300 588 2HZ LYS 70 2HZ LYS 70 6.305 -9.736 -13.257 589 3HZ LYS 70 3HZ LYS 70 5.059 -9.491 -14.285 590 H VAL 71 H VAL 71 8.179 -7.567 -9.542 591 HA VAL 71 HA VAL 71 8.310 -9.960 -10.958 592 HB VAL 71 HB VAL 71 10.551 -8.112 -10.117 593 1HG1 VAL 71 1HG1 VAL 71 11.835 -9.618 -11.169 594 2HG1 VAL 71 2HG1 VAL 71 10.426 -10.483 -11.828 595 3HG1 VAL 71 3HG1 VAL 71 11.071 -9.056 -12.675 596 1HG2 VAL 71 1HG2 VAL 71 9.364 -7.836 -12.812 597 2HG2 VAL 71 2HG2 VAL 71 8.312 -7.337 -11.466 598 3HG2 VAL 71 3HG2 VAL 71 9.917 -6.593 -11.664 599 H ILE 72 H ILE 72 9.181 -9.103 -7.640 600 HA ILE 72 HA ILE 72 10.871 -11.375 -7.267 601 HB ILE 72 HB ILE 72 9.764 -9.180 -5.579 602 1HG1 ILE 72 1HG1 ILE 72 11.965 -9.198 -6.975 603 2HG1 ILE 72 2HG1 ILE 72 11.959 -8.520 -5.359 604 1HG2 ILE 72 1HG2 ILE 72 11.102 -10.443 -3.675 605 2HG2 ILE 72 2HG2 ILE 72 9.371 -10.742 -3.961 606 3HG2 ILE 72 3HG2 ILE 72 10.588 -11.877 -4.595 607 1HD1 ILE 72 1HD1 ILE 72 13.069 -10.389 -4.419 608 2HD1 ILE 72 2HD1 ILE 72 12.620 -11.451 -5.775 609 3HD1 ILE 72 3HD1 ILE 72 13.862 -10.197 -6.001 610 H ASP 73 H ASP 73 7.472 -10.473 -6.413 611 HA ASP 73 HA ASP 73 6.865 -13.284 -6.444 612 1HB ASP 73 1HB ASP 73 7.103 -11.716 -3.997 613 2HB ASP 73 2HB ASP 73 5.438 -12.223 -4.203 614 H GLU 74 H GLU 74 4.365 -13.562 -6.350 615 HA GLU 74 HA GLU 74 3.144 -11.170 -7.488 616 1HB GLU 74 1HB GLU 74 1.847 -12.538 -8.914 617 2HB GLU 74 2HB GLU 74 3.420 -13.310 -8.923 618 1HG GLU 74 1HG GLU 74 2.622 -14.883 -7.116 619 2HG GLU 74 2HG GLU 74 1.036 -14.143 -7.203 620 H ASN 75 H ASN 75 3.200 -13.358 -4.822 621 HA ASN 75 HA ASN 75 0.460 -13.219 -4.188 622 1HB ASN 75 1HB ASN 75 1.430 -13.944 -1.842 623 2HB ASN 75 2HB ASN 75 1.581 -15.054 -3.189 624 1HD2 ASN 75 1HD2 ASN 75 3.452 -16.017 -3.201 625 2HD2 ASN 75 2HD2 ASN 75 5.000 -15.323 -2.849 626 H ILE 76 H ILE 76 3.198 -11.086 -3.933 627 HA ILE 76 HA ILE 76 2.502 -9.730 -1.560 628 HB ILE 76 HB ILE 76 4.722 -9.595 -2.293 629 1HG1 ILE 76 1HG1 ILE 76 3.323 -6.955 -2.800 630 2HG1 ILE 76 2HG1 ILE 76 3.948 -7.545 -1.272 631 1HG2 ILE 76 1HG2 ILE 76 3.549 -8.882 -4.966 632 2HG2 ILE 76 2HG2 ILE 76 5.211 -8.401 -4.551 633 3HG2 ILE 76 3HG2 ILE 76 4.756 -10.121 -4.546 634 1HD1 ILE 76 1HD1 ILE 76 5.675 -6.122 -2.001 635 2HD1 ILE 76 2HD1 ILE 76 6.249 -7.714 -2.553 636 3HD1 ILE 76 3HD1 ILE 76 5.480 -6.597 -3.705 637 H ARG 77 H ARG 77 1.095 -8.064 -1.165 638 HA ARG 77 HA ARG 77 -0.344 -7.121 -3.515 639 1HB ARG 77 1HB ARG 77 -2.153 -8.036 -2.443 640 2HB ARG 77 2HB ARG 77 -1.281 -8.203 -0.932 641 1HG ARG 77 1HG ARG 77 -1.781 -5.961 -0.254 642 2HG ARG 77 2HG ARG 77 -2.222 -5.472 -1.878 643 1HD ARG 77 1HD ARG 77 -3.880 -7.724 -0.983 644 2HD ARG 77 2HD ARG 77 -3.974 -6.392 0.152 645 HE ARG 77 HE ARG 77 -5.282 -6.452 -2.335 646 1HH1 ARG 77 1HH1 ARG 77 -3.086 -4.272 -0.659 647 2HH1 ARG 77 2HH1 ARG 77 -3.697 -2.851 -1.440 648 1HH2 ARG 77 1HH2 ARG 77 -6.089 -4.578 -3.365 649 2HH2 ARG 77 2HH2 ARG 77 -5.416 -3.027 -2.989 650 H VAL 78 H VAL 78 0.181 -4.999 -3.937 651 HA VAL 78 HA VAL 78 0.341 -3.182 -1.661 652 HB VAL 78 HB VAL 78 2.618 -4.164 -2.685 653 1HG1 VAL 78 1HG1 VAL 78 3.602 -2.634 -4.292 654 2HG1 VAL 78 2HG1 VAL 78 2.097 -3.311 -4.960 655 3HG1 VAL 78 3HG1 VAL 78 2.117 -1.652 -4.316 656 1HG2 VAL 78 1HG2 VAL 78 1.876 -2.107 -0.968 657 2HG2 VAL 78 2HG2 VAL 78 3.525 -2.727 -1.226 658 3HG2 VAL 78 3HG2 VAL 78 2.952 -1.311 -2.141 659 H ILE 79 H ILE 79 -0.303 -1.032 -2.162 660 HA ILE 79 HA ILE 79 -1.546 -0.814 -4.814 661 HB ILE 79 HB ILE 79 -2.457 -0.156 -2.083 662 1HG1 ILE 79 1HG1 ILE 79 -3.695 -1.084 -4.673 663 2HG1 ILE 79 2HG1 ILE 79 -3.553 -1.948 -3.155 664 1HG2 ILE 79 1HG2 ILE 79 -3.196 1.626 -4.420 665 2HG2 ILE 79 2HG2 ILE 79 -3.867 1.690 -2.773 666 3HG2 ILE 79 3HG2 ILE 79 -2.156 2.093 -3.053 667 1HD1 ILE 79 1HD1 ILE 79 -5.332 0.457 -3.741 668 2HD1 ILE 79 2HD1 ILE 79 -5.845 -1.198 -3.336 669 3HD1 ILE 79 3HD1 ILE 79 -5.065 -0.181 -2.101 670 H ILE 80 H ILE 80 -1.233 1.086 -6.023 671 HA ILE 80 HA ILE 80 1.021 2.684 -5.061 672 HB ILE 80 HB ILE 80 1.464 3.199 -7.341 673 1HG1 ILE 80 1HG1 ILE 80 0.030 2.147 -9.167 674 2HG1 ILE 80 2HG1 ILE 80 -1.186 1.867 -7.937 675 1HG2 ILE 80 1HG2 ILE 80 2.505 1.262 -7.670 676 2HG2 ILE 80 2HG2 ILE 80 1.619 0.640 -6.257 677 3HG2 ILE 80 3HG2 ILE 80 0.970 0.389 -7.896 678 1HD1 ILE 80 1HD1 ILE 80 -0.841 4.226 -9.411 679 2HD1 ILE 80 2HD1 ILE 80 -1.832 4.045 -7.944 680 3HD1 ILE 80 3HD1 ILE 80 -0.151 4.616 -7.817 681 H MET 81 H MET 81 0.954 5.008 -5.213 682 HA MET 81 HA MET 81 -1.689 6.095 -5.686 683 1HB MET 81 1HB MET 81 -0.386 7.388 -3.389 684 2HB MET 81 2HB MET 81 -2.002 6.717 -3.491 685 1HG MET 81 1HG MET 81 -1.173 4.462 -3.001 686 2HG MET 81 2HG MET 81 0.493 4.994 -3.119 687 1HE MET 81 1HE MET 81 1.807 5.307 -1.238 688 2HE MET 81 2HE MET 81 1.232 5.325 0.447 689 3HE MET 81 3HE MET 81 0.902 3.917 -0.591 690 H THR 82 H THR 82 -1.561 7.894 -6.967 691 HA THR 82 HA THR 82 0.273 9.949 -6.634 692 HB THR 82 HB THR 82 2.107 8.631 -7.351 693 HG1 THR 82 HG1 THR 82 0.833 9.454 -9.855 694 1HG2 THR 82 1HG2 THR 82 2.022 6.998 -9.171 695 2HG2 THR 82 2HG2 THR 82 0.689 6.619 -8.053 696 3HG2 THR 82 3HG2 THR 82 0.355 7.473 -9.578 697 H ALA 83 H ALA 83 0.019 11.649 -8.222 698 HA ALA 83 HA ALA 83 -2.599 11.893 -9.085 699 1HB ALA 83 1HB ALA 83 -1.833 13.927 -10.137 700 2HB ALA 83 2HB ALA 83 -0.912 13.718 -8.629 701 3HB ALA 83 3HB ALA 83 -0.157 13.329 -10.193 702 H TYR 84 H TYR 84 -3.428 12.088 -11.337 703 HA TYR 84 HA TYR 84 -2.644 9.797 -12.846 704 1HB TYR 84 1HB TYR 84 -4.527 10.672 -14.291 705 2HB TYR 84 2HB TYR 84 -4.994 10.667 -12.602 706 HD1 TYR 84 HD1 TYR 84 -4.211 12.757 -15.506 707 HD2 TYR 84 HD2 TYR 84 -5.202 12.780 -11.344 708 HE1 TYR 84 HE1 TYR 84 -4.783 15.230 -15.649 709 HE2 TYR 84 HE2 TYR 84 -5.771 15.253 -11.501 710 HH TYR 84 HH TYR 84 -5.408 17.103 -12.789 711 H GLY 85 H GLY 85 -3.269 11.093 -15.478 712 1HA GLY 85 1HA GLY 85 -2.271 12.347 -17.102 713 2HA GLY 85 2HA GLY 85 -1.122 12.974 -15.937 714 H GLU 86 H GLU 86 0.111 10.740 -14.869 715 HA GLU 86 HA GLU 86 1.575 9.848 -17.177 716 1HB GLU 86 1HB GLU 86 3.062 8.812 -15.312 717 2HB GLU 86 2HB GLU 86 3.018 10.558 -15.454 718 1HG GLU 86 1HG GLU 86 1.673 10.825 -13.533 719 2HG GLU 86 2HG GLU 86 1.015 9.204 -13.637 720 H LEU 87 H LEU 87 -0.980 8.779 -17.252 721 HA LEU 87 HA LEU 87 -1.543 6.495 -15.917 722 1HB LEU 87 1HB LEU 87 -1.979 7.090 -18.847 723 2HB LEU 87 2HB LEU 87 -2.772 5.807 -17.954 724 HG LEU 87 HG LEU 87 -3.023 8.758 -17.308 725 1HD1 LEU 87 1HD1 LEU 87 -5.360 8.459 -18.218 726 2HD1 LEU 87 2HD1 LEU 87 -4.049 8.449 -19.423 727 3HD1 LEU 87 3HD1 LEU 87 -4.805 6.919 -18.916 728 1HD2 LEU 87 1HD2 LEU 87 -3.884 6.303 -15.945 729 2HD2 LEU 87 2HD2 LEU 87 -3.710 7.965 -15.332 730 3HD2 LEU 87 3HD2 LEU 87 -5.187 7.489 -16.204 731 H ASP 88 H ASP 88 0.899 7.009 -18.467 732 HA ASP 88 HA ASP 88 1.408 4.548 -19.317 733 1HB ASP 88 1HB ASP 88 2.911 7.007 -18.956 734 2HB ASP 88 2HB ASP 88 3.965 5.651 -18.609 735 H MET 89 H MET 89 2.896 6.077 -16.352 736 HA MET 89 HA MET 89 4.186 3.791 -15.500 737 1HB MET 89 1HB MET 89 4.336 6.326 -14.751 738 2HB MET 89 2HB MET 89 3.051 5.923 -13.630 739 1HG MET 89 1HG MET 89 5.347 4.010 -13.641 740 2HG MET 89 2HG MET 89 5.737 5.624 -13.080 741 1HE MET 89 1HE MET 89 6.153 4.865 -10.410 742 2HE MET 89 2HE MET 89 5.232 3.448 -9.852 743 3HE MET 89 3HE MET 89 6.178 3.358 -11.357 744 H ILE 90 H ILE 90 1.111 5.265 -14.214 745 HA ILE 90 HA ILE 90 0.451 3.356 -12.412 746 HB ILE 90 HB ILE 90 -1.311 4.964 -14.258 747 1HG1 ILE 90 1HG1 ILE 90 -1.555 6.001 -11.736 748 2HG1 ILE 90 2HG1 ILE 90 0.122 5.492 -11.729 749 1HG2 ILE 90 1HG2 ILE 90 -3.125 4.533 -12.633 750 2HG2 ILE 90 2HG2 ILE 90 -2.599 3.067 -13.495 751 3HG2 ILE 90 3HG2 ILE 90 -2.081 3.346 -11.815 752 1HD1 ILE 90 1HD1 ILE 90 -1.060 7.776 -13.048 753 2HD1 ILE 90 2HD1 ILE 90 0.659 7.324 -12.940 754 3HD1 ILE 90 3HD1 ILE 90 -0.341 6.709 -14.278 755 H GLN 91 H GLN 91 -0.210 3.311 -15.971 756 HA GLN 91 HA GLN 91 -1.678 1.048 -16.080 757 1HB GLN 91 1HB GLN 91 0.141 2.502 -17.929 758 2HB GLN 91 2HB GLN 91 -0.135 0.825 -18.357 759 1HG GLN 91 1HG GLN 91 -2.632 2.158 -17.551 760 2HG GLN 91 2HG GLN 91 -1.857 2.994 -18.883 761 1HE2 GLN 91 1HE2 GLN 91 -3.663 2.339 -20.146 762 2HE2 GLN 91 2HE2 GLN 91 -3.744 0.759 -20.852 763 H GLU 92 H GLU 92 1.945 1.258 -16.384 764 HA GLU 92 HA GLU 92 2.401 -1.422 -16.557 765 1HB GLU 92 1HB GLU 92 3.936 0.979 -16.127 766 2HB GLU 92 2HB GLU 92 4.520 -0.238 -15.010 767 1HG GLU 92 1HG GLU 92 5.195 -1.697 -16.719 768 2HG GLU 92 2HG GLU 92 4.019 -1.079 -17.863 769 H SER 93 H SER 93 1.879 0.639 -13.661 770 HA SER 93 HA SER 93 2.682 -1.156 -11.756 771 1HB SER 93 1HB SER 93 1.803 0.355 -10.263 772 2HB SER 93 2HB SER 93 1.729 1.365 -11.692 773 HG SER 93 HG SER 93 -0.339 1.520 -11.053 774 H LYS 94 H LYS 94 -0.337 -0.932 -13.656 775 HA LYS 94 HA LYS 94 -1.767 -2.792 -12.048 776 1HB LYS 94 1HB LYS 94 -2.344 -0.977 -14.121 777 2HB LYS 94 2HB LYS 94 -2.731 -2.556 -14.773 778 1HG LYS 94 1HG LYS 94 -3.901 -2.940 -12.418 779 2HG LYS 94 2HG LYS 94 -3.877 -1.191 -12.324 780 1HD LYS 94 1HD LYS 94 -5.837 -1.284 -13.490 781 2HD LYS 94 2HD LYS 94 -4.825 -1.560 -14.893 782 1HE LYS 94 1HE LYS 94 -5.789 -3.595 -15.158 783 2HE LYS 94 2HE LYS 94 -5.091 -4.105 -13.634 784 1HZ LYS 94 1HZ LYS 94 -7.766 -3.417 -14.217 785 2HZ LYS 94 2HZ LYS 94 -7.162 -4.211 -12.924 786 3HZ LYS 94 3HZ LYS 94 -7.214 -2.579 -12.928 787 H GLU 95 H GLU 95 -0.023 -2.957 -15.222 788 HA GLU 95 HA GLU 95 -0.513 -5.695 -15.518 789 1HB GLU 95 1HB GLU 95 0.729 -5.518 -17.485 790 2HB GLU 95 2HB GLU 95 0.229 -3.854 -17.255 791 1HG GLU 95 1HG GLU 95 2.445 -3.340 -17.413 792 2HG GLU 95 2HG GLU 95 2.569 -3.931 -15.767 793 H LEU 96 H LEU 96 1.604 -3.910 -13.459 794 HA LEU 96 HA LEU 96 3.727 -5.797 -13.365 795 1HB LEU 96 1HB LEU 96 3.071 -3.225 -12.260 796 2HB LEU 96 2HB LEU 96 3.626 -4.287 -10.981 797 HG LEU 96 HG LEU 96 5.704 -4.724 -12.195 798 1HD1 LEU 96 1HD1 LEU 96 4.879 -4.582 -14.480 799 2HD1 LEU 96 2HD1 LEU 96 4.618 -2.830 -14.297 800 3HD1 LEU 96 3HD1 LEU 96 6.269 -3.495 -14.243 801 1HD2 LEU 96 1HD2 LEU 96 5.583 -2.832 -10.630 802 2HD2 LEU 96 2HD2 LEU 96 6.730 -2.532 -11.958 803 3HD2 LEU 96 3HD2 LEU 96 5.128 -1.757 -11.974 804 H GLY 97 H GLY 97 0.482 -5.707 -12.160 805 1HA GLY 97 1HA GLY 97 -0.395 -7.765 -11.309 806 2HA GLY 97 2HA GLY 97 1.100 -8.020 -10.431 807 H ALA 98 H ALA 98 0.082 -4.699 -10.478 808 HA ALA 98 HA ALA 98 -0.251 -4.658 -7.682 809 1HB ALA 98 1HB ALA 98 -0.832 -2.291 -8.073 810 2HB ALA 98 2HB ALA 98 0.599 -2.763 -9.021 811 3HB ALA 98 3HB ALA 98 -0.987 -2.613 -9.817 812 H LEU 99 H LEU 99 -2.236 -3.938 -6.515 813 HA LEU 99 HA LEU 99 -4.465 -5.493 -7.424 814 1HB LEU 99 1HB LEU 99 -4.250 -3.703 -5.004 815 2HB LEU 99 2HB LEU 99 -5.434 -4.962 -5.290 816 HG LEU 99 HG LEU 99 -3.932 -5.895 -3.763 817 1HD1 LEU 99 1HD1 LEU 99 -4.293 -7.081 -6.180 818 2HD1 LEU 99 2HD1 LEU 99 -2.516 -7.069 -6.072 819 3HD1 LEU 99 3HD1 LEU 99 -3.480 -7.842 -4.791 820 1HD2 LEU 99 1HD2 LEU 99 -2.186 -4.044 -4.275 821 2HD2 LEU 99 2HD2 LEU 99 -1.633 -5.622 -3.664 822 3HD2 LEU 99 3HD2 LEU 99 -1.495 -5.241 -5.397 823 H THR 100 H THR 100 -3.772 -1.992 -6.794 824 HA THR 100 HA THR 100 -5.468 -1.231 -8.957 825 HB THR 100 HB THR 100 -7.043 -1.827 -6.957 826 HG1 THR 100 HG1 THR 100 -7.936 -0.520 -8.561 827 1HG2 THR 100 1HG2 THR 100 -6.800 -0.661 -5.009 828 2HG2 THR 100 2HG2 THR 100 -5.325 0.090 -5.663 829 3HG2 THR 100 3HG2 THR 100 -6.906 0.871 -5.909 830 H HIS 101 H HIS 101 -5.652 1.263 -9.025 831 HA HIS 101 HA HIS 101 -3.308 2.428 -7.736 832 1HB HIS 101 1HB HIS 101 -2.941 3.649 -9.981 833 2HB HIS 101 2HB HIS 101 -2.357 2.007 -9.798 834 HD1 HIS 101 HD1 HIS 101 -2.817 0.621 -11.812 835 HD2 HIS 101 HD2 HIS 101 -5.809 3.492 -11.174 836 HE1 HIS 101 HE1 HIS 101 -4.500 0.334 -13.708 837 H PHE 102 H PHE 102 -3.827 4.291 -6.700 838 HA PHE 102 HA PHE 102 -6.378 5.519 -7.448 839 1HB PHE 102 1HB PHE 102 -4.604 5.695 -4.937 840 2HB PHE 102 2HB PHE 102 -6.178 6.451 -5.092 841 HD1 PHE 102 HD1 PHE 102 -7.854 4.398 -6.245 842 HD2 PHE 102 HD2 PHE 102 -4.763 4.016 -3.364 843 HE1 PHE 102 HE1 PHE 102 -8.942 2.319 -5.354 844 HE2 PHE 102 HE2 PHE 102 -5.850 1.937 -2.473 845 HZ PHE 102 HZ PHE 102 -7.926 1.113 -3.479 846 H ALA 103 H ALA 103 -6.525 7.907 -7.373 847 HA ALA 103 HA ALA 103 -4.015 9.076 -8.318 848 1HB ALA 103 1HB ALA 103 -5.439 10.749 -9.365 849 2HB ALA 103 2HB ALA 103 -6.059 9.130 -9.770 850 3HB ALA 103 3HB ALA 103 -6.872 10.108 -8.525 851 H LYS 104 H LYS 104 -3.253 11.095 -7.463 852 HA LYS 104 HA LYS 104 -2.902 11.455 -4.942 853 1HB LYS 104 1HB LYS 104 -3.150 13.280 -7.183 854 2HB LYS 104 2HB LYS 104 -3.626 14.069 -5.692 855 1HG LYS 104 1HG LYS 104 -1.494 13.292 -4.614 856 2HG LYS 104 2HG LYS 104 -1.017 12.536 -6.121 857 1HD LYS 104 1HD LYS 104 -0.190 14.503 -6.880 858 2HD LYS 104 2HD LYS 104 -1.767 15.251 -6.724 859 1HE LYS 104 1HE LYS 104 -1.274 16.206 -4.667 860 2HE LYS 104 2HE LYS 104 -0.253 14.873 -4.166 861 1HZ LYS 104 1HZ LYS 104 1.526 15.745 -5.239 862 2HZ LYS 104 2HZ LYS 104 0.649 16.532 -6.370 863 3HZ LYS 104 3HZ LYS 104 0.759 17.135 -4.856 864 HA PRO 105 HA PRO 105 -7.154 13.213 -3.946 865 1HB PRO 105 1HB PRO 105 -9.057 13.509 -5.885 866 2HB PRO 105 2HB PRO 105 -7.983 14.803 -5.390 867 1HG PRO 105 1HG PRO 105 -7.898 13.162 -7.847 868 2HG PRO 105 2HG PRO 105 -7.126 14.702 -7.529 869 1HD PRO 105 1HD PRO 105 -5.869 12.124 -7.548 870 2HD PRO 105 2HD PRO 105 -5.124 13.651 -7.117 871 H PHE 106 H PHE 106 -7.261 11.314 -2.757 872 HA PHE 106 HA PHE 106 -9.214 9.470 -3.933 873 1HB PHE 106 1HB PHE 106 -7.657 7.881 -2.306 874 2HB PHE 106 2HB PHE 106 -7.326 8.085 -4.014 875 HD1 PHE 106 HD1 PHE 106 -5.084 8.320 -4.442 876 HD2 PHE 106 HD2 PHE 106 -6.674 10.140 -0.955 877 HE1 PHE 106 HE1 PHE 106 -2.817 9.248 -3.892 878 HE2 PHE 106 HE2 PHE 106 -4.408 11.068 -0.405 879 HZ PHE 106 HZ PHE 106 -2.506 10.611 -1.880 880 H ASP 107 H ASP 107 -10.557 8.325 -2.376 881 HA ASP 107 HA ASP 107 -10.619 9.747 0.168 882 1HB ASP 107 1HB ASP 107 -12.625 9.407 -1.767 883 2HB ASP 107 2HB ASP 107 -13.022 8.189 -0.571 884 H ILE 108 H ILE 108 -10.740 8.453 2.097 885 HA ILE 108 HA ILE 108 -9.639 5.914 2.000 886 HB ILE 108 HB ILE 108 -10.240 7.796 3.916 887 1HG1 ILE 108 1HG1 ILE 108 -8.256 6.374 3.837 888 2HG1 ILE 108 2HG1 ILE 108 -8.996 6.343 5.425 889 1HG2 ILE 108 1HG2 ILE 108 -11.480 6.573 5.668 890 2HG2 ILE 108 2HG2 ILE 108 -12.484 6.953 4.248 891 3HG2 ILE 108 3HG2 ILE 108 -11.864 5.301 4.483 892 1HD1 ILE 108 1HD1 ILE 108 -8.421 4.122 3.724 893 2HD1 ILE 108 2HD1 ILE 108 -9.231 4.097 5.308 894 3HD1 ILE 108 3HD1 ILE 108 -10.193 4.253 3.819 895 H ASP 109 H ASP 109 -13.082 6.983 2.256 896 HA ASP 109 HA ASP 109 -14.273 4.632 2.710 897 1HB ASP 109 1HB ASP 109 -14.971 7.158 1.382 898 2HB ASP 109 2HB ASP 109 -15.841 5.816 0.667 899 H GLU 110 H GLU 110 -12.871 5.899 -0.354 900 HA GLU 110 HA GLU 110 -13.914 3.838 -1.960 901 1HB GLU 110 1HB GLU 110 -11.422 5.408 -2.658 902 2HB GLU 110 2HB GLU 110 -12.688 4.833 -3.725 903 1HG GLU 110 1HG GLU 110 -13.962 6.542 -1.811 904 2HG GLU 110 2HG GLU 110 -12.506 7.373 -2.322 905 H ILE 111 H ILE 111 -10.825 4.392 -0.199 906 HA ILE 111 HA ILE 111 -9.516 2.139 -1.287 907 HB ILE 111 HB ILE 111 -9.061 4.055 0.948 908 1HG1 ILE 111 1HG1 ILE 111 -7.464 3.160 -1.467 909 2HG1 ILE 111 2HG1 ILE 111 -8.346 4.663 -1.287 910 1HG2 ILE 111 1HG2 ILE 111 -7.555 1.445 0.632 911 2HG2 ILE 111 2HG2 ILE 111 -7.035 2.818 1.638 912 3HG2 ILE 111 3HG2 ILE 111 -8.542 1.952 2.023 913 1HD1 ILE 111 1HD1 ILE 111 -5.706 3.869 -0.162 914 2HD1 ILE 111 2HD1 ILE 111 -6.312 5.480 -0.614 915 3HD1 ILE 111 3HD1 ILE 111 -6.763 4.767 0.953 916 H ARG 112 H ARG 112 -11.715 2.695 1.470 917 HA ARG 112 HA ARG 112 -11.191 0.304 2.759 918 1HB ARG 112 1HB ARG 112 -13.700 2.049 2.663 919 2HB ARG 112 2HB ARG 112 -13.536 0.684 3.750 920 1HG ARG 112 1HG ARG 112 -11.297 1.825 4.511 921 2HG ARG 112 2HG ARG 112 -11.920 3.258 3.717 922 1HD ARG 112 1HD ARG 112 -12.932 3.674 5.731 923 2HD ARG 112 2HD ARG 112 -14.127 2.513 5.188 924 HE ARG 112 HE ARG 112 -12.022 1.023 6.367 925 1HH1 ARG 112 1HH1 ARG 112 -14.431 3.391 7.354 926 2HH1 ARG 112 2HH1 ARG 112 -14.524 2.807 8.982 927 1HH2 ARG 112 1HH2 ARG 112 -12.145 0.251 8.515 928 2HH2 ARG 112 2HH2 ARG 112 -13.216 1.009 9.646 929 H ASP 113 H ASP 113 -12.820 1.030 -0.227 930 HA ASP 113 HA ASP 113 -14.622 -1.139 -0.161 931 1HB ASP 113 1HB ASP 113 -14.095 1.107 -1.821 932 2HB ASP 113 2HB ASP 113 -13.825 -0.286 -2.850 933 H ALA 114 H ALA 114 -11.539 -0.394 -1.967 934 HA ALA 114 HA ALA 114 -11.280 -2.908 -3.148 935 1HB ALA 114 1HB ALA 114 -8.715 -1.699 -2.640 936 2HB ALA 114 2HB ALA 114 -9.631 -1.774 -4.164 937 3HB ALA 114 3HB ALA 114 -9.888 -0.421 -3.037 938 H VAL 115 H VAL 115 -10.226 -1.581 0.022 939 HA VAL 115 HA VAL 115 -8.672 -3.858 0.689 940 HB VAL 115 HB VAL 115 -9.838 -1.562 2.262 941 1HG1 VAL 115 1HG1 VAL 115 -8.928 -4.059 3.288 942 2HG1 VAL 115 2HG1 VAL 115 -7.690 -2.837 3.664 943 3HG1 VAL 115 3HG1 VAL 115 -9.374 -2.587 4.185 944 1HG2 VAL 115 1HG2 VAL 115 -7.991 -1.167 0.561 945 2HG2 VAL 115 2HG2 VAL 115 -7.647 -0.641 2.226 946 3HG2 VAL 115 3HG2 VAL 115 -6.940 -2.152 1.606 947 H LYS 116 H LYS 116 -12.081 -2.847 1.132 948 HA LYS 116 HA LYS 116 -12.655 -5.052 2.863 949 1HB LYS 116 1HB LYS 116 -13.855 -2.960 3.114 950 2HB LYS 116 2HB LYS 116 -14.419 -3.028 1.456 951 1HG LYS 116 1HG LYS 116 -15.039 -5.489 2.983 952 2HG LYS 116 2HG LYS 116 -15.766 -4.054 3.679 953 1HD LYS 116 1HD LYS 116 -17.377 -4.135 2.089 954 2HD LYS 116 2HD LYS 116 -16.161 -3.807 0.871 955 1HE LYS 116 1HE LYS 116 -16.040 -6.011 0.194 956 2HE LYS 116 2HE LYS 116 -16.233 -6.635 1.821 957 1HZ LYS 116 1HZ LYS 116 -18.220 -7.152 0.900 958 2HZ LYS 116 2HZ LYS 116 -18.610 -5.690 1.514 959 3HZ LYS 116 3HZ LYS 116 -18.278 -5.846 -0.078 960 H LYS 117 H LYS 117 -12.174 -4.626 -0.516 961 HA LYS 117 HA LYS 117 -13.941 -6.838 -1.189 962 1HB LYS 117 1HB LYS 117 -13.682 -4.623 -2.522 963 2HB LYS 117 2HB LYS 117 -12.189 -5.322 -3.117 964 1HG LYS 117 1HG LYS 117 -13.327 -7.187 -4.121 965 2HG LYS 117 2HG LYS 117 -14.800 -6.880 -3.222 966 1HD LYS 117 1HD LYS 117 -15.345 -5.987 -5.322 967 2HD LYS 117 2HD LYS 117 -14.802 -4.556 -4.468 968 1HE LYS 117 1HE LYS 117 -13.737 -4.586 -6.664 969 2HE LYS 117 2HE LYS 117 -12.503 -4.868 -5.452 970 1HZ LYS 117 1HZ LYS 117 -12.112 -6.848 -6.306 971 2HZ LYS 117 2HZ LYS 117 -13.685 -7.287 -6.290 972 3HZ LYS 117 3HZ LYS 117 -13.079 -6.468 -7.566 973 H TYR 118 H TYR 118 -10.503 -5.975 -0.788 974 HA TYR 118 HA TYR 118 -9.713 -8.611 -1.748 975 1HB TYR 118 1HB TYR 118 -8.665 -6.125 -2.077 976 2HB TYR 118 2HB TYR 118 -7.945 -6.450 -0.512 977 HD1 TYR 118 HD1 TYR 118 -6.601 -8.702 -0.304 978 HD2 TYR 118 HD2 TYR 118 -7.563 -6.813 -4.020 979 HE1 TYR 118 HE1 TYR 118 -4.711 -9.964 -1.444 980 HE2 TYR 118 HE2 TYR 118 -5.670 -8.081 -5.147 981 HH TYR 118 HH TYR 118 -4.263 -10.730 -3.864 982 H LEU 119 H LEU 119 -9.568 -6.536 1.217 983 HA LEU 119 HA LEU 119 -8.874 -8.970 2.708 984 1HB LEU 119 1HB LEU 119 -7.991 -6.160 2.865 985 2HB LEU 119 2HB LEU 119 -8.345 -6.913 4.407 986 HG LEU 119 HG LEU 119 -5.946 -7.021 3.645 987 1HD1 LEU 119 1HD1 LEU 119 -6.803 -8.470 5.408 988 2HD1 LEU 119 2HD1 LEU 119 -7.339 -9.657 4.195 989 3HD1 LEU 119 3HD1 LEU 119 -5.603 -9.325 4.410 990 1HD2 LEU 119 1HD2 LEU 119 -5.300 -8.672 1.984 991 2HD2 LEU 119 2HD2 LEU 119 -7.008 -9.071 1.681 992 3HD2 LEU 119 3HD2 LEU 119 -6.383 -7.458 1.263 993 HA PRO 120 HA PRO 120 -12.631 -8.637 4.801 994 1HB PRO 120 1HB PRO 120 -12.054 -9.687 7.258 995 2HB PRO 120 2HB PRO 120 -12.340 -10.673 5.838 996 1HG PRO 120 1HG PRO 120 -9.779 -10.051 7.177 997 2HG PRO 120 2HG PRO 120 -10.142 -11.341 6.048 998 1HD PRO 120 1HD PRO 120 -8.723 -8.913 5.481 999 2HD PRO 120 2HD PRO 120 -9.188 -10.149 4.329 1000 H LEU 121 H LEU 121 -11.844 -6.175 4.529 1001 HA LEU 121 HA LEU 121 -11.396 -4.961 7.073 1002 1HB LEU 121 1HB LEU 121 -10.401 -3.961 5.181 1003 2HB LEU 121 2HB LEU 121 -11.910 -3.934 4.291 1004 HG LEU 121 HG LEU 121 -12.793 -2.273 5.961 1005 1HD1 LEU 121 1HD1 LEU 121 -11.595 -1.453 7.693 1006 2HD1 LEU 121 2HD1 LEU 121 -10.783 -3.033 7.578 1007 3HD1 LEU 121 3HD1 LEU 121 -10.041 -1.595 6.837 1008 1HD2 LEU 121 1HD2 LEU 121 -11.386 -1.875 3.689 1009 2HD2 LEU 121 2HD2 LEU 121 -12.104 -0.567 4.659 1010 3HD2 LEU 121 3HD2 LEU 121 -10.381 -0.970 4.846 1011 H LYS 122 H LYS 122 -12.906 -3.126 7.830 1012 HA LYS 122 HA LYS 122 -15.261 -4.158 8.681 1013 1HB LYS 122 1HB LYS 122 -14.136 -2.111 9.529 1014 2HB LYS 122 2HB LYS 122 -14.684 -1.235 8.114 1015 1HG LYS 122 1HG LYS 122 -17.080 -2.182 8.851 1016 2HG LYS 122 2HG LYS 122 -16.308 -2.326 10.417 1017 1HD LYS 122 1HD LYS 122 -16.925 -0.138 10.684 1018 2HD LYS 122 2HD LYS 122 -15.508 0.209 9.714 1019 1HE LYS 122 1HE LYS 122 -16.778 0.497 7.720 1020 2HE LYS 122 2HE LYS 122 -18.152 -0.389 8.351 1021 1HZ LYS 122 1HZ LYS 122 -17.417 1.947 9.848 1022 2HZ LYS 122 2HZ LYS 122 -17.984 2.242 8.346 1023 3HZ LYS 122 3HZ LYS 122 -18.896 1.410 9.414 1024 H SER 123 H SER 123 -16.947 -4.995 7.583 1025 HA SER 123 HA SER 123 -17.343 -4.421 4.884 1026 1HB SER 123 1HB SER 123 -19.223 -5.707 6.914 1027 2HB SER 123 2HB SER 123 -19.450 -5.751 5.177 1028 HG SER 123 HG SER 123 -17.411 -6.895 4.988 1029 H ASN 124 H ASN 124 -18.121 -2.508 4.077 1030 HA ASN 124 HA ASN 124 -19.515 -0.729 5.757 1031 1HB ASN 124 1HB ASN 124 -18.046 -0.509 3.403 1032 2HB ASN 124 2HB ASN 124 -19.680 -0.295 2.806 1033 1HD2 ASN 124 1HD2 ASN 124 -17.659 0.682 5.575 1034 2HD2 ASN 124 2HD2 ASN 124 -18.142 2.344 5.624 Start of MODEL 17 1 1H MET 1 1H MET 1 -12.163 -12.104 16.120 2 HA MET 1 HA MET 1 -10.686 -11.519 18.027 3 1HB MET 1 1HB MET 1 -11.539 -14.378 18.627 4 2HB MET 1 2HB MET 1 -9.957 -13.840 19.156 5 1HG MET 1 1HG MET 1 -10.995 -11.955 20.412 6 2HG MET 1 2HG MET 1 -12.583 -12.432 19.845 7 1HE MET 1 1HE MET 1 -13.649 -12.922 22.412 8 2HE MET 1 2HE MET 1 -12.454 -13.370 23.652 9 3HE MET 1 3HE MET 1 -12.180 -11.940 22.628 10 H MET 2 H MET 2 -9.979 -11.292 15.623 11 HA MET 2 HA MET 2 -8.172 -13.497 14.995 12 1HB MET 2 1HB MET 2 -10.188 -12.400 13.432 13 2HB MET 2 2HB MET 2 -8.818 -11.441 12.907 14 1HG MET 2 1HG MET 2 -7.545 -13.667 12.580 15 2HG MET 2 2HG MET 2 -9.078 -14.481 12.825 16 1HE MET 2 1HE MET 2 -7.988 -14.306 8.942 17 2HE MET 2 2HE MET 2 -6.834 -13.400 9.950 18 3HE MET 2 3HE MET 2 -7.451 -14.975 10.502 19 H ASN 3 H ASN 3 -6.814 -11.832 12.908 20 HA ASN 3 HA ASN 3 -5.698 -9.665 14.407 21 1HB ASN 3 1HB ASN 3 -3.315 -10.595 13.970 22 2HB ASN 3 2HB ASN 3 -4.218 -11.353 15.266 23 1HD2 ASN 3 1HD2 ASN 3 -3.168 -13.282 15.163 24 2HD2 ASN 3 2HD2 ASN 3 -3.335 -14.420 13.867 25 H GLU 4 H GLU 4 -4.396 -8.248 12.957 26 HA GLU 4 HA GLU 4 -4.468 -9.062 10.169 27 1HB GLU 4 1HB GLU 4 -6.219 -7.154 11.282 28 2HB GLU 4 2HB GLU 4 -4.982 -6.192 10.498 29 1HG GLU 4 1HG GLU 4 -5.662 -6.803 8.402 30 2HG GLU 4 2HG GLU 4 -5.828 -8.490 8.846 31 H LYS 5 H LYS 5 -3.025 -7.558 8.782 32 HA LYS 5 HA LYS 5 -0.983 -6.188 10.303 33 1HB LYS 5 1HB LYS 5 -0.315 -8.597 8.585 34 2HB LYS 5 2HB LYS 5 0.853 -7.491 9.280 35 1HG LYS 5 1HG LYS 5 -1.184 -9.000 10.977 36 2HG LYS 5 2HG LYS 5 0.400 -9.653 10.607 37 1HD LYS 5 1HD LYS 5 0.074 -6.889 11.840 38 2HD LYS 5 2HD LYS 5 0.122 -8.331 12.835 39 1HE LYS 5 1HE LYS 5 2.312 -8.707 11.145 40 2HE LYS 5 2HE LYS 5 2.322 -6.971 11.384 41 1HZ LYS 5 1HZ LYS 5 3.416 -8.604 13.080 42 2HZ LYS 5 2HZ LYS 5 2.727 -7.208 13.573 43 3HZ LYS 5 3HZ LYS 5 1.917 -8.618 13.726 44 H ILE 6 H ILE 6 -0.091 -4.494 9.147 45 HA ILE 6 HA ILE 6 -0.383 -4.455 6.281 46 HB ILE 6 HB ILE 6 -2.343 -3.227 7.976 47 1HG1 ILE 6 1HG1 ILE 6 -2.518 -2.659 5.117 48 2HG1 ILE 6 2HG1 ILE 6 -2.137 -4.341 5.427 49 1HG2 ILE 6 1HG2 ILE 6 -2.339 -0.965 6.984 50 2HG2 ILE 6 2HG2 ILE 6 -0.926 -1.265 8.025 51 3HG2 ILE 6 3HG2 ILE 6 -0.752 -1.307 6.254 52 1HD1 ILE 6 1HD1 ILE 6 -4.211 -4.774 6.259 53 2HD1 ILE 6 2HD1 ILE 6 -4.207 -3.301 7.258 54 3HD1 ILE 6 3HD1 ILE 6 -4.680 -3.213 5.544 55 H LEU 7 H LEU 7 0.846 -2.653 5.311 56 HA LEU 7 HA LEU 7 2.692 -1.410 7.215 57 1HB LEU 7 1HB LEU 7 3.355 -3.547 5.558 58 2HB LEU 7 2HB LEU 7 3.953 -2.141 4.700 59 HG LEU 7 HG LEU 7 4.875 -1.605 7.204 60 1HD1 LEU 7 1HD1 LEU 7 3.915 -3.941 7.823 61 2HD1 LEU 7 2HD1 LEU 7 5.363 -4.562 6.995 62 3HD1 LEU 7 3HD1 LEU 7 5.535 -3.475 8.395 63 1HD2 LEU 7 1HD2 LEU 7 5.946 -2.035 4.743 64 2HD2 LEU 7 2HD2 LEU 7 6.891 -1.715 6.217 65 3HD2 LEU 7 3HD2 LEU 7 6.649 -3.389 5.661 66 H ILE 8 H ILE 8 3.440 0.671 6.606 67 HA ILE 8 HA ILE 8 2.069 1.759 4.246 68 HB ILE 8 HB ILE 8 2.395 2.932 7.001 69 1HG1 ILE 8 1HG1 ILE 8 -0.123 2.722 5.352 70 2HG1 ILE 8 2HG1 ILE 8 0.437 1.380 6.330 71 1HG2 ILE 8 1HG2 ILE 8 0.992 4.717 5.281 72 2HG2 ILE 8 2HG2 ILE 8 2.510 4.983 6.173 73 3HG2 ILE 8 3HG2 ILE 8 2.553 4.326 4.519 74 1HD1 ILE 8 1HD1 ILE 8 0.664 3.415 8.152 75 2HD1 ILE 8 2HD1 ILE 8 -0.707 3.998 7.178 76 3HD1 ILE 8 3HD1 ILE 8 -0.792 2.407 7.972 77 H VAL 9 H VAL 9 3.643 1.954 2.727 78 HA VAL 9 HA VAL 9 6.282 2.815 3.629 79 HB VAL 9 HB VAL 9 5.345 1.762 0.954 80 1HG1 VAL 9 1HG1 VAL 9 7.383 3.186 0.874 81 2HG1 VAL 9 2HG1 VAL 9 8.163 2.087 2.036 82 3HG1 VAL 9 3HG1 VAL 9 7.696 1.492 0.424 83 1HG2 VAL 9 1HG2 VAL 9 5.070 0.051 2.654 84 2HG2 VAL 9 2HG2 VAL 9 6.474 -0.344 1.632 85 3HG2 VAL 9 3HG2 VAL 9 6.720 0.339 3.257 86 H ASP 10 H ASP 10 7.040 4.852 3.265 87 HA ASP 10 HA ASP 10 6.930 6.985 2.827 88 1HB ASP 10 1HB ASP 10 5.865 6.320 0.065 89 2HB ASP 10 2HB ASP 10 7.011 7.568 0.513 90 H ASP 11 H ASP 11 5.337 8.681 1.246 91 HA ASP 11 HA ASP 11 3.417 9.677 1.106 92 1HB ASP 11 1HB ASP 11 2.733 7.294 0.237 93 2HB ASP 11 2HB ASP 11 1.952 7.103 1.794 94 H GLN 12 H GLN 12 4.765 8.613 3.825 95 HA GLN 12 HA GLN 12 2.526 8.811 5.602 96 1HB GLN 12 1HB GLN 12 4.464 8.629 7.347 97 2HB GLN 12 2HB GLN 12 4.086 7.231 6.361 98 1HG GLN 12 1HG GLN 12 6.040 7.392 5.119 99 2HG GLN 12 2HG GLN 12 6.080 9.143 5.200 100 1HE2 GLN 12 1HE2 GLN 12 6.149 9.890 7.665 101 2HE2 GLN 12 2HE2 GLN 12 7.454 9.212 8.580 102 H TYR 13 H TYR 13 1.685 10.828 5.957 103 HA TYR 13 HA TYR 13 3.518 12.884 6.867 104 1HB TYR 13 1HB TYR 13 2.517 12.688 4.189 105 2HB TYR 13 2HB TYR 13 1.464 13.862 4.955 106 HD1 TYR 13 HD1 TYR 13 4.274 13.600 2.996 107 HD2 TYR 13 HD2 TYR 13 2.943 15.598 6.538 108 HE1 TYR 13 HE1 TYR 13 6.024 15.410 2.641 109 HE2 TYR 13 HE2 TYR 13 4.697 17.401 6.171 110 HH TYR 13 HH TYR 13 6.306 18.117 4.931 111 H GLY 14 H GLY 14 1.356 11.112 8.001 112 1HA GLY 14 1HA GLY 14 0.081 11.820 9.875 113 2HA GLY 14 2HA GLY 14 -0.348 13.291 9.024 114 H ILE 15 H ILE 15 -0.466 11.072 6.592 115 HA ILE 15 HA ILE 15 -3.337 10.783 6.905 116 HB ILE 15 HB ILE 15 -1.400 10.535 4.627 117 1HG1 ILE 15 1HG1 ILE 15 -3.600 12.056 3.882 118 2HG1 ILE 15 2HG1 ILE 15 -3.382 12.474 5.570 119 1HG2 ILE 15 1HG2 ILE 15 -2.672 8.700 4.070 120 2HG2 ILE 15 2HG2 ILE 15 -4.140 9.339 4.848 121 3HG2 ILE 15 3HG2 ILE 15 -3.592 10.011 3.294 122 1HD1 ILE 15 1HD1 ILE 15 -1.254 13.376 5.229 123 2HD1 ILE 15 2HD1 ILE 