NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
21037 | 2gzu | 6317 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 1H MET 1 1HT MET 1 13.194 -5.054 4.762 2 2H MET 1 2HT MET 1 12.063 -4.203 5.658 3 3H MET 1 3HT MET 1 11.712 -4.651 4.081 4 HA MET 1 HA MET 1 11.569 -6.897 4.621 5 1HB MET 1 2HB MET 1 12.309 -5.979 7.414 6 2HB MET 1 1HB MET 1 11.721 -7.590 7.026 7 1HG MET 1 2HG MET 1 13.676 -7.952 5.594 8 2HG MET 1 1HG MET 1 14.263 -6.341 6.002 9 1HE MET 1 1HE MET 1 16.595 -7.448 6.682 10 2HE MET 1 2HE MET 1 15.958 -9.047 6.300 11 3HE MET 1 3HE MET 1 16.748 -8.762 7.850 12 H ILE 2 H ILE 2 9.627 -7.770 5.530 13 HA ILE 2 HA ILE 2 7.668 -5.658 6.159 14 HB ILE 2 HB ILE 2 7.185 -8.215 4.580 15 1HG1 ILE 2 2HG1 ILE 2 8.390 -6.550 3.239 16 2HG1 ILE 2 1HG1 ILE 2 6.748 -6.761 2.648 17 1HG2 ILE 2 1HG2 ILE 2 5.245 -6.012 5.261 18 2HG2 ILE 2 2HG2 ILE 2 5.232 -7.658 5.895 19 3HG2 ILE 2 3HG2 ILE 2 4.918 -7.370 4.183 20 1HD1 ILE 2 1HD1 ILE 2 6.096 -4.676 3.757 21 2HD1 ILE 2 2HD1 ILE 2 7.412 -4.426 2.610 22 3HD1 ILE 2 3HD1 ILE 2 7.748 -4.478 4.342 23 H ILE 3 H ILE 3 6.444 -5.983 7.930 24 HA ILE 3 HA ILE 3 6.641 -8.554 9.312 25 HB ILE 3 HB ILE 3 6.252 -5.773 10.543 26 1HG1 ILE 3 2HG1 ILE 3 8.393 -6.354 11.853 27 2HG1 ILE 3 1HG1 ILE 3 8.642 -7.637 10.685 28 1HG2 ILE 3 1HG2 ILE 3 6.310 -6.886 12.729 29 2HG2 ILE 3 2HG2 ILE 3 6.362 -8.450 11.911 30 3HG2 ILE 3 3HG2 ILE 3 4.951 -7.409 11.733 31 1HD1 ILE 3 1HD1 ILE 3 9.985 -5.681 10.162 32 2HD1 ILE 3 2HD1 ILE 3 8.533 -4.684 10.083 33 3HD1 ILE 3 3HD1 ILE 3 8.789 -5.966 8.899 34 H ASN 4 H ASN 4 4.531 -9.489 9.662 35 HA ASN 4 HA ASN 4 2.411 -7.818 8.559 36 1HB ASN 4 2HB ASN 4 3.051 -9.774 7.193 37 2HB ASN 4 1HB ASN 4 2.735 -10.820 8.571 38 1HD2 ASN 4 1HD2 ASN 4 1.199 -11.937 7.390 39 2HD2 ASN 4 2HD2 ASN 4 -0.343 -11.262 7.012 40 H ASN 5 H ASN 5 0.739 -7.359 9.796 41 HA ASN 5 HA ASN 5 0.470 -8.741 12.365 42 1HB ASN 5 2HB ASN 5 0.289 -5.799 11.683 43 2HB ASN 5 1HB ASN 5 -0.477 -6.461 13.117 44 1HD2 ASN 5 1HD2 ASN 5 0.842 -5.068 14.336 45 2HD2 ASN 5 2HD2 ASN 5 2.504 -5.444 14.655 46 H LEU 6 H LEU 6 -0.717 -8.935 9.603 47 HA LEU 6 HA LEU 6 -3.324 -8.052 9.403 48 1HB LEU 6 2HB LEU 6 -1.976 -9.155 7.627 49 2HB LEU 6 1HB LEU 6 -2.116 -10.672 8.464 50 HG LEU 6 HG LEU 6 -3.482 -10.413 6.377 51 1HD1 LEU 6 1HD1 LEU 6 -5.029 -11.017 8.871 52 2HD1 LEU 6 2HD1 LEU 6 -3.988 -12.127 7.985 53 3HD1 LEU 6 3HD1 LEU 6 -5.459 -11.507 7.231 54 1HD2 LEU 6 1HD2 LEU 6 -5.121 -8.561 8.093 55 2HD2 LEU 6 2HD2 LEU 6 -5.585 -9.178 6.507 56 3HD2 LEU 6 3HD2 LEU 6 -4.190 -8.113 6.666 57 H LYS 7 H LYS 7 -2.108 -10.964 10.989 58 HA LYS 7 HA LYS 7 -4.541 -12.040 11.865 59 1HB LYS 7 2HB LYS 7 -3.136 -13.176 13.625 60 2HB LYS 7 1HB LYS 7 -2.585 -13.400 11.972 61 1HG LYS 7 2HG LYS 7 -0.850 -11.734 12.294 62 2HG LYS 7 1HG LYS 7 -1.436 -11.414 13.924 63 1HD LYS 7 2HD LYS 7 -0.361 -14.064 12.965 64 2HD LYS 7 1HD LYS 7 0.573 -12.861 13.852 65 1HE LYS 7 2HE LYS 7 -1.055 -13.025 15.706 66 2HE LYS 7 1HE LYS 7 -1.890 -14.300 14.822 67 1HZ LYS 7 1HZ LYS 7 0.146 -15.618 14.909 68 2HZ LYS 7 2HZ LYS 7 -0.399 -15.230 16.456 69 3HZ LYS 7 3HZ LYS 7 0.911 -14.380 15.769 70 H LEU 8 H LEU 8 -2.358 -9.738 13.509 71 HA LEU 8 HA LEU 8 -3.684 -9.523 15.932 72 1HB LEU 8 2HB LEU 8 -1.350 -8.766 15.298 73 2HB LEU 8 1HB LEU 8 -2.065 -7.409 14.481 74 HG LEU 8 HG LEU 8 -1.036 -6.845 16.657 75 1HD1 LEU 8 1HD1 LEU 8 -4.002 -6.394 16.618 76 2HD1 LEU 8 2HD1 LEU 8 -2.771 -5.390 15.848 77 3HD1 LEU 8 3HD1 LEU 8 -2.834 -5.518 17.607 78 1HD2 LEU 8 1HD2 LEU 8 -1.480 -8.895 17.852 79 2HD2 LEU 8 2HD2 LEU 8 -3.209 -8.553 17.835 80 3HD2 LEU 8 3HD2 LEU 8 -2.112 -7.509 18.741 81 H ILE 9 H ILE 9 -4.023 -7.649 12.958 82 HA ILE 9 HA ILE 9 -6.014 -5.926 14.019 83 HB ILE 9 HB ILE 9 -5.097 -6.384 11.165 84 1HG1 ILE 9 2HG1 ILE 9 -4.460 -3.997 11.295 85 2HG1 ILE 9 1HG1 ILE 9 -5.078 -3.925 12.934 86 1HG2 ILE 9 1HG2 ILE 9 -7.350 -4.548 11.977 87 2HG2 ILE 9 2HG2 ILE 9 -7.497 -6.003 10.993 88 3HG2 ILE 9 3HG2 ILE 9 -6.595 -4.616 10.382 89 1HD1 ILE 9 1HD1 ILE 9 -3.350 -5.501 13.635 90 2HD1 ILE 9 2HD1 ILE 9 -2.668 -4.053 12.894 91 3HD1 ILE 9 3HD1 ILE 9 -2.746 -5.562 11.980 92 H ARG 10 H ARG 10 -6.192 -8.901 12.258 93 HA ARG 10 HA ARG 10 -9.011 -8.908 12.074 94 1HB ARG 10 2HB ARG 10 -6.969 -11.068 11.845 95 2HB ARG 10 1HB ARG 10 -8.684 -11.473 11.918 96 1HG ARG 10 2HG ARG 10 -9.141 -10.161 9.977 97 2HG ARG 10 1HG ARG 10 -7.487 -9.554 9.943 98 1HD ARG 10 2HD ARG 10 -7.913 -11.325 8.296 99 2HD ARG 10 1HD ARG 10 -6.645 -11.731 9.445 100 HE ARG 10 HE ARG 10 -9.018 -12.760 10.427 101 1HH1 ARG 10 1HH1 ARG 10 -7.337 -13.148 7.371 102 2HH1 ARG 10 2HH1 ARG 10 -7.297 -14.852 7.409 103 1HH2 ARG 10 1HH2 ARG 10 -9.039 -15.109 10.492 104 2HH2 ARG 10 2HH2 ARG 10 -8.315 -16.014 9.228 105 H GLU 11 H GLU 11 -6.853 -9.917 14.689 106 HA GLU 11 HA GLU 11 -8.998 -10.795 16.245 107 1HB GLU 11 2HB GLU 11 -6.171 -10.064 16.946 108 2HB GLU 11 1HB GLU 11 -7.333 -10.693 18.113 109 1HG GLU 11 2HG GLU 11 -7.654 -12.656 16.629 110 2HG GLU 11 1HG GLU 11 -6.369 -12.039 15.621 111 H LYS 12 H LYS 12 -7.477 -7.656 15.885 112 HA LYS 12 HA LYS 12 -8.819 -6.246 17.861 113 1HB LYS 12 2HB LYS 12 -8.090 -5.381 15.054 114 2HB LYS 12 1HB LYS 12 -8.697 -4.265 16.270 115 1HG LYS 12 2HG LYS 12 -6.793 -4.649 17.666 116 2HG LYS 12 1HG LYS 12 -6.230 -5.946 16.617 117 1HD LYS 12 2HD LYS 12 -4.983 -3.797 16.349 118 2HD LYS 12 1HD LYS 12 -5.713 -4.378 14.858 119 1HE LYS 12 2HE LYS 12 -7.467 -2.766 15.015 120 2HE LYS 12 1HE LYS 12 -6.978 -2.316 16.647 121 1HZ LYS 12 1HZ LYS 12 -5.057 -1.313 15.864 122 2HZ LYS 12 2HZ LYS 12 -6.259 -0.759 14.818 123 3HZ LYS 12 3HZ LYS 12 -5.156 -1.934 14.313 124 H LYS 13 H LYS 13 -10.011 -7.179 14.701 125 HA LYS 13 HA LYS 13 -12.779 -6.540 15.532 126 1HB LYS 13 2HB LYS 13 -11.622 -7.320 12.815 127 2HB LYS 13 1HB LYS 13 -13.311 -6.934 13.121 128 1HG LYS 13 2HG LYS 13 -10.992 -5.029 13.404 129 2HG LYS 13 1HG LYS 13 -12.140 -5.074 12.063 130 1HD LYS 13 2HD LYS 13 -13.963 -4.528 13.559 131 2HD LYS 13 1HD LYS 13 -12.879 -4.596 14.948 132 1HE LYS 13 2HE LYS 13 -13.326 -2.298 14.278 133 2HE LYS 13 1HE LYS 13 -11.627 -2.707 14.074 134 1HZ LYS 13 1HZ LYS 13 -12.612 -1.423 12.244 135 2HZ LYS 13 2HZ LYS 13 -13.607 -2.741 11.854 136 3HZ LYS 13 3HZ LYS 13 -11.931 -2.870 11.715 137 H LYS 14 H LYS 14 -14.175 -9.016 14.136 138 HA LYS 14 HA LYS 14 -12.172 -10.889 14.449 139 1HB LYS 14 2HB LYS 14 -13.996 -12.401 15.447 140 2HB LYS 14 1HB LYS 14 -13.242 -11.232 16.512 141 1HG LYS 14 2HG LYS 14 -15.197 -9.796 16.337 142 2HG LYS 14 1HG LYS 14 -15.940 -10.933 15.203 143 1HD LYS 14 2HD LYS 14 -15.969 -12.661 16.889 144 2HD LYS 14 1HD LYS 14 -15.103 -11.619 18.016 145 1HE LYS 14 2HE LYS 14 -17.809 -10.968 16.873 146 2HE LYS 14 1HE LYS 14 -17.578 -11.818 18.394 147 1HZ LYS 14 1HZ LYS 14 -16.603 -9.046 17.819 148 2HZ LYS 14 2HZ LYS 14 -16.400 -9.899 19.254 149 3HZ LYS 14 3HZ LYS 14 -17.950 -9.485 18.741 150 H ILE 15 H ILE 15 -12.028 -10.562 12.319 151 HA ILE 15 HA ILE 15 -14.198 -11.757 10.732 152 HB ILE 15 HB ILE 15 -12.048 -9.819 9.768 153 1HG1 ILE 15 2HG1 ILE 15 -14.989 -9.279 10.277 154 2HG1 ILE 15 1HG1 ILE 15 -13.667 -8.713 11.290 155 1HG2 ILE 15 1HG2 ILE 15 -12.851 -11.351 8.042 156 2HG2 ILE 15 2HG2 ILE 15 -13.392 -9.704 7.720 157 3HG2 ILE 15 3HG2 ILE 15 -14.517 -10.886 8.390 158 1HD1 ILE 15 1HD1 ILE 15 -12.829 -7.365 9.431 159 2HD1 ILE 15 2HD1 ILE 15 -14.495 -6.948 9.835 160 3HD1 ILE 15 3HD1 ILE 15 -14.150 -7.942 8.417 161 H SER 16 H SER 16 -13.604 -13.493 9.479 162 HA SER 16 HA SER 16 -10.845 -14.345 9.813 163 1HB SER 16 2HB SER 16 -13.324 -16.017 9.408 164 2HB SER 16 1HB SER 16 -11.691 -16.614 9.720 165 HG SER 16 HG SER 16 -13.546 -15.445 11.390 166 H GLN 17 H GLN 17 -10.693 -16.321 7.978 167 HA GLN 17 HA GLN 17 -9.972 -14.881 5.709 168 1HB GLN 17 2HB GLN 17 -9.458 -17.136 4.727 169 2HB GLN 17 1HB GLN 17 -8.646 -16.721 6.228 170 1HG GLN 17 2HG GLN 17 -10.209 -18.107 7.470 171 2HG GLN 17 1HG GLN 17 -11.070 -18.489 5.979 172 1HE2 GLN 17 1HE2 GLN 17 -8.130 -18.918 7.762 173 2HE2 GLN 17 2HE2 GLN 17 -7.553 -20.300 6.908 174 H SER 18 H SER 18 -12.897 -16.971 6.173 175 HA SER 18 HA SER 18 -13.490 -17.088 3.450 176 1HB SER 18 2HB SER 18 -15.386 -17.282 5.803 177 2HB SER 18 1HB SER 18 -15.633 -17.951 4.186 178 HG SER 18 HG SER 18 -13.989 -18.786 6.267 179 H GLU 19 H GLU 19 -14.498 -14.850 6.024 180 HA GLU 19 HA GLU 19 -16.282 -13.423 4.391 181 1HB GLU 19 2HB GLU 19 -14.845 -12.283 6.786 182 2HB GLU 19 1HB GLU 19 -16.383 -11.771 6.114 183 1HG GLU 19 2HG GLU 19 -17.133 -12.945 7.893 184 2HG GLU 19 1HG GLU 19 -17.046 -14.260 6.720 185 H LEU 20 H LEU 20 -12.824 -12.735 5.340 186 HA LEU 20 HA LEU 20 -12.688 -10.395 3.892 187 1HB LEU 20 2HB LEU 20 -10.566 -12.351 4.711 188 2HB LEU 20 1HB LEU 20 -10.203 -10.867 3.855 189 HG LEU 20 HG LEU 20 -11.492 -11.065 6.574 190 1HD1 LEU 20 1HD1 LEU 20 -9.395 -10.090 7.354 191 2HD1 LEU 20 2HD1 LEU 20 -8.754 -10.151 5.714 192 3HD1 LEU 20 3HD1 LEU 20 -9.127 -11.647 6.573 193 1HD2 LEU 20 1HD2 LEU 20 -11.253 -8.626 6.622 194 2HD2 LEU 20 2HD2 LEU 20 -12.309 -9.141 5.304 195 3HD2 LEU 20 3HD2 LEU 20 -10.651 -8.651 4.964 196 H ALA 21 H ALA 21 -12.109 -13.700 2.864 197 HA ALA 21 HA ALA 21 -11.113 -13.163 0.329 198 1HB ALA 21 1HB ALA 21 -12.953 -15.419 1.120 199 2HB ALA 21 2HB ALA 21 -11.197 -15.410 1.296 200 3HB ALA 21 3HB ALA 21 -11.923 -15.374 -0.311 201 H ALA 22 H ALA 22 -14.503 -13.382 1.380 202 HA ALA 22 HA ALA 22 -15.614 -12.950 -1.188 203 1HB ALA 22 1HB ALA 22 -16.877 -13.965 0.650 204 2HB ALA 22 2HB ALA 22 -17.712 -12.550 0.005 205 3HB ALA 22 3HB ALA 22 -16.827 -12.436 1.527 206 H LEU 23 H LEU 23 -14.622 -10.811 1.395 207 HA LEU 23 HA LEU 23 -15.804 -8.444 0.313 208 1HB LEU 23 2HB LEU 23 -13.930 -9.067 2.544 209 2HB LEU 23 1HB LEU 23 -13.992 -7.421 1.961 210 HG LEU 23 HG LEU 23 -16.311 -7.209 2.633 211 1HD1 LEU 23 1HD1 LEU 23 -17.100 -9.457 2.127 212 2HD1 LEU 23 2HD1 LEU 23 -17.517 -8.960 3.770 213 3HD1 LEU 23 3HD1 LEU 23 -16.180 -10.082 3.500 214 1HD2 LEU 23 1HD2 LEU 23 -14.626 -6.812 4.325 215 2HD2 LEU 23 2HD2 LEU 23 -14.666 -8.514 4.787 216 3HD2 LEU 23 3HD2 LEU 23 -16.085 -7.498 5.042 217 H LEU 24 H LEU 24 -12.453 -9.831 0.235 218 HA LEU 24 HA LEU 24 -11.461 -7.615 -1.228 219 1HB LEU 24 2HB LEU 24 -10.224 -10.296 -0.652 220 2HB LEU 24 1HB LEU 24 -9.389 -8.854 -1.182 221 HG LEU 24 HG LEU 24 -10.741 -9.229 1.486 222 1HD1 LEU 24 1HD1 LEU 24 -7.830 -9.189 0.740 223 2HD1 LEU 24 2HD1 LEU 24 -8.760 -10.587 1.275 224 3HD1 LEU 24 3HD1 LEU 24 -8.471 -9.243 2.382 225 1HD2 LEU 24 1HD2 LEU 24 -9.671 -7.122 2.102 226 2HD2 LEU 24 2HD2 LEU 24 -10.789 -6.897 0.758 227 3HD2 LEU 24 3HD2 LEU 24 -9.051 -6.952 0.462 228 H GLU 25 H GLU 25 -13.308 -10.195 -2.107 229 HA GLU 25 HA GLU 25 -13.968 -11.085 -4.120 230 1HB GLU 25 2HB GLU 25 -12.070 -9.055 -5.332 231 2HB GLU 25 1HB GLU 25 -13.241 -10.005 -6.228 232 1HG GLU 25 2HG GLU 25 -15.057 -8.871 -5.087 233 2HG GLU 25 1HG GLU 25 -13.891 -7.958 -4.122 234 H VAL 26 H VAL 26 -11.791 -12.236 -2.610 235 HA VAL 26 HA VAL 26 -10.214 -13.379 -4.780 236 HB VAL 26 HB VAL 26 -8.326 -13.643 -3.221 237 1HG1 VAL 26 1HG1 VAL 26 -7.598 -11.313 -3.160 238 2HG1 VAL 26 2HG1 VAL 26 -9.247 -10.795 -3.509 239 3HG1 VAL 26 3HG1 VAL 26 -8.345 -11.732 -4.701 240 1HG2 VAL 26 1HG2 VAL 26 -8.286 -12.389 -1.092 241 2HG2 VAL 26 2HG2 VAL 26 -9.508 -13.661 -1.101 242 3HG2 VAL 26 3HG2 VAL 26 -9.989 -11.979 -1.324 243 H SER 27 H SER 27 -9.233 -15.469 -4.047 244 HA SER 27 HA SER 27 -11.250 -17.154 -2.906 245 1HB SER 27 2HB SER 27 -8.426 -17.804 -3.764 246 2HB SER 27 1HB SER 27 -9.775 -18.931 -3.590 247 HG SER 27 HG SER 27 -9.268 -17.005 -5.541 248 H ARG 28 H ARG 28 -10.757 -18.578 -1.074 249 HA ARG 28 HA ARG 28 -9.731 -17.139 1.112 250 1HB ARG 28 2HB ARG 28 -10.390 -20.077 0.930 251 2HB ARG 28 1HB ARG 28 -9.985 -19.243 2.425 252 1HG ARG 28 2HG ARG 28 -11.906 -17.693 1.935 253 2HG ARG 28 1HG ARG 28 -12.368 -18.817 0.657 254 1HD ARG 28 2HD ARG 28 -12.061 -19.500 3.572 255 2HD ARG 28 1HD ARG 28 -13.585 -19.180 2.761 256 HE ARG 28 HE ARG 28 -12.269 -21.259 1.420 257 1HH1 ARG 28 1HH1 ARG 28 -13.951 -20.567 4.468 258 2HH1 ARG 28 2HH1 ARG 28 -14.480 -22.161 4.707 259 1HH2 ARG 28 1HH2 ARG 28 -12.958 -23.525 1.788 260 2HH2 ARG 28 2HH2 ARG 28 -13.819 -23.886 3.209 261 H GLN 29 H GLN 29 -8.238 -19.458 -1.010 262 HA GLN 29 HA GLN 29 -5.935 -19.976 0.471 263 1HB GLN 29 2HB GLN 29 -6.735 -21.152 -1.611 264 2HB GLN 29 1HB GLN 29 -6.206 -19.768 -2.540 265 1HG GLN 29 2HG GLN 29 -4.326 -21.372 -0.833 266 2HG GLN 29 1HG GLN 29 -4.713 -21.822 -2.484 267 1HE2 GLN 29 1HE2 GLN 29 -2.229 -21.089 -1.263 268 2HE2 GLN 29 2HE2 GLN 29 -1.584 -19.761 -2.152 269 H THR 30 H THR 30 -6.821 -17.252 -1.594 270 HA THR 30 HA THR 30 -4.302 -16.063 -1.847 271 HB THR 30 HB THR 30 -6.992 -14.674 -1.790 272 HG1 THR 30 1HG THR 30 -5.684 -16.164 -3.848 273 1HG2 THR 30 1HG2 THR 30 -5.912 -13.111 -3.359 274 2HG2 THR 30 2HG2 THR 30 -4.405 -14.018 -3.222 275 3HG2 THR 30 3HG2 THR 30 -5.053 -13.167 -1.819 276 H ILE 31 H ILE 31 -6.969 -15.467 0.466 277 HA ILE 31 HA ILE 31 -5.472 -13.489 1.850 278 HB ILE 31 HB ILE 31 -7.896 -13.307 1.875 279 1HG1 ILE 31 2HG1 ILE 31 -8.345 -13.015 4.311 280 2HG1 ILE 31 1HG1 ILE 31 -6.838 -13.852 4.659 281 1HG2 ILE 31 1HG2 ILE 31 -7.959 -15.892 3.388 282 2HG2 ILE 31 2HG2 ILE 31 -8.541 -15.602 1.749 283 3HG2 ILE 31 3HG2 ILE 31 -9.342 -14.831 3.121 284 1HD1 ILE 31 1HD1 ILE 31 -5.596 -12.079 3.515 285 2HD1 ILE 31 2HD1 ILE 31 -6.575 -11.442 4.838 286 3HD1 ILE 31 3HD1 ILE 31 -7.111 -11.245 3.169 287 H ASN 32 H ASN 32 -5.957 -16.930 2.344 288 HA ASN 32 HA ASN 32 -4.766 -17.161 4.890 289 1HB ASN 32 2HB ASN 32 -6.056 -18.988 3.819 290 2HB ASN 32 1HB ASN 32 -4.820 -19.141 2.584 291 1HD2 ASN 32 1HD2 ASN 32 -4.599 -21.323 3.115 292 2HD2 ASN 32 2HD2 ASN 32 -3.738 -21.858 4.514 293 H GLY 33 H GLY 33 -3.468 -17.165 1.662 294 1HA GLY 33 2HA GLY 33 -0.737 -17.621 2.302 295 2HA GLY 33 1HA GLY 33 -1.315 -16.859 0.825 296 H ILE 34 H ILE 34 -2.689 -14.673 2.135 297 HA ILE 34 HA ILE 34 -0.550 -12.863 2.478 298 HB ILE 34 HB ILE 34 -3.539 -12.567 2.895 299 1HG1 ILE 34 2HG1 ILE 34 -2.856 -12.865 0.572 300 2HG1 ILE 34 1HG1 ILE 34 -3.456 -11.233 0.829 301 1HG2 ILE 34 1HG2 ILE 34 -2.465 -10.982 4.379 302 2HG2 ILE 34 2HG2 ILE 34 -3.232 -10.140 3.033 303 3HG2 ILE 34 3HG2 ILE 34 -1.482 -10.365 3.049 304 1HD1 ILE 34 1HD1 ILE 34 -1.145 -10.405 0.905 305 2HD1 ILE 34 2HD1 ILE 34 -1.494 -11.235 -0.612 306 3HD1 ILE 34 3HD1 ILE 34 -0.558 -12.047 0.643 307 H GLU 35 H GLU 35 -2.812 -14.399 4.747 308 HA GLU 35 HA GLU 35 -2.042 -13.211 7.109 309 1HB GLU 35 2HB GLU 35 -2.702 -16.107 6.652 310 2HB GLU 35 1HB GLU 35 -2.659 -15.322 8.219 311 1HG GLU 35 2HG GLU 35 -4.468 -13.850 7.516 312 2HG GLU 35 1HG GLU 35 -4.510 -14.670 5.952 313 H LYS 36 H LYS 36 -0.472 -15.789 5.375 314 HA LYS 36 HA LYS 36 1.567 -16.170 7.420 315 1HB LYS 36 2HB LYS 36 1.366 -17.374 4.651 316 2HB LYS 36 1HB LYS 36 2.410 -17.914 5.954 317 1HG LYS 36 2HG LYS 36 -0.604 -18.012 5.977 318 2HG LYS 36 1HG LYS 36 0.465 -19.371 5.639 319 1HD LYS 36 2HD LYS 36 0.418 -17.807 8.220 320 2HD LYS 36 1HD LYS 36 -0.406 -19.344 7.960 321 1HE LYS 36 2HE LYS 36 1.726 -20.430 7.523 322 2HE LYS 36 1HE LYS 36 2.563 -18.890 7.710 323 1HZ LYS 36 1HZ LYS 36 1.820 -18.807 9.990 324 2HZ LYS 36 2HZ LYS 36 2.724 -20.201 9.702 325 3HZ LYS 36 3HZ LYS 36 1.020 -20.288 9.828 326 H ASN 37 H ASN 37 1.033 -13.849 5.269 327 HA ASN 37 HA ASN 37 2.038 -12.628 3.668 328 1HB ASN 37 2HB ASN 37 3.896 -11.278 4.482 329 2HB ASN 37 1HB ASN 37 2.789 -11.573 5.804 330 1HD2 ASN 37 1HD2 ASN 37 5.968 -11.970 4.583 331 2HD2 ASN 37 2HD2 ASN 37 6.683 -12.647 5.990 332 H LYS 38 H LYS 38 2.299 -15.213 3.031 333 HA LYS 38 HA LYS 38 5.077 -15.693 2.217 334 1HB LYS 38 2HB LYS 38 3.789 -17.449 3.465 335 2HB LYS 38 1HB LYS 38 2.655 -17.504 2.129 336 1HG LYS 38 2HG LYS 38 4.546 -18.177 0.650 337 2HG LYS 38 1HG LYS 38 5.559 -18.286 2.090 338 1HD LYS 38 2HD LYS 38 4.724 -20.484 1.553 339 2HD LYS 38 1HD LYS 38 3.947 -19.924 3.037 340 1HE LYS 38 2HE LYS 38 1.968 -19.265 1.765 341 2HE LYS 38 1HE LYS 38 2.744 -19.781 0.271 342 1HZ LYS 38 1HZ LYS 38 1.887 -21.502 2.537 343 2HZ LYS 38 2HZ LYS 38 2.865 -22.024 1.259 344 3HZ LYS 38 3HZ LYS 38 1.301 -21.487 0.934 345 H TYR 39 H TYR 39 1.871 -15.008 1.228 346 HA TYR 39 HA TYR 39 2.103 -15.627 -1.546 347 1HB TYR 39 2HB TYR 39 0.027 -15.617 -0.089 348 2HB TYR 39 1HB TYR 39 0.099 -13.867 -0.143 349 HD1 TYR 39 1HD TYR 39 -0.332 -16.891 -2.133 350 HD2 TYR 39 2HD TYR 39 -0.769 -12.680 -2.019 351 HE1 TYR 39 1HE TYR 39 -1.694 -16.991 -4.183 352 HE2 TYR 39 2HE TYR 39 -2.126 -12.749 -4.071 353 HH TYR 39 HH TYR 39 -3.352 -15.697 -5.249 354 H ASN 40 H ASN 40 3.233 -13.169 0.416 355 HA ASN 40 HA ASN 40 4.148 -11.151 0.171 356 1HB ASN 40 2HB ASN 40 5.337 -11.978 -1.815 357 2HB ASN 40 1HB ASN 40 3.924 -11.669 -2.816 358 1HD2 ASN 40 1HD2 ASN 40 3.498 -9.583 -3.478 359 2HD2 ASN 40 2HD2 ASN 40 4.607 -8.284 -3.266 360 HA PRO 41 HA PRO 41 0.340 -8.964 0.337 361 1HB PRO 41 2HB PRO 41 1.460 -6.542 1.091 362 2HB PRO 41 1HB PRO 41 0.999 -7.839 2.199 363 1HG PRO 41 2HG PRO 41 3.682 -7.139 1.109 364 2HG PRO 41 1HG PRO 41 3.237 -7.746 2.717 365 1HD PRO 41 2HD PRO 41 4.356 -9.320 0.827 366 2HD PRO 41 1HD PRO 41 3.188 -9.935 2.012 367 H SER 42 H SER 42 -0.251 -8.880 -1.790 368 HA SER 42 HA SER 42 0.806 -7.241 -3.780 369 1HB SER 42 2HB SER 42 -2.066 -8.095 -3.378 370 2HB SER 42 1HB SER 42 -1.284 -7.678 -4.902 371 HG SER 42 HG SER 42 -1.071 -9.737 -4.973 372 H LEU 43 H LEU 43 0.327 -5.090 -4.292 373 HA LEU 43 HA LEU 43 -0.371 -3.551 -2.022 374 1HB LEU 43 2HB LEU 43 1.419 -2.916 -3.639 375 2HB LEU 43 1HB LEU 43 0.188 -2.602 -4.837 376 HG LEU 43 HG LEU 43 1.253 -0.609 -3.596 377 1HD1 LEU 43 1HD1 LEU 43 -0.827 0.675 -3.626 378 2HD1 LEU 43 2HD1 LEU 43 -1.746 -0.827 -3.733 379 3HD1 LEU 43 3HD1 LEU 43 -0.673 -0.354 -5.051 380 1HD2 LEU 43 1HD2 LEU 43 1.061 -1.498 -1.303 381 2HD2 LEU 43 2HD2 LEU 43 -0.675 -1.544 -1.444 382 3HD2 LEU 43 3HD2 LEU 43 0.160 0.001 -1.452 383 H GLN 44 H GLN 44 -2.055 -4.249 -5.150 384 HA GLN 44 HA GLN 44 -4.197 -2.588 -4.825 385 1HB GLN 44 2HB GLN 44 -3.711 -3.852 -6.848 386 2HB GLN 44 1HB GLN 44 -3.971 -5.365 -5.996 387 1HG GLN 44 2HG GLN 44 -6.340 -4.772 -5.713 388 2HG GLN 44 1HG GLN 44 -6.054 -3.285 -6.621 389 1HE2 GLN 44 1HE2 GLN 44 -5.721 -3.407 -8.848 390 2HE2 GLN 44 2HE2 GLN 44 -6.064 -4.843 -9.734 391 H LEU 45 H LEU 45 -3.699 -5.870 -3.632 392 HA LEU 45 HA LEU 45 -6.194 -6.066 -2.349 393 1HB LEU 45 2HB LEU 45 -3.676 -7.681 -2.056 394 2HB LEU 45 1HB LEU 45 -5.085 -7.993 -1.069 395 HG LEU 45 HG LEU 45 -5.066 -9.569 -2.839 396 1HD1 LEU 45 1HD1 LEU 45 -7.121 -7.458 -3.400 397 2HD1 LEU 45 2HD1 LEU 45 -7.234 -8.770 -2.226 398 3HD1 LEU 45 3HD1 LEU 45 -7.192 -9.132 -3.951 399 1HD2 LEU 45 1HD2 LEU 45 -3.630 -8.408 -4.445 400 2HD2 LEU 45 2HD2 LEU 45 -4.928 -7.264 -4.791 401 3HD2 LEU 45 3HD2 LEU 45 -5.114 -8.963 -5.221 402 H ALA 46 H ALA 46 -3.089 -4.953 -1.226 403 HA ALA 46 HA ALA 46 -3.606 -4.982 1.544 404 1HB ALA 46 1HB ALA 46 -1.765 -3.382 1.756 405 2HB ALA 46 2HB ALA 46 -1.821 -3.076 0.019 406 3HB ALA 46 3HB ALA 46 -1.353 -4.666 0.620 407 H LEU 47 H LEU 47 -4.277 -2.561 -0.927 408 HA LEU 47 HA LEU 47 -5.154 -0.485 0.734 409 1HB LEU 47 2HB LEU 47 -5.422 -1.242 -2.130 410 2HB LEU 47 1HB LEU 47 -6.502 -0.018 -1.505 411 HG LEU 47 HG LEU 47 -4.694 1.466 -1.035 412 1HD1 LEU 47 1HD1 LEU 47 -2.801 -0.738 -1.788 413 2HD1 LEU 47 2HD1 LEU 47 -3.075 -0.107 -0.165 414 3HD1 LEU 47 3HD1 LEU 47 -2.364 0.927 -1.404 415 1HD2 LEU 47 1HD2 LEU 47 -5.430 1.409 -3.341 416 2HD2 LEU 47 2HD2 LEU 47 -4.237 0.163 -3.707 417 3HD2 LEU 47 3HD2 LEU 47 -3.710 1.779 -3.234 418 H LYS 48 H LYS 48 -6.901 -3.091 -0.893 419 HA LYS 48 HA LYS 48 -9.339 -2.168 0.209 420 1HB LYS 48 2HB LYS 48 -10.405 -4.301 -0.641 421 2HB LYS 48 1HB LYS 48 -9.700 -3.243 -1.845 422 1HG LYS 48 2HG LYS 48 -7.781 -4.723 -2.031 423 2HG LYS 48 1HG LYS 48 -8.452 -5.767 -0.774 424 1HD LYS 48 2HD LYS 48 -8.929 -6.682 -2.985 425 2HD LYS 48 1HD LYS 48 -10.419 -6.190 -2.185 426 1HE LYS 48 2HE LYS 48 -10.357 -4.067 -3.479 427 2HE LYS 48 1HE LYS 48 -8.932 -4.665 -4.328 428 1HZ LYS 48 1HZ LYS 48 -10.901 -5.051 -5.637 429 2HZ LYS 48 2HZ LYS 48 -11.655 -5.866 -4.379 430 3HZ LYS 48 3HZ LYS 48 -10.294 -6.541 -5.130 431 H ILE 49 H ILE 49 -7.040 -4.526 1.251 432 HA ILE 49 HA ILE 49 -8.545 -5.691 3.329 433 HB ILE 49 HB ILE 49 -5.550 -5.164 3.174 434 1HG1 ILE 49 2HG1 ILE 49 -7.136 -7.702 2.730 435 2HG1 ILE 49 1HG1 ILE 49 -6.455 -6.691 1.465 436 1HG2 ILE 49 1HG2 ILE 49 -5.272 -6.817 4.970 437 2HG2 ILE 49 2HG2 ILE 49 -7.024 -6.896 5.155 438 3HG2 ILE 49 3HG2 ILE 49 -6.168 -5.397 5.511 439 1HD1 ILE 49 1HD1 ILE 49 -4.892 -8.206 3.548 440 2HD1 ILE 49 2HD1 ILE 49 -4.203 -7.203 2.271 441 3HD1 ILE 49 3HD1 ILE 49 -5.096 -8.667 1.858 442 H ALA 50 H ALA 50 -6.584 -2.779 3.218 443 HA ALA 50 HA ALA 50 -6.705 -1.939 5.882 444 1HB ALA 50 1HB ALA 50 -5.272 -0.919 4.166 445 2HB ALA 50 2HB ALA 50 -6.280 0.289 4.990 446 3HB ALA 50 3HB ALA 50 -6.729 -0.290 3.385 447 H TYR 51 H TYR 51 -8.837 -1.384 3.176 448 HA TYR 51 HA TYR 51 -10.623 0.307 4.548 449 1HB TYR 51 2HB TYR 51 -10.441 0.498 2.182 450 2HB TYR 51 1HB TYR 51 -10.837 -1.200 1.955 451 HD1 TYR 51 1HD TYR 51 -12.981 -1.872 1.728 452 HD2 TYR 51 2HD TYR 51 -12.229 2.049 3.081 453 HE1 TYR 51 1HE TYR 51 -15.403 -1.335 1.467 454 HE2 TYR 51 2HE TYR 51 -14.605 2.622 2.842 455 HH TYR 51 HH TYR 51 -16.510 1.804 1.436 456 H TYR 52 H TYR 52 -10.852 -3.136 3.640 457 HA TYR 52 HA TYR 52 -13.422 -3.414 4.789 458 1HB TYR 52 2HB TYR 52 -11.475 -5.449 3.767 459 2HB TYR 52 1HB TYR 52 -13.021 -5.906 4.489 460 HD1 TYR 52 1HD TYR 52 -15.088 -4.647 3.581 461 HD2 TYR 52 2HD TYR 52 -11.431 -5.002 1.463 462 HE1 TYR 52 1HE TYR 52 -16.263 -4.178 1.496 463 HE2 TYR 52 2HE TYR 52 -12.602 -4.533 -0.644 464 HH TYR 52 HH TYR 52 -14.844 -4.655 -1.550 465 H LEU 53 H LEU 53 -10.338 -3.796 6.127 466 HA LEU 53 HA LEU 53 -11.502 -4.903 8.579 467 1HB LEU 53 2HB LEU 53 -8.639 -4.205 7.916 468 2HB LEU 53 1HB LEU 53 -9.151 -4.801 9.482 469 1HD1 LEU 53 1HD1 LEU 53 -7.644 -7.744 7.796 470 2HD1 LEU 53 2HD1 LEU 53 -7.504 -6.671 9.189 471 3HD1 LEU 53 3HD1 LEU 53 -7.083 -6.087 7.578 472 1HD2 LEU 53 1HD2 LEU 53 -9.994 -8.212 8.315 473 2HD2 LEU 53 2HD2 LEU 53 -11.149 -6.893 8.492 474 3HD2 LEU 53 3HD2 LEU 53 -9.921 -7.164 9.731 475 H ASN 54 H ASN 54 -11.187 -1.991 7.192 476 HA ASN 54 HA ASN 54 -10.987 0.176 7.753 477 1HB ASN 54 2HB ASN 54 -13.307 -0.311 8.426 478 2HB ASN 54 1HB ASN 54 -12.755 -0.745 10.037 479 1HD2 ASN 54 1HD2 ASN 54 -14.039 0.810 10.999 480 2HD2 ASN 54 2HD2 ASN 54 -13.684 2.502 10.894 481 H THR 55 H THR 55 -8.749 -0.343 8.164 482 HA THR 55 HA THR 55 -7.909 0.813 10.668 483 HB THR 55 HB THR 55 -7.019 -1.977 9.793 484 HG1 THR 55 1HG THR 55 -9.086 -1.272 11.146 485 1HG2 THR 55 1HG2 THR 55 -5.730 -2.019 11.885 486 2HG2 THR 55 2HG2 THR 55 -6.242 -0.369 12.237 487 3HG2 THR 55 3HG2 THR 55 -5.202 -0.693 10.850 488 HA PRO 56 HA PRO 56 -5.083 2.556 7.635 489 1HB PRO 56 2HB PRO 56 -3.110 2.546 9.861 490 2HB PRO 56 1HB PRO 56 -3.625 3.875 8.824 491 1HG PRO 56 2HG PRO 56 -4.452 3.698 11.360 492 2HG PRO 56 1HG PRO 56 -5.496 4.329 10.074 493 1HD PRO 56 2HD PRO 56 -5.564 1.690 11.450 494 2HD PRO 56 1HD PRO 56 -6.898 2.665 10.802 495 H LEU 57 H LEU 57 -3.817 1.543 6.259 496 HA LEU 57 HA LEU 57 -3.196 -1.128 6.623 497 1HB LEU 57 2HB LEU 57 -1.664 -0.772 4.533 498 2HB LEU 57 1HB LEU 57 -3.405 -0.783 4.420 499 1HD1 LEU 57 1HD1 LEU 57 -1.542 2.234 5.615 500 2HD1 LEU 57 2HD1 LEU 57 -1.414 2.964 4.013 501 3HD1 LEU 57 3HD1 LEU 57 -0.443 1.548 4.418 502 1HD2 LEU 57 1HD2 LEU 57 -1.439 0.343 2.407 503 2HD2 LEU 57 2HD2 LEU 57 -2.315 1.839 2.067 504 3HD2 LEU 57 3HD2 LEU 57 -3.194 0.314 2.218 505 H GLU 58 H GLU 58 -1.214 1.595 7.442 506 HA GLU 58 HA GLU 58 1.217 0.183 7.676 507 1HB GLU 58 2HB GLU 58 0.293 2.605 9.237 508 2HB GLU 58 1HB GLU 58 1.943 2.014 9.156 509 1HG GLU 58 2HG GLU 58 1.833 2.414 6.671 510 2HG GLU 58 1HG GLU 58 0.298 3.235 6.976 511 H ASP 59 H ASP 59 -1.608 0.386 9.725 512 HA ASP 59 HA ASP 59 -0.335 -0.626 12.077 513 1HB ASP 59 2HB ASP 59 -2.460 0.778 12.023 514 2HB ASP 59 1HB ASP 59 -3.290 -0.634 11.387 515 H ILE 60 H ILE 60 -2.050 -1.813 9.361 516 HA ILE 60 HA ILE 60 -2.384 -4.556 10.224 517 HB ILE 60 HB ILE 60 -2.675 -3.449 7.411 518 1HG1 ILE 60 2HG1 ILE 60 -4.774 -3.863 9.557 519 2HG1 ILE 60 1HG1 ILE 60 -4.151 -2.303 9.039 520 1HG2 ILE 60 1HG2 ILE 60 -3.727 -5.984 8.688 521 2HG2 ILE 60 2HG2 ILE 60 -2.428 -5.886 7.497 522 3HG2 ILE 60 3HG2 ILE 60 -4.076 -5.442 7.046 523 1HD1 ILE 60 1HD1 ILE 60 -5.091 -2.678 6.814 524 2HD1 ILE 60 2HD1 ILE 60 -6.327 -2.762 8.069 525 3HD1 ILE 60 3HD1 ILE 60 -5.706 -4.244 7.341 526 H PHE 61 H PHE 61 -0.427 -3.105 7.637 527 HA PHE 61 HA PHE 61 1.405 -5.392 7.977 528 1HB PHE 61 2HB PHE 61 1.126 -3.600 5.467 529 2HB PHE 61 1HB PHE 61 2.200 -4.964 5.699 530 HD1 PHE 61 1HD PHE 61 1.353 -7.232 5.641 531 HD2 PHE 61 2HD PHE 61 -1.192 -3.883 5.007 532 HE1 PHE 61 1HE PHE 61 -0.347 -8.712 4.654 533 HE2 PHE 61 2HE PHE 61 -2.898 -5.358 4.025 534 HZ PHE 61 HZ PHE 61 -2.475 -7.775 3.847 535 H GLN 62 H GLN 62 3.507 -4.935 8.455 536 HA GLN 62 HA GLN 62 4.083 -2.111 8.818 537 1HB GLN 62 2HB GLN 62 5.204 -4.513 10.273 538 2HB GLN 62 1HB GLN 62 5.789 -2.866 10.479 539 1HG GLN 62 2HG GLN 62 3.536 -2.189 11.211 540 2HG GLN 62 1HG GLN 62 3.019 -3.867 11.088 541 1HE2 GLN 62 1HE2 GLN 62 3.142 -2.020 13.326 542 2HE2 GLN 62 2HE2 GLN 62 4.043 -2.793 14.574 543 H TRP 63 H TRP 63 5.525 -1.271 7.666 544 HA TRP 63 HA TRP 63 7.234 -3.062 6.159 545 1HB TRP 63 2HB TRP 63 7.077 -1.153 4.392 546 2HB TRP 63 1HB TRP 63 5.900 -2.442 4.439 547 HD1 TRP 63 HD TRP 63 6.275 1.200 5.747 548 HE1 TRP 63 1HE TRP 63 3.983 2.324 5.632 549 HE3 TRP 63 3HE TRP 63 3.513 -2.805 4.231 550 HZ2 TRP 63 2HZ TRP 63 1.332 1.599 4.981 551 HZ3 TRP 63 3HZ TRP 63 1.102 -2.504 3.886 552 HH2 TRP 63 HH TRP 63 0.040 -0.353 4.254 553 H GLN 64 H GLN 64 9.188 -2.753 6.054 554 HA GLN 64 HA GLN 64 10.381 -0.203 6.884 555 1HB GLN 64 2HB GLN 64 11.471 -3.027 7.090 556 2HB GLN 64 1HB GLN 64 12.332 -1.570 7.556 557 1HG GLN 64 2HG GLN 64 9.765 -2.489 8.817 558 2HG GLN 64 1HG GLN 64 11.362 -2.867 9.454 559 1HE2 GLN 64 1HE2 GLN 64 8.960 -0.404 8.998 560 2HE2 GLN 64 2HE2 GLN 64 9.678 0.767 10.024 561 HA PRO 65 HA PRO 65 11.592 -0.467 2.503 562 1HB PRO 65 2HB PRO 65 13.197 1.938 3.105 563 2HB PRO 65 1HB PRO 65 11.817 1.766 2.013 564 1HG PRO 65 2HG PRO 65 11.543 3.137 4.292 565 2HG PRO 65 1HG PRO 65 10.260 2.041 3.724 566 1HD PRO 65 2HD PRO 65 12.396 1.485 5.762 567 2HD PRO 65 1HD PRO 65 10.631 1.292 5.911 568 H GLU 66 H GLU 66 12.995 -1.702 4.523 569 HA GLU 66 HA GLU 66 15.631 -2.199 3.472 570 1HB GLU 66 2HB GLU 66 15.320 -1.137 6.306 571 2HB GLU 66 1HB GLU 66 16.770 -1.923 5.713 572 1HG GLU 66 2HG GLU 66 15.627 0.671 4.679 573 2HG GLU 66 1HG GLU 66 16.986 0.516 5.786 574 1H MET 67 1HT MET 67 -12.872 1.306 -7.995 575 2H MET 67 2HT MET 67 -12.274 1.722 -6.473 576 3H MET 67 3HT MET 67 -11.278 0.913 -7.573 577 HA MET 67 HA MET 67 -11.237 2.803 -8.984 578 1HB MET 67 2HB MET 67 -13.028 3.974 -6.853 579 2HB MET 67 1HB MET 67 -12.125 4.966 -7.980 580 1HG MET 67 2HG MET 67 -14.184 2.912 -8.739 581 2HG MET 67 1HG MET 67 -14.469 4.648 -8.625 582 1HE MET 67 1HE MET 67 -15.391 4.751 -11.090 583 2HE MET 67 2HE MET 67 -15.171 3.006 -11.232 584 3HE MET 67 3HE MET 67 -14.545 4.078 -12.484 585 H ILE 68 H ILE 68 -9.094 2.848 -8.650 586 HA ILE 68 HA ILE 68 -8.160 3.826 -6.077 587 HB ILE 68 HB ILE 68 -6.599 2.762 -8.462 588 1HG1 ILE 68 2HG1 ILE 68 -7.883 0.971 -7.426 589 2HG1 ILE 68 1HG1 ILE 68 -6.176 0.761 -7.064 590 1HG2 ILE 68 1HG2 ILE 68 -5.629 3.450 -5.685 591 2HG2 ILE 68 2HG2 ILE 68 -5.271 4.337 -7.165 592 3HG2 ILE 68 3HG2 ILE 68 -4.657 2.697 -6.952 593 1HD1 ILE 68 1HD1 ILE 68 -6.551 1.677 -4.823 594 2HD1 ILE 68 2HD1 ILE 68 -7.557 0.263 -5.129 595 3HD1 ILE 68 3HD1 ILE 68 -8.262 1.878 -5.197 596 H ILE 69 H ILE 69 -7.479 5.870 -5.876 597 HA ILE 69 HA ILE 69 -7.271 7.503 -8.299 598 HB ILE 69 HB ILE 69 -8.204 8.333 -5.508 599 1HG1 ILE 69 2HG1 ILE 69 -10.268 9.182 -6.778 600 2HG1 ILE 69 1HG1 ILE 69 -9.700 8.230 -8.139 601 1HG2 ILE 69 1HG2 ILE 69 -7.755 10.100 -7.901 602 2HG2 ILE 69 2HG2 ILE 69 -6.792 10.059 -6.427 603 3HG2 ILE 69 3HG2 ILE 69 -8.468 10.607 -6.367 604 1HD1 ILE 69 1HD1 ILE 69 -9.908 6.201 -6.783 605 2HD1 ILE 69 2HD1 ILE 69 -11.437 7.071 -6.910 606 3HD1 ILE 69 3HD1 ILE 69 -10.486 7.172 -5.429 607 H ASN 70 H ASN 70 -5.140 8.326 -8.569 608 HA ASN 70 HA ASN 70 -3.412 7.900 -6.299 609 1HB ASN 70 2HB ASN 70 -2.845 6.677 -8.324 610 2HB ASN 70 1HB ASN 70 -2.933 8.159 -9.270 611 1HD2 ASN 70 1HD2 ASN 70 -0.851 8.051 -9.961 612 2HD2 ASN 70 2HD2 ASN 70 0.512 8.266 -8.936 613 H ASN 71 H ASN 71 -2.521 9.660 -5.364 614 HA ASN 71 HA ASN 71 -2.661 12.173 -6.831 615 1HB ASN 71 2HB ASN 71 -3.375 11.658 -3.951 616 2HB ASN 71 1HB ASN 71 -2.863 13.256 -4.487 617 1HD2 ASN 71 1HD2 ASN 71 -5.461 12.383 -3.453 618 2HD2 ASN 71 2HD2 ASN 71 -6.607 12.789 -4.676 619 H LEU 72 H LEU 72 -0.602 10.160 -6.584 620 HA LEU 72 HA LEU 72 1.557 10.662 -5.008 621 1HB LEU 72 2HB LEU 72 1.187 8.942 -6.851 622 2HB LEU 72 1HB LEU 72 1.698 10.163 -7.989 623 HG LEU 72 HG LEU 72 3.433 8.499 -7.512 624 1HD1 LEU 72 1HD1 LEU 72 5.315 9.956 -6.992 625 2HD1 LEU 72 2HD1 LEU 72 4.191 11.220 -6.489 626 3HD1 LEU 72 3HD1 LEU 72 4.217 10.682 -8.167 627 1HD2 LEU 72 1HD2 LEU 72 2.811 7.922 -5.276 628 2HD2 LEU 72 2HD2 LEU 72 3.279 9.521 -4.700 629 3HD2 LEU 72 3HD2 LEU 72 4.504 8.412 -5.323 630 H LYS 73 H LYS 73 0.820 12.254 -8.110 631 HA LYS 73 HA LYS 73 3.007 14.020 -7.824 632 1HB LYS 73 2HB LYS 73 2.004 15.312 -9.773 633 2HB LYS 73 1HB LYS 73 2.455 13.646 -10.061 634 1HG LYS 73 2HG LYS 73 0.062 13.021 -9.800 635 2HG LYS 73 1HG LYS 73 -0.321 14.743 -9.687 636 1HD LYS 73 2HD LYS 73 0.519 15.152 -11.878 637 2HD LYS 73 1HD LYS 73 1.202 13.532 -11.980 638 1HE LYS 73 2HE LYS 73 -1.060 12.591 -11.945 639 2HE LYS 73 1HE LYS 73 -1.729 14.221 -11.851 640 1HZ LYS 73 1HZ LYS 73 -1.689 13.234 -14.131 641 2HZ LYS 73 2HZ LYS 73 0.003 13.311 -14.096 642 3HZ LYS 73 3HZ LYS 73 -0.907 14.721 -13.999 643 H LEU 74 H LEU 74 -0.420 14.481 -7.072 644 HA LEU 74 HA LEU 74 -0.342 17.148 -6.340 645 1HB LEU 74 2HB LEU 74 -2.380 15.712 -6.527 646 2HB LEU 74 1HB LEU 74 -1.901 14.865 -5.084 647 HG LEU 74 HG LEU 74 -3.809 16.473 -4.823 648 1HD1 LEU 74 1HD1 LEU 74 -2.619 15.760 -2.860 649 2HD1 LEU 74 2HD1 LEU 74 -3.087 17.456 -2.714 650 3HD1 LEU 74 3HD1 LEU 74 -1.418 17.029 -3.098 651 1HD2 LEU 74 1HD2 LEU 74 -3.032 18.244 -6.276 652 2HD2 LEU 74 2HD2 LEU 74 -1.671 18.557 -5.199 653 3HD2 LEU 74 3HD2 LEU 74 -3.320 18.860 -4.649 654 H ILE 75 H ILE 75 0.426 14.283 -4.415 655 HA ILE 75 HA ILE 75 1.154 15.663 -2.064 656 HB ILE 75 HB ILE 75 1.636 12.842 -3.009 657 1HG1 ILE 75 2HG1 ILE 75 0.455 12.252 -0.922 658 2HG1 ILE 75 1HG1 ILE 75 0.386 13.949 -0.484 659 1HG2 ILE 75 1HG2 ILE 75 3.769 13.381 -2.004 660 2HG2 ILE 75 2HG2 ILE 75 2.882 12.268 -0.959 661 3HG2 ILE 75 3HG2 ILE 75 2.969 13.985 -0.559 662 1HD1 ILE 75 1HD1 ILE 75 -0.977 12.657 -2.827 663 2HD1 ILE 75 2HD1 ILE 75 -1.059 14.366 -2.404 664 3HD1 ILE 75 3HD1 ILE 75 -1.736 13.154 -1.315 665 H ARG 76 H ARG 76 2.992 14.712 -4.849 666 HA ARG 76 HA ARG 76 5.551 15.447 -3.931 667 1HB ARG 76 2HB ARG 76 4.406 15.497 -6.697 668 2HB ARG 76 1HB ARG 76 6.051 15.982 -6.347 669 1HG ARG 76 2HG ARG 76 6.390 13.676 -5.393 670 2HG ARG 76 1HG ARG 76 4.819 13.262 -6.107 671 1HD ARG 76 2HD ARG 76 6.719 12.750 -7.617 672 2HD ARG 76 1HD ARG 76 5.589 13.931 -8.298 673 HE ARG 76 HE ARG 76 7.989 14.851 -6.883 674 1HH1 ARG 76 1HH1 ARG 76 6.233 14.654 -10.004 675 2HH1 ARG 76 2HH1 ARG 76 7.134 15.913 -10.665 676 1HH2 ARG 76 1HH2 ARG 76 9.078 16.627 -7.857 677 2HH2 ARG 76 2HH2 ARG 76 8.713 17.070 -9.481 678 H GLU 77 H GLU 77 2.940 17.400 -5.409 679 HA GLU 77 HA GLU 77 4.457 19.739 -5.520 680 1HB GLU 77 2HB GLU 77 1.462 19.349 -5.548 681 2HB GLU 77 1HB GLU 77 2.321 20.801 -6.059 682 1HG GLU 77 2HG GLU 77 3.436 19.507 -7.820 683 2HG GLU 77 1HG GLU 77 2.546 18.079 -7.317 684 H LYS 78 H LYS 78 2.295 18.371 -3.095 685 HA LYS 78 HA LYS 78 2.299 20.471 -1.278 686 1HB LYS 78 2HB LYS 78 2.313 17.511 -0.670 687 2HB LYS 78 1HB LYS 78 2.001 18.757 0.528 688 1HG LYS 78 2HG LYS 78 0.350 18.210 -1.929 689 2HG LYS 78 1HG LYS 78 -0.063 17.765 -0.271 690 1HD LYS 78 2HD LYS 78 -0.097 20.117 0.362 691 2HD LYS 78 1HD LYS 78 0.358 20.576 -1.279 692 1HE LYS 78 2HE LYS 78 -1.726 19.527 -2.099 693 2HE LYS 78 1HE LYS 78 -2.182 19.197 -0.427 694 1HZ LYS 78 1HZ LYS 78 -3.225 21.214 -1.232 695 2HZ LYS 78 2HZ LYS 78 -1.709 21.870 -1.611 696 3HZ LYS 78 3HZ LYS 78 -2.117 21.602 -0.007 697 H LYS 79 H LYS 79 4.853 18.180 -1.883 698 HA LYS 79 HA LYS 79 6.607 19.676 -0.048 699 1HB LYS 79 2HB LYS 79 7.054 17.054 -1.548 700 2HB LYS 79 1HB LYS 79 8.244 17.819 -0.507 701 1HG LYS 79 2HG LYS 79 5.575 16.726 0.368 702 2HG LYS 79 1HG LYS 79 7.141 15.942 0.592 703 1HD LYS 79 2HD LYS 79 7.874 17.830 1.980 704 2HD LYS 79 1HD LYS 79 6.306 18.604 1.753 705 1HE LYS 79 2HE LYS 79 6.769 15.926 3.066 706 2HE LYS 79 1HE LYS 79 6.487 17.442 3.917 707 1HZ LYS 79 1HZ LYS 79 4.534 16.113 2.080 708 2HZ LYS 79 2HZ LYS 79 4.314 17.568 2.884 709 3HZ LYS 79 3HZ LYS 79 4.459 16.147 3.773 710 H LYS 80 H LYS 80 9.221 19.728 -1.799 711 HA LYS 80 HA LYS 80 8.168 19.713 -4.309 712 1HB LYS 80 2HB LYS 80 9.275 21.904 -4.820 713 2HB LYS 80 1HB LYS 80 7.821 22.024 -3.855 714 1HG LYS 80 2HG LYS 80 9.267 22.306 -1.847 715 2HG LYS 80 1HG LYS 80 10.666 22.351 -2.935 716 1HD LYS 80 2HD LYS 80 9.603 24.211 -4.158 717 2HD LYS 80 1HD LYS 80 8.294 24.200 -2.981 718 1HE LYS 80 2HE LYS 80 9.924 24.697 -1.211 719 2HE LYS 80 1HE LYS 80 11.200 24.761 -2.431 720 1HZ LYS 80 1HZ LYS 80 10.521 26.968 -2.067 721 2HZ LYS 80 2HZ LYS 80 8.878 26.559 -2.121 722 3HZ LYS 80 3HZ LYS 80 9.804 26.516 -3.541 723 H ILE 81 H ILE 81 9.175 17.904 -4.417 724 HA ILE 81 HA ILE 81 12.084 18.036 -4.671 725 HB ILE 81 HB ILE 81 10.453 15.655 -3.671 726 1HG1 ILE 81 2HG1 ILE 81 12.451 17.388 -2.183 727 2HG1 ILE 81 1HG1 ILE 81 10.708 17.452 -1.980 728 1HG2 ILE 81 1HG2 ILE 81 13.440 15.953 -4.041 729 2HG2 ILE 81 2HG2 ILE 81 12.366 14.955 -5.021 730 3HG2 ILE 81 3HG2 ILE 81 12.631 14.558 -3.323 731 1HD1 ILE 81 1HD1 ILE 81 12.475 15.099 -1.337 732 2HD1 ILE 81 2HD1 ILE 81 10.724 15.167 -1.131 733 3HD1 ILE 81 3HD1 ILE 81 11.763 16.220 -0.174 734 H SER 82 H SER 82 12.765 17.270 -6.596 735 HA SER 82 HA SER 82 10.704 17.029 -8.591 736 1HB SER 82 2HB SER 82 13.697 17.257 -8.827 737 2HB SER 82 1HB SER 82 12.511 17.480 -10.119 738 HG SER 82 HG SER 82 11.754 19.009 -8.132 739 H GLN 83 H GLN 83 11.240 15.473 -10.401 740 HA GLN 83 HA GLN 83 10.945 12.900 -9.250 741 1HB GLN 83 2HB GLN 83 10.771 12.032 -11.557 742 2HB GLN 83 1HB GLN 83 9.714 13.400 -11.260 743 1HG GLN 83 2HG GLN 83 11.300 14.857 -12.425 744 2HG GLN 83 1HG GLN 83 12.339 13.466 -12.727 745 1HE2 GLN 83 1HE2 GLN 83 11.698 11.934 -14.273 746 2HE2 GLN 83 2HE2 GLN 83 10.443 12.267 -15.393 747 H SER 84 H SER 84 13.773 14.488 -10.792 748 HA SER 84 HA SER 84 15.238 12.138 -11.061 749 1HB SER 84 2HB SER 84 17.143 13.838 -11.179 750 2HB SER 84 1HB SER 84 15.852 14.009 -12.370 751 HG SER 84 HG SER 84 16.575 15.682 -10.277 752 H GLU 85 H GLU 85 15.154 14.632 -8.526 753 HA GLU 85 HA GLU 85 17.160 13.366 -6.974 754 1HB GLU 85 2HB GLU 85 15.182 15.513 -6.246 755 2HB GLU 85 1HB GLU 85 16.367 14.887 -5.117 756 1HG GLU 85 2HG GLU 85 17.183 16.937 -5.997 757 2HG GLU 85 1HG GLU 85 18.153 15.637 -6.673 758 H LEU 86 H LEU 86 13.623 13.260 -6.901 759 HA LEU 86 HA LEU 86 13.475 11.854 -4.476 760 1HB LEU 86 2HB LEU 86 11.570 13.068 -5.503 761 2HB LEU 86 1HB LEU 86 11.513 11.865 -6.774 762 HG LEU 86 HG LEU 86 10.891 10.145 -5.132 763 1HD1 LEU 86 1HD1 LEU 86 10.896 12.419 -3.144 764 2HD1 LEU 86 2HD1 LEU 86 12.020 11.060 -3.169 765 3HD1 LEU 86 3HD1 LEU 86 10.308 10.784 -2.841 766 1HD2 LEU 86 1HD2 LEU 86 9.138 11.406 -6.281 767 2HD2 LEU 86 2HD2 LEU 86 9.165 12.617 -4.997 768 3HD2 LEU 86 3HD2 LEU 86 8.642 10.971 -4.646 769 H ALA 87 H ALA 87 13.661 10.822 -7.858 770 HA ALA 87 HA ALA 87 13.353 8.074 -7.458 771 1HB ALA 87 1HB ALA 87 15.038 9.465 -9.533 772 2HB ALA 87 2HB ALA 87 13.314 9.124 -9.670 773 3HB ALA 87 3HB ALA 87 14.473 7.796 -9.601 774 H ALA 88 H ALA 88 16.268 10.130 -7.329 775 HA ALA 88 HA ALA 88 18.110 8.062 -6.967 776 1HB ALA 88 1HB ALA 88 18.731 10.344 -7.617 777 2HB ALA 88 2HB ALA 88 19.614 9.816 -6.185 778 3HB ALA 88 3HB ALA 88 18.251 10.925 -6.023 779 H LEU 89 H LEU 89 16.209 9.961 -4.693 780 HA LEU 89 HA LEU 89 17.332 8.965 -2.305 781 1HB LEU 89 2HB LEU 89 14.558 10.012 -2.850 782 2HB LEU 89 1HB LEU 89 15.190 9.680 -1.253 783 HG LEU 89 HG LEU 89 16.264 11.755 -3.163 784 1HD1 LEU 89 1HD1 LEU 89 14.611 12.028 -0.657 785 2HD1 LEU 89 2HD1 LEU 89 14.063 12.338 -2.305 786 3HD1 LEU 89 3HD1 LEU 89 15.305 13.360 -1.581 787 1HD2 LEU 89 1HD2 LEU 89 17.993 10.837 -1.702 788 2HD2 LEU 89 2HD2 LEU 89 16.977 11.141 -0.292 789 3HD2 LEU 89 3HD2 LEU 89 17.594 12.493 -1.244 790 H LEU 90 H LEU 90 14.723 7.829 -4.361 791 HA LEU 90 HA LEU 90 13.894 5.751 -2.527 792 1HB LEU 90 2HB LEU 90 13.208 6.066 -5.432 793 2HB LEU 90 1HB LEU 90 12.321 5.156 -4.233 794 HG LEU 90 HG LEU 90 12.546 8.150 -4.422 795 1HD1 LEU 90 1HD1 LEU 90 10.237 6.303 -4.926 796 2HD1 LEU 90 2HD1 LEU 90 11.148 7.210 -6.136 797 3HD1 LEU 90 3HD1 LEU 90 10.171 8.064 -4.941 798 1HD2 LEU 90 1HD2 LEU 90 10.992 6.461 -2.476 799 2HD2 LEU 90 2HD2 LEU 90 10.895 8.217 -2.626 800 3HD2 LEU 90 3HD2 LEU 90 12.397 7.457 -2.102 801 H GLU 91 H GLU 91 16.459 6.105 -4.597 802 HA GLU 91 HA GLU 91 17.967 4.788 -5.637 803 1HB GLU 91 2HB GLU 91 16.690 2.592 -3.998 804 2HB GLU 91 1HB GLU 91 18.211 2.459 -4.857 805 1HG GLU 91 2HG GLU 91 19.198 4.136 -3.416 806 2HG GLU 91 1HG GLU 91 17.650 4.351 -2.592 807 H VAL 92 H VAL 92 15.467 5.288 -6.965 808 HA VAL 92 HA VAL 92 15.186 2.823 -8.525 809 HB VAL 92 HB VAL 92 12.867 3.382 -9.015 810 1HG1 VAL 92 1HG1 VAL 92 13.363 3.386 -6.052 811 2HG1 VAL 92 2HG1 VAL 92 13.212 1.974 -7.100 812 3HG1 VAL 92 3HG1 VAL 92 11.821 3.024 -6.829 813 1HG2 VAL 92 1HG2 VAL 92 13.251 5.771 -7.209 814 2HG2 VAL 92 2HG2 VAL 92 11.690 5.219 -7.818 815 3HG2 VAL 92 3HG2 VAL 92 12.922 5.791 -8.940 816 H SER 93 H SER 93 14.225 3.446 -10.761 817 HA SER 93 HA SER 93 15.972 5.404 -11.876 818 1HB SER 93 2HB SER 93 13.750 3.798 -13.166 819 2HB SER 93 1HB SER 93 15.054 4.643 -14.002 820 HG SER 93 HG SER 93 16.477 3.276 -12.626 821 H ARG 94 H ARG 94 15.282 7.249 -13.056 822 HA ARG 94 HA ARG 94 13.402 8.891 -11.742 823 1HB ARG 94 2HB ARG 94 14.604 9.197 -14.495 824 2HB ARG 94 1HB ARG 94 13.788 10.466 -13.592 825 1HG ARG 94 2HG ARG 94 15.489 10.428 -11.903 826 2HG ARG 94 1HG ARG 94 16.263 9.042 -12.669 827 1HD ARG 94 2HD ARG 94 16.719 10.384 -14.644 828 2HD ARG 94 1HD ARG 94 15.931 11.771 -13.891 829 HE ARG 94 HE ARG 94 17.891 10.867 -12.163 830 1HH1 ARG 94 1HH1 ARG 94 17.806 12.199 -15.465 831 2HH1 ARG 94 2HH1 ARG 94 19.278 13.043 -15.299 832 1HH2 ARG 94 1HH2 ARG 94 19.911 12.062 -11.958 833 2HH2 ARG 94 2HH2 ARG 94 20.481 13.008 -13.252 834 H GLN 95 H GLN 95 13.270 7.009 -14.565 835 HA GLN 95 HA GLN 95 10.732 7.792 -15.525 836 1HB GLN 95 2HB GLN 95 12.383 6.636 -16.906 837 2HB GLN 95 1HB GLN 95 12.202 5.193 -15.930 838 1HG GLN 95 2HG GLN 95 9.971 4.874 -16.714 839 2HG GLN 95 1HG GLN 95 10.000 6.429 -17.551 840 1HE2 GLN 95 1HE2 GLN 95 11.154 6.640 -19.423 841 2HE2 GLN 95 2HE2 GLN 95 11.727 5.293 -20.322 842 H THR 96 H THR 96 11.692 5.567 -13.016 843 HA THR 96 HA THR 96 9.346 4.030 -12.836 844 HB THR 96 HB THR 96 11.325 4.778 -10.667 845 HG1 THR 96 1HG THR 96 11.559 3.278 -12.903 846 1HG2 THR 96 1HG2 THR 96 10.662 2.639 -9.631 847 2HG2 THR 96 2HG2 THR 96 9.467 2.393 -10.905 848 3HG2 THR 96 3HG2 THR 96 9.286 3.732 -9.772 849 H ILE 97 H ILE 97 10.424 6.909 -10.983 850 HA ILE 97 HA ILE 97 7.988 7.092 -9.562 851 HB ILE 97 HB ILE 97 10.082 7.930 -8.610 852 1HG1 ILE 97 2HG1 ILE 97 7.917 9.036 -7.851 853 2HG1 ILE 97 1HG1 ILE 97 9.385 9.926 -7.518 854 1HG2 ILE 97 1HG2 ILE 97 11.244 8.673 -10.511 855 2HG2 ILE 97 2HG2 ILE 97 11.182 9.980 -9.330 856 3HG2 ILE 97 3HG2 ILE 97 10.123 10.014 -10.742 857 1HD1 ILE 97 1HD1 ILE 97 7.584 11.402 -8.226 858 2HD1 ILE 97 2HD1 ILE 97 7.428 10.509 -9.740 859 3HD1 ILE 97 3HD1 ILE 97 8.899 11.419 -9.403 860 H ASN 98 H ASN 98 9.182 8.583 -12.478 861 HA ASN 98 HA ASN 98 7.105 10.448 -12.849 862 1HB ASN 98 2HB ASN 98 9.256 10.615 -14.011 863 2HB ASN 98 1HB ASN 98 8.944 9.104 -14.848 864 1HD2 ASN 98 1HD2 ASN 98 8.108 12.485 -14.616 865 2HD2 ASN 98 2HD2 ASN 98 7.321 12.577 -16.140 866 H GLY 99 H GLY 99 7.502 7.078 -13.765 867 1HA GLY 99 2HA GLY 99 5.149 6.796 -15.294 868 2HA GLY 99 1HA GLY 99 6.011 5.496 -14.476 869 H ILE 100 H ILE 100 5.800 6.510 -11.814 870 HA ILE 100 HA ILE 100 3.253 5.536 -11.109 871 HB ILE 100 HB ILE 100 5.147 7.161 -9.361 872 1HG1 ILE 100 2HG1 ILE 100 6.278 5.171 -10.229 873 2HG1 ILE 100 1HG1 ILE 100 5.968 5.003 -8.509 874 1HG2 ILE 100 1HG2 ILE 100 2.910 5.284 -8.589 875 2HG2 ILE 100 2HG2 ILE 100 2.898 7.041 -8.428 876 3HG2 ILE 100 3HG2 ILE 100 4.019 6.077 -7.468 877 1HD1 ILE 100 1HD1 ILE 100 5.566 2.922 -9.686 878 2HD1 ILE 100 2HD1 ILE 100 4.391 3.719 -10.732 879 3HD1 ILE 100 3HD1 ILE 100 4.062 3.545 -9.009 880 H GLU 101 H GLU 101 4.551 8.819 -11.414 881 HA GLU 101 HA GLU 101 2.369 10.278 -10.514 882 1HB GLU 101 2HB GLU 101 4.150 10.958 -12.844 883 2HB GLU 101 1HB GLU 101 3.044 12.075 -12.072 884 1HG GLU 101 2HG GLU 101 4.339 11.753 -9.967 885 2HG GLU 101 1HG GLU 101 5.516 10.833 -10.914 886 H LYS 102 H LYS 102 2.717 8.543 -13.504 887 HA LYS 102 HA LYS 102 0.301 9.752 -14.575 888 1HB LYS 102 2HB LYS 102 2.228 7.769 -15.768 889 2HB LYS 102 1HB LYS 102 0.759 8.302 -16.568 890 1HG LYS 102 2HG LYS 102 1.609 10.623 -16.490 891 2HG LYS 102 1HG LYS 102 3.111 10.011 -15.792 892 1HD LYS 102 2HD LYS 102 1.988 9.139 -18.455 893 2HD LYS 102 1HD LYS 102 3.215 10.389 -18.250 894 1HE LYS 102 2HE LYS 102 3.498 7.520 -17.351 895 2HE LYS 102 1HE LYS 102 4.152 8.171 -18.850 896 1HZ LYS 102 1HZ LYS 102 5.849 8.122 -17.154 897 2HZ LYS 102 2HZ LYS 102 4.929 9.079 -16.106 898 3HZ LYS 102 3HZ LYS 102 5.482 9.707 -17.560 899 H ASN 103 H ASN 103 0.746 7.597 -12.309 900 HA ASN 103 HA ASN 103 -0.160 5.654 -11.533 901 1HB ASN 103 2HB ASN 103 -2.628 5.668 -11.383 902 2HB ASN 103 1HB ASN 103 -1.960 7.247 -11.023 903 1HD2 ASN 103 1HD2 ASN 103 -3.913 5.384 -13.166 904 2HD2 ASN 103 2HD2 ASN 103 -4.561 6.658 -14.103 905 H LYS 104 H LYS 104 1.017 5.177 -13.968 906 HA LYS 104 HA LYS 104 -0.391 2.810 -14.615 907 1HB LYS 104 2HB LYS 104 -1.375 4.488 -16.225 908 2HB LYS 104 1HB LYS 104 0.243 4.723 -16.880 909 1HG LYS 104 2HG LYS 104 0.330 2.320 -17.430 910 2HG LYS 104 1HG LYS 104 -1.334 2.164 -16.873 911 1HD LYS 104 2HD LYS 104 -2.052 3.744 -18.587 912 2HD LYS 104 1HD LYS 104 -0.380 3.908 -19.137 913 1HE LYS 104 2HE LYS 104 -2.038 1.386 -19.157 914 2HE LYS 104 1HE LYS 104 -1.584 2.351 -20.560 915 1HZ LYS 104 1HZ LYS 104 -0.156 0.433 -20.361 916 2HZ LYS 104 2HZ LYS 104 0.278 0.843 -18.789 917 3HZ LYS 104 3HZ LYS 104 0.764 1.823 -20.081 918 H TYR 105 H TYR 105 1.426 2.232 -13.477 919 HA TYR 105 HA TYR 105 3.672 1.497 -15.154 920 1HB TYR 105 2HB TYR 105 4.311 3.753 -14.244 921 2HB TYR 105 1HB TYR 105 4.071 3.140 -12.618 922 HD1 TYR 105 1HD TYR 105 6.253 3.078 -15.567 923 HD2 TYR 105 2HD TYR 105 5.750 1.728 -11.573 924 HE1 TYR 105 1HE TYR 105 8.616 2.409 -15.501 925 HE2 TYR 105 2HE TYR 105 8.104 1.050 -11.497 926 HH TYR 105 HH TYR 105 9.827 0.433 -13.027 927 H ASN 106 H ASN 106 1.387 0.985 -12.813 928 HA ASN 106 HA ASN 106 0.928 -0.295 -11.180 929 1HB ASN 106 2HB ASN 106 1.181 -2.106 -12.780 930 2HB ASN 106 1HB ASN 106 2.906 -2.200 -12.453 931 1HD2 ASN 106 1HD2 ASN 106 3.616 -3.372 -10.678 932 2HD2 ASN 106 2HD2 ASN 106 2.560 -4.299 -9.696 933 HA PRO 107 HA PRO 107 4.106 0.787 -8.262 934 1HB PRO 107 2HB PRO 107 2.067 1.788 -6.543 935 2HB PRO 107 1HB PRO 107 3.180 2.723 -7.543 936 1HG PRO 107 2HG PRO 107 0.422 2.564 -7.919 937 2HG PRO 107 1HG PRO 107 1.599 3.103 -9.130 938 1HD PRO 107 2HD PRO 107 0.280 0.440 -8.812 939 2HD PRO 107 1HD PRO 107 0.718 1.317 -10.297 940 H SER 108 H SER 108 4.753 -1.001 -7.202 941 HA SER 108 HA SER 108 2.870 -2.566 -5.685 942 1HB SER 108 2HB SER 108 5.882 -2.784 -6.000 943 2HB SER 108 1HB SER 108 4.853 -3.973 -5.190 944 HG SER 108 HG SER 108 5.438 -4.244 -7.573 945 H LEU 109 H LEU 109 3.595 -3.041 -3.274 946 HA LEU 109 HA LEU 109 3.258 -0.578 -2.006 947 1HB LEU 109 2HB LEU 109 2.378 -2.687 -1.078 948 2HB LEU 109 1HB LEU 109 4.002 -3.217 -0.727 949 HG LEU 109 HG LEU 109 2.633 -2.433 1.254 950 1HD1 LEU 109 1HD1 LEU 109 5.241 -1.015 0.787 951 2HD1 LEU 109 2HD1 LEU 109 5.025 -2.638 1.441 952 3HD1 LEU 109 3HD1 LEU 109 4.456 -1.240 2.352 953 1HD2 LEU 109 1HD2 LEU 109 2.439 0.021 1.664 954 2HD2 LEU 109 2HD2 LEU 109 1.524 -0.449 0.250 955 3HD2 LEU 109 3HD2 LEU 109 3.074 0.336 0.058 956 H GLN 110 H GLN 110 6.278 -2.517 -2.307 957 HA GLN 110 HA GLN 110 7.853 -1.019 -0.618 958 1HB GLN 110 2HB GLN 110 8.478 -3.136 -1.765 959 2HB GLN 110 1HB GLN 110 8.629 -2.249 -3.269 960 1HG GLN 110 2HG GLN 110 10.799 -2.694 -2.280 961 2HG GLN 110 1HG GLN 110 10.476 -0.963 -2.333 962 1HE2 GLN 110 1HE2 GLN 110 10.635 -3.765 -0.279 963 2HE2 GLN 110 2HE2 GLN 110 10.840 -2.923 1.207 964 H LEU 111 H LEU 111 7.055 -0.442 -3.972 965 HA LEU 111 HA LEU 111 8.634 1.873 -4.359 966 1HB LEU 111 2HB LEU 111 6.099 1.007 -5.765 967 2HB LEU 111 1HB LEU 111 7.006 2.423 -6.230 968 HG LEU 111 HG LEU 111 8.949 0.906 -6.753 969 1HD1 LEU 111 1HD1 LEU 111 6.917 -1.288 -6.398 970 2HD1 LEU 111 2HD1 LEU 111 8.354 -1.023 -5.409 971 3HD1 LEU 111 3HD1 LEU 111 8.522 -1.466 -7.108 972 1HD2 LEU 111 1HD2 LEU 111 8.004 0.130 -8.875 973 2HD2 LEU 111 2HD2 LEU 111 7.507 1.778 -8.490 974 3HD2 LEU 111 3HD2 LEU 111 6.381 0.441 -8.257 975 H ALA 112 H ALA 112 5.233 1.481 -3.478 976 HA ALA 112 HA ALA 112 4.611 4.208 -3.230 977 1HB ALA 112 1HB ALA 112 2.913 2.452 -3.428 978 2HB ALA 112 2HB ALA 112 2.644 3.452 -2.001 979 3HB ALA 112 3HB ALA 112 3.352 1.847 -1.831 980 H LEU 113 H LEU 113 5.866 1.836 -0.887 981 HA LEU 113 HA LEU 113 5.619 3.316 1.434 982 1HB LEU 113 2HB LEU 113 6.010 1.066 1.720 983 2HB LEU 113 1HB LEU 113 7.254 1.012 0.496 984 HG LEU 113 HG LEU 113 8.818 2.123 2.048 985 1HD1 LEU 113 1HD1 LEU 113 8.295 2.340 4.410 986 2HD1 LEU 113 2HD1 LEU 113 6.626 1.870 4.091 987 3HD1 LEU 113 3HD1 LEU 113 7.264 3.372 3.417 988 1HD2 LEU 113 1HD2 LEU 113 9.134 0.214 3.536 989 2HD2 LEU 113 2HD2 LEU 113 8.770 -0.288 1.884 990 3HD2 LEU 113 3HD2 LEU 113 7.519 -0.366 3.126 991 H LYS 114 H LYS 114 8.336 3.040 -0.848 992 HA LYS 114 HA LYS 114 9.865 4.707 0.821 993 1HB LYS 114 2HB LYS 114 11.466 4.901 -1.142 994 2HB LYS 114 1HB LYS 114 11.196 3.312 -0.457 995 1HG LYS 114 2HG LYS 114 9.639 2.828 -2.321 996 2HG LYS 114 1HG LYS 114 10.055 4.399 -3.018 997 1HD LYS 114 2HD LYS 114 11.352 2.505 -3.982 998 2HD LYS 114 1HD LYS 114 12.358 3.752 -3.240 999 1HE LYS 114 2HE LYS 114 12.481 2.362 -1.184 1000 2HE LYS 114 1HE LYS 114 11.572 1.105 -2.019 1001 1HZ LYS 114 1HZ LYS 114 13.343 0.757 -3.513 1002 2HZ LYS 114 2HZ LYS 114 14.053 0.859 -1.976 1003 3HZ LYS 114 3HZ LYS 114 14.139 2.169 -3.028 1004 H ILE 115 H ILE 115 7.889 5.430 -1.922 1005 HA ILE 115 HA ILE 115 8.601 8.162 -2.085 1006 HB ILE 115 HB ILE 115 5.869 6.957 -2.695 1007 1HG1 ILE 115 2HG1 ILE 115 8.233 7.429 -4.540 1008 2HG1 ILE 115 1HG1 ILE 115 7.733 5.864 -3.923 1009 1HG2 ILE 115 1HG2 ILE 115 7.164 9.521 -3.645 1010 2HG2 ILE 115 2HG2 ILE 115 5.840 9.399 -2.487 1011 3HG2 ILE 115 3HG2 ILE 115 5.592 8.909 -4.163 1012 1HD1 ILE 115 1HD1 ILE 115 6.117 7.642 -5.735 1013 2HD1 ILE 115 2HD1 ILE 115 5.621 6.061 -5.132 1014 3HD1 ILE 115 3HD1 ILE 115 7.007 6.197 -6.216 1015 H ALA 116 H ALA 116 6.215 6.437 -0.182 1016 HA ALA 116 HA ALA 116 4.954 8.602 1.118 1017 1HB ALA 116 1HB ALA 116 5.429 5.829 2.102 1018 2HB ALA 116 2HB ALA 116 4.082 6.297 1.052 1019 3HB ALA 116 3HB ALA 116 4.199 6.937 2.707 1020 H TYR 117 H TYR 117 7.703 6.599 1.916 1021 HA TYR 117 HA TYR 117 8.097 7.488 4.541 1022 1HB TYR 117 2HB TYR 117 8.741 5.311 3.613 1023 2HB TYR 117 1HB TYR 117 9.916 6.103 2.586 1024 HD1 TYR 117 1HD TYR 117 11.889 6.971 3.503 1025 HD2 TYR 117 2HD TYR 117 9.139 4.926 5.925 1026 HE1 TYR 117 1HE TYR 117 13.679 6.650 5.236 1027 HE2 TYR 117 2HE TYR 117 10.835 4.595 7.658 1028 HH TYR 117 HH TYR 117 13.740 6.257 7.680 1029 H TYR 118 H TYR 118 9.896 8.218 1.493 1030 HA TYR 118 HA TYR 118 11.629 10.018 2.838 1031 1HB TYR 118 2HB TYR 118 11.176 9.524 -0.100 1032 2HB TYR 118 1HB TYR 118 12.327 10.718 0.484 1033 HD1 TYR 118 1HD TYR 118 14.441 10.027 1.444 1034 HD2 TYR 118 2HD TYR 118 11.577 7.121 0.275 1035 HE1 TYR 118 1HE TYR 118 16.152 8.267 1.623 1036 HE2 TYR 118 2HE TYR 118 13.267 5.361 0.449 1037 HH TYR 118 HH TYR 118 15.683 5.162 0.331 1038 H LEU 119 H LEU 119 8.671 10.448 1.262 1039 HA LEU 119 HA LEU 119 8.870 13.384 1.401 1040 1HB LEU 119 2HB LEU 119 6.537 11.673 0.526 1041 2HB LEU 119 1HB LEU 119 6.540 13.422 0.515 1042 1HD1 LEU 119 1HD2 LEU 119 5.928 13.297 -1.919 1043 2HD1 LEU 119 2HD2 LEU 119 6.018 11.537 -1.864 1044 3HD1 LEU 119 3HD2 LEU 119 6.986 12.435 -3.035 1045 1HD2 LEU 119 1HD1 LEU 119 7.937 14.652 -1.161 1046 2HD2 LEU 119 2HD1 LEU 119 8.934 13.742 -2.298 1047 3HD2 LEU 119 3HD1 LEU 119 9.375 13.804 -0.590 1048 H ASN 120 H ASN 120 8.068 10.891 3.365 1049 HA ASN 120 HA ASN 120 6.746 10.431 5.081 1050 1HB ASN 120 2HB ASN 120 8.518 11.747 6.208 1051 2HB ASN 120 1HB ASN 120 7.526 13.198 6.036 1052 1HD2 ASN 120 1HD2 ASN 120 7.251 13.522 8.245 1053 2HD2 ASN 120 2HD2 ASN 120 6.330 12.456 9.241 1054 H THR 121 H THR 121 4.941 10.305 3.857 1055 HA THR 121 HA THR 121 2.879 12.120 4.761 1056 HB THR 121 HB THR 121 3.372 11.417 1.841 1057 HG1 THR 121 1HG THR 121 4.326 13.350 3.384 1058 1HG2 THR 121 1HG2 THR 121 1.274 13.188 3.112 1059 2HG2 THR 121 2HG2 THR 121 0.982 11.610 2.381 1060 3HG2 THR 121 3HG2 THR 121 1.512 12.962 1.380 1061 HA PRO 122 HA PRO 122 0.933 8.154 5.552 1062 1HB PRO 122 2HB PRO 122 -1.555 9.677 4.936 1063 2HB PRO 122 1HB PRO 122 -1.168 8.678 6.341 1064 1HG PRO 122 2HG PRO 122 -1.152 11.329 6.528 1065 2HG PRO 122 1HG PRO 122 0.061 10.346 7.365 1066 1HD PRO 122 2HD PRO 122 0.327 11.989 4.891 1067 2HD PRO 122 1HD PRO 122 1.505 11.699 6.188 1068 H LEU 123 H LEU 123 0.301 6.512 4.349 1069 HA LEU 123 HA LEU 123 0.518 6.515 1.558 1070 1HB LEU 123 2HB LEU 123 0.461 4.577 3.454 1071 2HB LEU 123 1HB LEU 123 -1.164 4.445 2.859 1072 1HD1 LEU 123 1HD1 LEU 123 -0.780 4.786 -0.124 1073 2HD1 LEU 123 2HD1 LEU 123 -1.624 3.429 0.623 1074 3HD1 LEU 123 3HD1 LEU 123 -0.286 3.133 -0.487 1075 1HD2 LEU 123 1HD2 LEU 123 2.375 4.177 1.789 1076 2HD2 LEU 123 2HD2 LEU 123 1.595 5.309 0.693 1077 3HD2 LEU 123 3HD2 LEU 123 1.992 3.672 0.131 1078 H GLU 124 H GLU 124 -2.339 6.525 3.669 1079 HA GLU 124 HA GLU 124 -4.380 6.423 1.832 1080 1HB GLU 124 2HB GLU 124 -4.327 8.019 4.401 1081 2HB GLU 124 1HB GLU 124 -5.759 7.464 3.554 1082 1HG GLU 124 2HG GLU 124 -5.111 5.141 4.000 1083 2HG GLU 124 1HG GLU 124 -3.687 5.716 4.865 1084 H ASP 125 H ASP 125 -2.421 9.165 2.797 1085 HA ASP 125 HA ASP 125 -4.071 11.096 1.488 1086 1HB ASP 125 2HB ASP 125 -2.539 11.708 3.364 1087 2HB ASP 125 1HB ASP 125 -1.172 11.413 2.293 1088 H ILE 126 H ILE 126 -1.346 9.223 0.642 1089 HA ILE 126 HA ILE 126 -0.752 10.680 -1.799 1090 HB ILE 126 HB ILE 126 0.396 7.992 -0.963 1091 1HG1 ILE 126 2HG1 ILE 126 1.498 10.794 -0.622 1092 2HG1 ILE 126 1HG1 ILE 126 0.884 9.774 0.672 1093 1HG2 ILE 126 1HG2 ILE 126 2.169 8.538 -2.577 1094 2HG2 ILE 126 2HG2 ILE 126 1.301 10.007 -3.025 1095 3HG2 ILE 126 3HG2 ILE 126 0.591 8.428 -3.356 1096 1HD1 ILE 126 1HD1 ILE 126 2.689 8.184 0.265 1097 2HD1 ILE 126 2HD1 ILE 126 3.305 9.796 0.628 1098 3HD1 ILE 126 3HD1 ILE 126 3.294 9.210 -1.034 1099 H PHE 127 H PHE 127 -2.021 7.438 -1.055 1100 HA PHE 127 HA PHE 127 -3.159 7.369 -3.756 1101 1HB PHE 127 2HB PHE 127 -2.248 5.045 -1.965 1102 2HB PHE 127 1HB PHE 127 -3.172 4.867 -3.452 1103 HD1 PHE 127 1HD PHE 127 -2.104 5.178 -5.595 1104 HD2 PHE 127 2HD PHE 127 0.066 5.656 -1.967 1105 HE1 PHE 127 1HE PHE 127 0.014 5.049 -6.844 1106 HE2 PHE 127 2HE PHE 127 2.182 5.535 -3.209 1107 HZ PHE 127 HZ PHE 127 2.158 5.230 -5.651 1108 H GLN 128 H GLN 128 -5.313 7.007 -3.862 1109 HA GLN 128 HA GLN 128 -6.690 6.650 -1.292 1110 1HB GLN 128 2HB GLN 128 -7.107 8.883 -2.208 1111 2HB GLN 128 1HB GLN 128 -7.675 8.170 -3.715 1112 1HG GLN 128 2HG GLN 128 -9.523 7.110 -2.518 1113 2HG GLN 128 1HG GLN 128 -8.953 7.824 -1.014 1114 1HE2 GLN 128 1HE2 GLN 128 -10.507 8.416 -4.058 1115 2HE2 GLN 128 2HE2 GLN 128 -11.118 9.976 -3.646 1116 H TRP 129 H TRP 129 -7.825 4.918 -1.092 1117 HA TRP 129 HA TRP 129 -8.495 3.446 -3.492 1118 1HB TRP 129 2HB TRP 129 -8.679 1.477 -1.848 1119 2HB TRP 129 1HB TRP 129 -7.085 2.055 -2.309 1120 HD1 TRP 129 HD TRP 129 -9.386 1.703 0.721 1121 HE1 TRP 129 1HE TRP 129 -8.019 2.199 2.854 1122 HE3 TRP 129 3HE TRP 129 -5.140 3.516 -1.452 1123 HZ2 TRP 129 2HZ TRP 129 -5.422 3.225 3.500 1124 HZ3 TRP 129 3HZ TRP 129 -3.280 4.215 -0.025 1125 HH2 TRP 129 HH TRP 129 -3.414 4.067 2.379 1126 H GLN 130 H GLN 130 -10.400 3.445 -4.068 1127 HA GLN 130 HA GLN 130 -12.586 3.557 -2.097 1128 1HB GLN 130 2HB GLN 130 -12.624 4.681 -4.923 1129 2HB GLN 130 1HB GLN 130 -13.962 4.712 -3.794 1130 1HG GLN 130 2HG GLN 130 -11.346 6.153 -3.383 1131 2HG GLN 130 1HG GLN 130 -12.779 6.881 -4.091 1132 1HE2 GLN 130 1HE2 GLN 130 -12.907 8.421 -2.501 1133 2HE2 GLN 130 2HE2 GLN 130 -13.421 8.101 -0.903 1134 HA PRO 131 HA PRO 131 -12.821 -0.439 -4.404 1135 1HB PRO 131 2HB PRO 131 -14.215 -1.336 -1.959 1136 2HB PRO 131 1HB PRO 131 -12.765 -1.997 -2.725 1137 1HG PRO 131 2HG PRO 131 -12.614 -0.682 -0.397 1138 2HG PRO 131 1HG PRO 131 -11.349 -0.526 -1.630 1139 1HD PRO 131 2HD PRO 131 -13.621 1.341 -1.014 1140 2HD PRO 131 1HD PRO 131 -11.902 1.718 -1.282 1141 H GLU 132 H GLU 132 -14.954 1.708 -3.195 1142 HA GLU 132 HA GLU 132 -17.423 0.408 -3.977 1143 1HB GLU 132 2HB GLU 132 -16.851 3.157 -2.847 1144 2HB GLU 132 1HB GLU 132 -18.450 2.458 -3.074 1145 1HG GLU 132 2HG GLU 132 -18.036 0.784 -1.430 1146 2HG GLU 132 1HG GLU 132 -16.339 1.239 -1.317 Start of MODEL 2 1 1H MET 1 1HT MET 1 13.225 -5.668 5.226 2 2H MET 1 2HT MET 1 12.311 -4.357 5.828 3 3H MET 1 3HT MET 1 11.884 -5.075 4.378 4 HA MET 1 HA MET 1 11.350 -7.107 5.410 5 1HB MET 1 2HB MET 1 12.074 -5.641 7.938 6 2HB MET 1 1HB MET 1 11.045 -7.060 7.930 7 1HG MET 1 2HG MET 1 12.895 -8.326 6.882 8 2HG MET 1 1HG MET 1 13.914 -6.895 7.055 9 1HE MET 1 1HE MET 1 14.575 -9.818 8.211 10 2HE MET 1 2HE MET 1 15.241 -9.396 9.788 11 3HE MET 1 3HE MET 1 15.668 -8.443 8.367 12 H ILE 2 H ILE 2 9.386 -7.490 6.285 13 HA ILE 2 HA ILE 2 7.564 -5.180 6.399 14 HB ILE 2 HB ILE 2 7.004 -7.876 5.097 15 1HG1 ILE 2 2HG1 ILE 2 8.344 -6.410 3.655 16 2HG1 ILE 2 1HG1 ILE 2 6.728 -6.619 2.998 17 1HG2 ILE 2 1HG2 ILE 2 4.794 -6.989 4.480 18 2HG2 ILE 2 2HG2 ILE 2 5.124 -5.542 5.432 19 3HG2 ILE 2 3HG2 ILE 2 5.004 -7.112 6.228 20 1HD1 ILE 2 1HD1 ILE 2 6.104 -4.416 3.852 21 2HD1 ILE 2 2HD1 ILE 2 7.483 -4.332 2.757 22 3HD1 ILE 2 3HD1 ILE 2 7.731 -4.210 4.499 23 H ILE 3 H ILE 3 6.097 -5.250 8.057 24 HA ILE 3 HA ILE 3 6.215 -7.566 9.837 25 HB ILE 3 HB ILE 3 5.480 -4.675 10.473 26 1HG1 ILE 3 2HG1 ILE 3 7.961 -6.237 11.268 27 2HG1 ILE 3 1HG1 ILE 3 7.898 -4.918 10.109 28 1HG2 ILE 3 1HG2 ILE 3 4.230 -6.259 11.834 29 2HG2 ILE 3 2HG2 ILE 3 5.412 -5.399 12.822 30 3HG2 ILE 3 3HG2 ILE 3 5.730 -7.058 12.314 31 1HD1 ILE 3 1HD1 ILE 3 8.783 -4.176 12.242 32 2HD1 ILE 3 2HD1 ILE 3 7.313 -4.711 13.056 33 3HD1 ILE 3 3HD1 ILE 3 7.246 -3.384 11.897 34 H ASN 4 H ASN 4 4.156 -8.665 9.976 35 HA ASN 4 HA ASN 4 2.064 -7.347 8.501 36 1HB ASN 4 2HB ASN 4 2.961 -9.353 7.426 37 2HB ASN 4 1HB ASN 4 2.783 -10.257 8.922 38 1HD2 ASN 4 1HD2 ASN 4 1.455 -11.770 8.021 39 2HD2 ASN 4 2HD2 ASN 4 -0.151 -11.426 7.474 40 H ASN 5 H ASN 5 0.318 -6.895 9.697 41 HA ASN 5 HA ASN 5 0.097 -8.206 12.317 42 1HB ASN 5 2HB ASN 5 -0.801 -5.395 11.626 43 2HB ASN 5 1HB ASN 5 -0.879 -6.162 13.203 44 1HD2 ASN 5 1HD2 ASN 5 1.047 -4.486 10.956 45 2HD2 ASN 5 2HD2 ASN 5 2.462 -4.325 11.941 46 H LEU 6 H LEU 6 -1.065 -8.676 9.498 47 HA LEU 6 HA LEU 6 -3.702 -7.991 9.313 48 1HB LEU 6 2HB LEU 6 -2.302 -9.041 7.549 49 2HB LEU 6 1HB LEU 6 -2.352 -10.551 8.413 50 HG LEU 6 HG LEU 6 -3.783 -10.353 6.330 51 1HD1 LEU 6 1HD1 LEU 6 -5.670 -11.578 7.232 52 2HD1 LEU 6 2HD1 LEU 6 -5.188 -11.121 8.867 53 3HD1 LEU 6 3HD1 LEU 6 -4.137 -12.149 7.893 54 1HD2 LEU 6 1HD2 LEU 6 -5.475 -8.641 8.137 55 2HD2 LEU 6 2HD2 LEU 6 -5.974 -9.285 6.574 56 3HD2 LEU 6 3HD2 LEU 6 -4.653 -8.121 6.665 57 H LYS 7 H LYS 7 -2.381 -10.892 10.914 58 HA LYS 7 HA LYS 7 -4.919 -11.769 11.764 59 1HB LYS 7 2HB LYS 7 -3.801 -13.308 13.332 60 2HB LYS 7 1HB LYS 7 -3.130 -13.389 11.715 61 1HG LYS 7 2HG LYS 7 -1.188 -12.169 12.399 62 2HG LYS 7 1HG LYS 7 -1.892 -11.855 13.985 63 1HD LYS 7 2HD LYS 7 -1.269 -14.603 12.904 64 2HD LYS 7 1HD LYS 7 -0.213 -13.690 13.983 65 1HE LYS 7 2HE LYS 7 -1.995 -13.640 15.670 66 2HE LYS 7 1HE LYS 7 -3.038 -14.564 14.590 67 1HZ LYS 7 1HZ LYS 7 -1.535 -16.418 14.728 68 2HZ LYS 7 2HZ LYS 7 -1.897 -15.908 16.317 69 3HZ LYS 7 3HZ LYS 7 -0.423 -15.499 15.610 70 H LEU 8 H LEU 8 -2.590 -9.644 13.419 71 HA LEU 8 HA LEU 8 -3.854 -9.518 15.865 72 1HB LEU 8 2HB LEU 8 -1.593 -8.570 15.145 73 2HB LEU 8 1HB LEU 8 -2.465 -7.212 14.481 74 HG LEU 8 HG LEU 8 -1.370 -6.792 16.692 75 1HD1 LEU 8 1HD1 LEU 8 -4.361 -6.494 16.706 76 2HD1 LEU 8 2HD1 LEU 8 -3.199 -5.360 16.017 77 3HD1 LEU 8 3HD1 LEU 8 -3.234 -5.637 17.758 78 1HD2 LEU 8 1HD2 LEU 8 -1.704 -8.963 17.693 79 2HD2 LEU 8 2HD2 LEU 8 -3.450 -8.710 17.711 80 3HD2 LEU 8 3HD2 LEU 8 -2.401 -7.701 18.709 81 H ILE 9 H ILE 9 -4.464 -7.524 12.960 82 HA ILE 9 HA ILE 9 -6.572 -6.006 14.089 83 HB ILE 9 HB ILE 9 -6.025 -6.689 11.167 84 1HG1 ILE 9 2HG1 ILE 9 -5.692 -4.186 10.974 85 2HG1 ILE 9 1HG1 ILE 9 -5.859 -4.091 12.716 86 1HG2 ILE 9 1HG2 ILE 9 -7.781 -5.127 10.468 87 2HG2 ILE 9 2HG2 ILE 9 -8.288 -4.961 12.152 88 3HG2 ILE 9 3HG2 ILE 9 -8.433 -6.515 11.342 89 1HD1 ILE 9 1HD1 ILE 9 -3.859 -5.461 12.972 90 2HD1 ILE 9 2HD1 ILE 9 -3.549 -3.998 12.038 91 3HD1 ILE 9 3HD1 ILE 9 -3.707 -5.554 11.218 92 H ARG 10 H ARG 10 -6.533 -9.093 12.531 93 HA ARG 10 HA ARG 10 -9.301 -9.559 12.470 94 1HB ARG 10 2HB ARG 10 -6.961 -11.409 12.496 95 2HB ARG 10 1HB ARG 10 -8.615 -11.998 12.468 96 1HG ARG 10 2HG ARG 10 -9.024 -10.966 10.375 97 2HG ARG 10 1HG ARG 10 -7.473 -10.117 10.439 98 1HD ARG 10 2HD ARG 10 -7.485 -12.131 8.984 99 2HD ARG 10 1HD ARG 10 -6.268 -12.145 10.257 100 HE ARG 10 HE ARG 10 -8.289 -13.465 11.393 101 1HH1 ARG 10 1HH1 ARG 10 -7.014 -13.802 8.133 102 2HH1 ARG 10 2HH1 ARG 10 -6.971 -15.493 8.128 103 1HH2 ARG 10 1HH2 ARG 10 -8.335 -15.772 11.434 104 2HH2 ARG 10 2HH2 ARG 10 -7.894 -16.672 10.062 105 H GLU 11 H GLU 11 -6.920 -10.119 15.144 106 HA GLU 11 HA GLU 11 -8.842 -11.334 16.746 107 1HB GLU 11 2HB GLU 11 -6.251 -9.987 17.485 108 2HB GLU 11 1HB GLU 11 -7.233 -10.963 18.572 109 1HG GLU 11 2HG GLU 11 -6.974 -12.846 16.934 110 2HG GLU 11 1HG GLU 11 -5.795 -11.847 16.098 111 H LYS 12 H LYS 12 -7.882 -7.996 16.351 112 HA LYS 12 HA LYS 12 -9.374 -6.824 18.378 113 1HB LYS 12 2HB LYS 12 -9.042 -5.740 15.568 114 2HB LYS 12 1HB LYS 12 -9.563 -4.798 16.957 115 1HG LYS 12 2HG LYS 12 -7.405 -5.200 18.037 116 2HG LYS 12 1HG LYS 12 -6.888 -6.147 16.642 117 1HD LYS 12 2HD LYS 12 -5.974 -3.898 16.521 118 2HD LYS 12 1HD LYS 12 -7.141 -4.145 15.221 119 1HE LYS 12 2HE LYS 12 -8.831 -2.933 16.496 120 2HE LYS 12 1HE LYS 12 -7.700 -2.739 17.835 121 1HZ LYS 12 1HZ LYS 12 -7.810 -0.737 16.457 122 2HZ LYS 12 2HZ LYS 12 -7.307 -1.625 15.103 123 3HZ LYS 12 3HZ LYS 12 -6.279 -1.422 16.401 124 H LYS 13 H LYS 13 -10.510 -7.923 15.232 125 HA LYS 13 HA LYS 13 -13.296 -7.676 16.141 126 1HB LYS 13 2HB LYS 13 -12.175 -8.484 13.427 127 2HB LYS 13 1HB LYS 13 -13.845 -8.084 13.790 128 1HG LYS 13 2HG LYS 13 -11.516 -6.177 13.818 129 2HG LYS 13 1HG LYS 13 -12.757 -6.292 12.571 130 1HD LYS 13 2HD LYS 13 -14.456 -5.660 14.209 131 2HD LYS 13 1HD LYS 13 -13.212 -5.556 15.459 132 1HE LYS 13 2HE LYS 13 -13.737 -3.349 14.618 133 2HE LYS 13 1HE LYS 13 -12.092 -3.800 14.174 134 1HZ LYS 13 1HZ LYS 13 -13.245 -2.757 12.340 135 2HZ LYS 13 2HZ LYS 13 -14.466 -3.921 12.385 136 3HZ LYS 13 3HZ LYS 13 -12.916 -4.364 11.940 137 H LYS 14 H LYS 14 -14.329 -10.232 14.815 138 HA LYS 14 HA LYS 14 -12.076 -11.885 15.011 139 1HB LYS 14 2HB LYS 14 -13.588 -13.711 15.989 140 2HB LYS 14 1HB LYS 14 -12.964 -12.489 17.071 141 1HG LYS 14 2HG LYS 14 -15.138 -11.364 17.023 142 2HG LYS 14 1HG LYS 14 -15.745 -12.628 15.941 143 1HD LYS 14 2HD LYS 14 -15.411 -14.312 17.582 144 2HD LYS 14 1HD LYS 14 -14.524 -13.205 18.627 145 1HE LYS 14 2HE LYS 14 -17.436 -12.979 17.900 146 2HE LYS 14 1HE LYS 14 -16.806 -13.616 19.417 147 1HZ LYS 14 1HZ LYS 14 -15.712 -11.416 19.731 148 2HZ LYS 14 2HZ LYS 14 -17.397 -11.409 19.795 149 3HZ LYS 14 3HZ LYS 14 -16.614 -10.836 18.404 150 H ILE 15 H ILE 15 -11.823 -11.870 12.998 151 HA ILE 15 HA ILE 15 -13.876 -13.191 11.376 152 HB ILE 15 HB ILE 15 -11.864 -11.130 10.391 153 1HG1 ILE 15 2HG1 ILE 15 -14.818 -10.717 10.957 154 2HG1 ILE 15 1HG1 ILE 15 -13.506 -10.073 11.933 155 1HG2 ILE 15 1HG2 ILE 15 -13.269 -11.110 8.381 156 2HG2 ILE 15 2HG2 ILE 15 -14.312 -12.336 9.101 157 3HG2 ILE 15 3HG2 ILE 15 -12.636 -12.724 8.710 158 1HD1 ILE 15 1HD1 ILE 15 -14.097 -9.364 9.064 159 2HD1 ILE 15 2HD1 ILE 15 -12.770 -8.717 10.028 160 3HD1 ILE 15 3HD1 ILE 15 -14.438 -8.368 10.478 161 H SER 16 H SER 16 -13.112 -14.898 10.213 162 HA SER 16 HA SER 16 -10.281 -15.512 10.514 163 1HB SER 16 2HB SER 16 -12.640 -17.337 10.018 164 2HB SER 16 1HB SER 16 -10.961 -17.857 10.196 165 HG SER 16 HG SER 16 -12.680 -16.693 12.113 166 H GLN 17 H GLN 17 -9.975 -17.378 8.505 167 HA GLN 17 HA GLN 17 -9.401 -15.603 6.395 168 1HB GLN 17 2HB GLN 17 -8.599 -17.577 5.132 169 2HB GLN 17 1HB GLN 17 -7.898 -17.401 6.732 170 1HG GLN 17 2HG GLN 17 -9.195 -19.178 7.591 171 2HG GLN 17 1HG GLN 17 -10.206 -19.227 6.148 172 1HE2 GLN 17 1HE2 GLN 17 -7.065 -19.957 7.463 173 2HE2 GLN 17 2HE2 GLN 17 -6.605 -21.065 6.221 174 H SER 18 H SER 18 -12.069 -18.053 6.631 175 HA SER 18 HA SER 18 -12.650 -17.939 3.925 176 1HB SER 18 2HB SER 18 -14.421 -18.665 6.257 177 2HB SER 18 1HB SER 18 -14.686 -19.108 4.568 178 HG SER 18 HG SER 18 -13.459 -20.570 6.218 179 H GLU 19 H GLU 19 -13.986 -16.129 6.679 180 HA GLU 19 HA GLU 19 -15.957 -14.794 5.196 181 1HB GLU 19 2HB GLU 19 -14.575 -13.648 7.624 182 2HB GLU 19 1HB GLU 19 -16.167 -13.246 7.016 183 1HG GLU 19 2HG GLU 19 -16.673 -14.569 8.812 184 2HG GLU 19 1HG GLU 19 -16.678 -15.746 7.501 185 H LEU 20 H LEU 20 -12.572 -13.999 5.889 186 HA LEU 20 HA LEU 20 -12.659 -11.445 4.705 187 1HB LEU 20 2HB LEU 20 -10.378 -13.312 5.277 188 2HB LEU 20 1HB LEU 20 -10.156 -11.726 4.572 189 HG LEU 20 HG LEU 20 -11.366 -12.263 7.279 190 1HD1 LEU 20 1HD1 LEU 20 -9.289 -11.316 8.133 191 2HD1 LEU 20 2HD1 LEU 20 -8.666 -11.193 6.484 192 3HD1 LEU 20 3HD1 LEU 20 -8.985 -12.776 7.189 193 1HD2 LEU 20 1HD2 LEU 20 -11.180 -9.842 7.565 194 2HD2 LEU 20 2HD2 LEU 20 -12.249 -10.249 6.225 195 3HD2 LEU 20 3HD2 LEU 20 -10.607 -9.689 5.904 196 H ALA 21 H ALA 21 -11.879 -14.628 3.460 197 HA ALA 21 HA ALA 21 -10.910 -13.901 0.960 198 1HB ALA 21 1HB ALA 21 -12.570 -16.320 1.648 199 2HB ALA 21 2HB ALA 21 -10.820 -16.180 1.831 200 3HB ALA 21 3HB ALA 21 -11.548 -16.132 0.224 201 H ALA 22 H ALA 22 -14.262 -14.623 1.904 202 HA ALA 22 HA ALA 22 -15.333 -14.023 -0.647 203 1HB ALA 22 1HB ALA 22 -16.510 -15.432 0.976 204 2HB ALA 22 2HB ALA 22 -17.507 -14.068 0.462 205 3HB ALA 22 3HB ALA 22 -16.711 -14.034 2.034 206 H LEU 23 H LEU 23 -14.740 -12.139 2.231 207 HA LEU 23 HA LEU 23 -16.239 -9.836 1.566 208 1HB LEU 23 2HB LEU 23 -15.342 -10.467 3.830 209 2HB LEU 23 1HB LEU 23 -13.757 -10.016 3.239 210 HG LEU 23 HG LEU 23 -14.503 -7.695 2.984 211 1HD1 LEU 23 1HD1 LEU 23 -17.060 -8.691 4.233 212 2HD1 LEU 23 2HD1 LEU 23 -16.871 -8.094 2.584 213 3HD1 LEU 23 3HD1 LEU 23 -16.642 -7.002 3.951 214 1HD2 LEU 23 1HD2 LEU 23 -13.422 -8.412 5.046 215 2HD2 LEU 23 2HD2 LEU 23 -14.979 -8.894 5.714 216 3HD2 LEU 23 3HD2 LEU 23 -14.649 -7.193 5.384 217 H LEU 24 H LEU 24 -12.851 -10.752 0.992 218 HA LEU 24 HA LEU 24 -12.260 -8.234 -0.304 219 1HB LEU 24 2HB LEU 24 -10.593 -10.725 -0.002 220 2HB LEU 24 1HB LEU 24 -10.020 -9.169 -0.564 221 HG LEU 24 HG LEU 24 -11.035 -9.771 2.215 222 1HD1 LEU 24 1HD1 LEU 24 -8.706 -9.517 2.882 223 2HD1 LEU 24 2HD1 LEU 24 -8.239 -9.329 1.192 224 3HD1 LEU 24 3HD1 LEU 24 -8.919 -10.857 1.756 225 1HD2 LEU 24 1HD2 LEU 24 -11.442 -7.455 1.558 226 2HD2 LEU 24 2HD2 LEU 24 -9.750 -7.288 1.082 227 3HD2 LEU 24 3HD2 LEU 24 -10.169 -7.553 2.773 228 H GLU 25 H GLU 25 -13.869 -10.914 -1.237 229 HA GLU 25 HA GLU 25 -14.459 -11.924 -3.139 230 1HB GLU 25 2HB GLU 25 -13.226 -9.517 -4.513 231 2HB GLU 25 1HB GLU 25 -14.398 -10.627 -5.208 232 1HG GLU 25 2HG GLU 25 -16.025 -9.904 -3.471 233 2HG GLU 25 1HG GLU 25 -14.847 -8.709 -2.932 234 H VAL 26 H VAL 26 -12.047 -12.790 -2.027 235 HA VAL 26 HA VAL 26 -10.496 -13.533 -4.398 236 HB VAL 26 HB VAL 26 -8.431 -13.526 -3.031 237 1HG1 VAL 26 1HG1 VAL 26 -8.893 -11.577 -4.382 238 2HG1 VAL 26 2HG1 VAL 26 -8.089 -11.107 -2.882 239 3HG1 VAL 26 3HG1 VAL 26 -9.827 -10.860 -3.067 240 1HG2 VAL 26 1HG2 VAL 26 -10.151 -12.253 -0.899 241 2HG2 VAL 26 2HG2 VAL 26 -8.393 -12.381 -0.839 242 3HG2 VAL 26 3HG2 VAL 26 -9.385 -13.840 -0.816 243 H SER 27 H SER 27 -8.975 -15.450 -3.607 244 HA SER 27 HA SER 27 -10.724 -17.473 -2.540 245 1HB SER 27 2HB SER 27 -7.855 -17.623 -3.468 246 2HB SER 27 1HB SER 27 -8.886 -19.004 -3.092 247 HG SER 27 HG SER 27 -10.223 -17.471 -4.773 248 H ARG 28 H ARG 28 -10.058 -18.881 -0.780 249 HA ARG 28 HA ARG 28 -9.235 -17.455 1.502 250 1HB ARG 28 2HB ARG 28 -9.399 -20.440 1.110 251 2HB ARG 28 1HB ARG 28 -9.145 -19.653 2.660 252 1HG ARG 28 2HG ARG 28 -11.329 -18.480 2.327 253 2HG ARG 28 1HG ARG 28 -11.581 -19.497 0.906 254 1HD ARG 28 2HD ARG 28 -11.152 -20.465 3.724 255 2HD ARG 28 1HD ARG 28 -12.696 -20.409 2.876 256 HE ARG 28 HE ARG 28 -11.684 -21.999 1.281 257 1HH1 ARG 28 1HH1 ARG 28 -10.288 -21.734 4.487 258 2HH1 ARG 28 2HH1 ARG 28 -9.851 -23.359 4.646 259 1HH2 ARG 28 1HH2 ARG 28 -11.181 -24.275 1.457 260 2HH2 ARG 28 2HH2 ARG 28 -10.362 -24.875 2.833 261 H GLN 29 H GLN 29 -7.521 -19.431 -0.735 262 HA GLN 29 HA GLN 29 -5.074 -19.619 0.661 263 1HB GLN 29 2HB GLN 29 -5.645 -20.971 -1.354 264 2HB GLN 29 1HB GLN 29 -5.488 -19.534 -2.343 265 1HG GLN 29 2HG GLN 29 -3.184 -20.583 -0.720 266 2HG GLN 29 1HG GLN 29 -3.568 -21.239 -2.302 267 1HE2 GLN 29 1HE2 GLN 29 -1.224 -19.795 -1.313 268 2HE2 GLN 29 2HE2 GLN 29 -0.992 -18.444 -2.356 269 H THR 30 H THR 30 -6.464 -17.041 -1.288 270 HA THR 30 HA THR 30 -4.130 -15.539 -1.672 271 HB THR 30 HB THR 30 -6.912 -14.403 -1.418 272 HG1 THR 30 1HG THR 30 -5.829 -15.846 -3.652 273 1HG2 THR 30 1HG2 THR 30 -6.137 -12.962 -3.261 274 2HG2 THR 30 2HG2 THR 30 -4.592 -13.812 -3.275 275 3HG2 THR 30 3HG2 THR 30 -5.054 -12.848 -1.873 276 H ILE 31 H ILE 31 -6.829 -15.201 0.708 277 HA ILE 31 HA ILE 31 -5.490 -13.198 2.146 278 HB ILE 31 HB ILE 31 -7.908 -13.297 2.244 279 1HG1 ILE 31 2HG1 ILE 31 -8.289 -13.129 4.703 280 2HG1 ILE 31 1HG1 ILE 31 -6.689 -13.811 4.965 281 1HG2 ILE 31 1HG2 ILE 31 -7.621 -15.921 3.675 282 2HG2 ILE 31 2HG2 ILE 31 -8.280 -15.659 2.060 283 3HG2 ILE 31 3HG2 ILE 31 -9.127 -15.025 3.472 284 1HD1 ILE 31 1HD1 ILE 31 -6.679 -11.395 5.222 285 2HD1 ILE 31 2HD1 ILE 31 -7.291 -11.204 3.579 286 3HD1 ILE 31 3HD1 ILE 31 -5.687 -11.884 3.849 287 H ASN 32 H ASN 32 -5.670 -16.682 2.690 288 HA ASN 32 HA ASN 32 -4.236 -16.612 5.129 289 1HB ASN 32 2HB ASN 32 -5.515 -18.628 4.374 290 2HB ASN 32 1HB ASN 32 -4.291 -18.908 3.143 291 1HD2 ASN 32 1HD2 ASN 32 -4.937 -18.877 6.564 292 2HD2 ASN 32 2HD2 ASN 32 -3.634 -19.876 7.052 293 H GLY 33 H GLY 33 -3.212 -16.788 1.793 294 1HA GLY 33 2HA GLY 33 -0.457 -17.030 2.175 295 2HA GLY 33 1HA GLY 33 -1.233 -16.238 0.809 296 H ILE 34 H ILE 34 -2.598 -14.182 2.339 297 HA ILE 34 HA ILE 34 -0.541 -12.300 2.733 298 HB ILE 34 HB ILE 34 -3.502 -12.239 3.381 299 1HG1 ILE 34 2HG1 ILE 34 -2.996 -12.293 0.991 300 2HG1 ILE 34 1HG1 ILE 34 -3.673 -10.736 1.447 301 1HG2 ILE 34 1HG2 ILE 34 -2.395 -10.722 4.911 302 2HG2 ILE 34 2HG2 ILE 34 -3.319 -9.821 3.712 303 3HG2 ILE 34 3HG2 ILE 34 -1.565 -9.935 3.569 304 1HD1 ILE 34 1HD1 ILE 34 -1.847 -10.482 -0.140 305 2HD1 ILE 34 2HD1 ILE 34 -0.756 -11.328 0.958 306 3HD1 ILE 34 3HD1 ILE 34 -1.425 -9.760 1.414 307 H GLU 35 H GLU 35 -2.612 -14.140 4.967 308 HA GLU 35 HA GLU 35 -1.746 -13.182 7.413 309 1HB GLU 35 2HB GLU 35 -2.281 -16.060 6.706 310 2HB GLU 35 1HB GLU 35 -2.180 -15.422 8.335 311 1HG GLU 35 2HG GLU 35 -4.150 -14.058 7.910 312 2HG GLU 35 1HG GLU 35 -4.241 -14.720 6.272 313 H LYS 36 H LYS 36 -0.182 -15.505 5.304 314 HA LYS 36 HA LYS 36 1.992 -15.869 7.214 315 1HB LYS 36 2HB LYS 36 1.613 -17.149 4.504 316 2HB LYS 36 1HB LYS 36 2.734 -17.649 5.762 317 1HG LYS 36 2HG LYS 36 -0.276 -17.805 5.883 318 2HG LYS 36 1HG LYS 36 0.828 -19.149 5.634 319 1HD LYS 36 2HD LYS 36 0.704 -17.426 8.112 320 2HD LYS 36 1HD LYS 36 -0.030 -19.019 7.943 321 1HE LYS 36 2HE LYS 36 2.223 -19.960 7.525 322 2HE LYS 36 1HE LYS 36 2.911 -18.360 7.812 323 1HZ LYS 36 1HZ LYS 36 2.006 -18.429 10.069 324 2HZ LYS 36 2HZ LYS 36 2.999 -19.779 9.789 325 3HZ LYS 36 3HZ LYS 36 1.328 -19.934 9.756 326 H ASN 37 H ASN 37 1.205 -13.591 5.148 327 HA ASN 37 HA ASN 37 2.070 -12.225 3.586 328 1HB ASN 37 2HB ASN 37 4.053 -10.962 4.286 329 2HB ASN 37 1HB ASN 37 3.029 -11.285 5.669 330 1HD2 ASN 37 1HD2 ASN 37 6.068 -11.946 4.128 331 2HD2 ASN 37 2HD2 ASN 37 6.834 -12.665 5.496 332 H LYS 38 H LYS 38 2.253 -14.747 2.655 333 HA LYS 38 HA LYS 38 4.978 -15.163 1.650 334 1HB LYS 38 2HB LYS 38 3.832 -17.023 2.863 335 2HB LYS 38 1HB LYS 38 2.546 -16.972 1.672 336 1HG LYS 38 2HG LYS 38 4.205 -17.584 -0.073 337 2HG LYS 38 1HG LYS 38 5.420 -17.743 1.196 338 1HD LYS 38 2HD LYS 38 4.511 -19.928 0.676 339 2HD LYS 38 1HD LYS 38 4.005 -19.451 2.297 340 1HE LYS 38 2HE LYS 38 1.840 -18.690 1.344 341 2HE LYS 38 1HE LYS 38 2.357 -19.292 -0.227 342 1HZ LYS 38 1HZ LYS 38 1.938 -20.920 2.226 343 2HZ LYS 38 2HZ LYS 38 2.485 -21.532 0.745 344 3HZ LYS 38 3HZ LYS 38 0.941 -20.873 0.862 345 H TYR 39 H TYR 39 1.711 -14.318 0.950 346 HA TYR 39 HA TYR 39 1.782 -14.730 -1.843 347 1HB TYR 39 2HB TYR 39 -0.276 -14.715 -0.445 348 2HB TYR 39 1HB TYR 39 -0.032 -12.995 -0.153 349 HD1 TYR 39 1HD TYR 39 -0.484 -15.456 -2.757 350 HD2 TYR 39 2HD TYR 39 -0.916 -11.420 -1.654 351 HE1 TYR 39 1HE TYR 39 -1.703 -15.015 -4.900 352 HE2 TYR 39 2HE TYR 39 -2.121 -10.929 -3.738 353 HH TYR 39 HH TYR 39 -3.301 -13.367 -5.749 354 H ASN 40 H ASN 40 2.921 -12.380 0.301 355 HA ASN 40 HA ASN 40 3.906 -10.373 0.181 356 1HB ASN 40 2HB ASN 40 5.241 -11.384 -1.693 357 2HB ASN 40 1HB ASN 40 4.047 -10.763 -2.829 358 1HD2 ASN 40 1HD2 ASN 40 6.627 -9.975 -0.678 359 2HD2 ASN 40 2HD2 ASN 40 6.865 -8.353 -1.224 360 HA PRO 41 HA PRO 41 0.196 -8.097 -0.304 361 1HB PRO 41 2HB PRO 41 1.601 -5.850 0.923 362 2HB PRO 41 1HB PRO 41 0.258 -6.810 1.555 363 1HG PRO 41 2HG PRO 41 2.767 -6.957 2.572 364 2HG PRO 41 1HG PRO 41 1.649 -8.332 2.569 365 1HD PRO 41 2HD PRO 41 3.933 -7.737 0.726 366 2HD PRO 41 1HD PRO 41 3.435 -9.286 1.439 367 H SER 42 H SER 42 0.086 -7.767 -2.503 368 HA SER 42 HA SER 42 1.431 -5.566 -3.749 369 1HB SER 42 2HB SER 42 -1.036 -7.121 -4.619 370 2HB SER 42 1HB SER 42 -0.011 -6.116 -5.652 371 HG SER 42 HG SER 42 1.730 -7.601 -4.819 372 H LEU 43 H LEU 43 0.110 -3.610 -4.519 373 HA LEU 43 HA LEU 43 -1.025 -2.621 -2.126 374 1HB LEU 43 2HB LEU 43 0.425 -1.252 -3.617 375 2HB LEU 43 1HB LEU 43 -0.868 -1.202 -4.789 376 HG LEU 43 HG LEU 43 -0.516 0.883 -3.359 377 1HD1 LEU 43 1HD1 LEU 43 -2.894 1.367 -3.094 378 2HD1 LEU 43 2HD1 LEU 43 -3.265 -0.339 -3.345 379 3HD1 LEU 43 3HD1 LEU 43 -2.546 0.607 -4.647 380 1HD2 LEU 43 1HD2 LEU 43 -0.165 -0.198 -1.184 381 2HD2 LEU 43 2HD2 LEU 43 -1.780 -0.860 -1.224 382 3HD2 LEU 43 3HD2 LEU 43 -1.553 0.880 -1.103 383 H GLN 44 H GLN 44 -2.600 -3.379 -5.345 384 HA GLN 44 HA GLN 44 -5.097 -2.572 -4.771 385 1HB GLN 44 2HB GLN 44 -4.078 -3.579 -6.869 386 2HB GLN 44 1HB GLN 44 -4.272 -5.148 -6.134 387 1HG GLN 44 2HG GLN 44 -6.558 -3.295 -6.799 388 2HG GLN 44 1HG GLN 44 -5.948 -4.540 -7.875 389 1HE2 GLN 44 1HE2 GLN 44 -6.238 -6.713 -7.261 390 2HE2 GLN 44 2HE2 GLN 44 -7.511 -7.185 -6.187 391 H LEU 45 H LEU 45 -3.696 -5.749 -3.997 392 HA LEU 45 HA LEU 45 -5.904 -6.742 -2.572 393 1HB LEU 45 2HB LEU 45 -2.987 -7.486 -2.334 394 2HB LEU 45 1HB LEU 45 -4.229 -8.276 -1.394 395 HG LEU 45 HG LEU 45 -3.688 -9.694 -3.207 396 1HD1 LEU 45 1HD1 LEU 45 -6.292 -8.337 -3.796 397 2HD1 LEU 45 2HD1 LEU 45 -6.013 -9.663 -2.663 398 3HD1 LEU 45 3HD1 LEU 45 -5.801 -9.922 -4.394 399 1HD2 LEU 45 1HD2 LEU 45 -2.642 -8.090 -4.708 400 2HD2 LEU 45 2HD2 LEU 45 -4.218 -7.382 -5.065 401 3HD2 LEU 45 3HD2 LEU 45 -3.864 -9.035 -5.561 402 H ALA 46 H ALA 46 -3.135 -4.951 -1.428 403 HA ALA 46 HA ALA 46 -3.705 -5.097 1.346 404 1HB ALA 46 1HB ALA 46 -1.500 -4.447 0.479 405 2HB ALA 46 2HB ALA 46 -2.136 -3.254 1.612 406 3HB ALA 46 3HB ALA 46 -2.187 -2.937 -0.125 407 H LEU 47 H LEU 47 -4.721 -2.864 -1.188 408 HA LEU 47 HA LEU 47 -5.766 -0.751 0.267 409 1HB LEU 47 2HB LEU 47 -5.166 -0.995 -2.156 410 2HB LEU 47 1HB LEU 47 -6.589 -1.968 -2.361 411 HG LEU 47 HG LEU 47 -6.530 0.991 -1.716 412 1HD1 LEU 47 1HD1 LEU 47 -7.134 -0.525 -4.243 413 2HD1 LEU 47 2HD1 LEU 47 -5.696 0.443 -3.918 414 3HD1 LEU 47 3HD1 LEU 47 -7.277 1.221 -4.032 415 1HD2 LEU 47 1HD2 LEU 47 -8.930 0.972 -2.240 416 2HD2 LEU 47 2HD2 LEU 47 -8.607 -0.099 -0.874 417 3HD2 LEU 47 3HD2 LEU 47 -8.880 -0.775 -2.477 418 H LYS 48 H LYS 48 -7.293 -3.716 -1.070 419 HA LYS 48 HA LYS 48 -9.800 -2.966 -0.022 420 1HB LYS 48 2HB LYS 48 -10.565 -5.296 -0.614 421 2HB LYS 48 1HB LYS 48 -9.977 -4.302 -1.931 422 1HG LYS 48 2HG LYS 48 -7.886 -5.530 -1.945 423 2HG LYS 48 1HG LYS 48 -8.420 -6.484 -0.558 424 1HD LYS 48 2HD LYS 48 -8.717 -7.665 -2.721 425 2HD LYS 48 1HD LYS 48 -10.227 -7.435 -1.840 426 1HE LYS 48 2HE LYS 48 -10.720 -5.470 -3.251 427 2HE LYS 48 1HE LYS 48 -9.235 -5.762 -4.150 428 1HZ LYS 48 1HZ LYS 48 -10.114 -7.850 -4.913 429 2HZ LYS 48 2HZ LYS 48 -11.215 -6.636 -5.255 430 3HZ LYS 48 3HZ LYS 48 -11.494 -7.675 -3.950 431 H ILE 49 H ILE 49 -7.277 -4.964 1.179 432 HA ILE 49 HA ILE 49 -8.643 -6.049 3.389 433 HB ILE 49 HB ILE 49 -5.706 -5.298 3.131 434 1HG1 ILE 49 2HG1 ILE 49 -7.102 -7.967 2.835 435 2HG1 ILE 49 1HG1 ILE 49 -6.510 -6.972 1.511 436 1HG2 ILE 49 1HG2 ILE 49 -7.041 -7.021 5.215 437 2HG2 ILE 49 2HG2 ILE 49 -6.293 -5.447 5.481 438 3HG2 ILE 49 3HG2 ILE 49 -5.300 -6.828 5.009 439 1HD1 ILE 49 1HD1 ILE 49 -4.819 -8.257 3.647 440 2HD1 ILE 49 2HD1 ILE 49 -4.222 -7.267 2.315 441 3HD1 ILE 49 3HD1 ILE 49 -5.001 -8.814 1.984 442 H ALA 50 H ALA 50 -6.900 -3.033 2.960 443 HA ALA 50 HA ALA 50 -7.124 -2.014 5.583 444 1HB ALA 50 1HB ALA 50 -6.585 0.128 4.561 445 2HB ALA 50 2HB ALA 50 -6.956 -0.549 2.976 446 3HB ALA 50 3HB ALA 50 -5.563 -1.154 3.888 447 H TYR 51 H TYR 51 -9.105 -1.658 2.689 448 HA TYR 51 HA TYR 51 -10.876 0.234 3.752 449 1HB TYR 51 2HB TYR 51 -10.442 0.156 1.433 450 2HB TYR 51 1HB TYR 51 -10.886 -1.535 1.332 451 HD1 TYR 51 1HD TYR 51 -13.042 -2.164 0.928 452 HD2 TYR 51 2HD TYR 51 -12.222 1.887 1.816 453 HE1 TYR 51 1HE TYR 51 -15.331 -1.555 0.192 454 HE2 TYR 51 2HE TYR 51 -14.484 2.528 1.100 455 HH TYR 51 HH TYR 51 -16.197 1.643 -0.417 456 H TYR 52 H TYR 52 -11.351 -3.305 3.098 457 HA TYR 52 HA TYR 52 -13.974 -3.271 4.134 458 1HB TYR 52 2HB TYR 52 -12.097 -5.545 3.549 459 2HB TYR 52 1HB TYR 52 -13.705 -5.807 4.206 460 HD1 TYR 52 1HD TYR 52 -15.688 -4.879 2.833 461 HD2 TYR 52 2HD TYR 52 -11.778 -5.365 1.262 462 HE1 TYR 52 1HE TYR 52 -16.615 -4.907 0.551 463 HE2 TYR 52 2HE TYR 52 -12.679 -5.398 -1.006 464 HH TYR 52 HH TYR 52 -14.629 -5.766 -2.158 465 H LEU 53 H LEU 53 -11.001 -3.699 5.611 466 HA LEU 53 HA LEU 53 -12.227 -4.624 8.127 467 1HB LEU 53 2HB LEU 53 -9.323 -4.019 7.552 468 2HB LEU 53 1HB LEU 53 -9.926 -4.609 9.088 469 1HD1 LEU 53 1HD1 LEU 53 -8.329 -6.519 8.924 470 2HD1 LEU 53 2HD1 LEU 53 -7.768 -5.929 7.360 471 3HD1 LEU 53 3HD1 LEU 53 -8.375 -7.579 7.515 472 1HD2 LEU 53 1HD2 LEU 53 -11.916 -6.656 7.907 473 2HD2 LEU 53 2HD2 LEU 53 -10.812 -6.977 9.244 474 3HD2 LEU 53 3HD2 LEU 53 -10.780 -8.000 7.806 475 H ASN 54 H ASN 54 -11.797 -1.795 6.615 476 HA ASN 54 HA ASN 54 -11.433 0.367 7.078 477 1HB ASN 54 2HB ASN 54 -13.835 -0.029 7.803 478 2HB ASN 54 1HB ASN 54 -13.257 -0.163 9.458 479 1HD2 ASN 54 1HD2 ASN 54 -15.124 1.776 8.241 480 2HD2 ASN 54 2HD2 ASN 54 -14.429 3.331 8.519 481 H THR 55 H THR 55 -9.275 -0.192 7.498 482 HA THR 55 HA THR 55 -8.378 0.892 10.010 483 HB THR 55 HB THR 55 -7.685 -1.877 8.978 484 HG1 THR 55 1HG THR 55 -9.445 -1.087 10.628 485 1HG2 THR 55 1HG2 THR 55 -6.352 -0.350 11.226 486 2HG2 THR 55 2HG2 THR 55 -5.612 -0.763 9.678 487 3HG2 THR 55 3HG2 THR 55 -6.049 -2.038 10.815 488 HA PRO 56 HA PRO 56 -5.679 2.723 6.956 489 1HB PRO 56 2HB PRO 56 -3.627 3.426 8.674 490 2HB PRO 56 1HB PRO 56 -5.084 4.390 8.439 491 1HG PRO 56 2HG PRO 56 -4.396 2.493 10.627 492 2HG PRO 56 1HG PRO 56 -5.257 4.039 10.708 493 1HD PRO 56 2HD PRO 56 -6.479 1.651 10.809 494 2HD PRO 56 1HD PRO 56 -7.266 3.089 10.101 495 H LEU 57 H LEU 57 -4.154 1.778 5.682 496 HA LEU 57 HA LEU 57 -3.437 -0.824 6.270 497 1HB LEU 57 2HB LEU 57 -1.872 -0.654 4.240 498 2HB LEU 57 1HB LEU 57 -3.600 -0.580 4.029 499 1HD1 LEU 57 1HD1 LEU 57 -1.516 2.372 5.047 500 2HD1 LEU 57 2HD1 LEU 57 -1.323 2.962 3.396 501 3HD1 LEU 57 3HD1 LEU 57 -0.482 1.501 3.914 502 1HD2 LEU 57 1HD2 LEU 57 -1.549 0.241 2.024 503 2HD2 LEU 57 2HD2 LEU 57 -2.310 1.762 1.543 504 3HD2 LEU 57 3HD2 LEU 57 -3.299 0.321 1.807 505 H GLU 58 H GLU 58 -1.581 2.041 6.984 506 HA GLU 58 HA GLU 58 0.880 0.831 7.462 507 1HB GLU 58 2HB GLU 58 -0.452 3.122 8.918 508 2HB GLU 58 1HB GLU 58 1.228 2.663 9.147 509 1HG GLU 58 2HG GLU 58 1.717 3.188 6.841 510 2HG GLU 58 1HG GLU 58 0.017 3.536 6.539 511 H ASP 59 H ASP 59 -2.065 0.767 9.372 512 HA ASP 59 HA ASP 59 -0.825 -0.268 11.721 513 1HB ASP 59 2HB ASP 59 -2.980 0.938 11.828 514 2HB ASP 59 1HB ASP 59 -3.742 -0.349 10.903 515 H ILE 60 H ILE 60 -2.281 -1.524 8.912 516 HA ILE 60 HA ILE 60 -2.473 -4.258 9.816 517 HB ILE 60 HB ILE 60 -2.712 -3.234 6.965 518 1HG1 ILE 60 2HG1 ILE 60 -4.857 -3.824 9.022 519 2HG1 ILE 60 1HG1 ILE 60 -4.359 -2.222 8.502 520 1HG2 ILE 60 1HG2 ILE 60 -3.889 -5.364 6.564 521 2HG2 ILE 60 2HG2 ILE 60 -3.580 -5.850 8.230 522 3HG2 ILE 60 3HG2 ILE 60 -2.235 -5.640 7.108 523 1HD1 ILE 60 1HD1 ILE 60 -6.435 -2.895 7.449 524 2HD1 ILE 60 2HD1 ILE 60 -5.646 -4.320 6.775 525 3HD1 ILE 60 3HD1 ILE 60 -5.157 -2.708 6.249 526 H PHE 61 H PHE 61 -0.487 -2.632 7.328 527 HA PHE 61 HA PHE 61 1.487 -4.780 7.674 528 1HB PHE 61 2HB PHE 61 0.973 -3.081 5.172 529 2HB PHE 61 1HB PHE 61 2.210 -4.312 5.367 530 HD1 PHE 61 1HD PHE 61 1.401 -6.706 5.830 531 HD2 PHE 61 2HD PHE 61 -1.102 -3.594 4.356 532 HE1 PHE 61 1HE PHE 61 -0.173 -8.386 4.960 533 HE2 PHE 61 2HE PHE 61 -2.679 -5.267 3.488 534 HZ PHE 61 HZ PHE 61 -2.216 -7.665 3.790 535 H GLN 62 H GLN 62 3.518 -4.147 8.115 536 HA GLN 62 HA GLN 62 4.044 -1.259 8.117 537 1HB GLN 62 2HB GLN 62 3.886 -2.102 10.419 538 2HB GLN 62 1HB GLN 62 5.071 -3.343 10.061 539 1HG GLN 62 2HG GLN 62 6.044 -1.512 11.352 540 2HG GLN 62 1HG GLN 62 6.795 -1.651 9.767 541 1HE2 GLN 62 1HE2 GLN 62 6.655 0.075 8.336 542 2HE2 GLN 62 2HE2 GLN 62 5.890 1.563 8.739 543 H TRP 63 H TRP 63 5.563 -0.704 6.874 544 HA TRP 63 HA TRP 63 7.337 -2.714 5.751 545 1HB TRP 63 2HB TRP 63 7.669 -0.768 4.050 546 2HB TRP 63 1HB TRP 63 6.225 -1.766 3.993 547 HD1 TRP 63 HD TRP 63 7.325 1.787 5.046 548 HE1 TRP 63 1HE TRP 63 5.200 3.262 5.168 549 HE3 TRP 63 3HE TRP 63 3.770 -1.802 4.265 550 HZ2 TRP 63 2HZ TRP 63 2.430 2.940 4.948 551 HZ3 TRP 63 3HZ TRP 63 1.411 -1.135 4.235 552 HH2 TRP 63 HH TRP 63 0.758 1.187 4.570 553 H GLN 64 H GLN 64 9.455 -2.584 5.954 554 HA GLN 64 HA GLN 64 10.642 -0.161 7.098 555 1HB GLN 64 2HB GLN 64 11.270 -2.996 7.975 556 2HB GLN 64 1HB GLN 64 12.067 -1.543 8.546 557 1HG GLN 64 2HG GLN 64 9.887 -0.813 9.534 558 2HG GLN 64 1HG GLN 64 9.211 -2.354 9.035 559 1HE2 GLN 64 1HE2 GLN 64 9.598 -1.200 11.734 560 2HE2 GLN 64 2HE2 GLN 64 10.529 -2.370 12.581 561 HA PRO 65 HA PRO 65 13.145 -1.241 3.436 562 1HB PRO 65 2HB PRO 65 14.391 1.378 3.970 563 2HB PRO 65 1HB PRO 65 13.539 0.830 2.523 564 1HG PRO 65 2HG PRO 65 12.476 2.663 4.173 565 2HG PRO 65 1HG PRO 65 11.472 1.465 3.336 566 1HD PRO 65 2HD PRO 65 12.438 1.479 6.172 567 2HD PRO 65 1HD PRO 65 10.830 1.062 5.534 568 H GLU 66 H GLU 66 13.945 -0.195 6.477 569 HA GLU 66 HA GLU 66 16.336 -1.796 6.692 570 1HB GLU 66 2HB GLU 66 16.423 1.212 7.049 571 2HB GLU 66 1HB GLU 66 17.577 0.159 7.850 572 1HG GLU 66 2HG GLU 66 17.186 0.248 4.863 573 2HG GLU 66 1HG GLU 66 18.377 1.217 5.725 574 1H MET 67 1HT MET 67 -12.122 2.255 -8.941 575 2H MET 67 2HT MET 67 -11.433 2.906 -7.523 576 3H MET 67 3HT MET 67 -10.534 1.876 -8.483 577 HA MET 67 HA MET 67 -10.364 3.445 -10.199 578 1HB MET 67 2HB MET 67 -12.782 4.305 -9.510 579 2HB MET 67 1HB MET 67 -11.870 5.437 -8.526 580 1HG MET 67 2HG MET 67 -11.645 5.120 -11.511 581 2HG MET 67 1HG MET 67 -12.538 6.380 -10.677 582 1HE MET 67 1HE MET 67 -11.284 8.142 -12.187 583 2HE MET 67 2HE MET 67 -10.387 6.839 -12.966 584 3HE MET 67 3HE MET 67 -9.528 8.239 -12.324 585 H ILE 68 H ILE 68 -8.323 4.127 -9.960 586 HA ILE 68 HA ILE 68 -7.397 4.876 -7.270 587 HB ILE 68 HB ILE 68 -5.734 4.073 -9.689 588 1HG1 ILE 68 2HG1 ILE 68 -7.056 2.175 -8.883 589 2HG1 ILE 68 1HG1 ILE 68 -5.354 1.940 -8.511 590 1HG2 ILE 68 1HG2 ILE 68 -3.866 3.868 -8.124 591 2HG2 ILE 68 2HG2 ILE 68 -4.888 4.485 -6.827 592 3HG2 ILE 68 3HG2 ILE 68 -4.490 5.517 -8.201 593 1HD1 ILE 68 1HD1 ILE 68 -6.761 1.232 -6.665 594 2HD1 ILE 68 2HD1 ILE 68 -7.484 2.838 -6.579 595 3HD1 ILE 68 3HD1 ILE 68 -5.778 2.620 -6.195 596 H ILE 69 H ILE 69 -6.590 6.905 -6.833 597 HA ILE 69 HA ILE 69 -6.253 8.744 -9.075 598 HB ILE 69 HB ILE 69 -7.287 9.412 -6.277 599 1HG1 ILE 69 2HG1 ILE 69 -9.338 10.311 -7.582 600 2HG1 ILE 69 1HG1 ILE 69 -8.771 9.319 -8.912 601 1HG2 ILE 69 1HG2 ILE 69 -6.817 11.241 -8.613 602 2HG2 ILE 69 2HG2 ILE 69 -5.898 11.177 -7.107 603 3HG2 ILE 69 3HG2 ILE 69 -7.584 11.699 -7.091 604 1HD1 ILE 69 1HD1 ILE 69 -10.533 8.209 -7.665 605 2HD1 ILE 69 2HD1 ILE 69 -9.583 8.329 -6.183 606 3HD1 ILE 69 3HD1 ILE 69 -9.016 7.322 -7.515 607 H ASN 70 H ASN 70 -4.123 9.493 -9.093 608 HA ASN 70 HA ASN 70 -2.532 8.897 -6.711 609 1HB ASN 70 2HB ASN 70 -1.708 8.026 -8.852 610 2HB ASN 70 1HB ASN 70 -1.718 9.656 -9.524 611 1HD2 ASN 70 1HD2 ASN 70 0.443 9.745 -9.912 612 2HD2 ASN 70 2HD2 ASN 70 1.627 9.764 -8.654 613 H ASN 71 H ASN 71 -1.714 10.468 -5.427 614 HA ASN 71 HA ASN 71 -2.127 13.259 -6.268 615 1HB ASN 71 2HB ASN 71 -2.217 12.104 -3.458 616 2HB ASN 71 1HB ASN 71 -2.388 13.799 -3.870 617 1HD2 ASN 71 1HD2 ASN 71 -4.128 12.073 -2.415 618 2HD2 ASN 71 2HD2 ASN 71 -5.658 12.083 -3.219 619 H LEU 72 H LEU 72 0.142 11.189 -6.337 620 HA LEU 72 HA LEU 72 2.175 11.736 -4.527 621 1HB LEU 72 2HB LEU 72 2.190 9.931 -6.286 622 2HB LEU 72 1HB LEU 72 2.584 11.146 -7.471 623 HG LEU 72 HG LEU 72 4.410 10.477 -5.140 624 1HD1 LEU 72 1HD1 LEU 72 4.409 9.368 -7.934 625 2HD1 LEU 72 2HD1 LEU 72 4.057 8.476 -6.446 626 3HD1 LEU 72 3HD1 LEU 72 5.672 9.132 -6.728 627 1HD2 LEU 72 1HD2 LEU 72 4.866 12.629 -6.259 628 2HD2 LEU 72 2HD2 LEU 72 4.968 11.795 -7.810 629 3HD2 LEU 72 3HD2 LEU 72 6.155 11.461 -6.549 630 H LYS 73 H LYS 73 1.379 13.462 -7.494 631 HA LYS 73 HA LYS 73 3.490 15.286 -7.494 632 1HB LYS 73 2HB LYS 73 2.002 15.009 -9.385 633 2HB LYS 73 1HB LYS 73 0.650 15.617 -8.448 634 1HG LYS 73 2HG LYS 73 1.711 17.803 -8.326 635 2HG LYS 73 1HG LYS 73 3.081 17.186 -9.254 636 1HD LYS 73 2HD LYS 73 1.657 16.730 -11.138 637 2HD LYS 73 1HD LYS 73 0.231 17.204 -10.213 638 1HE LYS 73 2HE LYS 73 2.539 18.992 -10.918 639 2HE LYS 73 1HE LYS 73 0.987 18.952 -11.757 640 1HZ LYS 73 1HZ LYS 73 0.931 20.742 -10.226 641 2HZ LYS 73 2HZ LYS 73 1.533 19.808 -8.969 642 3HZ LYS 73 3HZ LYS 73 -0.037 19.520 -9.533 643 H LEU 74 H LEU 74 0.300 15.531 -5.948 644 HA LEU 74 HA LEU 74 0.584 18.114 -4.908 645 1HB LEU 74 2HB LEU 74 -1.549 16.824 -5.166 646 2HB LEU 74 1HB LEU 74 -1.058 15.791 -3.854 647 HG LEU 74 HG LEU 74 -2.827 17.450 -3.279 648 1HD1 LEU 74 1HD1 LEU 74 -1.516 16.527 -1.481 649 2HD1 LEU 74 2HD1 LEU 74 -1.922 18.210 -1.152 650 3HD1 LEU 74 3HD1 LEU 74 -0.299 17.784 -1.693 651 1HD2 LEU 74 1HD2 LEU 74 -2.213 19.800 -2.946 652 2HD2 LEU 74 2HD2 LEU 74 -2.107 19.310 -4.637 653 3HD2 LEU 74 3HD2 LEU 74 -0.639 19.481 -3.675 654 H ILE 75 H ILE 75 1.384 14.937 -3.573 655 HA ILE 75 HA ILE 75 2.170 16.023 -1.065 656 HB ILE 75 HB ILE 75 2.398 13.227 -2.197 657 1HG1 ILE 75 2HG1 ILE 75 0.988 12.645 -0.231 658 2HG1 ILE 75 1HG1 ILE 75 0.980 14.331 0.245 659 1HG2 ILE 75 1HG2 ILE 75 4.445 13.537 -0.948 660 2HG2 ILE 75 2HG2 ILE 75 3.364 12.473 -0.042 661 3HG2 ILE 75 3HG2 ILE 75 3.548 14.166 0.425 662 1HD1 ILE 75 1HD1 ILE 75 -1.103 13.672 -0.802 663 2HD1 ILE 75 2HD1 ILE 75 -0.233 13.186 -2.257 664 3HD1 ILE 75 3HD1 ILE 75 -0.269 14.883 -1.775 665 H ARG 76 H ARG 76 3.982 15.059 -3.951 666 HA ARG 76 HA ARG 76 6.487 15.509 -2.738 667 1HB ARG 76 2HB ARG 76 7.503 15.398 -4.922 668 2HB ARG 76 1HB ARG 76 6.164 14.285 -4.923 669 1HG ARG 76 2HG ARG 76 4.812 15.813 -6.193 670 2HG ARG 76 1HG ARG 76 6.085 17.038 -6.121 671 1HD ARG 76 2HD ARG 76 7.586 15.543 -7.318 672 2HD ARG 76 1HD ARG 76 6.323 14.316 -7.382 673 HE ARG 76 HE ARG 76 5.756 16.920 -8.571 674 1HH1 ARG 76 1HH1 ARG 76 6.552 13.517 -9.017 675 2HH1 ARG 76 2HH1 ARG 76 6.159 13.495 -10.683 676 1HH2 ARG 76 1HH2 ARG 76 5.279 16.926 -10.877 677 2HH2 ARG 76 2HH2 ARG 76 5.485 15.503 -11.772 678 H GLU 77 H GLU 77 4.167 17.658 -4.244 679 HA GLU 77 HA GLU 77 5.807 19.905 -4.010 680 1HB GLU 77 2HB GLU 77 2.850 19.667 -4.456 681 2HB GLU 77 1HB GLU 77 3.713 21.208 -4.424 682 1HG GLU 77 2HG GLU 77 5.224 20.276 -6.188 683 2HG GLU 77 1HG GLU 77 4.123 18.916 -6.306 684 H LYS 78 H LYS 78 3.563 18.426 -1.788 685 HA LYS 78 HA LYS 78 3.518 20.338 0.237 686 1HB LYS 78 2HB LYS 78 3.764 17.332 0.526 687 2HB LYS 78 1HB LYS 78 3.386 18.418 1.849 688 1HG LYS 78 2HG LYS 78 1.689 18.157 -0.620 689 2HG LYS 78 1HG LYS 78 1.448 17.203 0.843 690 1HD LYS 78 2HD LYS 78 1.404 20.216 0.711 691 2HD LYS 78 1HD LYS 78 -0.026 19.184 0.719 692 1HE LYS 78 2HE LYS 78 2.056 19.312 2.907 693 2HE LYS 78 1HE LYS 78 0.485 20.108 2.950 694 1HZ LYS 78 1HZ LYS 78 0.493 18.005 4.175 695 2HZ LYS 78 2HZ LYS 78 0.876 17.147 2.771 696 3HZ LYS 78 3HZ LYS 78 -0.589 17.977 2.881 697 H LYS 79 H LYS 79 6.073 17.982 -0.510 698 HA LYS 79 HA LYS 79 7.952 19.338 1.305 699 1HB LYS 79 2HB LYS 79 8.308 16.944 -0.553 700 2HB LYS 79 1HB LYS 79 9.541 17.560 0.525 701 1HG LYS 79 2HG LYS 79 6.930 16.341 1.440 702 2HG LYS 79 1HG LYS 79 8.432 15.445 1.263 703 1HD LYS 79 2HD LYS 79 8.347 15.935 3.552 704 2HD LYS 79 1HD LYS 79 9.414 17.175 2.911 705 1HE LYS 79 2HE LYS 79 7.904 18.171 4.485 706 2HE LYS 79 1HE LYS 79 7.470 18.751 2.888 707 1HZ LYS 79 1HZ LYS 79 6.112 16.689 4.502 708 2HZ LYS 79 2HZ LYS 79 5.710 16.929 2.903 709 3HZ LYS 79 3HZ LYS 79 5.481 18.180 4.037 710 H LYS 80 H LYS 80 10.456 19.679 -0.491 711 HA LYS 80 HA LYS 80 9.099 20.328 -2.834 712 1HB LYS 80 2HB LYS 80 10.668 22.228 -3.070 713 2HB LYS 80 1HB LYS 80 9.593 22.413 -1.702 714 1HG LYS 80 2HG LYS 80 11.480 21.665 -0.229 715 2HG LYS 80 1HG LYS 80 12.525 21.714 -1.654 716 1HD LYS 80 2HD LYS 80 11.020 24.019 -0.402 717 2HD LYS 80 1HD LYS 80 12.767 23.787 -0.456 718 1HE LYS 80 2HE LYS 80 12.747 24.025 -2.877 719 2HE LYS 80 1HE LYS 80 10.991 24.175 -2.867 720 1HZ LYS 80 1HZ LYS 80 12.975 26.098 -1.778 721 2HZ LYS 80 2HZ LYS 80 11.319 26.170 -1.433 722 3HZ LYS 80 3HZ LYS 80 11.831 26.354 -3.013 723 H ILE 81 H ILE 81 9.501 18.257 -3.360 724 HA ILE 81 HA ILE 81 12.292 17.716 -4.128 725 HB ILE 81 HB ILE 81 10.185 15.648 -3.377 726 1HG1 ILE 81 2HG1 ILE 81 12.553 16.606 -1.747 727 2HG1 ILE 81 1HG1 ILE 81 10.875 17.024 -1.425 728 1HG2 ILE 81 1HG2 ILE 81 12.078 14.096 -3.349 729 2HG2 ILE 81 2HG2 ILE 81 13.155 15.402 -3.844 730 3HG2 ILE 81 3HG2 ILE 81 11.888 14.845 -4.935 731 1HD1 ILE 81 1HD1 ILE 81 11.661 15.273 0.058 732 2HD1 ILE 81 2HD1 ILE 81 12.063 14.257 -1.328 733 3HD1 ILE 81 3HD1 ILE 81 10.381 14.672 -0.994 734 H SER 82 H SER 82 12.584 17.257 -6.253 735 HA SER 82 HA SER 82 10.295 17.460 -8.016 736 1HB SER 82 2HB SER 82 13.256 17.293 -8.604 737 2HB SER 82 1HB SER 82 11.993 17.688 -9.772 738 HG SER 82 HG SER 82 12.335 19.199 -7.387 739 H GLN 83 H GLN 83 10.338 16.004 -9.996 740 HA GLN 83 HA GLN 83 9.678 13.379 -9.285 741 1HB GLN 83 2HB GLN 83 8.842 14.507 -11.295 742 2HB GLN 83 1HB GLN 83 10.445 14.452 -12.002 743 1HG GLN 83 2HG GLN 83 10.315 11.952 -11.908 744 2HG GLN 83 1HG GLN 83 8.631 12.124 -11.410 745 1HE2 GLN 83 1HE2 GLN 83 7.114 12.886 -12.899 746 2HE2 GLN 83 2HE2 GLN 83 7.449 12.996 -14.578 747 H SER 84 H SER 84 12.677 14.580 -10.855 748 HA SER 84 HA SER 84 13.823 12.027 -11.144 749 1HB SER 84 2HB SER 84 15.176 14.726 -11.010 750 2HB SER 84 1HB SER 84 15.845 13.247 -11.710 751 HG SER 84 HG SER 84 13.643 14.790 -12.615 752 H GLU 85 H GLU 85 13.876 14.428 -8.576 753 HA GLU 85 HA GLU 85 15.860 13.175 -7.035 754 1HB GLU 85 2HB GLU 85 13.609 14.972 -6.163 755 2HB GLU 85 1HB GLU 85 14.997 14.528 -5.181 756 1HG GLU 85 2HG GLU 85 16.468 15.633 -6.783 757 2HG GLU 85 1HG GLU 85 15.057 16.094 -7.740 758 H LEU 86 H LEU 86 12.291 12.837 -7.143 759 HA LEU 86 HA LEU 86 12.070 10.992 -5.050 760 1HB LEU 86 2HB LEU 86 10.427 11.530 -7.484 761 2HB LEU 86 1HB LEU 86 10.178 10.005 -6.676 762 HG LEU 86 HG LEU 86 8.507 11.465 -5.938 763 1HD1 LEU 86 1HD1 LEU 86 9.368 10.066 -4.217 764 2HD1 LEU 86 2HD1 LEU 86 8.881 11.618 -3.538 765 3HD1 LEU 86 3HD1 LEU 86 10.590 11.267 -3.798 766 1HD2 LEU 86 1HD2 LEU 86 8.931 13.635 -4.879 767 2HD2 LEU 86 2HD2 LEU 86 9.476 13.599 -6.555 768 3HD2 LEU 86 3HD2 LEU 86 10.647 13.467 -5.244 769 H ALA 87 H ALA 87 12.872 10.560 -8.432 770 HA ALA 87 HA ALA 87 12.922 7.769 -8.490 771 1HB ALA 87 1HB ALA 87 14.651 9.676 -10.069 772 2HB ALA 87 2HB ALA 87 13.032 9.141 -10.519 773 3HB ALA 87 3HB ALA 87 14.358 7.979 -10.458 774 H ALA 88 H ALA 88 15.536 10.089 -7.712 775 HA ALA 88 HA ALA 88 17.463 8.140 -7.179 776 1HB ALA 88 1HB ALA 88 17.976 10.477 -7.659 777 2HB ALA 88 2HB ALA 88 18.688 9.961 -6.129 778 3HB ALA 88 3HB ALA 88 17.231 10.954 -6.133 779 H LEU 89 H LEU 89 15.206 9.862 -5.042 780 HA LEU 89 HA LEU 89 16.210 8.879 -2.598 781 1HB LEU 89 2HB LEU 89 13.434 9.826 -3.272 782 2HB LEU 89 1HB LEU 89 13.995 9.489 -1.652 783 HG LEU 89 HG LEU 89 15.057 11.647 -3.472 784 1HD1 LEU 89 1HD1 LEU 89 14.004 13.166 -1.875 785 2HD1 LEU 89 2HD1 LEU 89 13.345 11.788 -0.996 786 3HD1 LEU 89 3HD1 LEU 89 12.820 12.114 -2.649 787 1HD2 LEU 89 1HD2 LEU 89 15.724 10.996 -0.602 788 2HD2 LEU 89 2HD2 LEU 89 16.304 12.394 -1.505 789 3HD2 LEU 89 3HD2 LEU 89 16.790 10.768 -1.989 790 H LEU 90 H LEU 90 13.824 7.562 -4.794 791 HA LEU 90 HA LEU 90 13.159 5.431 -2.916 792 1HB LEU 90 2HB LEU 90 12.245 5.776 -5.756 793 2HB LEU 90 1HB LEU 90 11.506 4.801 -4.505 794 HG LEU 90 HG LEU 90 11.590 7.803 -4.595 795 1HD1 LEU 90 1HD1 LEU 90 9.339 5.873 -5.041 796 2HD1 LEU 90 2HD1 LEU 90 10.127 6.882 -6.258 797 3HD1 LEU 90 3HD1 LEU 90 9.189 7.628 -4.964 798 1HD2 LEU 90 1HD2 LEU 90 11.635 6.986 -2.304 799 2HD2 LEU 90 2HD2 LEU 90 10.241 5.956 -2.631 800 3HD2 LEU 90 3HD2 LEU 90 10.072 7.712 -2.677 801 H GLU 91 H GLU 91 15.598 6.030 -5.044 802 HA GLU 91 HA GLU 91 16.842 5.010 -6.534 803 1HB GLU 91 2HB GLU 91 17.283 3.810 -4.206 804 2HB GLU 91 1HB GLU 91 16.569 2.432 -5.025 805 1HG GLU 91 2HG GLU 91 18.959 3.986 -5.925 806 2HG GLU 91 1HG GLU 91 19.020 2.409 -5.134 807 H VAL 92 H VAL 92 14.878 5.294 -7.876 808 HA VAL 92 HA VAL 92 14.302 2.760 -9.154 809 HB VAL 92 HB VAL 92 12.000 3.560 -9.693 810 1HG1 VAL 92 1HG1 VAL 92 12.241 2.005 -7.862 811 2HG1 VAL 92 2HG1 VAL 92 10.937 3.148 -7.530 812 3HG1 VAL 92 3HG1 VAL 92 12.501 3.338 -6.735 813 1HG2 VAL 92 1HG2 VAL 92 12.329 5.956 -9.421 814 2HG2 VAL 92 2HG2 VAL 92 12.543 5.751 -7.683 815 3HG2 VAL 92 3HG2 VAL 92 10.981 5.404 -8.429 816 H SER 93 H SER 93 13.385 3.344 -11.382 817 HA SER 93 HA SER 93 15.203 5.215 -12.575 818 1HB SER 93 2HB SER 93 12.983 3.580 -13.811 819 2HB SER 93 1HB SER 93 14.391 4.267 -14.629 820 HG SER 93 HG SER 93 15.660 2.750 -13.805 821 H ARG 94 H ARG 94 14.469 7.066 -13.873 822 HA ARG 94 HA ARG 94 12.338 8.531 -12.806 823 1HB ARG 94 2HB ARG 94 13.999 8.864 -15.280 824 2HB ARG 94 1HB ARG 94 12.610 9.908 -15.010 825 1HG ARG 94 2HG ARG 94 13.542 10.739 -12.971 826 2HG ARG 94 1HG ARG 94 14.853 9.565 -13.034 827 1HD ARG 94 2HD ARG 94 14.399 11.673 -15.133 828 2HD ARG 94 1HD ARG 94 15.450 11.903 -13.736 829 HE ARG 94 HE ARG 94 16.198 9.544 -14.987 830 1HH1 ARG 94 1HH1 ARG 94 16.135 13.012 -15.844 831 2HH1 ARG 94 2HH1 ARG 94 17.574 12.961 -16.740 832 1HH2 ARG 94 1HH2 ARG 94 18.166 9.493 -16.310 833 2HH2 ARG 94 2HH2 ARG 94 18.745 10.922 -17.016 834 H GLN 95 H GLN 95 12.485 6.333 -15.507 835 HA GLN 95 HA GLN 95 9.915 6.807 -16.532 836 1HB GLN 95 2HB GLN 95 11.637 5.515 -17.713 837 2HB GLN 95 1HB GLN 95 11.557 4.264 -16.484 838 1HG GLN 95 2HG GLN 95 10.383 3.631 -18.533 839 2HG GLN 95 1HG GLN 95 9.298 3.715 -17.147 840 1HE2 GLN 95 1HE2 GLN 95 7.541 3.949 -18.486 841 2HE2 GLN 95 2HE2 GLN 95 7.187 5.392 -19.353 842 H THR 96 H THR 96 11.093 4.833 -13.877 843 HA THR 96 HA THR 96 8.710 3.425 -13.378 844 HB THR 96 HB THR 96 11.013 4.090 -11.529 845 HG1 THR 96 1HG THR 96 10.689 1.622 -12.849 846 1HG2 THR 96 1HG2 THR 96 10.323 2.070 -10.295 847 2HG2 THR 96 2HG2 THR 96 8.953 1.876 -11.387 848 3HG2 THR 96 3HG2 THR 96 9.033 3.275 -10.317 849 H ILE 97 H ILE 97 10.199 6.280 -11.697 850 HA ILE 97 HA ILE 97 7.997 6.657 -10.051 851 HB ILE 97 HB ILE 97 10.174 7.610 -9.467 852 1HG1 ILE 97 2HG1 ILE 97 9.467 9.874 -8.737 853 2HG1 ILE 97 1HG1 ILE 97 8.045 9.732 -9.767 854 1HG2 ILE 97 1HG2 ILE 97 9.766 9.557 -11.716 855 2HG2 ILE 97 2HG2 ILE 97 10.960 8.259 -11.648 856 3HG2 ILE 97 3HG2 ILE 97 11.064 9.611 -10.519 857 1HD1 ILE 97 1HD1 ILE 97 7.506 9.262 -7.448 858 2HD1 ILE 97 2HD1 ILE 97 8.714 7.979 -7.409 859 3HD1 ILE 97 3HD1 ILE 97 7.291 7.821 -8.442 860 H ASN 98 H ASN 98 8.713 8.194 -13.147 861 HA ASN 98 HA ASN 98 6.395 9.824 -13.166 862 1HB ASN 98 2HB ASN 98 8.308 10.117 -14.778 863 2HB ASN 98 1HB ASN 98 7.740 8.690 -15.635 864 1HD2 ASN 98 1HD2 ASN 98 5.679 11.185 -14.197 865 2HD2 ASN 98 2HD2 ASN 98 5.015 11.766 -15.658 866 H GLY 99 H GLY 99 6.952 6.508 -14.218 867 1HA GLY 99 2HA GLY 99 4.456 6.028 -15.365 868 2HA GLY 99 1HA GLY 99 5.518 4.817 -14.659 869 H ILE 100 H ILE 100 5.547 5.740 -11.953 870 HA ILE 100 HA ILE 100 3.083 4.776 -10.990 871 HB ILE 100 HB ILE 100 5.300 6.293 -9.563 872 1HG1 ILE 100 2HG1 ILE 100 6.123 4.208 -10.502 873 2HG1 ILE 100 1HG1 ILE 100 6.025 4.078 -8.754 874 1HG2 ILE 100 1HG2 ILE 100 4.402 5.366 -7.480 875 2HG2 ILE 100 2HG2 ILE 100 3.045 4.687 -8.377 876 3HG2 ILE 100 3HG2 ILE 100 3.254 6.437 -8.283 877 1HD1 ILE 100 1HD1 ILE 100 5.283 2.040 -9.831 878 2HD1 ILE 100 2HD1 ILE 100 4.064 2.942 -10.732 879 3HD1 ILE 100 3HD1 ILE 100 3.944 2.808 -8.977 880 H GLU 101 H GLU 101 4.528 7.979 -11.239 881 HA GLU 101 HA GLU 101 2.594 9.582 -10.164 882 1HB GLU 101 2HB GLU 101 4.825 10.237 -11.005 883 2HB GLU 101 1HB GLU 101 4.217 10.111 -12.643 884 1HG GLU 101 2HG GLU 101 2.552 11.872 -12.049 885 2HG GLU 101 1HG GLU 101 3.429 12.080 -10.530 886 H LYS 102 H LYS 102 2.681 8.186 -13.408 887 HA LYS 102 HA LYS 102 0.128 9.394 -14.101 888 1HB LYS 102 2HB LYS 102 1.979 7.597 -15.647 889 2HB LYS 102 1HB LYS 102 0.456 8.210 -16.273 890 1HG LYS 102 2HG LYS 102 1.282 10.494 -16.057 891 2HG LYS 102 1HG LYS 102 2.805 9.878 -15.404 892 1HD LYS 102 2HD LYS 102 3.195 8.656 -17.420 893 2HD LYS 102 1HD LYS 102 1.682 9.231 -18.120 894 1HE LYS 102 2HE LYS 102 3.997 10.992 -17.286 895 2HE LYS 102 1HE LYS 102 3.654 10.502 -18.942 896 1HZ LYS 102 1HZ LYS 102 1.658 11.800 -18.948 897 2HZ LYS 102 2HZ LYS 102 2.843 12.777 -18.255 898 3HZ LYS 102 3HZ LYS 102 1.705 12.016 -17.285 899 H ASN 103 H ASN 103 0.862 6.994 -12.167 900 HA ASN 103 HA ASN 103 0.317 4.873 -11.688 901 1HB ASN 103 2HB ASN 103 -2.093 4.528 -11.183 902 2HB ASN 103 1HB ASN 103 -1.537 6.092 -10.638 903 1HD2 ASN 103 1HD2 ASN 103 -3.683 4.368 -12.725 904 2HD2 ASN 103 2HD2 ASN 103 -4.593 5.729 -13.252 905 H LYS 104 H LYS 104 1.270 4.831 -14.081 906 HA LYS 104 HA LYS 104 -0.501 3.224 -15.796 907 1HB LYS 104 2HB LYS 104 0.357 5.339 -16.732 908 2HB LYS 104 1HB LYS 104 1.994 4.833 -16.386 909 1HG LYS 104 2HG LYS 104 1.533 4.613 -18.736 910 2HG LYS 104 1HG LYS 104 1.751 3.016 -18.027 911 1HD LYS 104 2HD LYS 104 -0.618 2.634 -18.020 912 2HD LYS 104 1HD LYS 104 -0.929 4.298 -18.524 913 1HE LYS 104 2HE LYS 104 -1.143 2.783 -20.416 914 2HE LYS 104 1HE LYS 104 0.218 3.873 -20.638 915 1HZ LYS 104 1HZ LYS 104 1.723 2.062 -20.003 916 2HZ LYS 104 2HZ LYS 104 0.723 1.608 -21.286 917 3HZ LYS 104 3HZ LYS 104 0.403 1.042 -19.740 918 H TYR 105 H TYR 105 2.501 3.409 -14.026 919 HA TYR 105 HA TYR 105 3.753 1.101 -15.174 920 1HB TYR 105 2HB TYR 105 4.820 3.210 -14.244 921 2HB TYR 105 1HB TYR 105 4.410 2.613 -12.652 922 HD1 TYR 105 1HD TYR 105 6.569 2.306 -15.506 923 HD2 TYR 105 2HD TYR 105 5.639 0.694 -11.704 924 HE1 TYR 105 1HE TYR 105 8.768 1.165 -15.463 925 HE2 TYR 105 2HE TYR 105 7.800 -0.455 -11.635 926 HH TYR 105 HH TYR 105 9.470 -1.228 -13.139 927 H ASN 106 H ASN 106 1.393 1.672 -12.854 928 HA ASN 106 HA ASN 106 0.268 0.502 -11.307 929 1HB ASN 106 2HB ASN 106 0.323 -1.484 -12.755 930 2HB ASN 106 1HB ASN 106 1.933 -1.890 -12.177 931 1HD2 ASN 106 1HD2 ASN 106 2.141 -2.967 -10.199 932 2HD2 ASN 106 2HD2 ASN 106 0.769 -3.537 -9.314 933 HA PRO 107 HA PRO 107 3.200 1.317 -8.104 934 1HB PRO 107 2HB PRO 107 0.884 1.728 -6.389 935 2HB PRO 107 1HB PRO 107 2.070 2.908 -6.950 936 1HG PRO 107 2HG PRO 107 -0.516 2.893 -7.787 937 2HG PRO 107 1HG PRO 107 0.826 3.485 -8.785 938 1HD PRO 107 2HD PRO 107 -0.579 0.842 -8.871 939 2HD PRO 107 1HD PRO 107 -0.040 1.875 -10.214 940 H SER 108 H SER 108 4.067 -0.606 -7.539 941 HA SER 108 HA SER 108 2.560 -2.617 -6.144 942 1HB SER 108 2HB SER 108 5.564 -2.244 -6.345 943 2HB SER 108 1HB SER 108 4.710 -3.728 -5.921 944 HG SER 108 HG SER 108 5.294 -3.891 -7.981 945 H LEU 109 H LEU 109 3.128 -3.128 -3.809 946 HA LEU 109 HA LEU 109 2.955 -0.677 -2.401 947 1HB LEU 109 2HB LEU 109 1.700 -2.760 -1.762 948 2HB LEU 109 1HB LEU 109 3.209 -3.462 -1.234 949 HG LEU 109 HG LEU 109 1.637 -2.573 0.565 950 1HD1 LEU 109 1HD1 LEU 109 4.448 -1.503 0.542 951 2HD1 LEU 109 2HD1 LEU 109 3.941 -3.104 1.081 952 3HD1 LEU 109 3HD1 LEU 109 3.420 -1.670 1.967 953 1HD2 LEU 109 1HD2 LEU 109 1.724 -0.143 1.034 954 2HD2 LEU 109 2HD2 LEU 109 0.981 -0.461 -0.524 955 3HD2 LEU 109 3HD2 LEU 109 2.632 0.106 -0.448 956 H GLN 110 H GLN 110 5.694 -3.059 -2.852 957 HA GLN 110 HA GLN 110 7.511 -1.975 -1.199 958 1HB GLN 110 2HB GLN 110 7.934 -3.915 -2.570 959 2HB GLN 110 1HB GLN 110 7.735 -2.983 -4.041 960 1HG GLN 110 2HG GLN 110 10.051 -3.401 -3.754 961 2HG GLN 110 1HG GLN 110 9.776 -1.696 -3.425 962 1HE2 GLN 110 1HE2 GLN 110 10.695 -4.731 -2.160 963 2HE2 GLN 110 2HE2 GLN 110 11.262 -4.196 -0.635 964 H LEU 111 H LEU 111 6.799 -0.958 -4.480 965 HA LEU 111 HA LEU 111 8.496 1.258 -4.566 966 1HB LEU 111 2HB LEU 111 5.982 0.684 -6.129 967 2HB LEU 111 1HB LEU 111 6.944 2.115 -6.406 968 HG LEU 111 HG LEU 111 8.866 0.650 -7.044 969 1HD1 LEU 111 1HD1 LEU 111 6.859 -1.588 -6.884 970 2HD1 LEU 111 2HD1 LEU 111 8.262 -1.369 -5.835 971 3HD1 LEU 111 3HD1 LEU 111 8.489 -1.694 -7.553 972 1HD2 LEU 111 1HD2 LEU 111 6.330 0.230 -8.611 973 2HD2 LEU 111 2HD2 LEU 111 7.971 0.014 -9.223 974 3HD2 LEU 111 3HD2 LEU 111 7.415 1.613 -8.735 975 H ALA 112 H ALA 112 5.152 1.008 -3.565 976 HA ALA 112 HA ALA 112 4.752 3.787 -3.230 977 1HB ALA 112 1HB ALA 112 3.212 1.506 -2.004 978 2HB ALA 112 2HB ALA 112 2.911 2.216 -3.592 979 3HB ALA 112 3HB ALA 112 2.678 3.183 -2.136 980 H LEU 113 H LEU 113 5.804 1.228 -0.953 981 HA LEU 113 HA LEU 113 5.319 2.657 1.375 982 1HB LEU 113 2HB LEU 113 6.545 0.928 2.516 983 2HB LEU 113 1HB LEU 113 5.616 0.216 1.223 984 HG LEU 113 HG LEU 113 7.863 0.226 -0.087 985 1HD1 LEU 113 1HD1 LEU 113 9.846 -0.088 1.309 986 2HD1 LEU 113 2HD1 LEU 113 8.906 0.347 2.736 987 3HD1 LEU 113 3HD1 LEU 113 9.182 1.539 1.468 988 1HD2 LEU 113 1HD2 LEU 113 8.409 -1.980 0.827 989 2HD2 LEU 113 2HD2 LEU 113 6.673 -1.777 0.582 990 3HD2 LEU 113 3HD2 LEU 113 7.354 -1.662 2.205 991 H LYS 114 H LYS 114 8.148 2.478 -0.641 992 HA LYS 114 HA LYS 114 9.716 4.011 1.122 993 1HB LYS 114 2HB LYS 114 11.323 4.197 -0.785 994 2HB LYS 114 1HB LYS 114 10.888 2.558 -0.339 995 1HG LYS 114 2HG LYS 114 9.224 2.633 -2.248 996 2HG LYS 114 1HG LYS 114 10.024 4.125 -2.746 997 1HD LYS 114 2HD LYS 114 10.977 2.272 -3.959 998 2HD LYS 114 1HD LYS 114 12.175 2.893 -2.821 999 1HE LYS 114 2HE LYS 114 11.557 1.105 -1.241 1000 2HE LYS 114 1HE LYS 114 10.432 0.446 -2.421 1001 1HZ LYS 114 1HZ LYS 114 12.437 0.209 -3.933 1002 2HZ LYS 114 2HZ LYS 114 12.502 -0.775 -2.566 1003 3HZ LYS 114 3HZ LYS 114 13.384 0.652 -2.627 1004 H ILE 115 H ILE 115 7.603 4.830 -1.490 1005 HA ILE 115 HA ILE 115 8.299 7.548 -1.795 1006 HB ILE 115 HB ILE 115 5.520 6.318 -2.043 1007 1HG1 ILE 115 2HG1 ILE 115 7.589 6.832 -4.186 1008 2HG1 ILE 115 1HG1 ILE 115 7.188 5.260 -3.512 1009 1HG2 ILE 115 1HG2 ILE 115 6.571 8.923 -3.149 1010 2HG2 ILE 115 2HG2 ILE 115 5.389 8.736 -1.855 1011 3HG2 ILE 115 3HG2 ILE 115 4.987 8.227 -3.496 1012 1HD1 ILE 115 1HD1 ILE 115 4.920 5.457 -4.407 1013 2HD1 ILE 115 2HD1 ILE 115 6.139 5.577 -5.676 1014 3HD1 ILE 115 3HD1 ILE 115 5.331 7.032 -5.087 1015 H ALA 116 H ALA 116 6.057 5.885 0.302 1016 HA ALA 116 HA ALA 116 4.862 8.022 1.670 1017 1HB ALA 116 1HB ALA 116 4.074 5.702 1.777 1018 2HB ALA 116 2HB ALA 116 4.355 6.381 3.392 1019 3HB ALA 116 3HB ALA 116 5.542 5.287 2.673 1020 H TYR 117 H TYR 117 7.705 6.105 2.359 1021 HA TYR 117 HA TYR 117 8.277 7.285 4.827 1022 1HB TYR 117 2HB TYR 117 8.886 5.012 4.212 1023 2HB TYR 117 1HB TYR 117 9.947 5.619 2.955 1024 HD1 TYR 117 1HD TYR 117 12.108 5.815 3.401 1025 HD2 TYR 117 2HD TYR 117 9.409 5.864 6.636 1026 HE1 TYR 117 1HE TYR 117 14.033 5.829 4.988 1027 HE2 TYR 117 2HE TYR 117 11.269 5.878 8.239 1028 HH TYR 117 HH TYR 117 14.504 6.449 7.248 1029 H TYR 118 H TYR 118 9.797 7.743 1.581 1030 HA TYR 118 HA TYR 118 11.573 9.706 2.609 1031 1HB TYR 118 2HB TYR 118 10.978 8.898 -0.225 1032 2HB TYR 118 1HB TYR 118 12.128 10.174 0.173 1033 HD1 TYR 118 1HD TYR 118 14.145 9.639 1.508 1034 HD2 TYR 118 2HD TYR 118 11.553 6.609 0.061 1035 HE1 TYR 118 1HE TYR 118 15.888 7.966 1.922 1036 HE2 TYR 118 2HE TYR 118 13.253 4.927 0.454 1037 HH TYR 118 HH TYR 118 15.747 4.843 0.669 1038 H LEU 119 H LEU 119 8.464 9.981 1.233 1039 HA LEU 119 HA LEU 119 8.741 12.887 1.145 1040 1HB LEU 119 2HB LEU 119 6.365 11.129 0.527 1041 2HB LEU 119 1HB LEU 119 6.304 12.882 0.491 1042 1HD1 LEU 119 1HD2 LEU 119 5.759 10.862 -1.829 1043 2HD1 LEU 119 2HD2 LEU 119 6.582 11.806 -3.072 1044 3HD1 LEU 119 3HD2 LEU 119 5.517 12.606 -1.914 1045 1HD2 LEU 119 1HD1 LEU 119 7.466 14.141 -1.303 1046 2HD2 LEU 119 2HD1 LEU 119 8.453 13.277 -2.484 1047 3HD2 LEU 119 3HD1 LEU 119 8.997 13.414 -0.812 1048 H ASN 120 H ASN 120 8.200 10.618 3.392 1049 HA ASN 120 HA ASN 120 7.199 10.395 5.395 1050 1HB ASN 120 2HB ASN 120 9.050 11.937 5.950 1051 2HB ASN 120 1HB ASN 120 8.009 13.312 5.613 1052 1HD2 ASN 120 1HD2 ASN 120 8.644 10.676 7.816 1053 2HD2 ASN 120 2HD2 ASN 120 7.748 11.318 9.144 1054 H THR 121 H THR 121 5.258 10.128 4.130 1055 HA THR 121 HA THR 121 3.130 11.753 5.162 1056 HB THR 121 HB THR 121 3.657 11.481 2.171 1057 HG1 THR 121 1HG THR 121 4.548 13.241 3.848 1058 1HG2 THR 121 1HG2 THR 121 1.272 11.363 2.691 1059 2HG2 THR 121 2HG2 THR 121 1.663 12.885 1.888 1060 3HG2 THR 121 3HG2 THR 121 1.395 12.849 3.632 1061 HA PRO 122 HA PRO 122 1.542 7.560 5.118 1062 1HB PRO 122 2HB PRO 122 -1.153 8.230 5.149 1063 2HB PRO 122 1HB PRO 122 -0.132 8.079 6.582 1064 1HG PRO 122 2HG PRO 122 -0.985 10.520 5.111 1065 2HG PRO 122 1HG PRO 122 -0.755 10.275 6.850 1066 1HD PRO 122 2HD PRO 122 1.016 11.584 5.318 1067 2HD PRO 122 1HD PRO 122 1.520 10.615 6.723 1068 H LEU 123 H LEU 123 0.900 6.193 3.569 1069 HA LEU 123 HA LEU 123 0.892 6.853 0.886 1070 1HB LEU 123 2HB LEU 123 -0.155 4.464 2.337 1071 2HB LEU 123 1HB LEU 123 -0.222 4.596 0.592 1072 1HD1 LEU 123 1HD2 LEU 123 2.685 2.464 1.348 1073 2HD1 LEU 123 2HD2 LEU 123 1.100 2.511 0.558 1074 3HD1 LEU 123 3HD2 LEU 123 1.210 2.541 2.318 1075 1HD2 LEU 123 1HD1 LEU 123 2.393 5.948 0.120 1076 2HD2 LEU 123 2HD1 LEU 123 1.783 4.537 -0.746 1077 3HD2 LEU 123 3HD1 LEU 123 3.367 4.480 0.030 1078 H GLU 124 H GLU 124 -1.845 6.458 3.089 1079 HA GLU 124 HA GLU 124 -3.914 6.555 1.302 1080 1HB GLU 124 2HB GLU 124 -3.799 7.797 4.046 1081 2HB GLU 124 1HB GLU 124 -5.248 7.296 3.182 1082 1HG GLU 124 2HG GLU 124 -4.501 4.987 3.253 1083 2HG GLU 124 1HG GLU 124 -3.041 5.480 4.112 1084 H ASP 125 H ASP 125 -1.958 9.199 2.589 1085 HA ASP 125 HA ASP 125 -3.605 11.236 1.475 1086 1HB ASP 125 2HB ASP 125 -2.055 11.558 3.453 1087 2HB ASP 125 1HB ASP 125 -0.717 11.524 2.307 1088 H ILE 126 H ILE 126 -0.792 9.518 0.544 1089 HA ILE 126 HA ILE 126 -0.035 11.172 -1.728 1090 HB ILE 126 HB ILE 126 0.947 8.370 -1.084 1091 1HG1 ILE 126 2HG1 ILE 126 2.147 11.055 -0.355 1092 2HG1 ILE 126 1HG1 ILE 126 1.363 9.950 0.766 1093 1HG2 ILE 126 1HG2 ILE 126 2.120 10.539 -2.841 1094 2HG2 ILE 126 2HG2 ILE 126 1.378 9.039 -3.400 1095 3HG2 ILE 126 3HG2 ILE 126 2.884 8.990 -2.484 1096 1HD1 ILE 126 1HD1 ILE 126 3.896 9.414 -0.770 1097 2HD1 ILE 126 2HD1 ILE 126 3.113 8.298 0.346 1098 3HD1 ILE 126 3HD1 ILE 126 3.777 9.818 0.944 1099 H PHE 127 H PHE 127 -1.379 7.961 -1.410 1100 HA PHE 127 HA PHE 127 -2.358 8.238 -4.176 1101 1HB PHE 127 2HB PHE 127 -1.858 5.680 -2.551 1102 2HB PHE 127 1HB PHE 127 -2.645 5.745 -4.125 1103 HD1 PHE 127 1HD PHE 127 -1.357 6.165 -6.117 1104 HD2 PHE 127 2HD PHE 127 0.478 6.028 -2.276 1105 HE1 PHE 127 1HE PHE 127 0.848 5.951 -7.176 1106 HE2 PHE 127 2HE PHE 127 2.685 5.816 -3.333 1107 HZ PHE 127 HZ PHE 127 2.871 5.778 -5.785 1108 H GLN 128 H GLN 128 -4.506 8.094 -4.532 1109 HA GLN 128 HA GLN 128 -6.140 7.908 -2.120 1110 1HB GLN 128 2HB GLN 128 -6.078 10.089 -3.403 1111 2HB GLN 128 1HB GLN 128 -6.809 9.233 -4.749 1112 1HG GLN 128 2HG GLN 128 -8.770 8.755 -3.401 1113 2HG GLN 128 1HG GLN 128 -8.029 9.567 -2.018 1114 1HE2 GLN 128 1HE2 GLN 128 -9.598 9.975 -5.058 1115 2HE2 GLN 128 2HE2 GLN 128 -9.758 11.683 -4.987 1116 H TRP 129 H TRP 129 -7.369 6.230 -2.051 1117 HA TRP 129 HA TRP 129 -7.853 4.830 -4.530 1118 1HB TRP 129 2HB TRP 129 -7.750 2.713 -3.062 1119 2HB TRP 129 1HB TRP 129 -6.273 3.456 -3.653 1120 HD1 TRP 129 HD TRP 129 -8.405 3.678 -0.389 1121 HE1 TRP 129 1HE TRP 129 -6.779 3.832 1.582 1122 HE3 TRP 129 3HE TRP 129 -4.017 3.602 -2.990 1123 HZ2 TRP 129 2HZ TRP 129 -3.971 3.862 1.976 1124 HZ3 TRP 129 3HZ TRP 129 -1.905 3.685 -1.740 1125 HH2 TRP 129 HH TRP 129 -1.889 3.813 0.690 1126 H GLN 130 H GLN 130 -9.682 4.309 -4.985 1127 HA GLN 130 HA GLN 130 -11.791 4.236 -2.963 1128 1HB GLN 130 2HB GLN 130 -11.999 5.408 -5.755 1129 2HB GLN 130 1HB GLN 130 -13.294 5.315 -4.574 1130 1HG GLN 130 2HG GLN 130 -10.762 6.880 -4.197 1131 2HG GLN 130 1HG GLN 130 -12.245 7.578 -4.813 1132 1HE2 GLN 130 1HE2 GLN 130 -12.408 8.993 -3.097 1133 2HE2 GLN 130 2HE2 GLN 130 -12.751 8.492 -1.464 1134 HA PRO 131 HA PRO 131 -11.918 0.208 -5.036 1135 1HB PRO 131 2HB PRO 131 -14.170 -0.223 -3.162 1136 2HB PRO 131 1HB PRO 131 -12.668 -1.139 -3.339 1137 1HG PRO 131 2HG PRO 131 -13.031 0.422 -1.228 1138 2HG PRO 131 1HG PRO 131 -11.451 0.362 -2.040 1139 1HD PRO 131 2HD PRO 131 -13.634 2.408 -2.322 1140 2HD PRO 131 1HD PRO 131 -11.895 2.660 -2.031 1141 H GLU 132 H GLU 132 -13.448 2.540 -5.943 1142 HA GLU 132 HA GLU 132 -16.062 1.658 -6.735 1143 1HB GLU 132 2HB GLU 132 -14.408 3.974 -7.770 1144 2HB GLU 132 1HB GLU 132 -16.132 3.738 -8.001 1145 1HG GLU 132 2HG GLU 132 -14.727 4.321 -5.404 1146 2HG GLU 132 1HG GLU 132 -15.742 5.426 -6.328 Start of MODEL 3 1 1H MET 1 1HT MET 1 12.980 -5.064 5.953 2 2H MET 1 2HT MET 1 12.463 -5.507 4.425 3 3H MET 1 3HT MET 1 13.831 -6.266 5.092 4 HA MET 1 HA MET 1 11.955 -7.708 5.129 5 1HB MET 1 2HB MET 1 12.644 -6.601 7.853 6 2HB MET 1 1HB MET 1 11.689 -8.054 7.607 7 1HG MET 1 2HG MET 1 13.584 -9.094 6.466 8 2HG MET 1 1HG MET 1 14.539 -7.636 6.741 9 1HE MET 1 1HE MET 1 13.660 -6.756 9.661 10 2HE MET 1 2HE MET 1 15.338 -6.801 9.119 11 3HE MET 1 3HE MET 1 14.882 -7.572 10.639 12 H ILE 2 H ILE 2 9.921 -8.135 5.626 13 HA ILE 2 HA ILE 2 8.181 -5.821 6.199 14 HB ILE 2 HB ILE 2 7.495 -8.305 4.563 15 1HG1 ILE 2 2HG1 ILE 2 8.924 -6.757 3.316 16 2HG1 ILE 2 1HG1 ILE 2 7.298 -6.764 2.652 17 1HG2 ILE 2 1HG2 ILE 2 5.546 -7.577 5.797 18 2HG2 ILE 2 2HG2 ILE 2 5.346 -7.240 4.077 19 3HG2 ILE 2 3HG2 ILE 2 5.748 -5.932 5.190 20 1HD1 ILE 2 1HD1 ILE 2 6.825 -4.653 3.795 21 2HD1 ILE 2 2HD1 ILE 2 8.212 -4.520 2.713 22 3HD1 ILE 2 3HD1 ILE 2 8.461 -4.650 4.454 23 H ILE 3 H ILE 3 6.684 -6.037 7.800 24 HA ILE 3 HA ILE 3 6.707 -8.532 9.312 25 HB ILE 3 HB ILE 3 6.591 -5.666 10.353 26 1HG1 ILE 3 2HG1 ILE 3 8.731 -7.781 10.722 27 2HG1 ILE 3 1HG1 ILE 3 8.845 -6.407 9.635 28 1HG2 ILE 3 1HG2 ILE 3 6.520 -8.274 11.882 29 2HG2 ILE 3 2HG2 ILE 3 5.169 -7.164 11.672 30 3HG2 ILE 3 3HG2 ILE 3 6.584 -6.663 12.600 31 1HD1 ILE 3 1HD1 ILE 3 10.105 -6.037 11.674 32 2HD1 ILE 3 2HD1 ILE 3 8.648 -6.284 12.634 33 3HD1 ILE 3 3HD1 ILE 3 8.766 -4.897 11.553 34 H ASN 4 H ASN 4 4.635 -9.365 9.349 35 HA ASN 4 HA ASN 4 2.563 -7.601 8.304 36 1HB ASN 4 2HB ASN 4 3.113 -9.608 7.019 37 2HB ASN 4 1HB ASN 4 2.813 -10.601 8.433 38 1HD2 ASN 4 1HD2 ASN 4 1.289 -11.745 7.327 39 2HD2 ASN 4 2HD2 ASN 4 -0.269 -11.103 6.946 40 H ASN 5 H ASN 5 0.857 -7.036 9.519 41 HA ASN 5 HA ASN 5 0.650 -8.227 12.203 42 1HB ASN 5 2HB ASN 5 -0.133 -5.453 11.261 43 2HB ASN 5 1HB ASN 5 -0.331 -6.083 12.885 44 1HD2 ASN 5 1HD2 ASN 5 1.064 -3.775 11.853 45 2HD2 ASN 5 2HD2 ASN 5 2.692 -3.900 12.419 46 H LEU 6 H LEU 6 -0.588 -8.703 9.395 47 HA LEU 6 HA LEU 6 -3.225 -7.938 9.228 48 1HB LEU 6 2HB LEU 6 -1.892 -9.096 7.466 49 2HB LEU 6 1HB LEU 6 -2.021 -10.583 8.359 50 HG LEU 6 HG LEU 6 -3.453 -10.367 6.298 51 1HD1 LEU 6 1HD1 LEU 6 -4.901 -10.909 8.870 52 2HD1 LEU 6 2HD1 LEU 6 -3.949 -12.061 7.934 53 3HD1 LEU 6 3HD1 LEU 6 -5.437 -11.395 7.262 54 1HD2 LEU 6 1HD2 LEU 6 -5.010 -8.459 8.029 55 2HD2 LEU 6 2HD2 LEU 6 -5.544 -9.110 6.479 56 3HD2 LEU 6 3HD2 LEU 6 -4.130 -8.057 6.554 57 H LYS 7 H LYS 7 -1.934 -10.757 10.919 58 HA LYS 7 HA LYS 7 -4.427 -11.690 11.832 59 1HB LYS 7 2HB LYS 7 -3.171 -13.037 13.490 60 2HB LYS 7 1HB LYS 7 -2.541 -13.190 11.862 61 1HG LYS 7 2HG LYS 7 -0.719 -11.620 12.464 62 2HG LYS 7 1HG LYS 7 -1.344 -11.578 14.116 63 1HD LYS 7 2HD LYS 7 -0.402 -14.060 12.668 64 2HD LYS 7 1HD LYS 7 0.548 -13.155 13.846 65 1HE LYS 7 2HE LYS 7 -1.065 -13.652 15.579 66 2HE LYS 7 1HE LYS 7 -2.122 -14.441 14.415 67 1HZ LYS 7 1HZ LYS 7 -0.426 -16.125 14.069 68 2HZ LYS 7 2HZ LYS 7 -0.862 -16.050 15.688 69 3HZ LYS 7 3HZ LYS 7 0.604 -15.393 15.196 70 H LEU 8 H LEU 8 -2.122 -9.454 13.408 71 HA LEU 8 HA LEU 8 -3.438 -9.161 15.838 72 1HB LEU 8 2HB LEU 8 -1.101 -8.395 15.103 73 2HB LEU 8 1HB LEU 8 -1.877 -7.025 14.358 74 HG LEU 8 HG LEU 8 -0.806 -6.449 16.479 75 1HD1 LEU 8 1HD1 LEU 8 -2.624 -5.312 17.624 76 2HD1 LEU 8 2HD1 LEU 8 -3.794 -6.232 16.677 77 3HD1 LEU 8 3HD1 LEU 8 -2.701 -5.104 15.875 78 1HD2 LEU 8 1HD2 LEU 8 -0.965 -8.562 17.615 79 2HD2 LEU 8 2HD2 LEU 8 -2.718 -8.403 17.733 80 3HD2 LEU 8 3HD2 LEU 8 -1.671 -7.288 18.612 81 H ILE 9 H ILE 9 -3.779 -7.323 12.808 82 HA ILE 9 HA ILE 9 -5.749 -5.554 13.810 83 HB ILE 9 HB ILE 9 -4.959 -6.261 10.965 84 1HG1 ILE 9 2HG1 ILE 9 -4.331 -3.856 10.846 85 2HG1 ILE 9 1HG1 ILE 9 -4.843 -3.663 12.511 86 1HG2 ILE 9 1HG2 ILE 9 -7.169 -4.346 11.701 87 2HG2 ILE 9 2HG2 ILE 9 -7.357 -5.882 10.855 88 3HG2 ILE 9 3HG2 ILE 9 -6.483 -4.554 10.089 89 1HD1 ILE 9 1HD1 ILE 9 -3.065 -5.171 13.213 90 2HD1 ILE 9 2HD1 ILE 9 -2.441 -3.788 12.313 91 3HD1 ILE 9 3HD1 ILE 9 -2.570 -5.365 11.533 92 H ARG 10 H ARG 10 -5.963 -8.644 12.234 93 HA ARG 10 HA ARG 10 -8.775 -8.645 12.091 94 1HB ARG 10 2HB ARG 10 -6.751 -10.809 11.893 95 2HB ARG 10 1HB ARG 10 -8.466 -11.195 11.995 96 1HG ARG 10 2HG ARG 10 -8.903 -9.856 10.030 97 2HG ARG 10 1HG ARG 10 -7.193 -9.424 9.933 98 1HD ARG 10 2HD ARG 10 -7.860 -11.263 8.419 99 2HD ARG 10 1HD ARG 10 -6.576 -11.685 9.550 100 HE ARG 10 HE ARG 10 -9.040 -12.372 10.671 101 1HH1 ARG 10 1HH1 ARG 10 -7.291 -13.303 7.793 102 2HH1 ARG 10 2HH1 ARG 10 -7.444 -14.975 8.021 103 1HH2 ARG 10 1HH2 ARG 10 -9.327 -14.660 11.028 104 2HH2 ARG 10 2HH2 ARG 10 -8.730 -15.769 9.887 105 H GLU 11 H GLU 11 -6.576 -9.664 14.714 106 HA GLU 11 HA GLU 11 -8.710 -10.654 16.252 107 1HB GLU 11 2HB GLU 11 -5.989 -9.692 17.119 108 2HB GLU 11 1HB GLU 11 -7.128 -10.584 18.124 109 1HG GLU 11 2HG GLU 11 -7.038 -12.415 16.434 110 2HG GLU 11 1HG GLU 11 -5.724 -11.538 15.656 111 H LYS 12 H LYS 12 -7.217 -7.524 15.918 112 HA LYS 12 HA LYS 12 -8.574 -6.155 17.896 113 1HB LYS 12 2HB LYS 12 -6.745 -5.181 16.615 114 2HB LYS 12 1HB LYS 12 -7.716 -5.199 15.158 115 1HG LYS 12 2HG LYS 12 -9.078 -3.440 15.932 116 2HG LYS 12 1HG LYS 12 -8.464 -3.592 17.579 117 1HD LYS 12 2HD LYS 12 -7.492 -1.658 16.430 118 2HD LYS 12 1HD LYS 12 -6.267 -2.846 16.854 119 1HE LYS 12 2HE LYS 12 -6.309 -3.680 14.527 120 2HE LYS 12 1HE LYS 12 -7.502 -2.441 14.127 121 1HZ LYS 12 1HZ LYS 12 -4.750 -1.963 15.108 122 2HZ LYS 12 2HZ LYS 12 -5.857 -0.752 14.791 123 3HZ LYS 12 3HZ LYS 12 -5.234 -1.700 13.537 124 H LYS 13 H LYS 13 -9.735 -6.993 14.676 125 HA LYS 13 HA LYS 13 -12.465 -6.232 15.509 126 1HB LYS 13 2HB LYS 13 -11.374 -7.106 12.794 127 2HB LYS 13 1HB LYS 13 -13.050 -6.680 13.107 128 1HG LYS 13 2HG LYS 13 -10.682 -4.819 13.302 129 2HG LYS 13 1HG LYS 13 -11.879 -4.855 12.006 130 1HD LYS 13 2HD LYS 13 -13.637 -4.254 13.583 131 2HD LYS 13 1HD LYS 13 -12.479 -4.290 14.910 132 1HE LYS 13 2HE LYS 13 -12.902 -1.999 14.232 133 2HE LYS 13 1HE LYS 13 -11.241 -2.441 13.857 134 1HZ LYS 13 1HZ LYS 13 -12.282 -1.193 12.099 135 2HZ LYS 13 2HZ LYS 13 -13.495 -2.347 11.920 136 3HZ LYS 13 3HZ LYS 13 -11.880 -2.724 11.528 137 H LYS 14 H LYS 14 -14.064 -8.678 14.231 138 HA LYS 14 HA LYS 14 -12.240 -10.687 14.793 139 1HB LYS 14 2HB LYS 14 -14.284 -11.870 15.799 140 2HB LYS 14 1HB LYS 14 -13.492 -10.656 16.787 141 1HG LYS 14 2HG LYS 14 -15.241 -9.046 16.197 142 2HG LYS 14 1HG LYS 14 -16.029 -10.279 15.208 143 1HD LYS 14 2HD LYS 14 -16.443 -11.644 17.128 144 2HD LYS 14 1HD LYS 14 -15.471 -10.584 18.150 145 1HE LYS 14 2HE LYS 14 -18.038 -9.807 16.764 146 2HE LYS 14 1HE LYS 14 -17.889 -10.236 18.467 147 1HZ LYS 14 1HZ LYS 14 -16.312 -8.333 18.686 148 2HZ LYS 14 2HZ LYS 14 -17.857 -7.848 18.294 149 3HZ LYS 14 3HZ LYS 14 -16.667 -7.872 17.112 150 H ILE 15 H ILE 15 -12.034 -10.485 12.520 151 HA ILE 15 HA ILE 15 -14.266 -11.749 11.087 152 HB ILE 15 HB ILE 15 -12.197 -9.842 9.927 153 1HG1 ILE 15 2HG1 ILE 15 -15.130 -9.344 10.515 154 2HG1 ILE 15 1HG1 ILE 15 -13.783 -8.666 11.419 155 1HG2 ILE 15 1HG2 ILE 15 -13.013 -11.497 8.328 156 2HG2 ILE 15 2HG2 ILE 15 -13.612 -9.890 7.922 157 3HG2 ILE 15 3HG2 ILE 15 -14.681 -11.057 8.702 158 1HD1 ILE 15 1HD1 ILE 15 -14.720 -7.038 9.882 159 2HD1 ILE 15 2HD1 ILE 15 -14.421 -8.129 8.527 160 3HD1 ILE 15 3HD1 ILE 15 -13.066 -7.445 9.427 161 H SER 16 H SER 16 -13.734 -13.598 9.988 162 HA SER 16 HA SER 16 -10.974 -14.428 10.271 163 1HB SER 16 2HB SER 16 -13.498 -16.058 10.004 164 2HB SER 16 1HB SER 16 -11.865 -16.722 10.142 165 HG SER 16 HG SER 16 -13.491 -15.517 12.034 166 H GLN 17 H GLN 17 -10.751 -16.423 8.492 167 HA GLN 17 HA GLN 17 -10.019 -14.944 6.229 168 1HB GLN 17 2HB GLN 17 -9.359 -17.094 5.205 169 2HB GLN 17 1HB GLN 17 -8.706 -16.846 6.813 170 1HG GLN 17 2HG GLN 17 -10.239 -18.398 7.760 171 2HG GLN 17 1HG GLN 17 -11.152 -18.501 6.255 172 1HE2 GLN 17 1HE2 GLN 17 -8.185 -19.370 7.857 173 2HE2 GLN 17 2HE2 GLN 17 -7.773 -20.652 6.776 174 H SER 18 H SER 18 -12.866 -17.113 6.681 175 HA SER 18 HA SER 18 -13.442 -17.267 3.959 176 1HB SER 18 2HB SER 18 -15.365 -17.528 6.269 177 2HB SER 18 1HB SER 18 -15.463 -18.301 4.684 178 HG SER 18 HG SER 18 -13.929 -18.884 6.898 179 H GLU 19 H GLU 19 -14.551 -15.117 6.540 180 HA GLU 19 HA GLU 19 -16.404 -13.742 4.962 181 1HB GLU 19 2HB GLU 19 -14.916 -12.621 7.341 182 2HB GLU 19 1HB GLU 19 -16.428 -12.029 6.678 183 1HG GLU 19 2HG GLU 19 -17.172 -13.198 8.492 184 2HG GLU 19 1HG GLU 19 -17.282 -14.431 7.243 185 H LEU 20 H LEU 20 -12.977 -12.982 5.738 186 HA LEU 20 HA LEU 20 -12.940 -10.628 4.242 187 1HB LEU 20 2HB LEU 20 -10.740 -12.473 5.096 188 2HB LEU 20 1HB LEU 20 -10.431 -11.026 4.161 189 HG LEU 20 HG LEU 20 -11.679 -11.118 6.905 190 1HD1 LEU 20 1HD1 LEU 20 -9.301 -11.643 6.908 191 2HD1 LEU 20 2HD1 LEU 20 -9.601 -10.053 7.608 192 3HD1 LEU 20 3HD1 LEU 20 -8.971 -10.190 5.966 193 1HD2 LEU 20 1HD2 LEU 20 -10.913 -8.770 5.166 194 2HD2 LEU 20 2HD2 LEU 20 -11.484 -8.678 6.831 195 3HD2 LEU 20 3HD2 LEU 20 -12.558 -9.272 5.563 196 H ALA 21 H ALA 21 -12.321 -13.942 3.307 197 HA ALA 21 HA ALA 21 -11.324 -13.491 0.757 198 1HB ALA 21 1HB ALA 21 -13.153 -15.731 1.636 199 2HB ALA 21 2HB ALA 21 -11.398 -15.703 1.815 200 3HB ALA 21 3HB ALA 21 -12.121 -15.733 0.207 201 H ALA 22 H ALA 22 -14.707 -13.803 1.806 202 HA ALA 22 HA ALA 22 -15.864 -13.422 -0.713 203 1HB ALA 22 1HB ALA 22 -17.069 -14.356 1.211 204 2HB ALA 22 2HB ALA 22 -17.933 -12.994 0.499 205 3HB ALA 22 3HB ALA 22 -17.027 -12.778 1.997 206 H LEU 23 H LEU 23 -14.881 -11.118 1.772 207 HA LEU 23 HA LEU 23 -16.055 -8.827 0.520 208 1HB LEU 23 2HB LEU 23 -14.146 -9.244 2.770 209 2HB LEU 23 1HB LEU 23 -14.205 -7.664 2.033 210 HG LEU 23 HG LEU 23 -16.560 -7.432 2.671 211 1HD1 LEU 23 1HD1 LEU 23 -17.257 -9.747 2.572 212 2HD1 LEU 23 2HD1 LEU 23 -17.614 -9.011 4.147 213 3HD1 LEU 23 3HD1 LEU 23 -16.240 -10.109 3.975 214 1HD2 LEU 23 1HD2 LEU 23 -14.855 -6.670 4.209 215 2HD2 LEU 23 2HD2 LEU 23 -14.780 -8.270 4.947 216 3HD2 LEU 23 3HD2 LEU 23 -16.248 -7.304 5.087 217 H LEU 24 H LEU 24 -12.733 -10.228 0.501 218 HA LEU 24 HA LEU 24 -11.749 -8.091 -1.093 219 1HB LEU 24 2HB LEU 24 -10.485 -10.715 -0.358 220 2HB LEU 24 1HB LEU 24 -9.662 -9.298 -0.979 221 HG LEU 24 HG LEU 24 -10.984 -9.581 1.713 222 1HD1 LEU 24 1HD1 LEU 24 -8.092 -9.385 0.933 223 2HD1 LEU 24 2HD1 LEU 24 -8.926 -10.814 1.543 224 3HD1 LEU 24 3HD1 LEU 24 -8.714 -9.404 2.583 225 1HD2 LEU 24 1HD2 LEU 24 -10.038 -7.380 2.224 226 2HD2 LEU 24 2HD2 LEU 24 -11.198 -7.292 0.898 227 3HD2 LEU 24 3HD2 LEU 24 -9.469 -7.239 0.562 228 H GLU 25 H GLU 25 -13.621 -10.639 -1.855 229 HA GLU 25 HA GLU 25 -14.340 -11.556 -3.863 230 1HB GLU 25 2HB GLU 25 -12.263 -9.783 -5.169 231 2HB GLU 25 1HB GLU 25 -13.524 -10.664 -5.997 232 1HG GLU 25 2HG GLU 25 -15.200 -9.221 -4.996 233 2HG GLU 25 1HG GLU 25 -13.937 -8.365 -4.098 234 H VAL 26 H VAL 26 -12.073 -12.698 -2.292 235 HA VAL 26 HA VAL 26 -10.651 -14.020 -4.470 236 HB VAL 26 HB VAL 26 -8.616 -14.138 -3.072 237 1HG1 VAL 26 1HG1 VAL 26 -7.883 -11.825 -3.368 238 2HG1 VAL 26 2HG1 VAL 26 -9.560 -11.338 -3.630 239 3HG1 VAL 26 3HG1 VAL 26 -8.769 -12.429 -4.769 240 1HG2 VAL 26 1HG2 VAL 26 -8.383 -12.633 -1.121 241 2HG2 VAL 26 2HG2 VAL 26 -9.592 -13.890 -0.868 242 3HG2 VAL 26 3HG2 VAL 26 -10.103 -12.248 -1.249 243 H SER 27 H SER 27 -9.490 -15.994 -3.545 244 HA SER 27 HA SER 27 -11.481 -17.596 -2.238 245 1HB SER 27 2HB SER 27 -8.699 -18.312 -3.163 246 2HB SER 27 1HB SER 27 -10.045 -19.417 -2.864 247 HG SER 27 HG SER 27 -11.074 -17.815 -4.550 248 H ARG 28 H ARG 28 -10.882 -18.932 -0.342 249 HA ARG 28 HA ARG 28 -9.811 -17.338 1.705 250 1HB ARG 28 2HB ARG 28 -10.224 -20.319 1.792 251 2HB ARG 28 1HB ARG 28 -10.018 -19.259 3.179 252 1HG ARG 28 2HG ARG 28 -12.084 -18.041 2.375 253 2HG ARG 28 1HG ARG 28 -12.325 -19.395 1.272 254 1HD ARG 28 2HD ARG 28 -12.227 -19.469 4.274 255 2HD ARG 28 1HD ARG 28 -13.621 -19.755 3.246 256 HE ARG 28 HE ARG 28 -12.020 -21.677 2.419 257 1HH1 ARG 28 1HH1 ARG 28 -12.930 -20.608 5.673 258 2HH1 ARG 28 2HH1 ARG 28 -12.535 -22.067 6.460 259 1HH2 ARG 28 1HH2 ARG 28 -11.620 -23.782 3.459 260 2HH2 ARG 28 2HH2 ARG 28 -11.829 -23.940 5.150 261 H GLN 29 H GLN 29 -8.311 -19.809 -0.251 262 HA GLN 29 HA GLN 29 -5.902 -20.079 1.108 263 1HB GLN 29 2HB GLN 29 -6.597 -21.543 -0.735 264 2HB GLN 29 1HB GLN 29 -6.495 -20.213 -1.864 265 1HG GLN 29 2HG GLN 29 -4.070 -21.189 -0.386 266 2HG GLN 29 1HG GLN 29 -4.644 -21.995 -1.842 267 1HE2 GLN 29 1HE2 GLN 29 -2.157 -20.612 -1.353 268 2HE2 GLN 29 2HE2 GLN 29 -2.027 -19.361 -2.525 269 H THR 30 H THR 30 -7.004 -17.550 -1.088 270 HA THR 30 HA THR 30 -4.542 -16.295 -1.527 271 HB THR 30 HB THR 30 -7.237 -14.930 -1.447 272 HG1 THR 30 1HG THR 30 -6.139 -16.478 -3.589 273 1HG2 THR 30 1HG2 THR 30 -6.285 -13.635 -3.311 274 2HG2 THR 30 2HG2 THR 30 -4.796 -14.574 -3.209 275 3HG2 THR 30 3HG2 THR 30 -5.265 -13.517 -1.877 276 H ILE 31 H ILE 31 -7.210 -15.583 0.776 277 HA ILE 31 HA ILE 31 -5.736 -13.536 2.044 278 HB ILE 31 HB ILE 31 -8.154 -13.408 2.116 279 1HG1 ILE 31 2HG1 ILE 31 -8.575 -13.026 4.544 280 2HG1 ILE 31 1HG1 ILE 31 -7.045 -13.817 4.903 281 1HG2 ILE 31 1HG2 ILE 31 -8.145 -15.916 3.754 282 2HG2 ILE 31 2HG2 ILE 31 -8.721 -15.734 2.099 283 3HG2 ILE 31 3HG2 ILE 31 -9.555 -14.911 3.419 284 1HD1 ILE 31 1HD1 ILE 31 -6.827 -11.401 4.990 285 2HD1 ILE 31 2HD1 ILE 31 -7.407 -11.273 3.330 286 3HD1 ILE 31 3HD1 ILE 31 -5.864 -12.060 3.665 287 H ASN 32 H ASN 32 -6.128 -16.960 2.809 288 HA ASN 32 HA ASN 32 -4.813 -16.904 5.302 289 1HB ASN 32 2HB ASN 32 -6.055 -18.901 4.560 290 2HB ASN 32 1HB ASN 32 -4.899 -19.157 3.261 291 1HD2 ASN 32 1HD2 ASN 32 -2.943 -20.179 3.725 292 2HD2 ASN 32 2HD2 ASN 32 -2.559 -20.792 5.287 293 H GLY 33 H GLY 33 -3.624 -17.138 2.036 294 1HA GLY 33 2HA GLY 33 -0.890 -17.521 2.613 295 2HA GLY 33 1HA GLY 33 -1.531 -16.802 1.135 296 H ILE 34 H ILE 34 -2.893 -14.592 2.376 297 HA ILE 34 HA ILE 34 -0.746 -12.791 2.669 298 HB ILE 34 HB ILE 34 -3.724 -12.410 3.128 299 1HG1 ILE 34 2HG1 ILE 34 -3.181 -12.948 0.802 300 2HG1 ILE 34 1HG1 ILE 34 -3.703 -11.276 0.942 301 1HG2 ILE 34 1HG2 ILE 34 -2.496 -10.733 4.389 302 2HG2 ILE 34 2HG2 ILE 34 -3.310 -9.992 3.011 303 3HG2 ILE 34 3HG2 ILE 34 -1.574 -10.300 2.949 304 1HD1 ILE 34 1HD1 ILE 34 -1.369 -10.542 0.816 305 2HD1 ILE 34 2HD1 ILE 34 -1.832 -11.494 -0.594 306 3HD1 ILE 34 3HD1 ILE 34 -0.853 -12.223 0.678 307 H GLU 35 H GLU 35 -3.070 -14.226 4.982 308 HA GLU 35 HA GLU 35 -2.423 -12.947 7.314 309 1HB GLU 35 2HB GLU 35 -2.815 -15.912 6.993 310 2HB GLU 35 1HB GLU 35 -2.857 -15.052 8.514 311 1HG GLU 35 2HG GLU 35 -4.832 -13.838 7.729 312 2HG GLU 35 1HG GLU 35 -4.780 -14.778 6.231 313 H LYS 36 H LYS 36 -0.715 -15.509 5.792 314 HA LYS 36 HA LYS 36 1.310 -15.484 7.926 315 1HB LYS 36 2HB LYS 36 1.103 -17.428 5.621 316 2HB LYS 36 1HB LYS 36 2.126 -17.585 7.039 317 1HG LYS 36 2HG LYS 36 -0.886 -17.733 6.946 318 2HG LYS 36 1HG LYS 36 0.239 -19.044 7.295 319 1HD LYS 36 2HD LYS 36 -0.156 -16.571 8.990 320 2HD LYS 36 1HD LYS 36 -0.853 -18.152 9.328 321 1HE LYS 36 2HE LYS 36 1.352 -19.096 9.633 322 2HE LYS 36 1HE LYS 36 2.100 -17.574 9.144 323 1HZ LYS 36 1HZ LYS 36 1.165 -16.514 11.058 324 2HZ LYS 36 2HZ LYS 36 2.068 -17.866 11.553 325 3HZ LYS 36 3HZ LYS 36 0.384 -17.936 11.537 326 H ASN 37 H ASN 37 0.857 -13.618 5.479 327 HA ASN 37 HA ASN 37 1.924 -12.642 3.755 328 1HB ASN 37 2HB ASN 37 4.004 -11.444 4.389 329 2HB ASN 37 1HB ASN 37 2.798 -11.355 5.653 330 1HD2 ASN 37 1HD2 ASN 37 5.943 -12.469 4.755 331 2HD2 ASN 37 2HD2 ASN 37 6.428 -13.023 6.303 332 H LYS 38 H LYS 38 1.939 -15.258 3.372 333 HA LYS 38 HA LYS 38 4.617 -16.179 2.628 334 1HB LYS 38 2HB LYS 38 3.123 -17.616 3.987 335 2HB LYS 38 1HB LYS 38 1.918 -17.547 2.717 336 1HG LYS 38 2HG LYS 38 3.499 -18.716 1.214 337 2HG LYS 38 1HG LYS 38 4.629 -18.849 2.561 338 1HD LYS 38 2HD LYS 38 3.370 -20.912 2.348 339 2HD LYS 38 1HD LYS 38 2.915 -20.087 3.839 340 1HE LYS 38 2HE LYS 38 0.931 -19.163 2.680 341 2HE LYS 38 1HE LYS 38 1.374 -20.080 1.242 342 1HZ LYS 38 1HZ LYS 38 0.699 -21.197 3.896 343 2HZ LYS 38 2HZ LYS 38 1.142 -22.124 2.572 344 3HZ LYS 38 3HZ LYS 38 -0.310 -21.227 2.540 345 H TYR 39 H TYR 39 1.674 -14.949 1.470 346 HA TYR 39 HA TYR 39 1.889 -15.888 -1.252 347 1HB TYR 39 2HB TYR 39 -0.203 -15.553 0.185 348 2HB TYR 39 1HB TYR 39 0.033 -13.837 -0.067 349 HD1 TYR 39 1HD TYR 39 -0.868 -17.014 -1.592 350 HD2 TYR 39 2HD TYR 39 -0.516 -12.827 -2.202 351 HE1 TYR 39 1HE TYR 39 -2.213 -17.213 -3.622 352 HE2 TYR 39 2HE TYR 39 -1.861 -13.013 -4.249 353 HH TYR 39 HH TYR 39 -3.653 -15.777 -4.970 354 H ASN 40 H ASN 40 3.094 -13.346 0.637 355 HA ASN 40 HA ASN 40 3.985 -11.333 0.402 356 1HB ASN 40 2HB ASN 40 5.396 -12.333 -1.421 357 2HB ASN 40 1HB ASN 40 4.163 -11.881 -2.592 358 1HD2 ASN 40 1HD2 ASN 40 4.005 -9.699 -3.244 359 2HD2 ASN 40 2HD2 ASN 40 5.177 -8.522 -2.798 360 HA PRO 41 HA PRO 41 0.127 -9.299 -0.063 361 1HB PRO 41 2HB PRO 41 1.591 -6.957 0.975 362 2HB PRO 41 1HB PRO 41 0.184 -7.791 1.641 363 1HG PRO 41 2HG PRO 41 2.594 -8.021 2.779 364 2HG PRO 41 1HG PRO 41 1.465 -9.387 2.716 365 1HD PRO 41 2HD PRO 41 3.855 -8.824 1.006 366 2HD PRO 41 1HD PRO 41 3.317 -10.359 1.721 367 H SER 42 H SER 42 -0.256 -8.991 -2.204 368 HA SER 42 HA SER 42 1.133 -7.140 -3.851 369 1HB SER 42 2HB SER 42 -1.702 -8.162 -4.135 370 2HB SER 42 1HB SER 42 -0.620 -7.619 -5.421 371 HG SER 42 HG SER 42 0.782 -9.417 -4.580 372 H LEU 43 H LEU 43 0.250 -5.003 -4.488 373 HA LEU 43 HA LEU 43 -0.627 -3.681 -2.165 374 1HB LEU 43 2HB LEU 43 0.904 -2.616 -3.784 375 2HB LEU 43 1HB LEU 43 -0.386 -2.546 -4.958 376 HG LEU 43 HG LEU 43 0.236 -0.383 -3.692 377 1HD1 LEU 43 1HD1 LEU 43 -2.651 -1.238 -3.738 378 2HD1 LEU 43 2HD1 LEU 43 -1.755 -0.517 -5.075 379 3HD1 LEU 43 3HD1 LEU 43 -2.070 0.423 -3.615 380 1HD2 LEU 43 1HD2 LEU 43 -1.389 -1.730 -1.512 381 2HD2 LEU 43 2HD2 LEU 43 -0.883 -0.048 -1.503 382 3HD2 LEU 43 3HD2 LEU 43 0.313 -1.326 -1.410 383 H GLN 44 H GLN 44 -2.403 -4.398 -5.244 384 HA GLN 44 HA GLN 44 -4.704 -3.105 -4.561 385 1HB GLN 44 2HB GLN 44 -4.261 -5.629 -6.160 386 2HB GLN 44 1HB GLN 44 -5.822 -4.849 -6.029 387 1HG GLN 44 2HG GLN 44 -4.767 -4.274 -8.126 388 2HG GLN 44 1HG GLN 44 -4.912 -2.847 -7.113 389 1HE2 GLN 44 1HE2 GLN 44 -3.346 -1.812 -8.287 390 2HE2 GLN 44 2HE2 GLN 44 -1.655 -2.166 -8.149 391 H LEU 45 H LEU 45 -3.736 -6.390 -3.719 392 HA LEU 45 HA LEU 45 -6.080 -7.033 -2.302 393 1HB LEU 45 2HB LEU 45 -3.295 -8.169 -2.103 394 2HB LEU 45 1HB LEU 45 -4.598 -8.745 -1.093 395 HG LEU 45 HG LEU 45 -4.325 -10.275 -2.879 396 1HD1 LEU 45 1HD1 LEU 45 -6.511 -10.245 -3.957 397 2HD1 LEU 45 2HD1 LEU 45 -6.756 -8.595 -3.384 398 3HD1 LEU 45 3HD1 LEU 45 -6.595 -9.916 -2.227 399 1HD2 LEU 45 1HD2 LEU 45 -4.639 -7.966 -4.801 400 2HD2 LEU 45 2HD2 LEU 45 -4.537 -9.668 -5.251 401 3HD2 LEU 45 3HD2 LEU 45 -3.158 -8.871 -4.496 402 H ALA 46 H ALA 46 -3.061 -5.642 -1.231 403 HA ALA 46 HA ALA 46 -3.649 -5.556 1.546 404 1HB ALA 46 1HB ALA 46 -1.373 -5.274 0.679 405 2HB ALA 46 2HB ALA 46 -1.836 -3.902 1.687 406 3HB ALA 46 3HB ALA 46 -1.843 -3.749 -0.070 407 H LEU 47 H LEU 47 -4.253 -3.353 -1.129 408 HA LEU 47 HA LEU 47 -5.114 -1.100 0.224 409 1HB LEU 47 2HB LEU 47 -4.348 -0.987 -1.995 410 2HB LEU 47 1HB LEU 47 -5.365 -2.293 -2.512 411 HG LEU 47 HG LEU 47 -6.581 0.361 -1.766 412 1HD1 LEU 47 1HD1 LEU 47 -6.289 1.021 -4.109 413 2HD1 LEU 47 2HD1 LEU 47 -5.364 -0.449 -4.418 414 3HD1 LEU 47 3HD1 LEU 47 -4.721 0.786 -3.336 415 1HD2 LEU 47 1HD2 LEU 47 -7.306 -1.783 -3.784 416 2HD2 LEU 47 2HD2 LEU 47 -8.244 -0.333 -3.420 417 3HD2 LEU 47 3HD2 LEU 47 -8.052 -1.588 -2.198 418 H LYS 48 H LYS 48 -6.902 -3.848 -1.148 419 HA LYS 48 HA LYS 48 -9.342 -2.780 -0.204 420 1HB LYS 48 2HB LYS 48 -10.361 -5.025 -0.771 421 2HB LYS 48 1HB LYS 48 -9.645 -4.124 -2.090 422 1HG LYS 48 2HG LYS 48 -7.681 -5.570 -2.004 423 2HG LYS 48 1HG LYS 48 -8.399 -6.468 -0.665 424 1HD LYS 48 2HD LYS 48 -8.750 -7.616 -2.795 425 2HD LYS 48 1HD LYS 48 -10.280 -7.097 -2.086 426 1HE LYS 48 2HE LYS 48 -10.164 -5.066 -3.567 427 2HE LYS 48 1HE LYS 48 -8.775 -5.807 -4.361 428 1HZ LYS 48 1HZ LYS 48 -11.492 -6.960 -4.177 429 2HZ LYS 48 2HZ LYS 48 -10.187 -7.683 -4.972 430 3HZ LYS 48 3HZ LYS 48 -10.844 -6.246 -5.555 431 H ILE 49 H ILE 49 -7.100 -5.022 1.148 432 HA ILE 49 HA ILE 49 -8.643 -5.876 3.339 433 HB ILE 49 HB ILE 49 -5.641 -5.452 3.136 434 1HG1 ILE 49 2HG1 ILE 49 -7.298 -7.979 3.066 435 2HG1 ILE 49 1HG1 ILE 49 -6.602 -7.174 1.666 436 1HG2 ILE 49 1HG2 ILE 49 -7.142 -6.844 5.352 437 2HG2 ILE 49 2HG2 ILE 49 -6.254 -5.327 5.483 438 3HG2 ILE 49 3HG2 ILE 49 -5.391 -6.829 5.148 439 1HD1 ILE 49 1HD1 ILE 49 -4.362 -7.617 2.523 440 2HD1 ILE 49 2HD1 ILE 49 -5.288 -9.105 2.329 441 3HD1 ILE 49 3HD1 ILE 49 -5.060 -8.411 3.934 442 H ALA 50 H ALA 50 -6.650 -3.044 2.859 443 HA ALA 50 HA ALA 50 -6.732 -1.872 5.396 444 1HB ALA 50 1HB ALA 50 -5.294 -1.091 3.568 445 2HB ALA 50 2HB ALA 50 -6.283 0.218 4.237 446 3HB ALA 50 3HB ALA 50 -6.743 -0.546 2.712 447 H TYR 51 H TYR 51 -8.863 -1.551 2.630 448 HA TYR 51 HA TYR 51 -10.599 0.304 3.841 449 1HB TYR 51 2HB TYR 51 -10.420 0.221 1.458 450 2HB TYR 51 1HB TYR 51 -10.893 -1.474 1.424 451 HD1 TYR 51 1HD TYR 51 -13.116 -2.104 1.565 452 HD2 TYR 51 2HD TYR 51 -12.082 1.968 1.931 453 HE1 TYR 51 1HE TYR 51 -15.507 -1.492 1.325 454 HE2 TYR 51 2HE TYR 51 -14.439 2.612 1.697 455 HH TYR 51 HH TYR 51 -16.470 1.668 0.725 456 H TYR 52 H TYR 52 -10.949 -3.208 3.243 457 HA TYR 52 HA TYR 52 -13.523 -3.308 4.420 458 1HB TYR 52 2HB TYR 52 -11.679 -5.505 3.525 459 2HB TYR 52 1HB TYR 52 -13.249 -5.832 4.267 460 HD1 TYR 52 1HD TYR 52 -15.308 -4.750 3.221 461 HD2 TYR 52 2HD TYR 52 -11.575 -4.977 1.208 462 HE1 TYR 52 1HE TYR 52 -16.442 -4.316 1.091 463 HE2 TYR 52 2HE TYR 52 -12.686 -4.552 -0.928 464 HH TYR 52 HH TYR 52 -14.913 -4.665 -1.959 465 H LEU 53 H LEU 53 -10.486 -3.637 5.812 466 HA LEU 53 HA LEU 53 -11.735 -4.448 8.364 467 1HB LEU 53 2HB LEU 53 -8.815 -4.083 7.673 468 2HB LEU 53 1HB LEU 53 -9.394 -4.503 9.272 469 1HD1 LEU 53 1HD1 LEU 53 -8.132 -7.694 7.847 470 2HD1 LEU 53 2HD1 LEU 53 -7.900 -6.524 9.147 471 3HD1 LEU 53 3HD1 LEU 53 -7.431 -6.114 7.498 472 1HD2 LEU 53 1HD2 LEU 53 -11.552 -6.487 8.435 473 2HD2 LEU 53 2HD2 LEU 53 -10.357 -6.758 9.704 474 3HD2 LEU 53 3HD2 LEU 53 -10.512 -7.911 8.376 475 H ASN 54 H ASN 54 -11.091 -1.732 6.687 476 HA ASN 54 HA ASN 54 -10.630 0.426 6.986 477 1HB ASN 54 2HB ASN 54 -13.006 0.310 7.805 478 2HB ASN 54 1HB ASN 54 -12.390 0.179 9.450 479 1HD2 ASN 54 1HD2 ASN 54 -12.880 2.309 6.727 480 2HD2 ASN 54 2HD2 ASN 54 -12.512 3.769 7.527 481 H THR 55 H THR 55 -8.463 -0.086 7.353 482 HA THR 55 HA THR 55 -7.492 1.019 9.846 483 HB THR 55 HB THR 55 -6.585 -1.723 8.858 484 HG1 THR 55 1HG THR 55 -8.731 -1.044 10.272 485 1HG2 THR 55 1HG2 THR 55 -5.471 -1.855 11.034 486 2HG2 THR 55 2HG2 THR 55 -6.068 -0.246 11.439 487 3HG2 THR 55 3HG2 THR 55 -4.910 -0.452 10.124 488 HA PRO 56 HA PRO 56 -4.686 2.718 6.731 489 1HB PRO 56 2HB PRO 56 -2.523 3.142 8.389 490 2HB PRO 56 1HB PRO 56 -3.879 4.259 8.207 491 1HG PRO 56 2HG PRO 56 -3.416 2.202 10.329 492 2HG PRO 56 1HG PRO 56 -4.019 3.863 10.491 493 1HD PRO 56 2HD PRO 56 -5.693 1.795 10.570 494 2HD PRO 56 1HD PRO 56 -6.142 3.296 9.728 495 H LEU 57 H LEU 57 -3.136 1.880 5.468 496 HA LEU 57 HA LEU 57 -2.367 -0.772 5.546 497 1HB LEU 57 2HB LEU 57 -1.004 1.556 4.213 498 2HB LEU 57 1HB LEU 57 -0.514 -0.106 3.973 499 1HD1 LEU 57 1HD2 LEU 57 -1.444 1.932 1.879 500 2HD1 LEU 57 2HD2 LEU 57 -2.456 0.816 0.956 501 3HD1 LEU 57 3HD2 LEU 57 -0.865 0.304 1.525 502 1HD2 LEU 57 1HD1 LEU 57 -3.500 -1.120 2.089 503 2HD2 LEU 57 2HD1 LEU 57 -3.265 -1.364 3.821 504 3HD2 LEU 57 3HD1 LEU 57 -1.936 -1.657 2.702 505 H GLU 58 H GLU 58 -0.687 2.057 6.795 506 HA GLU 58 HA GLU 58 1.720 0.929 7.510 507 1HB GLU 58 2HB GLU 58 0.286 3.075 9.079 508 2HB GLU 58 1HB GLU 58 2.014 2.800 8.988 509 1HG GLU 58 2HG GLU 58 1.841 4.569 7.545 510 2HG GLU 58 1HG GLU 58 1.592 3.221 6.433 511 H ASP 59 H ASP 59 -1.360 0.871 9.259 512 HA ASP 59 HA ASP 59 -0.207 -0.161 11.661 513 1HB ASP 59 2HB ASP 59 -2.302 1.194 11.637 514 2HB ASP 59 1HB ASP 59 -3.108 -0.116 10.785 515 H ILE 60 H ILE 60 -1.786 -1.416 8.863 516 HA ILE 60 HA ILE 60 -2.124 -4.133 9.840 517 HB ILE 60 HB ILE 60 -2.312 -3.219 6.949 518 1HG1 ILE 60 2HG1 ILE 60 -4.514 -3.488 9.016 519 2HG1 ILE 60 1HG1 ILE 60 -3.870 -1.970 8.407 520 1HG2 ILE 60 1HG2 ILE 60 -3.413 -5.662 8.359 521 2HG2 ILE 60 2HG2 ILE 60 -2.062 -5.642 7.228 522 3HG2 ILE 60 3HG2 ILE 60 -3.684 -5.245 6.666 523 1HD1 ILE 60 1HD1 ILE 60 -4.677 -2.521 6.171 524 2HD1 ILE 60 2HD1 ILE 60 -5.987 -2.519 7.351 525 3HD1 ILE 60 3HD1 ILE 60 -5.320 -4.047 6.777 526 H PHE 61 H PHE 61 -0.062 -2.689 7.391 527 HA PHE 61 HA PHE 61 1.690 -5.025 7.726 528 1HB PHE 61 2HB PHE 61 1.436 -3.213 5.251 529 2HB PHE 61 1HB PHE 61 2.575 -4.540 5.454 530 HD1 PHE 61 1HD PHE 61 1.735 -6.856 5.554 531 HD2 PHE 61 2HD PHE 61 -0.809 -3.556 4.687 532 HE1 PHE 61 1HE PHE 61 0.042 -8.396 4.641 533 HE2 PHE 61 2HE PHE 61 -2.500 -5.091 3.777 534 HZ PHE 61 HZ PHE 61 -2.077 -7.515 3.754 535 H GLN 62 H GLN 62 3.794 -4.729 8.242 536 HA GLN 62 HA GLN 62 4.601 -1.974 8.692 537 1HB GLN 62 2HB GLN 62 4.339 -3.411 10.745 538 2HB GLN 62 1HB GLN 62 5.628 -4.436 10.115 539 1HG GLN 62 2HG GLN 62 7.073 -2.409 10.035 540 2HG GLN 62 1HG GLN 62 5.803 -1.549 10.897 541 1HE2 GLN 62 1HE2 GLN 62 8.460 -2.013 11.658 542 2HE2 GLN 62 2HE2 GLN 62 8.466 -2.925 13.139 543 H TRP 63 H TRP 63 6.407 -1.373 7.813 544 HA TRP 63 HA TRP 63 7.852 -3.324 6.205 545 1HB TRP 63 2HB TRP 63 8.104 -1.163 4.688 546 2HB TRP 63 1HB TRP 63 6.771 -2.296 4.533 547 HD1 TRP 63 HD TRP 63 7.442 1.072 6.408 548 HE1 TRP 63 1HE TRP 63 5.217 2.391 6.436 549 HE3 TRP 63 3HE TRP 63 4.420 -2.373 4.145 550 HZ2 TRP 63 2HZ TRP 63 2.560 2.005 5.612 551 HZ3 TRP 63 3HZ TRP 63 2.055 -1.814 3.797 552 HH2 TRP 63 HH TRP 63 1.148 0.324 4.516 553 H GLN 64 H GLN 64 9.977 -3.334 6.392 554 HA GLN 64 HA GLN 64 11.260 -1.004 7.591 555 1HB GLN 64 2HB GLN 64 11.849 -3.948 7.898 556 2HB GLN 64 1HB GLN 64 13.020 -2.707 8.306 557 1HG GLN 64 2HG GLN 64 10.279 -2.827 9.509 558 2HG GLN 64 1HG GLN 64 11.664 -3.664 10.203 559 1HE2 GLN 64 1HE2 GLN 64 11.643 -2.474 12.052 560 2HE2 GLN 64 2HE2 GLN 64 12.085 -0.818 12.160 561 HA PRO 65 HA PRO 65 13.120 -1.330 3.441 562 1HB PRO 65 2HB PRO 65 13.555 1.550 3.801 563 2HB PRO 65 1HB PRO 65 12.638 0.722 2.542 564 1HG PRO 65 2HG PRO 65 11.438 2.217 4.442 565 2HG PRO 65 1HG PRO 65 10.675 0.777 3.741 566 1HD PRO 65 2HD PRO 65 12.113 1.081 6.353 567 2HD PRO 65 1HD PRO 65 10.596 0.221 5.995 568 H GLU 66 H GLU 66 13.970 0.121 6.305 569 HA GLU 66 HA GLU 66 16.848 0.004 5.726 570 1HB GLU 66 2HB GLU 66 15.410 1.365 8.005 571 2HB GLU 66 1HB GLU 66 17.161 1.282 7.862 572 1HG GLU 66 2HG GLU 66 15.274 2.610 5.930 573 2HG GLU 66 1HG GLU 66 16.344 3.420 7.076 574 1H MET 67 1HT MET 67 -13.077 1.678 -8.713 575 2H MET 67 2HT MET 67 -12.334 1.866 -7.194 576 3H MET 67 3HT MET 67 -11.460 1.263 -8.487 577 HA MET 67 HA MET 67 -11.420 3.244 -9.631 578 1HB MET 67 2HB MET 67 -13.131 4.308 -7.372 579 2HB MET 67 1HB MET 67 -12.338 5.318 -8.571 580 1HG MET 67 2HG MET 67 -14.444 3.245 -9.114 581 2HG MET 67 1HG MET 67 -14.681 4.992 -9.087 582 1HE MET 67 1HE MET 67 -15.805 4.864 -11.488 583 2HE MET 67 2HE MET 67 -15.555 3.116 -11.521 584 3HE MET 67 3HE MET 67 -15.039 4.108 -12.885 585 H ILE 68 H ILE 68 -9.399 3.803 -9.414 586 HA ILE 68 HA ILE 68 -8.356 4.118 -6.691 587 HB ILE 68 HB ILE 68 -6.841 3.372 -9.223 588 1HG1 ILE 68 2HG1 ILE 68 -8.178 1.490 -8.441 589 2HG1 ILE 68 1HG1 ILE 68 -6.481 1.180 -8.100 590 1HG2 ILE 68 1HG2 ILE 68 -5.811 3.617 -6.395 591 2HG2 ILE 68 2HG2 ILE 68 -5.442 4.702 -7.735 592 3HG2 ILE 68 3HG2 ILE 68 -4.888 3.029 -7.777 593 1HD1 ILE 68 1HD1 ILE 68 -7.896 0.478 -6.263 594 2HD1 ILE 68 2HD1 ILE 68 -8.528 2.119 -6.105 595 3HD1 ILE 68 3HD1 ILE 68 -6.829 1.792 -5.770 596 H ILE 69 H ILE 69 -7.478 6.041 -6.154 597 HA ILE 69 HA ILE 69 -7.389 8.077 -8.244 598 HB ILE 69 HB ILE 69 -8.093 8.396 -5.289 599 1HG1 ILE 69 2HG1 ILE 69 -10.229 9.469 -6.226 600 2HG1 ILE 69 1HG1 ILE 69 -9.782 8.781 -7.776 601 1HG2 ILE 69 1HG2 ILE 69 -6.725 10.240 -5.980 602 2HG2 ILE 69 2HG2 ILE 69 -8.383 10.778 -5.723 603 3HG2 ILE 69 3HG2 ILE 69 -7.774 10.544 -7.362 604 1HD1 ILE 69 1HD1 ILE 69 -11.450 7.428 -6.651 605 2HD1 ILE 69 2HD1 ILE 69 -10.388 7.248 -5.255 606 3HD1 ILE 69 3HD1 ILE 69 -9.935 6.538 -6.804 607 H ASN 70 H ASN 70 -5.235 8.906 -8.564 608 HA ASN 70 HA ASN 70 -3.315 8.071 -6.610 609 1HB ASN 70 2HB ASN 70 -2.852 7.334 -8.850 610 2HB ASN 70 1HB ASN 70 -3.227 8.915 -9.515 611 1HD2 ASN 70 1HD2 ASN 70 -1.249 9.080 -10.517 612 2HD2 ASN 70 2HD2 ASN 70 0.223 9.362 -9.673 613 H ASN 71 H ASN 71 -2.502 9.584 -5.289 614 HA ASN 71 HA ASN 71 -2.823 12.398 -6.049 615 1HB ASN 71 2HB ASN 71 -2.981 11.181 -3.278 616 2HB ASN 71 1HB ASN 71 -3.051 12.898 -3.647 617 1HD2 ASN 71 1HD2 ASN 71 -4.916 11.025 -2.361 618 2HD2 ASN 71 2HD2 ASN 71 -6.419 11.237 -3.201 619 H LEU 72 H LEU 72 -0.630 10.179 -6.162 620 HA LEU 72 HA LEU 72 1.416 10.652 -4.355 621 1HB LEU 72 2HB LEU 72 1.209 8.868 -6.194 622 2HB LEU 72 1HB LEU 72 1.801 10.068 -7.306 623 HG LEU 72 HG LEU 72 3.502 8.412 -6.654 624 1HD1 LEU 72 1HD1 LEU 72 4.176 11.183 -5.711 625 2HD1 LEU 72 2HD1 LEU 72 4.306 10.569 -7.359 626 3HD1 LEU 72 3HD1 LEU 72 5.334 9.909 -6.088 627 1HD2 LEU 72 1HD2 LEU 72 4.456 8.435 -4.400 628 2HD2 LEU 72 2HD2 LEU 72 2.769 7.927 -4.416 629 3HD2 LEU 72 3HD2 LEU 72 3.194 9.556 -3.890 630 H LYS 73 H LYS 73 0.720 12.260 -7.411 631 HA LYS 73 HA LYS 73 2.895 14.032 -7.336 632 1HB LYS 73 2HB LYS 73 1.686 15.333 -9.067 633 2HB LYS 73 1HB LYS 73 1.805 13.624 -9.433 634 1HG LYS 73 2HG LYS 73 -0.514 13.311 -8.743 635 2HG LYS 73 1HG LYS 73 -0.625 15.028 -8.341 636 1HD LYS 73 2HD LYS 73 -0.126 15.594 -10.677 637 2HD LYS 73 1HD LYS 73 -0.054 13.877 -11.071 638 1HE LYS 73 2HE LYS 73 -2.393 13.629 -10.415 639 2HE LYS 73 1HE LYS 73 -2.456 15.340 -9.995 640 1HZ LYS 73 1HZ LYS 73 -1.926 14.239 -12.699 641 2HZ LYS 73 2HZ LYS 73 -2.002 15.889 -12.289 642 3HZ LYS 73 3HZ LYS 73 -3.385 14.933 -12.183 643 H LEU 74 H LEU 74 -0.431 14.442 -6.108 644 HA LEU 74 HA LEU 74 -0.225 17.088 -5.342 645 1HB LEU 74 2HB LEU 74 -2.322 15.781 -5.509 646 2HB LEU 74 1HB LEU 74 -1.841 14.819 -4.140 647 HG LEU 74 HG LEU 74 -3.647 16.530 -3.732 648 1HD1 LEU 74 1HD1 LEU 74 -2.818 17.265 -1.565 649 2HD1 LEU 74 2HD1 LEU 74 -1.189 16.766 -2.022 650 3HD1 LEU 74 3HD1 LEU 74 -2.468 15.563 -1.868 651 1HD2 LEU 74 1HD2 LEU 74 -2.771 18.355 -5.057 652 2HD2 LEU 74 2HD2 LEU 74 -1.357 18.468 -4.011 653 3HD2 LEU 74 3HD2 LEU 74 -2.956 18.862 -3.379 654 H ILE 75 H ILE 75 0.623 14.157 -3.571 655 HA ILE 75 HA ILE 75 1.443 15.508 -1.237 656 HB ILE 75 HB ILE 75 2.079 12.712 -2.224 657 1HG1 ILE 75 2HG1 ILE 75 0.889 12.040 -0.136 658 2HG1 ILE 75 1HG1 ILE 75 0.611 13.729 0.225 659 1HG2 ILE 75 1HG2 ILE 75 4.100 13.447 -1.106 660 2HG2 ILE 75 2HG2 ILE 75 3.262 12.246 -0.119 661 3HG2 ILE 75 3HG2 ILE 75 3.167 13.959 0.294 662 1HD1 ILE 75 1HD1 ILE 75 -1.371 12.667 -0.657 663 2HD1 ILE 75 2HD1 ILE 75 -0.497 12.199 -2.115 664 3HD1 ILE 75 3HD1 ILE 75 -0.792 13.904 -1.770 665 H ARG 76 H ARG 76 3.158 14.700 -4.151 666 HA ARG 76 HA ARG 76 5.771 15.499 -3.406 667 1HB ARG 76 2HB ARG 76 4.458 15.862 -6.105 668 2HB ARG 76 1HB ARG 76 6.180 15.942 -5.784 669 1HG ARG 76 2HG ARG 76 6.270 13.622 -5.316 670 2HG ARG 76 1HG ARG 76 4.506 13.498 -5.334 671 1HD ARG 76 2HD ARG 76 5.164 12.678 -7.398 672 2HD ARG 76 1HD ARG 76 4.645 14.327 -7.746 673 HE ARG 76 HE ARG 76 7.255 13.141 -7.985 674 1HH1 ARG 76 1HH1 ARG 76 5.708 16.375 -7.843 675 2HH1 ARG 76 2HH1 ARG 76 6.893 17.050 -8.868 676 1HH2 ARG 76 1HH2 ARG 76 8.558 14.022 -9.482 677 2HH2 ARG 76 2HH2 ARG 76 8.543 15.687 -9.914 678 H GLU 77 H GLU 77 2.888 17.414 -4.502 679 HA GLU 77 HA GLU 77 4.208 19.846 -4.603 680 1HB GLU 77 2HB GLU 77 1.292 19.158 -4.280 681 2HB GLU 77 1HB GLU 77 1.921 20.754 -4.658 682 1HG GLU 77 2HG GLU 77 2.092 18.282 -6.360 683 2HG GLU 77 1HG GLU 77 1.129 19.728 -6.666 684 H LYS 78 H LYS 78 2.389 18.217 -2.043 685 HA LYS 78 HA LYS 78 2.352 20.201 -0.128 686 1HB LYS 78 2HB LYS 78 2.818 17.253 0.368 687 2HB LYS 78 1HB LYS 78 2.403 18.410 1.621 688 1HG LYS 78 2HG LYS 78 0.685 17.637 -0.734 689 2HG LYS 78 1HG LYS 78 0.459 17.130 0.941 690 1HD LYS 78 2HD LYS 78 0.180 19.522 1.562 691 2HD LYS 78 1HD LYS 78 0.268 19.938 -0.149 692 1HE LYS 78 2HE LYS 78 -2.043 19.853 0.517 693 2HE LYS 78 1HE LYS 78 -1.707 18.501 -0.556 694 1HZ LYS 78 1HZ LYS 78 -3.061 17.830 1.340 695 2HZ LYS 78 2HZ LYS 78 -1.864 18.355 2.413 696 3HZ LYS 78 3HZ LYS 78 -1.578 17.038 1.401 697 H LYS 79 H LYS 79 5.011 18.091 -0.888 698 HA LYS 79 HA LYS 79 6.780 19.745 0.794 699 1HB LYS 79 2HB LYS 79 7.379 17.080 -0.568 700 2HB LYS 79 1HB LYS 79 8.444 17.923 0.547 701 1HG LYS 79 2HG LYS 79 5.776 16.675 1.209 702 2HG LYS 79 1HG LYS 79 7.368 16.075 1.682 703 1HD LYS 79 2HD LYS 79 7.738 18.042 3.050 704 2HD LYS 79 1HD LYS 79 6.221 18.748 2.497 705 1HE LYS 79 2HE LYS 79 5.902 17.832 4.700 706 2HE LYS 79 1HE LYS 79 5.007 16.860 3.538 707 1HZ LYS 79 1HZ LYS 79 6.782 15.190 3.637 708 2HZ LYS 79 2HZ LYS 79 6.177 15.529 5.176 709 3HZ LYS 79 3HZ LYS 79 7.646 16.176 4.711 710 H LYS 80 H LYS 80 9.353 19.708 -1.021 711 HA LYS 80 HA LYS 80 8.094 19.925 -3.487 712 1HB LYS 80 2HB LYS 80 9.602 21.875 -3.968 713 2HB LYS 80 1HB LYS 80 8.335 22.230 -2.813 714 1HG LYS 80 2HG LYS 80 9.923 22.146 -0.993 715 2HG LYS 80 1HG LYS 80 11.203 21.640 -2.102 716 1HD LYS 80 2HD LYS 80 10.907 23.762 -3.336 717 2HD LYS 80 1HD LYS 80 9.716 24.261 -2.133 718 1HE LYS 80 2HE LYS 80 12.596 23.582 -1.551 719 2HE LYS 80 1HE LYS 80 11.968 25.215 -1.746 720 1HZ LYS 80 1HZ LYS 80 10.542 24.858 0.173 721 2HZ LYS 80 2HZ LYS 80 12.172 24.610 0.569 722 3HZ LYS 80 3HZ LYS 80 11.150 23.294 0.392 723 H ILE 81 H ILE 81 8.761 17.839 -3.674 724 HA ILE 81 HA ILE 81 11.621 17.598 -4.184 725 HB ILE 81 HB ILE 81 9.776 15.399 -3.143 726 1HG1 ILE 81 2HG1 ILE 81 12.012 16.885 -1.723 727 2HG1 ILE 81 1HG1 ILE 81 10.295 17.066 -1.396 728 1HG2 ILE 81 1HG2 ILE 81 11.538 14.563 -4.615 729 2HG2 ILE 81 2HG2 ILE 81 11.832 14.073 -2.946 730 3HG2 ILE 81 3HG2 ILE 81 12.755 15.400 -3.650 731 1HD1 ILE 81 1HD1 ILE 81 11.379 15.690 0.287 732 2HD1 ILE 81 2HD1 ILE 81 11.933 14.575 -0.964 733 3HD1 ILE 81 3HD1 ILE 81 10.208 14.739 -0.628 734 H SER 82 H SER 82 12.065 16.916 -6.186 735 HA SER 82 HA SER 82 9.738 16.392 -7.865 736 1HB SER 82 2HB SER 82 12.385 17.644 -8.607 737 2HB SER 82 1HB SER 82 11.058 17.329 -9.729 738 HG SER 82 HG SER 82 9.750 18.624 -8.366 739 H GLN 83 H GLN 83 10.961 15.415 -10.145 740 HA GLN 83 HA GLN 83 10.931 12.719 -9.357 741 1HB GLN 83 2HB GLN 83 11.296 12.215 -11.778 742 2HB GLN 83 1HB GLN 83 9.896 13.209 -11.413 743 1HG GLN 83 2HG GLN 83 11.104 15.190 -12.089 744 2HG GLN 83 1HG GLN 83 12.544 14.224 -12.393 745 1HE2 GLN 83 1HE2 GLN 83 12.584 14.918 -14.482 746 2HE2 GLN 83 2HE2 GLN 83 11.512 14.338 -15.696 747 H SER 84 H SER 84 13.783 14.802 -10.406 748 HA SER 84 HA SER 84 15.486 12.627 -10.614 749 1HB SER 84 2HB SER 84 16.118 15.465 -9.785 750 2HB SER 84 1HB SER 84 17.241 14.290 -10.466 751 HG SER 84 HG SER 84 15.454 14.313 -12.234 752 H GLU 85 H GLU 85 14.718 14.811 -7.915 753 HA GLU 85 HA GLU 85 16.469 13.710 -6.057 754 1HB GLU 85 2HB GLU 85 13.784 14.988 -5.556 755 2HB GLU 85 1HB GLU 85 15.017 14.700 -4.339 756 1HG GLU 85 2HG GLU 85 15.223 16.527 -6.713 757 2HG GLU 85 1HG GLU 85 15.045 16.995 -5.022 758 H LEU 86 H LEU 86 13.039 12.986 -6.636 759 HA LEU 86 HA LEU 86 12.820 10.971 -4.730 760 1HB LEU 86 2HB LEU 86 11.309 11.491 -7.272 761 2HB LEU 86 1HB LEU 86 10.869 10.171 -6.219 762 HG LEU 86 HG LEU 86 10.870 13.085 -5.429 763 1HD1 LEU 86 1HD1 LEU 86 9.137 12.559 -7.069 764 2HD1 LEU 86 2HD1 LEU 86 8.440 12.861 -5.477 765 3HD1 LEU 86 3HD1 LEU 86 8.599 11.208 -6.072 766 1HD2 LEU 86 1HD2 LEU 86 11.312 11.579 -3.553 767 2HD2 LEU 86 2HD2 LEU 86 9.894 10.621 -3.981 768 3HD2 LEU 86 3HD2 LEU 86 9.701 12.287 -3.430 769 H ALA 87 H ALA 87 13.818 10.775 -8.125 770 HA ALA 87 HA ALA 87 13.977 7.995 -8.327 771 1HB ALA 87 1HB ALA 87 15.725 10.043 -9.678 772 2HB ALA 87 2HB ALA 87 14.155 9.489 -10.256 773 3HB ALA 87 3HB ALA 87 15.512 8.366 -10.177 774 H ALA 88 H ALA 88 16.533 10.360 -7.388 775 HA ALA 88 HA ALA 88 18.497 8.457 -6.895 776 1HB ALA 88 1HB ALA 88 18.938 10.840 -7.212 777 2HB ALA 88 2HB ALA 88 19.640 10.236 -5.711 778 3HB ALA 88 3HB ALA 88 18.154 11.187 -5.672 779 H LEU 89 H LEU 89 16.107 9.941 -4.795 780 HA LEU 89 HA LEU 89 17.028 8.836 -2.405 781 1HB LEU 89 2HB LEU 89 14.247 9.687 -3.187 782 2HB LEU 89 1HB LEU 89 14.706 9.236 -1.555 783 HG LEU 89 HG LEU 89 15.826 11.564 -3.116 784 1HD1 LEU 89 1HD1 LEU 89 14.595 12.949 -1.520 785 2HD1 LEU 89 2HD1 LEU 89 13.891 11.492 -0.816 786 3HD1 LEU 89 3HD1 LEU 89 13.520 11.934 -2.482 787 1HD2 LEU 89 1HD2 LEU 89 16.880 12.201 -0.991 788 2HD2 LEU 89 2HD2 LEU 89 17.460 10.632 -1.557 789 3HD2 LEU 89 3HD2 LEU 89 16.276 10.715 -0.254 790 H LEU 90 H LEU 90 14.881 7.507 -4.837 791 HA LEU 90 HA LEU 90 14.366 5.173 -3.168 792 1HB LEU 90 2HB LEU 90 13.555 5.568 -6.021 793 2HB LEU 90 1HB LEU 90 12.879 4.455 -4.858 794 HG LEU 90 HG LEU 90 12.550 7.437 -4.927 795 1HD1 LEU 90 1HD1 LEU 90 11.292 6.224 -6.591 796 2HD1 LEU 90 2HD1 LEU 90 10.246 6.936 -5.371 797 3HD1 LEU 90 3HD1 LEU 90 10.588 5.202 -5.335 798 1HD2 LEU 90 1HD2 LEU 90 11.008 7.143 -3.046 799 2HD2 LEU 90 2HD2 LEU 90 12.660 6.699 -2.619 800 3HD2 LEU 90 3HD2 LEU 90 11.466 5.443 -2.944 801 H GLU 91 H GLU 91 16.922 6.104 -5.060 802 HA GLU 91 HA GLU 91 18.504 5.139 -6.338 803 1HB GLU 91 2HB GLU 91 17.633 2.728 -4.730 804 2HB GLU 91 1HB GLU 91 19.021 2.706 -5.808 805 1HG GLU 91 2HG GLU 91 18.691 4.532 -3.438 806 2HG GLU 91 1HG GLU 91 19.632 3.039 -3.454 807 H VAL 92 H VAL 92 16.008 5.422 -7.561 808 HA VAL 92 HA VAL 92 15.848 3.019 -9.242 809 HB VAL 92 HB VAL 92 13.510 3.478 -9.730 810 1HG1 VAL 92 1HG1 VAL 92 14.003 3.306 -6.776 811 2HG1 VAL 92 2HG1 VAL 92 13.932 1.969 -7.926 812 3HG1 VAL 92 3HG1 VAL 92 12.486 2.918 -7.588 813 1HG2 VAL 92 1HG2 VAL 92 13.760 5.787 -7.800 814 2HG2 VAL 92 2HG2 VAL 92 12.227 5.162 -8.406 815 3HG2 VAL 92 3HG2 VAL 92 13.397 5.865 -9.524 816 H SER 93 H SER 93 14.707 3.647 -11.368 817 HA SER 93 HA SER 93 16.402 5.569 -12.609 818 1HB SER 93 2HB SER 93 14.129 3.929 -13.725 819 2HB SER 93 1HB SER 93 15.462 4.666 -14.621 820 HG SER 93 HG SER 93 16.751 3.121 -14.041 821 H ARG 94 H ARG 94 15.710 7.480 -13.546 822 HA ARG 94 HA ARG 94 13.648 8.917 -12.316 823 1HB ARG 94 2HB ARG 94 15.151 9.480 -14.870 824 2HB ARG 94 1HB ARG 94 14.125 10.641 -14.040 825 1HG ARG 94 2HG ARG 94 15.566 10.660 -12.130 826 2HG ARG 94 1HG ARG 94 16.518 9.326 -12.778 827 1HD ARG 94 2HD ARG 94 16.257 12.061 -14.008 828 2HD ARG 94 1HD ARG 94 17.628 11.492 -13.056 829 HE ARG 94 HE ARG 94 17.291 9.664 -15.072 830 1HH1 ARG 94 1HH1 ARG 94 18.098 13.123 -14.821 831 2HH1 ARG 94 2HH1 ARG 94 18.910 13.199 -16.303 832 1HH2 ARG 94 1HH2 ARG 94 18.402 9.761 -17.151 833 2HH2 ARG 94 2HH2 ARG 94 19.112 11.218 -17.667 834 H GLN 95 H GLN 95 13.683 7.020 -15.188 835 HA GLN 95 HA GLN 95 11.159 7.903 -16.229 836 1HB GLN 95 2HB GLN 95 12.936 6.543 -17.466 837 2HB GLN 95 1HB GLN 95 12.320 5.145 -16.600 838 1HG GLN 95 2HG GLN 95 11.320 5.146 -18.743 839 2HG GLN 95 1HG GLN 95 10.073 5.626 -17.589 840 1HE2 GLN 95 1HE2 GLN 95 9.246 7.744 -17.677 841 2HE2 GLN 95 2HE2 GLN 95 9.627 8.821 -18.950 842 H THR 96 H THR 96 12.168 5.436 -13.951 843 HA THR 96 HA THR 96 9.705 4.106 -13.749 844 HB THR 96 HB THR 96 12.075 4.177 -11.865 845 HG1 THR 96 1HG THR 96 11.362 2.182 -13.765 846 1HG2 THR 96 1HG2 THR 96 11.212 2.033 -11.003 847 2HG2 THR 96 2HG2 THR 96 9.804 2.172 -12.058 848 3HG2 THR 96 3HG2 THR 96 10.037 3.323 -10.742 849 H ILE 97 H ILE 97 11.289 6.522 -11.529 850 HA ILE 97 HA ILE 97 9.135 6.667 -9.788 851 HB ILE 97 HB ILE 97 11.253 7.576 -9.096 852 1HG1 ILE 97 2HG1 ILE 97 10.630 9.824 -8.262 853 2HG1 ILE 97 1HG1 ILE 97 9.236 9.814 -9.334 854 1HG2 ILE 97 1HG2 ILE 97 12.128 8.303 -11.220 855 2HG2 ILE 97 2HG2 ILE 97 12.241 9.600 -10.030 856 3HG2 ILE 97 3HG2 ILE 97 10.977 9.639 -11.262 857 1HD1 ILE 97 1HD1 ILE 97 8.336 7.892 -8.135 858 2HD1 ILE 97 2HD1 ILE 97 8.613 9.260 -7.058 859 3HD1 ILE 97 3HD1 ILE 97 9.737 7.903 -7.065 860 H ASN 98 H ASN 98 9.805 8.687 -12.594 861 HA ASN 98 HA ASN 98 7.594 10.379 -12.448 862 1HB ASN 98 2HB ASN 98 9.341 10.841 -14.050 863 2HB ASN 98 1HB ASN 98 9.021 9.339 -14.907 864 1HD2 ASN 98 1HD2 ASN 98 7.331 9.257 -16.366 865 2HD2 ASN 98 2HD2 ASN 98 6.436 10.640 -16.851 866 H GLY 99 H GLY 99 7.876 7.186 -13.719 867 1HA GLY 99 2HA GLY 99 5.351 7.007 -14.973 868 2HA GLY 99 1HA GLY 99 6.332 5.646 -14.450 869 H ILE 100 H ILE 100 6.414 6.297 -11.626 870 HA ILE 100 HA ILE 100 3.906 5.238 -10.876 871 HB ILE 100 HB ILE 100 6.146 6.346 -9.144 872 1HG1 ILE 100 2HG1 ILE 100 6.879 4.433 -10.509 873 2HG1 ILE 100 1HG1 ILE 100 6.806 4.006 -8.804 874 1HG2 ILE 100 1HG2 ILE 100 3.793 4.613 -8.379 875 2HG2 ILE 100 2HG2 ILE 100 4.034 6.301 -7.931 876 3HG2 ILE 100 3HG2 ILE 100 5.126 5.060 -7.313 877 1HD1 ILE 100 1HD1 ILE 100 5.967 2.205 -10.207 878 2HD1 ILE 100 2HD1 ILE 100 4.759 3.288 -10.899 879 3HD1 ILE 100 3HD1 ILE 100 4.678 2.853 -9.192 880 H GLU 101 H GLU 101 5.475 8.433 -10.508 881 HA GLU 101 HA GLU 101 3.555 9.831 -9.127 882 1HB GLU 101 2HB GLU 101 4.994 10.875 -11.555 883 2HB GLU 101 1HB GLU 101 4.321 11.820 -10.247 884 1HG GLU 101 2HG GLU 101 6.001 10.974 -8.735 885 2HG GLU 101 1HG GLU 101 6.635 9.920 -10.007 886 H LYS 102 H LYS 102 3.654 9.059 -12.519 887 HA LYS 102 HA LYS 102 1.129 10.455 -13.011 888 1HB LYS 102 2HB LYS 102 2.820 8.969 -15.032 889 2HB LYS 102 1HB LYS 102 1.538 10.117 -15.369 890 1HG LYS 102 2HG LYS 102 4.265 10.697 -14.212 891 2HG LYS 102 1HG LYS 102 3.644 11.174 -15.787 892 1HD LYS 102 2HD LYS 102 1.977 12.614 -14.665 893 2HD LYS 102 1HD LYS 102 2.659 12.153 -13.104 894 1HE LYS 102 2HE LYS 102 4.082 13.632 -15.323 895 2HE LYS 102 1HE LYS 102 3.512 14.324 -13.808 896 1HZ LYS 102 1HZ LYS 102 5.875 13.910 -13.710 897 2HZ LYS 102 2HZ LYS 102 5.715 12.337 -14.144 898 3HZ LYS 102 3HZ LYS 102 5.160 12.854 -12.632 899 H ASN 103 H ASN 103 1.717 7.707 -11.627 900 HA ASN 103 HA ASN 103 1.006 5.591 -11.487 901 1HB ASN 103 2HB ASN 103 -1.433 5.320 -11.264 902 2HB ASN 103 1HB ASN 103 -0.880 6.790 -10.487 903 1HD2 ASN 103 1HD2 ASN 103 -2.827 5.425 -12.972 904 2HD2 ASN 103 2HD2 ASN 103 -3.558 6.897 -13.495 905 H LYS 104 H LYS 104 2.039 6.000 -14.000 906 HA LYS 104 HA LYS 104 0.232 4.529 -15.785 907 1HB LYS 104 2HB LYS 104 1.146 6.674 -16.642 908 2HB LYS 104 1HB LYS 104 2.772 6.046 -16.435 909 1HG LYS 104 2HG LYS 104 2.369 4.338 -18.086 910 2HG LYS 104 1HG LYS 104 0.690 4.848 -18.242 911 1HD LYS 104 2HD LYS 104 1.489 7.058 -19.026 912 2HD LYS 104 1HD LYS 104 3.143 6.435 -18.974 913 1HE LYS 104 2HE LYS 104 2.162 6.326 -21.239 914 2HE LYS 104 1HE LYS 104 2.590 4.734 -20.610 915 1HZ LYS 104 1HZ LYS 104 -0.142 5.885 -20.484 916 2HZ LYS 104 2HZ LYS 104 0.283 4.295 -20.124 917 3HZ LYS 104 3HZ LYS 104 0.343 4.842 -21.706 918 H TYR 105 H TYR 105 3.089 4.381 -13.960 919 HA TYR 105 HA TYR 105 4.300 2.177 -15.390 920 1HB TYR 105 2HB TYR 105 5.347 4.126 -13.940 921 2HB TYR 105 1HB TYR 105 5.065 3.003 -12.625 922 HD1 TYR 105 1HD TYR 105 7.003 3.735 -15.605 923 HD2 TYR 105 2HD TYR 105 6.409 0.939 -12.459 924 HE1 TYR 105 1HE TYR 105 9.172 2.723 -16.112 925 HE2 TYR 105 2HE TYR 105 8.584 -0.092 -12.966 926 HH TYR 105 HH TYR 105 10.093 -0.263 -14.913 927 H ASN 106 H ASN 106 1.675 2.390 -13.485 928 HA ASN 106 HA ASN 106 0.328 0.984 -12.363 929 1HB ASN 106 2HB ASN 106 0.947 -0.870 -13.816 930 2HB ASN 106 1HB ASN 106 2.428 -1.134 -12.908 931 1HD2 ASN 106 1HD2 ASN 106 1.997 -3.195 -12.360 932 2HD2 ASN 106 2HD2 ASN 106 0.730 -3.690 -11.285 933 HA PRO 107 HA PRO 107 2.119 2.061 -8.419 934 1HB PRO 107 2HB PRO 107 -0.683 1.487 -7.610 935 2HB PRO 107 1HB PRO 107 0.304 2.921 -7.303 936 1HG PRO 107 2HG PRO 107 -1.658 2.996 -9.095 937 2HG PRO 107 1HG PRO 107 -0.118 3.824 -9.397 938 1HD PRO 107 2HD PRO 107 -1.106 1.215 -10.473 939 2HD PRO 107 1HD PRO 107 -0.230 2.514 -11.309 940 H SER 108 H SER 108 3.295 0.551 -7.507 941 HA SER 108 HA SER 108 2.037 -1.914 -6.567 942 1HB SER 108 2HB SER 108 4.931 -1.433 -7.358 943 2HB SER 108 1HB SER 108 4.222 -2.979 -6.878 944 HG SER 108 HG SER 108 2.848 -1.766 -8.867 945 H LEU 109 H LEU 109 3.033 -2.628 -4.424 946 HA LEU 109 HA LEU 109 2.788 -0.371 -2.751 947 1HB LEU 109 2HB LEU 109 1.879 -2.566 -2.114 948 2HB LEU 109 1HB LEU 109 3.497 -3.197 -1.943 949 HG LEU 109 HG LEU 109 2.229 -2.665 0.209 950 1HD1 LEU 109 1HD1 LEU 109 4.912 -1.350 -0.135 951 2HD1 LEU 109 2HD1 LEU 109 4.614 -3.041 0.269 952 3HD1 LEU 109 3HD1 LEU 109 4.157 -1.768 1.403 953 1HD2 LEU 109 1HD2 LEU 109 2.839 0.200 -0.574 954 2HD2 LEU 109 2HD2 LEU 109 2.235 -0.317 0.996 955 3HD2 LEU 109 3HD2 LEU 109 1.238 -0.511 -0.433 956 H GLN 110 H GLN 110 5.716 -2.528 -3.077 957 HA GLN 110 HA GLN 110 7.259 -1.108 -1.313 958 1HB GLN 110 2HB GLN 110 7.781 -3.326 -2.287 959 2HB GLN 110 1HB GLN 110 8.151 -2.549 -3.813 960 1HG GLN 110 2HG GLN 110 10.185 -3.089 -2.653 961 2HG GLN 110 1HG GLN 110 9.995 -1.340 -2.728 962 1HE2 GLN 110 1HE2 GLN 110 9.854 -4.138 -0.694 963 2HE2 GLN 110 2HE2 GLN 110 9.962 -3.289 0.818 964 H LEU 111 H LEU 111 6.978 -0.626 -4.807 965 HA LEU 111 HA LEU 111 8.826 1.473 -5.059 966 1HB LEU 111 2HB LEU 111 6.328 0.984 -6.670 967 2HB LEU 111 1HB LEU 111 7.574 2.130 -7.108 968 HG LEU 111 HG LEU 111 7.908 -0.865 -6.930 969 1HD1 LEU 111 1HD1 LEU 111 6.583 -0.178 -8.837 970 2HD1 LEU 111 2HD1 LEU 111 8.178 -0.728 -9.354 971 3HD1 LEU 111 3HD1 LEU 111 7.817 0.997 -9.294 972 1HD2 LEU 111 1HD2 LEU 111 9.960 0.316 -6.306 973 2HD2 LEU 111 2HD2 LEU 111 9.867 1.270 -7.787 974 3HD2 LEU 111 3HD2 LEU 111 10.132 -0.472 -7.873 975 H ALA 112 H ALA 112 5.402 1.601 -4.367 976 HA ALA 112 HA ALA 112 5.216 4.461 -4.375 977 1HB ALA 112 1HB ALA 112 3.257 3.049 -4.826 978 2HB ALA 112 2HB ALA 112 2.970 4.137 -3.467 979 3HB ALA 112 3HB ALA 112 3.325 2.436 -3.172 980 H LEU 113 H LEU 113 5.775 1.990 -1.972 981 HA LEU 113 HA LEU 113 5.194 3.319 0.371 982 1HB LEU 113 2HB LEU 113 5.414 0.949 0.115 983 2HB LEU 113 1HB LEU 113 7.104 1.122 -0.304 984 HG LEU 113 HG LEU 113 7.539 1.998 1.942 985 1HD1 LEU 113 1HD1 LEU 113 5.803 1.762 3.637 986 2HD1 LEU 113 2HD1 LEU 113 4.655 1.280 2.389 987 3HD1 LEU 113 3HD1 LEU 113 5.339 2.908 2.379 988 1HD2 LEU 113 1HD2 LEU 113 7.294 -0.161 3.065 989 2HD2 LEU 113 2HD2 LEU 113 7.866 -0.351 1.406 990 3HD2 LEU 113 3HD2 LEU 113 6.182 -0.686 1.804 991 H LYS 114 H LYS 114 8.223 2.932 -1.392 992 HA LYS 114 HA LYS 114 9.606 4.342 0.608 993 1HB LYS 114 2HB LYS 114 11.536 4.404 -1.112 994 2HB LYS 114 1HB LYS 114 11.035 2.871 -0.427 995 1HG LYS 114 2HG LYS 114 9.644 2.546 -2.521 996 2HG LYS 114 1HG LYS 114 10.505 3.936 -3.187 997 1HD LYS 114 2HD LYS 114 11.567 1.817 -3.847 998 2HD LYS 114 1HD LYS 114 12.643 2.792 -2.843 999 1HE LYS 114 2HE LYS 114 12.010 1.447 -0.872 1000 2HE LYS 114 1HE LYS 114 10.951 0.470 -1.883 1001 1HZ LYS 114 1HZ LYS 114 12.852 -0.363 -3.073 1002 2HZ LYS 114 2HZ LYS 114 13.185 -0.541 -1.422 1003 3HZ LYS 114 3HZ LYS 114 13.872 0.722 -2.296 1004 H ILE 115 H ILE 115 8.152 5.369 -2.338 1005 HA ILE 115 HA ILE 115 9.018 8.071 -2.329 1006 HB ILE 115 HB ILE 115 6.190 7.191 -3.019 1007 1HG1 ILE 115 2HG1 ILE 115 8.570 7.282 -4.862 1008 2HG1 ILE 115 1HG1 ILE 115 7.920 5.792 -4.177 1009 1HG2 ILE 115 1HG2 ILE 115 6.283 9.102 -4.568 1010 2HG2 ILE 115 2HG2 ILE 115 7.911 9.473 -4.004 1011 3HG2 ILE 115 3HG2 ILE 115 6.545 9.604 -2.899 1012 1HD1 ILE 115 1HD1 ILE 115 7.163 6.121 -6.454 1013 2HD1 ILE 115 2HD1 ILE 115 6.488 7.692 -6.018 1014 3HD1 ILE 115 3HD1 ILE 115 5.803 6.218 -5.334 1015 H ALA 116 H ALA 116 6.429 6.397 -0.713 1016 HA ALA 116 HA ALA 116 5.103 8.520 0.598 1017 1HB ALA 116 1HB ALA 116 4.171 6.779 2.013 1018 2HB ALA 116 2HB ALA 116 5.418 5.675 1.432 1019 3HB ALA 116 3HB ALA 116 4.173 6.258 0.313 1020 H TYR 117 H TYR 117 7.809 6.495 1.418 1021 HA TYR 117 HA TYR 117 8.076 7.267 4.094 1022 1HB TYR 117 2HB TYR 117 9.061 5.224 3.456 1023 2HB TYR 117 1HB TYR 117 9.901 5.955 2.100 1024 HD1 TYR 117 1HD TYR 117 11.983 6.688 2.311 1025 HD2 TYR 117 2HD TYR 117 9.834 5.829 5.828 1026 HE1 TYR 117 1HE TYR 117 14.086 6.970 3.642 1027 HE2 TYR 117 2HE TYR 117 11.876 6.096 7.184 1028 HH TYR 117 HH TYR 117 14.287 6.003 6.906 1029 H TYR 118 H TYR 118 9.682 8.399 1.156 1030 HA TYR 118 HA TYR 118 11.237 10.295 2.624 1031 1HB TYR 118 2HB TYR 118 10.809 10.012 -0.341 1032 2HB TYR 118 1HB TYR 118 11.831 11.255 0.371 1033 HD1 TYR 118 1HD TYR 118 13.834 10.545 1.727 1034 HD2 TYR 118 2HD TYR 118 11.592 7.825 -0.631 1035 HE1 TYR 118 1HE TYR 118 15.722 8.971 1.757 1036 HE2 TYR 118 2HE TYR 118 13.459 6.248 -0.606 1037 HH TYR 118 HH TYR 118 15.846 6.330 -0.357 1038 H LEU 119 H LEU 119 8.295 10.569 0.717 1039 HA LEU 119 HA LEU 119 8.159 13.408 1.109 1040 1HB LEU 119 2HB LEU 119 6.105 11.440 0.109 1041 2HB LEU 119 1HB LEU 119 5.850 13.171 0.172 1042 1HD1 LEU 119 1HD1 LEU 119 5.720 11.326 -2.305 1043 2HD1 LEU 119 2HD1 LEU 119 6.580 12.410 -3.398 1044 3HD1 LEU 119 3HD1 LEU 119 5.353 13.052 -2.304 1045 1HD2 LEU 119 1HD2 LEU 119 8.600 14.055 -0.799 1046 2HD2 LEU 119 2HD2 LEU 119 7.062 14.676 -1.398 1047 3HD2 LEU 119 3HD2 LEU 119 8.239 13.999 -2.524 1048 H ASN 120 H ASN 120 7.356 10.721 2.926 1049 HA ASN 120 HA ASN 120 6.174 10.218 4.739 1050 1HB ASN 120 2HB ASN 120 7.961 11.513 5.758 1051 2HB ASN 120 1HB ASN 120 7.019 12.991 5.582 1052 1HD2 ASN 120 1HD2 ASN 120 7.272 9.954 7.252 1053 2HD2 ASN 120 2HD2 ASN 120 6.210 10.340 8.552 1054 H THR 121 H THR 121 4.167 9.911 3.949 1055 HA THR 121 HA THR 121 2.158 11.636 5.090 1056 HB THR 121 HB THR 121 2.182 11.003 2.093 1057 HG1 THR 121 1HG THR 121 3.294 13.020 3.472 1058 1HG2 THR 121 1HG2 THR 121 -0.088 11.133 3.055 1059 2HG2 THR 121 2HG2 THR 121 0.230 12.479 1.962 1060 3HG2 THR 121 3HG2 THR 121 0.288 12.727 3.707 1061 HA PRO 122 HA PRO 122 0.439 7.484 5.719 1062 1HB PRO 122 2HB PRO 122 -2.240 8.703 5.396 1063 2HB PRO 122 1HB PRO 122 -1.576 7.798 6.744 1064 1HG PRO 122 2HG PRO 122 -1.925 10.463 6.893 1065 2HG PRO 122 1HG PRO 122 -0.605 9.627 7.726 1066 1HD PRO 122 2HD PRO 122 -0.547 11.286 5.257 1067 2HD PRO 122 1HD PRO 122 0.681 11.097 6.522 1068 H LEU 123 H LEU 123 -0.222 5.893 4.389 1069 HA LEU 123 HA LEU 123 -0.064 6.278 1.634 1070 1HB LEU 123 2HB LEU 123 -1.003 3.923 3.237 1071 2HB LEU 123 1HB LEU 123 -1.050 3.901 1.492 1072 1HD1 LEU 123 1HD1 LEU 123 1.153 3.934 0.192 1073 2HD1 LEU 123 2HD1 LEU 123 2.674 3.940 1.084 1074 3HD1 LEU 123 3HD1 LEU 123 1.660 5.381 1.062 1075 1HD2 LEU 123 1HD2 LEU 123 1.217 3.701 4.434 1076 2HD2 LEU 123 2HD2 LEU 123 1.707 5.232 3.710 1077 3HD2 LEU 123 3HD2 LEU 123 2.712 3.797 3.500 1078 H GLU 124 H GLU 124 -2.967 6.032 3.662 1079 HA GLU 124 HA GLU 124 -4.870 5.777 1.647 1080 1HB GLU 124 2HB GLU 124 -5.066 7.147 4.317 1081 2HB GLU 124 1HB GLU 124 -6.427 6.644 3.326 1082 1HG GLU 124 2HG GLU 124 -5.873 4.338 3.613 1083 2HG GLU 124 1HG GLU 124 -4.329 4.800 4.354 1084 H ASP 125 H ASP 125 -3.215 8.620 2.874 1085 HA ASP 125 HA ASP 125 -4.940 10.511 1.581 1086 1HB ASP 125 2HB ASP 125 -3.494 11.063 3.572 1087 2HB ASP 125 1HB ASP 125 -2.092 10.948 2.517 1088 H ILE 126 H ILE 126 -2.073 8.839 0.853 1089 HA ILE 126 HA ILE 126 -1.262 10.375 -1.463 1090 HB ILE 126 HB ILE 126 -0.265 7.641 -0.598 1091 1HG1 ILE 126 2HG1 ILE 126 0.882 10.393 -0.082 1092 2HG1 ILE 126 1HG1 ILE 126 0.071 9.390 1.115 1093 1HG2 ILE 126 1HG2 ILE 126 1.692 8.175 -1.996 1094 2HG2 ILE 126 2HG2 ILE 126 0.914 9.678 -2.498 1095 3HG2 ILE 126 3HG2 ILE 126 0.207 8.125 -2.945 1096 1HD1 ILE 126 1HD1 ILE 126 1.839 7.722 0.901 1097 2HD1 ILE 126 2HD1 ILE 126 2.475 9.296 1.369 1098 3HD1 ILE 126 3HD1 ILE 126 2.647 8.735 -0.295 1099 H PHE 127 H PHE 127 -2.502 7.089 -1.049 1100 HA PHE 127 HA PHE 127 -3.631 7.367 -3.746 1101 1HB PHE 127 2HB PHE 127 -2.637 4.837 -2.361 1102 2HB PHE 127 1HB PHE 127 -3.621 4.834 -3.822 1103 HD1 PHE 127 1HD PHE 127 -2.690 5.747 -5.915 1104 HD2 PHE 127 2HD PHE 127 -0.331 5.295 -2.408 1105 HE1 PHE 127 1HE PHE 127 -0.643 5.918 -7.275 1106 HE2 PHE 127 2HE PHE 127 1.718 5.470 -3.759 1107 HZ PHE 127 HZ PHE 127 1.563 5.784 -6.195 1108 H GLN 128 H GLN 128 -5.759 6.942 -3.965 1109 HA GLN 128 HA GLN 128 -7.106 6.169 -1.498 1110 1HB GLN 128 2HB GLN 128 -7.490 8.564 -1.902 1111 2HB GLN 128 1HB GLN 128 -8.144 8.191 -3.494 1112 1HG GLN 128 2HG GLN 128 -9.998 7.022 -2.529 1113 2HG GLN 128 1HG GLN 128 -9.310 7.170 -0.916 1114 1HE2 GLN 128 1HE2 GLN 128 -10.968 8.809 -3.488 1115 2HE2 GLN 128 2HE2 GLN 128 -11.431 10.174 -2.565 1116 H TRP 129 H TRP 129 -8.589 4.710 -1.593 1117 HA TRP 129 HA TRP 129 -9.076 3.524 -4.191 1118 1HB TRP 129 2HB TRP 129 -9.359 1.386 -2.809 1119 2HB TRP 129 1HB TRP 129 -7.748 2.000 -3.092 1120 HD1 TRP 129 HD TRP 129 -10.328 1.751 -0.213 1121 HE1 TRP 129 1HE TRP 129 -9.050 1.930 2.023 1122 HE3 TRP 129 3HE TRP 129 -5.653 2.794 -2.012 1123 HZ2 TRP 129 2HZ TRP 129 -6.413 2.413 2.895 1124 HZ3 TRP 129 3HZ TRP 129 -3.810 3.090 -0.415 1125 HH2 TRP 129 HH TRP 129 -4.174 2.903 1.978 1126 H GLN 130 H GLN 130 -11.008 3.361 -4.816 1127 HA GLN 130 HA GLN 130 -13.210 3.664 -2.898 1128 1HB GLN 130 2HB GLN 130 -12.997 4.819 -5.680 1129 2HB GLN 130 1HB GLN 130 -14.474 4.796 -4.734 1130 1HG GLN 130 2HG GLN 130 -11.938 6.157 -3.869 1131 2HG GLN 130 1HG GLN 130 -13.240 6.962 -4.735 1132 1HE2 GLN 130 1HE2 GLN 130 -13.642 8.358 -3.109 1133 2HE2 GLN 130 2HE2 GLN 130 -14.395 7.907 -1.610 1134 HA PRO 131 HA PRO 131 -14.032 -0.311 -4.970 1135 1HB PRO 131 2HB PRO 131 -15.686 -0.715 -2.557 1136 2HB PRO 131 1HB PRO 131 -14.366 -1.713 -3.177 1137 1HG PRO 131 2HG PRO 131 -14.073 -0.260 -0.952 1138 2HG PRO 131 1HG PRO 131 -12.738 -0.455 -2.108 1139 1HD PRO 131 2HD PRO 131 -14.627 1.856 -1.774 1140 2HD PRO 131 1HD PRO 131 -12.858 1.873 -1.968 1141 H GLU 132 H GLU 132 -15.966 2.228 -3.714 1142 HA GLU 132 HA GLU 132 -18.182 1.494 -5.453 1143 1HB GLU 132 2HB GLU 132 -18.280 2.954 -2.804 1144 2HB GLU 132 1HB GLU 132 -19.651 2.652 -3.863 1145 1HG GLU 132 2HG GLU 132 -19.460 0.279 -3.488 1146 2HG GLU 132 1HG GLU 132 -18.017 0.528 -2.505 Start of MODEL 4 1 1H MET 1 1HT MET 1 13.346 -5.548 3.802 2 2H MET 1 2HT MET 1 12.479 -4.494 4.810 3 3H MET 1 3HT MET 1 11.736 -5.143 3.471 4 HA MET 1 HA MET 1 11.853 -7.349 4.418 5 1HB MET 1 2HB MET 1 12.884 -5.788 6.799 6 2HB MET 1 1HB MET 1 12.245 -7.420 6.912 7 1HG MET 1 2HG MET 1 14.022 -8.203 5.408 8 2HG MET 1 1HG MET 1 14.662 -6.564 5.338 9 1HE MET 1 1HE MET 1 15.916 -5.958 8.983 10 2HE MET 1 2HE MET 1 14.373 -5.486 8.269 11 3HE MET 1 3HE MET 1 15.861 -5.334 7.335 12 H ILE 2 H ILE 2 10.069 -8.054 5.790 13 HA ILE 2 HA ILE 2 8.119 -5.928 6.331 14 HB ILE 2 HB ILE 2 7.590 -8.481 4.764 15 1HG1 ILE 2 2HG1 ILE 2 8.509 -6.665 3.386 16 2HG1 ILE 2 1HG1 ILE 2 6.842 -7.003 2.946 17 1HG2 ILE 2 1HG2 ILE 2 5.230 -7.820 4.628 18 2HG2 ILE 2 2HG2 ILE 2 5.555 -6.475 5.722 19 3HG2 ILE 2 3HG2 ILE 2 5.736 -8.133 6.292 20 1HD1 ILE 2 1HD1 ILE 2 7.790 -4.705 4.645 21 2HD1 ILE 2 2HD1 ILE 2 6.115 -5.040 4.213 22 3HD1 ILE 2 3HD1 ILE 2 7.282 -4.616 2.959 23 H ILE 3 H ILE 3 6.909 -6.234 8.119 24 HA ILE 3 HA ILE 3 7.091 -8.758 9.567 25 HB ILE 3 HB ILE 3 6.959 -5.925 10.713 26 1HG1 ILE 3 2HG1 ILE 3 9.167 -7.997 10.874 27 2HG1 ILE 3 1HG1 ILE 3 9.206 -6.528 9.912 28 1HG2 ILE 3 1HG2 ILE 3 5.632 -7.471 12.052 29 2HG2 ILE 3 2HG2 ILE 3 7.089 -7.004 12.931 30 3HG2 ILE 3 3HG2 ILE 3 6.996 -8.584 12.152 31 1HD1 ILE 3 1HD1 ILE 3 10.529 -6.296 11.929 32 2HD1 ILE 3 2HD1 ILE 3 9.125 -6.687 12.918 33 3HD1 ILE 3 3HD1 ILE 3 9.149 -5.198 11.973 34 H ASN 4 H ASN 4 5.053 -9.646 9.611 35 HA ASN 4 HA ASN 4 2.847 -7.909 8.728 36 1HB ASN 4 2HB ASN 4 3.500 -9.710 7.230 37 2HB ASN 4 1HB ASN 4 3.362 -10.872 8.538 38 1HD2 ASN 4 1HD2 ASN 4 1.907 -12.070 7.461 39 2HD2 ASN 4 2HD2 ASN 4 0.284 -11.578 7.155 40 H ASN 5 H ASN 5 1.054 -7.714 9.842 41 HA ASN 5 HA ASN 5 0.651 -9.367 12.208 42 1HB ASN 5 2HB ASN 5 0.713 -6.359 12.042 43 2HB ASN 5 1HB ASN 5 -0.304 -7.155 13.238 44 1HD2 ASN 5 1HD2 ASN 5 2.185 -5.455 13.434 45 2HD2 ASN 5 2HD2 ASN 5 3.246 -6.381 14.426 46 H LEU 6 H LEU 6 -0.428 -9.222 9.404 47 HA LEU 6 HA LEU 6 -2.923 -8.135 9.130 48 1HB LEU 6 2HB LEU 6 -1.648 -9.229 7.334 49 2HB LEU 6 1HB LEU 6 -1.908 -10.783 8.075 50 HG LEU 6 HG LEU 6 -3.237 -10.270 5.986 51 1HD1 LEU 6 1HD1 LEU 6 -3.892 -12.111 7.391 52 2HD1 LEU 6 2HD1 LEU 6 -5.314 -11.292 6.743 53 3HD1 LEU 6 3HD1 LEU 6 -4.826 -11.025 8.418 54 1HD2 LEU 6 1HD2 LEU 6 -4.756 -8.473 7.855 55 2HD2 LEU 6 2HD2 LEU 6 -5.274 -8.936 6.235 56 3HD2 LEU 6 3HD2 LEU 6 -3.810 -7.977 6.454 57 H LYS 7 H LYS 7 -2.193 -11.336 10.499 58 HA LYS 7 HA LYS 7 -4.893 -11.964 10.950 59 1HB LYS 7 2HB LYS 7 -4.163 -13.784 12.397 60 2HB LYS 7 1HB LYS 7 -3.212 -13.737 10.927 61 1HG LYS 7 2HG LYS 7 -1.334 -12.823 12.098 62 2HG LYS 7 1HG LYS 7 -2.295 -12.615 13.566 63 1HD LYS 7 2HD LYS 7 -1.647 -15.249 12.246 64 2HD LYS 7 1HD LYS 7 -0.858 -14.604 13.689 65 1HE LYS 7 2HE LYS 7 -3.029 -14.612 14.853 66 2HE LYS 7 1HE LYS 7 -3.786 -15.284 13.413 67 1HZ LYS 7 1HZ LYS 7 -3.329 -16.994 14.996 68 2HZ LYS 7 2HZ LYS 7 -1.672 -16.580 15.038 69 3HZ LYS 7 3HZ LYS 7 -2.356 -17.228 13.639 70 H LEU 8 H LEU 8 -2.566 -10.275 12.968 71 HA LEU 8 HA LEU 8 -4.056 -10.325 15.343 72 1HB LEU 8 2HB LEU 8 -1.587 -9.797 15.048 73 2HB LEU 8 1HB LEU 8 -2.054 -8.232 14.443 74 HG LEU 8 HG LEU 8 -1.215 -8.256 16.798 75 1HD1 LEU 8 1HD1 LEU 8 -4.045 -7.289 16.507 76 2HD1 LEU 8 2HD1 LEU 8 -2.589 -6.403 16.061 77 3HD1 LEU 8 3HD1 LEU 8 -2.903 -6.792 17.753 78 1HD2 LEU 8 1HD2 LEU 8 -2.690 -9.065 18.577 79 2HD2 LEU 8 2HD2 LEU 8 -2.152 -10.372 17.522 80 3HD2 LEU 8 3HD2 LEU 8 -3.784 -9.724 17.362 81 H ILE 9 H ILE 9 -3.996 -8.067 12.616 82 HA ILE 9 HA ILE 9 -5.843 -6.223 13.720 83 HB ILE 9 HB ILE 9 -4.947 -6.734 10.873 84 1HG1 ILE 9 2HG1 ILE 9 -4.155 -4.386 11.020 85 2HG1 ILE 9 1HG1 ILE 9 -4.758 -4.303 12.662 86 1HG2 ILE 9 1HG2 ILE 9 -7.294 -6.196 10.624 87 2HG2 ILE 9 2HG2 ILE 9 -6.300 -4.844 10.069 88 3HG2 ILE 9 3HG2 ILE 9 -7.099 -4.770 11.641 89 1HD1 ILE 9 1HD1 ILE 9 -3.154 -6.015 13.326 90 2HD1 ILE 9 2HD1 ILE 9 -2.366 -4.611 12.603 91 3HD1 ILE 9 3HD1 ILE 9 -2.561 -6.093 11.668 92 H ARG 10 H ARG 10 -6.206 -9.076 11.840 93 HA ARG 10 HA ARG 10 -9.015 -8.967 11.495 94 1HB ARG 10 2HB ARG 10 -7.066 -11.227 11.522 95 2HB ARG 10 1HB ARG 10 -8.790 -11.517 11.398 96 1HG ARG 10 2HG ARG 10 -8.866 -10.194 9.358 97 2HG ARG 10 1HG ARG 10 -7.126 -9.902 9.492 98 1HD ARG 10 2HD ARG 10 -7.840 -11.796 7.975 99 2HD ARG 10 1HD ARG 10 -6.615 -12.172 9.188 100 HE ARG 10 HE ARG 10 -9.149 -12.684 10.257 101 1HH1 ARG 10 1HH1 ARG 10 -7.294 -13.968 7.583 102 2HH1 ARG 10 2HH1 ARG 10 -7.479 -15.599 7.989 103 1HH2 ARG 10 1HH2 ARG 10 -9.462 -14.896 10.883 104 2HH2 ARG 10 2HH2 ARG 10 -8.876 -16.155 9.916 105 H GLU 11 H GLU 11 -6.944 -10.167 14.147 106 HA GLU 11 HA GLU 11 -9.109 -11.168 15.593 107 1HB GLU 11 2HB GLU 11 -6.325 -10.477 16.525 108 2HB GLU 11 1HB GLU 11 -7.517 -11.391 17.447 109 1HG GLU 11 2HG GLU 11 -7.569 -12.967 15.422 110 2HG GLU 11 1HG GLU 11 -6.069 -12.177 14.954 111 H LYS 12 H LYS 12 -7.503 -8.063 15.530 112 HA LYS 12 HA LYS 12 -8.853 -6.806 17.601 113 1HB LYS 12 2HB LYS 12 -7.987 -5.661 14.928 114 2HB LYS 12 1HB LYS 12 -8.515 -4.679 16.293 115 1HG LYS 12 2HG LYS 12 -6.671 -5.417 17.626 116 2HG LYS 12 1HG LYS 12 -6.206 -6.603 16.414 117 1HD LYS 12 2HD LYS 12 -4.722 -4.661 16.379 118 2HD LYS 12 1HD LYS 12 -5.617 -4.801 14.870 119 1HE LYS 12 2HE LYS 12 -7.065 -3.015 15.479 120 2HE LYS 12 1HE LYS 12 -6.456 -3.008 17.136 121 1HZ LYS 12 1HZ LYS 12 -4.368 -2.210 16.397 122 2HZ LYS 12 2HZ LYS 12 -5.526 -1.203 15.719 123 3HZ LYS 12 3HZ LYS 12 -4.745 -2.351 14.771 124 H LYS 13 H LYS 13 -9.990 -7.439 14.337 125 HA LYS 13 HA LYS 13 -12.677 -6.584 15.150 126 1HB LYS 13 2HB LYS 13 -11.620 -7.420 12.406 127 2HB LYS 13 1HB LYS 13 -13.275 -6.902 12.720 128 1HG LYS 13 2HG LYS 13 -10.778 -5.215 12.990 129 2HG LYS 13 1HG LYS 13 -12.040 -5.054 11.763 130 1HD LYS 13 2HD LYS 13 -13.661 -4.427 13.438 131 2HD LYS 13 1HD LYS 13 -12.514 -4.757 14.728 132 1HE LYS 13 2HE LYS 13 -12.669 -2.380 14.428 133 2HE LYS 13 1HE LYS 13 -11.093 -2.913 13.861 134 1HZ LYS 13 1HZ LYS 13 -12.143 -1.277 12.413 135 2HZ LYS 13 2HZ LYS 13 -13.423 -2.313 12.104 136 3HZ LYS 13 3HZ LYS 13 -11.877 -2.712 11.573 137 H LYS 14 H LYS 14 -14.474 -8.983 13.880 138 HA LYS 14 HA LYS 14 -12.951 -11.029 15.015 139 1HB LYS 14 2HB LYS 14 -15.136 -11.794 15.783 140 2HB LYS 14 1HB LYS 14 -14.868 -10.160 16.370 141 1HG LYS 14 2HG LYS 14 -16.290 -9.313 14.525 142 2HG LYS 14 1HG LYS 14 -16.603 -10.980 14.049 143 1HD LYS 14 2HD LYS 14 -17.499 -11.348 16.367 144 2HD LYS 14 1HD LYS 14 -17.388 -9.603 16.606 145 1HE LYS 14 2HE LYS 14 -19.065 -11.089 14.594 146 2HE LYS 14 1HE LYS 14 -19.621 -10.094 15.936 147 1HZ LYS 14 1HZ LYS 14 -18.577 -8.149 14.772 148 2HZ LYS 14 2HZ LYS 14 -19.850 -8.879 13.939 149 3HZ LYS 14 3HZ LYS 14 -18.279 -9.185 13.451 150 H ILE 15 H ILE 15 -12.409 -10.647 12.440 151 HA ILE 15 HA ILE 15 -14.464 -12.110 10.935 152 HB ILE 15 HB ILE 15 -12.619 -9.985 9.767 153 1HG1 ILE 15 2HG1 ILE 15 -15.598 -9.874 10.334 154 2HG1 ILE 15 1HG1 ILE 15 -14.359 -9.033 11.253 155 1HG2 ILE 15 1HG2 ILE 15 -14.013 -10.235 7.753 156 2HG2 ILE 15 2HG2 ILE 15 -14.931 -11.513 8.545 157 3HG2 ILE 15 3HG2 ILE 15 -13.222 -11.754 8.174 158 1HD1 ILE 15 1HD1 ILE 15 -15.040 -8.561 8.357 159 2HD1 ILE 15 2HD1 ILE 15 -13.799 -7.709 9.275 160 3HD1 ILE 15 3HD1 ILE 15 -15.498 -7.534 9.718 161 H SER 16 H SER 16 -13.833 -13.884 9.832 162 HA SER 16 HA SER 16 -11.041 -14.604 10.156 163 1HB SER 16 2HB SER 16 -13.512 -16.310 9.908 164 2HB SER 16 1HB SER 16 -11.865 -16.944 9.981 165 HG SER 16 HG SER 16 -13.355 -15.593 11.963 166 H GLN 17 H GLN 17 -10.694 -16.614 8.393 167 HA GLN 17 HA GLN 17 -10.048 -15.070 6.116 168 1HB GLN 17 2HB GLN 17 -9.106 -17.114 5.121 169 2HB GLN 17 1HB GLN 17 -8.546 -16.854 6.762 170 1HG GLN 17 2HG GLN 17 -9.984 -18.592 7.585 171 2HG GLN 17 1HG GLN 17 -10.762 -18.751 6.014 172 1HE2 GLN 17 1HE2 GLN 17 -7.837 -19.373 7.841 173 2HE2 GLN 17 2HE2 GLN 17 -7.201 -20.551 6.778 174 H SER 18 H SER 18 -12.699 -17.468 6.646 175 HA SER 18 HA SER 18 -13.346 -17.865 4.035 176 1HB SER 18 2HB SER 18 -15.239 -17.771 6.346 177 2HB SER 18 1HB SER 18 -15.187 -18.905 4.994 178 HG SER 18 HG SER 18 -14.175 -19.232 7.339 179 H GLU 19 H GLU 19 -14.643 -15.563 6.456 180 HA GLU 19 HA GLU 19 -16.547 -14.390 4.787 181 1HB GLU 19 2HB GLU 19 -15.164 -13.011 7.095 182 2HB GLU 19 1HB GLU 19 -16.725 -12.610 6.410 183 1HG GLU 19 2HG GLU 19 -17.320 -13.702 8.334 184 2HG GLU 19 1HG GLU 19 -17.371 -15.015 7.162 185 H LEU 20 H LEU 20 -13.235 -13.388 5.606 186 HA LEU 20 HA LEU 20 -13.296 -11.060 4.072 187 1HB LEU 20 2HB LEU 20 -11.012 -12.722 5.050 188 2HB LEU 20 1HB LEU 20 -10.760 -11.290 4.076 189 HG LEU 20 HG LEU 20 -12.128 -11.354 6.763 190 1HD1 LEU 20 1HD1 LEU 20 -9.731 -11.756 6.911 191 2HD1 LEU 20 2HD1 LEU 20 -10.149 -10.155 7.528 192 3HD1 LEU 20 3HD1 LEU 20 -9.426 -10.324 5.928 193 1HD2 LEU 20 1HD2 LEU 20 -13.027 -9.612 5.307 194 2HD2 LEU 20 2HD2 LEU 20 -11.393 -9.042 4.966 195 3HD2 LEU 20 3HD2 LEU 20 -12.048 -8.911 6.598 196 H ALA 21 H ALA 21 -12.354 -14.332 3.198 197 HA ALA 21 HA ALA 21 -11.277 -13.749 0.697 198 1HB ALA 21 1HB ALA 21 -12.876 -16.168 1.468 199 2HB ALA 21 2HB ALA 21 -11.152 -15.931 1.759 200 3HB ALA 21 3HB ALA 21 -11.761 -16.036 0.107 201 H ALA 22 H ALA 22 -14.644 -14.552 1.540 202 HA ALA 22 HA ALA 22 -15.615 -14.279 -1.087 203 1HB ALA 22 1HB ALA 22 -17.064 -14.044 1.542 204 2HB ALA 22 2HB ALA 22 -16.788 -15.534 0.637 205 3HB ALA 22 3HB ALA 22 -17.814 -14.267 -0.038 206 H LEU 23 H LEU 23 -15.322 -12.077 1.625 207 HA LEU 23 HA LEU 23 -16.827 -9.961 0.532 208 1HB LEU 23 2HB LEU 23 -16.351 -10.269 2.919 209 2HB LEU 23 1HB LEU 23 -14.661 -9.949 2.625 210 HG LEU 23 HG LEU 23 -15.212 -7.638 1.997 211 1HD1 LEU 23 1HD1 LEU 23 -18.028 -8.409 2.769 212 2HD1 LEU 23 2HD1 LEU 23 -17.474 -8.025 1.140 213 3HD1 LEU 23 3HD1 LEU 23 -17.469 -6.778 2.390 214 1HD2 LEU 23 1HD2 LEU 23 -15.816 -6.890 4.240 215 2HD2 LEU 23 2HD2 LEU 23 -14.632 -8.196 4.296 216 3HD2 LEU 23 3HD2 LEU 23 -16.328 -8.527 4.652 217 H LEU 24 H LEU 24 -13.361 -10.750 0.466 218 HA LEU 24 HA LEU 24 -12.674 -8.353 -0.981 219 1HB LEU 24 2HB LEU 24 -11.021 -10.814 -0.416 220 2HB LEU 24 1HB LEU 24 -10.421 -9.286 -1.018 221 HG LEU 24 HG LEU 24 -11.568 -9.801 1.724 222 1HD1 LEU 24 1HD1 LEU 24 -8.752 -9.260 0.821 223 2HD1 LEU 24 2HD1 LEU 24 -9.388 -10.792 1.423 224 3HD1 LEU 24 3HD1 LEU 24 -9.290 -9.397 2.494 225 1HD2 LEU 24 1HD2 LEU 24 -12.065 -7.539 0.978 226 2HD2 LEU 24 2HD2 LEU 24 -10.367 -7.289 0.570 227 3HD2 LEU 24 3HD2 LEU 24 -10.846 -7.529 2.251 228 H GLU 25 H GLU 25 -14.188 -11.138 -1.856 229 HA GLU 25 HA GLU 25 -14.721 -12.136 -3.816 230 1HB GLU 25 2HB GLU 25 -13.313 -9.753 -5.026 231 2HB GLU 25 1HB GLU 25 -14.320 -10.889 -5.912 232 1HG GLU 25 2HG GLU 25 -16.258 -10.210 -4.671 233 2HG GLU 25 1HG GLU 25 -15.273 -9.178 -3.634 234 H VAL 26 H VAL 26 -12.327 -12.961 -2.488 235 HA VAL 26 HA VAL 26 -10.778 -13.928 -4.761 236 HB VAL 26 HB VAL 26 -8.720 -13.840 -3.363 237 1HG1 VAL 26 1HG1 VAL 26 -8.304 -11.431 -3.543 238 2HG1 VAL 26 2HG1 VAL 26 -10.031 -11.159 -3.774 239 3HG1 VAL 26 3HG1 VAL 26 -9.115 -12.070 -4.974 240 1HG2 VAL 26 1HG2 VAL 26 -9.750 -13.820 -1.145 241 2HG2 VAL 26 2HG2 VAL 26 -10.408 -12.214 -1.451 242 3HG2 VAL 26 3HG2 VAL 26 -8.663 -12.445 -1.337 243 H SER 27 H SER 27 -9.300 -15.779 -3.803 244 HA SER 27 HA SER 27 -11.108 -17.660 -2.635 245 1HB SER 27 2HB SER 27 -8.213 -17.940 -3.464 246 2HB SER 27 1HB SER 27 -9.313 -19.267 -3.074 247 HG SER 27 HG SER 27 -10.648 -17.978 -4.797 248 H ARG 28 H ARG 28 -10.624 -18.892 -0.726 249 HA ARG 28 HA ARG 28 -9.903 -17.293 1.484 250 1HB ARG 28 2HB ARG 28 -10.268 -20.300 1.344 251 2HB ARG 28 1HB ARG 28 -10.192 -19.358 2.832 252 1HG ARG 28 2HG ARG 28 -12.181 -18.105 2.128 253 2HG ARG 28 1HG ARG 28 -12.272 -19.083 0.673 254 1HD ARG 28 2HD ARG 28 -12.552 -20.054 3.512 255 2HD ARG 28 1HD ARG 28 -13.857 -19.843 2.350 256 HE ARG 28 HE ARG 28 -11.871 -21.934 2.464 257 1HH1 ARG 28 1HH1 ARG 28 -14.444 -20.442 0.465 258 2HH1 ARG 28 2HH1 ARG 28 -14.858 -21.889 -0.324 259 1HH2 ARG 28 1HH2 ARG 28 -12.493 -23.914 1.406 260 2HH2 ARG 28 2HH2 ARG 28 -13.721 -23.952 0.236 261 H GLN 29 H GLN 29 -8.216 -19.546 -0.455 262 HA GLN 29 HA GLN 29 -5.842 -19.883 0.966 263 1HB GLN 29 2HB GLN 29 -6.327 -21.222 -0.963 264 2HB GLN 29 1HB GLN 29 -6.468 -19.817 -1.989 265 1HG GLN 29 2HG GLN 29 -3.853 -20.623 -0.730 266 2HG GLN 29 1HG GLN 29 -4.414 -21.309 -2.249 267 1HE2 GLN 29 1HE2 GLN 29 -2.063 -19.733 -1.732 268 2HE2 GLN 29 2HE2 GLN 29 -2.148 -18.329 -2.740 269 H THR 30 H THR 30 -6.963 -17.201 -1.000 270 HA THR 30 HA THR 30 -4.468 -15.938 -1.317 271 HB THR 30 HB THR 30 -7.258 -14.793 -1.501 272 HG1 THR 30 1HG THR 30 -5.791 -16.534 -3.082 273 1HG2 THR 30 1HG2 THR 30 -5.484 -13.080 -1.483 274 2HG2 THR 30 2HG2 THR 30 -6.231 -13.200 -3.076 275 3HG2 THR 30 3HG2 THR 30 -4.651 -13.930 -2.785 276 H ILE 31 H ILE 31 -7.251 -15.249 0.849 277 HA ILE 31 HA ILE 31 -5.867 -13.179 2.206 278 HB ILE 31 HB ILE 31 -8.297 -13.154 2.190 279 1HG1 ILE 31 2HG1 ILE 31 -8.813 -12.863 4.613 280 2HG1 ILE 31 1HG1 ILE 31 -7.263 -13.594 4.999 281 1HG2 ILE 31 1HG2 ILE 31 -8.767 -15.498 2.083 282 2HG2 ILE 31 2HG2 ILE 31 -9.665 -14.760 3.410 283 3HG2 ILE 31 3HG2 ILE 31 -8.218 -15.712 3.744 284 1HD1 ILE 31 1HD1 ILE 31 -6.115 -11.761 3.865 285 2HD1 ILE 31 2HD1 ILE 31 -7.165 -11.176 5.155 286 3HD1 ILE 31 3HD1 ILE 31 -7.671 -11.030 3.472 287 H ASN 32 H ASN 32 -6.229 -16.600 2.787 288 HA ASN 32 HA ASN 32 -5.003 -16.707 5.328 289 1HB ASN 32 2HB ASN 32 -6.298 -18.567 4.227 290 2HB ASN 32 1HB ASN 32 -4.920 -18.823 3.167 291 1HD2 ASN 32 1HD2 ASN 32 -4.922 -18.081 6.629 292 2HD2 ASN 32 2HD2 ASN 32 -4.150 -19.526 7.118 293 H GLY 33 H GLY 33 -3.787 -16.776 2.049 294 1HA GLY 33 2HA GLY 33 -1.073 -17.273 2.554 295 2HA GLY 33 1HA GLY 33 -1.723 -16.458 1.137 296 H ILE 34 H ILE 34 -2.978 -14.319 2.614 297 HA ILE 34 HA ILE 34 -0.774 -12.578 2.961 298 HB ILE 34 HB ILE 34 -3.700 -12.146 3.682 299 1HG1 ILE 34 2HG1 ILE 34 -3.304 -12.575 1.278 300 2HG1 ILE 34 1HG1 ILE 34 -3.866 -10.936 1.582 301 1HG2 ILE 34 1HG2 ILE 34 -2.249 -10.600 4.899 302 2HG2 ILE 34 2HG2 ILE 34 -3.158 -9.744 3.652 303 3HG2 ILE 34 3HG2 ILE 34 -1.460 -10.144 3.390 304 1HD1 ILE 34 1HD1 ILE 34 -2.108 -10.981 -0.097 305 2HD1 ILE 34 2HD1 ILE 34 -1.018 -11.762 1.048 306 3HD1 ILE 34 3HD1 ILE 34 -1.573 -10.116 1.345 307 H GLU 35 H GLU 35 -2.932 -14.284 5.223 308 HA GLU 35 HA GLU 35 -2.121 -13.215 7.643 309 1HB GLU 35 2HB GLU 35 -2.666 -16.120 7.053 310 2HB GLU 35 1HB GLU 35 -2.554 -15.432 8.656 311 1HG GLU 35 2HG GLU 35 -4.524 -14.084 8.210 312 2HG GLU 35 1HG GLU 35 -4.614 -14.759 6.579 313 H LYS 36 H LYS 36 -0.505 -15.655 5.701 314 HA LYS 36 HA LYS 36 1.639 -15.782 7.690 315 1HB LYS 36 2HB LYS 36 1.105 -17.562 5.303 316 2HB LYS 36 1HB LYS 36 2.423 -17.765 6.446 317 1HG LYS 36 2HG LYS 36 -0.522 -17.976 7.071 318 2HG LYS 36 1HG LYS 36 0.611 -19.315 6.911 319 1HD LYS 36 2HD LYS 36 0.765 -17.127 8.997 320 2HD LYS 36 1HD LYS 36 0.143 -18.754 9.268 321 1HE LYS 36 2HE LYS 36 2.346 -19.683 8.715 322 2HE LYS 36 1HE LYS 36 2.960 -18.054 8.439 323 1HZ LYS 36 1HZ LYS 36 3.550 -18.851 10.646 324 2HZ LYS 36 2HZ LYS 36 1.912 -19.088 11.018 325 3HZ LYS 36 3HZ LYS 36 2.511 -17.529 10.737 326 H ASN 37 H ASN 37 0.911 -13.838 5.342 327 HA ASN 37 HA ASN 37 1.855 -12.684 3.663 328 1HB ASN 37 2HB ASN 37 3.964 -11.482 4.267 329 2HB ASN 37 1HB ASN 37 2.765 -11.451 5.543 330 1HD2 ASN 37 1HD2 ASN 37 5.907 -12.449 4.601 331 2HD2 ASN 37 2HD2 ASN 37 6.417 -13.045 6.133 332 H LYS 38 H LYS 38 1.878 -15.141 2.903 333 HA LYS 38 HA LYS 38 4.540 -15.948 1.984 334 1HB LYS 38 2HB LYS 38 3.064 -17.617 3.021 335 2HB LYS 38 1HB LYS 38 1.801 -17.232 1.868 336 1HG LYS 38 2HG LYS 38 3.337 -18.044 0.056 337 2HG LYS 38 1HG LYS 38 4.423 -18.606 1.330 338 1HD LYS 38 2HD LYS 38 2.988 -20.426 0.579 339 2HD LYS 38 1HD LYS 38 2.607 -19.993 2.248 340 1HE LYS 38 2HE LYS 38 0.730 -18.606 1.419 341 2HE LYS 38 1HE LYS 38 1.089 -19.138 -0.219 342 1HZ LYS 38 1HZ LYS 38 -0.705 -20.374 0.750 343 2HZ LYS 38 2HZ LYS 38 0.248 -20.867 2.039 344 3HZ LYS 38 3HZ LYS 38 0.600 -21.408 0.459 345 H TYR 39 H TYR 39 1.439 -14.750 1.118 346 HA TYR 39 HA TYR 39 1.431 -15.102 -1.655 347 1HB TYR 39 2HB TYR 39 -0.525 -14.788 -0.177 348 2HB TYR 39 1HB TYR 39 -0.016 -13.138 0.117 349 HD1 TYR 39 1HD TYR 39 -1.438 -15.438 -2.214 350 HD2 TYR 39 2HD TYR 39 -0.377 -11.416 -1.575 351 HE1 TYR 39 1HE TYR 39 -2.846 -14.754 -4.184 352 HE2 TYR 39 2HE TYR 39 -1.735 -10.694 -3.481 353 HH TYR 39 HH TYR 39 -3.992 -12.706 -4.982 354 H ASN 40 H ASN 40 2.988 -12.830 0.421 355 HA ASN 40 HA ASN 40 4.114 -10.911 0.191 356 1HB ASN 40 2HB ASN 40 5.421 -11.763 -1.650 357 2HB ASN 40 1HB ASN 40 4.068 -11.628 -2.763 358 1HD2 ASN 40 1HD2 ASN 40 3.647 -9.690 -3.724 359 2HD2 ASN 40 2HD2 ASN 40 4.689 -8.328 -3.672 360 HA PRO 41 HA PRO 41 0.675 -8.297 0.187 361 1HB PRO 41 2HB PRO 41 2.534 -6.091 0.741 362 2HB PRO 41 1HB PRO 41 1.238 -6.752 1.744 363 1HG PRO 41 2HG PRO 41 3.833 -7.154 2.332 364 2HG PRO 41 1HG PRO 41 2.591 -8.382 2.655 365 1HD PRO 41 2HD PRO 41 4.560 -8.227 0.403 366 2HD PRO 41 1HD PRO 41 4.052 -9.635 1.358 367 H SER 42 H SER 42 0.286 -8.420 -2.072 368 HA SER 42 HA SER 42 1.188 -6.352 -3.797 369 1HB SER 42 2HB SER 42 -1.308 -8.074 -3.882 370 2HB SER 42 1HB SER 42 -0.659 -7.130 -5.224 371 HG SER 42 HG SER 42 0.008 -9.172 -5.491 372 H LEU 43 H LEU 43 0.122 -4.315 -4.141 373 HA LEU 43 HA LEU 43 -0.965 -3.443 -1.705 374 1HB LEU 43 2HB LEU 43 0.599 -2.094 -3.113 375 2HB LEU 43 1HB LEU 43 -0.700 -1.834 -4.249 376 HG LEU 43 HG LEU 43 -0.152 0.084 -2.663 377 1HD1 LEU 43 1HD1 LEU 43 -2.471 0.738 -2.287 378 2HD1 LEU 43 2HD1 LEU 43 -2.996 -0.908 -2.640 379 3HD1 LEU 43 3HD1 LEU 43 -2.241 0.064 -3.902 380 1HD2 LEU 43 1HD2 LEU 43 -1.516 -1.717 -0.647 381 2HD2 LEU 43 2HD2 LEU 43 -1.109 -0.027 -0.385 382 3HD2 LEU 43 3HD2 LEU 43 0.167 -1.212 -0.607 383 H GLN 44 H GLN 44 -2.605 -4.040 -4.914 384 HA GLN 44 HA GLN 44 -4.966 -2.815 -4.154 385 1HB GLN 44 2HB GLN 44 -4.541 -5.173 -5.996 386 2HB GLN 44 1HB GLN 44 -5.993 -4.190 -5.919 387 1HG GLN 44 2HG GLN 44 -3.258 -3.289 -6.795 388 2HG GLN 44 1HG GLN 44 -4.649 -3.593 -7.834 389 1HE2 GLN 44 1HE2 GLN 44 -6.360 -2.130 -7.816 390 2HE2 GLN 44 2HE2 GLN 44 -6.184 -0.532 -7.183 391 H LEU 45 H LEU 45 -3.870 -6.116 -3.731 392 HA LEU 45 HA LEU 45 -6.190 -7.140 -2.507 393 1HB LEU 45 2HB LEU 45 -4.032 -8.325 -3.418 394 2HB LEU 45 1HB LEU 45 -3.418 -8.090 -1.801 395 HG LEU 45 HG LEU 45 -4.267 -10.370 -2.170 396 1HD1 LEU 45 1HD1 LEU 45 -5.947 -8.842 -0.203 397 2HD1 LEU 45 2HD1 LEU 45 -4.345 -9.520 0.090 398 3HD1 LEU 45 3HD1 LEU 45 -5.709 -10.589 -0.226 399 1HD2 LEU 45 1HD2 LEU 45 -6.659 -10.780 -2.453 400 2HD2 LEU 45 2HD2 LEU 45 -5.980 -9.878 -3.807 401 3HD2 LEU 45 3HD2 LEU 45 -6.936 -9.043 -2.582 402 H ALA 46 H ALA 46 -3.321 -5.650 -1.174 403 HA ALA 46 HA ALA 46 -3.973 -5.895 1.588 404 1HB ALA 46 1HB ALA 46 -1.688 -5.410 0.818 405 2HB ALA 46 2HB ALA 46 -2.239 -4.206 1.984 406 3HB ALA 46 3HB ALA 46 -2.214 -3.821 0.263 407 H LEU 47 H LEU 47 -4.670 -3.462 -0.832 408 HA LEU 47 HA LEU 47 -5.580 -1.327 0.670 409 1HB LEU 47 2HB LEU 47 -4.852 -1.353 -1.648 410 2HB LEU 47 1HB LEU 47 -6.176 -2.385 -2.081 411 HG LEU 47 HG LEU 47 -6.536 0.477 -1.173 412 1HD1 LEU 47 1HD1 LEU 47 -5.073 0.319 -3.124 413 2HD1 LEU 47 2HD1 LEU 47 -6.647 0.981 -3.558 414 3HD1 LEU 47 3HD1 LEU 47 -6.260 -0.698 -3.939 415 1HD2 LEU 47 1HD2 LEU 47 -8.575 -0.963 -1.105 416 2HD2 LEU 47 2HD2 LEU 47 -8.311 -1.377 -2.798 417 3HD2 LEU 47 3HD2 LEU 47 -8.679 0.289 -2.344 418 H LYS 48 H LYS 48 -7.296 -4.057 -0.816 419 HA LYS 48 HA LYS 48 -9.798 -3.100 0.085 420 1HB LYS 48 2HB LYS 48 -10.718 -5.351 -0.619 421 2HB LYS 48 1HB LYS 48 -9.929 -4.412 -1.870 422 1HG LYS 48 2HG LYS 48 -7.923 -5.814 -1.626 423 2HG LYS 48 1HG LYS 48 -8.764 -6.768 -0.402 424 1HD LYS 48 2HD LYS 48 -8.848 -7.856 -2.594 425 2HD LYS 48 1HD LYS 48 -10.460 -7.396 -2.042 426 1HE LYS 48 2HE LYS 48 -10.274 -6.844 -4.370 427 2HE LYS 48 1HE LYS 48 -10.293 -5.349 -3.439 428 1HZ LYS 48 1HZ LYS 48 -7.791 -5.365 -3.659 429 2HZ LYS 48 2HZ LYS 48 -8.675 -5.104 -5.043 430 3HZ LYS 48 3HZ LYS 48 -7.994 -6.641 -4.786 431 H ILE 49 H ILE 49 -7.527 -5.356 1.391 432 HA ILE 49 HA ILE 49 -9.060 -6.303 3.554 433 HB ILE 49 HB ILE 49 -6.074 -5.739 3.499 434 1HG1 ILE 49 2HG1 ILE 49 -7.564 -8.321 2.977 435 2HG1 ILE 49 1HG1 ILE 49 -6.811 -7.313 1.749 436 1HG2 ILE 49 1HG2 ILE 49 -7.679 -7.465 5.377 437 2HG2 ILE 49 2HG2 ILE 49 -6.875 -5.946 5.774 438 3HG2 ILE 49 3HG2 ILE 49 -5.919 -7.361 5.339 439 1HD1 ILE 49 1HD1 ILE 49 -5.385 -8.741 3.980 440 2HD1 ILE 49 2HD1 ILE 49 -4.623 -7.729 2.753 441 3HD1 ILE 49 3HD1 ILE 49 -5.424 -9.231 2.286 442 H ALA 50 H ALA 50 -7.028 -3.472 3.165 443 HA ALA 50 HA ALA 50 -7.105 -2.407 5.754 444 1HB ALA 50 1HB ALA 50 -6.455 -0.312 4.719 445 2HB ALA 50 2HB ALA 50 -6.952 -0.940 3.148 446 3HB ALA 50 3HB ALA 50 -5.568 -1.658 3.981 447 H TYR 51 H TYR 51 -9.149 -1.838 2.947 448 HA TYR 51 HA TYR 51 -10.794 0.046 4.242 449 1HB TYR 51 2HB TYR 51 -10.694 0.224 1.893 450 2HB TYR 51 1HB TYR 51 -11.070 -1.481 1.665 451 HD1 TYR 51 1HD TYR 51 -13.192 -2.145 1.303 452 HD2 TYR 51 2HD TYR 51 -12.558 1.709 2.914 453 HE1 TYR 51 1HE TYR 51 -15.624 -1.679 1.110 454 HE2 TYR 51 2HE TYR 51 -14.961 2.208 2.730 455 HH TYR 51 HH TYR 51 -16.898 1.450 1.491 456 H TYR 52 H TYR 52 -11.362 -3.425 3.504 457 HA TYR 52 HA TYR 52 -13.968 -3.284 4.625 458 1HB TYR 52 2HB TYR 52 -12.335 -5.661 3.772 459 2HB TYR 52 1HB TYR 52 -13.946 -5.817 4.460 460 HD1 TYR 52 1HD TYR 52 -15.836 -4.468 3.276 461 HD2 TYR 52 2HD TYR 52 -12.098 -5.366 1.472 462 HE1 TYR 52 1HE TYR 52 -16.833 -4.130 1.053 463 HE2 TYR 52 2HE TYR 52 -13.068 -5.028 -0.745 464 HH TYR 52 HH TYR 52 -15.333 -5.175 -1.742 465 H LEU 53 H LEU 53 -10.954 -4.216 5.933 466 HA LEU 53 HA LEU 53 -12.194 -4.963 8.479 467 1HB LEU 53 2HB LEU 53 -9.276 -4.668 7.759 468 2HB LEU 53 1HB LEU 53 -9.832 -5.078 9.369 469 1HD1 LEU 53 1HD1 LEU 53 -8.443 -7.119 9.272 470 2HD1 LEU 53 2HD1 LEU 53 -7.931 -6.724 7.631 471 3HD1 LEU 53 3HD1 LEU 53 -8.680 -8.285 7.973 472 1HD2 LEU 53 1HD2 LEU 53 -12.080 -6.987 8.495 473 2HD2 LEU 53 2HD2 LEU 53 -10.913 -7.305 9.779 474 3HD2 LEU 53 3HD2 LEU 53 -11.085 -8.442 8.442 475 H ASN 54 H ASN 54 -11.420 -2.222 6.925 476 HA ASN 54 HA ASN 54 -10.895 -0.111 7.336 477 1HB ASN 54 2HB ASN 54 -13.288 -0.175 7.964 478 2HB ASN 54 1HB ASN 54 -12.826 -0.458 9.641 479 1HD2 ASN 54 1HD2 ASN 54 -12.945 1.882 7.049 480 2HD2 ASN 54 2HD2 ASN 54 -12.634 3.257 8.060 481 H THR 55 H THR 55 -8.791 -0.662 7.780 482 HA THR 55 HA THR 55 -7.918 0.372 10.318 483 HB THR 55 HB THR 55 -7.141 -2.431 9.376 484 HG1 THR 55 1HG THR 55 -9.177 -1.644 10.733 485 1HG2 THR 55 1HG2 THR 55 -5.870 -2.575 11.477 486 2HG2 THR 55 2HG2 THR 55 -6.307 -0.908 11.856 487 3HG2 THR 55 3HG2 THR 55 -5.272 -1.255 10.470 488 HA PRO 56 HA PRO 56 -5.015 2.217 7.437 489 1HB PRO 56 2HB PRO 56 -2.985 2.610 9.296 490 2HB PRO 56 1HB PRO 56 -4.320 3.727 9.000 491 1HG PRO 56 2HG PRO 56 -4.011 1.664 11.132 492 2HG PRO 56 1HG PRO 56 -4.694 3.296 11.240 493 1HD PRO 56 2HD PRO 56 -6.265 1.146 11.154 494 2HD PRO 56 1HD PRO 56 -6.716 2.640 10.305 495 H LEU 57 H LEU 57 -3.450 1.428 6.172 496 HA LEU 57 HA LEU 57 -2.578 -1.208 6.244 497 1HB LEU 57 2HB LEU 57 -1.312 1.177 4.919 498 2HB LEU 57 1HB LEU 57 -0.749 -0.461 4.679 499 1HD1 LEU 57 1HD2 LEU 57 -1.139 0.056 2.219 500 2HD1 LEU 57 2HD2 LEU 57 -1.857 1.611 2.639 501 3HD1 LEU 57 3HD2 LEU 57 -2.775 0.447 1.682 502 1HD2 LEU 57 1HD1 LEU 57 -3.376 -1.895 4.482 503 2HD2 LEU 57 2HD1 LEU 57 -2.062 -2.054 3.317 504 3HD2 LEU 57 3HD1 LEU 57 -3.678 -1.603 2.771 505 H GLU 58 H GLU 58 -0.989 1.665 7.532 506 HA GLU 58 HA GLU 58 1.451 0.615 8.283 507 1HB GLU 58 2HB GLU 58 -0.231 2.738 9.618 508 2HB GLU 58 1HB GLU 58 1.482 2.475 9.915 509 1HG GLU 58 2HG GLU 58 2.060 3.142 7.721 510 2HG GLU 58 1HG GLU 58 0.379 3.098 7.193 511 H ASP 59 H ASP 59 -1.689 0.347 9.895 512 HA ASP 59 HA ASP 59 -0.670 -0.630 12.392 513 1HB ASP 59 2HB ASP 59 -2.929 0.507 11.988 514 2HB ASP 59 1HB ASP 59 -3.457 -1.001 11.265 515 H ILE 60 H ILE 60 -1.898 -1.929 9.451 516 HA ILE 60 HA ILE 60 -2.109 -4.729 10.264 517 HB ILE 60 HB ILE 60 -2.177 -3.615 7.444 518 1HG1 ILE 60 2HG1 ILE 60 -4.503 -4.114 9.324 519 2HG1 ILE 60 1HG1 ILE 60 -3.889 -2.528 8.883 520 1HG2 ILE 60 1HG2 ILE 60 -1.831 -6.028 7.579 521 2HG2 ILE 60 2HG2 ILE 60 -3.446 -5.672 6.964 522 3HG2 ILE 60 3HG2 ILE 60 -3.235 -6.184 8.636 523 1HD1 ILE 60 1HD1 ILE 60 -5.904 -3.077 7.639 524 2HD1 ILE 60 2HD1 ILE 60 -5.129 -4.528 7.002 525 3HD1 ILE 60 3HD1 ILE 60 -4.518 -2.933 6.557 526 H PHE 61 H PHE 61 -0.041 -3.045 7.993 527 HA PHE 61 HA PHE 61 1.801 -5.325 8.258 528 1HB PHE 61 2HB PHE 61 1.516 -3.370 5.929 529 2HB PHE 61 1HB PHE 61 2.727 -4.640 6.062 530 HD1 PHE 61 1HD PHE 61 1.960 -7.028 6.058 531 HD2 PHE 61 2HD PHE 61 -0.622 -3.774 5.134 532 HE1 PHE 61 1HE PHE 61 0.415 -8.577 4.933 533 HE2 PHE 61 2HE PHE 61 -2.174 -5.318 4.013 534 HZ PHE 61 HZ PHE 61 -1.657 -7.722 3.911 535 H GLN 62 H GLN 62 3.848 -4.979 8.832 536 HA GLN 62 HA GLN 62 4.621 -2.226 9.293 537 1HB GLN 62 2HB GLN 62 4.458 -3.580 11.354 538 2HB GLN 62 1HB GLN 62 5.550 -4.765 10.657 539 1HG GLN 62 2HG GLN 62 7.351 -3.171 10.655 540 2HG GLN 62 1HG GLN 62 6.261 -1.902 11.214 541 1HE2 GLN 62 1HE2 GLN 62 8.684 -3.006 12.397 542 2HE2 GLN 62 2HE2 GLN 62 8.232 -3.506 13.991 543 H TRP 63 H TRP 63 6.183 -1.572 8.135 544 HA TRP 63 HA TRP 63 7.581 -3.524 6.488 545 1HB TRP 63 2HB TRP 63 7.756 -1.402 4.933 546 2HB TRP 63 1HB TRP 63 6.341 -2.445 4.925 547 HD1 TRP 63 HD TRP 63 7.403 0.812 6.811 548 HE1 TRP 63 1HE TRP 63 5.331 2.308 7.013 549 HE3 TRP 63 3HE TRP 63 3.993 -2.280 4.587 550 HZ2 TRP 63 2HZ TRP 63 2.587 2.180 6.297 551 HZ3 TRP 63 3HZ TRP 63 1.668 -1.514 4.385 552 HH2 TRP 63 HH TRP 63 0.985 0.667 5.223 553 H GLN 64 H GLN 64 9.762 -3.464 6.357 554 HA GLN 64 HA GLN 64 11.074 -1.405 7.936 555 1HB GLN 64 2HB GLN 64 11.821 -4.305 7.479 556 2HB GLN 64 1HB GLN 64 12.686 -3.152 8.488 557 1HG GLN 64 2HG GLN 64 9.853 -4.045 8.982 558 2HG GLN 64 1HG GLN 64 11.267 -4.770 9.741 559 1HE2 GLN 64 1HE2 GLN 64 12.714 -2.391 10.109 560 2HE2 GLN 64 2HE2 GLN 64 11.903 -1.430 11.291 561 HA PRO 65 HA PRO 65 12.842 -1.091 3.647 562 1HB PRO 65 2HB PRO 65 13.316 1.693 4.485 563 2HB PRO 65 1HB PRO 65 12.450 1.109 3.063 564 1HG PRO 65 2HG PRO 65 11.187 2.293 5.127 565 2HG PRO 65 1HG PRO 65 10.432 1.002 4.174 566 1HD PRO 65 2HD PRO 65 11.721 0.871 6.873 567 2HD PRO 65 1HD PRO 65 10.245 0.071 6.289 568 H GLU 66 H GLU 66 13.674 0.416 6.538 569 HA GLU 66 HA GLU 66 16.538 -0.256 6.269 570 1HB GLU 66 2HB GLU 66 15.288 2.018 7.837 571 2HB GLU 66 1HB GLU 66 16.994 1.610 7.855 572 1HG GLU 66 2HG GLU 66 15.419 2.561 5.472 573 2HG GLU 66 1HG GLU 66 16.560 3.512 6.422 574 1H MET 67 1HT MET 67 -12.493 1.959 -8.149 575 2H MET 67 2HT MET 67 -12.202 3.292 -7.155 576 3H MET 67 3HT MET 67 -11.283 1.917 -6.960 577 HA MET 67 HA MET 67 -10.313 2.181 -9.126 578 1HB MET 67 2HB MET 67 -11.881 4.766 -9.111 579 2HB MET 67 1HB MET 67 -10.557 4.429 -10.216 580 1HG MET 67 2HG MET 67 -13.152 2.947 -10.007 581 2HG MET 67 1HG MET 67 -12.688 4.070 -11.285 582 1HE MET 67 1HE MET 67 -13.290 2.237 -13.129 583 2HE MET 67 2HE MET 67 -13.756 1.110 -11.855 584 3HE MET 67 3HE MET 67 -12.644 0.595 -13.123 585 H ILE 68 H ILE 68 -8.381 3.372 -9.344 586 HA ILE 68 HA ILE 68 -7.509 4.461 -6.779 587 HB ILE 68 HB ILE 68 -5.868 3.555 -9.169 588 1HG1 ILE 68 2HG1 ILE 68 -7.003 1.662 -8.129 589 2HG1 ILE 68 1HG1 ILE 68 -5.276 1.596 -7.804 590 1HG2 ILE 68 1HG2 ILE 68 -4.972 4.305 -6.385 591 2HG2 ILE 68 2HG2 ILE 68 -4.695 5.237 -7.855 592 3HG2 ILE 68 3HG2 ILE 68 -3.935 3.657 -7.658 593 1HD1 ILE 68 1HD1 ILE 68 -6.572 0.984 -5.849 594 2HD1 ILE 68 2HD1 ILE 68 -7.403 2.540 -5.898 595 3HD1 ILE 68 3HD1 ILE 68 -5.672 2.473 -5.563 596 H ILE 69 H ILE 69 -6.973 6.527 -6.587 597 HA ILE 69 HA ILE 69 -6.712 8.188 -8.977 598 HB ILE 69 HB ILE 69 -7.763 8.948 -6.205 599 1HG1 ILE 69 2HG1 ILE 69 -9.802 9.789 -7.525 600 2HG1 ILE 69 1HG1 ILE 69 -9.172 8.872 -8.883 601 1HG2 ILE 69 1HG2 ILE 69 -6.357 10.714 -7.026 602 2HG2 ILE 69 2HG2 ILE 69 -8.045 11.230 -7.047 603 3HG2 ILE 69 3HG2 ILE 69 -7.249 10.759 -8.549 604 1HD1 ILE 69 1HD1 ILE 69 -9.393 6.813 -7.577 605 2HD1 ILE 69 2HD1 ILE 69 -10.930 7.664 -7.735 606 3HD1 ILE 69 3HD1 ILE 69 -10.025 7.749 -6.221 607 H ASN 70 H ASN 70 -4.645 9.208 -9.035 608 HA ASN 70 HA ASN 70 -3.024 8.553 -6.719 609 1HB ASN 70 2HB ASN 70 -2.375 7.425 -8.796 610 2HB ASN 70 1HB ASN 70 -2.255 8.983 -9.607 611 1HD2 ASN 70 1HD2 ASN 70 -0.115 8.639 -10.084 612 2HD2 ASN 70 2HD2 ASN 70 1.123 8.673 -8.884 613 H ASN 71 H ASN 71 -2.049 10.165 -5.636 614 HA ASN 71 HA ASN 71 -2.460 12.898 -6.645 615 1HB ASN 71 2HB ASN 71 -2.257 11.886 -3.797 616 2HB ASN 71 1HB ASN 71 -2.398 13.567 -4.268 617 1HD2 ASN 71 1HD2 ASN 71 -4.020 11.861 -2.587 618 2HD2 ASN 71 2HD2 ASN 71 -5.629 11.966 -3.196 619 H LEU 72 H LEU 72 -0.207 10.728 -6.763 620 HA LEU 72 HA LEU 72 2.005 11.181 -5.296 621 1HB LEU 72 2HB LEU 72 1.616 9.589 -7.206 622 2HB LEU 72 1HB LEU 72 2.088 10.869 -8.303 623 HG LEU 72 HG LEU 72 3.868 9.234 -7.993 624 1HD1 LEU 72 1HD1 LEU 72 4.620 11.824 -6.674 625 2HD1 LEU 72 2HD1 LEU 72 4.621 11.490 -8.403 626 3HD1 LEU 72 3HD1 LEU 72 5.741 10.635 -7.337 627 1HD2 LEU 72 1HD2 LEU 72 3.740 9.947 -5.083 628 2HD2 LEU 72 2HD2 LEU 72 4.955 8.913 -5.837 629 3HD2 LEU 72 3HD2 LEU 72 3.263 8.417 -5.815 630 H LYS 73 H LYS 73 1.315 13.025 -8.283 631 HA LYS 73 HA LYS 73 3.505 14.761 -7.948 632 1HB LYS 73 2HB LYS 73 2.389 16.256 -9.621 633 2HB LYS 73 1HB LYS 73 2.586 14.594 -10.150 634 1HG LYS 73 2HG LYS 73 0.286 14.136 -9.895 635 2HG LYS 73 1HG LYS 73 0.020 15.616 -8.972 636 1HD LYS 73 2HD LYS 73 -0.831 15.872 -11.232 637 2HD LYS 73 1HD LYS 73 0.537 16.943 -10.968 638 1HE LYS 73 2HE LYS 73 1.987 15.325 -12.141 639 2HE LYS 73 1HE LYS 73 0.575 14.310 -12.440 640 1HZ LYS 73 1HZ LYS 73 1.043 17.057 -13.441 641 2HZ LYS 73 2HZ LYS 73 -0.423 16.259 -13.590 642 3HZ LYS 73 3HZ LYS 73 0.948 15.647 -14.389 643 H LEU 74 H LEU 74 0.125 15.108 -6.932 644 HA LEU 74 HA LEU 74 0.216 17.723 -6.036 645 1HB LEU 74 2HB LEU 74 -1.810 16.314 -6.444 646 2HB LEU 74 1HB LEU 74 -1.440 15.401 -5.007 647 HG LEU 74 HG LEU 74 -3.321 17.055 -4.816 648 1HD1 LEU 74 1HD1 LEU 74 -1.026 17.460 -2.919 649 2HD1 LEU 74 2HD1 LEU 74 -2.270 16.213 -2.814 650 3HD1 LEU 74 3HD1 LEU 74 -2.703 17.912 -2.619 651 1HD2 LEU 74 1HD2 LEU 74 -2.761 19.421 -4.525 652 2HD2 LEU 74 2HD2 LEU 74 -2.377 18.847 -6.149 653 3HD2 LEU 74 3HD2 LEU 74 -1.088 19.071 -4.965 654 H ILE 75 H ILE 75 0.923 14.716 -4.347 655 HA ILE 75 HA ILE 75 1.528 15.922 -1.878 656 HB ILE 75 HB ILE 75 2.114 13.188 -2.992 657 1HG1 ILE 75 2HG1 ILE 75 0.879 12.439 -1.012 658 2HG1 ILE 75 1HG1 ILE 75 0.799 14.090 -0.424 659 1HG2 ILE 75 1HG2 ILE 75 3.301 12.515 -0.947 660 2HG2 ILE 75 2HG2 ILE 75 3.333 14.202 -0.424 661 3HG2 ILE 75 3HG2 ILE 75 4.204 13.713 -1.874 662 1HD1 ILE 75 1HD1 ILE 75 -0.609 14.679 -2.326 663 2HD1 ILE 75 2HD1 ILE 75 -1.305 13.372 -1.366 664 3HD1 ILE 75 3HD1 ILE 75 -0.511 13.015 -2.902 665 H ARG 76 H ARG 76 3.476 15.328 -4.657 666 HA ARG 76 HA ARG 76 5.966 16.116 -3.501 667 1HB ARG 76 2HB ARG 76 5.135 16.491 -6.378 668 2HB ARG 76 1HB ARG 76 6.766 16.627 -5.750 669 1HG ARG 76 2HG ARG 76 6.585 14.213 -5.104 670 2HG ARG 76 1HG ARG 76 5.086 14.170 -6.038 671 1HD ARG 76 2HD ARG 76 7.847 14.837 -7.034 672 2HD ARG 76 1HD ARG 76 6.861 13.444 -7.466 673 HE ARG 76 HE ARG 76 5.869 16.127 -8.123 674 1HH1 ARG 76 1HH1 ARG 76 7.270 13.094 -9.256 675 2HH1 ARG 76 2HH1 ARG 76 6.857 13.327 -10.881 676 1HH2 ARG 76 1HH2 ARG 76 5.389 16.530 -10.310 677 2HH2 ARG 76 2HH2 ARG 76 5.786 15.386 -11.531 678 H GLU 77 H GLU 77 3.218 17.969 -4.911 679 HA GLU 77 HA GLU 77 4.512 20.408 -4.764 680 1HB GLU 77 2HB GLU 77 1.606 19.657 -4.968 681 2HB GLU 77 1HB GLU 77 2.265 21.275 -5.198 682 1HG GLU 77 2HG GLU 77 3.652 20.414 -7.038 683 2HG GLU 77 1HG GLU 77 2.895 18.846 -6.834 684 H LYS 78 H LYS 78 2.367 18.663 -2.547 685 HA LYS 78 HA LYS 78 2.105 20.536 -0.549 686 1HB LYS 78 2HB LYS 78 2.519 17.562 -0.211 687 2HB LYS 78 1HB LYS 78 1.933 18.635 1.055 688 1HG LYS 78 2HG LYS 78 -0.018 19.179 -0.283 689 2HG LYS 78 1HG LYS 78 0.581 18.157 -1.584 690 1HD LYS 78 2HD LYS 78 -1.172 17.050 -0.262 691 2HD LYS 78 1HD LYS 78 0.368 16.193 -0.168 692 1HE LYS 78 2HE LYS 78 0.781 17.035 2.021 693 2HE LYS 78 1HE LYS 78 -0.571 18.162 1.910 694 1HZ LYS 78 1HZ LYS 78 -0.895 15.202 1.838 695 2HZ LYS 78 2HZ LYS 78 -2.096 16.342 1.921 696 3HZ LYS 78 3HZ LYS 78 -1.060 16.127 3.238 697 H LYS 79 H LYS 79 4.798 18.460 -1.100 698 HA LYS 79 HA LYS 79 6.442 20.033 0.796 699 1HB LYS 79 2HB LYS 79 7.128 17.450 -0.686 700 2HB LYS 79 1HB LYS 79 8.127 18.215 0.547 701 1HG LYS 79 2HG LYS 79 5.410 16.968 0.960 702 2HG LYS 79 1HG LYS 79 6.963 16.332 1.515 703 1HD LYS 79 2HD LYS 79 7.254 18.180 3.019 704 2HD LYS 79 1HD LYS 79 5.860 19.012 2.346 705 1HE LYS 79 2HE LYS 79 5.281 18.038 4.478 706 2HE LYS 79 1HE LYS 79 4.408 17.213 3.192 707 1HZ LYS 79 1HZ LYS 79 6.883 16.207 4.477 708 2HZ LYS 79 2HZ LYS 79 5.950 15.367 3.354 709 3HZ LYS 79 3HZ LYS 79 5.326 15.724 4.883 710 H LYS 80 H LYS 80 9.153 20.066 -0.962 711 HA LYS 80 HA LYS 80 7.935 20.385 -3.417 712 1HB LYS 80 2HB LYS 80 9.250 22.483 -3.805 713 2HB LYS 80 1HB LYS 80 7.942 22.665 -2.663 714 1HG LYS 80 2HG LYS 80 10.859 22.398 -1.921 715 2HG LYS 80 1HG LYS 80 10.000 23.923 -2.094 716 1HD LYS 80 2HD LYS 80 8.478 23.233 -0.270 717 2HD LYS 80 1HD LYS 80 9.412 21.745 -0.084 718 1HE LYS 80 2HE LYS 80 10.168 23.292 1.566 719 2HE LYS 80 1HE LYS 80 11.426 23.156 0.338 720 1HZ LYS 80 1HZ LYS 80 11.217 25.444 0.782 721 2HZ LYS 80 2HZ LYS 80 9.547 25.371 0.821 722 3HZ LYS 80 3HZ LYS 80 10.314 25.284 -0.651 723 H ILE 81 H ILE 81 8.724 18.426 -3.812 724 HA ILE 81 HA ILE 81 11.592 18.424 -4.416 725 HB ILE 81 HB ILE 81 10.042 15.961 -3.491 726 1HG1 ILE 81 2HG1 ILE 81 12.041 17.617 -1.916 727 2HG1 ILE 81 1HG1 ILE 81 10.307 17.590 -1.631 728 1HG2 ILE 81 1HG2 ILE 81 11.949 15.497 -4.963 729 2HG2 ILE 81 2HG2 ILE 81 12.273 14.937 -3.325 730 3HG2 ILE 81 3HG2 ILE 81 13.004 16.435 -3.904 731 1HD1 ILE 81 1HD1 ILE 81 12.192 15.260 -1.319 732 2HD1 ILE 81 2HD1 ILE 81 10.453 15.223 -1.026 733 3HD1 ILE 81 3HD1 ILE 81 11.496 16.221 -0.015 734 H SER 82 H SER 82 12.111 17.390 -6.371 735 HA SER 82 HA SER 82 9.835 17.055 -8.161 736 1HB SER 82 2HB SER 82 12.723 17.692 -8.748 737 2HB SER 82 1HB SER 82 11.415 17.630 -9.933 738 HG SER 82 HG SER 82 11.246 19.295 -7.665 739 H GLN 83 H GLN 83 10.633 15.597 -10.138 740 HA GLN 83 HA GLN 83 10.674 13.061 -8.883 741 1HB GLN 83 2HB GLN 83 10.364 12.025 -11.189 742 2HB GLN 83 1HB GLN 83 9.078 12.995 -10.515 743 1HG GLN 83 2HG GLN 83 9.215 13.477 -12.824 744 2HG GLN 83 1HG GLN 83 9.836 14.875 -11.963 745 1HE2 GLN 83 1HE2 GLN 83 10.594 12.200 -13.996 746 2HE2 GLN 83 2HE2 GLN 83 12.135 12.758 -14.527 747 H SER 84 H SER 84 13.302 14.710 -10.535 748 HA SER 84 HA SER 84 14.781 12.411 -11.151 749 1HB SER 84 2HB SER 84 15.794 15.173 -10.508 750 2HB SER 84 1HB SER 84 16.545 13.960 -11.552 751 HG SER 84 HG SER 84 14.485 15.708 -12.017 752 H GLU 85 H GLU 85 14.851 14.664 -8.468 753 HA GLU 85 HA GLU 85 16.908 13.320 -7.115 754 1HB GLU 85 2HB GLU 85 16.010 14.831 -5.114 755 2HB GLU 85 1HB GLU 85 16.984 15.479 -6.411 756 1HG GLU 85 2HG GLU 85 13.970 15.626 -6.339 757 2HG GLU 85 1HG GLU 85 15.034 16.883 -5.711 758 H LEU 86 H LEU 86 13.419 13.188 -6.841 759 HA LEU 86 HA LEU 86 13.359 11.451 -4.638 760 1HB LEU 86 2HB LEU 86 11.451 11.825 -6.928 761 2HB LEU 86 1HB LEU 86 11.165 10.633 -5.677 762 HG LEU 86 HG LEU 86 11.405 13.607 -5.227 763 1HD1 LEU 86 1HD1 LEU 86 9.006 11.777 -5.218 764 2HD1 LEU 86 2HD1 LEU 86 9.372 13.003 -6.432 765 3HD1 LEU 86 3HD1 LEU 86 9.001 13.486 -4.778 766 1HD2 LEU 86 1HD2 LEU 86 12.169 12.288 -3.314 767 2HD2 LEU 86 2HD2 LEU 86 10.673 11.355 -3.350 768 3HD2 LEU 86 3HD2 LEU 86 10.631 13.077 -2.968 769 H ALA 87 H ALA 87 13.648 10.846 -8.097 770 HA ALA 87 HA ALA 87 13.440 8.070 -8.056 771 1HB ALA 87 1HB ALA 87 15.081 9.798 -9.906 772 2HB ALA 87 2HB ALA 87 13.378 9.383 -10.117 773 3HB ALA 87 3HB ALA 87 14.612 8.125 -10.202 774 H ALA 88 H ALA 88 16.287 10.186 -7.696 775 HA ALA 88 HA ALA 88 18.172 8.132 -7.488 776 1HB ALA 88 1HB ALA 88 18.751 10.465 -7.951 777 2HB ALA 88 2HB ALA 88 19.637 9.844 -6.558 778 3HB ALA 88 3HB ALA 88 18.254 10.913 -6.319 779 H LEU 89 H LEU 89 16.231 9.773 -5.052 780 HA LEU 89 HA LEU 89 17.432 8.562 -2.793 781 1HB LEU 89 2HB LEU 89 14.641 9.660 -3.139 782 2HB LEU 89 1HB LEU 89 15.351 9.216 -1.602 783 HG LEU 89 HG LEU 89 16.358 11.417 -3.408 784 1HD1 LEU 89 1HD1 LEU 89 15.475 12.929 -1.700 785 2HD1 LEU 89 2HD1 LEU 89 14.789 11.551 -0.837 786 3HD1 LEU 89 3HD1 LEU 89 14.196 11.970 -2.445 787 1HD2 LEU 89 1HD2 LEU 89 17.157 10.617 -0.610 788 2HD2 LEU 89 2HD2 LEU 89 17.750 12.030 -1.485 789 3HD2 LEU 89 3HD2 LEU 89 18.130 10.408 -2.064 790 H LEU 90 H LEU 90 14.747 7.638 -4.863 791 HA LEU 90 HA LEU 90 13.997 5.364 -3.251 792 1HB LEU 90 2HB LEU 90 13.126 6.033 -6.044 793 2HB LEU 90 1HB LEU 90 12.309 5.000 -4.894 794 HG LEU 90 HG LEU 90 12.587 7.992 -4.758 795 1HD1 LEU 90 1HD1 LEU 90 10.180 8.006 -5.097 796 2HD1 LEU 90 2HD1 LEU 90 10.208 6.255 -5.300 797 3HD1 LEU 90 3HD1 LEU 90 11.052 7.290 -6.452 798 1HD2 LEU 90 1HD2 LEU 90 11.154 6.123 -2.878 799 2HD2 LEU 90 2HD2 LEU 90 11.058 7.882 -2.845 800 3HD2 LEU 90 3HD2 LEU 90 12.591 7.077 -2.513 801 H GLU 91 H GLU 91 16.442 5.934 -5.434 802 HA GLU 91 HA GLU 91 17.874 4.705 -6.652 803 1HB GLU 91 2HB GLU 91 16.754 2.442 -4.991 804 2HB GLU 91 1HB GLU 91 18.116 2.261 -6.087 805 1HG GLU 91 2HG GLU 91 17.998 4.061 -3.677 806 2HG GLU 91 1HG GLU 91 18.853 2.525 -3.789 807 H VAL 92 H VAL 92 15.484 5.358 -7.908 808 HA VAL 92 HA VAL 92 15.180 3.088 -9.700 809 HB VAL 92 HB VAL 92 12.834 3.751 -10.091 810 1HG1 VAL 92 1HG1 VAL 92 13.396 3.167 -7.195 811 2HG1 VAL 92 2HG1 VAL 92 13.227 1.988 -8.499 812 3HG1 VAL 92 3HG1 VAL 92 11.839 2.958 -8.000 813 1HG2 VAL 92 1HG2 VAL 92 11.688 5.315 -8.549 814 2HG2 VAL 92 2HG2 VAL 92 12.936 6.102 -9.512 815 3HG2 VAL 92 3HG2 VAL 92 13.249 5.705 -7.825 816 H SER 93 H SER 93 14.268 3.978 -11.839 817 HA SER 93 HA SER 93 15.939 6.162 -12.647 818 1HB SER 93 2HB SER 93 13.787 4.729 -14.213 819 2HB SER 93 1HB SER 93 15.180 5.603 -14.853 820 HG SER 93 HG SER 93 16.391 3.945 -13.471 821 H ARG 94 H ARG 94 14.990 8.068 -13.807 822 HA ARG 94 HA ARG 94 12.996 9.411 -12.319 823 1HB ARG 94 2HB ARG 94 13.894 9.963 -15.157 824 2HB ARG 94 1HB ARG 94 13.017 11.082 -14.125 825 1HG ARG 94 2HG ARG 94 14.916 11.207 -12.618 826 2HG ARG 94 1HG ARG 94 15.785 10.027 -13.602 827 1HD ARG 94 2HD ARG 94 16.566 12.215 -14.171 828 2HD ARG 94 1HD ARG 94 15.632 11.583 -15.521 829 HE ARG 94 HE ARG 94 14.284 13.328 -13.612 830 1HH1 ARG 94 1HH1 ARG 94 15.690 12.968 -16.856 831 2HH1 ARG 94 2HH1 ARG 94 15.130 14.475 -17.401 832 1HH2 ARG 94 1HH2 ARG 94 13.478 15.319 -14.362 833 2HH2 ARG 94 2HH2 ARG 94 13.829 15.888 -15.940 834 H GLN 95 H GLN 95 12.955 7.570 -15.200 835 HA GLN 95 HA GLN 95 10.282 7.937 -16.041 836 1HB GLN 95 2HB GLN 95 11.989 7.050 -17.491 837 2HB GLN 95 1HB GLN 95 12.214 5.665 -16.444 838 1HG GLN 95 2HG GLN 95 9.975 4.876 -17.019 839 2HG GLN 95 1HG GLN 95 9.758 6.282 -18.067 840 1HE2 GLN 95 1HE2 GLN 95 9.829 3.399 -18.671 841 2HE2 GLN 95 2HE2 GLN 95 11.056 3.199 -19.868 842 H THR 96 H THR 96 11.739 5.776 -13.644 843 HA THR 96 HA THR 96 9.612 3.944 -13.448 844 HB THR 96 HB THR 96 11.595 4.714 -11.305 845 HG1 THR 96 1HG THR 96 11.904 2.874 -13.468 846 1HG2 THR 96 1HG2 THR 96 9.812 3.163 -10.622 847 2HG2 THR 96 2HG2 THR 96 11.380 2.355 -10.658 848 3HG2 THR 96 3HG2 THR 96 10.223 2.097 -11.966 849 H ILE 97 H ILE 97 10.599 6.686 -11.341 850 HA ILE 97 HA ILE 97 8.292 6.602 -9.775 851 HB ILE 97 HB ILE 97 10.392 7.645 -9.028 852 1HG1 ILE 97 2HG1 ILE 97 8.199 8.411 -7.962 853 2HG1 ILE 97 1HG1 ILE 97 9.580 9.459 -7.720 854 1HG2 ILE 97 1HG2 ILE 97 11.194 8.636 -11.009 855 2HG2 ILE 97 2HG2 ILE 97 11.124 9.858 -9.739 856 3HG2 ILE 97 3HG2 ILE 97 9.895 9.828 -11.004 857 1HD1 ILE 97 1HD1 ILE 97 7.319 9.916 -9.669 858 2HD1 ILE 97 2HD1 ILE 97 8.700 10.986 -9.432 859 3HD1 ILE 97 3HD1 ILE 97 7.548 10.733 -8.121 860 H ASN 98 H ASN 98 8.987 8.331 -12.717 861 HA ASN 98 HA ASN 98 6.617 9.869 -12.758 862 1HB ASN 98 2HB ASN 98 8.548 10.392 -14.194 863 2HB ASN 98 1HB ASN 98 8.227 8.940 -15.139 864 1HD2 ASN 98 1HD2 ASN 98 6.990 12.044 -14.204 865 2HD2 ASN 98 2HD2 ASN 98 5.979 12.314 -15.561 866 H GLY 99 H GLY 99 7.322 6.639 -14.001 