15 -0.934 12.349 3.811 124 3HD1 ILE 15 3HD1 ILE 15 -2.022 13.750 3.667 125 H ARG 16 H ARG 16 -0.323 8.861 6.783 126 HA ARG 16 HA ARG 16 -1.393 6.399 6.415 127 1HB ARG 16 1HB ARG 16 0.617 5.636 7.904 128 2HB ARG 16 2HB ARG 16 0.979 6.539 6.446 129 1HG ARG 16 1HG ARG 16 1.353 8.580 7.669 130 2HG ARG 16 2HG ARG 16 0.600 7.945 9.118 131 1HD ARG 16 1HD ARG 16 2.994 6.466 8.031 132 2HD ARG 16 2HD ARG 16 3.282 8.006 8.816 133 HE ARG 16 HE ARG 16 1.539 6.166 10.323 134 1HH1 ARG 16 1HH1 ARG 16 4.824 7.307 9.782 135 2HH1 ARG 16 2HH1 ARG 16 5.404 6.757 11.318 136 1HH2 ARG 16 1HH2 ARG 16 2.304 5.440 12.350 137 2HH2 ARG 16 2HH2 ARG 16 3.961 5.688 12.789 138 H ILE 17 H ILE 17 -1.199 8.405 9.390 139 HA ILE 17 HA ILE 17 -1.995 6.379 11.173 140 HB ILE 17 HB ILE 17 -2.138 9.390 11.344 141 1HG1 ILE 17 1HG1 ILE 17 -0.136 7.652 12.758 142 2HG1 ILE 17 2HG1 ILE 17 0.115 8.059 11.072 143 1HG2 ILE 17 1HG2 ILE 17 -1.985 8.451 13.921 144 2HG2 ILE 17 2HG2 ILE 17 -3.458 9.040 13.114 145 3HG2 ILE 17 3HG2 ILE 17 -3.103 7.296 13.157 146 1HD1 ILE 17 1HD1 ILE 17 -0.348 10.529 11.801 147 2HD1 ILE 17 2HD1 ILE 17 -0.066 9.930 13.453 148 3HD1 ILE 17 3HD1 ILE 17 1.220 9.804 12.229 149 H LEU 18 H LEU 18 -3.800 8.977 9.410 150 HA LEU 18 HA LEU 18 -6.269 8.653 10.433 151 1HB LEU 18 1HB LEU 18 -5.356 10.172 8.561 152 2HB LEU 18 2HB LEU 18 -5.828 8.886 7.469 153 HG LEU 18 HG LEU 18 -7.853 9.947 9.410 154 1HD1 LEU 18 1HD1 LEU 18 -6.460 11.648 7.640 155 2HD1 LEU 18 2HD1 LEU 18 -8.057 11.353 6.911 156 3HD1 LEU 18 3HD1 LEU 18 -7.939 11.996 8.566 157 1HD2 LEU 18 1HD2 LEU 18 -8.908 8.297 8.291 158 2HD2 LEU 18 2HD2 LEU 18 -9.142 9.570 7.069 159 3HD2 LEU 18 3HD2 LEU 18 -7.817 8.395 6.888 160 H LEU 19 H LEU 19 -4.923 6.723 7.660 161 HA LEU 19 HA LEU 19 -7.139 4.949 7.701 162 1HB LEU 19 1HB LEU 19 -5.920 3.730 6.021 163 2HB LEU 19 2HB LEU 19 -5.909 5.448 5.675 164 HG LEU 19 HG LEU 19 -3.569 5.388 6.883 165 1HD1 LEU 19 1HD1 LEU 19 -2.514 3.091 6.078 166 2HD1 LEU 19 2HD1 LEU 19 -3.243 3.281 7.691 167 3HD1 LEU 19 3HD1 LEU 19 -4.168 2.509 6.381 168 1HD2 LEU 19 1HD2 LEU 19 -4.360 5.625 4.321 169 2HD2 LEU 19 2HD2 LEU 19 -2.655 5.625 4.832 170 3HD2 LEU 19 3HD2 LEU 19 -3.396 4.134 4.202 171 H ASN 20 H ASN 20 -4.161 5.258 9.508 172 HA ASN 20 HA ASN 20 -3.775 2.582 10.112 173 1HB ASN 20 1HB ASN 20 -2.170 4.530 10.548 174 2HB ASN 20 2HB ASN 20 -3.181 4.997 11.901 175 1HD2 ASN 20 1HD2 ASN 20 -0.914 4.636 12.815 176 2HD2 ASN 20 2HD2 ASN 20 -0.590 3.084 13.513 177 H GLU 21 H GLU 21 -5.182 5.272 12.147 178 HA GLU 21 HA GLU 21 -6.068 3.797 14.210 179 1HB GLU 21 1HB GLU 21 -6.201 6.189 14.309 180 2HB GLU 21 2HB GLU 21 -7.236 6.275 12.897 181 1HG GLU 21 1HG GLU 21 -9.082 5.191 14.125 182 2HG GLU 21 2HG GLU 21 -8.051 4.934 15.518 183 H VAL 22 H VAL 22 -7.446 4.042 10.943 184 HA VAL 22 HA VAL 22 -9.984 3.005 11.541 185 HB VAL 22 HB VAL 22 -8.277 3.242 9.082 186 1HG1 VAL 22 1HG1 VAL 22 -10.794 2.580 8.134 187 2HG1 VAL 22 2HG1 VAL 22 -9.363 1.521 8.139 188 3HG1 VAL 22 3HG1 VAL 22 -10.545 1.427 9.467 189 1HG2 VAL 22 1HG2 VAL 22 -9.276 5.293 9.819 190 2HG2 VAL 22 2HG2 VAL 22 -10.183 4.735 8.392 191 3HG2 VAL 22 3HG2 VAL 22 -10.865 4.515 10.022 192 H PHE 23 H PHE 23 -6.950 1.433 10.307 193 HA PHE 23 HA PHE 23 -8.140 -1.160 10.634 194 1HB PHE 23 1HB PHE 23 -5.391 -0.011 9.892 195 2HB PHE 23 2HB PHE 23 -5.646 -1.741 10.006 196 HD1 PHE 23 HD1 PHE 23 -8.013 -2.398 8.692 197 HD2 PHE 23 HD2 PHE 23 -5.349 0.762 7.733 198 HE1 PHE 23 HE1 PHE 23 -8.826 -2.433 6.318 199 HE2 PHE 23 HE2 PHE 23 -6.162 0.727 5.359 200 HZ PHE 23 HZ PHE 23 -7.890 -0.870 4.679 201 H ASN 24 H ASN 24 -6.424 1.112 12.618 202 HA ASN 24 HA ASN 24 -5.020 -0.729 14.185 203 1HB ASN 24 1HB ASN 24 -5.061 2.007 13.980 204 2HB ASN 24 2HB ASN 24 -6.021 1.819 15.434 205 1HD2 ASN 24 1HD2 ASN 24 -5.134 0.971 17.291 206 2HD2 ASN 24 2HD2 ASN 24 -3.430 0.792 17.544 207 H LYS 25 H LYS 25 -8.361 0.430 14.022 208 HA LYS 25 HA LYS 25 -9.233 0.049 16.598 209 1HB LYS 25 1HB LYS 25 -10.495 -0.032 13.889 210 2HB LYS 25 2HB LYS 25 -11.428 -0.639 15.242 211 1HG LYS 25 1HG LYS 25 -11.252 1.469 16.432 212 2HG LYS 25 2HG LYS 25 -10.030 2.068 15.329 213 1HD LYS 25 1HD LYS 25 -11.575 2.469 13.601 214 2HD LYS 25 2HD LYS 25 -12.704 1.262 14.183 215 1HE LYS 25 1HE LYS 25 -13.867 2.911 15.219 216 2HE LYS 25 2HE LYS 25 -12.504 3.153 16.294 217 1HZ LYS 25 1HZ LYS 25 -13.092 5.155 15.111 218 2HZ LYS 25 2HZ LYS 25 -11.582 4.686 14.706 219 3HZ LYS 25 3HZ LYS 25 -12.819 4.439 13.670 220 H GLU 26 H GLU 26 -8.005 -2.272 14.321 221 HA GLU 26 HA GLU 26 -9.338 -4.442 15.675 222 1HB GLU 26 1HB GLU 26 -7.482 -4.322 13.264 223 2HB GLU 26 2HB GLU 26 -8.041 -5.835 13.949 224 1HG GLU 26 1HG GLU 26 -10.251 -3.925 13.525 225 2HG GLU 26 2HG GLU 26 -9.393 -4.281 12.039 226 H GLY 27 H GLY 27 -6.341 -2.649 15.718 227 1HA GLY 27 1HA GLY 27 -4.764 -2.782 17.394 228 2HA GLY 27 2HA GLY 27 -5.338 -4.376 17.839 229 H TYR 28 H TYR 28 -4.953 -3.921 14.409 230 HA TYR 28 HA TYR 28 -2.983 -5.922 14.250 231 1HB TYR 28 1HB TYR 28 -3.264 -5.468 11.879 232 2HB TYR 28 2HB TYR 28 -4.816 -5.050 12.577 233 HD1 TYR 28 HD1 TYR 28 -3.959 -2.378 13.829 234 HD2 TYR 28 HD2 TYR 28 -3.329 -4.072 9.951 235 HE1 TYR 28 HE1 TYR 28 -3.774 -0.047 12.832 236 HE2 TYR 28 HE2 TYR 28 -3.145 -1.735 8.968 237 HH TYR 28 HH TYR 28 -2.761 1.010 10.906 238 H GLN 29 H GLN 29 -0.769 -5.811 13.614 239 HA GLN 29 HA GLN 29 0.497 -3.445 14.595 240 1HB GLN 29 1HB GLN 29 1.176 -6.223 14.298 241 2HB GLN 29 2HB GLN 29 2.374 -5.294 13.420 242 1HG GLN 29 1HG GLN 29 3.163 -4.221 15.332 243 2HG GLN 29 2HG GLN 29 1.606 -4.265 16.136 244 1HE2 GLN 29 1HE2 GLN 29 0.802 -6.373 16.853 245 2HE2 GLN 29 2HE2 GLN 29 1.919 -7.552 17.454 246 H THR 30 H THR 30 1.489 -1.837 13.388 247 HA THR 30 HA THR 30 1.614 -2.285 10.480 248 HB THR 30 HB THR 30 0.917 0.154 10.302 249 HG1 THR 30 HG1 THR 30 0.269 -0.361 13.114 250 1HG2 THR 30 1HG2 THR 30 -0.764 -2.082 11.003 251 2HG2 THR 30 2HG2 THR 30 -1.348 -0.665 11.907 252 3HG2 THR 30 3HG2 THR 30 -1.230 -0.602 10.132 253 H PHE 31 H PHE 31 3.234 -1.005 9.341 254 HA PHE 31 HA PHE 31 5.287 0.121 11.060 255 1HB PHE 31 1HB PHE 31 5.372 -2.530 10.140 256 2HB PHE 31 2HB PHE 31 6.216 -1.691 8.854 257 HD1 PHE 31 HD1 PHE 31 8.034 0.070 9.772 258 HD2 PHE 31 HD2 PHE 31 6.651 -3.351 11.867 259 HE1 PHE 31 HE1 PHE 31 10.136 0.061 11.145 260 HE2 PHE 31 HE2 PHE 31 8.752 -3.360 13.240 261 HZ PHE 31 HZ PHE 31 10.469 -1.654 12.862 262 H GLN 32 H GLN 32 6.697 1.601 9.960 263 HA GLN 32 HA GLN 32 5.672 2.305 7.322 264 1HB GLN 32 1HB GLN 32 6.917 4.043 9.494 265 2HB GLN 32 2HB GLN 32 6.589 4.619 7.872 266 1HG GLN 32 1HG GLN 32 4.635 5.261 9.008 267 2HG GLN 32 2HG GLN 32 4.144 3.740 8.289 268 1HE2 GLN 32 1HE2 GLN 32 2.812 2.819 9.659 269 2HE2 GLN 32 2HE2 GLN 32 3.085 2.530 11.345 270 H ALA 33 H ALA 33 7.256 3.104 5.718 271 HA ALA 33 HA ALA 33 10.027 2.423 6.343 272 1HB ALA 33 1HB ALA 33 10.130 0.686 4.906 273 2HB ALA 33 2HB ALA 33 8.351 0.684 4.954 274 3HB ALA 33 3HB ALA 33 9.205 1.560 3.661 275 H ALA 34 H ALA 34 11.485 3.211 4.444 276 HA ALA 34 HA ALA 34 10.291 5.628 3.278 277 1HB ALA 34 1HB ALA 34 11.574 6.542 5.003 278 2HB ALA 34 2HB ALA 34 12.814 5.269 4.894 279 3HB ALA 34 3HB ALA 34 12.729 6.538 3.648 280 H ASN 35 H ASN 35 10.283 3.203 1.919 281 HA ASN 35 HA ASN 35 11.358 3.784 -0.435 282 1HB ASN 35 1HB ASN 35 13.470 2.840 1.393 283 2HB ASN 35 2HB ASN 35 13.342 1.801 -0.012 284 1HD2 ASN 35 1HD2 ASN 35 15.550 3.394 0.551 285 2HD2 ASN 35 2HD2 ASN 35 15.725 4.616 -0.665 286 H GLY 36 H GLY 36 12.064 1.373 -1.609 287 1HA GLY 36 1HA GLY 36 9.735 -0.286 -1.067 288 2HA GLY 36 2HA GLY 36 10.827 -0.383 -2.434 289 H LEU 37 H LEU 37 13.353 -0.583 -1.227 290 HA LEU 37 HA LEU 37 13.484 -3.278 -0.634 291 1HB LEU 37 1HB LEU 37 15.244 -1.171 -1.095 292 2HB LEU 37 2HB LEU 37 15.654 -1.723 0.516 293 HG LEU 37 HG LEU 37 15.435 -3.608 -1.838 294 1HD1 LEU 37 1HD1 LEU 37 17.592 -3.258 -2.479 295 2HD1 LEU 37 2HD1 LEU 37 17.188 -1.613 -1.933 296 3HD1 LEU 37 3HD1 LEU 37 18.106 -2.704 -0.868 297 1HD2 LEU 37 1HD2 LEU 37 16.986 -3.937 0.737 298 2HD2 LEU 37 2HD2 LEU 37 15.311 -4.501 0.521 299 3HD2 LEU 37 3HD2 LEU 37 16.613 -5.167 -0.494 300 H GLN 38 H GLN 38 13.756 -0.449 1.634 301 HA GLN 38 HA GLN 38 13.952 -1.912 3.919 302 1HB GLN 38 1HB GLN 38 12.989 0.846 3.234 303 2HB GLN 38 2HB GLN 38 12.609 0.256 4.840 304 1HG GLN 38 1HG GLN 38 14.867 0.096 5.475 305 2HG GLN 38 2HG GLN 38 15.431 -0.104 3.828 306 1HE2 GLN 38 1HE2 GLN 38 15.373 1.935 6.361 307 2HE2 GLN 38 2HE2 GLN 38 15.544 3.473 5.582 308 H ALA 39 H ALA 39 11.162 -1.365 1.838 309 HA ALA 39 HA ALA 39 9.278 -2.178 3.872 310 1HB ALA 39 1HB ALA 39 9.184 -1.214 1.024 311 2HB ALA 39 2HB ALA 39 7.787 -2.102 1.679 312 3HB ALA 39 3HB ALA 39 8.332 -0.598 2.461 313 H LEU 40 H LEU 40 11.251 -3.568 1.297 314 HA LEU 40 HA LEU 40 9.714 -5.876 0.859 315 1HB LEU 40 1HB LEU 40 12.541 -5.042 0.349 316 2HB LEU 40 2HB LEU 40 12.095 -6.725 0.149 317 HG LEU 40 HG LEU 40 10.929 -4.349 -1.323 318 1HD1 LEU 40 1HD1 LEU 40 11.835 -5.788 -3.296 319 2HD1 LEU 40 2HD1 LEU 40 12.954 -4.778 -2.349 320 3HD1 LEU 40 3HD1 LEU 40 12.862 -6.530 -2.046 321 1HD2 LEU 40 1HD2 LEU 40 9.781 -6.964 -0.816 322 2HD2 LEU 40 2HD2 LEU 40 9.069 -5.533 -1.598 323 3HD2 LEU 40 3HD2 LEU 40 10.029 -6.686 -2.556 324 H ASP 41 H ASP 41 12.345 -5.050 3.179 325 HA ASP 41 HA ASP 41 12.477 -7.664 4.196 326 1HB ASP 41 1HB ASP 41 14.227 -5.759 4.343 327 2HB ASP 41 2HB ASP 41 13.254 -5.095 5.641 328 H ILE 42 H ILE 42 11.079 -4.510 5.371 329 HA ILE 42 HA ILE 42 9.953 -5.551 7.706 330 HB ILE 42 HB ILE 42 9.309 -3.121 6.040 331 1HG1 ILE 42 1HG1 ILE 42 11.463 -3.765 7.779 332 2HG1 ILE 42 2HG1 ILE 42 11.135 -2.254 6.955 333 1HG2 ILE 42 1HG2 ILE 42 8.391 -3.631 8.876 334 2HG2 ILE 42 2HG2 ILE 42 7.957 -2.282 7.799 335 3HG2 ILE 42 3HG2 ILE 42 7.372 -3.925 7.446 336 1HD1 ILE 42 1HD1 ILE 42 9.545 -1.645 8.846 337 2HD1 ILE 42 2HD1 ILE 42 10.110 -3.101 9.700 338 3HD1 ILE 42 3HD1 ILE 42 11.252 -1.786 9.333 339 H VAL 43 H VAL 43 9.100 -5.898 4.353 340 HA VAL 43 HA VAL 43 6.327 -6.202 4.633 341 HB VAL 43 HB VAL 43 8.415 -6.664 2.632 342 1HG1 VAL 43 1HG1 VAL 43 6.028 -8.509 2.790 343 2HG1 VAL 43 2HG1 VAL 43 6.793 -8.102 1.235 344 3HG1 VAL 43 3HG1 VAL 43 7.740 -8.910 2.508 345 1HG2 VAL 43 1HG2 VAL 43 6.521 -4.838 2.890 346 2HG2 VAL 43 2HG2 VAL 43 7.042 -5.400 1.283 347 3HG2 VAL 43 3HG2 VAL 43 5.549 -6.041 2.009 348 H THR 44 H THR 44 8.972 -8.691 4.407 349 HA THR 44 HA THR 44 7.191 -10.790 5.153 350 HB THR 44 HB THR 44 10.251 -10.706 5.114 351 HG1 THR 44 HG1 THR 44 8.266 -11.405 3.073 352 1HG2 THR 44 1HG2 THR 44 9.963 -13.091 4.397 353 2HG2 THR 44 2HG2 THR 44 9.293 -12.823 6.024 354 3HG2 THR 44 3HG2 THR 44 8.204 -12.933 4.620 355 H LYS 45 H LYS 45 9.456 -8.636 6.882 356 HA LYS 45 HA LYS 45 9.582 -10.072 9.251 357 1HB LYS 45 1HB LYS 45 10.632 -7.722 8.268 358 2HB LYS 45 2HB LYS 45 9.561 -7.142 9.528 359 1HG LYS 45 1HG LYS 45 10.928 -9.462 10.558 360 2HG LYS 45 2HG LYS 45 12.133 -8.431 9.812 361 1HD LYS 45 1HD LYS 45 10.594 -6.570 11.174 362 2HD LYS 45 2HD LYS 45 10.479 -7.956 12.240 363 1HE LYS 45 1HE LYS 45 13.038 -6.614 11.256 364 2HE LYS 45 2HE LYS 45 12.426 -6.633 12.898 365 1HZ LYS 45 1HZ LYS 45 12.630 -9.100 12.760 366 2HZ LYS 45 2HZ LYS 45 13.457 -8.908 11.365 367 3HZ LYS 45 3HZ LYS 45 14.046 -8.287 12.756 368 H GLU 46 H GLU 46 7.281 -7.467 8.214 369 HA GLU 46 HA GLU 46 5.698 -8.075 10.550 370 1HB GLU 46 1HB GLU 46 5.748 -5.843 8.516 371 2HB GLU 46 2HB GLU 46 4.284 -6.110 9.441 372 1HG GLU 46 1HG GLU 46 5.539 -4.530 10.722 373 2HG GLU 46 2HG GLU 46 5.748 -6.056 11.559 374 H ARG 47 H ARG 47 6.066 -9.322 7.479 375 HA ARG 47 HA ARG 47 4.632 -10.046 5.916 376 1HB ARG 47 1HB ARG 47 3.529 -12.149 6.795 377 2HB ARG 47 2HB ARG 47 5.207 -11.994 7.275 378 1HG ARG 47 1HG ARG 47 4.670 -11.900 9.486 379 2HG ARG 47 2HG ARG 47 3.442 -10.679 9.215 380 1HD ARG 47 1HD ARG 47 2.408 -12.731 10.123 381 2HD ARG 47 2HD ARG 47 1.827 -12.438 8.496 382 HE ARG 47 HE ARG 47 4.197 -14.180 8.642 383 1HH1 ARG 47 1HH1 ARG 47 0.682 -14.028 8.580 384 2HH1 ARG 47 2HH1 ARG 47 0.493 -15.663 8.042 385 1HH2 ARG 47 1HH2 ARG 47 3.948 -16.338 7.931 386 2HH2 ARG 47 2HH2 ARG 47 2.364 -16.986 7.670 387 HA PRO 48 HA PRO 48 0.855 -7.831 7.327 388 1HB PRO 48 1HB PRO 48 0.949 -5.694 5.627 389 2HB PRO 48 2HB PRO 48 1.560 -5.640 7.268 390 1HG PRO 48 1HG PRO 48 3.072 -5.798 4.733 391 2HG PRO 48 2HG PRO 48 3.639 -5.321 6.321 392 1HD PRO 48 1HD PRO 48 4.094 -7.836 5.019 393 2HD PRO 48 2HD PRO 48 4.560 -7.402 6.652 394 H ASP 49 H ASP 49 -1.230 -7.906 6.473 395 HA ASP 49 HA ASP 49 -1.297 -9.597 4.193 396 1HB ASP 49 1HB ASP 49 -3.568 -8.218 5.703 397 2HB ASP 49 2HB ASP 49 -3.767 -9.520 4.546 398 H LEU 50 H LEU 50 -0.707 -6.371 4.493 399 HA LEU 50 HA LEU 50 -1.503 -5.776 1.847 400 1HB LEU 50 1HB LEU 50 -3.503 -5.381 3.760 401 2HB LEU 50 2HB LEU 50 -2.836 -3.786 3.477 402 HG LEU 50 HG LEU 50 -3.185 -4.171 1.003 403 1HD1 LEU 50 1HD1 LEU 50 -3.310 -6.520 0.812 404 2HD1 LEU 50 2HD1 LEU 50 -4.586 -6.635 2.048 405 3HD1 LEU 50 3HD1 LEU 50 -4.947 -5.915 0.461 406 1HD2 LEU 50 1HD2 LEU 50 -5.855 -4.131 1.424 407 2HD2 LEU 50 2HD2 LEU 50 -5.269 -3.768 3.065 408 3HD2 LEU 50 3HD2 LEU 50 -4.781 -2.739 1.698 409 H VAL 51 H VAL 51 -0.354 -3.985 1.051 410 HA VAL 51 HA VAL 51 1.164 -2.462 3.026 411 HB VAL 51 HB VAL 51 2.321 -3.979 0.681 412 1HG1 VAL 51 1HG1 VAL 51 3.914 -2.258 2.581 413 2HG1 VAL 51 2HG1 VAL 51 4.379 -2.903 0.988 414 3HG1 VAL 51 3HG1 VAL 51 3.193 -1.581 1.101 415 1HG2 VAL 51 1HG2 VAL 51 3.169 -4.168 3.574 416 2HG2 VAL 51 2HG2 VAL 51 1.847 -5.164 2.920 417 3HG2 VAL 51 3HG2 VAL 51 3.485 -5.300 2.237 418 H LEU 52 H LEU 52 1.637 -0.327 2.370 419 HA LEU 52 HA LEU 52 0.444 0.411 -0.212 420 1HB LEU 52 1HB LEU 52 -1.096 1.324 1.168 421 2HB LEU 52 2HB LEU 52 0.014 1.472 2.517 422 HG LEU 52 HG LEU 52 0.402 3.256 0.140 423 1HD1 LEU 52 1HD1 LEU 52 -1.148 4.913 1.325 424 2HD1 LEU 52 2HD1 LEU 52 -1.904 3.599 0.391 425 3HD1 LEU 52 3HD1 LEU 52 -1.820 3.496 2.167 426 1HD2 LEU 52 1HD2 LEU 52 1.385 3.051 2.855 427 2HD2 LEU 52 2HD2 LEU 52 1.978 4.035 1.496 428 3HD2 LEU 52 3HD2 LEU 52 0.683 4.657 2.547 429 H LEU 53 H LEU 53 1.848 1.316 -1.617 430 HA LEU 53 HA LEU 53 4.224 2.594 -0.459 431 1HB LEU 53 1HB LEU 53 4.668 0.312 -1.374 432 2HB LEU 53 2HB LEU 53 4.166 0.889 -2.951 433 HG LEU 53 HG LEU 53 6.511 1.952 -1.350 434 1HD1 LEU 53 1HD1 LEU 53 7.213 0.785 -3.883 435 2HD1 LEU 53 2HD1 LEU 53 7.768 0.361 -2.246 436 3HD1 LEU 53 3HD1 LEU 53 6.296 -0.389 -2.908 437 1HD2 LEU 53 1HD2 LEU 53 6.207 3.789 -2.593 438 2HD2 LEU 53 2HD2 LEU 53 6.863 2.810 -3.927 439 3HD2 LEU 53 3HD2 LEU 53 5.102 2.967 -3.721 440 H ASP 54 H ASP 54 4.872 4.534 -1.412 441 HA ASP 54 HA ASP 54 2.912 5.572 -3.288 442 1HB ASP 54 1HB ASP 54 2.983 7.404 -1.959 443 2HB ASP 54 2HB ASP 54 4.188 6.630 -0.948 444 H MET 55 H MET 55 3.600 6.120 -5.389 445 HA MET 55 HA MET 55 6.035 5.213 -6.297 446 1HB MET 55 1HB MET 55 3.934 7.152 -7.365 447 2HB MET 55 2HB MET 55 5.380 6.831 -8.301 448 1HG MET 55 1HG MET 55 3.932 5.192 -9.148 449 2HG MET 55 2HG MET 55 4.764 4.283 -7.903 450 1HE MET 55 1HE MET 55 2.685 2.908 -5.837 451 2HE MET 55 2HE MET 55 4.192 3.856 -5.842 452 3HE MET 55 3HE MET 55 2.784 4.427 -4.915 453 H LYS 56 H LYS 56 5.082 8.687 -6.648 454 HA LYS 56 HA LYS 56 7.482 9.776 -6.989 455 1HB LYS 56 1HB LYS 56 4.903 10.675 -6.047 456 2HB LYS 56 2HB LYS 56 6.174 11.542 -5.210 457 1HG LYS 56 1HG LYS 56 7.185 12.259 -7.302 458 2HG LYS 56 2HG LYS 56 6.172 11.177 -8.237 459 1HD LYS 56 1HD LYS 56 4.140 12.470 -7.390 460 2HD LYS 56 2HD LYS 56 5.243 13.616 -6.654 461 1HE LYS 56 1HE LYS 56 5.764 13.004 -9.538 462 2HE LYS 56 2HE LYS 56 4.272 13.862 -9.208 463 1HZ LYS 56 1HZ LYS 56 5.727 15.566 -9.324 464 2HZ LYS 56 2HZ LYS 56 5.859 15.268 -7.723 465 3HZ LYS 56 3HZ LYS 56 7.001 14.718 -8.753 466 H ILE 57 H ILE 57 9.372 9.227 -6.022 467 HA ILE 57 HA ILE 57 9.574 9.736 -3.185 468 HB ILE 57 HB ILE 57 9.777 7.014 -4.394 469 1HG1 ILE 57 1HG1 ILE 57 7.775 7.596 -3.143 470 2HG1 ILE 57 2HG1 ILE 57 8.691 6.362 -2.300 471 1HG2 ILE 57 1HG2 ILE 57 12.044 7.493 -3.555 472 2HG2 ILE 57 2HG2 ILE 57 11.358 7.886 -1.960 473 3HG2 ILE 57 3HG2 ILE 57 11.218 6.233 -2.605 474 1HD1 ILE 57 1HD1 ILE 57 8.750 7.684 -0.467 475 2HD1 ILE 57 2HD1 ILE 57 9.690 8.886 -1.384 476 3HD1 ILE 57 3HD1 ILE 57 7.913 8.979 -1.358 477 HA PRO 58 HA PRO 58 13.326 11.232 -4.746 478 1HB PRO 58 1HB PRO 58 14.503 11.974 -2.394 479 2HB PRO 58 2HB PRO 58 13.333 12.970 -3.236 480 1HG PRO 58 1HG PRO 58 12.968 11.348 -0.792 481 2HG PRO 58 2HG PRO 58 11.973 12.656 -1.400 482 1HD PRO 58 1HD PRO 58 11.400 9.850 -1.553 483 2HD PRO 58 2HD PRO 58 10.464 11.151 -2.262 484 H GLY 59 H GLY 59 15.415 10.632 -5.259 485 1HA GLY 59 1HA GLY 59 17.363 9.429 -4.800 486 2HA GLY 59 2HA GLY 59 16.496 8.432 -3.648 487 H MET 60 H MET 60 14.158 7.851 -5.305 488 HA MET 60 HA MET 60 14.807 6.941 -7.809 489 1HB MET 60 1HB MET 60 16.304 5.439 -6.209 490 2HB MET 60 2HB MET 60 14.802 4.623 -5.824 491 1HG MET 60 1HG MET 60 14.555 4.539 -8.502 492 2HG MET 60 2HG MET 60 16.299 4.704 -8.445 493 1HE MET 60 1HE MET 60 13.257 3.071 -7.167 494 2HE MET 60 2HE MET 60 13.644 1.341 -7.004 495 3HE MET 60 3HE MET 60 14.022 2.467 -5.678 496 H ASP 61 H ASP 61 12.735 7.327 -8.513 497 HA ASP 61 HA ASP 61 10.477 7.279 -7.140 498 1HB ASP 61 1HB ASP 61 9.659 6.140 -9.561 499 2HB ASP 61 2HB ASP 61 9.850 7.853 -9.246 500 H GLY 62 H GLY 62 8.574 5.610 -7.266 501 1HA GLY 62 1HA GLY 62 9.564 3.037 -6.378 502 2HA GLY 62 2HA GLY 62 7.913 3.624 -6.344 503 H ILE 63 H ILE 63 9.422 4.205 -9.397 504 HA ILE 63 HA ILE 63 7.647 2.477 -10.723 505 HB ILE 63 HB ILE 63 10.105 3.948 -11.678 506 1HG1 ILE 63 1HG1 ILE 63 7.232 4.750 -12.120 507 2HG1 ILE 63 2HG1 ILE 63 8.082 5.213 -10.659 508 1HG2 ILE 63 1HG2 ILE 63 8.574 3.687 -13.884 509 2HG2 ILE 63 2HG2 ILE 63 9.890 2.570 -13.451 510 3HG2 ILE 63 3HG2 ILE 63 8.203 2.150 -13.066 511 1HD1 ILE 63 1HD1 ILE 63 8.172 6.554 -13.121 512 2HD1 ILE 63 2HD1 ILE 63 9.270 6.815 -11.745 513 3HD1 ILE 63 3HD1 ILE 63 9.727 5.690 -13.046 514 H GLU 64 H GLU 64 11.052 2.202 -9.649 515 HA GLU 64 HA GLU 64 11.285 -0.326 -10.990 516 1HB GLU 64 1HB GLU 64 13.204 1.233 -9.206 517 2HB GLU 64 2HB GLU 64 13.602 -0.300 -9.956 518 1HG GLU 64 1HG GLU 64 12.600 2.048 -11.612 519 2HG GLU 64 2HG GLU 64 14.295 1.890 -11.197 520 H ILE 65 H ILE 65 11.062 1.004 -7.644 521 HA ILE 65 HA ILE 65 11.503 -1.307 -6.231 522 HB ILE 65 HB ILE 65 10.036 1.234 -5.776 523 1HG1 ILE 65 1HG1 ILE 65 12.422 1.172 -5.415 524 2HG1 ILE 65 2HG1 ILE 65 11.604 1.373 -3.878 525 1HG2 ILE 65 1HG2 ILE 65 9.786 -1.144 -3.914 526 2HG2 ILE 65 2HG2 ILE 65 9.285 0.525 -3.552 527 3HG2 ILE 65 3HG2 ILE 65 8.472 -0.387 -4.846 528 1HD1 ILE 65 1HD1 ILE 65 11.765 -1.407 -4.127 529 2HD1 ILE 65 2HD1 ILE 65 13.307 -0.840 -4.814 530 3HD1 ILE 65 3HD1 ILE 65 12.851 -0.385 -3.154 531 H LEU 66 H LEU 66 8.246 0.029 -7.155 532 HA LEU 66 HA LEU 66 6.832 -2.227 -6.413 533 1HB LEU 66 1HB LEU 66 6.298 -0.034 -8.405 534 2HB LEU 66 2HB LEU 66 5.140 -1.313 -8.098 535 HG LEU 66 HG LEU 66 4.335 0.243 -6.657 536 1HD1 LEU 66 1HD1 LEU 66 4.898 -0.264 -4.396 537 2HD1 LEU 66 2HD1 LEU 66 5.085 -1.759 -5.344 538 3HD1 LEU 66 3HD1 LEU 66 6.522 -0.827 -4.859 539 1HD2 LEU 66 1HD2 LEU 66 5.644 1.966 -5.512 540 2HD2 LEU 66 2HD2 LEU 66 7.146 1.264 -6.161 541 3HD2 LEU 66 3HD2 LEU 66 5.945 1.975 -7.267 542 H LYS 67 H LYS 67 8.832 -1.565 -9.252 543 HA LYS 67 HA LYS 67 7.732 -3.611 -10.867 544 1HB LYS 67 1HB LYS 67 9.812 -1.601 -11.032 545 2HB LYS 67 2HB LYS 67 10.400 -3.133 -11.645 546 1HG LYS 67 1HG LYS 67 8.095 -3.240 -12.925 547 2HG LYS 67 2HG LYS 67 8.008 -1.522 -12.591 548 1HD LYS 67 1HD LYS 67 9.342 -1.146 -14.384 549 2HD LYS 67 2HD LYS 67 10.651 -1.949 -13.540 550 1HE LYS 67 1HE LYS 67 9.746 -4.174 -14.407 551 2HE LYS 67 2HE LYS 67 8.595 -3.270 -15.372 552 1HZ LYS 67 1HZ LYS 67 10.177 -3.034 -16.861 553 2HZ LYS 67 2HZ LYS 67 11.073 -2.154 -15.818 554 3HZ LYS 67 3HZ LYS 67 11.282 -3.771 -15.911 555 H ARG 68 H ARG 68 10.922 -3.427 -9.124 556 HA ARG 68 HA ARG 68 11.554 -6.044 -9.482 557 1HB ARG 68 1HB ARG 68 12.334 -3.882 -7.568 558 2HB ARG 68 2HB ARG 68 12.698 -5.507 -7.024 559 1HG ARG 68 1HG ARG 68 13.998 -5.970 -9.048 560 2HG ARG 68 2HG ARG 68 13.491 -4.460 -9.779 561 1HD ARG 68 1HD ARG 68 15.633 -3.918 -8.950 562 2HD ARG 68 2HD ARG 68 14.585 -3.315 -7.682 563 HE ARG 68 HE ARG 68 15.134 -5.988 -6.992 564 1HH1 ARG 68 1HH1 ARG 68 16.989 -3.043 -7.512 565 2HH1 ARG 68 2HH1 ARG 68 18.249 -3.490 -6.410 566 1HH2 ARG 68 1HH2 ARG 68 16.795 -6.577 -5.538 567 2HH2 ARG 68 2HH2 ARG 68 18.138 -5.514 -5.280 568 H MET 69 H MET 69 9.447 -4.483 -7.045 569 HA MET 69 HA MET 69 9.307 -6.507 -5.211 570 1HB MET 69 1HB MET 69 7.919 -4.060 -5.871 571 2HB MET 69 2HB MET 69 6.690 -5.278 -5.599 572 1HG MET 69 1HG MET 69 7.047 -5.248 -3.351 573 2HG MET 69 2HG MET 69 8.767 -5.506 -3.559 574 1HE MET 69 1HE MET 69 6.231 -3.659 -2.261 575 2HE MET 69 2HE MET 69 6.837 -2.022 -1.912 576 3HE MET 69 3HE MET 69 6.004 -2.354 -3.450 577 H LYS 70 H LYS 70 7.090 -5.890 -8.032 578 HA LYS 70 HA LYS 70 5.709 -8.341 -7.622 579 1HB LYS 70 1HB LYS 70 4.337 -7.657 -9.347 580 2HB LYS 70 2HB LYS 70 4.906 -6.125 -8.717 581 1HG LYS 70 1HG LYS 70 5.177 -5.921 -11.073 582 2HG LYS 70 2HG LYS 70 6.793 -6.256 -10.483 583 1HD LYS 70 1HD LYS 70 6.911 -8.189 -11.670 584 2HD LYS 70 2HD LYS 70 5.400 -8.766 -10.995 585 1HE LYS 70 1HE LYS 70 4.623 -6.726 -12.795 586 2HE LYS 70 2HE LYS 70 5.918 -7.565 -13.627 587 1HZ LYS 70 1HZ LYS 70 3.656 -8.955 -12.373 588 2HZ LYS 70 2HZ LYS 70 3.687 -8.524 -13.948 589 3HZ LYS 70 3HZ LYS 70 4.775 -9.598 -13.373 590 H VAL 71 H VAL 71 8.375 -7.194 -9.751 591 HA VAL 71 HA VAL 71 8.506 -9.489 -11.337 592 HB VAL 71 HB VAL 71 10.700 -7.567 -10.535 593 1HG1 VAL 71 1HG1 VAL 71 11.660 -8.181 -12.760 594 2HG1 VAL 71 2HG1 VAL 71 11.630 -9.526 -11.595 595 3HG1 VAL 71 3HG1 VAL 71 10.421 -9.451 -12.899 596 1HG2 VAL 71 1HG2 VAL 71 9.901 -6.020 -11.980 597 2HG2 VAL 71 2HG2 VAL 71 9.318 -7.242 -13.135 598 3HG2 VAL 71 3HG2 VAL 71 8.349 -6.845 -11.696 599 H ILE 72 H ILE 72 9.553 -8.782 -8.035 600 HA ILE 72 HA ILE 72 11.352 -11.011 -7.927 601 HB ILE 72 HB ILE 72 10.324 -8.962 -6.002 602 1HG1 ILE 72 1HG1 ILE 72 12.312 -8.705 -7.662 603 2HG1 ILE 72 2HG1 ILE 72 12.478 -8.141 -6.011 604 1HG2 ILE 72 1HG2 ILE 72 10.222 -10.941 -4.669 605 2HG2 ILE 72 2HG2 ILE 72 11.799 -11.503 -5.274 606 3HG2 ILE 72 3HG2 ILE 72 11.708 -10.065 -4.229 607 1HD1 ILE 72 1HD1 ILE 72 13.814 -10.000 -5.369 608 2HD1 ILE 72 2HD1 ILE 72 13.297 -10.965 -6.772 609 3HD1 ILE 72 3HD1 ILE 72 14.402 -9.589 -6.998 610 H ASP 73 H ASP 73 8.078 -10.216 -6.574 611 HA ASP 73 HA ASP 73 7.655 -13.097 -6.472 612 1HB ASP 73 1HB ASP 73 5.965 -11.768 -4.555 613 2HB ASP 73 2HB ASP 73 7.195 -12.980 -4.257 614 H GLU 74 H GLU 74 5.504 -13.755 -7.130 615 HA GLU 74 HA GLU 74 4.012 -11.603 -8.387 616 1HB GLU 74 1HB GLU 74 3.174 -13.199 -9.923 617 2HB GLU 74 2HB GLU 74 4.846 -13.671 -9.693 618 1HG GLU 74 1HG GLU 74 4.094 -15.339 -7.946 619 2HG GLU 74 2HG GLU 74 2.431 -14.908 -8.290 620 H ASN 75 H ASN 75 4.087 -13.348 -5.524 621 HA ASN 75 HA ASN 75 1.207 -13.557 -5.350 622 1HB ASN 75 1HB ASN 75 3.121 -15.277 -4.474 623 2HB ASN 75 2HB ASN 75 3.026 -14.265 -3.046 624 1HD2 ASN 75 1HD2 ASN 75 2.245 -16.115 -1.942 625 2HD2 ASN 75 2HD2 ASN 75 0.583 -16.593 -2.035 626 H ILE 76 H ILE 76 3.737 -11.352 -4.795 627 HA ILE 76 HA ILE 76 3.087 -10.318 -2.274 628 HB ILE 76 HB ILE 76 5.210 -9.954 -3.415 629 1HG1 ILE 76 1HG1 ILE 76 3.618 -7.496 -2.655 630 2HG1 ILE 76 2HG1 ILE 76 4.686 -8.445 -1.640 631 1HG2 ILE 76 1HG2 ILE 76 4.251 -7.791 -5.160 632 2HG2 ILE 76 2HG2 ILE 76 5.462 -9.063 -5.453 633 3HG2 ILE 76 3HG2 ILE 76 3.730 -9.420 -5.656 634 1HD1 ILE 76 1HD1 ILE 76 5.991 -6.554 -2.249 635 2HD1 ILE 76 2HD1 ILE 76 6.561 -7.837 -3.343 636 3HD1 ILE 76 3HD1 ILE 76 5.427 -6.600 -3.937 637 H ARG 77 H ARG 77 1.667 -8.715 -1.593 638 HA ARG 77 HA ARG 77 -0.158 -7.813 -3.676 639 1HB ARG 77 1HB ARG 77 -1.614 -9.117 -2.416 640 2HB ARG 77 2HB ARG 77 -0.650 -8.978 -0.959 641 1HG ARG 77 1HG ARG 77 -1.628 -6.945 -0.327 642 2HG ARG 77 2HG ARG 77 -1.993 -6.479 -1.977 643 1HD ARG 77 1HD ARG 77 -4.105 -7.027 -0.941 644 2HD ARG 77 2HD ARG 77 -3.739 -8.344 -2.037 645 HE ARG 77 HE ARG 77 -3.568 -8.438 0.934 646 1HH1 ARG 77 1HH1 ARG 77 -3.233 -10.092 -2.154 647 2HH1 ARG 77 2HH1 ARG 77 -3.225 -11.675 -1.450 648 1HH2 ARG 77 1HH2 ARG 77 -3.558 -10.526 1.863 649 2HH2 ARG 77 2HH2 ARG 77 -3.411 -11.923 0.850 650 H VAL 78 H VAL 78 0.264 -5.650 -4.033 651 HA VAL 78 HA VAL 78 0.362 -3.917 -1.697 652 HB VAL 78 HB VAL 78 2.549 -4.303 -3.710 653 1HG1 VAL 78 1HG1 VAL 78 3.491 -2.103 -3.097 654 2HG1 VAL 78 2HG1 VAL 78 1.936 -1.951 -3.950 655 3HG1 VAL 78 3HG1 VAL 78 2.009 -1.732 -2.185 656 1HG2 VAL 78 1HG2 VAL 78 3.250 -3.467 -1.001 657 2HG2 VAL 78 2HG2 VAL 78 2.243 -4.935 -1.018 658 3HG2 VAL 78 3HG2 VAL 78 3.771 -4.893 -1.929 659 H ILE 79 H ILE 79 -0.127 -1.654 -2.250 660 HA ILE 79 HA ILE 79 -1.512 -1.484 -4.837 661 HB ILE 79 HB ILE 79 -2.384 -0.891 -2.088 662 1HG1 ILE 79 1HG1 ILE 79 -3.622 -1.759 -4.691 663 2HG1 ILE 79 2HG1 ILE 79 -3.538 -2.617 -3.164 664 1HG2 ILE 79 1HG2 ILE 79 -2.090 1.393 -2.952 665 2HG2 ILE 79 2HG2 ILE 79 -3.123 0.992 -4.345 666 3HG2 ILE 79 3HG2 ILE 79 -3.804 0.983 -2.701 667 1HD1 ILE 79 1HD1 ILE 79 -5.003 -0.714 -2.187 668 2HD1 ILE 79 2HD1 ILE 79 -5.289 -0.235 -3.877 669 3HD1 ILE 79 3HD1 ILE 79 -5.792 -1.846 -3.311 670 H ILE 80 H ILE 80 -1.252 0.419 -6.049 671 HA ILE 80 HA ILE 80 0.985 2.065 -5.119 672 HB ILE 80 HB ILE 80 1.500 2.490 -7.356 673 1HG1 ILE 80 1HG1 ILE 80 -0.010 1.629 -9.232 674 2HG1 ILE 80 2HG1 ILE 80 -1.263 1.455 -8.019 675 1HG2 ILE 80 1HG2 ILE 80 0.771 -0.358 -6.780 676 2HG2 ILE 80 2HG2 ILE 80 1.363 0.085 -8.399 677 3HG2 ILE 80 3HG2 ILE 80 2.371 0.400 -6.967 678 1HD1 ILE 80 1HD1 ILE 80 -1.697 3.678 -8.050 679 2HD1 ILE 80 2HD1 ILE 80 0.016 4.066 -7.761 680 3HD1 ILE 80 3HD1 ILE 80 -0.571 3.813 -9.422 681 H MET 81 H MET 81 0.872 4.397 -5.363 682 HA MET 81 HA MET 81 -1.802 5.413 -5.801 683 1HB MET 81 1HB MET 81 -0.751 6.900 -3.603 684 2HB MET 81 2HB MET 81 -2.104 5.787 -3.556 685 1HG MET 81 1HG MET 81 -0.511 3.884 -3.157 686 2HG MET 81 2HG MET 81 0.830 5.012 -3.176 687 1HE MET 81 1HE MET 81 1.229 5.732 0.351 688 2HE MET 81 2HE MET 81 1.870 5.105 -1.187 689 3HE MET 81 3HE MET 81 1.319 6.794 -1.075 690 H THR 82 H THR 82 -1.744 7.219 -7.082 691 HA THR 82 HA THR 82 0.158 9.257 -6.812 692 HB THR 82 HB THR 82 1.879 7.958 -7.764 693 HG1 THR 82 HG1 THR 82 1.765 9.623 -9.269 694 1HG2 THR 82 1HG2 THR 82 -0.149 6.791 -9.740 695 2HG2 THR 82 2HG2 THR 82 1.560 6.323 -9.569 696 3HG2 THR 82 3HG2 THR 82 0.399 5.944 -8.274 697 H ALA 83 H ALA 83 -0.308 11.063 -8.134 698 HA ALA 83 HA ALA 83 -2.979 11.301 -8.832 699 1HB ALA 83 1HB ALA 83 -1.993 13.339 -8.440 700 2HB ALA 83 2HB ALA 83 -0.457 12.867 -9.207 701 3HB ALA 83 3HB ALA 83 -1.854 13.317 -10.215 702 H TYR 84 H TYR 