867 1HA GLY 99 2HA GLY 99 4.860 6.146 -15.228 868 2HA GLY 99 1HA GLY 99 5.925 4.922 -14.544 869 H ILE 100 H ILE 100 5.884 5.882 -11.809 870 HA ILE 100 HA ILE 100 3.528 4.780 -10.834 871 HB ILE 100 HB ILE 100 5.560 6.595 -9.489 872 1HG1 ILE 100 2HG1 ILE 100 6.539 4.495 -10.275 873 2HG1 ILE 100 1HG1 ILE 100 6.475 4.532 -8.519 874 1HG2 ILE 100 1HG2 ILE 100 3.478 6.670 -8.256 875 2HG2 ILE 100 2HG2 ILE 100 4.703 5.786 -7.348 876 3HG2 ILE 100 3HG2 ILE 100 3.428 4.908 -8.193 877 1HD1 ILE 100 1HD1 ILE 100 4.499 3.080 -8.571 878 2HD1 ILE 100 2HD1 ILE 100 5.885 2.338 -9.369 879 3HD1 ILE 100 3HD1 ILE 100 4.587 3.039 -10.334 880 H GLU 101 H GLU 101 4.555 8.145 -11.245 881 HA GLU 101 HA GLU 101 2.399 9.573 -10.246 882 1HB GLU 101 2HB GLU 101 3.769 10.138 -12.856 883 2HB GLU 101 1HB GLU 101 2.768 11.259 -11.970 884 1HG GLU 101 2HG GLU 101 4.416 11.344 -10.211 885 2HG GLU 101 1HG GLU 101 5.410 10.158 -11.079 886 H LYS 102 H LYS 102 2.636 7.886 -13.331 887 HA LYS 102 HA LYS 102 0.107 8.971 -14.230 888 1HB LYS 102 2HB LYS 102 2.006 7.033 -15.566 889 2HB LYS 102 1HB LYS 102 0.660 7.869 -16.329 890 1HG LYS 102 2HG LYS 102 3.062 9.245 -15.136 891 2HG LYS 102 1HG LYS 102 2.879 8.851 -16.846 892 1HD LYS 102 2HD LYS 102 1.002 10.325 -17.046 893 2HD LYS 102 1HD LYS 102 0.944 10.565 -15.299 894 1HE LYS 102 2HE LYS 102 3.299 11.353 -17.012 895 2HE LYS 102 1HE LYS 102 1.977 12.450 -16.627 896 1HZ LYS 102 1HZ LYS 102 3.833 12.769 -15.097 897 2HZ LYS 102 2HZ LYS 102 3.775 11.160 -14.611 898 3HZ LYS 102 3HZ LYS 102 2.478 12.192 -14.291 899 H ASN 103 H ASN 103 0.938 6.656 -12.130 900 HA ASN 103 HA ASN 103 0.235 4.597 -11.421 901 1HB ASN 103 2HB ASN 103 -1.814 6.045 -11.081 902 2HB ASN 103 1HB ASN 103 -2.391 5.549 -12.662 903 1HD2 ASN 103 1HD2 ASN 103 -3.433 3.576 -12.853 904 2HD2 ASN 103 2HD2 ASN 103 -3.785 2.547 -11.509 905 H LYS 104 H LYS 104 1.597 4.525 -13.839 906 HA LYS 104 HA LYS 104 0.001 2.825 -15.612 907 1HB LYS 104 2HB LYS 104 0.844 5.079 -16.382 908 2HB LYS 104 1HB LYS 104 2.468 4.454 -16.197 909 1HG LYS 104 2HG LYS 104 2.107 2.859 -17.948 910 2HG LYS 104 1HG LYS 104 0.397 3.309 -18.056 911 1HD LYS 104 2HD LYS 104 1.093 5.626 -18.594 912 2HD LYS 104 1HD LYS 104 2.768 5.082 -18.617 913 1HE LYS 104 2HE LYS 104 2.285 3.601 -20.469 914 2HE LYS 104 1HE LYS 104 0.576 4.043 -20.400 915 1HZ LYS 104 1HZ LYS 104 1.196 6.317 -20.878 916 2HZ LYS 104 2HZ LYS 104 1.677 5.276 -22.128 917 3HZ LYS 104 3HZ LYS 104 2.826 5.883 -21.031 918 H TYR 105 H TYR 105 2.927 3.247 -13.727 919 HA TYR 105 HA TYR 105 4.195 0.858 -14.656 920 1HB TYR 105 2HB TYR 105 5.229 3.076 -13.897 921 2HB TYR 105 1HB TYR 105 4.827 2.583 -12.266 922 HD1 TYR 105 1HD TYR 105 6.758 1.698 -15.233 923 HD2 TYR 105 2HD TYR 105 6.279 1.138 -11.071 924 HE1 TYR 105 1HE TYR 105 8.957 0.560 -15.145 925 HE2 TYR 105 2HE TYR 105 8.453 -0.009 -10.952 926 HH TYR 105 HH TYR 105 10.015 -1.061 -12.262 927 H ASN 106 H ASN 106 1.751 1.654 -12.570 928 HA ASN 106 HA ASN 106 0.563 0.740 -10.912 929 1HB ASN 106 2HB ASN 106 0.508 -1.345 -12.211 930 2HB ASN 106 1HB ASN 106 2.047 -1.840 -11.517 931 1HD2 ASN 106 1HD2 ASN 106 2.070 -2.770 -9.457 932 2HD2 ASN 106 2HD2 ASN 106 0.625 -3.140 -8.604 933 HA PRO 107 HA PRO 107 3.235 1.742 -7.615 934 1HB PRO 107 2HB PRO 107 0.785 1.580 -5.991 935 2HB PRO 107 1HB PRO 107 1.856 2.956 -6.275 936 1HG PRO 107 2HG PRO 107 -0.588 2.841 -7.365 937 2HG PRO 107 1HG PRO 107 0.786 3.567 -8.220 938 1HD PRO 107 2HD PRO 107 -0.441 0.858 -8.557 939 2HD PRO 107 1HD PRO 107 0.111 2.006 -9.798 940 H SER 108 H SER 108 4.419 -0.125 -7.320 941 HA SER 108 HA SER 108 3.397 -2.339 -5.837 942 1HB SER 108 2HB SER 108 6.281 -1.444 -6.165 943 2HB SER 108 1HB SER 108 5.699 -3.077 -5.827 944 HG SER 108 HG SER 108 4.717 -3.067 -7.921 945 H LEU 109 H LEU 109 3.743 -2.638 -3.535 946 HA LEU 109 HA LEU 109 3.373 -0.255 -2.128 947 1HB LEU 109 2HB LEU 109 2.395 -2.444 -1.463 948 2HB LEU 109 1HB LEU 109 3.985 -2.993 -0.994 949 HG LEU 109 HG LEU 109 2.397 -2.312 0.879 950 1HD1 LEU 109 1HD1 LEU 109 5.064 -0.917 0.797 951 2HD1 LEU 109 2HD1 LEU 109 4.767 -2.573 1.322 952 3HD1 LEU 109 3HD1 LEU 109 4.105 -1.225 2.246 953 1HD2 LEU 109 1HD2 LEU 109 1.461 -0.287 -0.135 954 2HD2 LEU 109 2HD2 LEU 109 3.041 0.474 -0.114 955 3HD2 LEU 109 3HD2 LEU 109 2.230 0.092 1.402 956 H GLN 110 H GLN 110 6.342 -2.312 -2.426 957 HA GLN 110 HA GLN 110 7.922 -1.011 -0.608 958 1HB GLN 110 2HB GLN 110 8.508 -3.028 -1.939 959 2HB GLN 110 1HB GLN 110 8.717 -2.002 -3.348 960 1HG GLN 110 2HG GLN 110 10.866 -2.480 -2.461 961 2HG GLN 110 1HG GLN 110 10.505 -0.788 -2.121 962 1HE2 GLN 110 1HE2 GLN 110 10.874 -3.941 -0.815 963 2HE2 GLN 110 2HE2 GLN 110 11.001 -3.493 0.848 964 H LEU 111 H LEU 111 7.408 -0.186 -4.008 965 HA LEU 111 HA LEU 111 9.050 2.109 -3.987 966 1HB LEU 111 2HB LEU 111 6.839 1.299 -5.875 967 2HB LEU 111 1HB LEU 111 7.711 2.800 -6.063 968 HG LEU 111 HG LEU 111 9.821 1.465 -6.329 969 1HD1 LEU 111 1HD1 LEU 111 9.156 -0.587 -5.227 970 2HD1 LEU 111 2HD1 LEU 111 9.664 -0.900 -6.887 971 3HD1 LEU 111 3HD1 LEU 111 7.949 -0.882 -6.478 972 1HD2 LEU 111 1HD2 LEU 111 7.609 0.923 -8.298 973 2HD2 LEU 111 2HD2 LEU 111 9.336 0.779 -8.627 974 3HD2 LEU 111 3HD2 LEU 111 8.640 2.353 -8.247 975 H ALA 112 H ALA 112 5.571 1.703 -3.579 976 HA ALA 112 HA ALA 112 4.882 4.405 -3.344 977 1HB ALA 112 1HB ALA 112 3.243 2.610 -3.655 978 2HB ALA 112 2HB ALA 112 2.853 3.595 -2.243 979 3HB ALA 112 3HB ALA 112 3.596 2.009 -2.034 980 H LEU 113 H LEU 113 5.988 2.052 -0.927 981 HA LEU 113 HA LEU 113 5.596 3.567 1.362 982 1HB LEU 113 2HB LEU 113 5.921 1.245 1.520 983 2HB LEU 113 1HB LEU 113 7.432 1.318 0.637 984 HG LEU 113 HG LEU 113 8.440 2.534 2.526 985 1HD1 LEU 113 1HD1 LEU 113 7.300 2.572 4.681 986 2HD1 LEU 113 2HD1 LEU 113 5.843 1.943 3.914 987 3HD1 LEU 113 3HD1 LEU 113 6.459 3.534 3.465 988 1HD2 LEU 113 1HD2 LEU 113 8.615 0.586 3.996 989 2HD2 LEU 113 2HD2 LEU 113 8.723 0.142 2.294 990 3HD2 LEU 113 3HD2 LEU 113 7.228 -0.142 3.187 991 H LYS 114 H LYS 114 8.441 3.182 -0.724 992 HA LYS 114 HA LYS 114 9.927 4.848 0.995 993 1HB LYS 114 2HB LYS 114 11.682 4.908 -0.821 994 2HB LYS 114 1HB LYS 114 11.264 3.327 -0.195 995 1HG LYS 114 2HG LYS 114 9.870 2.945 -2.178 996 2HG LYS 114 1HG LYS 114 10.369 4.510 -2.815 997 1HD LYS 114 2HD LYS 114 11.724 2.750 -3.790 998 2HD LYS 114 1HD LYS 114 12.718 3.763 -2.744 999 1HE LYS 114 2HE LYS 114 12.482 2.081 -0.944 1000 2HE LYS 114 1HE LYS 114 11.551 1.063 -2.041 1001 1HZ LYS 114 1HZ LYS 114 13.810 0.319 -2.021 1002 2HZ LYS 114 2HZ LYS 114 14.394 1.869 -2.320 1003 3HZ LYS 114 3HZ LYS 114 13.531 1.055 -3.519 1004 H ILE 115 H ILE 115 8.066 5.520 -1.855 1005 HA ILE 115 HA ILE 115 8.757 8.247 -2.102 1006 HB ILE 115 HB ILE 115 6.061 6.929 -2.623 1007 1HG1 ILE 115 2HG1 ILE 115 8.311 7.572 -4.544 1008 2HG1 ILE 115 1HG1 ILE 115 7.945 5.971 -3.919 1009 1HG2 ILE 115 1HG2 ILE 115 5.611 8.851 -4.086 1010 2HG2 ILE 115 2HG2 ILE 115 7.131 9.585 -3.578 1011 3HG2 ILE 115 3HG2 ILE 115 5.835 9.340 -2.406 1012 1HD1 ILE 115 1HD1 ILE 115 7.106 6.267 -6.183 1013 2HD1 ILE 115 2HD1 ILE 115 6.131 7.637 -5.650 1014 3HD1 ILE 115 3HD1 ILE 115 5.786 6.017 -5.043 1015 H ALA 116 H ALA 116 6.358 6.566 -0.180 1016 HA ALA 116 HA ALA 116 5.072 8.727 1.079 1017 1HB ALA 116 1HB ALA 116 4.238 6.418 1.068 1018 2HB ALA 116 2HB ALA 116 4.360 7.096 2.710 1019 3HB ALA 116 3HB ALA 116 5.602 5.991 2.115 1020 H TYR 117 H TYR 117 7.844 6.808 1.941 1021 HA TYR 117 HA TYR 117 8.198 7.884 4.506 1022 1HB TYR 117 2HB TYR 117 8.913 5.649 3.767 1023 2HB TYR 117 1HB TYR 117 10.095 6.391 2.705 1024 HD1 TYR 117 1HD TYR 117 12.108 6.951 3.463 1025 HD2 TYR 117 2HD TYR 117 9.147 5.940 6.253 1026 HE1 TYR 117 1HE TYR 117 13.868 6.856 5.271 1027 HE2 TYR 117 2HE TYR 117 10.805 5.835 8.066 1028 HH TYR 117 HH TYR 117 13.971 7.030 7.691 1029 H TYR 118 H TYR 118 9.920 8.455 1.404 1030 HA TYR 118 HA TYR 118 11.617 10.428 2.541 1031 1HB TYR 118 2HB TYR 118 11.074 9.672 -0.321 1032 2HB TYR 118 1HB TYR 118 12.107 11.032 0.086 1033 HD1 TYR 118 1HD TYR 118 14.258 10.655 1.226 1034 HD2 TYR 118 2HD TYR 118 11.835 7.401 -0.028 1035 HE1 TYR 118 1HE TYR 118 16.187 9.147 1.435 1036 HE2 TYR 118 2HE TYR 118 13.754 5.879 0.179 1037 HH TYR 118 HH TYR 118 16.137 5.918 0.222 1038 H LEU 119 H LEU 119 8.619 10.676 0.769 1039 HA LEU 119 HA LEU 119 8.707 13.585 0.867 1040 1HB LEU 119 2HB LEU 119 6.511 11.702 0.009 1041 2HB LEU 119 1HB LEU 119 6.331 13.444 0.014 1042 1HD1 LEU 119 1HD1 LEU 119 6.945 12.521 -3.531 1043 2HD1 LEU 119 2HD1 LEU 119 5.757 13.218 -2.430 1044 3HD1 LEU 119 3HD1 LEU 119 6.093 11.486 -2.387 1045 1HD2 LEU 119 1HD2 LEU 119 9.058 14.203 -1.046 1046 2HD2 LEU 119 2HD2 LEU 119 7.521 14.830 -1.642 1047 3HD2 LEU 119 3HD2 LEU 119 8.663 14.082 -2.761 1048 H ASN 120 H ASN 120 7.993 11.195 2.970 1049 HA ASN 120 HA ASN 120 6.831 10.871 4.847 1050 1HB ASN 120 2HB ASN 120 8.588 12.435 5.641 1051 2HB ASN 120 1HB ASN 120 7.499 13.786 5.349 1052 1HD2 ASN 120 1HD2 ASN 120 8.087 10.943 7.355 1053 2HD2 ASN 120 2HD2 ASN 120 7.051 11.444 8.624 1054 H THR 121 H THR 121 4.939 10.497 3.697 1055 HA THR 121 HA THR 121 2.779 12.233 4.527 1056 HB THR 121 HB THR 121 3.121 11.398 1.614 1057 HG1 THR 121 1HG THR 121 4.250 13.409 2.979 1058 1HG2 THR 121 1HG2 THR 121 1.334 13.029 1.211 1059 2HG2 THR 121 2HG2 THR 121 1.262 13.383 2.937 1060 3HG2 THR 121 3HG2 THR 121 0.808 11.785 2.342 1061 HA PRO 122 HA PRO 122 1.097 8.089 5.180 1062 1HB PRO 122 2HB PRO 122 -1.587 8.765 4.880 1063 2HB PRO 122 1HB PRO 122 -0.677 8.877 6.389 1064 1HG PRO 122 2HG PRO 122 -1.341 11.013 4.413 1065 2HG PRO 122 1HG PRO 122 -1.288 11.097 6.182 1066 1HD PRO 122 2HD PRO 122 0.669 12.104 4.670 1067 2HD PRO 122 1HD PRO 122 1.018 11.316 6.223 1068 H LEU 123 H LEU 123 0.473 6.437 3.917 1069 HA LEU 123 HA LEU 123 0.776 6.526 1.160 1070 1HB LEU 123 2HB LEU 123 -0.661 4.481 2.833 1071 2HB LEU 123 1HB LEU 123 -0.299 4.268 1.136 1072 1HD1 LEU 123 1HD2 LEU 123 0.841 2.135 1.920 1073 2HD1 LEU 123 2HD2 LEU 123 0.567 2.570 3.608 1074 3HD1 LEU 123 3HD2 LEU 123 2.204 2.260 3.030 1075 1HD2 LEU 123 1HD1 LEU 123 3.332 3.875 1.557 1076 2HD2 LEU 123 2HD1 LEU 123 2.516 5.363 1.080 1077 3HD2 LEU 123 3HD1 LEU 123 2.005 3.818 0.396 1078 H GLU 124 H GLU 124 -2.223 6.616 3.041 1079 HA GLU 124 HA GLU 124 -3.986 6.367 0.864 1080 1HB GLU 124 2HB GLU 124 -4.540 7.731 3.496 1081 2HB GLU 124 1HB GLU 124 -5.705 6.993 2.407 1082 1HG GLU 124 2HG GLU 124 -4.645 4.803 2.830 1083 2HG GLU 124 1HG GLU 124 -3.594 5.579 4.011 1084 H ASP 125 H ASP 125 -2.278 9.090 2.204 1085 HA ASP 125 HA ASP 125 -3.935 11.046 0.963 1086 1HB ASP 125 2HB ASP 125 -2.541 11.471 3.013 1087 2HB ASP 125 1HB ASP 125 -1.116 11.412 1.982 1088 H ILE 126 H ILE 126 -1.032 9.376 0.238 1089 HA ILE 126 HA ILE 126 -0.324 10.960 -2.087 1090 HB ILE 126 HB ILE 126 0.828 8.239 -1.376 1091 1HG1 ILE 126 2HG1 ILE 126 1.826 11.011 -0.675 1092 2HG1 ILE 126 1HG1 ILE 126 1.129 9.861 0.460 1093 1HG2 ILE 126 1HG2 ILE 126 1.204 8.921 -3.692 1094 2HG2 ILE 126 2HG2 ILE 126 2.711 8.971 -2.775 1095 3HG2 ILE 126 3HG2 ILE 126 1.852 10.466 -3.143 1096 1HD1 ILE 126 1HD1 ILE 126 3.541 9.917 0.624 1097 2HD1 ILE 126 2HD1 ILE 126 3.683 9.502 -1.085 1098 3HD1 ILE 126 3HD1 ILE 126 2.994 8.342 0.052 1099 H PHE 127 H PHE 127 -1.489 7.642 -1.590 1100 HA PHE 127 HA PHE 127 -2.532 7.763 -4.338 1101 1HB PHE 127 2HB PHE 127 -1.850 5.313 -2.628 1102 2HB PHE 127 1HB PHE 127 -2.546 5.278 -4.246 1103 HD1 PHE 127 1HD PHE 127 -1.180 5.830 -6.177 1104 HD2 PHE 127 2HD PHE 127 0.452 5.799 -2.250 1105 HE1 PHE 127 1HE PHE 127 1.088 5.816 -7.120 1106 HE2 PHE 127 2HE PHE 127 2.721 5.786 -3.188 1107 HZ PHE 127 HZ PHE 127 3.042 5.795 -5.627 1108 H GLN 128 H GLN 128 -4.681 7.479 -4.518 1109 HA GLN 128 HA GLN 128 -6.127 7.213 -1.979 1110 1HB GLN 128 2HB GLN 128 -6.143 9.496 -2.881 1111 2HB GLN 128 1HB GLN 128 -6.818 8.896 -4.385 1112 1HG GLN 128 2HG GLN 128 -8.831 8.192 -3.174 1113 2HG GLN 128 1HG GLN 128 -8.148 8.855 -1.685 1114 1HE2 GLN 128 1HE2 GLN 128 -9.465 9.590 -4.790 1115 2HE2 GLN 128 2HE2 GLN 128 -9.695 11.278 -4.543 1116 H TRP 129 H TRP 129 -7.413 5.598 -1.913 1117 HA TRP 129 HA TRP 129 -8.284 4.428 -4.422 1118 1HB TRP 129 2HB TRP 129 -8.664 2.349 -2.980 1119 2HB TRP 129 1HB TRP 129 -7.015 2.775 -3.403 1120 HD1 TRP 129 HD TRP 129 -9.410 2.782 -0.371 1121 HE1 TRP 129 1HE TRP 129 -7.973 2.793 1.768 1122 HE3 TRP 129 3HE TRP 129 -4.793 3.354 -2.489 1123 HZ2 TRP 129 2HZ TRP 129 -5.250 2.984 2.454 1124 HZ3 TRP 129 3HZ TRP 129 -2.824 3.437 -1.022 1125 HH2 TRP 129 HH TRP 129 -3.051 3.256 1.399 1126 H GLN 130 H GLN 130 -10.303 4.253 -4.826 1127 HA GLN 130 HA GLN 130 -12.162 4.855 -2.674 1128 1HB GLN 130 2HB GLN 130 -12.221 5.999 -5.464 1129 2HB GLN 130 1HB GLN 130 -13.592 6.080 -4.377 1130 1HG GLN 130 2HG GLN 130 -10.861 7.279 -3.878 1131 2HG GLN 130 1HG GLN 130 -12.287 8.166 -4.411 1132 1HE2 GLN 130 1HE2 GLN 130 -12.178 9.522 -2.589 1133 2HE2 GLN 130 2HE2 GLN 130 -12.602 8.967 -1.012 1134 HA PRO 131 HA PRO 131 -13.534 0.920 -4.382 1135 1HB PRO 131 2HB PRO 131 -14.682 0.576 -1.709 1136 2HB PRO 131 1HB PRO 131 -13.451 -0.400 -2.514 1137 1HG PRO 131 2HG PRO 131 -12.887 1.168 -0.388 1138 2HG PRO 131 1HG PRO 131 -11.714 0.868 -1.684 1139 1HD PRO 131 2HD PRO 131 -13.485 3.247 -1.247 1140 2HD PRO 131 1HD PRO 131 -11.770 3.194 -1.713 1141 H GLU 132 H GLU 132 -15.041 3.749 -3.223 1142 HA GLU 132 HA GLU 132 -17.607 2.935 -4.175 1143 1HB GLU 132 2HB GLU 132 -16.973 4.498 -1.638 1144 2HB GLU 132 1HB GLU 132 -18.582 4.240 -2.295 1145 1HG GLU 132 2HG GLU 132 -18.485 1.905 -1.811 1146 2HG GLU 132 1HG GLU 132 -16.779 2.012 -1.384 Start of MODEL 5 1 1H MET 1 1HT MET 1 13.807 -4.448 6.098 2 2H MET 1 2HT MET 1 12.378 -3.610 6.515 3 3H MET 1 3HT MET 1 12.495 -4.370 5.038 4 HA MET 1 HA MET 1 12.366 -6.470 5.889 5 1HB MET 1 2HB MET 1 13.710 -5.990 7.963 6 2HB MET 1 1HB MET 1 12.306 -5.168 8.627 7 1HG MET 1 2HG MET 1 11.034 -7.271 8.467 8 2HG MET 1 1HG MET 1 12.489 -8.081 7.894 9 1HE MET 1 1HE MET 1 11.953 -6.302 12.109 10 2HE MET 1 2HE MET 1 10.677 -6.383 10.896 11 3HE MET 1 3HE MET 1 12.060 -5.316 10.649 12 H ILE 2 H ILE 2 10.317 -7.168 5.748 13 HA ILE 2 HA ILE 2 8.205 -5.222 6.330 14 HB ILE 2 HB ILE 2 8.045 -7.825 4.761 15 1HG1 ILE 2 2HG1 ILE 2 9.319 -6.114 3.570 16 2HG1 ILE 2 1HG1 ILE 2 7.769 -6.378 2.782 17 1HG2 ILE 2 1HG2 ILE 2 5.800 -7.114 4.078 18 2HG2 ILE 2 2HG2 ILE 2 5.916 -5.721 5.152 19 3HG2 ILE 2 3HG2 ILE 2 5.907 -7.351 5.824 20 1HD1 ILE 2 1HD1 ILE 2 8.465 -4.076 4.602 21 2HD1 ILE 2 2HD1 ILE 2 6.905 -4.333 3.820 22 3HD1 ILE 2 3HD1 ILE 2 8.338 -4.014 2.843 23 H ILE 3 H ILE 3 6.725 -5.526 7.914 24 HA ILE 3 HA ILE 3 7.004 -7.933 9.576 25 HB ILE 3 HB ILE 3 6.114 -5.138 10.392 26 1HG1 ILE 3 2HG1 ILE 3 8.747 -6.530 10.963 27 2HG1 ILE 3 1HG1 ILE 3 8.516 -5.188 9.853 28 1HG2 ILE 3 1HG2 ILE 3 6.669 -7.588 12.066 29 2HG2 ILE 3 2HG2 ILE 3 5.087 -6.877 11.742 30 3HG2 ILE 3 3HG2 ILE 3 6.277 -5.987 12.695 31 1HD1 ILE 3 1HD1 ILE 3 8.100 -5.117 12.830 32 2HD1 ILE 3 2HD1 ILE 3 7.864 -3.762 11.723 33 3HD1 ILE 3 3HD1 ILE 3 9.473 -4.448 11.949 34 H ASN 4 H ASN 4 4.960 -9.172 9.774 35 HA ASN 4 HA ASN 4 2.706 -8.001 8.417 36 1HB ASN 4 2HB ASN 4 3.632 -10.233 7.737 37 2HB ASN 4 1HB ASN 4 3.401 -10.799 9.380 38 1HD2 ASN 4 1HD2 ASN 4 2.344 -11.962 7.057 39 2HD2 ASN 4 2HD2 ASN 4 0.614 -11.887 7.156 40 H ASN 5 H ASN 5 1.156 -7.180 9.703 41 HA ASN 5 HA ASN 5 0.926 -8.239 12.430 42 1HB ASN 5 2HB ASN 5 0.348 -5.428 11.451 43 2HB ASN 5 1HB ASN 5 -0.004 -6.018 13.065 44 1HD2 ASN 5 1HD2 ASN 5 1.673 -3.855 12.092 45 2HD2 ASN 5 2HD2 ASN 5 3.247 -4.092 12.758 46 H LEU 6 H LEU 6 -0.298 -8.820 9.718 47 HA LEU 6 HA LEU 6 -2.987 -7.974 9.673 48 1HB LEU 6 2HB LEU 6 -1.799 -8.859 7.689 49 2HB LEU 6 1HB LEU 6 -1.719 -10.435 8.427 50 HG LEU 6 HG LEU 6 -3.381 -10.141 6.540 51 1HD1 LEU 6 1HD1 LEU 6 -4.512 -11.076 9.164 52 2HD1 LEU 6 2HD1 LEU 6 -3.552 -12.034 8.035 53 3HD1 LEU 6 3HD1 LEU 6 -5.152 -11.457 7.565 54 1HD2 LEU 6 1HD2 LEU 6 -4.886 -8.582 8.627 55 2HD2 LEU 6 2HD2 LEU 6 -5.532 -9.114 7.074 56 3HD2 LEU 6 3HD2 LEU 6 -4.212 -7.945 7.125 57 H LYS 7 H LYS 7 -1.452 -10.781 11.083 58 HA LYS 7 HA LYS 7 -3.834 -12.028 11.927 59 1HB LYS 7 2HB LYS 7 -2.396 -13.305 13.543 60 2HB LYS 7 1HB LYS 7 -1.829 -13.360 11.881 61 1HG LYS 7 2HG LYS 7 -0.135 -11.697 12.392 62 2HG LYS 7 1HG LYS 7 -0.733 -11.579 14.043 63 1HD LYS 7 2HD LYS 7 0.434 -14.054 12.768 64 2HD LYS 7 1HD LYS 7 1.285 -12.973 13.869 65 1HE LYS 7 2HE LYS 7 -0.413 -13.479 15.603 66 2HE LYS 7 1HE LYS 7 -1.158 -14.629 14.493 67 1HZ LYS 7 1HZ LYS 7 0.258 -15.821 15.949 68 2HZ LYS 7 2HZ LYS 7 1.555 -14.769 15.674 69 3HZ LYS 7 3HZ LYS 7 1.047 -15.794 14.449 70 H LEU 8 H LEU 8 -1.690 -9.719 13.604 71 HA LEU 8 HA LEU 8 -3.074 -9.560 16.004 72 1HB LEU 8 2HB LEU 8 -0.757 -8.690 15.397 73 2HB LEU 8 1HB LEU 8 -1.540 -7.356 14.596 74 HG LEU 8 HG LEU 8 -0.572 -6.796 16.809 75 1HD1 LEU 8 1HD1 LEU 8 -2.355 -5.402 15.975 76 2HD1 LEU 8 2HD1 LEU 8 -2.455 -5.559 17.729 77 3HD1 LEU 8 3HD1 LEU 8 -3.555 -6.472 16.696 78 1HD2 LEU 8 1HD2 LEU 8 -1.681 -7.561 18.849 79 2HD2 LEU 8 2HD2 LEU 8 -0.948 -8.890 17.950 80 3HD2 LEU 8 3HD2 LEU 8 -2.692 -8.636 17.885 81 H ILE 9 H ILE 9 -3.447 -7.724 12.985 82 HA ILE 9 HA ILE 9 -5.523 -6.077 13.957 83 HB ILE 9 HB ILE 9 -4.460 -6.603 11.190 84 1HG1 ILE 9 2HG1 ILE 9 -4.112 -4.161 11.198 85 2HG1 ILE 9 1HG1 ILE 9 -4.881 -4.055 12.768 86 1HG2 ILE 9 1HG2 ILE 9 -6.857 -6.556 10.805 87 2HG2 ILE 9 2HG2 ILE 9 -6.114 -5.079 10.184 88 3HG2 ILE 9 3HG2 ILE 9 -6.996 -5.054 11.713 89 1HD1 ILE 9 1HD1 ILE 9 -3.058 -5.352 13.734 90 2HD1 ILE 9 2HD1 ILE 9 -2.483 -3.888 12.933 91 3HD1 ILE 9 3HD1 ILE 9 -2.300 -5.457 12.144 92 H ARG 10 H ARG 10 -5.571 -9.139 12.314 93 HA ARG 10 HA ARG 10 -8.376 -9.304 12.058 94 1HB ARG 10 2HB ARG 10 -6.274 -11.414 12.237 95 2HB ARG 10 1HB ARG 10 -7.971 -11.846 12.314 96 1HG ARG 10 2HG ARG 10 -8.208 -10.594 10.104 97 2HG ARG 10 1HG ARG 10 -6.437 -10.659 10.037 98 1HD ARG 10 2HD ARG 10 -7.555 -12.573 8.893 99 2HD ARG 10 1HD ARG 10 -6.459 -13.055 10.199 100 HE ARG 10 HE ARG 10 -9.251 -12.684 10.908 101 1HH1 ARG 10 1HH1 ARG 10 -6.889 -15.144 9.898 102 2HH1 ARG 10 2HH1 ARG 10 -7.636 -16.370 10.806 103 1HH2 ARG 10 1HH2 ARG 10 -10.163 -14.308 12.168 104 2HH2 ARG 10 2HH2 ARG 10 -9.581 -15.922 12.114 105 H GLU 11 H GLU 11 -6.207 -9.986 14.809 106 HA GLU 11 HA GLU 11 -8.291 -10.908 16.404 107 1HB GLU 11 2HB GLU 11 -5.521 -9.945 17.066 108 2HB GLU 11 1HB GLU 11 -6.635 -10.649 18.241 109 1HG GLU 11 2HG GLU 11 -6.768 -12.670 16.766 110 2HG GLU 11 1HG GLU 11 -5.469 -11.973 15.808 111 H LYS 12 H LYS 12 -6.904 -7.724 15.897 112 HA LYS 12 HA LYS 12 -8.276 -6.286 17.824 113 1HB LYS 12 2HB LYS 12 -7.598 -5.448 14.990 114 2HB LYS 12 1HB LYS 12 -8.207 -4.332 16.204 115 1HG LYS 12 2HG LYS 12 -6.265 -4.743 17.596 116 2HG LYS 12 1HG LYS 12 -5.675 -5.942 16.453 117 1HD LYS 12 2HD LYS 12 -4.501 -3.773 16.252 118 2HD LYS 12 1HD LYS 12 -5.333 -4.226 14.771 119 1HE LYS 12 2HE LYS 12 -7.072 -2.648 15.178 120 2HE LYS 12 1HE LYS 12 -6.513 -2.363 16.826 121 1HZ LYS 12 1HZ LYS 12 -4.681 -1.206 16.089 122 2HZ LYS 12 2HZ LYS 12 -5.892 -0.623 15.054 123 3HZ LYS 12 3HZ LYS 12 -4.750 -1.744 14.510 124 H LYS 13 H LYS 13 -9.472 -7.381 14.754 125 HA LYS 13 HA LYS 13 -12.209 -6.712 15.619 126 1HB LYS 13 2HB LYS 13 -11.212 -7.462 12.828 127 2HB LYS 13 1HB LYS 13 -12.850 -6.955 13.233 128 1HG LYS 13 2HG LYS 13 -10.354 -5.260 13.373 129 2HG LYS 13 1HG LYS 13 -11.685 -5.098 12.220 130 1HD LYS 13 2HD LYS 13 -13.195 -4.423 13.949 131 2HD LYS 13 1HD LYS 13 -12.034 -4.843 15.205 132 1HE LYS 13 2HE LYS 13 -12.087 -2.460 14.968 133 2HE LYS 13 1HE LYS 13 -10.549 -3.054 14.358 134 1HZ LYS 13 1HZ LYS 13 -11.492 -1.355 12.933 135 2HZ LYS 13 2HZ LYS 13 -12.888 -2.263 12.717 136 3HZ LYS 13 3HZ LYS 13 -11.438 -2.810 12.082 137 H LYS 14 H LYS 14 -13.701 -9.226 14.277 138 HA LYS 14 HA LYS 14 -11.804 -11.170 14.674 139 1HB LYS 14 2HB LYS 14 -13.542 -12.391 16.068 140 2HB LYS 14 1HB LYS 14 -12.716 -11.072 16.880 141 1HG LYS 14 2HG LYS 14 -14.682 -9.631 16.402 142 2HG LYS 14 1HG LYS 14 -15.499 -11.047 15.743 143 1HD LYS 14 2HD LYS 14 -15.312 -12.166 17.893 144 2HD LYS 14 1HD LYS 14 -14.445 -10.778 18.551 145 1HE LYS 14 2HE LYS 14 -17.275 -10.788 17.517 146 2HE LYS 14 1HE LYS 14 -16.786 -10.730 19.211 147 1HZ LYS 14 1HZ LYS 14 -16.260 -8.646 17.157 148 2HZ LYS 14 2HZ LYS 14 -15.664 -8.634 18.743 149 3HZ LYS 14 3HZ LYS 14 -17.316 -8.526 18.487 150 H ILE 15 H ILE 15 -11.930 -11.201 12.447 151 HA ILE 15 HA ILE 15 -14.358 -12.449 11.380 152 HB ILE 15 HB ILE 15 -12.641 -10.353 9.969 153 1HG1 ILE 15 2HG1 ILE 15 -15.483 -10.094 11.002 154 2HG1 ILE 15 1HG1 ILE 15 -14.067 -9.346 11.724 155 1HG2 ILE 15 1HG2 ILE 15 -14.329 -10.453 8.197 156 2HG2 ILE 15 2HG2 ILE 15 -15.171 -11.730 9.073 157 3HG2 ILE 15 3HG2 ILE 15 -13.549 -12.015 8.443 158 1HD1 ILE 15 1HD1 ILE 15 -15.163 -8.762 8.978 159 2HD1 ILE 15 2HD1 ILE 15 -13.750 -8.002 9.709 160 3HD1 ILE 15 3HD1 ILE 15 -15.346 -7.749 10.411 161 H SER 16 H SER 16 -13.820 -14.226 9.994 162 HA SER 16 HA SER 16 -11.009 -14.917 10.177 163 1HB SER 16 2HB SER 16 -13.443 -16.638 9.686 164 2HB SER 16 1HB SER 16 -11.785 -17.225 9.822 165 HG SER 16 HG SER 16 -11.774 -16.852 11.908 166 H GLN 17 H GLN 17 -10.567 -16.628 8.157 167 HA GLN 17 HA GLN 17 -10.242 -14.706 6.121 168 1HB GLN 17 2HB GLN 17 -9.130 -16.539 4.778 169 2HB GLN 17 1HB GLN 17 -8.377 -16.036 6.279 170 1HG GLN 17 2HG GLN 17 -9.138 -17.991 7.386 171 2HG GLN 17 1HG GLN 17 -10.126 -18.449 5.999 172 1HE2 GLN 17 1HE2 GLN 17 -6.823 -17.899 7.035 173 2HE2 GLN 17 2HE2 GLN 17 -6.104 -19.032 5.973 174 H SER 18 H SER 18 -12.616 -17.406 6.289 175 HA SER 18 HA SER 18 -13.185 -17.288 3.564 176 1HB SER 18 2HB SER 18 -14.979 -18.019 5.880 177 2HB SER 18 1HB SER 18 -15.199 -18.484 4.191 178 HG SER 18 HG SER 18 -14.171 -19.976 5.756 179 H GLU 19 H GLU 19 -14.523 -15.634 6.393 180 HA GLU 19 HA GLU 19 -16.495 -14.201 5.019 181 1HB GLU 19 2HB GLU 19 -15.066 -13.303 7.530 182 2HB GLU 19 1HB GLU 19 -16.635 -12.766 6.965 183 1HG GLU 19 2HG GLU 19 -17.226 -14.213 8.631 184 2HG GLU 19 1HG GLU 19 -17.279 -15.277 7.231 185 H LEU 20 H LEU 20 -13.096 -13.404 5.874 186 HA LEU 20 HA LEU 20 -13.114 -10.865 4.778 187 1HB LEU 20 2HB LEU 20 -10.901 -12.862 5.170 188 2HB LEU 20 1HB LEU 20 -10.623 -11.244 4.559 189 HG LEU 20 HG LEU 20 -11.795 -11.902 7.260 190 1HD1 LEU 20 1HD1 LEU 20 -9.662 -11.086 8.130 191 2HD1 LEU 20 2HD1 LEU 20 -9.061 -10.900 6.481 192 3HD1 LEU 20 3HD1 LEU 20 -9.441 -12.506 7.105 193 1HD2 LEU 20 1HD2 LEU 20 -11.507 -9.509 7.687 194 2HD2 LEU 20 2HD2 LEU 20 -12.622 -9.801 6.354 195 3HD2 LEU 20 3HD2 LEU 20 -10.969 -9.280 6.023 196 H ALA 21 H ALA 21 -12.364 -13.997 3.295 197 HA ALA 21 HA ALA 21 -11.580 -13.037 0.797 198 1HB ALA 21 1HB ALA 21 -13.056 -15.599 1.404 199 2HB ALA 21 2HB ALA 21 -11.307 -15.375 1.487 200 3HB ALA 21 3HB ALA 21 -12.143 -15.251 -0.064 201 H ALA 22 H ALA 22 -14.823 -13.896 2.011 202 HA ALA 22 HA ALA 22 -16.254 -13.332 -0.269 203 1HB ALA 22 1HB ALA 22 -17.164 -14.489 1.686 204 2HB ALA 22 2HB ALA 22 -18.174 -13.121 1.218 205 3HB ALA 22 3HB ALA 22 -17.095 -12.988 2.609 206 H LEU 23 H LEU 23 -15.317 -11.184 2.388 207 HA LEU 23 HA LEU 23 -16.659 -8.913 1.336 208 1HB LEU 23 2HB LEU 23 -14.717 -9.341 3.542 209 2HB LEU 23 1HB LEU 23 -14.856 -7.722 2.904 210 HG LEU 23 HG LEU 23 -17.264 -7.719 3.482 211 1HD1 LEU 23 1HD1 LEU 23 -17.718 -10.091 3.374 212 2HD1 LEU 23 2HD1 LEU 23 -18.160 -9.405 4.948 213 3HD1 LEU 23 3HD1 LEU 23 -16.675 -10.348 4.780 214 1HD2 LEU 23 1HD2 LEU 23 -15.644 -6.791 5.023 215 2HD2 LEU 23 2HD2 LEU 23 -15.418 -8.376 5.765 216 3HD2 LEU 23 3HD2 LEU 23 -16.973 -7.554 5.898 217 H LEU 24 H LEU 24 -13.259 -10.047 1.028 218 HA LEU 24 HA LEU 24 -12.459 -7.623 -0.252 219 1HB LEU 24 2HB LEU 24 -11.058 -10.272 -0.188 220 2HB LEU 24 1HB LEU 24 -10.348 -8.701 -0.471 221 HG LEU 24 HG LEU 24 -11.457 -9.748 2.117 222 1HD1 LEU 24 1HD1 LEU 24 -8.650 -9.171 1.242 223 2HD1 LEU 24 2HD1 LEU 24 -9.371 -10.758 1.514 224 3HD1 LEU 24 3HD1 LEU 24 -9.143 -9.648 2.865 225 1HD2 LEU 24 1HD2 LEU 24 -11.848 -7.363 1.943 226 2HD2 LEU 24 2HD2 LEU 24 -10.153 -7.104 1.528 227 3HD2 LEU 24 3HD2 LEU 24 -10.588 -7.710 3.126 228 H GLU 25 H GLU 25 -14.197 -10.280 -1.316 229 HA GLU 25 HA GLU 25 -14.735 -11.200 -3.300 230 1HB GLU 25 2HB GLU 25 -13.475 -8.696 -4.428 231 2HB GLU 25 1HB GLU 25 -14.486 -9.817 -5.328 232 1HG GLU 25 2HG GLU 25 -16.361 -9.292 -3.865 233 2HG GLU 25 1HG GLU 25 -15.332 -8.175 -2.965 234 H VAL 26 H VAL 26 -12.383 -12.126 -2.151 235 HA VAL 26 HA VAL 26 -10.813 -12.720 -4.539 236 HB VAL 26 HB VAL 26 -8.778 -12.925 -3.158 237 1HG1 VAL 26 1HG1 VAL 26 -8.331 -10.556 -2.753 238 2HG1 VAL 26 2HG1 VAL 26 -10.052 -10.210 -2.923 239 3HG1 VAL 26 3HG1 VAL 26 -9.138 -10.829 -4.298 240 1HG2 VAL 26 1HG2 VAL 26 -9.759 -13.437 -0.998 241 2HG2 VAL 26 2HG2 VAL 26 -10.478 -11.833 -0.912 242 3HG2 VAL 26 3HG2 VAL 26 -8.722 -12.015 -0.853 243 H SER 27 H SER 27 -9.544 -14.799 -4.121 244 HA SER 27 HA SER 27 -11.422 -16.782 -3.259 245 1HB SER 27 2HB SER 27 -8.541 -17.055 -4.142 246 2HB SER 27 1HB SER 27 -9.730 -18.355 -4.036 247 HG SER 27 HG SER 27 -10.772 -16.399 -5.526 248 H ARG 28 H ARG 28 -10.940 -18.355 -1.568 249 HA ARG 28 HA ARG 28 -9.963 -17.142 0.758 250 1HB ARG 28 2HB ARG 28 -10.629 -20.028 0.226 251 2HB ARG 28 1HB ARG 28 -10.102 -19.447 1.802 252 1HG ARG 28 2HG ARG 28 -11.983 -17.835 1.781 253 2HG ARG 28 1HG ARG 28 -12.541 -18.576 0.284 254 1HD ARG 28 2HD ARG 28 -12.181 -20.017 2.898 255 2HD ARG 28 1HD ARG 28 -13.712 -19.383 2.302 256 HE ARG 28 HE ARG 28 -12.160 -21.542 1.048 257 1HH1 ARG 28 1HH1 ARG 28 -15.229 -19.855 1.577 258 2HH1 ARG 28 2HH1 ARG 28 -16.199 -21.114 1.001 259 1HH2 ARG 28 1HH2 ARG 28 -13.478 -23.282 0.252 260 2HH2 ARG 28 2HH2 ARG 28 -15.190 -23.142 0.241 261 H GLN 29 H GLN 29 -8.360 -19.258 -1.531 262 HA GLN 29 HA GLN 29 -5.996 -19.684 -0.131 263 1HB GLN 29 2HB GLN 29 -6.353 -20.918 -2.145 264 2HB GLN 29 1HB GLN 29 -6.639 -19.464 -3.080 265 1HG GLN 29 2HG GLN 29 -3.942 -19.778 -1.883 266 2HG GLN 29 1HG GLN 29 -4.366 -20.874 -3.193 267 1HE2 GLN 29 1HE2 GLN 29 -2.733 -19.892 -4.445 268 2HE2 GLN 29 2HE2 GLN 29 -2.962 -18.359 -5.217 269 H THR 30 H THR 30 -7.178 -16.880 -1.765 270 HA THR 30 HA THR 30 -4.681 -15.596 -2.063 271 HB THR 30 HB THR 30 -7.464 -14.429 -2.148 272 HG1 THR 30 1HG THR 30 -6.153 -16.262 -3.677 273 1HG2 THR 30 1HG2 THR 30 -6.435 -12.835 -3.720 274 2HG2 THR 30 2HG2 THR 30 -4.874 -13.631 -3.513 275 3HG2 THR 30 3HG2 THR 30 -5.613 -12.773 -2.161 276 H ILE 31 H ILE 31 -7.414 -15.204 0.209 277 HA ILE 31 HA ILE 31 -6.023 -13.233 1.732 278 HB ILE 31 HB ILE 31 -8.451 -13.207 1.796 279 1HG1 ILE 31 2HG1 ILE 31 -8.906 -13.212 4.244 280 2HG1 ILE 31 1HG1 ILE 31 -7.357 -14.001 4.505 281 1HG2 ILE 31 1HG2 ILE 31 -9.787 -14.953 2.842 282 2HG2 ILE 31 2HG2 ILE 31 -8.336 -15.939 3.022 283 3HG2 ILE 31 3HG2 ILE 31 -8.924 -15.521 1.412 284 1HD1 ILE 31 1HD1 ILE 31 -7.225 -11.621 4.963 285 2HD1 ILE 31 2HD1 ILE 31 -7.769 -11.260 3.323 286 3HD1 ILE 31 3HD1 ILE 31 -6.213 -12.048 3.582 287 H ASN 32 H ASN 32 -6.317 -16.719 1.905 288 HA ASN 32 HA ASN 32 -5.197 -17.236 4.432 289 1HB ASN 32 2HB ASN 32 -6.298 -18.895 2.856 290 2HB ASN 32 1HB ASN 32 -4.824 -18.861 1.901 291 1HD2 ASN 32 1HD2 ASN 32 -6.426 -20.173 4.572 292 2HD2 ASN 32 2HD2 ASN 32 -5.119 -21.140 5.182 293 H GLY 33 H GLY 33 -3.834 -16.839 1.254 294 1HA GLY 33 2HA GLY 33 -1.113 -17.267 1.893 295 2HA GLY 33 1HA GLY 33 -1.703 -16.429 0.463 296 H ILE 34 H ILE 34 -3.116 -14.360 1.914 297 HA ILE 34 HA ILE 34 -0.943 -12.592 2.321 298 HB ILE 34 HB ILE 34 -3.897 -12.153 2.855 299 1HG1 ILE 34 2HG1 ILE 34 -3.412 -12.582 0.488 300 2HG1 ILE 34 1HG1 ILE 34 -3.887 -10.906 0.737 301 1HG2 ILE 34 1HG2 ILE 34 -1.645 -10.151 2.717 302 2HG2 ILE 34 2HG2 ILE 34 -2.548 -10.607 4.161 303 3HG2 ILE 34 3HG2 ILE 34 -3.358 -9.754 2.844 304 1HD1 ILE 34 1HD1 ILE 34 -2.058 -11.079 -0.843 305 2HD1 ILE 34 2HD1 ILE 34 -1.076 -11.920 0.356 306 3HD1 ILE 34 3HD1 ILE 34 -1.536 -10.236 0.617 307 H GLU 35 H GLU 35 -3.201 -14.237 4.531 308 HA GLU 35 HA GLU 35 -2.451 -13.013 6.875 309 1HB GLU 35 2HB GLU 35 -3.135 -15.921 6.498 310 2HB GLU 35 1HB GLU 35 -2.975 -15.143 8.060 311 1HG GLU 35 2HG GLU 35 -4.801 -13.547 7.181 312 2HG GLU 35 1HG GLU 35 -5.094 -14.821 5.989 313 H LYS 36 H LYS 36 -0.761 -15.549 5.189 314 HA LYS 36 HA LYS 36 1.304 -15.493 7.281 315 1HB LYS 36 2HB LYS 36 1.151 -17.360 4.905 316 2HB LYS 36 1HB LYS 36 2.195 -17.522 6.308 317 1HG LYS 36 2HG LYS 36 -0.804 -17.834 6.223 318 2HG LYS 36 1HG LYS 36 0.392 -19.099 6.484 319 1HD LYS 36 2HD LYS 36 -0.148 -16.772 8.345 320 2HD LYS 36 1HD LYS 36 -0.740 -18.413 8.572 321 1HE LYS 36 2HE LYS 36 1.574 -19.212 8.745 322 2HE LYS 36 1HE LYS 36 2.155 -17.564 8.505 323 1HZ LYS 36 1HZ LYS 36 1.043 -16.913 10.541 324 2HZ LYS 36 2HZ LYS 36 2.117 -18.169 10.850 325 3HZ LYS 36 3HZ LYS 36 0.455 -18.484 10.759 326 H ASN 37 H ASN 37 0.588 -13.678 4.856 327 HA ASN 37 HA ASN 37 1.461 -12.531 3.136 328 1HB ASN 37 2HB ASN 37 3.365 -11.105 3.699 329 2HB ASN 37 1HB ASN 37 2.306 -11.263 5.084 330 1HD2 ASN 37 1HD2 ASN 37 5.391 -11.959 3.752 331 2HD2 ASN 37 2HD2 ASN 37 6.149 -12.505 5.197 332 H LYS 38 H LYS 38 1.780 -15.139 2.603 333 HA LYS 38 HA LYS 38 4.571 -15.601 1.819 334 1HB LYS 38 2HB LYS 38 3.406 -17.274 3.242 335 2HB LYS 38 1HB LYS 38 2.174 -17.444 2.012 336 1HG LYS 38 2HG LYS 38 3.781 -18.431 0.497 337 2HG LYS 38 1HG LYS 38 5.076 -18.176 1.672 338 1HD LYS 38 2HD LYS 38 4.260 -20.491 1.737 339 2HD LYS 38 1HD LYS 38 3.936 -19.656 3.257 340 1HE LYS 38 2HE LYS 38 1.631 -19.217 2.477 341 2HE LYS 38 1HE LYS 38 1.975 -20.141 1.020 342 1HZ LYS 38 1HZ LYS 38 0.812 -21.445 2.616 343 2HZ LYS 38 2HZ LYS 38 1.967 -21.181 3.807 344 3HZ LYS 38 3HZ LYS 38 2.357 -22.098 2.414 345 H TYR 39 H TYR 39 1.483 -14.772 0.815 346 HA TYR 39 HA TYR 39 1.572 -15.529 -1.939 347 1HB TYR 39 2HB TYR 39 -0.464 -15.337 -0.519 348 2HB TYR 39 1HB TYR 39 -0.164 -13.621 -0.366 349 HD1 TYR 39 1HD TYR 39 -1.282 -16.283 -2.505 350 HD2 TYR 39 2HD TYR 39 -0.685 -12.115 -2.197 351 HE1 TYR 39 1HE TYR 39 -2.723 -15.932 -4.508 352 HE2 TYR 39 2HE TYR 39 -2.089 -11.728 -4.166 353 HH TYR 39 HH TYR 39 -4.050 -14.180 -5.536 354 H ASN 40 H ASN 40 2.816 -13.051 0.028 355 HA ASN 40 HA ASN 40 3.749 -11.038 -0.175 356 1HB ASN 40 2HB ASN 40 5.139 -12.033 -2.004 357 2HB ASN 40 1HB ASN 40 3.896 -11.606 -3.170 358 1HD2 ASN 40 1HD2 ASN 40 6.755 -10.839 -2.932 359 2HD2 ASN 40 2HD2 ASN 40 6.768 -9.114 -2.989 360 HA PRO 41 HA PRO 41 -0.172 -9.066 -0.860 361 1HB PRO 41 2HB PRO 41 0.088 -7.232 1.108 362 2HB PRO 41 1HB PRO 41 -0.363 -8.912 1.415 363 1HG PRO 41 2HG PRO 41 2.265 -7.557 1.779 364 2HG PRO 41 1HG PRO 41 1.503 -8.821 2.760 365 1HD PRO 41 2HD PRO 41 3.498 -9.244 0.890 366 2HD PRO 41 1HD PRO 41 2.373 -10.484 1.474 367 H SER 42 H SER 42 -0.399 -7.747 -2.536 368 HA SER 42 HA SER 42 1.453 -5.628 -3.108 369 1HB SER 42 2HB SER 42 -0.173 -5.277 -5.003 370 2HB SER 42 1HB SER 42 0.521 -6.899 -4.947 371 HG SER 42 HG SER 42 -1.515 -7.387 -5.103 372 H LEU 43 H LEU 43 0.142 -3.451 -3.711 373 HA LEU 43 HA LEU 43 -1.026 -2.585 -1.283 374 1HB LEU 43 2HB LEU 43 0.242 -1.048 -2.779 375 2HB LEU 43 1HB LEU 43 -1.001 -1.216 -3.995 376 HG LEU 43 HG LEU 43 -0.966 0.959 -2.655 377 1HD1 LEU 43 1HD1 LEU 43 -2.883 0.366 -4.002 378 2HD1 LEU 43 2HD1 LEU 43 -3.398 1.136 -2.500 379 3HD1 LEU 43 3HD1 LEU 43 -3.531 -0.612 -2.685 380 1HD2 LEU 43 1HD2 LEU 43 -2.127 -0.825 -0.500 381 2HD2 LEU 43 2HD2 LEU 43 -2.060 0.933 -0.440 382 3HD2 LEU 43 3HD2 LEU 43 -0.574 -0.008 -0.429 383 H GLN 44 H GLN 44 -2.402 -3.466 -4.535 384 HA GLN 44 HA GLN 44 -4.992 -3.081 -4.106 385 1HB GLN 44 2HB GLN 44 -4.080 -3.770 -6.198 386 2HB GLN 44 1HB GLN 44 -3.441 -5.249 -5.507 387 1HG GLN 44 2HG GLN 44 -5.733 -6.063 -5.192 388 2HG GLN 44 1HG GLN 44 -6.343 -4.590 -5.945 389 1HE2 GLN 44 1HE2 GLN 44 -6.501 -7.444 -6.701 390 2HE2 GLN 44 2HE2 GLN 44 -5.905 -7.524 -8.319 391 H LEU 45 H LEU 45 -3.229 -6.070 -3.308 392 HA LEU 45 HA LEU 45 -5.409 -7.240 -1.983 393 1HB LEU 45 2HB LEU 45 -2.515 -7.890 -2.041 394 2HB LEU 45 1HB LEU 45 -3.481 -8.603 -0.767 395 HG LEU 45 HG LEU 45 -3.261 -10.152 -2.608 396 1HD1 LEU 45 1HD1 LEU 45 -5.307 -10.227 -1.346 397 2HD1 LEU 45 2HD1 LEU 45 -5.619 -10.618 -3.037 398 3HD1 LEU 45 3HD1 LEU 45 -6.038 -9.024 -2.410 399 1HD2 LEU 45 1HD2 LEU 45 -2.926 -8.579 -4.451 400 2HD2 LEU 45 2HD2 LEU 45 -4.600 -8.045 -4.305 401 3HD2 LEU 45 3HD2 LEU 45 -4.243 -9.697 -4.808 402 H ALA 46 H ALA 46 -2.809 -5.307 -0.640 403 HA ALA 46 HA ALA 46 -3.480 -5.844 2.064 404 1HB ALA 46 1HB ALA 46 -1.254 -5.081 1.394 405 2HB ALA 46 2HB ALA 46 -1.954 -4.048 2.640 406 3HB ALA 46 3HB ALA 46 -1.929 -3.511 0.960 407 H LEU 47 H LEU 47 -4.453 -3.230 -0.166 408 HA LEU 47 HA LEU 47 -5.526 -1.628 1.861 409 1HB LEU 47 2HB LEU 47 -4.781 -0.731 -0.295 410 2HB LEU 47 1HB LEU 47 -6.058 -1.608 -1.104 411 HG LEU 47 HG LEU 47 -6.348 0.926 -0.722 412 1HD1 LEU 47 1HD1 LEU 47 -8.760 0.739 -0.392 413 2HD1 LEU 47 2HD1 LEU 47 -8.565 -0.935 0.135 414 3HD1 LEU 47 3HD1 LEU 47 -8.174 -0.483 -1.523 415 1HD2 LEU 47 1HD2 LEU 47 -7.344 1.541 1.434 416 2HD2 LEU 47 2HD2 LEU 47 -5.679 0.985 1.609 417 3HD2 LEU 47 3HD2 LEU 47 -7.016 -0.081 2.044 418 H LYS 48 H LYS 48 -7.035 -4.009 -0.276 419 HA LYS 48 HA LYS 48 -9.625 -3.310 0.536 420 1HB LYS 48 2HB LYS 48 -10.340 -5.622 -0.232 421 2HB LYS 48 1HB LYS 48 -9.573 -4.597 -1.429 422 1HG LYS 48 2HG LYS 48 -7.504 -5.846 -1.200 423 2HG LYS 48 1HG LYS 48 -8.221 -6.833 0.075 424 1HD LYS 48 2HD LYS 48 -8.236 -7.977 -2.115 425 2HD LYS 48 1HD LYS 48 -9.859 -7.716 -1.480 426 1HE LYS 48 2HE LYS 48 -9.852 -7.211 -3.844 427 2HE LYS 48 1HE LYS 48 -10.054 -5.715 -2.930 428 1HZ LYS 48 1HZ LYS 48 -7.553 -6.695 -4.169 429 2HZ LYS 48 2HZ LYS 48 -7.696 -5.249 -3.265 430 3HZ LYS 48 3HZ LYS 48 -8.515 -5.419 -4.722 431 H ILE 49 H ILE 49 -7.407 -5.575 1.864 432 HA ILE 49 HA ILE 49 -9.067 -6.618 3.878 433 HB ILE 49 HB ILE 49 -6.082 -6.140 4.136 434 1HG1 ILE 49 2HG1 ILE 49 -7.552 -8.533 3.020 435 2HG1 ILE 49 1HG1 ILE 49 -6.691 -7.338 2.061 436 1HG2 ILE 49 1HG2 ILE 49 -7.937 -8.133 5.453 437 2HG2 ILE 49 2HG2 ILE 49 -7.188 -6.738 6.233 438 3HG2 ILE 49 3HG2 ILE 49 -6.187 -8.072 5.659 439 1HD1 ILE 49 1HD1 ILE 49 -5.485 -9.171 4.104 440 2HD1 ILE 49 2HD1 ILE 49 -4.613 -7.975 3.147 441 3HD1 ILE 49 3HD1 ILE 49 -5.389 -9.347 2.352 442 H ALA 50 H ALA 50 -6.998 -3.803 3.783 443 HA ALA 50 HA ALA 50 -7.162 -2.928 6.464 444 1HB ALA 50 1HB ALA 50 -6.424 -0.784 5.592 445 2HB ALA 50 2HB ALA 50 -6.867 -1.311 3.968 446 3HB ALA 50 3HB ALA 50 -5.523 -2.101 4.810 447 H TYR 51 H TYR 51 -9.031 -2.288 3.613 448 HA TYR 51 HA TYR 51 -10.688 -0.315 4.717 449 1HB TYR 51 2HB TYR 51 -10.207 -0.458 2.349 450 2HB TYR 51 1HB TYR 51 -10.956 -2.044 2.265 451 HD1 TYR 51 1HD TYR 51 -13.233 -2.281 2.173 452 HD2 TYR 51 2HD TYR 51 -11.565 1.553 2.626 453 HE1 TYR 51 1HE TYR 51 -15.449 -1.270 1.619 454 HE2 TYR 51 2HE TYR 51 -13.720 2.596 2.094 455 HH TYR 51 HH TYR 51 -15.765 1.932 0.799 456 H TYR 52 H TYR 52 -11.270 -3.798 4.032 457 HA TYR 52 HA TYR 52 -13.920 -3.669 5.126 458 1HB TYR 52 2HB TYR 52 -12.267 -5.990 4.161 459 2HB TYR 52 1HB TYR 52 -13.882 -6.185 4.848 460 HD1 TYR 52 1HD TYR 52 -15.839 -5.203 3.712 461 HD2 TYR 52 2HD TYR 52 -11.985 -5.086 1.939 462 HE1 TYR 52 1HE TYR 52 -16.856 -4.642 1.551 463 HE2 TYR 52 2HE TYR 52 -12.971 -4.535 -0.215 464 HH TYR 52 HH TYR 52 -16.301 -3.613 -0.511 465 H LEU 53 H LEU 53 -10.914 -4.528 6.440 466 HA LEU 53 HA LEU 53 -12.142 -5.362 8.962 467 1HB LEU 53 2HB LEU 53 -9.254 -5.032 8.190 468 2HB LEU 53 1HB LEU 53 -9.730 -5.318 9.850 469 1HD1 LEU 53 1HD1 LEU 53 -8.599 -8.615 8.613 470 2HD1 LEU 53 2HD1 LEU 53 -8.294 -7.355 9.811 471 3HD1 LEU 53 3HD1 LEU 53 -7.899 -7.074 8.116 472 1HD2 LEU 53 1HD2 LEU 53 -11.973 -7.311 9.293 473 2HD2 LEU 53 2HD2 LEU 53 -10.712 -7.491 10.513 474 3HD2 LEU 53 3HD2 LEU 53 -10.954 -8.750 9.302 475 H ASN 54 H ASN 54 -11.463 -2.526 7.504 476 HA ASN 54 HA ASN 54 -11.087 -0.386 8.040 477 1HB ASN 54 2HB ASN 54 -13.478 -0.662 8.727 478 2HB ASN 54 1HB ASN 54 -12.948 -1.019 10.361 479 1HD2 ASN 54 1HD2 ASN 54 -14.655 1.128 9.222 480 2HD2 ASN 54 2HD2 ASN 54 -13.969 2.608 9.793 481 H THR 55 H THR 55 -8.904 -0.808 8.419 482 HA THR 55 HA THR 55 -8.060 0.188 10.972 483 HB THR 55 HB THR 55 -7.025 -2.487 9.909 484 HG1 THR 55 1HG THR 55 -9.111 -1.912 11.417 485 1HG2 THR 55 1HG2 THR 55 -5.766 -2.589 12.018 486 2HG2 THR 55 2HG2 THR 55 -6.400 -1.008 12.476 487 3HG2 THR 55 3HG2 THR 55 -5.321 -1.158 11.089 488 HA PRO 56 HA PRO 56 -5.389 2.325 8.035 489 1HB PRO 56 2HB PRO 56 -3.470 2.171 10.325 490 2HB PRO 56 1HB PRO 56 -3.922 3.566 9.336 491 1HG PRO 56 2HG PRO 56 -4.902 3.320 11.772 492 2HG PRO 56 1HG PRO 56 -5.947 3.861 10.443 493 1HD PRO 56 2HD PRO 56 -5.793 1.190 11.766 494 2HD PRO 56 1HD PRO 56 -7.218 2.074 11.172 495 H LEU 57 H LEU 57 -4.132 1.479 6.528 496 HA LEU 57 HA LEU 57 -3.352 -1.191 6.665 497 1HB LEU 57 2HB LEU 57 -2.130 -0.690 4.458 498 2HB LEU 57 1HB LEU 57 -3.870 -0.568 4.526 499 1HD1 LEU 57 1HD1 LEU 57 -1.372 2.086 5.543 500 2HD1 LEU 57 2HD1 LEU 57 -1.544 2.963 4.021 501 3HD1 LEU 57 3HD1 LEU 57 -0.742 1.393 4.048 502 1HD2 LEU 57 1HD2 LEU 57 -3.098 2.237 2.338 503 2HD2 LEU 57 2HD2 LEU 57 -4.151 0.845 2.601 504 3HD2 LEU 57 3HD2 LEU 57 -2.431 0.606 2.270 505 H GLU 58 H GLU 58 -1.521 1.659 7.463 506 HA GLU 58 HA GLU 58 1.061 0.547 7.426 507 1HB GLU 58 2HB GLU 58 -0.007 2.614 9.338 508 2HB GLU 58 1HB GLU 58 1.666 2.366 8.866 509 1HG GLU 58 2HG GLU 58 1.096 3.046 6.584 510 2HG GLU 58 1HG GLU 58 -0.562 3.346 7.112 511 H ASP 59 H ASP 59 -1.568 0.398 9.698 512 HA ASP 59 HA ASP 59 -0.066 -0.623 11.898 513 1HB ASP 59 2HB ASP 59 -2.233 0.623 12.123 514 2HB ASP 59 1HB ASP 59 -3.051 -0.758 11.408 515 H ILE 60 H ILE 60 -1.835 -1.852 9.279 516 HA ILE 60 HA ILE 60 -2.002 -4.629 10.134 517 HB ILE 60 HB ILE 60 -2.537 -3.492 7.371 518 1HG1 ILE 60 2HG1 ILE 60 -4.402 -4.081 9.679 519 2HG1 ILE 60 1HG1 ILE 60 -3.988 -2.493 9.050 520 1HG2 ILE 60 1HG2 ILE 60 -2.098 -5.910 7.349 521 2HG2 ILE 60 2HG2 ILE 60 -3.796 -5.576 7.009 522 3HG2 ILE 60 3HG2 ILE 60 -3.314 -6.147 8.604 523 1HD1 ILE 60 1HD1 ILE 60 -6.188 -3.188 8.326 524 2HD1 ILE 60 2HD1 ILE 60 -5.503 -4.637 7.592 525 3HD1 ILE 60 3HD1 ILE 60 -5.093 -3.046 6.950 526 H PHE 61 H PHE 61 -0.255 -3.051 7.467 527 HA PHE 61 HA PHE 61 1.722 -5.170 7.866 528 1HB PHE 61 2HB PHE 61 1.027 -3.678 5.301 529 2HB PHE 61 1HB PHE 61 2.476 -4.663 5.504 530 HD1 PHE 61 1HD PHE 61 2.220 -7.095 6.062 531 HD2 PHE 61 2HD PHE 61 -1.027 -4.665 4.772 532 HE1 PHE 61 1HE PHE 61 0.952 -9.113 5.473 533 HE2 PHE 61 2HE PHE 61 -2.304 -6.684 4.181 534 HZ PHE 61 HZ PHE 61 -1.313 -8.909 4.533 535 H GLN 62 H GLN 62 3.780 -4.583 8.151 536 HA GLN 62 HA GLN 62 4.077 -1.713 8.546 537 1HB GLN 62 2HB GLN 62 3.878 -3.099 10.613 538 2HB GLN 62 1HB GLN 62 5.364 -3.912 10.146 539 1HG GLN 62 2HG GLN 62 6.625 -1.932 10.406 540 2HG GLN 62 1HG GLN 62 5.165 -0.954 10.576 541 1HE2 GLN 62 1HE2 GLN 62 7.391 -1.209 12.384 542 2HE2 GLN 62 2HE2 GLN 62 6.732 -1.755 13.883 543 H TRP 63 H TRP 63 5.590 -0.816 7.506 544 HA TRP 63 HA TRP 63 7.514 -2.529 6.151 545 1HB TRP 63 2HB TRP 63 7.568 -0.610 4.441 546 2HB TRP 63 1HB TRP 63 6.228 -1.742 4.427 547 HD1 TRP 63 HD TRP 63 7.016 1.892 5.543 548 HE1 TRP 63 1HE TRP 63 4.776 3.205 5.543 549 HE3 TRP 63 3HE TRP 63 3.816 -1.940 4.480 550 HZ2 TRP 63 2HZ TRP 63 2.064 2.673 5.122 551 HZ3 TRP 63 3HZ TRP 63 1.419 -1.455 4.289 552 HH2 TRP 63 HH TRP 63 0.565 0.801 4.604 553 H GLN 64 H GLN 64 9.507 -2.177 6.246 554 HA GLN 64 HA GLN 64 10.528 0.329 7.365 555 1HB GLN 64 2HB GLN 64 11.667 -2.437 7.834 556 2HB GLN 64 1HB GLN 64 12.237 -0.940 8.548 557 1HG GLN 64 2HG GLN 64 9.995 -0.777 9.722 558 2HG GLN 64 1HG GLN 64 9.658 -2.368 9.085 559 1HE2 GLN 64 1HE2 GLN 64 9.976 -1.398 11.813 560 2HE2 GLN 64 2HE2 GLN 64 11.160 -2.446 12.535 561 HA PRO 65 HA PRO 65 12.377 0.005 3.255 562 1HB PRO 65 2HB PRO 65 13.731 2.512 3.954 563 2HB PRO 65 1HB PRO 65 12.498 2.217 2.725 564 1HG PRO 65 2HG PRO 65 11.951 3.642 4.929 565 2HG PRO 65 1HG PRO 65 10.750 2.555 4.204 566 1HD PRO 65 2HD PRO 65 12.557 2.065 6.553 567 2HD PRO 65 1HD PRO 65 10.807 1.773 6.403 568 H GLU 66 H GLU 66 13.657 -1.396 5.257 569 HA GLU 66 HA GLU 66 16.426 -1.305 4.421 570 1HB GLU 66 2HB GLU 66 16.369 0.209 6.390 571 2HB GLU 66 1HB GLU 66 15.672 -1.085 7.351 572 1HG GLU 66 2HG GLU 66 17.732 -2.404 6.982 573 2HG GLU 66 1HG GLU 66 18.420 -1.022 6.131 574 1H MET 67 1HT MET 67 -12.668 1.337 -8.629 575 2H MET 67 2HT MET 67 -12.342 2.408 -7.345 576 3H MET 67 3HT MET 67 -11.376 1.076 -7.585 577 HA MET 67 HA MET 67 -10.515 1.879 -9.612 578 1HB MET 67 2HB MET 67 -12.207 4.331 -9.042 579 2HB MET 67 1HB MET 67 -11.000 4.202 -10.315 580 1HG MET 67 2HG MET 67 -13.523 2.575 -10.100 581 2HG MET 67 1HG MET 67 -13.255 3.940 -11.179 582 1HE MET 67 1HE MET 67 -14.111 2.326 -13.163 583 2HE MET 67 2HE MET 67 -14.259 0.983 -12.030 584 3HE MET 67 3HE MET 67 -13.368 0.772 -13.537 585 H ILE 68 H ILE 68 -8.498 2.750 -9.408 586 HA ILE 68 HA ILE 68 -7.884 3.992 -6.818 587 HB ILE 68 HB ILE 68 -5.954 2.803 -8.854 588 1HG1 ILE 68 2HG1 ILE 68 -7.370 1.007 -7.949 589 2HG1 ILE 68 1HG1 ILE 68 -5.720 0.858 -7.366 590 1HG2 ILE 68 1HG2 ILE 68 -5.490 3.633 -6.000 591 2HG2 ILE 68 2HG2 ILE 68 -4.914 4.465 -7.445 592 3HG2 ILE 68 3HG2 ILE 68 -4.303 2.858 -7.051 593 1HD1 ILE 68 1HD1 ILE 68 -7.331 0.371 -5.619 594 2HD1 ILE 68 2HD1 ILE 68 -8.055 1.967 -5.821 595 3HD1 ILE 68 3HD1 ILE 68 -6.403 1.818 -5.222 596 H ILE 69 H ILE 69 -7.104 6.061 -6.806 597 HA ILE 69 HA ILE 69 -6.522 7.310 -9.384 598 HB ILE 69 HB ILE 69 -7.834 8.693 -6.993 599 1HG1 ILE 69 2HG1 ILE 69 -9.741 9.172 -8.663 600 2HG1 ILE 69 1HG1 ILE 69 -9.047 7.902 -9.652 601 1HG2 ILE 69 1HG2 ILE 69 -6.341 10.180 -8.138 602 2HG2 ILE 69 2HG2 ILE 69 -8.012 10.671 -8.427 603 3HG2 ILE 69 3HG2 ILE 69 -7.114 9.823 -9.684 604 1HD1 ILE 69 1HD1 ILE 69 -9.441 6.294 -7.842 605 2HD1 ILE 69 2HD1 ILE 69 -10.930 7.088 -8.348 606 3HD1 ILE 69 3HD1 ILE 69 -10.132 7.583 -6.857 607 H ASN 70 H ASN 70 -4.504 8.315 -9.422 608 HA ASN 70 HA ASN 70 -2.926 8.039 -7.009 609 1HB ASN 70 2HB ASN 70 -2.210 6.790 -8.957 610 2HB ASN 70 1HB ASN 70 -2.376 8.200 -9.977 611 1HD2 ASN 70 1HD2 ASN 70 -0.218 6.306 -9.316 612 2HD2 ASN 70 2HD2 ASN 70 1.150 7.310 -8.980 613 H ASN 71 H ASN 71 -2.239 9.801 -5.950 614 HA ASN 71 HA ASN 71 -2.518 12.395 -7.282 615 1HB ASN 71 2HB ASN 71 -3.006 11.677 -4.376 616 2HB ASN 71 1HB ASN 71 -2.874 13.321 -4.966 617 1HD2 ASN 71 1HD2 ASN 71 -4.387 12.786 -7.431 618 2HD2 ASN 71 2HD2 ASN 71 -6.026 12.614 -6.929 619 H LEU 72 H LEU 72 -0.354 10.314 -6.816 620 HA LEU 72 HA LEU 72 1.527 11.167 -4.919 621 1HB LEU 72 2HB LEU 72 1.679 8.977 -5.982 622 2HB LEU 72 1HB LEU 72 1.908 9.700 -7.547 623 HG LEU 72 HG LEU 72 3.911 8.566 -6.430 624 1HD1 LEU 72 1HD1 LEU 72 4.255 11.400 -7.372 625 2HD1 LEU 72 2HD1 LEU 72 4.176 9.964 -8.391 626 3HD1 LEU 72 3HD1 LEU 72 5.526 10.180 -7.278 627 1HD2 LEU 72 1HD2 LEU 72 3.913 11.123 -4.842 628 2HD2 LEU 72 2HD2 LEU 72 5.217 9.933 -4.881 629 3HD2 LEU 72 3HD2 LEU 72 3.647 9.500 -4.206 630 H LYS 73 H LYS 73 1.050 12.128 -8.218 631 HA LYS 73 HA LYS 73 3.241 13.832 -8.467 632 1HB LYS 73 2HB LYS 73 1.921 14.933 -10.298 633 2HB LYS 73 1HB LYS 73 2.096 13.193 -10.442 634 1HG LYS 73 2HG LYS 73 -0.186 12.905 -9.577 635 2HG LYS 73 1HG LYS 73 -0.354 14.661 -9.475 636 1HD LYS 73 2HD LYS 73 0.004 14.843 -11.874 637 2HD LYS 73 1HD LYS 73 0.219 13.096 -11.984 638 1HE LYS 73 2HE LYS 73 -2.077 12.760 -11.237 639 2HE LYS 73 1HE LYS 73 -2.291 14.506 -11.087 640 1HZ LYS 73 1HZ LYS 73 -1.928 14.744 -13.438 641 2HZ LYS 73 2HZ LYS 73 -3.158 13.575 -13.233 642 3HZ LYS 73 3HZ LYS 73 -1.604 13.100 -13.594 643 H LEU 74 H LEU 74 -0.029 14.543 -7.217 644 HA LEU 74 HA LEU 74 0.423 17.287 -6.814 645 1HB LEU 74 2HB LEU 74 -1.796 16.028 -6.998 646 2HB LEU 74 1HB LEU 74 -1.532 15.480 -5.366 647 HG LEU 74 HG LEU 74 -3.178 17.340 -5.581 648 1HD1 LEU 74 1HD1 LEU 74 -2.372 18.732 -3.762 649 2HD1 LEU 74 2HD1 LEU 74 -0.759 18.050 -3.957 650 3HD1 LEU 74 3HD1 LEU 74 -2.096 17.017 -3.452 651 1HD2 LEU 74 1HD2 LEU 74 -2.389 19.612 -6.023 652 2HD2 LEU 74 2HD2 LEU 74 -2.143 18.553 -7.413 653 3HD2 LEU 74 3HD2 LEU 74 -0.782 18.979 -6.376 654 H ILE 75 H ILE 75 0.908 14.418 -4.791 655 HA ILE 75 HA ILE 75 1.505 15.754 -2.387 656 HB ILE 75 HB ILE 75 2.101 12.971 -3.388 657 1HG1 ILE 75 2HG1 ILE 75 0.833 12.274 -1.391 658 2HG1 ILE 75 1HG1 ILE 75 0.713 13.944 -0.877 659 1HG2 ILE 75 1HG2 ILE 75 3.286 14.082 -0.851 660 2HG2 ILE 75 2HG2 ILE 75 4.166 13.533 -2.261 661 3HG2 ILE 75 3HG2 ILE 75 3.254 12.370 -1.287 662 1HD1 ILE 75 1HD1 ILE 75 -0.538 12.745 -3.335 663 2HD1 ILE 75 2HD1 ILE 75 -0.678 14.427 -2.823 664 3HD1 ILE 75 3HD1 ILE 75 -1.361 13.141 -1.827 665 H ARG 76 H ARG 76 3.501 14.850 -5.079 666 HA ARG 76 HA ARG 76 6.069 15.498 -4.129 667 1HB ARG 76 2HB ARG 76 4.937 15.917 -6.885 668 2HB ARG 76 1HB ARG 76 6.637 15.918 -6.473 669 1HG ARG 76 2HG ARG 76 6.672 13.632 -6.125 670 2HG ARG 76 1HG ARG 76 4.913 13.541 -5.964 671 1HD ARG 76 2HD ARG 76 5.322 12.700 -8.091 672 2HD ARG 76 1HD ARG 76 4.808 14.352 -8.363 673 HE ARG 76 HE ARG 76 7.280 13.116 -9.037 674 1HH1 ARG 76 1HH1 ARG 76 6.179 16.408 -8.201 675 2HH1 ARG 76 2HH1 ARG 76 7.104 17.145 -9.390 676 1HH2 ARG 76 1HH2 ARG 76 8.295 14.094 -10.743 677 2HH2 ARG 76 2HH2 ARG 76 8.287 15.807 -10.993 678 H GLU 77 H GLU 77 3.522 17.491 -5.667 679 HA GLU 77 HA GLU 77 5.048 19.835 -5.762 680 1HB GLU 77 2HB GLU 77 2.076 19.433 -6.003 681 2HB GLU 77 1HB GLU 77 2.946 20.904 -6.406 682 1HG GLU 77 2HG GLU 77 3.164 18.233 -7.766 683 2HG GLU 77 1HG GLU 77 2.452 19.710 -8.412 684 H LYS 78 H LYS 78 2.683 18.592 -3.442 685 HA LYS 78 HA LYS 78 2.625 20.840 -1.823 686 1HB LYS 78 2HB LYS 78 2.402 17.951 -0.968 687 2HB LYS 78 1HB LYS 78 2.071 19.315 0.098 688 1HG LYS 78 2HG LYS 78 0.345 20.086 -1.508 689 2HG LYS 78 1HG LYS 78 0.623 18.621 -2.446 690 1HD LYS 78 2HD LYS 78 -0.290 18.708 0.430 691 2HD LYS 78 1HD LYS 78 -1.342 18.463 -0.962 692 1HE LYS 78 2HE LYS 78 -0.079 16.430 -1.521 693 2HE LYS 78 1HE LYS 78 0.919 16.675 -0.090 694 1HZ LYS 78 1HZ LYS 78 -0.867 15.094 0.373 695 2HZ LYS 78 2HZ LYS 78 -2.007 16.208 -0.124 696 3HZ LYS 78 3HZ LYS 78 -1.094 16.498 1.266 697 H LYS 79 H LYS 79 5.081 18.408 -1.980 698 HA LYS 79 HA LYS 79 6.767 19.922 -0.121 699 1HB LYS 79 2HB LYS 79 7.274 17.355 -1.692 700 2HB LYS 79 1HB LYS 79 8.405 18.065 -0.555 701 1HG LYS 79 2HG LYS 79 5.669 17.026 0.169 702 2HG LYS 79 1HG LYS 79 7.170 16.119 0.345 703 1HD LYS 79 2HD LYS 79 8.010 17.857 1.872 704 2HD LYS 79 1HD LYS 79 6.483 18.721 1.713 705 1HE LYS 79 2HE LYS 79 6.783 15.913 2.790 706 2HE LYS 79 1HE LYS 79 6.643 17.357 3.784 707 1HZ LYS 79 1HZ LYS 79 4.537 16.224 3.588 708 2HZ LYS 79 2HZ LYS 79 4.554 16.345 1.896 709 3HZ LYS 79 3HZ LYS 79 4.433 17.730 2.842 710 H LYS 80 H LYS 80 9.467 20.033 -1.837 711 HA LYS 80 HA LYS 80 8.280 20.348 -4.347 712 1HB LYS 80 2HB LYS 80 10.200 21.961 -4.732 713 2HB LYS 80 1HB LYS 80 8.938 22.541 -3.659 714 1HG LYS 80 2HG LYS 80 10.338 22.123 -1.730 715 2HG LYS 80 1HG LYS 80 11.579 21.400 -2.758 716 1HD LYS 80 2HD LYS 80 10.610 24.244 -3.025 717 2HD LYS 80 1HD LYS 80 12.034 23.768 -2.094 718 1HE LYS 80 2HE LYS 80 11.653 23.170 -5.024 719 2HE LYS 80 1HE LYS 80 12.515 24.581 -4.408 720 1HZ LYS 80 1HZ LYS 80 13.294 21.750 -3.820 721 2HZ LYS 80 2HZ LYS 80 14.076 23.159 -3.335 722 3HZ LYS 80 3HZ LYS 80 14.034 22.766 -4.960 723 H ILE 81 H ILE 81 8.580 18.087 -4.257 724 HA ILE 81 HA ILE 81 11.367 17.313 -4.673 725 HB ILE 81 HB ILE 81 9.054 15.664 -3.579 726 1HG1 ILE 81 2HG1 ILE 81 11.618 16.638 -2.292 727 2HG1 ILE 81 1HG1 ILE 81 9.997 17.232 -1.958 728 1HG2 ILE 81 1HG2 ILE 81 11.906 14.836 -4.079 729 2HG2 ILE 81 2HG2 ILE 81 10.502 14.307 -5.007 730 3HG2 ILE 81 3HG2 ILE 81 10.661 13.853 -3.311 731 1HD1 ILE 81 1HD1 ILE 81 9.396 15.049 -1.041 732 2HD1 ILE 81 2HD1 ILE 81 10.781 15.748 -0.203 733 3HD1 ILE 81 3HD1 ILE 81 11.022 14.459 -1.382 734 H SER 82 H SER 82 11.806 16.848 -6.708 735 HA SER 82 HA SER 82 9.565 16.324 -8.477 736 1HB SER 82 2HB SER 82 12.295 17.478 -9.070 737 2HB SER 82 1HB SER 82 10.953 17.323 -10.208 738 HG SER 82 HG SER 82 9.743 18.648 -8.737 739 H GLN 83 H GLN 83 11.024 15.342 -10.649 740 HA GLN 83 HA GLN 83 10.931 12.621 -10.110 741 1HB GLN 83 2HB GLN 83 12.227 14.084 -12.385 742 2HB GLN 83 1HB GLN 83 11.975 12.345 -12.334 743 1HG GLN 83 2HG GLN 83 9.608 12.629 -12.286 744 2HG GLN 83 1HG GLN 83 9.778 14.376 -12.124 745 1HE2 GLN 83 1HE2 GLN 83 8.582 14.709 -13.949 746 2HE2 GLN 83 2HE2 GLN 83 9.199 14.446 -15.539 747 H SER 84 H SER 84 13.909 14.672 -10.449 748 HA SER 84 HA SER 84 15.580 12.440 -10.249 749 1HB SER 84 2HB SER 84 16.195 15.345 -9.758 750 2HB SER 84 1HB SER 84 17.354 14.073 -10.162 751 HG SER 84 HG SER 84 16.462 15.495 -11.930 752 H GLU 85 H GLU 85 14.356 14.774 -7.870 753 HA GLU 85 HA GLU 85 15.876 13.962 -5.685 754 1HB GLU 85 2HB GLU 85 13.047 15.014 -5.803 755 2HB GLU 85 1HB GLU 85 13.887 14.705 -4.295 756 1HG GLU 85 2HG GLU 85 13.888 17.062 -4.850 757 2HG GLU 85 1HG GLU 85 15.522 16.411 -4.857 758 H LEU 86 H LEU 86 12.674 12.817 -6.767 759 HA LEU 86 HA LEU 86 12.420 10.843 -4.802 760 1HB LEU 86 2HB LEU 86 11.101 11.273 -7.454 761 2HB LEU 86 1HB LEU 86 10.706 9.896 -6.448 762 HG LEU 86 HG LEU 86 10.418 12.767 -5.564 763 1HD1 LEU 86 1HD1 LEU 86 8.890 12.269 -7.402 764 2HD1 LEU 86 2HD1 LEU 86 8.020 12.417 -5.876 765 3HD1 LEU 86 3HD1 LEU 86 8.343 10.823 -6.558 766 1HD2 LEU 86 1HD2 LEU 86 9.094 11.783 -3.760 767 2HD2 LEU 86 2HD2 LEU 86 10.752 11.183 -3.745 768 3HD2 LEU 86 3HD2 LEU 86 9.455 10.168 -4.376 769 H ALA 87 H ALA 87 13.696 10.740 -8.077 770 HA ALA 87 HA ALA 87 14.030 7.992 -8.320 771 1HB ALA 87 1HB ALA 87 15.808 10.171 -9.410 772 2HB ALA 87 2HB ALA 87 14.341 9.558 -10.175 773 3HB ALA 87 3HB ALA 87 15.744 8.505 -9.983 774 H ALA 88 H ALA 88 16.340 10.428 -7.091 775 HA ALA 88 HA ALA 88 18.339 8.615 -6.415 776 1HB ALA 88 1HB ALA 88 18.702 11.025 -6.660 777 2HB ALA 88 2HB ALA 88 19.283 10.434 -5.104 778 3HB ALA 88 3HB ALA 88 17.757 11.310 -5.201 779 H LEU 89 H LEU 89 15.662 9.924 -4.478 780 HA LEU 89 HA LEU 89 16.530 8.787 -2.020 781 1HB LEU 89 2HB LEU 89 13.741 9.590 -2.848 782 2HB LEU 89 1HB LEU 89 14.244 9.223 -1.215 783 HG LEU 89 HG LEU 89 15.191 11.566 -2.868 784 1HD1 LEU 89 1HD1 LEU 89 12.878 11.790 -2.186 785 2HD1 LEU 89 2HD1 LEU 89 13.901 12.907 -1.283 786 3HD1 LEU 89 3HD1 LEU 89 13.319 11.429 -0.516 787 1HD2 LEU 89 1HD2 LEU 89 16.910 10.795 -1.312 788 2HD2 LEU 89 2HD2 LEU 89 15.748 10.854 0.013 789 3HD2 LEU 89 3HD2 LEU 89 16.238 12.343 -0.798 790 H LEU 90 H LEU 90 14.263 7.616 -4.535 791 HA LEU 90 HA LEU 90 13.577 5.341 -2.916 792 1HB LEU 90 2HB LEU 90 12.791 5.974 -5.744 793 2HB LEU 90 1HB LEU 90 12.048 4.789 -4.693 794 HG LEU 90 HG LEU 90 11.957 7.785 -4.375 795 1HD1 LEU 90 1HD1 LEU 90 10.586 6.991 -6.185 796 2HD1 LEU 90 2HD1 LEU 90 9.577 7.512 -4.836 797 3HD1 LEU 90 3HD1 LEU 90 9.841 5.793 -5.127 798 1HD2 LEU 90 1HD2 LEU 90 10.398 7.378 -2.538 799 2HD2 LEU 90 2HD2 LEU 90 11.982 6.681 -2.194 800 3HD2 LEU 90 3HD2 LEU 90 10.652 5.643 -2.703 801 H GLU 91 H GLU 91 16.153 6.030 -4.892 802 HA GLU 91 HA GLU 91 17.775 4.841 -5.906 803 1HB GLU 91 2HB GLU 91 16.489 2.438 -4.577 804 2HB GLU 91 1HB GLU 91 18.080 2.460 -5.318 805 1HG GLU 91 2HG GLU 91 18.811 4.099 -3.645 806 2HG GLU 91 1HG GLU 91 17.220 4.013 -2.888 807 H VAL 92 H VAL 92 15.457 5.442 -7.391 808 HA VAL 92 HA VAL 92 15.339 3.163 -9.211 809 HB VAL 92 HB VAL 92 13.022 3.790 -9.799 810 1HG1 VAL 92 1HG1 VAL 92 13.318 2.038 -8.160 811 2HG1 VAL 92 2HG1 VAL 92 11.873 2.980 -7.793 812 3HG1 VAL 92 3HG1 VAL 92 13.349 3.227 -6.859 813 1HG2 VAL 92 1HG2 VAL 92 13.214 5.745 -7.504 814 2HG2 VAL 92 2HG2 VAL 92 11.733 5.341 -8.369 815 3HG2 VAL 92 3HG2 VAL 92 13.054 6.151 -9.213 816 H SER 93 H SER 93 14.627 4.003 -11.423 817 HA SER 93 HA SER 93 16.290 6.243 -12.040 818 1HB SER 93 2HB SER 93 14.462 4.595 -13.787 819 2HB SER 93 1HB SER 93 15.706 5.717 -14.347 820 HG SER 93 HG SER 93 17.109 4.371 -12.897 821 H ARG 94 H ARG 94 15.520 8.091 -13.244 822 HA ARG 94 HA ARG 94 13.386 9.456 -12.012 823 1HB ARG 94 2HB ARG 94 14.646 10.022 -14.697 824 2HB ARG 94 1HB ARG 94 13.702 11.155 -13.741 825 1HG ARG 94 2HG ARG 94 15.399 11.189 -12.031 826 2HG ARG 94 1HG ARG 94 16.321 9.947 -12.880 827 1HD ARG 94 2HD ARG 94 17.292 12.095 -13.342 828 2HD ARG 94 1HD ARG 94 16.532 11.473 -14.803 829 HE ARG 94 HE ARG 94 15.442 13.559 -13.060 830 1HH1 ARG 94 1HH1 ARG 94 15.573 12.013 -16.289 831 2HH1 ARG 94 2HH1 ARG 94 14.833 13.332 -17.067 832 1HH2 ARG 94 1HH2 ARG 94 14.373 15.298 -14.172 833 2HH2 ARG 94 2HH2 ARG 94 14.179 15.249 -15.872 834 H GLN 95 H GLN 95 13.648 7.763 -15.060 835 HA GLN 95 HA GLN 95 11.120 8.230 -16.150 836 1HB GLN 95 2HB GLN 95 12.874 7.229 -17.429 837 2HB GLN 95 1HB GLN 95 12.977 5.868 -16.328 838 1HG GLN 95 2HG GLN 95 10.716 5.179 -17.033 839 2HG GLN 95 1HG GLN 95 10.712 6.503 -18.199 840 1HE2 GLN 95 1HE2 GLN 95 10.620 3.587 -18.524 841 2HE2 GLN 95 2HE2 GLN 95 11.911 3.181 -19.594 842 H THR 96 H THR 96 12.200 5.861 -13.770 843 HA THR 96 HA THR 96 9.922 4.245 -13.750 844 HB THR 96 HB THR 96 11.887 4.715 -11.509 845 HG1 THR 96 1HG THR 96 13.044 2.976 -12.619 846 1HG2 THR 96 1HG2 THR 96 9.938 3.295 -10.963 847 2HG2 THR 96 2HG2 THR 96 11.426 2.347 -11.009 848 3HG2 THR 96 3HG2 THR 96 10.295 2.278 -12.360 849 H ILE 97 H ILE 97 10.980 6.878 -11.518 850 HA ILE 97 HA ILE 97 8.562 6.749 -10.072 851 HB ILE 97 HB ILE 97 10.558 7.647 -8.980 852 1HG1 ILE 97 2HG1 ILE 97 9.595 9.689 -7.958 853 2HG1 ILE 97 1HG1 ILE 97 8.373 9.721 -9.220 854 1HG2 ILE 97 1HG2 ILE 97 11.457 9.863 -9.499 855 2HG2 ILE 97 2HG2 ILE 97 10.366 9.975 -10.879 856 3HG2 ILE 97 3HG2 ILE 97 11.628 8.745 -10.854 857 1HD1 ILE 97 1HD1 ILE 97 7.516 7.569 -8.438 858 2HD1 ILE 97 2HD1 ILE 97 7.490 8.789 -7.165 859 3HD1 ILE 97 3HD1 ILE 97 8.743 7.545 -7.171 860 H ASN 98 H ASN 98 9.577 8.682 -12.788 861 HA ASN 98 HA ASN 98 7.380 10.421 -12.920 862 1HB ASN 98 2HB ASN 98 9.474 10.617 -14.278 863 2HB ASN 98 1HB ASN 98 8.939 9.249 -15.239 864 1HD2 ASN 98 1HD2 ASN 98 6.859 11.876 -14.060 865 2HD2 ASN 98 2HD2 ASN 98 6.508 12.477 -15.626 866 H GLY 99 H GLY 99 7.868 7.162 -14.045 867 1HA GLY 99 2HA GLY 99 5.425 6.787 -15.425 868 2HA GLY 99 1HA GLY 99 6.417 5.508 -14.732 869 H ILE 100 H ILE 100 6.306 6.522 -11.988 870 HA ILE 100 HA ILE 100 3.883 5.426 -11.081 871 HB ILE 100 HB ILE 100 5.900 7.189 -9.644 872 1HG1 ILE 100 2HG1 ILE 100 6.942 5.141 -10.476 873 2HG1 ILE 100 1HG1 ILE 100 6.828 5.108 -8.723 874 1HG2 ILE 100 1HG2 ILE 100 3.759 5.427 -8.465 875 2HG2 ILE 100 2HG2 ILE 100 3.794 7.191 -8.455 876 3HG2 ILE 100 3HG2 ILE 100 5.006 6.279 -7.552 877 1HD1 ILE 100 1HD1 ILE 100 5.017 3.667 -10.645 878 2HD1 ILE 100 2HD1 ILE 100 4.901 3.618 -8.885 879 3HD1 ILE 100 3HD1 ILE 100 6.314 2.944 -9.696 880 H GLU 101 H GLU 101 5.127 8.743 -11.330 881 HA GLU 101 HA GLU 101 3.017 10.223 -10.338 882 1HB GLU 101 2HB GLU 101 4.700 10.876 -12.740 883 2HB GLU 101 1HB GLU 101 3.765 12.023 -11.803 884 1HG GLU 101 2HG GLU 101 5.184 11.692 -9.904 885 2HG GLU 101 1HG GLU 101 6.059 10.410 -10.747 886 H LYS 102 H LYS 102 3.412 8.820 -13.523 887 HA LYS 102 HA LYS 102 0.929 10.010 -14.454 888 1HB LYS 102 2HB LYS 102 2.961 8.314 -15.915 889 2HB LYS 102 1HB LYS 102 1.542 9.054 -16.647 890 1HG LYS 102 2HG LYS 102 2.426 11.276 -15.988 891 2HG LYS 102 1HG LYS 102 3.881 10.475 -15.400 892 1HD LYS 102 2HD LYS 102 2.867 10.375 -18.238 893 2HD LYS 102 1HD LYS 102 4.138 11.447 -17.659 894 1HE LYS 102 2HE LYS 102 5.478 9.480 -17.038 895 2HE LYS 102 1HE LYS 102 4.208 8.431 -17.672 896 1HZ LYS 102 1HZ LYS 102 4.529 9.497 -19.853 897 2HZ LYS 102 2HZ LYS 102 5.902 8.695 -19.314 898 3HZ LYS 102 3HZ LYS 102 5.813 10.397 -19.217 899 H ASN 103 H ASN 103 1.428 7.615 -12.511 900 HA ASN 103 HA ASN 103 0.510 5.678 -11.870 901 1HB ASN 103 2HB ASN 103 -1.880 5.500 -11.914 902 2HB ASN 103 1HB ASN 103 -1.517 7.206 -11.844 903 1HD2 ASN 103 1HD2 ASN 103 -3.445 7.927 -12.665 904 2HD2 ASN 103 2HD2 ASN 103 -3.985 7.613 -14.275 905 H LYS 104 H LYS 104 2.015 5.475 -14.368 906 HA LYS 104 HA LYS 104 0.340 3.769 -16.047 907 1HB LYS 104 2HB LYS 104 1.548 5.724 -17.037 908 2HB LYS 104 1HB LYS 104 3.061 4.968 -16.576 909 1HG LYS 104 2HG LYS 104 2.733 4.530 -18.871 910 2HG LYS 104 1HG LYS 104 2.417 3.022 -18.017 911 1HD LYS 104 2HD LYS 104 0.012 3.425 -18.172 912 2HD LYS 104 1HD LYS 104 0.317 4.962 -18.986 913 1HE LYS 104 2HE LYS 104 -0.204 3.397 -20.688 914 2HE LYS 104 1HE LYS 104 1.535 3.660 -20.760 915 1HZ LYS 104 1HZ LYS 104 0.054 1.322 -19.761 916 2HZ LYS 104 2HZ LYS 104 1.657 1.546 -19.297 917 3HZ LYS 104 3HZ LYS 104 1.277 1.355 -20.933 918 H TYR 105 H TYR 105 3.165 3.922 -14.056 919 HA TYR 105 HA TYR 105 4.325 1.463 -14.872 920 1HB TYR 105 2HB TYR 105 5.481 3.477 -13.851 921 2HB TYR 105 1HB TYR 105 4.808 2.974 -12.308 922 HD1 TYR 105 1HD TYR 105 6.983 2.026 -15.030 923 HD2 TYR 105 2HD TYR 105 5.856 1.234 -11.044 924 HE1 TYR 105 1HE TYR 105 8.969 0.526 -14.778 925 HE2 TYR 105 2HE TYR 105 7.792 -0.250 -10.752 926 HH TYR 105 HH TYR 105 9.261 -1.531 -12.050 927 H ASN 106 H ASN 106 1.864 2.370 -12.689 928 HA ASN 106 HA ASN 106 0.653 1.411 -11.063 929 1HB ASN 106 2HB ASN 106 0.104 -0.259 -12.849 930 2HB ASN 106 1HB ASN 106 1.456 -1.250 -12.304 931 1HD2 ASN 106 1HD2 ASN 106 0.133 -2.986 -11.750 932 2HD2 ASN 106 2HD2 ASN 106 -0.901 -2.933 -10.367 933 HA PRO 107 HA PRO 107 4.294 1.168 -8.431 934 1HB PRO 107 2HB PRO 107 2.376 2.130 -6.415 935 2HB PRO 107 1HB PRO 107 3.906 2.833 -6.943 936 1HG PRO 107 2HG PRO 107 1.552 3.928 -7.614 937 2HG PRO 107 1HG PRO 107 2.940 3.943 -8.719 938 1HD PRO 107 2HD PRO 107 0.524 2.189 -8.728 939 2HD PRO 107 1HD PRO 107 1.380 2.940 -10.091 940 H SER 108 H SER 108 4.979 -0.560 -7.347 941 HA SER 108 HA SER 108 3.188 -2.486 -6.274 942 1HB SER 108 2HB SER 108 5.442 -3.476 -5.580 943 2HB SER 108 1HB SER 108 5.199 -3.265 -7.319 944 HG SER 108 HG SER 108 7.176 -2.440 -6.873 945 H LEU 109 H LEU 109 3.654 -3.143 -3.899 946 HA LEU 109 HA LEU 109 3.187 -0.782 -2.412 947 1HB LEU 109 2HB LEU 109 2.137 -3.061 -1.952 948 2HB LEU 109 1HB LEU 109 3.655 -3.520 -1.217 949 HG LEU 109 HG LEU 109 1.763 -2.824 0.356 950 1HD1 LEU 109 1HD1 LEU 109 4.377 -1.352 0.607 951 2HD1 LEU 109 2HD1 LEU 109 4.046 -2.994 1.157 952 3HD1 LEU 109 3HD1 LEU 109 3.219 -1.631 1.908 953 1HD2 LEU 109 1HD2 LEU 109 1.448 -0.388 0.714 954 2HD2 LEU 109 2HD2 LEU 109 0.946 -0.859 -0.895 955 3HD2 LEU 109 3HD2 LEU 109 2.479 -0.055 -0.665 956 H GLN 110 H GLN 110 6.122 -2.911 -2.742 957 HA GLN 110 HA GLN 110 7.690 -1.743 -0.882 958 1HB GLN 110 2HB GLN 110 8.296 -3.686 -2.238 959 2HB GLN 110 1HB GLN 110 8.354 -2.692 -3.678 960 1HG GLN 110 2HG GLN 110 10.583 -3.242 -2.890 961 2HG GLN 110 1HG GLN 110 10.291 -1.509 -2.806 962 1HE2 GLN 110 1HE2 GLN 110 10.692 -4.434 -0.957 963 2HE2 GLN 110 2HE2 GLN 110 11.017 -3.644 0.551 964 H LEU 111 H LEU 111 7.251 -0.636 -4.245 965 HA LEU 111 HA LEU 111 8.815 1.672 -3.932 966 1HB LEU 111 2HB LEU 111 6.729 0.900 -5.924 967 2HB LEU 111 1HB LEU 111 7.259 2.566 -5.874 968 HG LEU 111 HG LEU 111 9.563 1.859 -6.358 969 1HD1 LEU 111 1HD1 LEU 111 8.440 -0.922 -6.585 970 2HD1 LEU 111 2HD1 LEU 111 9.566 -0.349 -5.354 971 3HD1 LEU 111 3HD1 LEU 111 10.068 -0.422 -7.043 972 1HD2 LEU 111 1HD2 LEU 111 9.206 1.168 -8.673 973 2HD2 LEU 111 2HD2 LEU 111 8.092 2.450 -8.189 974 3HD2 LEU 111 3HD2 LEU 111 7.526 0.782 -8.294 975 H ALA 112 H ALA 112 5.403 1.161 -3.364 976 HA ALA 112 HA ALA 112 4.755 3.872 -2.939 977 1HB ALA 112 1HB ALA 112 3.076 2.167 -3.454 978 2HB ALA 112 2HB ALA 112 2.676 3.050 -1.980 979 3HB ALA 112 3HB ALA 112 3.353 1.423 -1.879 980 H LEU 113 H LEU 113 5.856 1.313 -0.690 981 HA LEU 113 HA LEU 113 5.248 2.728 1.637 982 1HB LEU 113 2HB LEU 113 6.405 0.989 2.825 983 2HB LEU 113 1HB LEU 113 5.577 0.281 1.463 984 HG LEU 113 HG LEU 113 7.884 0.326 0.302 985 1HD1 LEU 113 1HD1 LEU 113 9.788 0.040 1.806 986 2HD1 LEU 113 2HD1 LEU 113 8.761 0.428 3.186 987 3HD1 LEU 113 3HD1 LEU 113 9.088 1.653 1.957 988 1HD2 LEU 113 1HD2 LEU 113 8.385 -1.879 1.224 989 2HD2 LEU 113 2HD2 LEU 113 6.660 -1.680 0.907 990 3HD2 LEU 113 3HD2 LEU 113 7.273 -1.570 2.558 991 H LYS 114 H LYS 114 8.169 2.552 -0.292 992 HA LYS 114 HA LYS 114 9.588 4.135 1.546 993 1HB LYS 114 2HB LYS 114 11.314 4.350 -0.303 994 2HB LYS 114 1HB LYS 114 10.936 2.734 0.268 995 1HG LYS 114 2HG LYS 114 9.425 2.484 -1.697 996 2HG LYS 114 1HG LYS 114 10.059 4.007 -2.315 997 1HD LYS 114 2HD LYS 114 11.241 2.120 -3.306 998 2HD LYS 114 1HD LYS 114 12.332 3.046 -2.267 999 1HE LYS 114 2HE LYS 114 11.996 1.447 -0.465 1000 2HE LYS 114 1HE LYS 114 10.888 0.508 -1.456 1001 1HZ LYS 114 1HZ LYS 114 13.769 1.002 -2.021 1002 2HZ LYS 114 2HZ LYS 114 12.792 0.039 -2.979 1003 3HZ LYS 114 3HZ LYS 114 13.168 -0.433 -1.405 1004 H ILE 115 H ILE 115 7.706 4.933 -1.254 1005 HA ILE 115 HA ILE 115 8.310 7.690 -1.368 1006 HB ILE 115 HB ILE 115 5.655 6.320 -1.948 1007 1HG1 ILE 115 2HG1 ILE 115 7.834 7.227 -3.847 1008 2HG1 ILE 115 1HG1 ILE 115 7.540 5.562 -3.361 1009 1HG2 ILE 115 1HG2 ILE 115 6.565 9.096 -2.697 1010 2HG2 ILE 115 2HG2 ILE 115 5.316 8.690 -1.521 1011 3HG2 ILE 115 3HG2 ILE 115 5.070 8.328 -3.229 1012 1HD1 ILE 115 1HD1 ILE 115 5.637 7.313 -4.910 1013 2HD1 ILE 115 2HD1 ILE 115 5.340 5.644 -4.425 1014 3HD1 ILE 115 3HD1 ILE 115 6.633 6.012 -5.567 1015 H ALA 116 H ALA 116 5.966 5.871 0.494 1016 HA ALA 116 HA ALA 116 4.599 7.928 1.807 1017 1HB ALA 116 1HB ALA 116 3.890 5.577 1.813 1018 2HB ALA 116 2HB ALA 116 4.031 6.225 3.459 1019 3HB ALA 116 3HB ALA 116 5.302 5.192 2.804 1020 H TYR 117 H TYR 117 7.490 6.143 2.660 1021 HA TYR 117 HA TYR 117 7.842 7.296 5.184 1022 1HB TYR 117 2HB TYR 117 8.745 5.143 4.750 1023 2HB TYR 117 1HB TYR 117 9.660 5.733 3.371 1024 HD1 TYR 117 1HD TYR 117 11.791 6.351 3.621 1025 HD2 TYR 117 2HD TYR 117 9.376 6.097 7.068 1026 HE1 TYR 117 1HE TYR 117 13.804 6.734 5.040 1027 HE2 TYR 117 2HE TYR 117 11.331 6.472 8.507 1028 HH TYR 117 HH TYR 117 14.333 7.503 7.214 1029 H TYR 118 H TYR 118 9.531 7.980 2.075 1030 HA TYR 118 HA TYR 118 11.190 9.954 3.247 1031 1HB TYR 118 2HB TYR 118 10.502 9.465 0.357 1032 2HB TYR 118 1HB TYR 118 11.609 10.731 0.875 1033 HD1 TYR 118 1HD TYR 118 13.623 9.970 2.321 1034 HD2 TYR 118 2HD TYR 118 11.300 7.344 -0.065 1035 HE1 TYR 118 1HE TYR 118 15.478 8.363 2.295 1036 HE2 TYR 118 2HE TYR 118 13.136 5.727 -0.090 1037 HH TYR 118 HH TYR 118 15.570 5.841 0.126 1038 H LEU 119 H LEU 119 8.142 10.172 1.666 1039 HA LEU 119 HA LEU 119 8.114 13.069 1.755 1040 1HB LEU 119 2HB LEU 119 6.023 11.037 0.996 1041 2HB LEU 119 1HB LEU 119 5.601 12.718 1.195 1042 1HD1 LEU 119 1HD1 LEU 119 6.381 14.401 -0.495 1043 2HD1 LEU 119 2HD1 LEU 119 7.440 13.898 -1.812 1044 3HD1 LEU 119 3HD1 LEU 119 8.054 13.962 -0.160 1045 1HD2 LEU 119 1HD2 LEU 119 8.734 11.456 -0.506 1046 2HD2 LEU 119 2HD2 LEU 119 8.042 11.585 -2.123 1047 3HD2 LEU 119 3HD2 LEU 119 7.470 10.338 -1.015 1048 H ASN 120 H ASN 120 7.602 10.654 3.965 1049 HA ASN 120 HA ASN 120 6.433 10.287 5.839 1050 1HB ASN 120 2HB ASN 120 8.094 11.983 6.663 1051 2HB ASN 120 1HB ASN 120 6.916 13.249 6.339 1052 1HD2 ASN 120 1HD2 ASN 120 7.732 10.563 8.384 1053 2HD2 ASN 120 2HD2 ASN 120 6.638 10.931 9.660 1054 H THR 121 H THR 121 4.688 9.939 4.382 1055 HA THR 121 HA THR 121 2.379 11.477 5.136 1056 HB THR 121 HB THR 121 3.273 11.094 2.256 1057 HG1 THR 121 1HG THR 121 3.896 12.985 3.916 1058 1HG2 THR 121 1HG2 THR 121 0.784 12.387 3.370 1059 2HG2 THR 121 2HG2 THR 121 0.855 10.852 2.501 1060 3HG2 THR 121 3HG2 THR 121 1.252 12.356 1.670 1061 HA PRO 122 HA PRO 122 1.101 7.177 5.039 1062 1HB PRO 122 2HB PRO 122 -1.605 7.630 5.201 1063 2HB PRO 122 1HB PRO 122 -0.527 7.632 6.602 1064 1HG PRO 122 2HG PRO 122 -1.604 9.930 5.034 1065 2HG PRO 122 1HG PRO 122 -1.400 9.765 6.788 1066 1HD PRO 122 2HD PRO 122 0.313 11.173 5.270 1067 2HD PRO 122 1HD PRO 122 0.852 10.259 6.697 1068 H LEU 123 H LEU 123 0.332 5.823 3.535 1069 HA LEU 123 HA LEU 123 0.388 6.460 0.852 1070 1HB LEU 123 2HB LEU 123 -0.985 4.147 2.175 1071 2HB LEU 123 1HB LEU 123 -0.737 4.284 0.447 1072 1HD1 LEU 123 1HD2 LEU 123 0.217 2.093 2.350 1073 2HD1 LEU 123 2HD2 LEU 123 1.824 1.911 1.631 1074 3HD1 LEU 123 3HD2 LEU 123 0.402 2.091 0.597 1075 1HD2 LEU 123 1HD1 LEU 123 2.083 5.414 0.519 1076 2HD2 LEU 123 2HD1 LEU 123 1.532 4.087 -0.503 1077 3HD2 LEU 123 3HD1 LEU 123 2.913 3.860 0.568 1078 H GLU 124 H GLU 124 -2.437 6.296 2.950 1079 HA GLU 124 HA GLU 124 -4.442 6.484 1.057 1080 1HB GLU 124 2HB GLU 124 -4.314 7.544 3.868 1081 2HB GLU 124 1HB GLU 124 -5.786 7.527 2.904 1082 1HG GLU 124 2HG GLU 124 -5.780 5.159 2.791 1083 2HG GLU 124 1HG GLU 124 -4.162 5.073 3.479 1084 H ASP 125 H ASP 125 -2.410 9.106 2.299 1085 HA ASP 125 HA ASP 125 -4.016 11.151 1.106 1086 1HB ASP 125 2HB ASP 125 -2.520 11.630 3.023 1087 2HB ASP 125 1HB ASP 125 -1.128 11.275 2.007 1088 H ILE 126 H ILE 126 -1.309 9.254 0.220 1089 HA ILE 126 HA ILE 126 -0.517 10.727 -2.151 1090 HB ILE 126 HB ILE 126 0.295 7.929 -1.298 1091 1HG1 ILE 126 2HG1 ILE 126 1.681 10.571 -0.781 1092 2HG1 ILE 126 1HG1 ILE 126 0.793 9.650 0.425 1093 1HG2 ILE 126 1HG2 ILE 126 2.250 8.329 -2.734 1094 2HG2 ILE 126 2HG2 ILE 126 1.580 9.893 -3.199 1095 3HG2 ILE 126 3HG2 ILE 126 0.745 8.406 -3.649 1096 1HD1 ILE 126 1HD1 ILE 126 2.405 7.822 0.201 1097 2HD1 ILE 126 2HD1 ILE 126 3.188 9.335 0.658 1098 3HD1 ILE 126 3HD1 ILE 126 3.288 8.757 -1.007 1099 H PHE 127 H PHE 127 -1.970 7.557 -1.651 1100 HA PHE 127 HA PHE 127 -3.011 7.732 -4.404 1101 1HB PHE 127 2HB PHE 127 -2.417 5.194 -2.758 1102 2HB PHE 127 1HB PHE 127 -3.097 5.258 -4.383 1103 HD1 PHE 127 1HD PHE 127 -1.643 6.091 -6.238 1104 HD2 PHE 127 2HD PHE 127 -0.165 5.276 -2.331 1105 HE1 PHE 127 1HE PHE 127 0.646 5.955 -7.129 1106 HE2 PHE 127 2HE PHE 127 2.126 5.139 -3.218 1107 HZ PHE 127 HZ PHE 127 2.532 5.481 -5.622 1108 H GLN 128 H GLN 128 -5.198 7.521 -4.650 1109 HA GLN 128 HA GLN 128 -6.655 6.952 -2.192 1110 1HB GLN 128 2HB GLN 128 -8.558 8.304 -3.023 1111 2HB GLN 128 1HB GLN 128 -7.110 9.252 -2.749 1112 1HG GLN 128 2HG GLN 128 -6.694 9.381 -5.098 1113 2HG GLN 128 1HG GLN 128 -8.016 8.265 -5.432 1114 1HE2 GLN 128 1HE2 GLN 128 -7.164 11.487 -4.492 1115 2HE2 GLN 128 2HE2 GLN 128 -8.733 12.179 -4.713 1116 H TRP 129 H TRP 129 -8.204 5.607 -2.195 1117 HA TRP 129 HA TRP 129 -8.595 4.034 -4.609 1118 1HB TRP 129 2HB TRP 129 -8.904 2.212 -2.649 1119 2HB TRP 129 1HB TRP 129 -7.374 2.512 -3.474 1120 HD1 TRP 129 HD TRP 129 -9.197 3.590 -0.211 1121 HE1 TRP 129 1HE TRP 129 -7.412 4.110 1.547 1122 HE3 TRP 129 3HE TRP 129 -5.045 2.971 -3.112 1123 HZ2 TRP 129 2HZ TRP 129 -4.569 4.233 1.668 1124 HZ3 TRP 129 3HZ TRP 129 -2.834 3.302 -2.097 1125 HH2 TRP 129 HH TRP 129 -2.605 3.921 0.241 1126 H GLN 130 H GLN 130 -10.540 4.054 -5.198 1127 HA GLN 130 HA GLN 130 -12.635 4.441 -3.195 1128 1HB GLN 130 2HB GLN 130 -12.674 5.142 -6.147 1129 2HB GLN 130 1HB GLN 130 -14.026 5.340 -5.042 1130 1HG GLN 130 2HG GLN 130 -11.371 6.750 -4.767 1131 2HG GLN 130 1HG GLN 130 -12.795 7.441 -5.534 1132 1HE2 GLN 130 1HE2 GLN 130 -12.849 9.133 -4.033 1133 2HE2 GLN 130 2HE2 GLN 130 -13.384 8.879 -2.408 1134 HA PRO 131 HA PRO 131 -13.164 0.098 -4.557 1135 1HB PRO 131 2HB PRO 131 -14.673 -0.041 -2.019 1136 2HB PRO 131 1HB PRO 131 -13.314 -1.029 -2.562 1137 1HG PRO 131 2HG PRO 131 -13.022 0.773 -0.607 1138 2HG PRO 131 1HG PRO 131 -11.736 0.479 -1.796 1139 1HD PRO 131 2HD PRO 131 -13.741 2.703 -1.688 1140 2HD PRO 131 1HD PRO 131 -11.997 2.777 -2.038 1141 H GLU 132 H GLU 132 -15.336 2.453 -3.345 1142 HA GLU 132 HA GLU 132 -17.475 1.288 -4.952 1143 1HB GLU 132 2HB GLU 132 -17.759 3.031 -2.495 1144 2HB GLU 132 1HB GLU 132 -19.087 2.463 -3.496 1145 1HG GLU 132 2HG GLU 132 -18.376 0.127 -2.943 1146 2HG GLU 132 1HG GLU 132 -17.255 0.828 -1.774 Start of MODEL 6 1 1H MET 1 1HT MET 1 12.270 -5.974 3.477 2 2H MET 1 2HT MET 1 10.972 -4.905 3.584 3 3H MET 1 3HT MET 1 10.741 -6.425 2.929 4 HA MET 1 HA MET 1 11.039 -7.497 4.970 5 1HB MET 1 2HB MET 1 11.816 -4.753 5.896 6 2HB MET 1 1HB MET 1 11.200 -5.945 7.031 7 1HG MET 1 2HG MET 1 13.592 -6.358 5.263 8 2HG MET 1 1HG MET 1 13.664 -5.793 6.933 9 1HE MET 1 1HE MET 1 12.857 -7.235 9.023 10 2HE MET 1 2HE MET 1 12.148 -8.845 8.877 11 3HE MET 1 3HE MET 1 11.288 -7.442 8.247 12 H ILE 2 H ILE 2 9.108 -8.126 5.399 13 HA ILE 2 HA ILE 2 7.056 -6.094 5.876 14 HB ILE 2 HB ILE 2 6.733 -8.727 4.392 15 1HG1 ILE 2 2HG1 ILE 2 7.568 -6.890 2.990 16 2HG1 ILE 2 1HG1 ILE 2 5.928 -7.318 2.523 17 1HG2 ILE 2 1HG2 ILE 2 4.823 -8.472 5.869 18 2HG2 ILE 2 2HG2 ILE 2 4.335 -8.230 4.191 19 3HG2 ILE 2 3HG2 ILE 2 4.541 -6.840 5.257 20 1HD1 ILE 2 1HD1 ILE 2 5.077 -5.381 3.737 21 2HD1 ILE 2 2HD1 ILE 2 6.250 -4.922 2.502 22 3HD1 ILE 2 3HD1 ILE 2 6.724 -4.952 4.199 23 H ILE 3 H ILE 3 5.936 -6.303 7.671 24 HA ILE 3 HA ILE 3 6.207 -8.737 9.258 25 HB ILE 3 HB ILE 3 6.254 -5.851 10.260 26 1HG1 ILE 3 2HG1 ILE 3 8.399 -7.992 10.355 27 2HG1 ILE 3 1HG1 ILE 3 8.405 -6.582 9.307 28 1HG2 ILE 3 1HG2 ILE 3 6.339 -8.432 11.831 29 2HG2 ILE 3 2HG2 ILE 3 4.995 -7.292 11.778 30 3HG2 ILE 3 3HG2 ILE 3 6.531 -6.814 12.505 31 1HD1 ILE 3 1HD1 ILE 3 9.898 -6.291 11.198 32 2HD1 ILE 3 2HD1 ILE 3 8.560 -6.563 12.314 33 3HD1 ILE 3 3HD1 ILE 3 8.566 -5.139 11.275 34 H ASN 4 H ASN 4 4.196 -9.558 9.581 35 HA ASN 4 HA ASN 4 2.027 -7.835 8.689 36 1HB ASN 4 2HB ASN 4 2.443 -9.886 7.412 37 2HB ASN 4 1HB ASN 4 2.200 -10.840 8.871 38 1HD2 ASN 4 1HD2 ASN 4 0.468 -11.956 7.932 39 2HD2 ASN 4 2HD2 ASN 4 -1.045 -11.179 7.705 40 H ASN 5 H ASN 5 0.379 -7.270 9.984 41 HA ASN 5 HA ASN 5 0.266 -8.424 12.709 42 1HB ASN 5 2HB ASN 5 -0.548 -5.648 11.795 43 2HB ASN 5 1HB ASN 5 -0.682 -6.272 13.427 44 1HD2 ASN 5 1HD2 ASN 5 0.661 -3.953 12.345 45 2HD2 ASN 5 2HD2 ASN 5 2.305 -4.058 12.850 46 H LEU 6 H LEU 6 -1.056 -8.820 9.955 47 HA LEU 6 HA LEU 6 -3.683 -8.004 9.837 48 1HB LEU 6 2HB LEU 6 -2.527 -9.032 7.977 49 2HB LEU 6 1HB LEU 6 -2.406 -10.542 8.822 50 HG LEU 6 HG LEU 6 -4.002 -10.385 6.860 51 1HD1 LEU 6 1HD1 LEU 6 -5.101 -11.348 9.473 52 2HD1 LEU 6 2HD1 LEU 6 -4.021 -12.232 8.403 53 3HD1 LEU 6 3HD1 LEU 6 -5.657 -11.829 7.870 54 1HD2 LEU 6 1HD2 LEU 6 -6.242 -9.516 7.320 55 2HD2 LEU 6 2HD2 LEU 6 -5.019 -8.247 7.387 56 3HD2 LEU 6 3HD2 LEU 6 -5.679 -8.913 8.881 57 H LYS 7 H LYS 7 -2.508 -10.895 11.489 58 HA LYS 7 HA LYS 7 -5.021 -11.833 12.305 59 1HB LYS 7 2HB LYS 7 -3.788 -13.152 14.005 60 2HB LYS 7 1HB LYS 7 -3.152 -13.318 12.379 61 1HG LYS 7 2HG LYS 7 -1.327 -11.765 12.959 62 2HG LYS 7 1HG LYS 7 -1.967 -11.654 14.601 63 1HD LYS 7 2HD LYS 7 -1.053 -14.201 13.260 64 2HD LYS 7 1HD LYS 7 -0.104 -13.264 14.416 65 1HE LYS 7 2HE LYS 7 -1.733 -13.659 16.146 66 2HE LYS 7 1HE LYS 7 -2.812 -14.449 14.998 67 1HZ LYS 7 1HZ LYS 7 -1.570 -15.993 16.394 68 2HZ LYS 7 2HZ LYS 7 -0.109 -15.476 15.730 69 3HZ LYS 7 3HZ LYS 7 -1.286 -16.221 14.750 70 H LEU 8 H LEU 8 -2.805 -9.561 13.919 71 HA LEU 8 HA LEU 8 -4.234 -9.369 16.303 72 1HB LEU 8 2HB LEU 8 -1.848 -8.681 15.890 73 2HB LEU 8 1HB LEU 8 -2.433 -7.322 14.968 74 HG LEU 8 HG LEU 8 -1.593 -6.798 17.279 75 1HD1 LEU 8 1HD1 LEU 8 -4.453 -6.060 16.747 76 2HD1 LEU 8 2HD1 LEU 8 -3.022 -5.212 16.164 77 3HD1 LEU 8 3HD1 LEU 8 -3.379 -5.256 17.890 78 1HD2 LEU 8 1HD2 LEU 8 -4.092 -8.245 18.138 79 2HD2 LEU 8 2HD2 LEU 8 -3.060 -7.273 19.187 80 3HD2 LEU 8 3HD2 LEU 8 -2.430 -8.745 18.449 81 H ILE 9 H ILE 9 -4.448 -7.595 13.257 82 HA ILE 9 HA ILE 9 -6.450 -5.804 14.164 83 HB ILE 9 HB ILE 9 -5.558 -6.550 11.356 84 1HG1 ILE 9 2HG1 ILE 9 -4.966 -4.124 11.240 85 2HG1 ILE 9 1HG1 ILE 9 -5.481 -3.953 12.907 86 1HG2 ILE 9 1HG2 ILE 9 -7.804 -4.651 12.003 87 2HG2 ILE 9 2HG2 ILE 9 -7.948 -6.190 11.154 88 3HG2 ILE 9 3HG2 ILE 9 -7.059 -4.855 10.418 89 1HD1 ILE 9 1HD1 ILE 9 -3.703 -5.477 13.593 90 2HD1 ILE 9 2HD1 ILE 9 -3.081 -4.072 12.726 91 3HD1 ILE 9 3HD1 ILE 9 -3.199 -5.633 11.911 92 H ARG 10 H ARG 10 -6.569 -8.932 12.691 93 HA ARG 10 HA ARG 10 -9.370 -9.119 12.471 94 1HB ARG 10 2HB ARG 10 -7.216 -11.182 12.667 95 2HB ARG 10 1HB ARG 10 -8.917 -11.643 12.656 96 1HG ARG 10 2HG ARG 10 -9.247 -10.732 10.516 97 2HG ARG 10 1HG ARG 10 -7.694 -9.903 10.554 98 1HD ARG 10 2HD ARG 10 -7.670 -11.888 9.135 99 2HD ARG 10 1HD ARG 10 -6.527 -11.985 10.464 100 HE ARG 10 HE ARG 10 -8.679 -13.300 11.423 101 1HH1 ARG 10 1HH1 ARG 10 -7.083 -13.539 8.295 102 2HH1 ARG 10 2HH1 ARG 10 -7.078 -15.217 8.217 103 1HH2 ARG 10 1HH2 ARG 10 -8.757 -15.573 11.370 104 2HH2 ARG 10 2HH2 ARG 10 -8.076 -16.443 10.050 105 H GLU 11 H GLU 11 -7.226 -9.710 15.248 106 HA GLU 11 HA GLU 11 -9.353 -10.526 16.890 107 1HB GLU 11 2HB GLU 11 -6.632 -9.422 17.596 108 2HB GLU 11 1HB GLU 11 -7.765 -10.099 18.760 109 1HG GLU 11 2HG GLU 11 -7.725 -12.212 17.394 110 2HG GLU 11 1HG GLU 11 -6.405 -11.499 16.491 111 H LYS 12 H LYS 12 -7.965 -7.399 16.138 112 HA LYS 12 HA LYS 12 -9.385 -5.806 17.924 113 1HB LYS 12 2HB LYS 12 -8.493 -5.152 15.095 114 2HB LYS 12 1HB LYS 12 -9.135 -3.948 16.210 115 1HG LYS 12 2HG LYS 12 -7.302 -4.264 17.721 116 2HG LYS 12 1HG LYS 12 -6.721 -5.647 16.805 117 1HD LYS 12 2HD LYS 12 -5.335 -3.676 16.383 118 2HD LYS 12 1HD LYS 12 -6.179 -4.167 14.919 119 1HE LYS 12 2HE LYS 12 -7.751 -2.372 15.159 120 2HE LYS 12 1HE LYS 12 -7.115 -1.962 16.750 121 1HZ LYS 12 1HZ LYS 12 -5.432 -1.780 14.270 122 2HZ LYS 12 2HZ LYS 12 -5.112 -1.134 15.779 123 3HZ LYS 12 3HZ LYS 12 -6.373 -0.521 14.861 124 H LYS 13 H LYS 13 -10.496 -7.088 14.839 125 HA LYS 13 HA LYS 13 -13.254 -6.328 15.579 126 1HB LYS 13 2HB LYS 13 -12.103 -7.240 12.893 127 2HB LYS 13 1HB LYS 13 -13.788 -6.821 13.173 128 1HG LYS 13 2HG LYS 13 -11.436 -4.935 13.372 129 2HG LYS 13 1HG LYS 13 -12.622 -4.989 12.063 130 1HD LYS 13 2HD LYS 13 -14.389 -4.340 13.559 131 2HD LYS 13 1HD LYS 13 -13.323 -4.489 14.950 132 1HE LYS 13 2HE LYS 13 -13.625 -2.163 14.417 133 2HE LYS 13 1HE LYS 13 -11.967 -2.630 14.075 134 1HZ LYS 13 1HZ LYS 13 -12.477 -2.666 11.713 135 2HZ LYS 13 2HZ LYS 13 -12.938 -1.204 12.408 136 3HZ LYS 13 3HZ LYS 13 -14.112 -2.338 12.025 137 H LYS 14 H LYS 14 -14.708 -8.914 14.344 138 HA LYS 14 HA LYS 14 -12.773 -10.794 14.961 139 1HB LYS 14 2HB LYS 14 -14.689 -12.056 16.099 140 2HB LYS 14 1HB LYS 14 -13.921 -10.765 17.004 141 1HG LYS 14 2HG LYS 14 -15.794 -9.278 16.423 142 2HG LYS 14 1HG LYS 14 -16.565 -10.618 15.571 143 1HD LYS 14 2HD LYS 14 -16.752 -11.882 17.594 144 2HD LYS 14 1HD LYS 14 -15.779 -10.705 18.475 145 1HE LYS 14 2HE LYS 14 -18.499 -10.219 17.270 146 2HE LYS 14 1HE LYS 14 -18.152 -10.457 18.983 147 1HZ LYS 14 1HZ LYS 14 -18.328 -8.144 18.631 148 2HZ LYS 14 2HZ LYS 14 -17.363 -8.177 17.264 149 3HZ LYS 14 3HZ LYS 14 -16.662 -8.427 18.780 150 H ILE 15 H ILE 15 -12.550 -10.908 12.794 151 HA ILE 15 HA ILE 15 -14.682 -12.420 11.464 152 HB ILE 15 HB ILE 15 -12.734 -10.476 10.147 153 1HG1 ILE 15 2HG1 ILE 15 -15.714 -10.167 10.630 154 2HG1 ILE 15 1HG1 ILE 15 -14.448 -9.293 11.480 155 1HG2 ILE 15 1HG2 ILE 15 -13.367 -12.333 8.697 156 2HG2 ILE 15 2HG2 ILE 15 -14.075 -10.823 8.129 157 3HG2 ILE 15 3HG2 ILE 15 -15.073 -11.996 8.990 158 1HD1 ILE 15 1HD1 ILE 15 -15.489 -7.908 9.782 159 2HD1 ILE 15 2HD1 ILE 15 -15.079 -9.094 8.543 160 3HD1 ILE 15 3HD1 ILE 15 -13.799 -8.213 9.377 161 H SER 16 H SER 16 -13.982 -14.288 10.482 162 HA SER 16 HA SER 16 -11.203 -14.966 10.929 163 1HB SER 16 2HB SER 16 -12.283 -17.363 10.411 164 2HB SER 16 1HB SER 16 -12.338 -16.629 12.015 165 HG SER 16 HG SER 16 -14.350 -16.532 10.008 166 H GLN 17 H GLN 17 -10.603 -16.914 9.161 167 HA GLN 17 HA GLN 17 -9.954 -15.262 6.968 168 1HB GLN 17 2HB GLN 17 -8.787 -17.173 5.994 169 2HB GLN 17 1HB GLN 17 -8.395 -16.962 7.693 170 1HG GLN 17 2HG GLN 17 -9.820 -18.807 8.291 171 2HG GLN 17 1HG GLN 17 -10.353 -18.967 6.612 172 1HE2 GLN 17 1HE2 GLN 17 -7.770 -19.516 8.875 173 2HE2 GLN 17 2HE2 GLN 17 -6.821 -20.511 7.831 174 H SER 18 H SER 18 -12.462 -17.836 7.216 175 HA SER 18 HA SER 18 -12.923 -18.064 4.500 176 1HB SER 18 2HB SER 18 -14.811 -18.431 6.825 177 2HB SER 18 1HB SER 18 -14.961 -19.151 5.221 178 HG SER 18 HG SER 18 -13.956 -20.412 7.052 179 H GLU 19 H GLU 19 -14.392 -16.035 6.993 180 HA GLU 19 HA GLU 19 -16.340 -14.842 5.387 181 1HB GLU 19 2HB GLU 19 -15.034 -13.918 7.952 182 2HB GLU 19 1HB GLU 19 -16.413 -13.125 7.223 183 1HG GLU 19 2HG GLU 19 -17.063 -14.559 9.090 184 2HG GLU 19 1HG GLU 19 -17.779 -15.105 7.578 185 H LEU 20 H LEU 20 -12.998 -13.881 6.249 186 HA LEU 20 HA LEU 20 -13.021 -11.452 4.885 187 1HB LEU 20 2HB LEU 20 -10.796 -13.355 5.566 188 2HB LEU 20 1HB LEU 20 -10.521 -11.821 4.771 189 HG LEU 20 HG LEU 20 -11.733 -12.159 7.513 190 1HD1 LEU 20 1HD1 LEU 20 -8.990 -11.272 6.641 191 2HD1 LEU 20 2HD1 LEU 20 -9.384 -12.798 7.434 192 3HD1 LEU 20 3HD1 LEU 20 -9.599 -11.274 8.296 193 1HD2 LEU 20 1HD2 LEU 20 -11.430 -9.735 7.666 194 2HD2 LEU 20 2HD2 LEU 20 -12.520 -10.156 6.345 195 3HD2 LEU 20 3HD2 LEU 20 -10.852 -9.698 5.999 196 H ALA 21 H ALA 21 -12.170 -14.723 3.845 197 HA ALA 21 HA ALA 21 -11.185 -14.089 1.326 198 1HB ALA 21 1HB ALA 21 -12.710 -16.569 2.119 199 2HB ALA 21 2HB ALA 21 -10.981 -16.309 2.352 200 3HB ALA 21 3HB ALA 21 -11.647 -16.402 0.721 201 H ALA 22 H ALA 22 -14.518 -14.960 2.246 202 HA ALA 22 HA ALA 22 -15.615 -14.645 -0.310 203 1HB ALA 22 1HB ALA 22 -16.735 -15.828 1.515 204 2HB ALA 22 2HB ALA 22 -17.764 -14.572 0.824 205 3HB ALA 22 3HB ALA 22 -16.953 -14.298 2.366 206 H LEU 23 H LEU 23 -15.153 -12.372 2.324 207 HA LEU 23 HA LEU 23 -16.680 -10.261 1.200 208 1HB LEU 23 2HB LEU 23 -16.202 -10.540 3.604 209 2HB LEU 23 1HB LEU 23 -14.523 -10.167 3.300 210 HG LEU 23 HG LEU 23 -15.149 -7.880 2.645 211 1HD1 LEU 23 1HD1 LEU 23 -17.397 -8.370 1.779 212 2HD1 LEU 23 2HD1 LEU 23 -17.432 -7.092 2.993 213 3HD1 LEU 23 3HD1 LEU 23 -17.942 -8.726 3.419 214 1HD2 LEU 23 1HD2 LEU 23 -14.580 -8.383 4.962 215 2HD2 LEU 23 2HD2 LEU 23 -16.268 -8.765 5.301 216 3HD2 LEU 23 3HD2 LEU 23 -15.807 -7.119 4.871 217 H LEU 24 H LEU 24 -13.198 -11.032 1.161 218 HA LEU 24 HA LEU 24 -12.538 -8.648 -0.303 219 1HB LEU 24 2HB LEU 24 -10.882 -11.098 0.281 220 2HB LEU 24 1HB LEU 24 -10.288 -9.561 -0.304 221 HG LEU 24 HG LEU 24 -11.521 -10.045 2.405 222 1HD1 LEU 24 1HD1 LEU 24 -8.662 -9.591 1.595 223 2HD1 LEU 24 2HD1 LEU 24 -9.358 -11.098 2.187 224 3HD1 LEU 24 3HD1 LEU 24 -9.263 -9.693 3.249 225 1HD2 LEU 24 1HD2 LEU 24 -11.929 -7.779 1.614 226 2HD2 LEU 24 2HD2 LEU 24 -10.214 -7.586 1.250 227 3HD2 LEU 24 3HD2 LEU 24 -10.745 -7.780 2.921 228 H GLU 25 H GLU 25 -13.972 -11.502 -1.120 229 HA GLU 25 HA GLU 25 -14.465 -12.595 -3.008 230 1HB GLU 25 2HB GLU 25 -13.286 -10.136 -4.311 231 2HB GLU 25 1HB GLU 25 -14.204 -11.376 -5.161 232 1HG GLU 25 2HG GLU 25 -16.177 -10.863 -3.957 233 2HG GLU 25 1HG GLU 25 -15.298 -9.826 -2.835 234 H VAL 26 H VAL 26 -12.135 -13.314 -1.704 235 HA VAL 26 HA VAL 26 -10.482 -14.223 -3.916 236 HB VAL 26 HB VAL 26 -8.524 -14.212 -2.399 237 1HG1 VAL 26 1HG1 VAL 26 -8.821 -12.313 -3.867 238 2HG1 VAL 26 2HG1 VAL 26 -8.102 -11.799 -2.340 239 3HG1 VAL 26 3HG1 VAL 26 -9.811 -11.502 -2.654 240 1HG2 VAL 26 1HG2 VAL 26 -8.591 -12.981 -0.262 241 2HG2 VAL 26 2HG2 VAL 26 -9.663 -14.381 -0.249 242 3HG2 VAL 26 3HG2 VAL 26 -10.330 -12.761 -0.456 243 H SER 27 H SER 27 -9.278 -16.238 -3.177 244 HA SER 27 HA SER 27 -11.172 -17.985 -1.860 245 1HB SER 27 2HB SER 27 -8.502 -18.587 -3.161 246 2HB SER 27 1HB SER 27 -9.739 -19.767 -2.712 247 HG SER 27 HG SER 27 -10.166 -17.623 -4.514 248 H ARG 28 H ARG 28 -10.332 -19.500 -0.130 249 HA ARG 28 HA ARG 28 -9.162 -17.973 1.900 250 1HB ARG 28 2HB ARG 28 -9.716 -20.925 1.806 251 2HB ARG 28 1HB ARG 28 -9.018 -20.130 3.211 252 1HG ARG 28 2HG ARG 28 -11.008 -18.614 3.222 253 2HG ARG 28 1HG ARG 28 -11.713 -19.651 1.984 254 1HD ARG 28 2HD ARG 28 -10.821 -20.568 4.711 255 2HD ARG 28 1HD ARG 28 -12.478 -20.173 4.278 256 HE ARG 28 HE ARG 28 -11.068 -22.272 2.802 257 1HH1 ARG 28 1HH1 ARG 28 -13.580 -21.349 5.136 258 2HH1 ARG 28 2HH1 ARG 28 -14.402 -22.836 5.089 259 1HH2 ARG 28 1HH2 ARG 28 -12.138 -24.393 2.811 260 2HH2 ARG 28 2HH2 ARG 28 -13.570 -24.591 3.719 261 H GLN 29 H GLN 29 -7.704 -20.328 -0.288 262 HA GLN 29 HA GLN 29 -5.238 -20.440 1.021 263 1HB GLN 29 2HB GLN 29 -6.224 -21.930 -0.812 264 2HB GLN 29 1HB GLN 29 -5.774 -20.681 -1.948 265 1HG GLN 29 2HG GLN 29 -3.796 -22.102 -0.183 266 2HG GLN 29 1HG GLN 29 -4.259 -22.684 -1.771 267 1HE2 GLN 29 1HE2 GLN 29 -1.714 -21.946 -0.794 268 2HE2 GLN 29 2HE2 GLN 29 -1.091 -20.695 -1.822 269 H THR 30 H THR 30 -6.685 -18.126 -1.187 270 HA THR 30 HA THR 30 -4.371 -16.682 -1.891 271 HB THR 30 HB THR 30 -7.175 -15.569 -1.665 272 HG1 THR 30 1HG THR 30 -6.071 -17.095 -3.816 273 1HG2 THR 30 1HG2 THR 30 -6.489 -14.261 -3.635 274 2HG2 THR 30 2HG2 THR 30 -4.909 -15.044 -3.608 275 3HG2 THR 30 3HG2 THR 30 -5.391 -13.983 -2.283 276 H ILE 31 H ILE 31 -6.966 -16.042 0.542 277 HA ILE 31 HA ILE 31 -5.588 -13.866 1.673 278 HB ILE 31 HB ILE 31 -8.019 -14.030 1.975 279 1HG1 ILE 31 2HG1 ILE 31 -8.215 -13.525 4.395 280 2HG1 ILE 31 1HG1 ILE 31 -6.579 -14.126 4.634 281 1HG2 ILE 31 1HG2 ILE 31 -9.056 -15.596 3.529 282 2HG2 ILE 31 2HG2 ILE 31 -7.496 -16.401 3.737 283 3HG2 ILE 31 3HG2 ILE 31 -8.288 -16.401 2.161 284 1HD1 ILE 31 1HD1 ILE 31 -6.629 -11.698 4.555 285 2HD1 ILE 31 2HD1 ILE 31 -7.369 -11.753 2.955 286 3HD1 ILE 31 3HD1 ILE 31 -5.725 -12.350 3.187 287 H ASN 32 H ASN 32 -5.554 -17.292 2.477 288 HA ASN 32 HA ASN 32 -4.113 -17.187 4.853 289 1HB ASN 32 2HB ASN 32 -5.071 -19.274 4.037 290 2HB ASN 32 1HB ASN 32 -4.006 -19.253 2.637 291 1HD2 ASN 32 1HD2 ASN 32 -4.246 -19.797 6.027 292 2HD2 ASN 32 2HD2 ASN 32 -2.740 -20.574 6.262 293 H GLY 33 H GLY 33 -3.060 -17.189 1.483 294 1HA GLY 33 2HA GLY 33 -0.302 -17.237 1.885 295 2HA GLY 33 1HA GLY 33 -1.125 -16.577 0.478 296 H ILE 34 H ILE 34 -2.595 -14.508 1.849 297 HA ILE 34 HA ILE 34 -0.625 -12.521 2.056 298 HB ILE 34 HB ILE 34 -3.546 -12.488 2.888 299 1HG1 ILE 34 2HG1 ILE 34 -3.286 -12.971 0.501 300 2HG1 ILE 34 1HG1 ILE 34 -3.961 -11.366 0.737 301 1HG2 ILE 34 1HG2 ILE 34 -2.340 -10.700 3.988 302 2HG2 ILE 34 2HG2 ILE 34 -3.403 -10.042 2.743 303 3HG2 ILE 34 3HG2 ILE 34 -1.670 -10.171 2.445 304 1HD1 ILE 34 1HD1 ILE 34 -2.319 -11.384 -1.059 305 2HD1 ILE 34 2HD1 ILE 34 -1.093 -12.000 0.047 306 3HD1 ILE 34 3HD1 ILE 34 -1.763 -10.385 0.282 307 H GLU 35 H GLU 35 -2.651 -14.186 4.468 308 HA GLU 35 HA GLU 35 -1.842 -12.940 6.804 309 1HB GLU 35 2HB GLU 35 -2.425 -15.856 6.413 310 2HB GLU 35 1HB GLU 35 -2.374 -15.029 7.955 311 1HG GLU 35 2HG GLU 35 -4.263 -13.636 7.208 312 2HG GLU 35 1HG GLU 35 -4.330 -14.599 5.728 313 H LYS 36 H LYS 36 -0.269 -15.553 5.077 314 HA LYS 36 HA LYS 36 1.746 -15.803 7.159 315 1HB LYS 36 2HB LYS 36 1.415 -17.312 4.557 316 2HB LYS 36 1HB LYS 36 2.579 -17.693 5.815 317 1HG LYS 36 2HG LYS 36 -0.427 -17.827 6.084 318 2HG LYS 36 1HG LYS 36 0.669 -19.199 5.904 319 1HD LYS 36 2HD LYS 36 0.742 -17.225 8.185 320 2HD LYS 36 1HD LYS 36 -0.055 -18.797 8.248 321 1HE LYS 36 2HE LYS 36 2.030 -19.939 7.968 322 2HE LYS 36 1HE LYS 36 2.872 -18.425 7.633 323 1HZ LYS 36 1HZ LYS 36 2.437 -17.697 9.825 324 2HZ LYS 36 2HZ LYS 36 3.249 -19.160 9.922 325 3HZ LYS 36 3HZ LYS 36 1.561 -19.074 10.222 326 H ASN 37 H ASN 37 1.274 -13.611 4.949 327 HA ASN 37 HA ASN 37 2.350 -12.341 3.453 328 1HB ASN 37 2HB ASN 37 4.469 -11.304 4.197 329 2HB ASN 37 1HB ASN 37 3.327 -11.415 5.517 330 1HD2 ASN 37 1HD2 ASN 37 6.309 -12.627 4.195 331 2HD2 ASN 37 2HD2 ASN 37 6.930 -13.294 5.651 332 H LYS 38 H LYS 38 2.285 -14.877 2.689 333 HA LYS 38 HA LYS 38 4.894 -15.790 1.794 334 1HB LYS 38 2HB LYS 38 3.446 -17.353 2.920 335 2HB LYS 38 1HB LYS 38 2.105 -16.943 1.879 336 1HG LYS 38 2HG LYS 38 3.156 -18.071 0.023 337 2HG LYS 38 1HG LYS 38 4.606 -18.368 0.993 338 1HD LYS 38 2HD LYS 38 3.116 -20.352 0.871 339 2HD LYS 38 1HD LYS 38 3.363 -19.773 2.518 340 1HE LYS 38 2HE LYS 38 1.177 -18.579 2.368 341 2HE LYS 38 1HE LYS 38 0.935 -19.295 0.776 342 1HZ LYS 38 1HZ LYS 38 1.331 -20.844 3.267 343 2HZ LYS 38 2HZ LYS 38 0.902 -21.473 1.751 344 3HZ LYS 38 3HZ LYS 38 -0.189 -20.516 2.619 345 H TYR 39 H TYR 39 1.968 -14.371 0.744 346 HA TYR 39 HA TYR 39 2.485 -14.703 -2.097 347 1HB TYR 39 2HB TYR 39 0.259 -13.652 -0.453 348 2HB TYR 39 1HB TYR 39 0.472 -12.914 -2.031 349 HD1 TYR 39 1HD TYR 39 0.670 -16.450 -0.774 350 HD2 TYR 39 2HD TYR 39 -1.060 -13.698 -3.510 351 HE1 TYR 39 1HE TYR 39 -0.598 -18.284 -1.818 352 HE2 TYR 39 2HE TYR 39 -2.322 -15.517 -4.561 353 HH TYR 39 HH TYR 39 -2.582 -18.641 -3.180 354 H ASN 40 H ASN 40 3.393 -12.574 0.345 355 HA ASN 40 HA ASN 40 4.043 -10.427 0.549 356 1HB ASN 40 2HB ASN 40 5.892 -11.140 -0.990 357 2HB ASN 40 1HB ASN 40 4.895 -10.684 -2.368 358 1HD2 ASN 40 1HD2 ASN 40 6.409 -9.160 -3.077 359 2HD2 ASN 40 2HD2 ASN 40 6.692 -7.674 -2.250 360 HA PRO 41 HA PRO 41 -0.069 -9.143 -0.693 361 1HB PRO 41 2HB PRO 41 0.534 -7.045 1.315 362 2HB PRO 41 1HB PRO 41 -0.866 -8.118 1.184 363 1HG PRO 41 2HG PRO 41 0.984 -8.561 3.032 364 2HG PRO 41 1HG PRO 41 0.255 -9.913 2.144 365 1HD PRO 41 2HD PRO 41 2.924 -8.616 1.763 366 2HD PRO 41 1HD PRO 41 2.494 -10.339 1.728 367 H SER 42 H SER 42 -0.324 -8.129 -2.511 368 HA SER 42 HA SER 42 1.113 -5.779 -3.271 369 1HB SER 42 2HB SER 42 -1.404 -6.984 -4.467 370 2HB SER 42 1HB SER 42 -0.304 -5.848 -5.256 371 HG SER 42 HG SER 42 1.346 -7.481 -4.848 372 H LEU 43 H LEU 43 -0.203 -3.735 -3.868 373 HA LEU 43 HA LEU 43 -1.209 -2.817 -1.426 374 1HB LEU 43 2HB LEU 43 0.033 -1.376 -2.986 375 2HB LEU 43 1HB LEU 43 -1.285 -1.457 -4.127 376 HG LEU 43 HG LEU 43 -1.029 0.699 -2.785 377 1HD1 LEU 43 1HD1 LEU 43 -3.432 1.046 -2.507 378 2HD1 LEU 43 2HD1 LEU 43 -3.699 -0.689 -2.680 379 3HD1 LEU 43 3HD1 LEU 43 -3.055 0.242 -4.031 380 1HD2 LEU 43 1HD2 LEU 43 -0.589 -0.291 -0.577 381 2HD2 LEU 43 2HD2 LEU 43 -2.177 -1.023 -0.565 382 3HD2 LEU 43 3HD2 LEU 43 -2.022 0.730 -0.517 383 H GLN 44 H GLN 44 -3.000 -3.552 -4.490 384 HA GLN 44 HA GLN 44 -5.492 -2.757 -3.649 385 1HB GLN 44 2HB GLN 44 -4.937 -3.515 -5.931 386 2HB GLN 44 1HB GLN 44 -4.789 -5.163 -5.339 387 1HG GLN 44 2HG GLN 44 -7.185 -5.054 -4.655 388 2HG GLN 44 1HG GLN 44 -7.282 -3.484 -5.450 389 1HE2 GLN 44 1HE2 GLN 44 -7.171 -3.390 -7.716 390 2HE2 GLN 44 2HE2 GLN 44 -7.374 -4.824 -8.672 391 H LEU 45 H LEU 45 -3.939 -5.888 -3.185 392 HA LEU 45 HA LEU 45 -6.066 -7.138 -1.846 393 1HB LEU 45 2HB LEU 45 -3.099 -7.716 -1.749 394 2HB LEU 45 1HB LEU 45 -4.281 -8.695 -0.916 395 HG LEU 45 HG LEU 45 -3.666 -9.833 -2.897 396 1HD1 LEU 45 1HD1 LEU 45 -5.773 -10.046 -4.104 397 2HD1 LEU 45 2HD1 LEU 45 -6.362 -8.591 -3.299 398 3HD1 LEU 45 3HD1 LEU 45 -5.980 -10.027 -2.352 399 1HD2 LEU 45 1HD2 LEU 45 -2.736 -7.994 -4.200 400 2HD2 LEU 45 2HD2 LEU 45 -4.354 -7.341 -4.462 401 3HD2 LEU 45 3HD2 LEU 45 -3.908 -8.898 -5.159 402 H ALA 46 H ALA 46 -3.288 -5.364 -0.630 403 HA ALA 46 HA ALA 46 -3.832 -5.747 2.114 404 1HB ALA 46 1HB ALA 46 -1.628 -5.073 1.280 405 2HB ALA 46 2HB ALA 46 -2.234 -3.941 2.489 406 3HB ALA 46 3HB ALA 46 -2.293 -3.516 0.779 407 H LEU 47 H LEU 47 -4.813 -3.244 -0.209 408 HA LEU 47 HA LEU 47 -5.878 -1.532 1.735 409 1HB LEU 47 2HB LEU 47 -5.050 -0.731 -0.425 410 2HB LEU 47 1HB LEU 47 -6.287 -1.636 -1.255 411 HG LEU 47 HG LEU 47 -6.574 0.911 -1.034 412 1HD1 LEU 47 1HD1 LEU 47 -8.379 -0.516 -1.821 413 2HD1 LEU 47 2HD1 LEU 47 -8.996 0.780 -0.797 414 3HD1 LEU 47 3HD1 LEU 47 -8.848 -0.857 -0.155 415 1HD2 LEU 47 1HD2 LEU 47 -7.389 0.099 1.754 416 2HD2 LEU 47 2HD2 LEU 47 -7.652 1.686 1.029 417 3HD2 LEU 47 3HD2 LEU 47 -6.010 1.110 1.320 418 H LYS 48 H LYS 48 -7.372 -4.033 -0.330 419 HA LYS 48 HA LYS 48 -9.942 -3.276 0.538 420 1HB LYS 48 2HB LYS 48 -10.767 -5.479 -0.304 421 2HB LYS 48 1HB LYS 48 -9.838 -4.571 -1.476 422 1HG LYS 48 2HG LYS 48 -7.905 -6.027 -1.043 423 2HG LYS 48 1HG LYS 48 -8.879 -6.949 0.108 424 1HD LYS 48 2HD LYS 48 -8.854 -8.072 -2.057 425 2HD LYS 48 1HD LYS 48 -10.475 -7.484 -1.688 426 1HE LYS 48 2HE LYS 48 -9.981 -5.468 -3.091 427 2HE LYS 48 1HE LYS 48 -8.461 -6.227 -3.551 428 1HZ LYS 48 1HZ LYS 48 -11.171 -7.292 -4.042 429 2HZ LYS 48 2HZ LYS 48 -9.726 -8.063 -4.526 430 3HZ LYS 48 3HZ LYS 48 -10.185 -6.574 -5.198 431 H ILE 49 H ILE 49 -7.648 -5.478 1.850 432 HA ILE 49 HA ILE 49 -9.162 -6.483 4.007 433 HB ILE 49 HB ILE 49 -6.198 -5.838 3.902 434 1HG1 ILE 49 2HG1 ILE 49 -7.656 -8.460 3.518 435 2HG1 ILE 49 1HG1 ILE 49 -6.950 -7.485 2.237 436 1HG2 ILE 49 1HG2 ILE 49 -7.697 -7.517 5.907 437 2HG2 ILE 49 2HG2 ILE 49 -6.913 -5.965 6.209 438 3HG2 ILE 49 3HG2 ILE 49 -5.942 -7.377 5.794 439 1HD1 ILE 49 1HD1 ILE 49 -5.444 -8.818 4.475 440 2HD1 ILE 49 2HD1 ILE 49 -4.728 -7.856 3.182 441 3HD1 ILE 49 3HD1 ILE 49 -5.537 -9.378 2.806 442 H ALA 50 H ALA 50 -7.241 -3.583 3.653 443 HA ALA 50 HA ALA 50 -7.406 -2.564 6.285 444 1HB ALA 50 1HB ALA 50 -6.638 -0.488 5.313 445 2HB ALA 50 2HB ALA 50 -7.062 -1.096 3.712 446 3HB ALA 50 3HB ALA 50 -5.747 -1.858 4.618 447 H TYR 51 H TYR 51 -9.312 -2.066 3.398 448 HA TYR 51 HA TYR 51 -10.935 -0.062 4.492 449 1HB TYR 51 2HB TYR 51 -10.729 -0.085 2.146 450 2HB TYR 51 1HB TYR 51 -11.152 -1.787 2.040 451 HD1 TYR 51 1HD TYR 51 -13.244 -2.400 1.608 452 HD2 TYR 51 2HD TYR 51 -12.594 1.534 2.972 453 HE1 TYR 51 1HE TYR 51 -15.649 -1.877 1.203 454 HE2 TYR 51 2HE TYR 51 -14.959 2.096 2.585 455 HH TYR 51 HH TYR 51 -16.830 1.255 1.137 456 H TYR 52 H TYR 52 -11.534 -3.561 3.997 457 HA TYR 52 HA TYR 52 -14.139 -3.317 5.122 458 1HB TYR 52 2HB TYR 52 -12.515 -5.753 4.432 459 2HB TYR 52 1HB TYR 52 -14.117 -5.858 5.157 460 HD1 TYR 52 1HD TYR 52 -15.949 -4.381 3.913 461 HD2 TYR 52 2HD TYR 52 -12.395 -5.856 2.119 462 HE1 TYR 52 1HE TYR 52 -16.999 -4.194 1.701 463 HE2 TYR 52 2HE TYR 52 -13.428 -5.665 -0.101 464 HH TYR 52 HH TYR 52 -15.771 -5.678 -1.007 465 H LEU 53 H LEU 53 -11.112 -4.393 6.432 466 HA LEU 53 HA LEU 53 -12.294 -4.931 9.019 467 1HB LEU 53 2HB LEU 53 -9.391 -4.705 8.218 468 2HB LEU 53 1HB LEU 53 -9.918 -5.083 9.847 469 1HD1 LEU 53 1HD1 LEU 53 -8.896 -8.347 8.415 470 2HD1 LEU 53 2HD1 LEU 53 -8.571 -7.195 9.710 471 3HD1 LEU 53 3HD1 LEU 53 -8.118 -6.807 8.049 472 1HD2 LEU 53 1HD2 LEU 53 -12.230 -6.946 9.089 473 2HD2 LEU 53 2HD2 LEU 53 -11.018 -7.271 10.329 474 3HD2 LEU 53 3HD2 LEU 53 -11.276 -8.429 9.026 475 H ASN 54 H ASN 54 -11.534 -2.240 7.381 476 HA ASN 54 HA ASN 54 -11.115 -0.076 7.746 477 1HB ASN 54 2HB ASN 54 -13.512 -0.291 8.404 478 2HB ASN 54 1HB ASN 54 -13.003 -0.455 10.082 479 1HD2 ASN 54 1HD2 ASN 54 -13.404 1.705 7.408 480 2HD2 ASN 54 2HD2 ASN 54 -13.140 3.170 8.254 481 H THR 55 H THR 55 -8.936 -0.347 8.204 482 HA THR 55 HA THR 55 -8.179 0.684 10.750 483 HB THR 55 HB THR 55 -7.179 -2.041 9.783 484 HG1 THR 55 1HG THR 55 -9.306 -1.495 11.193 485 1HG2 THR 55 1HG2 THR 55 -5.441 -0.736 10.917 486 2HG2 THR 55 2HG2 THR 55 -5.933 -2.117 11.898 487 3HG2 THR 55 3HG2 THR 55 -6.512 -0.502 12.299 488 HA PRO 56 HA PRO 56 -5.401 2.641 7.818 489 1HB PRO 56 2HB PRO 56 -3.419 2.368 10.028 490 2HB PRO 56 1HB PRO 56 -3.863 3.788 9.087 491 1HG PRO 56 2HG PRO 56 -4.724 3.461 11.606 492 2HG PRO 56 1HG PRO 56 -5.712 4.253 10.365 493 1HD PRO 56 2HD PRO 56 -5.989 1.561 11.570 494 2HD PRO 56 1HD PRO 56 -7.227 2.629 10.880 495 H LEU 57 H LEU 57 -4.229 1.715 6.331 496 HA LEU 57 HA LEU 57 -3.608 -0.983 6.152 497 1HB LEU 57 2HB LEU 57 -2.178 1.275 4.739 498 2HB LEU 57 1HB LEU 57 -2.079 -0.407 4.296 499 1HD1 LEU 57 1HD1 LEU 57 -4.057 2.683 3.944 500 2HD1 LEU 57 2HD1 LEU 57 -5.117 1.755 5.005 501 3HD1 LEU 57 3HD1 LEU 57 -5.502 1.913 3.290 502 1HD2 LEU 57 1HD2 LEU 57 -2.652 1.408 2.222 503 2HD2 LEU 57 2HD2 LEU 57 -4.170 0.745 1.606 504 3HD2 LEU 57 3HD2 LEU 57 -2.856 -0.337 2.085 505 H GLU 58 H GLU 58 -1.665 1.688 7.139 506 HA GLU 58 HA GLU 58 0.853 0.511 7.416 507 1HB GLU 58 2HB GLU 58 -0.345 2.771 9.005 508 2HB GLU 58 1HB GLU 58 1.367 2.450 8.760 509 1HG GLU 58 2HG GLU 58 1.173 2.916 6.409 510 2HG GLU 58 1HG GLU 58 -0.581 3.052 6.572 511 H ASP 59 H ASP 59 -1.928 0.550 9.581 512 HA ASP 59 HA ASP 59 -0.522 -0.382 11.895 513 1HB ASP 59 2HB ASP 59 -2.675 0.917 11.969 514 2HB ASP 59 1HB ASP 59 -3.493 -0.506 11.334 515 H ILE 60 H ILE 60 -2.312 -1.730 9.321 516 HA ILE 60 HA ILE 60 -2.580 -4.393 10.409 517 HB ILE 60 HB ILE 60 -3.002 -3.563 7.517 518 1HG1 ILE 60 2HG1 ILE 60 -4.985 -3.763 9.800 519 2HG1 ILE 60 1HG1 ILE 60 -4.429 -2.275 9.050 520 1HG2 ILE 60 1HG2 ILE 60 -2.724 -5.980 7.820 521 2HG2 ILE 60 2HG2 ILE 60 -4.393 -5.597 7.399 522 3HG2 ILE 60 3HG2 ILE 60 -3.972 -5.980 9.068 523 1HD1 ILE 60 1HD1 ILE 60 -6.639 -2.889 8.274 524 2HD1 ILE 60 2HD1 ILE 60 -6.025 -4.442 7.710 525 3HD1 ILE 60 3HD1 ILE 60 -5.475 -2.949 6.953 526 H PHE 61 H PHE 61 -0.746 -3.049 7.723 527 HA PHE 61 HA PHE 61 1.095 -5.327 8.029 528 1HB PHE 61 2HB PHE 61 0.622 -3.572 5.569 529 2HB PHE 61 1HB PHE 61 1.814 -4.858 5.702 530 HD1 PHE 61 1HD PHE 61 1.103 -7.191 5.792 531 HD2 PHE 61 2HD PHE 61 -1.690 -4.030 5.245 532 HE1 PHE 61 1HE PHE 61 -0.572 -8.810 5.011 533 HE2 PHE 61 2HE PHE 61 -3.372 -5.648 4.463 534 HZ PHE 61 HZ PHE 61 -2.813 -8.040 4.348 535 H GLN 62 H GLN 62 3.215 -4.950 8.418 536 HA GLN 62 HA GLN 62 3.982 -2.154 8.630 537 1HB GLN 62 2HB GLN 62 4.166 -3.346 10.777 538 2HB GLN 62 1HB GLN 62 5.158 -4.585 10.014 539 1HG GLN 62 2HG GLN 62 6.876 -2.909 9.531 540 2HG GLN 62 1HG GLN 62 5.892 -1.681 10.311 541 1HE2 GLN 62 1HE2 GLN 62 5.047 -3.371 12.514 542 2HE2 GLN 62 2HE2 GLN 62 6.449 -3.603 13.489 543 H TRP 63 H TRP 63 5.342 -1.486 7.279 544 HA TRP 63 HA TRP 63 6.797 -3.430 5.687 545 1HB TRP 63 2HB TRP 63 6.547 -1.480 3.913 546 2HB TRP 63 1HB TRP 63 5.377 -2.758 4.062 547 HD1 TRP 63 HD TRP 63 5.810 0.737 5.764 548 HE1 TRP 63 1HE TRP 63 3.538 1.878 5.838 549 HE3 TRP 63 3HE TRP 63 3.036 -2.935 3.552 550 HZ2 TRP 63 2HZ TRP 63 0.871 1.296 5.042 551 HZ3 TRP 63 3HZ TRP 63 0.629 -2.560 3.239 552 HH2 TRP 63 HH TRP 63 -0.428 -0.490 3.969 553 H GLN 64 H GLN 64 8.810 -3.228 5.482 554 HA GLN 64 HA GLN 64 10.184 -0.726 6.168 555 1HB GLN 64 2HB GLN 64 11.046 -3.609 6.558 556 2HB GLN 64 1HB GLN 64 12.068 -2.214 6.853 557 1HG GLN 64 2HG GLN 64 9.480 -2.667 8.303 558 2HG GLN 64 1HG GLN 64 11.013 -3.322 8.867 559 1HE2 GLN 64 1HE2 GLN 64 10.886 -2.116 10.744 560 2HE2 GLN 64 2HE2 GLN 64 11.188 -0.413 10.758 561 HA PRO 65 HA PRO 65 11.219 -1.190 1.788 562 1HB PRO 65 2HB PRO 65 12.997 1.109 2.340 563 2HB PRO 65 1HB PRO 65 11.609 1.002 1.246 564 1HG PRO 65 2HG PRO 65 11.374 2.414 3.480 565 2HG PRO 65 1HG PRO 65 10.063 1.317 2.973 566 1HD PRO 65 2HD PRO 65 12.255 0.767 4.953 567 2HD PRO 65 1HD PRO 65 10.492 0.653 5.182 568 H GLU 66 H GLU 66 12.570 -2.852 3.420 569 HA GLU 66 HA GLU 66 15.344 -2.771 2.444 570 1HB GLU 66 2HB GLU 66 14.406 -3.780 5.132 571 2HB GLU 66 1HB GLU 66 15.970 -4.173 4.456 572 1HG GLU 66 2HG GLU 66 16.286 -2.451 6.032 573 2HG GLU 66 1HG GLU 66 16.490 -1.736 4.441 574 1H MET 67 1HT MET 67 -11.040 0.935 -8.715 575 2H MET 67 2HT MET 67 -10.723 1.897 -7.374 576 3H MET 67 3HT MET 67 -9.570 0.809 -7.895 577 HA MET 67 HA MET 67 -9.197 2.020 -9.889 578 1HB MET 67 2HB MET 67 -11.248 3.935 -8.750 579 2HB MET 67 1HB MET 67 -10.227 4.275 -10.140 580 1HG MET 67 2HG MET 67 -12.315 2.119 -9.938 581 2HG MET 67 1HG MET 67 -12.430 3.618 -10.858 582 1HE MET 67 1HE MET 67 -13.115 2.193 -13.003 583 2HE MET 67 2HE MET 67 -12.959 0.699 -12.078 584 3HE MET 67 3HE MET 67 -12.150 0.859 -13.638 585 H ILE 68 H ILE 68 -7.365 3.194 -9.807 586 HA ILE 68 HA ILE 68 -6.640 4.253 -7.162 587 HB ILE 68 HB ILE 68 -4.832 3.059 -9.290 588 1HG1 ILE 68 2HG1 ILE 68 -6.108 1.338 -8.106 589 2HG1 ILE 68 1HG1 ILE 68 -4.415 1.254 -7.651 590 1HG2 ILE 68 1HG2 ILE 68 -2.999 3.277 -7.660 591 2HG2 ILE 68 2HG2 ILE 68 -4.083 4.148 -6.573 592 3HG2 ILE 68 3HG2 ILE 68 -3.660 4.842 -8.137 593 1HD1 ILE 68 1HD1 ILE 68 -5.858 0.915 -5.737 594 2HD1 ILE 68 2HD1 ILE 68 -6.626 2.478 -6.019 595 3HD1 ILE 68 3HD1 ILE 68 -4.927 2.402 -5.554 596 H ILE 69 H ILE 69 -5.924 6.304 -7.008 597 HA ILE 69 HA ILE 69 -5.478 7.868 -9.441 598 HB ILE 69 HB ILE 69 -6.946 8.725 -6.902 599 1HG1 ILE 69 2HG1 ILE 69 -8.789 9.417 -8.574 600 2HG1 ILE 69 1HG1 ILE 69 -7.947 8.412 -9.739 601 1HG2 ILE 69 1HG2 ILE 69 -6.144 10.446 -9.229 602 2HG2 ILE 69 2HG2 ILE 69 -5.527 10.520 -7.578 603 3HG2 ILE 69 3HG2 ILE 69 -7.207 10.943 -7.912 604 1HD1 ILE 69 1HD1 ILE 69 -9.837 7.252 -8.746 605 2HD1 ILE 69 2HD1 ILE 69 -9.151 7.478 -7.137 606 3HD1 ILE 69 3HD1 ILE 69 -8.323 6.460 -8.315 607 H ASN 70 H ASN 70 -3.472 8.901 -9.301 608 HA ASN 70 HA ASN 70 -2.220 8.722 -6.666 609 1HB ASN 70 2HB ASN 70 -1.026 7.482 -8.423 610 2HB ASN 70 1HB ASN 70 -0.887 8.956 -9.376 611 1HD2 ASN 70 1HD2 ASN 70 1.381 8.646 -9.335 612 2HD2 ASN 70 2HD2 ASN 70 2.302 9.077 -7.942 613 H ASN 71 H ASN 71 -1.465 10.472 -5.621 614 HA ASN 71 HA ASN 71 -2.087 13.096 -6.841 615 1HB ASN 71 2HB ASN 71 -2.051 12.452 -3.870 616 2HB ASN 71 1HB ASN 71 -2.605 13.920 -4.638 617 1HD2 ASN 71 1HD2 ASN 71 -3.337 10.649 -3.909 618 2HD2 ASN 71 2HD2 ASN 71 -5.031 10.711 -4.240 619 H LEU 72 H LEU 72 0.307 11.339 -6.652 620 HA LEU 72 HA LEU 72 2.297 12.147 -4.860 621 1HB LEU 72 2HB LEU 72 2.482 10.237 -6.464 622 2HB LEU 72 1HB LEU 72 2.751 11.374 -7.753 623 HG LEU 72 HG LEU 72 4.779 10.133 -6.930 624 1HD1 LEU 72 1HD1 LEU 72 6.312 12.029 -6.947 625 2HD1 LEU 72 2HD1 LEU 72 4.948 13.129 -6.745 626 3HD1 LEU 72 3HD1 LEU 72 5.090 12.160 -8.211 627 1HD2 LEU 72 1HD2 LEU 72 4.293 10.124 -4.571 628 2HD2 LEU 72 2HD2 LEU 72 4.424 11.881 -4.511 629 3HD2 LEU 72 3HD2 LEU 72 5.846 10.903 -4.864 630 H LYS 73 H LYS 73 1.448 13.619 -7.963 631 HA LYS 73 HA LYS 73 3.506 15.524 -7.962 632 1HB LYS 73 2HB LYS 73 2.217 16.746 -9.656 633 2HB LYS 73 1HB LYS 73 2.254 15.025 -10.003 634 1HG LYS 73 2HG LYS 73 -0.025 14.806 -9.128 635 2HG LYS 73 1HG LYS 73 -0.051 16.536 -8.782 636 1HD LYS 73 2HD LYS 73 -1.205 16.124 -10.861 637 2HD LYS 73 1HD LYS 73 0.301 16.978 -11.193 638 1HE LYS 73 2HE LYS 73 1.360 14.867 -11.836 639 2HE LYS 73 1HE LYS 73 -0.133 14.000 -11.473 640 1HZ LYS 73 1HZ LYS 73 0.268 16.037 -13.599 641 2HZ LYS 73 2HZ LYS 73 -1.218 15.407 -13.182 642 3HZ LYS 73 3HZ LYS 73 -0.045 14.382 -13.833 643 H LEU 74 H LEU 74 0.194 15.719 -6.602 644 HA LEU 74 HA LEU 74 0.210 18.368 -5.850 645 1HB LEU 74 2HB LEU 74 -1.741 16.939 -5.831 646 2HB LEU 74 1HB LEU 74 -1.058 15.984 -4.534 647 HG LEU 74 HG LEU 74 -1.215 17.930 -3.032 648 1HD1 LEU 74 1HD1 LEU 74 -1.033 19.692 -4.716 649 2HD1 LEU 74 2HD1 LEU 74 -2.485 19.889 -3.732 650 3HD1 LEU 74 3HD1 LEU 74 -2.606 19.230 -5.366 651 1HD2 LEU 74 1HD2 LEU 74 -3.748 17.186 -4.452 652 2HD2 LEU 74 2HD2 LEU 74 -3.648 17.922 -2.849 653 3HD2 LEU 74 3HD2 LEU 74 -2.998 16.299 -3.124 654 H ILE 75 H ILE 75 1.285 15.538 -4.023 655 HA ILE 75 HA ILE 75 2.079 16.933 -1.696 656 HB ILE 75 HB ILE 75 3.104 14.281 -2.801 657 1HG1 ILE 75 2HG1 ILE 75 1.953 13.330 -0.745 658 2HG1 ILE 75 1HG1 ILE 75 1.249 14.917 -0.498 659 1HG2 ILE 75 1HG2 ILE 75 4.195 13.853 -0.650 660 2HG2 ILE 75 2HG2 ILE 75 3.827 15.506 -0.150 661 3HG2 ILE 75 3HG2 ILE 75 4.905 15.216 -1.516 662 1HD1 ILE 75 1HD1 ILE 75 -0.315 13.400 -1.541 663 2HD1 ILE 75 2HD1 ILE 75 0.813 13.127 -2.870 664 3HD1 ILE 75 3HD1 ILE 75 0.093 14.718 -2.638 665 H ARG 76 H ARG 76 3.801 16.039 -4.579 666 HA ARG 76 HA ARG 76 6.138 17.233 -3.638 667 1HB ARG 76 2HB ARG 76 5.629 15.777 -6.154 668 2HB ARG 76 1HB ARG 76 7.071 16.793 -6.016 669 1HG ARG 76 2HG ARG 76 6.270 14.562 -4.158 670 2HG ARG 76 1HG ARG 76 7.651 14.583 -5.276 671 1HD ARG 76 2HD ARG 76 8.649 16.397 -4.131 672 2HD ARG 76 1HD ARG 76 7.258 16.596 -3.060 673 HE ARG 76 HE ARG 76 9.209 14.409 -3.037 674 1HH1 ARG 76 1HH1 ARG 76 6.698 16.250 -1.335 675 2HH1 ARG 76 2HH1 ARG 76 7.240 15.799 0.217 676 1HH2 ARG 76 1HH2 ARG 76 10.066 14.000 -0.899 677 2HH2 ARG 76 2HH2 ARG 76 9.260 14.606 0.483 678 H GLU 77 H GLU 77 3.704 18.645 -5.696 679 HA GLU 77 HA GLU 77 5.366 20.858 -6.093 680 1HB GLU 77 2HB GLU 77 2.361 20.642 -6.229 681 2HB GLU 77 1HB GLU 77 3.297 22.035 -6.757 682 1HG GLU 77 2HG GLU 77 3.311 19.264 -7.933 683 2HG GLU 77 1HG GLU 77 2.739 20.751 -8.684 684 H LYS 78 H LYS 78 2.886 20.130 -3.583 685 HA LYS 78 HA LYS 78 3.047 22.678 -2.405 686 1HB LYS 78 2HB LYS 78 2.095 20.087 -1.182 687 2HB LYS 78 1HB LYS 78 1.865 21.673 -0.455 688 1HG LYS 78 2HG LYS 78 0.764 20.776 -3.118 689 2HG LYS 78 1HG LYS 78 -0.146 20.916 -1.617 690 1HD LYS 78 2HD LYS 78 0.184 23.310 -1.583 691 2HD LYS 78 1HD LYS 78 1.273 23.217 -2.967 692 1HE LYS 78 2HE LYS 78 -0.573 22.407 -4.363 693 2HE LYS 78 1HE LYS 78 -1.658 22.496 -2.976 694 1HZ LYS 78 1HZ LYS 78 -0.220 24.875 -4.049 695 2HZ LYS 78 2HZ LYS 78 -1.518 24.862 -2.973 696 3HZ LYS 78 3HZ LYS 78 -1.747 24.415 -4.570 697 H LYS 79 H LYS 79 4.840 19.745 -1.631 698 HA LYS 79 HA LYS 79 6.604 21.401 0.048 699 1HB LYS 79 2HB LYS 79 6.540 18.374 -0.307 700 2HB LYS 79 1HB LYS 79 7.462 19.271 0.893 701 1HG LYS 79 2HG LYS 79 5.309 19.980 1.924 702 2HG LYS 79 1HG LYS 79 4.480 18.929 0.784 703 1HD LYS 79 2HD LYS 79 4.749 17.778 2.889 704 2HD LYS 79 1HD LYS 79 5.746 17.004 1.657 705 1HE LYS 79 2HE LYS 79 6.992 17.188 3.734 706 2HE LYS 79 1HE LYS 79 7.708 18.237 2.510 707 1HZ LYS 79 1HZ LYS 79 7.485 19.315 4.721 708 2HZ LYS 79 2HZ LYS 79 5.810 19.162 4.592 709 3HZ LYS 79 3HZ LYS 79 6.667 20.121 3.495 710 H LYS 80 H LYS 80 9.022 21.539 -1.342 711 HA LYS 80 HA LYS 80 7.887 21.020 -3.838 712 1HB LYS 80 2HB LYS 80 9.098 23.094 -4.603 713 2HB LYS 80 1HB LYS 80 7.671 23.363 -3.618 714 1HG LYS 80 2HG LYS 80 9.107 23.761 -1.669 715 2HG LYS 80 1HG LYS 80 10.529 23.523 -2.686 716 1HD LYS 80 2HD LYS 80 9.754 25.399 -4.109 717 2HD LYS 80 1HD LYS 80 8.438 25.671 -2.964 718 1HE LYS 80 2HE LYS 80 10.061 26.068 -1.188 719 2HE LYS 80 1HE LYS 80 11.378 25.775 -2.321 720 1HZ LYS 80 1HZ LYS 80 10.413 27.697 -3.639 721 2HZ LYS 80 2HZ LYS 80 11.177 28.053 -2.184 722 3HZ LYS 80 3HZ LYS 80 9.501 28.072 -2.248 723 H ILE 