84 -3.924 11.715 -11.012 703 HA TYR 84 HA TYR 84 -3.317 9.591 -12.755 704 1HB TYR 84 1HB TYR 84 -5.055 10.815 -14.137 705 2HB TYR 84 2HB TYR 84 -5.553 10.696 -12.461 706 HD1 TYR 84 HD1 TYR 84 -5.545 12.685 -10.999 707 HD2 TYR 84 HD2 TYR 84 -4.482 12.959 -15.134 708 HE1 TYR 84 HE1 TYR 84 -5.828 15.210 -10.911 709 HE2 TYR 84 HE2 TYR 84 -4.769 15.483 -15.032 710 HH TYR 84 HH TYR 84 -6.431 17.020 -12.848 711 H GLY 85 H GLY 85 -3.759 11.201 -15.262 712 1HA GLY 85 1HA GLY 85 -2.589 12.374 -16.811 713 2HA GLY 85 2HA GLY 85 -1.456 12.886 -15.576 714 H GLU 86 H GLU 86 -0.211 10.744 -14.581 715 HA GLU 86 HA GLU 86 1.140 9.724 -16.901 716 1HB GLU 86 1HB GLU 86 2.715 8.769 -15.105 717 2HB GLU 86 2HB GLU 86 2.619 10.516 -15.215 718 1HG GLU 86 1HG GLU 86 1.408 10.724 -13.218 719 2HG GLU 86 2HG GLU 86 0.699 9.127 -13.351 720 H LEU 87 H LEU 87 -1.460 8.714 -16.787 721 HA LEU 87 HA LEU 87 -1.953 6.467 -15.347 722 1HB LEU 87 1HB LEU 87 -2.632 7.024 -18.238 723 2HB LEU 87 2HB LEU 87 -3.365 5.770 -17.258 724 HG LEU 87 HG LEU 87 -3.506 8.730 -16.626 725 1HD1 LEU 87 1HD1 LEU 87 -4.870 7.278 -18.645 726 2HD1 LEU 87 2HD1 LEU 87 -6.041 7.615 -17.347 727 3HD1 LEU 87 3HD1 LEU 87 -5.142 8.952 -18.104 728 1HD2 LEU 87 1HD2 LEU 87 -3.926 6.544 -14.962 729 2HD2 LEU 87 2HD2 LEU 87 -4.494 8.211 -14.702 730 3HD2 LEU 87 3HD2 LEU 87 -5.561 7.018 -15.481 731 H ASP 88 H ASP 88 0.239 6.884 -18.139 732 HA ASP 88 HA ASP 88 0.632 4.390 -18.958 733 1HB ASP 88 1HB ASP 88 2.229 6.833 -18.778 734 2HB ASP 88 2HB ASP 88 3.263 5.429 -18.604 735 H MET 89 H MET 89 2.414 5.996 -16.204 736 HA MET 89 HA MET 89 3.756 3.703 -15.418 737 1HB MET 89 1HB MET 89 4.139 6.214 -14.804 738 2HB MET 89 2HB MET 89 2.888 6.005 -13.595 739 1HG MET 89 1HG MET 89 5.109 3.972 -13.626 740 2HG MET 89 2HG MET 89 5.508 5.579 -13.053 741 1HE MET 89 1HE MET 89 5.894 4.940 -10.379 742 2HE MET 89 2HE MET 89 5.036 3.494 -9.795 743 3HE MET 89 3HE MET 89 5.999 3.414 -11.290 744 H ILE 90 H ILE 90 0.729 5.245 -14.132 745 HA ILE 90 HA ILE 90 0.252 3.496 -12.074 746 HB ILE 90 HB ILE 90 -1.590 5.056 -13.874 747 1HG1 ILE 90 1HG1 ILE 90 -1.485 5.834 -11.089 748 2HG1 ILE 90 2HG1 ILE 90 0.133 5.777 -11.759 749 1HG2 ILE 90 1HG2 ILE 90 -3.377 4.029 -13.061 750 2HG2 ILE 90 2HG2 ILE 90 -2.326 2.891 -12.184 751 3HG2 ILE 90 3HG2 ILE 90 -2.856 4.399 -11.400 752 1HD1 ILE 90 1HD1 ILE 90 -2.249 7.360 -12.804 753 2HD1 ILE 90 2HD1 ILE 90 -0.695 7.988 -12.205 754 3HD1 ILE 90 3HD1 ILE 90 -0.765 7.120 -13.758 755 H GLN 91 H GLN 91 -0.858 3.252 -15.522 756 HA GLN 91 HA GLN 91 -2.226 0.921 -15.273 757 1HB GLN 91 1HB GLN 91 -0.835 2.361 -17.484 758 2HB GLN 91 2HB GLN 91 -1.155 0.665 -17.789 759 1HG GLN 91 1HG GLN 91 -3.492 1.925 -16.564 760 2HG GLN 91 2HG GLN 91 -2.995 2.828 -17.981 761 1HE2 GLN 91 1HE2 GLN 91 -5.105 2.051 -18.735 762 2HE2 GLN 91 2HE2 GLN 91 -5.210 0.520 -19.537 763 H GLU 92 H GLU 92 1.297 1.377 -16.015 764 HA GLU 92 HA GLU 92 1.968 -1.216 -16.391 765 1HB GLU 92 1HB GLU 92 3.337 1.269 -15.674 766 2HB GLU 92 2HB GLU 92 4.117 -0.108 -14.923 767 1HG GLU 92 1HG GLU 92 4.897 -0.907 -16.919 768 2HG GLU 92 2HG GLU 92 3.366 -0.643 -17.729 769 H SER 93 H SER 93 1.785 0.590 -13.252 770 HA SER 93 HA SER 93 2.692 -1.403 -11.634 771 1HB SER 93 1HB SER 93 0.587 -0.093 -10.226 772 2HB SER 93 2HB SER 93 2.304 0.246 -10.144 773 HG SER 93 HG SER 93 2.115 1.835 -11.718 774 H LYS 94 H LYS 94 -0.684 -0.729 -12.771 775 HA LYS 94 HA LYS 94 -1.887 -2.803 -11.336 776 1HB LYS 94 1HB LYS 94 -2.709 -0.718 -12.971 777 2HB LYS 94 2HB LYS 94 -3.155 -2.140 -13.893 778 1HG LYS 94 1HG LYS 94 -3.946 -2.890 -11.349 779 2HG LYS 94 2HG LYS 94 -4.222 -1.160 -11.290 780 1HD LYS 94 1HD LYS 94 -5.736 -1.220 -13.154 781 2HD LYS 94 2HD LYS 94 -5.211 -2.819 -13.640 782 1HE LYS 94 1HE LYS 94 -6.296 -2.636 -10.861 783 2HE LYS 94 2HE LYS 94 -7.461 -2.328 -12.133 784 1HZ LYS 94 1HZ LYS 94 -6.125 -4.764 -11.459 785 2HZ LYS 94 2HZ LYS 94 -7.570 -4.534 -12.183 786 3HZ LYS 94 3HZ LYS 94 -6.196 -4.471 -13.064 787 H GLU 95 H GLU 95 -0.690 -2.639 -14.758 788 HA GLU 95 HA GLU 95 -1.316 -5.311 -15.268 789 1HB GLU 95 1HB GLU 95 0.770 -3.562 -16.644 790 2HB GLU 95 2HB GLU 95 0.037 -5.008 -17.308 791 1HG GLU 95 1HG GLU 95 -1.516 -2.499 -16.515 792 2HG GLU 95 2HG GLU 95 -1.011 -2.872 -18.151 793 H LEU 96 H LEU 96 1.089 -3.886 -13.295 794 HA LEU 96 HA LEU 96 3.152 -5.797 -13.776 795 1HB LEU 96 1HB LEU 96 2.753 -3.379 -12.250 796 2HB LEU 96 2HB LEU 96 3.502 -4.612 -11.255 797 HG LEU 96 HG LEU 96 5.390 -4.779 -12.665 798 1HD1 LEU 96 1HD1 LEU 96 5.014 -2.948 -14.777 799 2HD1 LEU 96 2HD1 LEU 96 5.173 -4.719 -14.871 800 3HD1 LEU 96 3HD1 LEU 96 3.561 -3.976 -14.734 801 1HD2 LEU 96 1HD2 LEU 96 5.394 -2.807 -11.230 802 2HD2 LEU 96 2HD2 LEU 96 6.261 -2.491 -12.752 803 3HD2 LEU 96 3HD2 LEU 96 4.616 -1.853 -12.516 804 H GLY 97 H GLY 97 0.125 -5.780 -12.096 805 1HA GLY 97 1HA GLY 97 -0.709 -7.900 -11.368 806 2HA GLY 97 2HA GLY 97 0.888 -8.307 -10.772 807 H ALA 98 H ALA 98 -0.411 -5.022 -10.355 808 HA ALA 98 HA ALA 98 -0.259 -5.382 -7.491 809 1HB ALA 98 1HB ALA 98 -0.413 -2.981 -7.418 810 2HB ALA 98 2HB ALA 98 0.678 -3.397 -8.760 811 3HB ALA 98 3HB ALA 98 -1.000 -2.908 -9.097 812 H LEU 99 H LEU 99 -2.070 -4.580 -6.078 813 HA LEU 99 HA LEU 99 -4.437 -5.911 -6.730 814 1HB LEU 99 1HB LEU 99 -3.736 -3.887 -4.609 815 2HB LEU 99 2HB LEU 99 -5.310 -4.650 -4.712 816 HG LEU 99 HG LEU 99 -3.850 -5.718 -3.051 817 1HD1 LEU 99 1HD1 LEU 99 -3.940 -7.979 -4.846 818 2HD1 LEU 99 2HD1 LEU 99 -4.939 -7.616 -3.419 819 3HD1 LEU 99 3HD1 LEU 99 -5.404 -6.981 -5.015 820 1HD2 LEU 99 1HD2 LEU 99 -2.078 -6.383 -5.417 821 2HD2 LEU 99 2HD2 LEU 99 -1.681 -5.320 -4.045 822 3HD2 LEU 99 3HD2 LEU 99 -1.911 -7.065 -3.782 823 H THR 100 H THR 100 -3.496 -2.426 -6.856 824 HA THR 100 HA THR 100 -5.141 -1.897 -9.051 825 HB THR 100 HB THR 100 -6.957 -2.302 -7.335 826 HG1 THR 100 HG1 THR 100 -7.817 -0.723 -8.623 827 1HG2 THR 100 1HG2 THR 100 -7.152 -0.063 -5.843 828 2HG2 THR 100 2HG2 THR 100 -6.304 -1.502 -5.228 829 3HG2 THR 100 3HG2 THR 100 -5.376 -0.150 -5.920 830 H HIS 101 H HIS 101 -5.700 0.811 -8.695 831 HA HIS 101 HA HIS 101 -3.227 1.969 -7.725 832 1HB HIS 101 1HB HIS 101 -2.780 3.144 -9.807 833 2HB HIS 101 2HB HIS 101 -2.711 1.409 -10.037 834 HD1 HIS 101 HD1 HIS 101 -3.905 0.592 -12.069 835 HD2 HIS 101 HD2 HIS 101 -5.530 4.181 -10.628 836 HE1 HIS 101 HE1 HIS 101 -5.738 1.257 -13.713 837 H PHE 102 H PHE 102 -3.699 3.774 -6.570 838 HA PHE 102 HA PHE 102 -6.348 4.939 -7.019 839 1HB PHE 102 1HB PHE 102 -4.340 5.047 -4.687 840 2HB PHE 102 2HB PHE 102 -5.918 5.809 -4.656 841 HD1 PHE 102 HD1 PHE 102 -4.598 3.549 -2.882 842 HD2 PHE 102 HD2 PHE 102 -7.459 3.560 -6.017 843 HE1 PHE 102 HE1 PHE 102 -5.601 1.435 -1.975 844 HE2 PHE 102 HE2 PHE 102 -8.462 1.446 -5.109 845 HZ PHE 102 HZ PHE 102 -7.521 0.408 -3.099 846 H ALA 103 H ALA 103 -6.562 7.315 -6.840 847 HA ALA 103 HA ALA 103 -4.159 8.614 -7.904 848 1HB ALA 103 1HB ALA 103 -6.328 8.540 -9.238 849 2HB ALA 103 2HB ALA 103 -7.035 9.592 -7.988 850 3HB ALA 103 3HB ALA 103 -5.656 10.164 -8.956 851 H LYS 104 H LYS 104 -3.384 10.559 -6.982 852 HA LYS 104 HA LYS 104 -3.131 10.856 -4.408 853 1HB LYS 104 1HB LYS 104 -3.010 12.632 -6.666 854 2HB LYS 104 2HB LYS 104 -3.649 13.509 -5.290 855 1HG LYS 104 1HG LYS 104 -1.727 13.076 -3.953 856 2HG LYS 104 2HG LYS 104 -1.225 11.719 -4.941 857 1HD LYS 104 1HD LYS 104 -0.372 13.103 -6.659 858 2HD LYS 104 2HD LYS 104 -1.371 14.467 -6.200 859 1HE LYS 104 1HE LYS 104 0.214 13.940 -3.908 860 2HE LYS 104 2HE LYS 104 1.311 13.741 -5.260 861 1HZ LYS 104 1HZ LYS 104 -0.442 16.074 -4.938 862 2HZ LYS 104 2HZ LYS 104 1.111 16.031 -4.436 863 3HZ LYS 104 3HZ LYS 104 0.763 15.895 -6.025 864 HA PRO 105 HA PRO 105 -7.297 12.935 -3.712 865 1HB PRO 105 1HB PRO 105 -9.041 13.341 -5.777 866 2HB PRO 105 2HB PRO 105 -7.911 14.561 -5.223 867 1HG PRO 105 1HG PRO 105 -7.783 12.884 -7.654 868 2HG PRO 105 2HG PRO 105 -6.924 14.369 -7.299 869 1HD PRO 105 1HD PRO 105 -5.859 11.707 -7.210 870 2HD PRO 105 2HD PRO 105 -5.035 13.182 -6.744 871 H PHE 106 H PHE 106 -7.649 11.086 -2.505 872 HA PHE 106 HA PHE 106 -9.624 9.353 -3.807 873 1HB PHE 106 1HB PHE 106 -8.334 7.691 -2.038 874 2HB PHE 106 2HB PHE 106 -7.821 7.854 -3.706 875 HD1 PHE 106 HD1 PHE 106 -7.351 9.986 -0.668 876 HD2 PHE 106 HD2 PHE 106 -5.526 7.842 -3.844 877 HE1 PHE 106 HE1 PHE 106 -5.093 10.765 0.103 878 HE2 PHE 106 HE2 PHE 106 -3.268 8.621 -3.073 879 HZ PHE 106 HZ PHE 106 -3.079 10.074 -1.109 880 H ASP 107 H ASP 107 -11.122 8.277 -2.309 881 HA ASP 107 HA ASP 107 -11.340 9.814 0.158 882 1HB ASP 107 1HB ASP 107 -13.190 9.495 -1.907 883 2HB ASP 107 2HB ASP 107 -13.716 8.285 -0.754 884 H ILE 108 H ILE 108 -11.540 8.617 2.119 885 HA ILE 108 HA ILE 108 -10.642 5.970 2.117 886 HB ILE 108 HB ILE 108 -11.716 7.892 4.120 887 1HG1 ILE 108 1HG1 ILE 108 -9.566 7.714 5.081 888 2HG1 ILE 108 2HG1 ILE 108 -9.209 6.217 4.243 889 1HG2 ILE 108 1HG2 ILE 108 -12.867 6.037 4.948 890 2HG2 ILE 108 2HG2 ILE 108 -11.563 4.908 4.509 891 3HG2 ILE 108 3HG2 ILE 108 -11.341 6.041 5.864 892 1HD1 ILE 108 1HD1 ILE 108 -9.297 7.457 2.050 893 2HD1 ILE 108 2HD1 ILE 108 -9.537 8.967 2.961 894 3HD1 ILE 108 3HD1 ILE 108 -8.022 8.050 3.140 895 H ASP 109 H ASP 109 -13.909 7.445 2.167 896 HA ASP 109 HA ASP 109 -15.327 5.225 2.883 897 1HB ASP 109 1HB ASP 109 -15.956 7.774 2.187 898 2HB ASP 109 2HB ASP 109 -16.414 6.980 0.693 899 H GLU 110 H GLU 110 -14.119 6.364 -0.334 900 HA GLU 110 HA GLU 110 -15.341 4.202 -1.708 901 1HB GLU 110 1HB GLU 110 -14.288 5.128 -3.688 902 2HB GLU 110 2HB GLU 110 -14.906 6.458 -2.729 903 1HG GLU 110 1HG GLU 110 -12.777 7.188 -2.098 904 2HG GLU 110 2HG GLU 110 -12.074 5.586 -2.198 905 H ILE 111 H ILE 111 -12.323 4.783 -0.008 906 HA ILE 111 HA ILE 111 -10.898 2.690 -1.361 907 HB ILE 111 HB ILE 111 -10.343 4.820 0.525 908 1HG1 ILE 111 1HG1 ILE 111 -8.027 4.470 -0.486 909 2HG1 ILE 111 2HG1 ILE 111 -8.739 3.205 -1.468 910 1HG2 ILE 111 1HG2 ILE 111 -8.956 2.174 1.035 911 2HG2 ILE 111 2HG2 ILE 111 -8.573 3.741 1.787 912 3HG2 ILE 111 3HG2 ILE 111 -10.134 2.954 2.119 913 1HD1 ILE 111 1HD1 ILE 111 -9.832 6.052 -1.361 914 2HD1 ILE 111 2HD1 ILE 111 -8.670 5.482 -2.584 915 3HD1 ILE 111 3HD1 ILE 111 -10.297 4.764 -2.499 916 H ARG 112 H ARG 112 -13.118 3.027 1.343 917 HA ARG 112 HA ARG 112 -12.285 0.765 2.735 918 1HB ARG 112 1HB ARG 112 -15.009 2.152 2.602 919 2HB ARG 112 2HB ARG 112 -14.610 0.908 3.771 920 1HG ARG 112 1HG ARG 112 -12.483 2.838 3.850 921 2HG ARG 112 2HG ARG 112 -13.986 3.739 3.857 922 1HD ARG 112 1HD ARG 112 -13.434 3.248 6.169 923 2HD ARG 112 2HD ARG 112 -14.809 2.248 5.744 924 HE ARG 112 HE ARG 112 -11.997 1.305 6.066 925 1HH1 ARG 112 1HH1 ARG 112 -15.391 0.563 5.505 926 2HH1 ARG 112 2HH1 ARG 112 -15.202 -1.132 5.807 927 1HH2 ARG 112 1HH2 ARG 112 -11.748 -0.931 6.465 928 2HH2 ARG 112 2HH2 ARG 112 -13.116 -1.987 6.357 929 H ASP 113 H ASP 113 -14.076 1.245 -0.230 930 HA ASP 113 HA ASP 113 -15.443 -1.253 -0.064 931 1HB ASP 113 1HB ASP 113 -15.643 1.131 -1.606 932 2HB ASP 113 2HB ASP 113 -15.231 -0.124 -2.757 933 H ALA 114 H ALA 114 -12.704 0.263 -1.904 934 HA ALA 114 HA ALA 114 -12.098 -2.071 -3.386 935 1HB ALA 114 1HB ALA 114 -10.407 -0.770 -4.310 936 2HB ALA 114 2HB ALA 114 -11.531 0.489 -3.744 937 3HB ALA 114 3HB ALA 114 -10.087 0.088 -2.784 938 H VAL 115 H VAL 115 -11.454 -0.973 -0.117 939 HA VAL 115 HA VAL 115 -9.087 -2.470 0.286 940 HB VAL 115 HB VAL 115 -11.103 -1.049 1.976 941 1HG1 VAL 115 1HG1 VAL 115 -10.801 -2.926 3.371 942 2HG1 VAL 115 2HG1 VAL 115 -9.071 -3.056 2.972 943 3HG1 VAL 115 3HG1 VAL 115 -9.652 -1.714 3.986 944 1HG2 VAL 115 1HG2 VAL 115 -9.367 0.428 2.442 945 2HG2 VAL 115 2HG2 VAL 115 -8.106 -0.781 2.100 946 3HG2 VAL 115 3HG2 VAL 115 -9.021 -0.047 0.762 947 H LYS 116 H LYS 116 -12.583 -3.153 0.431 948 HA LYS 116 HA LYS 116 -12.454 -5.502 1.918 949 1HB LYS 116 1HB LYS 116 -14.529 -4.302 1.484 950 2HB LYS 116 2HB LYS 116 -14.401 -4.622 -0.234 951 1HG LYS 116 1HG LYS 116 -14.160 -7.178 0.860 952 2HG LYS 116 2HG LYS 116 -15.295 -6.412 1.955 953 1HD LYS 116 1HD LYS 116 -16.701 -7.296 0.272 954 2HD LYS 116 2HD LYS 116 -16.550 -5.613 -0.191 955 1HE LYS 116 1HE LYS 116 -14.437 -7.407 -1.302 956 2HE LYS 116 2HE LYS 116 -16.058 -7.741 -1.878 957 1HZ LYS 116 1HZ LYS 116 -16.053 -5.146 -2.115 958 2HZ LYS 116 2HZ LYS 116 -14.443 -5.378 -2.259 959 3HZ LYS 116 3HZ LYS 116 -15.470 -6.115 -3.293 960 H LYS 117 H LYS 117 -11.909 -4.819 -1.563 961 HA LYS 117 HA LYS 117 -11.580 -7.635 -2.112 962 1HB LYS 117 1HB LYS 117 -12.700 -6.328 -3.780 963 2HB LYS 117 2HB LYS 117 -11.414 -5.139 -3.815 964 1HG LYS 117 1HG LYS 117 -9.848 -7.113 -4.496 965 2HG LYS 117 2HG LYS 117 -11.318 -8.016 -4.799 966 1HD LYS 117 1HD LYS 117 -11.294 -7.084 -6.876 967 2HD LYS 117 2HD LYS 117 -11.842 -5.611 -6.101 968 1HE LYS 117 1HE LYS 117 -9.946 -4.745 -7.094 969 2HE LYS 117 2HE LYS 117 -9.188 -5.332 -5.627 970 1HZ LYS 117 1HZ LYS 117 -9.158 -6.513 -8.283 971 2HZ LYS 117 2HZ LYS 117 -7.921 -6.279 -7.243 972 3HZ LYS 117 3HZ LYS 117 -8.984 -7.492 -6.988 973 H TYR 118 H TYR 118 -9.626 -4.706 -1.520 974 HA TYR 118 HA TYR 118 -7.183 -5.617 -2.442 975 1HB TYR 118 1HB TYR 118 -7.998 -3.320 -1.496 976 2HB TYR 118 2HB TYR 118 -7.827 -4.010 0.106 977 HD1 TYR 118 HD1 TYR 118 -6.373 -1.691 -0.069 978 HD2 TYR 118 HD2 TYR 118 -5.273 -5.489 -1.704 979 HE1 TYR 118 HE1 TYR 118 -3.925 -1.005 -0.035 980 HE2 TYR 118 HE2 TYR 118 -2.829 -4.790 -1.665 981 HH TYR 118 HH TYR 118 -1.424 -3.231 -0.431 982 H LEU 119 H LEU 119 -8.712 -5.993 0.825 983 HA LEU 119 HA LEU 119 -6.498 -7.687 1.626 984 1HB LEU 119 1HB LEU 119 -8.250 -5.906 2.923 985 2HB LEU 119 2HB LEU 119 -8.654 -7.500 3.528 986 HG LEU 119 HG LEU 119 -5.790 -7.207 3.503 987 1HD1 LEU 119 1HD1 LEU 119 -5.322 -5.239 4.483 988 2HD1 LEU 119 2HD1 LEU 119 -6.854 -4.721 3.739 989 3HD1 LEU 119 3HD1 LEU 119 -6.820 -5.233 5.444 990 1HD2 LEU 119 1HD2 LEU 119 -5.984 -8.331 5.427 991 2HD2 LEU 119 2HD2 LEU 119 -7.155 -7.173 6.102 992 3HD2 LEU 119 3HD2 LEU 119 -7.709 -8.465 5.009 993 HA PRO 120 HA PRO 120 -8.599 -11.369 0.825 994 1HB PRO 120 1HB PRO 120 -7.454 -13.076 2.625 995 2HB PRO 120 2HB PRO 120 -6.687 -12.617 1.118 996 1HG PRO 120 1HG PRO 120 -6.066 -11.715 3.864 997 2HG PRO 120 2HG PRO 120 -5.072 -11.613 2.424 998 1HD PRO 120 1HD PRO 120 -6.540 -9.476 3.652 999 2HD PRO 120 2HD PRO 120 -5.642 -9.403 2.149 1000 H LEU 121 H LEU 121 -10.406 -9.830 1.873 1001 HA LEU 121 HA LEU 121 -11.372 -11.179 4.264 1002 1HB LEU 121 1HB LEU 121 -11.364 -8.833 4.439 1003 2HB LEU 121 2HB LEU 121 -12.078 -8.619 2.853 1004 HG LEU 121 HG LEU 121 -14.185 -9.688 3.742 1005 1HD1 LEU 121 1HD1 LEU 121 -14.450 -10.359 5.879 1006 2HD1 LEU 121 2HD1 LEU 121 -12.682 -10.555 5.810 1007 3HD1 LEU 121 3HD1 LEU 121 -13.387 -9.088 6.531 1008 1HD2 LEU 121 1HD2 LEU 121 -13.144 -7.041 4.135 1009 2HD2 LEU 121 2HD2 LEU 121 -14.814 -7.564 3.807 1010 3HD2 LEU 121 3HD2 LEU 121 -14.225 -7.463 5.484 1011 H LYS 122 H LYS 122 -13.817 -11.643 4.318 1012 HA LYS 122 HA LYS 122 -14.441 -13.644 2.628 1013 1HB LYS 122 1HB LYS 122 -15.657 -13.165 4.681 1014 2HB LYS 122 2HB LYS 122 -16.325 -11.699 3.992 1015 1HG LYS 122 1HG LYS 122 -17.006 -13.600 2.074 1016 2HG LYS 122 2HG LYS 122 -17.127 -14.524 3.558 1017 1HD LYS 122 1HD LYS 122 -19.285 -13.581 3.349 1018 2HD LYS 122 2HD LYS 122 -18.500 -12.507 4.490 1019 1HE LYS 122 1HE LYS 122 -17.973 -11.643 1.739 1020 2HE LYS 122 2HE LYS 122 -19.696 -11.792 2.017 1021 1HZ LYS 122 1HZ LYS 122 -19.663 -10.126 3.488 1022 2HZ LYS 122 2HZ LYS 122 -18.209 -10.516 4.121 1023 3HZ LYS 122 3HZ LYS 122 -18.293 -9.683 2.719 1024 H SER 123 H SER 123 -14.810 -13.853 0.489 1025 HA SER 123 HA SER 123 -14.804 -11.602 -1.146 1026 1HB SER 123 1HB SER 123 -14.851 -13.120 -2.939 1027 2HB SER 123 2HB SER 123 -14.139 -14.075 -1.653 1028 HG SER 123 HG SER 123 -16.738 -14.250 -2.819 1029 H ASN 124 H ASN 124 -16.468 -10.326 -1.934 1030 HA ASN 124 HA ASN 124 -18.986 -10.589 -0.777 1031 1HB ASN 124 1HB ASN 124 -18.236 -8.387 -1.457 1032 2HB ASN 124 2HB ASN 124 -17.892 -8.924 -3.090 1033 1HD2 ASN 124 1HD2 ASN 124 -19.192 -7.138 -3.755 1034 2HD2 ASN 124 2HD2 ASN 124 -20.919 -7.262 -3.819 Start of MODEL 18 1 1H MET 1 1H MET 1 -1.868 -12.890 20.033 2 HA MET 1 HA MET 1 -2.416 -10.620 21.621 3 1HB MET 1 1HB MET 1 -0.534 -11.478 19.494 4 2HB MET 1 2HB MET 1 -0.977 -9.790 19.330 5 1HG MET 1 1HG MET 1 1.040 -10.078 20.775 6 2HG MET 1 2HG MET 1 -0.280 -9.329 21.652 7 1HE MET 1 1HE MET 1 2.385 -11.517 23.011 8 2HE MET 1 2HE MET 1 1.578 -9.955 23.291 9 3HE MET 1 3HE MET 1 1.303 -11.313 24.409 10 H MET 2 H MET 2 -2.321 -10.661 18.003 11 HA MET 2 HA MET 2 -5.036 -9.777 17.885 12 1HB MET 2 1HB MET 2 -3.068 -7.820 18.219 13 2HB MET 2 2HB MET 2 -3.194 -7.892 16.473 14 1HG MET 2 1HG MET 2 -4.773 -6.215 17.370 15 2HG MET 2 2HG MET 2 -5.656 -7.527 16.616 16 1HE MET 2 1HE MET 2 -5.410 -5.385 19.795 17 2HE MET 2 2HE MET 2 -5.287 -6.603 21.087 18 3HE MET 2 3HE MET 2 -3.979 -6.439 19.891 19 H ASN 3 H ASN 3 -5.480 -9.082 15.395 20 HA ASN 3 HA ASN 3 -3.907 -10.916 13.766 21 1HB ASN 3 1HB ASN 3 -6.891 -10.679 14.128 22 2HB ASN 3 2HB ASN 3 -6.325 -10.992 12.499 23 1HD2 ASN 3 1HD2 ASN 3 -7.877 -12.779 13.915 24 2HD2 ASN 3 2HD2 ASN 3 -6.976 -14.215 14.270 25 H GLU 4 H GLU 4 -4.842 -10.380 11.249 26 HA GLU 4 HA GLU 4 -4.780 -8.970 9.600 27 1HB GLU 4 1HB GLU 4 -6.887 -8.114 10.612 28 2HB GLU 4 2HB GLU 4 -5.971 -6.970 11.573 29 1HG GLU 4 1HG GLU 4 -5.448 -5.618 9.738 30 2HG GLU 4 2HG GLU 4 -5.502 -6.949 8.599 31 H LYS 5 H LYS 5 -3.212 -7.689 8.592 32 HA LYS 5 HA LYS 5 -1.569 -6.007 10.314 33 1HB LYS 5 1HB LYS 5 -0.534 -8.311 8.646 34 2HB LYS 5 2HB LYS 5 0.486 -6.996 9.191 35 1HG LYS 5 1HG LYS 5 -1.169 -8.075 11.378 36 2HG LYS 5 2HG LYS 5 -0.169 -9.314 10.648 37 1HD LYS 5 1HD LYS 5 1.172 -6.687 11.196 38 2HD LYS 5 2HD LYS 5 0.724 -7.633 12.602 39 1HE LYS 5 1HE LYS 5 2.001 -9.248 10.464 40 2HE LYS 5 2HE LYS 5 3.041 -7.985 11.091 41 1HZ LYS 5 1HZ LYS 5 2.164 -10.360 12.354 42 2HZ LYS 5 2HZ LYS 5 3.405 -9.376 12.750 43 3HZ LYS 5 3HZ LYS 5 1.901 -9.052 13.296 44 H ILE 6 H ILE 6 -0.221 -4.472 9.026 45 HA ILE 6 HA ILE 6 -0.734 -4.240 6.242 46 HB ILE 6 HB ILE 6 -2.599 -3.015 8.059 47 1HG1 ILE 6 1HG1 ILE 6 -2.646 -2.635 5.088 48 2HG1 ILE 6 2HG1 ILE 6 -2.784 -4.261 5.726 49 1HG2 ILE 6 1HG2 ILE 6 -2.601 -0.745 7.136 50 2HG2 ILE 6 2HG2 ILE 6 -1.099 -1.092 8.025 51 3HG2 ILE 6 3HG2 ILE 6 -1.102 -1.102 6.245 52 1HD1 ILE 6 1HD1 ILE 6 -5.031 -3.502 5.592 53 2HD1 ILE 6 2HD1 ILE 6 -4.614 -3.296 7.310 54 3HD1 ILE 6 3HD1 ILE 6 -4.614 -1.889 6.219 55 H LEU 7 H LEU 7 0.582 -2.558 5.273 56 HA LEU 7 HA LEU 7 2.442 -1.308 7.158 57 1HB LEU 7 1HB LEU 7 3.093 -3.519 5.663 58 2HB LEU 7 2HB LEU 7 3.640 -2.208 4.638 59 HG LEU 7 HG LEU 7 4.582 -1.518 7.178 60 1HD1 LEU 7 1HD1 LEU 7 3.965 -3.869 7.857 61 2HD1 LEU 7 2HD1 LEU 7 5.212 -4.440 6.721 62 3HD1 LEU 7 3HD1 LEU 7 5.669 -3.414 8.102 63 1HD2 LEU 7 1HD2 LEU 7 5.580 -1.474 4.748 64 2HD2 LEU 7 2HD2 LEU 7 6.647 -1.524 6.172 65 3HD2 LEU 7 3HD2 LEU 7 6.322 -3.012 5.251 66 H ILE 8 H ILE 8 3.201 0.750 6.533 67 HA ILE 8 HA ILE 8 1.905 1.799 4.113 68 HB ILE 8 HB ILE 8 2.219 3.065 6.831 69 1HG1 ILE 8 1HG1 ILE 8 -0.320 2.805 5.232 70 2HG1 ILE 8 2HG1 ILE 8 0.264 1.461 6.193 71 1HG2 ILE 8 1HG2 ILE 8 0.791 4.795 5.127 72 2HG2 ILE 8 2HG2 ILE 8 2.388 5.055 5.868 73 3HG2 ILE 8 3HG2 ILE 8 2.266 4.331 4.246 74 1HD1 ILE 8 1HD1 ILE 8 -0.688 2.422 8.007 75 2HD1 ILE 8 2HD1 ILE 8 0.502 3.739 7.876 76 3HD1 ILE 8 3HD1 ILE 8 -1.080 3.886 7.073 77 H VAL 9 H VAL 9 3.332 2.435 2.595 78 HA VAL 9 HA VAL 9 5.949 3.361 3.552 79 HB VAL 9 HB VAL 9 5.474 1.727 1.058 80 1HG1 VAL 9 1HG1 VAL 9 7.791 1.646 0.813 81 2HG1 VAL 9 2HG1 VAL 9 7.514 3.313 1.372 82 3HG1 VAL 9 3HG1 VAL 9 8.090 2.075 2.514 83 1HG2 VAL 9 1HG2 VAL 9 5.757 0.868 3.865 84 2HG2 VAL 9 2HG2 VAL 9 5.133 -0.012 2.450 85 3HG2 VAL 9 3HG2 VAL 9 6.887 0.083 2.736 86 H ASP 10 H ASP 10 6.610 5.304 2.721 87 HA ASP 10 HA ASP 10 6.472 7.217 1.706 88 1HB ASP 10 1HB ASP 10 7.022 5.630 -0.252 89 2HB ASP 10 2HB ASP 10 5.327 5.712 -0.689 90 H ASP 11 H ASP 11 4.830 8.710 0.240 91 HA ASP 11 HA ASP 11 2.870 9.609 -0.032 92 1HB ASP 11 1HB ASP 11 2.190 7.149 -0.597 93 2HB ASP 11 2HB ASP 11 1.498 7.100 1.012 94 H GLN 12 H GLN 12 4.287 8.781 2.781 95 HA GLN 12 HA GLN 12 2.171 9.089 4.625 96 1HB GLN 12 1HB GLN 12 4.183 9.420 6.247 97 2HB GLN 12 2HB GLN 12 4.000 7.865 5.460 98 1HG GLN 12 1HG GLN 12 5.841 8.181 4.074 99 2HG GLN 12 2HG GLN 12 5.617 9.917 3.982 100 1HE2 GLN 12 1HE2 GLN 12 5.697 10.940 6.330 101 2HE2 GLN 12 2HE2 GLN 12 7.121 10.554 7.239 102 H TYR 13 H TYR 13 1.099 10.982 4.977 103 HA TYR 13 HA TYR 13 2.613 13.377 5.443 104 1HB TYR 13 1HB TYR 13 1.568 12.693 2.839 105 2HB TYR 13 2HB TYR 13 0.456 13.881 3.490 106 HD1 TYR 13 HD1 TYR 13 3.735 13.322 2.051 107 HD2 TYR 13 HD2 TYR 13 1.321 16.155 4.159 108 HE1 TYR 13 HE1 TYR 13 5.322 15.189 1.373 109 HE2 TYR 13 HE2 TYR 13 2.916 18.013 3.475 110 HH TYR 13 HH TYR 13 5.670 17.330 1.347 111 H GLY 14 H GLY 14 0.757 11.517 6.880 112 1HA GLY 14 1HA GLY 14 -0.600 12.287 8.666 113 2HA GLY 14 2HA GLY 14 -1.247 13.545 7.630 114 H ILE 15 H ILE 15 -1.060 11.015 5.532 115 HA ILE 15 HA ILE 15 -3.851 10.348 5.983 116 HB ILE 15 HB ILE 15 -1.946 10.103 3.677 117 1HG1 ILE 15 1HG1 ILE 15 -4.258 11.203 2.748 118 2HG1 ILE 15 2HG1 ILE 15 -4.287 11.763 4.408 119 1HG2 ILE 15 1HG2 ILE 15 -4.628 8.731 3.975 120 2HG2 ILE 15 2HG2 ILE 15 -3.805 8.995 2.419 121 3HG2 ILE 15 3HG2 ILE 15 -3.043 7.980 3.667 122 1HD1 ILE 15 1HD1 ILE 15 -2.022 12.714 4.174 123 2HD1 ILE 15 2HD1 ILE 15 -1.909 12.072 2.518 124 3HD1 ILE 15 3HD1 ILE 15 -3.087 13.351 2.899 125 H ARG 16 H ARG 16 -0.580 8.883 5.919 126 HA ARG 16 HA ARG 16 -1.288 6.268 5.931 127 1HB ARG 16 1HB ARG 16 0.883 5.996 7.356 128 2HB ARG 16 2HB ARG 16 1.037 6.756 5.784 129 1HG ARG 16 1HG ARG 16 1.186 8.956 6.730 130 2HG ARG 16 2HG ARG 16 0.562 8.426 8.280 131 1HD ARG 16 1HD ARG 16 3.100 7.128 7.299 132 2HD ARG 16 2HD ARG 16 3.207 8.790 7.845 133 HE ARG 16 HE ARG 16 2.571 8.109 10.055 134 1HH1 ARG 16 1HH1 ARG 16 2.665 5.407 7.803 135 2HH1 ARG 16 2HH1 ARG 16 2.661 4.203 9.048 136 1HH2 ARG 16 1HH2 ARG 16 2.566 6.521 11.699 137 2HH2 ARG 16 2HH2 ARG 16 2.604 4.841 11.279 138 H ILE 17 H ILE 17 -1.269 8.661 8.609 139 HA ILE 17 HA ILE 17 -1.702 6.759 10.661 140 HB ILE 17 HB ILE 17 -2.153 9.743 10.540 141 1HG1 ILE 17 1HG1 ILE 17 0.112 8.462 12.010 142 2HG1 ILE 17 2HG1 ILE 17 0.216 8.539 10.263 143 1HG2 ILE 17 1HG2 ILE 17 -2.288 9.735 12.932 144 2HG2 ILE 17 2HG2 ILE 17 -3.498 8.592 12.301 145 3HG2 ILE 17 3HG2 ILE 17 -1.978 7.983 12.998 146 1HD1 ILE 17 1HD1 ILE 17 0.637 10.770 10.294 147 2HD1 ILE 17 2HD1 ILE 17 -0.738 11.081 11.380 148 3HD1 ILE 17 3HD1 ILE 17 0.840 10.608 12.055 149 H LEU 18 H LEU 18 -3.839 8.891 8.676 150 HA LEU 18 HA LEU 18 -6.213 8.530 9.894 151 1HB LEU 18 1HB LEU 18 -5.527 9.778 7.735 152 2HB LEU 18 2HB LEU 18 -5.963 8.295 6.910 153 HG LEU 18 HG LEU 18 -8.016 9.278 8.786 154 1HD1 LEU 18 1HD1 LEU 18 -8.032 11.414 8.177 155 2HD1 LEU 18 2HD1 LEU 18 -6.780 11.140 6.942 156 3HD1 LEU 18 3HD1 LEU 18 -8.495 10.877 6.544 157 1HD2 LEU 18 1HD2 LEU 18 -9.519 8.644 7.026 158 2HD2 LEU 18 2HD2 LEU 18 -8.181 8.527 5.857 159 3HD2 LEU 18 3HD2 LEU 18 -8.288 7.370 7.206 160 H LEU 19 H LEU 19 -4.832 6.291 7.383 161 HA LEU 19 HA LEU 19 -6.861 4.363 7.862 162 1HB LEU 19 1HB LEU 19 -5.305 2.936 6.444 163 2HB LEU 19 2HB LEU 19 -6.029 4.354 5.713 164 HG LEU 19 HG LEU 19 -3.446 4.999 6.880 165 1HD1 LEU 19 1HD1 LEU 19 -2.817 2.722 6.508 166 2HD1 LEU 19 2HD1 LEU 19 -3.531 2.730 4.877 167 3HD1 LEU 19 3HD1 LEU 19 -2.086 3.712 5.221 168 1HD2 LEU 19 1HD2 LEU 19 -4.945 6.122 5.032 169 2HD2 LEU 19 2HD2 LEU 19 -3.169 6.228 4.962 170 3HD2 LEU 19 3HD2 LEU 19 -4.031 5.049 3.944 171 H ASN 20 H ASN 20 -3.799 5.202 9.347 172 HA ASN 20 HA ASN 20 -3.140 2.709 10.349 173 1HB ASN 20 1HB ASN 20 -1.709 4.845 10.337 174 2HB ASN 20 2HB ASN 20 -2.655 5.416 11.697 175 1HD2 ASN 20 1HD2 ASN 20 -0.314 5.403 12.462 176 2HD2 ASN 20 2HD2 ASN 20 0.222 4.005 13.332 177 H GLU 21 H GLU 21 -4.746 5.573 11.951 178 HA GLU 21 HA GLU 21 -5.338 4.375 14.313 179 1HB GLU 21 1HB GLU 21 -5.604 6.811 13.747 180 2HB GLU 21 2HB GLU 21 -7.052 6.424 12.839 181 1HG GLU 21 1HG GLU 21 -8.296 5.903 14.760 182 2HG GLU 21 2HG GLU 21 -6.880 5.448 15.688 183 H VAL 22 H VAL 22 -6.783 3.875 11.145 184 HA VAL 22 HA VAL 22 -9.241 2.807 12.093 185 HB VAL 22 HB VAL 22 -7.769 2.963 9.494 186 1HG1 VAL 22 1HG1 VAL 22 -10.241 1.262 9.966 187 2HG1 VAL 22 2HG1 VAL 22 -9.554 1.676 8.377 188 3HG1 VAL 22 3HG1 VAL 22 -8.623 0.673 9.516 189 1HG2 VAL 22 1HG2 VAL 22 -10.264 4.076 10.710 190 2HG2 VAL 22 2HG2 VAL 22 -9.012 4.875 9.729 191 3HG2 VAL 22 3HG2 VAL 22 -10.225 3.833 8.947 192 H PHE 23 H PHE 23 -6.306 1.271 10.583 193 HA PHE 23 HA PHE 23 -7.140 -1.328 11.225 194 1HB PHE 23 1HB PHE 23 -4.311 -0.189 10.830 195 2HB PHE 23 2HB PHE 23 -4.796 -1.845 10.530 196 HD1 PHE 23 HD1 PHE 23 -7.433 -1.188 9.122 197 HD2 PHE 23 HD2 PHE 23 -3.499 0.336 8.669 198 HE1 PHE 23 HE1 PHE 23 -7.933 -0.608 6.731 199 HE2 PHE 23 HE2 PHE 23 -3.999 0.916 6.278 200 HZ PHE 23 HZ PHE 23 -6.210 0.437 5.338 201 H ASN 24 H ASN 24 -5.098 1.101 12.910 202 HA ASN 24 HA ASN 24 -4.056 -0.641 14.791 203 1HB ASN 24 1HB ASN 24 -3.634 1.972 14.189 204 2HB ASN 24 2HB ASN 24 -4.699 2.210 15.560 205 1HD2 ASN 24 1HD2 ASN 24 -3.886 2.162 17.521 206 2HD2 ASN 24 2HD2 ASN 24 -2.326 1.569 17.986 207 H LYS 25 H LYS 25 -7.108 1.233 14.538 208 HA LYS 25 HA LYS 25 -7.981 1.134 17.140 209 1HB LYS 25 1HB LYS 25 -9.118 1.598 14.497 210 2HB LYS 25 2HB LYS 25 -10.263 0.803 15.558 211 1HG LYS 25 1HG LYS 25 -9.514 2.588 17.341 212 2HG LYS 25 2HG LYS 25 -8.847 3.458 15.974 213 1HD LYS 25 1HD LYS 25 -11.090 3.424 14.859 214 2HD LYS 25 2HD LYS 25 -11.756 2.557 16.229 215 1HE LYS 25 1HE LYS 25 -10.720 4.616 17.610 216 2HE LYS 25 2HE LYS 25 -10.843 5.431 16.063 217 1HZ LYS 25 1HZ LYS 25 -13.011 4.198 17.598 218 2HZ LYS 25 2HZ LYS 25 -12.859 5.761 17.152 219 3HZ LYS 25 3HZ LYS 25 -13.192 4.621 16.031 220 H GLU 26 H GLU 26 -7.470 -1.461 14.865 221 HA GLU 26 HA GLU 26 -9.213 -3.207 16.367 222 1HB GLU 26 1HB GLU 26 -7.478 -3.866 13.949 223 2HB GLU 26 2HB GLU 26 -8.777 -4.845 14.601 224 1HG GLU 26 1HG GLU 26 -9.511 -2.028 13.902 225 2HG GLU 26 2HG GLU 26 -9.100 -3.060 12.546 226 H GLY 27 H GLY 27 -5.867 -2.234 16.128 227 1HA GLY 27 1HA GLY 27 -4.360 -2.762 17.858 228 2HA GLY 27 2HA GLY 27 -5.156 -4.306 18.091 229 H TYR 28 H TYR 28 -4.922 -3.623 14.744 230 HA TYR 28 HA TYR 28 -3.144 -5.749 14.294 231 1HB TYR 28 1HB TYR 28 -3.926 -3.333 12.549 232 2HB TYR 28 2HB TYR 28 -3.370 -4.879 11.940 233 HD1 TYR 28 HD1 TYR 28 -5.836 -3.771 10.891 234 HD2 TYR 28 HD2 TYR 28 -5.224 -6.116 14.417 235 HE1 TYR 28 HE1 TYR 28 -8.240 -4.590 10.772 236 HE2 TYR 28 HE2 TYR 28 -7.629 -6.927 14.286 237 HH TYR 28 HH TYR 28 -9.599 -6.286 11.503 238 H GLN 29 H GLN 29 -0.979 -5.779 13.513 239 HA GLN 29 HA GLN 29 0.547 -3.576 14.515 240 1HB GLN 29 1HB GLN 29 0.955 -6.363 14.206 241 2HB GLN 29 2HB GLN 29 2.098 -5.615 13.108 242 1HG GLN 29 1HG GLN 29 3.175 -4.397 14.849 243 2HG GLN 29 2HG GLN 29 1.815 -4.565 15.941 244 1HE2 GLN 29 1HE2 GLN 29 1.603 -6.318 17.213 245 2HE2 GLN 29 2HE2 GLN 29 2.750 -7.611 17.326 246 H THR 30 H THR 30 1.004 -1.813 13.277 247 HA THR 30 HA THR 30 1.348 -2.270 10.385 248 HB THR 30 HB THR 30 0.353 0.070 10.170 249 HG1 THR 30 HG1 THR 30 0.669 0.825 12.315 250 1HG2 THR 30 1HG2 THR 30 -1.057 -2.215 10.247 251 2HG2 THR 30 2HG2 THR 30 -1.623 -1.546 11.796 252 3HG2 THR 30 3HG2 THR 30 -1.887 -0.641 10.286 253 H PHE 31 H PHE 31 3.073 -1.305 9.364 254 HA PHE 31 HA PHE 31 4.843 0.226 11.135 255 1HB PHE 31 1HB PHE 31 5.163 -2.321 9.671 256 2HB PHE 31 2HB PHE 31 6.338 -1.152 9.103 257 HD1 PHE 31 HD1 PHE 31 5.034 -2.701 12.225 258 HD2 PHE 31 HD2 PHE 31 8.304 -0.796 10.305 259 HE1 PHE 31 HE1 PHE 31 6.490 -3.201 14.207 260 HE2 PHE 31 HE2 PHE 31 9.759 -1.296 12.287 261 HZ PHE 31 HZ PHE 31 8.835 -2.492 14.215 262 H GLN 32 H GLN 32 6.518 1.520 9.839 263 HA GLN 32 HA GLN 32 5.358 2.313 7.287 264 1HB GLN 32 1HB GLN 32 4.724 4.208 8.412 265 2HB GLN 32 2HB GLN 32 5.878 3.958 9.707 266 1HG GLN 32 1HG GLN 32 7.680 4.919 8.450 267 2HG GLN 32 2HG GLN 32 6.814 4.777 6.933 268 1HE2 GLN 32 1HE2 GLN 32 6.453 6.217 10.170 269 2HE2 GLN 32 2HE2 GLN 32 5.775 7.728 9.665 270 H ALA 33 H ALA 33 6.886 3.036 5.677 271 HA ALA 33 HA ALA 33 9.699 2.733 6.427 272 1HB ALA 33 1HB ALA 33 9.542 1.642 3.875 273 2HB ALA 33 2HB ALA 33 9.709 0.725 5.392 274 3HB ALA 33 3HB ALA 33 8.097 0.989 4.684 275 H ALA 34 H ALA 34 11.169 3.853 4.937 276 HA ALA 34 HA ALA 34 9.754 5.949 3.434 277 1HB ALA 34 1HB ALA 34 12.191 5.992 5.220 278 2HB ALA 34 2HB ALA 34 11.988 7.211 3.940 279 3HB ALA 34 3HB ALA 34 10.770 7.064 5.229 280 H ASN 35 H ASN 35 10.291 3.386 2.306 281 HA ASN 35 HA ASN 35 11.685 4.191 0.045 282 1HB ASN 35 1HB ASN 35 13.319 1.953 0.735 283 2HB ASN 35 2HB ASN 35 13.839 3.615 0.538 284 1HD2 ASN 35 1HD2 ASN 35 15.284 3.761 2.138 285 2HD2 ASN 35 2HD2 ASN 35 14.939 3.605 3.828 286 H GLY 36 H GLY 36 12.117 2.014 -1.381 287 1HA GLY 36 1HA GLY 36 9.711 0.375 -1.049 288 2HA GLY 36 2HA GLY 36 10.685 0.553 -2.495 289 H LEU 37 H LEU 37 13.199 0.290 -0.622 290 HA LEU 37 HA LEU 37 13.342 -2.575 -0.909 291 1HB LEU 37 1HB LEU 37 15.134 -0.405 -1.041 292 2HB LEU 37 2HB LEU 37 15.637 -1.363 0.337 293 HG LEU 37 HG LEU 37 15.207 -2.476 -2.448 294 1HD1 LEU 37 1HD1 LEU 37 17.917 -2.127 -1.219 295 2HD1 LEU 37 2HD1 LEU 37 17.442 -2.238 -2.930 296 3HD1 LEU 37 3HD1 LEU 37 17.127 -0.745 -2.014 297 1HD2 LEU 37 1HD2 LEU 37 14.918 -4.088 -0.577 298 2HD2 LEU 37 2HD2 LEU 37 16.286 -4.472 -1.650 299 3HD2 LEU 37 3HD2 LEU 37 16.583 -3.731 -0.059 300 H GLN 38 H GLN 38 13.681 -0.129 1.751 301 HA GLN 38 HA GLN 38 14.006 -1.978 3.759 302 1HB GLN 38 1HB GLN 38 13.665 0.855 3.514 303 2HB GLN 38 2HB GLN 38 12.528 0.314 4.733 304 1HG GLN 38 1HG GLN 38 14.811 -1.132 5.399 305 2HG GLN 38 2HG GLN 38 15.496 0.370 4.812 306 1HE2 GLN 38 1HE2 GLN 38 15.620 2.019 6.138 307 2HE2 GLN 38 2HE2 GLN 38 14.770 2.222 7.633 308 H ALA 39 H ALA 39 11.206 -1.198 1.851 309 HA ALA 39 HA ALA 39 9.295 -2.009 3.838 310 1HB ALA 39 1HB ALA 39 7.694 -1.711 1.969 311 2HB ALA 39 2HB ALA 39 8.761 -0.298 2.152 312 3HB ALA 39 3HB ALA 39 9.057 -1.474 0.849 313 H LEU 40 H LEU 40 11.219 -3.454 1.228 314 HA LEU 40 HA LEU 40 9.676 -5.748 0.836 315 1HB LEU 40 1HB LEU 40 12.543 -5.003 0.381 316 2HB LEU 40 2HB LEU 40 12.023 -6.660 0.148 317 HG LEU 40 HG LEU 40 11.021 -4.208 -1.318 318 1HD1 LEU 40 1HD1 LEU 40 11.855 -5.711 -3.285 319 2HD1 LEU 40 2HD1 LEU 40 13.018 -4.760 -2.330 320 3HD1 LEU 40 3HD1 LEU 40 12.825 -6.502 -2.019 321 1HD2 LEU 40 1HD2 LEU 40 9.924 -6.333 -2.641 322 2HD2 LEU 40 2HD2 LEU 40 9.772 -6.846 -0.944 323 3HD2 LEU 40 3HD2 LEU 40 9.069 -5.298 -1.472 324 H ASP 41 H ASP 41 12.479 -5.089 3.041 325 HA ASP 41 HA ASP 41 12.449 -7.645 4.136 326 1HB ASP 41 1HB ASP 41 14.342 -5.988 4.274 327 2HB ASP 41 2HB ASP 41 13.389 -5.016 5.378 328 H ILE 42 H ILE 42 11.129 -4.431 5.219 329 HA ILE 42 HA ILE 42 10.027 -5.347 7.615 330 HB ILE 42 HB ILE 42 9.545 -2.979 5.835 331 1HG1 ILE 42 1HG1 ILE 42 11.496 -3.568 7.704 332 2HG1 ILE 42 2HG1 ILE 42 11.099 -1.979 7.080 333 1HG2 ILE 42 1HG2 ILE 42 8.139 -3.520 8.465 334 2HG2 ILE 42 2HG2 ILE 42 8.043 -2.032 7.492 335 3HG2 ILE 42 3HG2 ILE 42 7.381 -3.557 6.855 336 1HD1 ILE 42 1HD1 ILE 42 9.444 -1.660 8.920 337 2HD1 ILE 42 2HD1 ILE 42 9.862 -3.269 9.557 338 3HD1 ILE 42 3HD1 ILE 42 11.079 -1.970 9.551 339 H VAL 43 H VAL 43 8.984 -5.581 4.246 340 HA VAL 43 HA VAL 43 6.261 -5.996 4.697 341 HB VAL 43 HB VAL 43 8.236 -6.449 2.544 342 1HG1 VAL 43 1HG1 VAL 43 7.402 -8.552 2.173 343 2HG1 VAL 43 2HG1 VAL 43 5.821 -8.178 2.900 344 3HG1 VAL 43 3HG1 VAL 43 6.207 -7.597 1.263 345 1HG2 VAL 43 1HG2 VAL 43 5.485 -5.582 1.921 346 2HG2 VAL 43 2HG2 VAL 43 6.338 -4.555 3.098 347 3HG2 VAL 43 3HG2 VAL 43 7.048 -4.847 1.492 348 H THR 44 H THR 44 9.040 -8.312 4.454 349 HA THR 44 HA THR 44 7.346 -10.541 5.091 350 HB THR 44 HB THR 44 10.378 -10.169 4.842 351 HG1 THR 44 HG1 THR 44 9.217 -9.890 2.858 352 1HG2 THR 44 1HG2 THR 44 10.233 -12.700 4.362 353 2HG2 THR 44 2HG2 THR 44 10.041 -12.239 6.070 354 3HG2 THR 44 3HG2 THR 44 8.611 -12.653 5.094 355 H LYS 45 H LYS 45 9.535 -8.335 6.855 356 HA LYS 45 HA LYS 45 9.696 -9.858 9.189 357 1HB LYS 45 1HB LYS 45 10.663 -7.395 8.234 358 2HB LYS 45 2HB LYS 45 9.753 -6.999 9.677 359 1HG LYS 45 1HG LYS 45 11.182 -9.352 10.355 360 2HG LYS 45 2HG LYS 45 12.321 -8.391 9.434 361 1HD LYS 45 1HD LYS 45 11.221 -6.447 11.048 362 2HD LYS 45 2HD LYS 45 11.097 -7.842 12.102 363 1HE LYS 45 1HE LYS 45 13.653 -6.879 10.728 364 2HE LYS 45 2HE LYS 45 13.263 -6.656 12.422 365 1HZ LYS 45 1HZ LYS 45 12.986 -9.229 12.293 366 2HZ LYS 45 2HZ LYS 45 14.015 -9.081 11.033 367 3HZ LYS 45 3HZ LYS 45 14.455 -8.552 12.514 368 H GLU 46 H GLU 46 7.269 -7.510 7.972 369 HA GLU 46 HA GLU 46 5.756 -7.976 10.407 370 1HB GLU 46 1HB GLU 46 5.899 -5.766 8.397 371 2HB GLU 46 2HB GLU 46 4.313 -6.082 9.073 372 1HG GLU 46 1HG GLU 46 6.239 -6.154 11.231 373 2HG GLU 46 2HG GLU 46 6.525 -4.700 10.295 374 H ARG 47 H ARG 47 6.119 -9.215 7.298 375 HA ARG 47 HA ARG 47 4.671 -9.997 5.778 376 1HB ARG 47 1HB ARG 47 3.637 -12.138 6.727 377 2HB ARG 47 2HB ARG 47 5.352 -11.949 7.033 378 1HG ARG 47 1HG ARG 47 5.039 -11.906 9.285 379 2HG ARG 47 2HG ARG 47 3.799 -10.673 9.159 380 1HD ARG 47 1HD ARG 47 2.730 -12.615 10.116 381 2HD ARG 47 2HD ARG 47 2.156 -12.504 8.465 382 HE ARG 47 HE ARG 47 4.557 -14.164 8.753 383 1HH1 ARG 47 1HH1 ARG 47 1.040 -14.127 8.849 384 2HH1 ARG 47 2HH1 ARG 47 0.886 -15.822 8.527 385 1HH2 ARG 47 1HH2 ARG 47 4.355 -16.401 8.328 386 2HH2 ARG 47 2HH2 ARG 47 2.784 -17.124 8.229 387 HA PRO 48 HA PRO 48 0.844 -7.969 7.337 388 1HB PRO 48 1HB PRO 48 0.798 -5.795 5.682 389 2HB PRO 48 2HB PRO 48 1.449 -5.747 7.308 390 1HG PRO 48 1HG PRO 48 2.898 -5.785 4.732 391 2HG PRO 48 2HG PRO 48 3.486 -5.317 6.315 392 1HD PRO 48 1HD PRO 48 4.016 -7.781 4.947 393 2HD PRO 48 2HD PRO 48 4.507 -7.360 6.576 394 H ASP 49 H ASP 49 -1.284 -7.813 6.399 395 HA ASP 49 HA ASP 49 -1.363 -9.603 4.171 396 1HB ASP 49 1HB ASP 49 -3.833 -8.241 5.218 397 2HB ASP 49 2HB ASP 49 -3.620 -9.906 4.714 398 H LEU 50 H LEU 50 -0.805 -6.348 4.494 399 HA LEU 50 HA LEU 50 -1.531 -5.771 1.823 400 1HB LEU 50 1HB LEU 50 -3.683 -5.560 3.396 401 2HB LEU 50 2HB LEU 50 -2.992 -3.975 3.687 402 HG LEU 50 HG LEU 50 -4.741 -4.187 1.842 403 1HD1 LEU 50 1HD1 LEU 50 -3.674 -2.511 0.453 404 2HD1 LEU 50 2HD1 LEU 50 -3.293 -2.217 2.167 405 3HD1 LEU 50 3HD1 LEU 50 -2.075 -2.953 1.098 406 1HD2 LEU 50 1HD2 LEU 50 -2.478 -5.146 0.105 407 2HD2 LEU 50 2HD2 LEU 50 -3.567 -6.295 0.919 408 3HD2 LEU 50 3HD2 LEU 50 -4.225 -5.106 -0.231 409 H VAL 51 H VAL 51 -0.437 -3.911 1.067 410 HA VAL 51 HA VAL 51 1.080 -2.454 3.103 411 HB VAL 51 HB VAL 51 2.288 -3.465 0.529 412 1HG1 VAL 51 1HG1 VAL 51 3.173 -1.755 2.752 413 2HG1 VAL 51 2HG1 VAL 51 4.309 -3.068 2.359 414 3HG1 VAL 51 3HG1 VAL 51 3.812 -1.913 1.098 415 1HG2 VAL 51 1HG2 VAL 51 2.094 -5.509 1.514 416 2HG2 VAL 51 2HG2 VAL 51 3.551 -4.957 2.375 417 3HG2 VAL 51 3HG2 VAL 51 1.956 -4.832 3.155 418 H LEU 52 H LEU 52 1.335 -0.258 2.668 419 HA LEU 52 HA LEU 52 -0.061 0.645 0.250 420 1HB LEU 52 1HB LEU 52 -1.228 1.329 2.191 421 2HB LEU 52 2HB LEU 52 0.241 1.848 2.993 422 HG LEU 52 HG LEU 52 -0.099 3.295 0.507 423 1HD1 LEU 52 1HD1 LEU 52 -2.551 2.621 1.394 424 2HD1 LEU 52 2HD1 LEU 52 -2.273 4.091 2.358 425 3HD1 LEU 52 3HD1 LEU 52 -2.182 4.161 0.582 426 1HD2 LEU 52 1HD2 LEU 52 -0.115 4.233 3.389 427 2HD2 LEU 52 2HD2 LEU 52 1.338 3.961 2.398 428 3HD2 LEU 52 3HD2 LEU 52 0.175 5.230 1.943 429 H LEU 53 H LEU 53 1.476 0.889 -1.318 430 HA LEU 53 HA LEU 53 3.826 2.474 -0.542 431 1HB LEU 53 1HB LEU 53 4.754 0.430 -0.998 432 2HB LEU 53 2HB LEU 53 3.554 0.016 -2.207 433 HG LEU 53 HG LEU 53 5.708 0.330 -3.251 434 1HD1 LEU 53 1HD1 LEU 53 4.442 2.828 -4.187 435 2HD1 LEU 53 2HD1 LEU 53 4.894 1.356 -5.078 436 3HD1 LEU 53 3HD1 LEU 53 3.380 1.400 -4.143 437 1HD2 LEU 53 1HD2 LEU 53 5.856 3.242 -2.667 438 2HD2 LEU 53 2HD2 LEU 53 6.298 2.125 -1.353 439 3HD2 LEU 53 3HD2 LEU 53 7.151 2.045 -2.913 440 H ASP 54 H ASP 54 4.403 4.206 -1.879 441 HA ASP 54 HA ASP 54 2.379 4.798 -3.890 442 1HB ASP 54 1HB ASP 54 2.222 6.596 -2.423 443 2HB ASP 54 2HB ASP 54 3.885 6.447 -1.891 444 H MET 55 H MET 55 3.231 5.995 -5.862 445 HA MET 55 HA MET 55 5.513 4.753 -6.851 446 1HB MET 55 1HB MET 55 4.158 7.321 -7.844 447 2HB MET 55 2HB MET 55 5.132 6.233 -8.813 448 1HG MET 55 1HG MET 55 2.411 5.643 -7.562 449 2HG MET 55 2HG MET 55 2.789 5.743 -9.270 450 1HE MET 55 1HE MET 55 4.294 3.388 -6.058 451 2HE MET 55 2HE MET 55 2.636 4.029 -6.155 452 3HE MET 55 3HE MET 55 2.948 2.310 -6.497 453 H LYS 56 H LYS 56 5.005 8.338 -6.477 454 HA LYS 56 HA LYS 56 7.621 9.063 -6.732 455 1HB LYS 56 1HB LYS 56 5.166 10.288 -6.038 456 2HB LYS 56 2HB LYS 56 6.307 10.747 -4.790 457 1HG LYS 56 1HG LYS 56 7.801 11.759 -6.337 458 2HG LYS 56 2HG LYS 56 7.143 10.878 -7.702 459 1HD LYS 56 1HD LYS 56 4.916 12.171 -7.201 460 2HD LYS 56 2HD LYS 56 5.909 13.226 -6.217 461 1HE LYS 56 1HE LYS 56 7.320 13.804 -8.138 462 2HE LYS 56 2HE LYS 56 6.534 12.600 -9.140 463 1HZ LYS 56 1HZ LYS 56 4.586 13.832 -9.168 464 2HZ LYS 56 2HZ LYS 56 5.008 14.766 -7.897 465 3HZ LYS 56 3HZ LYS 56 5.750 14.964 -9.339 466 H ILE 57 H ILE 57 9.438 8.586 -5.631 467 HA ILE 57 HA ILE 57 9.267 8.374 -2.742 468 HB ILE 57 HB ILE 57 9.367 6.089 -4.449 469 1HG1 ILE 57 1HG1 ILE 57 9.638 6.269 -1.436 470 2HG1 ILE 57 2HG1 ILE 57 8.118 6.429 -2.293 471 1HG2 ILE 57 1HG2 ILE 57 11.895 6.628 -2.887 472 2HG2 ILE 57 2HG2 ILE 57 11.363 4.987 -3.325 473 3HG2 ILE 57 3HG2 ILE 57 11.718 6.178 -4.600 474 1HD1 ILE 57 1HD1 ILE 57 8.328 4.117 -1.589 475 2HD1 ILE 57 2HD1 ILE 57 8.551 4.159 -3.354 476 3HD1 ILE 57 3HD1 ILE 57 9.963 4.001 -2.282 477 HA PRO 58 HA PRO 58 13.099 10.323 -3.099 478 1HB PRO 58 1HB PRO 58 14.287 9.710 -0.716 479 2HB PRO 58 2HB PRO 58 13.074 10.963 -0.888 480 1HG PRO 58 1HG PRO 58 12.796 8.262 0.283 481 2HG PRO 58 2HG PRO 58 11.752 9.656 0.478 482 1HD PRO 58 1HD PRO 58 11.265 7.365 -1.177 483 2HD PRO 58 2HD PRO 58 10.278 8.809 -1.070 484 H GLY 59 H GLY 59 14.823 10.014 -4.355 485 1HA GLY 59 1HA GLY 59 16.555 8.930 -5.290 486 2HA GLY 59 2HA GLY 59 16.728 8.037 -3.792 487 H MET 60 H MET 60 15.602 7.964 -7.101 488 HA MET 60 HA MET 60 14.949 6.345 -8.397 489 1HB MET 60 1HB MET 60 16.639 5.086 -6.576 490 2HB MET 60 2HB MET 60 15.183 4.129 -6.394 491 1HG MET 60 1HG MET 60 15.226 4.163 -9.083 492 2HG MET 60 2HG MET 60 16.932 4.478 -8.832 493 1HE MET 60 1HE MET 60 13.965 2.591 -7.734 494 2HE MET 60 2HE MET 60 14.441 0.876 -7.721 495 3HE MET 60 3HE MET 60 14.739 1.893 -6.291 496 H ASP 61 H ASP 61 12.759 6.862 -8.618 497 HA ASP 61 HA ASP 61 10.840 6.682 -6.755 498 1HB ASP 61 1HB ASP 61 10.186 5.737 -9.547 499 2HB ASP 61 2HB ASP 61 9.291 6.845 -8.525 500 H GLY 62 H GLY 62 8.814 4.977 -7.095 501 1HA GLY 62 1HA GLY 62 9.949 2.359 -6.512 502 2HA GLY 62 2HA GLY 62 8.298 2.892 -6.265 503 H ILE 63 H ILE 63 9.856 3.614 -9.355 504 HA ILE 63 HA ILE 63 7.861 2.169 -10.753 505 HB ILE 63 HB ILE 63 10.395 3.521 -11.685 506 1HG1 ILE 63 1HG1 ILE 63 7.724 4.706 -12.189 507 2HG1 ILE 63 2HG1 ILE 63 8.252 4.715 -10.518 508 1HG2 ILE 63 1HG2 ILE 63 9.549 1.784 -13.258 509 2HG2 ILE 63 2HG2 ILE 63 8.005 2.666 -13.338 510 3HG2 ILE 63 3HG2 ILE 63 9.502 3.439 -13.912 511 1HD1 ILE 63 1HD1 ILE 63 9.309 6.653 -11.158 512 2HD1 ILE 63 2HD1 ILE 63 10.566 5.527 -11.725 513 3HD1 ILE 63 3HD1 ILE 63 9.368 6.174 -12.871 514 H GLU 64 H GLU 64 11.392 1.677 -10.138 515 HA GLU 64 HA GLU 64 11.217 -0.870 -11.459 516 1HB GLU 64 1HB GLU 64 13.620 0.292 -9.997 517 2HB GLU 64 2HB GLU 64 13.623 -0.954 -11.229 518 1HG GLU 64 1HG GLU 64 12.408 1.707 -11.951 519 2HG GLU 64 2HG GLU 64 14.152 1.630 -11.803 520 H ILE 65 H ILE 65 11.373 0.532 -8.188 521 HA ILE 65 HA ILE 65 12.106 -1.751 -6.786 522 HB ILE 65 HB ILE 65 10.309 0.517 -5.922 523 1HG1 ILE 65 1HG1 ILE 65 13.322 0.252 -5.992 524 2HG1 ILE 65 2HG1 ILE 65 12.330 1.461 -6.782 525 1HG2 ILE 65 1HG2 ILE 65 10.122 -0.592 -4.009 526 2HG2 ILE 65 2HG2 ILE 65 11.244 -1.858 -4.564 527 3HG2 ILE 65 3HG2 ILE 65 11.876 -0.390 -3.780 528 1HD1 ILE 65 1HD1 ILE 65 11.539 1.742 -4.139 529 2HD1 ILE 65 2HD1 ILE 65 13.264 1.332 -3.976 530 3HD1 ILE 65 3HD1 ILE 65 12.772 2.741 -4.947 531 H LEU 66 H LEU 66 8.795 -0.449 -7.528 532 HA LEU 66 HA LEU 66 7.467 -2.656 -6.425 533 1HB LEU 66 1HB LEU 66 6.723 -0.445 -8.310 534 2HB LEU 66 2HB LEU 66 5.601 -1.754 -7.996 535 HG LEU 66 HG LEU 66 5.018 0.040 -6.555 536 1HD1 LEU 66 1HD1 LEU 66 6.518 -1.602 -4.570 537 2HD1 LEU 66 2HD1 LEU 66 4.811 -1.096 -4.594 538 3HD1 LEU 66 3HD1 LEU 66 5.358 -2.432 -5.635 539 1HD2 LEU 66 1HD2 LEU 66 6.823 1.488 -6.473 540 2HD2 LEU 66 2HD2 LEU 66 6.784 0.830 -4.819 541 3HD2 LEU 66 3HD2 LEU 66 7.966 0.209 -5.997 542 H LYS 67 H LYS 67 8.723 -1.925 -9.713 543 HA LYS 67 HA LYS 67 7.521 -3.971 -11.093 544 1HB LYS 67 1HB LYS 67 9.613 -2.077 -11.503 545 2HB LYS 67 2HB LYS 67 10.218 -3.641 -12.013 546 1HG LYS 67 1HG LYS 67 7.755 -3.797 -13.131 547 2HG LYS 67 2HG LYS 67 7.904 -2.051 -13.096 548 1HD LYS 67 1HD LYS 67 10.161 -2.285 -14.251 549 2HD LYS 67 2HD LYS 67 9.855 -4.004 -14.401 550 1HE LYS 67 1HE LYS 67 7.637 -3.354 -15.583 551 2HE LYS 67 2HE LYS 67 8.275 -1.724 -15.663 552 1HZ LYS 67 1HZ LYS 67 10.285 -3.358 -16.538 553 2HZ LYS 67 2HZ LYS 67 8.934 -3.941 -17.247 554 3HZ LYS 67 3HZ LYS 67 9.353 -2.376 -17.451 555 H ARG 68 H ARG 68 10.833 -4.057 -9.586 556 HA ARG 68 HA ARG 68 11.236 -6.712 -10.022 557 1HB ARG 68 1HB ARG 68 12.321 -4.642 -8.155 558 2HB ARG 68 2HB ARG 68 12.595 -6.298 -7.650 559 1HG ARG 68 1HG ARG 68 13.702 -6.834 -9.770 560 2HG ARG 68 2HG ARG 68 13.266 -5.278 -10.448 561 1HD ARG 68 1HD ARG 68 15.333 -4.605 -9.733 562 2HD ARG 68 2HD ARG 68 14.586 -4.487 -8.152 563 HE ARG 68 HE ARG 68 15.435 -7.201 -8.616 564 1HH1 ARG 68 1HH1 ARG 68 16.718 -4.006 -7.888 565 2HH1 ARG 68 2HH1 ARG 68 18.131 -4.615 -7.091 566 1HH2 ARG 68 1HH2 ARG 68 17.298 -8.005 -7.565 567 2HH2 ARG 68 2HH2 ARG 68 18.462 -6.905 -6.906 568 H MET 69 H MET 69 9.407 -5.030 -7.454 569 HA MET 69 HA MET 69 9.256 -7.027 -5.598 570 1HB MET 69 1HB MET 69 8.125 -4.492 -6.038 571 2HB MET 69 2HB MET 69 6.717 -5.536 -6.053 572 1HG MET 69 1HG MET 69 7.638 -6.562 -3.852 573 2HG MET 69 2HG MET 69 8.766 -5.221 -3.816 574 1HE MET 69 1HE MET 69 8.563 -3.711 -2.543 575 2HE MET 69 2HE MET 69 7.467 -2.368 -2.946 576 3HE MET 69 3HE MET 69 7.170 -3.355 -1.494 577 H LYS 70 H LYS 70 6.909 -6.320 -8.291 578 HA LYS 70 HA LYS 70 5.413 -8.671 -7.776 579 1HB LYS 70 1HB LYS 70 4.012 -7.936 -9.448 580 2HB LYS 70 2HB LYS 70 4.726 -6.428 -8.913 581 1HG LYS 70 1HG LYS 70 4.883 -6.348 -11.291 582 2HG LYS 70 2HG LYS 70 6.501 -6.763 -10.761 583 1HD LYS 70 1HD LYS 70 6.435 -8.722 -11.901 584 2HD LYS 70 2HD LYS 70 4.971 -9.209 -11.070 585 1HE LYS 70 1HE LYS 70 3.574 -8.437 -12.765 586 2HE LYS 70 2HE LYS 70 4.652 -7.131 -13.215 587 1HZ LYS 70 1HZ LYS 70 4.559 -9.791 -14.197 588 2HZ LYS 70 2HZ LYS 70 5.227 -8.461 -14.867 589 3HZ LYS 70 3HZ LYS 70 6.074 -9.342 -13.785 590 H VAL 71 H VAL 71 8.028 -7.750 -10.079 591 HA VAL 71 HA VAL 71 7.957 -10.082 -11.595 592 HB VAL 71 HB VAL 71 10.338 -8.347 -10.913 593 1HG1 VAL 71 1HG1 VAL 71 10.993 -10.387 -12.045 594 2HG1 VAL 71 2HG1 VAL 71 9.741 -10.144 -13.287 595 3HG1 VAL 71 3HG1 VAL 71 11.118 -9.021 -13.179 596 1HG2 VAL 71 1HG2 VAL 71 7.961 -7.456 -11.986 597 2HG2 VAL 71 2HG2 VAL 71 9.552 -6.689 -12.209 598 3HG2 VAL 71 3HG2 VAL 71 8.928 -7.817 -13.436 599 H ILE 72 H ILE 72 9.257 -9.361 -8.371 600 HA ILE 72 HA ILE 72 10.829 -11.758 -8.286 601 HB ILE 72 HB ILE 72 10.160 -9.538 -6.394 602 1HG1 ILE 72 1HG1 ILE 72 11.994 -9.376 -8.116 603 2HG1 ILE 72 2HG1 ILE 72 12.482 -9.087 -6.458 604 1HG2 ILE 72 1HG2 ILE 72 11.626 -12.062 -5.584 605 2HG2 ILE 72 2HG2 ILE 72 11.311 -10.626 -4.581 606 3HG2 ILE 72 3HG2 ILE 72 9.959 -11.655 -5.111 607 1HD1 ILE 72 1HD1 ILE 72 12.650 -11.936 -7.302 608 2HD1 ILE 72 2HD1 ILE 72 13.753 -10.832 -8.158 609 3HD1 ILE 72 3HD1 ILE 72 13.814 -10.950 -6.383 610 H ASP 73 H ASP 73 7.758 -10.575 -6.756 611 HA ASP 73 HA ASP 73 7.054 -13.389 -6.491 612 1HB ASP 73 1HB ASP 73 5.612 -11.984 -4.509 613 2HB ASP 73 2HB ASP 73 6.937 -13.100 -4.247 614 H GLU 74 H GLU 74 4.936 -13.858 -7.242 615 HA GLU 74 HA GLU 74 3.518 -11.580 -8.335 616 1HB GLU 74 1HB GLU 74 2.523 -13.072 -9.871 617 2HB GLU 74 2HB GLU 74 4.151 -13.695 -9.697 618 1HG GLU 74 1HG GLU 74 3.270 -15.293 -7.913 619 2HG GLU 74 2HG GLU 74 1.650 -14.743 -8.293 620 H ASN 75 H ASN 75 3.570 -13.502 -5.547 621 HA ASN 75 HA ASN 75 0.706 -13.505 -5.239 622 1HB ASN 75 1HB ASN 75 2.555 -15.320 -4.444 623 2HB ASN 75 2HB ASN 75 2.598 -14.302 -3.018 624 1HD2 ASN 75 1HD2 ASN 75 1.601 -15.531 -1.564 625 2HD2 ASN 75 2HD2 ASN 75 -0.028 -16.112 -1.665 626 H ILE 76 H ILE 76 3.389 -11.448 -4.735 627 HA ILE 76 HA ILE 76 2.859 -10.383 -2.206 628 HB ILE 76 HB ILE 76 4.961 -10.124 -3.414 629 1HG1 ILE 76 1HG1 ILE 76 3.467 -7.723 -2.412 630 2HG1 ILE 76 2HG1 ILE 76 4.792 -8.601 -1.675 631 1HG2 ILE 76 1HG2 ILE 76 3.636 -9.675 -5.646 632 2HG2 ILE 76 2HG2 ILE 76 3.806 -7.975 -5.146 633 3HG2 ILE 76 3HG2 ILE 76 5.254 -8.983 -5.379 634 1HD1 ILE 76 1HD1 ILE 76 4.858 -6.448 -3.749 635 2HD1 ILE 76 2HD1 ILE 76 6.010 -6.802 -2.439 636 3HD1 ILE 76 3HD1 ILE 76 6.048 -7.758 -3.940 637 H ARG 77 H ARG 77 1.277 -9.071 -1.449 638 HA ARG 77 HA ARG 77 -0.462 -7.936 -3.483 639 1HB ARG 77 1HB ARG 77 -1.926 -9.222 -2.213 640 2HB ARG 77 2HB ARG 77 -0.926 -9.136 -0.776 641 1HG ARG 77 1HG ARG 77 -1.816 -7.069 -0.101 642 2HG ARG 77 2HG ARG 77 -2.243 -6.595 -1.733 643 1HD ARG 77 1HD ARG 77 -4.338 -7.101 -0.725 644 2HD ARG 77 2HD ARG 77 -3.980 -8.529 -1.674 645 HE ARG 77 HE ARG 77 -2.950 -8.700 1.059 646 1HH1 ARG 77 1HH1 ARG 77 -5.771 -9.210 -0.982 647 2HH1 ARG 77 2HH1 ARG 77 -6.492 -10.369 0.085 648 1HH2 ARG 77 1HH2 ARG 77 -3.901 -10.228 2.467 649 2HH2 ARG 77 2HH2 ARG 77 -5.421 -10.951 2.060 650 H VAL 78 H VAL 78 -0.010 -5.776 -3.809 651 HA VAL 78 HA VAL 78 0.209 -4.094 -1.444 652 HB VAL 78 HB VAL 78 2.298 -4.428 -3.580 653 1HG1 VAL 78 1HG1 VAL 78 3.326 -2.300 -2.556 654 2HG1 VAL 78 2HG1 VAL 78 1.983 -2.101 -3.708 655 3HG1 VAL 78 3HG1 VAL 78 1.685 -1.952 -1.960 656 1HG2 VAL 78 1HG2 VAL 78 2.069 -4.971 -0.736 657 2HG2 VAL 78 2HG2 VAL 78 3.324 -5.474 -1.894 658 3HG2 VAL 78 3HG2 VAL 78 3.448 -3.898 -1.076 659 H ILE 79 H ILE 79 -0.513 -1.938 -1.807 660 HA ILE 79 HA ILE 79 -1.878 -1.633 -4.389 661 HB ILE 79 HB ILE 79 -2.697 -1.226 -1.613 662 1HG1 ILE 79 1HG1 ILE 79 -3.935 -1.838 -4.269 663 2HG1 ILE 79 2HG1 ILE 79 -4.001 -2.739 -2.767 664 1HG2 ILE 79 1HG2 ILE 79 -2.294 1.130 -2.265 665 2HG2 ILE 79 2HG2 ILE 79 -3.421 0.919 -3.627 666 3HG2 ILE 79 3HG2 ILE 79 -4.009 0.770 -1.953 667 1HD1 ILE 79 1HD1 ILE 79 -6.181 -1.758 -3.074 668 2HD1 ILE 79 2HD1 ILE 79 -5.387 -0.815 -1.790 669 3HD1 ILE 79 3HD1 ILE 79 -5.482 -0.163 -3.444 670 H ILE 80 H ILE 80 -1.652 0.309 -5.544 671 HA ILE 80 HA ILE 80 0.611 1.924 -4.627 672 HB ILE 80 HB ILE 80 1.005 2.473 -6.884 673 1HG1 ILE 80 1HG1 ILE 80 -0.528 1.572 -8.713 674 2HG1 ILE 80 2HG1 ILE 80 -1.717 1.285 -7.459 675 1HG2 ILE 80 1HG2 ILE 80 1.341 -0.010 -5.945 676 2HG2 ILE 80 2HG2 ILE 80 0.269 -0.375 -7.318 677 3HG2 ILE 80 3HG2 ILE 80 1.808 0.475 -7.593 678 1HD1 ILE 80 1HD1 ILE 80 -1.365 3.682 -8.829 679 2HD1 ILE 80 2HD1 ILE 80 -2.239 3.496 -7.290 680 3HD1 ILE 80 3HD1 ILE 80 -0.527 3.983 -7.288 681 H MET 81 H MET 81 0.493 4.284 -4.896 682 HA MET 81 HA MET 81 -2.231 5.267 -5.064 683 1HB MET 81 1HB MET 81 -0.940 6.815 -3.044 684 2HB MET 81 2HB MET 81 -2.257 5.683 -2.806 685 1HG MET 81 1HG MET 81 -0.732 3.851 -2.358 686 2HG MET 81 2HG MET 81 0.649 4.765 -2.933 687 1HE MET 81 1HE MET 81 1.775 4.920 0.658 688 2HE MET 81 2HE MET 81 1.490 3.681 -0.589 689 3HE MET 81 3HE MET 81 2.306 5.205 -1.017 690 H THR 82 H THR 82 -2.398 7.191 -6.196 691 HA THR 82 HA THR 82 -0.541 9.222 -6.256 692 HB THR 82 HB THR 82 1.132 7.891 -7.296 693 HG1 THR 82 HG1 THR 82 0.791 8.567 -9.662 694 1HG2 THR 82 1HG2 THR 82 0.693 6.327 -9.148 695 2HG2 THR 82 2HG2 THR 82 -0.357 5.889 -7.780 696 3HG2 THR 82 3HG2 THR 82 -1.027 6.783 -9.165 697 H ALA 83 H ALA 83 -1.295 10.992 -7.407 698 HA ALA 83 HA ALA 83 -4.002 11.015 -7.982 699 1HB ALA 83 1HB ALA 83 -2.579 13.052 -9.461 700 2HB ALA 83 2HB ALA 83 -3.555 13.216 -7.982 701 3HB ALA 83 3HB ALA 83 -1.821 12.830 -7.866 702 H TYR 84 H TYR 84 -5.096 11.388 -10.088 703 HA TYR 84 HA TYR 84 -4.183 9.461 -11.997 704 1HB TYR 84 1HB TYR 84 -6.354 10.179 -13.077 705 2HB TYR 84 2HB TYR 84 -6.587 9.872 -11.367 706 HD1 TYR 84 HD1 TYR 84 -6.572 12.410 -13.997 707 HD2 TYR 84 HD2 TYR 84 -6.907 11.753 -9.783 708 HE1 TYR 84 HE1 TYR 84 -7.535 14.745 -13.702 709 HE2 TYR 84 HE2 TYR 84 -7.868 14.090 -9.502 710 HH TYR 84 HH TYR 84 -9.036 15.875 -12.045 711 H GLY 85 H GLY 85 -2.115 11.233 -11.903 712 1HA GLY 85 1HA GLY 85 -2.518 12.971 -14.262 713 2HA GLY 85 2HA GLY 85 -1.383 13.277 -12.963 714 H GLU 86 H GLU 86 -0.438 10.515 -12.640 715 HA GLU 86 HA GLU 86 1.089 10.367 -15.116 716 1HB GLU 86 1HB GLU 86 2.698 9.004 -13.564 717 2HB GLU 86 2HB GLU 86 2.654 10.749 -13.412 718 1HG GLU 86 1HG GLU 86 1.358 10.674 -11.413 719 2HG GLU 86 2HG GLU 86 0.813 9.036 -11.713 720 H LEU 87 H LEU 87 -1.388 9.248 -15.355 721 HA LEU 87 HA LEU 87 -1.874 6.743 -14.442 722 1HB LEU 87 1HB LEU 87 -2.392 7.826 -17.215 723 2HB LEU 87 2HB LEU 87 -3.158 6.413 -16.518 724 HG LEU 87 HG LEU 87 -3.376 9.035 -15.077 725 1HD1 LEU 87 1HD1 LEU 87 -5.089 9.877 -16.407 726 2HD1 LEU 87 2HD1 LEU 87 -3.895 9.299 -17.594 727 3HD1 LEU 87 3HD1 LEU 87 -5.344 8.326 -17.242 728 1HD2 LEU 87 1HD2 LEU 87 -4.317 7.327 -13.825 729 2HD2 LEU 87 2HD2 LEU 87 -5.721 7.993 -14.692 730 3HD2 LEU 87 3HD2 LEU 87 -4.960 6.486 -15.256 731 H ASP 88 H ASP 88 0.391 7.756 -17.037 732 HA ASP 88 HA ASP 88 0.937 5.446 -18.232 733 1HB ASP 88 1HB ASP 88 2.212 7.945 -17.914 734 2HB ASP 88 2HB ASP 88 3.434 6.787 -17.427 735 H MET 89 H MET 89 2.006 6.564 -14.975 736 HA MET 89 HA MET 89 3.692 4.312 -14.582 737 1HB MET 89 1HB MET 89 3.665 6.787 -13.520 738 2HB MET 89 2HB MET 89 2.601 6.049 -12.339 739 1HG MET 89 1HG MET 89 5.396 5.029 -13.046 740 2HG MET 89 2HG MET 89 5.008 5.985 -11.630 741 1HE MET 89 1HE MET 89 6.486 3.535 -11.156 742 2HE MET 89 2HE MET 89 5.702 4.256 -9.730 743 3HE MET 89 3HE MET 89 5.567 2.507 -10.032 744 H ILE 90 H ILE 90 0.439 5.386 -13.410 745 HA ILE 90 HA ILE 90 -0.034 3.336 -11.637 746 HB ILE 90 HB ILE 90 -1.855 4.978 -13.383 747 1HG1 ILE 90 1HG1 ILE 90 -2.159 5.428 -10.581 748 2HG1 ILE 90 2HG1 ILE 90 -0.442 5.442 -10.934 749 1HG2 ILE 90 1HG2 ILE 90 -3.303 3.246 -13.053 750 2HG2 ILE 90 2HG2 ILE 90 -2.512 2.714 -11.550 751 3HG2 ILE 90 3HG2 ILE 90 -3.569 4.146 -11.541 752 1HD1 ILE 90 1HD1 ILE 90 -2.522 7.028 -12.510 753 2HD1 ILE 90 2HD1 ILE 90 -1.523 7.697 -11.197 754 3HD1 ILE 90 3HD1 ILE 90 -0.754 7.121 -12.696 755 H GLN 91 H GLN 91 -0.552 3.468 -15.209 756 HA GLN 91 HA GLN 91 -1.855 1.110 -15.507 757 1HB GLN 91 1HB GLN 91 -0.046 2.773 -17.213 758 2HB GLN 91 2HB GLN 91 -0.315 1.130 -17.760 759 1HG GLN 91 1HG GLN 91 -2.847 2.280 -16.902 760 2HG GLN 91 2HG GLN 91 -2.070 3.372 -18.031 761 1HE2 GLN 91 1HE2 GLN 91 -3.509 3.002 -19.664 762 2HE2 GLN 91 2HE2 GLN 91 -3.591 1.529 -20.572 763 H GLU 92 H GLU 92 1.746 1.616 -15.728 764 HA GLU 92 HA GLU 92 2.448 -0.972 -16.066 765 1HB GLU 92 1HB GLU 92 3.737 1.500 -15.212 766 2HB GLU 92 2HB GLU 92 4.417 0.139 -14.344 767 1HG GLU 92 1HG GLU 92 5.716 0.304 -16.345 768 2HG GLU 92 2HG GLU 92 4.641 -1.054 -16.614 769 H SER 93 H SER 93 1.802 0.780 -12.970 770 HA SER 93 HA SER 93 2.570 -1.241 -11.279 771 1HB SER 93 1HB SER 93 1.544 0.013 -9.583 772 2HB SER 93 2HB SER 93 1.847 1.228 -10.808 773 HG SER 93 HG SER 93 -0.656 -0.154 -10.337 774 H LYS 94 H LYS 94 -0.673 -0.497 -12.728 775 HA LYS 94 HA LYS 94 -2.034 -2.588 -11.482 776 1HB LYS 94 1HB LYS 94 -2.569 -0.524 -13.390 777 2HB LYS 94 2HB LYS 94 -3.184 -2.031 -14.038 778 1HG LYS 94 1HG LYS 94 -3.833 -1.970 -11.230 779 2HG LYS 94 2HG LYS 94 -4.277 -0.415 -11.905 780 1HD LYS 94 1HD LYS 94 -5.226 -2.088 -13.871 781 2HD LYS 94 2HD LYS 94 -5.410 -3.122 -12.469 782 1HE LYS 94 1HE LYS 94 -6.488 -0.956 -11.360 783 2HE LYS 94 2HE LYS 94 -6.699 -0.436 -13.020 784 1HZ LYS 94 1HZ LYS 94 -8.399 -1.998 -11.741 785 2HZ LYS 94 2HZ LYS 94 -8.245 -1.988 -13.367 786 3HZ LYS 94 3HZ LYS 94 -7.497 -3.140 -12.483 787 H GLU 95 H GLU 95 -0.109 -2.404 -14.508 788 HA GLU 95 HA GLU 95 -0.819 -5.063 -15.221 789 1HB GLU 95 1HB GLU 95 1.395 -3.278 -16.323 790 2HB GLU 95 2HB GLU 95 0.783 -4.736 -17.077 791 1HG GLU 95 1HG GLU 95 -1.013 -2.359 -16.427 792 2HG GLU 95 2HG GLU 95 -0.165 -2.502 -17.954 793 H LEU 96 H LEU 96 1.288 -3.672 -12.933 794 HA LEU 96 HA LEU 96 3.410 -5.577 -13.190 795 1HB LEU 96 1HB LEU 96 2.844 -3.154 -11.718 796 2HB LEU 96 2HB LEU 96 3.483 -4.389 -10.651 797 HG LEU 96 HG LEU 96 5.457 -4.647 -12.083 798 1HD1 LEU 96 1HD1 LEU 96 5.778 -3.673 -14.107 799 2HD1 LEU 96 2HD1 LEU 96 4.000 -3.762 -14.140 800 3HD1 LEU 96 3HD1 LEU 96 4.807 -2.237 -13.703 801 1HD2 LEU 96 1HD2 LEU 96 6.425 -2.337 -11.721 802 2HD2 LEU 96 2HD2 LEU 96 4.815 -1.847 -11.139 803 3HD2 LEU 96 3HD2 LEU 96 5.718 -3.124 -10.289 804 H GLY 97 H GLY 97 0.214 -5.522 -11.843 805 1HA GLY 97 1HA GLY 97 -0.744 -7.600 -11.194 806 2HA GLY 97 2HA GLY 97 0.787 -8.079 -10.489 807 H ALA 98 H ALA 98 -0.369 -4.748 -10.087 808 HA ALA 98 HA ALA 98 -0.384 -5.106 -7.243 809 1HB ALA 98 1HB ALA 98 0.451 -3.030 -7.728 810 2HB ALA 98 2HB ALA 98 -0.513 -2.870 -9.216 811 3HB ALA 98 3HB ALA 98 -1.268 -2.578 -7.631 812 H LEU 99 H LEU 99 -2.256 -4.428 -5.872 813 HA LEU 99 HA LEU 99 -4.548 -5.843 -6.590 814 1HB LEU 99 1HB LEU 99 -3.970 -3.809 -4.443 815 2HB LEU 99 2HB LEU 99 -5.523 -4.607 -4.593 816 HG LEU 99 HG LEU 99 -4.094 -5.657 -2.899 817 1HD1 LEU 99 1HD1 LEU 99 -4.389 -7.587 -5.202 818 2HD1 LEU 99 2HD1 LEU 99 -4.549 -7.897 -3.456 819 3HD1 LEU 99 3HD1 LEU 99 -5.785 -6.940 -4.307 820 1HD2 LEU 99 1HD2 LEU 99 -1.903 -5.199 -3.794 821 2HD2 LEU 99 2HD2 LEU 99 -2.099 -6.957 -3.592 822 3HD2 LEU 99 3HD2 LEU 99 -2.222 -6.228 -5.211 823 H THR 100 H THR 100 -3.841 -2.290 -6.559 824 HA THR 100 HA THR 100 -5.485 -1.856 -8.822 825 HB THR 100 HB THR 100 -7.262 -2.247 -7.080 826 HG1 THR 100 HG1 THR 100 -8.240 -0.592 -8.181 827 1HG2 THR 100 1HG2 THR 100 -7.073 0.294 -5.744 828 2HG2 THR 100 2HG2 THR 100 -7.054 -1.323 -5.002 829 3HG2 THR 100 3HG2 THR 100 -5.527 -0.550 -5.490 830 H HIS 101 H HIS 101 -6.145 0.912 -8.110 831 HA HIS 101 HA HIS 101 -3.534 2.025 -7.523 832 1HB HIS 101 1HB HIS 101 -3.447 3.362 -9.523 833 2HB HIS 101 2HB HIS 101 -3.536 1.667 -9.956 834 HD1 HIS 101 HD1 HIS 101 -5.719 0.822 -11.129 835 HD2 HIS 101 HD2 HIS 101 -5.684 4.928 -10.271 836 HE1 HIS 101 HE1 HIS 101 -7.654 1.843 -12.442 837 H PHE 102 H PHE 102 -3.788 3.676 -6.104 838 HA PHE 102 HA PHE 102 -6.468 4.847 -5.943 839 1HB PHE 102 1HB PHE 102 -5.747 3.810 -3.863 840 2HB PHE 102 2HB PHE 102 -4.104 4.388 -4.056 841 HD1 PHE 102 HD1 PHE 102 -3.630 6.840 -3.725 842 HD2 PHE 102 HD2 PHE 102 -7.362 5.094 -2.707 843 HE1 PHE 102 HE1 PHE 102 -4.150 8.808 -2.256 844 HE2 PHE 102 HE2 PHE 102 -7.882 7.062 -1.239 845 HZ PHE 102 HZ PHE 102 -6.270 8.895 -1.031 846 H ALA 103 H ALA 103 -6.587 7.197 -5.366 847 HA ALA 103 HA ALA 103 -4.270 8.655 -6.441 848 1HB ALA 103 1HB ALA 103 -6.630 8.378 -7.763 849 2HB ALA 103 2HB ALA 103 -6.992 9.816 -6.777 850 3HB ALA 103 3HB ALA 103 -5.599 9.824 -7.885 851 H LYS 104 H LYS 104 -3.739 10.611 -5.385 852 HA LYS 104 HA LYS 104 -4.030 10.742 -2.709 853 1HB LYS 104 1HB LYS 104 -3.050 12.433 -4.804 854 2HB LYS 104 2HB LYS 104 -3.941 13.428 -3.670 855 1HG LYS 104 1HG LYS 104 -2.554 12.828 -1.841 856 2HG LYS 104 2HG LYS 104 -1.994 11.360 -2.615 857 1HD LYS 104 1HD LYS 104 -0.129 12.597 -3.104 858 2HD LYS 104 2HD LYS 104 -1.099 13.216 -4.426 859 1HE LYS 104 1HE LYS 104 -1.365 15.283 -3.447 860 2HE LYS 104 2HE LYS 104 -1.553 14.615 -1.838 861 1HZ LYS 104 1HZ LYS 104 0.475 15.633 -1.750 862 2HZ LYS 104 2HZ LYS 104 0.927 14.099 -2.083 863 3HZ LYS 104 3HZ LYS 104 0.910 15.221 -3.269 864 HA PRO 105 HA PRO 105 -7.917 13.370 -3.113 865 1HB PRO 105 1HB PRO 105 -8.985 13.950 -5.560 866 2HB PRO 105 2HB PRO 105 -7.891 15.025 -4.713 867 1HG PRO 105 1HG PRO 105 -7.348 13.289 -7.043 868 2HG PRO 105 2HG PRO 105 -6.425 14.658 -6.455 869 1HD PRO 105 1HD PRO 105 -5.781 11.883 -6.119 870 2HD PRO 105 2HD PRO 105 -4.923 13.249 -5.434 871 H PHE 106 H PHE 106 -8.365 11.216 -2.203 872 HA PHE 106 HA PHE 106 -10.479 10.021 -3.849 873 1HB PHE 106 1HB PHE 106 -7.992 8.943 -2.597 874 2HB PHE 106 2HB PHE 106 -9.415 8.028 -2.140 875 HD1 PHE 106 HD1 PHE 106 -9.156 6.022 -3.304 876 HD2 PHE 106 HD2 PHE 106 -8.713 9.690 -5.393 877 HE1 PHE 106 HE1 PHE 106 -9.049 4.772 -5.478 878 HE2 PHE 106 HE2 PHE 106 -8.606 8.439 -7.566 879 HZ PHE 106 HZ PHE 106 -8.775 5.995 -7.583 880 H ASP 107 H ASP 107 -12.060 8.700 -2.501 881 HA ASP 107 HA ASP 107 -12.416 10.091 0.030 882 1HB ASP 107 1HB ASP 107 -14.159 9.877 -2.081 883 2HB ASP 107 2HB ASP 107 -14.641 8.472 -1.151 884 H ILE 108 H ILE 108 -12.891 8.798 1.934 885 HA ILE 108 HA ILE 108 -11.691 6.306 2.054 886 HB ILE 108 HB ILE 108 -13.379 7.987 3.807 887 1HG1 ILE 108 1HG1 ILE 108 -11.523 7.878 5.260 888 2HG1 ILE 108 2HG1 ILE 108 -10.886 6.434 4.498 889 1HG2 ILE 108 1HG2 ILE 108 -14.547 5.911 4.112 890 2HG2 ILE 108 2HG2 ILE 108 -13.017 5.019 4.286 891 3HG2 ILE 108 3HG2 ILE 108 -13.507 6.194 5.529 892 1HD1 ILE 108 1HD1 ILE 108 -9.675 8.580 3.877 893 2HD1 ILE 108 2HD1 ILE 108 -10.285 7.654 2.485 894 3HD1 ILE 108 3HD1 ILE 108 -11.159 9.101 3.042 895 H ASP 109 H ASP 109 -15.075 7.279 1.394 896 HA ASP 109 HA ASP 109 -16.244 4.827 1.716 897 1HB ASP 109 1HB ASP 109 -16.809 7.203 -0.083 898 2HB ASP 109 2HB ASP 109 -17.801 5.765 -0.217 899 H GLU 110 H GLU 110 -14.373 6.274 -0.988 900 HA GLU 110 HA GLU 110 -15.033 4.250 -2.835 901 1HB GLU 110 1HB GLU 110 -12.541 5.959 -3.024 902 2HB GLU 110 2HB GLU 110 -13.564 5.371 -4.319 903 1HG GLU 110 1HG GLU 110 -15.238 6.941 -2.595 904 2HG GLU 110 2HG GLU 110 -13.765 7.859 -2.840 905 H ILE 111 H ILE 111 -12.316 4.864 -0.552 906 HA ILE 111 HA ILE 111 -10.688 2.771 -1.463 907 HB ILE 111 HB ILE 111 -10.856 4.513 0.939 908 1HG1 ILE 111 1HG1 ILE 111 -8.971 3.985 -1.321 909 2HG1 ILE 111 2HG1 ILE 111 -9.589 5.505 -0.706 910 1HG2 ILE 111 1HG2 ILE 111 -9.067 3.325 2.082 911 2HG2 ILE 111 2HG2 ILE 111 -10.501 2.284 1.911 912 3HG2 ILE 111 3HG2 ILE 111 -9.096 2.047 0.844 913 1HD1 ILE 111 1HD1 ILE 111 -7.465 3.730 0.569 914 2HD1 ILE 111 2HD1 ILE 111 -7.265 5.382 -0.063 915 3HD1 ILE 111 3HD1 ILE 111 -8.217 5.104 1.415 916 H ARG 112 H ARG 112 -13.564 2.904 0.593 917 HA ARG 112 HA ARG 112 -13.209 0.583 1.989 918 1HB ARG 112 1HB ARG 112 -15.740 1.908 0.905 919 2HB ARG 112 2HB ARG 112 -15.795 0.534 1.992 920 1HG ARG 112 1HG ARG 112 -13.984 2.301 3.235 921 2HG ARG 112 2HG ARG 112 -15.221 3.359 2.587 922 1HD ARG 112 1HD ARG 112 -16.524 2.811 4.366 923 2HD ARG 112 2HD ARG 112 -16.672 1.198 3.696 924 HE ARG 112 HE ARG 112 -15.283 0.434 5.402 925 1HH1 ARG 112 1HH1 ARG 112 -14.622 3.851 4.878 926 2HH1 ARG 112 2HH1 ARG 112 -13.483 3.961 6.178 927 1HH2 ARG 112 1HH2 ARG 112 -13.780 0.579 7.117 928 2HH2 ARG 112 2HH2 ARG 112 -13.000 2.087 7.460 929 H ASP 113 H ASP 113 -13.967 1.143 -1.412 930 HA ASP 113 HA ASP 113 -15.082 -1.419 -1.847 931 1HB ASP 113 1HB ASP 113 -14.787 1.013 -3.289 932 2HB ASP 113 2HB ASP 113 -13.892 -0.173 -4.218 933 H ALA 114 H ALA 114 -11.905 0.243 -2.386 934 HA ALA 114 HA ALA 114 -10.635 -1.883 -3.685 935 1HB ALA 114 1HB ALA 114 -9.605 0.205 -3.904 936 2HB ALA 114 2HB ALA 114 -9.764 0.579 -2.171 937 3HB ALA 114 3HB ALA 114 -8.555 -0.607 -2.718 938 H VAL 115 H VAL 115 -11.108 -1.042 -0.227 939 HA VAL 115 HA VAL 115 -9.285 -2.756 0.904 940 HB VAL 115 HB VAL 115 -12.036 -1.883 1.799 941 1HG1 VAL 115 1HG1 VAL 115 -10.611 -3.997 2.884 942 2HG1 VAL 115 2HG1 VAL 115 -10.140 -2.620 3.909 943 3HG1 VAL 115 3HG1 VAL 115 -11.859 -3.037 3.714 944 1HG2 VAL 115 1HG2 VAL 115 -11.011 0.088 2.050 945 2HG2 VAL 115 2HG2 VAL 115 -10.065 -0.662 3.358 946 3HG2 VAL 115 3HG2 VAL 115 -9.415 -0.617 1.701 947 H LYS 116 H LYS 116 -12.601 -3.408 -0.349 948 HA LYS 116 HA LYS 116 -12.949 -5.950 0.578 949 1HB LYS 116 1HB LYS 116 -14.491 -4.404 -0.809 950 2HB LYS 116 2HB LYS 116 -13.738 -5.126 -2.216 951 1HG LYS 116 1HG LYS 116 -14.292 -7.425 -1.063 952 2HG LYS 116 2HG LYS 116 -15.385 -6.492 -0.059 953 1HD LYS 116 1HD LYS 116 -16.605 -5.685 -2.039 954 2HD LYS 116 2HD LYS 116 -15.443 -6.440 -3.112 955 1HE LYS 116 1HE LYS 116 -16.093 -8.670 -1.841 956 2HE LYS 116 2HE LYS 116 -17.510 -7.772 -1.334 957 1HZ LYS 116 1HZ LYS 116 -16.670 -8.133 -4.127 958 2HZ LYS 116 2HZ LYS 116 -17.868 -8.962 -3.390 959 3HZ LYS 116 3HZ LYS 116 -18.016 -7.354 -3.631 960 H LYS 117 H LYS 117 -10.589 -4.749 -1.714 961 HA LYS 117 HA LYS 117 -9.915 -7.524 -2.400 962 1HB LYS 117 1HB LYS 117 -9.533 -4.931 -3.909 963 2HB LYS 117 2HB LYS 117 -8.651 -6.389 -4.317 964 1HG LYS 117 1HG LYS 117 -10.439 -7.038 -5.552 965 2HG LYS 117 2HG LYS 117 -11.319 -7.266 -4.054 966 1HD LYS 117 1HD LYS 117 -12.747 -5.673 -4.840 967 2HD LYS 117 2HD LYS 117 -11.509 -4.518 -4.389 968 1HE LYS 117 1HE LYS 117 -11.942 -3.991 -6.660 969 2HE LYS 117 2HE LYS 117 -10.481 -4.956 -6.745 970 1HZ LYS 117 1HZ LYS 117 -12.824 -5.470 -8.011 971 2HZ LYS 117 2HZ LYS 117 -11.556 -6.490 -7.882 972 3HZ LYS 117 3HZ LYS 117 -12.787 -6.579 -6.813 973 H TYR 118 H TYR 118 -8.847 -4.439 -0.997 974 HA TYR 118 HA TYR 118 -6.099 -5.122 -0.881 975 1HB TYR 118 1HB TYR 118 -6.209 -2.874 -0.309 976 2HB TYR 118 2HB TYR 118 -7.957 -2.988 -0.263 977 HD1 TYR 118 HD1 TYR 118 -5.246 -1.963 1.584 978 HD2 TYR 118 HD2 TYR 118 -8.781 -4.332 2.019 979 HE1 TYR 118 HE1 TYR 118 -5.211 -1.566 4.095 980 HE2 TYR 118 HE2 TYR 118 -8.734 -3.928 4.528 981 HH TYR 118 HH TYR 118 -7.261 -3.338 6.227 982 H LEU 119 H LEU 119 -8.936 -5.972 1.021 983 HA LEU 119 HA LEU 119 -7.740 -7.974 2.412 984 1HB LEU 119 1HB LEU 119 -6.794 -5.515 3.397 985 2HB LEU 119 2HB LEU 119 -7.946 -6.090 4.586 986 HG LEU 119 HG LEU 119 -5.326 -6.751 4.555 987 1HD1 LEU 119 1HD1 LEU 119 -6.082 -7.501 6.502 988 2HD1 LEU 119 2HD1 LEU 119 -7.730 -7.690 5.857 989 3HD1 LEU 119 3HD1 LEU 119 -6.549 -9.009 5.680 990 1HD2 LEU 119 1HD2 LEU 119 -5.815 -8.005 2.351 991 2HD2 LEU 119 2HD2 LEU 119 -4.853 -8.822 3.606 992 3HD2 LEU 119 3HD2 LEU 119 -6.572 -9.233 3.393 993 HA PRO 120 HA PRO 120 -11.943 -8.350 3.330 994 1HB PRO 120 1HB PRO 120 -11.898 -10.478 5.045 995 2HB PRO 120 2HB PRO 120 -11.812 -10.649 3.303 996 1HG PRO 120 1HG PRO 120 -9.652 -10.926 5.302 997 2HG PRO 120 2HG PRO 120 -9.694 -11.496 3.646 998 1HD PRO 120 1HD PRO 120 -8.285 -9.202 4.636 999 2HD PRO 120 2HD PRO 120 -8.423 -9.706 2.963 1000 H LEU 121 H LEU 121 -11.214 -6.119 4.449 1001 HA LEU 121 HA LEU 121 -11.698 -6.413 7.302 1002 1HB LEU 121 1HB LEU 121 -9.848 -5.052 6.780 1003 2HB LEU 121 2HB LEU 121 -10.726 -4.174 5.543 1004 HG LEU 121 HG LEU 121 -12.194 -3.227 7.364 1005 1HD1 LEU 121 1HD1 LEU 121 -10.126 -3.887 9.397 1006 2HD1 LEU 121 2HD1 LEU 121 -11.875 -3.613 9.576 1007 3HD1 LEU 121 3HD1 LEU 121 -11.277 -5.171 8.956 1008 1HD2 LEU 121 1HD2 LEU 121 -10.195 -2.085 6.297 1009 2HD2 LEU 121 2HD2 LEU 121 -10.700 -1.476 7.891 1010 3HD2 LEU 121 3HD2 LEU 121 -9.278 -2.538 7.753 1011 H LYS 122 H LYS 122 -13.238 -4.732 8.308 1012 HA LYS 122 HA LYS 122 -15.784 -5.230 7.564 1013 1HB LYS 122 1HB LYS 122 -15.068 -4.200 9.690 1014 2HB LYS 122 2HB LYS 122 -14.739 -2.694 8.859 1015 1HG LYS 122 1HG LYS 122 -17.440 -3.725 8.262 1016 2HG LYS 122 2HG LYS 122 -17.197 -3.465 9.978 1017 1HD LYS 122 1HD LYS 122 -16.999 -1.171 9.753 1018 2HD LYS 122 2HD LYS 122 -16.180 -1.282 8.207 1019 1HE LYS 122 1HE LYS 122 -18.138 -0.758 7.187 1020 2HE LYS 122 2HE LYS 122 -18.783 -2.300 7.716 1021 1HZ LYS 122 1HZ LYS 122 -20.135 -1.164 9.003 1022 2HZ LYS 122 2HZ LYS 122 -18.874 -0.630 9.892 1023 3HZ LYS 122 3HZ LYS 122 -19.422 0.259 8.637 1024 H SER 123 H SER 123 -16.391 -5.169 5.423 1025 HA SER 123 HA SER 123 -15.695 -2.860 3.882 1026 1HB SER 123 1HB SER 123 -15.602 -5.010 2.767 1027 2HB SER 123 2HB SER 123 -17.235 -5.411 3.260 1028 HG SER 123 HG SER 123 -16.385 -4.006 1.053 1029 H ASN 124 H ASN 124 -17.231 -1.354 2.967 1030 HA ASN 124 HA ASN 124 -19.123 -0.423 4.599 1031 1HB ASN 124 1HB ASN 124 -18.368 0.804 2.600 1032 2HB ASN 124 2HB ASN 124 -19.077 -0.396 1.538 1033 1HD2 ASN 124 1HD2 ASN 124 -20.376 1.063 0.496 1034 2HD2 ASN 124 2HD2 ASN 124 -21.778 1.790 1.206 Start of MODEL 19 1 1H MET 1 1H MET 1 -4.134 -15.595 17.424 2 HA MET 1 HA MET 1 -5.900 -17.299 17.504 3 1HB MET 1 1HB MET 1 -7.199 -14.909 18.847 4 2HB MET 1 2HB MET 1 -8.224 -15.965 17.896 5 1HG MET 1 1HG MET 1 -7.416 -17.934 19.240 6 2HG MET 1 2HG MET 1 -6.430 -16.856 20.208 7 1HE MET 1 1HE MET 1 -8.138 -17.350 22.821 8 2HE MET 1 2HE MET 1 -9.498 -18.274 22.140 9 3HE MET 1 3HE MET 1 -7.842 -18.569 21.558 10 H MET 2 H MET 2 -6.463 -13.776 16.780 11 HA MET 2 HA MET 2 -6.286 -14.355 13.996 12 1HB MET 2 1HB MET 2 -8.737 -14.851 14.796 13 2HB MET 2 2HB MET 2 -8.885 -13.122 15.038 14 1HG MET 2 1HG MET 2 -7.783 -13.300 12.464 15 2HG MET 2 2HG MET 2 -8.878 -14.667 12.516 16 1HE MET 2 1HE MET 2 -9.842 -13.728 10.671 17 2HE MET 2 2HE MET 2 -11.524 -13.708 11.255 18 3HE MET 2 3HE MET 2 -10.815 -12.244 10.532 19 H ASN 3 H ASN 3 -5.993 -12.425 12.711 20 HA ASN 3 HA ASN 3 -6.434 -9.886 13.678 21 1HB ASN 3 1HB ASN 3 -4.130 -11.076 14.869 22 2HB ASN 3 2HB ASN 3 -3.499 -9.996 13.641 23 1HD2 ASN 3 1HD2 ASN 3 -2.833 -9.316 16.043 24 2HD2 ASN 3 2HD2 ASN 3 -3.735 -7.982 16.679 25 H GLU 4 H GLU 4 -4.523 -8.361 12.365 26 HA GLU 4 HA GLU 4 -4.063 -9.659 9.816 27 1HB GLU 4 1HB GLU 4 -6.086 -7.634 10.306 28 2HB GLU 4 2HB GLU 4 -4.874 -6.987 9.219 29 1HG GLU 4 1HG GLU 4 -5.338 -8.532 7.539 30 2HG GLU 4 2HG GLU 4 -5.805 -9.789 8.668 31 H LYS 5 H LYS 5 -2.923 -7.658 8.353 32 HA LYS 5 HA LYS 5 -1.127 -6.152 10.040 33 1HB LYS 5 1HB LYS 5 -0.231 -8.517 8.404 34 2HB LYS 5 2HB LYS 5 0.845 -7.160 8.667 35 1HG LYS 5 1HG LYS 5 1.393 -8.148 10.641 36 2HG LYS 5 2HG LYS 5 -0.169 -7.611 11.226 37 1HD LYS 5 1HD LYS 5 -0.170 -9.944 11.673 38 2HD LYS 5 2HD LYS 5 -1.133 -9.798 10.217 39 1HE LYS 5 1HE LYS 5 1.069 -10.221 8.903 40 2HE LYS 5 2HE LYS 5 1.772 -10.692 10.437 41 1HZ LYS 5 1HZ LYS 5 0.161 -12.205 8.782 42 2HZ LYS 5 2HZ LYS 5 0.807 -12.640 10.217 43 3HZ LYS 5 3HZ LYS 5 -0.681 -11.969 10.161 44 H ILE 6 H ILE 6 0.049 -4.504 8.815 45 HA ILE 6 HA ILE 6 -0.476 -4.240 6.027 46 HB ILE 6 HB ILE 6 -2.240 -2.928 7.983 47 1HG1 ILE 6 1HG1 ILE 6 -3.067 -2.822 5.220 48 2HG1 ILE 6 2HG1 ILE 6 -2.446 -4.419 5.585 49 1HG2 ILE 6 1HG2 ILE 6 -2.493 -0.890 6.579 50 2HG2 ILE 6 2HG2 ILE 6 -0.935 -0.985 7.435 51 3HG2 ILE 6 3HG2 ILE 6 -1.020 -1.360 5.697 52 1HD1 ILE 6 1HD1 ILE 6 -3.999 -4.743 7.383 53 2HD1 ILE 6 2HD1 ILE 6 -4.416 -3.013 7.431 54 3HD1 ILE 6 3HD1 ILE 6 -4.947 -4.019 6.062 55 H LEU 7 H LEU 7 0.749 -2.462 5.092 56 HA LEU 7 HA LEU 7 2.590 -1.205 6.992 57 1HB LEU 7 1HB LEU 7 3.265 -3.316 5.287 58 2HB LEU 7 2HB LEU 7 3.867 -1.881 4.480 59 HG LEU 7 HG LEU 7 4.830 -1.356 6.914 60 1HD1 LEU 7 1HD1 LEU 7 4.693 -4.383 6.861 61 2HD1 LEU 7 2HD1 LEU 7 5.608 -3.396 8.025 62 3HD1 LEU 7 3HD1 LEU 7 3.831 -3.306 7.986 63 1HD2 LEU 7 1HD2 LEU 7 6.457 -3.383 5.498 64 2HD2 LEU 7 2HD2 LEU 7 5.896 -2.007 4.519 65 3HD2 LEU 7 3HD2 LEU 7 6.854 -1.719 5.991 66 H ILE 8 H ILE 8 3.272 0.898 6.414 67 HA ILE 8 HA ILE 8 1.862 1.980 4.073 68 HB ILE 8 HB ILE 8 2.272 3.165 6.814 69 1HG1 ILE 8 1HG1 ILE 8 -0.323 2.930 5.304 70 2HG1 ILE 8 2HG1 ILE 8 0.313 1.560 6.193 71 1HG2 ILE 8 1HG2 ILE 8 2.745 4.734 4.815 72 2HG2 ILE 8 2HG2 ILE 8 0.991 4.646 4.529 73 3HG2 ILE 8 3HG2 ILE 8 1.610 5.269 6.077 74 1HD1 ILE 8 1HD1 ILE 8 -0.945 2.565 7.869 75 2HD1 ILE 8 2HD1 ILE 8 0.611 3.386 8.137 76 3HD1 ILE 8 3HD1 ILE 8 -0.682 4.205 7.228 77 H VAL 9 H VAL 9 3.148 2.855 2.536 78 HA VAL 9 HA VAL 9 5.864 3.601 3.377 79 HB VAL 9 HB VAL 9 5.106 2.455 0.692 80 1HG1 VAL 9 1HG1 VAL 9 7.836 2.132 1.775 81 2HG1 VAL 9 2HG1 VAL 9 7.291 2.607 0.148 82 3HG1 VAL 9 3HG1 VAL 9 7.351 3.814 1.454 83 1HG2 VAL 9 1HG2 VAL 9 5.851 0.287 1.406 84 2HG2 VAL 9 2HG2 VAL 9 6.327 0.914 3.002 85 3HG2 VAL 9 3HG2 VAL 9 4.607 0.840 2.551 86 H ASP 10 H ASP 10 6.412 5.685 2.960 87 HA ASP 10 HA ASP 10 6.131 7.773 2.401 88 1HB ASP 10 1HB ASP 10 6.277 6.193 -0.020 89 2HB ASP 10 2HB ASP 10 5.213 7.552 -0.325 90 H ASP 11 H ASP 11 4.451 9.242 0.696 91 HA ASP 11 HA ASP 11 2.453 10.044 0.434 92 1HB ASP 11 1HB ASP 11 1.988 7.605 -0.346 93 2HB ASP 11 2HB ASP 11 1.254 7.358 1.226 94 H GLN 12 H GLN 12 3.803 9.246 3.250 95 HA GLN 12 HA GLN 12 1.552 9.259 4.985 96 1HB GLN 12 1HB GLN 12 3.442 9.573 6.748 97 2HB GLN 12 2HB GLN 12 3.391 8.069 5.850 98 1HG GLN 12 1HG GLN 12 5.320 8.541 4.666 99 2HG GLN 12 2HG GLN 12 4.969 10.255 4.563 100 1HE2 GLN 12 1HE2 GLN 12 4.886 11.345 6.824 101 2HE2 GLN 12 2HE2 GLN 12 6.237 11.034 7.862 102 H TYR 13 H TYR 13 0.328 11.124 4.992 103 HA TYR 13 HA TYR 13 1.776 13.588 5.644 104 1HB TYR 13 1HB TYR 13 0.610 12.907 3.158 105 2HB TYR 13 2HB TYR 13 -0.691 13.773 3.952 106 HD1 TYR 13 HD1 TYR 13 -0.751 16.115 3.888 107 HD2 TYR 13 HD2 TYR 13 2.936 14.098 3.083 108 HE1 TYR 13 HE1 TYR 13 0.319 18.322 3.219 109 HE2 TYR 13 HE2 TYR 13 3.993 16.312 2.416 110 HH TYR 13 HH TYR 13 2.649 18.730 1.454 111 H GLY 14 H GLY 14 0.232 11.548 7.243 112 1HA GLY 14 1HA GLY 14 -0.930 12.138 9.211 113 2HA GLY 14 2HA GLY 14 -1.734 13.438 8.354 114 H ILE 15 H ILE 15 -1.799 11.128 6.045 115 HA ILE 15 HA ILE 15 -4.497 10.381 6.730 116 HB ILE 15 HB ILE 15 -2.756 10.025 4.298 117 1HG1 ILE 15 1HG1 ILE 15 -5.166 11.351 3.707 118 2HG1 ILE 15 2HG1 ILE 15 -4.630 12.034 5.229 119 1HG2 ILE 15 1HG2 ILE 15 -5.272 9.341 3.469 120 2HG2 ILE 15 2HG2 ILE 15 -3.960 8.194 3.835 121 3HG2 ILE 15 3HG2 ILE 15 -5.189 8.564 5.068 122 1HD1 ILE 15 1HD1 ILE 15 -3.373 12.194 2.531 123 2HD1 ILE 15 2HD1 ILE 15 -3.342 13.363 3.873 124 3HD1 ILE 15 3HD1 ILE 15 -2.244 11.962 3.887 125 H ARG 16 H ARG 16 -1.249 8.887 6.423 126 HA ARG 16 HA ARG 16 -1.890 6.289 6.434 127 1HB ARG 16 1HB ARG 16 0.266 6.013 7.868 128 2HB ARG 16 2HB ARG 16 0.426 6.854 6.339 129 1HG ARG 16 1HG ARG 16 0.392 9.031 7.440 130 2HG ARG 16 2HG ARG 16 -0.058 8.313 8.974 131 1HD ARG 16 1HD ARG 16 2.482 7.334 7.674 132 2HD ARG 16 2HD ARG 16 2.504 8.934 8.387 133 HE ARG 16 HE ARG 16 1.322 6.935 10.162 134 1HH1 ARG 16 1HH1 ARG 16 4.350 8.358 9.070 135 2HH1 ARG 16 2HH1 ARG 16 5.217 7.931 10.508 136 1HH2 ARG 16 1HH2 ARG 16 2.465 6.372 12.059 137 2HH2 ARG 16 2HH2 ARG 16 4.137 6.794 12.219 138 H ILE 17 H ILE 17 -1.899 8.582 9.210 139 HA ILE 17 HA ILE 17 -2.366 6.598 11.172 140 HB ILE 17 HB ILE 17 -2.761 9.590 11.156 141 1HG1 ILE 17 1HG1 ILE 17 -0.591 8.152 12.641 142 2HG1 ILE 17 2HG1 ILE 17 -0.419 8.375 10.911 143 1HG2 ILE 17 1HG2 ILE 17 -3.811 9.437 13.101 144 2HG2 ILE 17 2HG2 ILE 17 -3.728 7.661 13.028 145 3HG2 ILE 17 3HG2 ILE 17 -2.409 8.583 13.790 146 1HD1 ILE 17 1HD1 ILE 17 -0.559 10.775 11.097 147 2HD1 ILE 17 2HD1 ILE 17 -1.119 10.674 12.784 148 3HD1 ILE 17 3HD1 ILE 17 0.558 10.237 12.375 149 H LEU 18 H LEU 18 -4.492 8.907 9.364 150 HA LEU 18 HA LEU 18 -6.866 8.425 10.537 151 1HB LEU 18 1HB LEU 18 -6.185 9.891 8.523 152 2HB LEU 18 2HB LEU 18 -6.608 8.500 7.544 153 HG LEU 18 HG LEU 18 -8.844 8.719 9.093 154 1HD1 LEU 18 1HD1 LEU 18 -8.706 11.547 8.426 155 2HD1 LEU 18 2HD1 LEU 18 -9.219 10.746 9.931 156 3HD1 LEU 18 3HD1 LEU 18 -7.495 11.087 9.647 157 1HD2 LEU 18 1HD2 LEU 18 -9.250 10.413 6.846 158 2HD2 LEU 18 2HD2 LEU 18 -8.085 9.153 6.375 159 3HD2 LEU 18 3HD2 LEU 18 -9.672 8.694 7.039 160 H LEU 19 H LEU 19 -5.385 6.411 7.903 161 HA LEU 19 HA LEU 19 -7.453 4.460 8.131 162 1HB LEU 19 1HB LEU 19 -6.216 3.256 6.469 163 2HB LEU 19 2HB LEU 19 -6.332 4.947 6.025 164 HG LEU 19 HG LEU 19 -3.972 5.197 7.027 165 1HD1 LEU 19 1HD1 LEU 19 -4.425 2.354 7.436 166 2HD1 LEU 19 2HD1 LEU 19 -2.957 2.666 6.480 167 3HD1 LEU 19 3HD1 LEU 19 -3.153 3.418 8.081 168 1HD2 LEU 19 1HD2 LEU 19 -2.994 4.840 4.944 169 2HD2 LEU 19 2HD2 LEU 19 -4.043 3.450 4.576 170 3HD2 LEU 19 3HD2 LEU 19 -4.712 5.100 4.558 171 H ASN 20 H ASN 20 -4.399 5.143 9.723 172 HA ASN 20 HA ASN 20 -3.729 2.588 10.496 173 1HB ASN 20 1HB ASN 20 -2.316 4.682 10.771 174 2HB ASN 20 2HB ASN 20 -3.364 5.184 12.084 175 1HD2 ASN 20 1HD2 ASN 20 -1.039 5.110 12.967 176 2HD2 ASN 20 2HD2 ASN 20 -0.584 3.673 13.821 177 H GLU 21 H GLU 21 -5.417 5.216 12.394 178 HA GLU 21 HA GLU 21 -6.101 3.620 14.521 179 1HB GLU 21 1HB GLU 21 -6.209 6.024 14.710 180 2HB GLU 21 2HB GLU 21 -7.357 6.150 13.391 181 1HG GLU 21 1HG GLU 21 -9.065 4.935 14.737 182 2HG GLU 21 2HG GLU 21 -7.917 4.747 16.048 183 H VAL 22 H VAL 22 -7.510 3.913 11.300 184 HA VAL 22 HA VAL 22 -10.071 2.927 11.917 185 HB VAL 22 HB VAL 22 -8.386 3.212 9.455 186 1HG1 VAL 22 1HG1 VAL 22 -9.444 1.210 8.862 187 2HG1 VAL 22 2HG1 VAL 22 -10.946 1.635 9.716 188 3HG1 VAL 22 3HG1 VAL 22 -10.521 2.461 8.198 189 1HG2 VAL 22 1HG2 VAL 22 -11.135 4.312 10.107 190 2HG2 VAL 22 2HG2 VAL 22 -9.615 5.146 10.511 191 3HG2 VAL 22 3HG2 VAL 22 -10.030 4.826 8.810 192 H PHE 23 H PHE 23 -6.988 1.360 10.856 193 HA PHE 23 HA PHE 23 -8.231 -1.237 11.047 194 1HB PHE 23 1HB PHE 23 -5.514 -0.033 10.327 195 2HB PHE 23 2HB PHE 23 -5.641 -1.763 10.575 196 HD1 PHE 23 HD1 PHE 23 -7.647 -2.895 9.221 197 HD2 PHE 23 HD2 PHE 23 -5.767 0.764 8.180 198 HE1 PHE 23 HE1 PHE 23 -8.410 -3.178 6.847 199 HE2 PHE 23 HE2 PHE 23 -6.530 0.481 5.806 200 HZ PHE 23 HZ PHE 23 -7.842 -1.487 5.167 201 H ASN 24 H ASN 24 -5.872 0.811 12.829 202 HA ASN 24 HA ASN 24 -4.750 -0.961 14.474 203 1HB ASN 24 1HB ASN 24 -4.710 1.713 14.376 204 2HB ASN 24 2HB ASN 24 -5.885 1.589 15.670 205 1HD2 ASN 24 1HD2 ASN 24 -5.151 1.510 17.647 206 2HD2 ASN 24 2HD2 ASN 24 -3.571 1.024 18.163 207 H LYS 25 H LYS 25 -8.108 0.246 14.455 208 HA LYS 25 HA LYS 25 -8.926 -0.374 17.000 209 1HB LYS 25 1HB LYS 25 -10.292 -0.251 14.327 210 2HB LYS 25 2HB LYS 25 -11.180 -0.836 15.719 211 1HG LYS 25 1HG LYS 25 -10.764 1.234 16.951 212 2HG LYS 25 2HG LYS 25 -9.642 1.800 15.730 213 1HD LYS 25 1HD LYS 25 -11.350 2.756 14.591 214 2HD LYS 25 2HD LYS 25 -12.091 1.183 14.369 215 1HE LYS 25 1HE LYS 25 -13.231 1.383 16.573 216 2HE LYS 25 2HE LYS 25 -12.451 2.927 16.854 217 1HZ LYS 25 1HZ LYS 25 -14.215 2.383 14.569 218 2HZ LYS 25 2HZ LYS 25 -14.700 3.106 15.951 219 3HZ LYS 25 3HZ LYS 25 -13.593 3.832 14.994 220 H GLU 26 H GLU 26 -7.839 -2.485 14.448 221 HA GLU 26 HA GLU 26 -9.175 -4.751 15.618 222 1HB GLU 26 1HB GLU 26 -7.561 -4.250 13.122 223 2HB GLU 26 2HB GLU 26 -7.671 -5.894 13.719 224 1HG GLU 26 1HG GLU 26 -10.293 -5.257 13.893 225 2HG GLU 26 2HG GLU 26 -9.847 -4.113 12.642 226 H GLY 27 H GLY 27 -6.143 -3.030 15.793 227 1HA GLY 27 1HA GLY 27 -4.551 -3.366 17.430 228 2HA GLY 27 2HA GLY 27 -5.141 -4.994 17.701 229 H TYR 28 H TYR 28 -4.824 -4.215 14.336 230 HA TYR 28 HA TYR 28 -2.833 -6.176 13.963 231 1HB TYR 28 1HB TYR 28 -3.214 -5.565 11.645 232 2HB TYR 28 2HB TYR 28 -4.743 -5.209 12.424 233 HD1 TYR 28 HD1 TYR 28 -3.844 -2.622 13.828 234 HD2 TYR 28 HD2 TYR 28 -3.373 -4.040 9.820 235 HE1 TYR 28 HE1 TYR 28 -3.710 -0.226 12.989 236 HE2 TYR 28 HE2 TYR 28 -3.240 -1.640 8.993 237 HH TYR 28 HH TYR 28 -2.559 0.868 10.847 238 H GLN 29 H GLN 29 -0.653 -5.951 13.193 239 HA GLN 29 HA GLN 29 0.600 -3.630 14.317 240 1HB GLN 29 1HB GLN 29 1.313 -6.359 13.927 241 2HB GLN 29 2HB GLN 29 2.428 -5.432 12.943 242 1HG GLN 29 1HG GLN 29 3.238 -4.182 14.811 243 2HG GLN 29 2HG GLN 29 1.852 -4.589 15.803 244 1HE2 GLN 29 1HE2 GLN 29 4.671 -4.900 16.364 245 2HE2 GLN 29 2HE2 GLN 29 4.968 -6.577 16.684 246 H THR 30 H THR 30 1.583 -1.958 13.176 247 HA THR 30 HA THR 30 1.567 -2.218 10.242 248 HB THR 30 HB THR 30 0.890 0.225 10.245 249 HG1 THR 30 HG1 THR 30 1.657 0.676 12.420 250 1HG2 THR 30 1HG2 THR 30 -0.783 -2.024 11.009 251 2HG2 THR 30 2HG2 THR 30 -1.301 -0.583 11.917 252 3HG2 THR 30 3HG2 THR 30 -1.257 -0.546 10.138 253 H PHE 31 H PHE 31 3.115 -0.779 9.125 254 HA PHE 31 HA PHE 31 5.270 0.187 10.797 255 1HB PHE 31 1HB PHE 31 5.288 -2.418 9.739 256 2HB PHE 31 2HB PHE 31 6.101 -1.519 8.474 257 HD1 PHE 31 HD1 PHE 31 7.924 0.227 9.501 258 HD2 PHE 31 HD2 PHE 31 6.653 -3.398 11.304 259 HE1 PHE 31 HE1 PHE 31 10.067 0.124 10.804 260 HE2 PHE 31 HE2 PHE 31 8.796 -3.501 12.607 261 HZ PHE 31 HZ PHE 31 10.477 -1.739 12.342 262 H GLN 32 H GLN 32 6.658 1.696 9.699 263 HA GLN 32 HA GLN 32 5.540 2.516 7.132 264 1HB GLN 32 1HB GLN 32 5.116 4.389 8.404 265 2HB GLN 32 2HB GLN 32 6.392 4.038 9.553 266 1HG GLN 32 1HG GLN 32 8.077 4.990 8.179 267 2HG GLN 32 2HG GLN 32 7.120 4.832 6.720 268 1HE2 GLN 32 1HE2 GLN 32 7.927 6.759 9.426 269 2HE2 GLN 32 2HE2 GLN 32 6.923 8.132 9.103 270 H ALA 33 H ALA 33 6.991 3.078 5.424 271 HA ALA 33 HA ALA 33 9.831 2.715 5.975 272 1HB ALA 33 1HB ALA 33 10.123 1.024 4.356 273 2HB ALA 33 2HB ALA 33 8.654 0.523 5.229 274 3HB ALA 33 3HB ALA 33 8.520 1.308 3.637 275 H ALA 34 H ALA 34 10.996 4.305 4.999 276 HA ALA 34 HA ALA 34 9.562 5.966 3.074 277 1HB ALA 34 1HB ALA 34 11.151 6.519 5.310 278 2HB ALA 34 2HB ALA 34 12.211 6.874 3.925 279 3HB ALA 34 3HB ALA 34 10.632 7.683 4.068 280 H ASN 35 H ASN 35 10.789 3.205 2.556 281 HA ASN 35 HA ASN 35 12.046 3.993 0.132 282 1HB ASN 35 1HB ASN 35 13.838 2.008 1.210 283 2HB ASN 35 2HB ASN 35 14.223 3.648 0.727 284 1HD2 ASN 35 1HD2 ASN 35 15.473 4.403 2.277 285 2HD2 ASN 35 2HD2 ASN 35 15.106 4.455 3.969 286 H GLY 36 H GLY 36 12.174 2.102 -1.364 287 1HA GLY 36 1HA GLY 36 10.113 0.206 -0.957 288 2HA GLY 36 2HA GLY 36 11.282 0.241 -2.262 289 H LEU 37 H LEU 37 13.736 -0.128 -1.141 290 HA LEU 37 HA LEU 37 13.890 -2.814 -0.698 291 1HB LEU 37 1HB LEU 37 15.629 -0.621 -0.826 292 2HB LEU 37 2HB LEU 37 15.980 -1.390 0.709 293 HG LEU 37 HG LEU 37 15.783 -3.135 -1.712 294 1HD1 LEU 37 1HD1 LEU 37 17.249 -1.887 -2.851 295 2HD1 LEU 37 2HD1 LEU 37 17.698 -0.926 -1.421 296 3HD1 LEU 37 3HD1 LEU 37 18.450 -2.515 -1.698 297 1HD2 LEU 37 1HD2 LEU 37 17.051 -3.191 0.973 298 2HD2 LEU 37 2HD2 LEU 37 16.270 -4.487 0.037 299 3HD2 LEU 37 3HD2 LEU 37 17.933 -3.987 -0.352 300 H GLN 38 H GLN 38 13.682 -0.158 1.752 301 HA GLN 38 HA GLN 38 13.892 -1.828 3.944 302 1HB GLN 38 1HB GLN 38 13.368 0.955 3.411 303 2HB GLN 38 2HB GLN 38 12.185 0.402 4.579 304 1HG GLN 38 1HG GLN 38 14.479 -0.776 5.570 305 2HG GLN 38 2HG GLN 38 15.140 0.685 4.862 306 1HE2 GLN 38 1HE2 GLN 38 15.113 2.456 6.019 307 2HE2 GLN 38 2HE2 GLN 38 14.125 2.790 7.401 308 H ALA 39 H ALA 39 11.193 -1.078 1.775 309 HA ALA 39 HA ALA 39 9.227 -2.166 3.582 310 1HB ALA 39 1HB ALA 39 9.295 -0.503 1.236 311 2HB ALA 39 2HB ALA 39 8.242 -1.902 0.914 312 3HB ALA 39 3HB ALA 39 7.923 -0.851 2.314 313 H LEU 40 H LEU 40 11.475 -3.282 1.149 314 HA LEU 40 HA LEU 40 10.004 -5.544 0.310 315 1HB LEU 40 1HB LEU 40 12.823 -4.583 0.096 316 2HB LEU 40 2HB LEU 40 12.483 -6.266 -0.256 317 HG LEU 40 HG LEU 40 11.393 -3.823 -1.666 318 1HD1 LEU 40 1HD1 LEU 40 12.443 -5.769 -3.440 319 2HD1 LEU 40 2HD1 LEU 40 13.085 -4.154 -3.057 320 3HD1 LEU 40 3HD1 LEU 40 13.616 -5.569 -2.117 321 1HD2 LEU 40 1HD2 LEU 40 9.482 -5.061 -1.768 322 2HD2 LEU 40 2HD2 LEU 40 10.352 -5.759 -3.155 323 3HD2 LEU 40 3HD2 LEU 40 10.337 -6.613 -1.593 324 H ASP 41 H ASP 41 12.367 -4.884 2.939 325 HA ASP 41 HA ASP 41 12.517 -7.592 3.690 326 1HB ASP 41 1HB ASP 41 14.208 -5.733 4.191 327 2HB ASP 41 2HB ASP 41 13.087 -5.122 5.391 328 H ILE 42 H ILE 42 10.994 -4.615 5.155 329 HA ILE 42 HA ILE 42 9.679 -5.920 7.220 330 HB ILE 42 HB ILE 42 9.007 -3.364 5.760 331 1HG1 ILE 42 1HG1 ILE 42 11.115 -4.098 7.604 332 2HG1 ILE 42 2HG1 ILE 42 10.887 -2.618 6.694 333 1HG2 ILE 42 1HG2 ILE 42 7.580 -2.760 7.532 334 2HG2 ILE 42 2HG2 ILE 42 7.122 -4.425 7.102 335 3HG2 ILE 42 3HG2 ILE 42 8.119 -4.121 8.545 336 1HD1 ILE 42 1HD1 ILE 42 9.138 -1.936 8.449 337 2HD1 ILE 42 2HD1 ILE 42 9.707 -3.321 9.412 338 3HD1 ILE 42 3HD1 ILE 42 10.825 -1.994 9.016 339 H VAL 43 H VAL 43 9.019 -5.754 3.769 340 HA VAL 43 HA VAL 43 6.312 -6.139 3.687 341 HB VAL 43 HB VAL 43 8.620 -6.548 1.983 342 1HG1 VAL 43 1HG1 VAL 43 6.361 -8.554 1.802 343 2HG1 VAL 43 2HG1 VAL 43 7.371 -8.124 0.401 344 3HG1 VAL 43 3HG1 VAL 43 8.115 -8.854 1.844 345 1HG2 VAL 43 1HG2 VAL 43 5.963 -6.211 0.752 346 2HG2 VAL 43 2HG2 VAL 43 6.353 -5.003 2.001 347 3HG2 VAL 43 3HG2 VAL 43 7.434 -5.220 0.604 348 H THR 44 H THR 44 8.895 -8.687 3.914 349 HA THR 44 HA THR 44 6.863 -10.672 4.494 350 HB THR 44 HB THR 44 9.913 -10.916 4.406 351 HG1 THR 44 HG1 THR 44 9.572 -11.058 2.163 352 1HG2 THR 44 1HG2 THR 44 7.796 -12.803 4.892 353 2HG2 THR 44 2HG2 THR 44 8.384 -13.088 3.236 354 3HG2 THR 44 3HG2 THR 44 9.518 -13.155 4.607 355 H LYS 45 H LYS 45 9.366 -8.770 6.189 356 HA LYS 45 HA LYS 45 9.425 -10.233 8.538 357 1HB LYS 45 1HB LYS 45 10.533 -7.856 7.543 358 2HB LYS 45 2HB LYS 45 9.655 -7.368 8.978 359 1HG LYS 45 1HG LYS 45 10.943 -9.799 9.692 360 2HG LYS 45 2HG LYS 45 12.135 -8.907 8.768 361 1HD LYS 45 1HD LYS 45 10.986 -6.946 10.430 362 2HD LYS 45 2HD LYS 45 11.071 -8.360 11.461 363 1HE LYS 45 1HE LYS 45 13.410 -7.207 9.865 364 2HE LYS 45 2HE LYS 45 13.156 -6.985 11.585 365 1HZ LYS 45 1HZ LYS 45 14.002 -8.969 11.971 366 2HZ LYS 45 2HZ LYS 45 13.045 -9.713 10.876 367 3HZ LYS 45 3HZ LYS 45 14.461 -9.049 10.405 368 H GLU 46 H GLU 46 7.124 -7.743 7.353 369 HA GLU 46 HA GLU 46 5.619 -8.136 9.809 370 1HB GLU 46 1HB GLU 46 6.022 -5.873 7.952 371 2HB GLU 46 2HB GLU 46 4.338 -6.116 8.373 372 1HG GLU 46 1HG GLU 46 5.936 -6.413 10.773 373 2HG GLU 46 2HG GLU 46 6.407 -4.926 9.973 374 H ARG 47 H ARG 47 5.851 -9.305 6.653 375 HA ARG 47 HA ARG 47 4.324 -9.939 5.140 376 1HB ARG 47 1HB ARG 47 3.149 -12.034 6.076 377 2HB ARG 47 2HB ARG 47 4.890 -11.985 6.271 378 1HG ARG 47 1HG ARG 47 4.764 -11.835 8.558 379 2HG ARG 47 2HG ARG 47 3.419 -10.712 8.513 380 1HD ARG 47 1HD ARG 47 2.647 -12.804 9.517 381 2HD ARG 47 2HD ARG 47 1.870 -12.621 7.957 382 HE ARG 47 HE ARG 47 4.389 -14.131 7.856 383 1HH1 ARG 47 1HH1 ARG 47 0.902 -14.325 8.287 384 2HH1 ARG 47 2HH1 ARG 47 0.811 -15.996 7.839 385 1HH2 ARG 47 1HH2 ARG 47 4.269 -16.335 7.265 386 2HH2 ARG 47 2HH2 ARG 47 2.739 -17.147 7.254 387 HA PRO 48 HA PRO 48 0.668 -7.714 6.797 388 1HB PRO 48 1HB PRO 48 0.672 -5.581 5.088 389 2HB PRO 48 2HB PRO 48 1.397 -5.533 6.683 390 1HG PRO 48 1HG PRO 48 2.724 -5.716 4.048 391 2HG PRO 48 2HG PRO 48 3.408 -5.245 5.591 392 1HD PRO 48 1HD PRO 48 3.736 -7.768 4.267 393 2HD PRO 48 2HD PRO 48 4.322 -7.337 5.862 394 H ASP 49 H ASP 49 -1.479 -7.701 6.067 395 HA ASP 49 HA ASP 49 -1.706 -9.376 3.761 396 1HB ASP 49 1HB ASP 49 -4.021 -8.118 5.269 397 2HB ASP 49 2HB ASP 49 -3.996 -9.643 4.406 398 H LEU 50 H LEU 50 -1.311 -6.090 4.283 399 HA LEU 50 HA LEU 50 -2.187 -5.392 1.695 400 1HB LEU 50 1HB LEU 50 -4.320 -5.505 3.229 401 2HB LEU 50 2HB LEU 50 -3.752 -3.946 3.793 402 HG LEU 50 HG LEU 50 -5.424 -3.709 2.033 403 1HD1 LEU 50 1HD1 LEU 50 -3.059 -2.798 0.530 404 2HD1 LEU 50 2HD1 LEU 50 -4.443 -1.883 1.174 405 3HD1 LEU 50 3HD1 LEU 50 -3.090 -2.320 2.244 406 1HD2 LEU 50 1HD2 LEU 50 -3.885 -5.799 0.761 407 2HD2 LEU 50 2HD2 LEU 50 -5.515 -5.192 0.384 408 3HD2 LEU 50 3HD2 LEU 50 -4.085 -4.407 -0.330 409 H VAL 51 H VAL 51 -0.560 -4.085 1.078 410 HA VAL 51 HA VAL 51 0.483 -2.237 3.112 411 HB VAL 51 HB VAL 51 2.222 -3.707 2.858 412 1HG1 VAL 51 1HG1 VAL 51 2.892 -4.767 0.716 413 2HG1 VAL 51 2HG1 VAL 51 1.224 -5.166 1.191 414 3HG1 VAL 51 3HG1 VAL 51 1.522 -3.962 -0.086 415 1HG2 VAL 51 1HG2 VAL 51 2.599 -1.615 0.695 416 2HG2 VAL 51 2HG2 VAL 51 3.105 -1.526 2.399 417 3HG2 VAL 51 3HG2 VAL 51 3.901 -2.671 1.292 418 H LEU 52 H LEU 52 0.829 -0.092 2.475 419 HA LEU 52 HA LEU 52 -0.115 0.517 -0.241 420 1HB LEU 52 1HB LEU 52 -1.794 1.493 0.854 421 2HB LEU 52 2HB LEU 52 -0.938 1.513 2.383 422 HG LEU 52 HG LEU 52 -0.292 3.474 0.179 423 1HD1 LEU 52 1HD1 LEU 52 -2.663 3.387 1.925 424 2HD1 LEU 52 2HD1 LEU 52 -1.783 4.934 1.935 425 3HD1 LEU 52 3HD1 LEU 52 -2.381 4.260 0.400 426 1HD2 LEU 52 1HD2 LEU 52 0.604 3.013 2.930 427 2HD2 LEU 52 2HD2 LEU 52 1.367 3.925 1.605 428 3HD2 LEU 52 3HD2 LEU 52 0.117 4.695 2.612 429 H LEU 53 H LEU 53 1.308 1.553 -1.544 430 HA LEU 53 HA LEU 53 3.458 3.053 -0.252 431 1HB LEU 53 1HB LEU 53 4.355 0.843 -0.666 432 2HB LEU 53 2HB LEU 53 3.825 0.898 -2.336 433 HG LEU 53 HG LEU 53 5.735 2.981 -1.307 434 1HD1 LEU 53 1HD1 LEU 53 6.624 0.761 -0.626 435 2HD1 LEU 53 2HD1 LEU 53 6.589 0.262 -2.334 436 3HD1 LEU 53 3HD1 LEU 53 7.639 1.604 -1.820 437 1HD2 LEU 53 1HD2 LEU 53 5.250 3.621 -3.420 438 2HD2 LEU 53 2HD2 LEU 53 6.508 2.428 -3.823 439 3HD2 LEU 53 3HD2 LEU 53 4.789 1.981 -3.936 440 H ASP 54 H ASP 54 4.230 4.829 -1.484 441 HA ASP 54 HA ASP 54 2.425 5.471 -3.671 442 1HB ASP 54 1HB ASP 54 2.220 7.338 -2.357 443 2HB ASP 54 2HB ASP 54 3.700 6.998 -1.482 444 H MET 55 H MET 55 3.324 5.569 -5.746 445 HA MET 55 HA MET 55 5.849 4.716 -6.266 446 1HB MET 55 1HB MET 55 4.253 6.702 -7.971 447 2HB MET 55 2HB MET 55 5.416 5.531 -8.559 448 1HG MET 55 1HG MET 55 2.642 5.019 -7.430 449 2HG MET 55 2HG MET 55 3.288 4.528 -8.983 450 1HE MET 55 1HE MET 55 3.901 3.494 -4.878 451 2HE MET 55 2HE MET 55 2.388 3.897 -5.726 452 3HE MET 55 3HE MET 55 2.811 2.195 -5.420 453 H LYS 56 H LYS 56 4.665 8.158 -6.406 454 HA LYS 56 HA LYS 56 7.087 9.325 -6.963 455 1HB LYS 56 1HB LYS 56 4.464 10.148 -6.319 456 2HB LYS 56 2HB LYS 56 5.511 10.975 -5.183 457 1HG LYS 56 1HG LYS 56 6.992 11.616 -7.191 458 2HG LYS 56 2HG LYS 56 5.719 11.001 -8.227 459 1HD LYS 56 1HD LYS 56 4.097 12.594 -7.138 460 2HD LYS 56 2HD LYS 56 5.406 13.235 -6.165 461 1HE LYS 56 1HE LYS 56 6.580 13.538 -8.570 462 2HE LYS 56 2HE LYS 56 4.919 13.533 -9.128 463 1HZ LYS 56 1HZ LYS 56 6.247 15.438 -7.394 464 2HZ LYS 56 2HZ LYS 56 5.212 15.705 -8.628 465 3HZ LYS 56 3HZ LYS 56 4.645 15.203 -7.181 466 H ILE 57 H ILE 57 8.965 8.824 -5.935 467 HA ILE 57 HA ILE 57 9.003 9.308 -3.059 468 HB ILE 57 HB ILE 57 9.979 6.805 -4.429 469 1HG1 ILE 57 1HG1 ILE 57 8.107 7.123 -2.069 470 2HG1 ILE 57 2HG1 ILE 57 7.556 6.984 -3.727 471 1HG2 ILE 57 1HG2 ILE 57 10.401 7.365 -1.508 472 2HG2 ILE 57 2HG2 ILE 57 11.218 6.196 -2.573 473 3HG2 ILE 57 3HG2 ILE 57 11.578 7.934 -2.716 474 1HD1 ILE 57 1HD1 ILE 57 9.369 4.872 -3.518 475 2HD1 ILE 57 2HD1 ILE 57 8.590 4.899 -1.918 476 3HD1 ILE 57 3HD1 ILE 57 7.599 4.735 -3.388 477 HA PRO 58 HA PRO 58 12.559 11.464 -4.235 478 1HB PRO 58 1HB PRO 58 13.684 11.907 -1.784 479 2HB PRO 58 2HB PRO 58 12.376 12.878 -2.427 480 1HG PRO 58 1HG PRO 58 12.282 10.798 -0.328 481 2HG PRO 58 2HG PRO 58 11.112 12.054 -0.683 482 1HD PRO 58 1HD PRO 58 10.903 9.274 -1.358 483 2HD PRO 58 2HD PRO 58 9.791 10.549 -1.812 484 H GLY 59 H GLY 59 14.351 10.869 -5.272 485 1HA GLY 59 1HA GLY 59 16.321 9.807 -5.582 486 2HA GLY 59 2HA GLY 59 16.299 9.287 -3.908 487 H MET 60 H MET 60 15.559 8.436 -7.237 488 HA MET 60 HA MET 60 15.178 6.516 -8.191 489 1HB MET 60 1HB MET 60 16.614 5.783 -5.943 490 2HB MET 60 2HB MET 60 15.144 4.866 -5.678 491 1HG MET 60 1HG MET 60 15.525 4.259 -8.299 492 2HG MET 60 2HG MET 60 17.192 4.585 -7.865 493 1HE MET 60 1HE MET 60 14.449 1.751 -5.568 494 2HE MET 60 2HE MET 60 14.032 3.265 -6.406 495 3HE MET 60 3HE MET 60 14.240 1.762 -7.336 496 H ASP 61 H ASP 61 13.004 7.166 -8.695 497 HA ASP 61 HA ASP 61 10.872 7.154 -7.089 498 1HB ASP 61 1HB ASP 61 9.766 6.103 -9.385 499 2HB ASP 61 2HB ASP 61 10.156 7.796 -9.158 500 H GLY 62 H GLY 62 8.912 5.432 -7.329 501 1HA GLY 62 1HA GLY 62 9.982 2.878 -6.428 502 2HA GLY 62 2HA GLY 62 8.328 3.445 -6.320 503 H ILE 63 H ILE 63 9.433 4.193 -9.431 504 HA ILE 63 HA ILE 63 7.703 2.489 -10.715 505 HB ILE 63 HB ILE 63 10.230 3.784 -11.744 506 1HG1 ILE 63 1HG1 ILE 63 7.504 4.896 -12.236 507 2HG1 ILE 63 2HG1 ILE 63 8.182 5.106 -10.634 508 1HG2 ILE 63 1HG2 ILE 63 8.107 3.456 -13.682 509 2HG2 ILE 63 2HG2 ILE 63 9.814 2.959 -13.763 510 3HG2 ILE 63 3HG2 ILE 63 8.609 1.885 -13.013 511 1HD1 ILE 63 1HD1 ILE 63 10.351 5.739 -12.249 512 2HD1 ILE 63 2HD1 ILE 63 8.975 6.362 -13.191 513 3HD1 ILE 63 3HD1 ILE 63 9.237 6.921 -11.522 514 H GLU 64 H GLU 64 11.148 2.033 -9.804 515 HA GLU 64 HA GLU 64 11.160 -0.524 -11.106 516 1HB GLU 64 1HB GLU 64 13.297 0.761 -9.351 517 2HB GLU 64 2HB GLU 64 13.516 -0.623 -10.403 518 1HG GLU 64 1HG GLU 64 12.419 1.887 -11.651 519 2HG GLU 64 2HG GLU 64 14.108 1.901 -11.184 520 H ILE 65 H ILE 65 11.344 0.829 -7.751 521 HA ILE 65 HA ILE 65 11.684 -1.462 -6.334 522 HB ILE 65 HB ILE 65 10.099 1.031 -5.771 523 1HG1 ILE 65 1HG1 ILE 65 12.770 0.034 -4.735 524 2HG1 ILE 65 2HG1 ILE 65 12.560 1.210 -6.017 525 1HG2 ILE 65 1HG2 ILE 65 10.781 -1.052 -3.692 526 2HG2 ILE 65 2HG2 ILE 65 9.759 0.396 -3.524 527 3HG2 ILE 65 3HG2 ILE 65 9.201 -0.978 -4.508 528 1HD1 ILE 65 1HD1 ILE 65 12.285 2.876 -4.509 529 2HD1 ILE 65 2HD1 ILE 65 10.949 1.997 -3.729 530 3HD1 ILE 65 3HD1 ILE 65 12.628 1.702 -3.216 531 H LEU 66 H LEU 66 8.446 -0.014 -7.148 532 HA LEU 66 HA LEU 66 6.970 -2.180 -6.276 533 1HB LEU 66 1HB LEU 66 6.422 -0.080 -8.371 534 2HB LEU 66 2HB LEU 66 5.228 -1.256 -7.859 535 HG LEU 66 HG LEU 66 4.632 0.453 -6.494 536 1HD1 LEU 66 1HD1 LEU 66 5.319 0.079 -4.265 537 2HD1 LEU 66 2HD1 LEU 66 5.464 -1.490 -5.094 538 3HD1 LEU 66 3HD1 LEU 66 6.919 -0.515 -4.773 539 1HD2 LEU 66 1HD2 LEU 66 6.393 1.956 -7.450 540 2HD2 LEU 66 2HD2 LEU 66 6.008 2.253 -5.738 541 3HD2 LEU 66 3HD2 LEU 66 7.496 1.380 -6.177 542 H LYS 67 H LYS 67 8.692 -1.593 -9.352 543 HA LYS 67 HA LYS 67 7.502 -3.680 -10.789 544 1HB LYS 67 1HB LYS 67 9.590 -1.734 -11.148 545 2HB LYS 67 2HB LYS 67 10.173 -3.298 -11.679 546 1HG LYS 67 1HG LYS 67 7.867 -3.511 -12.911 547 2HG LYS 67 2HG LYS 67 7.722 -1.785 -12.649 548 1HD LYS 67 1HD LYS 67 8.867 -1.604 -14.622 549 2HD LYS 67 2HD LYS 67 10.284 -1.912 -13.639 550 1HE LYS 67 1HE LYS 67 10.531 -4.081 -14.412 551 2HE LYS 67 2HE LYS 67 8.804 -4.351 -14.537 552 1HZ LYS 67 1HZ LYS 67 9.140 -4.058 -16.691 553 2HZ LYS 67 2HZ LYS 67 9.265 -2.458 -16.385 554 3HZ LYS 67 3HZ LYS 67 10.611 -3.375 -16.500 555 H ARG 68 H ARG 68 10.788 -3.578 -9.228 556 HA ARG 68 HA ARG 68 11.320 -6.214 -9.546 557 1HB ARG 68 1HB ARG 68 12.239 -4.040 -7.716 558 2HB ARG 68 2HB ARG 68 12.554 -5.660 -7.126 559 1HG ARG 68 1HG ARG 68 13.768 -6.241 -9.178 560 2HG ARG 68 2HG ARG 68 13.313 -4.726 -9.932 561 1HD ARG 68 1HD ARG 68 15.458 -4.184 -9.179 562 2HD ARG 68 2HD ARG 68 14.507 -3.638 -7.812 563 HE ARG 68 HE ARG 68 15.109 -6.378 -7.362 564 1HH1 ARG 68 1HH1 ARG 68 16.815 -3.311 -7.619 565 2HH1 ARG 68 2HH1 ARG 68 18.109 -3.797 -6.575 566 1HH2 ARG 68 1HH2 ARG 68 16.815 -7.019 -5.984 567 2HH2 ARG 68 2HH2 ARG 68 18.108 -5.921 -5.638 568 H MET 69 H MET 69 9.331 -4.558 -7.077 569 HA MET 69 HA MET 69 9.202 -6.513 -5.181 570 1HB MET 69 1HB MET 69 7.839 -4.080 -5.879 571 2HB MET 69 2HB MET 69 6.583 -5.272 -5.612 572 1HG MET 69 1HG MET 69 6.835 -4.916 -3.381 573 2HG MET 69 2HG MET 69 8.388 -5.719 -3.491 574 1HE MET 69 1HE MET 69 7.368 -3.304 -1.486 575 2HE MET 69 2HE MET 69 7.825 -1.668 -2.017 576 3HE MET 69 3HE MET 69 6.495 -2.528 -2.829 577 H LYS 70 H LYS 70 6.871 -5.982 -7.930 578 HA LYS 70 HA LYS 70 5.506 -8.405 -7.417 579 1HB LYS 70 1HB LYS 70 4.120 -7.788 -9.155 580 2HB LYS 70 2HB LYS 70 4.722 -6.233 -8.617 581 1HG LYS 70 1HG LYS 70 4.958 -6.170 -10.988 582 2HG LYS 70 2HG LYS 70 6.578 -6.480 -10.398 583 1HD LYS 70 1HD LYS 70 6.671 -8.471 -11.484 584 2HD LYS 70 2HD LYS 70 5.180 -9.011 -10.739 585 1HE LYS 70 1HE LYS 70 3.827 -8.102 -12.482 586 2HE LYS 70 2HE LYS 70 5.096 -7.028 -13.037 587 1HZ LYS 70 1HZ LYS 70 5.592 -8.608 -14.469 588 2HZ LYS 70 2HZ LYS 70 6.144 -9.531 -13.240 589 3HZ LYS 70 3HZ LYS 70 4.607 -9.702 -13.763 590 H VAL 71 H VAL 71 8.155 -7.397 -9.637 591 HA VAL 71 HA VAL 71 8.249 -9.746 -11.125 592 HB VAL 71 HB VAL 71 10.529 -7.910 -10.368 593 1HG1 VAL 71 1HG1 VAL 71 11.768 -9.173 -11.723 594 2HG1 VAL 71 2HG1 VAL 71 10.376 -10.237 -12.033 595 3HG1 VAL 71 3HG1 VAL 71 10.657 -8.815 -13.066 596 1HG2 VAL 71 1HG2 VAL 71 9.223 -7.426 -12.946 597 2HG2 VAL 71 2HG2 VAL 71 8.147 -7.141 -11.557 598 3HG2 VAL 71 3HG2 VAL 71 9.702 -6.281 -11.670 599 H ILE 72 H ILE 72 9.414 -8.922 -7.868 600 HA ILE 72 HA ILE 72 11.069 -11.254 -7.689 601 HB ILE 72 HB ILE 72 10.276 -9.001 -5.903 602 1HG1 ILE 72 1HG1 ILE 72 12.256 -9.031 -7.534 603 2HG1 ILE 72 2HG1 ILE 72 12.550 -8.495 -5.891 604 1HG2 ILE 72 1HG2 ILE 72 10.890 -11.734 -4.994 605 2HG2 ILE 72 2HG2 ILE 72 11.892 -10.460 -4.260 606 3HG2 ILE 72 3HG2 ILE 72 10.119 -10.377 -4.139 607 1HD1 ILE 72 1HD1 ILE 72 13.889 -10.574 -7.268 608 2HD1 ILE 72 2HD1 ILE 72 14.040 -10.165 -5.542 609 3HD1 ILE 72 3HD1 ILE 72 12.862 -11.392 -6.066 610 H ASP 73 H ASP 73 7.878 -10.183 -6.337 611 HA ASP 73 HA ASP 73 7.274 -13.017 -6.068 612 1HB ASP 73 1HB ASP 73 5.771 -11.542 -4.119 613 2HB ASP 73 2HB ASP 73 6.967 -12.791 -3.836 614 H GLU 74 H GLU 74 5.472 -13.443 -7.351 615 HA GLU 74 HA GLU 74 3.926 -11.232 -8.283 616 1HB GLU 74 1HB GLU 74 3.051 -12.729 -9.888 617 2HB GLU 74 2HB GLU 74 4.687 -13.306 -9.641 618 1HG GLU 74 1HG GLU 74 3.800 -14.980 -7.963 619 2HG GLU 74 2HG GLU 74 2.173 -14.442 -8.328 620 H ASN 75 H ASN 75 3.922 -12.895 -5.429 621 HA ASN 75 HA ASN 75 1.032 -13.086 -5.296 622 1HB ASN 75 1HB ASN 75 2.889 -14.855 -4.408 623 2HB ASN 75 2HB ASN 75 2.823 -13.839 -2.981 624 1HD2 ASN 75 1HD2 ASN 75 1.845 -15.257 -1.646 625 2HD2 ASN 75 2HD2 ASN 75 0.219 -15.829 -1.819 626 H ILE 76 H ILE 76 3.596 -10.931 -4.726 627 HA ILE 76 HA ILE 76 2.961 -9.888 -2.206 628 HB ILE 76 HB ILE 76 5.069 -9.603 -3.566 629 1HG1 ILE 76 1HG1 ILE 76 3.710 -7.295 -2.167 630 2HG1 ILE 76 2HG1 ILE 76 4.869 -8.435 -1.511 631 1HG2 ILE 76 1HG2 ILE 76 3.542 -8.714 -5.560 632 2HG2 ILE 76 2HG2 ILE 76 3.896 -7.151 -4.786 633 3HG2 ILE 76 3HG2 ILE 76 5.229 -8.191 -5.341 634 1HD1 ILE 76 1HD1 ILE 76 5.477 -6.433 -3.736 635 2HD1 ILE 76 2HD1 ILE 76 5.910 -6.222 -2.022 636 3HD1 ILE 76 3HD1 ILE 76 6.646 -7.536 -2.971 637 H ARG 77 H ARG 77 1.552 -8.283 -1.520 638 HA ARG 77 HA ARG 77 -0.242 -7.327 -3.605 639 1HB ARG 77 1HB ARG 77 -1.673 -8.702 -2.355 640 2HB ARG 77 2HB ARG 77 -0.786 -8.456 -0.864 641 1HG ARG 77 1HG ARG 77 -1.824 -6.385 -0.418 642 2HG ARG 77 2HG ARG 77 -2.209 -6.093 -2.103 643 1HD ARG 77 1HD ARG 77 -4.290 -6.658 -1.005 644 2HD ARG 77 2HD ARG 77 -3.856 -8.039 -1.992 645 HE ARG 77 HE ARG 77 -3.684 -7.881 0.975 646 1HH1 ARG 77 1HH1 ARG 77 -3.234 -9.758 -1.967 647 2HH1 ARG 77 2HH1 ARG 77 -3.133 -11.275 -1.136 648 1HH2 ARG 77 1HH2 ARG 77 -3.551 -9.881 2.071 649 2HH2 ARG 77 2HH2 ARG 77 -3.315 -11.345 1.176 650 H VAL 78 H VAL 78 0.174 -5.157 -3.914 651 HA VAL 78 HA VAL 78 0.293 -3.475 -1.544 652 HB VAL 78 HB VAL 78 2.623 -4.272 -2.556 653 1HG1 VAL 78 1HG1 VAL 78 2.335 -1.685 -4.055 654 2HG1 VAL 78 2HG1 VAL 78 3.491 -3.017 -4.293 655 3HG1 VAL 78 3HG1 VAL 78 1.799 -3.203 -4.813 656 1HG2 VAL 78 1HG2 VAL 78 3.071 -2.950 -0.800 657 2HG2 VAL 78 2HG2 VAL 78 3.220 -1.629 -1.984 658 3HG2 VAL 78 3HG2 VAL 78 1.679 -1.891 -1.132 659 H ILE 79 H ILE 79 -0.235 -1.221 -2.022 660 HA ILE 79 HA ILE 79 -1.666 -1.005 -4.578 661 HB ILE 79 HB ILE 79 -2.336 -0.225 -1.795 662 1HG1 ILE 79 1HG1 ILE 79 -3.484 -2.105 -2.676 663 2HG1 ILE 79 2HG1 ILE 79 -4.631 -0.780 -2.651 664 1HG2 ILE 79 1HG2 ILE 79 -3.280 1.393 -4.177 665 2HG2 ILE 79 2HG2 ILE 79 -3.832 1.557 -2.493 666 3HG2 ILE 79 3HG2 ILE 79 -2.151 1.955 -2.922 667 1HD1 ILE 79 1HD1 ILE 79 -3.172 -1.952 -5.044 668 2HD1 ILE 79 2HD1 ILE 79 -4.924 -1.768 -4.795 669 3HD1 ILE 79 3HD1 ILE 79 -3.916 -0.337 -5.114 670 H ILE 80 H ILE 80 -1.392 0.867 -5.836 671 HA ILE 80 HA ILE 80 0.877 2.517 -4.971 672 HB ILE 80 HB ILE 80 1.465 2.795 -7.239 673 1HG1 ILE 80 1HG1 ILE 80 0.097 1.629 -9.060 674 2HG1 ILE 80 2HG1 ILE 80 -1.197 1.515 -7.884 675 1HG2 ILE 80 1HG2 ILE 80 0.743 -0.116 -7.225 676 2HG2 ILE 80 2HG2 ILE 80 2.250 0.686 -7.729 677 3HG2 ILE 80 3HG2 ILE 80 1.863 0.527 -5.999 678 1HD1 ILE 80 1HD1 ILE 80 -1.709 3.729 -8.061 679 2HD1 ILE 80 2HD1 ILE 80 0.002 4.215 -8.000 680 3HD1 ILE 80 3HD1 ILE 80 -0.720 3.695 -9.541 681 H MET 81 H MET 81 0.778 4.817 -5.380 682 HA MET 81 HA MET 81 -1.859 5.791 -6.072 683 1HB MET 81 1HB MET 81 -0.826 7.395 -3.890 684 2HB MET 81 2HB MET 81 -2.312 6.468 -3.926 685 1HG MET 81 1HG MET 81 -1.219 4.482 -3.088 686 2HG MET 81 2HG MET 81 0.378 5.140 -3.388 687 1HE MET 81 1HE MET 81 1.729 5.846 -1.133 688 2HE MET 81 2HE MET 81 0.807 5.342 0.304 689 3HE MET 81 3HE MET 81 0.879 4.282 -1.124 690 H THR 82 H THR 82 -1.705 7.481 -7.494 691 HA THR 82 HA THR 82 0.210 9.527 -7.249 692 HB THR 82 HB THR 82 1.949 8.171 -8.059 693 HG1 THR 82 HG1 THR 82 2.133 8.964 -10.193 694 1HG2 THR 82 1HG2 THR 82 1.115 6.722 -10.283 695 2HG2 THR 82 2HG2 THR 82 1.308 6.037 -8.651 696 3HG2 THR 82 3HG2 THR 82 -0.294 6.583 -9.203 697 H ALA 83 H ALA 83 -0.090 11.215 -8.813 698 HA ALA 83 HA ALA 83 -2.731 11.556 -9.547 699 1HB ALA 83 1HB ALA 83 -0.438 13.084 -9.440 700 2HB ALA 83 2HB ALA 83 -0.738 12.989 -11.192 701 3HB ALA 83 3HB ALA 83 -1.997 13.626 -10.107 702 H TYR 84 H TYR 84 -3.689 11.733 -11.742 703 HA TYR 84 HA TYR 84 -2.945 9.420 -13.295 704 1HB TYR 84 1HB TYR 84 -5.047 10.230 -14.547 705 2HB TYR 84 2HB TYR 84 -5.316 9.957 -12.837 706 HD1 TYR 84 HD1 TYR 84 -5.868 11.771 -11.348 707 HD2 TYR 84 HD2 TYR 84 -4.859 12.555 -15.431 708 HE1 TYR 84 HE1 TYR 84 -6.726 14.153 -11.111 709 HE2 TYR 84 HE2 TYR 84 -5.721 14.934 -15.180 710 HH TYR 84 HH TYR 84 -6.094 16.539 -13.464 711 H GLY 85 H GLY 85 -0.952 11.571 -13.233 712 1HA GLY 85 1HA GLY 85 -1.196 12.803 -15.883 713 2HA GLY 85 2HA GLY 85 -0.041 13.204 -14.627 714 H GLU 86 H GLU 86 0.859 10.539 -13.951 715 HA GLU 86 HA GLU 86 2.361 10.017 -16.383 716 1HB GLU 86 1HB GLU 86 3.943 8.815 -14.780 717 2HB GLU 86 2HB GLU 86 3.820 10.549 -14.561 718 1HG GLU 86 1HG GLU 86 2.416 10.323 -12.625 719 2HG GLU 86 2HG GLU 86 2.055 8.645 -12.977 720 H LEU 87 H LEU 87 -0.181 9.023 -16.562 721 HA LEU 87 HA LEU 87 -0.820 6.643 -15.438 722 1HB LEU 87 1HB LEU 87 -1.236 7.488 -18.309 723 2HB LEU 87 2HB LEU 87 -2.097 6.197 -17.494 724 HG LEU 87 HG LEU 87 -2.187 8.903 -16.237 725 1HD1 LEU 87 1HD1 LEU 87 -3.898 9.733 -17.695 726 2HD1 LEU 87 2HD1 LEU 87 -2.476 9.317 -18.682 727 3HD1 LEU 87 3HD1 LEU 87 -3.887 8.232 -18.651 728 1HD2 LEU 87 1HD2 LEU 87 -4.112 6.593 -16.553 729 2HD2 LEU 87 2HD2 LEU 87 -3.314 7.172 -15.071 730 3HD2 LEU 87 3HD2 LEU 87 -4.569 8.164 -15.851 731 H ASP 88 H ASP 88 1.563 7.297 -18.033 732 HA ASP 88 HA ASP 88 1.988 4.862 -19.023 733 1HB ASP 88 1HB ASP 88 3.461 7.306 -18.771 734 2HB ASP 88 2HB ASP 88 4.572 6.020 -18.343 735 H MET 89 H MET 89 2.601 6.028 -15.743 736 HA MET 89 HA MET 89 4.307 3.787 -15.135 737 1HB MET 89 1HB MET 89 4.495 6.274 -14.260 738 2HB MET 89 2HB MET 89 3.189 5.845 -13.172 739 1HG MET 89 1HG MET 89 5.729 4.169 -13.354 740 2HG MET 89 2HG MET 89 5.619 5.557 -12.290 741 1HE MET 89 1HE MET 89 6.393 4.022 -10.753 742 2HE MET 89 2HE MET 89 5.218 3.759 -9.442 743 3HE MET 89 3HE MET 89 5.738 2.394 -10.459 744 H ILE 90 H ILE 90 1.156 5.195 -13.988 745 HA ILE 90 HA ILE 90 0.485 3.218 -12.214 746 HB ILE 90 HB ILE 90 -1.253 4.913 -14.007 747 1HG1 ILE 90 1HG1 ILE 90 -1.271 5.634 -11.225 748 2HG1 ILE 90 2HG1 ILE 90 0.391 5.539 -11.773 749 1HG2 ILE 90 1HG2 ILE 90 -2.778 3.313 -13.395 750 2HG2 ILE 90 2HG2 ILE 90 -1.949 2.943 -11.863 751 3HG2 ILE 90 3HG2 ILE 90 -2.908 4.435 -12.019 752 1HD1 ILE 90 1HD1 ILE 90 -1.050 7.767 -12.106 753 2HD1 ILE 90 2HD1 ILE 90 0.134 7.252 -13.331 754 3HD1 ILE 90 3HD1 ILE 90 -1.597 6.916 -13.570 755 H GLN 91 H GLN 91 0.218 3.280 -15.789 756 HA GLN 91 HA GLN 91 -1.415 1.136 -16.134 757 1HB GLN 91 1HB GLN 91 -0.021 0.816 -18.312 758 2HB GLN 91 2HB GLN 91 -0.857 2.338 -18.078 759 1HG GLN 91 1HG GLN 91 1.119 3.429 -18.274 760 2HG GLN 91 2HG GLN 91 1.674 2.652 -16.804 761 1HE2 GLN 91 1HE2 GLN 91 2.441 3.213 -19.894 762 2HE2 GLN 91 2HE2 GLN 91 3.432 1.845 -20.277 763 H GLU 92 H GLU 92 2.217 0.981 -16.376 764 HA GLU 92 HA GLU 92 2.423 -1.709 -16.393 765 1HB GLU 92 1HB GLU 92 4.171 0.549 -15.978 766 2HB GLU 92 2HB GLU 92 4.610 -0.696 -14.827 767 1HG GLU 92 1HG GLU 92 4.363 -2.292 -16.977 768 2HG GLU 92 2HG GLU 92 4.654 -0.797 -17.843 769 H SER 93 H SER 93 1.910 0.470 -13.604 770 HA SER 93 HA SER 93 2.558 -1.244 -11.583 771 1HB SER 93 1HB SER 93 1.865 0.524 -10.362 772 2HB SER 93 2HB SER 93 1.328 1.281 -11.849 773 HG SER 93 HG SER 93 -0.187 -0.194 -9.917 774 H LYS 94 H LYS 94 -0.486 -0.934 -13.490 775 HA LYS 94 HA LYS 94 -1.961 -2.759 -11.932 776 1HB LYS 94 1HB LYS 94 -2.490 -0.975 -13.976 777 2HB LYS 94 2HB LYS 94 -2.722 -2.524 -14.759 778 1HG LYS 94 1HG LYS 94 -3.897 -2.557 -12.080 779 2HG LYS 94 2HG LYS 94 -4.521 -1.203 -13.000 780 1HD LYS 94 1HD LYS 94 -4.582 -3.254 -14.882 781 2HD LYS 94 2HD LYS 94 -4.950 -4.113 -13.400 782 1HE LYS 94 1HE LYS 94 -6.782 -2.491 -12.901 783 2HE LYS 94 2HE LYS 94 -6.402 -1.599 -14.360 784 1HZ LYS 94 1HZ LYS 94 -6.813 -4.392 -14.789 785 2HZ LYS 94 2HZ LYS 94 -8.134 -3.617 -14.223 786 3HZ LYS 94 3HZ LYS 94 -7.420 -3.113 -15.602 787 H GLU 95 H GLU 95 -0.230 -3.102 -15.108 788 HA GLU 95 HA GLU 95 -0.713 -5.844 -15.244 789 1HB GLU 95 1HB GLU 95 0.459 -5.753 -17.237 790 2HB GLU 95 2HB GLU 95 0.091 -4.051 -17.047 791 1HG GLU 95 1HG GLU 95 2.381 -3.917 -17.441 792 2HG GLU 95 2HG GLU 95 2.387 -4.006 -15.691 793 H LEU 96 H LEU 96 1.331 -4.008 -13.203 794 HA LEU 96 HA LEU 96 3.483 -5.870 -13.036 795 1HB LEU 96 1HB LEU 96 2.746 -3.282 -11.937 796 2HB LEU 96 2HB LEU 96 3.450 -4.326 -10.719 797 HG LEU 96 HG LEU 96 5.503 -4.479 -11.835 798 1HD1 LEU 96 1HD1 LEU 96 3.908 -4.264 -14.213 799 2HD1 LEU 96 2HD1 LEU 96 5.249 -3.095 -14.286 800 3HD1 LEU 96 3HD1 LEU 96 5.588 -4.823 -14.023 801 1HD2 LEU 96 1HD2 LEU 96 4.511 -2.026 -11.113 802 2HD2 LEU 96 2HD2 LEU 96 6.208 -2.380 -11.519 803 3HD2 LEU 96 3HD2 LEU 96 5.115 -1.720 -12.760 804 H GLY 97 H GLY 97 0.226 -5.734 -11.858 805 1HA GLY 97 1HA GLY 97 -0.678 -7.742 -10.938 806 2HA GLY 97 2HA GLY 97 0.821 -8.007 -10.071 807 H ALA 98 H ALA 98 -0.312 -4.688 -10.246 808 HA ALA 98 HA ALA 98 -0.621 -4.627 -7.405 809 1HB ALA 98 1HB ALA 98 0.420 -2.761 -8.526 810 2HB ALA 98 2HB ALA 98 -0.970 -2.575 -9.623 811 3HB ALA 98 3HB ALA 98 -1.146 -2.201 -7.892 812 H LEU 99 H LEU 99 -2.503 -4.549 -6.199 813 HA LEU 99 HA LEU 99 -4.777 -5.719 -7.181 814 1HB LEU 99 1HB LEU 99 -4.814 -3.732 -4.928 815 2HB LEU 99 2HB LEU 99 -5.783 -5.177 -5.135 816 HG LEU 99 HG LEU 99 -4.350 -5.972 -3.576 817 1HD1 LEU 99 1HD1 LEU 99 -3.880 -7.023 -5.983 818 2HD1 LEU 99 2HD1 LEU 99 -2.248 -6.399 -5.642 819 3HD1 LEU 99 3HD1 LEU 99 -3.014 -7.549 -4.519 820 1HD2 LEU 99 1HD2 LEU 99 -2.653 -3.723 -4.445 821 2HD2 LEU 99 2HD2 LEU 99 -2.999 -4.349 -2.815 822 3HD2 LEU 99 3HD2 LEU 99 -1.768 -5.140 -3.829 823 H THR 100 H THR 100 -4.083 -2.186 -6.741 824 HA THR 100 HA THR 100 -5.620 -1.554 -9.058 825 HB THR 100 HB THR 100 -7.503 -1.927 -7.521 826 HG1 THR 100 HG1 THR 100 -6.746 0.906 -7.604 827 1HG2 THR 100 1HG2 THR 100 -7.566 -0.140 -5.549 828 2HG2 THR 100 2HG2 THR 100 -6.746 -1.698 -5.289 829 3HG2 THR 100 3HG2 THR 100 -5.792 -0.242 -5.664 830 H HIS 101 H HIS 101 -5.770 0.921 -9.309 831 HA HIS 101 HA HIS 101 -3.435 2.106 -8.001 832 1HB HIS 101 1HB HIS 101 -3.158 3.335 -10.266 833 2HB HIS 101 2HB HIS 101 -2.545 1.704 -10.086 834 HD1 HIS 101 HD1 HIS 101 -2.726 1.349 -12.682 835 HD2 HIS 101 HD2 HIS 101 -6.381 2.065 -10.753 836 HE1 HIS 101 HE1 HIS 101 -4.551 0.732 -14.356 837 H PHE 102 H PHE 102 -3.869 4.006 -6.984 838 HA PHE 102 HA PHE 102 -6.460 5.225 -7.596 839 1HB PHE 102 1HB PHE 102 -4.524 5.407 -5.209 840 2HB PHE 102 2HB PHE 102 -6.070 6.229 -5.277 841 HD1 PHE 102 HD1 PHE 102 -7.861 4.180 -6.340 842 HD2 PHE 102 HD2 PHE 102 -4.695 3.816 -3.538 843 HE1 PHE 102 HE1 PHE 102 -8.976 2.165 -5.341 844 HE2 PHE 102 HE2 PHE 102 -5.810 1.801 -2.539 845 HZ PHE 102 HZ PHE 102 -7.938 0.999 -3.453 846 H ALA 103 H ALA 103 -6.605 7.609 -7.583 847 HA ALA 103 HA ALA 103 -4.156 8.757 -8.696 848 1HB ALA 103 1HB ALA 103 -5.554 10.226 -9.883 849 2HB ALA 103 2HB ALA 103 -6.483 8.708 -9.877 850 3HB ALA 103 3HB ALA 103 -6.906 10.015 -8.745 851 H LYS 104 H LYS 104 -3.333 10.777 -7.922 852 HA LYS 104 HA LYS 104 -2.882 11.189 -5.416 853 1HB LYS 104 1HB LYS 104 -3.045 12.900 -7.712 854 2HB LYS 104 2HB LYS 104 -3.614 13.792 -6.315 855 1HG LYS 104 1HG LYS 104 -1.559 13.223 -5.063 856 2HG LYS 104 2HG LYS 104 -1.002 12.208 -6.378 857 1HD LYS 104 1HD LYS 104 -1.085 14.283 -7.885 858 2HD LYS 104 2HD LYS 104 -1.394 15.234 -6.446 859 1HE LYS 104 1HE LYS 104 0.942 15.388 -6.595 860 2HE LYS 104 2HE LYS 104 0.764 14.038 -5.491 861 1HZ LYS 104 1HZ LYS 104 1.427 13.968 -8.332 862 2HZ LYS 104 2HZ LYS 104 2.216 13.279 -7.080 863 3HZ LYS 104 3HZ LYS 104 0.804 12.647 -7.602 864 HA PRO 105 HA PRO 105 -7.055 13.101 -4.364 865 1HB PRO 105 1HB PRO 105 -9.011 13.358 -6.255 866 2HB PRO 105 2HB PRO 105 -7.894 14.646 -5.851 867 1HG PRO 105 1HG PRO 105 -7.923 12.898 -8.234 868 2HG PRO 105 2HG PRO 105 -7.108 14.432 -8.008 869 1HD PRO 105 1HD PRO 105 -5.909 11.827 -7.952 870 2HD PRO 105 2HD PRO 105 -5.117 13.353 -7.612 871 H PHE 106 H PHE 106 -7.051 11.177 -3.151 872 HA PHE 106 HA PHE 106 -9.144 9.376 -4.143 873 1HB PHE 106 1HB PHE 106 -7.550 7.760 -2.608 874 2HB PHE 106 2HB PHE 106 -7.268 7.971 -4.325 875 HD1 PHE 106 HD1 PHE 106 -6.488 10.041 -1.307 876 HD2 PHE 106 HD2 PHE 106 -5.021 8.103 -4.785 877 HE1 PHE 106 HE1 PHE 106 -4.184 10.911 -0.821 878 HE2 PHE 106 HE2 PHE 106 -2.718 8.973 -4.299 879 HZ PHE 106 HZ PHE 106 -2.327 10.367 -2.323 880 H ASP 107 H ASP 107 -10.346 8.226 -2.440 881 HA ASP 107 HA ASP 107 -10.279 9.769 0.031 882 1HB ASP 107 1HB ASP 107 -12.392 9.342 -1.732 883 2HB ASP 107 2HB ASP 107 -12.672 8.098 -0.530 884 H ILE 108 H ILE 108 -10.375 8.557 2.044 885 HA ILE 108 HA ILE 108 -9.262 5.958 1.900 886 HB ILE 108 HB ILE 108 -9.576 8.021 3.806 887 1HG1 ILE 108 1HG1 ILE 108 -7.468 7.016 3.403 888 2HG1 ILE 108 2HG1 ILE 108 -7.898 6.627 5.056 889 1HG2 ILE 108 1HG2 ILE 108 -10.132 6.622 5.821 890 2HG2 ILE 108 2HG2 ILE 108 -11.504 6.999 4.752 891 3HG2 ILE 108 3HG2 ILE 108 -10.757 5.385 4.703 892 1HD1 ILE 108 1HD1 ILE 108 -7.790 4.827 2.644 893 2HD1 ILE 108 2HD1 ILE 108 -7.235 4.525 4.309 894 3HD1 ILE 108 3HD1 ILE 108 -8.970 4.449 3.922 895 H ASP 109 H ASP 109 -12.538 7.305 2.492 896 HA ASP 109 HA ASP 109 -13.741 5.039 3.401 897 1HB ASP 109 1HB ASP 109 -14.899 7.182 3.350 898 2HB ASP 109 2HB ASP 109 -14.767 7.278 1.605 899 H GLU 110 H GLU 110 -13.144 6.214 0.023 900 HA GLU 110 HA GLU 110 -14.502 4.075 -1.184 901 1HB GLU 110 1HB GLU 110 -13.626 4.951 -3.267 902 2HB GLU 110 2HB GLU 110 -14.056 6.312 -2.250 903 1HG GLU 110 1HG GLU 110 -11.853 6.960 -1.930 904 2HG GLU 110 2HG GLU 110 -11.247 5.316 -1.957 905 H ILE 111 H ILE 111 -11.310 4.487 0.209 906 HA ILE 111 HA ILE 111 -10.126 2.343 -1.286 907 HB ILE 111 HB ILE 111 -9.294 4.243 0.845 908 1HG1 ILE 111 1HG1 ILE 111 -7.797 3.317 -1.612 909 2HG1 ILE 111 2HG1 ILE 111 -9.045 4.544 -1.693 910 1HG2 ILE 111 1HG2 ILE 111 -8.462 2.380 1.950 911 2HG2 ILE 111 2HG2 ILE 111 -8.105 1.510 0.439 912 3HG2 ILE 111 3HG2 ILE 111 -7.090 2.885 0.936 913 1HD1 ILE 111 1HD1 ILE 111 -7.732 5.710 0.257 914 2HD1 ILE 111 2HD1 ILE 111 -6.391 4.646 -0.231 915 3HD1 ILE 111 3HD1 ILE 111 -7.072 5.810 -1.393 916 H ARG 112 H ARG 112 -12.181 2.705 1.502 917 HA ARG 112 HA ARG 112 -11.300 0.384 2.818 918 1HB ARG 112 1HB ARG 112 -13.983 1.848 2.999 919 2HB ARG 112 2HB ARG 112 -13.407 0.661 4.152 920 1HG ARG 112 1HG ARG 112 -11.261 2.368 4.130 921 2HG ARG 112 2HG ARG 112 -12.546 3.500 3.757 922 1HD ARG 112 1HD ARG 112 -13.321 1.664 5.927 923 2HD ARG 112 2HD ARG 112 -11.854 2.540 6.318 924 HE ARG 112 HE ARG 112 -13.444 4.550 5.356 925 1HH1 ARG 112 1HH1 ARG 112 -14.044 2.012 7.718 926 2HH1 ARG 112 2HH1 ARG 112 -15.187 2.947 8.622 927 1HH2 ARG 112 1HH2 ARG 112 -14.953 