81 H ILE 81 8.821 19.189 -3.811 724 HA ILE 81 HA ILE 81 11.749 19.156 -4.077 725 HB ILE 81 HB ILE 81 9.999 16.811 -3.257 726 1HG1 ILE 81 2HG1 ILE 81 9.832 18.466 -1.459 727 2HG1 ILE 81 1HG1 ILE 81 10.785 17.088 -0.937 728 1HG2 ILE 81 1HG2 ILE 81 12.974 17.203 -3.124 729 2HG2 ILE 81 2HG2 ILE 81 12.091 16.166 -4.246 730 3HG2 ILE 81 3HG2 ILE 81 12.101 15.795 -2.522 731 1HD1 ILE 81 1HD1 ILE 81 11.710 19.174 -0.136 732 2HD1 ILE 81 2HD1 ILE 81 11.826 19.773 -1.789 733 3HD1 ILE 81 3HD1 ILE 81 12.831 18.408 -1.274 734 H SER 82 H SER 82 12.398 18.384 -6.039 735 HA SER 82 HA SER 82 10.335 18.062 -8.025 736 1HB SER 82 2HB SER 82 13.358 18.060 -8.269 737 2HB SER 82 1HB SER 82 12.232 18.037 -9.628 738 HG SER 82 HG SER 82 11.341 20.015 -8.593 739 H GLN 83 H GLN 83 10.428 16.277 -9.516 740 HA GLN 83 HA GLN 83 10.167 13.920 -7.943 741 1HB GLN 83 2HB GLN 83 9.307 12.747 -9.935 742 2HB GLN 83 1HB GLN 83 8.490 14.260 -9.622 743 1HG GLN 83 2HG GLN 83 8.684 14.362 -11.879 744 2HG GLN 83 1HG GLN 83 10.188 15.157 -11.426 745 1HE2 GLN 83 1HE2 GLN 83 8.735 12.284 -12.598 746 2HE2 GLN 83 2HE2 GLN 83 10.151 11.558 -13.291 747 H SER 84 H SER 84 12.718 15.009 -10.036 748 HA SER 84 HA SER 84 14.038 12.581 -10.319 749 1HB SER 84 2HB SER 84 16.036 14.200 -10.600 750 2HB SER 84 1HB SER 84 14.693 14.319 -11.740 751 HG SER 84 HG SER 84 14.202 16.215 -10.995 752 H GLU 85 H GLU 85 14.006 14.968 -7.701 753 HA GLU 85 HA GLU 85 16.124 13.967 -6.163 754 1HB GLU 85 2HB GLU 85 13.560 15.192 -5.129 755 2HB GLU 85 1HB GLU 85 15.102 15.134 -4.298 756 1HG GLU 85 2HG GLU 85 14.518 16.694 -6.805 757 2HG GLU 85 1HG GLU 85 14.577 17.354 -5.174 758 H LEU 86 H LEU 86 12.672 13.198 -6.258 759 HA LEU 86 HA LEU 86 12.616 11.340 -4.144 760 1HB LEU 86 2HB LEU 86 10.842 11.562 -6.583 761 2HB LEU 86 1HB LEU 86 10.584 10.364 -5.345 762 HG LEU 86 HG LEU 86 10.213 12.191 -3.711 763 1HD1 LEU 86 1HD1 LEU 86 9.718 14.409 -4.543 764 2HD1 LEU 86 2HD1 LEU 86 10.241 13.927 -6.158 765 3HD1 LEU 86 3HD1 LEU 86 11.401 13.975 -4.833 766 1HD2 LEU 86 1HD2 LEU 86 7.978 12.705 -4.531 767 2HD2 LEU 86 2HD2 LEU 86 8.388 11.006 -4.760 768 3HD2 LEU 86 3HD2 LEU 86 8.432 12.115 -6.130 769 H ALA 87 H ALA 87 13.191 10.963 -7.583 770 HA ALA 87 HA ALA 87 13.280 8.171 -7.689 771 1HB ALA 87 1HB ALA 87 14.826 10.138 -9.374 772 2HB ALA 87 2HB ALA 87 13.172 9.605 -9.675 773 3HB ALA 87 3HB ALA 87 14.502 8.450 -9.776 774 H ALA 88 H ALA 88 15.890 10.555 -7.051 775 HA ALA 88 HA ALA 88 17.977 8.754 -6.846 776 1HB ALA 88 1HB ALA 88 18.260 11.184 -7.034 777 2HB ALA 88 2HB ALA 88 19.129 10.535 -5.642 778 3HB ALA 88 3HB ALA 88 17.599 11.380 -5.410 779 H LEU 89 H LEU 89 15.756 9.975 -4.352 780 HA LEU 89 HA LEU 89 16.988 8.558 -2.218 781 1HB LEU 89 2HB LEU 89 14.336 9.895 -2.494 782 2HB LEU 89 1HB LEU 89 14.598 8.813 -1.148 783 HG LEU 89 HG LEU 89 16.523 10.243 -0.450 784 1HD1 LEU 89 1HD1 LEU 89 15.455 12.099 -2.530 785 2HD1 LEU 89 2HD1 LEU 89 17.034 11.290 -2.568 786 3HD1 LEU 89 3HD1 LEU 89 16.667 12.490 -1.310 787 1HD2 LEU 89 1HD2 LEU 89 14.354 10.447 0.580 788 2HD2 LEU 89 2HD2 LEU 89 13.855 11.595 -0.663 789 3HD2 LEU 89 3HD2 LEU 89 15.145 12.017 0.463 790 H LEU 90 H LEU 90 14.488 7.655 -4.497 791 HA LEU 90 HA LEU 90 13.850 5.249 -3.075 792 1HB LEU 90 2HB LEU 90 13.172 6.059 -5.887 793 2HB LEU 90 1HB LEU 90 12.411 4.774 -4.971 794 HG LEU 90 HG LEU 90 12.210 7.737 -4.497 795 1HD1 LEU 90 1HD1 LEU 90 9.866 7.423 -5.069 796 2HD1 LEU 90 2HD1 LEU 90 10.190 5.724 -5.419 797 3HD1 LEU 90 3HD1 LEU 90 10.943 6.985 -6.395 798 1HD2 LEU 90 1HD2 LEU 90 10.940 5.479 -2.963 799 2HD2 LEU 90 2HD2 LEU 90 10.593 7.195 -2.748 800 3HD2 LEU 90 3HD2 LEU 90 12.196 6.562 -2.368 801 H GLU 91 H GLU 91 16.483 6.124 -4.843 802 HA GLU 91 HA GLU 91 18.203 5.070 -5.863 803 1HB GLU 91 2HB GLU 91 16.961 2.543 -4.746 804 2HB GLU 91 1HB GLU 91 18.575 2.666 -5.419 805 1HG GLU 91 2HG GLU 91 17.556 3.990 -2.922 806 2HG GLU 91 1HG GLU 91 18.652 2.618 -3.015 807 H VAL 92 H VAL 92 15.835 5.585 -7.399 808 HA VAL 92 HA VAL 92 16.040 3.428 -9.360 809 HB VAL 92 HB VAL 92 13.665 3.733 -9.968 810 1HG1 VAL 92 1HG1 VAL 92 12.626 2.619 -8.054 811 2HG1 VAL 92 2HG1 VAL 92 14.043 3.009 -7.074 812 3HG1 VAL 92 3HG1 VAL 92 14.200 1.932 -8.462 813 1HG2 VAL 92 1HG2 VAL 92 12.138 4.958 -8.433 814 2HG2 VAL 92 2HG2 VAL 92 13.297 6.002 -9.253 815 3HG2 VAL 92 3HG2 VAL 92 13.562 5.557 -7.571 816 H SER 93 H SER 93 15.019 4.331 -11.500 817 HA SER 93 HA SER 93 16.429 6.793 -12.009 818 1HB SER 93 2HB SER 93 14.913 4.954 -13.871 819 2HB SER 93 1HB SER 93 16.025 6.243 -14.341 820 HG SER 93 HG SER 93 17.363 4.737 -12.663 821 H ARG 94 H ARG 94 15.251 8.424 -13.405 822 HA ARG 94 HA ARG 94 13.060 9.452 -11.986 823 1HB ARG 94 2HB ARG 94 14.005 10.180 -14.749 824 2HB ARG 94 1HB ARG 94 12.869 11.110 -13.787 825 1HG ARG 94 2HG ARG 94 14.619 11.424 -12.085 826 2HG ARG 94 1HG ARG 94 15.752 10.574 -13.142 827 1HD ARG 94 2HD ARG 94 15.993 12.964 -13.409 828 2HD ARG 94 1HD ARG 94 15.353 12.244 -14.887 829 HE ARG 94 HE ARG 94 13.227 13.074 -13.253 830 1HH1 ARG 94 1HH1 ARG 94 15.669 14.443 -15.450 831 2HH1 ARG 94 2HH1 ARG 94 14.846 15.934 -15.594 832 1HH2 ARG 94 1HH2 ARG 94 12.120 15.025 -13.542 833 2HH2 ARG 94 2HH2 ARG 94 12.724 16.259 -14.553 834 H GLN 95 H GLN 95 13.227 7.541 -14.872 835 HA GLN 95 HA GLN 95 10.584 7.878 -15.741 836 1HB GLN 95 2HB GLN 95 12.360 6.860 -17.126 837 2HB GLN 95 1HB GLN 95 12.326 5.432 -16.101 838 1HG GLN 95 2HG GLN 95 11.110 5.076 -18.184 839 2HG GLN 95 1HG GLN 95 10.038 4.974 -16.788 840 1HE2 GLN 95 1HE2 GLN 95 8.529 6.588 -16.460 841 2HE2 GLN 95 2HE2 GLN 95 8.096 7.741 -17.662 842 H THR 96 H THR 96 11.877 5.901 -13.164 843 HA THR 96 HA THR 96 9.666 4.157 -12.940 844 HB THR 96 HB THR 96 11.574 4.991 -10.749 845 HG1 THR 96 1HG THR 96 11.862 3.272 -12.986 846 1HG2 THR 96 1HG2 THR 96 11.184 2.699 -9.941 847 2HG2 THR 96 2HG2 THR 96 10.091 2.404 -11.292 848 3HG2 THR 96 3HG2 THR 96 9.665 3.588 -10.057 849 H ILE 97 H ILE 97 10.642 7.085 -11.084 850 HA ILE 97 HA ILE 97 8.221 7.157 -9.634 851 HB ILE 97 HB ILE 97 10.223 8.255 -8.724 852 1HG1 ILE 97 2HG1 ILE 97 9.253 10.439 -8.021 853 2HG1 ILE 97 1HG1 ILE 97 7.992 10.233 -9.230 854 1HG2 ILE 97 1HG2 ILE 97 11.075 10.368 -9.583 855 2HG2 ILE 97 2HG2 ILE 97 9.966 10.251 -10.950 856 3HG2 ILE 97 3HG2 ILE 97 11.247 9.055 -10.750 857 1HD1 ILE 97 1HD1 ILE 97 7.201 9.640 -7.013 858 2HD1 ILE 97 2HD1 ILE 97 8.481 8.437 -6.865 859 3HD1 ILE 97 3HD1 ILE 97 7.212 8.231 -8.074 860 H ASN 98 H ASN 98 9.218 8.609 -12.645 861 HA ASN 98 HA ASN 98 7.026 10.327 -13.051 862 1HB ASN 98 2HB ASN 98 9.016 10.551 -14.369 863 2HB ASN 98 1HB ASN 98 8.862 8.913 -14.979 864 1HD2 ASN 98 1HD2 ASN 98 7.571 12.163 -15.131 865 2HD2 ASN 98 2HD2 ASN 98 6.827 11.947 -16.666 866 H GLY 99 H GLY 99 7.577 6.945 -13.857 867 1HA GLY 99 2HA GLY 99 5.186 6.514 -15.266 868 2HA GLY 99 1HA GLY 99 6.148 5.279 -14.461 869 H ILE 100 H ILE 100 5.979 6.454 -11.825 870 HA ILE 100 HA ILE 100 3.470 5.469 -10.992 871 HB ILE 100 HB ILE 100 5.532 7.096 -9.465 872 1HG1 ILE 100 2HG1 ILE 100 6.479 4.991 -10.222 873 2HG1 ILE 100 1HG1 ILE 100 6.220 4.929 -8.485 874 1HG2 ILE 100 1HG2 ILE 100 3.361 7.242 -8.381 875 2HG2 ILE 100 2HG2 ILE 100 4.465 6.256 -7.420 876 3HG2 ILE 100 3HG2 ILE 100 3.217 5.484 -8.396 877 1HD1 ILE 100 1HD1 ILE 100 4.475 3.657 -10.588 878 2HD1 ILE 100 2HD1 ILE 100 4.194 3.595 -8.849 879 3HD1 ILE 100 3HD1 ILE 100 5.622 2.824 -9.539 880 H GLU 101 H GLU 101 4.856 8.737 -11.341 881 HA GLU 101 HA GLU 101 2.738 10.282 -10.442 882 1HB GLU 101 2HB GLU 101 4.531 10.844 -12.801 883 2HB GLU 101 1HB GLU 101 3.481 12.018 -12.041 884 1HG GLU 101 2HG GLU 101 4.805 11.815 -9.983 885 2HG GLU 101 1HG GLU 101 5.882 10.687 -10.821 886 H LYS 102 H LYS 102 3.173 8.721 -13.558 887 HA LYS 102 HA LYS 102 0.687 9.911 -14.508 888 1HB LYS 102 2HB LYS 102 2.526 8.028 -15.999 889 2HB LYS 102 1HB LYS 102 1.257 9.030 -16.681 890 1HG LYS 102 2HG LYS 102 3.908 9.919 -15.553 891 2HG LYS 102 1HG LYS 102 3.342 10.047 -17.216 892 1HD LYS 102 2HD LYS 102 1.599 11.626 -16.463 893 2HD LYS 102 1HD LYS 102 2.239 11.517 -14.824 894 1HE LYS 102 2HE LYS 102 3.105 13.511 -15.825 895 2HE LYS 102 1HE LYS 102 4.423 12.347 -15.697 896 1HZ LYS 102 1HZ LYS 102 4.185 11.849 -18.062 897 2HZ LYS 102 2HZ LYS 102 4.337 13.517 -17.866 898 3HZ LYS 102 3HZ LYS 102 2.823 12.831 -18.135 899 H ASN 103 H ASN 103 1.316 7.542 -12.526 900 HA ASN 103 HA ASN 103 0.663 5.469 -11.943 901 1HB ASN 103 2HB ASN 103 -1.735 5.119 -11.694 902 2HB ASN 103 1HB ASN 103 -1.382 6.807 -11.384 903 1HD2 ASN 103 1HD2 ASN 103 -2.417 8.344 -12.608 904 2HD2 ASN 103 2HD2 ASN 103 -3.543 7.954 -13.860 905 H LYS 104 H LYS 104 1.811 5.428 -14.481 906 HA LYS 104 HA LYS 104 0.055 3.680 -16.046 907 1HB LYS 104 2HB LYS 104 0.736 5.833 -17.076 908 2HB LYS 104 1HB LYS 104 2.413 5.365 -16.910 909 1HG LYS 104 2HG LYS 104 2.187 3.676 -18.561 910 2HG LYS 104 1HG LYS 104 0.425 3.829 -18.564 911 1HD LYS 104 2HD LYS 104 0.615 6.115 -19.403 912 2HD LYS 104 1HD LYS 104 2.373 5.982 -19.384 913 1HE LYS 104 2HE LYS 104 2.340 4.339 -21.104 914 2HE LYS 104 1HE LYS 104 0.586 4.172 -20.989 915 1HZ LYS 104 1HZ LYS 104 1.313 5.550 -22.906 916 2HZ LYS 104 2HZ LYS 104 1.931 6.702 -21.811 917 3HZ LYS 104 3HZ LYS 104 0.294 6.327 -21.828 918 H TYR 105 H TYR 105 2.940 3.928 -14.235 919 HA TYR 105 HA TYR 105 4.255 1.617 -15.328 920 1HB TYR 105 2HB TYR 105 5.313 3.699 -14.293 921 2HB TYR 105 1HB TYR 105 4.793 3.072 -12.740 922 HD1 TYR 105 1HD TYR 105 6.744 2.182 -15.721 923 HD2 TYR 105 2HD TYR 105 6.248 1.674 -11.546 924 HE1 TYR 105 1HE TYR 105 8.871 0.941 -15.631 925 HE2 TYR 105 2HE TYR 105 8.367 0.417 -11.433 926 HH TYR 105 HH TYR 105 9.959 -0.689 -12.734 927 H ASN 106 H ASN 106 1.700 2.215 -13.289 928 HA ASN 106 HA ASN 106 0.443 1.121 -11.802 929 1HB ASN 106 2HB ASN 106 0.571 -0.774 -13.426 930 2HB ASN 106 1HB ASN 106 1.991 -1.371 -12.572 931 1HD2 ASN 106 1HD2 ASN 106 1.712 -2.395 -10.559 932 2HD2 ASN 106 2HD2 ASN 106 0.169 -2.858 -9.980 933 HA PRO 107 HA PRO 107 3.366 1.736 -8.498 934 1HB PRO 107 2HB PRO 107 0.955 2.169 -6.874 935 2HB PRO 107 1HB PRO 107 2.284 3.276 -7.226 936 1HG PRO 107 2HG PRO 107 -0.172 3.614 -8.284 937 2HG PRO 107 1HG PRO 107 1.306 4.056 -9.159 938 1HD PRO 107 2HD PRO 107 -0.418 1.625 -9.457 939 2HD PRO 107 1HD PRO 107 0.348 2.625 -10.712 940 H SER 108 H SER 108 4.147 -0.272 -8.055 941 HA SER 108 HA SER 108 2.684 -2.369 -6.854 942 1HB SER 108 2HB SER 108 5.651 -1.824 -6.699 943 2HB SER 108 1HB SER 108 4.833 -3.388 -6.637 944 HG SER 108 HG SER 108 5.864 -2.675 -8.661 945 H LEU 109 H LEU 109 3.212 -3.099 -4.557 946 HA LEU 109 HA LEU 109 2.732 -0.859 -2.888 947 1HB LEU 109 2HB LEU 109 1.658 -3.071 -2.494 948 2HB LEU 109 1HB LEU 109 3.207 -3.720 -2.022 949 HG LEU 109 HG LEU 109 1.547 -3.134 -0.153 950 1HD1 LEU 109 1HD1 LEU 109 3.277 -2.322 1.375 951 2HD1 LEU 109 2HD1 LEU 109 4.314 -1.952 -0.003 952 3HD1 LEU 109 3HD1 LEU 109 3.871 -3.624 0.342 953 1HD2 LEU 109 1HD2 LEU 109 0.812 -0.933 -0.991 954 2HD2 LEU 109 2HD2 LEU 109 2.434 -0.308 -0.836 955 3HD2 LEU 109 3HD2 LEU 109 1.536 -0.767 0.601 956 H GLN 110 H GLN 110 5.697 -2.968 -3.255 957 HA GLN 110 HA GLN 110 7.117 -1.737 -1.256 958 1HB GLN 110 2HB GLN 110 7.742 -3.795 -2.497 959 2HB GLN 110 1HB GLN 110 8.107 -2.806 -3.900 960 1HG GLN 110 2HG GLN 110 10.148 -3.342 -2.832 961 2HG GLN 110 1HG GLN 110 9.824 -1.636 -2.544 962 1HE2 GLN 110 1HE2 GLN 110 8.229 -4.258 -0.877 963 2HE2 GLN 110 2HE2 GLN 110 8.923 -3.951 0.667 964 H LEU 111 H LEU 111 6.805 -0.886 -4.678 965 HA LEU 111 HA LEU 111 8.427 1.381 -4.747 966 1HB LEU 111 2HB LEU 111 5.849 0.876 -6.242 967 2HB LEU 111 1HB LEU 111 6.945 2.192 -6.594 968 HG LEU 111 HG LEU 111 7.585 -0.746 -6.873 969 1HD1 LEU 111 1HD1 LEU 111 7.050 1.377 -8.946 970 2HD1 LEU 111 2HD1 LEU 111 5.984 0.032 -8.538 971 3HD1 LEU 111 3HD1 LEU 111 7.557 -0.279 -9.273 972 1HD2 LEU 111 1HD2 LEU 111 9.183 1.704 -7.615 973 2HD2 LEU 111 2HD2 LEU 111 9.623 0.036 -7.979 974 3HD2 LEU 111 3HD2 LEU 111 9.553 0.583 -6.304 975 H ALA 112 H ALA 112 5.078 1.046 -3.839 976 HA ALA 112 HA ALA 112 4.545 3.808 -3.424 977 1HB ALA 112 1HB ALA 112 2.752 2.182 -3.795 978 2HB ALA 112 2HB ALA 112 2.514 3.056 -2.281 979 3HB ALA 112 3HB ALA 112 3.135 1.405 -2.259 980 H LEU 113 H LEU 113 5.690 1.177 -1.293 981 HA LEU 113 HA LEU 113 5.428 2.447 1.156 982 1HB LEU 113 2HB LEU 113 5.726 0.179 1.251 983 2HB LEU 113 1HB LEU 113 6.933 0.167 -0.010 984 HG LEU 113 HG LEU 113 8.582 1.072 1.603 985 1HD1 LEU 113 1HD1 LEU 113 6.426 0.654 3.653 986 2HD1 LEU 113 2HD1 LEU 113 7.125 2.196 3.153 987 3HD1 LEU 113 3HD1 LEU 113 8.122 1.006 3.990 988 1HD2 LEU 113 1HD2 LEU 113 8.879 -1.011 2.844 989 2HD2 LEU 113 2HD2 LEU 113 8.461 -1.302 1.156 990 3HD2 LEU 113 3HD2 LEU 113 7.240 -1.495 2.415 991 H LYS 114 H LYS 114 8.200 2.203 -1.083 992 HA LYS 114 HA LYS 114 9.828 3.678 0.648 993 1HB LYS 114 2HB LYS 114 11.429 3.863 -1.266 994 2HB LYS 114 1HB LYS 114 10.927 2.227 -0.888 995 1HG LYS 114 2HG LYS 114 9.320 2.371 -2.799 996 2HG LYS 114 1HG LYS 114 10.037 3.929 -3.209 997 1HD LYS 114 2HD LYS 114 11.049 2.169 -4.556 998 2HD LYS 114 1HD LYS 114 12.240 2.831 -3.432 999 1HE LYS 114 2HE LYS 114 11.801 0.943 -1.899 1000 2HE LYS 114 1HE LYS 114 10.669 0.278 -3.071 1001 1HZ LYS 114 1HZ LYS 114 13.569 0.710 -3.535 1002 2HZ LYS 114 2HZ LYS 114 12.491 -0.027 -4.625 1003 3HZ LYS 114 3HZ LYS 114 12.855 -0.755 -3.146 1004 H ILE 115 H ILE 115 7.865 4.640 -1.984 1005 HA ILE 115 HA ILE 115 8.566 7.361 -2.058 1006 HB ILE 115 HB ILE 115 5.834 6.137 -2.599 1007 1HG1 ILE 115 2HG1 ILE 115 8.007 7.013 -4.513 1008 2HG1 ILE 115 1HG1 ILE 115 7.666 5.349 -4.060 1009 1HG2 ILE 115 1HG2 ILE 115 5.577 8.509 -2.112 1010 2HG2 ILE 115 2HG2 ILE 115 5.300 8.201 -3.825 1011 3HG2 ILE 115 3HG2 ILE 115 6.827 8.903 -3.291 1012 1HD1 ILE 115 1HD1 ILE 115 6.733 5.883 -6.238 1013 2HD1 ILE 115 2HD1 ILE 115 5.801 7.201 -5.528 1014 3HD1 ILE 115 3HD1 ILE 115 5.453 5.530 -5.079 1015 H ALA 116 H ALA 116 6.240 5.643 -0.075 1016 HA ALA 116 HA ALA 116 5.077 7.855 1.271 1017 1HB ALA 116 1HB ALA 116 4.303 6.201 2.866 1018 2HB ALA 116 2HB ALA 116 5.456 5.044 2.199 1019 3HB ALA 116 3HB ALA 116 4.100 5.602 1.207 1020 H TYR 117 H TYR 117 7.819 5.764 1.900 1021 HA TYR 117 HA TYR 117 8.308 6.516 4.543 1022 1HB TYR 117 2HB TYR 117 8.796 4.370 3.578 1023 2HB TYR 117 1HB TYR 117 9.868 5.101 2.408 1024 HD1 TYR 117 1HD TYR 117 12.053 5.475 2.903 1025 HD2 TYR 117 2HD TYR 117 9.435 4.263 5.973 1026 HE1 TYR 117 1HE TYR 117 14.014 4.935 4.339 1027 HE2 TYR 117 2HE TYR 117 11.339 3.728 7.431 1028 HH TYR 117 HH TYR 117 13.656 3.082 7.137 1029 H TYR 118 H TYR 118 10.113 7.305 1.474 1030 HA TYR 118 HA TYR 118 11.876 9.086 2.831 1031 1HB TYR 118 2HB TYR 118 11.364 8.609 -0.099 1032 2HB TYR 118 1HB TYR 118 12.580 9.740 0.504 1033 HD1 TYR 118 1HD TYR 118 14.375 8.856 2.042 1034 HD2 TYR 118 2HD TYR 118 11.856 6.307 -0.229 1035 HE1 TYR 118 1HE TYR 118 15.962 7.018 2.368 1036 HE2 TYR 118 2HE TYR 118 13.413 4.462 0.075 1037 HH TYR 118 HH TYR 118 15.834 4.126 0.621 1038 H LEU 119 H LEU 119 8.952 9.515 1.321 1039 HA LEU 119 HA LEU 119 9.124 12.438 1.387 1040 1HB LEU 119 2HB LEU 119 6.882 10.584 0.622 1041 2HB LEU 119 1HB LEU 119 6.582 12.285 0.871 1042 1HD1 LEU 119 1HD1 LEU 119 8.379 9.875 -1.407 1043 2HD1 LEU 119 2HD1 LEU 119 9.653 10.978 -0.886 1044 3HD1 LEU 119 3HD1 LEU 119 8.950 11.141 -2.496 1045 1HD2 LEU 119 1HD2 LEU 119 5.967 10.868 -1.707 1046 2HD2 LEU 119 2HD2 LEU 119 6.715 12.040 -2.793 1047 3HD2 LEU 119 3HD2 LEU 119 5.764 12.597 -1.417 1048 H ASN 120 H ASN 120 8.483 10.033 3.535 1049 HA ASN 120 HA ASN 120 7.062 9.620 5.234 1050 1HB ASN 120 2HB ASN 120 8.992 10.854 6.309 1051 2HB ASN 120 1HB ASN 120 8.009 12.319 6.255 1052 1HD2 ASN 120 1HD2 ASN 120 7.972 12.447 8.570 1053 2HD2 ASN 120 2HD2 ASN 120 6.984 11.371 9.494 1054 H THR 121 H THR 121 5.391 9.795 3.800 1055 HA THR 121 HA THR 121 3.354 11.610 4.800 1056 HB THR 121 HB THR 121 3.873 11.123 1.834 1057 HG1 THR 121 1HG THR 121 5.032 12.756 3.527 1058 1HG2 THR 121 1HG2 THR 121 1.515 11.559 2.400 1059 2HG2 THR 121 2HG2 THR 121 2.211 12.907 1.498 1060 3HG2 THR 121 3HG2 THR 121 1.991 13.032 3.244 1061 HA PRO 122 HA PRO 122 1.395 7.604 5.019 1062 1HB PRO 122 2HB PRO 122 -1.097 9.190 4.660 1063 2HB PRO 122 1HB PRO 122 -0.679 8.025 5.924 1064 1HG PRO 122 2HG PRO 122 -0.686 10.628 6.443 1065 2HG PRO 122 1HG PRO 122 0.569 9.569 7.114 1066 1HD PRO 122 2HD PRO 122 0.723 11.470 4.816 1067 2HD PRO 122 1HD PRO 122 1.929 11.116 6.071 1068 H LEU 123 H LEU 123 0.819 6.163 3.550 1069 HA LEU 123 HA LEU 123 0.860 6.557 0.821 1070 1HB LEU 123 2HB LEU 123 -0.450 4.407 2.450 1071 2HB LEU 123 1HB LEU 123 -0.453 4.379 0.703 1072 1HD1 LEU 123 1HD2 LEU 123 0.645 2.129 0.954 1073 2HD1 LEU 123 2HD2 LEU 123 0.725 2.339 2.702 1074 3HD1 LEU 123 3HD2 LEU 123 2.199 2.024 1.784 1075 1HD2 LEU 123 1HD1 LEU 123 3.123 3.785 0.294 1076 2HD2 LEU 123 2HD1 LEU 123 2.314 5.349 0.179 1077 3HD2 LEU 123 3HD1 LEU 123 1.576 3.919 -0.542 1078 H GLU 124 H GLU 124 -1.916 6.557 2.997 1079 HA GLU 124 HA GLU 124 -3.977 6.682 1.180 1080 1HB GLU 124 2HB GLU 124 -3.707 7.954 3.884 1081 2HB GLU 124 1HB GLU 124 -5.223 7.755 3.011 1082 1HG GLU 124 2HG GLU 124 -5.088 5.412 3.126 1083 2HG GLU 124 1HG GLU 124 -3.426 5.467 3.722 1084 H ASP 125 H ASP 125 -1.899 9.332 2.352 1085 HA ASP 125 HA ASP 125 -3.509 11.337 1.127 1086 1HB ASP 125 2HB ASP 125 -2.111 11.866 3.080 1087 2HB ASP 125 1HB ASP 125 -0.664 11.494 2.145 1088 H ILE 126 H ILE 126 -0.699 9.537 0.307 1089 HA ILE 126 HA ILE 126 0.015 11.106 -2.012 1090 HB ILE 126 HB ILE 126 0.994 8.319 -1.299 1091 1HG1 ILE 126 2HG1 ILE 126 2.253 11.021 -0.742 1092 2HG1 ILE 126 1HG1 ILE 126 1.480 9.993 0.460 1093 1HG2 ILE 126 1HG2 ILE 126 1.349 8.879 -3.654 1094 2HG2 ILE 126 2HG2 ILE 126 2.887 8.871 -2.790 1095 3HG2 ILE 126 3HG2 ILE 126 2.112 10.402 -3.193 1096 1HD1 ILE 126 1HD1 ILE 126 3.900 9.818 0.574 1097 2HD1 ILE 126 2HD1 ILE 126 3.955 9.320 -1.119 1098 3HD1 ILE 126 3HD1 ILE 126 3.184 8.282 0.081 1099 H PHE 127 H PHE 127 -1.333 7.893 -1.552 1100 HA PHE 127 HA PHE 127 -2.235 7.963 -4.357 1101 1HB PHE 127 2HB PHE 127 -1.776 5.490 -2.575 1102 2HB PHE 127 1HB PHE 127 -2.354 5.500 -4.234 1103 HD1 PHE 127 1HD PHE 127 -0.834 6.001 -6.055 1104 HD2 PHE 127 2HD PHE 127 0.499 5.844 -2.020 1105 HE1 PHE 127 1HE PHE 127 1.495 5.833 -6.832 1106 HE2 PHE 127 2HE PHE 127 2.828 5.680 -2.789 1107 HZ PHE 127 HZ PHE 127 3.328 5.673 -5.196 1108 H GLN 128 H GLN 128 -4.344 7.701 -4.786 1109 HA GLN 128 HA GLN 128 -6.098 7.477 -2.477 1110 1HB GLN 128 2HB GLN 128 -6.257 9.654 -3.635 1111 2HB GLN 128 1HB GLN 128 -6.638 8.819 -5.135 1112 1HG GLN 128 2HG GLN 128 -8.695 7.975 -4.184 1113 2HG GLN 128 1HG GLN 128 -8.305 8.706 -2.629 1114 1HE2 GLN 128 1HE2 GLN 128 -9.404 9.284 -5.878 1115 2HE2 GLN 128 2HE2 GLN 128 -9.901 10.904 -5.606 1116 H TRP 129 H TRP 129 -7.236 5.822 -2.396 1117 HA TRP 129 HA TRP 129 -7.551 4.173 -4.771 1118 1HB TRP 129 2HB TRP 129 -7.882 2.359 -2.857 1119 2HB TRP 129 1HB TRP 129 -6.304 2.786 -3.495 1120 HD1 TRP 129 HD TRP 129 -8.527 3.999 -0.513 1121 HE1 TRP 129 1HE TRP 129 -6.943 4.514 1.449 1122 HE3 TRP 129 3HE TRP 129 -4.085 2.970 -2.797 1123 HZ2 TRP 129 2HZ TRP 129 -4.157 4.440 1.945 1124 HZ3 TRP 129 3HZ TRP 129 -2.012 3.214 -1.510 1125 HH2 TRP 129 HH TRP 129 -2.055 3.934 0.810 1126 H GLN 130 H GLN 130 -9.446 3.869 -5.451 1127 HA GLN 130 HA GLN 130 -11.711 4.371 -3.670 1128 1HB GLN 130 2HB GLN 130 -11.440 4.710 -6.658 1129 2HB GLN 130 1HB GLN 130 -12.954 4.850 -5.781 1130 1HG GLN 130 2HG GLN 130 -10.551 6.581 -5.254 1131 2HG GLN 130 1HG GLN 130 -11.843 7.005 -6.374 1132 1HE2 GLN 130 1HE2 GLN 130 -12.403 8.799 -5.226 1133 2HE2 GLN 130 2HE2 GLN 130 -13.240 8.735 -3.713 1134 HA PRO 131 HA PRO 131 -12.106 -0.056 -4.702 1135 1HB PRO 131 2HB PRO 131 -13.516 -0.311 -2.183 1136 2HB PRO 131 1HB PRO 131 -11.940 -0.975 -2.618 1137 1HG PRO 131 2HG PRO 131 -12.295 1.003 -0.754 1138 2HG PRO 131 1HG PRO 131 -10.805 0.779 -1.684 1139 1HD PRO 131 2HD PRO 131 -13.038 2.722 -2.113 1140 2HD PRO 131 1HD PRO 131 -11.283 2.969 -2.274 1141 H GLU 132 H GLU 132 -14.131 2.443 -4.035 1142 HA GLU 132 HA GLU 132 -16.490 1.077 -5.115 1143 1HB GLU 132 2HB GLU 132 -16.476 3.235 -2.996 1144 2HB GLU 132 1HB GLU 132 -17.905 2.482 -3.690 1145 1HG GLU 132 2HG GLU 132 -17.231 0.332 -2.756 1146 2HG GLU 132 1HG GLU 132 -15.800 1.088 -2.060 Start of MODEL 7 1 1H MET 1 1HT MET 1 13.963 -4.622 5.764 2 2H MET 1 2HT MET 1 12.668 -3.581 6.172 3 3H MET 1 3HT MET 1 12.657 -4.385 4.732 4 HA MET 1 HA MET 1 12.286 -6.461 5.653 5 1HB MET 1 2HB MET 1 12.528 -5.069 8.332 6 2HB MET 1 1HB MET 1 11.938 -6.707 8.114 7 1HG MET 1 2HG MET 1 14.132 -7.330 7.185 8 2HG MET 1 1HG MET 1 14.698 -5.693 7.506 9 1HE MET 1 1HE MET 1 13.463 -9.077 9.077 10 2HE MET 1 2HE MET 1 12.289 -7.922 9.701 11 3HE MET 1 3HE MET 1 13.438 -8.687 10.798 12 H ILE 2 H ILE 2 10.208 -7.052 5.714 13 HA ILE 2 HA ILE 2 8.256 -4.945 6.335 14 HB ILE 2 HB ILE 2 7.913 -7.401 4.565 15 1HG1 ILE 2 2HG1 ILE 2 9.275 -5.688 3.466 16 2HG1 ILE 2 1HG1 ILE 2 7.697 -5.788 2.699 17 1HG2 ILE 2 1HG2 ILE 2 5.923 -5.210 5.152 18 2HG2 ILE 2 2HG2 ILE 2 5.822 -6.886 5.688 19 3HG2 ILE 2 3HG2 ILE 2 5.709 -6.502 3.969 20 1HD1 ILE 2 1HD1 ILE 2 8.572 -3.678 4.662 21 2HD1 ILE 2 2HD1 ILE 2 6.989 -3.775 3.891 22 3HD1 ILE 2 3HD1 ILE 2 8.429 -3.488 2.914 23 H ILE 3 H ILE 3 6.710 -5.336 7.883 24 HA ILE 3 HA ILE 3 6.838 -7.902 9.283 25 HB ILE 3 HB ILE 3 6.244 -5.132 10.418 26 1HG1 ILE 3 2HG1 ILE 3 8.635 -6.929 10.916 27 2HG1 ILE 3 1HG1 ILE 3 8.649 -5.464 9.941 28 1HG2 ILE 3 1HG2 ILE 3 6.189 -6.247 12.612 29 2HG2 ILE 3 2HG2 ILE 3 6.404 -7.807 11.820 30 3HG2 ILE 3 3HG2 ILE 3 4.942 -6.866 11.528 31 1HD1 ILE 3 1HD1 ILE 3 8.110 -4.148 11.931 32 2HD1 ILE 3 2HD1 ILE 3 9.595 -5.070 12.142 33 3HD1 ILE 3 3HD1 ILE 3 8.100 -5.621 12.900 34 H ASN 4 H ASN 4 4.772 -8.928 9.387 35 HA ASN 4 HA ASN 4 2.618 -7.420 8.166 36 1HB ASN 4 2HB ASN 4 3.400 -9.366 6.917 37 2HB ASN 4 1HB ASN 4 3.260 -10.368 8.351 38 1HD2 ASN 4 1HD2 ASN 4 1.867 -11.772 7.368 39 2HD2 ASN 4 2HD2 ASN 4 0.243 -11.366 6.958 40 H ASN 5 H ASN 5 0.915 -6.953 9.504 41 HA ASN 5 HA ASN 5 0.725 -8.422 12.041 42 1HB ASN 5 2HB ASN 5 0.049 -5.527 11.427 43 2HB ASN 5 1HB ASN 5 -0.365 -6.341 12.924 44 1HD2 ASN 5 1HD2 ASN 5 1.236 -3.984 12.407 45 2HD2 ASN 5 2HD2 ASN 5 2.795 -4.289 13.095 46 H LEU 6 H LEU 6 -0.482 -8.741 9.234 47 HA LEU 6 HA LEU 6 -3.091 -7.953 9.068 48 1HB LEU 6 2HB LEU 6 -1.694 -9.042 7.312 49 2HB LEU 6 1HB LEU 6 -1.931 -10.576 8.107 50 HG LEU 6 HG LEU 6 -3.276 -10.206 6.024 51 1HD1 LEU 6 1HD1 LEU 6 -4.898 -10.706 8.499 52 2HD1 LEU 6 2HD1 LEU 6 -3.976 -11.903 7.593 53 3HD1 LEU 6 3HD1 LEU 6 -5.372 -11.119 6.852 54 1HD2 LEU 6 1HD2 LEU 6 -4.747 -8.221 7.738 55 2HD2 LEU 6 2HD2 LEU 6 -5.270 -8.796 6.155 56 3HD2 LEU 6 3HD2 LEU 6 -3.781 -7.863 6.306 57 H LYS 7 H LYS 7 -1.930 -10.999 10.550 58 HA LYS 7 HA LYS 7 -4.554 -11.715 11.284 59 1HB LYS 7 2HB LYS 7 -3.629 -13.498 12.688 60 2HB LYS 7 1HB LYS 7 -2.918 -13.495 11.088 61 1HG LYS 7 2HG LYS 7 -0.874 -12.619 11.918 62 2HG LYS 7 1HG LYS 7 -1.588 -12.289 13.498 63 1HD LYS 7 2HD LYS 7 -1.234 -15.031 12.277 64 2HD LYS 7 1HD LYS 7 -0.193 -14.322 13.516 65 1HE LYS 7 2HE LYS 7 -2.105 -14.183 15.043 66 2HE LYS 7 1HE LYS 7 -3.150 -14.871 13.802 67 1HZ LYS 7 1HZ LYS 7 -0.810 -16.253 15.004 68 2HZ LYS 7 2HZ LYS 7 -1.921 -16.932 13.924 69 3HZ LYS 7 3HZ LYS 7 -2.414 -16.481 15.469 70 H LEU 8 H LEU 8 -2.028 -9.997 13.078 71 HA LEU 8 HA LEU 8 -3.280 -9.906 15.551 72 1HB LEU 8 2HB LEU 8 -0.920 -9.254 15.032 73 2HB LEU 8 1HB LEU 8 -1.510 -7.815 14.247 74 HG LEU 8 HG LEU 8 -0.497 -7.508 16.537 75 1HD1 LEU 8 1HD1 LEU 8 -3.341 -6.580 16.234 76 2HD1 LEU 8 2HD1 LEU 8 -1.904 -5.773 15.605 77 3HD1 LEU 8 3HD1 LEU 8 -2.149 -5.912 17.347 78 1HD2 LEU 8 1HD2 LEU 8 -1.385 -9.489 17.605 79 2HD2 LEU 8 2HD2 LEU 8 -3.027 -8.875 17.426 80 3HD2 LEU 8 3HD2 LEU 8 -1.888 -8.045 18.484 81 H ILE 9 H ILE 9 -3.571 -7.690 12.797 82 HA ILE 9 HA ILE 9 -5.467 -5.991 14.021 83 HB ILE 9 HB ILE 9 -4.635 -6.380 11.144 84 1HG1 ILE 9 2HG1 ILE 9 -4.060 -3.997 11.285 85 2HG1 ILE 9 1HG1 ILE 9 -4.730 -3.919 12.904 86 1HG2 ILE 9 1HG2 ILE 9 -6.979 -4.669 11.966 87 2HG2 ILE 9 2HG2 ILE 9 -7.039 -6.105 10.954 88 3HG2 ILE 9 3HG2 ILE 9 -6.210 -4.655 10.379 89 1HD1 ILE 9 1HD1 ILE 9 -2.971 -5.424 13.681 90 2HD1 ILE 9 2HD1 ILE 9 -2.313 -3.968 12.930 91 3HD1 ILE 9 3HD1 ILE 9 -2.318 -5.494 12.045 92 H ARG 10 H ARG 10 -5.798 -8.864 12.166 93 HA ARG 10 HA ARG 10 -8.615 -8.832 12.049 94 1HB ARG 10 2HB ARG 10 -6.624 -11.021 11.726 95 2HB ARG 10 1HB ARG 10 -8.330 -11.416 11.886 96 1HG ARG 10 2HG ARG 10 -8.853 -10.043 9.966 97 2HG ARG 10 1HG ARG 10 -7.156 -9.578 9.822 98 1HD ARG 10 2HD ARG 10 -7.869 -11.377 8.266 99 2HD ARG 10 1HD ARG 10 -6.517 -11.805 9.311 100 HE ARG 10 HE ARG 10 -8.908 -12.630 10.527 101 1HH1 ARG 10 1HH1 ARG 10 -7.269 -13.392 7.523 102 2HH1 ARG 10 2HH1 ARG 10 -7.281 -15.073 7.755 103 1HH2 ARG 10 1HH2 ARG 10 -9.062 -14.925 10.826 104 2HH2 ARG 10 2HH2 ARG 10 -8.407 -15.992 9.658 105 H GLU 11 H GLU 11 -6.398 -9.919 14.603 106 HA GLU 11 HA GLU 11 -8.452 -10.980 16.195 107 1HB GLU 11 2HB GLU 11 -5.771 -9.888 17.028 108 2HB GLU 11 1HB GLU 11 -6.821 -10.918 17.992 109 1HG GLU 11 2HG GLU 11 -6.586 -12.656 16.219 110 2HG GLU 11 1HG GLU 11 -5.373 -11.626 15.468 111 H LYS 12 H LYS 12 -7.038 -7.776 15.870 112 HA LYS 12 HA LYS 12 -8.329 -6.458 17.938 113 1HB LYS 12 2HB LYS 12 -7.672 -5.386 15.176 114 2HB LYS 12 1HB LYS 12 -8.134 -4.378 16.544 115 1HG LYS 12 2HG LYS 12 -6.169 -5.055 17.769 116 2HG LYS 12 1HG LYS 12 -5.738 -6.202 16.508 117 1HD LYS 12 2HD LYS 12 -4.372 -4.168 16.389 118 2HD LYS 12 1HD LYS 12 -5.361 -4.367 14.946 119 1HE LYS 12 2HE LYS 12 -6.892 -2.695 15.678 120 2HE LYS 12 1HE LYS 12 -6.148 -2.631 17.274 121 1HZ LYS 12 1HZ LYS 12 -4.171 -1.704 16.312 122 2HZ LYS 12 2HZ LYS 12 -5.471 -0.760 15.830 123 3HZ LYS 12 3HZ LYS 12 -4.743 -1.843 14.754 124 H LYS 13 H LYS 13 -9.606 -7.258 14.783 125 HA LYS 13 HA LYS 13 -12.303 -6.571 15.731 126 1HB LYS 13 2HB LYS 13 -11.278 -7.237 12.935 127 2HB LYS 13 1HB LYS 13 -12.960 -6.885 13.317 128 1HG LYS 13 2HG LYS 13 -10.643 -4.976 13.622 129 2HG LYS 13 1HG LYS 13 -11.860 -4.942 12.343 130 1HD LYS 13 2HD LYS 13 -13.606 -4.485 13.946 131 2HD LYS 13 1HD LYS 13 -12.480 -4.681 15.286 132 1HE LYS 13 2HE LYS 13 -12.908 -2.329 14.870 133 2HE LYS 13 1HE LYS 13 -11.229 -2.721 14.509 134 1HZ LYS 13 1HZ LYS 13 -13.401 -2.439 12.495 135 2HZ LYS 13 2HZ LYS 13 -11.780 -2.722 12.137 136 3HZ LYS 13 3HZ LYS 13 -12.252 -1.269 12.860 137 H LYS 14 H LYS 14 -13.890 -9.000 14.348 138 HA LYS 14 HA LYS 14 -12.018 -10.979 14.601 139 1HB LYS 14 2HB LYS 14 -13.773 -12.273 15.941 140 2HB LYS 14 1HB LYS 14 -12.811 -11.091 16.805 141 1HG LYS 14 2HG LYS 14 -14.707 -9.508 16.669 142 2HG LYS 14 1HG LYS 14 -15.661 -10.775 15.886 143 1HD LYS 14 2HD LYS 14 -15.427 -12.200 17.829 144 2HD LYS 14 1HD LYS 14 -14.375 -11.018 18.602 145 1HE LYS 14 2HE LYS 14 -17.267 -10.584 17.869 146 2HE LYS 14 1HE LYS 14 -16.663 -10.951 19.484 147 1HZ LYS 14 1HZ LYS 14 -15.336 -8.870 19.342 148 2HZ LYS 14 2HZ LYS 14 -16.997 -8.629 19.327 149 3HZ LYS 14 3HZ LYS 14 -16.129 -8.493 17.888 150 H ILE 15 H ILE 15 -12.104 -11.075 12.439 151 HA ILE 15 HA ILE 15 -14.524 -12.353 11.380 152 HB ILE 15 HB ILE 15 -12.568 -10.698 9.728 153 1HG1 ILE 15 2HG1 ILE 15 -15.289 -9.800 10.736 154 2HG1 ILE 15 1HG1 ILE 15 -13.753 -9.221 11.359 155 1HG2 ILE 15 1HG2 ILE 15 -14.364 -10.784 8.037 156 2HG2 ILE 15 2HG2 ILE 15 -15.351 -11.738 9.143 157 3HG2 ILE 15 3HG2 ILE 15 -13.843 -12.400 8.517 158 1HD1 ILE 15 1HD1 ILE 15 -14.781 -8.838 8.552 159 2HD1 ILE 15 2HD1 ILE 15 -13.236 -8.254 9.175 160 3HD1 ILE 15 3HD1 ILE 15 -14.747 -7.621 9.830 161 H SER 16 H SER 16 -14.039 -14.256 10.202 162 HA SER 16 HA SER 16 -11.313 -15.151 10.583 163 1HB SER 16 2HB SER 16 -13.827 -16.683 9.925 164 2HB SER 16 1HB SER 16 -12.256 -17.378 10.340 165 HG SER 16 HG SER 16 -13.624 -15.575 12.022 166 H GLN 17 H GLN 17 -10.751 -16.826 8.737 167 HA GLN 17 HA GLN 17 -10.296 -15.066 6.553 168 1HB GLN 17 2HB GLN 17 -8.988 -16.815 5.474 169 2HB GLN 17 1HB GLN 17 -8.512 -16.557 7.139 170 1HG GLN 17 2HG GLN 17 -9.544 -18.585 7.822 171 2HG GLN 17 1HG GLN 17 -10.305 -18.792 6.240 172 1HE2 GLN 17 1HE2 GLN 17 -7.334 -18.901 7.998 173 2HE2 GLN 17 2HE2 GLN 17 -6.411 -19.751 6.811 174 H SER 18 H SER 18 -12.578 -17.818 6.923 175 HA SER 18 HA SER 18 -13.063 -18.059 4.231 176 1HB SER 18 2HB SER 18 -14.804 -18.660 6.619 177 2HB SER 18 1HB SER 18 -15.051 -19.276 4.982 178 HG SER 18 HG SER 18 -13.921 -20.693 6.437 179 H GLU 19 H GLU 19 -14.660 -16.033 6.719 180 HA GLU 19 HA GLU 19 -16.607 -15.028 4.952 181 1HB GLU 19 2HB GLU 19 -15.483 -13.528 7.323 182 2HB GLU 19 1HB GLU 19 -17.030 -13.268 6.544 183 1HG GLU 19 2HG GLU 19 -17.622 -14.383 8.450 184 2HG GLU 19 1HG GLU 19 -17.514 -15.703 7.284 185 H LEU 20 H LEU 20 -13.365 -13.911 5.827 186 HA LEU 20 HA LEU 20 -13.483 -11.530 4.375 187 1HB LEU 20 2HB LEU 20 -11.153 -13.207 5.241 188 2HB LEU 20 1HB LEU 20 -10.964 -11.689 4.389 189 HG LEU 20 HG LEU 20 -12.316 -12.010 7.069 190 1HD1 LEU 20 1HD1 LEU 20 -10.337 -10.890 7.943 191 2HD1 LEU 20 2HD1 LEU 20 -9.613 -10.908 6.334 192 3HD1 LEU 20 3HD1 LEU 20 -9.919 -12.424 7.181 193 1HD2 LEU 20 1HD2 LEU 20 -12.251 -9.566 7.121 194 2HD2 LEU 20 2HD2 LEU 20 -13.201 -10.146 5.751 195 3HD2 LEU 20 3HD2 LEU 20 -11.563 -9.545 5.496 196 H ALA 21 H ALA 21 -12.456 -14.757 3.414 197 HA ALA 21 HA ALA 21 -11.394 -14.115 0.918 198 1HB ALA 21 1HB ALA 21 -12.920 -16.599 1.674 199 2HB ALA 21 2HB ALA 21 -11.200 -16.318 1.948 200 3HB ALA 21 3HB ALA 21 -11.825 -16.426 0.303 201 H ALA 22 H ALA 22 -14.731 -15.035 1.731 202 HA ALA 22 HA ALA 22 -15.757 -14.784 -0.879 203 1HB ALA 22 1HB ALA 22 -17.167 -14.550 1.779 204 2HB ALA 22 2HB ALA 22 -16.891 -16.047 0.884 205 3HB ALA 22 3HB ALA 22 -17.952 -14.802 0.220 206 H LEU 23 H LEU 23 -15.392 -12.581 1.762 207 HA LEU 23 HA LEU 23 -16.931 -10.437 0.758 208 1HB LEU 23 2HB LEU 23 -16.358 -10.843 3.119 209 2HB LEU 23 1HB LEU 23 -14.688 -10.476 2.766 210 HG LEU 23 HG LEU 23 -15.288 -8.153 2.304 211 1HD1 LEU 23 1HD1 LEU 23 -17.558 -7.380 2.744 212 2HD1 LEU 23 2HD1 LEU 23 -18.075 -9.042 3.034 213 3HD1 LEU 23 3HD1 LEU 23 -17.536 -8.552 1.428 214 1HD2 LEU 23 1HD2 LEU 23 -14.710 -8.841 4.578 215 2HD2 LEU 23 2HD2 LEU 23 -16.407 -9.203 4.899 216 3HD2 LEU 23 3HD2 LEU 23 -15.903 -7.543 4.580 217 H LEU 24 H LEU 24 -13.460 -11.246 0.580 218 HA LEU 24 HA LEU 24 -12.758 -8.815 -0.788 219 1HB LEU 24 2HB LEU 24 -11.185 -11.337 -0.322 220 2HB LEU 24 1HB LEU 24 -10.533 -9.811 -0.882 221 HG LEU 24 HG LEU 24 -11.739 -10.314 1.836 222 1HD1 LEU 24 1HD1 LEU 24 -8.870 -10.045 0.980 223 2HD1 LEU 24 2HD1 LEU 24 -9.663 -11.517 1.541 224 3HD1 LEU 24 3HD1 LEU 24 -9.444 -10.157 2.643 225 1HD2 LEU 24 1HD2 LEU 24 -11.987 -7.997 1.107 226 2HD2 LEU 24 2HD2 LEU 24 -10.261 -7.925 0.744 227 3HD2 LEU 24 3HD2 LEU 24 -10.804 -8.130 2.407 228 H GLU 25 H GLU 25 -14.250 -11.596 -1.766 229 HA GLU 25 HA GLU 25 -14.759 -12.555 -3.767 230 1HB GLU 25 2HB GLU 25 -13.347 -10.154 -4.958 231 2HB GLU 25 1HB GLU 25 -14.299 -11.311 -5.869 232 1HG GLU 25 2HG GLU 25 -16.282 -10.650 -4.563 233 2HG GLU 25 1HG GLU 25 -15.296 -9.440 -3.739 234 H VAL 26 H VAL 26 -12.416 -13.431 -2.386 235 HA VAL 26 HA VAL 26 -10.863 -14.425 -4.632 236 HB VAL 26 HB VAL 26 -8.798 -14.295 -3.257 237 1HG1 VAL 26 1HG1 VAL 26 -10.092 -11.610 -3.688 238 2HG1 VAL 26 2HG1 VAL 26 -9.199 -12.543 -4.886 239 3HG1 VAL 26 3HG1 VAL 26 -8.365 -11.897 -3.471 240 1HG2 VAL 26 1HG2 VAL 26 -8.732 -12.859 -1.251 241 2HG2 VAL 26 2HG2 VAL 26 -9.786 -14.257 -1.038 242 3HG2 VAL 26 3HG2 VAL 26 -10.484 -12.668 -1.353 243 H SER 27 H SER 27 -9.501 -16.337 -3.722 244 HA SER 27 HA SER 27 -11.333 -18.073 -2.347 245 1HB SER 27 2HB SER 27 -8.492 -18.560 -3.288 246 2HB SER 27 1HB SER 27 -9.659 -19.792 -2.811 247 HG SER 27 HG SER 27 -9.856 -18.006 -5.017 248 H ARG 28 H ARG 28 -10.611 -19.326 -0.422 249 HA ARG 28 HA ARG 28 -9.699 -17.679 1.667 250 1HB ARG 28 2HB ARG 28 -9.949 -20.676 1.486 251 2HB ARG 28 1HB ARG 28 -9.538 -19.828 2.971 252 1HG ARG 28 2HG ARG 28 -11.648 -18.706 2.995 253 2HG ARG 28 1HG ARG 28 -12.050 -19.334 1.395 254 1HD ARG 28 2HD ARG 28 -11.590 -21.004 3.853 255 2HD ARG 28 1HD ARG 28 -13.168 -20.553 3.207 256 HE ARG 28 HE ARG 28 -12.274 -21.695 1.104 257 1HH1 ARG 28 1HH1 ARG 28 -11.543 -22.773 4.412 258 2HH1 ARG 28 2HH1 ARG 28 -11.453 -24.423 3.991 259 1HH2 ARG 28 1HH2 ARG 28 -12.189 -23.949 0.558 260 2HH2 ARG 28 2HH2 ARG 28 -11.817 -25.114 1.736 261 H GLN 29 H GLN 29 -8.083 -19.851 -0.455 262 HA GLN 29 HA GLN 29 -5.564 -20.042 0.679 263 1HB GLN 29 2HB GLN 29 -6.112 -21.376 -1.200 264 2HB GLN 29 1HB GLN 29 -6.569 -19.990 -2.155 265 1HG GLN 29 2HG GLN 29 -3.711 -20.434 -1.334 266 2HG GLN 29 1HG GLN 29 -4.405 -21.267 -2.719 267 1HE2 GLN 29 1HE2 GLN 29 -2.243 -19.358 -2.679 268 2HE2 GLN 29 2HE2 GLN 29 -2.727 -18.077 -3.745 269 H THR 30 H THR 30 -7.026 -17.378 -1.083 270 HA THR 30 HA THR 30 -4.593 -15.992 -1.463 271 HB THR 30 HB THR 30 -7.442 -14.990 -1.575 272 HG1 THR 30 1HG THR 30 -5.976 -16.689 -3.159 273 1HG2 THR 30 1HG2 THR 30 -6.517 -13.298 -3.115 274 2HG2 THR 30 2HG2 THR 30 -4.899 -13.954 -2.868 275 3HG2 THR 30 3HG2 THR 30 -5.753 -13.186 -1.530 276 H ILE 31 H ILE 31 -7.365 -15.512 0.807 277 HA ILE 31 HA ILE 31 -6.046 -13.459 2.210 278 HB ILE 31 HB ILE 31 -8.459 -13.574 2.316 279 1HG1 ILE 31 2HG1 ILE 31 -8.882 -13.422 4.766 280 2HG1 ILE 31 1HG1 ILE 31 -7.279 -14.086 5.056 281 1HG2 ILE 31 1HG2 ILE 31 -9.678 -15.307 3.534 282 2HG2 ILE 31 2HG2 ILE 31 -8.170 -16.203 3.724 283 3HG2 ILE 31 3HG2 ILE 31 -8.833 -15.922 2.114 284 1HD1 ILE 31 1HD1 ILE 31 -6.285 -12.140 3.960 285 2HD1 ILE 31 2HD1 ILE 31 -7.304 -11.670 5.323 286 3HD1 ILE 31 3HD1 ILE 31 -7.895 -11.482 3.672 287 H ASN 32 H ASN 32 -6.203 -16.937 2.820 288 HA ASN 32 HA ASN 32 -4.801 -16.947 5.258 289 1HB ASN 32 2HB ASN 32 -6.015 -18.933 4.393 290 2HB ASN 32 1HB ASN 32 -4.827 -19.092 3.104 291 1HD2 ASN 32 1HD2 ASN 32 -2.832 -20.075 3.554 292 2HD2 ASN 32 2HD2 ASN 32 -2.501 -20.769 5.103 293 H GLY 33 H GLY 33 -3.746 -16.939 1.929 294 1HA GLY 33 2HA GLY 33 -0.990 -17.266 2.350 295 2HA GLY 33 1HA GLY 33 -1.735 -16.500 0.952 296 H ILE 34 H ILE 34 -3.072 -14.394 2.469 297 HA ILE 34 HA ILE 34 -0.986 -12.514 2.670 298 HB ILE 34 HB ILE 34 -3.834 -12.308 3.717 299 1HG1 ILE 34 2HG1 ILE 34 -3.802 -12.782 1.309 300 2HG1 ILE 34 1HG1 ILE 34 -4.371 -11.149 1.628 301 1HG2 ILE 34 1HG2 ILE 34 -2.419 -10.611 4.705 302 2HG2 ILE 34 2HG2 ILE 34 -3.511 -9.867 3.535 303 3HG2 ILE 34 3HG2 ILE 34 -1.821 -10.143 3.113 304 1HD1 ILE 34 1HD1 ILE 34 -2.898 -11.226 -0.304 305 2HD1 ILE 34 2HD1 ILE 34 -1.612 -11.911 0.690 306 3HD1 ILE 34 3HD1 ILE 34 -2.182 -10.270 0.991 307 H GLU 35 H GLU 35 -2.898 -14.278 5.070 308 HA GLU 35 HA GLU 35 -1.968 -13.158 7.411 309 1HB GLU 35 2HB GLU 35 -2.644 -16.038 6.897 310 2HB GLU 35 1HB GLU 35 -2.393 -15.355 8.493 311 1HG GLU 35 2HG GLU 35 -4.273 -13.836 8.103 312 2HG GLU 35 1HG GLU 35 -4.535 -14.599 6.532 313 H LYS 36 H LYS 36 -0.380 -15.635 5.500 314 HA LYS 36 HA LYS 36 1.825 -15.633 7.447 315 1HB LYS 36 2HB LYS 36 1.435 -17.446 5.050 316 2HB LYS 36 1HB LYS 36 2.657 -17.622 6.299 317 1HG LYS 36 2HG LYS 36 -0.324 -17.883 6.701 318 2HG LYS 36 1HG LYS 36 0.823 -19.213 6.594 319 1HD LYS 36 2HD LYS 36 0.907 -17.051 8.702 320 2HD LYS 36 1HD LYS 36 0.135 -18.620 8.921 321 1HE LYS 36 2HE LYS 36 2.269 -19.733 8.583 322 2HE LYS 36 1HE LYS 36 3.047 -18.178 8.280 323 1HZ LYS 36 1HZ LYS 36 3.389 -18.979 10.559 324 2HZ LYS 36 2HZ LYS 36 1.699 -18.881 10.839 325 3HZ LYS 36 3HZ LYS 36 2.573 -17.506 10.519 326 H ASN 37 H ASN 37 0.950 -13.749 5.117 327 HA ASN 37 HA ASN 37 1.729 -12.602 3.366 328 1HB ASN 37 2HB ASN 37 3.736 -11.235 3.799 329 2HB ASN 37 1HB ASN 37 2.719 -11.327 5.222 330 1HD2 ASN 37 1HD2 ASN 37 5.743 -12.171 3.797 331 2HD2 ASN 37 2HD2 ASN 37 6.550 -12.639 5.250 332 H LYS 38 H LYS 38 1.815 -15.080 2.696 333 HA LYS 38 HA LYS 38 4.457 -15.848 1.702 334 1HB LYS 38 2HB LYS 38 3.102 -17.466 3.006 335 2HB LYS 38 1HB LYS 38 1.790 -17.280 1.861 336 1HG LYS 38 2HG LYS 38 3.220 -18.273 0.109 337 2HG LYS 38 1HG LYS 38 4.488 -18.514 1.318 338 1HD LYS 38 2HD LYS 38 3.223 -20.571 1.036 339 2HD LYS 38 1HD LYS 38 2.921 -19.901 2.641 340 1HE LYS 38 2HE LYS 38 0.841 -18.853 1.716 341 2HE LYS 38 1HE LYS 38 1.126 -19.738 0.220 342 1HZ LYS 38 1HZ LYS 38 0.741 -20.964 2.890 343 2HZ LYS 38 2HZ LYS 38 0.868 -21.834 1.451 344 3HZ LYS 38 3HZ LYS 38 -0.459 -20.808 1.740 345 H TYR 39 H TYR 39 1.321 -14.675 0.947 346 HA TYR 39 HA TYR 39 1.238 -15.246 -1.820 347 1HB TYR 39 2HB TYR 39 -0.688 -14.953 -0.278 348 2HB TYR 39 1HB TYR 39 -0.279 -13.255 -0.143 349 HD1 TYR 39 1HD TYR 39 -1.471 -15.861 -2.342 350 HD2 TYR 39 2HD TYR 39 -0.930 -11.701 -1.857 351 HE1 TYR 39 1HE TYR 39 -2.956 -15.451 -4.288 352 HE2 TYR 39 2HE TYR 39 -2.387 -11.253 -3.781 353 HH TYR 39 HH TYR 39 -3.274 -12.307 -5.697 354 H ASN 40 H ASN 40 2.608 -12.788 0.153 355 HA ASN 40 HA ASN 40 3.485 -10.726 -0.129 356 1HB ASN 40 2HB ASN 40 5.003 -11.902 -1.735 357 2HB ASN 40 1HB ASN 40 3.862 -11.564 -3.031 358 1HD2 ASN 40 1HD2 ASN 40 6.239 -10.240 -0.887 359 2HD2 ASN 40 2HD2 ASN 40 6.485 -8.756 -1.716 360 HA PRO 41 HA PRO 41 -0.605 -9.246 -1.253 361 1HB PRO 41 2HB PRO 41 -0.010 -7.112 0.663 362 2HB PRO 41 1HB PRO 41 -1.299 -8.318 0.687 363 1HG PRO 41 2HG PRO 41 0.764 -8.414 2.406 364 2HG PRO 41 1HG PRO 41 0.002 -9.886 1.766 365 1HD PRO 41 2HD PRO 41 2.549 -8.547 0.923 366 2HD PRO 41 1HD PRO 41 2.213 -10.275 1.168 367 H SER 42 H SER 42 -0.752 -8.263 -3.155 368 HA SER 42 HA SER 42 0.698 -5.932 -3.904 369 1HB SER 42 2HB SER 42 -1.911 -7.005 -5.023 370 2HB SER 42 1HB SER 42 -0.704 -6.031 -5.866 371 HG SER 42 HG SER 42 0.750 -7.916 -5.291 372 H LEU 43 H LEU 43 -0.573 -3.766 -4.311 373 HA LEU 43 HA LEU 43 -1.582 -3.106 -1.765 374 1HB LEU 43 2HB LEU 43 -0.227 -1.531 -3.098 375 2HB LEU 43 1HB LEU 43 -1.527 -1.381 -4.251 376 HG LEU 43 HG LEU 43 -1.192 0.558 -2.626 377 1HD1 LEU 43 1HD1 LEU 43 -3.927 -0.695 -2.696 378 2HD1 LEU 43 2HD1 LEU 43 -3.236 0.387 -3.907 379 3HD1 LEU 43 3HD1 LEU 43 -3.569 0.981 -2.281 380 1HD2 LEU 43 1HD2 LEU 43 -2.187 0.338 -0.375 381 2HD2 LEU 43 2HD2 LEU 43 -0.804 -0.730 -0.570 382 3HD2 LEU 43 3HD2 LEU 43 -2.430 -1.383 -0.659 383 H GLN 44 H GLN 44 -3.350 -3.279 -4.937 384 HA GLN 44 HA GLN 44 -5.782 -2.469 -3.985 385 1HB GLN 44 2HB GLN 44 -5.217 -2.798 -6.351 386 2HB GLN 44 1HB GLN 44 -5.137 -4.531 -6.105 387 1HG GLN 44 2HG GLN 44 -7.195 -3.861 -7.228 388 2HG GLN 44 1HG GLN 44 -7.524 -4.603 -5.666 389 1HE2 GLN 44 1HE2 GLN 44 -9.560 -3.621 -5.663 390 2HE2 GLN 44 2HE2 GLN 44 -9.767 -1.960 -5.273 391 H LEU 45 H LEU 45 -4.468 -5.743 -4.041 392 HA LEU 45 HA LEU 45 -6.679 -7.033 -2.889 393 1HB LEU 45 2HB LEU 45 -3.765 -7.826 -2.890 394 2HB LEU 45 1HB LEU 45 -5.025 -8.844 -2.233 395 HG LEU 45 HG LEU 45 -4.467 -9.682 -4.366 396 1HD1 LEU 45 1HD1 LEU 45 -7.058 -8.188 -4.574 397 2HD1 LEU 45 2HD1 LEU 45 -6.799 -9.787 -3.882 398 3HD1 LEU 45 3HD1 LEU 45 -6.563 -9.527 -5.611 399 1HD2 LEU 45 1HD2 LEU 45 -3.372 -7.742 -5.347 400 2HD2 LEU 45 2HD2 LEU 45 -4.925 -6.920 -5.504 401 3HD2 LEU 45 3HD2 LEU 45 -4.597 -8.374 -6.449 402 H ALA 46 H ALA 46 -3.844 -5.594 -1.408 403 HA ALA 46 HA ALA 46 -4.454 -6.455 1.239 404 1HB ALA 46 1HB ALA 46 -2.169 -5.886 0.540 405 2HB ALA 46 2HB ALA 46 -2.678 -4.953 1.948 406 3HB ALA 46 3HB ALA 46 -2.658 -4.202 0.352 407 H LEU 47 H LEU 47 -5.132 -3.512 -0.605 408 HA LEU 47 HA LEU 47 -5.923 -1.958 1.571 409 1HB LEU 47 2HB LEU 47 -5.173 -1.060 -0.609 410 2HB LEU 47 1HB LEU 47 -6.630 -1.667 -1.353 411 HG LEU 47 HG LEU 47 -6.491 0.843 -0.833 412 1HD1 LEU 47 1HD1 LEU 47 -8.591 -0.206 -1.481 413 2HD1 LEU 47 2HD1 LEU 47 -8.855 1.022 -0.242 414 3HD1 LEU 47 3HD1 LEU 47 -8.878 -0.690 0.192 415 1HD2 LEU 47 1HD2 LEU 47 -7.131 1.494 1.444 416 2HD2 LEU 47 2HD2 LEU 47 -5.581 0.658 1.410 417 3HD2 LEU 47 3HD2 LEU 47 -7.028 -0.194 1.947 418 H LYS 48 H LYS 48 -7.749 -4.104 -0.528 419 HA LYS 48 HA LYS 48 -10.199 -3.190 0.556 420 1HB LYS 48 2HB LYS 48 -11.265 -5.265 -0.382 421 2HB LYS 48 1HB LYS 48 -10.426 -4.257 -1.543 422 1HG LYS 48 2HG LYS 48 -8.567 -5.812 -1.570 423 2HG LYS 48 1HG LYS 48 -9.362 -6.811 -0.350 424 1HD LYS 48 2HD LYS 48 -9.716 -7.709 -2.608 425 2HD LYS 48 1HD LYS 48 -11.236 -7.188 -1.876 426 1HE LYS 48 2HE LYS 48 -11.019 -5.036 -3.113 427 2HE LYS 48 1HE LYS 48 -9.594 -5.687 -3.916 428 1HZ LYS 48 1HZ LYS 48 -10.982 -7.454 -4.829 429 2HZ LYS 48 2HZ LYS 48 -11.549 -5.916 -5.279 430 3HZ LYS 48 3HZ LYS 48 -12.345 -6.787 -4.073 431 H ILE 49 H ILE 49 -8.006 -5.678 1.520 432 HA ILE 49 HA ILE 49 -9.545 -6.792 3.618 433 HB ILE 49 HB ILE 49 -6.529 -6.385 3.670 434 1HG1 ILE 49 2HG1 ILE 49 -8.071 -8.706 2.480 435 2HG1 ILE 49 1HG1 ILE 49 -7.265 -7.452 1.548 436 1HG2 ILE 49 1HG2 ILE 49 -8.308 -8.464 4.954 437 2HG2 ILE 49 2HG2 ILE 49 -7.524 -7.120 5.780 438 3HG2 ILE 49 3HG2 ILE 49 -6.548 -8.405 5.068 439 1HD1 ILE 49 1HD1 ILE 49 -5.112 -8.165 2.447 440 2HD1 ILE 49 2HD1 ILE 49 -5.943 -9.492 1.634 441 3HD1 ILE 49 3HD1 ILE 49 -5.919 -9.410 3.397 442 H ALA 50 H ALA 50 -7.331 -4.083 3.435 443 HA ALA 50 HA ALA 50 -7.281 -3.241 6.119 444 1HB ALA 50 1HB ALA 50 -5.696 -2.468 4.411 445 2HB ALA 50 2HB ALA 50 -6.493 -1.110 5.231 446 3HB ALA 50 3HB ALA 50 -7.024 -1.610 3.621 447 H TYR 51 H TYR 51 -9.360 -2.398 3.438 448 HA TYR 51 HA TYR 51 -10.865 -0.442 4.785 449 1HB TYR 51 2HB TYR 51 -10.840 -0.285 2.444 450 2HB TYR 51 1HB TYR 51 -11.233 -1.983 2.233 451 HD1 TYR 51 1HD TYR 51 -13.347 -2.609 1.837 452 HD2 TYR 51 2HD TYR 51 -12.707 1.242 3.450 453 HE1 TYR 51 1HE TYR 51 -15.765 -2.095 1.528 454 HE2 TYR 51 2HE TYR 51 -15.094 1.788 3.164 455 HH TYR 51 HH TYR 51 -17.000 1.062 1.787 456 H TYR 52 H TYR 52 -11.466 -3.910 4.196 457 HA TYR 52 HA TYR 52 -14.006 -3.770 5.479 458 1HB TYR 52 2HB TYR 52 -12.352 -6.140 4.641 459 2HB TYR 52 1HB TYR 52 -13.899 -6.311 5.462 460 HD1 TYR 52 1HD TYR 52 -15.744 -4.588 4.309 461 HD2 TYR 52 2HD TYR 52 -12.481 -6.500 2.371 462 HE1 TYR 52 1HE TYR 52 -16.940 -4.447 2.172 463 HE2 TYR 52 2HE TYR 52 -13.663 -6.354 0.224 464 HH TYR 52 HH TYR 52 -16.342 -4.416 -0.278 465 H LEU 53 H LEU 53 -10.842 -4.484 6.615 466 HA LEU 53 HA LEU 53 -11.810 -5.248 9.253 467 1HB LEU 53 2HB LEU 53 -9.010 -4.607 8.311 468 2HB LEU 53 1HB LEU 53 -9.410 -5.191 9.913 469 1HD1 LEU 53 1HD1 LEU 53 -7.995 -8.129 8.168 470 2HD1 LEU 53 2HD1 LEU 53 -7.779 -7.039 9.537 471 3HD1 LEU 53 3HD1 LEU 53 -7.470 -6.468 7.896 472 1HD2 LEU 53 1HD2 LEU 53 -11.473 -7.303 9.043 473 2HD2 LEU 53 2HD2 LEU 53 -10.185 -7.560 10.220 474 3HD2 LEU 53 3HD2 LEU 53 -10.318 -8.617 8.816 475 H ASN 54 H ASN 54 -11.344 -2.471 7.578 476 HA ASN 54 HA ASN 54 -11.015 -0.280 7.930 477 1HB ASN 54 2HB ASN 54 -13.349 -0.583 8.790 478 2HB ASN 54 1HB ASN 54 -12.690 -0.746 10.415 479 1HD2 ASN 54 1HD2 ASN 54 -13.321 1.408 7.797 480 2HD2 ASN 54 2HD2 ASN 54 -13.032 2.889 8.611 481 H THR 55 H THR 55 -8.767 -0.663 8.268 482 HA THR 55 HA THR 55 -7.920 0.469 10.783 483 HB THR 55 HB THR 55 -6.860 -2.216 9.781 484 HG1 THR 55 1HG THR 55 -8.995 -1.747 11.135 485 1HG2 THR 55 1HG2 THR 55 -5.150 -0.849 10.912 486 2HG2 THR 55 2HG2 THR 55 -5.586 -2.262 11.873 487 3HG2 THR 55 3HG2 THR 55 -6.217 -0.673 12.303 488 HA PRO 56 HA PRO 56 -5.336 2.577 7.807 489 1HB PRO 56 2HB PRO 56 -3.228 3.229 9.472 490 2HB PRO 56 1HB PRO 56 -4.727 4.156 9.352 491 1HG PRO 56 2HG PRO 56 -3.913 2.116 11.377 492 2HG PRO 56 1HG PRO 56 -4.788 3.643 11.608 493 1HD PRO 56 2HD PRO 56 -6.033 1.274 11.604 494 2HD PRO 56 1HD PRO 56 -6.807 2.728 10.929 495 H LEU 57 H LEU 57 -3.665 2.135 6.529 496 HA LEU 57 HA LEU 57 -2.727 -0.472 6.266 497 1HB LEU 57 2HB LEU 57 -1.629 2.085 5.124 498 2HB LEU 57 1HB LEU 57 -0.961 0.524 4.731 499 1HD1 LEU 57 1HD1 LEU 57 -3.874 2.784 4.143 500 2HD1 LEU 57 2HD1 LEU 57 -4.631 1.409 4.946 501 3HD1 LEU 57 3HD1 LEU 57 -4.789 1.607 3.201 502 1HD2 LEU 57 1HD2 LEU 57 -1.836 2.362 2.683 503 2HD2 LEU 57 2HD2 LEU 57 -2.865 1.280 1.734 504 3HD2 LEU 57 3HD2 LEU 57 -1.324 0.703 2.387 505 H GLU 58 H GLU 58 -1.092 2.336 7.675 506 HA GLU 58 HA GLU 58 1.380 1.194 8.177 507 1HB GLU 58 2HB GLU 58 -0.070 3.310 9.778 508 2HB GLU 58 1HB GLU 58 1.637 2.927 9.939 509 1HG GLU 58 2HG GLU 58 2.012 3.597 7.631 510 2HG GLU 58 1HG GLU 58 0.299 3.963 7.448 511 H ASP 59 H ASP 59 -1.592 0.880 10.048 512 HA ASP 59 HA ASP 59 -0.264 -0.312 12.275 513 1HB ASP 59 2HB ASP 59 -2.410 0.894 12.543 514 2HB ASP 59 1HB ASP 59 -3.213 -0.354 11.598 515 H ILE 60 H ILE 60 -1.863 -1.429 9.456 516 HA ILE 60 HA ILE 60 -2.014 -4.212 10.250 517 HB ILE 60 HB ILE 60 -2.422 -3.079 7.458 518 1HG1 ILE 60 2HG1 ILE 60 -4.432 -3.750 9.623 519 2HG1 ILE 60 1HG1 ILE 60 -3.989 -2.129 9.113 520 1HG2 ILE 60 1HG2 ILE 60 -1.937 -5.477 7.455 521 2HG2 ILE 60 2HG2 ILE 60 -3.625 -5.187 7.036 522 3HG2 ILE 60 3HG2 ILE 60 -3.201 -5.747 8.655 523 1HD1 ILE 60 1HD1 ILE 60 -6.118 -2.807 8.175 524 2HD1 ILE 60 2HD1 ILE 60 -5.355 -4.208 7.422 525 3HD1 ILE 60 3HD1 ILE 60 -4.919 -2.579 6.902 526 H PHE 61 H PHE 61 -0.101 -2.443 7.885 527 HA PHE 61 HA PHE 61 1.847 -4.646 8.013 528 1HB PHE 61 2HB PHE 61 1.326 -2.709 5.707 529 2HB PHE 61 1HB PHE 61 2.650 -3.869 5.772 530 HD1 PHE 61 1HD PHE 61 2.122 -6.302 5.735 531 HD2 PHE 61 2HD PHE 61 -0.837 -3.317 5.074 532 HE1 PHE 61 1HE PHE 61 0.657 -7.988 4.704 533 HE2 PHE 61 2HE PHE 61 -2.309 -4.998 4.045 534 HZ PHE 61 HZ PHE 61 -1.561 -7.338 3.858 535 H GLN 62 H GLN 62 3.936 -4.141 8.484 536 HA GLN 62 HA GLN 62 4.428 -1.296 8.956 537 1HB GLN 62 2HB GLN 62 4.235 -2.719 11.056 538 2HB GLN 62 1HB GLN 62 5.721 -3.511 10.542 539 1HG GLN 62 2HG GLN 62 6.843 -1.308 10.519 540 2HG GLN 62 1HG GLN 62 5.370 -0.586 11.156 541 1HE2 GLN 62 1HE2 GLN 62 7.943 -0.559 12.329 542 2HE2 GLN 62 2HE2 GLN 62 7.834 -1.404 13.835 543 H TRP 63 H TRP 63 6.097 -0.501 8.007 544 HA TRP 63 HA TRP 63 7.828 -2.347 6.599 545 1HB TRP 63 2HB TRP 63 8.131 -0.265 5.056 546 2HB TRP 63 1HB TRP 63 6.741 -1.319 4.896 547 HD1 TRP 63 HD TRP 63 7.641 2.204 6.175 548 HE1 TRP 63 1HE TRP 63 5.436 3.566 6.339 549 HE3 TRP 63 3HE TRP 63 4.267 -1.499 5.158 550 HZ2 TRP 63 2HZ TRP 63 2.699 3.138 6.048 551 HZ3 TRP 63 3HZ TRP 63 1.872 -0.933 5.115 552 HH2 TRP 63 HH TRP 63 1.110 1.338 5.553 553 H GLN 64 H GLN 64 9.760 -2.450 7.165 554 HA GLN 64 HA GLN 64 11.044 -0.271 8.642 555 1HB GLN 64 2HB GLN 64 11.868 -3.169 8.243 556 2HB GLN 64 1HB GLN 64 12.666 -2.000 9.278 557 1HG GLN 64 2HG GLN 64 9.841 -2.949 9.697 558 2HG GLN 64 1HG GLN 64 11.249 -3.701 10.442 559 1HE2 GLN 64 1HE2 GLN 64 10.520 -3.233 12.490 560 2HE2 GLN 64 2HE2 GLN 64 10.514 -1.645 13.148 561 HA PRO 65 HA PRO 65 12.920 0.262 4.496 562 1HB PRO 65 2HB PRO 65 14.321 2.517 5.768 563 2HB PRO 65 1HB PRO 65 13.172 2.534 4.425 564 1HG PRO 65 2HG PRO 65 12.495 3.504 6.823 565 2HG PRO 65 1HG PRO 65 11.328 2.614 5.827 566 1HD PRO 65 2HD PRO 65 12.966 1.629 8.145 567 2HD PRO 65 1HD PRO 65 11.225 1.421 7.838 568 H GLU 66 H GLU 66 14.074 -1.149 6.843 569 HA GLU 66 HA GLU 66 16.808 -1.445 5.922 570 1HB GLU 66 2HB GLU 66 16.064 -0.955 8.840 571 2HB GLU 66 1HB GLU 66 17.658 -1.451 8.288 572 1HG GLU 66 2HG GLU 66 17.936 0.637 7.090 573 2HG GLU 66 1HG GLU 66 16.299 1.125 7.499 574 1H MET 67 1HT MET 67 -12.092 0.963 -8.199 575 2H MET 67 2HT MET 67 -11.811 1.932 -6.840 576 3H MET 67 3HT MET 67 -10.590 0.919 -7.434 577 HA MET 67 HA MET 67 -10.351 2.117 -9.401 578 1HB MET 67 2HB MET 67 -12.509 3.897 -8.251 579 2HB MET 67 1HB MET 67 -11.471 4.370 -9.588 580 1HG MET 67 2HG MET 67 -13.354 2.025 -9.574 581 2HG MET 67 1HG MET 67 -13.658 3.586 -10.334 582 1HE MET 67 1HE MET 67 -14.234 2.237 -12.576 583 2HE MET 67 2HE MET 67 -13.848 0.711 -11.779 584 3HE MET 67 3HE MET 67 -13.126 1.098 -13.342 585 H ILE 68 H ILE 68 -8.551 3.183 -9.347 586 HA ILE 68 HA ILE 68 -7.738 4.431 -6.811 587 HB ILE 68 HB ILE 68 -6.048 3.459 -9.143 588 1HG1 ILE 68 2HG1 ILE 68 -7.001 1.604 -7.864 589 2HG1 ILE 68 1HG1 ILE 68 -5.263 1.695 -7.625 590 1HG2 ILE 68 1HG2 ILE 68 -4.086 3.862 -7.724 591 2HG2 ILE 68 2HG2 ILE 68 -5.130 4.577 -6.495 592 3HG2 ILE 68 3HG2 ILE 68 -4.968 5.350 -8.074 593 1HD1 ILE 68 1HD1 ILE 68 -6.432 1.174 -5.554 594 2HD1 ILE 68 2HD1 ILE 68 -7.370 2.660 -5.697 595 3HD1 ILE 68 3HD1 ILE 68 -5.627 2.741 -5.443 596 H ILE 69 H ILE 69 -7.298 6.551 -6.729 597 HA ILE 69 HA ILE 69 -7.155 8.107 -9.206 598 HB ILE 69 HB ILE 69 -8.393 8.832 -6.497 599 1HG1 ILE 69 2HG1 ILE 69 -10.299 9.670 -7.950 600 2HG1 ILE 69 1HG1 ILE 69 -9.494 8.921 -9.316 601 1HG2 ILE 69 1HG2 ILE 69 -6.939 10.672 -7.070 602 2HG2 ILE 69 2HG2 ILE 69 -8.631 11.148 -7.224 603 3HG2 ILE 69 3HG2 ILE 69 -7.681 10.791 -8.667 604 1HD1 ILE 69 1HD1 ILE 69 -9.731 6.737 -8.232 605 2HD1 ILE 69 2HD1 ILE 69 -11.285 7.532 -8.486 606 3HD1 ILE 69 3HD1 ILE 69 -10.556 7.511 -6.878 607 H ASN 70 H ASN 70 -5.098 9.228 -9.426 608 HA ASN 70 HA ASN 70 -3.293 8.672 -7.241 609 1HB ASN 70 2HB ASN 70 -2.797 7.728 -9.434 610 2HB ASN 70 1HB ASN 70 -2.912 9.321 -10.164 611 1HD2 ASN 70 1HD2 ASN 70 -0.847 9.176 -10.954 612 2HD2 ASN 70 2HD2 ASN 70 0.552 9.281 -9.950 613 H ASN 71 H ASN 71 -2.274 10.267 -6.154 614 HA ASN 71 HA ASN 71 -2.537 13.030 -7.162 615 1HB ASN 71 2HB ASN 71 -2.597 12.249 -4.222 616 2HB ASN 71 1HB ASN 71 -2.703 13.867 -4.877 617 1HD2 ASN 71 1HD2 ASN 71 -4.362 10.998 -4.146 618 2HD2 ASN 71 2HD2 ASN 71 -5.962 11.544 -4.507 619 H LEU 72 H LEU 72 -0.421 10.763 -7.114 620 HA LEU 72 HA LEU 72 1.658 11.011 -5.449 621 1HB LEU 72 2HB LEU 72 1.327 9.484 -7.442 622 2HB LEU 72 1HB LEU 72 1.922 10.767 -8.456 623 HG LEU 72 HG LEU 72 3.560 8.967 -8.082 624 1HD1 LEU 72 1HD1 LEU 72 4.437 11.136 -8.586 625 2HD1 LEU 72 2HD1 LEU 72 5.501 10.273 -7.476 626 3HD1 LEU 72 3HD1 LEU 72 4.450 11.555 -6.874 627 1HD2 LEU 72 1HD2 LEU 72 4.635 8.684 -5.907 628 2HD2 LEU 72 2HD2 LEU 72 2.922 8.266 -5.877 629 3HD2 LEU 72 3HD2 LEU 72 3.467 9.797 -5.196 630 H LYS 73 H LYS 73 1.312 13.015 -8.395 631 HA LYS 73 HA LYS 73 3.633 14.508 -7.983 632 1HB LYS 73 2HB LYS 73 2.732 16.160 -9.598 633 2HB LYS 73 1HB LYS 73 2.670 14.506 -10.166 634 1HG LYS 73 2HG LYS 73 0.273 14.427 -9.706 635 2HG LYS 73 1HG LYS 73 0.333 16.081 -9.086 636 1HD LYS 73 2HD LYS 73 1.021 16.912 -11.245 637 2HD LYS 73 1HD LYS 73 1.133 15.274 -11.879 638 1HE LYS 73 2HE LYS 73 -1.401 16.613 -10.924 639 2HE LYS 73 1HE LYS 73 -0.912 16.443 -12.608 640 1HZ LYS 73 1HZ LYS 73 -2.386 14.711 -12.238 641 2HZ LYS 73 2HZ LYS 73 -1.790 14.313 -10.734 642 3HZ LYS 73 3HZ LYS 73 -0.888 13.955 -12.134 643 H LEU 74 H LEU 74 0.415 15.126 -6.787 644 HA LEU 74 HA LEU 74 0.678 17.796 -6.027 645 1HB LEU 74 2HB LEU 74 -1.437 16.624 -6.206 646 2HB LEU 74 1HB LEU 74 -0.999 15.596 -4.860 647 HG LEU 74 HG LEU 74 -1.050 17.560 -3.368 648 1HD1 LEU 74 1HD1 LEU 74 -0.522 19.291 -5.001 649 2HD1 LEU 74 2HD1 LEU 74 -2.039 19.644 -4.168 650 3HD1 LEU 74 3HD1 LEU 74 -2.062 19.001 -5.811 651 1HD2 LEU 74 1HD2 LEU 74 -3.468 17.810 -3.381 652 2HD2 LEU 74 2HD2 LEU 74 -2.983 16.130 -3.641 653 3HD2 LEU 74 3HD2 LEU 74 -3.522 17.117 -5.003 654 H ILE 75 H ILE 75 1.317 14.833 -4.232 655 HA ILE 75 HA ILE 75 1.928 16.122 -1.805 656 HB ILE 75 HB ILE 75 2.635 13.327 -2.755 657 1HG1 ILE 75 2HG1 ILE 75 1.088 12.650 -0.887 658 2HG1 ILE 75 1HG1 ILE 75 0.734 14.346 -0.627 659 1HG2 ILE 75 1HG2 ILE 75 3.279 14.499 -0.052 660 2HG2 ILE 75 2HG2 ILE 75 4.437 14.002 -1.281 661 3HG2 ILE 75 3HG2 ILE 75 3.422 12.794 -0.488 662 1HD1 ILE 75 1HD1 ILE 75 0.127 12.757 -3.108 663 2HD1 ILE 75 2HD1 ILE 75 -0.241 14.464 -2.864 664 3HD1 ILE 75 3HD1 ILE 75 -1.027 13.242 -1.866 665 H ARG 76 H ARG 76 3.942 15.300 -4.518 666 HA ARG 76 HA ARG 76 6.453 15.899 -3.244 667 1HB ARG 76 2HB ARG 76 5.871 16.232 -6.196 668 2HB ARG 76 1HB ARG 76 7.451 16.124 -5.452 669 1HG ARG 76 2HG ARG 76 7.447 13.946 -5.777 670 2HG ARG 76 1HG ARG 76 5.981 13.786 -4.799 671 1HD ARG 76 2HD ARG 76 5.471 12.882 -6.929 672 2HD ARG 76 1HD ARG 76 4.661 14.429 -6.816 673 HE ARG 76 HE ARG 76 6.704 13.639 -8.699 674 1HH1 ARG 76 1HH1 ARG 76 5.158 16.552 -7.321 675 2HH1 ARG 76 2HH1 ARG 76 5.595 17.532 -8.617 676 1HH2 ARG 76 1HH2 ARG 76 7.047 14.889 -10.473 677 2HH2 ARG 76 2HH2 ARG 76 6.625 16.564 -10.531 678 H GLU 77 H GLU 77 3.996 17.845 -4.999 679 HA GLU 77 HA GLU 77 5.552 20.162 -5.120 680 1HB GLU 77 2HB GLU 77 2.581 19.741 -5.413 681 2HB GLU 77 1HB GLU 77 3.451 21.212 -5.821 682 1HG GLU 77 2HG GLU 77 3.756 18.521 -7.133 683 2HG GLU 77 1HG GLU 77 2.966 19.943 -7.809 684 H LYS 78 H LYS 78 3.073 18.964 -2.837 685 HA LYS 78 HA LYS 78 2.978 21.202 -1.223 686 1HB LYS 78 2HB LYS 78 2.861 18.328 -0.299 687 2HB LYS 78 1HB LYS 78 2.392 19.709 0.673 688 1HG LYS 78 2HG LYS 78 1.066 18.720 -1.847 689 2HG LYS 78 1HG LYS 78 0.426 18.646 -0.208 690 1HD LYS 78 2HD LYS 78 0.933 21.150 -1.834 691 2HD LYS 78 1HD LYS 78 -0.637 20.440 -1.482 692 1HE LYS 78 2HE LYS 78 1.284 21.616 0.535 693 2HE LYS 78 1HE LYS 78 -0.177 22.388 -0.064 694 1HZ LYS 78 1HZ LYS 78 -0.576 21.443 2.070 695 2HZ LYS 78 2HZ LYS 78 0.016 19.961 1.641 696 3HZ LYS 78 3HZ LYS 78 -1.452 20.483 0.999 697 H LYS 79 H LYS 79 5.416 18.825 -1.386 698 HA LYS 79 HA LYS 79 7.006 20.226 0.673 699 1HB LYS 79 2HB LYS 79 7.815 17.731 -0.862 700 2HB LYS 79 1HB LYS 79 8.477 18.308 0.665 701 1HG LYS 79 2HG LYS 79 6.224 17.886 1.697 702 2HG LYS 79 1HG LYS 79 5.756 17.103 0.191 703 1HD LYS 79 2HD LYS 79 6.430 15.361 1.611 704 2HD LYS 79 1HD LYS 79 7.801 15.618 0.531 705 1HE LYS 79 2HE LYS 79 8.631 15.370 2.767 706 2HE LYS 79 1HE LYS 79 8.831 17.054 2.280 707 1HZ LYS 79 1HZ LYS 79 7.985 17.012 4.492 708 2HZ LYS 79 2HZ LYS 79 6.739 15.955 4.102 709 3HZ LYS 79 3HZ LYS 79 6.692 17.517 3.541 710 H LYS 80 H LYS 80 9.940 20.317 -0.780 711 HA LYS 80 HA LYS 80 8.995 21.020 -3.241 712 1HB LYS 80 2HB LYS 80 10.906 22.680 -3.036 713 2HB LYS 80 1HB LYS 80 9.503 23.039 -2.048 714 1HG LYS 80 2HG LYS 80 10.703 22.042 -0.103 715 2HG LYS 80 1HG LYS 80 12.119 21.859 -1.140 716 1HD LYS 80 2HD LYS 80 12.166 24.283 -1.499 717 2HD LYS 80 1HD LYS 80 10.739 24.462 -0.473 718 1HE LYS 80 2HE LYS 80 12.006 23.483 1.405 719 2HE LYS 80 1HE LYS 80 13.430 23.397 0.372 720 1HZ LYS 80 1HZ LYS 80 13.570 25.326 1.719 721 2HZ LYS 80 2HZ LYS 80 12.033 25.825 1.332 722 3HZ LYS 80 3HZ LYS 80 13.258 25.875 0.145 723 H ILE 81 H ILE 81 9.380 18.598 -3.158 724 HA ILE 81 HA ILE 81 12.205 18.080 -3.765 725 HB ILE 81 HB ILE 81 10.180 16.045 -2.725 726 1HG1 ILE 81 2HG1 ILE 81 12.452 17.391 -1.230 727 2HG1 ILE 81 1HG1 ILE 81 10.743 17.736 -0.996 728 1HG2 ILE 81 1HG2 ILE 81 13.176 15.880 -3.102 729 2HG2 ILE 81 2HG2 ILE 81 11.961 15.092 -4.108 730 3HG2 ILE 81 3HG2 ILE 81 12.154 14.616 -2.420 731 1HD1 ILE 81 1HD1 ILE 81 10.399 15.450 -0.195 732 2HD1 ILE 81 2HD1 ILE 81 11.611 16.298 0.763 733 3HD1 ILE 81 3HD1 ILE 81 12.112 15.111 -0.441 734 H SER 82 H SER 82 12.558 17.416 -5.777 735 HA SER 82 HA SER 82 10.277 17.232 -7.572 736 1HB SER 82 2HB SER 82 13.229 17.482 -8.103 737 2HB SER 82 1HB SER 82 11.959 17.520 -9.327 738 HG SER 82 HG SER 82 11.207 19.381 -8.544 739 H GLN 83 H GLN 83 10.710 15.726 -9.510 740 HA GLN 83 HA GLN 83 10.451 13.133 -8.423 741 1HB GLN 83 2HB GLN 83 10.032 12.330 -10.711 742 2HB GLN 83 1HB GLN 83 9.061 13.717 -10.282 743 1HG GLN 83 2HG GLN 83 9.623 14.252 -12.425 744 2HG GLN 83 1HG GLN 83 10.952 15.023 -11.569 745 1HE2 GLN 83 1HE2 GLN 83 9.996 12.392 -13.534 746 2HE2 GLN 83 2HE2 GLN 83 11.556 11.879 -14.057 747 H SER 84 H SER 84 13.221 14.666 -10.030 748 HA SER 84 HA SER 84 14.634 12.271 -10.412 749 1HB SER 84 2HB SER 84 15.689 15.068 -9.958 750 2HB SER 84 1HB SER 84 16.548 13.729 -10.725 751 HG SER 84 HG SER 84 14.227 14.025 -11.988 752 H GLU 85 H GLU 85 14.383 14.602 -7.789 753 HA GLU 85 HA GLU 85 16.319 13.522 -6.115 754 1HB GLU 85 2HB GLU 85 13.816 15.066 -5.392 755 2HB GLU 85 1HB GLU 85 15.214 14.836 -4.351 756 1HG GLU 85 2HG GLU 85 16.601 16.082 -5.948 757 2HG GLU 85 1HG GLU 85 15.189 16.327 -6.972 758 H LEU 86 H LEU 86 12.810 12.875 -6.386 759 HA LEU 86 HA LEU 86 12.663 10.963 -4.335 760 1HB LEU 86 2HB LEU 86 11.001 11.463 -6.762 761 2HB LEU 86 1HB LEU 86 10.809 9.930 -5.947 762 HG LEU 86 HG LEU 86 9.092 11.355 -5.207 763 1HD1 LEU 86 1HD1 LEU 86 11.189 11.169 -3.075 764 2HD1 LEU 86 2HD1 LEU 86 9.987 9.952 -3.501 765 3HD1 LEU 86 3HD1 LEU 86 9.475 11.489 -2.803 766 1HD2 LEU 86 1HD2 LEU 86 11.195 13.385 -4.488 767 2HD2 LEU 86 2HD2 LEU 86 9.473 13.521 -4.131 768 3HD2 LEU 86 3HD2 LEU 86 10.031 13.513 -5.805 769 H ALA 87 H ALA 87 13.474 10.590 -7.734 770 HA ALA 87 HA ALA 87 13.509 7.804 -7.877 771 1HB ALA 87 1HB ALA 87 15.243 9.746 -9.395 772 2HB ALA 87 2HB ALA 87 13.606 9.255 -9.837 773 3HB ALA 87 3HB ALA 87 14.914 8.071 -9.843 774 H ALA 88 H ALA 88 16.191 10.046 -7.103 775 HA ALA 88 HA ALA 88 18.155 8.104 -6.772 776 1HB ALA 88 1HB ALA 88 18.615 10.497 -7.024 777 2HB ALA 88 2HB ALA 88 19.384 9.842 -5.577 778 3HB ALA 88 3HB ALA 88 17.910 10.800 -5.436 779 H LEU 89 H LEU 89 15.857 9.495 -4.506 780 HA LEU 89 HA LEU 89 16.852 8.324 -2.153 781 1HB LEU 89 2HB LEU 89 14.083 9.253 -2.862 782 2HB LEU 89 1HB LEU 89 14.530 8.694 -1.266 783 HG LEU 89 HG LEU 89 15.744 11.078 -2.661 784 1HD1 LEU 89 1HD1 LEU 89 13.402 11.457 -2.088 785 2HD1 LEU 89 2HD1 LEU 89 14.469 12.398 -1.044 786 3HD1 LEU 89 3HD1 LEU 89 13.715 10.923 -0.436 787 1HD2 LEU 89 1HD2 LEU 89 16.017 10.051 0.162 788 2HD2 LEU 89 2HD2 LEU 89 16.701 11.553 -0.461 789 3HD2 LEU 89 3HD2 LEU 89 17.264 10.002 -1.084 790 H LEU 90 H LEU 90 14.667 7.062 -4.625 791 HA LEU 90 HA LEU 90 14.000 4.763 -3.006 792 1HB LEU 90 2HB LEU 90 13.353 5.189 -5.893 793 2HB LEU 90 1HB LEU 90 12.500 4.216 -4.722 794 HG LEU 90 HG LEU 90 12.547 7.212 -4.896 795 1HD1 LEU 90 1HD1 LEU 90 10.189 6.989 -5.432 796 2HD1 LEU 90 2HD1 LEU 90 10.366 5.234 -5.421 797 3HD1 LEU 90 3HD1 LEU 90 11.238 6.201 -6.611 798 1HD2 LEU 90 1HD2 LEU 90 12.422 6.574 -2.562 799 2HD2 LEU 90 2HD2 LEU 90 11.114 5.449 -2.906 800 3HD2 LEU 90 3HD2 LEU 90 10.858 7.182 -3.099 801 H GLU 91 H GLU 91 16.669 5.576 -4.711 802 HA GLU 91 HA GLU 91 18.312 4.577 -5.898 803 1HB GLU 91 2HB GLU 91 17.213 2.040 -4.636 804 2HB GLU 91 1HB GLU 91 18.677 2.092 -5.585 805 1HG GLU 91 2HG GLU 91 19.400 2.052 -3.380 806 2HG GLU 91 1HG GLU 91 19.533 3.745 -3.834 807 H VAL 92 H VAL 92 16.069 5.179 -7.456 808 HA VAL 92 HA VAL 92 16.106 2.957 -9.348 809 HB VAL 92 HB VAL 92 13.764 3.341 -9.972 810 1HG1 VAL 92 1HG1 VAL 92 12.649 2.370 -8.031 811 2HG1 VAL 92 2HG1 VAL 92 14.070 2.734 -7.052 812 3HG1 VAL 92 3HG1 VAL 92 14.191 1.594 -8.392 813 1HG2 VAL 92 1HG2 VAL 92 13.691 5.281 -7.661 814 2HG2 VAL 92 2HG2 VAL 92 12.267 4.694 -8.522 815 3HG2 VAL 92 3HG2 VAL 92 13.476 5.659 -9.369 816 H SER 93 H SER 93 15.027 3.855 -11.470 817 HA SER 93 HA SER 93 16.607 6.141 -12.172 818 1HB SER 93 2HB SER 93 14.856 4.306 -13.812 819 2HB SER 93 1HB SER 93 15.931 5.548 -14.467 820 HG SER 93 HG SER 93 17.661 4.517 -13.602 821 H ARG 94 H ARG 94 15.694 7.936 -13.367 822 HA ARG 94 HA ARG 94 13.598 9.128 -11.914 823 1HB ARG 94 2HB ARG 94 14.727 10.014 -14.561 824 2HB ARG 94 1HB ARG 94 13.754 10.993 -13.471 825 1HG ARG 94 2HG ARG 94 15.523 10.700 -11.756 826 2HG ARG 94 1HG ARG 94 16.505 9.910 -12.989 827 1HD ARG 94 2HD ARG 94 15.449 12.722 -13.037 828 2HD ARG 94 1HD ARG 94 17.115 12.231 -12.774 829 HE ARG 94 HE ARG 94 16.018 11.357 -15.290 830 1HH1 ARG 94 1HH1 ARG 94 17.808 13.879 -13.591 831 2HH1 ARG 94 2HH1 ARG 94 18.298 14.710 -14.984 832 1HH2 ARG 94 1HH2 ARG 94 16.684 12.418 -17.203 833 2HH2 ARG 94 2HH2 ARG 94 17.630 13.843 -17.142 834 H GLN 95 H GLN 95 13.673 7.650 -15.063 835 HA GLN 95 HA GLN 95 11.057 8.418 -15.825 836 1HB GLN 95 2HB GLN 95 12.860 7.601 -17.369 837 2HB GLN 95 1HB GLN 95 12.549 5.977 -16.776 838 1HG GLN 95 2HG GLN 95 10.268 6.106 -17.608 839 2HG GLN 95 1HG GLN 95 10.568 7.744 -18.182 840 1HE2 GLN 95 1HE2 GLN 95 10.187 7.260 -20.298 841 2HE2 GLN 95 2HE2 GLN 95 11.237 6.271 -21.245 842 H THR 96 H THR 96 12.272 5.813 -13.876 843 HA THR 96 HA THR 96 10.085 4.089 -13.842 844 HB THR 96 HB THR 96 11.983 4.712 -11.575 845 HG1 THR 96 1HG THR 96 12.387 2.887 -13.721 846 1HG2 THR 96 1HG2 THR 96 10.603 2.147 -12.424 847 2HG2 THR 96 2HG2 THR 96 10.158 3.143 -11.038 848 3HG2 THR 96 3HG2 THR 96 11.715 2.317 -11.065 849 H ILE 97 H ILE 97 10.990 6.745 -11.593 850 HA ILE 97 HA ILE 97 8.530 6.549 -10.171 851 HB ILE 97 HB ILE 97 10.697 7.349 -9.151 852 1HG1 ILE 97 2HG1 ILE 97 8.471 7.881 -8.036 853 2HG1 ILE 97 1HG1 ILE 97 9.810 8.909 -7.572 854 1HG2 ILE 97 1HG2 ILE 97 11.562 8.714 -10.872 855 2HG2 ILE 97 2HG2 ILE 97 11.418 9.668 -9.393 856 3HG2 ILE 97 3HG2 ILE 97 10.239 9.866 -10.691 857 1HD1 ILE 97 1HD1 ILE 97 8.924 10.682 -9.024 858 2HD1 ILE 97 2HD1 ILE 97 7.754 10.175 -7.807 859 3HD1 ILE 97 3HD1 ILE 97 7.583 9.627 -9.475 860 H ASN 98 H ASN 98 9.666 8.414 -12.880 861 HA ASN 98 HA ASN 98 7.665 10.375 -13.096 862 1HB ASN 98 2HB ASN 98 9.812 10.260 -14.405 863 2HB ASN 98 1HB ASN 98 9.136 8.928 -15.321 864 1HD2 ASN 98 1HD2 ASN 98 7.359 11.876 -14.346 865 2HD2 ASN 98 2HD2 ASN 98 7.194 12.459 -15.951 866 H GLY 99 H GLY 99 7.863 7.068 -14.160 867 1HA GLY 99 2HA GLY 99 5.412 6.908 -15.579 868 2HA GLY 99 1HA GLY 99 6.283 5.538 -14.903 869 H ILE 100 H ILE 100 6.196 6.497 -12.151 870 HA ILE 100 HA ILE 100 3.642 5.493 -11.426 871 HB ILE 100 HB ILE 100 5.778 6.787 -9.685 872 1HG1 ILE 100 2HG1 ILE 100 6.531 4.724 -10.800 873 2HG1 ILE 100 1HG1 ILE 100 6.387 4.503 -9.061 874 1HG2 ILE 100 1HG2 ILE 100 3.366 5.161 -8.871 875 2HG2 ILE 100 2HG2 ILE 100 3.589 6.889 -8.590 876 3HG2 ILE 100 3HG2 ILE 100 4.637 5.717 -7.781 877 1HD1 ILE 100 1HD1 ILE 100 4.246 3.348 -9.400 878 2HD1 ILE 100 2HD1 ILE 100 5.565 2.559 -10.264 879 3HD1 ILE 100 3HD1 ILE 100 4.414 3.566 -11.143 880 H GLU 101 H GLU 101 5.102 8.723 -11.478 881 HA GLU 101 HA GLU 101 3.079 10.241 -10.358 882 1HB GLU 101 2HB GLU 101 4.557 11.029 -12.869 883 2HB GLU 101 1HB GLU 101 3.836 12.098 -11.684 884 1HG GLU 101 2HG GLU 101 5.507 11.385 -10.050 885 2HG GLU 101 1HG GLU 101 6.229 10.332 -11.267 886 H LYS 102 H LYS 102 3.267 8.757 -13.472 887 HA LYS 102 HA LYS 102 0.872 10.056 -14.495 888 1HB LYS 102 2HB LYS 102 2.637 7.984 -15.758 889 2HB LYS 102 1HB LYS 102 1.406 8.952 -16.557 890 1HG LYS 102 2HG LYS 102 2.678 10.971 -16.063 891 2HG LYS 102 1HG LYS 102 3.917 9.986 -15.282 892 1HD LYS 102 2HD LYS 102 4.162 8.751 -17.377 893 2HD LYS 102 1HD LYS 102 3.064 9.889 -18.154 894 1HE LYS 102 2HE LYS 102 5.712 10.540 -16.872 895 2HE LYS 102 1HE LYS 102 5.361 10.531 -18.595 896 1HZ LYS 102 1HZ LYS 102 4.234 12.384 -16.569 897 2HZ LYS 102 2HZ LYS 102 3.797 12.385 -18.222 898 3HZ LYS 102 3HZ LYS 102 5.379 12.731 -17.753 899 H ASN 103 H ASN 103 1.416 7.568 -12.450 900 HA ASN 103 HA ASN 103 0.478 5.569 -11.850 901 1HB ASN 103 2HB ASN 103 -1.427 7.323 -11.739 902 2HB ASN 103 1HB ASN 103 -1.983 6.675 -13.263 903 1HD2 ASN 103 1HD2 ASN 103 -1.613 3.860 -12.547 904 2HD2 ASN 103 2HD2 ASN 103 -2.801 3.491 -11.344 905 H LYS 104 H LYS 104 1.930 5.538 -14.367 906 HA LYS 104 HA LYS 104 0.280 3.663 -15.912 907 1HB LYS 104 2HB LYS 104 0.712 6.013 -16.915 908 2HB LYS 104 1HB LYS 104 2.357 5.445 -17.174 909 1HG LYS 104 2HG LYS 104 1.494 3.583 -18.504 910 2HG LYS 104 1HG LYS 104 -0.145 4.182 -18.262 911 1HD LYS 104 2HD LYS 104 0.516 6.287 -19.383 912 2HD LYS 104 1HD LYS 104 2.103 5.575 -19.703 913 1HE LYS 104 2HE LYS 104 0.981 3.721 -20.891 914 2HE LYS 104 1HE LYS 104 -0.558 4.544 -20.655 915 1HZ LYS 104 1HZ LYS 104 0.385 6.442 -21.946 916 2HZ LYS 104 2HZ LYS 104 0.270 5.001 -22.817 917 3HZ LYS 104 3HZ LYS 104 1.763 5.500 -22.211 918 H TYR 105 H TYR 105 2.343 3.441 -13.818 919 HA TYR 105 HA TYR 105 4.101 1.573 -15.273 920 1HB TYR 105 2HB TYR 105 5.282 3.693 -14.437 921 2HB TYR 105 1HB TYR 105 4.966 3.121 -12.807 922 HD1 TYR 105 1HD TYR 105 6.655 2.200 -15.979 923 HD2 TYR 105 2HD TYR 105 6.483 1.638 -11.768 924 HE1 TYR 105 1HE TYR 105 8.738 0.902 -16.075 925 HE2 TYR 105 2HE TYR 105 8.565 0.337 -11.852 926 HH TYR 105 HH TYR 105 10.602 0.314 -14.519 927 H ASN 106 H ASN 106 1.514 1.622 -13.615 928 HA ASN 106 HA ASN 106 0.347 0.442 -12.155 929 1HB ASN 106 2HB ASN 106 1.226 -1.525 -13.374 930 2HB ASN 106 1HB ASN 106 2.620 -1.564 -12.303 931 1HD2 ASN 106 1HD2 ASN 106 2.199 -3.615 -11.511 932 2HD2 ASN 106 2HD2 ASN 106 0.824 -3.981 -10.545 933 HA PRO 107 HA PRO 107 1.930 2.128 -8.362 934 1HB PRO 107 2HB PRO 107 -0.642 1.052 -7.328 935 2HB PRO 107 1HB PRO 107 0.020 2.690 -7.217 936 1HG PRO 107 2HG PRO 107 -1.996 2.129 -8.878 937 2HG PRO 107 1HG PRO 107 -0.721 3.277 -9.327 938 1HD PRO 107 2HD PRO 107 -1.101 0.438 -10.187 939 2HD PRO 107 1HD PRO 107 -0.559 1.841 -11.131 940 H SER 108 H SER 108 3.516 0.688 -8.043 941 HA SER 108 HA SER 108 2.988 -1.974 -7.066 942 1HB SER 108 2HB SER 108 5.581 -0.487 -7.519 943 2HB SER 108 1HB SER 108 5.381 -2.233 -7.323 944 HG SER 108 HG SER 108 4.011 -0.843 -9.379 945 H LEU 109 H LEU 109 3.297 -2.523 -4.901 946 HA LEU 109 HA LEU 109 2.794 -0.338 -3.229 947 1HB LEU 109 2HB LEU 109 1.750 -2.566 -2.911 948 2HB LEU 109 1HB LEU 109 3.294 -3.200 -2.395 949 HG LEU 109 HG LEU 109 1.568 -2.668 -0.576 950 1HD1 LEU 109 1HD1 LEU 109 3.898 -3.091 -0.015 951 2HD1 LEU 109 2HD1 LEU 109 3.213 -1.837 1.018 952 3HD1 LEU 109 3HD1 LEU 109 4.283 -1.395 -0.312 953 1HD2 LEU 109 1HD2 LEU 109 0.801 -0.495 -1.423 954 2HD2 LEU 109 2HD2 LEU 109 2.405 0.175 -1.206 955 3HD2 LEU 109 3HD2 LEU 109 1.467 -0.320 0.196 956 H GLN 110 H GLN 110 5.715 -2.499 -3.347 957 HA GLN 110 HA GLN 110 7.024 -1.211 -1.280 958 1HB GLN 110 2HB GLN 110 7.804 -3.322 -2.199 959 2HB GLN 110 1HB GLN 110 8.147 -2.557 -3.743 960 1HG GLN 110 2HG GLN 110 10.196 -2.950 -2.514 961 2HG GLN 110 1HG GLN 110 9.909 -1.222 -2.697 962 1HE2 GLN 110 1HE2 GLN 110 10.057 -3.874 -0.499 963 2HE2 GLN 110 2HE2 GLN 110 10.061 -2.932 0.961 964 H LEU 111 H LEU 111 7.136 -0.479 -4.747 965 HA LEU 111 HA LEU 111 9.004 1.609 -4.557 966 1HB LEU 111 2HB LEU 111 8.394 0.434 -6.652 967 2HB LEU 111 1HB LEU 111 6.841 1.241 -6.631 968 HG LEU 111 HG LEU 111 7.959 3.410 -6.933 969 1HD1 LEU 111 1HD1 LEU 111 10.067 2.897 -5.814 970 2HD1 LEU 111 2HD1 LEU 111 10.351 3.492 -7.449 971 3HD1 LEU 111 3HD1 LEU 111 10.488 1.769 -7.101 972 1HD2 LEU 111 1HD2 LEU 111 7.234 2.152 -8.890 973 2HD2 LEU 111 2HD2 LEU 111 8.779 1.305 -8.930 974 3HD2 LEU 111 3HD2 LEU 111 8.718 3.040 -9.234 975 H ALA 112 H ALA 112 5.508 1.617 -4.376 976 HA ALA 112 HA ALA 112 5.231 4.464 -4.259 977 1HB ALA 112 1HB ALA 112 3.377 3.013 -4.969 978 2HB ALA 112 2HB ALA 112 2.920 4.044 -3.612 979 3HB ALA 112 3HB ALA 112 3.292 2.341 -3.340 980 H LEU 113 H LEU 113 5.540 1.883 -1.888 981 HA LEU 113 HA LEU 113 4.830 3.191 0.441 982 1HB LEU 113 2HB LEU 113 5.147 0.746 -0.095 983 2HB LEU 113 1HB LEU 113 6.865 1.024 0.066 984 HG LEU 113 HG LEU 113 6.487 1.704 2.410 985 1HD1 LEU 113 1HD1 LEU 113 4.298 1.219 3.391 986 2HD1 LEU 113 2HD1 LEU 113 3.679 0.791 1.796 987 3HD1 LEU 113 3HD1 LEU 113 4.172 2.449 2.133 988 1HD2 LEU 113 1HD2 LEU 113 6.052 -0.563 3.207 989 2HD2 LEU 113 2HD2 LEU 113 7.124 -0.586 1.804 990 3HD2 LEU 113 3HD2 LEU 113 5.421 -1.008 1.621 991 H LYS 114 H LYS 114 7.923 2.714 -1.170 992 HA LYS 114 HA LYS 114 9.323 4.105 0.853 993 1HB LYS 114 2HB LYS 114 11.296 4.127 -0.739 994 2HB LYS 114 1HB LYS 114 10.673 2.554 -0.286 995 1HG LYS 114 2HG LYS 114 9.534 2.388 -2.425 996 2HG LYS 114 1HG LYS 114 10.150 3.964 -2.907 997 1HD LYS 114 2HD LYS 114 11.548 2.246 -3.866 998 2HD LYS 114 1HD LYS 114 12.464 3.071 -2.605 999 1HE LYS 114 2HE LYS 114 11.860 1.239 -1.039 1000 2HE LYS 114 1HE LYS 114 11.065 0.404 -2.372 1001 1HZ LYS 114 1HZ LYS 114 13.271 0.433 -3.530 1002 2HZ LYS 114 2HZ LYS 114 13.214 -0.502 -2.139 1003 3HZ LYS 114 3HZ LYS 114 13.967 0.994 -2.089 1004 H ILE 115 H ILE 115 7.937 5.156 -2.159 1005 HA ILE 115 HA ILE 115 8.869 7.829 -2.144 1006 HB ILE 115 HB ILE 115 6.106 6.856 -2.996 1007 1HG1 ILE 115 2HG1 ILE 115 8.563 7.349 -4.686 1008 2HG1 ILE 115 1HG1 ILE 115 7.971 5.765 -4.204 1009 1HG2 ILE 115 1HG2 ILE 115 6.121 9.263 -2.642 1010 2HG2 ILE 115 2HG2 ILE 115 5.983 8.891 -4.360 1011 3HG2 ILE 115 3HG2 ILE 115 7.527 9.426 -3.696 1012 1HD1 ILE 115 1HD1 ILE 115 7.351 6.291 -6.494 1013 2HD1 ILE 115 2HD1 ILE 115 6.508 7.739 -5.947 1014 3HD1 ILE 115 3HD1 ILE 115 5.922 6.143 -5.473 1015 H ALA 116 H ALA 116 6.194 6.257 -0.579 1016 HA ALA 116 HA ALA 116 4.926 8.455 0.649 1017 1HB ALA 116 1HB ALA 116 3.893 6.798 2.089 1018 2HB ALA 116 2HB ALA 116 5.095 5.615 1.571 1019 3HB ALA 116 3HB ALA 116 3.912 6.231 0.409 1020 H TYR 117 H TYR 117 7.388 6.208 1.748 1021 HA TYR 117 HA TYR 117 7.626 7.237 4.328 1022 1HB TYR 117 2HB TYR 117 8.381 5.037 3.971 1023 2HB TYR 117 1HB TYR 117 9.409 5.516 2.627 1024 HD1 TYR 117 1HD TYR 117 11.576 6.004 2.960 1025 HD2 TYR 117 2HD TYR 117 9.024 5.872 6.318 1026 HE1 TYR 117 1HE TYR 117 13.554 6.227 4.445 1027 HE2 TYR 117 2HE TYR 117 10.957 6.092 7.829 1028 HH TYR 117 HH TYR 117 13.334 5.655 7.788 1029 H TYR 118 H TYR 118 9.592 7.899 1.401 1030 HA TYR 118 HA TYR 118 11.308 9.641 2.855 1031 1HB TYR 118 2HB TYR 118 10.979 9.247 -0.110 1032 2HB TYR 118 1HB TYR 118 12.119 10.405 0.573 1033 HD1 TYR 118 1HD TYR 118 13.814 9.466 2.290 1034 HD2 TYR 118 2HD TYR 118 11.645 7.051 -0.436 1035 HE1 TYR 118 1HE TYR 118 15.489 7.689 2.541 1036 HE2 TYR 118 2HE TYR 118 13.301 5.265 -0.190 1037 HH TYR 118 HH TYR 118 15.735 5.196 0.407 1038 H LEU 119 H LEU 119 8.439 10.129 1.167 1039 HA LEU 119 HA LEU 119 8.653 13.031 1.433 1040 1HB LEU 119 2HB LEU 119 6.337 11.355 0.451 1041 2HB LEU 119 1HB LEU 119 6.328 13.107 0.514 1042 1HD1 LEU 119 1HD1 LEU 119 5.899 11.350 -1.980 1043 2HD1 LEU 119 2HD1 LEU 119 6.917 12.295 -3.065 1044 3HD1 LEU 119 3HD1 LEU 119 5.817 13.112 -1.954 1045 1HD2 LEU 119 1HD2 LEU 119 7.816 14.420 -1.043 1046 2HD2 LEU 119 2HD2 LEU 119 8.832 13.558 -2.199 1047 3HD2 LEU 119 3HD2 LEU 119 9.225 13.520 -0.481 1048 H ASN 120 H ASN 120 7.897 10.538 3.398 1049 HA ASN 120 HA ASN 120 6.742 10.126 5.268 1050 1HB ASN 120 2HB ASN 120 8.412 11.800 6.130 1051 2HB ASN 120 1HB ASN 120 7.212 13.062 5.881 1052 1HD2 ASN 120 1HD2 ASN 120 7.046 13.610 8.043 1053 2HD2 ASN 120 2HD2 ASN 120 6.321 12.552 9.211 1054 H THR 121 H THR 121 4.945 9.924 3.677 1055 HA THR 121 HA THR 121 2.734 11.579 4.527 1056 HB THR 121 HB THR 121 3.469 11.029 1.632 1057 HG1 THR 121 1HG THR 121 4.635 12.683 3.060 1058 1HG2 THR 121 1HG2 THR 121 1.640 12.588 1.125 1059 2HG2 THR 121 2HG2 THR 121 1.297 12.752 2.846 1060 3HG2 THR 121 3HG2 THR 121 1.049 11.202 2.043 1061 HA PRO 122 HA PRO 122 1.049 7.392 4.712 1062 1HB PRO 122 2HB PRO 122 -1.505 8.894 4.430 1063 2HB PRO 122 1HB PRO 122 -1.035 7.695 5.639 1064 1HG PRO 122 2HG PRO 122 -1.142 10.280 6.254 1065 2HG PRO 122 1HG PRO 122 0.141 9.237 6.902 1066 1HD PRO 122 2HD PRO 122 0.259 11.245 4.697 1067 2HD PRO 122 1HD PRO 122 1.473 10.845 5.931 1068 H LEU 123 H LEU 123 0.426 6.000 3.198 1069 HA LEU 123 HA LEU 123 0.483 6.493 0.480 1070 1HB LEU 123 2HB LEU 123 -0.849 4.237 1.979 1071 2HB LEU 123 1HB LEU 123 -0.757 4.287 0.239 1072 1HD1 LEU 123 1HD1 LEU 123 2.195 5.287 0.085 1073 2HD1 LEU 123 2HD1 LEU 123 1.505 3.987 -0.887 1074 3HD1 LEU 123 3HD1 LEU 123 2.930 3.684 0.108 1075 1HD2 LEU 123 1HD2 LEU 123 1.176 3.594 3.334 1076 2HD2 LEU 123 2HD2 LEU 123 1.987 5.040 2.734 1077 3HD2 LEU 123 3HD2 LEU 123 2.740 3.458 2.528 1078 H GLU 124 H GLU 124 -2.297 6.417 2.665 1079 HA GLU 124 HA GLU 124 -4.363 6.567 0.849 1080 1HB GLU 124 2HB GLU 124 -4.181 7.847 3.573 1081 2HB GLU 124 1HB GLU 124 -5.665 7.597 2.668 1082 1HG GLU 124 2HG GLU 124 -5.284 5.174 2.757 1083 2HG GLU 124 1HG GLU 124 -3.832 5.457 3.719 1084 H ASP 125 H ASP 125 -2.287 9.193 2.028 1085 HA ASP 125 HA ASP 125 -3.941 11.210 0.858 1086 1HB ASP 125 2HB ASP 125 -2.524 11.731 2.821 1087 2HB ASP 125 1HB ASP 125 -1.086 11.446 1.848 1088 H ILE 126 H ILE 126 -1.204 9.389 -0.065 1089 HA ILE 126 HA ILE 126 -0.527 10.953 -2.399 1090 HB ILE 126 HB ILE 126 0.419 8.165 -1.653 1091 1HG1 ILE 126 2HG1 ILE 126 1.709 10.878 -1.249 1092 2HG1 ILE 126 1HG1 ILE 126 1.019 9.871 0.016 1093 1HG2 ILE 126 1HG2 ILE 126 0.658 8.636 -4.041 1094 2HG2 ILE 126 2HG2 ILE 126 2.234 8.603 -3.251 1095 3HG2 ILE 126 3HG2 ILE 126 1.491 10.146 -3.672 1096 1HD1 ILE 126 1HD1 ILE 126 3.437 9.731 -0.009 1097 2HD1 ILE 126 2HD1 ILE 126 3.404 9.190 -1.686 1098 3HD1 ILE 126 3HD1 ILE 126 2.720 8.172 -0.418 1099 H PHE 127 H PHE 127 -1.912 7.727 -1.954 1100 HA PHE 127 HA PHE 127 -3.092 8.038 -4.622 1101 1HB PHE 127 2HB PHE 127 -2.399 5.475 -3.097 1102 2HB PHE 127 1HB PHE 127 -3.331 5.531 -4.589 1103 HD1 PHE 127 1HD PHE 127 -2.231 6.139 -6.689 1104 HD2 PHE 127 2HD PHE 127 -0.049 5.731 -3.061 1105 HE1 PHE 127 1HE PHE 127 -0.134 5.985 -7.971 1106 HE2 PHE 127 2HE PHE 127 2.047 5.583 -4.333 1107 HZ PHE 127 HZ PHE 127 2.007 5.709 -6.791 1108 H GLN 128 H GLN 128 -5.219 7.814 -4.777 1109 HA GLN 128 HA GLN 128 -6.659 7.743 -2.228 1110 1HB GLN 128 2HB GLN 128 -6.493 9.878 -3.615 1111 2HB GLN 128 1HB GLN 128 -7.473 9.058 -4.808 1112 1HG GLN 128 2HG GLN 128 -9.339 9.001 -3.350 1113 2HG GLN 128 1HG GLN 128 -8.356 9.523 -1.975 1114 1HE2 GLN 128 1HE2 GLN 128 -10.715 10.842 -3.077 1115 2HE2 GLN 128 2HE2 GLN 128 -10.188 12.422 -3.527 1116 H TRP 129 H TRP 129 -7.970 6.104 -2.048 1117 HA TRP 129 HA TRP 129 -8.599 4.682 -4.494 1118 1HB TRP 129 2HB TRP 129 -8.752 2.638 -2.837 1119 2HB TRP 129 1HB TRP 129 -7.246 3.139 -3.591 1120 HD1 TRP 129 HD TRP 129 -9.098 3.652 -0.209 1121 HE1 TRP 129 1HE TRP 129 -7.303 3.836 1.625 1122 HE3 TRP 129 3HE TRP 129 -4.934 3.476 -3.155 1123 HZ2 TRP 129 2HZ TRP 129 -4.475 3.901 1.778 1124 HZ3 TRP 129 3HZ TRP 129 -2.726 3.604 -2.088 1125 HH2 TRP 129 HH TRP 129 -2.507 3.812 0.328 1126 H GLN 130 H GLN 130 -10.436 4.134 -4.984 1127 HA GLN 130 HA GLN 130 -12.650 4.689 -3.160 1128 1HB GLN 130 2HB GLN 130 -12.497 4.723 -6.177 1129 2HB GLN 130 1HB GLN 130 -13.950 5.009 -5.232 1130 1HG GLN 130 2HG GLN 130 -11.472 6.698 -5.070 1131 2HG GLN 130 1HG GLN 130 -12.857 7.057 -6.105 1132 1HE2 GLN 130 1HE2 GLN 130 -14.717 7.708 -5.204 1133 2HE2 GLN 130 2HE2 GLN 130 -14.871 8.209 -3.552 1134 HA PRO 131 HA PRO 131 -12.905 0.157 -3.885 1135 1HB PRO 131 2HB PRO 131 -14.173 0.084 -1.251 1136 2HB PRO 131 1HB PRO 131 -12.661 -0.669 -1.761 1137 1HG PRO 131 2HG PRO 131 -12.757 1.404 -0.007 1138 2HG PRO 131 1HG PRO 131 -11.390 1.124 -1.100 1139 1HD PRO 131 2HD PRO 131 -13.667 3.053 -1.364 1140 2HD PRO 131 1HD PRO 131 -11.938 3.298 -1.704 1141 H GLU 132 H GLU 132 -14.925 2.609 -3.143 1142 HA GLU 132 HA GLU 132 -17.324 1.211 -4.157 1143 1HB GLU 132 2HB GLU 132 -17.296 3.336 -2.007 1144 2HB GLU 132 1HB GLU 132 -18.729 2.558 -2.667 1145 1HG GLU 132 2HG GLU 132 -18.053 0.440 -1.762 1146 2HG GLU 132 1HG GLU 132 -16.531 1.133 -1.199 Start of MODEL 8 1 1H MET 1 1HT MET 1 12.813 -5.035 5.368 2 2H MET 1 2HT MET 1 14.107 -5.864 6.014 3 3H MET 1 3HT MET 1 13.257 -4.741 6.977 4 HA MET 1 HA MET 1 12.280 -7.279 5.800 5 1HB MET 1 2HB MET 1 12.792 -6.510 8.676 6 2HB MET 1 1HB MET 1 11.827 -7.902 8.218 7 1HG MET 1 2HG MET 1 13.812 -8.796 7.013 8 2HG MET 1 1HG MET 1 14.747 -7.451 7.663 9 1HE MET 1 1HE MET 1 15.515 -10.544 8.057 10 2HE MET 1 2HE MET 1 16.009 -10.537 9.752 11 3HE MET 1 3HE MET 1 16.480 -9.209 8.690 12 H ILE 2 H ILE 2 10.236 -7.919 6.593 13 HA ILE 2 HA ILE 2 8.363 -5.661 6.952 14 HB ILE 2 HB ILE 2 7.919 -8.136 5.239 15 1HG1 ILE 2 2HG1 ILE 2 9.357 -6.490 4.124 16 2HG1 ILE 2 1HG1 ILE 2 7.796 -6.601 3.324 17 1HG2 ILE 2 1HG2 ILE 2 6.018 -5.855 5.783 18 2HG2 ILE 2 2HG2 ILE 2 5.847 -7.523 6.327 19 3HG2 ILE 2 3HG2 ILE 2 5.757 -7.144 4.607 20 1HD1 ILE 2 1HD1 ILE 2 8.562 -4.297 3.462 21 2HD1 ILE 2 2HD1 ILE 2 8.680 -4.424 5.217 22 3HD1 ILE 2 3HD1 ILE 2 7.104 -4.522 4.430 23 H ILE 3 H ILE 3 6.828 -5.948 8.546 24 HA ILE 3 HA ILE 3 6.865 -8.503 9.940 25 HB ILE 3 HB ILE 3 6.491 -5.682 11.046 26 1HG1 ILE 3 2HG1 ILE 3 8.635 -7.753 11.577 27 2HG1 ILE 3 1HG1 ILE 3 8.824 -6.308 10.592 28 1HG2 ILE 3 1HG2 ILE 3 6.255 -6.733 13.258 29 2HG2 ILE 3 2HG2 ILE 3 6.316 -8.329 12.507 30 3HG2 ILE 3 3HG2 ILE 3 4.968 -7.247 12.164 31 1HD1 ILE 3 1HD1 ILE 3 9.810 -6.034 12.798 32 2HD1 ILE 3 2HD1 ILE 3 8.245 -6.362 13.545 33 3HD1 ILE 3 3HD1 ILE 3 8.464 -4.920 12.557 34 H ASN 4 H ASN 4 4.775 -9.466 10.200 35 HA ASN 4 HA ASN 4 2.696 -8.112 8.683 36 1HB ASN 4 2HB ASN 4 3.715 -10.234 7.801 37 2HB ASN 4 1HB ASN 4 3.226 -11.034 9.282 38 1HD2 ASN 4 1HD2 ASN 4 2.541 -11.712 6.655 39 2HD2 ASN 4 2HD2 ASN 4 0.819 -11.603 6.495 40 H ASN 5 H ASN 5 0.880 -7.580 9.854 41 HA ASN 5 HA ASN 5 0.475 -8.890 12.462 42 1HB ASN 5 2HB ASN 5 -0.182 -6.012 11.734 43 2HB ASN 5 1HB ASN 5 -0.450 -6.785 13.278 44 1HD2 ASN 5 1HD2 ASN 5 1.078 -4.407 12.412 45 2HD2 ASN 5 2HD2 ASN 5 2.654 -4.626 13.077 46 H LEU 6 H LEU 6 -0.565 -9.305 9.549 47 HA LEU 6 HA LEU 6 -3.041 -8.203 9.131 48 1HB LEU 6 2HB LEU 6 -1.555 -9.494 7.541 49 2HB LEU 6 1HB LEU 6 -2.090 -10.960 8.308 50 HG LEU 6 HG LEU 6 -3.111 -10.499 6.090 51 1HD1 LEU 6 1HD1 LEU 6 -5.081 -10.620 8.348 52 2HD1 LEU 6 2HD1 LEU 6 -4.259 -11.984 7.588 53 3HD1 LEU 6 3HD1 LEU 6 -5.412 -11.023 6.663 54 1HD2 LEU 6 1HD2 LEU 6 -4.457 -8.229 7.526 55 2HD2 LEU 6 2HD2 LEU 6 -4.865 -8.809 5.909 56 3HD2 LEU 6 3HD2 LEU 6 -3.279 -8.100 6.219 57 H LYS 7 H LYS 7 -2.274 -11.294 10.720 58 HA LYS 7 HA LYS 7 -4.949 -11.905 11.269 59 1HB LYS 7 2HB LYS 7 -4.163 -13.598 12.869 60 2HB LYS 7 1HB LYS 7 -3.322 -13.682 11.335 61 1HG LYS 7 2HG LYS 7 -1.403 -12.530 12.366 62 2HG LYS 7 1HG LYS 7 -2.261 -12.541 13.908 63 1HD LYS 7 2HD LYS 7 -1.738 -15.083 12.380 64 2HD LYS 7 1HD LYS 7 -0.524 -14.397 13.446 65 1HE LYS 7 2HE LYS 7 -1.797 -16.173 14.566 66 2HE LYS 7 1HE LYS 7 -2.042 -14.627 15.353 67 1HZ LYS 7 1HZ LYS 7 -4.250 -14.587 14.749 68 2HZ LYS 7 2HZ LYS 7 -4.016 -16.254 14.856 69 3HZ LYS 7 3HZ LYS 7 -4.041 -15.532 13.361 70 H LEU 8 H LEU 8 -2.632 -10.057 13.127 71 HA LEU 8 HA LEU 8 -4.022 -9.885 15.537 72 1HB LEU 8 2HB LEU 8 -1.945 -8.271 14.200 73 2HB LEU 8 1HB LEU 8 -2.885 -7.440 15.418 74 HG LEU 8 HG LEU 8 -0.811 -8.286 16.331 75 1HD1 LEU 8 1HD1 LEU 8 -1.742 -9.447 18.262 76 2HD1 LEU 8 2HD1 LEU 8 -3.225 -9.755 17.348 77 3HD1 LEU 8 3HD1 LEU 8 -2.769 -8.103 17.745 78 1HD2 LEU 8 1HD2 LEU 8 -0.476 -10.222 14.860 79 2HD2 LEU 8 2HD2 LEU 8 -1.854 -11.032 15.602 80 3HD2 LEU 8 3HD2 LEU 8 -0.410 -10.699 16.557 81 H ILE 9 H ILE 9 -4.233 -7.840 12.677 82 HA ILE 9 HA ILE 9 -6.144 -6.094 13.840 83 HB ILE 9 HB ILE 9 -5.250 -6.477 10.978 84 1HG1 ILE 9 2HG1 ILE 9 -4.508 -4.119 11.220 85 2HG1 ILE 9 1HG1 ILE 9 -5.102 -4.120 12.870 86 1HG2 ILE 9 1HG2 ILE 9 -7.426 -4.591 11.871 87 2HG2 ILE 9 2HG2 ILE 9 -7.625 -5.985 10.817 88 3HG2 ILE 9 3HG2 ILE 9 -6.671 -4.600 10.276 89 1HD1 ILE 9 1HD1 ILE 9 -3.438 -5.808 13.445 90 2HD1 ILE 9 2HD1 ILE 9 -2.699 -4.351 12.778 91 3HD1 ILE 9 3HD1 ILE 9 -2.858 -5.796 11.780 92 H ARG 10 H ARG 10 -6.424 -8.929 11.866 93 HA ARG 10 HA ARG 10 -9.213 -8.871 11.503 94 1HB ARG 10 2HB ARG 10 -7.212 -11.083 11.555 95 2HB ARG 10 1HB ARG 10 -8.929 -11.426 11.420 96 1HG ARG 10 2HG ARG 10 -9.061 -10.143 9.389 97 2HG ARG 10 1HG ARG 10 -7.359 -9.690 9.544 98 1HD ARG 10 2HD ARG 10 -7.863 -11.595 7.982 99 2HD ARG 10 1HD ARG 10 -6.638 -11.895 9.215 100 HE ARG 10 HE ARG 10 -9.090 -12.681 10.235 101 1HH1 ARG 10 1HH1 ARG 10 -7.215 -13.631 7.420 102 2HH1 ARG 10 2HH1 ARG 10 -7.258 -15.294 7.741 103 1HH2 ARG 10 1HH2 ARG 10 -9.227 -14.957 10.698 104 2HH2 ARG 10 2HH2 ARG 10 -8.511 -16.078 9.621 105 H GLU 11 H GLU 11 -7.191 -10.207 14.113 106 HA GLU 11 HA GLU 11 -9.401 -11.121 15.536 107 1HB GLU 11 2HB GLU 11 -6.509 -10.834 16.316 108 2HB GLU 11 1HB GLU 11 -7.743 -11.580 17.332 109 1HG GLU 11 2HG GLU 11 -8.239 -13.149 15.453 110 2HG GLU 11 1HG GLU 11 -6.844 -12.491 14.611 111 H LYS 12 H LYS 12 -7.579 -8.111 15.659 112 HA LYS 12 HA LYS 12 -8.831 -6.965 17.844 113 1HB LYS 12 2HB LYS 12 -7.968 -5.630 15.264 114 2HB LYS 12 1HB LYS 12 -8.400 -4.755 16.731 115 1HG LYS 12 2HG LYS 12 -6.565 -5.736 17.931 116 2HG LYS 12 1HG LYS 12 -6.194 -6.796 16.576 117 1HD LYS 12 2HD LYS 12 -4.612 -4.991 16.622 118 2HD LYS 12 1HD LYS 12 -5.663 -4.794 15.221 119 1HE LYS 12 2HE LYS 12 -6.959 -3.165 16.392 120 2HE LYS 12 1HE LYS 12 -6.005 -3.382 17.852 121 1HZ LYS 12 1HZ LYS 12 -4.077 -2.477 16.736 122 2HZ LYS 12 2HZ LYS 12 -5.373 -1.405 16.551 123 3HZ LYS 12 3HZ LYS 12 -4.893 -2.369 15.266 124 H LYS 13 H LYS 13 -10.118 -7.561 14.742 125 HA LYS 13 HA LYS 13 -12.787 -6.603 15.615 126 1HB LYS 13 2HB LYS 13 -11.821 -7.426 12.829 127 2HB LYS 13 1HB LYS 13 -13.439 -6.843 13.202 128 1HG LYS 13 2HG LYS 13 -10.882 -5.255 13.427 129 2HG LYS 13 1HG LYS 13 -12.109 -5.084 12.169 130 1HD LYS 13 2HD LYS 13 -13.744 -4.376 13.819 131 2HD LYS 13 1HD LYS 13 -12.586 -4.646 15.118 132 1HE LYS 13 2HE LYS 13 -12.716 -2.287 14.643 133 2HE LYS 13 1HE LYS 13 -11.140 -2.895 14.153 134 1HZ LYS 13 1HZ LYS 13 -11.829 -2.828 11.845 135 2HZ LYS 13 2HZ LYS 13 -12.235 -1.337 12.568 136 3HZ LYS 13 3HZ LYS 13 -13.415 -2.489 12.297 137 H LYS 14 H LYS 14 -14.516 -9.027 14.233 138 HA LYS 14 HA LYS 14 -12.612 -10.976 14.623 139 1HB LYS 14 2HB LYS 14 -14.472 -12.386 15.600 140 2HB LYS 14 1HB LYS 14 -13.845 -11.131 16.645 141 1HG LYS 14 2HG LYS 14 -15.829 -9.765 16.182 142 2HG LYS 14 1HG LYS 14 -16.452 -11.045 15.127 143 1HD LYS 14 2HD LYS 14 -16.439 -12.612 16.996 144 2HD LYS 14 1HD LYS 14 -15.785 -11.365 18.051 145 1HE LYS 14 2HE LYS 14 -18.474 -11.280 16.685 146 2HE LYS 14 1HE LYS 14 -18.199 -11.726 18.363 147 1HZ LYS 14 1HZ LYS 14 -17.216 -9.423 18.629 148 2HZ LYS 14 2HZ LYS 14 -18.864 -9.514 18.370 149 3HZ LYS 14 3HZ LYS 14 -17.858 -9.054 17.107 150 H ILE 15 H ILE 15 -12.358 -10.613 12.491 151 HA ILE 15 HA ILE 15 -14.462 -11.804 10.818 152 HB ILE 15 HB ILE 15 -12.280 -9.862 9.962 153 1HG1 ILE 15 2HG1 ILE 15 -15.243 -9.339 10.345 154 2HG1 ILE 15 1HG1 ILE 15 -13.983 -8.808 11.445 155 1HG2 ILE 15 1HG2 ILE 15 -13.008 -11.381 8.187 156 2HG2 ILE 15 2HG2 ILE 15 -13.541 -9.733 7.860 157 3HG2 ILE 15 3HG2 ILE 15 -14.688 -10.926 8.473 158 1HD1 ILE 15 1HD1 ILE 15 -13.043 -7.400 9.679 159 2HD1 ILE 15 2HD1 ILE 15 -14.726 -6.997 10.010 160 3HD1 ILE 15 3HD1 ILE 15 -14.309 -7.943 8.580 161 H SER 16 H SER 16 -13.895 -13.653 9.780 162 HA SER 16 HA SER 16 -11.186 -14.603 10.186 163 1HB SER 16 2HB SER 16 -13.731 -16.044 9.424 164 2HB SER 16 1HB SER 16 -12.174 -16.805 9.779 165 HG SER 16 HG SER 16 -13.897 -15.380 11.491 166 H GLN 17 H GLN 17 -10.713 -16.313 8.260 167 HA GLN 17 HA GLN 17 -10.015 -14.644 6.111 168 1HB GLN 17 2HB GLN 17 -9.169 -16.695 4.981 169 2HB GLN 17 1HB GLN 17 -8.560 -16.465 6.608 170 1HG GLN 17 2HG GLN 17 -10.051 -18.162 7.449 171 2HG GLN 17 1HG GLN 17 -10.804 -18.321 5.863 172 1HE2 GLN 17 1HE2 GLN 17 -7.914 -18.892 7.714 173 2HE2 GLN 17 2HE2 GLN 17 -7.235 -20.071 6.659 174 H SER 18 H SER 18 -12.658 -17.065 6.362 175 HA SER 18 HA SER 18 -13.317 -17.197 3.722 176 1HB SER 18 2HB SER 18 -15.162 -17.361 6.088 177 2HB SER 18 1HB SER 18 -15.267 -18.228 4.551 178 HG SER 18 HG SER 18 -14.122 -19.025 6.718 179 H GLU 19 H GLU 19 -14.525 -15.029 6.277 180 HA GLU 19 HA GLU 19 -16.430 -13.756 4.666 181 1HB GLU 19 2HB GLU 19 -15.055 -12.576 7.079 182 2HB GLU 19 1HB GLU 19 -16.547 -12.006 6.352 183 1HG GLU 19 2HG GLU 19 -17.301 -13.185 8.158 184 2HG GLU 19 1HG GLU 19 -17.417 -14.380 6.869 185 H LEU 20 H LEU 20 -13.079 -12.843 5.450 186 HA LEU 20 HA LEU 20 -13.119 -10.475 3.968 187 1HB LEU 20 2HB LEU 20 -10.852 -12.284 4.742 188 2HB LEU 20 1HB LEU 20 -10.606 -10.801 3.841 189 HG LEU 20 HG LEU 20 -11.797 -10.987 6.605 190 1HD1 LEU 20 1HD1 LEU 20 -9.113 -10.015 5.648 191 2HD1 LEU 20 2HD1 LEU 20 -9.417 -11.497 6.558 192 3HD1 LEU 20 3HD1 LEU 20 -9.715 -9.926 7.302 193 1HD2 LEU 20 1HD2 LEU 20 -11.065 -8.591 4.917 194 2HD2 LEU 20 2HD2 LEU 20 -11.625 -8.545 6.589 195 3HD2 LEU 20 3HD2 LEU 20 -12.701 -9.113 5.313 196 H ALA 21 H ALA 21 -12.356 -13.778 3.045 197 HA ALA 21 HA ALA 21 -11.431 -13.272 0.469 198 1HB ALA 21 1HB ALA 21 -12.016 -15.575 -0.036 199 2HB ALA 21 2HB ALA 21 -13.022 -15.651 1.411 200 3HB ALA 21 3HB ALA 21 -11.273 -15.457 1.559 201 H ALA 22 H ALA 22 -14.771 -13.754 1.637 202 HA ALA 22 HA ALA 22 -15.992 -13.544 -0.877 203 1HB ALA 22 1HB ALA 22 -17.107 -14.483 1.091 204 2HB ALA 22 2HB ALA 22 -18.049 -13.168 0.385 205 3HB ALA 22 3HB ALA 22 -17.103 -12.891 1.850 206 H LEU 23 H LEU 23 -15.192 -11.142 1.589 207 HA LEU 23 HA LEU 23 -16.518 -8.938 0.427 208 1HB LEU 23 2HB LEU 23 -14.093 -9.017 2.225 209 2HB LEU 23 1HB LEU 23 -14.989 -7.567 1.833 210 HG LEU 23 HG LEU 23 -16.102 -9.933 3.348 211 1HD1 LEU 23 1HD1 LEU 23 -14.400 -8.765 4.635 212 2HD1 LEU 23 2HD1 LEU 23 -16.006 -8.460 5.296 213 3HD1 LEU 23 3HD1 LEU 23 -15.203 -7.226 4.323 214 1HD2 LEU 23 1HD2 LEU 23 -17.803 -8.709 2.107 215 2HD2 LEU 23 2HD2 LEU 23 -17.236 -7.195 2.810 216 3HD2 LEU 23 3HD2 LEU 23 -17.965 -8.425 3.841 217 H LEU 24 H LEU 24 -13.220 -10.209 0.060 218 HA LEU 24 HA LEU 24 -12.444 -8.040 -1.664 219 1HB LEU 24 2HB LEU 24 -10.957 -10.585 -1.161 220 2HB LEU 24 1HB LEU 24 -10.314 -9.038 -1.660 221 HG LEU 24 HG LEU 24 -11.387 -9.765 1.049 222 1HD1 LEU 24 1HD1 LEU 24 -8.600 -9.149 0.145 223 2HD1 LEU 24 2HD1 LEU 24 -9.252 -10.735 0.554 224 3HD1 LEU 24 3HD1 LEU 24 -9.122 -9.493 1.799 225 1HD2 LEU 24 1HD2 LEU 24 -10.610 -7.553 1.775 226 2HD2 LEU 24 2HD2 LEU 24 -11.909 -7.446 0.588 227 3HD2 LEU 24 3HD2 LEU 24 -10.245 -7.139 0.100 228 H GLU 25 H GLU 25 -14.245 -10.839 -2.123 229 HA GLU 25 HA GLU 25 -14.850 -12.122 -3.870 230 1HB GLU 25 2HB GLU 25 -13.627 -9.854 -5.469 231 2HB GLU 25 1HB GLU 25 -14.690 -11.094 -6.121 232 1HG GLU 25 2HG GLU 25 -16.534 -10.303 -4.876 233 2HG GLU 25 1HG GLU 25 -15.508 -9.259 -3.894 234 H VAL 26 H VAL 26 -12.435 -12.828 -2.654 235 HA VAL 26 HA VAL 26 -10.809 -13.766 -4.911 236 HB VAL 26 HB VAL 26 -8.807 -13.672 -3.485 237 1HG1 VAL 26 1HG1 VAL 26 -8.446 -11.263 -3.473 238 2HG1 VAL 26 2HG1 VAL 26 -10.175 -11.016 -3.725 239 3HG1 VAL 26 3HG1 VAL 26 -9.210 -11.823 -4.961 240 1HG2 VAL 26 1HG2 VAL 26 -8.844 -12.366 -1.362 241 2HG2 VAL 26 2HG2 VAL 26 -9.762 -13.867 -1.296 242 3HG2 VAL 26 3HG2 VAL 26 -10.611 -12.336 -1.462 243 H SER 27 H SER 27 -9.386 -15.643 -4.084 244 HA SER 27 HA SER 27 -11.099 -17.644 -2.998 245 1HB SER 27 2HB SER 27 -8.114 -17.693 -3.480 246 2HB SER 27 1HB SER 27 -9.181 -19.086 -3.314 247 HG SER 27 HG SER 27 -10.171 -17.550 -5.256 248 H ARG 28 H ARG 28 -10.858 -18.643 -0.964 249 HA ARG 28 HA ARG 28 -10.032 -17.042 1.197 250 1HB ARG 28 2HB ARG 28 -10.451 -20.052 1.220 251 2HB ARG 28 1HB ARG 28 -10.391 -19.014 2.642 252 1HG ARG 28 2HG ARG 28 -12.370 -17.781 1.694 253 2HG ARG 28 1HG ARG 28 -12.480 -19.044 0.476 254 1HD ARG 28 2HD ARG 28 -12.710 -19.399 3.463 255 2HD ARG 28 1HD ARG 28 -14.032 -19.439 2.309 256 HE ARG 28 HE ARG 28 -11.956 -21.396 1.846 257 1HH1 ARG 28 1HH1 ARG 28 -15.131 -20.773 3.317 258 2HH1 ARG 28 2HH1 ARG 28 -15.452 -22.393 3.658 259 1HH2 ARG 28 1HH2 ARG 28 -12.389 -23.568 2.240 260 2HH2 ARG 28 2HH2 ARG 28 -13.866 -24.058 3.009 261 H GLN 29 H GLN 29 -8.372 -19.366 -0.679 262 HA GLN 29 HA GLN 29 -6.011 -19.658 0.820 263 1HB GLN 29 2HB GLN 29 -6.552 -21.114 -1.061 264 2HB GLN 29 1HB GLN 29 -6.461 -19.768 -2.174 265 1HG GLN 29 2HG GLN 29 -4.064 -20.656 -0.606 266 2HG GLN 29 1HG GLN 29 -4.542 -21.475 -2.089 267 1HE2 GLN 29 1HE2 GLN 29 -2.154 -20.049 -1.519 268 2HE2 GLN 29 2HE2 GLN 29 -1.990 -18.762 -2.661 269 H THR 30 H THR 30 -7.088 -17.023 -1.254 270 HA THR 30 HA THR 30 -4.600 -15.778 -1.623 271 HB THR 30 HB THR 30 -7.339 -14.470 -1.552 272 HG1 THR 30 1HG THR 30 -7.271 -14.978 -3.871 273 1HG2 THR 30 1HG2 THR 30 -6.339 -12.906 -3.170 274 2HG2 THR 30 2HG2 THR 30 -4.801 -13.761 -3.054 275 3HG2 THR 30 3HG2 THR 30 -5.438 -12.896 -1.655 276 H ILE 31 H ILE 31 -7.207 -15.213 0.762 277 HA ILE 31 HA ILE 31 -5.693 -13.260 2.161 278 HB ILE 31 HB ILE 31 -8.094 -13.109 2.300 279 1HG1 ILE 31 2HG1 ILE 31 -8.520 -13.053 4.759 280 2HG1 ILE 31 1HG1 ILE 31 -6.989 -13.882 5.005 281 1HG2 ILE 31 1HG2 ILE 31 -8.125 -15.816 3.569 282 2HG2 ILE 31 2HG2 ILE 31 -8.703 -15.381 1.962 283 3HG2 ILE 31 3HG2 ILE 31 -9.516 -14.746 3.393 284 1HD1 ILE 31 1HD1 ILE 31 -6.777 -11.495 5.395 285 2HD1 ILE 31 2HD1 ILE 31 -7.352 -11.166 3.760 286 3HD1 ILE 31 3HD1 ILE 31 -5.812 -11.990 4.003 287 H ASN 32 H ASN 32 -6.028 -16.721 2.451 288 HA ASN 32 HA ASN 32 -4.703 -17.215 4.884 289 1HB ASN 32 2HB ASN 32 -5.807 -19.010 3.663 290 2HB ASN 32 1HB ASN 32 -4.781 -18.750 2.263 291 1HD2 ASN 32 1HD2 ASN 32 -2.635 -19.618 2.275 292 2HD2 ASN 32 2HD2 ASN 32 -2.157 -20.751 3.458 293 H GLY 33 H GLY 33 -3.557 -16.816 1.605 294 1HA GLY 33 2HA GLY 33 -0.818 -17.134 2.080 295 2HA GLY 33 1HA GLY 33 -1.541 -16.328 0.693 296 H ILE 34 H ILE 34 -2.897 -14.275 2.259 297 HA ILE 34 HA ILE 34 -0.741 -12.478 2.553 298 HB ILE 34 HB ILE 34 -3.640 -12.118 3.379 299 1HG1 ILE 34 2HG1 ILE 34 -3.447 -12.556 0.984 300 2HG1 ILE 34 1HG1 ILE 34 -3.877 -10.875 1.258 301 1HG2 ILE 34 1HG2 ILE 34 -2.189 -10.528 4.522 302 2HG2 ILE 34 2HG2 ILE 34 -3.175 -9.708 3.311 303 3HG2 ILE 34 3HG2 ILE 34 -1.475 -10.050 2.979 304 1HD1 ILE 34 1HD1 ILE 34 -1.553 -10.223 0.834 305 2HD1 ILE 34 2HD1 ILE 34 -2.249 -11.092 -0.534 306 3HD1 ILE 34 3HD1 ILE 34 -1.134 -11.913 0.558 307 H GLU 35 H GLU 35 -2.791 -14.200 4.902 308 HA GLU 35 HA GLU 35 -1.881 -13.083 7.255 309 1HB GLU 35 2HB GLU 35 -2.569 -15.969 6.743 310 2HB GLU 35 1HB GLU 35 -2.291 -15.300 8.339 311 1HG GLU 35 2HG GLU 35 -4.179 -13.771 7.979 312 2HG GLU 35 1HG GLU 35 -4.475 -14.554 6.422 313 H LYS 36 H LYS 36 -0.312 -15.531 5.319 314 HA LYS 36 HA LYS 36 1.901 -15.538 7.244 315 1HB LYS 36 2HB LYS 36 1.354 -17.422 4.935 316 2HB LYS 36 1HB LYS 36 2.701 -17.550 6.055 317 1HG LYS 36 2HG LYS 36 -0.221 -17.785 6.776 318 2HG LYS 36 1HG LYS 36 0.923 -19.121 6.623 319 1HD LYS 36 2HD LYS 36 1.207 -16.839 8.586 320 2HD LYS 36 1HD LYS 36 0.505 -18.407 8.982 321 1HE LYS 36 2HE LYS 36 2.596 -19.514 8.509 322 2HE LYS 36 1HE LYS 36 3.304 -18.007 7.927 323 1HZ LYS 36 1HZ LYS 36 2.354 -18.408 10.715 324 2HZ LYS 36 2HZ LYS 36 3.230 -17.102 10.099 325 3HZ LYS 36 3HZ LYS 36 3.959 -18.624 10.218 326 H ASN 37 H ASN 37 1.030 -13.689 4.860 327 HA ASN 37 HA ASN 37 1.857 -12.587 3.073 328 1HB ASN 37 2HB ASN 37 3.853 -11.219 3.515 329 2HB ASN 37 1HB ASN 37 2.855 -11.301 4.947 330 1HD2 ASN 37 1HD2 ASN 37 5.913 -11.954 3.554 331 2HD2 ASN 37 2HD2 ASN 37 6.671 -12.557 4.994 332 H LYS 38 H LYS 38 1.914 -15.086 2.491 333 HA LYS 38 HA LYS 38 4.575 -15.838 1.532 334 1HB LYS 38 2HB LYS 38 3.421 -17.402 3.062 335 2HB LYS 38 1HB LYS 38 2.045 -17.446 1.978 336 1HG LYS 38 2HG LYS 38 3.384 -18.545 0.284 337 2HG LYS 38 1HG LYS 38 4.813 -18.421 1.310 338 1HD LYS 38 2HD LYS 38 3.877 -20.657 1.457 339 2HD LYS 38 1HD LYS 38 3.706 -19.824 2.998 340 1HE LYS 38 2HE LYS 38 1.364 -19.322 2.459 341 2HE LYS 38 1HE LYS 38 1.541 -20.160 0.918 342 1HZ LYS 38 1HZ LYS 38 2.020 -22.201 2.141 343 2HZ LYS 38 2HZ LYS 38 0.515 -21.572 2.651 344 3HZ LYS 38 3HZ LYS 38 1.876 -21.377 3.596 345 H TYR 39 H TYR 39 1.421 -14.765 0.690 346 HA TYR 39 HA TYR 39 1.551 -15.643 -2.064 347 1HB TYR 39 2HB TYR 39 -0.499 -15.606 -0.557 348 2HB TYR 39 1HB TYR 39 -0.450 -13.856 -0.676 349 HD1 TYR 39 1HD TYR 39 -0.855 -16.958 -2.540 350 HD2 TYR 39 2HD TYR 39 -1.394 -12.759 -2.584 351 HE1 TYR 39 1HE TYR 39 -2.251 -17.170 -4.572 352 HE2 TYR 39 2HE TYR 39 -2.782 -12.936 -4.610 353 HH TYR 39 HH TYR 39 -3.982 -15.934 -5.659 354 H ASN 40 H ASN 40 2.888 -13.273 -0.253 355 HA ASN 40 HA ASN 40 3.757 -11.213 -0.493 356 1HB ASN 40 2HB ASN 40 4.727 -11.952 -2.640 357 2HB ASN 40 1HB ASN 40 3.216 -11.582 -3.464 358 1HD2 ASN 40 1HD2 ASN 40 2.689 -9.403 -3.862 359 2HD2 ASN 40 2HD2 ASN 40 3.848 -8.136 -3.718 360 HA PRO 41 HA PRO 41 -0.178 -9.172 -0.197 361 1HB PRO 41 2HB PRO 41 1.237 -7.192 1.421 362 2HB PRO 41 1HB PRO 41 -0.050 -8.304 1.899 363 1HG PRO 41 2HG PRO 41 2.511 -8.573 2.756 364 2HG PRO 41 1HG PRO 41 1.422 -9.951 2.524 365 1HD PRO 41 2HD PRO 41 3.596 -8.931 0.734 366 2HD PRO 41 1HD PRO 41 3.171 -10.604 1.148 367 H SER 42 H SER 42 -0.069 -8.574 -2.406 368 HA SER 42 HA SER 42 1.247 -6.328 -3.440 369 1HB SER 42 2HB SER 42 -1.478 -7.371 -4.209 370 2HB SER 42 1HB SER 42 -0.285 -6.592 -5.248 371 HG SER 42 HG SER 42 -0.134 -8.699 -5.645 372 H LEU 43 H LEU 43 0.210 -4.134 -3.817 373 HA LEU 43 HA LEU 43 -0.864 -3.315 -1.341 374 1HB LEU 43 2HB LEU 43 0.665 -1.878 -2.665 375 2HB LEU 43 1HB LEU 43 -0.584 -1.673 -3.868 376 HG LEU 43 HG LEU 43 -0.183 0.271 -2.239 377 1HD1 LEU 43 1HD1 LEU 43 -2.549 0.860 -2.041 378 2HD1 LEU 43 2HD1 LEU 43 -2.989 -0.792 -2.481 379 3HD1 LEU 43 3HD1 LEU 43 -2.150 0.234 -3.643 380 1HD2 LEU 43 1HD2 LEU 43 -1.668 -1.565 -0.338 381 2HD2 LEU 43 2HD2 LEU 43 -1.337 0.138 -0.050 382 3HD2 LEU 43 3HD2 LEU 43 -0.009 -1.007 -0.151 383 H GLN 44 H GLN 44 -2.433 -3.639 -4.625 384 HA GLN 44 HA GLN 44 -4.829 -2.607 -3.854 385 1HB GLN 44 2HB GLN 44 -4.250 -2.979 -6.157 386 2HB GLN 44 1HB GLN 44 -4.026 -4.690 -5.888 387 1HG GLN 44 2HG GLN 44 -6.747 -3.586 -5.438 388 2HG GLN 44 1HG GLN 44 -6.163 -3.662 -7.100 389 1HE2 GLN 44 1HE2 GLN 44 -5.734 -5.677 -8.015 390 2HE2 GLN 44 2HE2 GLN 44 -6.352 -7.147 -7.330 391 H LEU 45 H LEU 45 -3.741 -5.956 -3.667 392 HA LEU 45 HA LEU 45 -6.071 -6.990 -2.489 393 1HB LEU 45 2HB LEU 45 -3.224 -7.986 -2.370 394 2HB LEU 45 1HB LEU 45 -4.541 -8.836 -1.604 395 HG LEU 45 HG LEU 45 -4.053 -9.933 -3.637 396 1HD1 LEU 45 1HD1 LEU 45 -6.153 -9.788 -4.868 397 2HD1 LEU 45 2HD1 LEU 45 -6.550 -8.315 -3.983 398 3HD1 LEU 45 3HD1 LEU 45 -6.379 -9.842 -3.119 399 1HD2 LEU 45 1HD2 LEU 45 -2.866 -8.172 -4.827 400 2HD2 LEU 45 2HD2 LEU 45 -4.373 -7.286 -5.057 401 3HD2 LEU 45 3HD2 LEU 45 -4.139 -8.847 -5.846 402 H ALA 46 H ALA 46 -3.138 -5.784 -1.033 403 HA ALA 46 HA ALA 46 -3.800 -6.418 1.660 404 1HB ALA 46 1HB ALA 46 -1.494 -5.981 0.961 405 2HB ALA 46 2HB ALA 46 -1.968 -4.945 2.310 406 3HB ALA 46 3HB ALA 46 -1.902 -4.290 0.674 407 H LEU 47 H LEU 47 -4.327 -3.543 -0.321 408 HA LEU 47 HA LEU 47 -5.170 -1.902 1.788 409 1HB LEU 47 2HB LEU 47 -4.257 -1.034 -0.313 410 2HB LEU 47 1HB LEU 47 -5.613 -1.690 -1.191 411 HG LEU 47 HG LEU 47 -5.569 0.833 -0.743 412 1HD1 LEU 47 1HD1 LEU 47 -7.986 0.977 -0.418 413 2HD1 LEU 47 2HD1 LEU 47 -8.026 -0.716 0.073 414 3HD1 LEU 47 3HD1 LEU 47 -7.567 -0.288 -1.574 415 1HD2 LEU 47 1HD2 LEU 47 -6.398 -0.129 1.987 416 2HD2 LEU 47 2HD2 LEU 47 -6.455 1.543 1.422 417 3HD2 LEU 47 3HD2 LEU 47 -4.904 0.721 1.592 418 H LYS 48 H LYS 48 -6.920 -3.974 -0.486 419 HA LYS 48 HA LYS 48 -9.376 -2.990 0.514 420 1HB LYS 48 2HB LYS 48 -10.490 -4.923 -0.635 421 2HB LYS 48 1HB LYS 48 -9.521 -3.896 -1.671 422 1HG LYS 48 2HG LYS 48 -7.752 -5.546 -1.677 423 2HG LYS 48 1HG LYS 48 -8.681 -6.577 -0.589 424 1HD LYS 48 2HD LYS 48 -8.913 -7.322 -2.894 425 2HD LYS 48 1HD LYS 48 -10.454 -6.733 -2.273 426 1HE LYS 48 2HE LYS 48 -10.107 -4.598 -3.417 427 2HE LYS 48 1HE LYS 48 -8.543 -5.161 -4.004 428 1HZ LYS 48 1HZ LYS 48 -10.104 -5.457 -5.744 429 2HZ LYS 48 2HZ LYS 48 -11.220 -6.222 -4.745 430 3HZ LYS 48 3HZ LYS 48 -9.768 -6.988 -5.117 431 H ILE 49 H ILE 49 -7.378 -5.663 1.426 432 HA ILE 49 HA ILE 49 -9.065 -6.793 3.389 433 HB ILE 49 HB ILE 49 -6.046 -6.458 3.629 434 1HG1 ILE 49 2HG1 ILE 49 -7.585 -8.768 2.448 435 2HG1 ILE 49 1HG1 ILE 49 -6.765 -7.535 1.496 436 1HG2 ILE 49 1HG2 ILE 49 -7.933 -8.472 4.859 437 2HG2 ILE 49 2HG2 ILE 49 -7.150 -7.136 5.701 438 3HG2 ILE 49 3HG2 ILE 49 -6.180 -8.454 5.046 439 1HD1 ILE 49 1HD1 ILE 49 -5.447 -9.555 1.637 440 2HD1 ILE 49 2HD1 ILE 49 -5.480 -9.476 3.398 441 3HD1 ILE 49 3HD1 ILE 49 -4.633 -8.234 2.477 442 H ALA 50 H ALA 50 -6.827 -4.120 3.469 443 HA ALA 50 HA ALA 50 -6.925 -3.406 6.198 444 1HB ALA 50 1HB ALA 50 -5.221 -2.586 4.629 445 2HB ALA 50 2HB ALA 50 -6.059 -1.261 5.464 446 3HB ALA 50 3HB ALA 50 -6.491 -1.670 3.804 447 H TYR 51 H TYR 51 -8.716 -2.316 3.410 448 HA TYR 51 HA TYR 51 -10.176 -0.349 4.779 449 1HB TYR 51 2HB TYR 51 -9.736 -0.191 2.406 450 2HB TYR 51 1HB TYR 51 -10.656 -1.661 2.107 451 HD1 TYR 51 1HD TYR 51 -12.958 -1.647 2.096 452 HD2 TYR 51 2HD TYR 51 -10.872 1.892 3.014 453 HE1 TYR 51 1HE TYR 51 -15.070 -0.347 1.813 454 HE2 TYR 51 2HE TYR 51 -12.924 3.215 2.750 455 HH TYR 51 HH TYR 51 -15.964 1.858 2.656 456 H TYR 52 H TYR 52 -11.022 -3.685 3.777 457 HA TYR 52 HA TYR 52 -13.625 -3.411 4.865 458 1HB TYR 52 2HB TYR 52 -12.169 -5.846 3.832 459 2HB TYR 52 1HB TYR 52 -13.793 -5.943 4.512 460 HD1 TYR 52 1HD TYR 52 -15.662 -4.662 3.392 461 HD2 TYR 52 2HD TYR 52 -11.838 -5.068 1.599 462 HE1 TYR 52 1HE TYR 52 -16.615 -4.012 1.217 463 HE2 TYR 52 2HE TYR 52 -12.772 -4.423 -0.572 464 HH TYR 52 HH TYR 52 -15.873 -3.051 -0.907 465 H LEU 53 H LEU 53 -10.705 -4.464 6.159 466 HA LEU 53 HA LEU 53 -11.868 -5.325 8.716 467 1HB LEU 53 2HB LEU 53 -9.007 -4.714 7.975 468 2HB LEU 53 1HB LEU 53 -9.492 -5.225 9.574 469 1HD1 LEU 53 1HD1 LEU 53 -7.991 -8.208 7.978 470 2HD1 LEU 53 2HD1 LEU 53 -7.819 -7.066 9.311 471 3HD1 LEU 53 3HD1 LEU 53 -7.475 -6.552 7.659 472 1HD2 LEU 53 1HD2 LEU 53 -11.482 -7.364 8.795 473 2HD2 LEU 53 2HD2 LEU 53 -10.191 -7.550 9.984 474 3HD2 LEU 53 3HD2 LEU 53 -10.317 -8.678 8.634 475 H ASN 54 H ASN 54 -11.346 -2.506 7.218 476 HA ASN 54 HA ASN 54 -11.044 -0.329 7.639 477 1HB ASN 54 2HB ASN 54 -13.375 -0.860 8.540 478 2HB ASN 54 1HB ASN 54 -12.660 -0.839 10.143 479 1HD2 ASN 54 1HD2 ASN 54 -14.735 0.854 9.070 480 2HD2 ASN 54 2HD2 ASN 54 -14.159 2.478 9.136 481 H THR 55 H THR 55 -8.772 -0.750 7.974 482 HA THR 55 HA THR 55 -7.869 0.437 10.440 483 HB THR 55 HB THR 55 -7.044 -2.353 9.556 484 HG1 THR 55 1HG THR 55 -8.947 -1.780 10.980 485 1HG2 THR 55 1HG2 THR 55 -5.469 -2.339 11.437 486 2HG2 THR 55 2HG2 THR 55 -5.882 -0.658 11.773 487 3HG2 THR 55 3HG2 THR 55 -5.068 -1.084 10.266 488 HA PRO 56 HA PRO 56 -5.127 2.193 7.360 489 1HB PRO 56 2HB PRO 56 -3.132 3.055 9.050 490 2HB PRO 56 1HB PRO 56 -4.632 3.941 8.759 491 1HG PRO 56 2HG PRO 56 -3.897 2.162 11.036 492 2HG PRO 56 1HG PRO 56 -4.801 3.687 11.048 493 1HD PRO 56 2HD PRO 56 -5.978 1.273 11.232 494 2HD PRO 56 1HD PRO 56 -6.782 2.657 10.447 495 H LEU 57 H LEU 57 -3.319 1.649 6.340 496 HA LEU 57 HA LEU 57 -2.418 -0.950 6.301 497 1HB LEU 57 2HB LEU 57 -0.985 1.493 5.266 498 2HB LEU 57 1HB LEU 57 -0.457 -0.140 4.954 499 1HD1 LEU 57 1HD2 LEU 57 -3.357 -1.167 4.574 500 2HD1 LEU 57 2HD2 LEU 57 -1.976 -1.649 3.588 501 3HD1 LEU 57 3HD2 LEU 57 -3.423 -0.967 2.817 502 1HD2 LEU 57 1HD1 LEU 57 -2.862 2.477 3.968 503 2HD2 LEU 57 2HD1 LEU 57 -3.945 1.323 4.748 504 3HD2 LEU 57 3HD1 LEU 57 -3.893 1.433 2.988 505 H GLU 58 H GLU 58 -0.928 1.786 7.899 506 HA GLU 58 HA GLU 58 1.498 0.661 8.615 507 1HB GLU 58 2HB GLU 58 0.041 2.527 10.464 508 2HB GLU 58 1HB GLU 58 1.765 2.360 10.227 509 1HG GLU 58 2HG GLU 58 1.341 4.346 9.163 510 2HG GLU 58 1HG GLU 58 1.214 3.205 7.821 511 H ASP 59 H ASP 59 -1.651 0.297 10.227 512 HA ASP 59 HA ASP 59 -0.488 -0.853 12.559 513 1HB ASP 59 2HB ASP 59 -2.678 0.325 12.639 514 2HB ASP 59 1HB ASP 59 -3.379 -0.944 11.641 515 H ILE 60 H ILE 60 -1.838 -1.975 9.617 516 HA ILE 60 HA ILE 60 -2.020 -4.760 10.363 517 HB ILE 60 HB ILE 60 -2.218 -3.547 7.593 518 1HG1 ILE 60 2HG1 ILE 60 -4.347 -4.278 9.612 519 2HG1 ILE 60 1HG1 ILE 60 -3.903 -2.655 9.113 520 1HG2 ILE 60 1HG2 ILE 60 -3.065 -6.256 8.643 521 2HG2 ILE 60 2HG2 ILE 60 -1.699 -5.949 7.572 522 3HG2 ILE 60 3HG2 ILE 60 -3.343 -5.653 7.007 523 1HD1 ILE 60 1HD1 ILE 60 -4.699 -3.140 6.862 524 2HD1 ILE 60 2HD1 ILE 60 -5.960 -3.367 8.075 525 3HD1 ILE 60 3HD1 ILE 60 -5.146 -4.767 7.378 526 H PHE 61 H PHE 61 0.084 -2.950 8.225 527 HA PHE 61 HA PHE 61 1.977 -5.170 8.561 528 1HB PHE 61 2HB PHE 61 1.636 -3.407 6.103 529 2HB PHE 61 1HB PHE 61 2.972 -4.530 6.349 530 HD1 PHE 61 1HD PHE 61 2.329 -6.991 6.781 531 HD2 PHE 61 2HD PHE 61 -0.307 -4.110 5.088 532 HE1 PHE 61 1HE PHE 61 0.971 -8.803 5.824 533 HE2 PHE 61 2HE PHE 61 -1.671 -5.921 4.131 534 HZ PHE 61 HZ PHE 61 -1.034 -8.269 4.499 535 H GLN 62 H GLN 62 4.008 -4.763 9.107 536 HA GLN 62 HA GLN 62 4.623 -1.966 9.662 537 1HB GLN 62 2HB GLN 62 4.447 -3.690 11.605 538 2HB GLN 62 1HB GLN 62 5.935 -4.365 10.966 539 1HG GLN 62 2HG GLN 62 5.655 -1.494 11.828 540 2HG GLN 62 1HG GLN 62 6.176 -2.782 12.902 541 1HE2 GLN 62 1HE2 GLN 62 7.506 -0.357 11.977 542 2HE2 GLN 62 2HE2 GLN 62 8.994 -0.873 11.267 543 H TRP 63 H TRP 63 6.217 -1.170 8.527 544 HA TRP 63 HA TRP 63 7.746 -3.070 6.939 545 1HB TRP 63 2HB TRP 63 7.858 -1.220 5.211 546 2HB TRP 63 1HB TRP 63 6.327 -2.055 5.410 547 HD1 TRP 63 HD TRP 63 7.982 1.346 6.302 548 HE1 TRP 63 1HE TRP 63 6.089 3.111 6.510 549 HE3 TRP 63 3HE TRP 63 3.925 -1.721 5.768 550 HZ2 TRP 63 2HZ TRP 63 3.289 3.173 6.460 551 HZ3 TRP 63 3HZ TRP 63 1.681 -0.726 5.852 552 HH2 TRP 63 HH TRP 63 1.372 1.666 6.189 553 H GLN 64 H GLN 64 9.846 -3.011 6.959 554 HA GLN 64 HA GLN 64 11.159 -0.571 7.859 555 1HB GLN 64 2HB GLN 64 11.923 -3.442 8.455 556 2HB GLN 64 1HB GLN 64 12.930 -2.049 8.819 557 1HG GLN 64 2HG GLN 64 10.163 -2.415 9.908 558 2HG GLN 64 1HG GLN 64 11.601 -3.002 10.734 559 1HE2 GLN 64 1HE2 GLN 64 11.104 -1.638 12.481 560 2HE2 GLN 64 2HE2 GLN 64 11.457 0.061 12.403 561 HA PRO 65 HA PRO 65 12.707 -1.822 3.706 562 1HB PRO 65 2HB PRO 65 12.273 0.864 2.767 563 2HB PRO 65 1HB PRO 65 11.428 -0.602 2.274 564 1HG PRO 65 2HG PRO 65 10.281 1.481 3.695 565 2HG PRO 65 1HG PRO 65 9.649 -0.173 3.636 566 1HD PRO 65 2HD PRO 65 11.256 1.180 5.752 567 2HD PRO 65 1HD PRO 65 9.960 -0.026 5.913 568 H GLU 66 H GLU 66 13.112 1.005 5.579 569 HA GLU 66 HA GLU 66 15.930 1.275 4.768 570 1HB GLU 66 2HB GLU 66 14.068 3.280 6.045 571 2HB GLU 66 1HB GLU 66 15.760 3.579 5.677 572 1HG GLU 66 2HG GLU 66 13.662 2.903 3.625 573 2HG GLU 66 1HG GLU 66 14.170 4.541 4.033 574 1H MET 67 1HT MET 67 -13.106 1.528 -7.965 575 2H MET 67 2HT MET 67 -12.695 2.235 -6.480 576 3H MET 67 3HT MET 67 -11.661 1.115 -7.211 577 HA MET 67 HA MET 67 -11.224 2.502 -9.034 578 1HB MET 67 2HB MET 67 -13.355 3.706 -9.134 579 2HB MET 67 1HB MET 67 -13.001 4.499 -7.606 580 1HG MET 67 2HG MET 67 -12.643 5.967 -9.531 581 2HG MET 67 1HG MET 67 -11.164 5.705 -8.609 582 1HE MET 67 1HE MET 67 -9.678 6.628 -10.596 583 2HE MET 67 2HE MET 67 -11.149 6.948 -11.514 584 3HE MET 67 3HE MET 67 -9.818 6.068 -12.264 585 H ILE 68 H ILE 68 -9.289 3.481 -8.951 586 HA ILE 68 HA ILE 68 -8.321 4.327 -6.313 587 HB ILE 68 HB ILE 68 -6.764 3.055 -8.595 588 1HG1 ILE 68 2HG1 ILE 68 -8.096 1.396 -7.375 589 2HG1 ILE 68 1HG1 ILE 68 -6.381 1.161 -7.075 590 1HG2 ILE 68 1HG2 ILE 68 -5.752 3.969 -5.906 591 2HG2 ILE 68 2HG2 ILE 68 -5.389 4.702 -7.468 592 3HG2 ILE 68 3HG2 ILE 68 -4.814 3.075 -7.104 593 1HD1 ILE 68 1HD1 ILE 68 -6.624 2.251 -4.895 594 2HD1 ILE 68 2HD1 ILE 68 -7.689 0.853 -5.048 595 3HD1 ILE 68 3HD1 ILE 68 -8.344 2.481 -5.206 596 H ILE 69 H ILE 69 -7.474 6.344 -6.235 597 HA ILE 69 HA ILE 69 -7.112 7.799 -8.754 598 HB ILE 69 HB ILE 69 -7.986 8.929 -6.047 599 1HG1 ILE 69 2HG1 ILE 69 -10.029 9.760 -7.388 600 2HG1 ILE 69 1HG1 ILE 69 -9.554 8.595 -8.612 601 1HG2 ILE 69 1HG2 ILE 69 -6.524 10.479 -7.152 602 2HG2 ILE 69 2HG2 ILE 69 -8.175 11.103 -7.169 603 3HG2 ILE 69 3HG2 ILE 69 -7.488 10.386 -8.628 604 1HD1 ILE 69 1HD1 ILE 69 -11.329 7.731 -7.200 605 2HD1 ILE 69 2HD1 ILE 69 -10.327 7.968 -5.768 606 3HD1 ILE 69 3HD1 ILE 69 -9.854 6.787 -6.989 607 H ASN 70 H ASN 70 -4.968 8.646 -8.938 608 HA ASN 70 HA ASN 70 -3.300 8.052 -6.631 609 1HB ASN 70 2HB ASN 70 -2.770 6.812 -8.679 610 2HB ASN 70 1HB ASN 70 -2.677 8.318 -9.580 611 1HD2 ASN 70 1HD2 ASN 70 -0.610 7.870 -10.189 612 2HD2 ASN 70 2HD2 ASN 70 0.742 7.978 -9.126 613 H ASN 71 H ASN 71 -2.257 9.706 -5.643 614 HA ASN 71 HA ASN 71 -2.414 12.331 -6.940 615 1HB ASN 71 2HB ASN 71 -2.746 11.757 -3.973 616 2HB ASN 71 1HB ASN 71 -2.722 13.351 -4.709 617 1HD2 ASN 71 1HD2 ASN 71 -4.579 10.577 -3.992 618 2HD2 ASN 71 2HD2 ASN 71 -6.093 11.160 -4.584 619 H LEU 72 H LEU 72 -0.336 10.197 -6.806 620 HA LEU 72 HA LEU 72 1.735 10.695 -5.053 621 1HB LEU 72 2HB LEU 72 1.453 8.848 -6.810 622 2HB LEU 72 1HB LEU 72 2.022 9.993 -7.991 623 HG LEU 72 HG LEU 72 3.734 8.353 -7.315 624 1HD1 LEU 72 1HD1 LEU 72 5.597 9.861 -6.875 625 2HD1 LEU 72 2HD1 LEU 72 4.456 11.158 -6.516 626 3HD1 LEU 72 3HD1 LEU 72 4.531 10.473 -8.139 627 1HD2 LEU 72 1HD2 LEU 72 4.745 8.463 -5.093 628 2HD2 LEU 72 2HD2 LEU 72 3.047 7.990 -5.033 629 3HD2 LEU 72 3HD2 LEU 72 3.521 9.633 -4.606 630 H LYS 73 H LYS 73 1.021 12.154 -8.176 631 HA LYS 73 HA LYS 73 3.220 13.899 -8.260 632 1HB LYS 73 2HB LYS 73 1.951 15.124 -10.021 633 2HB LYS 73 1HB LYS 73 2.017 13.388 -10.289 634 1HG LYS 73 2HG LYS 73 -0.274 13.258 -9.257 635 2HG LYS 73 1HG LYS 73 -0.309 15.019 -9.310 636 1HD LYS 73 2HD LYS 73 0.063 13.209 -11.696 637 2HD LYS 73 1HD LYS 73 -1.456 13.965 -11.223 638 1HE LYS 73 2HE LYS 73 1.071 15.409 -12.015 639 2HE LYS 73 1HE LYS 73 -0.347 15.179 -13.035 640 1HZ LYS 73 1HZ LYS 73 -0.528 17.328 -12.126 641 2HZ LYS 73 2HZ LYS 73 -0.094 16.822 -10.594 642 3HZ LYS 73 3HZ LYS 73 -1.600 16.407 -11.198 643 H LEU 74 H LEU 74 -0.059 14.410 -6.969 644 HA LEU 74 HA LEU 74 0.147 17.087 -6.278 645 1HB LEU 74 2HB LEU 74 -1.923 15.699 -6.387 646 2HB LEU 74 1HB LEU 74 -1.418 14.850 -4.955 647 HG LEU 74 HG LEU 74 -3.255 16.487 -4.604 648 1HD1 LEU 74 1HD1 LEU 74 -0.751 17.110 -3.068 649 2HD1 LEU 74 2HD1 LEU 74 -1.931 15.851 -2.699 650 3HD1 LEU 74 3HD1 LEU 74 -2.391 17.550 -2.590 651 1HD2 LEU 74 1HD2 LEU 74 -2.586 18.179 -6.185 652 2HD2 LEU 74 2HD2 LEU 74 -1.142 18.528 -5.236 653 3HD2 LEU 74 3HD2 LEU 74 -2.739 18.879 -4.574 654 H ILE 75 H ILE 75 0.945 14.186 -4.412 655 HA ILE 75 HA ILE 75 1.678 15.546 -2.084 656 HB ILE 75 HB ILE 75 2.254 12.745 -3.013 657 1HG1 ILE 75 2HG1 ILE 75 1.082 12.147 -0.933 658 2HG1 ILE 75 1HG1 ILE 75 0.996 13.837 -0.482 659 1HG2 ILE 75 1HG2 ILE 75 3.550 13.984 -0.575 660 2HG2 ILE 75 2HG2 ILE 75 4.377 13.408 -1.998 661 3HG2 ILE 75 3HG2 ILE 75 3.538 12.255 -0.946 662 1HD1 ILE 75 1HD1 ILE 75 -1.129 13.022 -1.305 663 2HD1 ILE 75 2HD1 ILE 75 -0.376 12.550 -2.828 664 3HD1 ILE 75 3HD1 ILE 75 -0.477 14.254 -2.386 665 H ARG 76 H ARG 76 3.530 14.847 -4.894 666 HA ARG 76 HA ARG 76 6.116 15.539 -3.949 667 1HB ARG 76 2HB ARG 76 5.098 16.346 -6.648 668 2HB ARG 76 1HB ARG 76 6.746 16.018 -6.168 669 1HG ARG 76 2HG ARG 76 6.287 13.661 -6.099 670 2HG ARG 76 1HG ARG 76 4.569 13.963 -6.435 671 1HD ARG 76 2HD ARG 76 6.936 14.420 -8.221 672 2HD ARG 76 1HD ARG 76 5.469 13.489 -8.549 673 HE ARG 76 HE ARG 76 4.654 16.086 -8.039 674 1HH1 ARG 76 1HH1 ARG 76 6.366 14.396 -10.625 675 2HH1 ARG 76 2HH1 ARG 76 6.224 15.718 -11.699 676 1HH2 ARG 76 1HH2 ARG 76 4.586 17.863 -9.475 677 2HH2 ARG 76 2HH2 ARG 76 5.202 17.688 -11.077 678 H GLU 77 H GLU 77 3.309 17.519 -5.123 679 HA GLU 77 HA GLU 77 4.660 19.947 -5.230 680 1HB GLU 77 2HB GLU 77 1.701 19.450 -4.961 681 2HB GLU 77 1HB GLU 77 2.486 20.870 -5.630 682 1HG GLU 77 2HG GLU 77 2.400 18.110 -6.811 683 2HG GLU 77 1HG GLU 77 1.585 19.551 -7.405 684 H LYS 78 H LYS 78 2.722 18.350 -2.782 685 HA LYS 78 HA LYS 78 2.670 20.292 -0.814 686 1HB LYS 78 2HB LYS 78 3.079 17.319 -0.473 687 2HB LYS 78 1HB LYS 78 2.727 18.412 0.856 688 1HG LYS 78 2HG LYS 78 0.590 18.979 -0.135 689 2HG LYS 78 1HG LYS 78 0.949 17.969 -1.533 690 1HD LYS 78 2HD LYS 78 -0.567 16.898 0.130 691 2HD LYS 78 1HD LYS 78 0.906 15.982 -0.186 692 1HE LYS 78 2HE LYS 78 1.886 16.734 1.870 693 2HE LYS 78 1HE LYS 78 0.565 17.869 2.140 694 1HZ LYS 78 1HZ LYS 78 0.518 15.674 3.411 695 2HZ LYS 78 2HZ LYS 78 -0.058 14.979 1.932 696 3HZ LYS 78 3HZ LYS 78 -0.874 16.215 2.643 697 H LYS 79 H LYS 79 5.366 18.367 -1.817 698 HA LYS 79 HA LYS 79 7.086 19.856 0.011 699 1HB LYS 79 2HB LYS 79 7.624 17.329 -1.604 700 2HB LYS 79 1HB LYS 79 8.824 18.132 -0.601 701 1HG LYS 79 2HG LYS 79 6.266 16.875 0.381 702 2HG LYS 79 1HG LYS 79 7.884 16.186 0.526 703 1HD LYS 79 2HD LYS 79 8.576 18.090 1.898 704 2HD LYS 79 1HD LYS 79 6.971 18.798 1.731 705 1HE LYS 79 2HE LYS 79 7.579 16.144 3.029 706 2HE LYS 79 1HE LYS 79 7.309 17.653 3.894 707 1HZ LYS 79 1HZ LYS 79 5.312 16.243 2.182 708 2HZ LYS 79 2HZ LYS 79 5.044 17.707 2.974 709 3HZ LYS 79 3HZ LYS 79 5.339 16.312 3.866 710 H LYS 80 H LYS 80 9.578 20.058 -1.930 711 HA LYS 80 HA LYS 80 8.180 20.282 -4.341 712 1HB LYS 80 2HB LYS 80 9.781 22.127 -4.966 713 2HB LYS 80 1HB LYS 80 8.563 22.574 -3.791 714 1HG LYS 80 2HG LYS 80 10.195 22.506 -2.020 715 2HG LYS 80 1HG LYS 80 11.422 21.898 -3.143 716 1HD LYS 80 2HD LYS 80 11.354 23.927 -4.411 717 2HD LYS 80 1HD LYS 80 9.974 24.514 -3.484 718 1HE LYS 80 2HE LYS 80 12.744 24.014 -2.410 719 2HE LYS 80 1HE LYS 80 12.061 25.593 -2.799 720 1HZ LYS 80 1HZ LYS 80 11.166 23.719 -0.689 721 2HZ LYS 80 2HZ LYS 80 10.276 25.059 -1.174 722 3HZ LYS 80 3HZ LYS 80 11.813 25.277 -0.479 723 H ILE 81 H ILE 81 8.663 18.251 -4.592 724 HA ILE 81 HA ILE 81 11.489 17.683 -5.150 725 HB ILE 81 HB ILE 81 9.306 15.732 -4.325 726 1HG1 ILE 81 2HG1 ILE 81 9.974 17.139 -2.422 727 2HG1 ILE 81 1HG1 ILE 81 10.504 15.480 -2.195 728 1HG2 ILE 81 1HG2 ILE 81 10.948 14.704 -5.785 729 2HG2 ILE 81 2HG2 ILE 81 11.088 14.073 -4.145 730 3HG2 ILE 81 3HG2 ILE 81 12.253 15.261 -4.736 731 1HD1 ILE 81 1HD1 ILE 81 12.776 16.128 -2.846 732 2HD1 ILE 81 2HD1 ILE 81 12.197 17.060 -1.465 733 3HD1 ILE 81 3HD1 ILE 81 12.230 17.792 -3.070 734 H SER 82 H SER 82 11.907 17.117 -7.210 735 HA SER 82 HA SER 82 9.649 16.647 -8.964 736 1HB SER 82 2HB SER 82 12.483 17.570 -9.509 737 2HB SER 82 1HB SER 82 11.312 17.193 -10.776 738 HG SER 82 HG SER 82 9.921 18.723 -9.801 739 H GLN 83 H GLN 83 10.774 15.253 -10.950 740 HA GLN 83 HA GLN 83 10.610 12.677 -9.830 741 1HB GLN 83 2HB GLN 83 10.965 11.827 -12.113 742 2HB GLN 83 1HB GLN 83 9.717 13.059 -12.018 743 1HG GLN 83 2HG GLN 83 11.341 14.714 -12.860 744 2HG GLN 83 1HG GLN 83 12.529 13.421 -13.025 745 1HE2 GLN 83 1HE2 GLN 83 12.234 11.884 -14.623 746 2HE2 GLN 83 2HE2 GLN 83 11.145 12.085 -15.944 747 H SER 84 H SER 84 13.545 14.506 -10.976 748 HA SER 84 HA SER 84 15.182 12.291 -10.959 749 1HB SER 84 2HB SER 84 15.860 15.205 -10.624 750 2HB SER 84 1HB SER 84 16.924 13.922 -11.212 751 HG SER 84 HG SER 84 15.882 15.234 -12.860 752 H GLU 85 H GLU 85 14.668 14.843 -8.460 753 HA GLU 85 HA GLU 85 16.579 13.889 -6.661 754 1HB GLU 85 2HB GLU 85 13.984 15.204 -5.824 755 2HB GLU 85 1HB GLU 85 15.476 15.138 -4.913 756 1HG GLU 85 2HG GLU 85 15.431 17.300 -5.686 757 2HG GLU 85 1HG GLU 85 16.455 16.498 -6.876 758 H LEU 86 H LEU 86 13.199 13.093 -7.062 759 HA LEU 86 HA LEU 86 13.118 11.426 -4.775 760 1HB LEU 86 2HB LEU 86 11.126 12.560 -5.710 761 2HB LEU 86 1HB LEU 86 11.206 11.511 -7.110 762 HG LEU 86 HG LEU 86 10.608 9.584 -5.786 763 1HD1 LEU 86 1HD1 LEU 86 10.711 11.446 -3.407 764 2HD1 LEU 86 2HD1 LEU 86 11.866 10.156 -3.751 765 3HD1 LEU 86 3HD1 LEU 86 10.186 9.763 -3.379 766 1HD2 LEU 86 1HD2 LEU 86 8.408 10.253 -4.990 767 2HD2 LEU 86 2HD2 LEU 86 8.779 11.022 -6.534 768 3HD2 LEU 86 3HD2 LEU 86 8.893 11.948 -5.036 769 H ALA 87 H ALA 87 13.680 10.839 -8.215 770 HA ALA 87 HA ALA 87 13.696 8.038 -8.148 771 1HB ALA 87 1HB ALA 87 15.411 9.870 -9.825 772 2HB ALA 87 2HB ALA 87 13.781 9.334 -10.231 773 3HB ALA 87 3HB ALA 87 15.099 8.164 -10.145 774 H ALA 88 H ALA 88 16.319 10.407 -7.535 775 HA ALA 88 HA ALA 88 18.312 8.596 -6.962 776 1HB ALA 88 1HB ALA 88 18.659 10.990 -7.372 777 2HB ALA 88 2HB ALA 88 19.402 10.466 -5.861 778 3HB ALA 88 3HB ALA 88 17.883 11.360 -5.829 779 H LEU 89 H LEU 89 15.925 10.120 -4.831 780 HA LEU 89 HA LEU 89 16.851 9.101 -2.386 781 1HB LEU 89 2HB LEU 89 14.055 9.838 -3.228 782 2HB LEU 89 1HB LEU 89 14.491 9.421 -1.586 783 HG LEU 89 HG LEU 89 15.579 11.779 -3.125 784 1HD1 LEU 89 1HD1 LEU 89 14.173 13.120 -1.636 785 2HD1 LEU 89 2HD1 LEU 89 13.506 11.641 -0.942 786 3HD1 LEU 89 3HD1 LEU 89 13.204 12.036 -2.633 787 1HD2 LEU 89 1HD2 LEU 89 16.442 12.481 -0.943 788 2HD2 LEU 89 2HD2 LEU 89 17.126 10.934 -1.444 789 3HD2 LEU 89 3HD2 LEU 89 15.848 10.980 -0.230 790 H LEU 90 H LEU 90 14.638 7.719 -4.751 791 HA LEU 90 HA LEU 90 13.993 5.464 -3.044 792 1HB LEU 90 2HB LEU 90 13.345 5.841 -5.944 793 2HB LEU 90 1HB LEU 90 12.551 4.775 -4.806 794 HG LEU 90 HG LEU 90 12.415 7.780 -4.870 795 1HD1 LEU 90 1HD1 LEU 90 11.207 6.743 -6.669 796 2HD1 LEU 90 2HD1 LEU 90 10.082 7.410 -5.480 797 3HD1 LEU 90 3HD1 LEU 90 10.381 5.674 -5.535 798 1HD2 LEU 90 1HD2 LEU 90 12.287 6.908 -2.569 799 2HD2 LEU 90 2HD2 LEU 90 10.953 5.859 -3.070 800 3HD2 LEU 90 3HD2 LEU 90 10.762 7.606 -3.110 801 H GLU 91 H GLU 91 16.613 6.213 -4.957 802 HA GLU 91 HA GLU 91 18.052 5.180 -6.289 803 1HB GLU 91 2HB GLU 91 17.501 3.063 -4.231 804 2HB GLU 91 1HB GLU 91 18.679 2.797 -5.512 805 1HG GLU 91 2HG GLU 91 18.750 5.116 -3.597 806 2HG GLU 91 1HG GLU 91 19.666 3.620 -3.395 807 H VAL 92 H VAL 92 15.981 5.431 -7.731 808 HA VAL 92 HA VAL 92 15.847 2.981 -9.272 809 HB VAL 92 HB VAL 92 13.457 3.331 -9.759 810 1HG1 VAL 92 1HG1 VAL 92 13.973 3.069 -6.811 811 2HG1 VAL 92 2HG1 VAL 92 13.980 1.770 -8.006 812 3HG1 VAL 92 3HG1 VAL 92 12.479 2.620 -7.635 813 1HG2 VAL 92 1HG2 VAL 92 13.248 5.708 -9.416 814 2HG2 VAL 92 2HG2 VAL 92 13.605 5.534 -7.705 815 3HG2 VAL 92 3HG2 VAL 92 12.097 4.885 -8.359 816 H SER 93 H SER 93 14.598 3.745 -11.409 817 HA SER 93 HA SER 93 16.238 5.851 -12.451 818 1HB SER 93 2HB SER 93 14.072 4.210 -13.768 819 2HB SER 93 1HB SER 93 15.268 5.215 -14.591 820 HG SER 93 HG SER 93 15.766 2.938 -12.974 821 H ARG 94 H ARG 94 15.423 7.700 -13.538 822 HA ARG 94 HA ARG 94 13.400 9.172 -12.243 823 1HB ARG 94 2HB ARG 94 14.613 9.570 -14.991 824 2HB ARG 94 1HB ARG 94 13.606 10.750 -14.166 825 1HG ARG 94 2HG ARG 94 15.250 11.037 -12.441 826 2HG ARG 94 1HG ARG 94 16.224 9.720 -13.093 827 1HD ARG 94 2HD ARG 94 15.610 12.326 -14.491 828 2HD ARG 94 1HD ARG 94 17.136 11.912 -13.706 829 HE ARG 94 HE ARG 94 16.028 10.636 -16.107 830 1HH1 ARG 94 1HH1 ARG 94 18.866 11.615 -14.160 831 2HH1 ARG 94 2HH1 ARG 94 19.964 10.799 -15.186 832 1HH2 ARG 94 1HH2 ARG 94 17.635 9.540 -17.469 833 2HH2 ARG 94 2HH2 ARG 94 19.302 9.649 -17.012 834 H GLN 95 H GLN 95 13.424 7.179 -15.082 835 HA GLN 95 HA GLN 95 10.843 7.654 -16.093 836 1HB GLN 95 2HB GLN 95 12.557 6.422 -17.309 837 2HB GLN 95 1HB GLN 95 12.505 5.141 -16.111 838 1HG GLN 95 2HG GLN 95 10.139 4.730 -16.741 839 2HG GLN 95 1HG GLN 95 10.328 5.914 -18.031 840 1HE2 GLN 95 1HE2 GLN 95 13.093 5.096 -18.568 841 2HE2 GLN 95 2HE2 GLN 95 12.965 3.579 -19.389 842 H THR 96 H THR 96 12.027 5.441 -13.577 843 HA THR 96 HA THR 96 9.767 3.844 -13.288 844 HB THR 96 HB THR 96 11.740 4.586 -11.135 845 HG1 THR 96 1HG THR 96 12.281 2.457 -12.915 846 1HG2 THR 96 1HG2 THR 96 11.444 2.237 -10.475 847 2HG2 THR 96 2HG2 THR 96 10.322 1.999 -11.817 848 3HG2 THR 96 3HG2 THR 96 9.897 3.082 -10.491 849 H ILE 97 H ILE 97 10.911 6.631 -11.341 850 HA ILE 97 HA ILE 97 8.601 6.721 -9.779 851 HB ILE 97 HB ILE 97 10.712 7.598 -8.978 852 1HG1 ILE 97 2HG1 ILE 97 8.546 8.650 -8.097 853 2HG1 ILE 97 1HG1 ILE 97 10.032 9.521 -7.782 854 1HG2 ILE 97 1HG2 ILE 97 10.541 9.711 -11.077 855 2HG2 ILE 97 2HG2 ILE 97 11.705 8.390 -10.957 856 3HG2 ILE 97 3HG2 ILE 97 11.707 9.682 -9.754 857 1HD1 ILE 97 1HD1 ILE 97 9.477 11.086 -9.594 858 2HD1 ILE 97 2HD1 ILE 97 8.217 11.025 -8.362 859 3HD1 ILE 97 3HD1 ILE 97 7.985 10.192 -9.898 860 H ASN 98 H ASN 98 9.477 8.503 -12.707 861 HA ASN 98 HA ASN 98 7.293 10.270 -12.801 862 1HB ASN 98 2HB ASN 98 9.293 10.369 -14.312 863 2HB ASN 98 1HB ASN 98 8.660 8.972 -15.174 864 1HD2 ASN 98 1HD2 ASN 98 8.411 12.371 -14.673 865 2HD2 ASN 98 2HD2 ASN 98 7.259 12.689 -15.896 866 H GLY 99 H GLY 99 7.683 6.985 -13.950 867 1HA GLY 99 2HA GLY 99 5.186 6.711 -15.211 868 2HA GLY 99 1HA GLY 99 6.213 5.401 -14.643 869 H ILE 100 H ILE 100 6.209 6.150 -11.824 870 HA ILE 100 HA ILE 100 3.751 5.014 -11.062 871 HB ILE 100 HB ILE 100 5.897 6.321 -9.340 872 1HG1 ILE 100 2HG1 ILE 100 6.709 4.344 -10.545 873 2HG1 ILE 100 1HG1 ILE 100 6.592 4.020 -8.820 874 1HG2 ILE 100 1HG2 ILE 100 4.878 5.131 -7.435 875 2HG2 ILE 100 2HG2 ILE 100 3.582 4.579 -8.499 876 3HG2 ILE 100 3HG2 ILE 100 3.760 6.298 -8.153 877 1HD1 ILE 100 1HD1 ILE 100 5.832 2.115 -10.119 878 2HD1 ILE 100 2HD1 ILE 100 4.637 3.125 -10.933 879 3HD1 ILE 100 3HD1 ILE 100 4.490 2.807 -9.207 880 H GLU 101 H GLU 101 5.003 8.334 -10.972 881 HA GLU 101 HA GLU 101 2.939 9.696 -9.734 882 1HB GLU 101 2HB GLU 101 4.096 10.601 -12.351 883 2HB GLU 101 1HB GLU 101 3.380 11.597 -11.106 884 1HG GLU 101 2HG GLU 101 5.262 11.194 -9.672 885 2HG GLU 101 1HG GLU 101 5.959 10.093 -10.875 886 H LYS 102 H LYS 102 3.061 8.409 -13.003 887 HA LYS 102 HA LYS 102 0.459 9.570 -13.621 888 1HB LYS 102 2HB LYS 102 2.172 7.862 -15.425 889 2HB LYS 102 1HB LYS 102 0.857 8.919 -15.892 890 1HG LYS 102 2HG LYS 102 3.615 9.695 -14.961 891 2HG LYS 102 1HG LYS 102 2.903 9.936 -16.551 892 1HD LYS 102 2HD LYS 102 1.246 11.482 -15.491 893 2HD LYS 102 1HD LYS 102 2.134 11.314 -13.975 894 1HE LYS 102 2HE LYS 102 3.160 12.442 -16.578 895 2HE LYS 102 1HE LYS 102 2.838 13.331 -15.095 896 1HZ LYS 102 1HZ LYS 102 4.727 12.156 -14.027 897 2HZ LYS 102 2HZ LYS 102 5.176 12.916 -15.452 898 3HZ LYS 102 3HZ LYS 102 4.958 11.263 -15.450 899 H ASN 103 H ASN 103 1.389 7.064 -11.914 900 HA ASN 103 HA ASN 103 0.933 4.903 -11.519 901 1HB ASN 103 2HB ASN 103 -1.468 4.332 -11.222 902 2HB ASN 103 1HB ASN 103 -1.083 5.902 -10.552 903 1HD2 ASN 103 1HD2 ASN 103 -2.851 4.167 -13.009 904 2HD2 ASN 103 2HD2 ASN 103 -3.834 5.474 -13.519 905 H LYS 104 H LYS 104 1.976 5.098 -13.970 906 HA LYS 104 HA LYS 104 0.283 3.457 -15.718 907 1HB LYS 104 2HB LYS 104 0.794 5.680 -16.593 908 2HB LYS 104 1HB LYS 104 2.507 5.387 -16.372 909 1HG LYS 104 2HG LYS 104 2.446 3.649 -18.081 910 2HG LYS 104 1HG LYS 104 0.706 3.889 -18.271 911 1HD LYS 104 2HD LYS 104 2.002 5.057 -20.013 912 2HD LYS 104 1HD LYS 104 1.076 6.175 -19.009 913 1HE LYS 104 2HE LYS 104 3.107 6.614 -17.681 914 2HE LYS 104 1HE LYS 104 4.015 5.550 -18.751 915 1HZ LYS 104 1HZ LYS 104 2.611 8.021 -19.607 916 2HZ LYS 104 2HZ LYS 104 3.579 7.032 -20.576 917 3HZ LYS 104 3HZ LYS 104 4.256 7.891 -19.277 918 H TYR 105 H TYR 105 3.295 3.759 -14.021 919 HA TYR 105 HA TYR 105 4.646 1.662 -15.457 920 1HB TYR 105 2HB TYR 105 5.637 3.750 -14.316 921 2HB TYR 105 1HB TYR 105 5.418 2.883 -12.807 922 HD1 TYR 105 1HD TYR 105 7.155 2.859 -16.042 923 HD2 TYR 105 2HD TYR 105 6.992 1.224 -12.130 924 HE1 TYR 105 1HE TYR 105 9.352 1.814 -16.398 925 HE2 TYR 105 2HE TYR 105 9.184 0.171 -12.471 926 HH TYR 105 HH TYR 105 10.544 -0.565 -14.284 927 H ASN 106 H ASN 106 2.138 1.572 -13.588 928 HA ASN 106 HA ASN 106 0.975 0.088 -12.407 929 1HB ASN 106 2HB ASN 106 1.975 -1.709 -13.812 930 2HB ASN 106 1HB ASN 106 3.323 -1.819 -12.687 931 1HD2 ASN 106 1HD2 ASN 106 3.058 -2.985 -10.757 932 2HD2 ASN 106 2HD2 ASN 106 1.618 -3.850 -10.417 933 HA PRO 107 HA PRO 107 2.121 1.706 -8.531 934 1HB PRO 107 2HB PRO 107 -0.146 0.002 -7.623 935 2HB PRO 107 1HB PRO 107 0.160 1.724 -7.355 936 1HG PRO 107 2HG PRO 107 -1.670 0.942 -9.121 937 2HG PRO 107 1HG PRO 107 -0.621 2.334 -9.447 938 1HD PRO 107 2HD PRO 107 -0.468 -0.448 -10.526 939 2HD PRO 107 1HD PRO 107 -0.152 1.099 -11.342 940 H SER 108 H SER 108 3.981 0.819 -8.005 941 HA SER 108 HA SER 108 4.116 -1.903 -7.002 942 1HB SER 108 2HB SER 108 6.274 0.164 -7.489 943 2HB SER 108 1HB SER 108 6.511 -1.562 -7.196 944 HG SER 108 HG SER 108 4.975 -0.594 -9.389 945 H LEU 109 H LEU 109 3.977 -2.194 -4.820 946 HA LEU 109 HA LEU 109 3.413 0.035 -3.218 947 1HB LEU 109 2HB LEU 109 2.328 -2.128 -2.845 948 2HB LEU 109 1HB LEU 109 3.855 -2.843 -2.397 949 HG LEU 109 HG LEU 109 2.181 -2.297 -0.524 950 1HD1 LEU 109 1HD1 LEU 109 4.981 -1.226 -0.262 951 2HD1 LEU 109 2HD1 LEU 109 4.475 -2.898 -0.022 952 3HD1 LEU 109 3HD1 LEU 109 3.905 -1.638 1.073 953 1HD2 LEU 109 1HD2 LEU 109 2.246 0.009 0.364 954 2HD2 LEU 109 2HD2 LEU 109 1.536 -0.049 -1.242 955 3HD2 LEU 109 3HD2 LEU 109 3.189 0.511 -1.038 956 H GLN 110 H GLN 110 6.359 -2.054 -3.316 957 HA GLN 110 HA GLN 110 7.685 -0.951 -1.195 958 1HB GLN 110 2HB GLN 110 8.482 -2.885 -2.466 959 2HB GLN 110 1HB GLN 110 8.765 -1.877 -3.870 960 1HG GLN 110 2HG GLN 110 10.863 -2.384 -2.817 961 2HG GLN 110 1HG GLN 110 10.518 -0.671 -2.613 962 1HE2 GLN 110 1HE2 GLN 110 10.865 -3.728 -1.042 963 2HE2 GLN 110 2HE2 GLN 110 10.849 -3.136 0.574 964 H LEU 111 H LEU 111 7.631 0.181 -4.533 965 HA LEU 111 HA LEU 111 9.372 2.376 -4.199 966 1HB LEU 111 2HB LEU 111 7.146 2.050 -6.205 967 2HB LEU 111 1HB LEU 111 8.456 3.208 -6.310 968 HG LEU 111 HG LEU 111 8.706 0.210 -6.470 969 1HD1 LEU 111 1HD1 LEU 111 9.079 2.359 -8.544 970 2HD1 LEU 111 2HD1 LEU 111 7.750 1.202 -8.460 971 3HD1 LEU 111 3HD1 LEU 111 9.391 0.639 -8.772 972 1HD2 LEU 111 1HD2 LEU 111 10.642 1.181 -5.352 973 2HD2 LEU 111 2HD2 LEU 111 10.830 2.344 -6.665 974 3HD2 LEU 111 3HD2 LEU 111 11.069 0.623 -6.970 975 H ALA 112 H ALA 112 5.881 2.147 -4.148 976 HA ALA 112 HA ALA 112 5.331 4.909 -3.779 977 1HB ALA 112 1HB ALA 112 3.630 2.532 -3.023 978 2HB ALA 112 2HB ALA 112 3.648 3.327 -4.597 979 3HB ALA 112 3HB ALA 112 3.073 4.198 -3.176 980 H LEU 113 H LEU 113 5.846 2.237 -1.554 981 HA LEU 113 HA LEU 113 5.049 3.479 0.814 982 1HB LEU 113 2HB LEU 113 5.323 1.046 0.323 983 2HB LEU 113 1HB LEU 113 7.055 1.286 0.387 984 HG LEU 113 HG LEU 113 6.823 1.997 2.741 985 1HD1 LEU 113 1HD1 LEU 113 4.698 1.565 3.871 986 2HD1 LEU 113 2HD1 LEU 113 3.960 1.138 2.329 987 3HD1 LEU 113 3HD1 LEU 113 4.514 2.788 2.614 988 1HD2 LEU 113 1HD2 LEU 113 6.395 -0.251 3.592 989 2HD2 LEU 113 2HD2 LEU 113 7.388 -0.302 2.133 990 3HD2 LEU 113 3HD2 LEU 113 5.673 -0.702 2.050 991 H LYS 114 H LYS 114 8.165 3.091 -0.790 992 HA LYS 114 HA LYS 114 9.415 4.512 1.298 993 1HB LYS 114 2HB LYS 114 11.481 4.674 -0.182 994 2HB LYS 114 1HB LYS 114 10.959 3.083 0.319 995 1HG LYS 114 2HG LYS 114 10.008 2.699 -1.874 996 2HG LYS 114 1HG LYS 114 10.488 4.307 -2.398 997 1HD LYS 114 2HD LYS 114 12.110 2.642 -3.147 998 2HD LYS 114 1HD LYS 114 12.850 3.712 -1.956 999 1HE LYS 114 2HE LYS 114 12.357 1.996 -0.210 1000 2HE LYS 114 1HE LYS 114 11.793 0.923 -1.486 1001 1HZ LYS 114 1HZ LYS 114 14.075 0.456 -0.872 1002 2HZ LYS 114 2HZ LYS 114 14.526 2.031 -1.197 1003 3HZ LYS 114 3HZ LYS 114 14.025 1.027 -2.472 1004 H ILE 115 H ILE 115 8.082 5.576 -1.713 1005 HA ILE 115 HA ILE 115 8.941 8.269 -1.581 1006 HB ILE 115 HB ILE 115 6.238 7.230 -2.540 1007 1HG1 ILE 115 2HG1 ILE 115 8.733 7.901 -4.116 1008 2HG1 ILE 115 1HG1 ILE 115 8.183 6.278 -3.733 1009 1HG2 ILE 115 1HG2 ILE 115 7.558 9.897 -3.071 1010 2HG2 ILE 115 2HG2 ILE 115 6.129 9.620 -2.074 1011 3HG2 ILE 115 3HG2 ILE 115 6.060 9.329 -3.812 1012 1HD1 ILE 115 1HD1 ILE 115 6.728 8.279 -5.448 1013 2HD1 ILE 115 2HD1 ILE 115 6.174 6.648 -5.073 1014 3HD1 ILE 115 3HD1 ILE 115 7.646 6.883 -6.017 1015 H ALA 116 H ALA 116 6.314 6.568 -0.052 1016 HA ALA 116 HA ALA 116 4.993 8.693 1.267 1017 1HB ALA 116 1HB ALA 116 4.080 6.951 2.702 1018 2HB ALA 116 2HB ALA 116 5.314 5.841 2.109 1019 3HB ALA 116 3HB ALA 116 4.056 6.425 1.005 1020 H TYR 117 H TYR 117 7.637 6.584 2.109 1021 HA TYR 117 HA TYR 117 7.951 7.458 4.752 1022 1HB TYR 117 2HB TYR 117 8.667 5.270 4.074 1023 2HB TYR 117 1HB TYR 117 9.722 5.942 2.843 1024 HD1 TYR 117 1HD TYR 117 11.804 6.787 3.386 1025 HD2 TYR 117 2HD TYR 117 9.301 5.320 6.442 1026 HE1 TYR 117 1HE TYR 117 13.756 6.743 4.939 1027 HE2 TYR 117 2HE TYR 117 11.196 5.267 8.017 1028 HH TYR 117 HH TYR 117 14.071 6.853 7.417 1029 H TYR 118 H TYR 118 9.815 8.227 1.757 1030 HA TYR 118 HA TYR 118 11.592 9.996 3.108 1031 1HB TYR 118 2HB TYR 118 11.026 9.747 0.146 1032 2HB TYR 118 1HB TYR 118 12.264 10.797 0.817 1033 HD1 TYR 118 1HD TYR 118 14.075 9.629 2.288 1034 HD2 TYR 118 2HD TYR 118 11.541 7.574 -0.422 1035 HE1 TYR 118 1HE TYR 118 15.670 7.752 2.216 1036 HE2 TYR 118 2HE TYR 118 13.109 5.705 -0.499 1037 HH TYR 118 HH TYR 118 15.652 5.318 1.690 1038 H LEU 119 H LEU 119 8.700 10.546 1.364 1039 HA LEU 119 HA LEU 119 8.929 13.434 1.831 1040 1HB LEU 119 2HB LEU 119 6.855 11.889 0.283 1041 2HB LEU 119 1HB LEU 119 6.610 13.572 0.691 1042 1HD1 LEU 119 1HD1 LEU 119 8.576 11.260 -1.462 1043 2HD1 LEU 119 2HD1 LEU 119 9.841 12.016 -0.493 1044 3HD1 LEU 119 3HD1 LEU 119 9.593 12.517 -2.166 1045 1HD2 LEU 119 1HD2 LEU 119 6.525 12.749 -2.140 1046 2HD2 LEU 119 2HD2 LEU 119 7.707 13.876 -2.800 1047 3HD2 LEU 119 3HD2 LEU 119 6.532 14.429 -1.605 1048 H ASN 120 H ASN 120 7.941 10.910 3.514 1049 HA ASN 120 HA ASN 120 6.690 10.458 5.280 1050 1HB ASN 120 2HB ASN 120 8.419 11.891 6.304 1051 2HB ASN 120 1HB ASN 120 7.395 13.302 6.056 1052 1HD2 ASN 120 1HD2 ASN 120 7.491 13.665 8.298 1053 2HD2 ASN 120 2HD2 ASN 120 6.520 12.745 9.403 1054 H THR 121 H THR 121 4.908 10.308 3.804 1055 HA THR 121 HA THR 121 2.735 12.018 4.656 1056 HB THR 121 HB THR 121 3.289 11.259 1.759 1057 HG1 THR 121 1HG THR 121 4.455 13.120 3.174 1058 1HG2 THR 121 1HG2 THR 121 1.306 13.172 3.003 1059 2HG2 THR 121 2HG2 THR 121 0.925 11.588 2.329 1060 3HG2 THR 121 3HG2 THR 121 1.507 12.877 1.276 1061 HA PRO 122 HA PRO 122 1.210 7.813 5.203 1062 1HB PRO 122 2HB PRO 122 -1.432 9.171 5.141 1063 2HB PRO 122 1HB PRO 122 -0.751 8.102 6.372 1064 1HG PRO 122 2HG PRO 122 -0.925 10.705 6.823 1065 2HG PRO 122 1HG PRO 122 0.513 9.801 7.337 1066 1HD PRO 122 2HD PRO 122 0.143 11.576 4.955 1067 2HD PRO 122 1HD PRO 122 1.522 11.461 6.070 1068 H LEU 123 H LEU 123 0.295 6.267 3.931 1069 HA LEU 123 HA LEU 123 0.256 6.582 1.177 1070 1HB LEU 123 2HB LEU 123 -1.075 4.464 2.847 1071 2HB LEU 123 1HB LEU 123 -0.878 4.375 1.110 1072 1HD1 LEU 123 1HD2 LEU 123 0.142 2.475 3.354 1073 2HD1 LEU 123 2HD2 LEU 123 1.710 2.142 2.611 1074 3HD1 LEU 123 3HD2 LEU 123 0.243 2.154 1.623 1075 1HD2 LEU 123 1HD1 LEU 123 1.978 5.397 0.892 1076 2HD2 LEU 123 2HD1 LEU 123 1.356 3.938 0.119 1077 3HD2 LEU 123 3HD1 LEU 123 2.773 3.847 1.166 1078 H GLU 124 H GLU 124 -2.483 6.699 3.461 1079 HA GLU 124 HA GLU 124 -4.575 6.759 1.689 1080 1HB GLU 124 2HB GLU 124 -4.267 8.239 4.296 1081 2HB GLU 124 1HB GLU 124 -5.785 7.975 3.455 1082 1HG GLU 124 2HG GLU 124 -5.537 5.581 3.739 1083 2HG GLU 124 1HG GLU 124 -3.998 5.828 4.574 1084 H ASP 125 H ASP 125 -2.425 9.395 2.643 1085 HA ASP 125 HA ASP 125 -3.994 11.419 1.392 1086 1HB ASP 125 2HB ASP 125 -2.355 11.794 3.285 1087 2HB ASP 125 1HB ASP 125 -1.065 11.572 2.110 1088 H ILE 126 H ILE 126 -1.380 9.395 0.518 1089 HA ILE 126 HA ILE 126 -0.676 10.750 -1.940 1090 HB ILE 126 HB ILE 126 0.184 7.976 -1.060 1091 1HG1 ILE 126 2HG1 ILE 126 1.567 10.652 -0.739 1092 2HG1 ILE 126 1HG1 ILE 126 0.834 9.719 0.558 1093 1HG2 ILE 126 1HG2 ILE 126 2.024 8.318 -2.662 1094 2HG2 ILE 126 2HG2 ILE 126 1.324 9.867 -3.129 1095 3HG2 ILE 126 3HG2 ILE 126 0.452 8.369 -3.462 1096 1HD1 ILE 126 1HD1 ILE 126 3.189 8.876 -1.112 1097 2HD1 ILE 126 2HD1 ILE 126 2.463 7.943 0.197 1098 3HD1 ILE 126 3HD1 ILE 126 3.245 9.485 0.543 1099 H PHE 127 H PHE 127 -2.184 7.622 -1.248 1100 HA PHE 127 HA PHE 127 -3.264 7.696 -3.984 1101 1HB PHE 127 2HB PHE 127 -2.618 5.305 -2.207 1102 2HB PHE 127 1HB PHE 127 -3.610 5.192 -3.654 1103 HD1 PHE 127 1HD PHE 127 -2.608 5.168 -5.802 1104 HD2 PHE 127 2HD PHE 127 -0.247 5.853 -2.334 1105 HE1 PHE 127 1HE PHE 127 -0.568 4.796 -7.123 1106 HE2 PHE 127 2HE PHE 127 1.797 5.491 -3.652 1107 HZ PHE 127 HZ PHE 127 1.637 4.960 -6.049 1108 H GLN 128 H GLN 128 -5.389 7.451 -4.272 1109 HA GLN 128 HA GLN 128 -7.008 7.535 -1.847 1110 1HB GLN 128 2HB GLN 128 -7.001 9.605 -3.191 1111 2HB GLN 128 1HB GLN 128 -7.611 8.693 -4.563 1112 1HG GLN 128 2HG GLN 128 -9.651 8.202 -3.370 1113 2HG GLN 128 1HG GLN 128 -9.035 9.020 -1.935 1114 1HE2 GLN 128 1HE2 GLN 128 -11.401 9.600 -3.503 1115 2HE2 GLN 128 2HE2 GLN 128 -11.233 11.230 -4.015 1116 H TRP 129 H TRP 129 -8.338 5.985 -1.578 1117 HA TRP 129 HA TRP 129 -8.937 4.274 -3.845 1118 1HB TRP 129 2HB TRP 129 -9.156 2.485 -1.922 1119 2HB TRP 129 1HB TRP 129 -7.621 2.842 -2.701 1120 HD1 TRP 129 HD TRP 129 -9.531 3.767 0.565 1121 HE1 TRP 129 1HE TRP 129 -7.768 4.234 2.389 1122 HE3 TRP 129 3HE TRP 129 -5.305 3.330 -2.270 1123 HZ2 TRP 129 2HZ TRP 129 -4.950 4.373 2.581 1124 HZ3 TRP 129 3HZ TRP 129 -3.120 3.636 -1.187 1125 HH2 TRP 129 HH TRP 129 -2.954 4.148 1.186 1126 H GLN 130 H GLN 130 -10.858 4.064 -4.360 1127 HA GLN 130 HA GLN 130 -12.993 4.534 -2.394 1128 1HB GLN 130 2HB GLN 130 -13.047 5.106 -5.368 1129 2HB GLN 130 1HB GLN 130 -14.390 5.321 -4.265 1130 1HG GLN 130 2HG GLN 130 -11.796 6.842 -4.129 1131 2HG GLN 130 1HG GLN 130 -13.243 7.424 -4.935 1132 1HE2 GLN 130 1HE2 GLN 130 -13.525 9.157 -3.677 1133 2HE2 GLN 130 2HE2 GLN 130 -13.977 9.116 -2.007 1134 HA PRO 131 HA PRO 131 -13.471 0.255 -4.039 1135 1HB PRO 131 2HB PRO 131 -14.216 -0.449 -1.305 1136 2HB PRO 131 1HB PRO 131 -12.870 -1.060 -2.272 1137 1HG PRO 131 2HG PRO 131 -12.493 0.527 -0.117 1138 2HG PRO 131 1HG PRO 131 -11.419 0.572 -1.529 1139 1HD PRO 131 2HD PRO 131 -13.689 2.406 -0.817 1140 2HD PRO 131 1HD PRO 131 -12.055 2.813 -1.390 1141 H GLU 132 H GLU 132 -15.362 2.480 -2.438 1142 HA GLU 132 HA GLU 132 -17.819 0.977 -2.707 1143 1HB GLU 132 2HB GLU 132 -17.346 3.774 -1.690 1144 2HB GLU 132 1HB GLU 132 -18.931 3.022 -1.803 1145 1HG GLU 132 2HG GLU 132 -18.057 1.207 -0.309 1146 2HG GLU 132 1HG GLU 132 -16.626 2.212 -0.064 Start of MODEL 9 1 1H MET 1 1HT MET 1 13.094 -4.510 4.258 2 2H MET 1 2HT MET 1 11.894 -3.366 4.648 3 3H MET 1 3HT MET 1 11.563 -4.593 3.553 4 HA MET 1 HA MET 1 11.536 -6.240 5.133 5 1HB MET 1 2HB MET 1 12.387 -4.063 7.064 6 2HB MET 1 1HB MET 1 11.754 -5.620 7.568 7 1HG MET 1 2HG MET 1 13.652 -6.731 6.535 8 2HG MET 1 1HG MET 1 14.268 -5.175 5.975 9 1HE MET 1 1HE MET 1 16.771 -6.239 8.825 10 2HE MET 1 2HE MET 1 16.606 -5.795 7.123 11 3HE MET 1 3HE MET 1 15.930 -7.315 7.709 12 H ILE 2 H ILE 2 9.468 -6.524 4.966 13 HA ILE 2 HA ILE 2 7.705 -4.365 5.870 14 HB ILE 2 HB ILE 2 7.040 -6.832 4.217 15 1HG1 ILE 2 2HG1 ILE 2 8.304 -5.208 2.914 16 2HG1 ILE 2 1HG1 ILE 2 6.626 -5.192 2.388 17 1HG2 ILE 2 1HG2 ILE 2 4.807 -5.860 3.912 18 2HG2 ILE 2 2HG2 ILE 2 5.234 -4.542 5.004 19 3HG2 ILE 2 3HG2 ILE 2 5.140 -6.193 5.616 20 1HD1 ILE 2 1HD1 ILE 2 6.237 -3.158 3.675 21 2HD1 ILE 2 2HD1 ILE 2 7.537 -2.947 2.503 22 3HD1 ILE 2 3HD1 ILE 2 7.916 -3.175 4.210 23 H ILE 3 H ILE 3 6.445 -4.616 7.661 24 HA ILE 3 HA ILE 3 6.742 -7.146 9.101 25 HB ILE 3 HB ILE 3 6.261 -4.351 10.241 26 1HG1 ILE 3 2HG1 ILE 3 8.806 -5.985 10.335 27 2HG1 ILE 3 1HG1 ILE 3 8.540 -4.615 9.261 28 1HG2 ILE 3 1HG2 ILE 3 6.898 -6.980 11.585 29 2HG2 ILE 3 2HG2 ILE 3 5.332 -6.169 11.580 30 3HG2 ILE 3 3HG2 ILE 3 6.707 -5.424 12.396 31 1HD1 ILE 3 1HD1 ILE 3 8.558 -4.531 12.272 32 2HD1 ILE 3 2HD1 ILE 3 8.283 -3.155 11.203 33 3HD1 ILE 3 3HD1 ILE 3 9.846 -3.974 11.202 34 H ASN 4 H ASN 4 4.723 -8.249 8.968 35 HA ASN 4 HA ASN 4 2.443 -6.619 8.277 36 1HB ASN 4 2HB ASN 4 3.169 -8.288 6.648 37 2HB ASN 4 1HB ASN 4 3.141 -9.533 7.884 38 1HD2 ASN 4 1HD2 ASN 4 1.703 -10.804 6.810 39 2HD2 ASN 4 2HD2 ASN 4 0.059 -10.376 6.523 40 H ASN 5 H ASN 5 0.677 -6.690 9.548 41 HA ASN 5 HA ASN 5 0.531 -8.653 11.758 42 1HB ASN 5 2HB ASN 5 -0.355 -5.753 11.965 43 2HB ASN 5 1HB ASN 5 -0.394 -6.952 13.242 44 1HD2 ASN 5 1HD2 ASN 5 1.488 -4.835 11.394 45 2HD2 ASN 5 2HD2 ASN 5 2.925 -4.801 12.322 46 H LEU 6 H LEU 6 -0.655 -8.458 9.007 47 HA LEU 6 HA LEU 6 -3.239 -7.520 8.908 48 1HB LEU 6 2HB LEU 6 -1.728 -8.472 7.065 49 2HB LEU 6 1HB LEU 6 -2.271 -10.051 7.568 50 HG LEU 6 HG LEU 6 -3.373 -9.221 5.522 51 1HD1 LEU 6 1HD1 LEU 6 -5.270 -9.596 7.819 52 2HD1 LEU 6 2HD1 LEU 6 -4.558 -10.862 6.817 53 3HD1 LEU 6 3HD1 LEU 6 -5.686 -9.709 6.109 54 1HD2 LEU 6 1HD2 LEU 6 -3.396 -6.859 6.008 55 2HD2 LEU 6 2HD2 LEU 6 -4.534 -7.113 7.330 56 3HD2 LEU 6 3HD2 LEU 6 -5.033 -7.424 5.665 57 H LYS 7 H LYS 7 -2.147 -10.771 9.861 58 HA LYS 7 HA LYS 7 -4.780 -11.612 10.466 59 1HB LYS 7 2HB LYS 7 -3.776 -13.581 11.566 60 2HB LYS 7 1HB LYS 7 -3.157 -13.309 9.945 61 1HG LYS 7 2HG LYS 7 -1.130 -12.354 10.867 62 2HG LYS 7 1HG LYS 7 -1.761 -12.570 12.500 63 1HD LYS 7 2HD LYS 7 -1.256 -14.773 10.520 64 2HD LYS 7 1HD LYS 7 -0.186 -14.334 11.852 65 1HE LYS 7 2HE LYS 7 -1.988 -14.841 13.439 66 2HE LYS 7 1HE LYS 7 -3.029 -15.300 12.092 67 1HZ LYS 7 1HZ LYS 7 -1.483 -17.030 11.522 68 2HZ LYS 7 2HZ LYS 7 -2.005 -17.215 13.132 69 3HZ LYS 7 3HZ LYS 7 -0.464 -16.590 12.802 70 H LEU 8 H LEU 8 -2.225 -10.227 12.510 71 HA LEU 8 HA LEU 8 -3.482 -10.504 14.962 72 1HB LEU 8 2HB LEU 8 -1.128 -9.773 14.565 73 2HB LEU 8 1HB LEU 8 -1.713 -8.241 13.981 74 HG LEU 8 HG LEU 8 -0.717 -8.271 16.302 75 1HD1 LEU 8 1HD1 LEU 8 -3.542 -7.269 16.090 76 2HD1 LEU 8 2HD1 LEU 8 -2.092 -6.412 15.579 77 3HD1 LEU 8 3HD1 LEU 8 -2.352 -6.766 17.288 78 1HD2 LEU 8 1HD2 LEU 8 -2.152 -9.044 18.137 79 2HD2 LEU 8 2HD2 LEU 8 -1.648 -10.359 17.077 80 3HD2 LEU 8 3HD2 LEU 8 -3.280 -9.705 16.953 81 H ILE 9 H ILE 9 -3.790 -7.897 12.581 82 HA ILE 9 HA ILE 9 -5.725 -6.442 14.024 83 HB ILE 9 HB ILE 9 -4.936 -6.391 11.109 84 1HG1 ILE 9 2HG1 ILE 9 -4.498 -3.992 11.586 85 2HG1 ILE 9 1HG1 ILE 9 -5.066 -4.226 13.227 86 1HG2 ILE 9 1HG2 ILE 9 -7.332 -4.915 12.187 87 2HG2 ILE 9 2HG2 ILE 9 -7.347 -6.194 10.982 88 3HG2 ILE 9 3HG2 ILE 9 -6.588 -4.642 10.609 89 1HD1 ILE 9 1HD1 ILE 9 -3.191 -5.736 13.638 90 2HD1 ILE 9 2HD1 ILE 9 -2.657 -4.135 13.124 91 3HD1 ILE 9 3HD1 ILE 9 -2.634 -5.483 11.986 92 H ARG 10 H ARG 10 -6.027 -9.077 11.855 93 HA ARG 10 HA ARG 10 -8.860 -9.142 11.721 94 1HB ARG 10 2HB ARG 10 -6.794 -11.278 11.354 95 2HB ARG 10 1HB ARG 10 -8.507 -11.657 11.336 96 1HG ARG 10 2HG ARG 10 -8.848 -10.202 9.450 97 2HG ARG 10 1HG ARG 10 -7.153 -9.700 9.504 98 1HD ARG 10 2HD ARG 10 -7.683 -11.455 7.803 99 2HD ARG 10 1HD ARG 10 -6.405 -11.874 8.942 100 HE ARG 10 HE ARG 10 -8.886 -12.794 9.910 101 1HH1 ARG 10 1HH1 ARG 10 -6.794 -13.498 7.178 102 2HH1 ARG 10 2HH1 ARG 10 -6.807 -15.186 7.389 103 1HH2 ARG 10 1HH2 ARG 10 -8.963 -15.069 10.215 104 2HH2 ARG 10 2HH2 ARG 10 -8.217 -16.137 9.125 105 H GLU 11 H GLU 11 -6.535 -10.476 14.141 106 HA GLU 11 HA GLU 11 -8.555 -11.680 15.624 107 1HB GLU 11 2HB GLU 11 -5.698 -11.036 16.358 108 2HB GLU 11 1HB GLU 11 -6.791 -12.033 17.317 109 1HG GLU 11 2HG GLU 11 -7.050 -13.477 15.241 110 2HG GLU 11 1HG GLU 11 -5.671 -12.602 14.594 111 H LYS 12 H LYS 12 -7.040 -8.518 15.775 112 HA LYS 12 HA LYS 12 -8.300 -7.501 18.013 113 1HB LYS 12 2HB LYS 12 -7.889 -6.032 15.374 114 2HB LYS 12 1HB LYS 12 -8.180 -5.259 16.930 115 1HG LYS 12 2HG LYS 12 -6.107 -6.111 17.803 116 2HG LYS 12 1HG LYS 12 -5.835 -7.044 16.343 117 1HD LYS 12 2HD LYS 12 -4.423 -5.100 16.308 118 2HD LYS 12 1HD LYS 12 -5.661 -4.915 15.072 119 1HE LYS 12 2HE LYS 12 -6.844 -3.333 16.383 120 2HE LYS 12 1HE LYS 12 -5.888 -3.705 17.818 121 1HZ LYS 12 1HZ LYS 12 -4.794 -2.370 15.347 122 2HZ LYS 12 2HZ LYS 12 -3.943 -2.805 16.714 123 3HZ LYS 12 3HZ LYS 12 -5.140 -1.639 16.829 124 H LYS 13 H LYS 13 -9.656 -8.074 14.883 125 HA LYS 13 HA LYS 13 -12.373 -7.541 15.905 126 1HB LYS 13 2HB LYS 13 -11.414 -8.142 13.067 127 2HB LYS 13 1HB LYS 13 -13.074 -7.766 13.510 128 1HG LYS 13 2HG LYS 13 -10.708 -5.897 13.728 129 2HG LYS 13 1HG LYS 13 -11.988 -5.825 12.515 130 1HD LYS 13 2HD LYS 13 -13.639 -5.396 14.261 131 2HD LYS 13 1HD LYS 13 -12.392 -5.537 15.494 132 1HE LYS 13 2HE LYS 13 -12.904 -3.200 15.046 133 2HE LYS 13 1HE LYS 13 -11.253 -3.575 14.557 134 1HZ LYS 13 1HZ LYS 13 -13.544 -3.517 12.661 135 2HZ LYS 13 2HZ LYS 13 -11.892 -3.517 12.266 136 3HZ LYS 13 3HZ LYS 13 -12.580 -2.189 12.981 137 H LYS 14 H LYS 14 -13.864 -10.007 14.458 138 HA LYS 14 HA LYS 14 -11.852 -11.885 14.647 139 1HB LYS 14 2HB LYS 14 -13.768 -13.349 15.717 140 2HB LYS 14 1HB LYS 14 -12.721 -12.367 16.729 141 1HG LYS 14 2HG LYS 14 -14.456 -10.624 16.773 142 2HG LYS 14 1HG LYS 14 -15.499 -11.672 15.815 143 1HD LYS 14 2HD LYS 14 -15.635 -13.273 17.561 144 2HD LYS 14 1HD LYS 14 -14.335 -12.494 18.464 145 1HE LYS 14 2HE LYS 14 -17.024 -11.263 17.874 146 2HE LYS 14 1HE LYS 14 -16.555 -12.002 19.408 147 1HZ LYS 14 1HZ LYS 14 -14.767 -10.364 19.579 148 2HZ LYS 14 2HZ LYS 14 -16.264 -9.579 19.499 149 3HZ LYS 14 3HZ LYS 14 -15.269 -9.626 18.156 150 H ILE 15 H ILE 15 -11.881 -11.475 12.507 151 HA ILE 15 HA ILE 15 -14.105 -12.711 11.056 152 HB ILE 15 HB ILE 15 -12.315 -10.449 10.068 153 1HG1 ILE 15 2HG1 ILE 15 -15.243 -10.392 10.860 154 2HG1 ILE 15 1HG1 ILE 15 -13.924 -9.690 11.785 155 1HG2 ILE 15 1HG2 ILE 15 -13.037 -11.951 8.277 156 2HG2 ILE 15 2HG2 ILE 15 -13.834 -10.382 8.137 157 3HG2 ILE 15 3HG2 ILE 15 -14.716 -11.764 8.786 158 1HD1 ILE 15 1HD1 ILE 15 -14.824 -8.828 9.044 159 2HD1 ILE 15 2HD1 ILE 15 -13.496 -8.118 9.958 160 3HD1 ILE 15 3HD1 ILE 15 -15.149 -7.991 10.562 161 H SER 16 H SER 16 -13.521 -14.311 9.696 162 HA SER 16 HA SER 16 -10.752 -15.151 9.881 163 1HB SER 16 2HB SER 16 -13.247 -16.673 9.135 164 2HB SER 16 1HB SER 16 -11.636 -17.358 9.380 165 HG SER 16 HG SER 16 -13.356 -16.146 11.268 166 H GLN 17 H GLN 17 -10.342 -16.681 7.832 167 HA GLN 17 HA GLN 17 -9.929 -14.806 5.749 168 1HB GLN 17 2HB GLN 17 -8.860 -16.619 4.488 169 2HB GLN 17 1HB GLN 17 -8.259 -16.532 6.132 170 1HG GLN 17 2HG GLN 17 -9.554 -18.461 6.756 171 2HG GLN 17 1HG GLN 17 -10.324 -18.497 5.172 172 1HE2 GLN 17 1HE2 GLN 17 -7.358 -19.104 6.934 173 2HE2 GLN 17 2HE2 GLN 17 -6.624 -20.047 5.691 174 H SER 18 H SER 18 -12.460 -17.314 6.274 175 HA SER 18 HA SER 18 -13.254 -17.636 3.692 176 1HB SER 18 2HB SER 18 -14.988 -17.734 6.124 177 2HB SER 18 1HB SER 18 -14.925 -18.835 4.742 178 HG SER 18 HG SER 18 -12.932 -19.630 5.489 179 H GLU 19 H GLU 19 -14.508 -15.509 6.323 180 HA GLU 19 HA GLU 19 -16.523 -14.325 4.791 181 1HB GLU 19 2HB GLU 19 -15.103 -13.021 7.121 182 2HB GLU 19 1HB GLU 19 -16.676 -12.592 6.485 183 1HG GLU 19 2HG GLU 19 -17.180 -13.769 8.398 184 2HG GLU 19 1HG GLU 19 -17.342 -14.993 7.139 185 H LEU 20 H LEU 20 -13.217 -13.329 5.447 186 HA LEU 20 HA LEU 20 -13.379 -10.891 4.095 187 1HB LEU 20 2HB LEU 20 -11.013 -12.632 4.708 188 2HB LEU 20 1HB LEU 20 -10.869 -11.083 3.904 189 HG LEU 20 HG LEU 20 -11.990 -11.509 6.676 190 1HD1 LEU 20 1HD1 LEU 20 -9.374 -10.343 5.751 191 2HD1 LEU 20 2HD1 LEU 20 -9.585 -11.894 6.561 192 3HD1 LEU 20 3HD1 LEU 20 -9.952 -10.396 7.415 193 1HD2 LEU 20 1HD2 LEU 20 -11.409 -8.976 5.139 194 2HD2 LEU 20 2HD2 LEU 20 -11.929 -9.063 6.822 195 3HD2 LEU 20 3HD2 LEU 20 -13.009 -9.602 5.535 196 H ALA 21 H ALA 21 -12.475 -14.107 2.925 197 HA ALA 21 HA ALA 21 -11.625 -13.312 0.390 198 1HB ALA 21 1HB ALA 21 -12.033 -15.606 -0.306 199 2HB ALA 21 2HB ALA 21 -13.007 -15.882 1.139 200 3HB ALA 21 3HB ALA 21 -11.278 -15.565 1.289 201 H ALA 22 H ALA 22 -14.891 -14.216 1.523 202 HA ALA 22 HA ALA 22 -16.106 -13.851 -0.980 203 1HB ALA 22 1HB ALA 22 -17.290 -13.734 1.786 204 2HB ALA 22 2HB ALA 22 -17.080 -15.189 0.811 205 3HB ALA 22 3HB ALA 22 -18.188 -13.922 0.281 206 H LEU 23 H LEU 23 -15.726 -11.728 1.829 207 HA LEU 23 HA LEU 23 -17.351 -9.625 0.872 208 1HB LEU 23 2HB LEU 23 -16.816 -9.941 3.228 209 2HB LEU 23 1HB LEU 23 -15.128 -9.621 2.905 210 HG LEU 23 HG LEU 23 -15.689 -7.290 2.336 211 1HD1 LEU 23 1HD1 LEU 23 -17.973 -7.633 1.548 212 2HD1 LEU 23 2HD1 LEU 23 -17.912 -6.417 2.827 213 3HD1 LEU 23 3HD1 LEU 23 -18.480 -8.046 3.187 214 1HD2 LEU 23 1HD2 LEU 23 -16.718 -8.213 5.014 215 2HD2 LEU 23 2HD2 LEU 23 -16.220 -6.569 4.610 216 3HD2 LEU 23 3HD2 LEU 23 -15.036 -7.876 4.607 217 H LEU 24 H LEU 24 -13.894 -10.255 0.601 218 HA LEU 24 HA LEU 24 -13.333 -7.692 -0.618 219 1HB LEU 24 2HB LEU 24 -11.585 -10.113 -0.312 220 2HB LEU 24 1HB LEU 24 -11.062 -8.496 -0.731 221 HG LEU 24 HG LEU 24 -12.261 -9.297 1.911 222 1HD1 LEU 24 1HD1 LEU 24 -9.407 -8.763 1.141 223 2HD1 LEU 24 2HD1 LEU 24 -10.104 -10.332 1.548 224 3HD1 LEU 24 3HD1 LEU 24 -10.001 -9.068 2.773 225 1HD2 LEU 24 1HD2 LEU 24 -12.643 -6.964 1.353 226 2HD2 LEU 24 2HD2 LEU 24 -10.925 -6.750 1.024 227 3HD2 LEU 24 3HD2 LEU 24 -11.474 -7.121 2.661 228 H GLU 25 H GLU 25 -14.685 -10.495 -1.709 229 HA GLU 25 HA GLU 25 -15.073 -11.467 -3.729 230 1HB GLU 25 2HB GLU 25 -13.900 -8.897 -4.830 231 2HB GLU 25 1HB GLU 25 -14.828 -10.074 -5.748 232 1HG GLU 25 2HG GLU 25 -16.796 -9.586 -4.462 233 2HG GLU 25 1HG GLU 25 -15.878 -8.512 -3.404 234 H VAL 26 H VAL 26 -12.599 -12.053 -2.377 235 HA VAL 26 HA VAL 26 -10.799 -12.424 -4.642 236 HB VAL 26 HB VAL 26 -8.904 -12.418 -3.091 237 1HG1 VAL 26 1HG1 VAL 26 -8.827 -10.029 -2.573 238 2HG1 VAL 26 2HG1 VAL 26 -10.557 -9.914 -2.913 239 3HG1 VAL 26 3HG1 VAL 26 -9.431 -10.349 -4.199 240 1HG2 VAL 26 1HG2 VAL 26 -9.178 -11.595 -0.763 241 2HG2 VAL 26 2HG2 VAL 26 -9.959 -13.146 -1.052 242 3HG2 VAL 26 3HG2 VAL 26 -10.933 -11.679 -0.975 243 H SER 27 H SER 27 -9.207 -14.157 -4.010 244 HA SER 27 HA SER 27 -10.693 -16.557 -3.352 245 1HB SER 27 2HB SER 27 -7.897 -16.145 -4.417 246 2HB SER 27 1HB SER 27 -8.703 -17.706 -4.242 247 HG SER 27 HG SER 27 -9.488 -15.538 -5.924 248 H ARG 28 H ARG 28 -10.096 -18.005 -1.720 249 HA ARG 28 HA ARG 28 -9.196 -16.839 0.679 250 1HB ARG 28 2HB ARG 28 -9.556 -19.760 0.020 251 2HB ARG 28 1HB ARG 28 -9.244 -19.139 1.633 252 1HG ARG 28 2HG ARG 28 -11.327 -17.815 1.479 253 2HG ARG 28 1HG ARG 28 -11.646 -18.572 -0.081 254 1HD ARG 28 2HD ARG 28 -11.395 -19.978 2.575 255 2HD ARG 28 1HD ARG 28 -12.889 -19.673 1.693 256 HE ARG 28 HE ARG 28 -10.783 -21.568 0.977 257 1HH1 ARG 28 1HH1 ARG 28 -14.024 -20.230 0.278 258 2HH1 ARG 28 2HH1 ARG 28 -14.538 -21.591 -0.596 259 1HH2 ARG 28 1HH2 ARG 28 -11.518 -23.440 -0.232 260 2HH2 ARG 28 2HH2 ARG 28 -13.060 -23.440 -0.942 261 H GLN 29 H GLN 29 -7.509 -18.646 -1.731 262 HA GLN 29 HA GLN 29 -5.143 -19.169 -0.296 263 1HB GLN 29 2HB GLN 29 -5.640 -20.262 -2.435 264 2HB GLN 29 1HB GLN 29 -5.528 -18.733 -3.270 265 1HG GLN 29 2HG GLN 29 -3.146 -19.831 -1.818 266 2HG GLN 29 1HG GLN 29 -3.590 -20.465 -3.395 267 1HE2 GLN 29 1HE2 GLN 29 -1.192 -19.073 -2.625 268 2HE2 GLN 29 2HE2 GLN 29 -1.081 -17.660 -3.602 269 H THR 30 H THR 30 -6.290 -16.263 -1.802 270 HA THR 30 HA THR 30 -3.823 -14.885 -1.728 271 HB THR 30 HB THR 30 -6.670 -13.857 -1.881 272 HG1 THR 30 1HG THR 30 -6.464 -14.071 -4.011 273 1HG2 THR 30 1HG2 THR 30 -4.064 -12.447 -2.528 274 2HG2 THR 30 2HG2 THR 30 -5.100 -12.094 -1.145 275 3HG2 THR 30 3HG2 THR 30 -5.681 -11.788 -2.785 276 H ILE 31 H ILE 31 -6.721 -14.806 0.402 277 HA ILE 31 HA ILE 31 -5.513 -13.015 2.212 278 HB ILE 31 HB ILE 31 -7.898 -13.051 2.157 279 1HG1 ILE 31 2HG1 ILE 31 -8.549 -13.441 4.540 280 2HG1 ILE 31 1HG1 ILE 31 -6.979 -14.191 4.801 281 1HG2 ILE 31 1HG2 ILE 31 -7.850 -15.932 2.963 282 2HG2 ILE 31 2HG2 ILE 31 -8.320 -15.269 1.400 283 3HG2 ILE 31 3HG2 ILE 31 -9.294 -14.928 2.832 284 1HD1 ILE 31 1HD1 ILE 31 -5.887 -12.080 4.230 285 2HD1 ILE 31 2HD1 ILE 31 -7.000 -11.900 5.587 286 3HD1 ILE 31 3HD1 ILE 31 -7.468 -11.339 3.982 287 H ASN 32 H ASN 32 -5.776 -16.539 2.272 288 HA ASN 32 HA ASN 32 -4.461 -16.938 4.747 289 1HB ASN 32 2HB ASN 32 -5.733 -18.732 3.650 290 2HB ASN 32 1HB ASN 32 -4.615 -18.723 2.296 291 1HD2 ASN 32 1HD2 ASN 32 -4.145 -20.901 2.576 292 2HD2 ASN 32 2HD2 ASN 32 -3.173 -21.482 3.865 293 H GLY 33 H GLY 33 -3.347 -16.565 1.464 294 1HA GLY 33 2HA GLY 33 -0.616 -17.121 1.865 295 2HA GLY 33 1HA GLY 33 -1.291 -16.179 0.543 296 H ILE 34 H ILE 34 -2.487 -14.150 2.210 297 HA ILE 34 HA ILE 34 -0.212 -12.505 2.632 298 HB ILE 34 HB ILE 34 -3.124 -11.980 3.333 299 1HG1 ILE 34 2HG1 ILE 34 -2.744 -12.212 0.930 300 2HG1 ILE 34 1HG1 ILE 34 -3.118 -10.540 1.334 301 1HG2 ILE 34 1HG2 ILE 34 -1.678 -10.593 4.732 302 2HG2 ILE 34 2HG2 ILE 34 -2.511 -9.606 3.530 303 3HG2 ILE 34 3HG2 ILE 34 -0.815 -10.035 3.297 304 1HD1 ILE 34 1HD1 ILE 34 -1.352 -10.679 -0.334 305 2HD1 ILE 34 2HD1 ILE 34 -0.378 -11.662 0.758 306 3HD1 ILE 34 3HD1 ILE 34 -0.734 -9.984 1.165 307 H GLU 35 H GLU 35 -2.402 -14.236 4.841 308 HA GLU 35 HA GLU 35 -1.540 -13.274 7.300 309 1HB GLU 35 2HB GLU 35 -2.246 -16.094 6.550 310 2HB GLU 35 1HB GLU 35 -2.006 -15.552 8.193 311 1HG GLU 35 2HG GLU 35 -3.920 -14.040 7.931 312 2HG GLU 35 1HG GLU 35 -4.157 -14.679 6.296 313 H LYS 36 H LYS 36 -0.078 -15.669 5.247 314 HA LYS 36 HA LYS 36 2.087 -16.009 7.197 315 1HB LYS 36 2HB LYS 36 1.169 -17.768 4.929 316 2HB LYS 36 1HB LYS 36 2.630 -18.064 5.860 317 1HG LYS 36 2HG LYS 36 -0.168 -17.968 6.982 318 2HG LYS 36 1HG LYS 36 0.760 -19.431 6.645 319 1HD LYS 36 2HD LYS 36 1.574 -17.259 8.586 320 2HD LYS 36 1HD LYS 36 0.847 -18.805 9.032 321 1HE LYS 36 2HE LYS 36 2.749 -19.991 8.094 322 2HE LYS 36 1HE LYS 36 3.448 -18.474 7.544 323 1HZ LYS 36 1HZ LYS 36 3.786 -17.801 9.792 324 2HZ LYS 36 2HZ LYS 36 4.428 -19.352 9.639 325 3HZ LYS 36 3HZ LYS 36 2.936 -19.107 10.397 326 H ASN 37 H ASN 37 1.467 -14.053 4.877 327 HA ASN 37 HA ASN 37 2.425 -12.991 3.169 328 1HB ASN 37 2HB ASN 37 4.423 -11.706 3.670 329 2HB ASN 37 1HB ASN 37 3.470 -11.846 5.129 330 1HD2 ASN 37 1HD2 ASN 37 6.334 -11.241 4.630 331 2HD2 ASN 37 2HD2 ASN 37 7.203 -12.394 5.573 332 H LYS 38 H LYS 38 2.360 -15.489 2.507 333 HA LYS 38 HA LYS 38 4.965 -16.372 1.492 334 1HB LYS 38 2HB LYS 38 3.503 -17.957 2.752 335 2HB LYS 38 1HB LYS 38 2.239 -17.707 1.564 336 1HG LYS 38 2HG LYS 38 3.700 -18.708 -0.156 337 2HG LYS 38 1HG LYS 38 4.919 -19.007 1.086 338 1HD LYS 38 2HD LYS 38 3.647 -21.033 0.729 339 2HD LYS 38 1HD LYS 38 3.249 -20.382 2.321 340 1HE LYS 38 2HE LYS 38 1.221 -19.331 1.307 341 2HE LYS 38 1HE LYS 38 1.604 -20.143 -0.205 342 1HZ LYS 38 1HZ LYS 38 0.948 -21.422 2.384 343 2HZ LYS 38 2HZ LYS 38 1.436 -22.287 1.035 344 3HZ LYS 38 3HZ LYS 38 -0.024 -21.420 0.999 345 H TYR 39 H TYR 39 1.916 -14.988 0.720 346 HA TYR 39 HA TYR 39 1.882 -15.437 -2.104 347 1HB TYR 39 2HB TYR 39 -0.049 -15.171 -0.472 348 2HB TYR 39 1HB TYR 39 0.381 -13.481 -0.359 349 HD1 TYR 39 1HD TYR 39 -1.095 -16.087 -2.383 350 HD2 TYR 39 2HD TYR 39 -0.169 -11.947 -2.212 351 HE1 TYR 39 1HE TYR 39 -2.670 -15.668 -4.208 352 HE2 TYR 39 2HE TYR 39 -1.744 -11.512 -4.056 353 HH TYR 39 HH TYR 39 -3.999 -13.852 -4.976 354 H ASN 40 H ASN 40 3.489 -13.439 0.049 355 HA ASN 40 HA ASN 40 4.621 -11.529 0.091 356 1HB ASN 40 2HB ASN 40 5.728 -12.253 -2.019 357 2HB ASN 40 1HB ASN 40 4.425 -11.528 -2.954 358 1HD2 ASN 40 1HD2 ASN 40 7.156 -10.892 -0.880 359 2HD2 ASN 40 2HD2 ASN 40 7.401 -9.249 -1.352 360 HA PRO 41 HA PRO 41 1.207 -8.991 0.722 361 1HB PRO 41 2HB PRO 41 3.138 -6.881 1.446 362 2HB PRO 41 1HB PRO 41 1.865 -7.631 2.415 363 1HG PRO 41 2HG PRO 41 4.446 -8.191 2.849 364 2HG PRO 41 1HG PRO 41 3.186 -9.427 3.012 365 1HD PRO 41 2HD PRO 41 5.102 -8.969 0.757 366 2HD PRO 41 1HD PRO 41 4.578 -10.495 1.494 367 H SER 42 H SER 42 0.647 -8.808 -1.495 368 HA SER 42 HA SER 42 1.373 -6.463 -2.947 369 1HB SER 42 2HB SER 42 -1.076 -8.251 -3.198 370 2HB SER 42 1HB SER 42 -0.447 -7.151 -4.430 371 HG SER 42 HG SER 42 1.582 -8.529 -3.979 372 H LEU 43 H LEU 43 0.491 -4.447 -2.593 373 HA LEU 43 HA LEU 43 -0.787 -4.285 -0.045 374 1HB LEU 43 2HB LEU 43 1.148 -2.840 -0.742 375 2HB LEU 43 1HB LEU 43 0.062 -2.008 -1.818 376 HG LEU 43 HG LEU 43 0.614 -0.788 0.299 377 1HD1 LEU 43 1HD1 LEU 43 -1.627 -0.008 0.835 378 2HD1 LEU 43 2HD1 LEU 43 -2.311 -1.368 -0.053 379 3HD1 LEU 43 3HD1 LEU 43 -1.376 -0.141 -0.906 380 1HD2 LEU 43 1HD2 LEU 43 -0.474 -1.466 2.387 381 2HD2 LEU 43 2HD2 LEU 43 0.697 -2.662 1.825 382 3HD2 LEU 43 3HD2 LEU 43 -1.028 -2.947 1.604 383 H GLN 44 H GLN 44 -1.989 -3.958 -3.483 384 HA GLN 44 HA GLN 44 -4.190 -2.444 -2.862 385 1HB GLN 44 2HB GLN 44 -3.285 -2.945 -5.117 386 2HB GLN 44 1HB GLN 44 -3.770 -4.619 -4.914 387 1HG GLN 44 2HG GLN 44 -6.120 -3.879 -4.748 388 2HG GLN 44 1HG GLN 44 -5.585 -2.228 -5.078 389 1HE2 GLN 44 1HE2 GLN 44 -7.373 -3.917 -6.619 390 2HE2 GLN 44 2HE2 GLN 44 -6.628 -4.061 -8.185 391 H LEU 45 H LEU 45 -3.732 -5.957 -3.103 392 HA LEU 45 HA LEU 45 -6.269 -6.748 -2.262 393 1HB LEU 45 2HB LEU 45 -3.623 -8.184 -1.942 394 2HB LEU 45 1HB LEU 45 -5.163 -8.913 -1.559 395 HG LEU 45 HG LEU 45 -4.492 -9.764 -3.644 396 1HD1 LEU 45 1HD1 LEU 45 -6.580 -7.674 -4.124 397 2HD1 LEU 45 2HD1 LEU 45 -6.824 -9.311 -3.519 398 3HD1 LEU 45 3HD1 LEU 45 -6.255 -9.056 -5.170 399 1HD2 LEU 45 1HD2 LEU 45 -2.822 -8.108 -4.290 400 2HD2 LEU 45 2HD2 LEU 45 -4.094 -6.933 -4.626 401 3HD2 LEU 45 3HD2 LEU 45 -3.956 -8.388 -5.612 402 H ALA 46 H ALA 46 -3.533 -5.805 -0.547 403 HA ALA 46 HA ALA 46 -4.390 -6.631 2.080 404 1HB ALA 46 1HB ALA 46 -2.008 -6.365 1.588 405 2HB ALA 46 2HB ALA 46 -2.496 -5.330 2.931 406 3HB ALA 46 3HB ALA 46 -2.252 -4.638 1.327 407 H LEU 47 H LEU 47 -4.591 -3.674 0.171 408 HA LEU 47 HA LEU 47 -5.366 -1.935 2.204 409 1HB LEU 47 2HB LEU 47 -4.333 -1.226 0.091 410 2HB LEU 47 1HB LEU 47 -5.707 -1.821 -0.800 411 HG LEU 47 HG LEU 47 -5.493 0.700 -0.523 412 1HD1 LEU 47 1HD1 LEU 47 -7.877 1.085 -0.225 413 2HD1 LEU 47 2HD1 LEU 47 -8.070 -0.541 0.426 414 3HD1 LEU 47 3HD1 LEU 47 -7.585 -0.318 -1.256 415 1HD2 LEU 47 1HD2 LEU 47 -6.381 0.039 2.278 416 2HD2 LEU 47 2HD2 LEU 47 -6.303 1.657 1.577 417 3HD2 LEU 47 3HD2 LEU 47 -4.823 0.723 1.809 418 H LYS 48 H LYS 48 -7.206 -3.860 -0.138 419 HA LYS 48 HA LYS 48 -9.658 -2.801 0.789 420 1HB LYS 48 2HB LYS 48 -10.815 -4.765 -0.273 421 2HB LYS 48 1HB LYS 48 -9.778 -3.857 -1.353 422 1HG LYS 48 2HG LYS 48 -8.118 -5.578 -1.297 423 2HG LYS 48 1HG LYS 48 -8.988 -6.438 -0.023 424 1HD LYS 48 2HD LYS 48 -9.360 -7.472 -2.227 425 2HD LYS 48 1HD LYS 48 -10.853 -6.840 -1.540 426 1HE LYS 48 2HE LYS 48 -10.609 -4.824 -2.956 427 2HE LYS 48 1HE LYS 48 -9.162 -5.531 -3.673 428 1HZ LYS 48 1HZ LYS 48 -11.906 -6.681 -3.811 429 2HZ LYS 48 2HZ LYS 48 -10.505 -7.343 -4.537 430 3HZ LYS 48 3HZ LYS 48 -11.100 -5.879 -5.053 431 H ILE 49 H ILE 49 -7.805 -5.540 1.848 432 HA ILE 49 HA ILE 49 -9.576 -6.510 3.815 433 HB ILE 49 HB ILE 49 -6.557 -6.362 4.194 434 1HG1 ILE 49 2HG1 ILE 49 -8.121 -8.572 2.846 435 2HG1 ILE 49 1HG1 ILE 49 -7.163 -7.374 1.988 436 1HG2 ILE 49 1HG2 ILE 49 -8.633 -8.287 5.247 437 2HG2 ILE 49 2HG2 ILE 49 -7.822 -7.020 6.168 438 3HG2 ILE 49 3HG2 ILE 49 -6.896 -8.387 5.546 439 1HD1 ILE 49 1HD1 ILE 49 -6.118 -9.406 3.952 440 2HD1 ILE 49 2HD1 ILE 49 -5.149 -8.206 3.094 441 3HD1 ILE 49 3HD1 ILE 49 -5.974 -9.479 2.194 442 H ALA 50 H ALA 50 -7.188 -3.974 3.879 443 HA ALA 50 HA ALA 50 -7.289 -3.256 6.628 444 1HB ALA 50 1HB ALA 50 -6.535 -1.588 4.246 445 2HB ALA 50 2HB ALA 50 -5.440 -2.638 5.149 446 3HB ALA 50 3HB ALA 50 -6.151 -1.217 5.927 447 H TYR 51 H TYR 51 -8.937 -2.110 3.779 448 HA TYR 51 HA TYR 51 -10.344 -0.015 5.012 449 1HB TYR 51 2HB TYR 51 -10.005 0.175 2.711 450 2HB TYR 51 1HB TYR 51 -10.519 -1.470 2.398 451 HD1 TYR 51 1HD TYR 51 -12.470 -1.755 1.398 452 HD2 TYR 51 2HD TYR 51 -11.975 1.748 3.725 453 HE1 TYR 51 1HE TYR 51 -14.702 -0.993 0.693 454 HE2 TYR 51 2HE TYR 51 -14.211 2.536 3.033 455 HH TYR 51 HH TYR 51 -16.373 0.427 1.233 456 H TYR 52 H TYR 52 -11.276 -3.356 4.195 457 HA TYR 52 HA TYR 52 -13.850 -2.940 5.342 458 1HB TYR 52 2HB TYR 52 -12.538 -5.430 4.318 459 2HB TYR 52 1HB TYR 52 -14.097 -5.492 5.147 460 HD1 TYR 52 1HD TYR 52 -15.937 -3.978 4.289 461 HD2 TYR 52 2HD TYR 52 -12.467 -4.877 2.034 462 HE1 TYR 52 1HE TYR 52 -17.089 -3.272 2.255 463 HE2 TYR 52 2HE TYR 52 -13.600 -4.180 -0.015 464 HH TYR 52 HH TYR 52 -16.469 -2.395 0.098 465 H LEU 53 H LEU 53 -10.972 -4.195 6.600 466 HA LEU 53 HA LEU 53 -12.179 -4.850 9.175 467 1HB LEU 53 2HB LEU 53 -9.255 -4.490 8.477 468 2HB LEU 53 1HB LEU 53 -9.837 -5.013 10.044 469 1HD1 LEU 53 1HD1 LEU 53 -8.576 -8.097 8.447 470 2HD1 LEU 53 2HD1 LEU 53 -8.391 -7.027 9.833 471 3HD1 LEU 53 3HD1 LEU 53 -7.864 -6.498 8.236 472 1HD2 LEU 53 1HD2 LEU 53 -10.970 -8.352 8.880 473 2HD2 LEU 53 2HD2 LEU 53 -12.017 -6.937 8.992 474 3HD2 LEU 53 3HD2 LEU 53 -10.874 -7.294 10.287 475 H ASN 54 H ASN 54 -11.492 -2.137 7.600 476 HA ASN 54 HA ASN 54 -11.019 0.003 7.938 477 1HB ASN 54 2HB ASN 54 -13.426 -0.222 8.602 478 2HB ASN 54 1HB ASN 54 -12.912 -0.285 10.279 479 1HD2 ASN 54 1HD2 ASN 54 -11.413 1.787 7.829 480 2HD2 ASN 54 2HD2 ASN 54 -11.964 3.266 8.490 481 H THR 55 H THR 55 -8.883 -0.680 8.476 482 HA THR 55 HA THR 55 -8.070 0.434 11.048 483 HB THR 55 HB THR 55 -6.917 -2.078 9.767 484 HG1 THR 55 1HG THR 55 -9.115 -1.738 11.265 485 1HG2 THR 55 1HG2 THR 55 -5.786 -2.360 11.929 486 2HG2 THR 55 2HG2 THR 55 -6.507 -0.853 12.503 487 3HG2 THR 55 3HG2 THR 55 -5.342 -0.827 11.179 488 HA PRO 56 HA PRO 56 -5.474 2.739 8.165 489 1HB PRO 56 2HB PRO 56 -3.441 3.356 9.947 490 2HB PRO 56 1HB PRO 56 -4.932 4.285 9.772 491 1HG PRO 56 2HG PRO 56 -4.204 2.219 11.797 492 2HG PRO 56 1HG PRO 56 -5.122 3.725 12.004 493 1HD PRO 56 2HD PRO 56 -6.318 1.322 11.893 494 2HD PRO 56 1HD PRO 56 -7.082 2.782 11.222 495 H LEU 57 H LEU 57 -3.785 2.263 6.876 496 HA LEU 57 HA LEU 57 -2.731 -0.299 6.697 497 1HB LEU 57 2HB LEU 57 -1.672 2.301 5.608 498 2HB LEU 57 1HB LEU 57 -1.062 0.724 5.141 499 1HD1 LEU 57 1HD1 LEU 57 -2.303 2.880 3.311 500 2HD1 LEU 57 2HD1 LEU 57 -3.283 1.765 2.359 501 3HD1 LEU 57 3HD1 LEU 57 -1.618 1.349 2.767 502 1HD2 LEU 57 1HD2 LEU 57 -4.087 -0.360 3.376 503 2HD2 LEU 57 2HD2 LEU 57 -3.657 -0.716 5.058 504 3HD2 LEU 57 3HD2 LEU 57 -2.422 -0.788 3.804 505 H GLU 58 H GLU 58 -1.307 2.605 8.086 506 HA GLU 58 HA GLU 58 1.178 1.786 8.765 507 1HB GLU 58 2HB GLU 58 -0.707 3.574 10.271 508 2HB GLU 58 1HB GLU 58 1.046 3.571 10.411 509 1HG GLU 58 2HG GLU 58 1.318 4.384 8.214 510 2HG GLU 58 1HG GLU 58 -0.374 4.102 7.816 511 H ASP 59 H ASP 59 -1.822 1.237 10.566 512 HA ASP 59 HA ASP 59 -0.508 0.151 12.879 513 1HB ASP 59 2HB ASP 59 -2.789 1.114 13.035 514 2HB ASP 59 1HB ASP 59 -3.404 -0.193 12.032 515 H ILE 60 H ILE 60 -1.738 -1.073 9.974 516 HA ILE 60 HA ILE 60 -1.689 -3.849 10.759 517 HB ILE 60 HB ILE 60 -2.109 -2.719 7.972 518 1HG1 ILE 60 2HG1 ILE 60 -4.071 -3.686 10.066 519 2HG1 ILE 60 1HG1 ILE 60 -3.835 -2.017 9.568 520 1HG2 ILE 60 1HG2 ILE 60 -1.316 -5.041 7.938 521 2HG2 ILE 60 2HG2 ILE 60 -3.013 -4.956 7.464 522 3HG2 ILE 60 3HG2 ILE 60 -2.577 -5.497 9.084 523 1HD1 ILE 60 1HD1 ILE 60 -4.647 -2.577 7.339 524 2HD1 ILE 60 2HD1 ILE 60 -5.833 -2.966 8.584 525 3HD1 ILE 60 3HD1 ILE 60 -4.875 -4.250 7.845 526 H PHE 61 H PHE 61 0.270 -1.804 8.643 527 HA PHE 61 HA PHE 61 2.335 -3.926 8.673 528 1HB PHE 61 2HB PHE 61 1.817 -1.877 6.516 529 2HB PHE 61 1HB PHE 61 3.103 -3.065 6.519 530 HD1 PHE 61 1HD PHE 61 2.602 -5.415 6.085 531 HD2 PHE 61 2HD PHE 61 -0.420 -2.429 5.928 532 HE1 PHE 61 1HE PHE 61 1.147 -6.954 4.828 533 HE2 PHE 61 2HE PHE 61 -1.880 -3.962 4.684 534 HZ PHE 61 HZ PHE 61 -1.093 -6.231 4.129 535 H GLN 62 H GLN 62 4.312 -3.329 9.279 536 HA GLN 62 HA GLN 62 4.883 -0.463 9.462 537 1HB GLN 62 2HB GLN 62 6.229 -2.774 10.902 538 2HB GLN 62 1HB GLN 62 6.912 -1.161 10.848 539 1HG GLN 62 2HG GLN 62 5.869 -1.336 12.935 540 2HG GLN 62 1HG GLN 62 4.781 -0.366 11.951 541 1HE2 GLN 62 1HE2 GLN 62 3.036 -0.841 13.243 542 2HE2 GLN 62 2HE2 GLN 62 2.258 -2.369 13.225 543 H TRP 63 H TRP 63 6.226 0.330 8.030 544 HA TRP 63 HA TRP 63 7.582 -1.629 6.382 545 1HB TRP 63 2HB TRP 63 7.675 0.287 4.669 546 2HB TRP 63 1HB TRP 63 6.165 -0.549 4.924 547 HD1 TRP 63 HD TRP 63 7.815 2.870 5.574 548 HE1 TRP 63 1HE TRP 63 5.925 4.575 6.078 549 HE3 TRP 63 3HE TRP 63 3.836 -0.335 5.809 550 HZ2 TRP 63 2HZ TRP 63 3.157 4.549 6.497 551 HZ3 TRP 63 3HZ TRP 63 1.605 0.586 6.255 552 HH2 TRP 63 HH TRP 63 1.276 2.974 6.592 553 H GLN 64 H GLN 64 9.599 -1.888 6.578 554 HA GLN 64 HA GLN 64 11.258 0.304 7.539 555 1HB GLN 64 2HB GLN 64 11.892 -2.634 7.274 556 2HB GLN 64 1HB GLN 64 12.731 -1.435 8.240 557 1HG GLN 64 2HG GLN 64 9.924 -2.356 8.802 558 2HG GLN 64 1HG GLN 64 11.353 -3.093 9.508 559 1HE2 GLN 64 1HE2 GLN 64 12.475 -2.003 11.012 560 2HE2 GLN 64 2HE2 GLN 64 11.847 -0.638 11.873 561 HA PRO 65 HA PRO 65 12.467 0.162 3.103 562 1HB PRO 65 2HB PRO 65 14.342 2.299 3.896 563 2HB PRO 65 1HB PRO 65 12.999 2.364 2.750 564 1HG PRO 65 2HG PRO 65 12.835 3.633 5.092 565 2HG PRO 65 1HG PRO 65 11.428 2.794 4.407 566 1HD PRO 65 2HD PRO 65 13.346 1.822 6.506 567 2HD PRO 65 1HD PRO 65 11.566 1.848 6.545 568 H GLU 66 H GLU 66 13.627 -1.554 5.006 569 HA GLU 66 HA GLU 66 16.522 -1.525 4.582 570 1HB GLU 66 2HB GLU 66 14.848 -3.343 6.328 571 2HB GLU 66 1HB GLU 66 16.596 -3.203 6.333 572 1HG GLU 66 2HG GLU 66 14.648 -1.072 7.187 573 2HG GLU 66 1HG GLU 66 15.609 -2.094 8.254 574 1H MET 67 1HT MET 67 -12.833 1.103 -8.292 575 2H MET 67 2HT MET 67 -12.582 2.146 -6.994 576 3H MET 67 3HT MET 67 -11.385 1.066 -7.420 577 HA MET 67 HA MET 67 -11.099 2.185 -9.555 578 1HB MET 67 2HB MET 67 -12.971 4.208 -8.288 579 2HB MET 67 1HB MET 67 -12.048 4.470 -9.759 580 1HG MET 67 2HG MET 67 -14.220 2.427 -9.366 581 2HG MET 67 1HG MET 67 -14.361 3.946 -10.252 582 1HE MET 67 1HE MET 67 -15.306 2.625 -12.358 583 2HE MET 67 2HE MET 67 -15.164 1.112 -11.465 584 3HE MET 67 3HE MET 67 -14.488 1.242 -13.089 585 H ILE 68 H ILE 68 -9.175 3.171 -9.516 586 HA ILE 68 HA ILE 68 -8.290 4.263 -6.932 587 HB ILE 68 HB ILE 68 -6.635 3.136 -9.220 588 1HG1 ILE 68 2HG1 ILE 68 -7.880 1.369 -8.061 589 2HG1 ILE 68 1HG1 ILE 68 -6.157 1.225 -7.751 590 1HG2 ILE 68 1HG2 ILE 68 -5.400 4.842 -8.014 591 2HG2 ILE 68 2HG2 ILE 68 -4.721 3.247 -7.679 592 3HG2 ILE 68 3HG2 ILE 68 -5.744 4.040 -6.481 593 1HD1 ILE 68 1HD1 ILE 68 -6.479 2.233 -5.543 594 2HD1 ILE 68 2HD1 ILE 68 -7.464 0.784 -5.750 595 3HD1 ILE 68 3HD1 ILE 68 -8.205 2.380 -5.866 596 H ILE 69 H ILE 69 -7.557 6.352 -6.857 597 HA ILE 69 HA ILE 69 -7.184 7.811 -9.363 598 HB ILE 69 HB ILE 69 -8.264 8.932 -6.726 599 1HG1 ILE 69 2HG1 ILE 69 -10.308 9.570 -8.170 600 2HG1 ILE 69 1HG1 ILE 69 -9.712 8.396 -9.332 601 1HG2 ILE 69 1HG2 ILE 69 -6.872 10.543 -7.846 602 2HG2 ILE 69 2HG2 ILE 69 -8.560 11.048 -7.932 603 3HG2 ILE 69 3HG2 ILE 69 -7.782 10.334 -9.344 604 1HD1 ILE 69 1HD1 ILE 69 -9.942 6.636 -7.644 605 2HD1 ILE 69 2HD1 ILE 69 -11.470 7.464 -7.945 606 3HD1 ILE 69 3HD1 ILE 69 -10.543 7.827 -6.491 607 H ASN 70 H ASN 70 -5.070 8.588 -9.471 608 HA ASN 70 HA ASN 70 -3.455 8.178 -7.098 609 1HB ASN 70 2HB ASN 70 -2.820 7.026 -9.145 610 2HB ASN 70 1HB ASN 70 -2.790 8.546 -10.019 611 1HD2 ASN 70 1HD2 ASN 70 -0.681 8.227 -10.619 612 2HD2 ASN 70 2HD2 ASN 70 0.635 8.368 -9.517 613 H ASN 71 H ASN 71 -2.345 9.829 -6.098 614 HA ASN 71 HA ASN 71 -2.544 12.561 -7.212 615 1HB ASN 71 2HB ASN 71 -2.634 11.714 -4.299 616 2HB ASN 71 1HB ASN 71 -2.557 13.367 -4.864 617 1HD2 ASN 71 1HD2 ASN 71 -4.430 12.013 -3.171 618 2HD2 ASN 71 2HD2 ASN 71 -5.990 12.232 -3.868 619 H LEU 72 H LEU 72 -0.437 10.211 -7.081 620 HA LEU 72 HA LEU 72 1.586 10.547 -5.322 621 1HB LEU 72 2HB LEU 72 1.300 8.836 -7.184 622 2HB LEU 72 1HB LEU 72 1.992 10.011 -8.270 623 HG LEU 72 HG LEU 72 3.556 8.213 -7.582 624 1HD1 LEU 72 1HD1 LEU 72 4.510 10.301 -8.323 625 2HD1 LEU 72 2HD1 LEU 72 5.493 9.579 -7.047 626 3HD1 LEU 72 3HD1 LEU 72 4.434 10.942 -6.680 627 1HD2 LEU 72 1HD2 LEU 72 4.492 8.212 -5.327 628 2HD2 LEU 72 2HD2 LEU 72 2.765 7.849 -5.331 629 3HD2 LEU 72 3HD2 LEU 72 3.329 9.451 -4.856 630 H LYS 73 H LYS 73 1.318 12.283 -8.419 631 HA LYS 73 HA LYS 73 3.668 13.759 -8.097 632 1HB LYS 73 2HB LYS 73 2.822 15.318 -9.829 633 2HB LYS 73 1HB LYS 73 2.675 13.635 -10.297 634 1HG LYS 73 2HG LYS 73 0.285 13.705 -9.738 635 2HG LYS 73 1HG LYS 73 0.457 15.397 -9.281 636 1HD LYS 73 2HD LYS 73 1.190 14.432 -12.039 637 2HD LYS 73 1HD LYS 73 -0.473 14.827 -11.622 638 1HE LYS 73 2HE LYS 73 0.555 16.727 -12.717 639 2HE LYS 73 1HE LYS 73 0.263 17.120 -11.032 640 1HZ LYS 73 1HZ LYS 73 2.403 17.886 -11.902 641 2HZ LYS 73 2HZ LYS 73 2.929 16.283 -12.091 642 3HZ LYS 73 3HZ LYS 73 2.575 16.917 -10.560 643 H LEU 74 H LEU 74 0.436 14.481 -6.984 644 HA LEU 74 HA LEU 74 0.893 17.189 -6.324 645 1HB LEU 74 2HB LEU 74 -1.334 15.965 -6.695 646 2HB LEU 74 1HB LEU 74 -1.158 15.350 -5.075 647 HG LEU 74 HG LEU 74 -2.759 17.238 -5.267 648 1HD1 LEU 74 1HD1 LEU 74 -1.751 16.862 -3.114 649 2HD1 LEU 74 2HD1 LEU 74 -1.977 18.588 -3.397 650 3HD1 LEU 74 3HD1 LEU 74 -0.374 17.869 -3.557 651 1HD2 LEU 74 1HD2 LEU 74 -0.332 18.863 -5.977 652 2HD2 LEU 74 2HD2 LEU 74 -1.931 19.511 -5.614 653 3HD2 LEU 74 3HD2 LEU 74 -1.693 18.488 -7.033 654 H ILE 75 H ILE 75 1.252 14.187 -4.514 655 HA ILE 75 HA ILE 75 1.801 15.450 -2.027 656 HB ILE 75 HB ILE 75 2.390 12.632 -2.976 657 1HG1 ILE 75 2HG1 ILE 75 0.857 12.011 -1.124 658 2HG1 ILE 75 1HG1 ILE 75 0.656 13.712 -0.741 659 1HG2 ILE 75 1HG2 ILE 75 4.277 13.188 -1.558 660 2HG2 ILE 75 2HG2 ILE 75 3.212 12.065 -0.705 661 3HG2 ILE 75 3HG2 ILE 75 3.197 13.786 -0.308 662 1HD1 ILE 75 1HD1 ILE 75 -1.245 12.833 -1.949 663 2HD1 ILE 75 2HD1 ILE 75 -0.196 12.352 -3.283 664 3HD1 ILE 75 3HD1 ILE 75 -0.413 14.058 -2.906 665 H ARG 76 H ARG 76 3.827 14.519 -4.653 666 HA ARG 76 HA ARG 76 6.409 15.050 -3.485 667 1HB ARG 76 2HB ARG 76 5.733 15.716 -6.315 668 2HB ARG 76 1HB ARG 76 7.266 15.211 -5.648 669 1HG ARG 76 2HG ARG 76 6.496 12.960 -5.468 670 2HG ARG 76 1HG ARG 76 4.856 13.446 -5.945 671 1HD ARG 76 2HD ARG 76 7.364 13.559 -7.594 672 2HD ARG 76 1HD ARG 76 5.892 12.629 -7.912 673 HE ARG 76 HE ARG 76 4.929 15.103 -7.848 674 1HH1 ARG 76 1HH1 ARG 76 7.708 13.791 -9.595 675 2HH1 ARG 76 2HH1 ARG 76 7.625 14.942 -10.841 676 1HH2 ARG 76 1HH2 ARG 76 4.879 16.765 -9.547 677 2HH2 ARG 76 2HH2 ARG 76 6.095 16.680 -10.753 678 H GLU 77 H GLU 77 3.952 17.011 -5.140 679 HA GLU 77 HA GLU 77 5.450 19.315 -5.163 680 1HB GLU 77 2HB GLU 77 2.615 18.607 -5.849 681 2HB GLU 77 1HB GLU 77 3.321 20.212 -6.107 682 1HG GLU 77 2HG GLU 77 5.008 19.329 -7.560 683 2HG GLU 77 1HG GLU 77 4.588 17.707 -7.121 684 H LYS 78 H LYS 78 2.939 18.086 -2.946 685 HA LYS 78 HA LYS 78 2.774 20.265 -1.254 686 1HB LYS 78 2HB LYS 78 3.044 17.377 -0.374 687 2HB LYS 78 1HB LYS 78 2.543 18.689 0.670 688 1HG LYS 78 2HG LYS 78 0.600 18.999 -0.957 689 2HG LYS 78 1HG LYS 78 1.056 17.411 -1.596 690 1HD LYS 78 2HD LYS 78 0.858 16.448 0.649 691 2HD LYS 78 1HD LYS 78 0.415 18.026 1.291 692 1HE LYS 78 2HE LYS 78 -1.612 16.882 1.041 693 2HE LYS 78 1HE LYS 78 -1.533 17.956 -0.353 694 1HZ LYS 78 1HZ LYS 78 -2.239 15.848 -1.139 695 2HZ LYS 78 2HZ LYS 78 -1.144 15.052 -0.207 696 3HZ LYS 78 3HZ LYS 78 -0.594 15.915 -1.572 697 H LYS 79 H LYS 79 5.320 17.924 -1.482 698 HA LYS 79 HA LYS 79 7.067 19.436 0.371 699 1HB LYS 79 2HB LYS 79 7.777 17.010 -1.330 700 2HB LYS 79 1HB LYS 79 8.678 17.632 0.034 701 1HG LYS 79 2HG LYS 79 5.967 16.297 0.202 702 2HG LYS 79 1HG LYS 79 7.502 15.505 0.508 703 1HD LYS 79 2HD LYS 79 6.603 15.998 2.641 704 2HD LYS 79 1HD LYS 79 7.836 17.226 2.371 705 1HE LYS 79 2HE LYS 79 6.126 18.848 1.778 706 2HE LYS 79 1HE LYS 79 4.879 17.613 1.898 707 1HZ LYS 79 1HZ LYS 79 6.560 18.576 4.154 708 2HZ LYS 79 2HZ LYS 79 5.346 17.424 4.240 709 3HZ LYS 79 3HZ LYS 79 4.968 19.036 3.841 710 H LYS 80 H LYS 80 9.730 19.655 -1.327 711 HA LYS 80 HA LYS 80 8.550 19.962 -3.766 712 1HB LYS 80 2HB LYS 80 9.772 22.082 -4.127 713 2HB LYS 80 1HB LYS 80 8.527 22.239 -2.919 714 1HG LYS 80 2HG LYS 80 11.489 22.032 -2.373 715 2HG LYS 80 1HG LYS 80 10.538 23.510 -2.412 716 1HD LYS 80 2HD LYS 80 9.214 22.669 -0.511 717 2HD LYS 80 1HD LYS 80 10.253 21.240 -0.453 718 1HE LYS 80 2HE LYS 80 11.075 24.110 -0.023 719 2HE LYS 80 1HE LYS 80 11.032 22.825 1.180 720 1HZ LYS 80 1HZ LYS 80 12.847 22.938 -1.183 721 2HZ LYS 80 2HZ LYS 80 12.817 21.686 -0.042 722 3HZ LYS 80 3HZ LYS 80 13.276 23.228 0.414 723 H ILE 81 H ILE 81 9.323 17.982 -3.899 724 HA ILE 81 HA ILE 81 12.200 17.832 -4.400 725 HB ILE 81 HB ILE 81 10.337 15.724 -3.238 726 1HG1 ILE 81 2HG1 ILE 81 12.808 17.060 -2.120 727 2HG1 ILE 81 1HG1 ILE 81 11.149 17.357 -1.620 728 1HG2 ILE 81 1HG2 ILE 81 11.823 14.660 -4.840 729 2HG2 ILE 81 2HG2 ILE 81 12.237 14.201 -3.188 730 3HG2 ILE 81 3HG2 ILE 81 13.218 15.391 -4.043 731 1HD1 ILE 81 1HD1 ILE 81 12.663 14.775 -1.291 732 2HD1 ILE 81 2HD1 ILE 81 11.002 15.071 -0.779 733 3HD1 ILE 81 3HD1 ILE 81 12.326 15.956 -0.025 734 H SER 82 H SER 82 12.738 17.029 -6.361 735 HA SER 82 HA SER 82 10.632 16.846 -8.321 736 1HB SER 82 2HB SER 82 13.635 16.787 -8.605 737 2HB SER 82 1HB SER 82 12.476 16.931 -9.927 738 HG SER 82 HG SER 82 13.505 18.829 -8.399 739 H GLN 83 H GLN 83 10.987 15.176 -10.108 740 HA GLN 83 HA GLN 83 10.524 12.617 -9.064 741 1HB GLN 83 2HB GLN 83 10.580 11.801 -11.400 742 2HB GLN 83 1HB GLN 83 9.582 13.231 -11.211 743 1HG GLN 83 2HG GLN 83 11.373 14.606 -12.139 744 2HG GLN 83 1HG GLN 83 12.389 13.179 -12.300 745 1HE2 GLN 83 1HE2 GLN 83 11.950 11.716 -13.941 746 2HE2 GLN 83 2HE2 GLN 83 10.897 12.109 -15.248 747 H SER 84 H SER 84 13.545 13.925 -10.580 748 HA SER 84 HA SER 84 14.855 11.458 -10.468 749 1HB SER 84 2HB SER 84 15.987 14.250 -10.581 750 2HB SER 84 1HB SER 84 16.825 12.755 -11.026 751 HG SER 84 HG SER 84 15.196 14.268 -12.497 752 H GLU 85 H GLU 85 14.636 14.159 -8.209 753 HA GLU 85 HA GLU 85 16.521 13.293 -6.344 754 1HB GLU 85 2HB GLU 85 13.908 14.718 -5.839 755 2HB GLU 85 1HB GLU 85 15.235 14.598 -4.696 756 1HG GLU 85 2HG GLU 85 15.268 16.028 -7.339 757 2HG GLU 85 1HG GLU 85 15.168 16.767 -5.743 758 H LEU 86 H LEU 86 13.046 12.611 -6.615 759 HA LEU 86 HA LEU 86 12.863 10.864 -4.425 760 1HB LEU 86 2HB LEU 86 11.226 11.055 -6.936 761 2HB LEU 86 1HB LEU 86 10.844 9.954 -5.629 762 HG LEU 86 HG LEU 86 10.937 12.959 -5.386 763 1HD1 LEU 86 1HD1 LEU 86 9.099 12.188 -6.789 764 2HD1 LEU 86 2HD1 LEU 86 8.507 12.777 -5.234 765 3HD1 LEU 86 3HD1 LEU 86 8.618 11.043 -5.537 766 1HD2 LEU 86 1HD2 LEU 86 11.484 11.804 -3.304 767 2HD2 LEU 86 2HD2 LEU 86 10.033 10.813 -3.466 768 3HD2 LEU 86 3HD2 LEU 86 9.890 12.553 -3.209 769 H ALA 87 H ALA 87 13.632 10.313 -7.793 770 HA ALA 87 HA ALA 87 13.635 7.534 -7.821 771 1HB ALA 87 1HB ALA 87 15.456 9.404 -9.339 772 2HB ALA 87 2HB ALA 87 13.845 8.890 -9.844 773 3HB ALA 87 3HB ALA 87 15.154 7.711 -9.734 774 H ALA 88 H ALA 88 16.307 9.783 -7.076 775 HA ALA 88 HA ALA 88 18.190 7.802 -6.506 776 1HB ALA 88 1HB ALA 88 18.779 10.127 -6.988 777 2HB ALA 88 2HB ALA 88 19.468 9.592 -5.455 778 3HB ALA 88 3HB ALA 88 18.040 10.627 -5.468 779 H LEU 89 H LEU 89 15.878 9.487 -4.442 780 HA LEU 89 HA LEU 89 16.811 8.466 -1.987 781 1HB LEU 89 2HB LEU 89 14.066 9.435 -2.763 782 2HB LEU 89 1HB LEU 89 14.539 9.042 -1.125 783 HG LEU 89 HG LEU 89 15.733 11.241 -2.813 784 1HD1 LEU 89 1HD1 LEU 89 13.444 11.725 -2.139 785 2HD1 LEU 89 2HD1 LEU 89 14.586 12.745 -1.264 786 3HD1 LEU 89 3HD1 LEU 89 13.852 11.356 -0.463 787 1HD2 LEU 89 1HD2 LEU 89 16.852 11.919 -0.740 788 2HD2 LEU 89 2HD2 LEU 89 17.349 10.302 -1.237 789 3HD2 LEU 89 3HD2 LEU 89 16.194 10.502 0.080 790 H LEU 90 H LEU 90 14.429 7.212 -4.290 791 HA LEU 90 HA LEU 90 13.717 5.025 -2.531 792 1HB LEU 90 2HB LEU 90 13.006 5.364 -5.420 793 2HB LEU 90 1HB LEU 90 12.193 4.381 -4.229 794 HG LEU 90 HG LEU 90 12.206 7.384 -4.374 795 1HD1 LEU 90 1HD1 LEU 90 9.847 7.120 -4.919 796 2HD1 LEU 90 2HD1 LEU 90 10.049 5.370 -4.918 797 3HD1 LEU 90 3HD1 LEU 90 10.899 6.356 -6.109 798 1HD2 LEU 90 1HD2 LEU 90 12.092 6.652 -2.052 799 2HD2 LEU 90 2HD2 LEU 90 10.767 5.559 -2.451 800 3HD2 LEU 90 3HD2 LEU 90 10.540 7.302 -2.578 801 H GLU 91 H GLU 91 16.328 5.591 -4.534 802 HA GLU 91 HA GLU 91 17.857 4.398 -5.639 803 1HB GLU 91 2HB GLU 91 16.702 2.152 -3.976 804 2HB GLU 91 1HB GLU 91 18.088 1.925 -5.032 805 1HG GLU 91 2HG GLU 91 17.955 3.884 -2.751 806 2HG GLU 91 1HG GLU 91 18.704 2.289 -2.677 807 H VAL 92 H VAL 92 15.353 4.875 -6.887 808 HA VAL 92 HA VAL 92 15.152 2.539 -8.646 809 HB VAL 92 HB VAL 92 12.865 3.175 -9.213 810 1HG1 VAL 92 1HG1 VAL 92 11.717 2.667 -7.116 811 2HG1 VAL 92 2HG1 VAL 92 13.221 2.950 -6.236 812 3HG1 VAL 92 3HG1 VAL 92 13.112 1.623 -7.391 813 1HG2 VAL 92 1HG2 VAL 92 12.957 5.574 -8.951 814 2HG2 VAL 92 2HG2 VAL 92 13.201 5.419 -7.219 815 3HG2 VAL 92 3HG2 VAL 92 11.659 4.944 -7.935 816 H SER 93 H SER 93 14.453 3.242 -10.892 817 HA SER 93 HA SER 93 16.262 5.305 -11.666 818 1HB SER 93 2HB SER 93 14.415 3.568 -13.303 819 2HB SER 93 1HB SER 93 15.747 4.553 -13.927 820 HG SER 93 HG SER 93 16.890 3.260 -12.102 821 H ARG 94 H ARG 94 15.630 7.045 -13.123 822 HA ARG 94 HA ARG 94 13.639 8.729 -12.077 823 1HB ARG 94 2HB ARG 94 14.804 8.820 -14.864 824 2HB ARG 94 1HB ARG 94 13.998 10.138 -14.033 825 1HG ARG 94 2HG ARG 94 15.792 10.262 -12.424 826 2HG ARG 94 1HG ARG 94 16.583 8.869 -13.170 827 1HD ARG 94 2HD ARG 94 17.646 10.853 -13.971 828 2HD ARG 94 1HD ARG 94 16.718 10.146 -15.289 829 HE ARG 94 HE ARG 94 15.850 12.445 -13.680 830 1HH1 ARG 94 1HH1 ARG 94 15.645 10.683 -16.769 831 2HH1 ARG 94 2HH1 ARG 94 15.220 12.045 -17.680 832 1HH2 ARG 94 1HH2 ARG 94 15.276 14.344 -14.971 833 2HH2 ARG 94 2HH2 ARG 94 15.056 14.204 -16.646 834 H GLN 95 H GLN 95 13.702 6.653 -14.887 835 HA GLN 95 HA GLN 95 11.197 7.188 -15.975 836 1HB GLN 95 2HB GLN 95 12.878 5.986 -17.173 837 2HB GLN 95 1HB GLN 95 12.933 4.734 -15.949 838 1HG GLN 95 2HG GLN 95 10.722 3.991 -16.582 839 2HG GLN 95 1HG GLN 95 10.609 5.300 -17.765 840 1HE2 GLN 95 1HE2 GLN 95 11.790 5.197 -19.612 841 2HE2 GLN 95 2HE2 GLN 95 12.558 3.739 -20.166 842 H THR 96 H THR 96 12.194 4.948 -13.454 843 HA THR 96 HA THR 96 9.865 3.459 -13.199 844 HB THR 96 HB THR 96 11.930 4.138 -11.102 845 HG1 THR 96 1HG THR 96 11.945 2.025 -13.020 846 1HG2 THR 96 1HG2 THR 96 9.974 2.906 -10.243 847 2HG2 THR 96 2HG2 THR 96 11.421 1.900 -10.235 848 3HG2 THR 96 3HG2 THR 96 10.204 1.682 -11.491 849 H ILE 97 H ILE 97 11.019 6.261 -11.250 850 HA ILE 97 HA ILE 97 8.652 6.393 -9.703 851 HB ILE 97 HB ILE 97 10.667 7.291 -8.751 852 1HG1 ILE 97 2HG1 ILE 97 10.002 9.588 -8.073 853 2HG1 ILE 97 1HG1 ILE 97 8.766 9.571 -9.324 854 1HG2 ILE 97 1HG2 ILE 97 11.818 9.274 -9.595 855 2HG2 ILE 97 2HG2 ILE 97 10.759 9.265 -11.007 856 3HG2 ILE 97 3HG2 ILE 97 11.863 7.919 -10.723 857 1HD1 ILE 97 1HD1 ILE 97 7.666 7.711 -8.196 858 2HD1 ILE 97 2HD1 ILE 97 7.832 9.111 -7.135 859 3HD1 ILE 97 3HD1 ILE 97 8.910 7.732 -6.947 860 H ASN 98 H ASN 98 9.688 8.093 -12.569 861 HA ASN 98 HA ASN 98 7.671 10.037 -12.678 862 1HB ASN 98 2HB ASN 98 9.859 9.921 -13.977 863 2HB ASN 98 1HB ASN 98 9.049 8.795 -15.056 864 1HD2 ASN 98 1HD2 ASN 98 7.594 11.632 -13.529 865 2HD2 ASN 98 2HD2 ASN 98 7.346 12.489 -15.007 866 H GLY 99 H GLY 99 7.888 6.806 -13.895 867 1HA GLY 99 2HA GLY 99 5.444 6.717 -15.338 868 2HA GLY 99 1HA GLY 99 6.311 5.317 -14.724 869 H ILE 100 H ILE 100 6.194 6.189 -11.915 870 HA ILE 100 HA ILE 100 3.675 5.089 -11.247 871 HB ILE 100 HB ILE 100 5.704 6.426 -9.413 872 1HG1 ILE 100 2HG1 ILE 100 6.639 4.475 -10.558 873 2HG1 ILE 100 1HG1 ILE 100 6.400 4.135 -8.849 874 1HG2 ILE 100 1HG2 ILE 100 4.576 5.205 -7.586 875 2HG2 ILE 100 2HG2 ILE 100 3.384 4.611 -8.745 876 3HG2 ILE 100 3HG2 ILE 100 3.473 6.333 -8.386 877 1HD1 ILE 100 1HD1 ILE 100 4.353 2.900 -9.394 878 2HD1 ILE 100 2HD1 ILE 100 5.760 2.231 -10.216 879 3HD1 ILE 100 3HD1 ILE 100 4.615 3.237 -11.103 880 H GLU 101 H GLU 101 4.984 8.343 -11.221 881 HA GLU 101 HA GLU 101 2.937 9.804 -10.074 882 1HB GLU 101 2HB GLU 101 4.420 10.496 -12.593 883 2HB GLU 101 1HB GLU 101 3.536 11.618 -11.585 884 1HG GLU 101 2HG GLU 101 5.132 11.364 -9.823 885 2HG GLU 101 1HG GLU 101 5.954 10.071 -10.712 886 H LYS 102 H LYS 102 3.117 8.406 -13.294 887 HA LYS 102 HA LYS 102 0.591 9.592 -14.079 888 1HB LYS 102 2HB LYS 102 2.522 7.837 -15.576 889 2HB LYS 102 1HB LYS 102 1.100 8.621 -16.258 890 1HG LYS 102 2HG LYS 102 2.068 10.809 -15.751 891 2HG LYS 102 1HG LYS 102 3.494 10.016 -15.079 892 1HD LYS 102 2HD LYS 102 3.869 8.933 -17.203 893 2HD LYS 102 1HD LYS 102 2.506 9.805 -17.907 894 1HE LYS 102 2HE LYS 102 4.556 10.958 -18.497 895 2HE LYS 102 1HE LYS 102 3.636 11.946 -17.365 896 1HZ LYS 102 1HZ LYS 102 5.101 11.259 -15.591 897 2HZ LYS 102 2HZ LYS 102 6.022 11.871 -16.846 898 3HZ LYS 102 3HZ LYS 102 5.921 10.197 -16.624 899 H ASN 103 H ASN 103 1.446 7.095 -12.244 900 HA ASN 103 HA ASN 103 0.943 4.938 -11.820 901 1HB ASN 103 2HB ASN 103 -1.410 4.493 -11.332 902 2HB ASN 103 1HB ASN 103 -1.013 6.128 -10.852 903 1HD2 ASN 103 1HD2 ASN 103 -2.783 4.149 -13.091 904 2HD2 ASN 103 2HD2 ASN 103 -3.849 5.364 -13.674 905 H LYS 104 H LYS 104 1.803 5.123 -14.418 906 HA LYS 104 HA LYS 104 -0.055 3.375 -15.872 907 1HB LYS 104 2HB LYS 104 0.290 5.688 -16.832 908 2HB LYS 104 1HB LYS 104 1.982 5.284 -17.051 909 1HG LYS 104 2HG LYS 104 0.752 5.094 -19.133 910 2HG LYS 104 1HG LYS 104 1.359 3.520 -18.617 911 1HD LYS 104 2HD LYS 104 -0.855 2.949 -17.750 912 2HD LYS 104 1HD LYS 104 -1.461 4.533 -18.242 913 1HE LYS 104 2HE LYS 104 -1.012 4.018 -20.567 914 2HE LYS 104 1HE LYS 104 -0.297 2.474 -20.111 915 1HZ LYS 104 1HZ LYS 104 -3.156 3.241 -19.724 916 2HZ LYS 104 2HZ LYS 104 -2.455 1.793 -19.241 917 3HZ LYS 104 3HZ LYS 104 -2.548 2.174 -20.886 918 H TYR 105 H TYR 105 2.891 3.685 -14.294 919 HA TYR 105 HA TYR 105 4.374 1.696 -15.765 920 1HB TYR 105 2HB TYR 105 5.295 3.790 -14.648 921 2HB TYR 105 1HB TYR 105 4.915 3.045 -13.112 922 HD1 TYR 105 1HD TYR 105 7.008 2.773 -16.128 923 HD2 TYR 105 2HD TYR 105 6.468 1.500 -12.095 924 HE1 TYR 105 1HE TYR 105 9.262 1.820 -16.125 925 HE2 TYR 105 2HE TYR 105 8.709 0.541 -12.102 926 HH TYR 105 HH TYR 105 10.328 -0.287 -13.704 927 H ASN 106 H ASN 106 1.779 1.634 -13.766 928 HA ASN 106 HA ASN 106 0.686 0.116 -12.608 929 1HB ASN 106 2HB ASN 106 1.724 -1.812 -13.713 930 2HB ASN 106 1HB ASN 106 3.166 -1.640 -12.714 931 1HD2 ASN 106 1HD2 ASN 106 3.120 -2.399 -10.540 932 2HD2 ASN 106 2HD2 ASN 106 1.794 -3.304 -9.931 933 HA PRO 107 HA PRO 107 1.890 1.759 -8.786 934 1HB PRO 107 2HB PRO 107 -0.582 0.528 -7.767 935 2HB PRO 107 1HB PRO 107 -0.123 2.233 -7.836 936 1HG PRO 107 2HG PRO 107 -2.016 1.260 -9.470 937 2HG PRO 107 1HG PRO 107 -0.851 2.491 -10.008 938 1HD PRO 107 2HD PRO 107 -0.787 -0.477 -10.471 939 2HD PRO 107 1HD PRO 107 -0.542 0.844 -11.635 940 H SER 108 H SER 108 3.539 -0.041 -8.986 941 HA SER 108 HA SER 108 3.231 -2.270 -7.257 942 1HB SER 108 2HB SER 108 5.746 -0.778 -8.099 943 2HB SER 108 1HB SER 108 5.664 -2.428 -7.479 944 HG SER 108 HG SER 108 5.616 -2.869 -9.517 945 H LEU 109 H LEU 109 2.965 -2.008 -5.112 946 HA LEU 109 HA LEU 109 2.851 0.698 -4.272 947 1HB LEU 109 2HB LEU 109 1.361 -1.513 -3.728 948 2HB LEU 109 1HB LEU 109 2.262 -1.298 -2.244 949 HG LEU 109 HG LEU 109 0.066 -0.229 -2.128 950 1HD1 LEU 109 1HD1 LEU 109 2.297 1.779 -2.146 951 2HD1 LEU 109 2HD1 LEU 109 1.810 0.752 -0.798 952 3HD1 LEU 109 3HD1 LEU 109 0.719 2.002 -1.392 953 1HD2 LEU 109 1HD2 LEU 109 -0.470 1.733 -3.478 954 2HD2 LEU 109 2HD2 LEU 109 -0.260 0.294 -4.479 955 3HD2 LEU 109 3HD2 LEU 109 1.017 1.510 -4.397 956 H GLN 110 H GLN 110 5.283 -1.848 -3.824 957 HA GLN 110 HA GLN 110 6.320 -0.949 -1.417 958 1HB GLN 110 2HB GLN 110 6.964 -3.053 -2.513 959 2HB GLN 110 1HB GLN 110 7.683 -2.162 -3.839 960 1HG GLN 110 2HG GLN 110 9.366 -3.062 -2.317 961 2HG GLN 110 1HG GLN 110 9.406 -1.302 -2.368 962 1HE2 GLN 110 1HE2 GLN 110 8.544 -4.092 -0.458 963 2HE2 GLN 110 2HE2 GLN 110 8.479 -3.263 1.055 964 H LEU 111 H LEU 111 6.916 0.071 -4.730 965 HA LEU 111 HA LEU 111 8.874 2.019 -4.340 966 1HB LEU 111 2HB LEU 111 6.618 1.883 -6.354 967 2HB LEU 111 1HB LEU 111 7.843 3.122 -6.393 968 HG LEU 111 HG LEU 111 9.561 1.431 -6.907 969 1HD1 LEU 111 1HD1 LEU 111 7.296 -0.562 -6.936 970 2HD1 LEU 111 2HD1 LEU 111 8.601 -0.505 -5.751 971 3HD1 LEU 111 3HD1 LEU 111 8.959 -0.866 -7.440 972 1HD2 LEU 111 1HD2 LEU 111 7.140 1.283 -8.675 973 2HD2 LEU 111 2HD2 LEU 111 8.790 0.866 -9.142 974 3HD2 LEU 111 3HD2 LEU 111 8.387 2.528 -8.707 975 H ALA 112 H ALA 112 5.469 2.154 -4.143 976 HA ALA 112 HA ALA 112 5.233 5.003 -3.780 977 1HB ALA 112 1HB ALA 112 2.871 4.590 -3.396 978 2HB ALA 112 2HB ALA 112 3.178 2.849 -3.337 979 3HB ALA 112 3HB ALA 112 3.441 3.743 -4.834 980 H LEU 113 H LEU 113 5.278 2.187 -1.697 981 HA LEU 113 HA LEU 113 4.374 3.290 0.695 982 1HB LEU 113 2HB LEU 113 4.561 0.888 0.006 983 2HB LEU 113 1HB LEU 113 6.293 1.023 0.202 984 HG LEU 113 HG LEU 113 5.958 1.468 2.607 985 1HD1 LEU 113 1HD1 LEU 113 3.751 1.112 3.565 986 2HD1 LEU 113 2HD1 LEU 113 3.073 0.899 1.950 987 3HD1 LEU 113 3HD1 LEU 113 3.729 2.462 2.432 988 1HD2 LEU 113 1HD2 LEU 113 5.281 -0.803 3.182 989 2HD2 LEU 113 2HD2 LEU 113 6.359 -0.797 1.787 990 3HD2 LEU 113 3HD2 LEU 113 4.625 -1.026 1.561 991 H LYS 114 H LYS 114 7.558 2.829 -0.700 992 HA LYS 114 HA LYS 114 8.788 4.062 1.522 993 1HB LYS 114 2HB LYS 114 10.911 4.173 0.102 994 2HB LYS 114 1HB LYS 114 10.277 2.595 0.515 995 1HG LYS 114 2HG LYS 114 9.313 2.426 -1.738 996 2HG LYS 114 1HG LYS 114 10.023 3.980 -2.159 997 1HD LYS 114 2HD LYS 114 11.448 2.159 -2.927 998 2HD LYS 114 1HD LYS 114 12.263 3.066 -1.648 999 1HE LYS 114 2HE LYS 114 11.438 1.343 -0.020 1000 2HE LYS 114 1HE LYS 114 10.858 0.406 -1.396 1001 1HZ LYS 114 1HZ LYS 114 13.006 -0.326 -0.608 1002 2HZ LYS 114 2HZ LYS 114 13.667 1.202 -0.901 1003 3HZ LYS 114 3HZ LYS 114 13.134 0.236 -2.197 1004 H ILE 115 H ILE 115 7.667 5.330 -1.488 1005 HA ILE 115 HA ILE 115 8.648 7.975 -1.299 1006 HB ILE 115 HB ILE 115 5.895 7.105 -2.269 1007 1HG1 ILE 115 2HG1 ILE 115 8.388 7.629 -3.884 1008 2HG1 ILE 115 1HG1 ILE 115 7.810 6.034 -3.428 1009 1HG2 ILE 115 1HG2 ILE 115 7.399 9.663 -2.825 1010 2HG2 ILE 115 2HG2 ILE 115 5.950 9.500 -1.833 1011 3HG2 ILE 115 3HG2 ILE 115 5.870 9.188 -3.568 1012 1HD1 ILE 115 1HD1 ILE 115 5.771 6.400 -4.705 1013 2HD1 ILE 115 2HD1 ILE 115 7.209 6.581 -5.711 1014 3HD1 ILE 115 3HD1 ILE 115 6.337 8.010 -5.150 1015 H ALA 116 H ALA 116 5.936 6.386 0.165 1016 HA ALA 116 HA ALA 116 4.627 8.550 1.427 1017 1HB ALA 116 1HB ALA 116 3.623 6.850 2.839 1018 2HB ALA 116 2HB ALA 116 4.857 5.707 2.309 1019 3HB ALA 116 3HB ALA 116 3.656 6.303 1.149 1020 H TYR 117 H TYR 117 7.154 6.350 2.407 1021 HA TYR 117 HA TYR 117 7.363 7.267 5.053 1022 1HB TYR 117 2HB TYR 117 7.995 5.024 4.429 1023 2HB TYR 117 1HB TYR 117 9.213 5.632 3.322 1024 HD1 TYR 117 1HD TYR 117 11.250 6.455 4.119 1025 HD2 TYR 117 2HD TYR 117 8.379 5.000 6.833 1026 HE1 TYR 117 1HE TYR 117 13.019 6.318 5.881 1027 HE2 TYR 117 2HE TYR 117 10.069 4.854 8.606 1028 HH TYR 117 HH TYR 117 12.532 4.539 8.664 1029 H TYR 118 H TYR 118 9.425 7.874 2.152 1030 HA TYR 118 HA TYR 118 11.240 9.546 3.583 1031 1HB TYR 118 2HB TYR 118 10.760 9.370 0.597 1032 2HB TYR 118 1HB TYR 118 12.026 10.340 1.328 1033 HD1 TYR 118 1HD TYR 118 13.918 9.165 2.522 1034 HD2 TYR 118 2HD TYR 118 11.015 7.068 0.256 1035 HE1 TYR 118 1HE TYR 118 15.422 7.213 2.394 1036 HE2 TYR 118 2HE TYR 118 12.489 5.125 0.121 1037 HH TYR 118 HH TYR 118 15.209 4.788 2.057 1038 H LEU 119 H LEU 119 8.533 10.270 1.564 1039 HA LEU 119 HA LEU 119 8.822 13.143 1.949 1040 1HB LEU 119 2HB LEU 119 6.490 11.635 0.758 1041 2HB LEU 119 1HB LEU 119 6.628 13.382 0.797 1042 1HD1 LEU 119 1HD1 LEU 119 6.404 13.526 -1.653 1043 2HD1 LEU 119 2HD1 LEU 119 6.211 11.775 -1.718 1044 3HD1 LEU 119 3HD1 LEU 119 7.451 12.563 -2.696 1045 1HD2 LEU 119 1HD2 LEU 119 8.504 14.483 -0.562 1046 2HD2 LEU 119 2HD2 LEU 119 9.473 13.476 -1.634 1047 3HD2 LEU 119 3HD2 LEU 119 9.691 13.369 0.113 1048 H ASN 120 H ASN 120 7.636 10.712 3.736 1049 HA ASN 120 HA ASN 120 6.234 10.391 5.443 1050 1HB ASN 120 2HB ASN 120 7.923 11.752 6.583 1051 2HB ASN 120 1HB ASN 120 7.065 13.223 6.132 1052 1HD2 ASN 120 1HD2 ASN 120 6.933 10.324 8.024 1053 2HD2 ASN 120 2HD2 ASN 120 5.738 10.854 9.159 1054 H THR 121 H THR 121 4.509 10.160 4.060 1055 HA THR 121 HA THR 121 2.333 11.942 4.656 1056 HB THR 121 HB THR 121 3.181 11.295 1.799 1057 HG1 THR 121 1HG THR 121 4.028 13.159 3.340 1058 1HG2 THR 121 1HG2 THR 121 0.854 12.933 2.830 1059 2HG2 THR 121 2HG2 THR 121 0.738 11.348 2.065 1060 3HG2 THR 121 3HG2 THR 121 1.299 12.738 1.134 1061 HA PRO 122 HA PRO 122 0.655 7.792 4.902 1062 1HB PRO 122 2HB PRO 122 -2.014 8.499 4.820 1063 2HB PRO 122 1HB PRO 122 -1.028 8.510 6.286 1064 1HG PRO 122 2HG PRO 122 -1.796 10.777 4.501 1065 2HG PRO 122 1HG PRO 122 -1.669 10.729 6.270 1066 1HD PRO 122 2HD PRO 122 0.231 11.846 4.722 1067 2HD PRO 122 1HD PRO 122 0.621 11.005 6.236 1068 H LEU 123 H LEU 123 0.039 6.321 3.442 1069 HA LEU 123 HA LEU 123 0.087 6.793 0.691 1070 1HB LEU 123 2HB LEU 123 -1.171 4.510 2.199 1071 2HB LEU 123 1HB LEU 123 -0.958 4.540 0.464 1072 1HD1 LEU 123 1HD2 LEU 123 0.230 2.343 0.854 1073 2HD1 LEU 123 2HD2 LEU 123 0.111 2.551 2.600 1074 3HD1 LEU 123 3HD2 LEU 123 1.692 2.328 1.843 1075 1HD2 LEU 123 1HD1 LEU 123 1.815 5.670 0.288 1076 2HD2 LEU 123 2HD1 LEU 123 1.250 4.216 -0.537 1077 3HD2 LEU 123 3HD1 LEU 123 2.684 4.148 0.487 1078 H GLU 124 H GLU 124 -2.617 6.656 2.935 1079 HA GLU 124 HA GLU 124 -4.759 6.674 1.285 1080 1HB GLU 124 2HB GLU 124 -4.372 8.167 3.877 1081 2HB GLU 124 1HB GLU 124 -5.901 7.631 3.194 1082 1HG GLU 124 2HG GLU 124 -5.300 5.329 3.505 1083 2HG GLU 124 1HG GLU 124 -3.682 5.763 4.036 1084 H ASP 125 H ASP 125 -2.689 9.395 2.237 1085 HA ASP 125 HA ASP 125 -4.312 11.364 0.935 1086 1HB ASP 125 2HB ASP 125 -2.802 11.965 2.804 1087 2HB ASP 125 1HB ASP 125 -1.414 11.567 1.797 1088 H ILE 126 H ILE 126 -1.690 9.350 0.080 1089 HA ILE 126 HA ILE 126 -0.872 10.710 -2.313 1090 HB ILE 126 HB ILE 126 -0.229 7.866 -1.461 1091 1HG1 ILE 126 2HG1 ILE 126 1.335 10.432 -1.059 1092 2HG1 ILE 126 1HG1 ILE 126 0.482 9.549 0.200 1093 1HG2 ILE 126 1HG2 ILE 126 1.681 8.081 -2.990 1094 2HG2 ILE 126 2HG2 ILE 126 1.113 9.678 -3.475 1095 3HG2 ILE 126 3HG2 ILE 126 0.148 8.248 -3.844 1096 1HD1 ILE 126 1HD1 ILE 126 2.873 9.132 0.282 1097 2HD1 ILE 126 2HD1 ILE 126 2.836 8.538 -1.377 1098 3HD1 ILE 126 3HD1 ILE 126 1.988 7.657 -0.105 1099 H PHE 127 H PHE 127 -2.593 7.728 -1.712 1100 HA PHE 127 HA PHE 127 -3.689 7.925 -4.450 1101 1HB PHE 127 2HB PHE 127 -3.405 5.452 -2.733 1102 2HB PHE 127 1HB PHE 127 -4.170 5.505 -4.311 1103 HD1 PHE 127 1HD PHE 127 -2.814 5.847 -6.324 1104 HD2 PHE 127 2HD PHE 127 -1.060 5.417 -2.479 1105 HE1 PHE 127 1HE PHE 127 -0.643 5.358 -7.375 1106 HE2 PHE 127 2HE PHE 127 1.104 4.934 -3.511 1107 HZ PHE 127 HZ PHE 127 1.324 4.900 -5.965 1108 H GLN 128 H GLN 128 -5.821 7.907 -4.719 1109 HA GLN 128 HA GLN 128 -7.450 7.730 -2.301 1110 1HB GLN 128 2HB GLN 128 -7.595 9.899 -3.459 1111 2HB GLN 128 1HB GLN 128 -8.007 9.083 -4.957 1112 1HG GLN 128 2HG GLN 128 -10.103 8.331 -4.010 1113 2HG GLN 128 1HG GLN 128 -9.680 9.041 -2.451 1114 1HE2 GLN 128 1HE2 GLN 128 -10.676 9.706 -5.729 1115 2HE2 GLN 128 2HE2 GLN 128 -11.075 11.353 -5.451 1116 H TRP 129 H TRP 129 -8.623 5.989 -2.186 1117 HA TRP 129 HA TRP 129 -9.085 4.502 -4.633 1118 1HB TRP 129 2HB TRP 129 -9.309 2.513 -2.979 1119 2HB TRP 129 1HB TRP 129 -7.711 3.087 -3.429 1120 HD1 TRP 129 HD TRP 129 -10.202 3.329 -0.463 1121 HE1 TRP 129 1HE TRP 129 -8.843 3.749 1.679 1122 HE3 TRP 129 3HE TRP 129 -5.573 3.806 -2.559 1123 HZ2 TRP 129 2HZ TRP 129 -6.128 4.207 2.374 1124 HZ3 TRP 129 3HZ TRP 129 -3.646 4.220 -1.093 1125 HH2 TRP 129 HH TRP 129 -3.912 4.417 1.307 1126 H GLN 130 H GLN 130 -11.007 4.036 -5.161 1127 HA GLN 130 HA GLN 130 -13.161 4.569 -3.243 1128 1HB GLN 130 2HB GLN 130 -13.212 4.863 -6.259 1129 2HB GLN 130 1HB GLN 130 -14.584 5.107 -5.187 1130 1HG GLN 130 2HG GLN 130 -12.050 6.708 -5.059 1131 2HG GLN 130 1HG GLN 130 -13.455 7.188 -5.998 1132 1HE2 GLN 130 1HE2 GLN 130 -13.712 9.027 -4.824 1133 2HE2 GLN 130 2HE2 GLN 130 -14.262 9.075 -3.191 1134 HA PRO 131 HA PRO 131 -13.496 0.137 -4.398 1135 1HB PRO 131 2HB PRO 131 -14.240 -0.166 -1.566 1136 2HB PRO 131 1HB PRO 131 -12.966 -0.995 -2.465 1137 1HG PRO 131 2HG PRO 131 -12.404 0.819 -0.562 1138 2HG PRO 131 1HG PRO 131 -11.398 0.638 -2.010 1139 1HD PRO 131 2HD PRO 131 -13.521 2.671 -1.424 1140 2HD PRO 131 1HD PRO 131 -11.910 2.902 -2.145 1141 H GLU 132 H GLU 132 -15.343 2.310 -2.284 1142 HA GLU 132 HA GLU 132 -17.799 1.648 -3.575 1143 1HB GLU 132 2HB GLU 132 -17.341 1.659 -0.572 1144 2HB GLU 132 1HB GLU 132 -18.910 1.564 -1.360 1145 1HG GLU 132 2HG GLU 132 -18.421 -0.603 -2.221 1146 2HG GLU 132 1HG GLU 132 -16.744 -0.487 -1.691 Start of MODEL 10 1 1H MET 1 1HT MET 1 13.513 -4.725 4.501 2 2H MET 1 2HT MET 1 12.373 -3.600 5.031 3 3H MET 1 3HT MET 1 12.030 -4.599 3.727 4 HA MET 1 HA MET 1 11.941 -6.534 5.021 5 1HB MET 1 2HB MET 1 12.414 -4.640 7.328 6 2HB MET 1 1HB MET 1 11.760 -6.253 7.515 7 1HG MET 1 2HG MET 1 13.840 -7.171 6.595 8 2HG MET 1 1HG MET 1 14.484 -5.529 6.488 9 1HE MET 1 1HE MET 1 16.473 -7.018 9.499 10 2HE MET 1 2HE MET 1 16.584 -6.211 7.936 11 3HE MET 1 3HE MET 1 15.965 -7.860 8.036 12 H ILE 2 H ILE 2 9.978 -7.170 5.784 13 HA ILE 2 HA ILE 2 7.972 -5.067 6.091 14 HB ILE 2 HB ILE 2 7.653 -7.667 4.543 15 1HG1 ILE 2 2HG1 ILE 2 8.665 -5.875 3.221 16 2HG1 ILE 2 1HG1 ILE 2 7.033 -6.187 2.650 17 1HG2 ILE 2 1HG2 ILE 2 5.495 -5.690 5.279 18 2HG2 ILE 2 2HG2 ILE 2 5.653 -7.340 5.880 19 3HG2 ILE 2 3HG2 ILE 2 5.303 -7.052 4.174 20 1HD1 ILE 2 1HD1 ILE 2 7.510 -3.815 2.698 21 2HD1 ILE 2 2HD1 ILE 2 7.870 -3.908 4.422 22 3HD1 ILE 2 3HD1 ILE 2 6.234 -4.221 3.847 23 H ILE 3 H ILE 3 6.788 -5.247 7.859 24 HA ILE 3 HA ILE 3 7.083 -7.675 9.457 25 HB ILE 3 HB ILE 3 6.747 -4.790 10.410 26 1HG1 ILE 3 2HG1 ILE 3 9.172 -6.601 10.600 27 2HG1 ILE 3 1HG1 ILE 3 9.002 -5.259 9.482 28 1HG2 ILE 3 1HG2 ILE 3 7.105 -5.716 12.660 29 2HG2 ILE 3 2HG2 ILE 3 7.164 -7.342 11.979 30 3HG2 ILE 3 3HG2 ILE 3 5.671 -6.407 11.898 31 1HD1 ILE 3 1HD1 ILE 3 8.901 -3.713 11.374 32 2HD1 ILE 3 2HD1 ILE 3 10.388 -4.661 11.372 33 3HD1 ILE 3 3HD1 ILE 3 9.084 -5.069 12.485 34 H ASN 4 H ASN 4 5.090 -8.721 9.342 35 HA ASN 4 HA ASN 4 2.840 -7.110 8.558 36 1HB ASN 4 2HB ASN 4 3.515 -8.935 7.124 37 2HB ASN 4 1HB ASN 4 3.455 -10.058 8.471 38 1HD2 ASN 4 1HD2 ASN 4 2.047 -11.332 7.337 39 2HD2 ASN 4 2HD2 ASN 4 0.383 -10.923 7.116 40 H ASN 5 H ASN 5 1.098 -6.887 9.815 41 HA ASN 5 HA ASN 5 0.896 -8.486 12.291 42 1HB ASN 5 2HB ASN 5 0.036 -5.596 11.895 43 2HB ASN 5 1HB ASN 5 -0.176 -6.533 13.360 44 1HD2 ASN 5 1HD2 ASN 5 1.955 -4.699 11.435 45 2HD2 ASN 5 2HD2 ASN 5 3.282 -4.626 12.532 46 H LEU 6 H LEU 6 -0.272 -8.700 9.452 47 HA LEU 6 HA LEU 6 -2.879 -7.930 9.166 48 1HB LEU 6 2HB LEU 6 -1.312 -9.181 7.577 49 2HB LEU 6 1HB LEU 6 -1.842 -10.656 8.348 50 HG LEU 6 HG LEU 6 -2.925 -10.368 6.205 51 1HD1 LEU 6 1HD1 LEU 6 -4.957 -9.881 8.354 52 2HD1 LEU 6 2HD1 LEU 6 -4.272 -11.435 7.910 53 3HD1 LEU 6 3HD1 LEU 6 -5.268 -10.549 6.751 54 1HD2 LEU 6 1HD2 LEU 6 -3.942 -7.748 7.256 55 2HD2 LEU 6 2HD2 LEU 6 -4.434 -8.501 5.739 56 3HD2 LEU 6 3HD2 LEU 6 -2.763 -7.986 5.968 57 H LYS 7 H LYS 7 -1.746 -10.950 10.726 58 HA LYS 7 HA LYS 7 -4.334 -11.800 11.381 59 1HB LYS 7 2HB LYS 7 -3.364 -13.443 12.863 60 2HB LYS 7 1HB LYS 7 -2.459 -13.370 11.367 61 1HG LYS 7 2HG LYS 7 -0.655 -12.225 12.440 62 2HG LYS 7 1HG LYS 7 -1.601 -12.030 13.921 63 1HD LYS 7 2HD LYS 7 -0.683 -14.646 12.721 64 2HD LYS 7 1HD LYS 7 -0.014 -13.866 14.155 65 1HE LYS 7 2HE LYS 7 -2.199 -14.062 15.274 66 2HE LYS 7 1HE LYS 7 -2.852 -14.855 13.844 67 1HZ LYS 7 1HZ LYS 7 -1.201 -16.635 14.184 68 2HZ LYS 7 2HZ LYS 7 -2.268 -16.485 15.468 69 3HZ LYS 7 3HZ LYS 7 -0.691 -15.860 15.595 70 H LEU 8 H LEU 8 -2.072 -9.803 13.219 71 HA LEU 8 HA LEU 8 -3.473 -9.747 15.631 72 1HB LEU 8 2HB LEU 8 -1.115 -8.973 15.221 73 2HB LEU 8 1HB LEU 8 -1.747 -7.587 14.377 74 HG LEU 8 HG LEU 8 -0.874 -7.149 16.684 75 1HD1 LEU 8 1HD1 LEU 8 -2.382 -5.552 15.690 76 2HD1 LEU 8 2HD1 LEU 8 -2.678 -5.689 17.423 77 3HD1 LEU 8 3HD1 LEU 8 -3.771 -6.465 16.276 78 1HD2 LEU 8 1HD2 LEU 8 -3.305 -8.705 17.541 79 2HD2 LEU 8 2HD2 LEU 8 -2.263 -7.761 18.606 80 3HD2 LEU 8 3HD2 LEU 8 -1.621 -9.177 17.772 81 H ILE 9 H ILE 9 -3.796 -7.845 12.702 82 HA ILE 9 HA ILE 9 -5.839 -6.176 13.760 83 HB ILE 9 HB ILE 9 -4.890 -6.632 10.921 84 1HG1 ILE 9 2HG1 ILE 9 -4.410 -4.203 11.021 85 2HG1 ILE 9 1HG1 ILE 9 -5.047 -4.150 12.653 86 1HG2 ILE 9 1HG2 ILE 9 -7.272 -4.947 11.699 87 2HG2 ILE 9 2HG2 ILE 9 -7.315 -6.419 10.747 88 3HG2 ILE 9 3HG2 ILE 9 -6.519 -4.978 10.102 89 1HD1 ILE 9 1HD1 ILE 9 -2.632 -4.110 12.636 90 2HD1 ILE 9 2HD1 ILE 9 -2.595 -5.627 11.736 91 3HD1 ILE 9 3HD1 ILE 9 -3.218 -5.596 13.386 92 H ARG 10 H ARG 10 -5.856 -9.182 11.992 93 HA ARG 10 HA ARG 10 -8.644 -9.458 11.781 94 1HB ARG 10 2HB ARG 10 -6.530 -11.577 12.117 95 2HB ARG 10 1HB ARG 10 -8.232 -11.960 11.953 96 1HG ARG 10 2HG ARG 10 -8.159 -10.750 9.739 97 2HG ARG 10 1HG ARG 10 -6.398 -10.728 9.921 98 1HD ARG 10 2HD ARG 10 -7.198 -12.678 8.607 99 2HD ARG 10 1HD ARG 10 -6.343 -13.150 10.079 100 HE ARG 10 HE ARG 10 -9.181 -12.904 10.425 101 1HH1 ARG 10 1HH1 ARG 10 -6.743 -15.260 9.284 102 2HH1 ARG 10 2HH1 ARG 10 -7.608 -16.578 9.902 103 1HH2 ARG 10 1HH2 ARG 10 -10.311 -14.745 11.187 104 2HH2 ARG 10 2HH2 ARG 10 -9.689 -16.318 10.920 105 H GLU 11 H GLU 11 -6.428 -10.083 14.543 106 HA GLU 11 HA GLU 11 -8.400 -11.090 16.242 107 1HB GLU 11 2HB GLU 11 -5.797 -9.718 16.933 108 2HB GLU 11 1HB GLU 11 -6.741 -10.762 17.987 109 1HG GLU 11 2HG GLU 11 -6.369 -12.613 16.374 110 2HG GLU 11 1HG GLU 11 -5.299 -11.550 15.475 111 H LYS 12 H LYS 12 -7.199 -7.817 15.640 112 HA LYS 12 HA LYS 12 -8.592 -6.465 17.599 113 1HB LYS 12 2HB LYS 12 -7.914 -5.523 14.804 114 2HB LYS 12 1HB LYS 12 -8.548 -4.454 16.050 115 1HG LYS 12 2HG LYS 12 -6.620 -4.894 17.455 116 2HG LYS 12 1HG LYS 12 -5.999 -6.046 16.280 117 1HD LYS 12 2HD LYS 12 -4.826 -3.895 16.146 118 2HD LYS 12 1HD LYS 12 -5.697 -4.244 14.656 119 1HE LYS 12 2HE LYS 12 -7.444 -2.703 15.262 120 2HE LYS 12 1HE LYS 12 -6.741 -2.474 16.863 121 1HZ LYS 12 1HZ LYS 12 -6.271 -0.694 15.076 122 2HZ LYS 12 2HZ LYS 12 -5.126 -1.807 14.464 123 3HZ LYS 12 3HZ LYS 12 -4.998 -1.255 16.008 124 H LYS 13 H LYS 13 -9.834 -7.608 14.579 125 HA LYS 13 HA LYS 13 -12.543 -7.020 15.556 126 1HB LYS 13 2HB LYS 13 -11.595 -7.742 12.744 127 2HB LYS 13 1HB LYS 13 -13.275 -7.454 13.187 128 1HG LYS 13 2HG LYS 13 -11.054 -5.422 13.378 129 2HG LYS 13 1HG LYS 13 -12.263 -5.503 12.093 130 1HD LYS 13 2HD LYS 13 -14.009 -4.900 13.537 131 2HD LYS 13 1HD LYS 13 -13.078 -5.305 14.977 132 1HE LYS 13 2HE LYS 13 -13.328 -2.881 14.693 133 2HE LYS 13 1HE LYS 13 -11.643 -3.381 14.622 134 1HZ LYS 13 1HZ LYS 13 -12.221 -1.719 12.964 135 2HZ LYS 13 2HZ LYS 13 -13.340 -2.760 12.249 136 3HZ LYS 13 3HZ LYS 13 -11.699 -3.137 12.219 137 H LYS 14 H LYS 14 -13.986 -9.540 14.342 138 HA LYS 14 HA LYS 14 -11.978 -11.419 14.567 139 1HB LYS 14 2HB LYS 14 -13.541 -12.871 15.941 140 2HB LYS 14 1HB LYS 14 -12.783 -11.553 16.810 141 1HG LYS 14 2HG LYS 14 -14.861 -10.289 16.726 142 2HG LYS 14 1HG LYS 14 -15.615 -11.573 15.777 143 1HD LYS 14 2HD LYS 14 -15.348 -13.135 17.604 144 2HD LYS 14 1HD LYS 14 -14.471 -11.929 18.545 145 1HE LYS 14 2HE LYS 14 -17.334 -11.688 17.637 146 2HE LYS 14 1HE LYS 14 -16.827 -12.188 19.246 147 1HZ LYS 14 1HZ LYS 14 -16.301 -9.532 17.996 148 2HZ LYS 14 2HZ LYS 14 -15.727 -10.021 19.492 149 3HZ LYS 14 3HZ LYS 14 -17.410 -9.879 19.224 150 H ILE 15 H ILE 15 -12.092 -11.454 12.462 151 HA ILE 15 HA ILE 15 -14.531 -12.625 11.341 152 HB ILE 15 HB ILE 15 -12.571 -10.751 9.937 153 1HG1 ILE 15 2HG1 ILE 15 -15.436 -10.259 10.806 154 2HG1 ILE 15 1HG1 ILE 15 -14.007 -9.573 11.566 155 1HG2 ILE 15 1HG2 ILE 15 -13.524 -12.412 8.427 156 2HG2 ILE 15 2HG2 ILE 15 -14.155 -10.805 8.073 157 3HG2 ILE 15 3HG2 ILE 15 -15.150 -11.970 8.949 158 1HD1 ILE 15 1HD1 ILE 15 -13.510 -8.347 9.510 159 2HD1 ILE 15 2HD1 ILE 15 -15.116 -7.958 10.127 160 3HD1 ILE 15 3HD1 ILE 15 -14.939 -9.046 8.749 161 H SER 16 H SER 16 -14.182 -14.448 10.028 162 HA SER 16 HA SER 16 -11.584 -15.647 10.428 163 1HB SER 16 2HB SER 16 -14.146 -16.855 9.385 164 2HB SER 16 1HB SER 16 -12.710 -17.718 9.951 165 HG SER 16 HG SER 16 -14.546 -16.170 11.408 166 H GLN 17 H GLN 17 -11.002 -17.173 8.523 167 HA GLN 17 HA GLN 17 -10.141 -15.519 6.440 168 1HB GLN 17 2HB GLN 17 -10.301 -18.531 6.276 169 2HB GLN 17 1HB GLN 17 -9.201 -17.464 5.419 170 1HG GLN 17 2HG GLN 17 -8.176 -16.858 7.596 171 2HG GLN 17 1HG GLN 17 -9.215 -18.053 8.368 172 1HE2 GLN 17 1HE2 GLN 17 -6.386 -17.495 6.565 173 2HE2 GLN 17 2HE2 GLN 17 -5.835 -19.132 6.473 174 H SER 18 H SER 18 -12.942 -17.799 6.566 175 HA SER 18 HA SER 18 -13.474 -17.679 3.840 176 1HB SER 18 2HB SER 18 -15.316 -18.333 6.140 177 2HB SER 18 1HB SER 18 -15.567 -18.760 4.443 178 HG SER 18 HG SER 18 -13.778 -19.761 6.320 179 H GLU 19 H GLU 19 -14.833 -15.781 6.576 180 HA GLU 19 HA GLU 19 -16.710 -14.423 4.979 181 1HB GLU 19 2HB GLU 19 -15.382 -13.288 7.452 182 2HB GLU 19 1HB GLU 19 -16.850 -12.702 6.703 183 1HG GLU 19 2HG GLU 19 -17.626 -13.859 8.520 184 2HG GLU 19 1HG GLU 19 -17.766 -15.055 7.234 185 H LEU 20 H LEU 20 -13.327 -13.660 5.831 186 HA LEU 20 HA LEU 20 -13.243 -11.203 4.533 187 1HB LEU 20 2HB LEU 20 -11.100 -13.225 5.149 188 2HB LEU 20 1HB LEU 20 -10.767 -11.655 4.445 189 HG LEU 20 HG LEU 20 -12.049 -12.092 7.144 190 1HD1 LEU 20 1HD1 LEU 20 -9.715 -12.817 7.115 191 2HD1 LEU 20 2HD1 LEU 20 -9.911 -11.333 8.048 192 3HD1 LEU 20 3HD1 LEU 20 -9.238 -11.271 6.418 193 1HD2 LEU 20 1HD2 LEU 20 -11.661 -9.695 7.434 194 2HD2 LEU 20 2HD2 LEU 20 -12.725 -10.008 6.061 195 3HD2 LEU 20 3HD2 LEU 20 -11.034 -9.594 5.790 196 H ALA 21 H ALA 21 -12.542 -14.477 3.387 197 HA ALA 21 HA ALA 21 -11.569 -13.795 0.867 198 1HB ALA 21 1HB ALA 21 -13.149 -16.244 1.616 199 2HB ALA 21 2HB ALA 21 -11.407 -16.038 1.815 200 3HB ALA 21 3HB ALA 21 -12.114 -16.063 0.200 201 H ALA 22 H ALA 22 -14.925 -14.559 1.826 202 HA ALA 22 HA ALA 22 -16.029 -14.117 -0.704 203 1HB ALA 22 1HB ALA 22 -17.183 -15.312 1.093 204 2HB ALA 22 2HB ALA 22 -18.165 -13.986 0.470 205 3HB ALA 22 3HB ALA 22 -17.318 -13.812 2.008 206 H LEU 23 H LEU 23 -15.523 -11.960 2.021 207 HA LEU 23 HA LEU 23 -16.999 -9.797 0.952 208 1HB LEU 23 2HB LEU 23 -16.523 -10.226 3.349 209 2HB LEU 23 1HB LEU 23 -14.858 -9.775 3.064 210 HG LEU 23 HG LEU 23 -15.552 -7.489 2.555 211 1HD1 LEU 23 1HD1 LEU 23 -17.752 -7.990 1.593 212 2HD1 LEU 23 2HD1 LEU 23 -17.880 -6.808 2.896 213 3HD1 LEU 23 3HD1 LEU 23 -18.335 -8.488 3.181 214 1HD2 LEU 23 1HD2 LEU 23 -15.031 -8.118 4.855 215 2HD2 LEU 23 2HD2 LEU 23 -16.715 -8.571 5.118 216 3HD2 LEU 23 3HD2 LEU 23 -16.294 -6.889 4.803 217 H LEU 24 H LEU 24 -13.529 -10.620 0.909 218 HA LEU 24 HA LEU 24 -12.804 -8.178 -0.433 219 1HB LEU 24 2HB LEU 24 -11.214 -10.704 -0.027 220 2HB LEU 24 1HB LEU 24 -10.584 -9.135 -0.462 221 HG LEU 24 HG LEU 24 -11.828 -9.866 2.182 222 1HD1 LEU 24 1HD1 LEU 24 -8.967 -9.380 1.411 223 2HD1 LEU 24 2HD1 LEU 24 -9.688 -10.925 1.856 224 3HD1 LEU 24 3HD1 LEU 24 -9.560 -9.634 3.052 225 1HD2 LEU 24 1HD2 LEU 24 -12.199 -7.527 1.619 226 2HD2 LEU 24 2HD2 LEU 24 -10.478 -7.330 1.292 227 3HD2 LEU 24 3HD2 LEU 24 -11.029 -7.689 2.928 228 H GLU 25 H GLU 25 -14.261 -11.006 -1.393 229 HA GLU 25 HA GLU 25 -14.672 -12.093 -3.312 230 1HB GLU 25 2HB GLU 25 -13.504 -9.624 -4.575 231 2HB GLU 25 1HB GLU 25 -14.278 -10.918 -5.471 232 1HG GLU 25 2HG GLU 25 -16.340 -10.479 -4.143 233 2HG GLU 25 1HG GLU 25 -15.524 -9.054 -3.487 234 H VAL 26 H VAL 26 -12.289 -12.722 -1.973 235 HA VAL 26 HA VAL 26 -10.531 -13.386 -4.206 236 HB VAL 26 HB VAL 26 -8.643 -13.417 -2.627 237 1HG1 VAL 26 1HG1 VAL 26 -10.097 -10.784 -2.618 238 2HG1 VAL 26 2HG1 VAL 26 -9.000 -11.376 -3.865 239 3HG1 VAL 26 3HG1 VAL 26 -8.387 -11.010 -2.252 240 1HG2 VAL 26 1HG2 VAL 26 -8.856 -12.450 -0.364 241 2HG2 VAL 26 2HG2 VAL 26 -9.821 -13.916 -0.556 242 3HG2 VAL 26 3HG2 VAL 26 -10.603 -12.337 -0.594 243 H SER 27 H SER 27 -9.243 -15.353 -3.604 244 HA SER 27 HA SER 27 -11.044 -17.323 -2.520 245 1HB SER 27 2HB SER 27 -8.293 -17.591 -3.748 246 2HB SER 27 1HB SER 27 -9.388 -18.926 -3.364 247 HG SER 27 HG SER 27 -10.530 -16.912 -4.878 248 H ARG 28 H ARG 28 -10.416 -18.760 -0.801 249 HA ARG 28 HA ARG 28 -9.398 -17.356 1.402 250 1HB ARG 28 2HB ARG 28 -9.942 -20.307 1.137 251 2HB ARG 28 1HB ARG 28 -9.523 -19.512 2.650 252 1HG ARG 28 2HG ARG 28 -11.512 -18.042 2.334 253 2HG ARG 28 1HG ARG 28 -11.957 -19.042 0.955 254 1HD ARG 28 2HD ARG 28 -11.599 -20.019 3.776 255 2HD ARG 28 1HD ARG 28 -13.143 -19.646 3.022 256 HE ARG 28 HE ARG 28 -11.687 -21.530 1.488 257 1HH1 ARG 28 1HH1 ARG 28 -13.684 -21.214 4.413 258 2HH1 ARG 28 2HH1 ARG 28 -14.181 -22.830 4.436 259 1HH2 ARG 28 1HH2 ARG 28 -12.369 -23.781 1.502 260 2HH2 ARG 28 2HH2 ARG 28 -13.422 -24.316 2.731 261 H GLN 29 H GLN 29 -7.792 -19.489 -0.816 262 HA GLN 29 HA GLN 29 -5.449 -19.793 0.742 263 1HB GLN 29 2HB GLN 29 -5.958 -21.250 -1.207 264 2HB GLN 29 1HB GLN 29 -5.744 -19.883 -2.283 265 1HG GLN 29 2HG GLN 29 -3.501 -20.789 -0.513 266 2HG GLN 29 1HG GLN 29 -3.846 -21.628 -2.016 267 1HE2 GLN 29 1HE2 GLN 29 -1.551 -20.000 -1.103 268 2HE2 GLN 29 2HE2 GLN 29 -1.306 -18.809 -2.312 269 H THR 30 H THR 30 -6.584 -17.296 -1.405 270 HA THR 30 HA THR 30 -4.217 -15.833 -1.645 271 HB THR 30 HB THR 30 -7.110 -14.954 -1.788 272 HG1 THR 30 1HG THR 30 -6.900 -15.408 -3.994 273 1HG2 THR 30 1HG2 THR 30 -6.276 -13.107 -3.195 274 2HG2 THR 30 2HG2 THR 30 -4.621 -13.654 -2.936 275 3HG2 THR 30 3HG2 THR 30 -5.565 -13.031 -1.582 276 H ILE 31 H ILE 31 -7.041 -15.368 0.577 277 HA ILE 31 HA ILE 31 -5.782 -13.302 1.995 278 HB ILE 31 HB ILE 31 -8.203 -13.502 2.148 279 1HG1 ILE 31 2HG1 ILE 31 -8.574 -13.344 4.611 280 2HG1 ILE 31 1HG1 ILE 31 -6.940 -13.938 4.864 281 1HG2 ILE 31 1HG2 ILE 31 -7.796 -16.102 3.582 282 2HG2 ILE 31 2HG2 ILE 31 -8.510 -15.863 1.986 283 3HG2 ILE 31 3HG2 ILE 31 -9.336 -15.257 3.422 284 1HD1 ILE 31 1HD1 ILE 31 -6.049 -11.966 3.729 285 2HD1 ILE 31 2HD1 ILE 31 -7.061 -11.521 5.104 286 3HD1 ILE 31 3HD1 ILE 31 -7.690 -11.379 3.463 287 H ASN 32 H ASN 32 -5.842 -16.766 2.602 288 HA ASN 32 HA ASN 32 -4.434 -16.805 5.033 289 1HB ASN 32 2HB ASN 32 -5.578 -18.782 4.171 290 2HB ASN 32 1HB ASN 32 -4.524 -18.823 2.770 291 1HD2 ASN 32 1HD2 ASN 32 -4.006 -20.973 3.257 292 2HD2 ASN 32 2HD2 ASN 32 -2.920 -21.385 4.527 293 H GLY 33 H GLY 33 -3.325 -16.743 1.688 294 1HA GLY 33 2HA GLY 33 -0.573 -16.990 2.207 295 2HA GLY 33 1HA GLY 33 -1.297 -16.310 0.759 296 H ILE 34 H ILE 34 -2.722 -14.126 2.045 297 HA ILE 34 HA ILE 34 -0.615 -12.261 2.278 298 HB ILE 34 HB ILE 34 -3.560 -11.912 2.947 299 1HG1 ILE 34 2HG1 ILE 34 -3.277 -12.565 0.611 300 2HG1 ILE 34 1HG1 ILE 34 -3.759 -10.879 0.710 301 1HG2 ILE 34 1HG2 ILE 34 -2.190 -10.183 3.978 302 2HG2 ILE 34 2HG2 ILE 34 -3.161 -9.509 2.671 303 3HG2 ILE 34 3HG2 ILE 34 -1.443 -9.823 2.422 304 1HD1 ILE 34 1HD1 ILE 34 -1.441 -10.203 0.300 305 2HD1 ILE 34 2HD1 ILE 34 -2.071 -11.216 -1.000 306 3HD1 ILE 34 3HD1 ILE 34 -0.972 -11.900 0.198 307 H GLU 35 H GLU 35 -2.826 -13.757 4.625 308 HA GLU 35 HA GLU 35 -2.004 -12.522 6.946 309 1HB GLU 35 2HB GLU 35 -2.660 -15.440 6.576 310 2HB GLU 35 1HB GLU 35 -2.538 -14.636 8.126 311 1HG GLU 35 2HG GLU 35 -4.419 -13.194 7.500 312 2HG GLU 35 1HG GLU 35 -4.545 -14.062 5.966 313 H LYS 36 H LYS 36 -0.421 -15.107 5.195 314 HA LYS 36 HA LYS 36 1.666 -15.309 7.221 315 1HB LYS 36 2HB LYS 36 1.414 -16.827 4.621 316 2HB LYS 36 1HB LYS 36 2.453 -17.221 5.980 317 1HG LYS 36 2HG LYS 36 -0.559 -17.326 5.948 318 2HG LYS 36 1HG LYS 36 0.532 -18.705 5.881 319 1HD LYS 36 2HD LYS 36 0.288 -16.761 8.185 320 2HD LYS 36 1HD LYS 36 -0.440 -18.365 8.121 321 1HE LYS 36 2HE LYS 36 1.839 -19.319 7.870 322 2HE LYS 36 1HE LYS 36 2.497 -17.699 8.105 323 1HZ LYS 36 1HZ LYS 36 1.473 -17.653 10.299 324 2HZ LYS 36 2HZ LYS 36 2.504 -18.972 10.152 325 3HZ LYS 36 3HZ LYS 36 0.824 -19.188 10.033 326 H ASN 37 H ASN 37 1.039 -13.189 4.923 327 HA ASN 37 HA ASN 37 2.023 -12.067 3.242 328 1HB ASN 37 2HB ASN 37 4.011 -10.736 4.001 329 2HB ASN 37 1HB ASN 37 2.674 -10.736 5.135 330 1HD2 ASN 37 1HD2 ASN 37 5.969 -11.518 4.619 331 2HD2 ASN 37 2HD2 ASN 37 6.288 -12.077 6.234 332 H LYS 38 H LYS 38 2.275 -14.525 2.555 333 HA LYS 38 HA LYS 38 5.029 -14.824 1.548 334 1HB LYS 38 2HB LYS 38 4.276 -16.666 3.004 335 2HB LYS 38 1HB LYS 38 2.878 -16.913 1.976 336 1HG LYS 38 2HG LYS 38 4.344 -17.581 0.135 337 2HG LYS 38 1HG LYS 38 5.753 -17.324 1.164 338 1HD LYS 38 2HD LYS 38 5.154 -19.696 1.063 339 2HD LYS 38 1HD LYS 38 4.950 -19.060 2.697 340 1HE LYS 38 2HE LYS 38 2.542 -18.826 2.300 341 2HE LYS 38 1HE LYS 38 2.748 -19.451 0.666 342 1HZ LYS 38 1HZ LYS 38 3.468 -21.548 1.576 343 2HZ LYS 38 2HZ LYS 38 1.966 -21.134 2.228 344 3HZ LYS 38 3HZ LYS 38 3.369 -20.943 3.156 345 H TYR 39 H TYR 39 1.665 -14.508 0.806 346 HA TYR 39 HA TYR 39 1.708 -15.342 -1.923 347 1HB TYR 39 2HB TYR 39 -0.227 -15.281 -0.272 348 2HB TYR 39 1HB TYR 39 -0.246 -13.545 -0.487 349 HD1 TYR 39 1HD TYR 39 -1.080 -16.765 -1.897 350 HD2 TYR 39 2HD TYR 39 -1.076 -12.581 -2.622 351 HE1 TYR 39 1HE TYR 39 -2.687 -17.088 -3.720 352 HE2 TYR 39 2HE TYR 39 -2.682 -12.893 -4.461 353 HH TYR 39 HH TYR 39 -4.429 -15.720 -4.838 354 H ASN 40 H ASN 40 2.866 -12.694 -0.308 355 HA ASN 40 HA ASN 40 3.613 -10.583 -0.777 356 1HB ASN 40 2HB ASN 40 4.661 -11.594 -2.815 357 2HB ASN 40 1HB ASN 40 3.178 -11.273 -3.707 358 1HD2 ASN 40 1HD2 ASN 40 4.872 -9.199 -1.349 359 2HD2 ASN 40 2HD2 ASN 40 5.150 -7.905 -2.449 360 HA PRO 41 HA PRO 41 -0.498 -8.815 -1.110 361 1HB PRO 41 2HB PRO 41 0.208 -6.898 0.886 362 2HB PRO 41 1HB PRO 41 -0.777 -8.350 1.079 363 1HG PRO 41 2HG PRO 41 1.723 -7.966 2.221 364 2HG PRO 41 1HG PRO 41 0.952 -9.540 1.963 365 1HD PRO 41 2HD PRO 41 3.032 -8.152 0.319 366 2HD PRO 41 1HD PRO 41 2.880 -9.877 0.726 367 H SER 42 H SER 42 -0.626 -7.655 -2.998 368 HA SER 42 HA SER 42 0.938 -5.307 -3.460 369 1HB SER 42 2HB SER 42 -1.589 -6.291 -4.826 370 2HB SER 42 1HB SER 42 -0.506 -5.042 -5.440 371 HG SER 42 HG SER 42 0.514 -6.585 -6.343 372 H LEU 43 H LEU 43 -0.352 -3.163 -3.922 373 HA LEU 43 HA LEU 43 -1.284 -2.382 -1.408 374 1HB LEU 43 2HB LEU 43 -0.106 -0.881 -3.003 375 2HB LEU 43 1HB LEU 43 -1.532 -0.858 -4.008 376 HG LEU 43 HG LEU 43 -1.129 1.205 -2.605 377 1HD1 LEU 43 1HD1 LEU 43 -3.755 -0.195 -2.174 378 2HD1 LEU 43 2HD1 LEU 43 -3.311 0.812 -3.552 379 3HD1 LEU 43 3HD1 LEU 43 -3.457 1.529 -1.948 380 1HD2 LEU 43 1HD2 LEU 43 -1.776 1.135 -0.208 381 2HD2 LEU 43 2HD2 LEU 43 -0.363 0.145 -0.523 382 3HD2 LEU 43 3HD2 LEU 43 -1.925 -0.615 -0.306 383 H GLN 44 H GLN 44 -3.211 -2.802 -4.447 384 HA GLN 44 HA GLN 44 -5.606 -2.042 -3.200 385 1HB GLN 44 2HB GLN 44 -5.287 -2.099 -5.651 386 2HB GLN 44 1HB GLN 44 -5.228 -3.854 -5.596 387 1HG GLN 44 2HG GLN 44 -7.404 -3.057 -6.348 388 2HG GLN 44 1HG GLN 44 -7.536 -3.927 -4.820 389 1HE2 GLN 44 1HE2 GLN 44 -8.048 -2.785 -2.954 390 2HE2 GLN 44 2HE2 GLN 44 -8.697 -1.177 -3.012 391 H LEU 45 H LEU 45 -4.046 -5.123 -3.526 392 HA LEU 45 HA LEU 45 -6.093 -6.747 -2.469 393 1HB LEU 45 2HB LEU 45 -3.101 -7.145 -2.560 394 2HB LEU 45 1HB LEU 45 -4.169 -8.330 -1.851 395 HG LEU 45 HG LEU 45 -3.571 -9.044 -4.045 396 1HD1 LEU 45 1HD1 LEU 45 -6.399 -8.055 -4.009 397 2HD1 LEU 45 2HD1 LEU 45 -5.794 -9.582 -3.364 398 3HD1 LEU 45 3HD1 LEU 45 -5.754 -9.278 -5.102 399 1HD2 LEU 45 1HD2 LEU 45 -2.964 -6.910 -5.066 400 2HD2 LEU 45 2HD2 LEU 45 -4.661 -6.424 -5.084 401 3HD2 LEU 45 3HD2 LEU 45 -4.121 -7.775 -6.081 402 H ALA 46 H ALA 46 -3.364 -5.160 -0.931 403 HA ALA 46 HA ALA 46 -3.966 -6.043 1.694 404 1HB ALA 46 1HB ALA 46 -1.730 -5.273 1.038 405 2HB ALA 46 2HB ALA 46 -2.349 -4.367 2.418 406 3HB ALA 46 3HB ALA 46 -2.363 -3.642 0.810 407 H LEU 47 H LEU 47 -4.842 -3.180 -0.207 408 HA LEU 47 HA LEU 47 -5.880 -1.727 1.930 409 1HB LEU 47 2HB LEU 47 -5.068 -0.715 -0.157 410 2HB LEU 47 1HB LEU 47 -6.382 -1.455 -1.035 411 HG LEU 47 HG LEU 47 -6.545 1.043 -0.494 412 1HD1 LEU 47 1HD1 LEU 47 -8.847 -0.729 0.309 413 2HD1 LEU 47 2HD1 LEU 47 -8.465 -0.191 -1.327 414 3HD1 LEU 47 3HD1 LEU 47 -8.956 0.983 -0.105 415 1HD2 LEU 47 1HD2 LEU 47 -5.824 0.937 1.821 416 2HD2 LEU 47 2HD2 LEU 47 -7.211 -0.070 2.228 417 3HD2 LEU 47 3HD2 LEU 47 -7.454 1.604 1.716 418 H LYS 48 H LYS 48 -7.420 -4.024 -0.320 419 HA LYS 48 HA LYS 48 -9.994 -3.323 0.589 420 1HB LYS 48 2HB LYS 48 -10.792 -5.537 -0.285 421 2HB LYS 48 1HB LYS 48 -9.905 -4.584 -1.457 422 1HG LYS 48 2HG LYS 48 -7.961 -5.994 -1.183 423 2HG LYS 48 1HG LYS 48 -8.762 -6.889 0.109 424 1HD LYS 48 2HD LYS 48 -8.832 -8.104 -2.035 425 2HD LYS 48 1HD LYS 48 -10.442 -7.698 -1.453 426 1HE LYS 48 2HE LYS 48 -10.464 -5.752 -2.974 427 2HE LYS 48 1HE LYS 48 -8.882 -6.238 -3.581 428 1HZ LYS 48 1HZ LYS 48 -11.360 -7.889 -3.772 429 2HZ LYS 48 2HZ LYS 48 -9.853 -8.272 -4.447 430 3HZ LYS 48 3HZ LYS 48 -10.711 -6.938 -5.003 431 H ILE 49 H ILE 49 -7.676 -5.594 1.768 432 HA ILE 49 