5.784 6.548 928 2HH2 ARG 112 2HH2 ARG 112 -15.708 5.108 7.952 929 H ASP 113 H ASP 113 -13.269 1.025 0.022 930 HA ASP 113 HA ASP 113 -14.931 -1.244 0.265 931 1HB ASP 113 1HB ASP 113 -14.724 1.038 -1.416 932 2HB ASP 113 2HB ASP 113 -14.488 -0.330 -2.486 933 H ALA 114 H ALA 114 -11.912 -0.334 -1.524 934 HA ALA 114 HA ALA 114 -11.689 -2.789 -2.909 935 1HB ALA 114 1HB ALA 114 -9.409 -1.941 -3.417 936 2HB ALA 114 2HB ALA 114 -10.660 -0.706 -3.695 937 3HB ALA 114 3HB ALA 114 -9.648 -0.633 -2.233 938 H VAL 115 H VAL 115 -10.460 -1.497 0.215 939 HA VAL 115 HA VAL 115 -8.801 -3.756 0.702 940 HB VAL 115 HB VAL 115 -9.896 -1.657 2.585 941 1HG1 VAL 115 1HG1 VAL 115 -8.153 -3.970 2.962 942 2HG1 VAL 115 2HG1 VAL 115 -7.372 -2.448 3.454 943 3HG1 VAL 115 3HG1 VAL 115 -8.934 -2.918 4.167 944 1HG2 VAL 115 1HG2 VAL 115 -8.422 -0.171 1.787 945 2HG2 VAL 115 2HG2 VAL 115 -7.110 -1.373 1.748 946 3HG2 VAL 115 3HG2 VAL 115 -8.247 -1.252 0.384 947 H LYS 116 H LYS 116 -12.189 -2.842 1.346 948 HA LYS 116 HA LYS 116 -12.590 -5.031 3.153 949 1HB LYS 116 1HB LYS 116 -13.821 -2.952 3.438 950 2HB LYS 116 2HB LYS 116 -14.509 -3.090 1.833 951 1HG LYS 116 1HG LYS 116 -15.021 -5.573 3.199 952 2HG LYS 116 2HG LYS 116 -15.446 -4.277 4.299 953 1HD LYS 116 1HD LYS 116 -17.440 -4.352 3.143 954 2HD LYS 116 2HD LYS 116 -16.589 -3.274 2.055 955 1HE LYS 116 1HE LYS 116 -15.761 -5.550 0.927 956 2HE LYS 116 2HE LYS 116 -17.163 -6.228 1.730 957 1HZ LYS 116 1HZ LYS 116 -18.275 -4.132 0.668 958 2HZ LYS 116 2HZ LYS 116 -17.053 -4.283 -0.405 959 3HZ LYS 116 3HZ LYS 116 -18.096 -5.519 -0.176 960 H LYS 117 H LYS 117 -12.460 -4.563 -0.284 961 HA LYS 117 HA LYS 117 -14.144 -6.876 -0.790 962 1HB LYS 117 1HB LYS 117 -13.005 -4.646 -2.410 963 2HB LYS 117 2HB LYS 117 -13.262 -6.175 -3.226 964 1HG LYS 117 1HG LYS 117 -15.634 -6.204 -2.461 965 2HG LYS 117 2HG LYS 117 -15.386 -4.699 -1.598 966 1HD LYS 117 1HD LYS 117 -14.469 -4.323 -4.312 967 2HD LYS 117 2HD LYS 117 -16.051 -5.073 -4.380 968 1HE LYS 117 1HE LYS 117 -15.836 -2.881 -2.376 969 2HE LYS 117 2HE LYS 117 -15.599 -2.359 -4.032 970 1HZ LYS 117 1HZ LYS 117 -17.968 -2.665 -2.946 971 2HZ LYS 117 2HZ LYS 117 -17.709 -2.838 -4.549 972 3HZ LYS 117 3HZ LYS 117 -17.803 -4.156 -3.590 973 H TYR 118 H TYR 118 -10.734 -5.862 -0.653 974 HA TYR 118 HA TYR 118 -9.898 -8.443 -1.715 975 1HB TYR 118 1HB TYR 118 -8.992 -5.904 -2.070 976 2HB TYR 118 2HB TYR 118 -8.143 -6.223 -0.571 977 HD1 TYR 118 HD1 TYR 118 -7.508 -5.985 -3.849 978 HD2 TYR 118 HD2 TYR 118 -7.191 -8.935 -0.766 979 HE1 TYR 118 HE1 TYR 118 -5.652 -7.147 -5.142 980 HE2 TYR 118 HE2 TYR 118 -5.335 -10.086 -2.069 981 HH TYR 118 HH TYR 118 -4.412 -10.250 -4.117 982 H LEU 119 H LEU 119 -9.672 -6.419 1.276 983 HA LEU 119 HA LEU 119 -8.771 -8.845 2.668 984 1HB LEU 119 1HB LEU 119 -8.046 -5.963 2.934 985 2HB LEU 119 2HB LEU 119 -8.057 -6.955 4.378 986 HG LEU 119 HG LEU 119 -5.824 -6.783 3.378 987 1HD1 LEU 119 1HD1 LEU 119 -5.443 -9.333 3.105 988 2HD1 LEU 119 2HD1 LEU 119 -6.026 -8.702 4.663 989 3HD1 LEU 119 3HD1 LEU 119 -7.166 -9.469 3.531 990 1HD2 LEU 119 1HD2 LEU 119 -6.267 -8.557 1.112 991 2HD2 LEU 119 2HD2 LEU 119 -7.143 -7.016 0.946 992 3HD2 LEU 119 3HD2 LEU 119 -5.382 -7.016 1.209 993 HA PRO 120 HA PRO 120 -12.320 -8.609 5.110 994 1HB PRO 120 1HB PRO 120 -11.485 -9.501 7.554 995 2HB PRO 120 2HB PRO 120 -11.825 -10.571 6.208 996 1HG PRO 120 1HG PRO 120 -9.206 -9.740 7.300 997 2HG PRO 120 2HG PRO 120 -9.581 -11.102 6.264 998 1HD PRO 120 1HD PRO 120 -8.361 -8.630 5.473 999 2HD PRO 120 2HD PRO 120 -8.841 -9.946 4.420 1000 H LEU 121 H LEU 121 -11.779 -6.130 4.663 1001 HA LEU 121 HA LEU 121 -11.332 -4.829 7.214 1002 1HB LEU 121 1HB LEU 121 -10.142 -3.881 5.431 1003 2HB LEU 121 2HB LEU 121 -11.527 -3.914 4.358 1004 HG LEU 121 HG LEU 121 -12.615 -2.194 5.876 1005 1HD1 LEU 121 1HD1 LEU 121 -10.567 -2.805 7.605 1006 2HD1 LEU 121 2HD1 LEU 121 -10.031 -1.261 6.899 1007 3HD1 LEU 121 3HD1 LEU 121 -11.618 -1.371 7.698 1008 1HD2 LEU 121 1HD2 LEU 121 -11.498 -0.341 4.833 1009 2HD2 LEU 121 2HD2 LEU 121 -10.039 -1.318 4.545 1010 3HD2 LEU 121 3HD2 LEU 121 -11.548 -1.696 3.680 1011 H LYS 122 H LYS 122 -12.861 -2.951 7.787 1012 HA LYS 122 HA LYS 122 -14.879 -2.626 8.715 1013 1HB LYS 122 1HB LYS 122 -15.225 -1.138 7.012 1014 2HB LYS 122 2HB LYS 122 -15.098 -2.353 5.756 1015 1HG LYS 122 1HG LYS 122 -17.332 -3.014 5.960 1016 2HG LYS 122 2HG LYS 122 -17.421 -2.582 7.657 1017 1HD LYS 122 1HD LYS 122 -17.931 -0.365 7.218 1018 2HD LYS 122 2HD LYS 122 -16.940 -0.306 5.774 1019 1HE LYS 122 1HE LYS 122 -19.575 -1.843 5.916 1020 2HE LYS 122 2HE LYS 122 -19.471 -0.177 5.382 1021 1HZ LYS 122 1HZ LYS 122 -17.603 -1.277 3.890 1022 2HZ LYS 122 2HZ LYS 122 -18.591 -2.567 4.051 1023 3HZ LYS 122 3HZ LYS 122 -19.164 -1.173 3.422 1024 H SER 123 H SER 123 -15.081 -4.655 9.855 1025 HA SER 123 HA SER 123 -16.130 -6.918 8.653 1026 1HB SER 123 1HB SER 123 -16.482 -7.729 10.944 1027 2HB SER 123 2HB SER 123 -14.934 -6.915 10.826 1028 HG SER 123 HG SER 123 -15.580 -5.573 12.352 1029 H ASN 124 H ASN 124 -18.076 -6.840 7.549 1030 HA ASN 124 HA ASN 124 -20.207 -5.294 8.736 1031 1HB ASN 124 1HB ASN 124 -19.384 -5.812 6.071 1032 2HB ASN 124 2HB ASN 124 -20.861 -6.738 6.248 1033 1HD2 ASN 124 1HD2 ASN 124 -20.220 -4.297 4.720 1034 2HD2 ASN 124 2HD2 ASN 124 -21.375 -3.094 5.188 Start of MODEL 20 1 1H MET 1 1H MET 1 -7.556 -13.868 18.181 2 HA MET 1 HA MET 1 -9.864 -14.080 17.355 3 1HB MET 1 1HB MET 1 -9.930 -11.464 18.516 4 2HB MET 1 2HB MET 1 -10.087 -11.203 16.790 5 1HG MET 1 1HG MET 1 -12.132 -12.326 16.655 6 2HG MET 1 2HG MET 1 -11.754 -13.407 17.981 7 1HE MET 1 1HE MET 1 -13.465 -12.390 20.696 8 2HE MET 1 2HE MET 1 -14.619 -12.395 19.341 9 3HE MET 1 3HE MET 1 -13.242 -13.523 19.341 10 H MET 2 H MET 2 -10.408 -12.327 15.116 11 HA MET 2 HA MET 2 -8.864 -13.357 13.204 12 1HB MET 2 1HB MET 2 -10.641 -11.023 13.529 13 2HB MET 2 2HB MET 2 -9.405 -10.698 12.329 14 1HG MET 2 1HG MET 2 -10.392 -13.383 11.890 15 2HG MET 2 2HG MET 2 -11.774 -12.317 12.048 16 1HE MET 2 1HE MET 2 -12.220 -13.264 9.965 17 2HE MET 2 2HE MET 2 -12.277 -12.001 8.713 18 3HE MET 2 3HE MET 2 -11.113 -13.341 8.574 19 H ASN 3 H ASN 3 -7.277 -12.158 11.660 20 HA ASN 3 HA ASN 3 -5.430 -10.604 13.294 21 1HB ASN 3 1HB ASN 3 -3.598 -11.695 11.831 22 2HB ASN 3 2HB ASN 3 -4.360 -12.746 13.009 23 1HD2 ASN 3 1HD2 ASN 3 -4.294 -14.675 12.093 24 2HD2 ASN 3 2HD2 ASN 3 -4.961 -15.109 10.555 25 H GLU 4 H GLU 4 -3.800 -9.372 11.719 26 HA GLU 4 HA GLU 4 -4.319 -9.000 9.081 27 1HB GLU 4 1HB GLU 4 -6.409 -7.834 10.634 28 2HB GLU 4 2HB GLU 4 -5.440 -6.498 10.045 29 1HG GLU 4 1HG GLU 4 -6.083 -6.824 7.871 30 2HG GLU 4 2HG GLU 4 -5.911 -8.565 7.979 31 H LYS 5 H LYS 5 -2.984 -7.267 8.163 32 HA LYS 5 HA LYS 5 -1.514 -5.631 10.031 33 1HB LYS 5 1HB LYS 5 -0.260 -7.940 8.557 34 2HB LYS 5 2HB LYS 5 0.678 -6.510 8.935 35 1HG LYS 5 1HG LYS 5 1.046 -7.488 10.961 36 2HG LYS 5 2HG LYS 5 -0.586 -6.988 11.357 37 1HD LYS 5 1HD LYS 5 -1.043 -9.193 11.679 38 2HD LYS 5 2HD LYS 5 -1.020 -9.349 9.934 39 1HE LYS 5 1HE LYS 5 0.915 -10.549 9.972 40 2HE LYS 5 2HE LYS 5 1.708 -9.376 11.004 41 1HZ LYS 5 1HZ LYS 5 0.196 -11.729 11.752 42 2HZ LYS 5 2HZ LYS 5 1.583 -11.141 12.384 43 3HZ LYS 5 3HZ LYS 5 0.153 -10.453 12.771 44 H ILE 6 H ILE 6 -0.161 -4.003 8.864 45 HA ILE 6 HA ILE 6 -0.504 -3.784 6.041 46 HB ILE 6 HB ILE 6 -2.480 -2.606 7.783 47 1HG1 ILE 6 1HG1 ILE 6 -2.411 -2.291 4.800 48 2HG1 ILE 6 2HG1 ILE 6 -2.567 -3.898 5.481 49 1HG2 ILE 6 1HG2 ILE 6 -2.490 -0.357 6.650 50 2HG2 ILE 6 2HG2 ILE 6 -1.191 -0.609 7.840 51 3HG2 ILE 6 3HG2 ILE 6 -0.834 -0.707 6.099 52 1HD1 ILE 6 1HD1 ILE 6 -4.809 -3.329 5.404 53 2HD1 ILE 6 2HD1 ILE 6 -4.421 -2.665 7.009 54 3HD1 ILE 6 3HD1 ILE 6 -4.482 -1.590 5.592 55 H LEU 7 H LEU 7 1.127 -2.533 5.180 56 HA LEU 7 HA LEU 7 2.766 -1.114 7.163 57 1HB LEU 7 1HB LEU 7 3.467 -3.275 5.602 58 2HB LEU 7 2HB LEU 7 4.074 -1.919 4.672 59 HG LEU 7 HG LEU 7 5.054 -1.195 7.050 60 1HD1 LEU 7 1HD1 LEU 7 3.915 -3.306 8.031 61 2HD1 LEU 7 2HD1 LEU 7 5.286 -4.183 7.308 62 3HD1 LEU 7 3HD1 LEU 7 5.581 -2.912 8.519 63 1HD2 LEU 7 1HD2 LEU 7 6.139 -1.917 4.746 64 2HD2 LEU 7 2HD2 LEU 7 7.110 -1.754 6.229 65 3HD2 LEU 7 3HD2 LEU 7 6.585 -3.364 5.682 66 H ILE 8 H ILE 8 3.528 0.968 6.644 67 HA ILE 8 HA ILE 8 2.264 2.107 4.247 68 HB ILE 8 HB ILE 8 2.779 3.386 6.935 69 1HG1 ILE 8 1HG1 ILE 8 0.062 3.103 5.717 70 2HG1 ILE 8 2HG1 ILE 8 0.789 1.683 6.441 71 1HG2 ILE 8 1HG2 ILE 8 1.095 4.871 5.089 72 2HG2 ILE 8 2HG2 ILE 8 2.509 5.400 6.031 73 3HG2 ILE 8 3HG2 ILE 8 2.735 4.627 4.444 74 1HD1 ILE 8 1HD1 ILE 8 1.099 2.850 8.576 75 2HD1 ILE 8 2HD1 ILE 8 0.534 4.376 7.856 76 3HD1 ILE 8 3HD1 ILE 8 -0.597 3.017 8.061 77 H VAL 9 H VAL 9 3.517 3.424 2.906 78 HA VAL 9 HA VAL 9 6.253 3.943 3.744 79 HB VAL 9 HB VAL 9 5.667 2.609 1.105 80 1HG1 VAL 9 1HG1 VAL 9 7.829 2.956 0.675 81 2HG1 VAL 9 2HG1 VAL 9 7.928 3.925 2.164 82 3HG1 VAL 9 3HG1 VAL 9 8.304 2.186 2.208 83 1HG2 VAL 9 1HG2 VAL 9 6.241 1.363 3.789 84 2HG2 VAL 9 2HG2 VAL 9 5.048 0.891 2.555 85 3HG2 VAL 9 3HG2 VAL 9 6.779 0.576 2.286 86 H ASP 10 H ASP 10 6.830 5.988 3.184 87 HA ASP 10 HA ASP 10 6.623 8.013 2.420 88 1HB ASP 10 1HB ASP 10 6.678 6.233 0.125 89 2HB ASP 10 2HB ASP 10 5.690 7.625 -0.270 90 H ASP 11 H ASP 11 4.985 9.461 0.746 91 HA ASP 11 HA ASP 11 3.004 10.288 0.430 92 1HB ASP 11 1HB ASP 11 2.464 7.879 -0.315 93 2HB ASP 11 2HB ASP 11 1.785 7.624 1.280 94 H GLN 12 H GLN 12 4.310 9.493 3.286 95 HA GLN 12 HA GLN 12 2.073 9.601 5.014 96 1HB GLN 12 1HB GLN 12 3.974 10.003 6.757 97 2HB GLN 12 2HB GLN 12 3.913 8.460 5.929 98 1HG GLN 12 1HG GLN 12 5.781 8.930 4.598 99 2HG GLN 12 2HG GLN 12 5.512 10.661 4.636 100 1HE2 GLN 12 1HE2 GLN 12 5.411 11.437 7.109 101 2HE2 GLN 12 2HE2 GLN 12 6.820 11.032 8.032 102 H TYR 13 H TYR 13 0.868 11.418 5.333 103 HA TYR 13 HA TYR 13 2.232 13.890 5.922 104 1HB TYR 13 1HB TYR 13 1.330 13.217 3.285 105 2HB TYR 13 2HB TYR 13 0.058 14.237 3.928 106 HD1 TYR 13 HD1 TYR 13 3.248 14.184 2.347 107 HD2 TYR 13 HD2 TYR 13 0.791 16.525 4.952 108 HE1 TYR 13 HE1 TYR 13 4.615 16.253 1.788 109 HE2 TYR 13 HE2 TYR 13 2.167 18.587 4.384 110 HH TYR 13 HH TYR 13 4.871 18.372 2.085 111 H GLY 14 H GLY 14 0.459 11.865 7.266 112 1HA GLY 14 1HA GLY 14 -0.965 12.493 9.055 113 2HA GLY 14 2HA GLY 14 -1.660 13.756 8.058 114 H ILE 15 H ILE 15 -1.306 11.318 5.870 115 HA ILE 15 HA ILE 15 -4.068 10.499 6.238 116 HB ILE 15 HB ILE 15 -2.109 10.288 3.958 117 1HG1 ILE 15 1HG1 ILE 15 -4.617 11.581 3.374 118 2HG1 ILE 15 2HG1 ILE 15 -3.909 12.310 4.802 119 1HG2 ILE 15 1HG2 ILE 15 -3.540 8.251 4.105 120 2HG2 ILE 15 2HG2 ILE 15 -4.972 9.300 3.969 121 3HG2 ILE 15 3HG2 ILE 15 -3.798 9.218 2.634 122 1HD1 ILE 15 1HD1 ILE 15 -1.669 12.287 3.403 123 2HD1 ILE 15 2HD1 ILE 15 -2.762 12.112 2.009 124 3HD1 ILE 15 3HD1 ILE 15 -2.894 13.534 3.071 125 H ARG 16 H ARG 16 -0.728 9.197 6.202 126 HA ARG 16 HA ARG 16 -1.300 6.553 6.109 127 1HB ARG 16 1HB ARG 16 0.841 6.333 7.578 128 2HB ARG 16 2HB ARG 16 1.000 7.177 6.050 129 1HG ARG 16 1HG ARG 16 0.982 9.337 7.112 130 2HG ARG 16 2HG ARG 16 0.378 8.682 8.621 131 1HD ARG 16 1HD ARG 16 3.014 7.635 7.580 132 2HD ARG 16 2HD ARG 16 2.986 9.241 8.281 133 HE ARG 16 HE ARG 16 1.604 7.314 9.968 134 1HH1 ARG 16 1HH1 ARG 16 4.786 8.533 9.091 135 2HH1 ARG 16 2HH1 ARG 16 5.517 8.072 10.592 136 1HH2 ARG 16 1HH2 ARG 16 2.567 6.705 11.948 137 2HH2 ARG 16 2HH2 ARG 16 4.247 7.025 12.228 138 H ILE 17 H ILE 17 -1.470 8.842 8.873 139 HA ILE 17 HA ILE 17 -1.866 6.850 10.842 140 HB ILE 17 HB ILE 17 -2.466 9.809 10.807 141 1HG1 ILE 17 1HG1 ILE 17 -0.186 8.572 12.298 142 2HG1 ILE 17 2HG1 ILE 17 -0.034 8.754 10.562 143 1HG2 ILE 17 1HG2 ILE 17 -3.672 8.192 12.516 144 2HG2 ILE 17 2HG2 ILE 17 -2.096 8.266 13.339 145 3HG2 ILE 17 3HG2 ILE 17 -3.007 9.763 13.027 146 1HD1 ILE 17 1HD1 ILE 17 0.765 10.828 11.229 147 2HD1 ILE 17 2HD1 ILE 17 -0.965 11.222 11.091 148 3HD1 ILE 17 3HD1 ILE 17 -0.258 10.870 12.686 149 H LEU 18 H LEU 18 -4.055 8.933 8.864 150 HA LEU 18 HA LEU 18 -6.440 8.407 9.998 151 1HB LEU 18 1HB LEU 18 -5.744 9.753 7.889 152 2HB LEU 18 2HB LEU 18 -6.116 8.279 7.017 153 HG LEU 18 HG LEU 18 -8.381 8.547 8.506 154 1HD1 LEU 18 1HD1 LEU 18 -9.035 10.719 8.873 155 2HD1 LEU 18 2HD1 LEU 18 -7.298 10.820 9.249 156 3HD1 LEU 18 3HD1 LEU 18 -7.902 11.385 7.673 157 1HD2 LEU 18 1HD2 LEU 18 -7.786 9.730 5.781 158 2HD2 LEU 18 2HD2 LEU 18 -8.346 8.080 6.143 159 3HD2 LEU 18 3HD2 LEU 18 -9.416 9.469 6.448 160 H LEU 19 H LEU 19 -4.884 6.337 7.444 161 HA LEU 19 HA LEU 19 -6.816 4.290 7.796 162 1HB LEU 19 1HB LEU 19 -5.321 3.005 6.312 163 2HB LEU 19 2HB LEU 19 -5.811 4.562 5.673 164 HG LEU 19 HG LEU 19 -3.435 5.211 6.872 165 1HD1 LEU 19 1HD1 LEU 19 -1.801 3.568 6.571 166 2HD1 LEU 19 2HD1 LEU 19 -3.167 2.692 7.304 167 3HD1 LEU 19 3HD1 LEU 19 -2.861 2.561 5.556 168 1HD2 LEU 19 1HD2 LEU 19 -3.108 4.247 4.115 169 2HD2 LEU 19 2HD2 LEU 19 -4.524 5.297 4.361 170 3HD2 LEU 19 3HD2 LEU 19 -2.899 5.875 4.802 171 H ASN 20 H ASN 20 -3.861 5.237 9.421 172 HA ASN 20 HA ASN 20 -3.116 2.737 10.363 173 1HB ASN 20 1HB ASN 20 -1.776 4.933 10.447 174 2HB ASN 20 2HB ASN 20 -2.778 5.420 11.800 175 1HD2 ASN 20 1HD2 ASN 20 -0.470 5.484 12.638 176 2HD2 ASN 20 2HD2 ASN 20 0.109 4.080 13.471 177 H GLU 21 H GLU 21 -4.839 5.496 12.029 178 HA GLU 21 HA GLU 21 -5.467 4.168 14.318 179 1HB GLU 21 1HB GLU 21 -5.740 6.618 13.930 180 2HB GLU 21 2HB GLU 21 -7.119 6.303 12.896 181 1HG GLU 21 1HG GLU 21 -8.479 5.577 14.691 182 2HG GLU 21 2HG GLU 21 -7.107 5.174 15.704 183 H VAL 22 H VAL 22 -6.851 3.853 11.093 184 HA VAL 22 HA VAL 22 -9.314 2.712 11.920 185 HB VAL 22 HB VAL 22 -7.779 2.757 9.321 186 1HG1 VAL 22 1HG1 VAL 22 -9.029 0.925 8.825 187 2HG1 VAL 22 2HG1 VAL 22 -10.245 1.275 10.077 188 3HG1 VAL 22 3HG1 VAL 22 -10.284 2.152 8.529 189 1HG2 VAL 22 1HG2 VAL 22 -10.371 4.080 9.390 190 2HG2 VAL 22 2HG2 VAL 22 -9.273 4.718 10.638 191 3HG2 VAL 22 3HG2 VAL 22 -8.776 4.720 8.929 192 H PHE 23 H PHE 23 -6.333 1.275 10.404 193 HA PHE 23 HA PHE 23 -7.164 -1.360 10.880 194 1HB PHE 23 1HB PHE 23 -4.342 -0.162 10.617 195 2HB PHE 23 2HB PHE 23 -4.780 -1.818 10.248 196 HD1 PHE 23 HD1 PHE 23 -3.427 0.275 8.436 197 HD2 PHE 23 HD2 PHE 23 -7.455 -0.993 8.853 198 HE1 PHE 23 HE1 PHE 23 -3.878 0.925 6.054 199 HE2 PHE 23 HE2 PHE 23 -7.906 -0.344 6.471 200 HZ PHE 23 HZ PHE 23 -6.113 0.608 5.100 201 H ASN 24 H ASN 24 -5.045 0.927 12.702 202 HA ASN 24 HA ASN 24 -4.081 -0.880 14.520 203 1HB ASN 24 1HB ASN 24 -3.667 1.753 14.099 204 2HB ASN 24 2HB ASN 24 -4.812 1.921 15.415 205 1HD2 ASN 24 1HD2 ASN 24 -3.979 2.046 17.343 206 2HD2 ASN 24 2HD2 ASN 24 -2.488 1.359 17.897 207 H LYS 25 H LYS 25 -7.158 0.971 14.338 208 HA LYS 25 HA LYS 25 -8.075 0.650 16.912 209 1HB LYS 25 1HB LYS 25 -9.197 1.283 14.276 210 2HB LYS 25 2HB LYS 25 -10.344 0.481 15.329 211 1HG LYS 25 1HG LYS 25 -9.812 2.143 17.144 212 2HG LYS 25 2HG LYS 25 -8.713 2.962 16.052 213 1HD LYS 25 1HD LYS 25 -10.412 4.030 14.970 214 2HD LYS 25 2HD LYS 25 -11.343 2.555 14.805 215 1HE LYS 25 1HE LYS 25 -11.733 2.915 17.445 216 2HE LYS 25 2HE LYS 25 -11.377 4.582 17.040 217 1HZ LYS 25 1HZ LYS 25 -13.087 3.811 15.107 218 2HZ LYS 25 2HZ LYS 25 -13.680 3.048 16.424 219 3HZ LYS 25 3HZ LYS 25 -13.488 4.669 16.438 220 H GLU 26 H GLU 26 -7.503 -1.734 14.433 221 HA GLU 26 HA GLU 26 -9.276 -3.608 15.728 222 1HB GLU 26 1HB GLU 26 -7.532 -3.846 13.238 223 2HB GLU 26 2HB GLU 26 -8.557 -5.133 13.840 224 1HG GLU 26 1HG GLU 26 -9.878 -2.465 13.489 225 2HG GLU 26 2HG GLU 26 -9.387 -3.275 12.014 226 H GLY 27 H GLY 27 -5.943 -2.591 15.709 227 1HA GLY 27 1HA GLY 27 -4.438 -3.253 17.361 228 2HA GLY 27 2HA GLY 27 -5.282 -4.778 17.545 229 H TYR 28 H TYR 28 -4.654 -3.567 14.280 230 HA TYR 28 HA TYR 28 -3.060 -5.887 13.729 231 1HB TYR 28 1HB TYR 28 -3.797 -3.350 12.138 232 2HB TYR 28 2HB TYR 28 -3.156 -4.815 11.421 233 HD1 TYR 28 HD1 TYR 28 -5.681 -3.575 10.488 234 HD2 TYR 28 HD2 TYR 28 -4.996 -6.464 13.569 235 HE1 TYR 28 HE1 TYR 28 -8.044 -4.466 10.188 236 HE2 TYR 28 HE2 TYR 28 -7.361 -7.345 13.258 237 HH TYR 28 HH TYR 28 -9.051 -7.171 10.900 238 H GLN 29 H GLN 29 -0.869 -5.958 13.090 239 HA GLN 29 HA GLN 29 0.676 -3.839 14.224 240 1HB GLN 29 1HB GLN 29 1.039 -6.643 13.627 241 2HB GLN 29 2HB GLN 29 2.334 -5.746 12.858 242 1HG GLN 29 1HG GLN 29 3.036 -4.759 14.941 243 2HG GLN 29 2HG GLN 29 1.557 -5.227 15.755 244 1HE2 GLN 29 1HE2 GLN 29 4.739 -6.052 14.985 245 2HE2 GLN 29 2HE2 GLN 29 4.783 -7.674 15.590 246 H THR 30 H THR 30 1.254 -2.042 13.090 247 HA THR 30 HA THR 30 1.729 -2.380 10.203 248 HB THR 30 HB THR 30 0.720 -0.056 9.994 249 HG1 THR 30 HG1 THR 30 -0.113 -0.734 12.722 250 1HG2 THR 30 1HG2 THR 30 -1.211 -1.908 11.468 251 2HG2 THR 30 2HG2 THR 30 -1.594 -0.716 10.203 252 3HG2 THR 30 3HG2 THR 30 -0.721 -2.209 9.783 253 H PHE 31 H PHE 31 3.261 -0.860 9.256 254 HA PHE 31 HA PHE 31 4.944 0.515 11.175 255 1HB PHE 31 1HB PHE 31 5.499 -2.099 10.337 256 2HB PHE 31 2HB PHE 31 6.347 -1.169 9.118 257 HD1 PHE 31 HD1 PHE 31 8.237 0.267 9.740 258 HD2 PHE 31 HD2 PHE 31 6.259 -2.132 12.628 259 HE1 PHE 31 HE1 PHE 31 10.166 0.573 11.316 260 HE2 PHE 31 HE2 PHE 31 8.189 -1.826 14.204 261 HZ PHE 31 HZ PHE 31 10.119 -0.478 13.529 262 H GLN 32 H GLN 32 6.667 1.847 10.007 263 HA GLN 32 HA GLN 32 5.609 2.609 7.396 264 1HB GLN 32 1HB GLN 32 5.157 4.539 8.566 265 2HB GLN 32 2HB GLN 32 6.376 4.222 9.784 266 1HG GLN 32 1HG GLN 32 8.143 5.069 8.422 267 2HG GLN 32 2HG GLN 32 7.206 4.921 6.948 268 1HE2 GLN 32 1HE2 GLN 32 8.085 6.882 9.585 269 2HE2 GLN 32 2HE2 GLN 32 7.110 8.273 9.247 270 H ALA 33 H ALA 33 7.140 3.147 5.732 271 HA ALA 33 HA ALA 33 9.947 2.708 6.409 272 1HB ALA 33 1HB ALA 33 10.167 0.828 5.168 273 2HB ALA 33 2HB ALA 33 8.399 0.689 5.320 274 3HB ALA 33 3HB ALA 33 9.111 1.449 3.877 275 H ALA 34 H ALA 34 11.405 3.503 4.637 276 HA ALA 34 HA ALA 34 10.047 5.518 2.987 277 1HB ALA 34 1HB ALA 34 11.534 7.178 3.648 278 2HB ALA 34 2HB ALA 34 11.343 6.271 5.168 279 3HB ALA 34 3HB ALA 34 12.780 6.010 4.150 280 H ASN 35 H ASN 35 10.782 2.758 2.326 281 HA ASN 35 HA ASN 35 12.186 3.327 -0.024 282 1HB ASN 35 1HB ASN 35 13.669 1.940 2.240 283 2HB ASN 35 2HB ASN 35 14.039 1.513 0.581 284 1HD2 ASN 35 1HD2 ASN 35 14.269 3.489 -0.911 285 2HD2 ASN 35 2HD2 ASN 35 15.274 4.778 -0.335 286 H GLY 36 H GLY 36 12.551 1.128 -1.272 287 1HA GLY 36 1HA GLY 36 10.204 -0.488 -0.932 288 2HA GLY 36 2HA GLY 36 11.450 -0.648 -2.153 289 H LEU 37 H LEU 37 13.786 -0.950 -0.576 290 HA LEU 37 HA LEU 37 13.643 -3.671 0.030 291 1HB LEU 37 1HB LEU 37 15.607 -1.705 -0.308 292 2HB LEU 37 2HB LEU 37 15.843 -2.304 1.322 293 HG LEU 37 HG LEU 37 15.747 -4.027 -1.170 294 1HD1 LEU 37 1HD1 LEU 37 18.053 -2.897 0.415 295 2HD1 LEU 37 2HD1 LEU 37 18.216 -4.341 -0.612 296 3HD1 LEU 37 3HD1 LEU 37 17.735 -2.786 -1.333 297 1HD2 LEU 37 1HD2 LEU 37 16.691 -4.883 1.563 298 2HD2 LEU 37 2HD2 LEU 37 14.990 -5.034 1.062 299 3HD2 LEU 37 3HD2 LEU 37 16.264 -5.886 0.156 300 H GLN 38 H GLN 38 13.789 -0.746 2.171 301 HA GLN 38 HA GLN 38 13.786 -2.078 4.545 302 1HB GLN 38 1HB GLN 38 13.064 0.636 3.595 303 2HB GLN 38 2HB GLN 38 12.271 0.182 5.090 304 1HG GLN 38 1HG GLN 38 14.350 -0.182 6.224 305 2HG GLN 38 2HG GLN 38 15.256 -0.262 4.726 306 1HE2 GLN 38 1HE2 GLN 38 14.366 1.636 7.304 307 2HE2 GLN 38 2HE2 GLN 38 14.770 3.209 6.701 308 H ALA 39 H ALA 39 11.153 -1.555 2.233 309 HA ALA 39 HA ALA 39 9.112 -2.289 4.126 310 1HB ALA 39 1HB ALA 39 9.282 -0.975 1.599 311 2HB ALA 39 2HB ALA 39 8.262 -2.417 1.377 312 3HB ALA 39 3HB ALA 39 7.843 -1.213 2.619 313 H LEU 40 H LEU 40 11.182 -3.803 1.658 314 HA LEU 40 HA LEU 40 9.660 -6.161 1.397 315 1HB LEU 40 1HB LEU 40 12.508 -5.408 0.785 316 2HB LEU 40 2HB LEU 40 11.916 -7.040 0.544 317 HG LEU 40 HG LEU 40 11.055 -4.512 -0.862 318 1HD1 LEU 40 1HD1 LEU 40 11.472 -6.312 -2.805 319 2HD1 LEU 40 2HD1 LEU 40 12.762 -5.287 -2.132 320 3HD1 LEU 40 3HD1 LEU 40 12.574 -6.965 -1.569 321 1HD2 LEU 40 1HD2 LEU 40 9.541 -7.066 -0.511 322 2HD2 LEU 40 2HD2 LEU 40 8.956 -5.389 -0.621 323 3HD2 LEU 40 3HD2 LEU 40 9.485 -6.244 -2.089 324 H ASP 41 H ASP 41 12.493 -5.230 3.448 325 HA ASP 41 HA ASP 41 12.760 -7.721 4.621 326 1HB ASP 41 1HB ASP 41 13.842 -5.049 4.924 327 2HB ASP 41 2HB ASP 41 13.461 -5.671 6.518 328 H ILE 42 H ILE 42 10.922 -4.729 5.509 329 HA ILE 42 HA ILE 42 9.955 -5.821 7.956 330 HB ILE 42 HB ILE 42 9.343 -3.365 6.332 331 1HG1 ILE 42 1HG1 ILE 42 11.140 -4.066 8.527 332 2HG1 ILE 42 2HG1 ILE 42 11.183 -2.705 7.424 333 1HG2 ILE 42 1HG2 ILE 42 7.266 -4.252 7.452 334 2HG2 ILE 42 2HG2 ILE 42 8.093 -4.010 9.010 335 3HG2 ILE 42 3HG2 ILE 42 7.771 -2.618 7.947 336 1HD1 ILE 42 1HD1 ILE 42 9.295 -1.648 8.773 337 2HD1 ILE 42 2HD1 ILE 42 9.505 -2.960 9.957 338 3HD1 ILE 42 3HD1 ILE 42 10.835 -1.817 9.649 339 H VAL 43 H VAL 43 9.080 -6.030 4.572 340 HA VAL 43 HA VAL 43 6.341 -6.499 4.855 341 HB VAL 43 HB VAL 43 8.444 -6.831 2.829 342 1HG1 VAL 43 1HG1 VAL 43 7.778 -9.062 2.585 343 2HG1 VAL 43 2HG1 VAL 43 6.072 -8.694 2.934 344 3HG1 VAL 43 3HG1 VAL 43 6.790 -8.199 1.382 345 1HG2 VAL 43 1HG2 VAL 43 7.215 -5.286 1.770 346 2HG2 VAL 43 2HG2 VAL 43 5.722 -6.241 1.937 347 3HG2 VAL 43 3HG2 VAL 43 6.253 -5.181 3.264 348 H THR 44 H THR 44 9.221 -8.521 5.379 349 HA THR 44 HA THR 44 7.554 -10.894 5.682 350 HB THR 44 HB THR 44 10.584 -10.519 5.923 351 HG1 THR 44 HG1 THR 44 10.509 -10.815 3.671 352 1HG2 THR 44 1HG2 THR 44 9.192 -12.739 6.637 353 2HG2 THR 44 2HG2 THR 44 9.223 -12.994 4.876 354 3HG2 THR 44 3HG2 THR 44 10.749 -12.844 5.781 355 H LYS 45 H LYS 45 9.383 -8.509 7.598 356 HA LYS 45 HA LYS 45 9.230 -10.023 9.995 357 1HB LYS 45 1HB LYS 45 10.536 -7.693 9.083 358 2HB LYS 45 2HB LYS 45 9.518 -7.172 10.410 359 1HG LYS 45 1HG LYS 45 10.631 -9.621 11.294 360 2HG LYS 45 2HG LYS 45 11.951 -8.812 10.474 361 1HD LYS 45 1HD LYS 45 10.703 -6.769 11.983 362 2HD LYS 45 2HD LYS 45 10.688 -8.163 13.043 363 1HE LYS 45 1HE LYS 45 13.262 -7.801 11.606 364 2HE LYS 45 2HE LYS 45 12.858 -6.461 12.660 365 1HZ LYS 45 1HZ LYS 45 13.965 -8.740 13.470 366 2HZ LYS 45 2HZ LYS 45 13.145 -7.723 14.450 367 3HZ LYS 45 3HZ LYS 45 12.397 -9.031 13.820 368 H GLU 46 H GLU 46 7.398 -7.182 8.672 369 HA GLU 46 HA GLU 46 5.548 -7.391 10.838 370 1HB GLU 46 1HB GLU 46 6.018 -5.524 8.541 371 2HB GLU 46 2HB GLU 46 4.382 -5.598 9.164 372 1HG GLU 46 1HG GLU 46 6.344 -5.488 11.349 373 2HG GLU 46 2HG GLU 46 6.543 -4.135 10.254 374 H ARG 47 H ARG 47 6.019 -8.979 7.861 375 HA ARG 47 HA ARG 47 4.664 -9.934 6.398 376 1HB ARG 47 1HB ARG 47 3.305 -11.775 7.519 377 2HB ARG 47 2HB ARG 47 4.974 -11.690 8.047 378 1HG ARG 47 1HG ARG 47 4.399 -10.684 10.132 379 2HG ARG 47 2HG ARG 47 2.822 -10.176 9.561 380 1HD ARG 47 1HD ARG 47 2.773 -12.182 11.125 381 2HD ARG 47 2HD ARG 47 1.971 -12.446 9.589 382 HE ARG 47 HE ARG 47 4.805 -13.217 9.586 383 1HH1 ARG 47 1HH1 ARG 47 1.511 -14.282 10.216 384 2HH1 ARG 47 2HH1 ARG 47 1.880 -15.963 10.017 385 1HH2 ARG 47 1HH2 ARG 47 5.293 -15.434 9.324 386 2HH2 ARG 47 2HH2 ARG 47 4.046 -16.622 9.507 387 HA PRO 48 HA PRO 48 0.970 -7.286 7.153 388 1HB PRO 48 1HB PRO 48 1.376 -5.398 5.218 389 2HB PRO 48 2HB PRO 48 1.841 -5.170 6.892 390 1HG PRO 48 1HG PRO 48 3.555 -5.753 4.556 391 2HG PRO 48 2HG PRO 48 4.014 -5.111 6.120 392 1HD PRO 48 1HD PRO 48 4.390 -7.799 5.190 393 2HD PRO 48 2HD PRO 48 4.742 -7.186 6.794 394 H ASP 49 H ASP 49 -1.014 -7.119 5.979 395 HA ASP 49 HA ASP 49 -0.920 -9.043 3.817 396 1HB ASP 49 1HB ASP 49 -3.479 -7.864 4.907 397 2HB ASP 49 2HB ASP 49 -3.200 -9.468 4.258 398 H LEU 50 H LEU 50 -0.605 -5.765 4.219 399 HA LEU 50 HA LEU 50 -1.301 -5.177 1.547 400 1HB LEU 50 1HB LEU 50 -3.506 -5.169 3.084 401 2HB LEU 50 2HB LEU 50 -2.958 -3.530 3.374 402 HG LEU 50 HG LEU 50 -4.642 -3.904 1.494 403 1HD1 LEU 50 1HD1 LEU 50 -2.067 -2.376 1.108 404 2HD1 LEU 50 2HD1 LEU 50 -3.430 -2.264 -0.031 405 3HD1 LEU 50 3HD1 LEU 50 -3.647 -1.778 1.667 406 1HD2 LEU 50 1HD2 LEU 50 -4.019 -4.810 -0.547 407 2HD2 LEU 50 2HD2 LEU 50 -2.279 -4.660 -0.204 408 3HD2 LEU 50 3HD2 LEU 50 -3.244 -5.908 0.621 409 H VAL 51 H VAL 51 0.219 -3.745 0.912 410 HA VAL 51 HA VAL 51 1.193 -1.869 2.949 411 HB VAL 51 HB VAL 51 2.893 -3.460 2.835 412 1HG1 VAL 51 1HG1 VAL 51 3.743 -3.848 0.236 413 2HG1 VAL 51 2HG1 VAL 51 2.741 -4.974 1.184 414 3HG1 VAL 51 3HG1 VAL 51 1.970 -3.817 0.071 415 1HG2 VAL 51 1HG2 VAL 51 3.792 -1.505 0.706 416 2HG2 VAL 51 2HG2 VAL 51 3.563 -1.029 2.406 417 3HG2 VAL 51 3HG2 VAL 51 4.759 -2.279 1.986 418 H LEU 52 H LEU 52 1.713 0.231 2.189 419 HA LEU 52 HA LEU 52 0.761 0.725 -0.547 420 1HB LEU 52 1HB LEU 52 -0.082 2.813 0.159 421 2HB LEU 52 2HB LEU 52 -0.686 1.594 1.263 422 HG LEU 52 HG LEU 52 1.706 2.583 2.415 423 1HD1 LEU 52 1HD1 LEU 52 0.693 5.048 2.632 424 2HD1 LEU 52 2HD1 LEU 52 1.886 4.599 1.389 425 3HD1 LEU 52 3HD1 LEU 52 0.156 4.675 0.977 426 1HD2 LEU 52 1HD2 LEU 52 -0.307 3.725 3.869 427 2HD2 LEU 52 2HD2 LEU 52 -1.164 2.406 3.036 428 3HD2 LEU 52 3HD2 LEU 52 0.261 2.046 4.040 429 H LEU 53 H LEU 53 1.981 2.104 -1.891 430 HA LEU 53 HA LEU 53 4.443 3.173 -0.786 431 1HB LEU 53 1HB LEU 53 5.043 0.910 -1.432 432 2HB LEU 53 2HB LEU 53 4.380 1.158 -3.035 433 HG LEU 53 HG LEU 53 6.874 1.266 -2.892 434 1HD1 LEU 53 1HD1 LEU 53 6.885 2.554 -4.716 435 2HD1 LEU 53 2HD1 LEU 53 5.135 2.728 -4.445 436 3HD1 LEU 53 3HD1 LEU 53 6.257 3.969 -3.838 437 1HD2 LEU 53 1HD2 LEU 53 7.030 4.006 -1.955 438 2HD2 LEU 53 2HD2 LEU 53 6.390 2.922 -0.697 439 3HD2 LEU 53 3HD2 LEU 53 7.960 2.572 -1.459 440 H ASP 54 H ASP 54 4.868 5.162 -1.629 441 HA ASP 54 HA ASP 54 3.079 6.011 -3.726 442 1HB ASP 54 1HB ASP 54 3.213 8.057 -2.735 443 2HB ASP 54 2HB ASP 54 3.992 7.221 -1.406 444 H MET 55 H MET 55 3.833 6.488 -5.829 445 HA MET 55 HA MET 55 5.950 5.434 -6.924 446 1HB MET 55 1HB MET 55 5.894 7.370 -8.592 447 2HB MET 55 2HB MET 55 4.311 6.714 -8.224 448 1HG MET 55 1HG MET 55 5.297 8.979 -6.497 449 2HG MET 55 2HG MET 55 4.825 9.370 -8.138 450 1HE MET 55 1HE MET 55 2.722 9.410 -4.638 451 2HE MET 55 2HE MET 55 2.622 7.634 -4.700 452 3HE MET 55 3HE MET 55 4.203 8.441 -4.824 453 H LYS 56 H LYS 56 6.001 8.458 -4.998 454 HA LYS 56 HA LYS 56 8.625 9.203 -5.660 455 1HB LYS 56 1HB LYS 56 6.614 10.451 -4.444 456 2HB LYS 56 2HB LYS 56 7.428 9.881 -3.001 457 1HG LYS 56 1HG LYS 56 8.689 11.779 -3.242 458 2HG LYS 56 2HG LYS 56 9.584 10.825 -4.408 459 1HD LYS 56 1HD LYS 56 7.134 12.136 -5.494 460 2HD LYS 56 2HD LYS 56 8.384 13.246 -4.966 461 1HE LYS 56 1HE LYS 56 10.049 12.131 -6.410 462 2HE LYS 56 2HE LYS 56 8.886 10.900 -6.859 463 1HZ LYS 56 1HZ LYS 56 8.505 13.765 -7.382 464 2HZ LYS 56 2HZ LYS 56 9.099 12.706 -8.475 465 3HZ LYS 56 3HZ LYS 56 7.570 12.542 -7.926 466 H ILE 57 H ILE 57 10.534 9.147 -4.181 467 HA ILE 57 HA ILE 57 10.899 7.729 -1.966 468 HB ILE 57 HB ILE 57 10.190 5.901 -4.113 469 1HG1 ILE 57 1HG1 ILE 57 9.229 6.147 -1.751 470 2HG1 ILE 57 2HG1 ILE 57 9.505 4.526 -2.357 471 1HG2 ILE 57 1HG2 ILE 57 12.877 5.618 -2.791 472 2HG2 ILE 57 2HG2 ILE 57 11.937 4.185 -3.273 473 3HG2 ILE 57 3HG2 ILE 57 12.421 5.385 -4.496 474 1HD1 ILE 57 1HD1 ILE 57 11.001 6.043 -0.233 475 2HD1 ILE 57 2HD1 ILE 57 10.500 4.335 -0.266 476 3HD1 ILE 57 3HD1 ILE 57 11.909 4.868 -1.214 477 HA PRO 58 HA PRO 58 14.837 9.103 -3.106 478 1HB PRO 58 1HB PRO 58 16.269 8.274 -0.931 479 2HB PRO 58 2HB PRO 58 15.309 9.740 -0.945 480 1HG PRO 58 1HG PRO 58 14.718 7.149 0.350 481 2HG PRO 58 2HG PRO 58 14.010 8.721 0.665 482 1HD PRO 58 1HD PRO 58 12.818 6.565 -0.805 483 2HD PRO 58 2HD PRO 58 12.161 8.175 -0.587 484 H GLY 59 H GLY 59 16.243 8.462 -4.610 485 1HA GLY 59 1HA GLY 59 17.686 7.079 -5.659 486 2HA GLY 59 2HA GLY 59 17.667 6.019 -4.264 487 H MET 60 H MET 60 16.648 6.437 -7.519 488 HA MET 60 HA MET 60 15.404 5.290 -8.886 489 1HB MET 60 1HB MET 60 16.883 3.459 -7.441 490 2HB MET 60 2HB MET 60 15.268 2.859 -7.119 491 1HG MET 60 1HG MET 60 14.952 3.123 -9.752 492 2HG MET 60 2HG MET 60 16.704 3.091 -9.776 493 1HE MET 60 1HE MET 60 13.670 0.028 -8.620 494 2HE MET 60 2HE MET 60 14.467 0.536 -7.112 495 3HE MET 60 3HE MET 60 13.705 1.749 -8.168 496 H ASP 61 H ASP 61 13.348 6.152 -8.983 497 HA ASP 61 HA ASP 61 11.568 6.384 -7.016 498 1HB ASP 61 1HB ASP 61 9.890 5.821 -9.133 499 2HB ASP 61 2HB ASP 61 10.657 7.372 -8.859 500 H GLY 62 H GLY 62 9.275 5.126 -6.986 501 1HA GLY 62 1HA GLY 62 9.844 2.413 -6.267 502 2HA GLY 62 2HA GLY 62 8.299 3.238 -6.207 503 H ILE 63 H ILE 63 8.850 4.081 -9.194 504 HA ILE 63 HA ILE 63 7.181 2.339 -10.419 505 HB ILE 63 HB ILE 63 9.504 3.848 -11.622 506 1HG1 ILE 63 1HG1 ILE 63 6.718 4.855 -11.810 507 2HG1 ILE 63 2HG1 ILE 63 7.448 4.922 -10.218 508 1HG2 ILE 63 1HG2 ILE 63 8.989 2.751 -13.496 509 2HG2 ILE 63 2HG2 ILE 63 7.481 2.100 -12.810 510 3HG2 ILE 63 3HG2 ILE 63 7.505 3.734 -13.516 511 1HD1 ILE 63 1HD1 ILE 63 8.706 6.702 -10.821 512 2HD1 ILE 63 2HD1 ILE 63 9.399 5.790 -12.184 513 3HD1 ILE 63 3HD1 ILE 63 7.884 6.699 -12.400 514 H GLU 64 H GLU 64 10.720 2.014 -9.909 515 HA GLU 64 HA GLU 64 10.714 -0.441 -11.396 516 1HB GLU 64 1HB GLU 64 12.834 1.226 -10.019 517 2HB GLU 64 2HB GLU 64 13.195 -0.419 -10.502 518 1HG GLU 64 1HG GLU 64 11.849 0.903 -12.700 519 2HG GLU 64 2HG GLU 64 13.148 1.940 -12.145 520 H ILE 65 H ILE 65 11.158 0.699 -7.991 521 HA ILE 65 HA ILE 65 11.787 -1.655 -6.783 522 HB ILE 65 HB ILE 65 9.981 0.548 -5.780 523 1HG1 ILE 65 1HG1 ILE 65 12.985 0.175 -5.629 524 2HG1 ILE 65 2HG1 ILE 65 12.125 1.407 -6.532 525 1HG2 ILE 65 1HG2 ILE 65 10.041 -1.766 -4.564 526 2HG2 ILE 65 2HG2 ILE 65 11.638 -1.214 -4.005 527 3HG2 ILE 65 3HG2 ILE 65 10.185 -0.257 -3.630 528 1HD1 ILE 65 1HD1 ILE 65 13.095 1.955 -4.126 529 2HD1 ILE 65 2HD1 ILE 65 11.505 2.595 -4.608 530 3HD1 ILE 65 3HD1 ILE 65 11.606 1.156 -3.565 531 H LEU 66 H LEU 66 8.405 -0.366 -7.163 532 HA LEU 66 HA LEU 66 7.137 -2.649 -6.290 533 1HB LEU 66 1HB LEU 66 6.220 -0.606 -8.319 534 2HB LEU 66 2HB LEU 66 5.185 -1.776 -7.524 535 HG LEU 66 HG LEU 66 4.770 -0.109 -6.087 536 1HD1 LEU 66 1HD1 LEU 66 7.555 -0.614 -5.017 537 2HD1 LEU 66 2HD1 LEU 66 6.112 -0.087 -4.119 538 3HD1 LEU 66 3HD1 LEU 66 6.188 -1.732 -4.795 539 1HD2 LEU 66 1HD2 LEU 66 7.353 1.354 -6.235 540 2HD2 LEU 66 2HD2 LEU 66 6.355 1.320 -7.709 541 3HD2 LEU 66 3HD2 LEU 66 5.681 1.962 -6.192 542 H LYS 67 H LYS 67 8.393 -1.782 -9.545 543 HA LYS 67 HA LYS 67 7.243 -3.851 -10.966 544 1HB LYS 67 1HB LYS 67 9.148 -1.801 -11.399 545 2HB LYS 67 2HB LYS 67 9.914 -3.293 -11.906 546 1HG LYS 67 1HG LYS 67 7.355 -3.604 -12.941 547 2HG LYS 67 2HG LYS 67 7.582 -1.872 -13.082 548 1HD LYS 67 1HD LYS 67 8.559 -2.522 -15.082 549 2HD LYS 67 2HD LYS 67 9.976 -2.598 -14.054 550 1HE LYS 67 1HE LYS 67 8.649 -5.118 -13.766 551 2HE LYS 67 2HE LYS 67 8.642 -4.757 -15.480 552 1HZ LYS 67 1HZ LYS 67 10.673 -5.874 -14.425 553 2HZ LYS 67 2HZ LYS 67 10.910 -4.710 -15.545 554 3HZ LYS 67 3HZ LYS 67 11.093 -4.367 -13.959 555 H ARG 68 H ARG 68 10.615 -3.772 -9.599 556 HA ARG 68 HA ARG 68 11.150 -6.389 -10.098 557 1HB ARG 68 1HB ARG 68 12.188 -4.295 -8.232 558 2HB ARG 68 2HB ARG 68 12.579 -5.941 -7.775 559 1HG ARG 68 1HG ARG 68 13.623 -6.369 -9.952 560 2HG ARG 68 2HG ARG 68 13.075 -4.825 -10.573 561 1HD ARG 68 1HD ARG 68 15.135 -4.061 -9.926 562 2HD ARG 68 2HD ARG 68 14.442 -4.007 -8.317 563 HE ARG 68 HE ARG 68 15.923 -5.703 -7.736 564 1HH1 ARG 68 1HH1 ARG 68 15.177 -6.020 -11.160 565 2HH1 ARG 68 2HH1 ARG 68 16.211 -7.390 -11.390 566 1HH2 ARG 68 1HH2 ARG 68 17.288 -7.511 -8.038 567 2HH2 ARG 68 2HH2 ARG 68 17.420 -8.244 -9.602 568 H MET 69 H MET 69 9.326 -4.868 -7.430 569 HA MET 69 HA MET 69 9.369 -6.934 -5.629 570 1HB MET 69 1HB MET 69 7.898 -4.468 -6.119 571 2HB MET 69 2HB MET 69 6.752 -5.700 -5.630 572 1HG MET 69 1HG MET 69 7.545 -5.762 -3.478 573 2HG MET 69 2HG MET 69 9.220 -5.721 -3.992 574 1HE MET 69 1HE MET 69 6.858 -3.897 -1.890 575 2HE MET 69 2HE MET 69 6.625 -2.287 -2.613 576 3HE MET 69 3HE MET 69 5.979 -3.731 -3.429 577 H LYS 70 H LYS 70 6.864 -6.214 -8.170 578 HA LYS 70 HA LYS 70 5.453 -8.612 -7.669 579 1HB LYS 70 1HB LYS 70 3.978 -7.870 -9.267 580 2HB LYS 70 2HB LYS 70 4.694 -6.357 -8.750 581 1HG LYS 70 1HG LYS 70 4.746 -6.267 -11.136 582 2HG LYS 70 2HG LYS 70 6.393 -6.643 -10.669 583 1HD LYS 70 1HD LYS 70 6.332 -8.607 -11.804 584 2HD LYS 70 2HD LYS 70 4.902 -9.122 -10.933 585 1HE LYS 70 1HE LYS 70 3.420 -8.181 -12.538 586 2HE LYS 70 2HE LYS 70 4.639 -7.093 -13.172 587 1HZ LYS 70 1HZ LYS 70 4.361 -8.877 -14.670 588 2HZ LYS 70 2HZ LYS 70 5.822 -9.083 -13.970 589 3HZ LYS 70 3HZ LYS 70 4.558 -10.008 -13.509 590 H VAL 71 H VAL 71 7.978 -7.595 -10.029 591 HA VAL 71 HA VAL 71 7.906 -9.903 -11.585 592 HB VAL 71 HB VAL 71 10.275 -8.133 -10.957 593 1HG1 VAL 71 1HG1 VAL 71 11.328 -9.575 -12.316 594 2HG1 VAL 71 2HG1 VAL 71 9.804 -10.335 -12.834 595 3HG1 VAL 71 3HG1 VAL 71 10.373 -8.848 -13.630 596 1HG2 VAL 71 1HG2 VAL 71 9.393 -6.455 -12.157 597 2HG2 VAL 71 2HG2 VAL 71 8.780 -7.557 -13.413 598 3HG2 VAL 71 3HG2 VAL 71 7.831 -7.278 -11.933 599 H ILE 72 H ILE 72 9.301 -9.200 -8.396 600 HA ILE 72 HA ILE 72 10.918 -11.571 -8.406 601 HB ILE 72 HB ILE 72 10.280 -9.405 -6.434 602 1HG1 ILE 72 1HG1 ILE 72 12.045 -9.304 -8.351 603 2HG1 ILE 72 2HG1 ILE 72 12.450 -8.709 -6.754 604 1HG2 ILE 72 1HG2 ILE 72 12.038 -10.707 -4.985 605 2HG2 ILE 72 2HG2 ILE 72 10.307 -11.108 -4.892 606 3HG2 ILE 72 3HG2 ILE 72 11.404 -12.122 -5.860 607 1HD1 ILE 72 1HD1 ILE 72 13.958 -10.398 -6.349 608 2HD1 ILE 72 2HD1 ILE 72 12.973 -11.616 -7.193 609 3HD1 ILE 72 3HD1 ILE 72 13.991 -10.493 -8.126 610 H ASP 73 H ASP 73 7.847 -10.456 -6.843 611 HA ASP 73 HA ASP 73 7.164 -13.269 -6.623 612 1HB ASP 73 1HB ASP 73 5.954 -11.897 -4.422 613 2HB ASP 73 2HB ASP 73 7.138 -13.188 -4.361 614 H GLU 74 H GLU 74 5.176 -13.546 -7.652 615 HA GLU 74 HA GLU 74 3.682 -11.211 -8.325 616 1HB GLU 74 1HB GLU 74 2.836 -14.076 -8.868 617 2HB GLU 74 2HB GLU 74 2.444 -12.638 -9.790 618 1HG GLU 74 1HG GLU 74 5.229 -12.624 -9.852 619 2HG GLU 74 2HG GLU 74 4.872 -14.339 -9.893 620 H ASN 75 H ASN 75 3.709 -13.608 -5.799 621 HA ASN 75 HA ASN 75 0.947 -13.501 -5.240 622 1HB ASN 75 1HB ASN 75 1.841 -14.452 -2.944 623 2HB ASN 75 2HB ASN 75 2.013 -15.436 -4.384 624 1HD2 ASN 75 1HD2 ASN 75 3.808 -16.540 -3.977 625 2HD2 ASN 75 2HD2 ASN 75 5.377 -15.867 -3.683 626 H ILE 76 H ILE 76 3.672 -11.411 -4.748 627 HA ILE 76 HA ILE 76 3.095 -10.300 -2.261 628 HB ILE 76 HB ILE 76 5.180 -10.091 -3.669 629 1HG1 ILE 76 1HG1 ILE 76 3.910 -7.753 -2.243 630 2HG1 ILE 76 2HG1 ILE 76 5.091 -8.896 -1.634 631 1HG2 ILE 76 1HG2 ILE 76 3.685 -9.216 -5.659 632 2HG2 ILE 76 2HG2 ILE 76 3.991 -7.637 -4.897 633 3HG2 ILE 76 3HG2 ILE 76 5.356 -8.646 -5.435 634 1HD1 ILE 76 1HD1 ILE 76 5.627 -6.932 -3.910 635 2HD1 ILE 76 2HD1 ILE 76 6.093 -6.666 -2.213 636 3HD1 ILE 76 3HD1 ILE 76 6.818 -8.005 -3.135 637 H ARG 77 H ARG 77 1.803 -8.577 -1.579 638 HA ARG 77 HA ARG 77 -0.059 -7.657 -3.620 639 1HB ARG 77 1HB ARG 77 -1.430 -8.952 -2.198 640 2HB ARG 77 2HB ARG 77 -0.499 -8.560 -0.767 641 1HG ARG 77 1HG ARG 77 -1.565 -6.502 -0.454 642 2HG ARG 77 2HG ARG 77 -1.894 -6.286 -2.162 643 1HD ARG 77 1HD ARG 77 -4.011 -6.749 -1.047 644 2HD ARG 77 2HD ARG 77 -3.608 -8.142 -2.031 645 HE ARG 77 HE ARG 77 -2.603 -8.342 0.715 646 1HH1 ARG 77 1HH1 ARG 77 -5.355 -8.930 -1.398 647 2HH1 ARG 77 2HH1 ARG 77 -6.042 -10.148 -0.376 648 1HH2 ARG 77 1HH2 ARG 77 -3.510 -9.949 2.063 649 2HH2 ARG 77 2HH2 ARG 77 -4.986 -10.731 1.606 650 H VAL 78 H VAL 78 0.333 -5.507 -4.052 651 HA VAL 78 HA VAL 78 0.762 -3.742 -1.770 652 HB VAL 78 HB VAL 78 2.906 -4.611 -3.118 653 1HG1 VAL 78 1HG1 VAL 78 3.508 -3.395 -4.977 654 2HG1 VAL 78 2HG1 VAL 78 1.746 -3.485 -5.212 655 3HG1 VAL 78 3HG1 VAL 78 2.481 -2.008 -4.543 656 1HG2 VAL 78 1HG2 VAL 78 2.277 -2.475 -1.363 657 2HG2 VAL 78 2HG2 VAL 78 3.865 -3.224 -1.660 658 3HG2 VAL 78 3HG2 VAL 78 3.352 -1.813 -2.617 659 H ILE 79 H ILE 79 0.157 -1.514 -2.219 660 HA ILE 79 HA ILE 79 -1.533 -1.318 -4.616 661 HB ILE 79 HB ILE 79 -2.035 -0.709 -1.771 662 1HG1 ILE 79 1HG1 ILE 79 -3.561 -1.704 -4.158 663 2HG1 ILE 79 2HG1 ILE 79 -3.310 -2.466 -2.601 664 1HG2 ILE 79 1HG2 ILE 79 -3.126 1.100 -3.944 665 2HG2 ILE 79 2HG2 ILE 79 -3.556 1.126 -2.217 666 3HG2 ILE 79 3HG2 ILE 79 -1.907 1.558 -2.730 667 1HD1 ILE 79 1HD1 ILE 79 -5.057 -0.024 -3.152 668 2HD1 ILE 79 2HD1 ILE 79 -5.617 -1.661 -2.734 669 3HD1 ILE 79 3HD1 ILE 79 -4.739 -0.688 -1.531 670 H ILE 80 H ILE 80 -1.437 0.603 -5.830 671 HA ILE 80 HA ILE 80 0.865 2.283 -5.130 672 HB ILE 80 HB ILE 80 1.226 2.649 -7.405 673 1HG1 ILE 80 1HG1 ILE 80 -0.402 1.684 -9.146 674 2HG1 ILE 80 2HG1 ILE 80 -1.567 1.585 -7.840 675 1HG2 ILE 80 1HG2 ILE 80 0.388 -0.173 -7.744 676 2HG2 ILE 80 2HG2 ILE 80 1.968 0.604 -8.007 677 3HG2 ILE 80 3HG2 ILE 80 1.449 0.177 -6.358 678 1HD1 ILE 80 1HD1 ILE 80 -1.984 3.809 -7.950 679 2HD1 ILE 80 2HD1 ILE 80 -0.251 4.193 -7.816 680 3HD1 ILE 80 3HD1 ILE 80 -0.968 3.859 -9.411 681 H MET 81 H MET 81 0.677 4.614 -5.519 682 HA MET 81 HA MET 81 -2.073 5.521 -5.687 683 1HB MET 81 1HB MET 81 -0.758 7.206 -3.783 684 2HB MET 81 2HB MET 81 -2.071 6.090 -3.463 685 1HG MET 81 1HG MET 81 -0.430 4.241 -3.107 686 2HG MET 81 2HG MET 81 0.893 5.333 -3.465 687 1HE MET 81 1HE MET 81 1.863 4.526 -0.958 688 2HE MET 81 2HE MET 81 2.240 6.089 -1.721 689 3HE MET 81 3HE MET 81 1.847 6.017 0.013 690 H THR 82 H THR 82 -2.291 7.292 -7.016 691 HA THR 82 HA THR 82 -0.377 9.335 -7.215 692 HB THR 82 HB THR 82 1.108 7.918 -8.406 693 HG1 THR 82 HG1 THR 82 0.823 9.556 -9.905 694 1HG2 THR 82 1HG2 THR 82 -0.509 5.963 -8.630 695 2HG2 THR 82 2HG2 THR 82 -1.290 6.833 -9.973 696 3HG2 THR 82 3HG2 THR 82 0.403 6.302 -10.120 697 H ALA 83 H ALA 83 -1.241 11.128 -8.186 698 HA ALA 83 HA ALA 83 -4.011 11.104 -8.617 699 1HB ALA 83 1HB ALA 83 -3.764 13.388 -8.762 700 2HB ALA 83 2HB ALA 83 -2.205 12.990 -8.000 701 3HB ALA 83 3HB ALA 83 -2.291 13.277 -9.755 702 H TYR 84 H TYR 84 -5.144 11.724 -10.658 703 HA TYR 84 HA TYR 84 -4.381 9.995 -12.749 704 1HB TYR 84 1HB TYR 84 -6.341 11.254 -13.848 705 2HB TYR 84 2HB TYR 84 -6.724 10.624 -12.258 706 HD1 TYR 84 HD1 TYR 84 -6.162 13.650 -14.246 707 HD2 TYR 84 HD2 TYR 84 -6.967 12.137 -10.326 708 HE1 TYR 84 HE1 TYR 84 -6.843 15.977 -13.480 709 HE2 TYR 84 HE2 TYR 84 -7.645 14.469 -9.573 710 HH TYR 84 HH TYR 84 -7.623 17.182 -11.870 711 H GLY 85 H GLY 85 -2.057 11.261 -12.573 712 1HA GLY 85 1HA GLY 85 -2.099 13.218 -14.793 713 2HA GLY 85 2HA GLY 85 -1.054 13.374 -13.396 714 H GLU 86 H GLU 86 -0.393 10.549 -13.063 715 HA GLU 86 HA GLU 86 1.193 10.211 -15.489 716 1HB GLU 86 1HB GLU 86 2.696 8.850 -13.775 717 2HB GLU 86 2HB GLU 86 2.828 10.594 -13.886 718 1HG GLU 86 1HG GLU 86 1.511 10.941 -11.912 719 2HG GLU 86 2HG GLU 86 0.877 9.307 -11.942 720 H LEU 87 H LEU 87 -1.336 9.195 -15.636 721 HA LEU 87 HA LEU 87 -1.960 6.808 -14.542 722 1HB LEU 87 1HB LEU 87 -2.362 7.693 -17.403 723 2HB LEU 87 2HB LEU 87 -3.194 6.352 -16.641 724 HG LEU 87 HG LEU 87 -3.388 8.985 -15.266 725 1HD1 LEU 87 1HD1 LEU 87 -5.051 9.880 -16.737 726 2HD1 LEU 87 2HD1 LEU 87 -3.590 9.540 -17.694 727 3HD1 LEU 87 3HD1 LEU 87 -4.985 8.439 -17.779 728 1HD2 LEU 87 1HD2 LEU 87 -4.470 6.919 -14.419 729 2HD2 LEU 87 2HD2 LEU 87 -5.621 8.234 -14.760 730 3HD2 LEU 87 3HD2 LEU 87 -5.464 6.871 -15.895 731 H ASP 88 H ASP 88 0.540 7.505 -16.978 732 HA ASP 88 HA ASP 88 0.987 5.136 -18.090 733 1HB ASP 88 1HB ASP 88 2.714 7.391 -17.190 734 2HB ASP 88 2HB ASP 88 3.579 5.891 -17.462 735 H MET 89 H MET 89 2.166 6.264 -14.838 736 HA MET 89 HA MET 89 3.517 3.913 -14.224 737 1HB MET 89 1HB MET 89 4.030 5.901 -12.961 738 2HB MET 89 2HB MET 89 2.341 6.228 -12.624 739 1HG MET 89 1HG MET 89 3.357 5.367 -10.583 740 2HG MET 89 2HG MET 89 2.259 4.144 -11.192 741 1HE MET 89 1HE MET 89 4.872 2.351 -9.427 742 2HE MET 89 2HE MET 89 5.984 3.728 -9.608 743 3HE MET 89 3HE MET 89 4.281 4.011 -9.175 744 H ILE 90 H ILE 90 0.169 5.061 -13.478 745 HA ILE 90 HA ILE 90 -0.563 2.984 -11.806 746 HB ILE 90 HB ILE 90 -2.163 4.692 -13.708 747 1HG1 ILE 90 1HG1 ILE 90 -2.344 5.024 -10.771 748 2HG1 ILE 90 2HG1 ILE 90 -0.796 5.445 -11.476 749 1HG2 ILE 90 1HG2 ILE 90 -3.748 3.108 -13.429 750 2HG2 ILE 90 2HG2 ILE 90 -2.996 2.451 -11.955 751 3HG2 ILE 90 3HG2 ILE 90 -3.978 3.934 -11.869 752 1HD1 ILE 90 1HD1 ILE 90 -1.641 7.264 -12.592 753 2HD1 ILE 90 2HD1 ILE 90 -3.164 6.435 -12.993 754 3HD1 ILE 90 3HD1 ILE 90 -2.938 7.148 -11.378 755 H GLN 91 H GLN 91 -1.152 3.299 -15.383 756 HA GLN 91 HA GLN 91 -2.306 0.933 -15.822 757 1HB GLN 91 1HB GLN 91 -0.585 2.761 -17.405 758 2HB GLN 91 2HB GLN 91 -0.638 1.123 -18.025 759 1HG GLN 91 1HG GLN 91 -3.316 2.025 -17.235 760 2HG GLN 91 2HG GLN 91 -2.596 3.140 -18.379 761 1HE2 GLN 91 1HE2 GLN 91 -4.670 2.017 -19.351 762 2HE2 GLN 91 2HE2 GLN 91 -4.348 0.715 -20.447 763 H GLU 92 H GLU 92 1.259 1.550 -15.610 764 HA GLU 92 HA GLU 92 1.996 -1.066 -16.151 765 1HB GLU 92 1HB GLU 92 3.285 1.376 -15.615 766 2HB GLU 92 2HB GLU 92 3.820 0.328 -14.317 767 1HG GLU 92 1HG GLU 92 5.256 -0.691 -15.740 768 2HG GLU 92 2HG GLU 92 3.900 -1.257 -16.695 769 H SER 93 H SER 93 1.012 0.604 -13.147 770 HA SER 93 HA SER 93 1.927 -1.310 -11.373 771 1HB SER 93 1HB SER 93 0.880 -0.026 -9.781 772 2HB SER 93 2HB SER 93 0.798 1.124 -11.101 773 HG SER 93 HG SER 93 -1.359 0.572 -11.495 774 H LYS 94 H LYS 94 -1.181 -0.949 -13.175 775 HA LYS 94 HA LYS 94 -2.499 -3.078 -11.919 776 1HB LYS 94 1HB LYS 94 -3.048 -1.135 -13.907 777 2HB LYS 94 2HB LYS 94 -3.371 -2.693 -14.641 778 1HG LYS 94 1HG LYS 94 -4.419 -2.857 -11.992 779 2HG LYS 94 2HG LYS 94 -4.895 -1.281 -12.593 780 1HD LYS 94 1HD LYS 94 -5.402 -2.882 -14.800 781 2HD LYS 94 2HD LYS 94 -5.757 -3.985 -13.486 782 1HE LYS 94 1HE LYS 94 -6.864 -1.271 -13.045 783 2HE LYS 94 2HE LYS 94 -7.494 -2.039 -14.488 784 1HZ LYS 94 1HZ LYS 94 -7.593 -4.027 -12.726 785 2HZ LYS 94 2HZ LYS 94 -7.883 -2.751 -11.748 786 3HZ LYS 94 3HZ LYS 94 -8.842 -3.023 -13.041 787 H GLU 95 H GLU 95 -0.396 -2.864 -14.839 788 HA GLU 95 HA GLU 95 -0.767 -5.615 -15.414 789 1HB GLU 95 1HB GLU 95 0.343 -5.147 -17.364 790 2HB GLU 95 2HB GLU 95 -0.003 -3.489 -16.913 791 1HG GLU 95 1HG GLU 95 2.278 -3.649 -15.574 792 2HG GLU 95 2HG GLU 95 2.595 -5.024 -16.614 793 H LEU 96 H LEU 96 1.020 -3.894 -13.073 794 HA LEU 96 HA LEU 96 3.280 -5.680 -13.044 795 1HB LEU 96 1HB LEU 96 2.557 -3.118 -11.929 796 2HB LEU 96 2HB LEU 96 3.168 -4.176 -10.672 797 HG LEU 96 HG LEU 96 5.205 -4.587 -12.061 798 1HD1 LEU 96 1HD1 LEU 96 4.032 -3.968 -14.234 799 2HD1 LEU 96 2HD1 LEU 96 4.303 -2.270 -13.775 800 3HD1 LEU 96 3HD1 LEU 96 5.690 -3.360 -14.012 801 1HD2 LEU 96 1HD2 LEU 96 5.377 -3.020 -10.278 802 2HD2 LEU 96 2HD2 LEU 96 6.184 -2.299 -11.692 803 3HD2 LEU 96 3HD2 LEU 96 4.556 -1.753 -11.222 804 H GLY 97 H GLY 97 0.023 -5.623 -11.867 805 1HA GLY 97 1HA GLY 97 -0.875 -7.645 -10.997 806 2HA GLY 97 2HA GLY 97 0.639 -7.956 -10.170 807 H ALA 98 H ALA 98 -0.479 -4.627 -10.180 808 HA ALA 98 HA ALA 98 -0.695 -4.653 -7.342 809 1HB ALA 98 1HB ALA 98 -1.548 -2.440 -9.234 810 2HB ALA 98 2HB ALA 98 -0.934 -2.298 -7.569 811 3HB ALA 98 3HB ALA 98 0.163 -2.783 -8.884 812 H LEU 99 H LEU 99 -2.531 -4.577 -6.040 813 HA LEU 99 HA LEU 99 -4.827 -5.801 -7.001 814 1HB LEU 99 1HB LEU 99 -4.898 -4.021 -4.602 815 2HB LEU 99 2HB LEU 99 -5.659 -5.578 -4.865 816 HG LEU 99 HG LEU 99 -4.042 -6.228 -3.416 817 1HD1 LEU 99 1HD1 LEU 99 -2.748 -7.647 -4.563 818 2HD1 LEU 99 2HD1 LEU 99 -3.518 -6.953 -6.009 819 3HD1 LEU 99 3HD1 LEU 99 -1.939 -6.341 -5.461 820 1HD2 LEU 99 1HD2 LEU 99 -2.686 -3.749 -4.283 821 2HD2 LEU 99 2HD2 LEU 99 -2.892 -4.447 -2.659 822 3HD2 LEU 99 3HD2 LEU 99 -1.617 -5.063 -3.738 823 H THR 100 H THR 100 -4.191 -2.306 -6.252 824 HA THR 100 HA THR 100 -5.928 -1.537 -8.409 825 HB THR 100 HB THR 100 -7.679 -1.903 -6.787 826 HG1 THR 100 HG1 THR 100 -8.343 0.248 -6.844 827 1HG2 THR 100 1HG2 THR 100 -7.152 -0.240 -4.602 828 2HG2 THR 100 2HG2 THR 100 -7.045 -2.017 -4.579 829 3HG2 THR 100 3HG2 THR 100 -5.585 -1.041 -4.870 830 H HIS 101 H HIS 101 -6.154 1.013 -8.331 831 HA HIS 101 HA HIS 101 -3.642 2.084 -7.297 832 1HB HIS 101 1HB HIS 101 -3.469 3.402 -9.456 833 2HB HIS 101 2HB HIS 101 -3.067 1.699 -9.535 834 HD1 HIS 101 HD1 HIS 101 -4.180 0.398 -11.363 835 HD2 HIS 101 HD2 HIS 101 -6.278 3.902 -10.406 836 HE1 HIS 101 HE1 HIS 101 -6.089 0.571 -13.048 837 H PHE 102 H PHE 102 -4.005 3.851 -6.053 838 HA PHE 102 HA PHE 102 -6.599 5.167 -6.390 839 1HB PHE 102 1HB PHE 102 -4.527 5.142 -4.113 840 2HB PHE 102 2HB PHE 102 -6.098 5.913 -4.016 841 HD1 PHE 102 HD1 PHE 102 -4.789 3.622 -2.312 842 HD2 PHE 102 HD2 PHE 102 -7.651 3.686 -5.445 843 HE1 PHE 102 HE1 PHE 102 -5.784 1.487 -1.447 844 HE2 PHE 102 HE2 PHE 102 -8.646 1.551 -4.579 845 HZ PHE 102 HZ PHE 102 -7.701 0.476 -2.591 846 H ALA 103 H ALA 103 -6.681 7.546 -6.118 847 HA ALA 103 HA ALA 103 -4.187 8.767 -7.083 848 1HB ALA 103 1HB ALA 103 -5.847 8.930 -8.786 849 2HB ALA 103 2HB ALA 103 -7.116 9.362 -7.614 850 3HB ALA 103 3HB ALA 103 -5.821 10.523 -7.992 851 H LYS 104 H LYS 104 -3.526 10.774 -6.156 852 HA LYS 104 HA LYS 104 -3.440 11.122 -3.591 853 1HB LYS 104 1HB LYS 104 -3.360 12.921 -5.860 854 2HB LYS 104 2HB LYS 104 -4.008 13.744 -4.456 855 1HG LYS 104 1HG LYS 104 -2.059 13.013 -3.097 856 2HG LYS 104 2HG LYS 104 -1.421 12.117 -4.461 857 1HD LYS 104 1HD LYS 104 -1.733 14.573 -5.632 858 2HD LYS 104 2HD LYS 104 -1.455 15.072 -3.976 859 1HE LYS 104 1HE LYS 104 0.390 12.949 -4.995 860 2HE LYS 104 2HE LYS 104 0.554 14.514 -5.765 861 1HZ LYS 104 1HZ LYS 104 1.771 13.956 -3.553 862 2HZ LYS 104 2HZ LYS 104 1.220 15.465 -3.844 863 3HZ LYS 104 3HZ LYS 104 0.374 14.460 -2.875 864 HA PRO 105 HA PRO 105 -7.719 13.010 -3.098 865 1HB PRO 105 1HB PRO 105 -9.358 13.410 -5.248 866 2HB PRO 105 2HB PRO 105 -8.304 14.652 -4.602 867 1HG PRO 105 1HG PRO 105 -7.982 13.043 -7.061 868 2HG PRO 105 2HG PRO 105 -7.196 14.546 -6.622 869 1HD PRO 105 1HD PRO 105 -6.046 11.920 -6.536 870 2HD PRO 105 2HD PRO 105 -5.301 13.408 -5.989 871 H PHE 106 H PHE 106 -8.057 11.108 -1.962 872 HA PHE 106 HA PHE 106 -9.882 9.335 -3.423 873 1HB PHE 106 1HB PHE 106 -8.665 7.701 -1.577 874 2HB PHE 106 2HB PHE 106 -8.036 7.904 -3.200 875 HD1 PHE 106 HD1 PHE 106 -7.872 9.957 -0.075 876 HD2 PHE 106 HD2 PHE 106 -5.744 8.040 -3.206 877 HE1 PHE 106 HE1 PHE 106 -5.710 10.813 0.870 878 HE2 PHE 106 HE2 PHE 106 -3.582 8.896 -2.261 879 HZ PHE 106 HZ PHE 106 -3.591 10.272 -0.234 880 H ASP 107 H ASP 107 -11.444 8.178 -2.054 881 HA ASP 107 HA ASP 107 -11.917 9.678 0.400 882 1HB ASP 107 1HB ASP 107 -13.588 9.277 -1.806 883 2HB ASP 107 2HB ASP 107 -14.148 8.053 -0.684 884 H ILE 108 H ILE 108 -12.516 8.425 2.310 885 HA ILE 108 HA ILE 108 -11.361 5.861 2.432 886 HB ILE 108 HB ILE 108 -12.793 7.706 4.255 887 1HG1 ILE 108 1HG1 ILE 108 -10.829 7.564 5.537 888 2HG1 ILE 108 2HG1 ILE 108 -10.347 6.039 4.821 889 1HG2 ILE 108 1HG2 ILE 108 -12.859 5.965 6.041 890 2HG2 ILE 108 2HG2 ILE 108 -14.041 5.716 4.734 891 3HG2 ILE 108 3HG2 ILE 108 -12.557 4.735 4.790 892 1HD1 ILE 108 1HD1 ILE 108 -10.574 8.619 3.211 893 2HD1 ILE 108 2HD1 ILE 108 -9.065 8.075 3.982 894 3HD1 ILE 108 3HD1 ILE 108 -9.816 7.090 2.704 895 H ASP 109 H ASP 109 -14.694 7.087 1.981 896 HA ASP 109 HA ASP 109 -15.999 4.713 2.459 897 1HB ASP 109 1HB ASP 109 -16.990 7.047 2.100 898 2HB ASP 109 2HB ASP 109 -16.752 6.817 0.380 899 H GLU 110 H GLU 110 -14.618 6.179 -0.561 900 HA GLU 110 HA GLU 110 -15.462 4.062 -2.204 901 1HB GLU 110 1HB GLU 110 -14.151 5.149 -3.936 902 2HB GLU 110 2HB GLU 110 -14.957 6.390 -2.998 903 1HG GLU 110 1HG GLU 110 -12.964 7.058 -1.908 904 2HG GLU 110 2HG GLU 110 -12.168 5.524 -2.198 905 H ILE 111 H ILE 111 -12.698 4.628 -0.087 906 HA ILE 111 HA ILE 111 -10.983 2.735 -1.328 907 HB ILE 111 HB ILE 111 -11.008 4.374 1.150 908 1HG1 ILE 111 1HG1 ILE 111 -9.228 3.975 -1.242 909 2HG1 ILE 111 2HG1 ILE 111 -9.997 5.440 -0.664 910 1HG2 ILE 111 1HG2 ILE 111 -9.051 3.243 2.063 911 2HG2 ILE 111 2HG2 ILE 111 -10.450 2.143 2.004 912 3HG2 ILE 111 3HG2 ILE 111 -9.155 2.002 0.791 913 1HD1 ILE 111 1HD1 ILE 111 -7.557 4.024 0.438 914 2HD1 ILE 111 2HD1 ILE 111 -7.756 5.738 0.004 915 3HD1 ILE 111 3HD1 ILE 111 -8.513 5.102 1.483 916 H ARG 112 H ARG 112 -13.774 2.563 0.755 917 HA ARG 112 HA ARG 112 -13.112 0.203 2.067 918 1HB ARG 112 1HB ARG 112 -15.860 1.333 1.331 919 2HB ARG 112 2HB ARG 112 -15.591 0.059 2.504 920 1HG ARG 112 1HG ARG 112 -13.851 1.949 3.463 921 2HG ARG 112 2HG ARG 112 -15.051 2.995 2.729 922 1HD ARG 112 1HD ARG 112 -16.463 0.924 4.161 923 2HD ARG 112 2HD ARG 112 -15.223 1.553 5.228 924 HE ARG 112 HE ARG 112 -17.534 3.040 4.149 925 1HH1 ARG 112 1HH1 ARG 112 -14.431 3.223 5.798 926 2HH1 ARG 112 2HH1 ARG 112 -14.738 4.787 6.475 927 1HH2 ARG 112 1HH2 ARG 112 -17.941 5.103 5.042 928 2HH2 ARG 112 2HH2 ARG 112 -16.748 5.864 6.042 929 H ASP 113 H ASP 113 -14.180 0.941 -1.196 930 HA ASP 113 HA ASP 113 -15.316 -1.600 -1.694 931 1HB ASP 113 1HB ASP 113 -15.147 0.916 -3.005 932 2HB ASP 113 2HB ASP 113 -14.322 -0.203 -4.072 933 H ALA 114 H ALA 114 -12.301 0.155 -2.771 934 HA ALA 114 HA ALA 114 -11.135 -1.977 -4.104 935 1HB ALA 114 1HB ALA 114 -10.325 0.252 -4.430 936 2HB ALA 114 2HB ALA 114 -10.004 0.464 -2.692 937 3HB ALA 114 3HB ALA 114 -9.002 -0.650 -3.653 938 H VAL 115 H VAL 115 -11.340 -1.167 -0.643 939 HA VAL 115 HA VAL 115 -9.260 -2.733 0.297 940 HB VAL 115 HB VAL 115 -11.849 -1.705 1.381 941 1HG1 VAL 115 1HG1 VAL 115 -10.140 -3.844 2.632 942 2HG1 VAL 115 2HG1 VAL 115 -10.973 -2.649 3.656 943 3HG1 VAL 115 3HG1 VAL 115 -11.913 -3.701 2.570 944 1HG2 VAL 115 1HG2 VAL 115 -10.534 -0.227 2.569 945 2HG2 VAL 115 2HG2 VAL 115 -9.142 -1.335 2.624 946 3HG2 VAL 115 3HG2 VAL 115 -9.533 -0.471 1.118 947 H LYS 116 H LYS 116 -12.608 -3.572 -0.690 948 HA LYS 116 HA LYS 116 -12.756 -6.110 0.336 949 1HB LYS 116 1HB LYS 116 -14.398 -4.561 -1.101 950 2HB LYS 116 2HB LYS 116 -13.848 -5.604 -2.396 951 1HG LYS 116 1HG LYS 116 -14.342 -7.545 -0.620 952 2HG LYS 116 2HG LYS 116 -15.380 -6.333 0.106 953 1HD LYS 116 1HD LYS 116 -15.521 -7.288 -2.794 954 2HD LYS 116 2HD LYS 116 -16.635 -7.737 -1.517 955 1HE LYS 116 1HE LYS 116 -17.765 -5.737 -1.614 956 2HE LYS 116 2HE LYS 116 -16.299 -4.800 -1.822 957 1HZ LYS 116 1HZ LYS 116 -16.639 -4.772 -3.983 958 2HZ LYS 116 2HZ LYS 116 -16.768 -6.397 -4.082 959 3HZ LYS 116 3HZ LYS 116 -18.088 -5.491 -3.762 960 H LYS 117 H LYS 117 -10.681 -4.837 -2.184 961 HA LYS 117 HA LYS 117 -9.909 -7.591 -2.856 962 1HB LYS 117 1HB LYS 117 -9.880 -5.051 -4.496 963 2HB LYS 117 2HB LYS 117 -8.938 -6.459 -4.941 964 1HG LYS 117 1HG LYS 117 -11.017 -7.852 -4.946 965 2HG LYS 117 2HG LYS 117 -11.961 -6.447 -4.493 966 1HD LYS 117 1HD LYS 117 -10.205 -6.328 -6.961 967 2HD LYS 117 2HD LYS 117 -11.755 -7.141 -7.046 968 1HE LYS 117 1HE LYS 117 -12.189 -4.648 -5.679 969 2HE LYS 117 2HE LYS 117 -11.206 -4.295 -7.086 970 1HZ LYS 117 1HZ LYS 117 -13.915 -5.085 -6.967 971 2HZ LYS 117 2HZ LYS 117 -13.087 -4.419 -8.206 972 3HZ LYS 117 3HZ LYS 117 -13.071 -6.038 -7.989 973 H TYR 118 H TYR 118 -9.001 -4.519 -1.443 974 HA TYR 118 HA TYR 118 -6.176 -4.987 -1.673 975 1HB TYR 118 1HB TYR 118 -6.372 -2.716 -1.226 976 2HB TYR 118 2HB TYR 118 -8.095 -2.921 -0.981 977 HD1 TYR 118 HD1 TYR 118 -8.590 -4.170 1.445 978 HD2 TYR 118 HD2 TYR 118 -5.267 -1.645 0.500 979 HE1 TYR 118 HE1 TYR 118 -8.300 -3.617 3.909 980 HE2 TYR 118 HE2 TYR 118 -4.989 -1.101 2.967 981 HH TYR 118 HH TYR 118 -7.271 -2.376 5.363 982 H LEU 119 H LEU 119 -8.782 -5.864 0.526 983 HA LEU 119 HA LEU 119 -7.327 -7.709 1.911 984 1HB LEU 119 1HB LEU 119 -6.457 -5.173 2.668 985 2HB LEU 119 2HB LEU 119 -7.546 -5.655 3.954 986 HG LEU 119 HG LEU 119 -4.931 -6.237 3.936 987 1HD1 LEU 119 1HD1 LEU 119 -7.290 -7.261 5.287 988 2HD1 LEU 119 2HD1 LEU 119 -5.988 -8.473 5.217 989 3HD1 LEU 119 3HD1 LEU 119 -5.677 -6.873 5.932 990 1HD2 LEU 119 1HD2 LEU 119 -6.057 -8.840 2.930 991 2HD2 LEU 119 2HD2 LEU 119 -5.368 -7.639 1.812 992 3HD2 LEU 119 3HD2 LEU 119 -4.360 -8.333 3.105 993 HA PRO 120 HA PRO 120 -11.424 -8.349 3.123 994 1HB PRO 120 1HB PRO 120 -11.099 -10.434 4.860 995 2HB PRO 120 2HB PRO 120 -11.136 -10.634 3.119 996 1HG PRO 120 1HG PRO 120 -8.813 -10.724 4.946 997 2HG PRO 120 2HG PRO 120 -8.945 -11.328 3.306 998 1HD PRO 120 1HD PRO 120 -7.626 -8.925 4.148 999 2HD PRO 120 2HD PRO 120 -7.858 -9.470 2.499 1000 H LEU 121 H LEU 121 -10.755 -6.052 4.152 1001 HA LEU 121 HA LEU 121 -11.011 -6.326 7.037 1002 1HB LEU 121 1HB LEU 121 -9.284 -4.871 6.353 1003 2HB LEU 121 2HB LEU 121 -10.310 -4.056 5.190 1004 HG LEU 121 HG LEU 121 -11.671 -3.166 7.107 1005 1HD1 LEU 121 1HD1 LEU 121 -10.401 -5.069 8.610 1006 2HD1 LEU 121 2HD1 LEU 121 -9.515 -3.591 9.058 1007 3HD1 LEU 121 3HD1 LEU 121 -11.283 -3.664 9.254 1008 1HD2 LEU 121 1HD2 LEU 121 -8.808 -2.299 7.418 1009 2HD2 LEU 121 2HD2 LEU 121 -9.691 -2.013 5.900 1010 3HD2 LEU 121 3HD2 LEU 121 -10.296 -1.323 7.425 1011 H LYS 122 H LYS 122 -12.571 -4.719 8.130 1012 HA LYS 122 HA LYS 122 -15.123 -5.373 7.633 1013 1HB LYS 122 1HB LYS 122 -14.353 -4.185 9.627 1014 2HB LYS 122 2HB LYS 122 -14.091 -2.726 8.693 1015 1HG LYS 122 1HG LYS 122 -16.776 -3.626 8.155 1016 2HG LYS 122 2HG LYS 122 -16.544 -3.672 9.892 1017 1HD LYS 122 1HD LYS 122 -16.899 -1.431 9.914 1018 2HD LYS 122 2HD LYS 122 -15.344 -1.242 9.130 1019 1HE LYS 122 1HE LYS 122 -17.066 -1.958 7.018 1020 2HE LYS 122 2HE LYS 122 -18.050 -0.903 8.013 1021 1HZ LYS 122 1HZ LYS 122 -16.422 0.776 7.860 1022 2HZ LYS 122 2HZ LYS 122 -15.327 -0.213 7.161 1023 3HZ LYS 122 3HZ LYS 122 -16.666 0.234 6.340 1024 H SER 123 H SER 123 -16.204 -5.376 5.732 1025 HA SER 123 HA SER 123 -15.698 -3.180 3.923 1026 1HB SER 123 1HB SER 123 -17.544 -5.492 3.303 1027 2HB SER 123 2HB SER 123 -16.547 -4.557 2.206 1028 HG SER 123 HG SER 123 -15.655 -6.677 2.575 1029 H ASN 124 H ASN 124 -17.416 -1.827 3.094 1030 HA ASN 124 HA ASN 124 -20.005 -2.195 4.304 1031 1HB ASN 124 1HB ASN 124 -18.389 -0.564 5.679 1032 2HB ASN 124 2HB ASN 124 -18.770 0.578 4.406 1033 1HD2 ASN 124 1HD2 ASN 124 -20.057 1.980 5.392 1034 2HD2 ASN 124 2HD2 ASN 124 -21.564 1.618 6.166
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