HA ILE 49 -9.208 -6.693 3.867 433 HB ILE 49 HB ILE 49 -6.212 -6.173 3.886 434 1HG1 ILE 49 2HG1 ILE 49 -7.713 -8.613 2.908 435 2HG1 ILE 49 1HG1 ILE 49 -6.966 -7.406 1.871 436 1HG2 ILE 49 1HG2 ILE 49 -7.119 -6.772 6.076 437 2HG2 ILE 49 2HG2 ILE 49 -6.129 -8.085 5.431 438 3HG2 ILE 49 3HG2 ILE 49 -7.889 -8.199 5.380 439 1HD1 ILE 49 1HD1 ILE 49 -5.531 -9.196 3.816 440 2HD1 ILE 49 2HD1 ILE 49 -4.776 -7.996 2.768 441 3HD1 ILE 49 3HD1 ILE 49 -5.591 -9.394 2.065 442 H ALA 50 H ALA 50 -7.120 -3.892 3.651 443 HA ALA 50 HA ALA 50 -7.134 -2.982 6.314 444 1HB ALA 50 1HB ALA 50 -6.418 -0.857 5.400 445 2HB ALA 50 2HB ALA 50 -6.962 -1.370 3.805 446 3HB ALA 50 3HB ALA 50 -5.588 -2.189 4.569 447 H TYR 51 H TYR 51 -9.189 -2.246 3.591 448 HA TYR 51 HA TYR 51 -10.769 -0.310 4.884 449 1HB TYR 51 2HB TYR 51 -10.515 -0.285 2.493 450 2HB TYR 51 1HB TYR 51 -11.141 -1.917 2.356 451 HD1 TYR 51 1HD TYR 51 -13.429 -2.331 2.458 452 HD2 TYR 51 2HD TYR 51 -12.014 1.622 2.839 453 HE1 TYR 51 1HE TYR 51 -15.741 -1.487 2.056 454 HE2 TYR 51 2HE TYR 51 -14.281 2.505 2.451 455 HH TYR 51 HH TYR 51 -16.439 1.663 1.277 456 H TYR 52 H TYR 52 -11.349 -3.768 4.142 457 HA TYR 52 HA TYR 52 -13.901 -3.634 5.387 458 1HB TYR 52 2HB TYR 52 -12.385 -5.973 4.286 459 2HB TYR 52 1HB TYR 52 -13.953 -6.141 5.073 460 HD1 TYR 52 1HD TYR 52 -15.865 -4.639 4.156 461 HD2 TYR 52 2HD TYR 52 -12.308 -5.513 2.020 462 HE1 TYR 52 1HE TYR 52 -17.001 -4.082 2.050 463 HE2 TYR 52 2HE TYR 52 -13.411 -4.964 -0.077 464 HH TYR 52 HH TYR 52 -16.409 -3.374 -0.189 465 H LEU 53 H LEU 53 -10.828 -4.580 6.526 466 HA LEU 53 HA LEU 53 -12.006 -5.386 9.085 467 1HB LEU 53 2HB LEU 53 -9.113 -5.087 8.264 468 2HB LEU 53 1HB LEU 53 -9.601 -5.503 9.896 469 1HD1 LEU 53 1HD1 LEU 53 -8.540 -8.719 8.383 470 2HD1 LEU 53 2HD1 LEU 53 -8.201 -7.572 9.678 471 3HD1 LEU 53 3HD1 LEU 53 -7.804 -7.162 8.008 472 1HD2 LEU 53 1HD2 LEU 53 -11.882 -7.397 9.165 473 2HD2 LEU 53 2HD2 LEU 53 -10.629 -7.721 10.363 474 3HD2 LEU 53 3HD2 LEU 53 -10.903 -8.858 9.043 475 H ASN 54 H ASN 54 -11.339 -2.672 7.530 476 HA ASN 54 HA ASN 54 -10.947 -0.526 7.893 477 1HB ASN 54 2HB ASN 54 -13.355 -0.805 8.597 478 2HB ASN 54 1HB ASN 54 -12.793 -0.824 10.270 479 1HD2 ASN 54 1HD2 ASN 54 -13.924 1.115 10.741 480 2HD2 ASN 54 2HD2 ASN 54 -13.305 2.631 10.187 481 H THR 55 H THR 55 -8.783 -0.885 8.347 482 HA THR 55 HA THR 55 -8.042 0.144 10.956 483 HB THR 55 HB THR 55 -6.839 -2.382 9.763 484 HG1 THR 55 1HG THR 55 -9.074 -2.121 11.045 485 1HG2 THR 55 1HG2 THR 55 -5.683 -2.562 11.917 486 2HG2 THR 55 2HG2 THR 55 -6.439 -1.064 12.453 487 3HG2 THR 55 3HG2 THR 55 -5.280 -1.040 11.123 488 HA PRO 56 HA PRO 56 -5.352 2.564 8.269 489 1HB PRO 56 2HB PRO 56 -3.482 2.380 10.578 490 2HB PRO 56 1HB PRO 56 -4.045 3.800 9.699 491 1HG PRO 56 2HG PRO 56 -4.986 3.232 12.126 492 2HG PRO 56 1HG PRO 56 -6.027 3.921 10.866 493 1HD PRO 56 2HD PRO 56 -5.892 1.138 11.905 494 2HD PRO 56 1HD PRO 56 -7.284 2.058 11.307 495 H LEU 57 H LEU 57 -3.868 1.982 6.851 496 HA LEU 57 HA LEU 57 -2.993 -0.630 6.549 497 1HB LEU 57 2HB LEU 57 -1.917 1.892 5.320 498 2HB LEU 57 1HB LEU 57 -1.355 0.302 4.876 499 1HD1 LEU 57 1HD1 LEU 57 -5.223 1.590 3.664 500 2HD1 LEU 57 2HD1 LEU 57 -4.134 2.720 4.472 501 3HD1 LEU 57 3HD1 LEU 57 -4.917 1.438 5.394 502 1HD2 LEU 57 1HD2 LEU 57 -3.471 1.046 2.048 503 2HD2 LEU 57 2HD2 LEU 57 -1.931 0.367 2.610 504 3HD2 LEU 57 3HD2 LEU 57 -2.283 2.073 2.868 505 H GLU 58 H GLU 58 -1.242 2.140 7.855 506 HA GLU 58 HA GLU 58 1.276 0.978 8.220 507 1HB GLU 58 2HB GLU 58 -0.041 2.903 10.124 508 2HB GLU 58 1HB GLU 58 1.677 2.586 9.974 509 1HG GLU 58 2HG GLU 58 1.560 3.487 7.665 510 2HG GLU 58 1HG GLU 58 -0.120 3.922 7.998 511 H ASP 59 H ASP 59 -1.614 0.667 10.196 512 HA ASP 59 HA ASP 59 -0.256 -0.509 12.407 513 1HB ASP 59 2HB ASP 59 -2.387 0.703 12.694 514 2HB ASP 59 1HB ASP 59 -3.205 -0.505 11.711 515 H ILE 60 H ILE 60 -1.801 -1.584 9.583 516 HA ILE 60 HA ILE 60 -1.909 -4.378 10.300 517 HB ILE 60 HB ILE 60 -2.214 -3.234 7.502 518 1HG1 ILE 60 2HG1 ILE 60 -4.323 -3.834 9.595 519 2HG1 ILE 60 1HG1 ILE 60 -3.831 -2.226 9.082 520 1HG2 ILE 60 1HG2 ILE 60 -3.091 -5.849 8.736 521 2HG2 ILE 60 2HG2 ILE 60 -1.763 -5.636 7.594 522 3HG2 ILE 60 3HG2 ILE 60 -3.424 -5.329 7.084 523 1HD1 ILE 60 1HD1 ILE 60 -4.671 -2.692 6.843 524 2HD1 ILE 60 2HD1 ILE 60 -5.928 -2.885 8.064 525 3HD1 ILE 60 3HD1 ILE 60 -5.154 -4.306 7.361 526 H PHE 61 H PHE 61 -0.012 -2.522 7.920 527 HA PHE 61 HA PHE 61 2.009 -4.653 8.061 528 1HB PHE 61 2HB PHE 61 1.331 -2.823 5.712 529 2HB PHE 61 1HB PHE 61 2.716 -3.902 5.782 530 HD1 PHE 61 1HD PHE 61 2.364 -6.341 5.762 531 HD2 PHE 61 2HD PHE 61 -0.838 -3.596 5.217 532 HE1 PHE 61 1HE PHE 61 0.991 -8.140 4.799 533 HE2 PHE 61 2HE PHE 61 -2.219 -5.392 4.260 534 HZ PHE 61 HZ PHE 61 -1.305 -7.666 4.049 535 H GLN 62 H GLN 62 4.068 -4.071 8.481 536 HA GLN 62 HA GLN 62 4.582 -1.223 8.808 537 1HB GLN 62 2HB GLN 62 4.580 -2.459 10.955 538 2HB GLN 62 1HB GLN 62 5.801 -3.550 10.321 539 1HG GLN 62 2HG GLN 62 7.405 -1.775 10.191 540 2HG GLN 62 1HG GLN 62 6.186 -0.587 10.639 541 1HE2 GLN 62 1HE2 GLN 62 7.309 0.108 12.403 542 2HE2 GLN 62 2HE2 GLN 62 7.497 -0.813 13.842 543 H TRP 63 H TRP 63 6.097 -0.440 7.598 544 HA TRP 63 HA TRP 63 7.641 -2.321 6.002 545 1HB TRP 63 2HB TRP 63 7.768 -0.435 4.342 546 2HB TRP 63 1HB TRP 63 6.214 -1.197 4.569 547 HD1 TRP 63 HD TRP 63 7.979 2.157 5.362 548 HE1 TRP 63 1HE TRP 63 6.133 3.936 5.788 549 HE3 TRP 63 3HE TRP 63 3.862 -0.871 5.273 550 HZ2 TRP 63 2HZ TRP 63 3.340 4.025 6.005 551 HZ3 TRP 63 3HZ TRP 63 1.645 0.138 5.587 552 HH2 TRP 63 HH TRP 63 1.387 2.523 5.937 553 H GLN 64 H GLN 64 9.748 -2.295 6.028 554 HA GLN 64 HA GLN 64 11.089 -0.036 7.328 555 1HB GLN 64 2HB GLN 64 11.902 -2.952 7.251 556 2HB GLN 64 1HB GLN 64 12.776 -1.658 8.051 557 1HG GLN 64 2HG GLN 64 9.991 -2.503 8.811 558 2HG GLN 64 1HG GLN 64 11.450 -3.169 9.541 559 1HE2 GLN 64 1HE2 GLN 64 12.658 -1.891 10.881 560 2HE2 GLN 64 2HE2 GLN 64 12.052 -0.442 11.599 561 HA PRO 65 HA PRO 65 12.840 -0.300 3.023 562 1HB PRO 65 2HB PRO 65 12.947 2.625 3.210 563 2HB PRO 65 1HB PRO 65 12.113 1.627 2.016 564 1HG PRO 65 2HG PRO 65 10.771 3.088 3.851 565 2HG PRO 65 1HG PRO 65 10.168 1.532 3.255 566 1HD PRO 65 2HD PRO 65 11.616 2.147 5.811 567 2HD PRO 65 1HD PRO 65 10.185 1.125 5.549 568 H GLU 66 H GLU 66 13.561 1.409 5.810 569 HA GLU 66 HA GLU 66 16.445 1.620 5.251 570 1HB GLU 66 2HB GLU 66 14.751 2.866 7.427 571 2HB GLU 66 1HB GLU 66 16.504 2.976 7.383 572 1HG GLU 66 2HG GLU 66 14.666 4.009 5.233 573 2HG GLU 66 1HG GLU 66 15.361 4.986 6.528 574 1H MET 67 1HT MET 67 -11.213 1.032 -9.337 575 2H MET 67 2HT MET 67 -10.853 1.728 -7.840 576 3H MET 67 3HT MET 67 -9.704 0.775 -8.608 577 HA MET 67 HA MET 67 -9.521 2.404 -10.371 578 1HB MET 67 2HB MET 67 -11.444 3.934 -8.608 579 2HB MET 67 1HB MET 67 -10.546 4.639 -9.942 580 1HG MET 67 2HG MET 67 -12.582 2.437 -10.154 581 2HG MET 67 1HG MET 67 -12.840 4.134 -10.561 582 1HE MET 67 1HE MET 67 -13.685 3.543 -12.977 583 2HE MET 67 2HE MET 67 -13.509 1.829 -12.603 584 3HE MET 67 3HE MET 67 -12.819 2.482 -14.088 585 H ILE 68 H ILE 68 -7.615 3.444 -10.159 586 HA ILE 68 HA ILE 68 -6.793 4.156 -7.436 587 HB ILE 68 HB ILE 68 -5.085 3.083 -9.710 588 1HG1 ILE 68 2HG1 ILE 68 -6.354 1.320 -8.578 589 2HG1 ILE 68 1HG1 ILE 68 -4.639 1.170 -8.215 590 1HG2 ILE 68 1HG2 ILE 68 -4.193 3.962 -6.962 591 2HG2 ILE 68 2HG2 ILE 68 -3.836 4.775 -8.485 592 3HG2 ILE 68 3HG2 ILE 68 -3.176 3.170 -8.168 593 1HD1 ILE 68 1HD1 ILE 68 -5.019 2.189 -6.022 594 2HD1 ILE 68 2HD1 ILE 68 -6.000 0.743 -6.248 595 3HD1 ILE 68 3HD1 ILE 68 -6.737 2.339 -6.392 596 H ILE 69 H ILE 69 -6.081 6.197 -7.137 597 HA ILE 69 HA ILE 69 -5.636 7.878 -9.479 598 HB ILE 69 HB ILE 69 -7.006 8.663 -6.859 599 1HG1 ILE 69 2HG1 ILE 69 -8.907 9.413 -8.430 600 2HG1 ILE 69 1HG1 ILE 69 -8.125 8.442 -9.665 601 1HG2 ILE 69 1HG2 ILE 69 -6.316 10.414 -9.204 602 2HG2 ILE 69 2HG2 ILE 69 -5.553 10.432 -7.617 603 3HG2 ILE 69 3HG2 ILE 69 -7.243 10.910 -7.787 604 1HD1 ILE 69 1HD1 ILE 69 -8.465 6.445 -8.280 605 2HD1 ILE 69 2HD1 ILE 69 -9.984 7.257 -8.655 606 3HD1 ILE 69 3HD1 ILE 69 -9.261 7.436 -7.057 607 H ASN 70 H ASN 70 -3.658 8.973 -9.296 608 HA ASN 70 HA ASN 70 -2.385 8.615 -6.684 609 1HB ASN 70 2HB ASN 70 -1.391 7.075 -8.341 610 2HB ASN 70 1HB ASN 70 -1.003 8.454 -9.368 611 1HD2 ASN 70 1HD2 ASN 70 -0.712 8.432 -5.810 612 2HD2 ASN 70 2HD2 ASN 70 1.003 8.548 -5.846 613 H ASN 71 H ASN 71 -1.560 10.456 -5.786 614 HA ASN 71 HA ASN 71 -1.708 12.801 -7.509 615 1HB ASN 71 2HB ASN 71 -2.101 12.592 -4.509 616 2HB ASN 71 1HB ASN 71 -2.045 14.093 -5.413 617 1HD2 ASN 71 1HD2 ASN 71 -4.096 13.251 -3.753 618 2HD2 ASN 71 2HD2 ASN 71 -5.548 13.050 -4.654 619 H LEU 72 H LEU 72 0.439 10.896 -7.114 620 HA LEU 72 HA LEU 72 2.414 11.696 -5.272 621 1HB LEU 72 2HB LEU 72 2.484 9.591 -6.671 622 2HB LEU 72 1HB LEU 72 2.974 10.564 -8.030 623 HG LEU 72 HG LEU 72 4.803 9.231 -6.909 624 1HD1 LEU 72 1HD1 LEU 72 5.228 12.204 -7.006 625 2HD1 LEU 72 2HD1 LEU 72 5.441 11.059 -8.336 626 3HD1 LEU 72 3HD1 LEU 72 6.501 10.987 -6.931 627 1HD2 LEU 72 1HD2 LEU 72 5.769 10.102 -4.845 628 2HD2 LEU 72 2HD2 LEU 72 4.119 9.523 -4.610 629 3HD2 LEU 72 3HD2 LEU 72 4.441 11.254 -4.718 630 H LYS 73 H LYS 73 1.806 12.868 -8.534 631 HA LYS 73 HA LYS 73 3.994 14.632 -8.574 632 1HB LYS 73 2HB LYS 73 2.762 15.759 -10.457 633 2HB LYS 73 1HB LYS 73 3.079 14.049 -10.671 634 1HG LYS 73 2HG LYS 73 0.763 13.539 -10.140 635 2HG LYS 73 1HG LYS 73 0.445 15.252 -9.844 636 1HD LYS 73 2HD LYS 73 0.993 15.784 -12.144 637 2HD LYS 73 1HD LYS 73 1.431 14.103 -12.450 638 1HE LYS 73 2HE LYS 73 -0.860 13.414 -12.065 639 2HE LYS 73 1HE LYS 73 -1.310 15.070 -11.658 640 1HZ LYS 73 1HZ LYS 73 -0.845 15.763 -13.864 641 2HZ LYS 73 2HZ LYS 73 -1.868 14.418 -13.967 642 3HZ LYS 73 3HZ LYS 73 -0.216 14.256 -14.297 643 H LEU 74 H LEU 74 0.585 15.150 -7.643 644 HA LEU 74 HA LEU 74 0.815 17.832 -6.955 645 1HB LEU 74 2HB LEU 74 -1.301 16.608 -7.369 646 2HB LEU 74 1HB LEU 74 -1.028 15.640 -5.949 647 HG LEU 74 HG LEU 74 -2.816 17.404 -5.781 648 1HD1 LEU 74 1HD1 LEU 74 -2.259 18.130 -3.527 649 2HD1 LEU 74 2HD1 LEU 74 -0.595 17.593 -3.767 650 3HD1 LEU 74 3HD1 LEU 74 -1.911 16.420 -3.777 651 1HD2 LEU 74 1HD2 LEU 74 -1.715 19.187 -6.990 652 2HD2 LEU 74 2HD2 LEU 74 -0.458 19.274 -5.758 653 3HD2 LEU 74 3HD2 LEU 74 -2.120 19.712 -5.355 654 H ILE 75 H ILE 75 1.343 14.880 -5.115 655 HA ILE 75 HA ILE 75 1.891 15.988 -2.601 656 HB ILE 75 HB ILE 75 3.153 13.504 -3.825 657 1HG1 ILE 75 2HG1 ILE 75 0.743 13.310 -3.784 658 2HG1 ILE 75 1HG1 ILE 75 1.429 12.267 -2.547 659 1HG2 ILE 75 1HG2 ILE 75 4.449 14.245 -1.910 660 2HG2 ILE 75 2HG2 ILE 75 3.569 12.767 -1.516 661 3HG2 ILE 75 3HG2 ILE 75 2.987 14.323 -0.926 662 1HD1 ILE 75 1HD1 ILE 75 -0.566 13.397 -1.751 663 2HD1 ILE 75 2HD1 ILE 75 0.174 14.962 -2.090 664 3HD1 ILE 75 3HD1 ILE 75 0.854 13.916 -0.843 665 H ARG 76 H ARG 76 3.863 15.585 -5.396 666 HA ARG 76 HA ARG 76 6.322 16.394 -4.216 667 1HB ARG 76 2HB ARG 76 5.502 16.644 -7.104 668 2HB ARG 76 1HB ARG 76 7.117 16.911 -6.481 669 1HG ARG 76 2HG ARG 76 6.989 14.487 -5.674 670 2HG ARG 76 1HG ARG 76 5.604 14.353 -6.765 671 1HD ARG 76 2HD ARG 76 8.410 15.184 -7.502 672 2HD ARG 76 1HD ARG 76 7.635 13.655 -7.896 673 HE ARG 76 HE ARG 76 6.342 14.731 -9.525 674 1HH1 ARG 76 1HH1 ARG 76 8.425 17.104 -7.878 675 2HH1 ARG 76 2HH1 ARG 76 8.449 18.201 -9.167 676 1HH2 ARG 76 1HH2 ARG 76 6.373 16.243 -11.292 677 2HH2 ARG 76 2HH2 ARG 76 7.256 17.707 -11.150 678 H GLU 77 H GLU 77 3.569 18.253 -5.669 679 HA GLU 77 HA GLU 77 4.891 20.699 -5.533 680 1HB GLU 77 2HB GLU 77 1.947 20.039 -5.659 681 2HB GLU 77 1HB GLU 77 2.684 21.594 -6.033 682 1HG GLU 77 2HG GLU 77 3.934 20.517 -7.868 683 2HG GLU 77 1HG GLU 77 3.085 19.016 -7.522 684 H LYS 78 H LYS 78 2.700 18.935 -3.357 685 HA LYS 78 HA LYS 78 2.542 20.815 -1.321 686 1HB LYS 78 2HB LYS 78 2.708 17.808 -1.002 687 2HB LYS 78 1HB LYS 78 2.173 18.922 0.248 688 1HG LYS 78 2HG LYS 78 0.300 19.614 -1.155 689 2HG LYS 78 1HG LYS 78 0.843 18.515 -2.421 690 1HD LYS 78 2HD LYS 78 -0.984 17.513 -1.177 691 2HD LYS 78 1HD LYS 78 0.502 16.618 -0.881 692 1HE LYS 78 2HE LYS 78 0.774 17.700 1.263 693 2HE LYS 78 1HE LYS 78 -0.622 18.731 0.951 694 1HZ LYS 78 1HZ LYS 78 -0.699 15.759 1.266 695 2HZ LYS 78 2HZ LYS 78 -1.994 16.742 0.878 696 3HZ LYS 78 3HZ LYS 78 -1.274 16.905 2.373 697 H LYS 79 H LYS 79 5.098 18.507 -1.924 698 HA LYS 79 HA LYS 79 6.861 19.720 0.119 699 1HB LYS 79 2HB LYS 79 7.650 17.724 -2.034 700 2HB LYS 79 1HB LYS 79 8.403 17.973 -0.473 701 1HG LYS 79 2HG LYS 79 5.730 16.665 -0.961 702 2HG LYS 79 1HG LYS 79 7.243 15.828 -0.633 703 1HD LYS 79 2HD LYS 79 7.325 16.873 1.582 704 2HD LYS 79 1HD LYS 79 5.811 17.716 1.235 705 1HE LYS 79 2HE LYS 79 4.661 15.581 0.987 706 2HE LYS 79 1HE LYS 79 6.170 14.722 1.283 707 1HZ LYS 79 1HZ LYS 79 4.701 16.441 3.209 708 2HZ LYS 79 2HZ LYS 79 6.228 15.757 3.490 709 3HZ LYS 79 3HZ LYS 79 4.872 14.759 3.265 710 H LYS 80 H LYS 80 9.461 20.244 -1.567 711 HA LYS 80 HA LYS 80 8.335 20.744 -4.033 712 1HB LYS 80 2HB LYS 80 9.905 22.727 -4.148 713 2HB LYS 80 1HB LYS 80 8.524 22.956 -3.101 714 1HG LYS 80 2HG LYS 80 9.942 22.589 -1.146 715 2HG LYS 80 1HG LYS 80 11.332 22.316 -2.206 716 1HD LYS 80 2HD LYS 80 11.115 24.563 -3.104 717 2HD LYS 80 1HD LYS 80 9.695 24.844 -2.098 718 1HE LYS 80 2HE LYS 80 11.083 24.571 -0.092 719 2HE LYS 80 1HE LYS 80 12.496 24.307 -1.117 720 1HZ LYS 80 1HZ LYS 80 10.852 26.778 -1.099 721 2HZ LYS 80 2HZ LYS 80 12.216 26.556 -2.015 722 3HZ LYS 80 3HZ LYS 80 12.326 26.624 -0.314 723 H ILE 81 H ILE 81 8.983 18.615 -4.137 724 HA ILE 81 HA ILE 81 11.867 18.282 -4.596 725 HB ILE 81 HB ILE 81 9.924 16.143 -3.633 726 1HG1 ILE 81 2HG1 ILE 81 12.027 17.609 -2.015 727 2HG1 ILE 81 1HG1 ILE 81 10.294 17.878 -1.890 728 1HG2 ILE 81 1HG2 ILE 81 11.949 14.832 -3.201 729 2HG2 ILE 81 2HG2 ILE 81 12.933 16.146 -3.844 730 3HG2 ILE 81 3HG2 ILE 81 11.818 15.283 -4.902 731 1HD1 ILE 81 1HD1 ILE 81 11.740 15.317 -1.234 732 2HD1 ILE 81 2HD1 ILE 81 10.001 15.574 -1.107 733 3HD1 ILE 81 3HD1 ILE 81 11.104 16.481 -0.073 734 H SER 82 H SER 82 12.345 17.196 -6.527 735 HA SER 82 HA SER 82 10.079 16.846 -8.281 736 1HB SER 82 2HB SER 82 13.031 16.894 -8.891 737 2HB SER 82 1HB SER 82 11.721 16.881 -10.074 738 HG SER 82 HG SER 82 11.042 18.902 -8.785 739 H GLN 83 H GLN 83 10.506 14.932 -9.893 740 HA GLN 83 HA GLN 83 10.154 12.725 -8.127 741 1HB GLN 83 2HB GLN 83 9.512 11.308 -9.985 742 2HB GLN 83 1HB GLN 83 8.651 12.828 -10.030 743 1HG GLN 83 2HG GLN 83 11.022 12.144 -11.748 744 2HG GLN 83 1HG GLN 83 9.338 11.971 -12.236 745 1HE2 GLN 83 1HE2 GLN 83 8.100 13.812 -12.480 746 2HE2 GLN 83 2HE2 GLN 83 8.822 15.342 -12.820 747 H SER 84 H SER 84 12.873 13.710 -10.098 748 HA SER 84 HA SER 84 14.096 11.174 -10.192 749 1HB SER 84 2HB SER 84 15.434 13.867 -10.260 750 2HB SER 84 1HB SER 84 15.962 12.367 -11.035 751 HG SER 84 HG SER 84 14.123 14.221 -11.806 752 H GLU 85 H GLU 85 14.244 13.895 -7.969 753 HA GLU 85 HA GLU 85 16.255 13.034 -6.249 754 1HB GLU 85 2HB GLU 85 13.783 14.722 -5.808 755 2HB GLU 85 1HB GLU 85 15.004 14.479 -4.576 756 1HG GLU 85 2HG GLU 85 15.173 16.647 -5.770 757 2HG GLU 85 1HG GLU 85 16.633 15.674 -5.845 758 H LEU 86 H LEU 86 12.785 12.506 -6.285 759 HA LEU 86 HA LEU 86 12.652 10.899 -3.958 760 1HB LEU 86 2HB LEU 86 10.777 11.067 -6.314 761 2HB LEU 86 1HB LEU 86 10.437 10.182 -4.842 762 HG LEU 86 HG LEU 86 10.822 13.167 -5.051 763 1HD1 LEU 86 1HD1 LEU 86 8.436 13.266 -4.527 764 2HD1 LEU 86 2HD1 LEU 86 8.357 11.505 -4.562 765 3HD1 LEU 86 3HD1 LEU 86 8.728 12.400 -6.036 766 1HD2 LEU 86 1HD2 LEU 86 11.604 12.296 -2.915 767 2HD2 LEU 86 2HD2 LEU 86 10.080 11.431 -2.699 768 3HD2 LEU 86 3HD2 LEU 86 10.098 13.193 -2.708 769 H ALA 87 H ALA 87 12.998 10.172 -7.382 770 HA ALA 87 HA ALA 87 12.759 7.400 -7.310 771 1HB ALA 87 1HB ALA 87 14.527 9.054 -9.109 772 2HB ALA 87 2HB ALA 87 12.820 8.699 -9.384 773 3HB ALA 87 3HB ALA 87 14.008 7.395 -9.409 774 H ALA 88 H ALA 88 15.580 9.472 -6.821 775 HA ALA 88 HA ALA 88 17.468 7.440 -6.515 776 1HB ALA 88 1HB ALA 88 18.041 9.804 -6.857 777 2HB ALA 88 2HB ALA 88 18.839 9.140 -5.431 778 3HB ALA 88 3HB ALA 88 17.426 10.181 -5.247 779 H LEU 89 H LEU 89 15.304 8.995 -4.186 780 HA LEU 89 HA LEU 89 16.325 7.724 -1.858 781 1HB LEU 89 2HB LEU 89 13.635 8.952 -2.442 782 2HB LEU 89 1HB LEU 89 14.087 8.329 -0.873 783 HG LEU 89 HG LEU 89 15.474 10.611 -2.279 784 1HD1 LEU 89 1HD1 LEU 89 13.498 10.613 0.002 785 2HD1 LEU 89 2HD1 LEU 89 13.177 11.174 -1.638 786 3HD1 LEU 89 3HD1 LEU 89 14.348 12.023 -0.629 787 1HD2 LEU 89 1HD2 LEU 89 16.917 9.371 -0.746 788 2HD2 LEU 89 2HD2 LEU 89 15.712 9.541 0.533 789 3HD2 LEU 89 3HD2 LEU 89 16.529 10.967 -0.104 790 H LEU 90 H LEU 90 13.743 6.926 -4.159 791 HA LEU 90 HA LEU 90 12.858 4.664 -2.650 792 1HB LEU 90 2HB LEU 90 12.256 5.442 -5.484 793 2HB LEU 90 1HB LEU 90 11.327 4.355 -4.471 794 HG LEU 90 HG LEU 90 11.634 7.323 -4.095 795 1HD1 LEU 90 1HD1 LEU 90 9.313 5.674 -5.033 796 2HD1 LEU 90 2HD1 LEU 90 10.281 6.786 -6.003 797 3HD1 LEU 90 3HD1 LEU 90 9.270 7.402 -4.694 798 1HD2 LEU 90 1HD2 LEU 90 9.947 7.101 -2.352 799 2HD2 LEU 90 2HD2 LEU 90 11.382 6.151 -1.954 800 3HD2 LEU 90 3HD2 LEU 90 9.933 5.356 -2.576 801 H GLU 91 H GLU 91 15.489 5.220 -4.570 802 HA GLU 91 HA GLU 91 17.096 3.944 -5.504 803 1HB GLU 91 2HB GLU 91 15.573 1.611 -4.319 804 2HB GLU 91 1HB GLU 91 17.241 1.588 -4.872 805 1HG GLU 91 2HG GLU 91 17.924 3.028 -3.093 806 2HG GLU 91 1HG GLU 91 16.251 3.328 -2.628 807 H VAL 92 H VAL 92 14.631 4.605 -6.963 808 HA VAL 92 HA VAL 92 14.524 2.375 -8.863 809 HB VAL 92 HB VAL 92 12.228 3.003 -9.454 810 1HG1 VAL 92 1HG1 VAL 92 12.522 2.517 -6.501 811 2HG1 VAL 92 2HG1 VAL 92 12.478 1.297 -7.772 812 3HG1 VAL 92 3HG1 VAL 92 11.047 2.272 -7.437 813 1HG2 VAL 92 1HG2 VAL 92 12.265 5.374 -8.958 814 2HG2 VAL 92 2HG2 VAL 92 12.440 5.041 -7.241 815 3HG2 VAL 92 3HG2 VAL 92 10.942 4.611 -8.072 816 H SER 93 H SER 93 13.760 3.236 -11.062 817 HA SER 93 HA SER 93 15.572 5.335 -11.763 818 1HB SER 93 2HB SER 93 13.656 3.769 -13.490 819 2HB SER 93 1HB SER 93 15.051 4.710 -14.041 820 HG SER 93 HG SER 93 16.011 3.165 -12.218 821 H ARG 94 H ARG 94 15.065 7.206 -12.883 822 HA ARG 94 HA ARG 94 13.044 8.871 -11.945 823 1HB ARG 94 2HB ARG 94 14.462 9.082 -14.610 824 2HB ARG 94 1HB ARG 94 13.598 10.383 -13.808 825 1HG ARG 94 2HG ARG 94 15.219 10.383 -12.003 826 2HG ARG 94 1HG ARG 94 16.053 9.009 -12.730 827 1HD ARG 94 2HD ARG 94 17.239 11.051 -13.253 828 2HD ARG 94 1HD ARG 94 16.527 10.386 -14.722 829 HE ARG 94 HE ARG 94 14.929 12.370 -13.360 830 1HH1 ARG 94 1HH1 ARG 94 17.456 11.876 -15.788 831 2HH1 ARG 94 2HH1 ARG 94 17.175 13.289 -16.635 832 1HH2 ARG 94 1HH2 ARG 94 14.455 14.365 -14.521 833 2HH2 ARG 94 2HH2 ARG 94 15.381 14.764 -15.888 834 H GLN 95 H GLN 95 13.161 7.075 -14.973 835 HA GLN 95 HA GLN 95 10.685 7.879 -16.054 836 1HB GLN 95 2HB GLN 95 12.446 6.682 -17.331 837 2HB GLN 95 1HB GLN 95 12.092 5.223 -16.424 838 1HG GLN 95 2HG GLN 95 9.811 5.226 -17.370 839 2HG GLN 95 1HG GLN 95 10.241 6.641 -18.331 840 1HE2 GLN 95 1HE2 GLN 95 9.403 3.996 -19.238 841 2HE2 GLN 95 2HE2 GLN 95 10.696 3.386 -20.196 842 H THR 96 H THR 96 11.525 5.377 -13.768 843 HA THR 96 HA THR 96 9.136 3.944 -13.712 844 HB THR 96 HB THR 96 11.262 4.364 -11.609 845 HG1 THR 96 1HG THR 96 11.961 2.275 -12.502 846 1HG2 THR 96 1HG2 THR 96 10.534 2.185 -10.705 847 2HG2 THR 96 2HG2 THR 96 9.226 2.136 -11.887 848 3HG2 THR 96 3HG2 THR 96 9.237 3.377 -10.632 849 H ILE 97 H ILE 97 10.339 6.552 -11.536 850 HA ILE 97 HA ILE 97 7.893 6.616 -10.078 851 HB ILE 97 HB ILE 97 9.979 7.281 -8.991 852 1HG1 ILE 97 2HG1 ILE 97 9.274 9.424 -7.929 853 2HG1 ILE 97 1HG1 ILE 97 8.021 9.584 -9.153 854 1HG2 ILE 97 1HG2 ILE 97 11.143 8.253 -10.832 855 2HG2 ILE 97 2HG2 ILE 97 11.091 9.390 -9.485 856 3HG2 ILE 97 3HG2 ILE 97 10.019 9.612 -10.871 857 1HD1 ILE 97 1HD1 ILE 97 7.117 8.731 -7.070 858 2HD1 ILE 97 2HD1 ILE 97 8.242 7.374 -7.119 859 3HD1 ILE 97 3HD1 ILE 97 6.983 7.520 -8.345 860 H ASN 98 H ASN 98 9.135 8.446 -12.767 861 HA ASN 98 HA ASN 98 7.130 10.420 -12.964 862 1HB ASN 98 2HB ASN 98 9.298 10.387 -14.239 863 2HB ASN 98 1HB ASN 98 8.681 9.065 -15.205 864 1HD2 ASN 98 1HD2 ASN 98 9.626 11.712 -15.921 865 2HD2 ASN 98 2HD2 ASN 98 8.361 12.440 -16.854 866 H GLY 99 H GLY 99 7.357 7.142 -14.053 867 1HA GLY 99 2HA GLY 99 4.923 6.970 -15.501 868 2HA GLY 99 1HA GLY 99 5.797 5.607 -14.808 869 H ILE 100 H ILE 100 5.723 6.622 -12.086 870 HA ILE 100 HA ILE 100 3.232 5.640 -11.255 871 HB ILE 100 HB ILE 100 5.401 7.114 -9.720 872 1HG1 ILE 100 2HG1 ILE 100 6.192 5.004 -10.647 873 2HG1 ILE 100 1HG1 ILE 100 6.059 4.884 -8.899 874 1HG2 ILE 100 1HG2 ILE 100 4.403 6.227 -7.670 875 2HG2 ILE 100 2HG2 ILE 100 3.070 5.557 -8.608 876 3HG2 ILE 100 3HG2 ILE 100 3.298 7.304 -8.523 877 1HD1 ILE 100 1HD1 ILE 100 4.100 3.780 -10.906 878 2HD1 ILE 100 2HD1 ILE 100 3.963 3.646 -9.152 879 3HD1 ILE 100 3HD1 ILE 100 5.293 2.852 -9.995 880 H GLU 101 H GLU 101 4.621 8.927 -11.426 881 HA GLU 101 HA GLU 101 2.544 10.398 -10.346 882 1HB GLU 101 2HB GLU 101 4.227 11.184 -12.728 883 2HB GLU 101 1HB GLU 101 3.245 12.285 -11.782 884 1HG GLU 101 2HG GLU 101 4.644 11.795 -9.828 885 2HG GLU 101 1HG GLU 101 5.667 10.768 -10.842 886 H LYS 102 H LYS 102 2.705 8.955 -13.459 887 HA LYS 102 HA LYS 102 0.182 10.200 -14.318 888 1HB LYS 102 2HB LYS 102 2.032 8.333 -15.792 889 2HB LYS 102 1HB LYS 102 0.560 9.012 -16.456 890 1HG LYS 102 2HG LYS 102 1.534 11.267 -16.197 891 2HG LYS 102 1HG LYS 102 3.033 10.514 -15.635 892 1HD LYS 102 2HD LYS 102 1.733 9.977 -18.307 893 2HD LYS 102 1HD LYS 102 3.071 11.096 -18.051 894 1HE LYS 102 2HE LYS 102 3.150 8.138 -17.429 895 2HE LYS 102 1HE LYS 102 3.782 8.871 -18.902 896 1HZ LYS 102 1HZ LYS 102 5.565 8.551 -17.287 897 2HZ LYS 102 2HZ LYS 102 4.741 9.476 -16.142 898 3HZ LYS 102 3HZ LYS 102 5.280 10.186 -17.553 899 H ASN 103 H ASN 103 0.862 7.794 -12.335 900 HA ASN 103 HA ASN 103 0.243 5.689 -11.827 901 1HB ASN 103 2HB ASN 103 -2.203 5.357 -11.555 902 2HB ASN 103 1HB ASN 103 -1.709 6.943 -11.010 903 1HD2 ASN 103 1HD2 ASN 103 -3.675 5.148 -13.261 904 2HD2 ASN 103 2HD2 ASN 103 -4.482 6.523 -13.902 905 H LYS 104 H LYS 104 1.349 5.728 -14.263 906 HA LYS 104 HA LYS 104 -0.402 4.180 -16.025 907 1HB LYS 104 2HB LYS 104 0.629 6.377 -16.780 908 2HB LYS 104 1HB LYS 104 2.186 5.565 -16.710 909 1HG LYS 104 2HG LYS 104 1.299 5.639 -18.977 910 2HG LYS 104 1HG LYS 104 1.439 3.975 -18.394 911 1HD LYS 104 2HD LYS 104 -0.901 3.884 -17.905 912 2HD LYS 104 1HD LYS 104 -1.092 5.596 -18.274 913 1HE LYS 104 2HE LYS 104 -0.577 5.183 -20.594 914 2HE LYS 104 1HE LYS 104 -0.251 3.483 -20.246 915 1HZ LYS 104 1HZ LYS 104 -2.518 3.140 -19.667 916 2HZ LYS 104 2HZ LYS 104 -2.573 3.988 -21.145 917 3HZ LYS 104 3HZ LYS 104 -2.845 4.769 -19.697 918 H TYR 105 H TYR 105 2.686 4.342 -14.401 919 HA TYR 105 HA TYR 105 3.877 2.020 -15.542 920 1HB TYR 105 2HB TYR 105 4.943 4.070 -14.384 921 2HB TYR 105 1HB TYR 105 4.538 3.262 -12.882 922 HD1 TYR 105 1HD TYR 105 6.514 3.090 -15.921 923 HD2 TYR 105 2HD TYR 105 5.905 1.416 -12.062 924 HE1 TYR 105 1HE TYR 105 8.654 1.884 -16.106 925 HE2 TYR 105 2HE TYR 105 8.019 0.201 -12.242 926 HH TYR 105 HH TYR 105 9.522 -0.597 -13.946 927 H ASN 106 H ASN 106 1.457 2.513 -13.317 928 HA ASN 106 HA ASN 106 0.239 1.323 -11.899 929 1HB ASN 106 2HB ASN 106 0.236 -0.569 -13.463 930 2HB ASN 106 1HB ASN 106 1.792 -1.115 -12.840 931 1HD2 ASN 106 1HD2 ASN 106 1.849 -2.309 -10.966 932 2HD2 ASN 106 2HD2 ASN 106 0.451 -2.778 -10.073 933 HA PRO 107 HA PRO 107 2.789 1.925 -8.427 934 1HB PRO 107 2HB PRO 107 0.357 1.434 -6.858 935 2HB PRO 107 1HB PRO 107 1.335 2.900 -6.987 936 1HG PRO 107 2HG PRO 107 -1.119 2.730 -8.080 937 2HG PRO 107 1HG PRO 107 0.188 3.663 -8.834 938 1HD PRO 107 2HD PRO 107 -0.818 0.926 -9.513 939 2HD PRO 107 1HD PRO 107 -0.370 2.260 -10.599 940 H SER 108 H SER 108 4.033 0.050 -8.464 941 HA SER 108 HA SER 108 3.184 -2.398 -7.341 942 1HB SER 108 2HB SER 108 5.971 -1.198 -7.452 943 2HB SER 108 1HB SER 108 5.565 -2.910 -7.314 944 HG SER 108 HG SER 108 5.604 -2.941 -9.373 945 H LEU 109 H LEU 109 3.417 -3.064 -5.154 946 HA LEU 109 HA LEU 109 2.801 -0.950 -3.427 947 1HB LEU 109 2HB LEU 109 1.747 -3.162 -3.260 948 2HB LEU 109 1HB LEU 109 3.261 -3.856 -2.743 949 HG LEU 109 HG LEU 109 1.432 -3.415 -0.981 950 1HD1 LEU 109 1HD1 LEU 109 3.055 -2.867 0.743 951 2HD1 LEU 109 2HD1 LEU 109 4.214 -2.393 -0.498 952 3HD1 LEU 109 3HD1 LEU 109 3.678 -4.072 -0.384 953 1HD2 LEU 109 1HD2 LEU 109 2.497 -0.583 -1.253 954 2HD2 LEU 109 2HD2 LEU 109 1.435 -1.142 0.025 955 3HD2 LEU 109 3HD2 LEU 109 0.864 -1.096 -1.627 956 H GLN 110 H GLN 110 5.791 -2.969 -3.541 957 HA GLN 110 HA GLN 110 7.046 -1.830 -1.352 958 1HB GLN 110 2HB GLN 110 7.939 -3.767 -2.533 959 2HB GLN 110 1HB GLN 110 8.220 -2.802 -3.968 960 1HG GLN 110 2HG GLN 110 10.298 -3.268 -2.801 961 2HG GLN 110 1HG GLN 110 9.951 -1.545 -2.796 962 1HE2 GLN 110 1HE2 GLN 110 10.131 -4.430 -0.881 963 2HE2 GLN 110 2HE2 GLN 110 10.152 -3.658 0.658 964 H LEU 111 H LEU 111 6.982 -0.694 -4.683 965 HA LEU 111 HA LEU 111 8.678 1.527 -4.448 966 1HB LEU 111 2HB LEU 111 6.361 0.965 -6.296 967 2HB LEU 111 1HB LEU 111 7.228 2.476 -6.371 968 HG LEU 111 HG LEU 111 9.272 1.299 -7.046 969 1HD1 LEU 111 1HD1 LEU 111 7.613 -1.217 -6.973 970 2HD1 LEU 111 2HD1 LEU 111 8.941 -0.824 -5.882 971 3HD1 LEU 111 3HD1 LEU 111 9.257 -1.071 -7.600 972 1HD2 LEU 111 1HD2 LEU 111 7.753 2.066 -8.750 973 2HD2 LEU 111 2HD2 LEU 111 6.855 0.550 -8.668 974 3HD2 LEU 111 3HD2 LEU 111 8.524 0.559 -9.246 975 H ALA 112 H ALA 112 5.218 1.244 -4.061 976 HA ALA 112 HA ALA 112 4.688 3.997 -3.568 977 1HB ALA 112 1HB ALA 112 2.995 2.441 -4.406 978 2HB ALA 112 2HB ALA 112 2.465 3.248 -2.931 979 3HB ALA 112 3HB ALA 112 3.030 1.577 -2.869 980 H LEU 113 H LEU 113 5.302 1.222 -1.500 981 HA LEU 113 HA LEU 113 4.408 2.236 0.935 982 1HB LEU 113 2HB LEU 113 5.137 -0.132 -0.050 983 2HB LEU 113 1HB LEU 113 6.616 0.282 0.788 984 HG LEU 113 HG LEU 113 5.367 0.482 2.886 985 1HD1 LEU 113 1HD1 LEU 113 3.041 -0.264 2.961 986 2HD1 LEU 113 2HD1 LEU 113 3.031 -0.436 1.205 987 3HD1 LEU 113 3HD1 LEU 113 3.214 1.159 1.935 988 1HD2 LEU 113 1HD2 LEU 113 4.898 -1.896 3.148 989 2HD2 LEU 113 2HD2 LEU 113 6.386 -1.644 2.238 990 3HD2 LEU 113 3HD2 LEU 113 4.904 -2.097 1.397 991 H LYS 114 H LYS 114 7.559 2.161 -0.591 992 HA LYS 114 HA LYS 114 8.794 3.375 1.642 993 1HB LYS 114 2HB LYS 114 10.852 3.688 0.200 994 2HB LYS 114 1HB LYS 114 10.315 2.048 0.484 995 1HG LYS 114 2HG LYS 114 9.332 1.995 -1.752 996 2HG LYS 114 1HG LYS 114 9.900 3.646 -2.027 997 1HD LYS 114 2HD LYS 114 11.430 1.986 -2.998 998 2HD LYS 114 1HD LYS 114 12.206 2.922 -1.721 999 1HE LYS 114 2HE LYS 114 11.779 1.061 -0.143 1000 2HE LYS 114 1HE LYS 114 11.068 0.135 -1.463 1001 1HZ LYS 114 1HZ LYS 114 13.173 0.154 -2.600 1002 2HZ LYS 114 2HZ LYS 114 13.426 -0.439 -1.017 1003 3HZ LYS 114 3HZ LYS 114 13.870 1.116 -1.406 1004 H ILE 115 H ILE 115 7.410 4.673 -1.170 1005 HA ILE 115 HA ILE 115 8.326 7.343 -1.060 1006 HB ILE 115 HB ILE 115 5.464 6.524 -1.716 1007 1HG1 ILE 115 2HG1 ILE 115 7.819 6.846 -3.587 1008 2HG1 ILE 115 1HG1 ILE 115 7.114 5.313 -3.094 1009 1HG2 ILE 115 1HG2 ILE 115 7.029 8.980 -2.500 1010 2HG2 ILE 115 2HG2 ILE 115 5.702 8.911 -1.341 1011 3HG2 ILE 115 3HG2 ILE 115 5.398 8.584 -3.047 1012 1HD1 ILE 115 1HD1 ILE 115 5.720 7.460 -4.680 1013 2HD1 ILE 115 2HD1 ILE 115 5.020 5.915 -4.197 1014 3HD1 ILE 115 3HD1 ILE 115 6.381 5.955 -5.319 1015 H ALA 116 H ALA 116 5.821 5.701 0.740 1016 HA ALA 116 HA ALA 116 4.628 7.876 2.089 1017 1HB ALA 116 1HB ALA 116 3.856 6.219 3.676 1018 2HB ALA 116 2HB ALA 116 5.052 5.087 3.056 1019 3HB ALA 116 3HB ALA 116 3.700 5.587 2.024 1020 H TYR 117 H TYR 117 7.302 5.740 2.862 1021 HA TYR 117 HA TYR 117 7.693 6.719 5.463 1022 1HB TYR 117 2HB TYR 117 8.253 4.445 4.782 1023 2HB TYR 117 1HB TYR 117 9.470 5.064 3.679 1024 HD1 TYR 117 1HD TYR 117 11.550 5.674 4.432 1025 HD2 TYR 117 2HD TYR 117 8.592 4.620 7.236 1026 HE1 TYR 117 1HE TYR 117 13.305 5.544 6.216 1027 HE2 TYR 117 2HE TYR 117 10.272 4.484 9.022 1028 HH TYR 117 HH TYR 117 13.491 5.639 8.603 1029 H TYR 118 H TYR 118 9.569 7.200 2.425 1030 HA TYR 118 HA TYR 118 11.427 8.940 3.638 1031 1HB TYR 118 2HB TYR 118 10.738 8.508 0.740 1032 2HB TYR 118 1HB TYR 118 11.977 9.649 1.249 1033 HD1 TYR 118 1HD TYR 118 13.991 8.793 2.466 1034 HD2 TYR 118 2HD TYR 118 11.178 6.175 0.651 1035 HE1 TYR 118 1HE TYR 118 15.651 6.980 2.527 1036 HE2 TYR 118 2HE TYR 118 12.825 4.353 0.709 1037 HH TYR 118 HH TYR 118 15.692 4.528 2.528 1038 H LEU 119 H LEU 119 8.414 9.533 2.317 1039 HA LEU 119 HA LEU 119 8.822 12.450 2.444 1040 1HB LEU 119 2HB LEU 119 6.419 10.912 1.482 1041 2HB LEU 119 1HB LEU 119 6.465 12.660 1.594 1042 1HD1 LEU 119 1HD1 LEU 119 5.943 12.799 -0.837 1043 2HD1 LEU 119 2HD1 LEU 119 5.932 11.039 -0.936 1044 3HD1 LEU 119 3HD1 LEU 119 6.984 11.976 -1.998 1045 1HD2 LEU 119 1HD2 LEU 119 8.980 13.107 -1.096 1046 2HD2 LEU 119 2HD2 LEU 119 9.374 12.980 0.617 1047 3HD2 LEU 119 3HD2 LEU 119 8.006 13.964 0.099 1048 H ASN 120 H ASN 120 8.054 10.104 4.494 1049 HA ASN 120 HA ASN 120 6.850 9.785 6.399 1050 1HB ASN 120 2HB ASN 120 8.783 11.438 6.907 1051 2HB ASN 120 1HB ASN 120 7.532 12.667 7.003 1052 1HD2 ASN 120 1HD2 ASN 120 9.360 11.585 9.024 1053 2HD2 ASN 120 2HD2 ASN 120 8.373 11.017 10.326 1054 H THR 121 H THR 121 5.109 10.117 4.523 1055 HA THR 121 HA THR 121 2.981 11.757 5.648 1056 HB THR 121 HB THR 121 3.664 11.456 2.686 1057 HG1 THR 121 1HG THR 121 5.034 12.845 4.084 1058 1HG2 THR 121 1HG2 THR 121 1.950 13.183 2.336 1059 2HG2 THR 121 2HG2 THR 121 1.626 13.209 4.071 1060 3HG2 THR 121 3HG2 THR 121 1.264 11.763 3.126 1061 HA PRO 122 HA PRO 122 1.078 7.713 5.530 1062 1HB PRO 122 2HB PRO 122 -1.547 8.482 5.078 1063 2HB PRO 122 1HB PRO 122 -0.770 8.436 6.664 1064 1HG PRO 122 2HG PRO 122 -1.201 10.755 4.834 1065 2HG PRO 122 1HG PRO 122 -1.349 10.675 6.598 1066 1HD PRO 122 2HD PRO 122 0.771 11.767 5.411 1067 2HD PRO 122 1HD PRO 122 0.950 10.829 6.917 1068 H LEU 123 H LEU 123 -0.515 6.386 3.993 1069 HA LEU 123 HA LEU 123 0.776 6.607 1.436 1070 1HB LEU 123 2HB LEU 123 -1.041 4.596 2.754 1071 2HB LEU 123 1HB LEU 123 -0.674 4.524 1.046 1072 1HD1 LEU 123 1HD2 LEU 123 0.084 2.142 1.740 1073 2HD1 LEU 123 2HD2 LEU 123 -0.090 2.531 3.449 1074 3HD1 LEU 123 3HD2 LEU 123 1.471 2.000 2.821 1075 1HD2 LEU 123 1HD1 LEU 123 2.807 3.491 1.384 1076 2HD2 LEU 123 2HD1 LEU 123 2.222 5.111 0.998 1077 3HD2 LEU 123 3HD1 LEU 123 1.466 3.702 0.260 1078 H GLU 124 H GLU 124 -2.196 6.962 3.083 1079 HA GLU 124 HA GLU 124 -4.073 7.064 1.044 1080 1HB GLU 124 2HB GLU 124 -4.215 8.648 3.605 1081 2HB GLU 124 1HB GLU 124 -5.553 8.095 2.619 1082 1HG GLU 124 2HG GLU 124 -5.632 6.579 4.328 1083 2HG GLU 124 1HG GLU 124 -4.588 5.727 3.194 1084 H ASP 125 H ASP 125 -1.878 9.580 2.238 1085 HA ASP 125 HA ASP 125 -3.327 11.674 0.995 1086 1HB ASP 125 2HB ASP 125 -1.826 11.937 3.013 1087 2HB ASP 125 1HB ASP 125 -0.457 11.715 1.928 1088 H ILE 126 H ILE 126 -0.608 9.695 0.313 1089 HA ILE 126 HA ILE 126 0.236 11.104 -2.064 1090 HB ILE 126 HB ILE 126 1.127 8.371 -1.077 1091 1HG1 ILE 126 2HG1 ILE 126 2.373 11.098 -0.621 1092 2HG1 ILE 126 1HG1 ILE 126 1.466 10.195 0.584 1093 1HG2 ILE 126 1HG2 ILE 126 1.653 8.784 -3.435 1094 2HG2 ILE 126 2HG2 ILE 126 3.121 8.820 -2.458 1095 3HG2 ILE 126 3HG2 ILE 126 2.390 10.329 -3.007 1096 1HD1 ILE 126 1HD1 ILE 126 3.161 8.434 0.528 1097 2HD1 ILE 126 2HD1 ILE 126 3.857 10.001 0.939 1098 3HD1 ILE 126 3HD1 ILE 126 4.059 9.346 -0.684 1099 H PHE 127 H PHE 127 -1.242 7.956 -1.467 1100 HA PHE 127 HA PHE 127 -2.098 7.907 -4.293 1101 1HB PHE 127 2HB PHE 127 -1.621 5.505 -2.407 1102 2HB PHE 127 1HB PHE 127 -2.364 5.424 -3.991 1103 HD1 PHE 127 1HD PHE 127 -1.065 5.218 -5.890 1104 HD2 PHE 127 2HD PHE 127 0.743 6.360 -2.215 1105 HE1 PHE 127 1HE PHE 127 1.161 4.931 -6.897 1106 HE2 PHE 127 2HE PHE 127 2.967 6.081 -3.217 1107 HZ PHE 127 HZ PHE 127 3.178 5.368 -5.564 1108 H GLN 128 H GLN 128 -4.230 7.693 -4.762 1109 HA GLN 128 HA GLN 128 -6.061 7.568 -2.496 1110 1HB GLN 128 2HB GLN 128 -6.113 9.718 -3.726 1111 2HB GLN 128 1HB GLN 128 -6.421 8.849 -5.221 1112 1HG GLN 128 2HG GLN 128 -8.559 8.073 -4.339 1113 2HG GLN 128 1HG GLN 128 -8.245 8.929 -2.828 1114 1HE2 GLN 128 1HE2 GLN 128 -9.099 9.245 -6.160 1115 2HE2 GLN 128 2HE2 GLN 128 -9.582 10.888 -6.115 1116 H TRP 129 H TRP 129 -7.304 5.880 -2.459 1117 HA TRP 129 HA TRP 129 -7.414 4.234 -4.853 1118 1HB TRP 129 2HB TRP 129 -7.622 2.310 -3.124 1119 2HB TRP 129 1HB TRP 129 -6.045 2.982 -3.502 1120 HD1 TRP 129 HD TRP 129 -8.764 3.456 -0.740 1121 HE1 TRP 129 1HE TRP 129 -7.552 3.942 1.468 1122 HE3 TRP 129 3HE TRP 129 -3.968 3.571 -2.474 1123 HZ2 TRP 129 2HZ TRP 129 -4.897 4.318 2.356 1124 HZ3 TRP 129 3HZ TRP 129 -2.151 3.998 -0.879 1125 HH2 TRP 129 HH TRP 129 -2.610 4.362 1.477 1126 H GLN 130 H GLN 130 -9.323 3.803 -5.618 1127 HA GLN 130 HA GLN 130 -11.580 4.041 -3.794 1128 1HB GLN 130 2HB GLN 130 -11.464 4.785 -6.723 1129 2HB GLN 130 1HB GLN 130 -12.918 4.792 -5.738 1130 1HG GLN 130 2HG GLN 130 -10.487 6.498 -5.243 1131 2HG GLN 130 1HG GLN 130 -11.935 7.026 -6.089 1132 1HE2 GLN 130 1HE2 GLN 130 -12.316 8.635 -4.618 1133 2HE2 GLN 130 2HE2 GLN 130 -12.874 8.336 -2.998 1134 HA PRO 131 HA PRO 131 -11.923 -0.174 -5.464 1135 1HB PRO 131 2HB PRO 131 -12.536 -1.380 -3.145 1136 2HB PRO 131 1HB PRO 131 -10.870 -0.923 -3.508 1137 1HG PRO 131 2HG PRO 131 -12.851 0.408 -1.715 1138 2HG PRO 131 1HG PRO 131 -11.105 0.198 -1.501 1139 1HD PRO 131 2HD PRO 131 -12.364 2.513 -2.424 1140 2HD PRO 131 1HD PRO 131 -10.644 2.128 -2.617 1141 H GLU 132 H GLU 132 -13.740 2.105 -4.322 1142 HA GLU 132 HA GLU 132 -16.335 0.718 -4.410 1143 1HB GLU 132 2HB GLU 132 -15.686 3.484 -3.382 1144 2HB GLU 132 1HB GLU 132 -17.226 2.642 -3.219 1145 1HG GLU 132 2HG GLU 132 -16.207 0.968 -1.808 1146 2HG GLU 132 1HG GLU 132 -14.623 1.706 -2.030 Start of MODEL 11 1 1H MET 1 1HT MET 1 13.256 -4.240 5.085 2 2H MET 1 2HT MET 1 12.241 -3.466 6.194 3 3H MET 1 3HT MET 1 11.699 -3.712 4.657 4 HA MET 1 HA MET 1 11.696 -6.109 5.024 5 1HB MET 1 2HB MET 1 12.421 -5.252 7.840 6 2HB MET 1 1HB MET 1 11.836 -6.849 7.414 7 1HG MET 1 2HG MET 1 13.801 -7.202 6.020 8 2HG MET 1 1HG MET 1 14.382 -5.587 6.425 9 1HE MET 1 1HE MET 1 15.164 -4.864 8.877 10 2HE MET 1 2HE MET 1 15.106 -5.934 10.278 11 3HE MET 1 3HE MET 1 13.608 -5.379 9.527 12 H ILE 2 H ILE 2 9.787 -7.034 5.822 13 HA ILE 2 HA ILE 2 7.787 -5.064 6.715 14 HB ILE 2 HB ILE 2 7.382 -7.408 4.820 15 1HG1 ILE 2 2HG1 ILE 2 8.425 -5.484 3.715 16 2HG1 ILE 2 1HG1 ILE 2 6.785 -5.720 3.133 17 1HG2 ILE 2 1HG2 ILE 2 5.430 -7.177 6.248 18 2HG2 ILE 2 2HG2 ILE 2 5.041 -6.673 4.603 19 3HG2 ILE 2 3HG2 ILE 2 5.318 -5.461 5.856 20 1HD1 ILE 2 1HD1 ILE 2 7.671 -3.653 5.137 21 2HD1 ILE 2 2HD1 ILE 2 6.022 -3.883 4.559 22 3HD1 ILE 2 3HD1 ILE 2 7.286 -3.364 3.439 23 H ILE 3 H ILE 3 6.541 -5.644 8.391 24 HA ILE 3 HA ILE 3 6.812 -8.347 9.469 25 HB ILE 3 HB ILE 3 6.380 -5.740 10.998 26 1HG1 ILE 3 2HG1 ILE 3 8.785 -7.597 10.976 27 2HG1 ILE 3 1HG1 ILE 3 8.710 -6.008 10.228 28 1HG2 ILE 3 1HG2 ILE 3 6.652 -8.572 12.020 29 2HG2 ILE 3 2HG2 ILE 3 5.174 -7.612 12.000 30 3HG2 ILE 3 3HG2 ILE 3 6.526 -7.125 13.022 31 1HD1 ILE 3 1HD1 ILE 3 9.916 -5.955 12.348 32 2HD1 ILE 3 2HD1 ILE 3 8.495 -6.581 13.179 33 3HD1 ILE 3 3HD1 ILE 3 8.446 -4.985 12.429 34 H ASN 4 H ASN 4 4.810 -9.403 9.315 35 HA ASN 4 HA ASN 4 2.560 -7.736 8.588 36 1HB ASN 4 2HB ASN 4 3.254 -9.421 7.010 37 2HB ASN 4 1HB ASN 4 3.258 -10.650 8.262 38 1HD2 ASN 4 1HD2 ASN 4 1.870 -11.910 7.137 39 2HD2 ASN 4 2HD2 ASN 4 0.201 -11.527 6.908 40 H ASN 5 H ASN 5 0.817 -7.578 9.883 41 HA ASN 5 HA ASN 5 0.546 -9.464 12.106 42 1HB ASN 5 2HB ASN 5 0.261 -6.445 12.215 43 2HB ASN 5 1HB ASN 5 -0.406 -7.514 13.439 44 1HD2 ASN 5 1HD2 ASN 5 2.432 -5.993 12.220 45 2HD2 ASN 5 2HD2 ASN 5 3.492 -6.539 13.479 46 H LEU 6 H LEU 6 -0.636 -9.314 9.432 47 HA LEU 6 HA LEU 6 -3.191 -8.275 9.232 48 1HB LEU 6 2HB LEU 6 -1.752 -9.517 7.506 49 2HB LEU 6 1HB LEU 6 -2.365 -10.999 8.188 50 HG LEU 6 HG LEU 6 -3.477 -10.465 6.096 51 1HD1 LEU 6 1HD1 LEU 6 -5.392 -10.099 8.376 52 2HD1 LEU 6 2HD1 LEU 6 -4.856 -11.632 7.694 53 3HD1 LEU 6 3HD1 LEU 6 -5.821 -10.526 6.720 54 1HD2 LEU 6 1HD2 LEU 6 -4.333 -7.907 7.410 55 2HD2 LEU 6 2HD2 LEU 6 -4.895 -8.494 5.845 56 3HD2 LEU 6 3HD2 LEU 6 -3.196 -8.083 6.073 57 H LYS 7 H LYS 7 -2.197 -11.436 10.532 58 HA LYS 7 HA LYS 7 -4.838 -12.206 11.138 59 1HB LYS 7 2HB LYS 7 -3.921 -14.073 12.427 60 2HB LYS 7 1HB LYS 7 -3.169 -13.933 10.851 61 1HG LYS 7 2HG LYS 7 -1.173 -13.044 11.822 62 2HG LYS 7 1HG LYS 7 -1.940 -12.936 13.408 63 1HD LYS 7 2HD LYS 7 -1.442 -15.490 11.873 64 2HD LYS 7 1HD LYS 7 -0.473 -14.903 13.230 65 1HE LYS 7 2HE LYS 7 -2.404 -15.045 14.704 66 2HE LYS 7 1HE LYS 7 -3.423 -15.545 13.359 67 1HZ LYS 7 1HZ LYS 7 -2.067 -17.524 13.139 68 2HZ LYS 7 2HZ LYS 7 -2.772 -17.446 14.654 69 3HZ LYS 7 3HZ LYS 7 -1.129 -17.079 14.471 70 H LEU 8 H LEU 8 -2.402 -10.584 13.113 71 HA LEU 8 HA LEU 8 -3.739 -10.703 15.547 72 1HB LEU 8 2HB LEU 8 -1.344 -9.969 15.047 73 2HB LEU 8 1HB LEU 8 -1.999 -8.436 14.538 74 HG LEU 8 HG LEU 8 -0.985 -8.426 16.808 75 1HD1 LEU 8 1HD1 LEU 8 -3.924 -7.794 16.778 76 2HD1 LEU 8 2HD1 LEU 8 -2.616 -6.727 16.276 77 3HD1 LEU 8 3HD1 LEU 8 -2.755 -7.216 17.965 78 1HD2 LEU 8 1HD2 LEU 8 -1.590 -10.660 17.513 79 2HD2 LEU 8 2HD2 LEU 8 -3.298 -10.222 17.516 80 3HD2 LEU 8 3HD2 LEU 8 -2.190 -9.470 18.667 81 H ILE 9 H ILE 9 -3.910 -8.326 12.902 82 HA ILE 9 HA ILE 9 -5.834 -6.704 14.165 83 HB ILE 9 HB ILE 9 -4.921 -6.902 11.285 84 1HG1 ILE 9 2HG1 ILE 9 -4.313 -4.526 11.623 85 2HG1 ILE 9 1HG1 ILE 9 -4.969 -4.592 13.247 86 1HG2 ILE 9 1HG2 ILE 9 -6.429 -5.086 10.620 87 2HG2 ILE 9 2HG2 ILE 9 -7.227 -5.181 12.192 88 3HG2 ILE 9 3HG2 ILE 9 -7.319 -6.540 11.076 89 1HD1 ILE 9 1HD1 ILE 9 -3.228 -6.188 13.871 90 2HD1 ILE 9 2HD1 ILE 9 -2.550 -4.684 13.248 91 3HD1 ILE 9 3HD1 ILE 9 -2.588 -6.125 12.229 92 H ARG 10 H ARG 10 -6.116 -9.481 12.130 93 HA ARG 10 HA ARG 10 -8.917 -9.538 11.825 94 1HB ARG 10 2HB ARG 10 -6.936 -11.771 12.020 95 2HB ARG 10 1HB ARG 10 -8.654 -12.085 11.897 96 1HG ARG 10 2HG ARG 10 -8.663 -10.836 9.757 97 2HG ARG 10 1HG ARG 10 -6.899 -10.714 9.886 98 1HD ARG 10 2HD ARG 10 -7.684 -12.642 8.516 99 2HD ARG 10 1HD ARG 10 -6.659 -13.089 9.885 100 HE ARG 10 HE ARG 10 -9.514 -13.144 10.402 101 1HH1 ARG 10 1HH1 ARG 10 -6.699 -15.034 9.393 102 2HH1 ARG 10 2HH1 ARG 10 -7.344 -16.515 9.841 103 1HH2 ARG 10 1HH2 ARG 10 -10.376 -15.190 11.162 104 2HH2 ARG 10 2HH2 ARG 10 -9.528 -16.624 10.829 105 H GLU 11 H GLU 11 -6.870 -10.611 14.547 106 HA GLU 11 HA GLU 11 -9.038 -11.606 16.037 107 1HB GLU 11 2HB GLU 11 -6.244 -10.879 16.904 108 2HB GLU 11 1HB GLU 11 -7.428 -11.697 17.922 109 1HG GLU 11 2HG GLU 11 -7.554 -13.468 16.140 110 2HG GLU 11 1HG GLU 11 -6.154 -12.701 15.401 111 H LYS 12 H LYS 12 -7.458 -8.488 15.914 112 HA LYS 12 HA LYS 12 -8.741 -7.237 18.022 113 1HB LYS 12 2HB LYS 12 -8.006 -6.056 15.328 114 2HB LYS 12 1HB LYS 12 -8.412 -5.109 16.755 115 1HG LYS 12 2HG LYS 12 -6.509 -5.994 17.942 116 2HG LYS 12 1HG LYS 12 -6.133 -7.066 16.600 117 1HD LYS 12 2HD LYS 12 -4.639 -5.148 16.607 118 2HD LYS 12 1HD LYS 12 -5.673 -5.115 15.182 119 1HE LYS 12 2HE LYS 12 -7.032 -3.401 16.120 120 2HE LYS 12 1HE LYS 12 -6.262 -3.573 17.697 121 1HZ LYS 12 1HZ LYS 12 -4.218 -2.778 16.775 122 2HZ LYS 12 2HZ LYS 12 -5.412 -1.636 16.481 123 3HZ LYS 12 3HZ LYS 12 -4.847 -2.607 15.230 124 H LYS 13 H LYS 13 -9.964 -7.782 14.780 125 HA LYS 13 HA LYS 13 -12.686 -7.110 15.707 126 1HB LYS 13 2HB LYS 13 -11.605 -7.664 12.898 127 2HB LYS 13 1HB LYS 13 -13.294 -7.334 13.254 128 1HG LYS 13 2HG LYS 13 -10.986 -5.423 13.643 129 2HG LYS 13 1HG LYS 13 -12.206 -5.351 12.364 130 1HD LYS 13 2HD LYS 13 -13.954 -5.045 14.060 131 2HD LYS 13 1HD LYS 13 -12.740 -5.121 15.330 132 1HE LYS 13 2HE LYS 13 -13.334 -2.818 14.927 133 2HE LYS 13 1HE LYS 13 -11.681 -3.091 14.394 134 1HZ LYS 13 1HZ LYS 13 -13.132 -1.736 12.915 135 2HZ LYS 13 2HZ LYS 13 -13.995 -3.151 12.538 136 3HZ LYS 13 3HZ LYS 13 -12.350 -3.024 12.147 137 H LYS 14 H LYS 14 -14.282 -9.490 14.229 138 HA LYS 14 HA LYS 14 -12.387 -11.470 14.539 139 1HB LYS 14 2HB LYS 14 -14.321 -12.792 15.621 140 2HB LYS 14 1HB LYS 14 -13.414 -11.678 16.629 141 1HG LYS 14 2HG LYS 14 -15.217 -10.011 16.332 142 2HG LYS 14 1HG LYS 14 -16.126 -11.209 15.410 143 1HD LYS 14 2HD LYS 14 -16.272 -12.654 17.308 144 2HD LYS 14 1HD LYS 14 -15.166 -11.635 18.230 145 1HE LYS 14 2HE LYS 14 -17.878 -10.796 17.222 146 2HE LYS 14 1HE LYS 14 -17.527 -11.314 18.868 147 1HZ LYS 14 1HZ LYS 14 -15.959 -9.449 19.040 148 2HZ LYS 14 2HZ LYS 14 -17.535 -8.963 18.804 149 3HZ LYS 14 3HZ LYS 14 -16.429 -8.878 17.516 150 H ILE 15 H ILE 15 -12.320 -11.197 12.340 151 HA ILE 15 HA ILE 15 -14.608 -12.407 10.970 152 HB ILE 15 HB ILE 15 -12.629 -10.390 9.821 153 1HG1 ILE 15 2HG1 ILE 15 -15.565 -10.050 10.502 154 2HG1 ILE 15 1HG1 ILE 15 -14.232 -9.371 11.420 155 1HG2 ILE 15 1HG2 ILE 15 -13.414 -11.987 8.148 156 2HG2 ILE 15 2HG2 ILE 15 -14.105 -10.393 7.848 157 3HG2 ILE 15 3HG2 ILE 15 -15.086 -11.653 8.600 158 1HD1 ILE 15 1HD1 ILE 15 -15.282 -7.695 10.010 159 2HD1 ILE 15 2HD1 ILE 15 -14.969 -8.679 8.579 160 3HD1 ILE 15 3HD1 ILE 15 -13.624 -7.989 9.489 161 H SER 16 H SER 16 -14.147 -14.172 9.733 162 HA SER 16 HA SER 16 -11.489 -15.234 10.123 163 1HB SER 16 2HB SER 16 -14.043 -16.574 9.233 164 2HB SER 16 1HB SER 16 -12.518 -17.387 9.590 165 HG SER 16 HG SER 16 -13.841 -15.724 11.438 166 H GLN 17 H GLN 17 -10.940 -16.830 8.229 167 HA GLN 17 HA GLN 17 -10.126 -15.207 6.089 168 1HB GLN 17 2HB GLN 17 -10.304 -18.215 6.058 169 2HB GLN 17 1HB GLN 17 -9.285 -17.205 5.049 170 1HG GLN 17 2HG GLN 17 -8.034 -16.521 7.059 171 2HG GLN 17 1HG GLN 17 -9.033 -17.613 8.021 172 1HE2 GLN 17 1HE2 GLN 17 -6.395 -17.341 5.888 173 2HE2 GLN 17 2HE2 GLN 17 -5.989 -19.022 5.818 174 H SER 18 H SER 18 -12.903 -17.494 6.413 175 HA SER 18 HA SER 18 -13.567 -17.639 3.758 176 1HB SER 18 2HB SER 18 -15.307 -17.847 6.207 177 2HB SER 18 1HB SER 18 -15.656 -18.514 4.611 178 HG SER 18 HG SER 18 -14.784 -20.165 5.511 179 H GLU 19 H GLU 19 -14.810 -15.447 6.326 180 HA GLU 19 HA GLU 19 -16.657 -14.181 4.616 181 1HB GLU 19 2HB GLU 19 -15.402 -12.924 7.058 182 2HB GLU 19 1HB GLU 19 -16.904 -12.457 6.287 183 1HG GLU 19 2HG GLU 19 -17.701 -13.615 8.059 184 2HG GLU 19 1HG GLU 19 -17.586 -14.920 6.879 185 H LEU 20 H LEU 20 -13.287 -13.379 5.521 186 HA LEU 20 HA LEU 20 -13.204 -10.978 4.126 187 1HB LEU 20 2HB LEU 20 -11.036 -12.958 4.818 188 2HB LEU 20 1HB LEU 20 -10.723 -11.402 4.076 189 HG LEU 20 HG LEU 20 -12.009 -11.796 6.778 190 1HD1 LEU 20 1HD1 LEU 20 -9.892 -10.966 7.669 191 2HD1 LEU 20 2HD1 LEU 20 -9.213 -10.947 6.041 192 3HD1 LEU 20 3HD1 LEU 20 -9.673 -12.478 6.788 193 1HD2 LEU 20 1HD2 LEU 20 -11.653 -9.381 7.016 194 2HD2 LEU 20 2HD2 LEU 20 -12.728 -9.750 5.666 195 3HD2 LEU 20 3HD2 LEU 20 -11.047 -9.311 5.360 196 H ALA 21 H ALA 21 -12.502 -14.292 3.120 197 HA ALA 21 HA ALA 21 -11.589 -13.714 0.547 198 1HB ALA 21 1HB ALA 21 -11.382 -15.925 1.579 199 2HB ALA 21 2HB ALA 21 -12.149 -16.026 -0.006 200 3HB ALA 21 3HB ALA 21 -13.128 -16.147 1.456 201 H ALA 22 H ALA 22 -14.917 -14.423 1.662 202 HA ALA 22 HA ALA 22 -16.120 -14.133 -0.834 203 1HB ALA 22 1HB ALA 22 -17.139 -15.253 1.079 204 2HB ALA 22 2HB ALA 22 -18.186 -13.997 0.423 205 3HB ALA 22 3HB ALA 22 -17.279 -13.702 1.907 206 H LEU 23 H LEU 23 -15.622 -11.809 1.786 207 HA LEU 23 HA LEU 23 -17.116 -9.733 0.581 208 1HB LEU 23 2HB LEU 23 -16.732 -9.918 2.986 209 2HB LEU 23 1HB LEU 23 -15.026 -9.635 2.740 210 HG LEU 23 HG LEU 23 -15.505 -7.344 1.998 211 1HD1 LEU 23 1HD1 LEU 23 -18.373 -8.025 2.659 212 2HD1 LEU 23 2HD1 LEU 23 -17.729 -7.713 1.046 213 3HD1 LEU 23 3HD1 LEU 23 -17.762 -6.423 2.244 214 1HD2 LEU 23 1HD2 LEU 23 -16.212 -6.485 4.169 215 2HD2 LEU 23 2HD2 LEU 23 -15.050 -7.801 4.343 216 3HD2 LEU 23 3HD2 LEU 23 -16.764 -8.096 4.632 217 H LEU 24 H LEU 24 -13.670 -10.565 0.476 218 HA LEU 24 HA LEU 24 -13.048 -8.139 -0.978 219 1HB LEU 24 2HB LEU 24 -11.321 -10.540 -0.426 220 2HB LEU 24 1HB LEU 24 -10.781 -8.967 -0.972 221 HG LEU 24 HG LEU 24 -11.975 -9.599 1.719 222 1HD1 LEU 24 1HD1 LEU 24 -9.157 -8.966 0.914 223 2HD1 LEU 24 2HD1 LEU 24 -9.772 -10.529 1.451 224 3HD1 LEU 24 3HD1 LEU 24 -9.739 -9.164 2.567 225 1HD2 LEU 24 1HD2 LEU 24 -12.516 -7.331 1.016 226 2HD2 LEU 24 2HD2 LEU 24 -10.816 -7.025 0.661 227 3HD2 LEU 24 3HD2 LEU 24 -11.332 -7.317 2.323 228 H GLU 25 H GLU 25 -14.470 -10.980 -1.757 229 HA GLU 25 HA GLU 25 -14.914 -12.167 -3.605 230 1HB GLU 25 2HB GLU 25 -13.774 -9.780 -5.074 231 2HB GLU 25 1HB GLU 25 -14.742 -11.055 -5.797 232 1HG GLU 25 2HG GLU 25 -16.601 -10.410 -4.277 233 2HG GLU 25 1HG GLU 25 -15.616 -9.051 -3.739 234 H VAL 26 H VAL 26 -12.491 -12.748 -2.319 235 HA VAL 26 HA VAL 26 -10.820 -13.568 -4.570 236 HB VAL 26 HB VAL 26 -8.835 -13.431 -3.103 237 1HG1 VAL 26 1HG1 VAL 26 -9.298 -11.575 -4.577 238 2HG1 VAL 26 2HG1 VAL 26 -8.584 -10.997 -3.070 239 3HG1 VAL 26 3HG1 VAL 26 -10.319 -10.827 -3.349 240 1HG2 VAL 26 1HG2 VAL 26 -8.946 -12.176 -0.976 241 2HG2 VAL 26 2HG2 VAL 26 -9.892 -13.664 -0.929 242 3HG2 VAL 26 3HG2 VAL 26 -10.704 -12.112 -1.129 243 H SER 27 H SER 27 -9.325 -15.373 -3.734 244 HA SER 27 HA SER 27 -11.022 -17.415 -2.573 245 1HB SER 27 2HB SER 27 -8.208 -17.603 -3.676 246 2HB SER 27 1HB SER 27 -9.319 -18.943 -3.373 247 HG SER 27 HG SER 27 -10.729 -17.538 -4.896 248 H ARG 28 H ARG 28 -10.277 -18.725 -0.766 249 HA ARG 28 HA ARG 28 -9.187 -17.285 1.353 250 1HB ARG 28 2HB ARG 28 -9.896 -20.159 0.954 251 2HB ARG 28 1HB ARG 28 -9.023 -19.673 2.403 252 1HG ARG 28 2HG ARG 28 -10.768 -18.272 3.118 253 2HG ARG 28 1HG ARG 28 -11.562 -18.323 1.546 254 1HD ARG 28 2HD ARG 28 -11.192 -20.752 3.274 255 2HD ARG 28 1HD ARG 28 -12.606 -19.702 3.379 256 HE ARG 28 HE ARG 28 -12.311 -20.337 0.716 257 1HH1 ARG 28 1HH1 ARG 28 -12.763 -22.239 3.670 258 2HH1 ARG 28 2HH1 ARG 28 -13.817 -23.368 2.953 259 1HH2 ARG 28 1HH2 ARG 28 -13.824 -21.849 -0.268 260 2HH2 ARG 28 2HH2 ARG 28 -14.412 -23.155 0.656 261 H GLN 29 H GLN 29 -7.642 -19.322 -1.013 262 HA GLN 29 HA GLN 29 -5.140 -19.645 0.137 263 1HB GLN 29 2HB GLN 29 -5.693 -20.779 -1.909 264 2HB GLN 29 1HB GLN 29 -6.051 -19.279 -2.729 265 1HG GLN 29 2HG GLN 29 -3.264 -19.976 -1.819 266 2HG GLN 29 1HG GLN 29 -3.906 -20.529 -3.359 267 1HE2 GLN 29 1HE2 GLN 29 -1.671 -18.744 -2.749 268 2HE2 GLN 29 2HE2 GLN 29 -1.955 -17.277 -3.608 269 H THR 30 H THR 30 -6.617 -16.864 -1.369 270 HA THR 30 HA THR 30 -4.202 -15.422 -1.664 271 HB THR 30 HB THR 30 -7.061 -14.439 -1.706 272 HG1 THR 30 1HG THR 30 -5.662 -16.072 -3.322 273 1HG2 THR 30 1HG2 THR 30 -6.144 -12.610 -3.095 274 2HG2 THR 30 2HG2 THR 30 -4.521 -13.273 -2.902 275 3HG2 THR 30 3HG2 THR 30 -5.379 -12.621 -1.505 276 H ILE 31 H ILE 31 -6.947 -15.184 0.651 277 HA ILE 31 HA ILE 31 -5.661 -13.236 2.195 278 HB ILE 31 HB ILE 31 -8.072 -13.523 2.429 279 1HG1 ILE 31 2HG1 ILE 31 -8.323 -13.567 4.899 280 2HG1 ILE 31 1HG1 ILE 31 -6.663 -14.141 5.030 281 1HG2 ILE 31 1HG2 ILE 31 -7.525 -16.206 3.643 282 2HG2 ILE 31 2HG2 ILE 31 -8.288 -15.878 2.088 283 3HG2 ILE 31 3HG2 ILE 31 -9.095 -15.405 3.585 284 1HD1 ILE 31 1HD1 ILE 31 -5.873 -12.066 4.008 285 2HD1 ILE 31 2HD1 ILE 31 -6.818 -11.754 5.465 286 3HD1 ILE 31 3HD1 ILE 31 -7.537 -11.498 3.876 287 H ASN 32 H ASN 32 -5.573 -16.774 2.419 288 HA ASN 32 HA ASN 32 -4.033 -17.005 4.768 289 1HB ASN 32 2HB ASN 32 -5.097 -18.953 3.649 290 2HB ASN 32 1HB ASN 32 -3.984 -18.781 2.301 291 1HD2 ASN 32 1HD2 ASN 32 -2.981 -20.743 2.517 292 2HD2 ASN 32 2HD2 ASN 32 -1.991 -21.170 3.865 293 H GLY 33 H GLY 33 -3.106 -16.686 1.348 294 1HA GLY 33 2HA GLY 33 -0.353 -16.819 1.640 295 2HA GLY 33 1HA GLY 33 -1.212 -16.004 0.342 296 H ILE 34 H ILE 34 -2.554 -14.023 1.923 297 HA ILE 34 HA ILE 34 -0.515 -12.126 2.279 298 HB ILE 34 HB ILE 34 -3.415 -12.070 3.182 299 1HG1 ILE 34 2HG1 ILE 34 -3.199 -12.237 0.749 300 2HG1 ILE 34 1HG1 ILE 34 -3.805 -10.654 1.209 301 1HG2 ILE 34 1HG2 ILE 34 -1.445 -9.790 3.024 302 2HG2 ILE 34 2HG2 ILE 34 -2.130 -10.489 4.490 303 3HG2 ILE 34 3HG2 ILE 34 -3.172 -9.631 3.355 304 1HD1 ILE 34 1HD1 ILE 34 -0.976 -11.304 0.406 305 2HD1 ILE 34 2HD1 ILE 34 -1.572 -9.711 0.872 306 3HD1 ILE 34 3HD1 ILE 34 -2.182 -10.487 -0.591 307 H GLU 35 H GLU 35 -2.553 -13.917 4.596 308 HA GLU 35 HA GLU 35 -1.487 -12.862 6.936 309 1HB GLU 35 2HB GLU 35 -2.559 -15.628 6.481 310 2HB GLU 35 1HB GLU 35 -2.267 -14.900 8.052 311 1HG GLU 35 2HG GLU 35 -3.899 -13.161 7.511 312 2HG GLU 35 1HG GLU 35 -4.242 -13.990 5.985 313 H LYS 36 H LYS 36 -0.254 -15.517 4.943 314 HA LYS 36 HA LYS 36 1.846 -16.069 6.868 315 1HB LYS 36 2HB LYS 36 1.177 -17.277 4.170 316 2HB LYS 36 1HB LYS 36 2.511 -17.799 5.184 317 1HG LYS 36 2HG LYS 36 -0.410 -17.935 5.937 318 2HG LYS 36 1HG LYS 36 0.561 -19.284 5.352 319 1HD LYS 36 2HD LYS 36 1.090 -17.705 7.871 320 2HD LYS 36 1HD LYS 36 0.330 -19.296 7.805 321 1HE LYS 36 2HE LYS 36 2.351 -20.269 6.902 322 2HE LYS 36 1HE LYS 36 3.108 -18.679 6.797 323 1HZ LYS 36 1HZ LYS 36 2.933 -18.519 9.209 324 2HZ LYS 36 2HZ LYS 36 3.894 -19.816 8.747 325 3HZ LYS 36 3HZ LYS 36 2.320 -20.085 9.298 326 H ASN 37 H ASN 37 1.280 -13.735 4.726 327 HA ASN 37 HA ASN 37 2.326 -12.546 3.145 328 1HB ASN 37 2HB ASN 37 4.455 -11.436 3.980 329 2HB ASN 37 1HB ASN 37 3.067 -11.322 5.044 330 1HD2 ASN 37 1HD2 ASN 37 6.228 -12.699 4.582 331 2HD2 ASN 37 2HD2 ASN 37 6.452 -13.168 6.231 332 H LYS 38 H LYS 38 2.441 -14.984 2.327 333 HA LYS 38 HA LYS 38 5.171 -15.483 1.357 334 1HB LYS 38 2HB LYS 38 3.967 -17.348 2.489 335 2HB LYS 38 1HB LYS 38 2.689 -17.234 1.290 336 1HG LYS 38 2HG LYS 38 4.295 -17.845 -0.460 337 2HG LYS 38 1HG LYS 38 5.559 -17.974 0.759 338 1HD LYS 38 2HD LYS 38 4.704 -20.178 0.204 339 2HD LYS 38 1HD LYS 38 4.283 -19.764 1.865 340 1HE LYS 38 2HE LYS 38 2.025 -19.198 1.183 341 2HE LYS 38 1HE LYS 38 2.443 -19.470 -0.506 342 1HZ LYS 38 1HZ LYS 38 2.483 -21.548 1.619 343 2HZ LYS 38 2HZ LYS 38 2.832 -21.783 -0.016 344 3HZ LYS 38 3HZ LYS 38 1.265 -21.352 0.452 345 H TYR 39 H TYR 39 2.018 -14.449 0.590 346 HA TYR 39 HA TYR 39 2.030 -14.870 -2.217 347 1HB TYR 39 2HB TYR 39 0.044 -14.820 -0.748 348 2HB TYR 39 1HB TYR 39 0.366 -13.136 -0.396 349 HD1 TYR 39 1HD TYR 39 -0.732 -15.507 -2.840 350 HD2 TYR 39 2HD TYR 39 -0.230 -11.417 -1.980 351 HE1 TYR 39 1HE TYR 39 -2.185 -14.926 -4.793 352 HE2 TYR 39 2HE TYR 39 -1.643 -10.794 -3.879 353 HH TYR 39 HH TYR 39 -3.556 -13.056 -5.548 354 H ASN 40 H ASN 40 3.295 -12.550 -0.055 355 HA ASN 40 HA ASN 40 4.064 -10.432 -0.127 356 1HB ASN 40 2HB ASN 40 5.462 -11.108 -2.090 357 2HB ASN 40 1HB ASN 40 4.117 -10.740 -3.165 358 1HD2 ASN 40 1HD2 ASN 40 3.579 -8.537 -3.558 359 2HD2 ASN 40 2HD2 ASN 40 4.624 -7.258 -3.144 360 HA PRO 41 HA PRO 41 -0.069 -8.886 -0.251 361 1HB PRO 41 2HB PRO 41 1.183 -6.564 1.093 362 2HB PRO 41 1HB PRO 41 -0.172 -7.574 1.614 363 1HG PRO 41 2HG PRO 41 2.215 -7.794 2.774 364 2HG PRO 41 1HG PRO 41 1.211 -9.226 2.468 365 1HD PRO 41 2HD PRO 41 3.582 -8.214 0.943 366 2HD PRO 41 1HD PRO 41 3.160 -9.881 1.391 367 H SER 42 H SER 42 -0.410 -8.416 -2.385 368 HA SER 42 HA SER 42 0.597 -6.166 -3.736 369 1HB SER 42 2HB SER 42 -2.088 -7.537 -4.088 370 2HB SER 42 1HB SER 42 -1.165 -6.662 -5.314 371 HG SER 42 HG SER 42 0.518 -8.323 -4.802 372 H LEU 43 H LEU 43 -0.383 -4.038 -3.839 373 HA LEU 43 HA LEU 43 -1.377 -3.291 -1.317 374 1HB LEU 43 2HB LEU 43 0.139 -1.841 -2.608 375 2HB LEU 43 1HB LEU 43 -1.097 -1.610 -3.818 376 HG LEU 43 HG LEU 43 -0.668 0.319 -2.204 377 1HD1 LEU 43 1HD1 LEU 43 -2.651 0.290 -3.586 378 2HD1 LEU 43 2HD1 LEU 43 -3.019 0.948 -1.992 379 3HD1 LEU 43 3HD1 LEU 43 -3.491 -0.705 -2.395 380 1HD2 LEU 43 1HD2 LEU 43 -0.488 -0.954 -0.115 381 2HD2 LEU 43 2HD2 LEU 43 -2.159 -1.473 -0.266 382 3HD2 LEU 43 3HD2 LEU 43 -1.788 0.227 -0.003 383 H GLN 44 H GLN 44 -3.058 -3.632 -4.524 384 HA GLN 44 HA GLN 44 -5.440 -2.494 -3.794 385 1HB GLN 44 2HB GLN 44 -4.912 -4.901 -5.541 386 2HB GLN 44 1HB GLN 44 -6.398 -3.967 -5.523 387 1HG GLN 44 2HG GLN 44 -5.243 -2.031 -6.374 388 2HG GLN 44 1HG GLN 44 -3.696 -2.871 -6.271 389 1HE2 GLN 44 1HE2 GLN 44 -3.264 -2.705 -8.442 390 2HE2 GLN 44 2HE2 GLN 44 -4.149 -3.601 -9.643 391 H LEU 45 H LEU 45 -4.386 -5.841 -3.439 392 HA LEU 45 HA LEU 45 -6.739 -6.733 -2.166 393 1HB LEU 45 2HB LEU 45 -3.965 -7.935 -2.147 394 2HB LEU 45 1HB LEU 45 -5.347 -8.703 -1.411 395 HG LEU 45 HG LEU 45 -5.003 -9.782 -3.460 396 1HD1 LEU 45 1HD1 LEU 45 -7.249 -7.840 -3.850 397 2HD1 LEU 45 2HD1 LEU 45 -7.313 -9.393 -3.010 398 3HD1 LEU 45 3HD1 LEU 45 -7.019 -9.342 -4.746 399 1HD2 LEU 45 1HD2 LEU 45 -3.554 -8.173 -4.572 400 2HD2 LEU 45 2HD2 LEU 45 -4.922 -7.090 -4.819 401 3HD2 LEU 45 3HD2 LEU 45 -4.873 -8.651 -5.641 402 H ALA 46 H ALA 46 -3.637 -5.670 -0.903 403 HA ALA 46 HA ALA 46 -4.126 -6.215 1.815 404 1HB ALA 46 1HB ALA 46 -1.887 -5.753 0.920 405 2HB ALA 46 2HB ALA 46 -2.274 -4.711 2.291 406 3HB ALA 46 3HB ALA 46 -2.349 -4.073 0.649 407 H LEU 47 H LEU 47 -4.807 -3.333 -0.147 408 HA LEU 47 HA LEU 47 -5.604 -1.767 2.041 409 1HB LEU 47 2HB LEU 47 -4.775 -0.819 -0.082 410 2HB LEU 47 1HB LEU 47 -6.182 -1.435 -0.909 411 HG LEU 47 HG LEU 47 -6.129 1.056 -0.397 412 1HD1 LEU 47 1HD1 LEU 47 -8.195 -0.016 -1.075 413 2HD1 LEU 47 2HD1 LEU 47 -8.507 1.206 0.157 414 3HD1 LEU 47 3HD1 LEU 47 -8.514 -0.505 0.591 415 1HD2 LEU 47 1HD2 LEU 47 -5.265 0.935 1.868 416 2HD2 LEU 47 2HD2 LEU 47 -6.703 0.064 2.395 417 3HD2 LEU 47 3HD2 LEU 47 -6.836 1.738 1.853 418 H LYS 48 H LYS 48 -7.371 -3.846 -0.212 419 HA LYS 48 HA LYS 48 -9.818 -2.918 0.858 420 1HB LYS 48 2HB LYS 48 -10.973 -4.824 -0.262 421 2HB LYS 48 1HB LYS 48 -10.002 -3.848 -1.338 422 1HG LYS 48 2HG LYS 48 -8.279 -5.573 -1.351 423 2HG LYS 48 1HG LYS 48 -9.245 -6.542 -0.234 424 1HD LYS 48 2HD LYS 48 -9.553 -7.311 -2.537 425 2HD LYS 48 1HD LYS 48 -11.055 -6.657 -1.881 426 1HE LYS 48 2HE LYS 48 -10.583 -4.520 -3.039 427 2HE LYS 48 1HE LYS 48 -9.141 -5.244 -3.746 428 1HZ LYS 48 1HZ LYS 48 -10.950 -5.344 -5.322 429 2HZ LYS 48 2HZ LYS 48 -11.960 -6.097 -4.214 430 3HZ LYS 48 3HZ LYS 48 -10.615 -6.911 -4.803 431 H ILE 49 H ILE 49 -7.745 -5.544 1.746 432 HA ILE 49 HA ILE 49 -9.388 -6.682 3.734 433 HB ILE 49 HB ILE 49 -6.369 -6.327 3.944 434 1HG1 ILE 49 2HG1 ILE 49 -7.899 -8.644 2.742 435 2HG1 ILE 49 1HG1 ILE 49 -7.041 -7.422 1.812 436 1HG2 ILE 49 1HG2 ILE 49 -6.464 -8.334 5.357 437 2HG2 ILE 49 2HG2 ILE 49 -8.220 -8.359 5.194 438 3HG2 ILE 49 3HG2 ILE 49 -7.429 -7.019 6.028 439 1HD1 ILE 49 1HD1 ILE 49 -5.750 -9.469 1.981 440 2HD1 ILE 49 2HD1 ILE 49 -5.806 -9.373 3.743 441 3HD1 ILE 49 3HD1 ILE 49 -4.935 -8.149 2.822 442 H ALA 50 H ALA 50 -7.150 -3.982 3.789 443 HA ALA 50 HA ALA 50 -7.208 -3.320 6.534 444 1HB ALA 50 1HB ALA 50 -6.271 -1.196 5.846 445 2HB ALA 50 2HB ALA 50 -6.766 -1.527 4.187 446 3HB ALA 50 3HB ALA 50 -5.509 -2.521 4.941 447 H TYR 51 H TYR 51 -8.986 -2.096 3.781 448 HA TYR 51 HA TYR 51 -10.426 -0.134 5.137 449 1HB TYR 51 2HB TYR 51 -10.128 0.000 2.770 450 2HB TYR 51 1HB TYR 51 -10.883 -1.565 2.525 451 HD1 TYR 51 1HD TYR 51 -13.133 -1.761 2.275 452 HD2 TYR 51 2HD TYR 51 -11.547 1.947 3.511 453 HE1 TYR 51 1HE TYR 51 -15.354 -0.708 1.904 454 HE2 TYR 51 2HE TYR 51 -13.730 3.028 3.163 455 HH TYR 51 HH TYR 51 -15.720 2.612 1.774 456 H TYR 52 H TYR 52 -11.303 -3.484 4.264 457 HA TYR 52 HA TYR 52 -13.875 -3.141 5.434 458 1HB TYR 52 2HB TYR 52 -12.544 -5.591 4.308 459 2HB TYR 52 1HB TYR 52 -14.138 -5.647 5.064 460 HD1 TYR 52 1HD TYR 52 -15.900 -3.999 4.165 461 HD2 TYR 52 2HD TYR 52 -12.383 -5.033 2.027 462 HE1 TYR 52 1HE TYR 52 -16.947 -3.228 2.090 463 HE2 TYR 52 2HE TYR 52 -13.407 -4.272 -0.055 464 HH TYR 52 HH TYR 52 -16.259 -2.392 -0.061 465 H LEU 53 H LEU 53 -10.936 -4.330 6.617 466 HA LEU 53 HA LEU 53 -12.127 -5.221 9.124 467 1HB LEU 53 2HB LEU 53 -9.223 -4.760 8.424 468 2HB LEU 53 1HB LEU 53 -9.758 -5.325 9.993 469 1HD1 LEU 53 1HD1 LEU 53 -8.485 -8.360 8.297 470 2HD1 LEU 53 2HD1 LEU 53 -8.286 -7.325 9.710 471 3HD1 LEU 53 3HD1 LEU 53 -7.804 -6.743 8.114 472 1HD2 LEU 53 1HD2 LEU 53 -11.934 -7.247 8.954 473 2HD2 LEU 53 2HD2 LEU 53 -10.754 -7.630 10.208 474 3HD2 LEU 53 3HD2 LEU 53 -10.885 -8.654 8.777 475 H ASN 54 H ASN 54 -11.490 -2.333 7.774 476 HA ASN 54 HA ASN 54 -11.243 -0.172 8.355 477 1HB ASN 54 2HB ASN 54 -13.483 -0.675 9.393 478 2HB ASN 54 1HB ASN 54 -12.652 -0.960 10.921 479 1HD2 ASN 54 1HD2 ASN 54 -13.515 0.731 12.071 480 2HD2 ASN 54 2HD2 ASN 54 -13.247 2.383 11.669 481 H THR 55 H THR 55 -8.875 -0.582 8.511 482 HA THR 55 HA THR 55 -7.904 0.274 11.062 483 HB THR 55 HB THR 55 -6.993 -2.392 9.861 484 HG1 THR 55 1HG THR 55 -9.034 -1.852 11.466 485 1HG2 THR 55 1HG2 THR 55 -6.238 -1.041 12.459 486 2HG2 THR 55 2HG2 THR 55 -5.205 -1.180 11.037 487 3HG2 THR 55 3HG2 THR 55 -5.686 -2.627 11.924 488 HA PRO 56 HA PRO 56 -5.232 2.343 8.087 489 1HB PRO 56 2HB PRO 56 -3.060 2.751 9.748 490 2HB PRO 56 1HB PRO 56 -4.472 3.809 9.668 491 1HG PRO 56 2HG PRO 56 -3.850 1.650 11.641 492 2HG PRO 56 1HG PRO 56 -4.582 3.244 11.911 493 1HD PRO 56 2HD PRO 56 -6.071 1.015 11.851 494 2HD PRO 56 1HD PRO 56 -6.670 2.550 11.184 495 H LEU 57 H LEU 57 -3.635 1.777 6.787 496 HA LEU 57 HA LEU 57 -2.758 -0.833 6.456 497 1HB LEU 57 2HB LEU 57 -1.372 1.700 5.580 498 2HB LEU 57 1HB LEU 57 -0.988 0.099 4.987 499 1HD1 LEU 57 1HD1 LEU 57 -2.919 1.677 2.258 500 2HD1 LEU 57 2HD1 LEU 57 -1.360 0.971 2.684 501 3HD1 LEU 57 3HD1 LEU 57 -1.817 2.547 3.327 502 1HD2 LEU 57 1HD2 LEU 57 -4.105 -0.333 3.066 503 2HD2 LEU 57 2HD2 LEU 57 -3.848 -0.890 4.725 504 3HD2 LEU 57 3HD2 LEU 57 -2.573 -1.091 3.522 505 H GLU 58 H GLU 58 -1.182 1.850 8.028 506 HA GLU 58 HA GLU 58 1.273 0.784 8.667 507 1HB GLU 58 2HB GLU 58 -0.264 2.625 10.494 508 2HB GLU 58 1HB GLU 58 1.473 2.464 10.355 509 1HG GLU 58 2HG GLU 58 1.088 4.449 9.242 510 2HG GLU 58 1HG GLU 58 1.080 3.273 7.926 511 H ASP 59 H ASP 59 -1.806 0.400 10.401 512 HA ASP 59 HA ASP 59 -0.552 -0.760 12.692 513 1HB ASP 59 2HB ASP 59 -2.724 0.455 12.831 514 2HB ASP 59 1HB ASP 59 -3.476 -0.856 11.926 515 H ILE 60 H ILE 60 -2.048 -1.903 9.842 516 HA ILE 60 HA ILE 60 -2.199 -4.680 10.669 517 HB ILE 60 HB ILE 60 -2.550 -3.574 7.867 518 1HG1 ILE 60 2HG1 ILE 60 -4.583 -4.240 10.008 519 2HG1 ILE 60 1HG1 ILE 60 -4.165 -2.627 9.448 520 1HG2 ILE 60 1HG2 ILE 60 -3.310 -6.233 9.090 521 2HG2 ILE 60 2HG2 ILE 60 -2.015 -5.963 7.921 522 3HG2 ILE 60 3HG2 ILE 60 -3.698 -5.710 7.450 523 1HD1 ILE 60 1HD1 ILE 60 -6.264 -3.375 8.512 524 2HD1 ILE 60 2HD1 ILE 60 -5.462 -4.784 7.811 525 3HD1 ILE 60 3HD1 ILE 60 -5.055 -3.165 7.247 526 H PHE 61 H PHE 61 -0.267 -2.937 8.282 527 HA PHE 61 HA PHE 61 1.653 -5.163 8.439 528 1HB PHE 61 2HB PHE 61 1.245 -3.154 6.177 529 2HB PHE 61 1HB PHE 61 2.463 -4.423 6.224 530 HD1 PHE 61 1HD PHE 61 1.720 -6.805 6.126 531 HD2 PHE 61 2HD PHE 61 -0.941 -3.548 5.497 532 HE1 PHE 61 1HE PHE 61 0.129 -8.322 5.027 533 HE2 PHE 61 2HE PHE 61 -2.539 -5.059 4.401 534 HZ PHE 61 HZ PHE 61 -2.004 -7.450 4.162 535 H GLN 62 H GLN 62 3.697 -4.672 8.977 536 HA GLN 62 HA GLN 62 4.172 -1.871 9.664 537 1HB GLN 62 2HB GLN 62 4.109 -3.495 11.535 538 2HB GLN 62 1HB GLN 62 5.458 -4.348 10.799 539 1HG GLN 62 2HG GLN 62 6.822 -2.305 11.016 540 2HG GLN 62 1HG GLN 62 5.473 -1.523 11.838 541 1HE2 GLN 62 1HE2 GLN 62 4.723 -4.010 13.193 542 2HE2 GLN 62 2HE2 GLN 62 5.881 -4.289 14.422 543 H TRP 63 H TRP 63 5.618 -0.941 8.497 544 HA TRP 63 HA TRP 63 7.467 -2.589 7.002 545 1HB TRP 63 2HB TRP 63 7.809 -0.396 5.713 546 2HB TRP 63 1HB TRP 63 6.329 -1.307 5.458 547 HD1 TRP 63 HD TRP 63 7.555 1.912 7.241 548 HE1 TRP 63 1HE TRP 63 5.540 3.489 7.487 549 HE3 TRP 63 3HE TRP 63 3.893 -1.214 5.528 550 HZ2 TRP 63 2HZ TRP 63 2.747 3.407 6.992 551 HZ3 TRP 63 3HZ TRP 63 1.581 -0.389 5.437 552 HH2 TRP 63 HH TRP 63 1.023 1.867 6.151 553 H GLN 64 H GLN 64 9.506 -2.545 7.414 554 HA GLN 64 HA GLN 64 10.545 -0.408 9.126 555 1HB GLN 64 2HB GLN 64 11.319 -3.342 9.103 556 2HB GLN 64 1HB GLN 64 12.138 -2.092 10.020 557 1HG GLN 64 2HG GLN 64 9.262 -2.885 10.405 558 2HG GLN 64 1HG GLN 64 10.610 -3.516 11.349 559 1HE2 GLN 64 1HE2 GLN 64 8.632 -0.751 10.692 560 2HE2 GLN 64 2HE2 GLN 64 9.068 0.162 12.077 561 HA PRO 65 HA PRO 65 12.885 -0.425 5.130 562 1HB PRO 65 2HB PRO 65 13.163 2.437 5.873 563 2HB PRO 65 1HB PRO 65 12.647 1.736 4.335 564 1HG PRO 65 2HG PRO 65 10.900 2.963 5.941 565 2HG PRO 65 1HG PRO 65 10.448 1.515 5.023 566 1HD PRO 65 2HD PRO 65 11.188 1.768 7.917 567 2HD PRO 65 1HD PRO 65 9.889 0.814 7.167 568 H GLU 66 H GLU 66 13.376 1.305 8.115 569 HA GLU 66 HA GLU 66 16.225 0.616 8.076 570 1HB GLU 66 2HB GLU 66 14.893 2.926 9.513 571 2HB GLU 66 1HB GLU 66 16.614 2.584 9.461 572 1HG GLU 66 2HG GLU 66 14.891 3.415 7.130 573 2HG GLU 66 1HG GLU 66 16.030 4.434 8.000 574 1H MET 67 1HT MET 67 -11.895 1.434 -8.534 575 2H MET 67 2HT MET 67 -11.442 2.128 -7.068 576 3H MET 67 3HT MET 67 -10.358 1.141 -7.910 577 HA MET 67 HA MET 67 -10.162 2.676 -9.669 578 1HB MET 67 2HB MET 67 -12.388 3.631 -9.645 579 2HB MET 67 1HB MET 67 -12.121 4.314 -8.046 580 1HG MET 67 2HG MET 67 -11.994 5.991 -9.824 581 2HG MET 67 1HG MET 67 -10.487 5.843 -8.927 582 1HE MET 67 1HE MET 67 -9.153 7.144 -10.784 583 2HE MET 67 2HE MET 67 -10.663 7.368 -11.670 584 3HE MET 67 3HE MET 67 -9.237 6.752 -12.502 585 H ILE 68 H ILE 68 -8.130 3.214 -9.390 586 HA ILE 68 HA ILE 68 -7.311 4.413 -6.848 587 HB ILE 68 HB ILE 68 -5.621 3.178 -9.052 588 1HG1 ILE 68 2HG1 ILE 68 -6.909 1.466 -7.870 589 2HG1 ILE 68 1HG1 ILE 68 -5.206 1.332 -7.459 590 1HG2 ILE 68 1HG2 ILE 68 -3.742 3.319 -7.474 591 2HG2 ILE 68 2HG2 ILE 68 -4.777 4.175 -6.330 592 3HG2 ILE 68 3HG2 ILE 68 -4.383 4.913 -7.883 593 1HD1 ILE 68 1HD1 ILE 68 -5.636 2.453 -5.331 594 2HD1 ILE 68 2HD1 ILE 68 -6.606 0.991 -5.514 595 3HD1 ILE 68 3HD1 ILE 68 -7.346 2.577 -5.747 596 H ILE 69 H ILE 69 -6.658 6.468 -6.775 597 HA ILE 69 HA ILE 69 -6.302 7.972 -9.274 598 HB ILE 69 HB ILE 69 -7.366 8.996 -6.594 599 1HG1 ILE 69 2HG1 ILE 69 -9.417 9.681 -8.018 600 2HG1 ILE 69 1HG1 ILE 69 -8.808 8.543 -9.209 601 1HG2 ILE 69 1HG2 ILE 69 -5.994 10.668 -7.620 602 2HG2 ILE 69 2HG2 ILE 69 -7.685 11.166 -7.684 603 3HG2 ILE 69 3HG2 ILE 69 -6.894 10.534 -9.129 604 1HD1 ILE 69 1HD1 ILE 69 -10.549 7.558 -7.842 605 2HD1 ILE 69 2HD1 ILE 69 -9.618 7.895 -6.384 606 3HD1 ILE 69 3HD1 ILE 69 -9.009 6.741 -7.573 607 H ASN 70 H ASN 70 -4.224 8.964 -9.367 608 HA ASN 70 HA ASN 70 -2.607 8.495 -7.014 609 1HB ASN 70 2HB ASN 70 -1.877 7.472 -9.123 610 2HB ASN 70 1HB ASN 70 -1.888 9.054 -9.895 611 1HD2 ASN 70 1HD2 ASN 70 0.285 8.951 -10.369 612 2HD2 ASN 70 2HD2 ASN 70 1.493 9.066 -9.141 613 H ASN 71 H ASN 71 -1.855 10.195 -5.852 614 HA ASN 71 HA ASN 71 -2.245 12.906 -6.945 615 1HB ASN 71 2HB ASN 71 -2.278 11.968 -4.060 616 2HB ASN 71 1HB ASN 71 -2.381 13.638 -4.575 617 1HD2 ASN 71 1HD2 ASN 71 -4.141 11.959 -2.998 618 2HD2 ASN 71 2HD2 ASN 71 -5.699 12.075 -3.754 619 H LEU 72 H LEU 72 -0.003 10.829 -6.917 620 HA LEU 72 HA LEU 72 2.086 11.243 -5.215 621 1HB LEU 72 2HB LEU 72 1.853 9.622 -7.157 622 2HB LEU 72 1HB LEU 72 2.424 10.902 -8.196 623 HG LEU 72 HG LEU 72 4.133 9.197 -7.660 624 1HD1 LEU 72 1HD1 LEU 72 4.913 11.405 -8.258 625 2HD1 LEU 72 2HD1 LEU 72 5.970 10.667 -7.053 626 3HD1 LEU 72 3HD1 LEU 72 4.815 11.914 -6.573 627 1HD2 LEU 72 1HD2 LEU 72 3.407 8.611 -5.453 628 2HD2 LEU 72 2HD2 LEU 72 3.840 10.212 -4.853 629 3HD2 LEU 72 3HD2 LEU 72 5.096 9.112 -5.425 630 H LYS 73 H LYS 73 1.477 13.075 -8.197 631 HA LYS 73 HA LYS 73 3.711 14.711 -7.943 632 1HB LYS 73 2HB LYS 73 2.739 16.208 -9.594 633 2HB LYS 73 1HB LYS 73 2.559 14.531 -10.068 634 1HG LYS 73 2HG LYS 73 0.195 14.631 -9.315 635 2HG LYS 73 1HG LYS 73 0.417 16.356 -8.996 636 1HD LYS 73 2HD LYS 73 1.080 16.691 -11.330 637 2HD LYS 73 1HD LYS 73 0.820 14.976 -11.640 638 1HE LYS 73 2HE LYS 73 -1.091 16.159 -12.428 639 2HE LYS 73 1HE LYS 73 -1.561 15.305 -10.963 640 1HZ LYS 73 1HZ LYS 73 -2.408 17.544 -11.105 641 2HZ LYS 73 2HZ LYS 73 -0.821 18.178 -11.067 642 3HZ LYS 73 3HZ LYS 73 -1.446 17.362 -9.729 643 H LEU 74 H LEU 74 0.484 15.183 -6.596 644 HA LEU 74 HA LEU 74 0.865 17.823 -5.702 645 1HB LEU 74 2HB LEU 74 -1.358 16.690 -5.784 646 2HB LEU 74 1HB LEU 74 -0.862 15.645 -4.480 647 HG LEU 74 HG LEU 74 -2.465 17.499 -3.854 648 1HD1 LEU 74 1HD1 LEU 74 -1.175 16.431 -2.061 649 2HD1 LEU 74 2HD1 LEU 74 -1.379 18.146 -1.734 650 3HD1 LEU 74 3HD1 LEU 74 0.159 17.549 -2.317 651 1HD2 LEU 74 1HD2 LEU 74 -1.551 19.766 -3.570 652 2HD2 LEU 74 2HD2 LEU 74 -1.571 19.252 -5.256 653 3HD2 LEU 74 3HD2 LEU 74 -0.057 19.242 -4.349 654 H ILE 75 H ILE 75 1.632 14.704 -4.292 655 HA ILE 75 HA ILE 75 2.391 15.720 -1.789 656 HB ILE 75 HB ILE 75 2.839 13.084 -3.182 657 1HG1 ILE 75 2HG1 ILE 75 1.638 12.186 -1.210 658 2HG1 ILE 75 1HG1 ILE 75 1.539 13.807 -0.551 659 1HG2 ILE 75 1HG2 ILE 75 4.959 13.444 -2.054 660 2HG2 ILE 75 2HG2 ILE 75 4.032 12.173 -1.254 661 3HG2 ILE 75 3HG2 ILE 75 4.111 13.789 -0.546 662 1HD1 ILE 75 1HD1 ILE 75 0.226 12.828 -3.078 663 2HD1 ILE 75 2HD1 ILE 75 0.113 14.463 -2.429 664 3HD1 ILE 75 3HD1 ILE 75 -0.564 13.106 -1.526 665 H ARG 76 H ARG 76 4.179 15.179 -4.760 666 HA ARG 76 HA ARG 76 6.773 15.779 -3.815 667 1HB ARG 76 2HB ARG 76 5.771 16.685 -6.492 668 2HB ARG 76 1HB ARG 76 7.393 16.233 -6.033 669 1HG ARG 76 2HG ARG 76 6.760 13.907 -5.990 670 2HG ARG 76 1HG ARG 76 5.076 14.343 -6.340 671 1HD ARG 76 2HD ARG 76 7.490 14.629 -8.104 672 2HD ARG 76 1HD ARG 76 5.956 13.818 -8.448 673 HE ARG 76 HE ARG 76 5.527 16.564 -7.916 674 1HH1 ARG 76 1HH1 ARG 76 6.377 14.397 -10.565 675 2HH1 ARG 76 2HH1 ARG 76 6.360 15.610 -11.749 676 1HH2 ARG 76 1HH2 ARG 76 5.449 18.164 -9.428 677 2HH2 ARG 76 2HH2 ARG 76 5.736 17.892 -11.096 678 H GLU 77 H GLU 77 4.075 17.851 -5.101 679 HA GLU 77 HA GLU 77 5.525 20.243 -5.007 680 1HB GLU 77 2HB GLU 77 2.528 19.864 -5.064 681 2HB GLU 77 1HB GLU 77 3.424 21.295 -5.549 682 1HG GLU 77 2HG GLU 77 3.236 18.648 -6.950 683 2HG GLU 77 1HG GLU 77 2.750 20.234 -7.537 684 H LYS 78 H LYS 78 3.284 18.647 -2.844 685 HA LYS 78 HA LYS 78 3.068 20.525 -0.865 686 1HB LYS 78 2HB LYS 78 1.815 18.393 -1.047 687 2HB LYS 78 1HB LYS 78 3.249 17.512 -0.569 688 1HG LYS 78 2HG LYS 78 2.238 19.584 1.284 689 2HG LYS 78 1HG LYS 78 1.276 18.122 1.093 690 1HD LYS 78 2HD LYS 78 4.182 18.237 1.829 691 2HD LYS 78 1HD LYS 78 2.822 17.987 2.953 692 1HE LYS 78 2HE LYS 78 2.230 15.946 1.635 693 2HE LYS 78 1HE LYS 78 3.714 16.165 0.713 694 1HZ LYS 78 1HZ LYS 78 4.035 14.570 2.481 695 2HZ LYS 78 2HZ LYS 78 3.494 15.685 3.622 696 3HZ LYS 78 3HZ LYS 78 4.951 15.944 2.882 697 H LYS 79 H LYS 79 5.654 18.244 -1.376 698 HA LYS 79 HA LYS 79 7.460 19.539 0.586 699 1HB LYS 79 2HB LYS 79 7.746 17.254 -1.413 700 2HB LYS 79 1HB LYS 79 9.090 17.849 -0.456 701 1HG LYS 79 2HG LYS 79 6.580 16.811 0.824 702 2HG LYS 79 1HG LYS 79 7.896 15.741 0.326 703 1HD LYS 79 2HD LYS 79 8.221 18.103 2.175 704 2HD LYS 79 1HD LYS 79 8.017 16.434 2.717 705 1HE LYS 79 2HE LYS 79 10.048 15.782 1.533 706 2HE LYS 79 1HE LYS 79 10.234 17.421 0.921 707 1HZ LYS 79 1HZ LYS 79 11.670 17.000 2.771 708 2HZ LYS 79 2HZ LYS 79 10.353 16.631 3.790 709 3HZ LYS 79 3HZ LYS 79 10.552 18.196 3.166 710 H LYS 80 H LYS 80 10.013 20.031 -1.186 711 HA LYS 80 HA LYS 80 8.725 20.485 -3.596 712 1HB LYS 80 2HB LYS 80 10.249 22.450 -3.928 713 2HB LYS 80 1HB LYS 80 8.988 22.702 -2.740 714 1HG LYS 80 2HG LYS 80 10.638 22.396 -0.954 715 2HG LYS 80 1HG LYS 80 11.895 22.153 -2.176 716 1HD LYS 80 2HD LYS 80 11.408 24.359 -3.106 717 2HD LYS 80 1HD LYS 80 10.178 24.609 -1.874 718 1HE LYS 80 2HE LYS 80 11.894 24.485 -0.146 719 2HE LYS 80 1HE LYS 80 13.124 24.204 -1.379 720 1HZ LYS 80 1HZ LYS 80 12.571 26.374 -2.337 721 2HZ LYS 80 2HZ LYS 80 13.103 26.511 -0.746 722 3HZ LYS 80 3HZ LYS 80 11.447 26.643 -1.106 723 H ILE 81 H ILE 81 9.283 18.405 -3.781 724 HA ILE 81 HA ILE 81 12.134 17.917 -4.248 725 HB ILE 81 HB ILE 81 9.915 15.887 -3.778 726 1HG1 ILE 81 2HG1 ILE 81 10.343 17.133 -1.705 727 2HG1 ILE 81 1HG1 ILE 81 10.904 15.476 -1.566 728 1HG2 ILE 81 1HG2 ILE 81 11.731 14.256 -3.534 729 2HG2 ILE 81 2HG2 ILE 81 12.902 15.516 -3.924 730 3HG2 ILE 81 3HG2 ILE 81 11.723 15.005 -5.131 731 1HD1 ILE 81 1HD1 ILE 81 12.460 17.023 -0.534 732 2HD1 ILE 81 2HD1 ILE 81 12.630 17.898 -2.057 733 3HD1 ILE 81 3HD1 ILE 81 13.206 16.236 -1.926 734 H SER 82 H SER 82 12.669 17.499 -6.287 735 HA SER 82 HA SER 82 10.637 17.789 -8.297 736 1HB SER 82 2HB SER 82 13.623 17.347 -8.551 737 2HB SER 82 1HB SER 82 12.528 17.850 -9.846 738 HG SER 82 HG SER 82 12.151 19.771 -8.766 739 H GLN 83 H GLN 83 10.389 16.246 -9.984 740 HA GLN 83 HA GLN 83 9.791 13.720 -8.930 741 1HB GLN 83 2HB GLN 83 9.250 13.056 -11.294 742 2HB GLN 83 1HB GLN 83 8.422 14.473 -10.675 743 1HG GLN 83 2HG GLN 83 10.044 15.893 -11.883 744 2HG GLN 83 1HG GLN 83 10.756 14.434 -12.573 745 1HE2 GLN 83 1HE2 GLN 83 9.593 13.262 -14.082 746 2HE2 GLN 83 2HE2 GLN 83 8.228 13.910 -14.897 747 H SER 84 H SER 84 12.597 14.655 -10.883 748 HA SER 84 HA SER 84 13.548 12.017 -11.191 749 1HB SER 84 2HB SER 84 15.109 14.602 -11.239 750 2HB SER 84 1HB SER 84 15.603 13.054 -11.937 751 HG SER 84 HG SER 84 13.590 14.828 -12.729 752 H GLU 85 H GLU 85 13.812 14.362 -8.582 753 HA GLU 85 HA GLU 85 15.931 13.139 -7.232 754 1HB GLU 85 2HB GLU 85 13.659 14.728 -6.060 755 2HB GLU 85 1HB GLU 85 15.191 14.369 -5.274 756 1HG GLU 85 2HG GLU 85 16.321 15.597 -7.119 757 2HG GLU 85 1HG GLU 85 14.720 16.095 -7.673 758 H LEU 86 H LEU 86 12.473 12.597 -7.185 759 HA LEU 86 HA LEU 86 12.461 10.739 -5.063 760 1HB LEU 86 2HB LEU 86 10.603 10.858 -7.446 761 2HB LEU 86 1HB LEU 86 10.428 9.672 -6.182 762 HG LEU 86 HG LEU 86 10.153 11.667 -4.589 763 1HD1 LEU 86 1HD1 LEU 86 9.296 13.705 -5.575 764 2HD1 LEU 86 2HD1 LEU 86 9.642 13.078 -7.184 765 3HD1 LEU 86 3HD1 LEU 86 10.963 13.406 -6.066 766 1HD2 LEU 86 1HD2 LEU 86 7.780 11.857 -5.124 767 2HD2 LEU 86 2HD2 LEU 86 8.342 10.188 -5.213 768 3HD2 LEU 86 3HD2 LEU 86 8.079 11.110 -6.693 769 H ALA 87 H ALA 87 13.242 10.367 -8.435 770 HA ALA 87 HA ALA 87 13.397 7.568 -8.521 771 1HB ALA 87 1HB ALA 87 15.057 9.560 -10.070 772 2HB ALA 87 2HB ALA 87 13.472 8.953 -10.546 773 3HB ALA 87 3HB ALA 87 14.850 7.854 -10.469 774 H ALA 88 H ALA 88 15.942 10.011 -7.786 775 HA ALA 88 HA ALA 88 17.922 8.156 -7.182 776 1HB ALA 88 1HB ALA 88 18.354 10.514 -7.682 777 2HB ALA 88 2HB ALA 88 19.065 10.042 -6.139 778 3HB ALA 88 3HB ALA 88 17.568 10.976 -6.171 779 H LEU 89 H LEU 89 15.516 9.744 -5.131 780 HA LEU 89 HA LEU 89 16.383 8.811 -2.634 781 1HB LEU 89 2HB LEU 89 13.600 9.456 -3.596 782 2HB LEU 89 1HB LEU 89 13.968 9.069 -1.931 783 HG LEU 89 HG LEU 89 15.117 11.430 -3.426 784 1HD1 LEU 89 1HD1 LEU 89 13.576 12.769 -2.081 785 2HD1 LEU 89 2HD1 LEU 89 12.873 11.296 -1.411 786 3HD1 LEU 89 3HD1 LEU 89 12.699 11.654 -3.128 787 1HD2 LEU 89 1HD2 LEU 89 16.531 10.635 -1.610 788 2HD2 LEU 89 2HD2 LEU 89 15.157 10.674 -0.503 789 3HD2 LEU 89 3HD2 LEU 89 15.784 12.174 -1.190 790 H LEU 90 H LEU 90 14.363 7.256 -5.043 791 HA LEU 90 HA LEU 90 13.893 4.977 -3.269 792 1HB LEU 90 2HB LEU 90 13.028 5.205 -6.133 793 2HB LEU 90 1HB LEU 90 12.375 4.173 -4.889 794 HG LEU 90 HG LEU 90 11.979 7.109 -5.279 795 1HD1 LEU 90 1HD1 LEU 90 9.628 6.494 -5.395 796 2HD1 LEU 90 2HD1 LEU 90 10.081 4.798 -5.242 797 3HD1 LEU 90 3HD1 LEU 90 10.611 5.731 -6.644 798 1HD2 LEU 90 1HD2 LEU 90 12.257 6.860 -2.903 799 2HD2 LEU 90 2HD2 LEU 90 11.210 5.459 -2.871 800 3HD2 LEU 90 3HD2 LEU 90 10.532 7.052 -3.230 801 H GLU 91 H GLU 91 16.413 5.927 -5.110 802 HA GLU 91 HA GLU 91 17.976 5.087 -6.422 803 1HB GLU 91 2HB GLU 91 17.411 2.588 -4.814 804 2HB GLU 91 1HB GLU 91 18.879 2.900 -5.733 805 1HG GLU 91 2HG GLU 91 19.217 4.934 -4.296 806 2HG GLU 91 1HG GLU 91 17.897 4.344 -3.289 807 H VAL 92 H VAL 92 15.722 5.207 -7.807 808 HA VAL 92 HA VAL 92 15.690 2.756 -9.425 809 HB VAL 92 HB VAL 92 13.325 3.192 -10.010 810 1HG1 VAL 92 1HG1 VAL 92 13.764 1.631 -8.231 811 2HG1 VAL 92 2HG1 VAL 92 12.278 2.524 -7.906 812 3HG1 VAL 92 3HG1 VAL 92 13.765 2.940 -7.050 813 1HG2 VAL 92 1HG2 VAL 92 13.433 5.358 -7.907 814 2HG2 VAL 92 2HG2 VAL 92 11.974 4.799 -8.727 815 3HG2 VAL 92 3HG2 VAL 92 13.247 5.606 -9.642 816 H SER 93 H SER 93 14.572 3.449 -11.655 817 HA SER 93 HA SER 93 16.224 5.584 -12.686 818 1HB SER 93 2HB SER 93 14.255 3.750 -14.066 819 2HB SER 93 1HB SER 93 15.479 4.760 -14.844 820 HG SER 93 HG SER 93 16.796 3.349 -13.096 821 H ARG 94 H ARG 94 15.347 7.382 -13.822 822 HA ARG 94 HA ARG 94 13.171 8.725 -12.702 823 1HB ARG 94 2HB ARG 94 14.409 9.151 -15.435 824 2HB ARG 94 1HB ARG 94 13.354 10.297 -14.616 825 1HG ARG 94 2HG ARG 94 14.947 10.655 -12.891 826 2HG ARG 94 1HG ARG 94 15.951 9.330 -13.465 827 1HD ARG 94 2HD ARG 94 16.996 11.323 -14.162 828 2HD ARG 94 1HD ARG 94 16.256 10.618 -15.591 829 HE ARG 94 HE ARG 94 14.608 12.597 -14.298 830 1HH1 ARG 94 1HH1 ARG 94 17.193 12.051 -16.648 831 2HH1 ARG 94 2HH1 ARG 94 17.067 13.584 -17.370 832 1HH2 ARG 94 1HH2 ARG 94 14.418 14.741 -15.289 833 2HH2 ARG 94 2HH2 ARG 94 15.445 15.150 -16.578 834 H GLN 95 H GLN 95 13.307 6.659 -15.533 835 HA GLN 95 HA GLN 95 10.778 7.063 -16.605 836 1HB GLN 95 2HB GLN 95 12.525 5.777 -17.704 837 2HB GLN 95 1HB GLN 95 12.423 4.539 -16.464 838 1HG GLN 95 2HG GLN 95 10.120 4.057 -17.180 839 2HG GLN 95 1HG GLN 95 10.291 5.262 -18.455 840 1HE2 GLN 95 1HE2 GLN 95 9.803 2.402 -18.623 841 2HE2 GLN 95 2HE2 GLN 95 11.078 1.753 -19.605 842 H THR 96 H THR 96 11.808 4.983 -13.921 843 HA THR 96 HA THR 96 9.453 3.479 -13.671 844 HB THR 96 HB THR 96 11.495 4.136 -11.544 845 HG1 THR 96 1HG THR 96 11.479 2.071 -13.504 846 1HG2 THR 96 1HG2 THR 96 9.488 2.975 -10.717 847 2HG2 THR 96 2HG2 THR 96 10.899 1.916 -10.664 848 3HG2 THR 96 3HG2 THR 96 9.701 1.725 -11.943 849 H ILE 97 H ILE 97 10.699 6.273 -11.768 850 HA ILE 97 HA ILE 97 8.405 6.441 -10.181 851 HB ILE 97 HB ILE 97 10.595 7.338 -9.487 852 1HG1 ILE 97 2HG1 ILE 97 8.455 8.259 -8.430 853 2HG1 ILE 97 1HG1 ILE 97 9.903 9.221 -8.218 854 1HG2 ILE 97 1HG2 ILE 97 11.433 8.242 -11.508 855 2HG2 ILE 97 2HG2 ILE 97 11.448 9.489 -10.262 856 3HG2 ILE 97 3HG2 ILE 97 10.201 9.503 -11.510 857 1HD1 ILE 97 1HD1 ILE 97 9.109 10.764 -9.957 858 2HD1 ILE 97 2HD1 ILE 97 7.959 10.609 -8.628 859 3HD1 ILE 97 3HD1 ILE 97 7.660 9.774 -10.155 860 H ASN 98 H ASN 98 9.255 8.142 -13.130 861 HA ASN 98 HA ASN 98 7.009 9.849 -13.206 862 1HB ASN 98 2HB ASN 98 9.085 10.098 -14.601 863 2HB ASN 98 1HB ASN 98 8.569 8.722 -15.554 864 1HD2 ASN 98 1HD2 ASN 98 9.099 11.570 -16.125 865 2HD2 ASN 98 2HD2 ASN 98 7.728 12.147 -17.006 866 H GLY 99 H GLY 99 7.534 6.553 -14.369 867 1HA GLY 99 2HA GLY 99 5.068 6.168 -15.654 868 2HA GLY 99 1HA GLY 99 6.079 4.903 -14.967 869 H ILE 100 H ILE 100 6.020 5.894 -12.228 870 HA ILE 100 HA ILE 100 3.588 4.836 -11.321 871 HB ILE 100 HB ILE 100 5.715 6.441 -9.864 872 1HG1 ILE 100 2HG1 ILE 100 6.565 4.328 -10.731 873 2HG1 ILE 100 1HG1 ILE 100 6.459 4.259 -8.978 874 1HG2 ILE 100 1HG2 ILE 100 3.444 4.855 -8.671 875 2HG2 ILE 100 2HG2 ILE 100 3.632 6.608 -8.636 876 3HG2 ILE 100 3HG2 ILE 100 4.773 5.582 -7.765 877 1HD1 ILE 100 1HD1 ILE 100 4.507 3.042 -10.920 878 2HD1 ILE 100 2HD1 ILE 100 4.401 2.956 -9.160 879 3HD1 ILE 100 3HD1 ILE 100 5.741 2.179 -10.004 880 H GLU 101 H GLU 101 4.839 8.172 -11.516 881 HA GLU 101 HA GLU 101 2.696 9.535 -10.401 882 1HB GLU 101 2HB GLU 101 4.176 10.498 -12.835 883 2HB GLU 101 1HB GLU 101 3.281 11.475 -11.690 884 1HG GLU 101 2HG GLU 101 4.939 10.785 -9.965 885 2HG GLU 101 1HG GLU 101 5.872 10.047 -11.271 886 H LYS 102 H LYS 102 3.006 8.272 -13.662 887 HA LYS 102 HA LYS 102 0.476 9.491 -14.441 888 1HB LYS 102 2HB LYS 102 2.335 7.761 -16.093 889 2HB LYS 102 1HB LYS 102 1.067 8.830 -16.687 890 1HG LYS 102 2HG LYS 102 3.580 9.709 -15.268 891 2HG LYS 102 1HG LYS 102 3.285 9.805 -17.003 892 1HD LYS 102 2HD LYS 102 1.810 11.550 -16.789 893 2HD LYS 102 1HD LYS 102 1.334 11.089 -15.156 894 1HE LYS 102 2HE LYS 102 2.648 13.171 -15.203 895 2HE LYS 102 1HE LYS 102 3.427 11.901 -14.267 896 1HZ LYS 102 1HZ LYS 102 4.980 13.097 -15.610 897 2HZ LYS 102 2HZ LYS 102 4.176 12.751 -17.034 898 3HZ LYS 102 3HZ LYS 102 4.930 11.508 -16.143 899 H ASN 103 H ASN 103 1.248 7.035 -12.651 900 HA ASN 103 HA ASN 103 0.669 4.930 -12.168 901 1HB ASN 103 2HB ASN 103 -1.700 4.623 -11.701 902 2HB ASN 103 1HB ASN 103 -1.253 6.273 -11.329 903 1HD2 ASN 103 1HD2 ASN 103 -3.152 4.201 -13.258 904 2HD2 ASN 103 2HD2 ASN 103 -4.067 5.411 -14.101 905 H LYS 104 H LYS 104 1.685 4.916 -14.671 906 HA LYS 104 HA LYS 104 -0.144 3.282 -16.264 907 1HB LYS 104 2HB LYS 104 0.777 5.242 -17.413 908 2HB LYS 104 1HB LYS 104 2.407 4.740 -16.998 909 1HG LYS 104 2HG LYS 104 2.207 2.793 -18.425 910 2HG LYS 104 1HG LYS 104 0.531 3.203 -18.783 911 1HD LYS 104 2HD LYS 104 2.064 3.872 -20.589 912 2HD LYS 104 1HD LYS 104 1.237 5.254 -19.873 913 1HE LYS 104 2HE LYS 104 3.236 5.761 -18.547 914 2HE LYS 104 1HE LYS 104 4.053 4.361 -19.248 915 1HZ LYS 104 1HZ LYS 104 3.021 6.665 -20.788 916 2HZ LYS 104 2HZ LYS 104 3.948 5.358 -21.386 917 3HZ LYS 104 3HZ LYS 104 4.642 6.470 -20.340 918 H TYR 105 H TYR 105 2.806 3.452 -14.497 919 HA TYR 105 HA TYR 105 3.807 0.895 -15.310 920 1HB TYR 105 2HB TYR 105 5.142 2.919 -14.524 921 2HB TYR 105 1HB TYR 105 4.563 2.559 -12.907 922 HD1 TYR 105 1HD TYR 105 6.256 1.059 -15.742 923 HD2 TYR 105 2HD TYR 105 5.823 1.120 -11.550 924 HE1 TYR 105 1HE TYR 105 8.172 -0.511 -15.535 925 HE2 TYR 105 2HE TYR 105 7.711 -0.434 -11.296 926 HH TYR 105 HH TYR 105 8.867 -2.104 -12.625 927 H ASN 106 H ASN 106 1.475 2.095 -13.262 928 HA ASN 106 HA ASN 106 0.119 1.388 -11.638 929 1HB ASN 106 2HB ASN 106 -0.190 -0.630 -13.084 930 2HB ASN 106 1HB ASN 106 1.125 -1.419 -12.218 931 1HD2 ASN 106 1HD2 ASN 106 -0.145 -3.052 -11.417 932 2HD2 ASN 106 2HD2 ASN 106 -1.347 -2.794 -10.206 933 HA PRO 107 HA PRO 107 3.162 2.125 -8.509 934 1HB PRO 107 2HB PRO 107 0.675 2.239 -6.881 935 2HB PRO 107 1HB PRO 107 2.024 3.380 -6.966 936 1HG PRO 107 2HG PRO 107 -0.250 3.944 -8.188 937 2HG PRO 107 1HG PRO 107 1.299 4.293 -8.977 938 1HD PRO 107 2HD PRO 107 -0.618 2.057 -9.469 939 2HD PRO 107 1HD PRO 107 0.328 3.012 -10.633 940 H SER 108 H SER 108 4.255 0.296 -8.080 941 HA SER 108 HA SER 108 3.217 -1.938 -6.694 942 1HB SER 108 2HB SER 108 6.064 -0.918 -6.847 943 2HB SER 108 1HB SER 108 5.548 -2.571 -6.505 944 HG SER 108 HG SER 108 4.550 -2.544 -8.584 945 H LEU 109 H LEU 109 3.429 -2.368 -4.439 946 HA LEU 109 HA LEU 109 2.929 -0.098 -2.872 947 1HB LEU 109 2HB LEU 109 1.901 -2.295 -2.416 948 2HB LEU 109 1HB LEU 109 3.461 -2.936 -1.966 949 HG LEU 109 HG LEU 109 1.800 -2.369 -0.088 950 1HD1 LEU 109 1HD1 LEU 109 4.569 -1.189 0.080 951 2HD1 LEU 109 2HD1 LEU 109 4.128 -2.866 0.395 952 3HD1 LEU 109 3HD1 LEU 109 3.526 -1.585 1.446 953 1HD2 LEU 109 1HD2 LEU 109 1.076 -0.179 -0.909 954 2HD2 LEU 109 2HD2 LEU 109 2.709 0.442 -0.739 955 3HD2 LEU 109 3HD2 LEU 109 1.798 -0.030 0.691 956 H GLN 110 H GLN 110 5.906 -2.133 -3.137 957 HA GLN 110 HA GLN 110 7.311 -1.010 -1.061 958 1HB GLN 110 2HB GLN 110 7.981 -2.988 -2.386 959 2HB GLN 110 1HB GLN 110 8.320 -1.947 -3.755 960 1HG GLN 110 2HG GLN 110 10.366 -2.582 -2.633 961 2HG GLN 110 1HG GLN 110 10.093 -0.849 -2.480 962 1HE2 GLN 110 1HE2 GLN 110 10.079 -3.895 -0.834 963 2HE2 GLN 110 2HE2 GLN 110 10.109 -3.280 0.771 964 H LEU 111 H LEU 111 7.132 0.005 -4.436 965 HA LEU 111 HA LEU 111 8.878 2.202 -4.256 966 1HB LEU 111 2HB LEU 111 6.553 1.782 -6.136 967 2HB LEU 111 1HB LEU 111 7.813 2.976 -6.348 968 HG LEU 111 HG LEU 111 8.205 -0.016 -6.397 969 1HD1 LEU 111 1HD1 LEU 111 7.012 0.789 -8.351 970 2HD1 LEU 111 2HD1 LEU 111 8.654 0.309 -8.776 971 3HD1 LEU 111 3HD1 LEU 111 8.251 2.017 -8.620 972 1HD2 LEU 111 1HD2 LEU 111 10.156 2.227 -6.925 973 2HD2 LEU 111 2HD2 LEU 111 10.480 0.507 -7.147 974 3HD2 LEU 111 3HD2 LEU 111 10.174 1.145 -5.531 975 H ALA 112 H ALA 112 5.392 1.955 -3.973 976 HA ALA 112 HA ALA 112 4.799 4.695 -3.636 977 1HB ALA 112 1HB ALA 112 3.304 2.285 -2.609 978 2HB ALA 112 2HB ALA 112 3.126 3.004 -4.209 979 3HB ALA 112 3HB ALA 112 2.650 3.917 -2.778 980 H LEU 113 H LEU 113 5.588 2.122 -1.351 981 HA LEU 113 HA LEU 113 5.007 3.456 1.021 982 1HB LEU 113 2HB LEU 113 5.178 1.045 0.745 983 2HB LEU 113 1HB LEU 113 6.883 1.201 0.394 984 HG LEU 113 HG LEU 113 7.277 2.016 2.661 985 1HD1 LEU 113 1HD1 LEU 113 5.474 1.896 4.302 986 2HD1 LEU 113 2HD1 LEU 113 4.337 1.483 3.019 987 3HD1 LEU 113 3HD1 LEU 113 5.118 3.065 3.030 988 1HD2 LEU 113 1HD2 LEU 113 6.849 -0.109 3.794 989 2HD2 LEU 113 2HD2 LEU 113 7.460 -0.363 2.157 990 3HD2 LEU 113 3HD2 LEU 113 5.744 -0.576 2.500 991 H LYS 114 H LYS 114 8.020 2.990 -0.782 992 HA LYS 114 HA LYS 114 9.422 4.456 1.167 993 1HB LYS 114 2HB LYS 114 11.348 4.533 -0.518 994 2HB LYS 114 1HB LYS 114 10.853 2.973 0.103 995 1HG LYS 114 2HG LYS 114 9.647 2.538 -1.953 996 2HG LYS 114 1HG LYS 114 10.129 4.093 -2.611 997 1HD LYS 114 2HD LYS 114 11.602 2.359 -3.459 998 2HD LYS 114 1HD LYS 114 12.513 3.393 -2.358 999 1HE LYS 114 2HE LYS 114 12.139 1.732 -0.552 1000 2HE LYS 114 1HE LYS 114 11.326 0.691 -1.717 1001 1HZ LYS 114 1HZ LYS 114 14.177 1.539 -1.793 1002 2HZ LYS 114 2HZ LYS 114 13.435 0.651 -3.001 1003 3HZ LYS 114 3HZ LYS 114 13.590 -0.003 -1.437 1004 H ILE 115 H ILE 115 7.923 5.447 -1.798 1005 HA ILE 115 HA ILE 115 8.807 8.134 -1.763 1006 HB ILE 115 HB ILE 115 6.069 7.099 -2.604 1007 1HG1 ILE 115 2HG1 ILE 115 8.496 7.786 -4.275 1008 2HG1 ILE 115 1HG1 ILE 115 8.002 6.157 -3.842 1009 1HG2 ILE 115 1HG2 ILE 115 5.866 9.200 -3.883 1010 2HG2 ILE 115 2HG2 ILE 115 7.378 9.770 -3.170 1011 3HG2 ILE 115 3HG2 ILE 115 5.971 9.490 -2.147 1012 1HD1 ILE 115 1HD1 ILE 115 5.931 6.455 -5.109 1013 2HD1 ILE 115 2HD1 ILE 115 7.357 6.709 -6.114 1014 3HD1 ILE 115 3HD1 ILE 115 6.431 8.093 -5.530 1015 H ALA 116 H ALA 116 6.215 6.512 -0.080 1016 HA ALA 116 HA ALA 116 4.987 8.698 1.202 1017 1HB ALA 116 1HB ALA 116 4.085 7.031 2.729 1018 2HB ALA 116 2HB ALA 116 5.275 5.868 2.143 1019 3HB ALA 116 3HB ALA 116 4.004 6.444 1.057 1020 H TYR 117 H TYR 117 7.582 6.540 2.133 1021 HA TYR 117 HA TYR 117 7.964 7.595 4.700 1022 1HB TYR 117 2HB TYR 117 8.540 5.341 4.226 1023 2HB TYR 117 1HB TYR 117 9.597 5.812 2.910 1024 HD1 TYR 117 1HD TYR 117 11.792 5.906 3.271 1025 HD2 TYR 117 2HD TYR 117 9.228 6.213 6.617 1026 HE1 TYR 117 1HE TYR 117 13.772 5.824 4.776 1027 HE2 TYR 117 2HE TYR 117 11.165 6.134 8.139 1028 HH TYR 117 HH TYR 117 14.404 6.404 6.968 1029 H TYR 118 H TYR 118 9.877 8.049 1.662 1030 HA TYR 118 HA TYR 118 11.677 9.830 2.948 1031 1HB TYR 118 2HB TYR 118 11.251 9.274 0.009 1032 2HB TYR 118 1HB TYR 118 12.485 10.376 0.611 1033 HD1 TYR 118 1HD TYR 118 14.249 9.433 2.181 1034 HD2 TYR 118 2HD TYR 118 11.659 6.974 -0.104 1035 HE1 TYR 118 1HE TYR 118 15.787 7.534 2.484 1036 HE2 TYR 118 2HE TYR 118 13.179 5.074 0.189 1037 HH TYR 118 HH TYR 118 15.687 5.123 2.462 1038 H LEU 119 H LEU 119 8.813 10.343 1.199 1039 HA LEU 119 HA LEU 119 9.246 13.245 1.358 1040 1HB LEU 119 2HB LEU 119 7.101 11.731 -0.126 1041 2HB LEU 119 1HB LEU 119 7.017 13.462 0.101 1042 1HD1 LEU 119 1HD1 LEU 119 9.918 11.823 -2.565 1043 2HD1 LEU 119 2HD1 LEU 119 8.702 10.774 -1.835 1044 3HD1 LEU 119 3HD1 LEU 119 10.043 11.376 -0.862 1045 1HD2 LEU 119 1HD2 LEU 119 8.261 13.421 -3.322 1046 2HD2 LEU 119 2HD2 LEU 119 7.173 14.214 -2.187 1047 3HD2 LEU 119 3HD2 LEU 119 6.906 12.529 -2.634 1048 H ASN 120 H ASN 120 8.153 11.045 3.331 1049 HA ASN 120 HA ASN 120 6.948 10.934 5.227 1050 1HB ASN 120 2HB ASN 120 8.563 12.736 5.861 1051 2HB ASN 120 1HB ASN 120 7.379 13.937 5.355 1052 1HD2 ASN 120 1HD2 ASN 120 7.096 14.850 7.385 1053 2HD2 ASN 120 2HD2 ASN 120 6.326 13.976 8.669 1054 H THR 121 H THR 121 5.075 10.380 3.834 1055 HA THR 121 HA THR 121 2.887 12.198 4.346 1056 HB THR 121 HB THR 121 3.401 11.076 1.572 1057 HG1 THR 121 1HG THR 121 4.958 12.706 2.365 1058 1HG2 THR 121 1HG2 THR 121 1.577 13.258 2.595 1059 2HG2 THR 121 2HG2 THR 121 1.078 11.628 2.138 1060 3HG2 THR 121 3HG2 THR 121 1.712 12.731 0.917 1061 HA PRO 122 HA PRO 122 1.148 8.112 5.191 1062 1HB PRO 122 2HB PRO 122 -1.440 9.426 4.614 1063 2HB PRO 122 1HB PRO 122 -0.910 8.585 6.065 1064 1HG PRO 122 2HG PRO 122 -1.145 11.246 6.041 1065 2HG PRO 122 1HG PRO 122 0.142 10.434 6.951 1066 1HD PRO 122 2HD PRO 122 0.267 11.856 4.334 1067 2HD PRO 122 1HD PRO 122 1.445 11.832 5.664 1068 H LEU 123 H LEU 123 0.544 6.448 3.884 1069 HA LEU 123 HA LEU 123 0.734 6.681 1.118 1070 1HB LEU 123 2HB LEU 123 -0.511 4.448 2.740 1071 2HB LEU 123 1HB LEU 123 -0.260 4.360 1.018 1072 1HD1 LEU 123 1HD2 LEU 123 1.413 4.122 4.318 1073 2HD1 LEU 123 2HD2 LEU 123 2.158 5.579 3.660 1074 3HD1 LEU 123 3HD2 LEU 123 3.057 4.064 3.684 1075 1HD2 LEU 123 1HD1 LEU 123 1.144 2.401 1.033 1076 2HD2 LEU 123 2HD1 LEU 123 0.779 2.251 2.752 1077 3HD2 LEU 123 3HD1 LEU 123 2.454 2.235 2.201 1078 H GLU 124 H GLU 124 -2.149 6.508 3.173 1079 HA GLU 124 HA GLU 124 -4.101 6.489 1.212 1080 1HB GLU 124 2HB GLU 124 -4.179 7.834 3.905 1081 2HB GLU 124 1HB GLU 124 -5.577 7.467 2.909 1082 1HG GLU 124 2HG GLU 124 -5.021 5.063 3.104 1083 2HG GLU 124 1HG GLU 124 -3.695 5.523 4.189 1084 H ASP 125 H ASP 125 -2.194 9.149 2.421 1085 HA ASP 125 HA ASP 125 -3.874 11.160 1.284 1086 1HB ASP 125 2HB ASP 125 -2.329 11.545 3.238 1087 2HB ASP 125 1HB ASP 125 -0.983 11.470 2.103 1088 H ILE 126 H ILE 126 -1.130 9.369 0.293 1089 HA ILE 126 HA ILE 126 -0.452 11.003 -1.997 1090 HB ILE 126 HB ILE 126 0.503 8.169 -1.488 1091 1HG1 ILE 126 2HG1 ILE 126 1.770 10.802 -0.695 1092 2HG1 ILE 126 1HG1 ILE 126 1.049 9.642 0.413 1093 1HG2 ILE 126 1HG2 ILE 126 1.614 10.411 -3.186 1094 2HG2 ILE 126 2HG2 ILE 126 0.817 8.954 -3.780 1095 3HG2 ILE 126 3HG2 ILE 126 2.368 8.834 -2.949 1096 1HD1 ILE 126 1HD1 ILE 126 3.467 9.171 -1.312 1097 2HD1 ILE 126 2HD1 ILE 126 2.751 8.005 -0.200 1098 3HD1 ILE 126 3HD1 ILE 126 3.469 9.490 0.421 1099 H PHE 127 H PHE 127 -1.863 7.803 -1.583 1100 HA PHE 127 HA PHE 127 -2.875 8.046 -4.337 1101 1HB PHE 127 2HB PHE 127 -2.344 5.514 -2.726 1102 2HB PHE 127 1HB PHE 127 -3.030 5.579 -4.348 1103 HD1 PHE 127 1HD PHE 127 -1.637 6.113 -6.246 1104 HD2 PHE 127 2HD PHE 127 -0.026 5.919 -2.318 1105 HE1 PHE 127 1HE PHE 127 0.637 6.027 -7.181 1106 HE2 PHE 127 2HE PHE 127 2.245 5.840 -3.248 1107 HZ PHE 127 HZ PHE 127 2.579 5.892 -5.682 1108 H GLN 128 H GLN 128 -4.982 7.806 -4.711 1109 HA GLN 128 HA GLN 128 -6.659 7.569 -2.339 1110 1HB GLN 128 2HB GLN 128 -6.903 9.713 -3.460 1111 2HB GLN 128 1HB GLN 128 -7.242 8.902 -4.984 1112 1HG GLN 128 2HG GLN 128 -9.322 8.089 -4.188 1113 2HG GLN 128 1HG GLN 128 -8.956 8.585 -2.534 1114 1HE2 GLN 128 1HE2 GLN 128 -9.915 9.682 -5.720 1115 2HE2 GLN 128 2HE2 GLN 128 -10.406 11.247 -5.183 1116 H TRP 129 H TRP 129 -7.828 5.914 -2.141 1117 HA TRP 129 HA TRP 129 -8.302 4.270 -4.489 1118 1HB TRP 129 2HB TRP 129 -8.519 2.428 -2.550 1119 2HB TRP 129 1HB TRP 129 -7.023 2.799 -3.385 1120 HD1 TRP 129 HD TRP 129 -8.794 3.877 -0.075 1121 HE1 TRP 129 1HE TRP 129 -6.952 4.315 1.665 1122 HE3 TRP 129 3HE TRP 129 -4.693 3.110 -3.024 1123 HZ2 TRP 129 2HZ TRP 129 -4.113 4.315 1.765 1124 HZ3 TRP 129 3HZ TRP 129 -2.460 3.341 -2.027 1125 HH2 TRP 129 HH TRP 129 -2.182 3.932 0.314 1126 H GLN 130 H GLN 130 -10.172 4.151 -5.112 1127 HA GLN 130 HA GLN 130 -12.417 4.634 -3.288 1128 1HB GLN 130 2HB GLN 130 -12.224 4.859 -6.295 1129 2HB GLN 130 1HB GLN 130 -13.686 5.103 -5.361 1130 1HG GLN 130 2HG GLN 130 -11.198 6.781 -5.125 1131 2HG GLN 130 1HG GLN 130 -12.583 7.182 -6.128 1132 1HE2 GLN 130 1HE2 GLN 130 -13.117 9.003 -5.108 1133 2HE2 GLN 130 2HE2 GLN 130 -13.713 9.090 -3.486 1134 HA PRO 131 HA PRO 131 -13.030 0.195 -4.200 1135 1HB PRO 131 2HB PRO 131 -14.758 0.273 -1.842 1136 2HB PRO 131 1HB PRO 131 -13.276 -0.654 -2.087 1137 1HG PRO 131 2HG PRO 131 -13.430 1.413 -0.342 1138 2HG PRO 131 1HG PRO 131 -11.939 1.000 -1.208 1139 1HD PRO 131 2HD PRO 131 -13.943 3.149 -1.795 1140 2HD PRO 131 1HD PRO 131 -12.166 3.224 -1.846 1141 H GLU 132 H GLU 132 -15.158 2.694 -3.365 1142 HA GLU 132 HA GLU 132 -17.497 1.389 -4.563 1143 1HB GLU 132 2HB GLU 132 -17.365 3.970 -2.990 1144 2HB GLU 132 1HB GLU 132 -18.831 3.172 -3.539 1145 1HG GLU 132 2HG GLU 132 -18.361 1.272 -2.103 1146 2HG GLU 132 1HG GLU 132 -16.856 2.026 -1.577 Start of MODEL 12 1 1H MET 1 1HT MET 1 13.516 -5.355 5.480 2 2H MET 1 2HT MET 1 12.437 -4.100 5.836 3 3H MET 1 3HT MET 1 12.076 -5.211 4.621 4 HA MET 1 HA MET 1 11.830 -6.968 6.131 5 1HB MET 1 2HB MET 1 12.540 -4.900 8.215 6 2HB MET 1 1HB MET 1 11.798 -6.445 8.592 7 1HG MET 1 2HG MET 1 13.740 -7.606 7.694 8 2HG MET 1 1HG MET 1 14.477 -6.059 7.285 9 1HE MET 1 1HE MET 1 15.299 -4.289 9.036 10 2HE MET 1 2HE MET 1 15.087 -4.450 10.778 11 3HE MET 1 3HE MET 1 13.680 -4.248 9.734 12 H ILE 2 H ILE 2 9.814 -7.272 5.905 13 HA ILE 2 HA ILE 2 7.937 -5.122 6.600 14 HB ILE 2 HB ILE 2 7.492 -7.610 4.908 15 1HG1 ILE 2 2HG1 ILE 2 8.775 -5.895 3.738 16 2HG1 ILE 2 1HG1 ILE 2 7.169 -6.035 3.039 17 1HG2 ILE 2 1HG2 ILE 2 5.510 -5.444 5.594 18 2HG2 ILE 2 2HG2 ILE 2 5.447 -7.128 6.115 19 3HG2 ILE 2 3HG2 ILE 2 5.248 -6.724 4.410 20 1HD1 ILE 2 1HD1 ILE 2 8.103 -3.884 4.932 21 2HD1 ILE 2 2HD1 ILE 2 6.484 -4.015 4.247 22 3HD1 ILE 2 3HD1 ILE 2 7.866 -3.716 3.193 23 H ILE 3 H ILE 3 6.487 -5.412 8.238 24 HA ILE 3 HA ILE 3 6.712 -7.903 9.760 25 HB ILE 3 HB ILE 3 6.036 -5.102 10.750 26 1HG1 ILE 3 2HG1 ILE 3 8.589 -6.690 11.140 27 2HG1 ILE 3 1HG1 ILE 3 8.409 -5.310 10.069 28 1HG2 ILE 3 1HG2 ILE 3 4.966 -6.874 12.052 29 2HG2 ILE 3 2HG2 ILE 3 6.230 -6.085 12.996 30 3HG2 ILE 3 3HG2 ILE 3 6.526 -7.668 12.276 31 1HD1 ILE 3 1HD1 ILE 3 8.135 -5.277 13.062 32 2HD1 ILE 3 2HD1 ILE 3 7.943 -3.886 11.998 33 3HD1 ILE 3 3HD1 ILE 3 9.511 -4.683 12.132 34 H ASN 4 H ASN 4 4.688 -9.044 9.828 35 HA ASN 4 HA ASN 4 2.502 -7.689 8.565 36 1HB ASN 4 2HB ASN 4 3.446 -9.810 7.673 37 2HB ASN 4 1HB ASN 4 3.115 -10.581 9.208 38 1HD2 ASN 4 1HD2 ASN 4 2.248 -11.233 6.590 39 2HD2 ASN 4 2HD2 ASN 4 0.530 -11.247 6.570 40 H ASN 5 H ASN 5 0.828 -7.017 9.849 41 HA ASN 5 HA ASN 5 0.455 -8.341 12.439 42 1HB ASN 5 2HB ASN 5 -0.015 -5.438 11.708 43 2HB ASN 5 1HB ASN 5 -0.554 -6.185 13.196 44 1HD2 ASN 5 1HD2 ASN 5 1.162 -3.951 12.667 45 2HD2 ASN 5 2HD2 ASN 5 2.638 -4.227 13.513 46 H LEU 6 H LEU 6 -0.614 -8.474 9.477 47 HA LEU 6 HA LEU 6 -3.221 -7.503 9.358 48 1HB LEU 6 2HB LEU 6 -1.866 -8.250 7.427 49 2HB LEU 6 1HB LEU 6 -1.926 -9.890 8.002 50 HG LEU 6 HG LEU 6 -3.345 -9.320 5.990 51 1HD1 LEU 6 1HD1 LEU 6 -4.792 -10.492 8.352 52 2HD1 LEU 6 2HD1 LEU 6 -3.748 -11.362 7.229 53 3HD1 LEU 6 3HD1 LEU 6 -5.266 -10.661 6.662 54 1HD2 LEU 6 1HD2 LEU 6 -5.507 -8.264 6.402 55 2HD2 LEU 6 2HD2 LEU 6 -4.159 -7.171 6.716 56 3HD2 LEU 6 3HD2 LEU 6 -5.015 -7.928 8.062 57 H LYS 7 H LYS 7 -1.948 -10.540 10.388 58 HA LYS 7 HA LYS 7 -4.332 -11.853 11.034 59 1HB LYS 7 2HB LYS 7 -2.805 -13.264 12.499 60 2HB LYS 7 1HB LYS 7 -2.385 -13.157 10.795 61 1HG LYS 7 2HG LYS 7 -0.744 -11.351 11.416 62 2HG LYS 7 1HG LYS 7 -1.073 -11.739 13.103 63 1HD LYS 7 2HD LYS 7 -0.068 -13.699 11.044 64 2HD LYS 7 1HD LYS 7 0.956 -12.844 12.194 65 1HE LYS 7 2HE LYS 7 -0.157 -13.927 14.042 66 2HE LYS 7 1HE LYS 7 -1.308 -14.687 12.942 67 1HZ LYS 7 1HZ LYS 7 0.432 -15.939 11.965 68 2HZ LYS 7 2HZ LYS 7 0.524 -16.168 13.657 69 3HZ LYS 7 3HZ LYS 7 1.620 -15.143 12.861 70 H LEU 8 H LEU 8 -2.266 -9.741 13.051 71 HA LEU 8 HA LEU 8 -3.709 -10.026 15.438 72 1HB LEU 8 2HB LEU 8 -1.338 -9.186 15.112 73 2HB LEU 8 1HB LEU 8 -2.008 -7.687 14.528 74 HG LEU 8 HG LEU 8 -1.131 -7.608 16.861 75 1HD1 LEU 8 1HD1 LEU 8 -4.070 -7.030 16.635 76 2HD1 LEU 8 2HD1 LEU 8 -2.748 -5.950 16.194 77 3HD1 LEU 8 3HD1 LEU 8 -2.989 -6.407 17.882 78 1HD2 LEU 8 1HD2 LEU 8 -1.730 -9.831 17.590 79 2HD2 LEU 8 2HD2 LEU 8 -3.444 -9.436 17.469 80 3HD2 LEU 8 3HD2 LEU 8 -2.435 -8.626 18.669 81 H ILE 9 H ILE 9 -3.929 -7.673 12.770 82 HA ILE 9 HA ILE 9 -5.926 -6.116 14.012 83 HB ILE 9 HB ILE 9 -4.947 -6.241 11.156 84 1HG1 ILE 9 2HG1 ILE 9 -4.464 -3.843 11.542 85 2HG1 ILE 9 1HG1 ILE 9 -5.163 -3.968 13.143 86 1HG2 ILE 9 1HG2 ILE 9 -7.358 -4.644 12.028 87 2HG2 ILE 9 2HG2 ILE 9 -7.365 -6.002 10.916 88 3HG2 ILE 9 3HG2 ILE 9 -6.546 -4.503 10.467 89 1HD1 ILE 9 1HD1 ILE 9 -3.375 -5.500 13.782 90 2HD1 ILE 9 2HD1 ILE 9 -2.756 -3.944 13.229 91 3HD1 ILE 9 3HD1 ILE 9 -2.682 -5.351 12.167 92 H ARG 10 H ARG 10 -6.076 -8.877 11.934 93 HA ARG 10 HA ARG 10 -8.852 -8.999 11.601 94 1HB ARG 10 2HB ARG 10 -6.761 -11.131 11.725 95 2HB ARG 10 1HB ARG 10 -8.459 -11.544 11.575 96 1HG ARG 10 2HG ARG 10 -8.600 -10.302 9.501 97 2HG ARG 10 1HG ARG 10 -6.908 -9.815 9.667 98 1HD ARG 10 2HD ARG 10 -7.292 -11.751 8.141 99 2HD ARG 10 1HD ARG 10 -6.158 -12.056 9.457 100 HE ARG 10 HE ARG 10 -8.622 -12.851 10.383 101 1HH1 ARG 10 1HH1 ARG 10 -6.814 -13.745 7.505 102 2HH1 ARG 10 2HH1 ARG 10 -7.014 -15.407 7.666 103 1HH2 ARG 10 1HH2 ARG 10 -8.964 -15.032 10.666 104 2HH2 ARG 10 2HH2 ARG 10 -8.387 -16.210 9.566 105 H GLU 11 H GLU 11 -6.826 -9.985 14.343 106 HA GLU 11 HA GLU 11 -8.962 -11.099 15.814 107 1HB GLU 11 2HB GLU 11 -6.304 -10.068 16.801 108 2HB GLU 11 1HB GLU 11 -7.438 -11.035 17.736 109 1HG GLU 11 2HG GLU 11 -7.204 -12.754 15.859 110 2HG GLU 11 1HG GLU 11 -5.783 -11.828 15.384 111 H LYS 12 H LYS 12 -7.591 -7.901 15.615 112 HA LYS 12 HA LYS 12 -8.988 -6.662 17.665 113 1HB LYS 12 2HB LYS 12 -8.169 -5.458 15.000 114 2HB LYS 12 1HB LYS 12 -8.650 -4.527 16.416 115 1HG LYS 12 2HG LYS 12 -6.765 -5.396 17.675 116 2HG LYS 12 1HG LYS 12 -6.308 -6.422 16.324 117 1HD LYS 12 2HD LYS 12 -4.856 -4.477 16.424 118 2HD LYS 12 1HD LYS 12 -5.852 -4.399 14.975 119 1HE LYS 12 2HE LYS 12 -7.283 -2.763 15.972 120 2HE LYS 12 1HE LYS 12 -6.514 -2.975 17.543 121 1HZ LYS 12 1HZ LYS 12 -4.500 -2.007 16.696 122 2HZ LYS 12 2HZ LYS 12 -5.781 -0.963 16.344 123 3HZ LYS 12 3HZ LYS 12 -5.095 -1.908 15.132 124 H LYS 13 H LYS 13 -10.160 -7.515 14.486 125 HA LYS 13 HA LYS 13 -12.862 -6.846 15.411 126 1HB LYS 13 2HB LYS 13 -11.832 -7.305 12.567 127 2HB LYS 13 1HB LYS 13 -13.528 -7.052 12.970 128 1HG LYS 13 2HG LYS 13 -11.295 -5.060 13.388 129 2HG LYS 13 1HG LYS 13 -12.530 -4.991 12.126 130 1HD LYS 13 2HD LYS 13 -14.271 -4.707 13.770 131 2HD LYS 13 1HD LYS 13 -13.130 -4.981 15.084 132 1HE LYS 13 2HE LYS 13 -13.593 -2.627 14.924 133 2HE LYS 13 1HE LYS 13 -11.934 -2.924 14.425 134 1HZ LYS 13 1HZ LYS 13 -12.974 -1.351 13.001 135 2HZ LYS 13 2HZ LYS 13 -14.251 -2.373 12.632 136 3HZ LYS 13 3HZ LYS 13 -12.690 -2.730 12.080 137 H LYS 14 H LYS 14 -14.349 -9.285 13.883 138 HA LYS 14 HA LYS 14 -12.337 -11.181 14.228 139 1HB LYS 14 2HB LYS 14 -14.126 -12.649 15.285 140 2HB LYS 14 1HB LYS 14 -13.426 -11.406 16.305 141 1HG LYS 14 2HG LYS 14 -15.399 -10.041 16.061 142 2HG LYS 14 1HG LYS 14 -16.081 -11.181 14.898 143 1HD LYS 14 2HD LYS 14 -16.206 -12.894 16.585 144 2HD LYS 14 1HD LYS 14 -15.374 -11.859 17.744 145 1HE LYS 14 2HE LYS 14 -18.040 -11.237 16.492 146 2HE LYS 14 1HE LYS 14 -17.831 -11.976 18.078 147 1HZ LYS 14 1HZ LYS 14 -16.939 -9.245 17.265 148 2HZ LYS 14 2HZ LYS 14 -16.521 -9.986 18.698 149 3HZ LYS 14 3HZ LYS 14 -18.155 -9.654 18.380 150 H ILE 15 H ILE 15 -12.164 -11.199 12.056 151 HA ILE 15 HA ILE 15 -14.341 -12.655 10.745 152 HB ILE 15 HB ILE 15 -12.525 -10.609 9.394 153 1HG1 ILE 15 2HG1 ILE 15 -15.476 -10.380 10.051 154 2HG1 ILE 15 1HG1 ILE 15 -14.187 -9.530 10.892 155 1HG2 ILE 15 1HG2 ILE 15 -13.226 -12.429 7.927 156 2HG2 ILE 15 2HG2 ILE 15 -14.012 -10.920 7.467 157 3HG2 ILE 15 3HG2 ILE 15 -14.910 -12.145 8.362 158 1HD1 ILE 15 1HD1 ILE 15 -14.920 -9.203 7.991 159 2HD1 ILE 15 2HD1 ILE 15 -13.631 -8.345 8.842 160 3HD1 ILE 15 3HD1 ILE 15 -15.312 -8.088 9.302 161 H SER 16 H SER 16 -13.651 -14.476 9.672 162 HA SER 16 HA SER 16 -10.858 -15.137 10.130 163 1HB SER 16 2HB SER 16 -13.164 -16.953 9.399 164 2HB SER 16 1HB SER 16 -11.553 -17.451 9.931 165 HG SER 16 HG SER 16 -13.385 -15.893 11.412 166 H GLN 17 H GLN 17 -10.263 -16.957 8.284 167 HA GLN 17 HA GLN 17 -9.621 -15.263 6.118 168 1HB GLN 17 2HB GLN 17 -8.569 -17.279 5.076 169 2HB GLN 17 1HB GLN 17 -7.995 -16.879 6.687 170 1HG GLN 17 2HG GLN 17 -9.267 -18.671 7.640 171 2HG GLN 17 1HG GLN 17 -10.044 -18.998 6.091 172 1HE2 GLN 17 1HE2 GLN 17 -7.070 -19.207 7.899 173 2HE2 GLN 17 2HE2 GLN 17 -6.318 -20.379 6.879 174 H SER 18 H SER 18 -12.095 -17.867 6.386 175 HA SER 18 HA SER 18 -12.543 -17.978 3.649 176 1HB SER 18 2HB SER 18 -14.351 -18.704 5.957 177 2HB SER 18 1HB SER 18 -14.480 -19.288 4.295 178 HG SER 18 HG SER 18 -12.649 -19.906 6.298 179 H GLU 19 H GLU 19 -14.130 -16.171 6.272 180 HA GLU 19 HA GLU 19 -16.120 -15.017 4.675 181 1HB GLU 19 2HB GLU 19 -14.915 -13.809 7.173 182 2HB GLU 19 1HB GLU 19 -16.444 -13.365 6.445 183 1HG GLU 19 2HG GLU 19 -17.058 -14.678 8.239 184 2HG GLU 19 1HG GLU 19 -17.126 -15.798 6.884 185 H LEU 20 H LEU 20 -12.905 -13.841 5.567 186 HA LEU 20 HA LEU 20 -13.084 -11.367 4.275 187 1HB LEU 20 2HB LEU 20 -10.705 -13.099 4.878 188 2HB LEU 20 1HB LEU 20 -10.547 -11.548 4.077 189 HG LEU 20 HG LEU 20 -11.717 -11.951 6.833 190 1HD1 LEU 20 1HD1 LEU 20 -9.033 -10.900 5.958 191 2HD1 LEU 20 2HD1 LEU 20 -9.331 -12.438 6.769 192 3HD1 LEU 20 3HD1 LEU 20 -9.646 -10.922 7.611 193 1HD2 LEU 20 1HD2 LEU 20 -11.560 -9.514 6.980 194 2HD2 LEU 20 2HD2 LEU 20 -12.622 -10.000 5.659 195 3HD2 LEU 20 3HD2 LEU 20 -10.984 -9.444 5.314 196 H ALA 21 H ALA 21 -12.157 -14.519 3.044 197 HA ALA 21 HA ALA 21 -11.281 -13.720 0.520 198 1HB ALA 21 1HB ALA 21 -12.694 -16.275 1.263 199 2HB ALA 21 2HB ALA 21 -10.961 -15.977 1.403 200 3HB ALA 21 3HB ALA 21 -11.724 -16.008 -0.186 201 H ALA 22 H ALA 22 -14.576 -14.729 1.554 202 HA ALA 22 HA ALA 22 -15.722 -14.284 -0.972 203 1HB ALA 22 1HB ALA 22 -16.729 -15.716 0.734 204 2HB ALA 22 2HB ALA 22 -17.851 -14.473 0.174 205 3HB ALA 22 3HB ALA 22 -17.044 -14.296 1.733 206 H LEU 23 H LEU 23 -15.448 -12.255 1.910 207 HA LEU 23 HA LEU 23 -17.080 -10.145 1.030 208 1HB LEU 23 2HB LEU 23 -16.379 -10.462 3.364 209 2HB LEU 23 1HB LEU 23 -14.726 -10.083 2.920 210 HG LEU 23 HG LEU 23 -15.403 -7.785 2.384 211 1HD1 LEU 23 1HD1 LEU 23 -17.629 -7.000 2.996 212 2HD1 LEU 23 2HD1 LEU 23 -18.106 -8.651 3.394 213 3HD1 LEU 23 3HD1 LEU 23 -17.709 -8.225 1.729 214 1HD2 LEU 23 1HD2 LEU 23 -14.605 -8.342 4.625 215 2HD2 LEU 23 2HD2 LEU 23 -16.254 -8.720 5.123 216 3HD2 LEU 23 3HD2 LEU 23 -15.824 -7.070 4.679 217 H LEU 24 H LEU 24 -13.661 -10.797 0.583 218 HA LEU 24 HA LEU 24 -13.252 -8.270 -0.789 219 1HB LEU 24 2HB LEU 24 -11.313 -10.529 -0.360 220 2HB LEU 24 1HB LEU 24 -10.926 -8.911 -0.903 221 HG LEU 24 HG LEU 24 -11.917 -9.699 1.830 222 1HD1 LEU 24 1HD1 LEU 24 -9.249 -8.690 0.903 223 2HD1 LEU 24 2HD1 LEU 24 -9.632 -10.325 1.442 224 3HD1 LEU 24 3HD1 LEU 24 -9.717 -8.976 2.578 225 1HD2 LEU 24 1HD2 LEU 24 -11.550 -7.358 2.459 226 2HD2 LEU 24 2HD2 LEU 24 -12.795 -7.509 1.218 227 3HD2 LEU 24 3HD2 LEU 24 -11.173 -6.968 0.782 228 H GLU 25 H GLU 25 -14.551 -11.161 -1.673 229 HA GLU 25 HA GLU 25 -14.952 -12.286 -3.576 230 1HB GLU 25 2HB GLU 25 -14.001 -9.731 -4.885 231 2HB GLU 25 1HB GLU 25 -14.923 -11.001 -5.677 232 1HG GLU 25 2HG GLU 25 -16.827 -10.564 -4.309 233 2HG GLU 25 1HG GLU 25 -15.908 -9.441 -3.305 234 H VAL 26 H VAL 26 -12.494 -12.833 -2.397 235 HA VAL 26 HA VAL 26 -10.791 -13.353 -4.711 236 HB VAL 26 HB VAL 26 -8.793 -13.134 -3.270 237 1HG1 VAL 26 1HG1 VAL 26 -8.732 -10.693 -3.076 238 2HG1 VAL 26 2HG1 VAL 26 -10.479 -10.641 -3.303 239 3HG1 VAL 26 3HG1 VAL 26 -9.438 -11.221 -4.604 240 1HG2 VAL 26 1HG2 VAL 26 -8.940 -12.064 -1.056 241 2HG2 VAL 26 2HG2 VAL 26 -9.813 -13.597 -1.093 242 3HG2 VAL 26 3HG2 VAL 26 -10.701 -12.073 -1.177 243 H SER 27 H SER 27 -9.122 -15.086 -3.928 244 HA SER 27 HA SER 27 -10.679 -17.326 -2.980 245 1HB SER 27 2HB SER 27 -7.812 -17.187 -3.918 246 2HB SER 27 1HB SER 27 -8.802 -18.639 -3.740 247 HG SER 27 HG SER 27 -10.277 -17.403 -5.242 248 H ARG 28 H ARG 28 -10.034 -18.624 -1.215 249 HA ARG 28 HA ARG 28 -9.052 -17.251 1.028 250 1HB ARG 28 2HB ARG 28 -9.424 -20.210 0.582 251 2HB ARG 28 1HB ARG 28 -8.967 -19.505 2.130 252 1HG ARG 28 2HG ARG 28 -11.021 -18.178 2.124 253 2HG ARG 28 1HG ARG 28 -11.483 -18.928 0.598 254 1HD ARG 28 2HD ARG 28 -11.022 -20.379 3.194 255 2HD ARG 28 1HD ARG 28 -12.594 -19.934 2.539 256 HE ARG 28 HE ARG 28 -10.736 -21.898 1.423 257 1HH1 ARG 28 1HH1 ARG 28 -14.010 -20.446 1.528 258 2HH1 ARG 28 2HH1 ARG 28 -14.753 -21.726 0.723 259 1HH2 ARG 28 1HH2 ARG 28 -11.817 -23.661 0.265 260 2HH2 ARG 28 2HH2 ARG 28 -13.498 -23.571 -0.008 261 H GLN 29 H GLN 29 -7.443 -19.193 -1.379 262 HA GLN 29 HA GLN 29 -4.979 -19.548 -0.122 263 1HB GLN 29 2HB GLN 29 -5.823 -20.581 -2.286 264 2HB GLN 29 1HB GLN 29 -5.472 -19.060 -3.075 265 1HG GLN 29 2HG GLN 29 -3.364 -20.668 -1.655 266 2HG GLN 29 1HG GLN 29 -3.801 -20.957 -3.329 267 1HE2 GLN 29 1HE2 GLN 29 -1.315 -20.128 -2.087 268 2HE2 GLN 29 2HE2 GLN 29 -0.828 -18.656 -2.865 269 H THR 30 H THR 30 -6.377 -16.803 -1.808 270 HA THR 30 HA THR 30 -4.063 -15.244 -2.109 271 HB THR 30 HB THR 30 -6.912 -14.299 -1.824 272 HG1 THR 30 1HG THR 30 -5.732 -15.263 -4.249 273 1HG2 THR 30 1HG2 THR 30 -6.212 -12.635 -3.508 274 2HG2 THR 30 2HG2 THR 30 -4.589 -13.328 -3.510 275 3HG2 THR 30 3HG2 THR 30 -5.208 -12.545 -2.061 276 H ILE 31 H ILE 31 -6.801 -15.090 0.248 277 HA ILE 31 HA ILE 31 -5.580 -13.090 1.799 278 HB ILE 31 HB ILE 31 -7.987 -13.297 1.880 279 1HG1 ILE 31 2HG1 ILE 31 -8.437 -13.346 4.326 280 2HG1 ILE 31 1HG1 ILE 31 -6.819 -13.983 4.588 281 1HG2 ILE 31 1HG2 ILE 31 -7.629 -16.006 3.112 282 2HG2 ILE 31 2HG2 ILE 31 -8.259 -15.649 1.506 283 3HG2 ILE 31 3HG2 ILE 31 -9.162 -15.152 2.937 284 1HD1 ILE 31 1HD1 ILE 31 -5.869 -11.938 3.660 285 2HD1 ILE 31 2HD1 ILE 31 -6.919 -11.603 5.039 286 3HD1 ILE 31 3HD1 ILE 31 -7.493 -11.302 3.397 287 H ASN 32 H ASN 32 -5.626 -16.577 2.182 288 HA ASN 32 HA ASN 32 -4.272 -16.614 4.649 289 1HB ASN 32 2HB ASN 32 -5.498 -18.573 3.654 290 2HB ASN 32 1HB ASN 32 -4.146 -18.786 2.546 291 1HD2 ASN 32 1HD2 ASN 32 -5.134 -18.828 5.872 292 2HD2 ASN 32 2HD2 ASN 32 -3.872 -19.824 6.469 293 H GLY 33 H GLY 33 -3.148 -16.540 1.358 294 1HA GLY 33 2HA GLY 33 -0.396 -16.854 1.834 295 2HA GLY 33 1HA GLY 33 -1.102 -16.003 0.465 296 H ILE 34 H ILE 34 -2.519 -14.022 2.057 297 HA ILE 34 HA ILE 34 -0.456 -12.158 2.529 298 HB ILE 34 HB ILE 34 -3.412 -12.057 3.242 299 1HG1 ILE 34 2HG1 ILE 34 -3.073 -12.232 0.838 300 2HG1 ILE 34 1HG1 ILE 34 -3.637 -10.621 1.248 301 1HG2 ILE 34 1HG2 ILE 34 -2.193 -10.492 4.631 302 2HG2 ILE 34 2HG2 ILE 34 -3.153 -9.629 3.428 303 3HG2 ILE 34 3HG2 ILE 34 -1.411 -9.804 3.207 304 1HD1 ILE 34 1HD1 ILE 34 -1.907 -10.549 -0.460 305 2HD1 ILE 34 2HD1 ILE 34 -0.793 -11.391 0.616 306 3HD1 ILE 34 3HD1 ILE 34 -1.353 -9.769 1.021 307 H GLU 35 H GLU 35 -2.578 -14.087 4.638 308 HA GLU 35 HA GLU 35 -1.754 -13.254 7.153 309 1HB GLU 35 2HB GLU 35 -2.358 -16.069 6.268 310 2HB GLU 35 1HB GLU 35 -2.237 -15.546 7.934 311 1HG GLU 35 2HG GLU 35 -4.169 -14.109 7.614 312 2HG GLU 35 1HG GLU 35 -4.273 -14.643 5.931 313 H LYS 36 H LYS 36 -0.223 -15.474 4.934 314 HA LYS 36 HA LYS 36 1.885 -16.044 6.857 315 1HB LYS 36 2HB LYS 36 1.276 -17.255 4.160 316 2HB LYS 36 1HB LYS 36 2.593 -17.758 5.212 317 1HG LYS 36 2HG LYS 36 -0.349 -17.914 5.862 318 2HG LYS 36 1HG LYS 36 0.691 -19.266 5.406 319 1HD LYS 36 2HD LYS 36 1.086 -17.522 7.842 320 2HD LYS 36 1HD LYS 36 0.318 -19.110 7.855 321 1HE LYS 36 2HE LYS 36 2.357 -20.159 7.125 322 2HE LYS 36 1HE LYS 36 3.124 -18.591 6.887 323 1HZ LYS 36 1HZ LYS 36 3.038 -18.190 9.210 324 2HZ LYS 36 2HZ LYS 36 3.806 -19.673 8.958 325 3HZ LYS 36 3HZ LYS 36 2.211 -19.620 9.525 326 H ASN 37 H ASN 37 1.336 -13.611 4.962 327 HA ASN 37 HA ASN 37 2.443 -12.070 3.731 328 1HB ASN 37 2HB ASN 37 4.554 -11.241 4.631 329 2HB ASN 37 1HB ASN 37 3.496 -11.696 5.953 330 1HD2 ASN 37 1HD2 ASN 37 6.442 -12.383 4.268 331 2HD2 ASN 37 2HD2 ASN 37 7.116 -13.511 5.372 332 H LYS 38 H LYS 38 2.475 -14.621 2.424 333 HA LYS 38 HA LYS 38 5.189 -14.673 1.294 334 1HB LYS 38 2HB LYS 38 4.488 -16.736 2.475 335 2HB LYS 38 1HB LYS 38 3.124 -16.882 1.380 336 1HG LYS 38 2HG LYS 38 4.680 -17.149 -0.506 337 2HG LYS 38 1HG LYS 38 6.037 -17.031 0.615 338 1HD LYS 38 2HD LYS 38 5.550 -19.362 0.090 339 2HD LYS 38 1HD LYS 38 5.229 -19.030 1.793 340 1HE LYS 38 2HE LYS 38 2.839 -18.795 1.283 341 2HE LYS 38 1HE LYS 38 3.176 -19.144 -0.413 342 1HZ LYS 38 1HZ LYS 38 2.359 -21.055 0.812 343 2HZ LYS 38 2HZ LYS 38 3.696 -20.989 1.847 344 3HZ LYS 38 3HZ LYS 38 3.916 -21.345 0.203 345 H TYR 39 H TYR 39 1.820 -14.180 0.698 346 HA TYR 39 HA TYR 39 1.930 -14.644 -2.109 347 1HB TYR 39 2HB TYR 39 -0.065 -14.947 -0.594 348 2HB TYR 39 1HB TYR 39 -0.155 -13.195 -0.482 349 HD1 TYR 39 1HD TYR 39 -0.379 -16.040 -2.721 350 HD2 TYR 39 2HD TYR 39 -1.170 -11.918 -2.219 351 HE1 TYR 39 1HE TYR 39 -1.736 -16.058 -4.790 352 HE2 TYR 39 2HE TYR 39 -2.520 -11.902 -4.269 353 HH TYR 39 HH TYR 39 -3.580 -14.714 -5.746 354 H ASN 40 H ASN 40 3.089 -12.215 -0.175 355 HA ASN 40 HA ASN 40 3.778 -10.083 -0.429 356 1HB ASN 40 2HB ASN 40 4.740 -10.514 -2.611 357 2HB ASN 40 1HB ASN 40 3.154 -10.520 -3.371 358 1HD2 ASN 40 1HD2 ASN 40 5.700 -8.536 -2.078 359 2HD2 ASN 40 2HD2 ASN 40 5.115 -7.032 -2.688 360 HA PRO 41 HA PRO 41 -0.142 -8.231 0.176 361 1HB PRO 41 2HB PRO 41 0.727 -6.126 1.668 362 2HB PRO 41 1HB PRO 41 0.492 -7.747 2.328 363 1HG PRO 41 2HG PRO 41 3.003 -6.344 1.603 364 2HG PRO 41 1HG PRO 41 2.718 -7.572 2.846 365 1HD PRO 41 2HD PRO 41 3.889 -8.002 0.341 366 2HD PRO 41 1HD PRO 41 3.254 -9.252 1.425 367 H SER 42 H SER 42 -0.183 -7.778 -2.090 368 HA SER 42 HA SER 42 0.799 -5.344 -3.157 369 1HB SER 42 2HB SER 42 -1.545 -7.041 -4.060 370 2HB SER 42 1HB SER 42 -0.634 -5.894 -5.053 371 HG SER 42 HG SER 42 1.141 -7.482 -4.003 372 H LEU 43 H LEU 43 -0.590 -3.402 -3.670 373 HA LEU 43 HA LEU 43 -1.701 -2.677 -1.202 374 1HB LEU 43 2HB LEU 43 -0.416 -1.134 -2.696 375 2HB LEU 43 1HB LEU 43 -1.803 -1.054 -3.749 376 HG LEU 43 HG LEU 43 -1.440 0.939 -2.224 377 1HD1 LEU 43 1HD1 LEU 43 -4.098 -0.446 -1.989 378 2HD1 LEU 43 2HD1 LEU 43 -3.580 0.636 -3.283 379 3HD1 LEU 43 3HD1 LEU 43 -3.789 1.257 -1.644 380 1HD2 LEU 43 1HD2 LEU 43 -2.358 -0.981 -0.054 381 2HD2 LEU 43 2HD2 LEU 43 -2.188 0.758 0.140 382 3HD2 LEU 43 3HD2 LEU 43 -0.775 -0.227 -0.162 383 H GLN 44 H GLN 44 -3.425 -3.431 -4.333 384 HA GLN 44 HA GLN 44 -5.922 -2.614 -3.509 385 1HB GLN 44 2HB GLN 44 -5.457 -3.366 -5.790 386 2HB GLN 44 1HB GLN 44 -5.151 -4.998 -5.212 387 1HG GLN 44 2HG GLN 44 -7.515 -5.067 -4.401 388 2HG GLN 44 1HG GLN 44 -7.771 -3.524 -5.210 389 1HE2 GLN 44 1HE2 GLN 44 -7.800 -3.467 -7.434 390 2HE2 GLN 44 2HE2 GLN 44 -8.036 -4.881 -8.389 391 H LEU 45 H LEU 45 -4.356 -5.728 -3.089 392 HA LEU 45 HA LEU 45 -6.502 -6.981 -1.763 393 1HB LEU 45 2HB LEU 45 -3.555 -7.665 -1.689 394 2HB LEU 45 1HB LEU 45 -4.803 -8.656 -0.978 395 HG LEU 45 HG LEU 45 -4.211 -9.685 -2.994 396 1HD1 LEU 45 1HD1 LEU 45 -6.564 -9.713 -2.627 397 2HD1 LEU 45 2HD1 LEU 45 -6.227 -9.626 -4.357 398 3HD1 LEU 45 3HD1 LEU 45 -6.754 -8.185 -3.487 399 1HD2 LEU 45 1HD2 LEU 45 -3.022 -7.864 -4.090 400 2HD2 LEU 45 2HD2 LEU 45 -4.546 -7.034 -4.402 401 3HD2 LEU 45 3HD2 LEU 45 -4.203 -8.573 -5.193 402 H ALA 46 H ALA 46 -3.601 -5.408 -0.523 403 HA ALA 46 HA ALA 46 -4.116 -5.960 2.200 404 1HB ALA 46 1HB ALA 46 -2.379 -4.332 2.676 405 2HB ALA 46 2HB ALA 46 -2.465 -3.730 1.020 406 3HB ALA 46 3HB ALA 46 -1.895 -5.369 1.333 407 H LEU 47 H LEU 47 -4.951 -3.176 0.130 408 HA LEU 47 HA LEU 47 -5.850 -1.624 2.290 409 1HB LEU 47 2HB LEU 47 -4.995 -0.648 0.195 410 2HB LEU 47 1HB LEU 47 -6.359 -1.307 -0.671 411 HG LEU 47 HG LEU 47 -6.391 1.185 -0.156 412 1HD1 LEU 47 1HD1 LEU 47 -8.412 0.052 -0.884 413 2HD1 LEU 47 2HD1 LEU 47 -8.786 1.274 0.332 414 3HD1 LEU 47 3HD1 LEU 47 -8.759 -0.431 0.777 415 1HD2 LEU 47 1HD2 LEU 47 -5.581 1.080 2.132 416 2HD2 LEU 47 2HD2 LEU 47 -7.018 0.180 2.619 417 3HD2 LEU 47 3HD2 LEU 47 -7.168 1.849 2.071 418 H LYS 48 H LYS 48 -7.521 -3.813 0.044 419 HA LYS 48 HA LYS 48 -10.012 -2.887 0.988 420 1HB LYS 48 2HB LYS 48 -11.065 -4.905 -0.027 421 2HB LYS 48 1HB LYS 48 -10.082 -3.969 -1.129 422 1HG LYS 48 2HG LYS 48 -8.293 -5.640 -0.927 423 2HG LYS 48 1HG LYS 48 -9.316 -6.580 0.169 424 1HD LYS 48 2HD LYS 48 -9.461 -7.445 -2.120 425 2HD LYS 48 1HD LYS 48 -11.011 -6.795 -1.586 426 1HE LYS 48 2HE LYS 48 -10.399 -4.649 -2.749 427 2HE LYS 48 1HE LYS 48 -9.007 -5.490 -3.423 428 1HZ LYS 48 1HZ LYS 48 -11.857 -6.220 -3.843 429 2HZ LYS 48 2HZ LYS 48 -10.527 -7.027 -4.546 430 3HZ LYS 48 3HZ LYS 48 -10.871 -5.448 -4.949 431 H ILE 49 H ILE 49 -7.970 -5.432 2.110 432 HA ILE 49 HA ILE 49 -9.664 -6.419 4.147 433 HB ILE 49 HB ILE 49 -6.667 -6.059 4.506 434 1HG1 ILE 49 2HG1 ILE 49 -8.078 -8.405 3.215 435 2HG1 ILE 49 1HG1 ILE 49 -7.220 -7.159 2.319 436 1HG2 ILE 49 1HG2 ILE 49 -6.914 -8.074 5.902 437 2HG2 ILE 49 2HG2 ILE 49 -8.650 -8.071 5.585 438 3HG2 ILE 49 3HG2 ILE 49 -7.915 -6.744 6.484 439 1HD1 ILE 49 1HD1 ILE 49 -6.008 -9.047 4.326 440 2HD1 ILE 49 2HD1 ILE 49 -5.139 -7.796 3.435 441 3HD1 ILE 49 3HD1 ILE 49 -5.864 -9.155 2.570 442 H ALA 50 H ALA 50 -7.470 -3.710 4.029 443 HA ALA 50 HA ALA 50 -7.566 -2.822 6.722 444 1HB ALA 50 1HB ALA 50 -6.638 -0.758 5.850 445 2HB ALA 50 2HB ALA 50 -7.102 -1.257 4.224 446 3HB ALA 50 3HB ALA 50 -5.845 -2.156 5.090 447 H TYR 51 H TYR 51 -9.373 -2.073 3.866 448 HA TYR 51 HA TYR 51 -10.843 0.118 4.820 449 1HB TYR 51 2HB TYR 51 -10.314 -0.283 2.493 450 2HB TYR 51 1HB TYR 51 -11.191 -1.794 2.521 451 HD1 TYR 51 1HD TYR 51 -13.276 -1.850 1.794 452 HD2 TYR 51 2HD TYR 51 -11.695 1.880 2.925 453 HE1 TYR 51 1HE TYR 51 -15.299 -0.721 0.832 454 HE2 TYR 51 2HE TYR 51 -13.660 3.038 2.003 455 HH TYR 51 HH TYR 51 -15.355 2.645 0.323 456 H TYR 52 H TYR 52 -11.690 -3.328 4.362 457 HA TYR 52 HA TYR 52 -14.269 -2.918 5.499 458 1HB TYR 52 2HB TYR 52 -12.847 -5.444 4.692 459 2HB TYR 52 1HB TYR 52 -14.445 -5.462 5.441 460 HD1 TYR 52 1HD TYR 52 -16.351 -4.342 4.289 461 HD2 TYR 52 2HD TYR 52 -12.593 -4.863 2.383 462 HE1 TYR 52 1HE TYR 52 -17.400 -3.903 2.116 463 HE2 TYR 52 2HE TYR 52 -13.625 -4.421 0.205 464 HH TYR 52 HH TYR 52 -16.694 -3.054 -0.087 465 H LEU 53 H LEU 53 -11.282 -3.874 6.798 466 HA LEU 53 HA LEU 53 -12.473 -4.461 9.406 467 1HB LEU 53 2HB LEU 53 -9.559 -4.304 8.621 468 2HB LEU 53 1HB LEU 53 -10.120 -4.708 10.229 469 1HD1 LEU 53 1HD1 LEU 53 -8.840 -6.848 10.108 470 2HD1 LEU 53 2HD1 LEU 53 -8.309 -6.436 8.477 471 3HD1 LEU 53 3HD1 LEU 53 -9.137 -7.964 8.775 472 1HD2 LEU 53 1HD2 LEU 53 -12.466 -6.507 9.314 473 2HD2 LEU 53 2HD2 LEU 53 -11.330 -6.892 10.607 474 3HD2 LEU 53 3HD2 LEU 53 -11.538 -8.005 9.256 475 H ASN 54 H ASN 54 -11.632 -1.781 7.744 476 HA ASN 54 HA ASN 54 -11.176 0.379 8.109 477 1HB ASN 54 2HB ASN 54 -13.533 0.213 8.972 478 2HB ASN 54 1HB ASN 54 -12.886 0.018 10.596 479 1HD2 ASN 54 1HD2 ASN 54 -13.424 2.223 7.974 480 2HD2 ASN 54 2HD2 ASN 54 -13.067 3.674 8.839 481 H THR 55 H THR 55 -8.925 -0.331 8.482 482 HA THR 55 HA THR 55 -7.998 0.677 11.040 483 HB THR 55 HB THR 55 -7.185 -2.032 9.904 484 HG1 THR 55 1HG THR 55 -9.304 -1.574 11.158 485 1HG2 THR 55 1HG2 THR 55 -5.925 -2.295 11.994 486 2HG2 THR 55 2HG2 THR 55 -6.397 -0.665 12.485 487 3HG2 THR 55 3HG2 THR 55 -5.352 -0.898 11.083 488 HA PRO 56 HA PRO 56 -5.105 2.737 8.283 489 1HB PRO 56 2HB PRO 56 -3.274 2.593 10.617 490 2HB PRO 56 1HB PRO 56 -3.791 3.995 9.675 491 1HG PRO 56 2HG PRO 56 -4.757 3.580 12.111 492 2HG PRO 56 1HG PRO 56 -5.800 4.187 10.808 493 1HD PRO 56 2HD PRO 56 -5.600 1.433 11.952 494 2HD PRO 56 1HD PRO 56 -7.037 2.343 11.440 495 H LEU 57 H LEU 57 -3.576 2.120 6.950 496 HA LEU 57 HA LEU 57 -2.677 -0.476 6.655 497 1HB LEU 57 2HB LEU 57 -1.388 2.040 5.627 498 2HB LEU 57 1HB LEU 57 -0.980 0.423 5.094 499 1HD1 LEU 57 1HD1 LEU 57 -1.484 1.030 2.766 500 2HD1 LEU 57 2HD1 LEU 57 -1.891 2.667 3.282 501 3HD1 LEU 57 3HD1 LEU 57 -3.054 1.717 2.359 502 1HD2 LEU 57 1HD2 LEU 57 -2.689 -0.921 3.832 503 2HD2 LEU 57 2HD2 LEU 57 -4.249 -0.181 3.433 504 3HD2 LEU 57 3HD2 LEU 57 -3.855 -0.593 5.110 505 H GLU 58 H GLU 58 -1.012 2.217 8.185 506 HA GLU 58 HA GLU 58 1.479 1.027 8.641 507 1HB GLU 58 2HB GLU 58 0.064 2.954 10.470 508 2HB GLU 58 1HB GLU 58 1.775 2.587 10.488 509 1HG GLU 58 2HG GLU 58 1.971 3.544 8.236 510 2HG GLU 58 1HG GLU 58 0.255 3.959 8.290 511 H ASP 59 H ASP 59 -1.535 0.660 10.430 512 HA ASP 59 HA ASP 59 -0.336 -0.572 12.695 513 1HB ASP 59 2HB ASP 59 -2.471 0.721 12.773 514 2HB ASP 59 1HB ASP 59 -3.228 -0.534 11.804 515 H ILE 60 H ILE 60 -1.902 -1.542 9.797 516 HA ILE 60 HA ILE 60 -2.125 -4.341 10.430 517 HB ILE 60 HB ILE 60 -2.473 -2.958 7.753 518 1HG1 ILE 60 2HG1 ILE 60 -4.479 -3.835 9.839 519 2HG1 ILE 60 1HG1 ILE 60 -4.031 -2.175 9.471 520 1HG2 ILE 60 1HG2 ILE 60 -1.998 -5.347 7.497 521 2HG2 ILE 60 2HG2 ILE 60 -3.679 -4.996 7.097 522 3HG2 ILE 60 3HG2 ILE 60 -3.276 -5.732 8.648 523 1HD1 ILE 60 1HD1 ILE 60 -6.166 -2.757 8.496 524 2HD1 ILE 60 2HD1 ILE 60 -5.416 -4.089 7.616 525 3HD1 ILE 60 3HD1 ILE 60 -4.975 -2.423 7.239 526 H PHE 61 H PHE 61 -0.145 -2.564 8.130 527 HA PHE 61 HA PHE 61 1.808 -4.748 8.395 528 1HB PHE 61 2HB PHE 61 1.241 -3.066 5.920 529 2HB PHE 61 1HB PHE 61 2.641 -4.123 6.101 530 HD1 PHE 61 1HD PHE 61 2.194 -6.593 6.536 531 HD2 PHE 61 2HD PHE 61 -0.775 -3.884 5.141 532 HE1 PHE 61 1HE PHE 61 0.865 -8.487 5.705 533 HE2 PHE 61 2HE PHE 61 -2.111 -5.775 4.308 534 HZ PHE 61 HZ PHE 61 -1.292 -8.076 4.593 535 H GLN 62 H GLN 62 3.875 -4.227 8.794 536 HA GLN 62 HA GLN 62 4.374 -1.365 9.136 537 1HB GLN 62 2HB GLN 62 4.214 -2.681 11.295 538 2HB GLN 62 1HB GLN 62 5.645 -3.563 10.773 539 1HG GLN 62 2HG GLN 62 6.891 -1.445 10.664 540 2HG GLN 62 1HG GLN 62 5.464 -0.597 11.252 541 1HE2 GLN 62 1HE2 GLN 62 8.055 -0.694 12.439 542 2HE2 GLN 62 2HE2 GLN 62 7.847 -1.395 14.005 543 H TRP 63 H TRP 63 6.075 -0.607 8.167 544 HA TRP 63 HA TRP 63 7.756 -2.535 6.810 545 1HB TRP 63 2HB TRP 63 8.222 -0.578 5.225 546 2HB TRP 63 1HB TRP 63 6.671 -1.395 5.109 547 HD1 TRP 63 HD TRP 63 8.222 1.985 5.984 548 HE1 TRP 63 1HE TRP 63 6.330 3.745 6.134 549 HE3 TRP 63 3HE TRP 63 4.177 -1.138 5.740 550 HZ2 TRP 63 2HZ TRP 63 3.501 3.784 6.143 551 HZ3 TRP 63 3HZ TRP 63 1.922 -0.169 5.811 552 HH2 TRP 63 HH TRP 63 1.581 2.223 5.998 553 H GLN 64 H GLN 64 9.750 -2.670 7.325 554 HA GLN 64 HA GLN 64 11.038 -0.373 8.570 555 1HB GLN 64 2HB GLN 64 11.341 -3.302 9.256 556 2HB GLN 64 1HB GLN 64 12.463 -2.062 9.786 557 1HG GLN 64 2HG GLN 64 9.532 -2.099 10.440 558 2HG GLN 64 1HG GLN 64 10.787 -2.745 11.490 559 1HE2 GLN 64 1HE2 GLN 64 10.423 -1.324 13.147 560 2HE2 GLN 64 2HE2 GLN 64 10.748 0.372 13.038 561 HA PRO 65 HA PRO 65 13.449 -1.378 4.818 562 1HB PRO 65 2HB PRO 65 14.084 1.502 5.002 563 2HB PRO 65 1HB PRO 65 13.403 0.599 3.642 564 1HG PRO 65 2HG PRO 65 11.906 2.329 5.030 565 2HG PRO 65 1HG PRO 65 11.229 0.808 4.420 566 1HD PRO 65 2HD PRO 65 12.196 1.469 7.185 567 2HD PRO 65 1HD PRO 65 10.699 0.646 6.689 568 H GLU 66 H GLU 66 14.010 0.291 7.732 569 HA GLU 66 HA GLU 66 16.911 0.093 7.649 570 1HB GLU 66 2HB GLU 66 15.065 1.103 9.829 571 2HB GLU 66 1HB GLU 66 16.798 1.341 9.728 572 1HG GLU 66 2HG GLU 66 14.865 2.451 7.712 573 2HG GLU 66 1HG GLU 66 15.349 3.312 9.167 574 1H MET 67 1HT MET 67 -9.854 1.241 -8.700 575 2H MET 67 2HT MET 67 -11.487 1.403 -9.144 576 3H MET 67 3HT MET 67 -10.982 1.809 -7.586 577 HA MET 67 HA MET 67 -9.987 3.147 -9.983 578 1HB MET 67 2HB MET 67 -12.162 3.986 -8.057 579 2HB MET 67 1HB MET 67 -11.351 5.106 -9.145 580 1HG MET 67 2HG MET 67 -12.936 2.689 -9.969 581 2HG MET 67 1HG MET 67 -13.485 4.365 -10.041 582 1HE MET 67 1HE MET 67 -14.098 3.872 -12.619 583 2HE MET 67 2HE MET 67 -13.432 2.245 -12.500 584 3HE MET 67 3HE MET 67 -12.921 3.313 -13.805 585 H ILE 68 H ILE 68 -8.074 3.688 -9.562 586 HA ILE 68 HA ILE 68 -7.387 4.609 -6.852 587 HB ILE 68 HB ILE 68 -5.544 3.512 -9.008 588 1HG1 ILE 68 2HG1 ILE 68 -6.869 1.727 -7.978 589 2HG1 ILE 68 1HG1 ILE 68 -5.188 1.600 -7.484 590 1HG2 ILE 68 1HG2 ILE 68 -4.403 5.207 -7.697 591 2HG2 ILE 68 2HG2 ILE 68 -3.757 3.609 -7.324 592 3HG2 ILE 68 3HG2 ILE 68 -4.869 4.394 -6.203 593 1HD1 ILE 68 1HD1 ILE 68 -6.682 1.148 -5.625 594 2HD1 ILE 68 2HD1 ILE 68 -7.441 2.728 -5.832 595 3HD1 ILE 68 3HD1 ILE 68 -5.757 2.621 -5.328 596 H ILE 69 H ILE 69 -6.775 6.688 -6.634 597 HA ILE 69 HA ILE 69 -6.322 8.263 -9.057 598 HB ILE 69 HB ILE 69 -7.635 9.120 -6.431 599 1HG1 ILE 69 2HG1 ILE 69 -9.559 9.864 -7.959 600 2HG1 ILE 69 1HG1 ILE 69 -8.801 8.902 -9.217 601 1HG2 ILE 69 1HG2 ILE 69 -6.201 10.882 -7.184 602 2HG2 ILE 69 2HG2 ILE 69 -7.886 11.360 -7.402 603 3HG2 ILE 69 3HG2 ILE 69 -6.928 10.845 -8.791 604 1HD1 ILE 69 1HD1 ILE 69 -9.105 6.896 -7.840 605 2HD1 ILE 69 2HD1 ILE 69 -10.636 7.710 -8.166 606 3HD1 ILE 69 3HD1 ILE 69 -9.864 7.882 -6.589 607 H ASN 70 H ASN 70 -4.298 9.291 -8.981 608 HA ASN 70 HA ASN 70 -2.925 8.913 -6.443 609 1HB ASN 70 2HB ASN 70 -2.012 7.517 -8.249 610 2HB ASN 70 1HB ASN 70 -1.744 8.954 -9.225 611 1HD2 ASN 70 1HD2 ASN 70 0.455 8.388 -9.304 612 2HD2 ASN 70 2HD2 ASN 70 1.497 8.691 -7.965 613 H ASN 71 H ASN 71 -1.798 10.521 -5.576 614 HA ASN 71 HA ASN 71 -2.140 13.186 -6.797 615 1HB ASN 71 2HB ASN 71 -2.161 12.527 -3.841 616 2HB ASN 71 1HB ASN 71 -2.475 14.091 -4.579 617 1HD2 ASN 71 1HD2 ASN 71 -3.711 10.991 -3.808 618 2HD2 ASN 71 2HD2 ASN 71 -5.373 11.319 -4.193 619 H LEU 72 H LEU 72 0.072 11.115 -6.705 620 HA LEU 72 HA LEU 72 2.139 11.650 -4.955 621 1HB LEU 72 2HB LEU 72 1.921 9.883 -6.835 622 2HB LEU 72 1HB LEU 72 2.606 11.098 -7.883 623 HG LEU 72 HG LEU 72 4.274 9.459 -7.209 624 1HD1 LEU 72 1HD1 LEU 72 4.843 12.117 -5.933 625 2HD1 LEU 72 2HD1 LEU 72 5.132 11.674 -7.614 626 3HD1 LEU 72 3HD1 LEU 72 6.040 10.882 -6.324 627 1HD2 LEU 72 1HD2 LEU 72 5.001 9.252 -4.895 628 2HD2 LEU 72 2HD2 LEU 72 3.319 8.771 -5.118 629 3HD2 LEU 72 3HD2 LEU 72 3.701 10.335 -4.399 630 H LYS 73 H LYS 73 1.583 13.172 -8.129 631 HA LYS 73 HA LYS 73 3.756 14.924 -7.704 632 1HB LYS 73 2HB LYS 73 3.172 16.040 -9.809 633 2HB LYS 73 1HB LYS 73 3.330 14.305 -9.966 634 1HG LYS 73 2HG LYS 73 0.703 14.462 -9.631 635 2HG LYS 73 1HG LYS 73 0.996 16.057 -10.317 636 1HD LYS 73 2HD LYS 73 1.835 13.422 -11.548 637 2HD LYS 73 1HD LYS 73 0.444 14.378 -12.028 638 1HE LYS 73 2HE LYS 73 2.206 14.717 -13.635 639 2HE LYS 73 1HE LYS 73 2.010 16.198 -12.716 640 1HZ LYS 73 1HZ LYS 73 4.355 15.355 -13.207 641 2HZ LYS 73 2HZ LYS 73 4.125 14.247 -11.932 642 3HZ LYS 73 3HZ LYS 73 4.027 15.899 -11.667 643 H LEU 74 H LEU 74 0.260 15.384 -7.283 644 HA LEU 74 HA LEU 74 0.280 18.024 -6.541 645 1HB LEU 74 2HB LEU 74 -1.719 16.627 -6.769 646 2HB LEU 74 1HB LEU 74 -1.252 15.713 -5.352 647 HG LEU 74 HG LEU 74 -1.578 17.708 -3.955 648 1HD1 LEU 74 1HD1 LEU 74 -1.072 19.408 -5.631 649 2HD1 LEU 74 2HD1 LEU 74 -2.647 19.684 -4.888 650 3HD1 LEU 74 3HD1 LEU 74 -2.545 18.987 -6.507 651 1HD2 LEU 74 1HD2 LEU 74 -3.900 17.022 -5.725 652 2HD2 LEU 74 2HD2 LEU 74 -4.007 17.777 -4.129 653 3HD2 LEU 74 3HD2 LEU 74 -3.391 16.126 -4.292 654 H ILE 75 H ILE 75 0.964 15.155 -4.588 655 HA ILE 75 HA ILE 75 1.665 16.415 -2.197 656 HB ILE 75 HB ILE 75 2.146 13.685 -3.328 657 1HG1 ILE 75 2HG1 ILE 75 1.188 12.941 -1.177 658 2HG1 ILE 75 1HG1 ILE 75 1.173 14.601 -0.612 659 1HG2 ILE 75 1HG2 ILE 75 3.584 12.948 -1.488 660 2HG2 ILE 75 2HG2 ILE 75 3.745 14.626 -0.958 661 3HG2 ILE 75 3HG2 ILE 75 4.378 14.135 -2.526 662 1HD1 ILE 75 1HD1 ILE 75 -1.029 13.867 -1.284 663 2HD1 ILE 75 2HD1 ILE 75 -0.430 13.485 -2.898 664 3HD1 ILE 75 3HD1 ILE 75 -0.459 15.157 -2.342 665 H ARG 76 H ARG 76 3.516 15.817 -5.051 666 HA ARG 76 HA ARG 76 6.031 16.583 -4.047 667 1HB ARG 76 2HB ARG 76 5.032 16.859 -6.882 668 2HB ARG 76 1HB ARG 76 6.698 17.058 -6.380 669 1HG ARG 76 2HG ARG 76 5.088 14.520 -6.188 670 2HG ARG 76 1HG ARG 76 6.299 14.886 -7.411 671 1HD ARG 76 2HD ARG 76 7.292 13.471 -5.805 672 2HD ARG 76 1HD ARG 76 7.984 15.075 -5.564 673 HE ARG 76 HE ARG 76 5.881 13.884 -3.883 674 1HH1 ARG 76 1HH1 ARG 76 8.668 15.973 -4.253 675 2HH1 ARG 76 2HH1 ARG 76 8.918 16.271 -2.589 676 1HH2 ARG 76 1HH2 ARG 76 6.129 14.341 -1.511 677 2HH2 ARG 76 2HH2 ARG 76 7.396 15.302 -0.977 678 H GLU 77 H GLU 77 3.315 18.557 -5.276 679 HA GLU 77 HA GLU 77 4.719 20.985 -5.140 680 1HB GLU 77 2HB GLU 77 1.763 20.392 -5.074 681 2HB GLU 77 1HB GLU 77 2.455 22.002 -5.200 682 1HG GLU 77 2HG GLU 77 2.678 19.766 -7.188 683 2HG GLU 77 1HG GLU 77 1.789 21.279 -7.365 684 H LYS 78 H LYS 78 2.751 19.196 -2.853 685 HA LYS 78 HA LYS 78 2.603 21.015 -0.770 686 1HB LYS 78 2HB LYS 78 3.115 18.058 -0.387 687 2HB LYS 78 1HB LYS 78 2.346 19.147 0.758 688 1HG LYS 78 2HG LYS 78 1.250 18.240 -1.900 689 2HG LYS 78 1HG LYS 78 0.690 17.756 -0.301 690 1HD LYS 78 2HD LYS 78 0.051 20.098 0.147 691 2HD LYS 78 1HD LYS 78 0.559 20.523 -1.490 692 1HE LYS 78 2HE LYS 78 -1.098 18.988 -2.410 693 2HE LYS 78 1HE LYS 78 -1.592 18.535 -0.781 694 1HZ LYS 78 1HZ LYS 78 -1.924 21.168 -2.109 695 2HZ LYS 78 2HZ LYS 78 -2.094 20.964 -0.466 696 3HZ LYS 78 3HZ LYS 78 -3.148 20.140 -1.523 697 H LYS 79 H LYS 79 5.247 18.900 -1.607 698 HA LYS 79 HA LYS 79 7.013 20.312 0.288 699 1HB LYS 79 2HB LYS 79 7.524 17.820 -1.392 700 2HB LYS 79 1HB LYS 79 8.586 18.463 -0.146 701 1HG LYS 79 2HG LYS 79 5.832 17.323 0.320 702 2HG LYS 79 1HG LYS 79 7.354 16.486 0.619 703 1HD LYS 79 2HD LYS 79 7.953 18.166 2.294 704 2HD LYS 79 1HD LYS 79 6.449 19.032 1.969 705 1HE LYS 79 2HE LYS 79 6.311 17.648 4.007 706 2HE LYS 79 1HE LYS 79 5.153 17.148 2.779 707 1HZ LYS 79 1HZ LYS 79 6.467 15.272 2.247 708 2HZ LYS 79 2HZ LYS 79 6.413 15.294 3.940 709 3HZ LYS 79 3HZ LYS 79 7.788 15.835 3.114 710 H LYS 80 H LYS 80 9.601 20.426 -1.531 711 HA LYS 80 HA LYS 80 8.397 20.735 -4.004 712 1HB LYS 80 2HB LYS 80 9.844 22.797 -4.288 713 2HB LYS 80 1HB LYS 80 8.438 22.996 -3.262 714 1HG LYS 80 2HG LYS 80 9.946 22.710 -1.287 715 2HG LYS 80 1HG LYS 80 11.311 22.731 -2.409 716 1HD LYS 80 2HD LYS 80 10.980 24.944 -1.486 717 2HD LYS 80 1HD LYS 80 10.581 24.950 -3.203 718 1HE LYS 80 2HE LYS 80 8.201 24.791 -2.658 719 2HE LYS 80 1HE LYS 80 8.591 24.753 -0.942 720 1HZ LYS 80 1HZ LYS 80 7.934 26.940 -1.561 721 2HZ LYS 80 2HZ LYS 80 9.079 27.002 -2.817 722 3HZ LYS 80 3HZ LYS 80 9.598 26.984 -1.222 723 H ILE 81 H ILE 81 9.157 18.715 -4.089 724 HA ILE 81 HA ILE 81 11.991 18.461 -4.794 725 HB ILE 81 HB ILE 81 10.336 16.513 -3.130 726 1HG1 ILE 81 2HG1 ILE 81 12.851 18.018 -2.369 727 2HG1 ILE 81 1HG1 ILE 81 11.226 18.396 -1.817 728 1HG2 ILE 81 1HG2 ILE 81 13.139 16.156 -4.158 729 2HG2 ILE 81 2HG2 ILE 81 11.703 15.278 -4.680 730 3HG2 ILE 81 3HG2 ILE 81 12.308 15.077 -3.037 731 1HD1 ILE 81 1HD1 ILE 81 11.118 16.239 -0.673 732 2HD1 ILE 81 2HD1 ILE 81 12.488 17.202 -0.117 733 3HD1 ILE 81 3HD1 ILE 81 12.746 15.861 -1.237 734 H SER 82 H SER 82 12.184 17.170 -6.625 735 HA SER 82 HA SER 82 9.613 16.482 -7.840 736 1HB SER 82 2HB SER 82 12.085 17.526 -9.226 737 2HB SER 82 1HB SER 82 10.580 17.066 -10.025 738 HG SER 82 HG SER 82 9.551 18.661 -8.625 739 H GLN 83 H GLN 83 10.696 15.247 -10.120 740 HA GLN 83 HA GLN 83 10.580 12.618 -9.094 741 1HB GLN 83 2HB GLN 83 10.744 11.889 -11.444 742 2HB GLN 83 1HB GLN 83 9.492 13.086 -11.160 743 1HG GLN 83 2HG GLN 83 10.979 14.825 -12.038 744 2HG GLN 83 1HG GLN 83 12.201 13.595 -12.352 745 1HE2 GLN 83 1HE2 GLN 83 10.150 11.637 -13.238 746 2HE2 GLN 83 2HE2 GLN 83 9.707 12.188 -14.813 747 H SER 84 H SER 84 13.418 14.528 -10.358 748 HA SER 84 HA SER 84 15.003 12.271 -10.692 749 1HB SER 84 2HB SER 84 15.813 15.144 -10.215 750 2HB SER 84 1HB SER 84 16.808 13.876 -10.937 751 HG SER 84 HG SER 84 14.704 15.329 -11.981 752 H GLU 85 H GLU 85 14.610 14.514 -7.945 753 HA GLU 85 HA GLU 85 16.575 13.449 -6.280 754 1HB GLU 85 2HB GLU 85 13.888 14.578 -5.494 755 2HB GLU 85 1HB GLU 85 15.245 14.335 -4.411 756 1HG GLU 85 2HG GLU 85 15.194 16.204 -6.761 757 2HG GLU 85 1HG GLU 85 14.962 16.660 -5.076 758 H LEU 86 H LEU 86 13.162 12.609 -6.652 759 HA LEU 86 HA LEU 86 13.071 10.617 -4.684 760 1HB LEU 86 2HB LEU 86 11.402 10.918 -7.161 761 2HB LEU 86 1HB LEU 86 11.064 9.780 -5.872 762 HG LEU 86 HG LEU 86 11.035 12.782 -5.670 763 1HD1 LEU 86 1HD1 LEU 86 8.664 12.420 -5.195 764 2HD1 LEU 86 2HD1 LEU 86 8.869 10.702 -5.544 765 3HD1 LEU 86 3HD1 LEU 86 9.118 11.900 -6.818 766 1HD2 LEU 86 1HD2 LEU 86 11.883 11.783 -3.611 767 2HD2 LEU 86 2HD2 LEU 86 10.494 10.695 -3.563 768 3HD2 LEU 86 3HD2 LEU 86 10.261 12.433 -3.380 769 H ALA 87 H ALA 87 13.811 10.460 -8.099 770 HA ALA 87 HA ALA 87 13.934 7.693 -8.359 771 1HB ALA 87 1HB ALA 87 15.558 9.779 -9.818 772 2HB ALA 87 2HB ALA 87 13.943 9.221 -10.262 773 3HB ALA 87 3HB ALA 87 15.307 8.107 -10.332 774 H ALA 88 H ALA 88 16.506 10.038 -7.481 775 HA ALA 88 HA ALA 88 18.479 8.082 -7.124 776 1HB ALA 88 1HB ALA 88 18.964 10.446 -7.512 777 2HB ALA 88 2HB ALA 88 19.737 9.865 -6.034 778 3HB ALA 88 3HB ALA 88 18.274 10.845 -5.938 779 H LEU 89 H LEU 89 16.203 9.590 -4.866 780 HA LEU 89 HA LEU 89 17.233 8.479 -2.489 781 1HB LEU 89 2HB LEU 89 14.406 9.315 -3.135 782 2HB LEU 89 1HB LEU 89 14.965 8.892 -1.532 783 HG LEU 89 HG LEU 89 15.957 11.226 -3.168 784 1HD1 LEU 89 1HD1 LEU 89 14.129 11.126 -0.773 785 2HD1 LEU 89 2HD1 LEU 89 13.668 11.540 -2.425 786 3HD1 LEU 89 3HD1 LEU 89 14.761 12.590 -1.527 787 1HD2 LEU 89 1HD2 LEU 89 17.675 10.346 -1.667 788 2HD2 LEU 89 2HD2 LEU 89 16.541 10.414 -0.320 789 3HD2 LEU 89 3HD2 LEU 89 17.080 11.904 -1.097 790 H LEU 90 H LEU 90 14.884 7.216 -4.773 791 HA LEU 90 HA LEU 90 14.389 4.855 -3.114 792 1HB LEU 90 2HB LEU 90 13.282 5.541 -5.828 793 2HB LEU 90 1HB LEU 90 12.691 4.313 -4.731 794 HG LEU 90 HG LEU 90 12.562 7.291 -4.286 795 1HD1 LEU 90 1HD1 LEU 90 10.163 7.004 -4.574 796 2HD1 LEU 90 2HD1 LEU 90 10.416 5.301 -4.958 797 3HD1 LEU 90 3HD1 LEU 90 11.063 6.552 -6.021 798 1HD2 LEU 90 1HD2 LEU 90 11.160 6.737 -2.352 799 2HD2 LEU 90 2HD2 LEU 90 12.791 6.092 -2.179 800 3HD2 LEU 90 3HD2 LEU 90 11.466 5.020 -2.626 801 H GLU 91 H GLU 91 16.704 5.778 -5.191 802 HA GLU 91 HA GLU 91 18.078 4.938 -6.700 803 1HB GLU 91 2HB GLU 91 17.711 2.498 -4.973 804 2HB GLU 91 1HB GLU 91 18.959 2.639 -6.207 805 1HG GLU 91 2HG GLU 91 19.831 4.632 -5.041 806 2HG GLU 91 1HG GLU 91 18.629 4.378 -3.776 807 H VAL 92 H VAL 92 15.938 5.237 -7.959 808 HA VAL 92 HA VAL 92 15.682 2.914 -9.694 809 HB VAL 92 HB VAL 92 13.261 3.437 -10.016 810 1HG1 VAL 92 1HG1 VAL 92 13.964 2.767 -7.170 811 2HG1 VAL 92 2HG1 VAL 92 13.844 1.632 -8.518 812 3HG1 VAL 92 3HG1 VAL 92 12.404 2.473 -7.943 813 1HG2 VAL 92 1HG2 VAL 92 13.595 5.276 -7.639 814 2HG2 VAL 92 2HG2 VAL 92 12.061 4.843 -8.393 815 3HG2 VAL 92 3HG2 VAL 92 13.258 5.770 -9.300 816 H SER 93 H SER 93 14.428 3.820 -11.740 817 HA SER 93 HA SER 93 15.794 6.273 -12.490 818 1HB SER 93 2HB SER 93 14.179 4.314 -14.146 819 2HB SER 93 1HB SER 93 15.191 5.625 -14.765 820 HG SER 93 HG SER 93 16.471 3.899 -13.024 821 H ARG 94 H ARG 94 14.533 7.968 -13.580 822 HA ARG 94 HA ARG 94 12.289 8.755 -12.101 823 1HB ARG 94 2HB ARG 94 13.263 9.791 -14.742 824 2HB ARG 94 1HB ARG 94 12.003 10.550 -13.782 825 1HG ARG 94 2HG ARG 94 13.599 10.849 -11.958 826 2HG ARG 94 1HG ARG 94 14.856 10.126 -12.965 827 1HD ARG 94 2HD ARG 94 13.287 12.604 -13.612 828 2HD ARG 94 1HD ARG 94 14.930 12.566 -12.987 829 HE ARG 94 HE ARG 94 14.287 11.269 -15.538 830 1HH1 ARG 94 1HH1 ARG 94 16.016 13.717 -13.663 831 2HH1 ARG 94 2HH1 ARG 94 17.019 14.243 -14.914 832 1HH2 ARG 94 1HH2 ARG 94 15.637 11.982 -17.344 833 2HH2 ARG 94 2HH2 ARG 94 16.799 13.202 -17.099 834 H GLN 95 H GLN 95 12.506 6.999 -15.055 835 HA GLN 95 HA GLN 95 9.904 7.158 -16.019 836 1HB GLN 95 2HB GLN 95 11.663 6.038 -17.231 837 2HB GLN 95 1HB GLN 95 11.832 4.840 -15.960 838 1HG GLN 95 2HG GLN 95 9.484 4.115 -16.462 839 2HG GLN 95 1HG GLN 95 9.533 5.182 -17.865 840 1HE2 GLN 95 1HE2 GLN 95 9.263 3.389 -19.200 841 2HE2 GLN 95 2HE2 GLN 95 10.574 2.319 -19.557 842 H THR 96 H THR 96 11.219 5.300 -13.307 843 HA THR 96 HA THR 96 8.940 3.644 -12.979 844 HB THR 96 HB THR 96 11.064 4.382 -10.947 845 HG1 THR 96 1HG THR 96 11.207 2.873 -13.261 846 1HG2 THR 96 1HG2 THR 96 10.538 2.191 -9.976 847 2HG2 THR 96 2HG2 THR 96 9.313 1.930 -11.218 848 3HG2 THR 96 3HG2 THR 96 9.099 3.213 -10.028 849 H ILE 97 H ILE 97 10.178 6.522 -11.167 850 HA ILE 97 HA ILE 97 7.902 6.730 -9.582 851 HB ILE 97 HB ILE 97 9.931 7.769 -8.806 852 1HG1 ILE 97 2HG1 ILE 97 9.162 10.064 -8.200 853 2HG1 ILE 97 1HG1 ILE 97 7.838 9.876 -9.344 854 1HG2 ILE 97 1HG2 ILE 97 9.787 9.653 -11.132 855 2HG2 ILE 97 2HG2 ILE 97 10.986 8.387 -10.861 856 3HG2 ILE 97 3HG2 ILE 97 10.908 9.779 -9.779 857 1HD1 ILE 97 1HD1 ILE 97 8.316 8.184 -6.904 858 2HD1 ILE 97 2HD1 ILE 97 6.986 7.998 -8.046 859 3HD1 ILE 97 3HD1 ILE 97 7.109 9.463 -7.070 860 H ASN 98 H ASN 98 8.663 8.411 -12.597 861 HA ASN 98 HA ASN 98 6.375 10.064 -12.706 862 1HB ASN 98 2HB ASN 98 8.323 10.341 -14.216 863 2HB ASN 98 1HB ASN 98 7.900 8.838 -15.022 864 1HD2 ASN 98 1HD2 ASN 98 7.554 9.721 -17.014 865 2HD2 ASN 98 2HD2 ASN 98 6.253 10.787 -17.377 866 H GLY 99 H GLY 99 6.974 6.762 -13.818 867 1HA GLY 99 2HA GLY 99 4.540 6.318 -15.089 868 2HA GLY 99 1HA GLY 99 5.600 5.098 -14.390 869 H ILE 100 H ILE 100 5.506 5.970 -11.667 870 HA ILE 100 HA ILE 100 3.044 4.881 -10.847 871 HB ILE 100 HB ILE 100 5.132 6.386 -9.229 872 1HG1 ILE 100 2HG1 ILE 100 6.091 4.388 -10.230 873 2HG1 ILE 100 1HG1 ILE 100 5.899 4.145 -8.501 874 1HG2 ILE 100 1HG2 ILE 100 4.152 5.309 -7.248 875 2HG2 ILE 100 2HG2 ILE 100 2.874 4.638 -8.261 876 3HG2 ILE 100 3HG2 ILE 100 3.012 6.384 -8.059 877 1HD1 ILE 100 1HD1 ILE 100 5.312 2.148 -9.753 878 2HD1 ILE 100 2HD1 ILE 100 4.096 3.055 -10.655 879 3HD1 ILE 100 3HD1 ILE 100 3.900 2.800 -8.922 880 H GLU 101 H GLU 101 4.357 8.209 -10.861 881 HA GLU 101 HA GLU 101 2.278 9.589 -9.667 882 1HB GLU 101 2HB GLU 101 3.923 10.443 -12.035 883 2HB GLU 101 1HB GLU 101 2.884 11.510 -11.119 884 1HG GLU 101 2HG GLU 101 4.271 11.157 -9.153 885 2HG GLU 101 1HG GLU 101 5.308 10.072 -10.088 886 H LYS 102 H LYS 102 2.533 8.505 -12.986 887 HA LYS 102 HA LYS 102 -0.038 9.711 -13.567 888 1HB LYS 102 2HB LYS 102 2.002 8.442 -15.368 889 2HB LYS 102 1HB LYS 102 0.490 9.171 -15.912 890 1HG LYS 102 2HG LYS 102 1.192 11.308 -14.894 891 2HG LYS 102 1HG LYS 102 2.737 10.566 -14.483 892 1HD LYS 102 2HD LYS 102 3.154 10.132 -16.799 893 2HD LYS 102 1HD LYS 102 1.612 10.862 -17.252 894 1HE LYS 102 2HE LYS 102 2.387 12.985 -16.163 895 2HE LYS 102 1HE LYS 102 3.971 12.239 -15.964 896 1HZ LYS 102 1HZ LYS 102 3.862 13.629 -17.935 897 2HZ LYS 102 2HZ LYS 102 2.592 12.681 -18.543 898 3HZ LYS 102 3HZ LYS 102 4.136 12.008 -18.355 899 H ASN 103 H ASN 103 0.767 7.104 -12.078 900 HA ASN 103 HA ASN 103 0.180 4.941 -11.840 901 1HB ASN 103 2HB ASN 103 -2.292 4.575 -11.658 902 2HB ASN 103 1HB ASN 103 -1.747 6.018 -10.825 903 1HD2 ASN 103 1HD2 ASN 103 -3.572 4.774 -13.509 904 2HD2 ASN 103 2HD2 ASN 103 -4.387 6.248 -13.895 905 H LYS 104 H LYS 104 1.281 5.198 -14.199 906 HA LYS 104 HA LYS 104 -0.388 3.664 -16.084 907 1HB LYS 104 2HB LYS 104 0.278 6.009 -16.686 908 2HB LYS 104 1HB LYS 104 1.946 5.481 -16.672 909 1HG LYS 104 2HG LYS 104 1.448 3.923 -18.498 910 2HG LYS 104 1HG LYS 104 -0.222 4.505 -18.513 911 1HD LYS 104 2HD LYS 104 0.608 6.779 -18.956 912 2HD LYS 104 1HD LYS 104 2.253 6.142 -19.019 913 1HE LYS 104 2HE LYS 104 1.608 4.707 -20.897 914 2HE LYS 104 1HE LYS 104 -0.024 5.375 -20.836 915 1HZ LYS 104 1HZ LYS 104 1.264 6.512 -22.528 916 2HZ LYS 104 2HZ LYS 104 2.465 6.875 -21.391 917 3HZ LYS 104 3HZ LYS 104 0.965 7.582 -21.251 918 H TYR 105 H TYR 105 2.307 3.456 -14.008 919 HA TYR 105 HA TYR 105 3.674 1.484 -15.694 920 1HB TYR 105 2HB TYR 105 4.748 3.550 -14.550 921 2HB TYR 105 1HB TYR 105 4.649 2.604 -13.077 922 HD1 TYR 105 1HD TYR 105 5.926 2.481 -16.542 923 HD2 TYR 105 2HD TYR 105 6.482 1.166 -12.522 924 HE1 TYR 105 1HE TYR 105 8.085 1.503 -17.164 925 HE2 TYR 105 2HE TYR 105 8.636 0.177 -13.151 926 HH TYR 105 HH TYR 105 9.780 -0.633 -15.140 927 H ASN 106 H ASN 106 1.164 1.408 -13.736 928 HA ASN 106 HA ASN 106 0.226 0.195 -12.137 929 1HB ASN 106 2HB ASN 106 0.459 -1.695 -13.625 930 2HB ASN 106 1HB ASN 106 2.146 -1.914 -13.171 931 1HD2 ASN 106 1HD2 ASN 106 2.631 -3.018 -11.359 932 2HD2 ASN 106 2HD2 ASN 106 1.471 -3.837 -10.364 933 HA PRO 107 HA PRO 107 2.994 1.101 -8.816 934 1HB PRO 107 2HB PRO 107 0.740 1.533 -7.104 935 2HB PRO 107 1HB PRO 107 1.773 2.742 -7.870 936 1HG PRO 107 2HG PRO 107 -0.888 2.315 -8.507 937 2HG PRO 107 1HG PRO 107 0.294 3.099 -9.569 938 1HD PRO 107 2HD PRO 107 -0.709 0.281 -9.595 939 2HD PRO 107 1HD PRO 107 -0.323 1.355 -10.958 940 H SER 108 H SER 108 3.836 -0.968 -8.413 941 HA SER 108 HA SER 108 2.398 -2.876 -6.842 942 1HB SER 108 2HB SER 108 5.404 -2.569 -7.188 943 2HB SER 108 1HB SER 108 4.557 -4.015 -6.630 944 HG SER 108 HG SER 108 4.722 -2.857 -9.152 945 H LEU 109 H LEU 109 2.919 -3.333 -4.541 946 HA LEU 109 HA LEU 109 2.628 -0.884 -3.225 947 1HB LEU 109 2HB LEU 109 1.435 -2.933 -2.543 948 2HB LEU 109 1HB LEU 109 2.939 -3.625 -1.996 949 HG LEU 109 HG LEU 109 1.331 -2.720 -0.222 950 1HD1 LEU 109 1HD1 LEU 109 4.161 -1.710 -0.191 951 2HD1 LEU 109 2HD1 LEU 109 3.609 -3.302 0.330 952 3HD1 LEU 109 3HD1 LEU 109 3.102 -1.861 1.211 953 1HD2 LEU 109 1HD2 LEU 109 1.473 -0.290 0.264 954 2HD2 LEU 109 2HD2 LEU 109 0.725 -0.589 -1.293 955 3HD2 LEU 109 3HD2 LEU 109 2.394 -0.057 -1.215 956 H GLN 110 H GLN 110 5.481 -3.134 -3.227 957 HA GLN 110 HA GLN 110 6.974 -1.815 -1.357 958 1HB GLN 110 2HB GLN 110 7.591 -3.931 -2.479 959 2HB GLN 110 1HB GLN 110 7.957 -3.036 -3.943 960 1HG GLN 110 2HG GLN 110 9.991 -3.595 -2.780 961 2HG GLN 110 1HG GLN 110 9.749 -1.850 -2.749 962 1HE2 GLN 110 1HE2 GLN 110 9.720 -4.770 -0.900 963 2HE2 GLN 110 2HE2 GLN 110 9.772 -4.046 0.664 964 H LEU 111 H LEU 111 6.813 -1.114 -4.825 965 HA LEU 111 HA LEU 111 8.629 1.013 -4.867 966 1HB LEU 111 2HB LEU 111 6.268 0.461 -6.673 967 2HB LEU 111 1HB LEU 111 7.360 1.797 -6.935 968 HG LEU 111 HG LEU 111 9.217 0.139 -7.231 969 1HD1 LEU 111 1HD1 LEU 111 8.662 -2.191 -7.713 970 2HD1 LEU 111 2HD1 LEU 111 6.989 -1.892 -7.241 971 3HD1 LEU 111 3HD1 LEU 111 8.278 -1.767 -6.044 972 1HD2 LEU 111 1HD2 LEU 111 8.133 1.148 -9.128 973 2HD2 LEU 111 2HD2 LEU 111 6.874 -0.083 -9.095 974 3HD2 LEU 111 3HD2 LEU 111 8.534 -0.532 -9.483 975 H ALA 112 H ALA 112 5.179 0.997 -4.391 976 HA ALA 112 HA ALA 112 4.864 3.833 -4.276 977 1HB ALA 112 1HB ALA 112 3.018 2.333 -4.866 978 2HB ALA 112 2HB ALA 112 2.606 3.358 -3.491 979 3HB ALA 112 3HB ALA 112 3.040 1.668 -3.233 980 H LEU 113 H LEU 113 5.355 1.300 -1.870 981 HA LEU 113 HA LEU 113 4.710 2.746 0.418 982 1HB LEU 113 2HB LEU 113 4.854 0.262 0.075 983 2HB LEU 113 1HB LEU 113 6.595 0.434 0.140 984 HG LEU 113 HG LEU 113 6.371 1.345 2.432 985 1HD1 LEU 113 1HD1 LEU 113 4.098 2.194 2.218 986 2HD1 LEU 113 2HD1 LEU 113 4.231 1.074 3.573 987 3HD1 LEU 113 3HD1 LEU 113 3.486 0.547 2.063 988 1HD2 LEU 113 1HD2 LEU 113 6.871 -1.018 2.031 989 2HD2 LEU 113 2HD2 LEU 113 5.145 -1.374 1.958 990 3HD2 LEU 113 3HD2 LEU 113 5.867 -0.813 3.466 991 H LYS 114 H LYS 114 7.795 2.130 -1.263 992 HA LYS 114 HA LYS 114 9.243 3.435 0.774 993 1HB LYS 114 2HB LYS 114 11.195 3.461 -0.785 994 2HB LYS 114 1HB LYS 114 10.495 1.879 -0.521 995 1HG LYS 114 2HG LYS 114 9.400 2.000 -2.700 996 2HG LYS 114 1HG LYS 114 10.083 3.608 -2.951 997 1HD LYS 114 2HD LYS 114 11.401 1.875 -4.096 998 2HD LYS 114 1HD LYS 114 12.339 2.695 -2.848 999 1HE LYS 114 2HE LYS 114 11.897 0.815 -1.310 1000 2HE LYS 114 1HE LYS 114 11.001 -0.004 -2.586 1001 1HZ LYS 114 1HZ LYS 114 13.033 -0.087 -3.905 1002 2HZ LYS 114 2HZ LYS 114 13.311 -0.804 -2.389 1003 3HZ LYS 114 3HZ LYS 114 13.886 0.721 -2.700 1004 H ILE 115 H ILE 115 7.851 4.575 -2.163 1005 HA ILE 115 HA ILE 115 8.855 7.218 -2.147 1006 HB ILE 115 HB ILE 115 5.969 6.546 -2.835 1007 1HG1 ILE 115 2HG1 ILE 115 8.352 6.493 -4.700 1008 2HG1 ILE 115 1HG1 ILE 115 7.599 5.056 -4.021 1009 1HG2 ILE 115 1HG2 ILE 115 7.830 8.720 -3.801 1010 2HG2 ILE 115 2HG2 ILE 115 6.491 8.925 -2.674 1011 3HG2 ILE 115 3HG2 ILE 115 6.172 8.470 -4.350 1012 1HD1 ILE 115 1HD1 ILE 115 6.262 7.056 -5.834 1013 2HD1 ILE 115 2HD1 ILE 115 5.515 5.605 -5.164 1014 3HD1 ILE 115 3HD1 ILE 115 6.858 5.461 -6.301 1015 H ALA 116 H ALA 116 6.210 5.744 -0.467 1016 HA ALA 116 HA ALA 116 5.109 8.037 0.804 1017 1HB ALA 116 1HB ALA 116 3.966 6.448 2.233 1018 2HB ALA 116 2HB ALA 116 5.049 5.176 1.664 1019 3HB ALA 116 3HB ALA 116 3.900 5.918 0.541 1020 H TYR 117 H TYR 117 7.490 5.605 1.769 1021 HA TYR 117 HA TYR 117 7.730 6.474 4.421 1022 1HB TYR 117 2HB TYR 117 8.231 4.222 3.968 1023 2HB TYR 117 1HB TYR 117 9.337 4.640 2.667 1024 HD1 TYR 117 1HD TYR 117 11.542 4.975 3.065 1025 HD2 TYR 117 2HD TYR 117 8.913 4.721 6.352 1026 HE1 TYR 117 1HE TYR 117 13.499 4.877 4.594 1027 HE2 TYR 117 2HE TYR 117 10.823 4.624 7.902 1028 HH TYR 117 HH TYR 117 13.992 5.355 6.928 1029 H TYR 118 H TYR 118 9.927 6.968 1.606 1030 HA TYR 118 HA TYR 118 11.769 8.464 3.125 1031 1HB TYR 118 2HB TYR 118 11.393 8.258 0.126 1032 2HB TYR 118 1HB TYR 118 12.698 9.183 0.861 1033 HD1 TYR 118 1HD TYR 118 14.671 8.085 1.648 1034 HD2 TYR 118 2HD TYR 118 11.301 5.772 0.535 1035 HE1 TYR 118 1HE TYR 118 16.020 6.032 1.820 1036 HE2 TYR 118 2HE TYR 118 12.626 3.726 0.704 1037 HH TYR 118 HH TYR 118 15.646 3.620 2.191 1038 H LEU 119 H LEU 119 9.031 9.286 1.541 1039 HA LEU 119 HA LEU 119 9.436 12.207 1.824 1040 1HB LEU 119 2HB LEU 119 7.023 10.750 0.760 1041 2HB LEU 119 1HB LEU 119 7.191 12.494 0.806 1042 1HD1 LEU 119 1HD1 LEU 119 6.690 10.735 -1.671 1043 2HD1 LEU 119 2HD1 LEU 119 7.833 11.566 -2.727 1044 3HD1 LEU 119 3HD1 LEU 119 6.771 12.497 -1.671 1045 1HD2 LEU 119 1HD2 LEU 119 10.129 12.615 -0.029 1046 2HD2 LEU 119 2HD2 LEU 119 8.848 13.631 -0.692 1047 3HD2 LEU 119 3HD2 LEU 119 9.848 12.653 -1.769 1048 H ASN 120 H ASN 120 8.483 9.803 3.750 1049 HA ASN 120 HA ASN 120 7.138 9.403 5.519 1050 1HB ASN 120 2HB ASN 120 8.946 10.891 6.485 1051 2HB ASN 120 1HB ASN 120 7.838 12.251 6.322 1052 1HD2 ASN 120 1HD2 ASN 120 7.665 12.640 8.545 1053 2HD2 ASN 120 2HD2 ASN 120 6.880 11.542 9.617 1054 H THR 121 H THR 121 5.449 9.566 3.758 1055 HA THR 121 HA THR 121 3.404 11.455 4.653 1056 HB THR 121 HB THR 121 3.832 10.586 1.778 1057 HG1 THR 121 1HG THR 121 5.315 12.207 3.212 1058 1HG2 THR 121 1HG2 THR 121 1.574 11.403 2.364 1059 2HG2 THR 121 2HG2 THR 121 2.400 12.523 1.278 1060 3HG2 THR 121 3HG2 THR 121 2.283 12.887 3.001 1061 HA PRO 122 HA PRO 122 1.147 7.611 5.126 1062 1HB PRO 122 2HB PRO 122 -1.370 8.743 5.019 1063 2HB PRO 122 1HB PRO 122 -0.379 8.650 6.478 1064 1HG PRO 122 2HG PRO 122 -0.763 10.934 4.594 1065 2HG PRO 122 1HG PRO 122 -0.649 10.946 6.364 1066 1HD PRO 122 2HD PRO 122 1.406 11.666 4.811 1067 2HD PRO 122 1HD PRO 122 1.656 10.788 6.336 1068 H LEU 123 H LEU 123 0.409 6.204 3.709 1069 HA LEU 123 HA LEU 123 0.374 6.600 0.959 1070 1HB LEU 123 2HB LEU 123 -0.947 4.466 2.622 1071 2HB LEU 123 1HB LEU 123 -1.098 4.479 0.885 1072 1HD1 LEU 123 1HD1 LEU 123 1.862 5.294 0.312 1073 2HD1 LEU 123 2HD1 LEU 123 0.983 4.021 -0.534 1074 3HD1 LEU 123 3HD1 LEU 123 2.507 3.654 0.278 1075 1HD2 LEU 123 1HD2 LEU 123 2.617 3.452 2.696 1076 2HD2 LEU 123 2HD2 LEU 123 1.186 3.699 3.696 1077 3HD2 LEU 123 3HD2 LEU 123 2.004 5.084 2.969 1078 H GLU 124 H GLU 124 -2.303 6.806 3.276 1079 HA GLU 124 HA GLU 124 -4.441 7.060 1.605 1080 1HB GLU 124 2HB GLU 124 -4.097 8.714 4.107 1081 2HB GLU 124 1HB GLU 124 -5.588 8.123 3.404 1082 1HG GLU 124 2HG GLU 124 -5.326 6.732 5.225 1083 2HG GLU 124 1HG GLU 124 -4.595 5.778 3.936 1084 H ASP 125 H ASP 125 -2.073 9.530 2.535 1085 HA ASP 125 HA ASP 125 -3.583 11.704 1.473 1086 1HB ASP 125 2HB ASP 125 -1.801 11.833 3.316 1087 2HB ASP 125 1HB ASP 125 -0.613 11.697 2.023 1088 H ILE 126 H ILE 126 -1.050 9.639 0.427 1089 HA ILE 126 HA ILE 126 -0.411 11.118 -1.968 1090 HB ILE 126 HB ILE 126 0.446 8.301 -1.236 1091 1HG1 ILE 126 2HG1 ILE 126 1.904 10.942 -0.949 1092 2HG1 ILE 126 1HG1 ILE 126 1.225 10.007 0.374 1093 1HG2 ILE 126 1HG2 ILE 126 2.185 8.645 -2.938 1094 2HG2 ILE 126 2HG2 ILE 126 1.480 10.211 -3.339 1095 3HG2 ILE 126 3HG2 ILE 126 0.566 8.730 -3.633 1096 1HD1 ILE 126 1HD1 ILE 126 2.787 8.196 -0.100 1097 2HD1 ILE 126 2HD1 ILE 126 3.634 9.713 0.206 1098 3HD1 ILE 126 3HD1 ILE 126 3.455 9.120 -1.443 1099 H PHE 127 H PHE 127 -1.947 7.975 -1.354 1100 HA PHE 127 HA PHE 127 -2.952 8.044 -4.118 1101 1HB PHE 127 2HB PHE 127 -2.453 5.608 -2.318 1102 2HB PHE 127 1HB PHE 127 -3.174 5.577 -3.920 1103 HD1 PHE 127 1HD PHE 127 -1.783 5.999 -5.883 1104 HD2 PHE 127 2HD PHE 127 -0.144 5.839 -1.962 1105 HE1 PHE 127 1HE PHE 127 0.462 5.686 -6.838 1106 HE2 PHE 127 2HE PHE 127 2.106 5.538 -2.909 1107 HZ PHE 127 HZ PHE 127 2.409 5.460 -5.353 1108 H GLN 128 H GLN 128 -5.067 7.828 -4.459 1109 HA GLN 128 HA GLN 128 -6.776 7.635 -2.100 1110 1HB GLN 128 2HB GLN 128 -6.857 9.788 -3.382 1111 2HB GLN 128 1HB GLN 128 -7.375 8.880 -4.791 1112 1HG GLN 128 2HG GLN 128 -9.436 8.288 -3.731 1113 2HG GLN 128 1HG GLN 128 -8.895 8.975 -2.198 1114 1HE2 GLN 128 1HE2 GLN 128 -10.093 9.698 -5.407 1115 2HE2 GLN 128 2HE2 GLN 128 -10.382 11.361 -5.094 1116 H TRP 129 H TRP 129 -7.985 5.938 -1.997 1117 HA TRP 129 HA TRP 129 -8.021 4.151 -4.300 1118 1HB TRP 129 2HB TRP 129 -8.237 2.388 -2.374 1119 2HB TRP 129 1HB TRP 129 -6.669 3.025 -2.860 1120 HD1 TRP 129 HD TRP 129 -9.346 4.077 -0.192 1121 HE1 TRP 129 1HE TRP 129 -8.088 4.731 1.951 1122 HE3 TRP 129 3HE TRP 129 -4.573 3.296 -1.819 1123 HZ2 TRP 129 2HZ TRP 129 -5.414 4.850 2.836 1124 HZ3 TRP 129 3HZ TRP 129 -2.723 3.690 -0.255 1125 HH2 TRP 129 HH TRP 129 -3.140 4.450 2.018 1126 H GLN 130 H GLN 130 -9.905 3.705 -5.104 1127 HA GLN 130 HA GLN 130 -12.215 3.636 -3.318 1128 1HB GLN 130 2HB GLN 130 -12.137 4.518 -6.216 1129 2HB GLN 130 1HB GLN 130 -13.559 4.451 -5.185 1130 1HG GLN 130 2HG GLN 130 -11.185 6.239 -4.776 1131 2HG GLN 130 1HG GLN 130 -12.703 6.748 -5.493 1132 1HE2 GLN 130 1HE2 GLN 130 -11.411 7.779 -3.166 1133 2HE2 GLN 130 2HE2 GLN 130 -12.467 7.553 -1.830 1134 HA PRO 131 HA PRO 131 -12.109 -0.457 -5.294 1135 1HB PRO 131 2HB PRO 131 -13.824 -1.458 -3.242 1136 2HB PRO 131 1HB PRO 131 -12.072 -1.646 -3.347 1137 1HG PRO 131 2HG PRO 131 -13.424 -0.177 -1.401 1138 2HG PRO 131 1HG PRO 131 -11.705 -0.025 -1.797 1139 1HD PRO 131 2HD PRO 131 -14.012 1.674 -2.648 1140 2HD PRO 131 1HD PRO 131 -12.347 2.146 -2.244 1141 H GLU 132 H GLU 132 -13.969 1.704 -5.670 1142 HA GLU 132 HA GLU 132 -16.447 0.277 -6.410 1143 1HB GLU 132 2HB GLU 132 -16.280 3.128 -5.379 1144 2HB GLU 132 1HB GLU 132 -17.752 2.244 -5.771 1145 1HG GLU 132 2HG GLU 132 -17.371 0.696 -3.957 1146 2HG GLU 132 1HG GLU 132 -15.805 1.420 -3.627 Start of MODEL 13 1 1H MET 1 1HT MET 1 13.583 -4.389 3.948 2 2H MET 1 2HT MET 1 12.434 -3.323 4.572 3 3H MET 1 3HT MET 1 12.052 -4.314 3.247 4 HA MET 1 HA MET 1 12.042 -6.239 4.468 5 1HB MET 1 2HB MET 1 12.772 -4.540 6.878 6 2HB MET 1 1HB MET 1 12.422 -6.262 6.897 7 1HG MET 1 2HG MET 1 14.771 -4.905 5.602 8 2HG MET 1 1HG MET 1 14.794 -5.913 7.045 9 1HE MET 1 1HE MET 1 12.920 -8.344 6.304 10 2HE MET 1 2HE MET 1 14.517 -8.560 7.021 11 3HE MET 1 3HE MET 1 14.063 -9.477 5.584 12 H ILE 2 H ILE 2 10.141 -6.872 5.321 13 HA ILE 2 HA ILE 2 8.175 -4.726 5.869 14 HB ILE 2 HB ILE 2 7.670 -7.229 4.215 15 1HG1 ILE 2 2HG1 ILE 2 8.881 -5.511 2.939 16 2HG1 ILE 2 1HG1 ILE 2 7.242 -5.704 2.331 17 1HG2 ILE 2 1HG2 ILE 2 5.398 -6.365 3.840 18 2HG2 ILE 2 2HG2 ILE 2 5.726 -5.046 4.965 19 3HG2 ILE 2 3HG2 ILE 2 5.709 -6.711 5.545 20 1HD1 ILE 2 1HD1 ILE 2 6.578 -3.662 3.512 21 2HD1 ILE 2 2HD1 ILE 2 7.903 -3.364 2.387 22 3HD1 ILE 2 3HD1 ILE 2 8.225 -3.483 4.118 23 H ILE 3 H ILE 3 6.848 -5.070 7.612 24 HA ILE 3 HA ILE 3 7.109 -7.640 8.963 25 HB ILE 3 HB ILE 3 6.733 -4.888 10.229 26 1HG1 ILE 3 2HG1 ILE 3 9.139 -6.745 10.261 27 2HG1 ILE 3 1HG1 ILE 3 9.026 -5.196 9.447 28 1HG2 ILE 3 1HG2 ILE 3 6.937 -6.065 12.376 29 2HG2 ILE 3 2HG2 ILE 3 7.022 -7.605 11.519 30 3HG2 ILE 3 3HG2 ILE 3 5.549 -6.637 11.449 31 1HD1 ILE 3 1HD1 ILE 3 8.834 -4.075 11.601 32 2HD1 ILE 3 2HD1 ILE 3 10.306 -5.039 11.499 33 3HD1 ILE 3 3HD1 ILE 3 8.921 -5.634 12.419 34 H ASN 4 H ASN 4 5.155 -8.696 8.866 35 HA ASN 4 HA ASN 4 2.853 -7.157 7.989 36 1HB ASN 4 2HB ASN 4 3.769 -9.015 6.615 37 2HB ASN 4 1HB ASN 4 3.564 -10.102 7.974 38 1HD2 ASN 4 1HD2 ASN 4 2.515 -10.268 5.334 39 2HD2 ASN 4 2HD2 ASN 4 0.800 -10.351 5.463 40 H ASN 5 H ASN 5 1.145 -6.900 9.341 41 HA ASN 5 HA ASN 5 0.840 -8.774 11.534 42 1HB ASN 5 2HB ASN 5 0.702 -5.750 11.740 43 2HB ASN 5 1HB ASN 5 -0.041 -6.816 12.922 44 1HD2 ASN 5 1HD2 ASN 5 2.865 -5.360 11.838 45 2HD2 ASN 5 2HD2 ASN 5 3.878 -5.966 13.092 46 H LEU 6 H LEU 6 -0.302 -8.603 8.870 47 HA LEU 6 HA LEU 6 -2.780 -7.407 8.629 48 1HB LEU 6 2HB LEU 6 -1.402 -8.649 6.888 49 2HB LEU 6 1HB LEU 6 -1.956 -10.139 7.592 50 HG LEU 6 HG LEU 6 -3.057 -9.546 5.457 51 1HD1 LEU 6 1HD1 LEU 6 -4.955 -9.648 7.779 52 2HD1 LEU 6 2HD1 LEU 6 -4.235 -11.025 6.948 53 3HD1 LEU 6 3HD1 LEU 6 -5.365 -9.974 6.093 54 1HD2 LEU 6 1HD2 LEU 6 -4.206 -7.259 7.024 55 2HD2 LEU 6 2HD2 LEU 6 -4.716 -7.753 5.410 56 3HD2 LEU 6 3HD2 LEU 6 -3.077 -7.152 5.675 57 H LYS 7 H LYS 7 -1.945 -10.556 9.973 58 HA LYS 7 HA LYS 7 -4.567 -11.315 10.618 59 1HB LYS 7 2HB LYS 7 -3.569 -13.016 12.104 60 2HB LYS 7 1HB LYS 7 -2.873 -13.014 10.492 61 1HG LYS 7 2HG LYS 7 -0.860 -12.082 11.246 62 2HG LYS 7 1HG LYS 7 -1.575 -11.575 12.779 63 1HD LYS 7 2HD LYS 7 -1.142 -14.429 11.900 64 2HD LYS 7 1HD LYS 7 -0.132 -13.545 13.052 65 1HE LYS 7 2HE LYS 7 -2.174 -13.201 14.457 66 2HE LYS 7 1HE LYS 7 -3.047 -14.266 13.359 67 1HZ LYS 7 1HZ LYS 7 -1.509 -16.047 13.942 68 2HZ LYS 7 2HZ LYS 7 -2.267 -15.390 15.331 69 3HZ LYS 7 3HZ LYS 7 -0.673 -14.979 14.960 70 H LEU 8 H LEU 8 -2.164 -9.493 12.503 71 HA LEU 8 HA LEU 8 -3.484 -9.614 14.969 72 1HB LEU 8 2HB LEU 8 -1.080 -8.940 14.531 73 2HB LEU 8 1HB LEU 8 -1.670 -7.416 13.926 74 HG LEU 8 HG LEU 8 -0.699 -7.324 16.220 75 1HD1 LEU 8 1HD1 LEU 8 -3.598 -6.556 16.074 76 2HD1 LEU 8 2HD1 LEU 8 -2.219 -5.574 15.572 77 3HD1 LEU 8 3HD1 LEU 8 -2.443 -5.978 17.274 78 1HD2 LEU 8 1HD2 LEU 8 -1.416 -9.477 17.048 79 2HD2 LEU 8 2HD2 LEU 8 -3.104 -8.973 16.968 80 3HD2 LEU 8 3HD2 LEU 8 -2.005 -8.195 18.107 81 H ILE 9 H ILE 9 -3.742 -7.358 12.268 82 HA ILE 9 HA ILE 9 -5.608 -5.650 13.523 83 HB ILE 9 HB ILE 9 -4.970 -6.054 10.574 84 1HG1 ILE 9 2HG1 ILE 9 -4.217 -3.695 10.703 85 2HG1 ILE 9 1HG1 ILE 9 -4.669 -3.649 12.396 86 1HG2 ILE 9 1HG2 ILE 9 -7.043 -4.143 11.655 87 2HG2 ILE 9 2HG2 ILE 9 -7.364 -5.565 10.674 88 3HG2 ILE 9 3HG2 ILE 9 -6.471 -4.206 9.986 89 1HD1 ILE 9 1HD1 ILE 9 -2.939 -5.300 12.885 90 2HD1 ILE 9 2HD1 ILE 9 -2.279 -3.857 12.119 91 3HD1 ILE 9 3HD1 ILE 9 -2.500 -5.336 11.178 92 H ARG 10 H ARG 10 -5.971 -8.550 11.762 93 HA ARG 10 HA ARG 10 -8.816 -8.597 11.747 94 1HB ARG 10 2HB ARG 10 -6.752 -10.728 11.414 95 2HB ARG 10 1HB ARG 10 -8.467 -11.115 11.484 96 1HG ARG 10 2HG ARG 10 -8.925 -9.849 9.554 97 2HG ARG 10 1HG ARG 10 -7.311 -9.132 9.564 98 1HD ARG 10 2HD ARG 10 -7.626 -10.931 7.898 99 2HD ARG 10 1HD ARG 10 -6.310 -11.205 9.034 100 HE ARG 10 HE ARG 10 -8.493 -12.473 10.113 101 1HH1 ARG 10 1HH1 ARG 10 -7.098 -12.626 6.902 102 2HH1 ARG 10 2HH1 ARG 10 -6.876 -14.321 6.912 103 1HH2 ARG 10 1HH2 ARG 10 -8.301 -14.826 10.102 104 2HH2 ARG 10 2HH2 ARG 10 -7.639 -15.590 8.722 105 H GLU 11 H GLU 11 -6.405 -9.624 14.187 106 HA GLU 11 HA GLU 11 -8.307 -10.742 15.885 107 1HB GLU 11 2HB GLU 11 -5.540 -9.630 16.427 108 2HB GLU 11 1HB GLU 11 -6.468 -10.640 17.535 109 1HG GLU 11 2HG GLU 11 -6.481 -12.424 15.806 110 2HG GLU 11 1HG GLU 11 -5.456 -11.411 14.819 111 H LYS 12 H LYS 12 -6.992 -7.509 15.479 112 HA LYS 12 HA LYS 12 -8.324 -6.186 17.523 113 1HB LYS 12 2HB LYS 12 -7.706 -5.172 14.728 114 2HB LYS 12 1HB LYS 12 -8.202 -4.135 16.064 115 1HG LYS 12 2HG LYS 12 -6.243 -4.698 17.320 116 2HG LYS 12 1HG LYS 12 -5.782 -5.917 16.144 117 1HD LYS 12 2HD LYS 12 -4.414 -3.909 15.941 118 2HD LYS 12 1HD LYS 12 -5.362 -4.167 14.485 119 1HE LYS 12 2HE LYS 12 -6.849 -2.410 15.046 120 2HE LYS 12 1HE LYS 12 -6.214 -2.309 16.691 121 1HZ LYS 12 1HZ LYS 12 -4.190 -1.466 15.908 122 2HZ LYS 12 2HZ LYS 12 -5.367 -0.547 15.105 123 3HZ LYS 12 3HZ LYS 12 -4.526 -1.729 14.291 124 H LYS 13 H LYS 13 -9.638 -7.225 14.435 125 HA LYS 13 HA LYS 13 -12.348 -6.570 15.404 126 1HB LYS 13 2HB LYS 13 -11.476 -7.724 12.710 127 2HB LYS 13 1HB LYS 13 -13.105 -7.233 13.131 128 1HG LYS 13 2HG LYS 13 -10.706 -5.462 12.696 129 2HG LYS 13 1HG LYS 13 -12.160 -5.571 11.705 130 1HD LYS 13 2HD LYS 13 -13.468 -4.743 13.657 131 2HD LYS 13 1HD LYS 13 -11.951 -4.511 14.524 132 1HE LYS 13 2HE LYS 13 -12.466 -2.398 13.645 133 2HE LYS 13 1HE LYS 13 -11.244 -3.050 12.558 134 1HZ LYS 13 1HZ LYS 13 -13.000 -2.083 11.244 135 2HZ LYS 13 2HZ LYS 13 -14.157 -2.852 12.128 136 3HZ LYS 13 3HZ LYS 13 -13.221 -3.757 11.079 137 H LYS 14 H LYS 14 -13.783 -9.206 14.374 138 HA LYS 14 HA LYS 14 -11.775 -11.062 14.963 139 1HB LYS 14 2HB LYS 14 -13.715 -12.380 16.056 140 2HB LYS 14 1HB LYS 14 -12.963 -11.101 16.994 141 1HG LYS 14 2HG LYS 14 -14.829 -9.609 16.401 142 2HG LYS 14 1HG LYS 14 -15.581 -10.936 15.516 143 1HD LYS 14 2HD LYS 14 -15.813 -12.224 17.527 144 2HD LYS 14 1HD LYS 14 -14.882 -11.039 18.445 145 1HE LYS 14 2HE LYS 14 -17.525 -10.490 17.095 146 2HE LYS 14 1HE LYS 14 -17.324 -10.862 18.806 147 1HZ LYS 14 1HZ LYS 14 -15.980 -8.859 19.049 148 2HZ LYS 14 2HZ LYS 14 -17.501 -8.490 18.455 149 3HZ LYS 14 3HZ LYS 14 -16.169 -8.473 17.416 150 H ILE 15 H ILE 15 -11.593 -10.967 12.741 151 HA ILE 15 HA ILE 15 -13.739 -12.379 11.312 152 HB ILE 15 HB ILE 15 -11.929 -10.191 10.224 153 1HG1 ILE 15 2HG1 ILE 15 -14.921 -10.217 10.693 154 2HG1 ILE 15 1HG1 ILE 15 -13.747 -9.368 11.687 155 1HG2 ILE 15 1HG2 ILE 15 -12.383 -11.888 8.531 156 2HG2 ILE 15 2HG2 ILE 15 -13.233 -10.389 8.156 157 3HG2 ILE 15 3HG2 ILE 15 -14.114 -11.753 8.845 158 1HD1 ILE 15 1HD1 ILE 15 -13.168 -7.956 9.777 159 2HD1 ILE 15 2HD1 ILE 15 -14.884 -7.853 10.173 160 3HD1 ILE 15 3HD1 ILE 15 -14.352 -8.812 8.791 161 H SER 16 H SER 16 -13.138 -14.156 10.210 162 HA SER 16 HA SER 16 -10.320 -14.873 10.322 163 1HB SER 16 2HB SER 16 -12.773 -16.627 10.041 164 2HB SER 16 1HB SER 16 -11.108 -17.181 10.245 165 HG SER 16 HG SER 16 -12.651 -15.669 12.094 166 H GLN 17 H GLN 17 -10.206 -16.817 8.409 167 HA GLN 17 HA GLN 17 -9.807 -15.164 6.172 168 1HB GLN 17 2HB GLN 17 -9.040 -17.224 4.977 169 2HB GLN 17 1HB GLN 17 -8.194 -16.816 6.460 170 1HG GLN 17 2HG GLN 17 -9.439 -18.526 7.651 171 2HG GLN 17 1HG GLN 17 -10.328 -18.915 6.177 172 1HE2 GLN 17 1HE2 GLN 17 -7.191 -18.944 7.689 173 2HE2 GLN 17 2HE2 GLN 17 -6.494 -20.180 6.721 174 H SER 18 H SER 18 -12.468 -17.585 6.693 175 HA SER 18 HA SER 18 -13.195 -17.602 3.995 176 1HB SER 18 2HB SER 18 -14.955 -18.068 6.405 177 2HB SER 18 1HB SER 18 -15.204 -18.683 4.768 178 HG SER 18 HG SER 18 -13.284 -19.384 6.684 179 H GLU 19 H GLU 19 -14.266 -15.675 6.778 180 HA GLU 19 HA GLU 19 -16.286 -14.281 5.504 181 1HB GLU 19 2HB GLU 19 -14.489 -13.192 7.682 182 2HB GLU 19 1HB GLU 19 -16.065 -12.571 7.237 183 1HG GLU 19 2HG GLU 19 -16.549 -13.762 9.133 184 2HG GLU 19 1HG GLU 19 -16.890 -14.955 7.884 185 H LEU 20 H LEU 20 -12.849 -13.553 5.724 186 HA LEU 20 HA LEU 20 -13.111 -11.161 4.220 187 1HB LEU 20 2HB LEU 20 -10.690 -12.788 4.903 188 2HB LEU 20 1HB LEU 20 -10.604 -11.363 3.889 189 HG LEU 20 HG LEU 20 -11.502 -11.449 6.768 190 1HD1 LEU 20 1HD1 LEU 20 -9.481 -10.145 7.154 191 2HD1 LEU 20 2HD1 LEU 20 -9.064 -10.279 5.446 192 3HD1 LEU 20 3HD1 LEU 20 -9.104 -11.721 6.461 193 1HD2 LEU 20 1HD2 LEU 20 -11.593 -9.006 6.602 194 2HD2 LEU 20 2HD2 LEU 20 -12.744 -9.765 5.502 195 3HD2 LEU 20 3HD2 LEU 20 -11.230 -9.108 4.879 196 H ALA 21 H ALA 21 -12.411 -14.479 3.340 197 HA ALA 21 HA ALA 21 -11.627 -14.019 0.700 198 1HB ALA 21 1HB ALA 21 -13.174 -16.377 1.789 199 2HB ALA 21 2HB ALA 21 -11.419 -16.206 1.797 200 3HB ALA 21 3HB ALA 21 -12.286 -16.334 0.266 201 H ALA 22 H ALA 22 -14.897 -14.691 2.004 202 HA ALA 22 HA ALA 22 -16.228 -14.353 -0.415 203 1HB ALA 22 1HB ALA 22 -17.159 -15.499 1.535 204 2HB ALA 22 2HB ALA 22 -18.229 -14.221 0.956 205 3HB ALA 22 3HB ALA 22 -17.242 -13.961 2.394 206 H LEU 23 H LEU 23 -15.506 -12.060 2.173 207 HA LEU 23 HA LEU 23 -17.051 -9.923 1.140 208 1HB LEU 23 2HB LEU 23 -16.373 -10.163 3.493 209 2HB LEU 23 1HB LEU 23 -14.714 -9.857 3.040 210 HG LEU 23 HG LEU 23 -15.335 -7.569 2.363 211 1HD1 LEU 23 1HD1 LEU 23 -17.534 -6.690 2.976 212 2HD1 LEU 23 2HD1 LEU 23 -18.049 -8.307 3.455 213 3HD1 LEU 23 3HD1 LEU 23 -17.664 -7.968 1.768 214 1HD2 LEU 23 1HD2 LEU 23 -16.153 -8.340 5.161 215 2HD2 LEU 23 2HD2 LEU 23 -15.695 -6.721 4.627 216 3HD2 LEU 23 3HD2 LEU 23 -14.507 -8.024 4.611 217 H LEU 24 H LEU 24 -13.620 -10.775 0.788 218 HA LEU 24 HA LEU 24 -13.070 -8.403 -0.768 219 1HB LEU 24 2HB LEU 24 -11.306 -10.790 -0.248 220 2HB LEU 24 1HB LEU 24 -10.802 -9.229 -0.852 221 HG LEU 24 HG LEU 24 -11.784 -9.854 1.928 222 1HD1 LEU 24 1HD1 LEU 24 -9.580 -10.704 1.503 223 2HD1 LEU 24 2HD1 LEU 24 -9.496 -9.319 2.592 224 3HD1 LEU 24 3HD1 LEU 24 -9.060 -9.133 0.893 225 1HD2 LEU 24 1HD2 LEU 24 -12.458 -7.600 1.281 226 2HD2 LEU 24 2HD2 LEU 24 -10.805 -7.239 0.783 227 3HD2 LEU 24 3HD2 LEU 24 -11.167 -7.550 2.482 228 H GLU 25 H GLU 25 -14.540 -11.282 -1.417 229 HA GLU 25 HA GLU 25 -15.058 -12.489 -3.249 230 1HB GLU 25 2HB GLU 25 -14.031 -10.034 -4.696 231 2HB GLU 25 1HB GLU 25 -14.845 -11.369 -5.490 232 1HG GLU 25 2HG GLU 25 -16.844 -10.928 -4.128 233 2HG GLU 25 1HG GLU 25 -16.020 -9.548 -3.401 234 H VAL 26 H VAL 26 -12.630 -13.163 -2.056 235 HA VAL 26 HA VAL 26 -11.020 -13.974 -4.344 236 HB VAL 26 HB VAL 26 -8.967 -13.719 -3.002 237 1HG1 VAL 26 1HG1 VAL 26 -8.784 -11.280 -3.087 238 2HG1 VAL 26 2HG1 VAL 26 -10.534 -11.169 -3.286 239 3HG1 VAL 26 3HG1 VAL 26 -9.554 -11.949 -4.526 240 1HG2 VAL 26 1HG2 VAL 26 -8.996 -12.372 -0.920 241 2HG2 VAL 26 2HG2 VAL 26 -9.884 -13.886 -0.760 242 3HG2 VAL 26 3HG2 VAL 26 -10.762 -12.372 -0.975 243 H SER 27 H SER 27 -9.383 -15.685 -3.396 244 HA SER 27 HA SER 27 -11.044 -17.638 -2.038 245 1HB SER 27 2HB SER 27 -8.393 -17.965 -3.425 246 2HB SER 27 1HB SER 27 -9.406 -19.275 -2.807 247 HG SER 27 HG SER 27 -11.090 -18.169 -4.178 248 H ARG 28 H ARG 28 -10.288 -18.970 -0.360 249 HA ARG 28 HA ARG 28 -9.144 -17.618 1.810 250 1HB ARG 28 2HB ARG 28 -9.809 -20.505 1.386 251 2HB ARG 28 1HB ARG 28 -8.982 -19.980 2.845 252 1HG ARG 28 2HG ARG 28 -10.840 -18.448 3.321 253 2HG ARG 28 1HG ARG 28 -11.669 -19.034 1.879 254 1HD ARG 28 2HD ARG 28 -10.813 -20.831 4.138 255 2HD ARG 28 1HD ARG 28 -12.391 -20.057 4.076 256 HE ARG 28 HE ARG 28 -11.881 -21.479 1.681 257 1HH1 ARG 28 1HH1 ARG 28 -12.515 -22.188 5.094 258 2HH1 ARG 28 2HH1 ARG 28 -13.566 -23.498 4.756 259 1HH2 ARG 28 1HH2 ARG 28 -13.353 -23.273 1.241 260 2HH2 ARG 28 2HH2 ARG 28 -14.069 -24.107 2.531 261 H GLN 29 H GLN 29 -7.629 -19.745 -0.526 262 HA GLN 29 HA GLN 29 -5.218 -20.037 0.938 263 1HB GLN 29 2HB GLN 29 -6.006 -21.511 -0.968 264 2HB GLN 29 1HB GLN 29 -5.605 -20.214 -2.070 265 1HG GLN 29 2HG GLN 29 -3.552 -21.485 -0.271 266 2HG GLN 29 1HG GLN 29 -3.966 -22.155 -1.842 267 1HE2 GLN 29 1HE2 GLN 29 -1.451 -21.132 -0.854 268 2HE2 GLN 29 2HE2 GLN 29 -0.964 -19.887 -1.936 269 H THR 30 H THR 30 -6.463 -17.650 -1.297 270 HA THR 30 HA THR 30 -4.131 -16.225 -1.863 271 HB THR 30 HB THR 30 -6.924 -15.135 -1.660 272 HG1 THR 30 1HG THR 30 -5.962 -16.419 -3.981 273 1HG2 THR 30 1HG2 THR 30 -5.132 -13.543 -2.267 274 2HG2 THR 30 2HG2 THR 30 -6.220 -13.823 -3.627 275 3HG2 THR 30 3HG2 THR 30 -4.639 -14.604 -3.587 276 H ILE 31 H ILE 31 -6.817 -15.556 0.465 277 HA ILE 31 HA ILE 31 -5.564 -13.344 1.600 278 HB ILE 31 HB ILE 31 -7.960 -13.583 1.839 279 1HG1 ILE 31 2HG1 ILE 31 -8.286 -13.158 4.267 280 2HG1 ILE 31 1HG1 ILE 31 -6.637 -13.702 4.555 281 1HG2 ILE 31 1HG2 ILE 31 -9.026 -15.218 3.305 282 2HG2 ILE 31 2HG2 ILE 31 -7.462 -16.000 3.542 283 3HG2 ILE 31 3HG2 ILE 31 -8.194 -15.962 1.940 284 1HD1 ILE 31 1HD1 ILE 31 -5.801 -11.861 3.188 285 2HD1 ILE 31 2HD1 ILE 31 -6.779 -11.280 4.535 286 3HD1 ILE 31 3HD1 ILE 31 -7.455 -11.319 2.905 287 H ASN 32 H ASN 32 -5.546 -16.681 2.658 288 HA ASN 32 HA ASN 32 -4.037 -16.327 5.013 289 1HB ASN 32 2HB ASN 32 -5.184 -18.448 4.473 290 2HB ASN 32 1HB ASN 32 -4.039 -18.728 3.170 291 1HD2 ASN 32 1HD2 ASN 32 -1.971 -19.477 3.667 292 2HD2 ASN 32 2HD2 ASN 32 -1.540 -19.988 5.265 293 H GLY 33 H GLY 33 -3.077 -16.738 1.665 294 1HA GLY 33 2HA GLY 33 -0.319 -16.955 2.061 295 2HA GLY 33 1HA GLY 33 -1.130 -16.392 0.599 296 H ILE 34 H ILE 34 -2.465 -14.113 1.769 297 HA ILE 34 HA ILE 34 -0.388 -12.213 1.752 298 HB ILE 34 HB ILE 34 -3.291 -11.917 2.599 299 1HG1 ILE 34 2HG1 ILE 34 -3.149 -12.697 0.294 300 2HG1 ILE 34 1HG1 ILE 34 -3.682 -11.025 0.325 301 1HG2 ILE 34 1HG2 ILE 34 -1.976 -10.072 3.448 302 2HG2 ILE 34 2HG2 ILE 34 -3.013 -9.514 2.134 303 3HG2 ILE 34 3HG2 ILE 34 -1.293 -9.787 1.848 304 1HD1 ILE 34 1HD1 ILE 34 -2.105 -11.423 -1.475 305 2HD1 ILE 34 2HD1 ILE 34 -0.902 -11.988 -0.315 306 3HD1 ILE 34 3HD1 ILE 34 -1.427 -10.303 -0.292 307 H GLU 35 H GLU 35 -2.479 -13.542 4.312 308 HA GLU 35 HA GLU 35 -1.619 -12.161 6.543 309 1HB GLU 35 2HB GLU 35 -2.198 -15.104 6.371 310 2HB GLU 35 1HB GLU 35 -2.140 -14.162 7.841 311 1HG GLU 35 2HG GLU 35 -4.080 -12.930 7.165 312 2HG GLU 35 1HG GLU 35 -4.094 -13.771 5.607 313 H LYS 36 H LYS 36 -0.132 -14.916 4.977 314 HA LYS 36 HA LYS 36 1.937 -14.988 7.031 315 1HB LYS 36 2HB LYS 36 1.531 -16.877 4.709 316 2HB LYS 36 1HB LYS 36 2.639 -17.103 6.051 317 1HG LYS 36 2HG LYS 36 -0.375 -17.132 6.150 318 2HG LYS 36 1HG LYS 36 0.713 -18.498 6.375 319 1HD LYS 36 2HD LYS 36 0.485 -16.091 8.192 320 2HD LYS 36 1HD LYS 36 -0.194 -17.684 8.510 321 1HE LYS 36 2HE LYS 36 2.064 -18.633 8.535 322 2HE LYS 36 1HE LYS 36 2.738 -17.036 8.207 323 1HZ LYS 36 1HZ LYS 36 1.799 -16.264 10.314 324 2HZ LYS 36 2HZ LYS 36 2.854 -17.569 10.534 325 3HZ LYS 36 3HZ LYS 36 1.188 -17.828 10.602 326 H ASN 37 H ASN 37 1.502 -13.115 4.544 327 HA ASN 37 HA ASN 37 2.647 -12.162 2.844 328 1HB ASN 37 2HB ASN 37 4.842 -11.141 3.502 329 2HB ASN 37 1HB ASN 37 3.595 -10.908 4.705 330 1HD2 ASN 37 1HD2 ASN 37 6.624 -12.366 3.971 331 2HD2 ASN 37 2HD2 ASN 37 7.042 -12.859 5.570 332 H LYS 38 H LYS 38 2.477 -14.733 2.407 333 HA LYS 38 HA LYS 38 5.090 -15.742 1.506 334 1HB LYS 38 2HB LYS 38 3.710 -17.093 3.071 335 2HB LYS 38 1HB LYS 38 2.427 -17.125 1.877 336 1HG LYS 38 2HG LYS 38 4.058 -18.273 0.333 337 2HG LYS 38 1HG LYS 38 5.128 -18.422 1.726 338 1HD LYS 38 2HD LYS 38 3.865 -20.473 1.482 339 2HD LYS 38 1HD LYS 38 3.312 -19.628 2.931 340 1HE LYS 38 2HE LYS 38 1.363 -18.797 1.747 341 2HE LYS 38 1HE LYS 38 1.942 -19.500 0.238 342 1HZ LYS 38 1HZ LYS 38 1.040 -20.990 2.661 343 2HZ LYS 38 2HZ LYS 38 1.799 -21.696 1.355 344 3HZ LYS 38 3HZ LYS 38 0.299 -20.991 1.139 345 H TYR 39 H TYR 39 1.920 -14.701 0.505 346 HA TYR 39 HA TYR 39 2.140 -15.925 -2.139 347 1HB TYR 39 2HB TYR 39 0.065 -15.921 -0.634 348 2HB TYR 39 1HB TYR 39 -0.129 -14.239 -1.107 349 HD1 TYR 39 1HD TYR 39 0.060 -17.652 -2.307 350 HD2 TYR 39 2HD TYR 39 -1.143 -13.705 -3.225 351 HE1 TYR 39 1HE TYR 39 -1.101 -18.487 -4.311 352 HE2 TYR 39 2HE TYR 39 -2.312 -14.510 -5.241 353 HH TYR 39 HH TYR 39 -2.911 -17.824 -5.760 354 H ASN 40 H ASN 40 3.345 -13.291 -0.823 355 HA ASN 40 HA ASN 40 4.023 -11.252 -1.393 356 1HB ASN 40 2HB ASN 40 4.614 -12.095 -3.654 357 2HB ASN 40 1HB ASN 40 2.960 -11.814 -4.190 358 1HD2 ASN 40 1HD2 ASN 40 5.955 -10.353 -3.299 359 2HD2 ASN 40 2HD2 ASN 40 5.621 -8.758 -3.883 360 HA PRO 41 HA PRO 41 0.131 -9.435 -0.375 361 1HB PRO 41 2HB PRO 41 1.723 -7.327 0.872 362 2HB PRO 41 1HB PRO 41 0.632 -8.489 1.633 363 1HG PRO 41 2HG PRO 41 3.332 -8.576 1.944 364 2HG PRO 41 1HG PRO 41 2.304 -10.021 1.994 365 1HD PRO 41 2HD PRO 41 3.990 -8.969 -0.248 366 2HD PRO 41 1HD PRO 41 3.760 -10.646 0.300 367 H SER 42 H SER 42 -0.301 -8.894 -2.508 368 HA SER 42 HA SER 42 0.828 -6.526 -3.584 369 1HB SER 42 2HB SER 42 -0.837 -6.996 -5.442 370 2HB SER 42 1HB SER 42 0.354 -8.261 -5.144 371 HG SER 42 HG SER 42 -1.180 -9.558 -4.643 372 H LEU 43 H LEU 43 -0.613 -4.723 -4.294 373 HA LEU 43 HA LEU 43 -1.646 -3.861 -1.819 374 1HB LEU 43 2HB LEU 43 -0.177 -2.442 -3.191 375 2HB LEU 43 1HB LEU 43 -1.450 -2.280 -4.375 376 HG LEU 43 HG LEU 43 -1.034 -0.306 -2.804 377 1HD1 LEU 43 1HD1 LEU 43 -3.388 0.269 -2.580 378 2HD1 LEU 43 2HD1 LEU 43 -3.825 -1.397 -2.962 379 3HD1 LEU 43 3HD1 LEU 43 -3.007 -0.400 -4.167 380 1HD2 LEU 43 1HD2 LEU 43 -0.801 -1.514 -0.667 381 2HD2 LEU 43 2HD2 LEU 43 -2.446 -2.098 -0.784 382 3HD2 LEU 43 3HD2 LEU 43 -2.132 -0.383 -0.568 383 H GLN 44 H GLN 44 -3.406 -4.797 -4.890 384 HA GLN 44 HA GLN 44 -5.728 -3.463 -4.196 385 1HB GLN 44 2HB GLN 44 -5.319 -4.515 -6.411 386 2HB GLN 44 1HB GLN 44 -5.479 -6.101 -5.667 387 1HG GLN 44 2HG GLN 44 -7.803 -5.524 -5.027 388 2HG GLN 44 1HG GLN 44 -7.626 -3.999 -5.890 389 1HE2 GLN 44 1HE2 GLN 44 -9.266 -4.473 -7.341 390 2HE2 GLN 44 2HE2 GLN 44 -9.113 -5.660 -8.568 391 H LEU 45 H LEU 45 -4.663 -6.712 -3.320 392 HA LEU 45 HA LEU 45 -6.908 -7.462 -1.812 393 1HB LEU 45 2HB LEU 45 -4.008 -8.243 -1.464 394 2HB LEU 45 1HB LEU 45 -5.283 -8.909 -0.476 395 HG LEU 45 HG LEU 45 -4.736 -10.506 -2.119 396 1HD1 LEU 45 1HD1 LEU 45 -7.299 -9.169 -2.889 397 2HD1 LEU 45 2HD1 LEU 45 -7.057 -10.370 -1.618 398 3HD1 LEU 45 3HD1 LEU 45 -6.832 -10.817 -3.308 399 1HD2 LEU 45 1HD2 LEU 45 -5.194 -8.396 -4.221 400 2HD2 LEU 45 2HD2 LEU 45 -4.857 -10.099 -4.530 401 3HD2 LEU 45 3HD2 LEU 45 -3.636 -9.083 -3.761 402 H ALA 46 H ALA 46 -4.019 -5.825 -0.898 403 HA ALA 46 HA ALA 46 -4.538 -5.592 1.888 404 1HB ALA 46 1HB ALA 46 -2.778 -3.838 0.172 405 2HB ALA 46 2HB ALA 46 -2.278 -5.338 0.955 406 3HB ALA 46 3HB ALA 46 -2.737 -3.941 1.932 407 H LEU 47 H LEU 47 -5.295 -3.596 -0.883 408 HA LEU 47 HA LEU 47 -6.010 -1.174 0.293 409 1HB LEU 47 2HB LEU 47 -5.512 -1.869 -2.122 410 2HB LEU 47 1HB LEU 47 -7.136 -2.493 -2.177 411 HG LEU 47 HG LEU 47 -6.891 -0.363 -3.316 412 1HD1 LEU 47 1HD1 LEU 47 -8.733 0.877 -2.310 413 2HD1 LEU 47 2HD1 LEU 47 -8.619 -0.136 -0.868 414 3HD1 LEU 47 3HD1 LEU 47 -9.072 -0.851 -2.414 415 1HD2 LEU 47 1HD2 LEU 47 -6.120 0.692 -0.620 416 2HD2 LEU 47 2HD2 LEU 47 -6.443 1.675 -2.048 417 3HD2 LEU 47 3HD2 LEU 47 -5.087 0.546 -2.041 418 H LYS 48 H LYS 48 -7.890 -3.995 -0.703 419 HA LYS 48 HA LYS 48 -10.249 -2.842 0.346 420 1HB LYS 48 2HB LYS 48 -11.357 -5.097 -0.091 421 2HB LYS 48 1HB LYS 48 -10.792 -4.163 -1.459 422 1HG LYS 48 2HG LYS 48 -8.811 -5.616 -1.598 423 2HG LYS 48 1HG LYS 48 -9.440 -6.568 -0.248 424 1HD LYS 48 2HD LYS 48 -9.976 -7.582 -2.429 425 2HD LYS 48 1HD LYS 48 -11.427 -7.131 -1.526 426 1HE LYS 48 2HE LYS 48 -11.488 -5.005 -2.850 427 2HE LYS 48 1HE LYS 48 -10.163 -5.634 -3.825 428 1HZ LYS 48 1HZ LYS 48 -11.601 -7.472 -4.497 429 2HZ LYS 48 2HZ LYS 48 -12.287 -5.978 -4.871 430 3HZ LYS 48 3HZ LYS 48 -12.858 -6.847 -3.546 431 H ILE 49 H ILE 49 -8.008 -5.123 1.635 432 HA ILE 49 HA ILE 49 -9.473 -5.824 3.938 433 HB ILE 49 HB ILE 49 -6.464 -5.515 3.612 434 1HG1 ILE 49 2HG1 ILE 49 -8.187 -8.002 3.535 435 2HG1 ILE 49 1HG1 ILE 49 -7.561 -7.171 2.118 436 1HG2 ILE 49 1HG2 ILE 49 -6.257 -6.951 5.592 437 2HG2 ILE 49 2HG2 ILE 49 -8.010 -6.923 5.791 438 3HG2 ILE 49 3HG2 ILE 49 -7.078 -5.436 5.973 439 1HD1 ILE 49 1HD1 ILE 49 -5.911 -8.480 4.267 440 2HD1 ILE 49 2HD1 ILE 49 -5.283 -7.663 2.836 441 3HD1 ILE 49 3HD1 ILE 49 -6.240 -9.136 2.663 442 H ALA 50 H ALA 50 -7.340 -3.136 3.243 443 HA ALA 50 HA ALA 50 -7.294 -1.891 5.785 444 1HB ALA 50 1HB ALA 50 -5.701 -1.388 3.985 445 2HB ALA 50 2HB ALA 50 -6.538 0.070 4.552 446 3HB ALA 50 3HB ALA 50 -7.040 -0.709 3.049 447 H TYR 51 H TYR 51 -9.339 -1.611 2.972 448 HA TYR 51 HA TYR 51 -10.857 0.576 3.881 449 1HB TYR 51 2HB TYR 51 -10.658 0.189 1.551 450 2HB TYR 51 1HB TYR 51 -11.225 -1.464 1.708 451 HD1 TYR 51 1HD TYR 51 -13.451 -1.962 1.698 452 HD2 TYR 51 2HD TYR 51 -12.264 2.083 1.765 453 HE1 TYR 51 1HE TYR 51 -15.782 -1.289 1.126 454 HE2 TYR 51 2HE TYR 51 -14.553 2.797 1.210 455 HH TYR 51 HH TYR 51 -16.498 1.763 0.020 456 H TYR 52 H TYR 52 -11.602 -2.944 3.776 457 HA TYR 52 HA TYR 52 -14.180 -2.535 4.944 458 1HB TYR 52 2HB TYR 52 -12.605 -5.066 4.511 459 2HB TYR 52 1HB TYR 52 -14.202 -5.046 5.240 460 HD1 TYR 52 1HD TYR 52 -16.082 -3.921 3.821 461 HD2 TYR 52 2HD TYR 52 -12.394 -5.268 2.225 462 HE1 TYR 52 1HE TYR 52 -17.102 -4.059 1.590 463 HE2 TYR 52 2HE TYR 52 -13.393 -5.405 -0.005 464 HH TYR 52 HH TYR 52 -16.496 -4.099 -0.693 465 H LEU 53 H LEU 53 -11.128 -3.337 6.221 466 HA LEU 53 HA LEU 53 -12.242 -3.717 8.888 467 1HB LEU 53 2HB LEU 53 -9.335 -3.619 8.063 468 2HB LEU 53 1HB LEU 53 -9.907 -4.000 9.675 469 1HD1 LEU 53 1HD1 LEU 53 -8.688 -6.173 9.616 470 2HD1 LEU 53 2HD1 LEU 53 -8.103 -5.797 7.995 471 3HD1 LEU 53 3HD1 LEU 53 -8.973 -7.304 8.294 472 1HD2 LEU 53 1HD2 LEU 53 -12.283 -5.787 8.690 473 2HD2 LEU 53 2HD2 LEU 53 -11.206 -6.175 10.032 474 3HD2 LEU 53 3HD2 LEU 53 -11.374 -7.297 8.682 475 H ASN 54 H ASN 54 -11.405 -1.176 6.997 476 HA ASN 54 HA ASN 54 -10.878 0.986 7.205 477 1HB ASN 54 2HB ASN 54 -13.214 1.038 7.974 478 2HB ASN 54 1HB ASN 54 -12.686 0.760 9.628 479 1HD2 ASN 54 1HD2 ASN 54 -13.607 2.634 10.362 480 2HD2 ASN 54 2HD2 ASN 54 -12.984 4.208 9.999 481 H THR 55 H THR 55 -8.721 0.255 7.607 482 HA THR 55 HA THR 55 -7.645 1.430 9.989 483 HB THR 55 HB THR 55 -7.231 -1.483 9.203 484 HG1 THR 55 1HG THR 55 -9.106 -0.550 10.596 485 1HG2 THR 55 1HG2 THR 55 -5.751 -1.632 11.148 486 2HG2 THR 55 2HG2 THR 55 -5.980 0.084 11.468 487 3HG2 THR 55 3HG2 THR 55 -5.141 -0.437 10.006 488 HA PRO 56 HA PRO 56 -4.968 2.801 6.659 489 1HB PRO 56 2HB PRO 56 -2.837 3.579 8.234 490 2HB PRO 56 1HB PRO 56 -4.287 4.543 7.945 491 1HG PRO 56 2HG PRO 56 -3.666 2.773 10.277 492 2HG PRO 56 1HG PRO 56 -4.360 4.408 10.265 493 1HD PRO 56 2HD PRO 56 -5.915 2.269 10.591 494 2HD PRO 56 1HD PRO 56 -6.458 3.642 9.602 495 H LEU 57 H LEU 57 -3.293 2.024 5.529 496 HA LEU 57 HA LEU 57 -2.311 -0.560 5.804 497 1HB LEU 57 2HB LEU 57 -1.210 1.824 4.359 498 2HB LEU 57 1HB LEU 57 -0.349 0.307 4.366 499 1HD1 LEU 57 1HD1 LEU 57 -4.070 0.576 4.023 500 2HD1 LEU 57 2HD1 LEU 57 -4.035 0.547 2.260 501 3HD1 LEU 57 3HD1 LEU 57 -3.467 1.971 3.128 502 1HD2 LEU 57 1HD2 LEU 57 -1.900 0.449 1.065 503 2HD2 LEU 57 2HD2 LEU 57 -0.393 0.241 1.973 504 3HD2 LEU 57 3HD2 LEU 57 -1.222 1.796 1.993 505 H GLU 58 H GLU 58 -1.002 2.497 7.009 506 HA GLU 58 HA GLU 58 1.454 1.773 7.908 507 1HB GLU 58 2HB GLU 58 -0.577 3.637 9.143 508 2HB GLU 58 1HB GLU 58 1.101 3.554 9.629 509 1HG GLU 58 2HG GLU 58 0.902 5.459 8.200 510 2HG GLU 58 1HG GLU 58 1.697 4.164 7.318 511 H ASP 59 H ASP 59 -1.674 1.250 9.478 512 HA ASP 59 HA ASP 59 -0.596 0.362 11.977 513 1HB ASP 59 2HB ASP 59 -2.885 1.368 11.626 514 2HB ASP 59 1HB ASP 59 -3.351 -0.128 10.836 515 H ILE 60 H ILE 60 -1.699 -1.051 9.052 516 HA ILE 60 HA ILE 60 -1.799 -3.809 9.948 517 HB ILE 60 HB ILE 60 -1.873 -2.781 7.097 518 1HG1 ILE 60 2HG1 ILE 60 -4.173 -3.408 8.974 519 2HG1 ILE 60 1HG1 ILE 60 -3.666 -1.790 8.508 520 1HG2 ILE 60 1HG2 ILE 60 -2.980 -4.931 6.644 521 2HG2 ILE 60 2HG2 ILE 60 -2.767 -5.392 8.333 522 3HG2 ILE 60 3HG2 ILE 60 -1.359 -5.161 7.296 523 1HD1 ILE 60 1HD1 ILE 60 -5.627 -2.491 7.261 524 2HD1 ILE 60 2HD1 ILE 60 -4.760 -3.908 6.665 525 3HD1 ILE 60 3HD1 ILE 60 -4.248 -2.293 6.181 526 H PHE 61 H PHE 61 0.277 -2.127 7.664 527 HA PHE 61 HA PHE 61 2.220 -4.305 8.032 528 1HB PHE 61 2HB PHE 61 1.822 -2.524 5.589 529 2HB PHE 61 1HB PHE 61 3.115 -3.704 5.783 530 HD1 PHE 61 1HD PHE 61 2.388 -6.148 6.101 531 HD2 PHE 61 2HD PHE 61 -0.194 -3.077 4.687 532 HE1 PHE 61 1HE PHE 61 0.924 -7.846 5.092 533 HE2 PHE 61 2HE PHE 61 -1.668 -4.771 3.681 534 HZ PHE 61 HZ PHE 61 -1.108 -7.161 3.884 535 H GLN 62 H GLN 62 4.297 -3.857 8.518 536 HA GLN 62 HA GLN 62 4.972 -1.043 8.899 537 1HB GLN 62 2HB GLN 62 5.079 -2.331 10.989 538 2HB GLN 62 1HB GLN 62 6.167 -3.491 10.229 539 1HG GLN 62 2HG GLN 62 7.866 -1.785 9.976 540 2HG GLN 62 1HG GLN 62 6.779 -0.568 10.630 541 1HE2 GLN 62 1HE2 GLN 62 5.741 -2.305 12.722 542 2HE2 GLN 62 2HE2 GLN 62 6.997 -2.451 13.886 543 H TRP 63 H TRP 63 6.437 -0.254 7.640 544 HA TRP 63 HA TRP 63 7.984 -2.126 6.037 545 1HB TRP 63 2HB TRP 63 8.054 -0.115 4.398 546 2HB TRP 63 1HB TRP 63 6.645 -1.156 4.474 547 HD1 TRP 63 HD TRP 63 7.758 2.405 5.532 548 HE1 TRP 63 1HE TRP 63 5.609 3.839 5.800 549 HE3 TRP 63 3HE TRP 63 4.248 -1.257 4.940 550 HZ2 TRP 63 2HZ TRP 63 2.812 3.446 5.719 551 HZ3 TRP 63 3HZ TRP 63 1.875 -0.655 5.029 552 HH2 TRP 63 HH TRP 63 1.163 1.613 5.390 553 H GLN 64 H GLN 64 10.077 -2.047 6.039 554 HA GLN 64 HA GLN 64 11.377 0.316 7.201 555 1HB GLN 64 2HB GLN 64 12.401 -2.517 7.406 556 2HB GLN 64 1HB GLN 64 12.999 -1.098 8.242 557 1HG GLN 64 2HG GLN 64 10.849 -1.021 9.509 558 2HG GLN 64 1HG GLN 64 10.403 -2.531 8.722 559 1HE2 GLN 64 1HE2 GLN 64 10.772 -1.982 11.502 560 2HE2 GLN 64 2HE2 GLN 64 11.999 -3.047 12.076 561 HA PRO 65 HA PRO 65 13.362 -0.321 3.098 562 1HB PRO 65 2HB PRO 65 13.357 2.565 2.832 563 2HB PRO 65 1HB PRO 65 12.448 1.385 1.884 564 1HG PRO 65 2HG PRO 65 11.261 3.156 3.596 565 2HG PRO 65 1HG PRO 65 10.577 1.568 3.202 566 1HD PRO 65 2HD PRO 65 12.181 2.393 5.604 567 2HD PRO 65 1HD PRO 65 10.696 1.414 5.528 568 H GLU 66 H GLU 66 14.062 0.976 5.902 569 HA GLU 66 HA GLU 66 16.575 2.309 5.572 570 1HB GLU 66 2HB GLU 66 15.428 0.922 7.993 571 2HB GLU 66 1HB GLU 66 16.906 1.866 8.012 572 1HG GLU 66 2HG GLU 66 14.176 2.914 7.311 573 2HG GLU 66 1HG GLU 66 14.967 3.090 8.877 574 1H MET 67 1HT MET 67 -12.774 2.197 -8.868 575 2H MET 67 2HT MET 67 -12.318 2.673 -7.303 576 3H MET 67 3HT MET 67 -11.279 1.773 -8.215 577 HA MET 67 HA MET 67 -10.795 3.492 -9.660 578 1HB MET 67 2HB MET 67 -13.024 4.960 -8.245 579 2HB MET 67 1HB MET 67 -11.842 5.764 -9.266 580 1HG MET 67 2HG MET 67 -13.717 3.589 -10.163 581 2HG MET 67 1HG MET 67 -13.957 5.318 -10.420 582 1HE MET 67 1HE MET 67 -14.270 4.880 -13.016 583 2HE MET 67 2HE MET 67 -14.025 3.153 -12.762 584 3HE MET 67 3HE MET 67 -13.114 3.998 -14.013 585 H ILE 68 H ILE 68 -8.965 4.285 -9.123 586 HA ILE 68 HA ILE 68 -8.490 4.958 -6.286 587 HB ILE 68 HB ILE 68 -6.459 4.132 -8.387 588 1HG1 ILE 68 2HG1 ILE 68 -7.867 2.225 -7.762 589 2HG1 ILE 68 1HG1 ILE 68 -6.239 2.021 -7.129 590 1HG2 ILE 68 1HG2 ILE 68 -6.080 4.600 -5.433 591 2HG2 ILE 68 2HG2 ILE 68 -5.483 5.622 -6.739 592 3HG2 ILE 68 3HG2 ILE 68 -4.853 3.986 -6.543 593 1HD1 ILE 68 1HD1 ILE 68 -7.918 1.307 -5.524 594 2HD1 ILE 68 2HD1 ILE 68 -8.660 2.906 -5.567 595 3HD1 ILE 68 3HD1 ILE 68 -7.034 2.709 -4.914 596 H ILE 69 H ILE 69 -8.243 7.070 -5.912 597 HA ILE 69 HA ILE 69 -7.500 8.836 -8.092 598 HB ILE 69 HB ILE 69 -8.361 9.444 -5.228 599 1HG1 ILE 69 2HG1 ILE 69 -10.391 10.501 -6.371 600 2HG1 ILE 69 1HG1 ILE 69 -9.864 9.715 -7.847 601 1HG2 ILE 69 1HG2 ILE 69 -8.504 11.801 -5.873 602 2HG2 ILE 69 2HG2 ILE 69 -7.804 11.400 -7.443 603 3HG2 ILE 69 3HG2 ILE 69 -6.857 11.172 -5.974 604 1HD1 ILE 69 1HD1 ILE 69 -11.658 8.480 -6.761 605 2HD1 ILE 69 2HD1 ILE 69 -10.684 8.334 -5.296 606 3HD1 ILE 69 3HD1 ILE 69 -10.170 7.530 -6.778 607 H ASN 70 H ASN 70 -5.414 9.654 -8.330 608 HA ASN 70 HA ASN 70 -3.512 8.808 -6.326 609 1HB ASN 70 2HB ASN 70 -3.203 7.774 -8.490 610 2HB ASN 70 1HB ASN 70 -3.351 9.322 -9.302 611 1HD2 ASN 70 1HD2 ASN 70 -1.386 9.111 -10.295 612 2HD2 ASN 70 2HD2 ASN 70 0.119 9.222 -9.458 613 H ASN 71 H ASN 71 -2.303 10.359 -5.353 614 HA ASN 71 HA ASN 71 -2.385 13.096 -6.400 615 1HB ASN 71 2HB ASN 71 -2.632 12.338 -3.469 616 2HB ASN 71 1HB ASN 71 -2.569 13.966 -4.115 617 1HD2 ASN 71 1HD2 ASN 71 -4.458 11.245 -3.453 618 2HD2 ASN 71 2HD2 ASN 71 -6.007 11.906 -3.835 619 H LEU 72 H LEU 72 -0.383 10.780 -6.498 620 HA LEU 72 HA LEU 72 1.589 10.892 -4.636 621 1HB LEU 72 2HB LEU 72 1.239 9.327 -6.612 622 2HB LEU 72 1HB LEU 72 1.949 10.553 -7.626 623 HG LEU 72 HG LEU 72 3.471 8.678 -7.115 624 1HD1 LEU 72 1HD1 LEU 72 4.486 10.790 -7.673 625 2HD1 LEU 72 2HD1 LEU 72 5.452 9.932 -6.470 626 3HD1 LEU 72 3HD1 LEU 72 4.432 11.285 -5.982 627 1HD2 LEU 72 1HD2 LEU 72 3.277 9.645 -4.273 628 2HD2 LEU 72 2HD2 LEU 72 4.423 8.442 -4.869 629 3HD2 LEU 72 3HD2 LEU 72 2.693 8.107 -4.909 630 H LYS 73 H LYS 73 1.356 12.832 -7.622 631 HA LYS 73 HA LYS 73 3.653 14.323 -6.941 632 1HB LYS 73 2HB LYS 73 3.204 15.807 -8.795 633 2HB LYS 73 1HB LYS 73 2.968 14.146 -9.291 634 1HG LYS 73 2HG LYS 73 0.551 14.456 -9.185 635 2HG LYS 73 1HG LYS 73 0.789 16.126 -8.645 636 1HD LYS 73 2HD LYS 73 2.063 16.566 -10.720 637 2HD LYS 73 1HD LYS 73 1.689 14.934 -11.264 638 1HE LYS 73 2HE LYS 73 -0.703 15.482 -11.188 639 2HE LYS 73 1HE LYS 73 -0.300 17.121 -10.673 640 1HZ LYS 73 1HZ LYS 73 0.420 15.848 -13.256 641 2HZ LYS 73 2HZ LYS 73 0.951 17.384 -12.768 642 3HZ LYS 73 3HZ LYS 73 -0.670 17.122 -13.031 643 H LEU 74 H LEU 74 0.237 14.898 -6.321 644 HA LEU 74 HA LEU 74 0.319 17.543 -5.506 645 1HB LEU 74 2HB LEU 74 -1.723 16.187 -5.912 646 2HB LEU 74 1HB LEU 74 -1.390 15.262 -4.475 647 HG LEU 74 HG LEU 74 -3.285 16.894 -4.293 648 1HD1 LEU 74 1HD1 LEU 74 -1.042 17.375 -2.359 649 2HD1 LEU 74 2HD1 LEU 74 -2.251 16.097 -2.269 650 3HD1 LEU 74 3HD1 LEU 74 -2.737 17.787 -2.102 651 1HD2 LEU 74 1HD2 LEU 74 -2.379 18.697 -5.617 652 2HD2 LEU 74 2HD2 LEU 74 -1.101 18.953 -4.428 653 3HD2 LEU 74 3HD2 LEU 74 -2.781 19.267 -3.997 654 H ILE 75 H ILE 75 0.837 14.620 -3.566 655 HA ILE 75 HA ILE 75 1.408 15.984 -1.151 656 HB ILE 75 HB ILE 75 2.028 13.173 -2.064 657 1HG1 ILE 75 2HG1 ILE 75 0.637 12.544 -0.107 658 2HG1 ILE 75 1HG1 ILE 75 0.440 14.244 0.282 659 1HG2 ILE 75 1HG2 ILE 75 4.007 13.753 -0.818 660 2HG2 ILE 75 2HG2 ILE 75 3.027 12.632 0.133 661 3HG2 ILE 75 3HG2 ILE 75 3.033 14.353 0.517 662 1HD1 ILE 75 1HD1 ILE 75 -1.530 13.339 -0.787 663 2HD1 ILE 75 2HD1 ILE 75 -0.570 12.853 -2.187 664 3HD1 ILE 75 3HD1 ILE 75 -0.779 14.563 -1.810 665 H ARG 76 H ARG 76 3.385 15.034 -3.775 666 HA ARG 76 HA ARG 76 5.889 15.716 -2.616 667 1HB ARG 76 2HB ARG 76 4.980 15.193 -5.384 668 2HB ARG 76 1HB ARG 76 6.558 15.911 -5.105 669 1HG ARG 76 2HG ARG 76 7.256 14.015 -3.818 670 2HG ARG 76 1HG ARG 76 5.635 13.315 -3.906 671 1HD ARG 76 2HD ARG 76 7.366 12.434 -5.548 672 2HD ARG 76 1HD ARG 76 5.803 12.925 -6.200 673 HE ARG 76 HE ARG 76 8.069 14.791 -6.224 674 1HH1 ARG 76 1HH1 ARG 76 5.733 12.793 -7.958 675 2HH1 ARG 76 2HH1 ARG 76 5.897 13.616 -9.442 676 1HH2 ARG 76 1HH2 ARG 76 8.209 16.024 -8.295 677 2HH2 ARG 76 2HH2 ARG 76 7.262 15.507 -9.596 678 H GLU 77 H GLU 77 3.509 17.596 -4.441 679 HA GLU 77 HA GLU 77 5.147 19.863 -4.629 680 1HB GLU 77 2HB GLU 77 2.151 19.593 -4.789 681 2HB GLU 77 1HB GLU 77 3.074 21.022 -5.246 682 1HG GLU 77 2HG GLU 77 4.272 19.645 -6.914 683 2HG GLU 77 1HG GLU 77 3.226 18.306 -6.491 684 H LYS 78 H LYS 78 2.804 18.752 -2.238 685 HA LYS 78 HA LYS 78 2.864 21.007 -0.630 686 1HB LYS 78 2HB LYS 78 2.527 18.118 0.237 687 2HB LYS 78 1HB LYS 78 2.192 19.509 1.268 688 1HG LYS 78 2HG LYS 78 0.541 20.289 -0.434 689 2HG LYS 78 1HG LYS 78 0.799 18.784 -1.304 690 1HD LYS 78 2HD LYS 78 -0.229 19.010 1.526 691 2HD LYS 78 1HD LYS 78 -1.233 18.779 0.101 692 1HE LYS 78 2HE LYS 78 -0.053 16.637 -0.320 693 2HE LYS 78 1HE LYS 78 0.846 16.876 1.181 694 1HZ LYS 78 1HZ LYS 78 -1.084 15.435 1.588 695 2HZ LYS 78 2HZ LYS 78 -2.111 16.573 0.940 696 3HZ LYS 78 3HZ LYS 78 -1.293 16.912 2.369 697 H LYS 79 H LYS 79 5.181 18.424 -0.807 698 HA LYS 79 HA LYS 79 7.007 19.930 0.945 699 1HB LYS 79 2HB LYS 79 7.279 17.178 -0.354 700 2HB LYS 79 1HB LYS 79 8.455 17.889 0.743 701 1HG LYS 79 2HG LYS 79 5.610 17.216 1.468 702 2HG LYS 79 1HG LYS 79 7.019 16.214 1.831 703 1HD LYS 79 2HD LYS 79 7.945 17.924 3.242 704 2HD LYS 79 1HD LYS 79 6.693 19.067 2.758 705 1HE LYS 79 2HE LYS 79 6.307 18.085 5.004 706 2HE LYS 79 1HE LYS 79 4.999 17.768 3.870 707 1HZ LYS 79 1HZ LYS 79 5.685 15.836 5.247 708 2HZ LYS 79 2HZ LYS 79 7.166 15.798 4.409 709 3HZ LYS 79 3HZ LYS 79 5.710 15.564 3.592 710 H LYS 80 H LYS 80 9.721 19.632 -0.823 711 HA LYS 80 HA LYS 80 8.495 19.823 -3.298 712 1HB LYS 80 2HB LYS 80 10.226 21.588 -3.800 713 2HB LYS 80 1HB LYS 80 8.929 22.093 -2.738 714 1HG LYS 80 2HG LYS 80 10.431 21.862 -0.810 715 2HG LYS 80 1HG LYS 80 11.732 21.355 -1.897 716 1HD LYS 80 2HD LYS 80 11.566 23.488 -3.082 717 2HD LYS 80 1HD LYS 80 10.276 23.989 -1.991 718 1HE LYS 80 2HE LYS 80 11.813 23.891 -0.109 719 2HE LYS 80 1HE LYS 80 13.104 23.339 -1.178 720 1HZ LYS 80 1HZ LYS 80 11.683 25.922 -1.433 721 2HZ LYS 80 2HZ LYS 80 12.983 25.437 -2.372 722 3HZ LYS 80 3HZ LYS 80 13.195 25.741 -0.706 723 H ILE 81 H ILE 81 8.965 17.652 -3.369 724 HA ILE 81 HA ILE 81 11.795 17.114 -3.968 725 HB ILE 81 HB ILE 81 9.715 15.139 -2.952 726 1HG1 ILE 81 2HG1 ILE 81 12.122 16.310 -1.527 727 2HG1 ILE 81 1HG1 ILE 81 10.451 16.761 -1.225 728 1HG2 ILE 81 1HG2 ILE 81 11.348 14.079 -4.418 729 2HG2 ILE 81 2HG2 ILE 81 11.622 13.581 -2.749 730 3HG2 ILE 81 3HG2 ILE 81 12.670 14.790 -3.493 731 1HD1 ILE 81 1HD1 ILE 81 11.285 15.241 0.477 732 2HD1 ILE 81 2HD1 ILE 81 11.661 14.041 -0.762 733 3HD1 ILE 81 3HD1 ILE 81 9.987 14.488 -0.447 734 H SER 82 H SER 82 12.218 16.448 -5.987 735 HA SER 82 HA SER 82 9.966 16.128 -7.784 736 1HB SER 82 2HB SER 82 12.893 16.648 -8.332 737 2HB SER 82 1HB SER 82 11.595 16.654 -9.526 738 HG SER 82 HG SER 82 12.333 18.495 -7.647 739 H GLN 83 H GLN 83 10.901 14.673 -9.783 740 HA GLN 83 HA GLN 83 10.683 12.072 -8.789 741 1HB GLN 83 2HB GLN 83 11.088 11.331 -11.147 742 2HB GLN 83 1HB GLN 83 9.779 12.480 -10.931 743 1HG GLN 83 2HG GLN 83 11.158 14.267 -11.763 744 2HG GLN 83 1HG GLN 83 12.548 13.192 -11.861 745 1HE2 GLN 83 1HE2 GLN 83 9.447 13.988 -13.234 746 2HE2 GLN 83 2HE2 GLN 83 9.696 13.189 -14.740 747 H SER 84 H SER 84 13.680 13.763 -9.936 748 HA SER 84 HA SER 84 15.137 11.370 -9.974 749 1HB SER 84 2HB SER 84 16.102 14.220 -9.866 750 2HB SER 84 1HB SER 84 17.082 12.810 -10.277 751 HG SER 84 HG SER 84 16.391 13.756 -12.133 752 H GLU 85 H GLU 85 14.681 13.815 -7.431 753 HA GLU 85 HA GLU 85 16.632 12.776 -5.725 754 1HB GLU 85 2HB GLU 85 14.039 14.060 -4.847 755 2HB GLU 85 1HB GLU 85 15.478 13.855 -3.867 756 1HG GLU 85 2HG GLU 85 15.619 16.052 -4.461 757 2HG GLU 85 1HG GLU 85 16.607 15.291 -5.708 758 H LEU 86 H LEU 86 13.248 11.937 -6.137 759 HA LEU 86 HA LEU 86 13.264 9.965 -4.123 760 1HB LEU 86 2HB LEU 86 11.448 10.361 -6.485 761 2HB LEU 86 1HB LEU 86 11.223 9.076 -5.312 762 HG LEU 86 HG LEU 86 11.135 12.033 -4.722 763 1HD1 LEU 86 1HD1 LEU 86 9.204 11.240 -5.979 764 2HD1 LEU 86 2HD1 LEU 86 8.766 11.633 -4.316 765 3HD1 LEU 86 3HD1 LEU 86 8.962 9.949 -4.804 766 1HD2 LEU 86 1HD2 LEU 86 10.652 9.651 -2.929 767 2HD2 LEU 86 2HD2 LEU 86 10.406 11.339 -2.488 768 3HD2 LEU 86 3HD2 LEU 86 12.028 10.749 -2.844 769 H ALA 87 H ALA 87 13.955 9.888 -7.556 770 HA ALA 87 HA ALA 87 14.199 7.122 -7.855 771 1HB ALA 87 1HB ALA 87 14.235 8.702 -9.750 772 2HB ALA 87 2HB ALA 87 15.631 7.624 -9.780 773 3HB ALA 87 3HB ALA 87 15.815 9.285 -9.224 774 H ALA 88 H ALA 88 16.660 9.563 -6.947 775 HA ALA 88 HA ALA 88 18.742 7.810 -6.471 776 1HB ALA 88 1HB ALA 88 18.162 10.456 -5.151 777 2HB ALA 88 2HB ALA 88 18.976 10.235 -6.699 778 3HB ALA 88 3HB ALA 88 19.726 9.644 -5.217 779 H LEU 89 H LEU 89 16.273 9.051 -4.228 780 HA LEU 89 HA LEU 89 17.378 7.823 -1.921 781 1HB LEU 89 2HB LEU 89 14.583 8.789 -2.452 782 2HB LEU 89 1HB LEU 89 15.147 8.235 -0.894 783 HG LEU 89 HG LEU 89 16.254 10.623 -2.372 784 1HD1 LEU 89 1HD1 LEU 89 13.947 10.977 -1.676 785 2HD1 LEU 89 2HD1 LEU 89 15.056 11.934 -0.691 786 3HD1 LEU 89 3HD1 LEU 89 14.349 10.454 -0.042 787 1HD2 LEU 89 1HD2 LEU 89 17.343 11.122 -0.248 788 2HD2 LEU 89 2HD2 LEU 89 17.858 9.543 -0.854 789 3HD2 LEU 89 3HD2 LEU 89 16.675 9.647 0.450 790 H LEU 90 H LEU 90 14.848 6.722 -4.186 791 HA LEU 90 HA LEU 90 14.211 4.488 -2.456 792 1HB LEU 90 2HB LEU 90 13.114 5.139 -5.169 793 2HB LEU 90 1HB LEU 90 12.420 4.076 -3.966 794 HG LEU 90 HG LEU 90 12.641 7.075 -3.789 795 1HD1 LEU 90 1HD1 LEU 90 10.989 6.356 -5.365 796 2HD1 LEU 90 2HD1 LEU 90 10.215 7.023 -3.928 797 3HD1 LEU 90 3HD1 LEU 90 10.276 5.278 -4.169 798 1HD2 LEU 90 1HD2 LEU 90 12.861 6.068 -1.578 799 2HD2 LEU 90 2HD2 LEU 90 11.394 5.128 -1.852 800 3HD2 LEU 90 3HD2 LEU 90 11.309 6.886 -1.748 801 H GLU 91 H GLU 91 16.493 5.038 -4.772 802 HA GLU 91 HA GLU 91 17.855 3.752 -6.050 803 1HB GLU 91 2HB GLU 91 16.725 1.559 -4.313 804 2HB GLU 91 1HB GLU 91 17.943 1.252 -5.545 805 1HG GLU 91 2HG GLU 91 18.221 3.104 -3.202 806 2HG GLU 91 1HG GLU 91 18.944 1.499 -3.360 807 H VAL 92 H VAL 92 15.313 4.480 -7.056 808 HA VAL 92 HA VAL 92 14.826 2.247 -8.850 809 HB VAL 92 HB VAL 92 12.590 3.213 -9.253 810 1HG1 VAL 92 1HG1 VAL 92 13.127 2.703 -6.337 811 2HG1 VAL 92 2HG1 VAL 92 12.782 1.493 -7.573 812 3HG1 VAL 92 3HG1 VAL 92 11.542 2.659 -7.109 813 1HG2 VAL 92 1HG2 VAL 92 13.064 5.565 -8.761 814 2HG2 VAL 92 2HG2 VAL 92 13.276 5.177 -7.055 815 3HG2 VAL 92 3HG2 VAL 92 11.693 4.994 -7.809 816 H SER 93 H SER 93 14.416 2.950 -11.057 817 HA SER 93 HA SER 93 16.195 5.107 -11.713 818 1HB SER 93 2HB SER 93 14.572 3.284 -13.494 819 2HB SER 93 1HB SER 93 15.885 4.345 -14.012 820 HG SER 93 HG SER 93 16.713 2.768 -11.950 821 H ARG 94 H ARG 94 15.469 6.718 -13.391 822 HA ARG 94 HA ARG 94 13.352 8.219 -12.314 823 1HB ARG 94 2HB ARG 94 14.762 8.591 -14.960 824 2HB ARG 94 1HB ARG 94 13.711 9.782 -14.200 825 1HG ARG 94 2HG ARG 94 15.227 9.913 -12.284 826 2HG ARG 94 1HG ARG 94 16.280 8.715 -13.037 827 1HD ARG 94 2HD ARG 94 17.207 10.878 -13.430 828 2HD ARG 94 1HD ARG 94 16.553 10.280 -14.955 829 HE ARG 94 HE ARG 94 15.173 12.212 -13.227 830 1HH1 ARG 94 1HH1 ARG 94 16.190 11.157 -16.468 831 2HH1 ARG 94 2HH1 ARG 94 15.403 12.467 -17.251 832 1HH2 ARG 94 1HH2 ARG 94 14.155 14.019 -14.376 833 2HH2 ARG 94 2HH2 ARG 94 14.256 14.047 -16.093 834 H GLN 95 H GLN 95 13.454 6.077 -15.085 835 HA GLN 95 HA GLN 95 10.926 6.600 -16.181 836 1HB GLN 95 2HB GLN 95 12.513 5.167 -17.322 837 2HB GLN 95 1HB GLN 95 12.484 4.012 -16.004 838 1HG GLN 95 2HG GLN 95 11.234 3.125 -17.842 839 2HG GLN 95 1HG GLN 95 10.116 3.522 -16.541 840 1HE2 GLN 95 1HE2 GLN 95 8.665 5.237 -16.839 841 2HE2 GLN 95 2HE2 GLN 95 8.355 5.888 -18.415 842 H THR 96 H THR 96 11.872 4.750 -13.362 843 HA THR 96 HA THR 96 9.457 3.346 -13.008 844 HB THR 96 HB THR 96 11.535 4.060 -10.930 845 HG1 THR 96 1HG THR 96 12.465 1.997 -11.653 846 1HG2 THR 96 1HG2 THR 96 9.695 1.674 -11.239 847 2HG2 THR 96 2HG2 THR 96 9.485 2.988 -10.082 848 3HG2 THR 96 3HG2 THR 96 10.875 1.909 -9.947 849 H ILE 97 H ILE 97 10.846 6.248 -11.379 850 HA ILE 97 HA ILE 97 8.531 6.675 -9.823 851 HB ILE 97 HB ILE 97 10.615 7.548 -9.004 852 1HG1 ILE 97 2HG1 ILE 97 10.067 9.936 -8.527 853 2HG1 ILE 97 1HG1 ILE 97 8.781 9.845 -9.722 854 1HG2 ILE 97 1HG2 ILE 97 11.842 9.387 -10.042 855 2HG2 ILE 97 2HG2 ILE 97 10.759 9.299 -11.430 856 3HG2 ILE 97 3HG2 ILE 97 11.800 7.930 -11.036 857 1HD1 ILE 97 1HD1 ILE 97 8.956 8.221 -7.193 858 2HD1 ILE 97 2HD1 ILE 97 7.659 8.139 -8.387 859 3HD1 ILE 97 3HD1 ILE 97 7.917 9.618 -7.464 860 H ASN 98 H ASN 98 9.569 8.045 -12.895 861 HA ASN 98 HA ASN 98 7.520 9.908 -13.331 862 1HB ASN 98 2HB ASN 98 9.482 9.900 -14.713 863 2HB ASN 98 1HB ASN 98 9.252 8.220 -15.145 864 1HD2 ASN 98 1HD2 ASN 98 9.470 8.771 -17.303 865 2HD2 ASN 98 2HD2 ASN 98 8.207 9.551 -18.186 866 H GLY 99 H GLY 99 7.756 6.484 -13.938 867 1HA GLY 99 2HA GLY 99 5.292 6.135 -15.264 868 2HA GLY 99 1HA GLY 99 6.235 4.889 -14.451 869 H ILE 100 H ILE 100 6.184 6.037 -11.822 870 HA ILE 100 HA ILE 100 3.690 5.063 -10.917 871 HB ILE 100 HB ILE 100 5.833 6.580 -9.387 872 1HG1 ILE 100 2HG1 ILE 100 6.688 4.484 -10.287 873 2HG1 ILE 100 1HG1 ILE 100 6.518 4.362 -8.542 874 1HG2 ILE 100 1HG2 ILE 100 3.715 6.728 -8.206 875 2HG2 ILE 100 2HG2 ILE 100 4.822 5.659 -7.341 876 3HG2 ILE 100 3HG2 ILE 100 3.515 4.978 -8.309 877 1HD1 ILE 100 1HD1 ILE 100 5.823 2.317 -9.646 878 2HD1 ILE 100 2HD1 ILE 100 4.639 3.214 -10.599 879 3HD1 ILE 100 3HD1 ILE 100 4.449 3.087 -8.851 880 H GLU 101 H GLU 101 5.021 8.350 -11.215 881 HA GLU 101 HA GLU 101 3.037 9.831 -10.022 882 1HB GLU 101 2HB GLU 101 4.441 10.529 -12.586 883 2HB GLU 101 1HB GLU 101 3.559 11.651 -11.571 884 1HG GLU 101 2HG GLU 101 5.190 11.174 -9.762 885 2HG GLU 101 1HG GLU 101 6.109 10.214 -10.933 886 H LYS 102 H LYS 102 3.005 8.461 -13.199 887 HA LYS 102 HA LYS 102 0.322 9.553 -13.660 888 1HB LYS 102 2HB LYS 102 2.255 8.308 -15.592 889 2HB LYS 102 1HB LYS 102 0.663 8.932 -16.009 890 1HG LYS 102 2HG LYS 102 1.331 11.157 -15.299 891 2HG LYS 102 1HG LYS 102 2.921 10.539 -14.847 892 1HD LYS 102 2HD LYS 102 3.267 9.823 -17.131 893 2HD LYS 102 1HD LYS 102 1.722 10.536 -17.599 894 1HE LYS 102 2HE LYS 102 2.507 12.742 -16.905 895 2HE LYS 102 1HE LYS 102 4.041 12.040 -16.386 896 1HZ LYS 102 1HZ LYS 102 4.263 13.041 -18.563 897 2HZ LYS 102 2HZ LYS 102 3.021 12.049 -19.183 898 3HZ LYS 102 3HZ LYS 102 4.456 11.370 -18.650 899 H ASN 103 H ASN 103 1.410 7.022 -12.171 900 HA ASN 103 HA ASN 103 0.967 4.829 -11.826 901 1HB ASN 103 2HB ASN 103 -1.345 4.255 -11.415 902 2HB ASN 103 1HB ASN 103 -1.170 5.951 -11.020 903 1HD2 ASN 103 1HD2 ASN 103 -2.707 3.627 -13.054 904 2HD2 ASN 103 2HD2 ASN 103 -3.757 4.723 -13.875 905 H LYS 104 H LYS 104 1.995 5.200 -14.363 906 HA LYS 104 HA LYS 104 0.273 3.785 -16.255 907 1HB LYS 104 2HB LYS 104 1.131 5.963 -16.948 908 2HB LYS 104 1HB LYS 104 2.768 5.471 -16.570 909 1HG LYS 104 2HG LYS 104 2.336 5.509 -18.966 910 2HG LYS 104 1HG LYS 104 2.740 3.890 -18.398 911 1HD LYS 104 2HD LYS 104 0.397 3.268 -18.433 912 2HD LYS 104 1HD LYS 104 -0.053 4.908 -18.914 913 1HE LYS 104 2HE LYS 104 -0.008 3.359 -20.819 914 2HE LYS 104 1HE LYS 104 1.156 4.669 -20.988 915 1HZ LYS 104 1HZ LYS 104 2.114 2.570 -21.641 916 2HZ LYS 104 2HZ LYS 104 1.798 1.890 -20.120 917 3HZ LYS 104 3HZ LYS 104 2.904 3.154 -20.282 918 H TYR 105 H TYR 105 3.040 3.600 -14.294 919 HA TYR 105 HA TYR 105 4.234 1.317 -15.638 920 1HB TYR 105 2HB TYR 105 5.413 3.347 -14.709 921 2HB TYR 105 1HB TYR 105 5.007 2.761 -13.105 922 HD1 TYR 105 1HD TYR 105 6.754 1.934 -16.189 923 HD2 TYR 105 2HD TYR 105 6.469 1.252 -12.035 924 HE1 TYR 105 1HE TYR 105 8.900 0.680 -16.263 925 HE2 TYR 105 2HE TYR 105 8.583 -0.003 -12.064 926 HH TYR 105 HH TYR 105 10.069 -1.080 -13.478 927 H ASN 106 H ASN 106 1.673 1.782 -13.765 928 HA ASN 106 HA ASN 106 0.453 0.785 -12.179 929 1HB ASN 106 2HB ASN 106 0.784 -1.361 -13.365 930 2HB ASN 106 1HB ASN 106 2.326 -1.592 -12.543 931 1HD2 ASN 106 1HD2 ASN 106 2.316 -2.166 -10.355 932 2HD2 ASN 106 2HD2 ASN 106 0.908 -2.742 -9.535 933 HA PRO 107 HA PRO 107 2.903 2.142 -8.788 934 1HB PRO 107 2HB PRO 107 0.465 2.023 -7.181 935 2HB PRO 107 1HB PRO 107 1.408 3.436 -7.669 936 1HG PRO 107 2HG PRO 107 -1.064 2.893 -8.663 937 2HG PRO 107 1HG PRO 107 0.181 3.762 -9.576 938 1HD PRO 107 2HD PRO 107 -0.661 0.896 -9.769 939 2HD PRO 107 1HD PRO 107 -0.226 2.033 -11.062 940 H SER 108 H SER 108 3.989 0.103 -8.701 941 HA SER 108 HA SER 108 3.123 -2.110 -7.257 942 1HB SER 108 2HB SER 108 5.933 -0.978 -7.410 943 2HB SER 108 1HB SER 108 5.486 -2.659 -7.117 944 HG SER 108 HG SER 108 4.624 -2.753 -9.211 945 H LEU 109 H LEU 109 3.139 -2.510 -5.042 946 HA LEU 109 HA LEU 109 2.633 -0.169 -3.582 947 1HB LEU 109 2HB LEU 109 1.341 -2.223 -3.234 948 2HB LEU 109 1HB LEU 109 2.756 -3.021 -2.600 949 HG LEU 109 HG LEU 109 0.948 -2.233 -0.953 950 1HD1 LEU 109 1HD1 LEU 109 3.806 -1.461 -0.454 951 2HD1 LEU 109 2HD1 LEU 109 3.085 -3.053 -0.209 952 3HD1 LEU 109 3HD1 LEU 109 2.569 -1.688 0.782 953 1HD2 LEU 109 1HD2 LEU 109 1.160 0.110 -0.132 954 2HD2 LEU 109 2HD2 LEU 109 0.604 0.056 -1.785 955 3HD2 LEU 109 3HD2 LEU 109 2.283 0.458 -1.445 956 H GLN 110 H GLN 110 5.438 -2.445 -3.484 957 HA GLN 110 HA GLN 110 6.693 -1.369 -1.277 958 1HB GLN 110 2HB GLN 110 7.409 -3.413 -2.416 959 2HB GLN 110 1HB GLN 110 7.846 -2.492 -3.842 960 1HG GLN 110 2HG GLN 110 9.829 -3.117 -2.629 961 2HG GLN 110 1HG GLN 110 9.617 -1.371 -2.553 962 1HE2 GLN 110 1HE2 GLN 110 9.623 -4.336 -0.777 963 2HE2 GLN 110 2HE2 GLN 110 9.579 -3.630 0.799 964 H LEU 111 H LEU 111 6.871 -0.376 -4.647 965 HA LEU 111 HA LEU 111 8.752 1.697 -4.396 966 1HB LEU 111 2HB LEU 111 6.477 1.522 -6.372 967 2HB LEU 111 1HB LEU 111 7.916 2.504 -6.539 968 HG LEU 111 HG LEU 111 7.811 -0.511 -6.570 969 1HD1 LEU 111 1HD1 LEU 111 8.463 -0.272 -8.905 970 2HD1 LEU 111 2HD1 LEU 111 8.359 1.482 -8.754 971 3HD1 LEU 111 3HD1 LEU 111 6.907 0.494 -8.580 972 1HD2 LEU 111 1HD2 LEU 111 9.883 0.293 -5.560 973 2HD2 LEU 111 2HD2 LEU 111 10.152 1.355 -6.944 974 3HD2 LEU 111 3HD2 LEU 111 10.181 -0.395 -7.155 975 H ALA 112 H ALA 112 5.293 1.736 -4.319 976 HA ALA 112 HA ALA 112 4.965 4.570 -4.030 977 1HB ALA 112 1HB ALA 112 3.160 3.155 -4.903 978 2HB ALA 112 2HB ALA 112 2.623 4.092 -3.507 979 3HB ALA 112 3HB ALA 112 3.008 2.381 -3.325 980 H LEU 113 H LEU 113 5.200 1.894 -1.806 981 HA LEU 113 HA LEU 113 4.335 3.014 0.578 982 1HB LEU 113 2HB LEU 113 4.909 0.626 -0.292 983 2HB LEU 113 1HB LEU 113 6.498 1.000 0.329 984 HG LEU 113 HG LEU 113 5.517 1.343 2.548 985 1HD1 LEU 113 1HD1 LEU 113 3.193 0.651 2.897 986 2HD1 LEU 113 2HD1 LEU 113 3.004 0.394 1.160 987 3HD1 LEU 113 3HD1 LEU 113 3.283 2.020 1.788 988 1HD2 LEU 113 1HD2 LEU 113 4.880 -1.288 1.213 989 2HD2 LEU 113 2HD2 LEU 113 5.074 -1.025 2.949 990 3HD2 LEU 113 3HD2 LEU 113 6.450 -0.816 1.866 991 H LYS 114 H LYS 114 7.505 2.656 -0.879 992 HA LYS 114 HA LYS 114 8.755 3.931 1.311 993 1HB LYS 114 2HB LYS 114 10.887 3.949 -0.034 994 2HB LYS 114 1HB LYS 114 10.175 2.379 0.267 995 1HG LYS 114 2HG LYS 114 9.264 2.406 -2.033 996 2HG LYS 114 1HG LYS 114 10.105 3.937 -2.304 997 1HD LYS 114 2HD LYS 114 11.436 2.087 -3.163 998 2HD LYS 114 1HD LYS 114 12.246 2.834 -1.785 999 1HE LYS 114 2HE LYS 114 11.370 1.041 -0.329 1000 2HE LYS 114 1HE LYS 114 10.617 0.287 -1.732 1001 1HZ LYS 114 1HZ LYS 114 12.869 0.109 -2.706 1002 2HZ LYS 114 2HZ LYS 114 12.669 -0.814 -1.322 1003 3HZ LYS 114 3HZ LYS 114 13.534 0.635 -1.240 1004 H ILE 115 H ILE 115 7.617 5.129 -1.723 1005 HA ILE 115 HA ILE 115 8.590 7.774 -1.527 1006 HB ILE 115 HB ILE 115 5.840 6.934 -2.537 1007 1HG1 ILE 115 2HG1 ILE 115 8.400 7.338 -4.100 1008 2HG1 ILE 115 1HG1 ILE 115 7.708 5.777 -3.684 1009 1HG2 ILE 115 1HG2 ILE 115 5.982 9.334 -2.109 1010 2HG2 ILE 115 2HG2 ILE 115 5.894 9.017 -3.843 1011 3HG2 ILE 115 3HG2 ILE 115 7.438 9.437 -3.101 1012 1HD1 ILE 115 1HD1 ILE 115 6.430 7.857 -5.447 1013 2HD1 ILE 115 2HD1 ILE 115 5.742 6.287 -5.037 1014 3HD1 ILE 115 3HD1 ILE 115 7.225 6.379 -5.986 1015 H ALA 116 H ALA 116 5.805 6.201 -0.126 1016 HA ALA 116 HA ALA 116 4.534 8.415 1.110 1017 1HB ALA 116 1HB ALA 116 3.394 6.738 2.462 1018 2HB ALA 116 2HB ALA 116 4.583 5.542 1.939 1019 3HB ALA 116 3HB ALA 116 3.458 6.234 0.762 1020 H TYR 117 H TYR 117 6.940 6.137 2.143 1021 HA TYR 117 HA TYR 117 7.140 6.976 4.813 1022 1HB TYR 117 2HB TYR 117 7.758 4.768 4.180 1023 2HB TYR 117 1HB TYR 117 8.897 5.358 2.986 1024 HD1 TYR 117 1HD TYR 117 11.046 5.589 3.500 1025 HD2 TYR 117 2HD TYR 117 8.272 5.260 6.654 1026 HE1 TYR 117 1HE TYR 117 12.936 5.372 5.117 1027 HE2 TYR 117 2HE TYR 117 10.097 5.042 8.284 1028 HH TYR 117 HH TYR 117 13.479 5.364 7.282 1029 H TYR 118 H TYR 118 9.142 7.717 1.927 1030 HA TYR 118 HA TYR 118 10.859 9.435 3.428 1031 1HB TYR 118 2HB TYR 118 10.626 8.913 0.481 1032 2HB TYR 118 1HB TYR 118 11.688 10.173 1.110 1033 HD1 TYR 118 1HD TYR 118 13.679 9.621 2.335 1034 HD2 TYR 118 2HD TYR 118 11.111 6.553 0.924 1035 HE1 TYR 118 1HE TYR 118 15.421 7.958 2.790 1036 HE2 TYR 118 2HE TYR 118 12.845 4.880 1.370 1037 HH TYR 118 HH TYR 118 15.619 5.602 3.212 1038 H LEU 119 H LEU 119 8.053 9.972 1.627 1039 HA LEU 119 HA LEU 119 8.242 12.882 1.882 1040 1HB LEU 119 2HB LEU 119 6.125 11.084 0.754 1041 2HB LEU 119 1HB LEU 119 5.700 12.722 1.182 1042 1HD1 LEU 119 1HD2 LEU 119 8.075 14.250 0.195 1043 2HD1 LEU 119 2HD2 LEU 119 6.403 14.598 -0.243 1044 3HD1 LEU 119 3HD2 LEU 119 7.614 14.355 -1.504 1045 1HD2 LEU 119 1HD1 LEU 119 7.877 10.723 -1.148 1046 2HD2 LEU 119 2HD1 LEU 119 8.994 11.854 -0.386 1047 3HD2 LEU 119 3HD1 LEU 119 8.439 12.140 -2.035 1048 H ASN 120 H ASN 120 7.490 10.416 3.861 1049 HA ASN 120 HA ASN 120 6.300 10.006 5.706 1050 1HB ASN 120 2HB ASN 120 8.054 11.521 6.601 1051 2HB ASN 120 1HB ASN 120 7.001 12.899 6.324 1052 1HD2 ASN 120 1HD2 ASN 120 5.402 13.353 7.819 1053 2HD2 ASN 120 2HD2 ASN 120 5.224 12.465 9.293 1054 H THR 121 H THR 121 4.458 9.741 4.363 1055 HA THR 121 HA THR 121 2.296 11.475 5.201 1056 HB THR 121 HB THR 121 2.861 10.794 2.294 1057 HG1 THR 121 1HG THR 121 3.870 12.682 3.832 1058 1HG2 THR 121 1HG2 THR 121 0.481 11.039 2.845 1059 2HG2 THR 121 2HG2 THR 121 1.044 12.365 1.827 1060 3HG2 THR 121 3HG2 THR 121 0.809 12.618 3.557 1061 HA PRO 122 HA PRO 122 0.514 7.336 5.536 1062 1HB PRO 122 2HB PRO 122 -2.036 8.850 5.377 1063 2HB PRO 122 1HB PRO 122 -1.485 7.719 6.618 1064 1HG PRO 122 2HG PRO 122 -1.565 10.339 7.101 1065 2HG PRO 122 1HG PRO 122 -0.246 9.333 7.727 1066 1HD PRO 122 2HD PRO 122 -0.270 11.187 5.386 1067 2HD PRO 122 1HD PRO 122 1.004 10.910 6.594 1068 H LEU 123 H LEU 123 -0.191 5.964 4.021 1069 HA LEU 123 HA LEU 123 -0.248 6.644 1.321 1070 1HB LEU 123 2HB LEU 123 -1.326 4.219 2.713 1071 2HB LEU 123 1HB LEU 123 -1.603 4.434 1.003 1072 1HD1 LEU 123 1HD1 LEU 123 1.220 5.636 0.382 1073 2HD1 LEU 123 2HD1 LEU 123 0.405 4.410 -0.585 1074 3HD1 LEU 123 3HD1 LEU 123 2.010 4.090 0.071 1075 1HD2 LEU 123 1HD2 LEU 123 0.950 3.549 3.535 1076 2HD2 LEU 123 2HD2 LEU 123 1.562 5.097 2.956 1077 3HD2 LEU 123 3HD2 LEU 123 2.320 3.594 2.426 1078 H GLU 124 H GLU 124 -2.930 6.581 3.570 1079 HA GLU 124 HA GLU 124 -5.098 6.822 1.905 1080 1HB GLU 124 2HB GLU 124 -4.650 8.250 4.513 1081 2HB GLU 124 1HB GLU 124 -6.195 7.866 3.773 1082 1HG GLU 124 2HG GLU 124 -5.778 5.504 4.092 1083 2HG GLU 124 1HG GLU 124 -4.192 5.863 4.777 1084 H ASP 125 H ASP 125 -2.768 9.349 2.937 1085 HA ASP 125 HA ASP 125 -4.380 11.455 1.906 1086 1HB ASP 125 2HB ASP 125 -2.781 11.825 3.780 1087 2HB ASP 125 1HB ASP 125 -1.448 11.511 2.676 1088 H ILE 126 H ILE 126 -1.796 9.505 0.805 1089 HA ILE 126 HA ILE 126 -1.202 11.050 -1.550 1090 HB ILE 126 HB ILE 126 -0.369 8.194 -0.936 1091 1HG1 ILE 126 2HG1 ILE 126 1.100 10.812 -0.521 1092 2HG1 ILE 126 1HG1 ILE 126 0.425 9.802 0.750 1093 1HG2 ILE 126 1HG2 ILE 126 1.381 8.599 -2.625 1094 2HG2 ILE 126 2HG2 ILE 126 0.693 10.186 -2.955 1095 3HG2 ILE 126 3HG2 ILE 126 -0.233 8.731 -3.323 1096 1HD1 ILE 126 1HD1 ILE 126 2.658 9.047 -1.115 1097 2HD1 ILE 126 2HD1 ILE 126 1.993 8.027 0.160 1098 3HD1 ILE 126 3HD1 ILE 126 2.825 9.524 0.575 1099 H PHE 127 H PHE 127 -2.739 7.896 -1.024 1100 HA PHE 127 HA PHE 127 -3.997 8.247 -3.661 1101 1HB PHE 127 2HB PHE 127 -3.401 5.655 -2.157 1102 2HB PHE 127 1HB PHE 127 -4.286 5.775 -3.675 1103 HD1 PHE 127 1HD PHE 127 -3.061 6.510 -5.716 1104 HD2 PHE 127 2HD PHE 127 -1.085 5.648 -2.050 1105 HE1 PHE 127 1HE PHE 127 -0.933 6.258 -6.924 1106 HE2 PHE 127 2HE PHE 127 1.048 5.400 -3.249 1107 HZ PHE 127 HZ PHE 127 1.126 5.705 -5.690 1108 H GLN 128 H GLN 128 -6.128 8.155 -3.769 1109 HA GLN 128 HA GLN 128 -7.611 7.802 -1.253 1110 1HB GLN 128 2HB GLN 128 -7.801 10.025 -2.422 1111 2HB GLN 128 1HB GLN 128 -8.465 9.183 -3.811 1112 1HG GLN 128 2HG GLN 128 -10.394 8.508 -2.530 1113 2HG GLN 128 1HG GLN 128 -9.706 9.220 -1.070 1114 1HE2 GLN 128 1HE2 GLN 128 -11.289 9.881 -4.111 1115 2HE2 GLN 128 2HE2 GLN 128 -11.558 11.547 -3.778 1116 H TRP 129 H TRP 129 -8.846 6.016 -1.181 1117 HA TRP 129 HA TRP 129 -8.994 4.635 -3.715 1118 1HB TRP 129 2HB TRP 129 -8.829 2.502 -2.387 1119 2HB TRP 129 1HB TRP 129 -7.387 3.458 -2.654 1120 HD1 TRP 129 HD TRP 129 -9.964 2.823 0.228 1121 HE1 TRP 129 1HE TRP 129 -8.637 2.927 2.462 1122 HE3 TRP 129 3HE TRP 129 -5.387 4.160 -1.604 1123 HZ2 TRP 129 2HZ TRP 129 -6.008 3.492 3.293 1124 HZ3 TRP 129 3HZ TRP 129 -3.523 4.442 -0.040 1125 HH2 TRP 129 HH TRP 129 -3.809 4.115 2.333 1126 H GLN 130 H GLN 130 -10.725 4.005 -4.501 1127 HA GLN 130 HA GLN 130 -12.958 3.373 -2.737 1128 1HB GLN 130 2HB GLN 130 -13.039 4.385 -5.600 1129 2HB GLN 130 1HB GLN 130 -14.429 4.002 -4.600 1130 1HG GLN 130 2HG GLN 130 -12.469 6.235 -4.177 1131 2HG GLN 130 1HG GLN 130 -14.118 6.402 -4.763 1132 1HE2 GLN 130 1HE2 GLN 130 -12.928 7.621 -2.495 1133 2HE2 GLN 130 2HE2 GLN 130 -13.783 7.115 -1.089 1134 HA PRO 131 HA PRO 131 -11.724 -0.566 -4.731 1135 1HB PRO 131 2HB PRO 131 -13.606 -1.719 -2.782 1136 2HB PRO 131 1HB PRO 131 -11.866 -1.977 -2.929 1137 1HG PRO 131 2HG PRO 131 -12.896 -0.614 -0.872 1138 2HG PRO 131 1HG PRO 131 -11.348 -0.155 -1.605 1139 1HD PRO 131 2HD PRO 131 -14.072 1.029 -2.059 1140 2HD PRO 131 1HD PRO 131 -12.531 1.856 -1.726 1141 H GLU 132 H GLU 132 -13.437 0.893 -5.936 1142 HA GLU 132 HA GLU 132 -15.720 -0.777 -6.737 1143 1HB GLU 132 2HB GLU 132 -15.870 2.210 -6.278 1144 2HB GLU 132 1HB GLU 132 -17.171 1.196 -6.881 1145 1HG GLU 132 2HG GLU 132 -17.217 -0.010 -4.756 1146 2HG GLU 132 1HG GLU 132 -15.912 1.012 -4.152 Start of MODEL 14 1 1H MET 1 1HT MET 1 13.174 -4.550 4.353 2 2H MET 1 2HT MET 1 12.104 -3.308 4.796 3 3H MET 1 3HT MET 1 11.655 -4.408 3.617 4 HA MET 1 HA MET 1 11.675 -6.198 5.235 5 1HB MET 1 2HB MET 1 13.331 -5.290 6.806 6 2HB MET 1 1HB MET 1 12.261 -3.950 7.195 7 1HG MET 1 2HG MET 1 10.628 -5.579 8.119 8 2HG MET 1 1HG MET 1 11.780 -6.868 7.804 9 1HE MET 1 1HE MET 1 14.691 -5.951 10.285 10 2HE MET 1 2HE MET 1 14.548 -5.450 8.600 11 3HE MET 1 3HE MET 1 14.120 -7.095 9.070 12 H ILE 2 H ILE 2 9.688 -6.777 5.663 13 HA ILE 2 HA ILE 2 7.670 -4.674 6.057 14 HB ILE 2 HB ILE 2 7.388 -7.277 4.516 15 1HG1 ILE 2 2HG1 ILE 2 8.413 -5.487 3.221 16 2HG1 ILE 2 1HG1 ILE 2 6.794 -5.814 2.617 17 1HG2 ILE 2 1HG2 ILE 2 5.364 -6.962 5.816 18 2HG2 ILE 2 2HG2 ILE 2 5.037 -6.675 4.106 19 3HG2 ILE 2 3HG2 ILE 2 5.205 -5.311 5.215 20 1HD1 ILE 2 1HD1 ILE 2 5.963 -3.848 3.806 21 2HD1 ILE 2 2HD1 ILE 2 7.250 -3.438 2.675 22 3HD1 ILE 2 3HD1 ILE 2 7.590 -3.528 4.404 23 H ILE 3 H ILE 3 6.395 -4.892 7.795 24 HA ILE 3 HA ILE 3 6.689 -7.318 9.392 25 HB ILE 3 HB ILE 3 6.243 -4.422 10.253 26 1HG1 ILE 3 2HG1 ILE 3 8.561 -6.303 10.768 27 2HG1 ILE 3 1HG1 ILE 3 8.562 -4.977 9.615 28 1HG2 ILE 3 1HG2 ILE 3 6.282 -5.244 12.559 29 2HG2 ILE 3 2HG2 ILE 3 6.378 -6.903 11.969 30 3HG2 ILE 3 3HG2 ILE 3 4.935 -5.941 11.656 31 1HD1 ILE 3 1HD1 ILE 3 9.748 -4.393 11.652 32 2HD1 ILE 3 2HD1 ILE 3 8.299 -4.728 12.603 33 3HD1 ILE 3 3HD1 ILE 3 8.310 -3.390 11.456 34 H ASN 4 H ASN 4 4.665 -8.496 9.544 35 HA ASN 4 HA ASN 4 2.425 -7.207 8.295 36 1HB ASN 4 2HB ASN 4 3.423 -9.313 7.419 37 2HB ASN 4 1HB ASN 4 3.147 -10.066 8.973 38 1HD2 ASN 4 1HD2 ASN 4 2.255 -10.888 6.445 39 2HD2 ASN 4 2HD2 ASN 4 0.536 -10.918 6.441 40 H ASN 5 H ASN 5 0.739 -6.608 9.553 41 HA ASN 5 HA ASN 5 0.366 -7.969 12.122 42 1HB ASN 5 2HB ASN 5 -0.159 -5.057 11.461 43 2HB ASN 5 1HB ASN 5 -0.662 -5.852 12.938 44 1HD2 ASN 5 1HD2 ASN 5 0.950 -3.584 12.528 45 2HD2 ASN 5 2HD2 ASN 5 2.476 -3.870 13.307 46 H LEU 6 H LEU 6 -0.702 -8.139 9.156 47 HA LEU 6 HA LEU 6 -3.305 -7.166 9.026 48 1HB LEU 6 2HB LEU 6 -1.895 -7.991 7.125 49 2HB LEU 6 1HB LEU 6 -2.081 -9.618 7.710 50 HG LEU 6 HG LEU 6 -3.421 -9.041 5.683 51 1HD1 LEU 6 1HD1 LEU 6 -5.062 -9.885 8.054 52 2HD1 LEU 6 2HD1 LEU 6 -4.095 -10.939 7.022 53 3HD1 LEU 6 3HD1 LEU 6 -5.504 -10.106 6.361 54 1HD2 LEU 6 1HD2 LEU 6 -4.986 -7.323 7.595 55 2HD2 LEU 6 2HD2 LEU 6 -5.457 -7.713 5.941 56 3HD2 LEU 6 3HD2 LEU 6 -4.000 -6.764 6.243 57 H LYS 7 H LYS 7 -2.049 -10.270 10.063 58 HA LYS 7 HA LYS 7 -4.536 -11.388 10.733 59 1HB LYS 7 2HB LYS 7 -3.224 -13.028 12.081 60 2HB LYS 7 1HB LYS 7 -2.678 -12.862 10.420 61 1HG LYS 7 2HG LYS 7 -0.809 -11.503 11.139 62 2HG LYS 7 1HG LYS 7 -1.388 -11.547 12.805 63 1HD LYS 7 2HD LYS 7 -0.508 -13.938 11.181 64 2HD LYS 7 1HD LYS 7 0.441 -13.134 12.434 65 1HE LYS 7 2HE LYS 7 -1.328 -13.668 14.069 66 2HE LYS 7 1HE LYS 7 -2.199 -14.540 12.810 67 1HZ LYS 7 1HZ LYS 7 -0.940 -16.044 14.157 68 2HZ LYS 7 2HZ LYS 7 0.489 -15.176 13.857 69 3HZ LYS 7 3HZ LYS 7 -0.273 -16.014 12.598 70 H LEU 8 H LEU 8 -2.215 -9.505 12.699 71 HA LEU 8 HA LEU 8 -3.511 -9.777 15.141 72 1HB LEU 8 2HB LEU 8 -1.167 -8.975 14.754 73 2HB LEU 8 1HB LEU 8 -1.804 -7.481 14.129 74 HG LEU 8 HG LEU 8 -0.865 -7.360 16.449 75 1HD1 LEU 8 1HD1 LEU 8 -2.404 -5.642 15.712 76 2HD1 LEU 8 2HD1 LEU 8 -2.632 -5.999 17.425 77 3HD1 LEU 8 3HD1 LEU 8 -3.774 -6.625 16.233 78 1HD2 LEU 8 1HD2 LEU 8 -1.595 -9.515 17.277 79 2HD2 LEU 8 2HD2 LEU 8 -3.282 -9.016 17.156 80 3HD2 LEU 8 3HD2 LEU 8 -2.210 -8.224 18.312 81 H ILE 9 H ILE 9 -3.863 -7.322 12.604 82 HA ILE 9 HA ILE 9 -5.803 -5.800 13.955 83 HB ILE 9 HB ILE 9 -5.027 -5.965 11.040 84 1HG1 ILE 9 2HG1 ILE 9 -4.545 -3.568 11.328 85 2HG1 ILE 9 1HG1 ILE 9 -5.162 -3.638 12.967 86 1HG2 ILE 9 1HG2 ILE 9 -7.398 -4.392 12.038 87 2HG2 ILE 9 2HG2 ILE 9 -7.448 -5.761 10.938 88 3HG2 ILE 9 3HG2 ILE 9 -6.681 -4.252 10.430 89 1HD1 ILE 9 1HD1 ILE 9 -2.712 -5.035 11.925 90 2HD1 ILE 9 2HD1 ILE 9 -3.321 -5.122 13.578 91 3HD1 ILE 9 3HD1 ILE 9 -2.749 -3.584 12.927 92 H ARG 10 H ARG 10 -6.056 -8.571 11.939 93 HA ARG 10 HA ARG 10 -8.887 -8.701 11.850 94 1HB ARG 10 2HB ARG 10 -6.757 -10.751 11.501 95 2HB ARG 10 1HB ARG 10 -8.442 -11.231 11.612 96 1HG ARG 10 2HG ARG 10 -8.953 -9.832 9.685 97 2HG ARG 10 1HG ARG 10 -7.242 -9.386 9.575 98 1HD ARG 10 2HD ARG 10 -7.943 -11.252 8.069 99 2HD ARG 10 1HD ARG 10 -6.600 -11.622 9.152 100 HE ARG 10 HE ARG 10 -9.089 -12.369 10.318 101 1HH1 ARG 10 1HH1 ARG 10 -7.008 -13.361 7.709 102 2HH1 ARG 10 2HH1 ARG 10 -7.052 -15.011 7.997 103 1HH2 ARG 10 1HH2 ARG 10 -9.297 -14.665 10.809 104 2HH2 ARG 10 2HH2 ARG 10 -8.511 -15.800 9.818 105 H GLU 11 H GLU 11 -6.466 -9.942 14.249 106 HA GLU 11 HA GLU 11 -8.436 -11.210 15.734 107 1HB GLU 11 2HB GLU 11 -5.615 -10.426 16.472 108 2HB GLU 11 1HB GLU 11 -6.663 -11.480 17.422 109 1HG GLU 11 2HG GLU 11 -6.827 -12.868 15.242 110 2HG GLU 11 1HG GLU 11 -5.377 -11.990 14.773 111 H LYS 12 H LYS 12 -7.008 -8.032 15.862 112 HA LYS 12 HA LYS 12 -8.297 -7.036 18.080 113 1HB LYS 12 2HB LYS 12 -6.671 -5.713 16.894 114 2HB LYS 12 1HB LYS 12 -7.651 -5.704 15.442 115 1HG LYS 12 2HG LYS 12 -9.206 -4.190 16.409 116 2HG LYS 12 1HG LYS 12 -8.479 -4.373 18.007 117 1HD LYS 12 2HD LYS 12 -7.836 -2.253 16.880 118 2HD LYS 12 1HD LYS 12 -6.460 -3.278 17.274 119 1HE LYS 12 2HE LYS 12 -6.378 -4.045 14.936 120 2HE LYS 12 1HE LYS 12 -7.762 -3.020 14.553 121 1HZ LYS 12 1HZ LYS 12 -6.476 -1.077 15.032 122 2HZ LYS 12 2HZ LYS 12 -5.439 -2.003 14.048 123 3HZ LYS 12 3HZ LYS 12 -5.229 -1.973 15.672 124 H LYS 13 H LYS 13 -9.647 -7.662 14.932 125 HA LYS 13 HA LYS 13 -12.369 -7.050 15.886 126 1HB LYS 13 2HB LYS 13 -11.299 -7.805 13.129 127 2HB LYS 13 1HB LYS 13 -13.000 -7.541 13.476 128 1HG LYS 13 2HG LYS 13 -10.847 -5.461 13.809 129 2HG LYS 13 1HG LYS 13 -11.895 -5.608 12.395 130 1HD LYS 13 2HD LYS 13 -13.853 -5.196 13.762 131 2HD LYS 13 1HD LYS 13 -12.869 -5.186 15.223 132 1HE LYS 13 2HE LYS 13 -13.498 -2.919 14.457 133 2HE LYS 13 1HE LYS 13 -11.756 -3.170 14.513 134 1HZ LYS 13 1HZ LYS 13 -12.606 -1.993 12.510 135 2HZ LYS 13 2HZ LYS 13 -13.325 -3.436 11.983 136 3HZ LYS 13 3HZ LYS 13 -11.653 -3.323 12.194 137 H LYS 14 H LYS 14 -13.899 -9.559 14.617 138 HA LYS 14 HA LYS 14 -11.963 -11.497 15.033 139 1HB LYS 14 2HB LYS 14 -13.886 -12.796 16.166 140 2HB LYS 14 1HB LYS 14 -13.041 -11.593 17.128 141 1HG LYS 14 2HG LYS 14 -14.888 -10.001 16.622 142 2HG LYS 14 1HG LYS 14 -15.740 -11.329 15.832 143 1HD LYS 14 2HD LYS 14 -15.810 -12.570 17.898 144 2HD LYS 14 1HD LYS 14 -14.817 -11.352 18.703 145 1HE LYS 14 2HE LYS 14 -17.565 -10.896 17.546 146 2HE LYS 14 1HE LYS 14 -17.202 -11.127 19.254 147 1HZ LYS 14 1HZ LYS 14 -17.459 -8.782 18.637 148 2HZ LYS 14 2HZ LYS 14 -16.105 -8.869 17.621 149 3HZ LYS 14 3HZ LYS 14 -15.950 -9.099 19.272 150 H ILE 15 H ILE 15 -11.896 -11.224 12.826 151 HA ILE 15 HA ILE 15 -14.158 -12.443 11.402 152 HB ILE 15 HB ILE 15 -12.104 -10.528 10.229 153 1HG1 ILE 15 2HG1 ILE 15 -14.979 -9.969 11.009 154 2HG1 ILE 15 1HG1 ILE 15 -13.562 -9.373 11.864 155 1HG2 ILE 15 1HG2 ILE 15 -13.077 -12.086 8.614 156 2HG2 ILE 15 2HG2 ILE 15 -13.661 -10.449 8.318 157 3HG2 ILE 15 3HG2 ILE 15 -14.699 -11.623 9.124 158 1HD1 ILE 15 1HD1 ILE 15 -12.931 -8.072 9.890 159 2HD1 ILE 15 2HD1 ILE 15 -14.546 -7.654 10.460 160 3HD1 ILE 15 3HD1 ILE 15 -14.350 -8.684 9.040 161 H SER 16 H SER 16 -13.681 -14.252 10.234 162 HA SER 16 HA SER 16 -10.959 -15.175 10.391 163 1HB SER 16 2HB SER 16 -13.552 -16.586 9.731 164 2HB SER 16 1HB SER 16 -11.968 -17.367 9.806 165 HG SER 16 HG SER 16 -11.926 -16.284 11.981 166 H GLN 17 H GLN 17 -10.459 -16.594 8.306 167 HA GLN 17 HA GLN 17 -10.120 -14.544 6.398 168 1HB GLN 17 2HB GLN 17 -8.871 -16.186 5.027 169 2HB GLN 17 1HB GLN 17 -8.275 -15.992 6.662 170 1HG GLN 17 2HG GLN 17 -9.279 -18.082 7.307 171 2HG GLN 17 1HG GLN 17 -10.000 -18.253 5.704 172 1HE2 GLN 17 1HE2 GLN 17 -7.009 -18.274 7.509 173 2HE2 GLN 17 2HE2 GLN 17 -6.081 -19.057 6.304 174 H SER 18 H SER 18 -12.478 -17.177 6.577 175 HA SER 18 HA SER 18 -13.108 -17.255 3.892 176 1HB SER 18 2HB SER 18 -14.886 -17.770 6.266 177 2HB SER 18 1HB SER 18 -15.032 -18.448 4.642 178 HG SER 18 HG SER 18 -14.040 -19.744 6.347 179 H GLU 19 H GLU 19 -14.527 -15.361 6.616 180 HA GLU 19 HA GLU 19 -16.563 -14.141 5.150 181 1HB GLU 19 2HB GLU 19 -15.068 -12.880 7.470 182 2HB GLU 19 1HB GLU 19 -16.624 -12.375 6.853 183 1HG GLU 19 2HG GLU 19 -17.176 -13.534 8.756 184 2HG GLU 19 1HG GLU 19 -17.392 -14.751 7.501 185 H LEU 20 H LEU 20 -13.247 -13.172 5.718 186 HA LEU 20 HA LEU 20 -13.464 -10.742 4.291 187 1HB LEU 20 2HB LEU 20 -11.056 -12.372 5.037 188 2HB LEU 20 1HB LEU 20 -10.949 -10.842 4.194 189 HG LEU 20 HG LEU 20 -12.112 -11.248 6.950 190 1HD1 LEU 20 1HD1 LEU 20 -10.142 -10.009 7.684 191 2HD1 LEU 20 2HD1 LEU 20 -9.534 -10.004 6.027 192 3HD1 LEU 20 3HD1 LEU 20 -9.709 -11.526 6.901 193 1HD2 LEU 20 1HD2 LEU 20 -13.205 -9.420 5.747 194 2HD2 LEU 20 2HD2 LEU 20 -11.632 -8.722 5.361 195 3HD2 LEU 20 3HD2 LEU 20 -12.176 -8.802 7.039 196 H ALA 21 H ALA 21 -12.416 -13.984 3.338 197 HA ALA 21 HA ALA 21 -11.460 -13.327 0.799 198 1HB ALA 21 1HB ALA 21 -11.083 -15.505 1.867 199 2HB ALA 21 2HB ALA 21 -11.754 -15.678 0.246 200 3HB ALA 21 3HB ALA 21 -12.791 -15.895 1.658 201 H ALA 22 H ALA 22 -14.721 -14.415 1.790 202 HA ALA 22 HA ALA 22 -15.900 -14.278 -0.716 203 1HB ALA 22 1HB ALA 22 -16.857 -15.426 1.215 204 2HB ALA 22 2HB ALA 22 -18.001 -14.277 0.518 205 3HB ALA 22 3HB ALA 22 -17.134 -13.873 2.000 206 H LEU 23 H LEU 23 -15.592 -11.877 1.809 207 HA LEU 23 HA LEU 23 -17.176 -9.868 0.602 208 1HB LEU 23 2HB LEU 23 -16.643 -9.915 2.969 209 2HB LEU 23 1HB LEU 23 -14.951 -9.662 2.613 210 HG LEU 23 HG LEU 23 -15.472 -7.403 1.789 211 1HD1 LEU 23 1HD1 LEU 23 -18.282 -8.037 2.701 212 2HD1 LEU 23 2HD1 LEU 23 -17.768 -7.796 1.034 213 3HD1 LEU 23 3HD1 LEU 23 -17.697 -6.458 2.181 214 1HD2 LEU 23 1HD2 LEU 23 -14.823 -7.775 4.094 215 2HD2 LEU 23 2HD2 LEU 23 -16.509 -8.050 4.538 216 3HD2 LEU 23 3HD2 LEU 23 -15.992 -6.458 3.977 217 H LEU 24 H LEU 24 -13.741 -10.591 0.437 218 HA LEU 24 HA LEU 24 -13.134 -8.242 -1.135 219 1HB LEU 24 2HB LEU 24 -11.411 -10.601 -0.449 220 2HB LEU 24 1HB LEU 24 -10.867 -9.053 -1.066 221 HG LEU 24 HG LEU 24 -12.118 -9.561 1.616 222 1HD1 LEU 24 1HD1 LEU 24 -9.919 -9.041 2.494 223 2HD1 LEU 24 2HD1 LEU 24 -9.295 -8.921 0.849 224 3HD1 LEU 24 3HD1 LEU 24 -9.902 -10.463 1.453 225 1HD2 LEU 24 1HD2 LEU 24 -11.537 -7.246 2.112 226 2HD2 LEU 24 2HD2 LEU 24 -12.686 -7.357 0.779 227 3HD2 LEU 24 3HD2 LEU 24 -10.982 -7.030 0.454 228 H GLU 25 H GLU 25 -14.534 -11.100 -1.821 229 HA GLU 25 HA GLU 25 -15.047 -12.251 -3.710 230 1HB GLU 25 2HB GLU 25 -13.711 -9.929 -5.123 231 2HB GLU 25 1HB GLU 25 -14.760 -11.117 -5.876 232 1HG GLU 25 2HG GLU 25 -16.642 -10.325 -4.584 233 2HG GLU 25 1HG GLU 25 -15.596 -9.211 -3.704 234 H VAL 26 H VAL 26 -12.573 -12.855 -2.323 235 HA VAL 26 HA VAL 26 -10.947 -13.814 -4.544 236 HB VAL 26 HB VAL 26 -8.925 -13.579 -3.144 237 1HG1 VAL 26 1HG1 VAL 26 -8.650 -11.147 -3.291 238 2HG1 VAL 26 2HG1 VAL 26 -10.386 -10.986 -3.566 239 3HG1 VAL 26 3HG1 VAL 26 -9.384 -11.838 -4.738 240 1HG2 VAL 26 1HG2 VAL 26 -10.723 -12.101 -1.219 241 2HG2 VAL 26 2HG2 VAL 26 -8.963 -12.174 -1.110 242 3HG2 VAL 26 3HG2 VAL 26 -9.920 -13.644 -0.931 243 H SER 27 H SER 27 -9.460 -15.589 -3.660 244 HA SER 27 HA SER 27 -11.146 -17.484 -2.281 245 1HB SER 27 2HB SER 27 -8.470 -17.787 -3.666 246 2HB SER 27 1HB SER 27 -9.441 -19.111 -3.011 247 HG SER 27 HG SER 27 -11.099 -18.469 -4.387 248 H ARG 28 H ARG 28 -10.426 -18.642 -0.492 249 HA ARG 28 HA ARG 28 -9.252 -17.205 1.570 250 1HB ARG 28 2HB ARG 28 -9.893 -20.093 1.211 251 2HB ARG 28 1HB ARG 28 -9.024 -19.551 2.641 252 1HG ARG 28 2HG ARG 28 -10.829 -18.102 3.257 253 2HG ARG 28 1HG ARG 28 -11.671 -18.453 1.746 254 1HD ARG 28 2HD ARG 28 -10.938 -20.603 3.693 255 2HD ARG 28 1HD ARG 28 -12.430 -19.678 3.852 256 HE ARG 28 HE ARG 28 -12.756 -20.434 1.424 257 1HH1 ARG 28 1HH1 ARG 28 -11.012 -22.508 3.717 258 2HH1 ARG 28 2HH1 ARG 28 -11.829 -23.929 3.262 259 1HH2 ARG 28 1HH2 ARG 28 -13.875 -22.334 0.822 260 2HH2 ARG 28 2HH2 ARG 28 -13.552 -23.837 1.581 261 H GLN 29 H GLN 29 -7.728 -19.366 -0.725 262 HA GLN 29 HA GLN 29 -5.275 -19.708 0.518 263 1HB GLN 29 2HB GLN 29 -6.067 -20.906 -1.515 264 2HB GLN 29 1HB GLN 29 -5.898 -19.434 -2.442 265 1HG GLN 29 2HG GLN 29 -3.571 -20.794 -1.095 266 2HG GLN 29 1HG GLN 29 -4.105 -21.204 -2.716 267 1HE2 GLN 29 1HE2 GLN 29 -1.583 -20.126 -1.760 268 2HE2 GLN 29 2HE2 GLN 29 -1.320 -18.665 -2.660 269 H THR 30 H THR 30 -6.536 -16.984 -1.294 270 HA THR 30 HA THR 30 -4.039 -15.666 -1.483 271 HB THR 30 HB THR 30 -6.864 -14.686 -1.919 272 HG1 THR 30 1HG THR 30 -5.221 -16.270 -3.286 273 1HG2 THR 30 1HG2 THR 30 -5.832 -12.804 -3.145 274 2HG2 THR 30 2HG2 THR 30 -4.230 -13.383 -2.690 275 3HG2 THR 30 3HG2 THR 30 -5.336 -12.787 -1.452 276 H ILE 31 H ILE 31 -6.920 -15.111 0.623 277 HA ILE 31 HA ILE 31 -5.679 -13.063 2.099 278 HB ILE 31 HB ILE 31 -8.058 -13.155 2.204 279 1HG1 ILE 31 2HG1 ILE 31 -8.599 -13.295 4.643 280 2HG1 ILE 31 1HG1 ILE 31 -7.006 -13.982 4.918 281 1HG2 ILE 31 1HG2 ILE 31 -9.359 -14.982 3.152 282 2HG2 ILE 31 2HG2 ILE 31 -7.875 -15.926 3.311 283 3HG2 ILE 31 3HG2 ILE 31 -8.449 -15.444 1.715 284 1HD1 ILE 31 1HD1 ILE 31 -7.057 -11.626 5.470 285 2HD1 ILE 31 2HD1 ILE 31 -7.593 -11.238 3.836 286 3HD1 ILE 31 3HD1 ILE 31 -5.987 -11.918 4.101 287 H ASN 32 H ASN 32 -5.824 -16.536 2.678 288 HA ASN 32 HA ASN 32 -4.432 -16.587 5.119 289 1HB ASN 32 2HB ASN 32 -5.667 -18.525 4.195 290 2HB ASN 32 1HB ASN 32 -4.473 -18.670 2.915 291 1HD2 ASN 32 1HD2 ASN 32 -2.563 -19.663 3.341 292 2HD2 ASN 32 2HD2 ASN 32 -2.198 -20.459 4.831 293 H GLY 33 H GLY 33 -3.362 -16.506 1.792 294 1HA GLY 33 2HA GLY 33 -0.602 -16.865 2.236 295 2HA GLY 33 1HA GLY 33 -1.333 -16.106 0.829 296 H ILE 34 H ILE 34 -2.687 -13.994 2.297 297 HA ILE 34 HA ILE 34 -0.579 -12.138 2.509 298 HB ILE 34 HB ILE 34 -3.484 -11.849 3.354 299 1HG1 ILE 34 2HG1 ILE 34 -3.318 -12.358 0.974 300 2HG1 ILE 34 1HG1 ILE 34 -3.802 -10.684 1.201 301 1HG2 ILE 34 1HG2 ILE 34 -2.115 -10.161 4.426 302 2HG2 ILE 34 2HG2 ILE 34 -3.123 -9.425 3.182 303 3HG2 ILE 34 3HG2 ILE 34 -1.409 -9.709 2.874 304 1HD1 ILE 34 1HD1 ILE 34 -2.209 -10.901 -0.613 305 2HD1 ILE 34 2HD1 ILE 34 -1.045 -11.654 0.477 306 3HD1 ILE 34 3HD1 ILE 34 -1.512 -9.971 0.714 307 H GLU 35 H GLU 35 -2.602 -13.809 4.902 308 HA GLU 35 HA GLU 35 -1.744 -12.633 7.230 309 1HB GLU 35 2HB GLU 35 -2.300 -15.560 6.787 310 2HB GLU 35 1HB GLU 35 -2.131 -14.812 8.362 311 1HG GLU 35 2HG GLU 35 -4.076 -13.393 7.855 312 2HG GLU 35 1HG GLU 35 -4.257 -14.241 6.317 313 H LYS 36 H LYS 36 -0.059 -15.101 5.407 314 HA LYS 36 HA LYS 36 2.124 -15.013 7.376 315 1HB LYS 36 2HB LYS 36 1.876 -16.834 4.970 316 2HB LYS 36 1HB LYS 36 3.080 -16.951 6.243 317 1HG LYS 36 2HG LYS 36 0.118 -17.456 6.484 318 2HG LYS 36 1HG LYS 36 1.417 -18.641 6.589 319 1HD LYS 36 2HD LYS 36 0.938 -16.366 8.516 320 2HD LYS 36 1HD LYS 36 0.509 -18.051 8.797 321 1HE LYS 36 2HE LYS 36 2.845 -18.684 8.767 322 2HE LYS 36 1HE LYS 36 3.315 -17.039 8.332 323 1HZ LYS 36 1HZ LYS 36 2.461 -16.255 10.414 324 2HZ LYS 36 2HZ LYS 36 3.586 -17.496 10.723 325 3HZ LYS 36 3HZ LYS 36 1.950 -17.797 10.866 326 H ASN 37 H ASN 37 1.251 -13.192 5.007 327 HA ASN 37 HA ASN 37 2.030 -12.118 3.173 328 1HB ASN 37 2HB ASN 37 3.843 -10.558 3.628 329 2HB ASN 37 1HB ASN 37 2.891 -10.749 5.083 330 1HD2 ASN 37 1HD2 ASN 37 5.925 -11.113 3.588 331 2HD2 ASN 37 2HD2 ASN 37 6.861 -11.556 4.952 332 H LYS 38 H LYS 38 2.328 -14.670 2.693 333 HA LYS 38 HA LYS 38 5.073 -15.138 1.756 334 1HB LYS 38 2HB LYS 38 4.141 -16.805 3.328 335 2HB LYS 38 1HB LYS 38 2.771 -17.049 2.261 336 1HG LYS 38 2HG LYS 38 4.186 -18.074 0.601 337 2HG LYS 38 1HG LYS 38 5.627 -17.693 1.550 338 1HD LYS 38 2HD LYS 38 4.946 -20.043 1.838 339 2HD LYS 38 1HD LYS 38 4.851 -19.141 3.352 340 1HE LYS 38 2HE LYS 38 2.411 -18.835 2.930 341 2HE LYS 38 1HE LYS 38 2.567 -19.884 1.525 342 1HZ LYS 38 1HZ LYS 38 1.757 -21.033 3.492 343 2HZ LYS 38 2HZ LYS 38 3.182 -20.679 4.324 344 3HZ LYS 38 3HZ LYS 38 3.211 -21.690 2.959 345 H TYR 39 H TYR 39 1.841 -14.544 0.953 346 HA TYR 39 HA TYR 39 1.823 -15.391 -1.766 347 1HB TYR 39 2HB TYR 39 -0.161 -15.089 -0.240 348 2HB TYR 39 1HB TYR 39 0.111 -13.360 -0.313 349 HD1 TYR 39 1HD TYR 39 -1.057 -16.283 -2.056 350 HD2 TYR 39 2HD TYR 39 -0.470 -12.105 -2.340 351 HE1 TYR 39 1HE TYR 39 -2.536 -16.222 -4.046 352 HE2 TYR 39 2HE TYR 39 -1.926 -12.009 -4.316 353 HH TYR 39 HH TYR 39 -3.957 -14.515 -5.203 354 H ASN 40 H ASN 40 3.147 -12.828 -0.008 355 HA ASN 40 HA ASN 40 4.046 -10.804 -0.369 356 1HB ASN 40 2HB ASN 40 5.233 -11.861 -2.333 357 2HB ASN 40 1HB ASN 40 3.870 -11.405 -3.351 358 1HD2 ASN 40 1HD2 ASN 40 4.941 -10.023 -4.657 359 2HD2 ASN 40 2HD2 ASN 40 5.648 -8.537 -4.134 360 HA PRO 41 HA PRO 41 -0.081 -9.158 -0.735 361 1HB PRO 41 2HB PRO 41 0.934 -7.029 1.010 362 2HB PRO 41 1HB PRO 41 -0.373 -8.183 1.287 363 1HG PRO 41 2HG PRO 41 1.974 -8.341 2.600 364 2HG PRO 41 1HG PRO 41 1.039 -9.780 2.159 365 1HD PRO 41 2HD PRO 41 3.440 -8.596 0.816 366 2HD PRO 41 1HD PRO 41 3.068 -10.303 1.152 367 H SER 42 H SER 42 -0.043 -8.470 -2.839 368 HA SER 42 HA SER 42 1.157 -6.085 -3.756 369 1HB SER 42 2HB SER 42 -1.364 -7.480 -4.714 370 2HB SER 42 1HB SER 42 -0.349 -6.381 -5.651 371 HG SER 42 HG SER 42 1.086 -7.860 -5.932 372 H LEU 43 H LEU 43 -0.167 -4.026 -4.231 373 HA LEU 43 HA LEU 43 -1.292 -3.280 -1.781 374 1HB LEU 43 2HB LEU 43 -0.004 -1.717 -3.195 375 2HB LEU 43 1HB LEU 43 -1.276 -1.744 -4.389 376 HG LEU 43 HG LEU 43 -1.148 0.332 -2.958 377 1HD1 LEU 43 1HD1 LEU 43 -3.161 -0.151 -4.195 378 2HD1 LEU 43 2HD1 LEU 43 -3.550 0.581 -2.639 379 3HD1 LEU 43 3HD1 LEU 43 -3.759 -1.154 -2.873 380 1HD2 LEU 43 1HD2 LEU 43 -2.111 0.260 -0.665 381 2HD2 LEU 43 2HD2 LEU 43 -0.640 -0.682 -0.767 382 3HD2 LEU 43 3HD2 LEU 43 -2.195 -1.495 -0.763 383 H GLN 44 H GLN 44 -2.955 -3.848 -5.011 384 HA GLN 44 HA GLN 44 -5.454 -3.116 -4.208 385 1HB GLN 44 2HB GLN 44 -4.593 -5.345 -6.057 386 2HB GLN 44 1HB GLN 44 -6.246 -4.780 -5.911 387 1HG GLN 44 2HG GLN 44 -3.910 -3.106 -6.805 388 2HG GLN 44 1HG GLN 44 -5.096 -3.865 -7.869 389 1HE2 GLN 44 1HE2 GLN 44 -7.208 -3.073 -7.891 390 2HE2 GLN 44 2HE2 GLN 44 -7.605 -1.507 -7.283 391 H LEU 45 H LEU 45 -4.030 -6.327 -3.978 392 HA LEU 45 HA LEU 45 -6.224 -7.567 -2.747 393 1HB LEU 45 2HB LEU 45 -3.307 -8.347 -2.675 394 2HB LEU 45 1HB LEU 45 -4.580 -9.324 -1.986 395 HG LEU 45 HG LEU 45 -4.014 -10.291 -4.050 396 1HD1 LEU 45 1HD1 LEU 45 -6.356 -10.310 -3.622 397 2HD1 LEU 45 2HD1 LEU 45 -6.066 -10.170 -5.356 398 3HD1 LEU 45 3HD1 LEU 45 -6.557 -8.753 -4.425 399 1HD2 LEU 45 1HD2 LEU 45 -2.839 -8.437 -5.107 400 2HD2 LEU 45 2HD2 LEU 45 -4.363 -7.589 -5.356 401 3HD2 LEU 45 3HD2 LEU 45 -4.046 -9.101 -6.207 402 H ALA 46 H ALA 46 -3.384 -6.073 -1.334 403 HA ALA 46 HA ALA 46 -4.028 -6.836 1.342 404 1HB ALA 46 1HB ALA 46 -1.726 -6.358 0.636 405 2HB ALA 46 2HB ALA 46 -2.208 -5.384 2.023 406 3HB ALA 46 3HB ALA 46 -2.154 -4.662 0.413 407 H LEU 47 H LEU 47 -4.605 -3.927 -0.609 408 HA LEU 47 HA LEU 47 -5.401 -2.347 1.554 409 1HB LEU 47 2HB LEU 47 -4.523 -1.397 -0.525 410 2HB LEU 47 1HB LEU 47 -5.892 -2.022 -1.406 411 HG LEU 47 HG LEU 47 -5.864 0.470 -0.918 412 1HD1 LEU 47 1HD1 LEU 47 -7.901 -0.621 -1.658 413 2HD1 LEU 47 2HD1 LEU 47 -8.260 0.627 -0.465 414 3HD1 LEU 47 3HD1 LEU 47 -8.286 -1.072 0.003 415 1HD2 LEU 47 1HD2 LEU 47 -6.643 1.188 1.292 416 2HD2 LEU 47 2HD2 LEU 47 -5.086 0.363 1.392 417 3HD2 LEU 47 3HD2 LEU 47 -6.564 -0.479 1.859 418 H LYS 48 H LYS 48 -7.203 -4.410 -0.694 419 HA LYS 48 HA LYS 48 -9.621 -3.335 0.254 420 1HB LYS 48 2HB LYS 48 -10.811 -5.328 -0.722 421 2HB LYS 48 1HB LYS 48 -9.841 -4.400 -1.844 422 1HG LYS 48 2HG LYS 48 -8.132 -6.124 -1.820 423 2HG LYS 48 1HG LYS 48 -9.041 -7.028 -0.603 424 1HD LYS 48 2HD LYS 48 -9.412 -7.930 -2.869 425 2HD LYS 48 1HD LYS 48 -10.901 -7.303 -2.162 426 1HE LYS 48 2HE LYS 48 -10.486 -5.170 -3.437 427 2HE LYS 48 1HE LYS 48 -9.156 -5.993 -4.248 428 1HZ LYS 48 1HZ LYS 48 -11.133 -6.074 -5.597 429 2HZ LYS 48 2HZ LYS 48 -12.034 -6.734 -4.354 430 3HZ LYS 48 3HZ LYS 48 -10.832 -7.651 -5.081 431 H ILE 49 H ILE 49 -7.760 -6.007 1.389 432 HA ILE 49 HA ILE 49 -9.496 -6.934 3.419 433 HB ILE 49 HB ILE 49 -6.514 -6.652 3.871 434 1HG1 ILE 49 2HG1 ILE 49 -7.870 -8.886 2.344 435 2HG1 ILE 49 1HG1 ILE 49 -6.940 -7.600 1.589 436 1HG2 ILE 49 1HG2 ILE 49 -7.869 -7.452 5.734 437 2HG2 ILE 49 2HG2 ILE 49 -6.832 -8.744 5.127 438 3HG2 ILE 49 3HG2 ILE 49 -8.548 -8.721 4.714 439 1HD1 ILE 49 1HD1 ILE 49 -5.892 -9.643 3.530 440 2HD1 ILE 49 2HD1 ILE 49 -4.945 -8.357 2.779 441 3HD1 ILE 49 3HD1 ILE 49 -5.642 -9.636 1.785 442 H ALA 50 H ALA 50 -7.151 -4.379 3.334 443 HA ALA 50 HA ALA 50 -7.148 -3.522 6.046 444 1HB ALA 50 1HB ALA 50 -5.384 -3.004 4.416 445 2HB ALA 50 2HB ALA 50 -6.057 -1.556 5.196 446 3HB ALA 50 3HB ALA 50 -6.564 -1.994 3.562 447 H TYR 51 H TYR 51 -8.855 -2.580 3.194 448 HA TYR 51 HA TYR 51 -10.027 -0.223 4.089 449 1HB TYR 51 2HB TYR 51 -9.666 -0.916 1.729 450 2HB TYR 51 1HB TYR 51 -10.925 -2.124 1.918 451 HD1 TYR 51 1HD TYR 51 -13.163 -1.424 2.283 452 HD2 TYR 51 2HD TYR 51 -10.170 1.347 1.306 453 HE1 TYR 51 1HE TYR 51 -14.932 0.232 1.632 454 HE2 TYR 51 2HE TYR 51 -11.848 3.016 0.666 455 HH TYR 51 HH TYR 51 -15.082 2.672 1.504 456 H TYR 52 H TYR 52 -11.239 -3.540 3.922 457 HA TYR 52 HA TYR 52 -13.750 -2.762 5.051 458 1HB TYR 52 2HB TYR 52 -12.682 -5.470 4.324 459 2HB TYR 52 1HB TYR 52 -14.250 -5.246 5.108 460 HD1 TYR 52 1HD TYR 52 -15.974 -3.824 3.999 461 HD2 TYR 52 2HD TYR 52 -12.441 -5.060 2.004 462 HE1 TYR 52 1HE TYR 52 -17.007 -3.281 1.847 463 HE2 TYR 52 2HE TYR 52 -13.465 -4.525 -0.157 464 HH TYR 52 HH TYR 52 -16.256 -2.670 -0.399 465 H LEU 53 H LEU 53 -10.869 -4.028 6.298 466 HA LEU 53 HA LEU 53 -11.909 -4.483 8.954 467 1HB LEU 53 2HB LEU 53 -9.059 -4.069 8.026 468 2HB LEU 53 1HB LEU 53 -9.504 -4.503 9.660 469 1HD1 LEU 53 1HD1 LEU 53 -8.248 -7.644 8.112 470 2HD1 LEU 53 2HD1 LEU 53 -7.955 -6.479 9.404 471 3HD1 LEU 53 3HD1 LEU 53 -7.636 -6.034 7.727 472 1HD2 LEU 53 1HD2 LEU 53 -11.657 -6.572 8.979 473 2HD2 LEU 53 2HD2 LEU 53 -10.365 -6.788 10.159 474 3HD2 LEU 53 3HD2 LEU 53 -10.566 -7.952 8.848 475 H ASN 54 H ASN 54 -11.197 -1.844 7.131 476 HA ASN 54 HA ASN 54 -10.678 0.323 7.375 477 1HB ASN 54 2HB ASN 54 -13.105 0.209 7.747 478 2HB ASN 54 1HB ASN 54 -12.832 0.075 9.480 479 1HD2 ASN 54 1HD2 ASN 54 -14.082 1.925 9.765 480 2HD2 ASN 54 2HD2 ASN 54 -13.446 3.504 9.445 481 H THR 55 H THR 55 -8.588 -0.032 8.084 482 HA THR 55 HA THR 55 -8.034 1.276 10.608 483 HB THR 55 HB THR 55 -6.861 -1.444 9.841 484 HG1 THR 55 1HG THR 55 -9.120 -0.808 11.085 485 1HG2 THR 55 1HG2 THR 55 -5.875 -1.418 12.082 486 2HG2 THR 55 2HG2 THR 55 -6.569 0.178 12.369 487 3HG2 THR 55 3HG2 THR 55 -5.323 -0.034 11.138 488 HA PRO 56 HA PRO 56 -5.146 3.219 7.765 489 1HB PRO 56 2HB PRO 56 -3.016 3.718 9.462 490 2HB PRO 56 1HB PRO 56 -4.427 4.761 9.282 491 1HG PRO 56 2HG PRO 56 -3.856 2.727 11.388 492 2HG PRO 56 1HG PRO 56 -4.633 4.313 11.540 493 1HD PRO 56 2HD PRO 56 -6.019 2.025 11.550 494 2HD PRO 56 1HD PRO 56 -6.693 3.505 10.818 495 H LEU 57 H LEU 57 -3.593 2.602 6.487 496 HA LEU 57 HA LEU 57 -2.745 -0.039 6.398 497 1HB LEU 57 2HB LEU 57 -1.461 2.345 5.091 498 2HB LEU 57 1HB LEU 57 -1.029 0.682 4.744 499 1HD1 LEU 57 1HD1 LEU 57 -1.588 0.931 2.373 500 2HD1 LEU 57 2HD1 LEU 57 -1.974 2.627 2.664 501 3HD1 LEU 57 3HD1 LEU 57 -3.162 1.570 1.901 502 1HD2 LEU 57 1HD2 LEU 57 -3.922 -0.328 4.953 503 2HD2 LEU 57 2HD2 LEU 57 -2.762 -0.835 3.723 504 3HD2 LEU 57 3HD2 LEU 57 -4.328 -0.155 3.244 505 H GLU 58 H GLU 58 -1.114 2.721 7.786 506 HA GLU 58 HA GLU 58 1.363 1.616 8.323 507 1HB GLU 58 2HB GLU 58 -0.043 3.501 10.213 508 2HB GLU 58 1HB GLU 58 1.681 3.301 9.983 509 1HG GLU 58 2HG GLU 58 1.325 5.272 8.856 510 2HG GLU 58 1HG GLU 58 1.117 4.088 7.561 511 H ASP 59 H ASP 59 -1.675 1.252 10.146 512 HA ASP 59 HA ASP 59 -0.378 0.040 12.374 513 1HB ASP 59 2HB ASP 59 -2.488 1.190 12.732 514 2HB ASP 59 1HB ASP 59 -3.303 0.109 11.608 515 H ILE 60 H ILE 60 -1.985 -1.007 9.559 516 HA ILE 60 HA ILE 60 -2.159 -3.812 10.268 517 HB ILE 60 HB ILE 60 -2.601 -2.512 7.563 518 1HG1 ILE 60 2HG1 ILE 60 -4.555 -3.306 9.736 519 2HG1 ILE 60 1HG1 ILE 60 -4.119 -1.664 9.293 520 1HG2 ILE 60 1HG2 ILE 60 -2.118 -4.911 7.400 521 2HG2 ILE 60 2HG2 ILE 60 -3.809 -4.580 7.020 522 3HG2 ILE 60 3HG2 ILE 60 -3.374 -5.248 8.592 523 1HD1 ILE 60 1HD1 ILE 60 -5.531 -3.650 7.541 524 2HD1 ILE 60 2HD1 ILE 60 -5.114 -1.997 7.098 525 3HD1 ILE 60 3HD1 ILE 60 -6.284 -2.296 8.381 526 H PHE 61 H PHE 61 -0.247 -2.031 7.914 527 HA PHE 61 HA PHE 61 1.700 -4.214 8.170 528 1HB PHE 61 2HB PHE 61 1.159 -2.499 5.709 529 2HB PHE 61 1HB PHE 61 2.524 -3.598 5.881 530 HD1 PHE 61 1HD PHE 61 2.011 -6.061 6.258 531 HD2 PHE 61 2HD PHE 61 -0.894 -3.242 4.940 532 HE1 PHE 61 1HE PHE 61 0.622 -7.900 5.389 533 HE2 PHE 61 2HE PHE 61 -2.287 -5.073 4.074 534 HZ PHE 61 HZ PHE 61 -1.528 -7.409 4.300 535 H GLN 62 H GLN 62 3.739 -3.698 8.586 536 HA GLN 62 HA GLN 62 4.264 -0.850 8.999 537 1HB GLN 62 2HB GLN 62 4.203 -2.194 11.089 538 2HB GLN 62 1HB GLN 62 5.473 -3.223 10.444 539 1HG GLN 62 2HG GLN 62 7.008 -1.331 10.412 540 2HG GLN 62 1HG GLN 62 5.732 -0.278 11.014 541 1HE2 GLN 62 1HE2 GLN 62 4.696 -2.301 12.845 542 2HE2 GLN 62 2HE2 GLN 62 5.830 -2.412 14.143 543 H TRP 63 H TRP 63 5.821 -0.060 7.803 544 HA TRP 63 HA TRP 63 7.370 -1.992 6.310 545 1HB TRP 63 2HB TRP 63 7.496 -0.162 4.557 546 2HB TRP 63 1HB TRP 63 5.992 -1.033 4.749 547 HD1 TRP 63 HD TRP 63 7.495 2.463 5.526 548 HE1 TRP 63 1HE TRP 63 5.540 4.150 5.657 549 HE3 TRP 63 3HE TRP 63 3.572 -0.802 5.162 550 HZ2 TRP 63 2HZ TRP 63 2.715 4.090 5.587 551 HZ3 TRP 63 3HZ TRP 63 1.284 0.091 5.187 552 HH2 TRP 63 HH TRP 63 0.858 2.465 5.384 553 H GLN 64 H GLN 64 9.390 -2.040 6.574 554 HA GLN 64 HA GLN 64 10.764 0.341 7.632 555 1HB GLN 64 2HB GLN 64 11.665 -2.546 7.858 556 2HB GLN 64 1HB GLN 64 12.356 -1.155 8.670 557 1HG GLN 64 2HG GLN 64 9.620 -2.303 9.192 558 2HG GLN 64 1HG GLN 64 11.055 -2.604 10.163 559 1HE2 GLN 64 1HE2 GLN 64 11.831 -0.980 11.473 560 2HE2 GLN 64 2HE2 GLN 64 10.857 0.389 11.899 561 HA PRO 65 HA PRO 65 12.247 -0.588 3.321 562 1HB PRO 65 2HB PRO 65 12.542 2.314 3.060 563 2HB PRO 65 1HB PRO 65 11.538 1.217 2.108 564 1HG PRO 65 2HG PRO 65 10.489 3.033 3.825 565 2HG PRO 65 1HG PRO 65 9.716 1.470 3.496 566 1HD PRO 65 2HD PRO 65 11.412 2.296 5.825 567 2HD PRO 65 1HD PRO 65 9.912 1.340 5.807 568 H GLU 66 H GLU 66 13.354 2.126 5.027 569 HA GLU 66 HA GLU 66 16.154 1.659 4.348 570 1HB GLU 66 2HB GLU 66 15.016 3.795 6.165 571 2HB GLU 66 1HB GLU 66 16.655 3.737 5.530 572 1HG GLU 66 2HG GLU 66 14.137 4.079 3.918 573 2HG GLU 66 1HG GLU 66 15.301 5.340 4.324 574 1H MET 67 1HT MET 67 -11.035 0.259 -8.941 575 2H MET 67 2HT MET 67 -10.818 1.162 -7.549 576 3H MET 67 3HT MET 67 -9.517 0.325 -8.192 577 HA MET 67 HA MET 67 -9.462 1.745 -10.093 578 1HB MET 67 2HB MET 67 -11.731 3.168 -8.670 579 2HB MET 67 1HB MET 67 -10.832 3.847 -10.015 580 1HG MET 67 2HG MET 67 -12.502 1.346 -10.106 581 2HG MET 67 1HG MET 67 -12.993 2.933 -10.696 582 1HE MET 67 1HE MET 67 -13.594 1.926 -13.071 583 2HE MET 67 2HE MET 67 -13.154 0.326 -12.478 584 3HE MET 67 3HE MET 67 -12.500 0.909 -14.008 585 H ILE 68 H ILE 68 -7.798 3.047 -9.911 586 HA ILE 68 HA ILE 68 -7.169 4.087 -7.234 587 HB ILE 68 HB ILE 68 -5.290 3.330 -9.493 588 1HG1 ILE 68 2HG1 ILE 68 -6.162 1.403 -8.270 589 2HG1 ILE 68 1HG1 ILE 68 -4.451 1.618 -7.940 590 1HG2 ILE 68 1HG2 ILE 68 -4.400 5.289 -8.364 591 2HG2 ILE 68 2HG2 ILE 68 -3.428 3.867 -7.982 592 3HG2 ILE 68 3HG2 ILE 68 -4.579 4.493 -6.800 593 1HD1 ILE 68 1HD1 ILE 68 -5.665 1.013 -5.937 594 2HD1 ILE 68 2HD1 ILE 68 -6.714 2.417 -6.127 595 3HD1 ILE 68 3HD1 ILE 68 -4.996 2.638 -5.793 596 H ILE 69 H ILE 69 -6.887 6.186 -6.952 597 HA ILE 69 HA ILE 69 -6.749 7.953 -9.268 598 HB ILE 69 HB ILE 69 -8.139 8.463 -6.586 599 1HG1 ILE 69 2HG1 ILE 69 -10.191 8.928 -8.081 600 2HG1 ILE 69 1HG1 ILE 69 -9.308 8.113 -9.357 601 1HG2 ILE 69 1HG2 ILE 69 -7.802 10.347 -8.905 602 2HG2 ILE 69 2HG2 ILE 69 -7.025 10.462 -7.328 603 3HG2 ILE 69 3HG2 ILE 69 -8.773 10.660 -7.465 604 1HD1 ILE 69 1HD1 ILE 69 -9.265 6.070 -8.005 605 2HD1 ILE 69 2HD1 ILE 69 -10.911 6.626 -8.300 606 3HD1 ILE 69 3HD1 ILE 69 -10.158 6.896 -6.731 607 H ASN 70 H ASN 70 -4.924 9.317 -9.111 608 HA ASN 70 HA ASN 70 -3.238 8.745 -6.800 609 1HB ASN 70 2HB ASN 70 -2.413 8.013 -8.977 610 2HB ASN 70 1HB ASN 70 -2.646 9.619 -9.632 611 1HD2 ASN 70 1HD2 ASN 70 -0.312 7.855 -9.396 612 2HD2 ASN 70 2HD2 ASN 70 0.900 8.812 -8.649 613 H ASN 71 H ASN 71 -2.800 10.394 -5.361 614 HA ASN 71 HA ASN 71 -3.104 13.115 -6.363 615 1HB ASN 71 2HB ASN 71 -3.922 12.161 -3.577 616 2HB ASN 71 1HB ASN 71 -3.847 13.818 -4.107 617 1HD2 ASN 71 1HD2 ASN 71 -6.086 12.303 -3.106 618 2HD2 ASN 71 2HD2 ASN 71 -7.333 12.416 -4.297 619 H LEU 72 H LEU 72 -1.024 11.127 -5.949 620 HA LEU 72 HA LEU 72 0.765 11.809 -3.836 621 1HB LEU 72 2HB LEU 72 0.998 9.704 -5.072 622 2HB LEU 72 1HB LEU 72 1.316 10.563 -6.548 623 HG LEU 72 HG LEU 72 3.246 9.330 -5.405 624 1HD1 LEU 72 1HD1 LEU 72 3.624 12.216 -6.141 625 2HD1 LEU 72 2HD1 LEU 72 3.628 10.833 -7.236 626 3HD1 LEU 72 3HD1 LEU 72 4.899 11.004 -6.025 627 1HD2 LEU 72 1HD2 LEU 72 2.869 10.094 -3.123 628 2HD2 LEU 72 2HD2 LEU 72 3.163 11.759 -3.617 629 3HD2 LEU 72 3HD2 LEU 72 4.473 10.580 -3.680 630 H LYS 73 H LYS 73 0.211 13.099 -6.935 631 HA LYS 73 HA LYS 73 2.319 14.855 -7.338 632 1HB LYS 73 2HB LYS 73 0.769 16.142 -8.761 633 2HB LYS 73 1HB LYS 73 0.608 14.414 -9.032 634 1HG LYS 73 2HG LYS 73 -1.397 14.432 -7.542 635 2HG LYS 73 1HG LYS 73 -1.260 16.183 -7.462 636 1HD LYS 73 2HD LYS 73 -2.886 15.688 -9.119 637 2HD LYS 73 1HD LYS 73 -1.432 16.200 -9.974 638 1HE LYS 73 2HE LYS 73 -0.849 13.847 -10.363 639 2HE LYS 73 1HE LYS 73 -2.312 13.350 -9.519 640 1HZ LYS 73 1HZ LYS 73 -2.143 14.855 -12.069 641 2HZ LYS 73 2HZ LYS 73 -3.568 14.642 -11.232 642 3HZ LYS 73 3HZ LYS 73 -2.756 13.291 -11.860 643 H LEU 74 H LEU 74 -0.623 15.331 -5.377 644 HA LEU 74 HA LEU 74 -0.322 17.975 -4.646 645 1HB LEU 74 2HB LEU 74 -2.317 16.606 -4.321 646 2HB LEU 74 1HB LEU 74 -1.475 15.659 -3.116 647 HG LEU 74 HG LEU 74 -1.341 17.655 -1.671 648 1HD1 LEU 74 1HD1 LEU 74 -3.035 18.885 -3.821 649 2HD1 LEU 74 2HD1 LEU 74 -1.376 19.347 -3.424 650 3HD1 LEU 74 3HD1 LEU 74 -2.679 19.614 -2.253 651 1HD2 LEU 74 1HD2 LEU 74 -4.084 16.949 -2.663 652 2HD2 LEU 74 2HD2 LEU 74 -3.713 17.709 -1.112 653 3HD2 LEU 74 3HD2 LEU 74 -3.158 16.063 -1.448 654 H ILE 75 H ILE 75 0.955 15.027 -3.157 655 HA ILE 75 HA ILE 75 2.101 16.362 -0.933 656 HB ILE 75 HB ILE 75 2.791 13.603 -2.044 657 1HG1 ILE 75 2HG1 ILE 75 1.559 12.798 0.050 658 2HG1 ILE 75 1HG1 ILE 75 0.968 14.437 0.231 659 1HG2 ILE 75 1HG2 ILE 75 3.565 14.828 0.601 660 2HG2 ILE 75 2HG2 ILE 75 4.645 14.474 -0.742 661 3HG2 ILE 75 3HG2 ILE 75 3.859 13.154 0.126 662 1HD1 ILE 75 1HD1 ILE 75 -0.192 14.243 -1.910 663 2HD1 ILE 75 2HD1 ILE 75 -0.695 12.990 -0.776 664 3HD1 ILE 75 3HD1 ILE 75 0.420 12.599 -2.088 665 H ARG 76 H ARG 76 3.334 15.352 -4.074 666 HA ARG 76 HA ARG 76 5.989 16.083 -3.833 667 1HB ARG 76 2HB ARG 76 4.246 16.448 -6.285 668 2HB ARG 76 1HB ARG 76 6.002 16.338 -6.265 669 1HG ARG 76 2HG ARG 76 4.139 14.123 -5.404 670 2HG ARG 76 1HG ARG 76 4.927 14.254 -6.982 671 1HD ARG 76 2HD ARG 76 6.475 14.234 -4.434 672 2HD ARG 76 1HD ARG 76 5.983 12.748 -5.249 673 HE ARG 76 HE ARG 76 7.087 13.797 -7.242 674 1HH1 ARG 76 1HH1 ARG 76 8.196 14.283 -3.931 675 2HH1 ARG 76 2HH1 ARG 76 9.845 14.457 -4.340 676 1HH2 ARG 76 1HH2 ARG 76 9.275 14.069 -7.832 677 2HH2 ARG 76 2HH2 ARG 76 10.492 14.323 -6.669 678 H GLU 77 H GLU 77 3.189 18.171 -4.494 679 HA GLU 77 HA GLU 77 4.726 20.519 -4.684 680 1HB GLU 77 2HB GLU 77 1.797 20.112 -4.103 681 2HB GLU 77 1HB GLU 77 2.540 21.682 -4.381 682 1HG GLU 77 2HG GLU 77 2.556 19.406 -6.353 683 2HG GLU 77 1HG GLU 77 1.417 20.746 -6.376 684 H LYS 78 H LYS 78 3.150 18.944 -1.952 685 HA LYS 78 HA LYS 78 3.261 20.926 0.015 686 1HB LYS 78 2HB LYS 78 3.697 17.964 0.450 687 2HB LYS 78 1HB LYS 78 3.283 19.122 1.697 688 1HG LYS 78 2HG LYS 78 1.502 18.544 -0.663 689 2HG LYS 78 1HG LYS 78 1.430 17.631 0.836 690 1HD LYS 78 2HD LYS 78 -0.298 19.285 0.889 691 2HD LYS 78 1HD LYS 78 0.946 19.782 2.026 692 1HE LYS 78 2HE LYS 78 1.791 21.397 0.396 693 2HE LYS 78 1HE LYS 78 0.584 20.858 -0.772 694 1HZ LYS 78 1HZ LYS 78 -1.146 21.598 0.692 695 2HZ LYS 78 2HZ LYS 78 -0.073 22.897 0.425 696 3HZ LYS 78 3HZ LYS 78 -0.026 22.048 1.870 697 H LYS 79 H LYS 79 5.798 18.651 -0.872 698 HA LYS 79 HA LYS 79 7.749 20.496 0.137 699 1HB LYS 79 2HB LYS 79 9.142 18.532 0.919 700 2HB LYS 79 1HB LYS 79 7.752 18.862 1.930 701 1HG LYS 79 2HG LYS 79 6.583 16.966 1.060 702 2HG LYS 79 1HG LYS 79 7.814 16.715 -0.183 703 1HD LYS 79 2HD LYS 79 8.080 15.150 1.692 704 2HD LYS 79 1HD LYS 79 9.463 16.231 1.504 705 1HE LYS 79 2HE LYS 79 8.527 17.664 3.304 706 2HE LYS 79 1HE LYS 79 7.248 16.474 3.540 707 1HZ LYS 79 1HZ LYS 79 9.192 16.259 5.092 708 2HZ LYS 79 2HZ LYS 79 10.134 15.824 3.763 709 3HZ LYS 79 3HZ LYS 79 8.874 14.853 4.238 710 H LYS 80 H LYS 80 9.881 20.095 -1.466 711 HA LYS 80 HA LYS 80 8.548 19.038 -3.650 712 1HB LYS 80 2HB LYS 80 9.079 20.950 -5.108 713 2HB LYS 80 1HB LYS 80 7.857 21.299 -3.907 714 1HG LYS 80 2HG LYS 80 9.407 22.614 -2.635 715 2HG LYS 80 1HG LYS 80 10.744 22.122 -3.684 716 1HD LYS 80 2HD LYS 80 8.324 23.730 -4.509 717 2HD LYS 80 1HD LYS 80 9.967 24.350 -4.301 718 1HE LYS 80 2HE LYS 80 10.754 22.850 -6.076 719 2HE LYS 80 1HE LYS 80 9.119 22.237 -6.284 720 1HZ LYS 80 1HZ LYS 80 9.988 25.037 -6.756 721 2HZ LYS 80 2HZ LYS 80 8.425 24.414 -7.084 722 3HZ LYS 80 3HZ LYS 80 9.750 23.854 -7.929 723 H ILE 81 H ILE 81 9.656 17.625 -3.994 724 HA ILE 81 HA ILE 81 12.589 17.829 -4.097 725 HB ILE 81 HB ILE 81 10.825 15.415 -3.473 726 1HG1 ILE 81 2HG1 ILE 81 12.718 16.955 -1.680 727 2HG1 ILE 81 1HG1 ILE 81 10.964 17.020 -1.613 728 1HG2 ILE 81 1HG2 ILE 81 12.809 14.741 -4.703 729 2HG2 ILE 81 2HG2 ILE 81 12.895 14.200 -3.026 730 3HG2 ILE 81 3HG2 ILE 81 13.827 15.603 -3.551 731 1HD1 ILE 81 1HD1 ILE 81 11.878 15.617 0.152 732 2HD1 ILE 81 2HD1 ILE 81 12.667 14.598 -1.053 733 3HD1 ILE 81 3HD1 ILE 81 10.905 14.663 -0.967 734 H SER 82 H SER 82 13.485 16.909 -6.074 735 HA SER 82 HA SER 82 11.581 16.864 -8.206 736 1HB SER 82 2HB SER 82 14.573 16.506 -8.172 737 2HB SER 82 1HB SER 82 13.576 16.784 -9.603 738 HG SER 82 HG SER 82 14.062 18.514 -7.424 739 H GLN 83 H GLN 83 11.665 15.101 -9.852 740 HA GLN 83 HA GLN 83 11.117 12.639 -8.612 741 1HB GLN 83 2HB GLN 83 10.866 11.706 -10.898 742 2HB GLN 83 1HB GLN 83 9.940 13.170 -10.616 743 1HG GLN 83 2HG GLN 83 11.613 14.461 -11.818 744 2HG GLN 83 1HG GLN 83 12.554 12.994 -12.083 745 1HE2 GLN 83 1HE2 GLN 83 11.847 11.509 -13.564 746 2HE2 GLN 83 2HE2 GLN 83 10.632 11.852 -14.722 747 H SER 84 H SER 84 14.064 13.757 -10.274 748 HA SER 84 HA SER 84 15.308 11.283 -10.474 749 1HB SER 84 2HB SER 84 16.549 13.998 -9.986 750 2HB SER 84 1HB SER 84 17.393 12.574 -10.595 751 HG SER 84 HG SER 84 16.534 14.213 -12.137 752 H GLU 85 H GLU 85 14.991 13.480 -7.762 753 HA GLU 85 HA GLU 85 16.888 12.243 -6.097 754 1HB GLU 85 2HB GLU 85 14.453 13.833 -5.303 755 2HB GLU 85 1HB GLU 85 15.823 13.460 -4.271 756 1HG GLU 85 2HG GLU 85 15.846 15.179 -6.737 757 2HG GLU 85 1HG GLU 85 15.952 15.727 -5.066 758 H LEU 86 H LEU 86 13.315 11.782 -6.441 759 HA LEU 86 HA LEU 86 13.280 9.818 -4.411 760 1HB LEU 86 2HB LEU 86 11.305 10.319 -6.641 761 2HB LEU 86 1HB LEU 86 11.073 9.129 -5.386 762 HG LEU 86 HG LEU 86 10.933 12.137 -5.165 763 1HD1 LEU 86 1HD1 LEU 86 8.781 11.652 -4.220 764 2HD1 LEU 86 2HD1 LEU 86 9.068 9.924 -4.431 765 3HD1 LEU 86 3HD1 LEU 86 8.960 10.979 -5.842 766 1HD2 LEU 86 1HD2 LEU 86 12.334 11.336 -3.279 767 2HD2 LEU 86 2HD2 LEU 86 11.087 10.158 -2.877 768 3HD2 LEU 86 3HD2 LEU 86 10.745 11.883 -2.742 769 H ALA 87 H ALA 87 13.700 9.743 -7.880 770 HA ALA 87 HA ALA 87 13.604 6.998 -8.318 771 1HB ALA 87 1HB ALA 87 13.744 8.653 -10.113 772 2HB ALA 87 2HB ALA 87 14.985 7.413 -10.282 773 3HB ALA 87 3HB ALA 87 15.410 9.009 -9.657 774 H ALA 88 H ALA 88 16.341 9.043 -7.351 775 HA ALA 88 HA ALA 88 18.283 7.068 -7.171 776 1HB ALA 88 1HB ALA 88 17.958 9.578 -5.536 777 2HB ALA 88 2HB ALA 88 18.750 9.466 -7.108 778 3HB ALA 88 3HB ALA 88 19.444 8.643 -5.707 779 H LEU 89 H LEU 89 15.918 8.233 -4.830 780 HA LEU 89 HA LEU 89 16.914 6.755 -2.619 781 1HB LEU 89 2HB LEU 89 14.260 8.101 -3.092 782 2HB LEU 89 1HB LEU 89 14.752 7.402 -1.565 783 HG LEU 89 HG LEU 89 16.156 9.696 -2.936 784 1HD1 LEU 89 1HD1 LEU 89 15.192 11.075 -1.167 785 2HD1 LEU 89 2HD1 LEU 89 14.303 9.677 -0.561 786 3HD1 LEU 89 3HD1 LEU 89 13.933 10.332 -2.156 787 1HD2 LEU 89 1HD2 LEU 89 17.340 9.926 -0.808 788 2HD2 LEU 89 2HD2 LEU 89 17.639 8.347 -1.539 789 3HD2 LEU 89 3HD2 LEU 89 16.513 8.496 -0.191 790 H LEU 90 H LEU 90 14.307 6.161 -5.010 791 HA LEU 90 HA LEU 90 13.507 3.727 -3.755 792 1HB LEU 90 2HB LEU 90 12.979 4.782 -6.517 793 2HB LEU 90 1HB LEU 90 12.116 3.471 -5.739 794 HG LEU 90 HG LEU 90 12.030 6.399 -5.047 795 1HD1 LEU 90 1HD1 LEU 90 10.810 5.814 -7.046 796 2HD1 LEU 90 2HD1 LEU 90 9.696 6.205 -5.734 797 3HD1 LEU 90 3HD1 LEU 90 9.976 4.523 -6.183 798 1HD2 LEU 90 1HD2 LEU 90 11.881 5.065 -3.023 799 2HD2 LEU 90 2HD2 LEU 90 10.610 4.084 -3.754 800 3HD2 LEU 90 3HD2 LEU 90 10.324 5.792 -3.416 801 H GLU 91 H GLU 91 16.146 4.620 -5.550 802 HA GLU 91 HA GLU 91 17.789 3.569 -6.678 803 1HB GLU 91 2HB GLU 91 16.559 1.089 -5.470 804 2HB GLU 91 1HB GLU 91 18.136 1.163 -6.238 805 1HG GLU 91 2HG GLU 91 18.874 2.748 -4.517 806 2HG GLU 91 1HG GLU 91 17.295 2.603 -3.735 807 H VAL 92 H VAL 92 15.523 4.212 -8.192 808 HA VAL 92 HA VAL 92 15.576 2.102 -10.184 809 HB VAL 92 HB VAL 92 13.175 2.399 -10.691 810 1HG1 VAL 92 1HG1 VAL 92 13.675 1.541 -7.855 811 2HG1 VAL 92 2HG1 VAL 92 13.808 0.536 -9.298 812 3HG1 VAL 92 3HG1 VAL 92 12.236 1.165 -8.801 813 1HG2 VAL 92 1HG2 VAL 92 13.107 4.058 -8.176 814 2HG2 VAL 92 2HG2 VAL 92 11.684 3.518 -9.068 815 3HG2 VAL 92 3HG2 VAL 92 12.825 4.637 -9.817 816 H SER 93 H SER 93 14.278 3.112 -12.166 817 HA SER 93 HA SER 93 15.844 5.359 -12.911 818 1HB SER 93 2HB SER 93 13.614 3.977 -14.398 819 2HB SER 93 1HB SER 93 14.859 5.029 -15.086 820 HG SER 93 HG SER 93 16.305 3.420 -13.925 821 H ARG 94 H ARG 94 15.114 7.341 -13.559 822 HA ARG 94 HA ARG 94 13.182 8.689 -12.046 823 1HB ARG 94 2HB ARG 94 14.281 9.456 -14.758 824 2HB ARG 94 1HB ARG 94 13.538 10.546 -13.592 825 1HG ARG 94 2HG ARG 94 15.346 10.231 -12.053 826 2HG ARG 94 1HG ARG 94 16.048 8.971 -13.068 827 1HD ARG 94 2HD ARG 94 15.719 11.874 -13.797 828 2HD ARG 94 1HD ARG 94 17.223 11.088 -13.321 829 HE ARG 94 HE ARG 94 16.841 9.648 -15.369 830 1HH1 ARG 94 1HH1 ARG 94 15.593 12.943 -15.161 831 2HH1 ARG 94 2HH1 ARG 94 15.766 13.281 -16.816 832 1HH2 ARG 94 1HH2 ARG 94 17.079 10.098 -17.676 833 2HH2 ARG 94 2HH2 ARG 94 16.621 11.641 -18.256 834 H GLN 95 H GLN 95 13.085 7.332 -15.213 835 HA GLN 95 HA GLN 95 10.469 8.032 -15.999 836 1HB GLN 95 2HB GLN 95 12.041 7.179 -17.614 837 2HB GLN 95 1HB GLN 95 12.198 5.668 -16.741 838 1HG GLN 95 2HG GLN 95 10.899 5.426 -18.788 839 2HG GLN 95 1HG GLN 95 9.954 5.035 -17.358 840 1HE2 GLN 95 1HE2 GLN 95 8.039 5.351 -18.372 841 2HE2 GLN 95 2HE2 GLN 95 7.431 6.893 -18.831 842 H THR 96 H THR 96 11.623 5.481 -13.887 843 HA THR 96 HA THR 96 9.197 4.011 -13.835 844 HB THR 96 HB THR 96 11.498 4.019 -11.869 845 HG1 THR 96 1HG THR 96 11.145 3.015 -14.423 846 1HG2 THR 96 1HG2 THR 96 9.460 2.928 -11.006 847 2HG2 THR 96 2HG2 THR 96 10.726 1.744 -11.332 848 3HG2 THR 96 3HG2 THR 96 9.382 1.931 -12.459 849 H ILE 97 H ILE 97 10.760 6.264 -11.465 850 HA ILE 97 HA ILE 97 8.567 6.255 -9.730 851 HB ILE 97 HB ILE 97 10.829 6.913 -9.010 852 1HG1 ILE 97 2HG1 ILE 97 8.795 7.795 -7.724 853 2HG1 ILE 97 1HG1 ILE 97 10.322 8.592 -7.418 854 1HG2 ILE 97 1HG2 ILE 97 11.795 9.094 -9.486 855 2HG2 ILE 97 2HG2 ILE 97 10.490 9.399 -10.631 856 3HG2 ILE 97 3HG2 ILE 97 11.623 8.077 -10.918 857 1HD1 ILE 97 1HD1 ILE 97 9.614 10.459 -8.851 858 2HD1 ILE 97 2HD1 ILE 97 8.491 10.186 -7.517 859 3HD1 ILE 97 3HD1 ILE 97 8.079 9.640 -9.143 860 H ASN 98 H ASN 98 9.384 8.428 -12.350 861 HA ASN 98 HA ASN 98 7.214 10.186 -12.099 862 1HB ASN 98 2HB ASN 98 9.126 10.596 -13.611 863 2HB ASN 98 1HB ASN 98 8.553 9.311 -14.667 864 1HD2 ASN 98 1HD2 ASN 98 7.900 12.455 -13.420 865 2HD2 ASN 98 2HD2 ASN 98 6.802 12.974 -14.631 866 H GLY 99 H GLY 99 7.495 7.120 -13.627 867 1HA GLY 99 2HA GLY 99 4.953 6.948 -14.857 868 2HA GLY 99 1HA GLY 99 5.914 5.565 -14.336 869 H ILE 100 H ILE 100 6.028 6.325 -11.516 870 HA ILE 100 HA ILE 100 3.573 5.276 -10.627 871 HB ILE 100 HB ILE 100 5.870 6.560 -9.106 872 1HG1 ILE 100 2HG1 ILE 100 6.528 4.510 -10.278 873 2HG1 ILE 100 1HG1 ILE 100 6.537 4.269 -8.537 874 1HG2 ILE 100 1HG2 ILE 100 3.852 6.690 -7.766 875 2HG2 ILE 100 2HG2 ILE 100 4.966 5.505 -7.083 876 3HG2 ILE 100 3HG2 ILE 100 3.559 4.965 -8.002 877 1HD1 ILE 100 1HD1 ILE 100 5.623 2.333 -9.695 878 2HD1 ILE 100 2HD1 ILE 100 4.385 3.346 -10.436 879 3HD1 ILE 100 3HD1 ILE 100 4.394 3.101 -8.690 880 H GLU 101 H GLU 101 5.090 8.540 -10.439 881 HA GLU 101 HA GLU 101 3.067 9.895 -9.122 882 1HB GLU 101 2HB GLU 101 4.685 11.010 -11.417 883 2HB GLU 101 1HB GLU 101 3.834 11.943 -10.206 884 1HG GLU 101 2HG GLU 101 5.376 10.989 -8.504 885 2HG GLU 101 1HG GLU 101 6.277 10.236 -9.822 886 H LYS 102 H LYS 102 3.312 9.099 -12.511 887 HA LYS 102 HA LYS 102 0.814 10.475 -13.065 888 1HB LYS 102 2HB LYS 102 2.711 9.048 -14.911 889 2HB LYS 102 1HB LYS 102 1.242 9.867 -15.428 890 1HG LYS 102 2HG LYS 102 2.116 11.969 -14.511 891 2HG LYS 102 1HG LYS 102 3.606 11.131 -14.072 892 1HD LYS 102 2HD LYS 102 3.917 10.538 -16.408 893 2HD LYS 102 1HD LYS 102 2.491 11.486 -16.846 894 1HE LYS 102 2HE LYS 102 3.549 13.491 -15.886 895 2HE LYS 102 1HE LYS 102 4.983 12.541 -15.509 896 1HZ LYS 102 1HZ LYS 102 5.383 13.712 -17.512 897 2HZ LYS 102 2HZ LYS 102 3.930 13.236 -18.193 898 3HZ LYS 102 3HZ LYS 102 5.161 12.106 -17.966 899 H ASN 103 H ASN 103 1.296 7.780 -11.595 900 HA ASN 103 HA ASN 103 0.418 5.718 -11.327 901 1HB ASN 103 2HB ASN 103 -2.024 5.535 -11.312 902 2HB ASN 103 1HB ASN 103 -1.553 7.099 -10.681 903 1HD2 ASN 103 1HD2 ASN 103 -2.243 8.958 -11.776 904 2HD2 ASN 103 2HD2 ASN 103 -3.359 8.900 -13.082 905 H LYS 104 H LYS 104 1.684 6.036 -13.818 906 HA LYS 104 HA LYS 104 0.010 4.756 -15.822 907 1HB LYS 104 2HB LYS 104 1.183 6.824 -16.364 908 2HB LYS 104 1HB LYS 104 2.709 6.103 -15.892 909 1HG LYS 104 2HG LYS 104 2.436 4.471 -17.725 910 2HG LYS 104 1HG LYS 104 0.983 5.344 -18.221 911 1HD LYS 104 2HD LYS 104 2.272 7.352 -18.584 912 2HD LYS 104 1HD LYS 104 3.729 6.556 -17.986 913 1HE LYS 104 2HE LYS 104 2.154 5.811 -20.444 914 2HE LYS 104 1HE LYS 104 3.724 6.612 -20.404 915 1HZ LYS 104 1HZ LYS 104 4.635 4.593 -19.319 916 2HZ LYS 104 2HZ LYS 104 4.002 4.287 -20.845 917 3HZ LYS 104 3HZ LYS 104 3.140 3.836 -19.487 918 H TYR 105 H TYR 105 2.598 4.260 -13.657 919 HA TYR 105 HA TYR 105 3.688 1.965 -15.068 920 1HB TYR 105 2HB TYR 105 5.044 3.747 -13.850 921 2HB TYR 105 1HB TYR 105 4.461 3.037 -12.354 922 HD1 TYR 105 1HD TYR 105 6.212 2.276 -15.431 923 HD2 TYR 105 2HD TYR 105 5.652 1.221 -11.376 924 HE1 TYR 105 1HE TYR 105 8.110 0.640 -15.595 925 HE2 TYR 105 2HE TYR 105 7.484 -0.377 -11.497 926 HH TYR 105 HH TYR 105 9.744 -0.473 -13.959 927 H ASN 106 H ASN 106 1.086 2.469 -13.147 928 HA ASN 106 HA ASN 106 -0.238 1.332 -11.690 929 1HB ASN 106 2HB ASN 106 -0.088 -0.650 -13.180 930 2HB ASN 106 1HB ASN 106 1.447 -1.104 -12.444 931 1HD2 ASN 106 1HD2 ASN 106 0.740 -3.088 -11.724 932 2HD2 ASN 106 2HD2 ASN 106 -0.388 -3.291 -10.415 933 HA PRO 107 HA PRO 107 2.172 2.410 -8.159 934 1HB PRO 107 2HB PRO 107 -0.158 1.180 -6.766 935 2HB PRO 107 1HB PRO 107 0.635 2.735 -6.479 936 1HG PRO 107 2HG PRO 107 -1.682 2.632 -7.776 937 2HG PRO 107 1HG PRO 107 -0.405 3.754 -8.288 938 1HD PRO 107 2HD PRO 107 -1.283 1.184 -9.522 939 2HD PRO 107 1HD PRO 107 -0.694 2.667 -10.297 940 H SER 108 H SER 108 3.842 0.902 -8.419 941 HA SER 108 HA SER 108 3.753 -1.734 -7.428 942 1HB SER 108 2HB SER 108 6.107 0.171 -7.613 943 2HB SER 108 1HB SER 108 6.169 -1.595 -7.604 944 HG SER 108 HG SER 108 4.594 -1.108 -9.557 945 H LEU 109 H LEU 109 3.714 -2.325 -5.322 946 HA LEU 109 HA LEU 109 3.042 -0.294 -3.529 947 1HB LEU 109 2HB LEU 109 2.003 -2.534 -3.490 948 2HB LEU 109 1HB LEU 109 3.508 -3.218 -2.931 949 HG LEU 109 HG LEU 109 1.636 -2.864 -1.208 950 1HD1 LEU 109 1HD1 LEU 109 4.349 -1.693 -0.611 951 2HD1 LEU 109 2HD1 LEU 109 3.907 -3.395 -0.523 952 3HD1 LEU 109 3HD1 LEU 109 3.173 -2.236 0.586 953 1HD2 LEU 109 1HD2 LEU 109 2.559 0.013 -1.458 954 2HD2 LEU 109 2HD2 LEU 109 1.503 -0.608 -0.198 955 3HD2 LEU 109 3HD2 LEU 109 0.962 -0.595 -1.864 956 H GLN 110 H GLN 110 6.027 -2.332 -3.701 957 HA GLN 110 HA GLN 110 7.057 -1.270 -1.332 958 1HB GLN 110 2HB GLN 110 7.923 -3.330 -2.407 959 2HB GLN 110 1HB GLN 110 8.596 -2.351 -3.702 960 1HG GLN 110 2HG GLN 110 10.349 -2.919 -2.174 961 2HG GLN 110 1HG GLN 110 10.019 -1.195 -2.040 962 1HE2 GLN 110 1HE2 GLN 110 8.106 -3.783 -0.611 963 2HE2 GLN 110 2HE2 GLN 110 8.447 -3.363 1.030 964 H LEU 111 H LEU 111 7.446 -0.181 -4.689 965 HA LEU 111 HA LEU 111 9.280 1.885 -4.099 966 1HB LEU 111 2HB LEU 111 7.285 1.699 -6.355 967 2HB LEU 111 1HB LEU 111 8.555 2.901 -6.258 968 HG LEU 111 HG LEU 111 8.960 -0.073 -6.479 969 1HD1 LEU 111 1HD1 LEU 111 9.385 2.135 -8.487 970 2HD1 LEU 111 2HD1 LEU 111 8.115 0.912 -8.535 971 3HD1 LEU 111 3HD1 LEU 111 9.804 0.437 -8.718 972 1HD2 LEU 111 1HD2 LEU 111 10.964 2.183 -6.466 973 2HD2 LEU 111 2HD2 LEU 111 11.328 0.485 -6.778 974 3HD2 LEU 111 3HD2 LEU 111 10.738 0.982 -5.192 975 H ALA 112 H ALA 112 5.829 1.857 -4.307 976 HA ALA 112 HA ALA 112 5.349 4.626 -3.822 977 1HB ALA 112 1HB ALA 112 3.530 2.285 -3.235 978 2HB ALA 112 2HB ALA 112 3.619 3.155 -4.766 979 3HB ALA 112 3HB ALA 112 3.041 3.976 -3.315 980 H LEU 113 H LEU 113 5.738 1.833 -1.774 981 HA LEU 113 HA LEU 113 4.882 2.724 0.707 982 1HB LEU 113 2HB LEU 113 5.579 0.448 -0.308 983 2HB LEU 113 1HB LEU 113 7.188 0.916 0.174 984 HG LEU 113 HG LEU 113 6.349 1.068 2.513 985 1HD1 LEU 113 1HD1 LEU 113 4.214 -0.026 2.977 986 2HD1 LEU 113 2HD1 LEU 113 3.939 -0.233 1.247 987 3HD1 LEU 113 3HD1 LEU 113 3.984 1.385 1.945 988 1HD2 LEU 113 1HD2 LEU 113 6.329 -1.351 2.794 989 2HD2 LEU 113 2HD2 LEU 113 7.566 -0.855 1.640 990 3HD2 LEU 113 3HD2 LEU 113 6.054 -1.556 1.063 991 H LYS 114 H LYS 114 7.989 2.795 -0.945 992 HA LYS 114 HA LYS 114 9.476 3.861 1.246 993 1HB LYS 114 2HB LYS 114 10.186 4.210 -1.648 994 2HB LYS 114 1HB LYS 114 11.259 4.290 -0.265 995 1HG LYS 114 2HG LYS 114 10.593 1.810 0.068 996 2HG LYS 114 1HG LYS 114 10.040 1.973 -1.613 997 1HD LYS 114 2HD LYS 114 12.329 1.150 -1.594 998 2HD LYS 114 1HD LYS 114 12.258 2.781 -2.257 999 1HE LYS 114 2HE LYS 114 12.902 3.787 -0.223 1000 2HE LYS 114 1HE LYS 114 12.794 2.276 0.648 1001 1HZ LYS 114 1HZ LYS 114 14.719 1.538 -0.833 1002 2HZ LYS 114 2HZ LYS 114 15.027 2.731 0.319 1003 3HZ LYS 114 3HZ LYS 114 14.861 3.180 -1.302 1004 H ILE 115 H ILE 115 7.881 5.186 -1.514 1005 HA ILE 115 HA ILE 115 8.736 7.850 -1.299 1006 HB ILE 115 HB ILE 115 6.105 6.825 -2.430 1007 1HG1 ILE 115 2HG1 ILE 115 8.744 7.444 -3.792 1008 2HG1 ILE 115 1HG1 ILE 115 8.047 5.862 -3.529 1009 1HG2 ILE 115 1HG2 ILE 115 5.956 9.207 -1.949 1010 2HG2 ILE 115 2HG2 ILE 115 5.996 8.922 -3.690 1011 3HG2 ILE 115 3HG2 ILE 115 7.441 9.498 -2.858 1012 1HD1 ILE 115 1HD1 ILE 115 6.188 6.388 -5.009 1013 2HD1 ILE 115 2HD1 ILE 115 7.736 6.585 -5.830 1014 3HD1 ILE 115 3HD1 ILE 115 6.848 8.004 -5.272 1015 H ALA 116 H ALA 116 6.037 6.132 0.103 1016 HA ALA 116 HA ALA 116 4.641 8.205 1.376 1017 1HB ALA 116 1HB ALA 116 3.781 6.455 2.851 1018 2HB ALA 116 2HB ALA 116 5.059 5.371 2.298 1019 3HB ALA 116 3HB ALA 116 3.807 5.902 1.170 1020 H TYR 117 H TYR 117 7.291 6.207 2.394 1021 HA TYR 117 HA TYR 117 7.587 7.257 4.984 1022 1HB TYR 117 2HB TYR 117 8.330 5.053 4.527 1023 2HB TYR 117 1HB TYR 117 9.312 5.585 3.176 1024 HD1 TYR 117 1HD TYR 117 11.484 6.309 3.483 1025 HD2 TYR 117 2HD TYR 117 9.065 5.517 6.864 1026 HE1 TYR 117 1HE TYR 117 13.477 6.393 4.882 1027 HE2 TYR 117 2HE TYR 117 11.046 5.598 8.323 1028 HH TYR 117 HH TYR 117 14.024 6.815 7.305 1029 H TYR 118 H TYR 118 9.424 7.847 1.957 1030 HA TYR 118 HA TYR 118 11.277 9.658 3.119 1031 1HB TYR 118 2HB TYR 118 10.462 9.369 0.234 1032 2HB TYR 118 1HB TYR 118 11.742 10.432 0.785 1033 HD1 TYR 118 1HD TYR 118 13.595 9.149 2.274 1034 HD2 TYR 118 2HD TYR 118 11.028 7.351 -0.572 1035 HE1 TYR 118 1HE TYR 118 15.222 7.328 1.955 1036 HE2 TYR 118 2HE TYR 118 12.623 5.537 -0.892 1037 HH TYR 118 HH TYR 118 15.268 4.976 1.134 1038 H LEU 119 H LEU 119 8.207 10.125 1.727 1039 HA LEU 119 HA LEU 119 8.508 13.049 1.890 1040 1HB LEU 119 2HB LEU 119 6.181 11.453 0.820 1041 2HB LEU 119 1HB LEU 119 6.281 13.203 0.809 1042 1HD1 LEU 119 1HD1 LEU 119 5.946 13.237 -1.652 1043 2HD1 LEU 119 2HD1 LEU 119 5.836 11.477 -1.664 1044 3HD1 LEU 119 3HD1 LEU 119 7.007 12.293 -2.697 1045 1HD2 LEU 119 1HD2 LEU 119 8.074 14.316 -0.669 1046 2HD2 LEU 119 2HD2 LEU 119 9.020 13.299 -1.757 1047 3HD2 LEU 119 3HD2 LEU 119 9.321 13.253 -0.020 1048 H ASN 120 H ASN 120 7.564 10.602 3.812 1049 HA ASN 120 HA ASN 120 6.336 10.255 5.622 1050 1HB ASN 120 2HB ASN 120 7.938 11.824 6.625 1051 2HB ASN 120 1HB ASN 120 6.922 13.185 6.160 1052 1HD2 ASN 120 1HD2 ASN 120 6.657 13.889 8.276 1053 2HD2 ASN 120 2HD2 ASN 120 5.694 13.054 9.423 1054 H THR 121 H THR 121 4.554 9.916 4.104 1055 HA THR 121 HA THR 121 2.254 11.279 5.056 1056 HB THR 121 HB THR 121 2.965 11.238 2.094 1057 HG1 THR 121 1HG THR 121 3.615 12.995 3.878 1058 1HG2 THR 121 1HG2 THR 121 0.830 12.419 1.766 1059 2HG2 THR 121 2HG2 THR 121 0.489 12.274 3.492 1060 3HG2 THR 121 3HG2 THR 121 0.583 10.829 2.486 1061 HA PRO 122 HA PRO 122 1.399 6.893 4.844 1062 1HB PRO 122 2HB PRO 122 -1.423 7.705 5.133 1063 2HB PRO 122 1HB PRO 122 -0.441 6.671 6.169 1064 1HG PRO 122 2HG PRO 122 -1.145 9.150 6.904 1065 2HG PRO 122 1HG PRO 122 0.411 8.435 7.371 1066 1HD PRO 122 2HD PRO 122 -0.192 10.459 5.245 1067 2HD PRO 122 1HD PRO 122 1.204 10.336 6.336 1068 H LEU 123 H LEU 123 0.491 5.438 3.427 1069 HA LEU 123 HA LEU 123 0.423 6.138 0.750 1070 1HB LEU 123 2HB LEU 123 -0.685 3.707 2.122 1071 2HB LEU 123 1HB LEU 123 -0.567 3.876 0.386 1072 1HD1 LEU 123 1HD2 LEU 123 0.743 1.705 0.529 1073 2HD1 LEU 123 2HD2 LEU 123 0.701 1.756 2.290 1074 3HD1 LEU 123 3HD2 LEU 123 2.248 1.681 1.447 1075 1HD2 LEU 123 1HD1 LEU 123 2.156 5.143 0.180 1076 2HD2 LEU 123 2HD1 LEU 123 1.627 3.733 -0.740 1077 3HD2 LEU 123 3HD1 LEU 123 3.100 3.654 0.224 1078 H GLU 124 H GLU 124 -2.319 5.613 2.981 1079 HA GLU 124 HA GLU 124 -4.358 5.726 1.134 1080 1HB GLU 124 2HB GLU 124 -4.298 6.549 4.026 1081 2HB GLU 124 1HB GLU 124 -5.767 6.333 3.082 1082 1HG GLU 124 2HG GLU 124 -5.332 4.016 2.782 1083 2HG GLU 124 1HG GLU 124 -3.713 4.190 3.459 1084 H ASP 125 H ASP 125 -2.641 8.385 2.678 1085 HA ASP 125 HA ASP 125 -4.456 10.367 1.711 1086 1HB ASP 125 2HB ASP 125 -2.943 10.702 3.685 1087 2HB ASP 125 1HB ASP 125 -1.585 10.765 2.566 1088 H ILE 126 H ILE 126 -1.675 8.800 0.572 1089 HA ILE 126 HA ILE 126 -0.969 10.597 -1.555 1090 HB ILE 126 HB ILE 126 -0.107 7.756 -0.974 1091 1HG1 ILE 126 2HG1 ILE 126 1.303 10.407 -0.593 1092 2HG1 ILE 126 1HG1 ILE 126 0.620 9.402 0.681 1093 1HG2 ILE 126 1HG2 ILE 126 1.689 8.096 -2.595 1094 2HG2 ILE 126 2HG2 ILE 126 0.981 9.648 -3.046 1095 3HG2 ILE 126 3HG2 ILE 126 0.097 8.152 -3.351 1096 1HD1 ILE 126 1HD1 ILE 126 2.915 8.658 -1.119 1097 2HD1 ILE 126 2HD1 ILE 126 2.237 7.651 0.159 1098 3HD1 ILE 126 3HD1 ILE 126 3.033 9.172 0.564 1099 H PHE 127 H PHE 127 -2.318 7.345 -1.553 1100 HA PHE 127 HA PHE 127 -3.396 7.897 -4.240 1101 1HB PHE 127 2HB PHE 127 -2.702 5.190 -3.010 1102 2HB PHE 127 1HB PHE 127 -3.502 5.429 -4.558 1103 HD1 PHE 127 1HD PHE 127 -2.197 6.733 -6.334 1104 HD2 PHE 127 2HD PHE 127 -0.436 5.096 -2.825 1105 HE1 PHE 127 1HE PHE 127 0.007 6.767 -7.424 1106 HE2 PHE 127 2HE PHE 127 1.770 5.137 -3.909 1107 HZ PHE 127 HZ PHE 127 1.993 5.973 -6.213 1108 H GLN 128 H GLN 128 -5.486 7.582 -4.660 1109 HA GLN 128 HA GLN 128 -7.197 6.923 -2.391 1110 1HB GLN 128 2HB GLN 128 -7.628 9.144 -3.388 1111 2HB GLN 128 1HB GLN 128 -7.845 8.398 -4.966 1112 1HG GLN 128 2HG GLN 128 -9.796 7.188 -4.127 1113 2HG GLN 128 1HG GLN 128 -9.577 7.932 -2.546 1114 1HE2 GLN 128 1HE2 GLN 128 -10.568 8.424 -5.825 1115 2HE2 GLN 128 2HE2 GLN 128 -11.327 9.938 -5.592 1116 H TRP 129 H TRP 129 -8.215 5.116 -2.492 1117 HA TRP 129 HA TRP 129 -8.285 3.669 -5.015 1118 1HB TRP 129 2HB TRP 129 -8.197 1.648 -3.229 1119 2HB TRP 129 1HB TRP 129 -6.791 2.318 -4.035 1120 HD1 TRP 129 HD TRP 129 -8.723 3.113 -0.733 1121 HE1 TRP 129 1HE TRP 129 -6.982 3.648 1.062 1122 HE3 TRP 129 3HE TRP 129 -4.522 2.623 -3.573 1123 HZ2 TRP 129 2HZ TRP 129 -4.152 3.813 1.235 1124 HZ3 TRP 129 3HZ TRP 129 -2.332 2.976 -2.514 1125 HH2 TRP 129 HH TRP 129 -2.158 3.559 -0.165 1126 H GLN 130 H GLN 130 -10.127 3.155 -5.640 1127 HA GLN 130 HA GLN 130 -12.347 3.004 -3.723 1128 1HB GLN 130 2HB GLN 130 -12.428 4.011 -6.573 1129 2HB GLN 130 1HB GLN 130 -13.783 3.930 -5.462 1130 1HG GLN 130 2HG GLN 130 -11.338 5.620 -5.033 1131 2HG GLN 130 1HG GLN 130 -12.803 6.222 -5.783 1132 1HE2 GLN 130 1HE2 GLN 130 -13.232 7.719 -4.219 1133 2HE2 GLN 130 2HE2 GLN 130 -13.718 7.299 -2.608 1134 HA PRO 131 HA PRO 131 -12.276 -1.042 -5.878 1135 1HB PRO 131 2HB PRO 131 -13.544 -2.033 -3.436 1136 2HB PRO 131 1HB PRO 131 -11.987 -2.488 -4.131 1137 1HG PRO 131 2HG PRO 131 -12.208 -1.089 -1.813 1138 2HG PRO 131 1HG PRO 131 -10.835 -0.903 -2.922 1139 1HD PRO 131 2HD PRO 131 -13.250 0.839 -2.583 1140 2HD PRO 131 1HD PRO 131 -11.549 1.302 -2.807 1141 H GLU 132 H GLU 132 -14.640 0.569 -4.086 1142 HA GLU 132 HA GLU 132 -16.826 -0.800 -5.513 1143 1HB GLU 132 2HB GLU 132 -16.990 0.807 -2.956 1144 2HB GLU 132 1HB GLU 132 -18.354 0.032 -3.752 1145 1HG GLU 132 2HG GLU 132 -17.263 -2.150 -3.447 1146 2HG GLU 132 1HG GLU 132 -15.946 -1.349 -2.592 Start of MODEL 15 1 1H MET 1 1HT MET 1 13.303 -4.659 3.692 2 2H MET 1 2HT MET 1 12.296 -3.613 4.503 3 3H MET 1 3HT MET 1 11.814 -4.227 3.018 4 HA MET 1 HA MET 1 11.719 -6.465 4.002 5 1HB MET 1 2HB MET 1 12.295 -4.948 6.553 6 2HB MET 1 1HB MET 1 11.710 -6.598 6.487 7 1HG MET 1 2HG MET 1 13.780 -7.238 5.314 8 2HG MET 1 1HG MET 1 14.357 -5.581 5.498 9 1HE MET 1 1HE MET 1 12.212 -7.662 8.065 10 2HE MET 1 2HE MET 1 13.465 -8.401 9.058 11 3HE MET 1 3HE MET 1 13.285 -8.875 7.369 12 H ILE 2 H ILE 2 9.751 -7.145 4.568 13 HA ILE 2 HA ILE 2 7.777 -5.074 5.288 14 HB ILE 2 HB ILE 2 7.341 -7.617 3.675 15 1HG1 ILE 2 2HG1 ILE 2 8.478 -5.919 2.348 16 2HG1 ILE 2 1HG1 ILE 2 6.824 -6.113 1.785 17 1HG2 ILE 2 1HG2 ILE 2 5.038 -6.820 3.318 18 2HG2 ILE 2 2HG2 ILE 2 5.348 -5.474 4.413 19 3HG2 ILE 2 3HG2 ILE 2 5.378 -7.129 5.022 20 1HD1 ILE 2 1HD1 ILE 2 7.487 -3.779 1.818 21 2HD1 ILE 2 2HD1 ILE 2 7.842 -3.892 3.544 22 3HD1 ILE 2 3HD1 ILE 2 6.186 -4.079 2.969 23 H ILE 3 H ILE 3 6.569 -5.479 7.093 24 HA ILE 3 HA ILE 3 6.761 -8.128 8.326 25 HB ILE 3 HB ILE 3 6.689 -5.414 9.734 26 1HG1 ILE 3 2HG1 ILE 3 8.904 -7.485 9.666 27 2HG1 ILE 3 1HG1 ILE 3 8.915 -5.959 8.793 28 1HG2 ILE 3 1HG2 ILE 3 6.781 -8.202 10.907 29 2HG2 ILE 3 2HG2 ILE 3 5.409 -7.094 10.954 30 3HG2 ILE 3 3HG2 ILE 3 6.893 -6.697 11.823 31 1HD1 ILE 3 1HD1 ILE 3 10.277 -5.842 10.806 32 2HD1 ILE 3 2HD1 ILE 3 8.881 -6.287 11.788 33 3HD1 ILE 3 3HD1 ILE 3 8.896 -4.751 10.921 34 H ASN 4 H ASN 4 4.708 -9.008 8.355 35 HA ASN 4 HA ASN 4 2.488 -7.179 7.968 36 1HB ASN 4 2HB ASN 4 2.753 -9.046 6.388 37 2HB ASN 4 1HB ASN 4 2.688 -10.190 7.724 38 1HD2 ASN 4 1HD2 ASN 4 0.845 -11.243 6.925 39 2HD2 ASN 4 2HD2 ASN 4 -0.690 -10.474 6.943 40 H ASN 5 H ASN 5 0.958 -6.873 9.488 41 HA ASN 5 HA ASN 5 0.814 -8.710 11.765 42 1HB ASN 5 2HB ASN 5 0.884 -5.689 11.866 43 2HB ASN 5 1HB ASN 5 0.201 -6.646 13.173 44 1HD2 ASN 5 1HD2 ASN 5 3.075 -5.599 11.611 45 2HD2 ASN 5 2HD2 ASN 5 4.201 -6.282 12.714 46 H LEU 6 H LEU 6 -0.570 -8.552 9.376 47 HA LEU 6 HA LEU 6 -3.104 -7.368 9.368 48 1HB LEU 6 2HB LEU 6 -1.991 -8.585 7.459 49 2HB LEU 6 1HB LEU 6 -2.407 -10.089 8.231 50 HG LEU 6 HG LEU 6 -3.816 -9.395 6.251 51 1HD1 LEU 6 1HD1 LEU 6 -4.614 -11.110 7.767 52 2HD1 LEU 6 2HD1 LEU 6 -5.945 -10.103 7.198 53 3HD1 LEU 6 3HD1 LEU 6 -5.298 -9.875 8.824 54 1HD2 LEU 6 1HD2 LEU 6 -5.589 -7.763 6.644 55 2HD2 LEU 6 2HD2 LEU 6 -3.983 -7.040 6.746 56 3HD2 LEU 6 3HD2 LEU 6 -4.888 -7.389 8.218 57 H LYS 7 H LYS 7 -2.067 -10.404 10.812 58 HA LYS 7 HA LYS 7 -4.603 -11.283 11.640 59 1HB LYS 7 2HB LYS 7 -3.456 -12.759 13.241 60 2HB LYS 7 1HB LYS 7 -2.736 -12.835 11.643 61 1HG LYS 7 2HG LYS 7 -0.879 -11.463 12.381 62 2HG LYS 7 1HG LYS 7 -1.627 -11.264 13.965 63 1HD LYS 7 2HD LYS 7 -0.766 -13.906 12.776 64 2HD LYS 7 1HD LYS 7 0.162 -12.978 13.953 65 1HE LYS 7 2HE LYS 7 -1.678 -13.177 15.557 66 2HE LYS 7 1HE LYS 7 -2.608 -14.098 14.376 67 1HZ LYS 7 1HZ LYS 7 -0.997 -15.859 14.474 68 2HZ LYS 7 2HZ LYS 7 -1.456 -15.495 16.042 69 3HZ LYS 7 3HZ LYS 7 0.028 -14.949 15.452 70 H LEU 8 H LEU 8 -2.269 -9.165 13.284 71 HA LEU 8 HA LEU 8 -3.691 -8.992 15.692 72 1HB LEU 8 2HB LEU 8 -1.271 -8.446 15.376 73 2HB LEU 8 1HB LEU 8 -1.723 -7.040 14.452 74 HG LEU 8 HG LEU 8 -0.929 -6.630 16.822 75 1HD1 LEU 8 1HD1 LEU 8 -3.673 -5.608 16.160 76 2HD1 LEU 8 2HD1 LEU 8 -2.141 -4.907 15.637 77 3HD1 LEU 8 3HD1 LEU 8 -2.570 -4.915 17.348 78 1HD2 LEU 8 1HD2 LEU 8 -2.544 -6.961 18.631 79 2HD2 LEU 8 2HD2 LEU 8 -2.025 -8.484 17.908 80 3HD2 LEU 8 3HD2 LEU 8 -3.608 -7.814 17.512 81 H ILE 9 H ILE 9 -3.809 -7.162 12.704 82 HA ILE 9 HA ILE 9 -5.683 -5.287 13.693 83 HB ILE 9 HB ILE 9 -4.822 -5.965 10.866 84 1HG1 ILE 9 2HG1 ILE 9 -4.150 -3.566 10.834 85 2HG1 ILE 9 1HG1 ILE 9 -4.724 -3.403 12.481 86 1HG2 ILE 9 1HG2 ILE 9 -6.302 -4.207 9.977 87 2HG2 ILE 9 2HG2 ILE 9 -7.051 -4.056 11.571 88 3HG2 ILE 9 3HG2 ILE 9 -7.211 -5.553 10.667 89 1HD1 ILE 9 1HD1 ILE 9 -2.998 -4.973 13.220 90 2HD1 ILE 9 2HD1 ILE 9 -2.313 -3.575 12.391 91 3HD1 ILE 9 3HD1 ILE 9 -2.433 -5.123 11.556 92 H ARG 10 H ARG 10 -5.991 -8.371 12.163 93 HA ARG 10 HA ARG 10 -8.809 -8.493 12.028 94 1HB ARG 10 2HB ARG 10 -6.732 -10.617 12.389 95 2HB ARG 10 1HB ARG 10 -8.443 -10.994 12.434 96 1HG ARG 10 2HG ARG 10 -8.684 -10.145 10.161 97 2HG ARG 10 1HG ARG 10 -6.952 -9.780 10.126 98 1HD ARG 10 2HD ARG 10 -7.597 -11.975 9.088 99 2HD ARG 10 1HD ARG 10 -6.375 -12.068 10.359 100 HE ARG 10 HE ARG 10 -9.085 -12.425 11.269 101 1HH1 ARG 10 1HH1 ARG 10 -6.337 -14.138 9.811 102 2HH1 ARG 10 2HH1 ARG 10 -6.605 -15.581 10.640 103 1HH2 ARG 10 1HH2 ARG 10 -9.431 -14.448 12.505 104 2HH2 ARG 10 2HH2 ARG 10 -8.381 -15.758 12.193 105 H GLU 11 H GLU 11 -6.553 -9.042 14.766 106 HA GLU 11 HA GLU 11 -8.534 -9.880 16.549 107 1HB GLU 11 2HB GLU 11 -5.835 -8.626 17.070 108 2HB GLU 11 1HB GLU 11 -6.811 -9.498 18.247 109 1HG GLU 11 2HG GLU 11 -6.646 -11.507 16.804 110 2HG GLU 11 1HG GLU 11 -5.580 -10.603 15.752 111 H LYS 12 H LYS 12 -7.183 -6.751 15.728 112 HA LYS 12 HA LYS 12 -8.500 -5.186 17.594 113 1HB LYS 12 2HB LYS 12 -7.839 -4.482 14.721 114 2HB LYS 12 1HB LYS 12 -8.315 -3.308 15.946 115 1HG LYS 12 2HG LYS 12 -6.357 -3.858 17.276 116 2HG LYS 12 1HG LYS 12 -5.896 -5.099 16.117 117 1HD LYS 12 2HD LYS 12 -4.566 -3.044 15.857 118 2HD LYS 12 1HD LYS 12 -5.521 -3.386 14.417 119 1HE LYS 12 2HE LYS 12 -7.084 -1.684 14.949 120 2HE LYS 12 1HE LYS 12 -6.423 -1.492 16.570 121 1HZ LYS 12 1HZ LYS 12 -4.538 -0.415 15.742 122 2HZ LYS 12 2HZ LYS 12 -5.797 0.224 14.806 123 3HZ LYS 12 3HZ LYS 12 -4.756 -0.939 14.168 124 H LYS 13 H LYS 13 -9.795 -6.421 14.551 125 HA LYS 13 HA LYS 13 -12.480 -5.610 15.427 126 1HB LYS 13 2HB LYS 13 -11.508 -6.776 12.776 127 2HB LYS 13 1HB LYS 13 -13.191 -6.444 13.140 128 1HG LYS 13 2HG LYS 13 -10.968 -4.422 12.855 129 2HG LYS 13 1HG LYS 13 -12.305 -4.699 11.738 130 1HD LYS 13 2HD LYS 13 -13.868 -4.080 13.615 131 2HD LYS 13 1HD LYS 13 -12.450 -3.599 14.544 132 1HE LYS 13 2HE LYS 13 -13.378 -1.635 13.543 133 2HE LYS 13 1HE LYS 13 -11.877 -2.011 12.698 134 1HZ LYS 13 1HZ LYS 13 -13.645 -1.432 11.130 135 2HZ LYS 13 2HZ LYS 13 -14.625 -2.632 11.743 136 3HZ LYS 13 3HZ LYS 13 -13.248 -3.056 10.909 137 H LYS 14 H LYS 14 -14.051 -8.211 14.487 138 HA LYS 14 HA LYS 14 -12.157 -10.123 15.203 139 1HB LYS 14 2HB LYS 14 -14.113 -11.249 16.433 140 2HB LYS 14 1HB LYS 14 -13.334 -9.907 17.250 141 1HG LYS 14 2HG LYS 14 -15.178 -8.434 16.564 142 2HG LYS 14 1HG LYS 14 -15.951 -9.800 15.755 143 1HD LYS 14 2HD LYS 14 -16.141 -10.969 17.882 144 2HD LYS 14 1HD LYS 14 -15.308 -9.647 18.700 145 1HE LYS 14 2HE LYS 14 -17.929 -9.364 17.227 146 2HE LYS 14 1HE LYS 14 -17.798 -9.638 18.961 147 1HZ LYS 14 1HZ LYS 14 -16.600 -7.537 19.160 148 2HZ LYS 14 2HZ LYS 14 -18.113 -7.307 18.495 149 3HZ LYS 14 3HZ LYS 14 -16.750 -7.231 17.505 150 H ILE 15 H ILE 15 -11.948 -10.319 12.996 151 HA ILE 15 HA ILE 15 -14.157 -11.799 11.740 152 HB ILE 15 HB ILE 15 -12.324 -9.791 10.352 153 1HG1 ILE 15 2HG1 ILE 15 -15.297 -9.604 10.938 154 2HG1 ILE 15 1HG1 ILE 15 -14.037 -8.695 11.762 155 1HG2 ILE 15 1HG2 ILE 15 -14.635 -11.388 9.247 156 2HG2 ILE 15 2HG2 ILE 15 -12.928 -11.653 8.896 157 3HG2 ILE 15 3HG2 ILE 15 -13.713 -10.165 8.372 158 1HD1 ILE 15 1HD1 ILE 15 -15.183 -7.326 10.116 159 2HD1 ILE 15 2HD1 ILE 15 -14.764 -8.477 8.847 160 3HD1 ILE 15 3HD1 ILE 15 -13.496 -7.561 9.659 161 H SER 16 H SER 16 -13.517 -13.642 10.631 162 HA SER 16 HA SER 16 -10.776 -14.494 11.135 163 1HB SER 16 2HB SER 16 -12.991 -16.127 9.917 164 2HB SER 16 1HB SER 16 -11.578 -16.689 10.814 165 HG SER 16 HG SER 16 -13.961 -15.647 11.623 166 H GLN 17 H GLN 17 -9.962 -15.981 9.256 167 HA GLN 17 HA GLN 17 -9.459 -14.193 7.072 168 1HB GLN 17 2HB GLN 17 -8.139 -16.074 6.065 169 2HB GLN 17 1HB GLN 17 -7.638 -15.634 7.689 170 1HG GLN 17 2HG GLN 17 -8.731 -17.535 8.612 171 2HG GLN 17 1HG GLN 17 -9.472 -17.920 7.064 172 1HE2 GLN 17 1HE2 GLN 17 -6.523 -17.945 8.920 173 2HE2 GLN 17 2HE2 GLN 17 -5.683 -19.031 7.885 174 H SER 18 H SER 18 -11.726 -16.952 7.526 175 HA SER 18 HA SER 18 -12.272 -17.375 4.884 176 1HB SER 18 2HB SER 18 -14.379 -18.265 6.255 177 2HB SER 18 1HB SER 18 -12.814 -19.094 6.256 178 HG SER 18 HG SER 18 -14.004 -17.509 8.263 179 H GLU 19 H GLU 19 -13.905 -15.427 7.420 180 HA GLU 19 HA GLU 19 -15.917 -14.461 5.757 181 1HB GLU 19 2HB GLU 19 -14.731 -13.091 8.182 182 2HB GLU 19 1HB GLU 19 -16.220 -12.619 7.386 183 1HG GLU 19 2HG GLU 19 -16.933 -13.804 9.238 184 2HG GLU 19 1HG GLU 19 -17.028 -14.986 7.936 185 H LEU 20 H LEU 20 -12.712 -13.300 6.420 186 HA LEU 20 HA LEU 20 -12.824 -10.893 4.963 187 1HB LEU 20 2HB LEU 20 -10.494 -12.739 5.440 188 2HB LEU 20 1HB LEU 20 -10.342 -11.194 4.638 189 HG LEU 20 HG LEU 20 -11.245 -11.601 7.488 190 1HD1 LEU 20 1HD1 LEU 20 -9.080 -10.626 8.054 191 2HD1 LEU 20 2HD1 LEU 20 -8.651 -10.587 6.342 192 3HD1 LEU 20 3HD1 LEU 20 -8.896 -12.132 7.156 193 1HD2 LEU 20 1HD2 LEU 20 -11.027 -9.168 7.654 194 2HD2 LEU 20 2HD2 LEU 20 -12.245 -9.619 6.461 195 3HD2 LEU 20 3HD2 LEU 20 -10.652 -9.079 5.933 196 H ALA 21 H ALA 21 -12.115 -14.195 3.929 197 HA ALA 21 HA ALA 21 -11.321 -13.623 1.312 198 1HB ALA 21 1HB ALA 21 -12.755 -16.072 2.325 199 2HB ALA 21 2HB ALA 21 -11.012 -15.808 2.375 200 3HB ALA 21 3HB ALA 21 -11.841 -15.949 0.822 201 H ALA 22 H ALA 22 -14.585 -14.519 2.552 202 HA ALA 22 HA ALA 22 -15.856 -14.207 0.085 203 1HB ALA 22 1HB ALA 22 -16.779 -15.491 1.937 204 2HB ALA 22 2HB ALA 22 -17.910 -14.249 1.400 205 3HB ALA 22 3HB ALA 22 -16.973 -14.012 2.875 206 H LEU 23 H LEU 23 -15.300 -12.011 2.738 207 HA LEU 23 HA LEU 23 -16.852 -9.824 1.908 208 1HB LEU 23 2HB LEU 23 -15.805 -10.125 4.152 209 2HB LEU 23 1HB LEU 23 -14.253 -9.754 3.432 210 HG LEU 23 HG LEU 23 -15.066 -7.481 2.911 211 1HD1 LEU 23 1HD1 LEU 23 -17.142 -6.701 3.923 212 2HD1 LEU 23 2HD1 LEU 23 -17.484 -8.335 4.492 213 3HD1 LEU 23 3HD1 LEU 23 -17.452 -7.992 2.762 214 1HD2 LEU 23 1HD2 LEU 23 -13.819 -7.925 4.960 215 2HD2 LEU 23 2HD2 LEU 23 -15.324 -8.315 5.798 216 3HD2 LEU 23 3HD2 LEU 23 -15.037 -6.675 5.219 217 H LEU 24 H LEU 24 -13.613 -10.812 1.053 218 HA LEU 24 HA LEU 24 -13.177 -8.416 -0.557 219 1HB LEU 24 2HB LEU 24 -11.356 -10.765 -0.089 220 2HB LEU 24 1HB LEU 24 -10.923 -9.231 -0.811 221 HG LEU 24 HG LEU 24 -11.702 -9.707 2.055 222 1HD1 LEU 24 1HD1 LEU 24 -9.068 -8.989 0.816 223 2HD1 LEU 24 2HD1 LEU 24 -9.513 -10.540 1.532 224 3HD1 LEU 24 3HD1 LEU 24 -9.403 -9.098 2.543 225 1HD2 LEU 24 1HD2 LEU 24 -12.478 -7.524 1.331 226 2HD2 LEU 24 2HD2 LEU 24 -10.880 -7.156 0.681 227 3HD2 LEU 24 3HD2 LEU 24 -11.099 -7.359 2.421 228 H GLU 25 H GLU 25 -14.789 -11.170 -1.003 229 HA GLU 25 HA GLU 25 -15.345 -12.586 -2.611 230 1HB GLU 25 2HB GLU 25 -14.611 -10.250 -4.373 231 2HB GLU 25 1HB GLU 25 -15.551 -11.643 -4.892 232 1HG GLU 25 2HG GLU 25 -17.213 -11.065 -3.114 233 2HG GLU 25 1HG GLU 25 -16.309 -9.573 -2.852 234 H VAL 26 H VAL 26 -12.914 -13.205 -1.705 235 HA VAL 26 HA VAL 26 -11.536 -14.145 -4.098 236 HB VAL 26 HB VAL 26 -9.361 -14.018 -2.903 237 1HG1 VAL 26 1HG1 VAL 26 -9.925 -12.224 -4.424 238 2HG1 VAL 26 2HG1 VAL 26 -9.006 -11.595 -3.055 239 3HG1 VAL 26 3HG1 VAL 26 -10.749 -11.355 -3.132 240 1HG2 VAL 26 1HG2 VAL 26 -9.126 -12.670 -0.857 241 2HG2 VAL 26 2HG2 VAL 26 -10.171 -14.067 -0.594 242 3HG2 VAL 26 3HG2 VAL 26 -10.877 -12.464 -0.798 243 H SER 27 H SER 27 -9.988 -16.022 -3.317 244 HA SER 27 HA SER 27 -11.750 -17.910 -2.038 245 1HB SER 27 2HB SER 27 -8.963 -18.326 -3.134 246 2HB SER 27 1HB SER 27 -10.197 -19.552 -2.845 247 HG SER 27 HG SER 27 -10.299 -17.436 -4.734 248 H ARG 28 H ARG 28 -11.109 -19.129 -0.192 249 HA ARG 28 HA ARG 28 -9.908 -17.642 1.870 250 1HB ARG 28 2HB ARG 28 -10.375 -20.618 1.763 251 2HB ARG 28 1HB ARG 28 -9.978 -19.706 3.207 252 1HG ARG 28 2HG ARG 28 -12.105 -18.417 2.855 253 2HG ARG 28 1HG ARG 28 -12.499 -19.575 1.579 254 1HD ARG 28 2HD ARG 28 -11.973 -20.221 4.480 255 2HD ARG 28 1HD ARG 28 -13.546 -20.222 3.683 256 HE ARG 28 HE ARG 28 -12.843 -22.093 2.401 257 1HH1 ARG 28 1HH1 ARG 28 -10.664 -21.291 5.109 258 2HH1 ARG 28 2HH1 ARG 28 -10.050 -22.874 5.259 259 1HH2 ARG 28 1HH2 ARG 28 -11.967 -24.271 2.649 260 2HH2 ARG 28 2HH2 ARG 28 -10.802 -24.604 3.845 261 H GLN 29 H GLN 29 -8.594 -20.139 -0.284 262 HA GLN 29 HA GLN 29 -6.154 -20.454 1.000 263 1HB GLN 29 2HB GLN 29 -7.158 -21.994 -0.637 264 2HB GLN 29 1HB GLN 29 -6.993 -20.794 -1.892 265 1HG GLN 29 2HG GLN 29 -4.553 -21.806 -0.504 266 2HG GLN 29 1HG GLN 29 -5.357 -22.826 -1.688 267 1HE2 GLN 29 1HE2 GLN 29 -3.388 -20.054 -1.182 268 2HE2 GLN 29 2HE2 GLN 29 -3.097 -19.726 -2.859 269 H THR 30 H THR 30 -7.309 -18.069 -1.322 270 HA THR 30 HA THR 30 -4.811 -16.958 -1.995 271 HB THR 30 HB THR 30 -7.481 -15.551 -2.021 272 HG1 THR 30 1HG THR 30 -6.539 -17.085 -4.221 273 1HG2 THR 30 1HG2 THR 30 -6.537 -14.455 -4.018 274 2HG2 THR 30 2HG2 THR 30 -5.052 -15.385 -3.828 275 3HG2 THR 30 3HG2 THR 30 -5.508 -14.194 -2.611 276 H ILE 31 H ILE 31 -7.405 -15.881 0.278 277 HA ILE 31 HA ILE 31 -5.956 -13.691 1.260 278 HB ILE 31 HB ILE 31 -8.398 -13.831 1.577 279 1HG1 ILE 31 2HG1 ILE 31 -8.566 -13.131 3.955 280 2HG1 ILE 31 1HG1 ILE 31 -6.919 -13.689 4.209 281 1HG2 ILE 31 1HG2 ILE 31 -9.405 -15.258 3.278 282 2HG2 ILE 31 2HG2 ILE 31 -7.841 -16.034 3.535 283 3HG2 ILE 31 3HG2 ILE 31 -8.655 -16.183 1.979 284 1HD1 ILE 31 1HD1 ILE 31 -7.002 -11.284 3.918 285 2HD1 ILE 31 2HD1 ILE 31 -7.769 -11.489 2.343 286 3HD1 ILE 31 3HD1 ILE 31 -6.115 -12.046 2.599 287 H ASN 32 H ASN 32 -6.065 -17.026 2.315 288 HA ASN 32 HA ASN 32 -4.533 -16.796 4.659 289 1HB ASN 32 2HB ASN 32 -5.746 -18.864 4.016 290 2HB ASN 32 1HB ASN 32 -4.603 -19.112 2.701 291 1HD2 ASN 32 1HD2 ASN 32 -3.893 -21.067 3.477 292 2HD2 ASN 32 2HD2 ASN 32 -2.904 -21.213 4.885 293 H GLY 33 H GLY 33 -3.591 -17.319 1.285 294 1HA GLY 33 2HA GLY 33 -0.829 -17.516 1.669 295 2HA GLY 33 1HA GLY 33 -1.620 -17.018 0.183 296 H ILE 34 H ILE 34 -2.908 -14.626 1.224 297 HA ILE 34 HA ILE 34 -0.785 -12.796 1.103 298 HB ILE 34 HB ILE 34 -3.684 -12.396 1.921 299 1HG1 ILE 34 2HG1 ILE 34 -3.461 -13.259 -0.366 300 2HG1 ILE 34 1HG1 ILE 34 -4.042 -11.600 -0.372 301 1HG2 ILE 34 1HG2 ILE 34 -1.638 -10.321 1.133 302 2HG2 ILE 34 2HG2 ILE 34 -2.327 -10.558 2.739 303 3HG2 ILE 34 3HG2 ILE 34 -3.355 -10.018 1.413 304 1HD1 ILE 34 1HD1 ILE 34 -2.414 -11.974 -2.140 305 2HD1 ILE 34 2HD1 ILE 34 -1.222 -12.498 -0.951 306 3HD1 ILE 34 3HD1 ILE 34 -1.790 -10.827 -0.955 307 H GLU 35 H GLU 35 -2.952 -13.791 3.769 308 HA GLU 35 HA GLU 35 -1.799 -12.244 5.768 309 1HB GLU 35 2HB GLU 35 -3.960 -13.525 5.940 310 2HB GLU 35 1HB GLU 35 -3.015 -14.988 6.176 311 1HG GLU 35 2HG GLU 35 -2.012 -13.977 8.193 312 2HG GLU 35 1HG GLU 35 -3.049 -12.571 7.970 313 H LYS 36 H LYS 36 -0.760 -15.408 4.510 314 HA LYS 36 HA LYS 36 1.310 -15.658 6.494 315 1HB LYS 36 2HB LYS 36 0.527 -17.299 4.084 316 2HB LYS 36 1HB LYS 36 1.933 -17.664 5.074 317 1HG LYS 36 2HG LYS 36 -0.904 -17.542 6.086 318 2HG LYS 36 1HG LYS 36 -0.039 -19.022 5.659 319 1HD LYS 36 2HD LYS 36 0.878 -17.044 7.747 320 2HD LYS 36 1HD LYS 36 -0.018 -18.525 8.097 321 1HE LYS 36 2HE LYS 36 1.765 -19.878 7.232 322 2HE LYS 36 1HE LYS 36 2.620 -18.454 6.645 323 1HZ LYS 36 1HZ LYS 36 2.070 -19.013 9.511 324 2HZ LYS 36 2HZ LYS 36 3.051 -17.769 8.849 325 3HZ LYS 36 3HZ LYS 36 3.516 -19.360 8.706 326 H ASN 37 H ASN 37 0.987 -13.614 4.110 327 HA ASN 37 HA ASN 37 2.158 -12.541 2.569 328 1HB ASN 37 2HB ASN 37 4.254 -11.525 3.367 329 2HB ASN 37 1HB ASN 37 3.049 -11.557 4.636 330 1HD2 ASN 37 1HD2 ASN 37 6.137 -12.604 3.606 331 2HD2 ASN 37 2HD2 ASN 37 6.634 -13.377 5.062 332 H LYS 38 H LYS 38 2.112 -15.231 1.908 333 HA LYS 38 HA LYS 38 4.825 -15.764 0.954 334 1HB LYS 38 2HB LYS 38 3.737 -17.589 2.216 335 2HB LYS 38 1HB LYS 38 2.416 -17.608 1.060 336 1HG LYS 38 2HG LYS 38 3.826 -18.460 -0.661 337 2HG LYS 38 1HG LYS 38 5.273 -18.179 0.305 338 1HD LYS 38 2HD LYS 38 4.658 -20.551 0.266 339 2HD LYS 38 1HD LYS 38 4.564 -19.883 1.893 340 1HE LYS 38 2HE LYS 38 2.134 -19.697 1.676 341 2HE LYS 38 1HE LYS 38 2.229 -20.335 0.034 342 1HZ LYS 38 1HZ LYS 38 3.109 -21.796 2.466 343 2HZ LYS 38 2HZ LYS 38 3.094 -22.402 0.906 344 3HZ LYS 38 3HZ LYS 38 1.635 -22.054 1.684 345 H TYR 39 H TYR 39 1.822 -14.650 -0.008 346 HA TYR 39 HA TYR 39 2.239 -15.172 -2.828 347 1HB TYR 39 2HB TYR 39 0.027 -14.069 -1.202 348 2HB TYR 39 1HB TYR 39 0.167 -13.473 -2.852 349 HD1 TYR 39 1HD TYR 39 0.316 -16.772 -1.072 350 HD2 TYR 39 2HD TYR 39 -1.063 -14.537 -4.404 351 HE1 TYR 39 1HE TYR 39 -0.846 -18.767 -1.923 352 HE2 TYR 39 2HE TYR 39 -2.228 -16.518 -5.268 353 HH TYR 39 HH TYR 39 -2.108 -18.897 -5.086 354 H ASN 40 H ASN 40 3.397 -13.015 -0.669 355 HA ASN 40 HA ASN 40 4.491 -11.032 -0.715 356 1HB ASN 40 2HB ASN 40 5.691 -12.016 -2.689 357 2HB ASN 40 1HB ASN 40 4.460 -11.350 -3.746 358 1HD2 ASN 40 1HD2 ASN 40 4.499 -9.162 -4.206 359 2HD2 ASN 40 2HD2 ASN 40 5.851 -8.158 -3.827 360 HA PRO 41 HA PRO 41 0.614 -8.856 -0.717 361 1HB PRO 41 2HB PRO 41 2.274 -6.771 0.588 362 2HB PRO 41 1HB PRO 41 0.772 -7.527 1.133 363 1HG PRO 41 2HG PRO 41 3.095 -8.183 2.254 364 2HG PRO 41 1HG PRO 41 1.862 -9.417 1.938 365 1HD PRO 41 2HD PRO 41 4.358 -8.796 0.410 366 2HD PRO 41 1HD PRO 41 3.658 -10.374 0.829 367 H SER 42 H SER 42 0.001 -8.097 -2.635 368 HA SER 42 HA SER 42 1.344 -5.769 -3.769 369 1HB SER 42 2HB SER 42 -0.975 -7.413 -4.851 370 2HB SER 42 1HB SER 42 -0.033 -6.209 -5.738 371 HG SER 42 HG SER 42 1.816 -7.560 -5.251 372 H LEU 43 H LEU 43 -0.161 -3.924 -4.375 373 HA LEU 43 HA LEU 43 -1.369 -3.215 -1.947 374 1HB LEU 43 2HB LEU 43 -0.141 -1.628 -3.435 375 2HB LEU 43 1HB LEU 43 -1.485 -1.676 -4.547 376 HG LEU 43 HG LEU 43 -1.296 0.372 -3.043 377 1HD1 LEU 43 1HD1 LEU 43 -3.887 -1.150 -2.963 378 2HD1 LEU 43 2HD1 LEU 43 -3.335 -0.075 -4.249 379 3HD1 LEU 43 3HD1 LEU 43 -3.697 0.576 -2.649 380 1HD2 LEU 43 1HD2 LEU 43 -0.722 -0.753 -0.913 381 2HD2 LEU 43 2HD2 LEU 43 -2.266 -1.562 -0.900 382 3HD2 LEU 43 3HD2 LEU 43 -2.191 0.183 -0.732 383 H GLN 44 H GLN 44 -2.950 -4.069 -5.150 384 HA GLN 44 HA GLN 44 -5.492 -3.453 -4.432 385 1HB GLN 44 2HB GLN 44 -4.796 -4.186 -6.660 386 2HB GLN 44 1HB GLN 44 -4.463 -5.796 -6.045 387 1HG GLN 44 2HG GLN 44 -6.540 -5.825 -7.232 388 2HG GLN 44 1HG GLN 44 -6.869 -6.043 -5.515 389 1HE2 GLN 44 1HE2 GLN 44 -7.887 -4.367 -4.381 390 2HE2 GLN 44 2HE2 GLN 44 -8.723 -3.103 -5.220 391 H LEU 45 H LEU 45 -3.817 -6.477 -3.912 392 HA LEU 45 HA LEU 45 -5.901 -7.811 -2.568 393 1HB LEU 45 2HB LEU 45 -2.931 -8.338 -2.476 394 2HB LEU 45 1HB LEU 45 -4.114 -9.369 -1.710 395 HG LEU 45 HG LEU 45 -3.469 -10.422 -3.710 396 1HD1 LEU 45 1HD1 LEU 45 -5.802 -10.616 -3.261 397 2HD1 LEU 45 2HD1 LEU 45 -5.524 -10.575 -5.001 398 3HD1 LEU 45 3HD1 LEU 45 -6.137 -9.145 -4.172 399 1HD2 LEU 45 1HD2 LEU 45 -2.464 -8.549 -4.900 400 2HD2 LEU 45 2HD2 LEU 45 -4.059 -7.859 -5.195 401 3HD2 LEU 45 3HD2 LEU 45 -3.611 -9.393 -5.941 402 H ALA 46 H ALA 46 -3.132 -6.039 -1.282 403 HA ALA 46 HA ALA 46 -3.734 -6.642 1.431 404 1HB ALA 46 1HB ALA 46 -1.471 -6.099 0.664 405 2HB ALA 46 2HB ALA 46 -1.993 -5.049 1.980 406 3HB ALA 46 3HB ALA 46 -1.988 -4.448 0.322 407 H LEU 47 H LEU 47 -4.487 -3.883 -0.685 408 HA LEU 47 HA LEU 47 -5.316 -2.251 1.435 409 1HB LEU 47 2HB LEU 47 -4.437 -1.349 -0.658 410 2HB LEU 47 1HB LEU 47 -5.798 -2.001 -1.529 411 HG LEU 47 HG LEU 47 -5.763 0.513 -1.046 412 1HD1 LEU 47 1HD1 LEU 47 -7.764 -0.609 -1.874 413 2HD1 LEU 47 2HD1 LEU 47 -8.172 0.648 -0.706 414 3HD1 LEU 47 3HD1 LEU 47 -8.206 -1.048 -0.221 415 1HD2 LEU 47 1HD2 LEU 47 -5.075 0.394 1.281 416 2HD2 LEU 47 2HD2 LEU 47 -6.548 -0.483 1.691 417 3HD2 LEU 47 3HD2 LEU 47 -6.643 1.191 1.140 418 H LYS 48 H LYS 48 -7.088 -4.493 -0.661 419 HA LYS 48 HA LYS 48 -9.562 -3.430 0.111 420 1HB LYS 48 2HB LYS 48 -10.583 -5.653 -0.532 421 2HB LYS 48 1HB LYS 48 -9.655 -4.853 -1.782 422 1HG LYS 48 2HG LYS 48 -7.803 -6.380 -1.411 423 2HG LYS 48 1HG LYS 48 -8.685 -7.146 -0.087 424 1HD LYS 48 2HD LYS 48 -8.845 -8.437 -2.192 425 2HD LYS 48 1HD LYS 48 -10.417 -7.884 -1.618 426 1HE LYS 48 2HE LYS 48 -10.284 -5.988 -3.204 427 2HE LYS 48 1HE LYS 48 -8.759 -6.632 -3.805 428 1HZ LYS 48 1HZ LYS 48 -11.351 -8.095 -3.915 429 2HZ LYS 48 2HZ LYS 48 -9.870 -8.549 -4.639 430 3HZ LYS 48 3HZ LYS 48 -10.686 -7.190 -5.164 431 H ILE 49 H ILE 49 -7.605 -5.831 1.589 432 HA ILE 49 HA ILE 49 -9.305 -6.515 3.748 433 HB ILE 49 HB ILE 49 -6.330 -6.217 4.178 434 1HG1 ILE 49 2HG1 ILE 49 -7.636 -8.569 2.776 435 2HG1 ILE 49 1HG1 ILE 49 -6.702 -7.332 1.945 436 1HG2 ILE 49 1HG2 ILE 49 -8.398 -8.224 5.093 437 2HG2 ILE 49 2HG2 ILE 49 -7.731 -6.900 6.049 438 3HG2 ILE 49 3HG2 ILE 49 -6.692 -8.233 5.546 439 1HD1 ILE 49 1HD1 ILE 49 -5.667 -9.201 4.063 440 2HD1 ILE 49 2HD1 ILE 49 -4.726 -7.961 3.233 441 3HD1 ILE 49 3HD1 ILE 49 -5.380 -9.326 2.326 442 H ALA 50 H ALA 50 -6.946 -3.984 3.312 443 HA ALA 50 HA ALA 50 -6.930 -2.835 5.913 444 1HB ALA 50 1HB ALA 50 -5.775 -0.969 4.859 445 2HB ALA 50 2HB ALA 50 -6.249 -1.584 3.274 446 3HB ALA 50 3HB ALA 50 -5.131 -2.514 4.280 447 H TYR 51 H TYR 51 -8.686 -2.146 2.997 448 HA TYR 51 HA TYR 51 -9.976 0.202 3.854 449 1HB TYR 51 2HB TYR 51 -9.669 -0.092 1.549 450 2HB TYR 51 1HB TYR 51 -10.319 -1.718 1.574 451 HD1 TYR 51 1HD TYR 51 -12.512 -2.103 1.159 452 HD2 TYR 51 2HD TYR 51 -11.256 1.871 1.855 453 HE1 TYR 51 1HE TYR 51 -14.726 -1.291 0.409 454 HE2 TYR 51 2HE TYR 51 -13.449 2.714 1.116 455 HH TYR 51 HH TYR 51 -16.101 0.615 0.695 456 H TYR 52 H TYR 52 -11.064 -3.202 3.655 457 HA TYR 52 HA TYR 52 -13.621 -2.517 4.671 458 1HB TYR 52 2HB TYR 52 -12.294 -5.160 4.182 459 2HB TYR 52 1HB TYR 52 -13.846 -5.067 5.014 460 HD1 TYR 52 1HD TYR 52 -15.779 -4.042 3.858 461 HD2 TYR 52 2HD TYR 52 -12.172 -4.903 1.811 462 HE1 TYR 52 1HE TYR 52 -16.960 -3.863 1.732 463 HE2 TYR 52 2HE TYR 52 -13.340 -4.730 -0.337 464 HH TYR 52 HH TYR 52 -16.456 -3.367 -0.561 465 H LEU 53 H LEU 53 -10.796 -3.832 6.141 466 HA LEU 53 HA LEU 53 -11.982 -3.921 8.771 467 1HB LEU 53 2HB LEU 53 -9.064 -3.959 7.990 468 2HB LEU 53 1HB LEU 53 -9.644 -4.186 9.629 469 1HD1 LEU 53 1HD1 LEU 53 -8.801 -7.609 8.457 470 2HD1 LEU 53 2HD1 LEU 53 -8.423 -6.382 9.666 471 3HD1 LEU 53 3HD1 LEU 53 -7.920 -6.154 7.991 472 1HD2 LEU 53 1HD2 LEU 53 -12.057 -5.970 8.924 473 2HD2 LEU 53 2HD2 LEU 53 -10.905 -6.274 10.225 474 3HD2 LEU 53 3HD2 LEU 53 -11.188 -7.504 8.996 475 H ASN 54 H ASN 54 -10.972 -1.490 6.853 476 HA ASN 54 HA ASN 54 -10.315 0.645 6.971 477 1HB ASN 54 2HB ASN 54 -12.719 0.780 7.616 478 2HB ASN 54 1HB ASN 54 -12.224 0.774 9.307 479 1HD2 ASN 54 1HD2 ASN 54 -10.591 2.457 6.621 480 2HD2 ASN 54 2HD2 ASN 54 -10.894 4.027 7.225 481 H THR 55 H THR 55 -8.216 0.031 7.573 482 HA THR 55 HA THR 55 -7.421 1.388 10.009 483 HB THR 55 HB THR 55 -6.436 -1.397 9.242 484 HG1 THR 55 1HG THR 55 -8.680 -0.720 10.435 485 1HG2 THR 55 1HG2 THR 55 -5.389 -1.383 11.463 486 2HG2 THR 55 2HG2 THR 55 -6.012 0.242 11.754 487 3HG2 THR 55 3HG2 THR 55 -4.804 -0.030 10.494 488 HA PRO 56 HA PRO 56 -4.578 3.051 6.956 489 1HB PRO 56 2HB PRO 56 -2.447 3.602 8.635 490 2HB PRO 56 1HB PRO 56 -3.822 4.676 8.367 491 1HG PRO 56 2HG PRO 56 -3.352 2.769 10.619 492 2HG PRO 56 1HG PRO 56 -4.051 4.399 10.657 493 1HD PRO 56 2HD PRO 56 -5.593 2.213 10.801 494 2HD PRO 56 1HD PRO 56 -6.126 3.659 9.914 495 H LEU 57 H LEU 57 -3.054 2.232 5.748 496 HA LEU 57 HA LEU 57 -2.310 -0.424 5.861 497 1HB LEU 57 2HB LEU 57 -0.949 1.835 4.414 498 2HB LEU 57 1HB LEU 57 -0.545 0.151 4.191 499 1HD1 LEU 57 1HD1 LEU 57 -3.992 1.721 4.341 500 2HD1 LEU 57 2HD1 LEU 57 -4.172 1.704 2.587 501 3HD1 LEU 57 3HD1 LEU 57 -3.008 2.790 3.343 502 1HD2 LEU 57 1HD2 LEU 57 -1.165 1.747 1.940 503 2HD2 LEU 57 2HD2 LEU 57 -2.424 0.761 1.177 504 3HD2 LEU 57 3HD2 LEU 57 -0.998 -0.005 1.900 505 H GLU 58 H GLU 58 -0.562 2.405 6.923 506 HA GLU 58 HA GLU 58 1.862 1.277 7.636 507 1HB GLU 58 2HB GLU 58 0.537 3.431 9.278 508 2HB GLU 58 1HB GLU 58 2.250 3.154 9.038 509 1HG GLU 58 2HG GLU 58 1.929 4.959 7.656 510 2HG GLU 58 1HG GLU 58 1.627 3.616 6.546 511 H ASP 59 H ASP 59 -1.191 1.242 9.415 512 HA ASP 59 HA ASP 59 0.004 0.293 11.831 513 1HB ASP 59 2HB ASP 59 -2.165 1.579 11.731 514 2HB ASP 59 1HB ASP 59 -2.914 0.137 11.052 515 H ILE 60 H ILE 60 -1.525 -1.055 9.090 516 HA ILE 60 HA ILE 60 -1.783 -3.734 10.137 517 HB ILE 60 HB ILE 60 -2.091 -2.840 7.258 518 1HG1 ILE 60 2HG1 ILE 60 -4.146 -3.225 9.449 519 2HG1 ILE 60 1HG1 ILE 60 -3.646 -1.686 8.763 520 1HG2 ILE 60 1HG2 ILE 60 -1.694 -5.245 7.482 521 2HG2 ILE 60 2HG2 ILE 60 -3.368 -4.936 7.013 522 3HG2 ILE 60 3HG2 ILE 60 -2.983 -5.356 8.683 523 1HD1 ILE 60 1HD1 ILE 60 -5.788 -2.396 7.887 524 2HD1 ILE 60 2HD1 ILE 60 -5.065 -3.899 7.309 525 3HD1 ILE 60 3HD1 ILE 60 -4.573 -2.357 6.612 526 H PHE 61 H PHE 61 0.205 -2.264 7.635 527 HA PHE 61 HA PHE 61 2.057 -4.535 7.830 528 1HB PHE 61 2HB PHE 61 1.507 -2.665 5.460 529 2HB PHE 61 1HB PHE 61 2.847 -3.801 5.544 530 HD1 PHE 61 1HD PHE 61 2.466 -6.152 5.269 531 HD2 PHE 61 2HD PHE 61 -0.766 -3.386 5.212 532 HE1 PHE 61 1HE PHE 61 1.011 -7.876 4.287 533 HE2 PHE 61 2HE PHE 61 -2.226 -5.106 4.236 534 HZ PHE 61 HZ PHE 61 -1.339 -7.355 3.773 535 H GLN 62 H GLN 62 4.131 -4.141 8.242 536 HA GLN 62 HA GLN 62 4.918 -1.364 8.693 537 1HB GLN 62 2HB GLN 62 5.742 -3.893 10.139 538 2HB GLN 62 1HB GLN 62 6.710 -2.436 10.212 539 1HG GLN 62 2HG GLN 62 5.347 -2.621 12.196 540 2HG GLN 62 1HG GLN 62 4.816 -1.246 11.242 541 1HE2 GLN 62 1HE2 GLN 62 2.820 -1.241 12.253 542 2HE2 GLN 62 2HE2 GLN 62 1.607 -2.407 11.856 543 H TRP 63 H TRP 63 6.447 -0.652 7.466 544 HA TRP 63 HA TRP 63 7.991 -2.645 6.023 545 1HB TRP 63 2HB TRP 63 8.241 -0.814 4.242 546 2HB TRP 63 1HB TRP 63 6.732 -1.697 4.349 547 HD1 TRP 63 HD TRP 63 8.184 1.805 4.946 548 HE1 TRP 63 1HE TRP 63 6.218 3.463 5.081 549 HE3 TRP 63 3HE TRP 63 4.309 -1.518 5.002 550 HZ2 TRP 63 2HZ TRP 63 3.404 3.369 5.181 551 HZ3 TRP 63 3HZ TRP 63 2.017 -0.658 5.107 552 HH2 TRP 63 HH TRP 63 1.568 1.717 5.185 553 H GLN 64 H GLN 64 9.975 -2.739 6.326 554 HA GLN 64 HA GLN 64 11.340 -0.512 7.678 555 1HB GLN 64 2HB GLN 64 12.063 -3.450 7.626 556 2HB GLN 64 1HB GLN 64 12.831 -2.197 8.580 557 1HG GLN 64 2HG GLN 64 9.992 -3.142 8.921 558 2HG GLN 64 1HG GLN 64 11.362 -3.669 9.892 559 1HE2 GLN 64 1HE2 GLN 64 12.275 -2.237 11.319 560 2HE2 GLN 64 2HE2 GLN 64 11.442 -0.817 11.863 561 HA PRO 65 HA PRO 65 13.405 -0.924 3.550 562 1HB PRO 65 2HB PRO 65 13.689 1.984 3.709 563 2HB PRO 65 1HB PRO 65 12.850 1.021 2.489 564 1HG PRO 65 2HG PRO 65 11.523 2.598 4.222 565 2HG PRO 65 1HG PRO 65 10.851 1.061 3.644 566 1HD PRO 65 2HD PRO 65 12.264 1.652 6.225 567 2HD PRO 65 1HD PRO 65 10.757 0.745 5.957 568 H GLU 66 H GLU 66 14.113 0.849 6.363 569 HA GLU 66 HA GLU 66 16.952 1.162 5.768 570 1HB GLU 66 2HB GLU 66 15.395 2.054 8.203 571 2HB GLU 66 1HB GLU 66 17.038 2.523 7.790 572 1HG GLU 66 2HG GLU 66 14.575 3.203 6.189 573 2HG GLU 66 1HG GLU 66 15.402 4.286 7.305 574 1H MET 67 1HT MET 67 -12.662 1.184 -9.130 575 2H MET 67 2HT MET 67 -12.271 1.905 -7.674 576 3H MET 67 3HT MET 67 -11.139 0.942 -8.445 577 HA MET 67 HA MET 67 -11.042 2.563 -10.276 578 1HB MET 67 2HB MET 67 -13.475 3.296 -9.659 579 2HB MET 67 1HB MET 67 -12.708 4.330 -8.470 580 1HG MET 67 2HG MET 67 -12.209 4.453 -11.439 581 2HG MET 67 1HG MET 67 -13.353 5.460 -10.573 582 1HE MET 67 1HE MET 67 -12.240 7.562 -11.708 583 2HE MET 67 2HE MET 67 -11.091 6.512 -12.537 584 3HE MET 67 3HE MET 67 -10.514 7.917 -11.643 585 H ILE 68 H ILE 68 -9.101 3.585 -10.077 586 HA ILE 68 HA ILE 68 -8.204 4.274 -7.345 587 HB ILE 68 HB ILE 68 -6.520 3.308 -9.681 588 1HG1 ILE 68 2HG1 ILE 68 -7.822 1.491 -8.677 589 2HG1 ILE 68 1HG1 ILE 68 -6.109 1.290 -8.343 590 1HG2 ILE 68 1HG2 ILE 68 -5.637 3.975 -6.872 591 2HG2 ILE 68 2HG2 ILE 68 -5.260 4.892 -8.330 592 3HG2 ILE 68 3HG2 ILE 68 -4.623 3.258 -8.125 593 1HD1 ILE 68 1HD1 ILE 68 -7.458 0.732 -6.403 594 2HD1 ILE 68 2HD1 ILE 68 -8.187 2.337 -6.426 595 3HD1 ILE 68 3HD1 ILE 68 -6.467 2.154 -6.075 596 H ILE 69 H ILE 69 -7.353 6.293 -6.992 597 HA ILE 69 HA ILE 69 -7.080 8.094 -9.281 598 HB ILE 69 HB ILE 69 -7.782 8.870 -6.410 599 1HG1 ILE 69 2HG1 ILE 69 -10.018 9.657 -7.476 600 2HG1 ILE 69 1HG1 ILE 69 -9.623 8.548 -8.780 601 1HG2 ILE 69 1HG2 ILE 69 -7.701 10.529 -8.915 602 2HG2 ILE 69 2HG2 ILE 69 -6.571 10.585 -7.561 603 3HG2 ILE 69 3HG2 ILE 69 -8.244 11.092 -7.334 604 1HD1 ILE 69 1HD1 ILE 69 -11.154 7.543 -7.185 605 2HD1 ILE 69 2HD1 ILE 69 -9.993 7.809 -5.883 606 3HD1 ILE 69 3HD1 ILE 69 -9.609 6.694 -7.193 607 H ASN 70 H ASN 70 -4.957 8.970 -9.415 608 HA ASN 70 HA ASN 70 -3.194 8.221 -7.238 609 1HB ASN 70 2HB ASN 70 -2.606 7.319 -9.406 610 2HB ASN 70 1HB ASN 70 -2.753 8.901 -10.151 611 1HD2 ASN 70 1HD2 ASN 70 -0.669 8.700 -10.928 612 2HD2 ASN 70 2HD2 ASN 70 0.727 8.862 -9.921 613 H ASN 71 H ASN 71 -2.305 9.796 -5.984 614 HA ASN 71 HA ASN 71 -2.741 12.586 -6.835 615 1HB ASN 71 2HB ASN 71 -2.618 11.596 -3.968 616 2HB ASN 71 1HB ASN 71 -2.995 13.199 -4.531 617 1HD2 ASN 71 1HD2 ASN 71 -4.463 11.314 -2.851 618 2HD2 ASN 71 2HD2 ASN 71 -6.036 11.183 -3.552 619 H LEU 72 H LEU 72 -0.468 10.471 -6.876 620 HA LEU 72 HA LEU 72 1.607 11.024 -5.119 621 1HB LEU 72 2HB LEU 72 1.551 9.191 -6.849 622 2HB LEU 72 1HB LEU 72 1.942 10.377 -8.062 623 HG LEU 72 HG LEU 72 3.826 8.868 -7.346 624 1HD1 LEU 72 1HD1 LEU 72 4.318 11.807 -6.946 625 2HD1 LEU 72 2HD1 LEU 72 4.347 10.938 -8.481 626 3HD1 LEU 72 3HD1 LEU 72 5.553 10.583 -7.245 627 1HD2 LEU 72 1HD2 LEU 72 3.336 8.750 -4.982 628 2HD2 LEU 72 2HD2 LEU 72 3.674 10.471 -4.805 629 3HD2 LEU 72 3HD2 LEU 72 4.971 9.360 -5.238 630 H LYS 73 H LYS 73 0.850 12.726 -8.102 631 HA LYS 73 HA LYS 73 2.959 14.509 -8.183 632 1HB LYS 73 2HB LYS 73 1.378 16.008 -9.469 633 2HB LYS 73 1HB LYS 73 1.518 14.364 -10.071 634 1HG LYS 73 2HG LYS 73 -0.579 13.806 -8.867 635 2HG LYS 73 1HG LYS 73 -0.731 15.505 -8.432 636 1HD LYS 73 2HD LYS 73 -0.877 16.116 -10.774 637 2HD LYS 73 1HD LYS 73 -0.619 14.435 -11.253 638 1HE LYS 73 2HE LYS 73 -2.673 13.808 -10.038 639 2HE LYS 73 1HE LYS 73 -2.937 15.505 -9.653 640 1HZ LYS 73 1HZ LYS 73 -3.150 15.977 -12.001 641 2HZ LYS 73 2HZ LYS 73 -4.244 14.759 -11.521 642 3HZ LYS 73 3HZ LYS 73 -2.855 14.339 -12.379 643 H LEU 74 H LEU 74 -0.074 14.837 -6.342 644 HA LEU 74 HA LEU 74 0.380 17.442 -5.371 645 1HB LEU 74 2HB LEU 74 -1.324 15.181 -4.338 646 2HB LEU 74 1HB LEU 74 -1.221 16.713 -3.510 647 HG LEU 74 HG LEU 74 -3.237 16.649 -4.766 648 1HD1 LEU 74 1HD1 LEU 74 -2.138 18.757 -4.641 649 2HD1 LEU 74 2HD1 LEU 74 -2.991 18.593 -6.184 650 3HD1 LEU 74 3HD1 LEU 74 -1.231 18.408 -6.115 651 1HD2 LEU 74 1HD2 LEU 74 -1.541 16.107 -7.179 652 2HD2 LEU 74 2HD2 LEU 74 -3.287 16.411 -7.201 653 3HD2 LEU 74 3HD2 LEU 74 -2.642 14.964 -6.412 654 H ILE 75 H ILE 75 1.231 14.258 -4.173 655 HA ILE 75 HA ILE 75 1.985 15.075 -1.605 656 HB ILE 75 HB ILE 75 2.562 12.591 -3.225 657 1HG1 ILE 75 2HG1 ILE 75 1.354 11.456 -1.392 658 2HG1 ILE 75 1HG1 ILE 75 1.186 12.984 -0.554 659 1HG2 ILE 75 1HG2 ILE 75 4.631 12.952 -2.019 660 2HG2 ILE 75 2HG2 ILE 75 3.760 11.582 -1.326 661 3HG2 ILE 75 3HG2 ILE 75 3.746 13.145 -0.507 662 1HD1 ILE 75 1HD1 ILE 75 -0.240 13.799 -2.359 663 2HD1 ILE 75 2HD1 ILE 75 -0.874 12.319 -1.637 664 3HD1 ILE 75 3HD1 ILE 75 -0.051 12.261 -3.196 665 H ARG 76 H ARG 76 3.771 14.842 -4.595 666 HA ARG 76 HA ARG 76 6.398 15.325 -3.619 667 1HB ARG 76 2HB ARG 76 5.299 16.481 -6.168 668 2HB ARG 76 1HB ARG 76 6.954 16.051 -5.806 669 1HG ARG 76 2HG ARG 76 6.472 13.739 -6.029 670 2HG ARG 76 1HG ARG 76 4.729 14.054 -6.097 671 1HD ARG 76 2HD ARG 76 6.816 14.886 -8.104 672 2HD ARG 76 1HD ARG 76 5.509 13.724 -8.346 673 HE ARG 76 HE ARG 76 4.289 16.091 -7.573 674 1HH1 ARG 76 1HH1 ARG 76 6.071 14.929 -10.421 675 2HH1 ARG 76 2HH1 ARG 76 5.546 16.192 -11.404 676 1HH2 ARG 76 1HH2 ARG 76 3.463 17.795 -9.030 677 2HH2 ARG 76 2HH2 ARG 76 4.027 17.769 -10.631 678 H GLU 77 H GLU 77 3.771 17.504 -4.762 679 HA GLU 77 HA GLU 77 5.300 19.827 -4.545 680 1HB GLU 77 2HB GLU 77 2.415 19.307 -5.139 681 2HB GLU 77 1HB GLU 77 3.183 20.892 -5.216 682 1HG GLU 77 2HG GLU 77 4.741 20.097 -6.877 683 2HG GLU 77 1HG GLU 77 4.064 18.479 -6.761 684 H LYS 78 H LYS 78 2.764 18.403 -2.510 685 HA LYS 78 HA LYS 78 2.772 20.549 -0.754 686 1HB LYS 78 2HB LYS 78 1.994 17.675 -0.285 687 2HB LYS 78 1HB LYS 78 1.693 18.972 0.876 688 1HG LYS 78 2HG LYS 78 0.355 20.178 -0.731 689 2HG LYS 78 1HG LYS 78 0.727 18.993 -1.976 690 1HD LYS 78 2HD LYS 78 -1.503 18.664 -1.104 691 2HD LYS 78 1HD LYS 78 -0.472 17.297 -0.693 692 1HE LYS 78 2HE LYS 78 -0.195 18.142 1.545 693 2HE LYS 78 1HE LYS 78 -1.133 19.586 1.152 694 1HZ LYS 78 1HZ LYS 78 -2.242 16.844 0.929 695 2HZ LYS 78 2HZ LYS 78 -3.098 18.318 0.974 696 3HZ LYS 78 3HZ LYS 78 -2.326 17.747 2.347 697 H LYS 79 H LYS 79 4.965 17.957 -0.963 698 HA LYS 79 HA LYS 79 6.543 19.010 1.295 699 1HB LYS 79 2HB LYS 79 7.200 16.833 -0.754 700 2HB LYS 79 1HB LYS 79 8.200 17.233 0.635 701 1HG LYS 79 2HG LYS 79 5.395 16.122 0.775 702 2HG LYS 79 1HG LYS 79 6.876 15.189 0.988 703 1HD LYS 79 2HD LYS 79 7.457 16.523 2.946 704 2HD LYS 79 1HD LYS 79 6.024 17.521 2.713 705 1HE LYS 79 2HE LYS 79 5.957 14.544 3.241 706 2HE LYS 79 1HE LYS 79 5.806 15.771 4.492 707 1HZ LYS 79 1HZ LYS 79 3.633 14.906 3.731 708 2HZ LYS 79 2HZ LYS 79 3.923 15.478 2.185 709 3HZ LYS 79 3HZ LYS 79 3.775 16.547 3.460 710 H LYS 80 H LYS 80 9.453 19.562 -0.130 711 HA LYS 80 HA LYS 80 8.448 20.610 -2.441 712 1HB LYS 80 2HB LYS 80 10.052 22.493 -1.915 713 2HB LYS 80 1HB LYS 80 8.617 22.461 -0.907 714 1HG LYS 80 2HG LYS 80 9.977 21.357 0.870 715 2HG LYS 80 1HG LYS 80 11.397 21.589 -0.152 716 1HD LYS 80 2HD LYS 80 11.018 24.011 -0.112 717 2HD LYS 80 1HD LYS 80 9.601 23.768 0.911 718 1HE LYS 80 2HE LYS 80 12.470 23.145 1.596 719 2HE LYS 80 1HE LYS 80 11.468 24.416 2.289 720 1HZ LYS 80 1HZ LYS 80 11.215 21.492 2.654 721 2HZ LYS 80 2HZ LYS 80 9.970 22.536 3.076 722 3HZ LYS 80 3HZ LYS 80 11.445 22.636 3.859 723 H ILE 81 H ILE 81 9.163 18.344 -2.803 724 HA ILE 81 HA ILE 81 12.049 18.299 -3.290 725 HB ILE 81 HB ILE 81 10.259 15.940 -2.582 726 1HG1 ILE 81 2HG1 ILE 81 12.464 17.283 -0.998 727 2HG1 ILE 81 1HG1 ILE 81 10.743 17.374 -0.649 728 1HG2 ILE 81 1HG2 ILE 81 13.233 16.041 -3.080 729 2HG2 ILE 81 2HG2 ILE 81 12.030 15.311 -4.144 730 3HG2 ILE 81 3HG2 ILE 81 12.325 14.625 -2.546 731 1HD1 ILE 81 1HD1 ILE 81 12.439 14.891 -0.551 732 2HD1 ILE 81 2HD1 ILE 81 10.715 14.978 -0.190 733 3HD1 ILE 81 3HD1 ILE 81 11.874 15.824 0.835 734 H SER 82 H SER 82 12.681 17.736 -5.317 735 HA SER 82 HA SER 82 10.715 17.750 -7.395 736 1HB SER 82 2HB SER 82 13.715 17.351 -7.500 737 2HB SER 82 1HB SER 82 12.666 17.803 -8.845 738 HG SER 82 HG SER 82 12.910 19.791 -8.260 739 H GLN 83 H GLN 83 10.711 15.994 -9.046 740 HA GLN 83 HA GLN 83 10.342 13.543 -7.661 741 1HB GLN 83 2HB GLN 83 9.525 12.566 -9.745 742 2HB GLN 83 1HB GLN 83 8.771 14.103 -9.407 743 1HG GLN 83 2HG GLN 83 9.094 14.214 -11.671 744 2HG GLN 83 1HG GLN 83 10.537 15.030 -11.084 745 1HE2 GLN 83 1HE2 GLN 83 9.267 12.083 -12.406 746 2HE2 GLN 83 2HE2 GLN 83 10.750 11.465 -13.040 747 H SER 84 H SER 84 12.964 14.764 -9.572 748 HA SER 84 HA SER 84 14.206 12.327 -10.088 749 1HB SER 84 2HB SER 84 15.421 15.064 -9.762 750 2HB SER 84 1HB SER 84 16.036 13.721 -10.736 751 HG SER 84 HG SER 84 13.636 14.009 -11.613 752 H GLU 85 H GLU 85 14.368 14.640 -7.380 753 HA GLU 85 HA GLU 85 16.472 13.467 -5.940 754 1HB GLU 85 2HB GLU 85 14.043 14.886 -4.838 755 2HB GLU 85 1HB GLU 85 15.579 14.668 -4.023 756 1HG GLU 85 2HG GLU 85 15.116 16.309 -6.495 757 2HG GLU 85 1HG GLU 85 15.279 16.932 -4.855 758 H LEU 86 H LEU 86 12.990 12.915 -6.030 759 HA LEU 86 HA LEU 86 12.761 11.083 -3.939 760 1HB LEU 86 2HB LEU 86 11.157 11.369 -6.479 761 2HB LEU 86 1HB LEU 86 10.663 10.373 -5.132 762 HG LEU 86 HG LEU 86 10.980 13.371 -5.068 763 1HD1 LEU 86 1HD1 LEU 86 8.518 11.632 -5.081 764 2HD1 LEU 86 2HD1 LEU 86 9.077 12.649 -6.409 765 3HD1 LEU 86 3HD1 LEU 86 8.542 13.385 -4.897 766 1HD2 LEU 86 1HD2 LEU 86 9.924 13.200 -2.864 767 2HD2 LEU 86 2HD2 LEU 86 11.461 12.340 -2.908 768 3HD2 LEU 86 3HD2 LEU 86 9.945 11.442 -2.991 769 H ALA 87 H ALA 87 13.396 10.665 -7.380 770 HA ALA 87 HA ALA 87 13.342 7.876 -7.494 771 1HB ALA 87 1HB ALA 87 15.038 9.756 -9.140 772 2HB ALA 87 2HB ALA 87 13.367 9.308 -9.484 773 3HB ALA 87 3HB ALA 87 14.637 8.086 -9.549 774 H ALA 88 H ALA 88 16.117 10.077 -6.983 775 HA ALA 88 HA ALA 88 18.062 8.138 -6.686 776 1HB ALA 88 1HB ALA 88 18.515 10.521 -7.022 777 2HB ALA 88 2HB ALA 88 19.370 9.889 -5.613 778 3HB ALA 88 3HB ALA 88 17.911 10.859 -5.397 779 H LEU 89 H LEU 89 16.010 9.666 -4.230 780 HA LEU 89 HA LEU 89 17.235 8.412 -2.012 781 1HB LEU 89 2HB LEU 89 15.792 10.420 -1.849 782 2HB LEU 89 1HB LEU 89 14.405 9.416 -2.240 783 HG LEU 89 HG LEU 89 14.698 8.176 -0.154 784 1HD1 LEU 89 1HD1 LEU 89 16.922 10.139 0.399 785 2HD1 LEU 89 2HD1 LEU 89 17.111 8.410 0.100 786 3HD1 LEU 89 3HD1 LEU 89 16.269 8.966 1.545 787 1HD2 LEU 89 1HD2 LEU 89 13.231 10.114 -0.206 788 2HD2 LEU 89 2HD2 LEU 89 14.587 11.172 0.181 789 3HD2 LEU 89 3HD2 LEU 89 14.028 9.985 1.360 790 H LEU 90 H LEU 90 14.551 7.441 -4.059 791 HA LEU 90 HA LEU 90 13.887 5.165 -2.405 792 1HB LEU 90 2HB LEU 90 12.892 5.865 -5.156 793 2HB LEU 90 1HB LEU 90 12.183 4.716 -4.044 794 HG LEU 90 HG LEU 90 12.291 7.702 -3.689 795 1HD1 LEU 90 1HD1 LEU 90 10.761 7.025 -5.408 796 2HD1 LEU 90 2HD1 LEU 90 9.886 7.600 -3.987 797 3HD1 LEU 90 3HD1 LEU 90 10.003 5.869 -4.312 798 1HD2 LEU 90 1HD2 LEU 90 12.412 6.581 -1.527 799 2HD2 LEU 90 2HD2 LEU 90 11.011 5.595 -1.944 800 3HD2 LEU 90 3HD2 LEU 90 10.834 7.338 -1.744 801 H GLU 91 H GLU 91 16.317 5.740 -4.527 802 HA GLU 91 HA GLU 91 17.785 4.515 -5.706 803 1HB GLU 91 2HB GLU 91 16.601 2.260 -4.085 804 2HB GLU 91 1HB GLU 91 17.981 2.062 -5.153 805 1HG GLU 91 2HG GLU 91 17.834 3.858 -2.746 806 2HG GLU 91 1HG GLU 91 18.679 2.315 -2.853 807 H VAL 92 H VAL 92 15.528 5.201 -7.088 808 HA VAL 92 HA VAL 92 15.291 2.938 -8.887 809 HB VAL 92 HB VAL 92 12.973 3.653 -9.437 810 1HG1 VAL 92 1HG1 VAL 92 13.236 1.841 -7.865 811 2HG1 VAL 92 2HG1 VAL 92 11.835 2.821 -7.432 812 3HG1 VAL 92 3HG1 VAL 92 13.342 2.986 -6.528 813 1HG2 VAL 92 1HG2 VAL 92 11.746 5.193 -7.971 814 2HG2 VAL 92 2HG2 VAL 92 13.106 5.996 -8.758 815 3HG2 VAL 92 3HG2 VAL 92 13.228 5.508 -7.066 816 H SER 93 H SER 93 14.656 3.797 -11.091 817 HA SER 93 HA SER 93 16.385 6.040 -11.667 818 1HB SER 93 2HB SER 93 14.730 4.315 -13.525 819 2HB SER 93 1HB SER 93 16.095 5.342 -13.968 820 HG SER 93 HG SER 93 16.101 3.019 -12.362 821 H ARG 94 H ARG 94 15.521 7.777 -13.175 822 HA ARG 94 HA ARG 94 13.229 8.967 -12.094 823 1HB ARG 94 2HB ARG 94 14.677 9.551 -14.663 824 2HB ARG 94 1HB ARG 94 13.301 10.496 -14.110 825 1HG ARG 94 2HG ARG 94 14.521 11.073 -12.079 826 2HG ARG 94 1HG ARG 94 15.901 10.128 -12.647 827 1HD ARG 94 2HD ARG 94 16.230 12.490 -13.092 828 2HD ARG 94 1HD ARG 94 16.092 11.580 -14.592 829 HE ARG 94 HE ARG 94 13.561 12.467 -14.110 830 1HH1 ARG 94 1HH1 ARG 94 16.705 14.084 -14.422 831 2HH1 ARG 94 2HH1 ARG 94 16.034 15.529 -15.016 832 1HH2 ARG 94 1HH2 ARG 94 12.687 14.408 -15.019 833 2HH2 ARG 94 2HH2 ARG 94 13.750 15.717 -15.392 834 H GLN 95 H GLN 95 13.600 6.951 -14.990 835 HA GLN 95 HA GLN 95 11.042 7.217 -16.004 836 1HB GLN 95 2HB GLN 95 12.819 6.140 -17.217 837 2HB GLN 95 1HB GLN 95 12.971 4.897 -15.989 838 1HG GLN 95 2HG GLN 95 10.806 4.003 -16.586 839 2HG GLN 95 1HG GLN 95 10.570 5.302 -17.754 840 1HE2 GLN 95 1HE2 GLN 95 10.683 2.373 -18.074 841 2HE2 GLN 95 2HE2 GLN 95 11.885 2.098 -19.273 842 H THR 96 H THR 96 12.208 5.370 -13.270 843 HA THR 96 HA THR 96 9.967 3.666 -13.074 844 HB THR 96 HB THR 96 11.870 4.423 -10.849 845 HG1 THR 96 1HG THR 96 12.229 2.860 -13.190 846 1HG2 THR 96 1HG2 THR 96 9.972 2.953 -10.280 847 2HG2 THR 96 2HG2 THR 96 11.502 2.077 -10.188 848 3HG2 THR 96 3HG2 THR 96 10.437 1.854 -11.576 849 H ILE 97 H ILE 97 11.016 6.590 -11.254 850 HA ILE 97 HA ILE 97 8.597 6.737 -9.805 851 HB ILE 97 HB ILE 97 10.631 7.818 -8.921 852 1HG1 ILE 97 2HG1 ILE 97 9.680 10.016 -8.231 853 2HG1 ILE 97 1HG1 ILE 97 8.405 9.806 -9.425 854 1HG2 ILE 97 1HG2 ILE 97 11.481 9.921 -9.813 855 2HG2 ILE 97 2HG2 ILE 97 10.359 9.790 -11.167 856 3HG2 ILE 97 3HG2 ILE 97 11.639 8.594 -10.963 857 1HD1 ILE 97 1HD1 ILE 97 7.627 7.817 -8.234 858 2HD1 ILE 97 2HD1 ILE 97 7.632 9.241 -7.192 859 3HD1 ILE 97 3HD1 ILE 97 8.908 8.032 -7.042 860 H ASN 98 H ASN 98 9.601 8.125 -12.879 861 HA ASN 98 HA ASN 98 7.526 9.966 -13.290 862 1HB ASN 98 2HB ASN 98 9.554 9.891 -14.673 863 2HB ASN 98 1HB ASN 98 9.107 8.308 -15.282 864 1HD2 ASN 98 1HD2 ASN 98 7.615 8.164 -16.940 865 2HD2 ASN 98 2HD2 ASN 98 7.027 9.534 -17.796 866 H GLY 99 H GLY 99 7.793 6.524 -13.986 867 1HA GLY 99 2HA GLY 99 5.329 6.206 -15.301 868 2HA GLY 99 1HA GLY 99 6.228 4.933 -14.487 869 H ILE 100 H ILE 100 6.207 6.114 -11.860 870 HA ILE 100 HA ILE 100 3.637 5.311 -10.993 871 HB ILE 100 HB ILE 100 5.897 6.628 -9.443 872 1HG1 ILE 100 2HG1 ILE 100 6.510 4.437 -10.365 873 2HG1 ILE 100 1HG1 ILE 100 6.377 4.365 -8.613 874 1HG2 ILE 100 1HG2 ILE 100 4.765 5.812 -7.410 875 2HG2 ILE 100 2HG2 ILE 100 3.422 5.247 -8.405 876 3HG2 ILE 100 3HG2 ILE 100 3.768 6.973 -8.297 877 1HD1 ILE 100 1HD1 ILE 100 5.425 2.383 -9.662 878 2HD1 ILE 100 2HD1 ILE 100 4.306 3.395 -10.581 879 3HD1 ILE 100 3HD1 ILE 100 4.178 3.310 -8.825 880 H GLU 101 H GLU 101 5.249 8.481 -11.284 881 HA GLU 101 HA GLU 101 3.321 10.124 -10.208 882 1HB GLU 101 2HB GLU 101 4.952 10.669 -12.688 883 2HB GLU 101 1HB GLU 101 4.097 11.880 -11.756 884 1HG GLU 101 2HG GLU 101 5.551 11.388 -9.842 885 2HG GLU 101 1HG GLU 101 6.427 10.223 -10.839 886 H LYS 102 H LYS 102 3.386 8.699 -13.389 887 HA LYS 102 HA LYS 102 0.791 9.923 -14.018 888 1HB LYS 102 2HB LYS 102 2.674 8.354 -15.801 889 2HB LYS 102 1HB LYS 102 1.190 9.139 -16.325 890 1HG LYS 102 2HG LYS 102 3.585 10.564 -15.169 891 2HG LYS 102 1HG LYS 102 3.194 10.448 -16.885 892 1HD LYS 102 2HD LYS 102 1.175 11.709 -16.579 893 2HD LYS 102 1HD LYS 102 1.353 11.652 -14.823 894 1HE LYS 102 2HE LYS 102 2.005 13.836 -15.693 895 2HE LYS 102 1HE LYS 102 3.381 13.005 -14.980 896 1HZ LYS 102 1HZ LYS 102 4.099 13.986 -16.975 897 2HZ LYS 102 2HZ LYS 102 2.802 13.393 -17.869 898 3HZ LYS 102 3HZ LYS 102 3.996 12.339 -17.313 899 H ASN 103 H ASN 103 1.674 7.451 -12.332 900 HA ASN 103 HA ASN 103 1.154 5.297 -11.871 901 1HB ASN 103 2HB ASN 103 -1.166 4.941 -11.269 902 2HB ASN 103 1HB ASN 103 -0.741 6.600 -10.900 903 1HD2 ASN 103 1HD2 ASN 103 -2.722 4.492 -12.728 904 2HD2 ASN 103 2HD2 ASN 103 -3.737 5.656 -13.462 905 H LYS 104 H LYS 104 1.968 5.357 -14.470 906 HA LYS 104 HA LYS 104 -0.009 3.778 -15.960 907 1HB LYS 104 2HB LYS 104 0.980 5.905 -16.964 908 2HB LYS 104 1HB LYS 104 2.518 5.060 -17.024 909 1HG LYS 104 2HG LYS 104 1.630 3.439 -18.553 910 2HG LYS 104 1HG LYS 104 0.013 4.126 -18.402 911 1HD LYS 104 2HD LYS 104 0.924 6.270 -19.303 912 2HD LYS 104 1HD LYS 104 2.449 5.434 -19.600 913 1HE LYS 104 2HE LYS 104 -0.226 4.663 -20.759 914 2HE LYS 104 1HE LYS 104 1.032 5.561 -21.605 915 1HZ LYS 104 1HZ LYS 104 2.486 3.662 -21.422 916 2HZ LYS 104 2HZ LYS 104 1.042 3.226 -22.174 917 3HZ LYS 104 3HZ LYS 104 1.307 2.771 -20.579 918 H TYR 105 H TYR 105 2.881 3.767 -14.245 919 HA TYR 105 HA TYR 105 4.064 1.367 -15.260 920 1HB TYR 105 2HB TYR 105 5.207 3.342 -14.126 921 2HB TYR 105 1HB TYR 105 4.467 2.813 -12.631 922 HD1 TYR 105 1HD TYR 105 6.851 1.912 -15.255 923 HD2 TYR 105 2HD TYR 105 5.507 1.089 -11.315 924 HE1 TYR 105 1HE TYR 105 8.852 0.526 -14.862 925 HE2 TYR 105 2HE TYR 105 7.482 -0.297 -10.916 926 HH TYR 105 HH TYR 105 9.117 -1.555 -12.200 927 H ASN 106 H ASN 106 1.389 2.141 -13.465 928 HA ASN 106 HA ASN 106 -0.080 1.214 -12.104 929 1HB ASN 106 2HB ASN 106 0.035 -0.873 -13.443 930 2HB ASN 106 1HB ASN 106 1.428 -1.401 -12.505 931 1HD2 ASN 106 1HD2 ASN 106 1.097 -2.272 -10.433 932 2HD2 ASN 106 2HD2 ASN 106 -0.461 -2.642 -9.820 933 HA PRO 107 HA PRO 107 1.820 2.357 -8.361 934 1HB PRO 107 2HB PRO 107 -0.597 1.059 -7.193 935 2HB PRO 107 1HB PRO 107 0.073 2.667 -6.892 936 1HG PRO 107 2HG PRO 107 -2.089 2.361 -8.411 937 2HG PRO 107 1HG PRO 107 -0.850 3.562 -8.815 938 1HD PRO 107 2HD PRO 107 -1.413 0.923 -10.072 939 2HD PRO 107 1HD PRO 107 -0.831 2.426 -10.814 940 H SER 108 H SER 108 3.528 0.954 -8.320 941 HA SER 108 HA SER 108 3.222 -1.757 -7.505 942 1HB SER 108 2HB SER 108 5.702 -0.035 -7.735 943 2HB SER 108 1HB SER 108 5.649 -1.800 -7.676 944 HG SER 108 HG SER 108 4.050 -0.708 -9.619 945 H LEU 109 H LEU 109 3.368 -2.491 -5.466 946 HA LEU 109 HA LEU 109 2.669 -0.594 -3.524 947 1HB LEU 109 2HB LEU 109 1.718 -2.866 -3.619 948 2HB LEU 109 1HB LEU 109 3.268 -3.535 -3.187 949 HG LEU 109 HG LEU 109 1.428 -3.391 -1.389 950 1HD1 LEU 109 1HD1 LEU 109 3.039 -2.962 0.396 951 2HD1 LEU 109 2HD1 LEU 109 4.164 -2.297 -0.788 952 3HD1 LEU 109 3HD1 LEU 109 3.710 -4.000 -0.861 953 1HD2 LEU 109 1HD2 LEU 109 0.749 -1.063 -1.786 954 2HD2 LEU 109 2HD2 LEU 109 2.354 -0.508 -1.368 955 3HD2 LEU 109 3HD2 LEU 109 1.341 -1.258 -0.139 956 H GLN 110 H GLN 110 5.637 -2.629 -3.766 957 HA GLN 110 HA GLN 110 6.913 -1.687 -1.531 958 1HB GLN 110 2HB GLN 110 7.613 -3.565 -3.011 959 2HB GLN 110 1HB GLN 110 8.156 -2.388 -4.195 960 1HG GLN 110 2HG GLN 110 10.034 -3.224 -2.962 961 2HG GLN 110 1HG GLN 110 9.778 -1.528 -2.562 962 1HE2 GLN 110 1HE2 GLN 110 7.837 -4.161 -1.275 963 2HE2 GLN 110 2HE2 GLN 110 8.396 -4.010 0.346 964 H LEU 111 H LEU 111 6.943 -0.359 -4.790 965 HA LEU 111 HA LEU 111 8.730 1.768 -4.362 966 1HB LEU 111 2HB LEU 111 6.534 1.389 -6.392 967 2HB LEU 111 1HB LEU 111 7.526 2.824 -6.370 968 HG LEU 111 HG LEU 111 9.524 1.434 -6.836 969 1HD1 LEU 111 1HD1 LEU 111 8.817 -0.686 -5.859 970 2HD1 LEU 111 2HD1 LEU 111 9.294 -0.887 -7.542 971 3HD1 LEU 111 3HD1 LEU 111 7.584 -0.856 -7.108 972 1HD2 LEU 111 1HD2 LEU 111 8.963 0.912 -9.150 973 2HD2 LEU 111 2HD2 LEU 111 8.322 2.477 -8.646 974 3HD2 LEU 111 3HD2 LEU 111 7.250 1.080 -8.765 975 H ALA 112 H ALA 112 5.262 1.634 -4.191 976 HA ALA 112 HA ALA 112 4.804 4.404 -3.649 977 1HB ALA 112 1HB ALA 112 3.053 2.925 -4.528 978 2HB ALA 112 2HB ALA 112 2.537 3.742 -3.054 979 3HB ALA 112 3HB ALA 112 3.032 2.050 -2.996 980 H LEU 113 H LEU 113 5.297 1.571 -1.665 981 HA LEU 113 HA LEU 113 4.500 2.498 0.823 982 1HB LEU 113 2HB LEU 113 5.352 0.200 -0.352 983 2HB LEU 113 1HB LEU 113 6.715 0.603 0.665 984 HG LEU 113 HG LEU 113 5.266 0.613 2.617 985 1HD1 LEU 113 1HD1 LEU 113 2.954 -0.161 2.419 986 2HD1 LEU 113 2HD1 LEU 113 3.120 -0.229 0.663 987 3HD1 LEU 113 3HD1 LEU 113 3.194 1.324 1.495 988 1HD2 LEU 113 1HD2 LEU 113 4.834 -1.785 2.655 989 2HD2 LEU 113 2HD2 LEU 113 6.399 -1.432 1.926 990 3HD2 LEU 113 3HD2 LEU 113 5.023 -1.850 0.904 991 H LYS 114 H LYS 114 7.620 2.427 -0.802 992 HA LYS 114 HA LYS 114 8.948 3.556 1.437 993 1HB LYS 114 2HB LYS 114 10.970 3.824 -0.007 994 2HB LYS 114 1HB LYS 114 10.338 2.194 0.075 995 1HG LYS 114 2HG LYS 114 9.317 2.511 -2.139 996 2HG LYS 114 1HG LYS 114 10.025 4.124 -2.223 997 1HD LYS 114 2HD LYS 114 11.449 2.566 -3.422 998 2HD LYS 114 1HD LYS 114 12.277 3.101 -1.958 999 1HE LYS 114 2HE LYS 114 11.478 1.032 -0.825 1000 2HE LYS 114 1HE LYS 114 10.819 0.494 -2.367 1001 1HZ LYS 114 1HZ LYS 114 13.171 0.591 -3.256 1002 2HZ LYS 114 2HZ LYS 114 12.882 -0.524 -2.045 1003 3HZ LYS 114 3HZ LYS 114 13.691 0.872 -1.664 1004 H ILE 115 H ILE 115 7.557 4.955 -1.399 1005 HA ILE 115 HA ILE 115 8.443 7.622 -1.112 1006 HB ILE 115 HB ILE 115 5.666 6.710 -1.974 1007 1HG1 ILE 115 2HG1 ILE 115 8.079 7.316 -3.693 1008 2HG1 ILE 115 1HG1 ILE 115 7.497 5.701 -3.310 1009 1HG2 ILE 115 1HG2 ILE 115 5.547 8.853 -3.191 1010 2HG2 ILE 115 2HG2 ILE 115 7.092 9.326 -2.481 1011 3HG2 ILE 115 3HG2 ILE 115 5.687 9.075 -1.448 1012 1HD1 ILE 115 1HD1 ILE 115 6.811 6.381 -5.535 1013 2HD1 ILE 115 2HD1 ILE 115 6.008 7.803 -4.868 1014 3HD1 ILE 115 3HD1 ILE 115 5.406 6.189 -4.487 1015 H ALA 116 H ALA 116 5.826 5.859 0.326 1016 HA ALA 116 HA ALA 116 4.542 7.923 1.784 1017 1HB ALA 116 1HB ALA 116 3.492 6.121 2.998 1018 2HB ALA 116 2HB ALA 116 4.707 5.010 2.368 1019 3HB ALA 116 3HB ALA 116 3.536 5.748 1.263 1020 H TYR 117 H TYR 117 7.083 5.660 2.502 1021 HA TYR 117 HA TYR 117 7.187 6.106 5.283 1022 1HB TYR 117 2HB TYR 117 7.889 4.020 4.410 1023 2HB TYR 117 1HB TYR 117 9.041 4.782 3.326 1024 HD1 TYR 117 1HD TYR 117 11.143 5.383 4.053 1025 HD2 TYR 117 2HD TYR 117 8.364 3.859 6.833 1026 HE1 TYR 117 1HE TYR 117 12.993 5.067 5.696 1027 HE2 TYR 117 2HE TYR 117 10.156 3.535 8.487 1028 HH TYR 117 HH TYR 117 13.286 4.851 8.107 1029 H TYR 118 H TYR 118 9.334 7.211 2.634 1030 HA TYR 118 HA TYR 118 11.063 8.568 4.481 1031 1HB TYR 118 2HB TYR 118 10.947 8.689 1.462 1032 2HB TYR 118 1HB TYR 118 12.147 9.537 2.425 1033 HD1 TYR 118 1HD TYR 118 13.883 8.252 3.636 1034 HD2 TYR 118 2HD TYR 118 11.084 6.337 1.094 1035 HE1 TYR 118 1HE TYR 118 15.307 6.250 3.584 1036 HE2 TYR 118 2HE TYR 118 12.481 4.337 1.036 1037 HH TYR 118 HH TYR 118 15.153 3.853 3.150 1038 H LEU 119 H LEU 119 8.621 9.573 2.303 1039 HA LEU 119 HA LEU 119 8.936 12.379 2.938 1040 1HB LEU 119 2HB LEU 119 6.678 11.020 1.479 1041 2HB LEU 119 1HB LEU 119 6.885 12.754 1.616 1042 1HD1 LEU 119 1HD1 LEU 119 6.636 11.244 -1.005 1043 2HD1 LEU 119 2HD1 LEU 119 7.981 12.033 -1.829 1044 3HD1 LEU 119 3HD1 LEU 119 6.866 12.986 -0.850 1045 1HD2 LEU 119 1HD2 LEU 119 9.915 12.845 -0.565 1046 2HD2 LEU 119 2HD2 LEU 119 9.984 12.655 1.186 1047 3HD2 LEU 119 3HD2 LEU 119 8.888 13.838 0.470 1048 H ASN 120 H ASN 120 7.516 9.847 4.490 1049 HA ASN 120 HA ASN 120 5.902 9.484 6.020 1050 1HB ASN 120 2HB ASN 120 7.426 10.911 7.403 1051 2HB ASN 120 1HB ASN 120 6.478 12.319 6.930 1052 1HD2 ASN 120 1HD2 ASN 120 5.338 9.053 7.792 1053 2HD2 ASN 120 2HD2 ASN 120 4.391 9.561 9.129 1054 H THR 121 H THR 121 4.389 9.383 4.360 1055 HA THR 121 HA THR 121 2.320 11.382 4.648 1056 HB THR 121 HB THR 121 3.404 10.410 1.972 1057 HG1 THR 121 1HG THR 121 4.133 12.403 3.595 1058 1HG2 THR 121 1HG2 THR 121 1.869 12.078 1.001 1059 2HG2 THR 121 2HG2 THR 121 1.280 12.476 2.614 1060 3HG2 THR 121 3HG2 THR 121 0.982 10.875 1.937 1061 HA PRO 122 HA PRO 122 0.122 7.520 5.059 1062 1HB PRO 122 2HB PRO 122 -2.271 9.068 4.285 1063 2HB PRO 122 1HB PRO 122 -1.949 8.178 5.775 1064 1HG PRO 122 2HG PRO 122 -1.969 10.855 5.725 1065 2HG PRO 122 1HG PRO 122 -0.842 9.948 6.755 1066 1HD PRO 122 2HD PRO 122 -0.348 11.309 4.141 1067 2HD PRO 122 1HD PRO 122 0.679 11.241 5.588 1068 H LEU 123 H LEU 123 -0.266 5.980 3.662 1069 HA LEU 123 HA LEU 123 0.002 6.164 0.916 1070 1HB LEU 123 2HB LEU 123 -1.396 4.066 2.557 1071 2HB LEU 123 1HB LEU 123 -1.237 3.937 0.822 1072 1HD1 LEU 123 1HD1 LEU 123 1.683 4.979 0.658 1073 2HD1 LEU 123 2HD1 LEU 123 1.075 3.549 -0.179 1074 3HD1 LEU 123 3HD1 LEU 123 2.461 3.416 0.903 1075 1HD2 LEU 123 1HD2 LEU 123 2.175 3.458 3.317 1076 2HD2 LEU 123 2HD2 LEU 123 0.576 3.651 4.037 1077 3HD2 LEU 123 3HD2 LEU 123 1.383 5.033 3.296 1078 H GLU 124 H GLU 124 -2.925 6.268 2.847 1079 HA GLU 124 HA GLU 124 -4.790 6.218 0.766 1080 1HB GLU 124 2HB GLU 124 -5.009 7.609 3.430 1081 2HB GLU 124 1HB GLU 124 -6.347 7.275 2.343 1082 1HG GLU 124 2HG GLU 124 -5.856 4.862 2.573 1083 2HG GLU 124 1HG GLU 124 -4.636 5.271 3.783 1084 H ASP 125 H ASP 125 -2.833 8.906 1.989 1085 HA ASP 125 HA ASP 125 -4.348 10.881 0.616 1086 1HB ASP 125 2HB ASP 125 -3.082 11.428 2.665 1087 2HB ASP 125 1HB ASP 125 -1.580 11.025 1.839 1088 H ILE 126 H ILE 126 -1.549 8.939 0.046 1089 HA ILE 126 HA ILE 126 -0.569 10.330 -2.266 1090 HB ILE 126 HB ILE 126 0.044 7.472 -1.431 1091 1HG1 ILE 126 2HG1 ILE 126 1.516 10.036 -0.779 1092 2HG1 ILE 126 1HG1 ILE 126 0.547 9.104 0.354 1093 1HG2 ILE 126 1HG2 ILE 126 2.102 7.791 -2.747 1094 2HG2 ILE 126 2HG2 ILE 126 1.548 9.396 -3.221 1095 3HG2 ILE 126 3HG2 ILE 126 0.660 7.966 -3.749 1096 1HD1 ILE 126 1HD1 ILE 126 2.915 8.699 0.675 1097 2HD1 ILE 126 2HD1 ILE 126 3.069 8.180 -1.004 1098 3HD1 ILE 126 3HD1 ILE 126 2.103 7.232 0.128 1099 H PHE 127 H PHE 127 -2.038 7.150 -1.927 1100 HA PHE 127 HA PHE 127 -3.155 7.542 -4.614 1101 1HB PHE 127 2HB PHE 127 -2.444 4.911 -3.211 1102 2HB PHE 127 1HB PHE 127 -3.404 5.022 -4.684 1103 HD1 PHE 127 1HD PHE 127 -2.365 5.827 -6.755 1104 HD2 PHE 127 2HD PHE 127 -0.105 5.149 -3.219 1105 HE1 PHE 127 1HE PHE 127 -0.297 5.795 -8.087 1106 HE2 PHE 127 2HE PHE 127 1.965 5.120 -4.544 1107 HZ PHE 127 HZ PHE 127 1.872 5.443 -6.980 1108 H GLN 128 H GLN 128 -5.300 7.303 -4.880 1109 HA GLN 128 HA GLN 128 -6.779 6.992 -2.389 1110 1HB GLN 128 2HB GLN 128 -6.646 9.320 -3.396 1111 2HB GLN 128 1HB GLN 128 -7.607 8.699 -4.730 1112 1HG GLN 128 2HG GLN 128 -9.476 8.360 -3.365 1113 2HG GLN 128 1HG GLN 128 -8.524 8.512 -1.886 1114 1HE2 GLN 128 1HE2 GLN 128 -10.082 10.249 -4.485 1115 2HE2 GLN 128 2HE2 GLN 128 -9.937 11.790 -3.747 1116 H TRP 129 H TRP 129 -8.326 5.569 -2.393 1117 HA TRP 129 HA TRP 129 -8.757 4.148 -4.895 1118 1HB TRP 129 2HB TRP 129 -8.953 2.119 -3.211 1119 2HB TRP 129 1HB TRP 129 -7.416 2.631 -3.901 1120 HD1 TRP 129 HD TRP 129 -9.450 3.197 -0.625 1121 HE1 TRP 129 1HE TRP 129 -7.770 3.514 1.288 1122 HE3 TRP 129 3HE TRP 129 -5.124 3.032 -3.342 1123 HZ2 TRP 129 2HZ TRP 129 -4.941 3.677 1.588 1124 HZ3 TRP 129 3HZ TRP 129 -2.979 3.270 -2.166 1125 HH2 TRP 129 HH TRP 129 -2.896 3.586 0.246 1126 H GLN 130 H GLN 130 -10.662 3.685 -5.453 1127 HA GLN 130 HA GLN 130 -12.849 3.857 -3.510 1128 1HB GLN 130 2HB GLN 130 -12.869 4.679 -6.426 1129 2HB GLN 130 1HB GLN 130 -14.268 4.657 -5.365 1130 1HG GLN 130 2HG GLN 130 -11.830 6.320 -4.890 1131 2HG GLN 130 1HG GLN 130 -13.231 6.909 -5.764 1132 1HE2 GLN 130 1HE2 GLN 130 -13.732 8.456 -4.322 1133 2HE2 GLN 130 2HE2 GLN 130 -14.248 8.163 -2.688 1134 HA PRO 131 HA PRO 131 -12.847 -0.340 -5.417 1135 1HB PRO 131 2HB PRO 131 -13.968 -1.070 -2.781 1136 2HB PRO 131 1HB PRO 131 -12.571 -1.757 -3.619 1137 1HG PRO 131 2HG PRO 131 -12.268 -0.231 -1.434 1138 2HG PRO 131 1HG PRO 131 -11.114 -0.158 -2.780 1139 1HD PRO 131 2HD PRO 131 -13.370 1.703 -2.116 1140 2HD PRO 131 1HD PRO 131 -11.706 2.088 -2.617 1141 H GLU 132 H GLU 132 -15.113 1.001 -3.149 1142 HA GLU 132 HA GLU 132 -17.305 0.215 -4.919 1143 1HB GLU 132 2HB GLU 132 -17.406 0.550 -1.911 1144 2HB GLU 132 1HB GLU 132 -18.770 0.135 -2.940 1145 1HG GLU 132 2HG GLU 132 -17.568 -1.932 -3.606 1146 2HG GLU 132 1HG GLU 132 -16.317 -1.526 -2.432
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