NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
577506 | 2mez | 19028 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 GLU 13 H1 GLU 13 20.041 -14.660 -0.990 2 H2 GLU 13 H2 GLU 13 18.863 -14.914 0.071 3 H3 GLU 13 H3 GLU 13 18.783 -13.630 -0.922 4 HA GLU 13 HA GLU 13 20.680 -13.964 1.239 5 HB2 GLU 13 HB2 GLU 13 21.784 -12.760 -0.656 6 HB3 GLU 13 HB1 GLU 13 20.334 -11.774 -0.804 7 HG2 GLU 13 HG2 GLU 13 21.996 -10.446 0.015 8 HG3 GLU 13 HG1 GLU 13 20.865 -10.677 1.332 9 H ASN 14 H ASN 14 19.960 -13.178 3.164 10 HA ASN 14 HA ASN 14 17.310 -12.130 3.383 11 HB2 ASN 14 HB2 ASN 14 18.018 -14.240 4.463 12 HB3 ASN 14 HB1 ASN 14 19.412 -13.433 5.152 13 HD21 ASN 14 1HD2 ASN 14 18.817 -12.068 7.068 14 HD22 ASN 14 2HD2 ASN 14 17.238 -12.353 7.827 15 H ALA 15 H ALA 15 20.448 -10.717 3.549 16 HA ALA 15 HA ALA 15 20.012 -8.307 4.968 17 HB1 ALA 15 HB1 ALA 15 22.064 -9.105 4.839 18 HB2 ALA 15 HB2 ALA 15 21.874 -9.639 3.131 19 HB3 ALA 15 HB3 ALA 15 22.092 -7.917 3.500 20 H GLU 16 H GLU 16 18.993 -9.483 1.767 21 HA GLU 16 HA GLU 16 18.771 -6.776 0.649 22 HB2 GLU 16 HB2 GLU 16 18.687 -9.670 -0.335 23 HB3 GLU 16 HB1 GLU 16 18.164 -8.338 -1.372 24 HG2 GLU 16 HG2 GLU 16 20.440 -7.356 -1.163 25 HG3 GLU 16 HG1 GLU 16 20.803 -8.796 -0.144 26 H LEU 17 H LEU 17 16.969 -8.923 2.494 27 HA LEU 17 HA LEU 17 14.334 -7.963 1.641 28 HB2 LEU 17 HB2 LEU 17 15.147 -9.576 4.112 29 HB3 LEU 17 HB1 LEU 17 13.593 -9.246 3.624 30 HG LEU 17 HG LEU 17 15.371 -10.999 1.910 31 HD11 LEU 17 1HD1 LEU 17 14.432 -12.049 3.981 32 HD12 LEU 17 2HD1 LEU 17 12.795 -11.568 3.326 33 HD13 LEU 17 3HD1 LEU 17 13.793 -12.796 2.529 34 HD21 LEU 17 3HD2 LEU 17 14.102 -9.596 0.547 35 HD22 LEU 17 1HD2 LEU 17 13.409 -11.213 0.445 36 HD23 LEU 17 2HD2 LEU 17 12.583 -10.005 1.360 37 H GLU 18 H GLU 18 12.806 -7.238 3.471 38 HA GLU 18 HA GLU 18 14.150 -5.223 5.092 39 HB2 GLU 18 HB2 GLU 18 13.363 -4.246 2.643 40 HB3 GLU 18 HB1 GLU 18 11.781 -4.463 3.330 41 HG2 GLU 18 HG2 GLU 18 12.859 -2.150 3.395 42 HG3 GLU 18 HG1 GLU 18 11.955 -2.701 4.722 43 H ILE 19 H ILE 19 13.120 -5.066 7.192 44 HA ILE 19 HA ILE 19 10.106 -5.128 7.231 45 HB ILE 19 HB ILE 19 10.536 -5.175 9.491 46 HG12 ILE 19 2HG1 ILE 19 13.275 -5.849 9.727 47 HG13 ILE 19 1HG1 ILE 19 13.115 -4.200 8.931 48 HG21 ILE 19 1HG2 ILE 19 12.243 -7.277 8.176 49 HG22 ILE 19 2HG2 ILE 19 11.293 -7.594 9.523 50 HG23 ILE 19 3HG2 ILE 19 10.597 -7.300 7.875 51 HD11 ILE 19 HD3 ILE 19 11.570 -3.540 10.712 52 HD12 ILE 19 HD1 ILE 19 11.813 -5.154 11.441 53 HD13 ILE 19 HD2 ILE 19 13.225 -4.094 11.321 54 H VAL 20 H VAL 20 12.485 -2.534 7.198 55 HA VAL 20 HA VAL 20 10.743 -0.532 8.401 56 HB VAL 20 HB VAL 20 13.510 -0.142 7.379 57 HG11 VAL 20 1HG1 VAL 20 13.486 1.432 9.064 58 HG12 VAL 20 2HG1 VAL 20 12.054 1.858 8.086 59 HG13 VAL 20 3HG1 VAL 20 11.845 0.977 9.623 60 HG21 VAL 20 3HG2 VAL 20 13.733 -2.018 9.044 61 HG22 VAL 20 1HG2 VAL 20 14.247 -0.687 9.780 62 HG23 VAL 20 2HG2 VAL 20 12.657 -1.180 10.165 63 H THR 21 H THR 21 9.594 -1.659 6.160 64 HA THR 21 HA THR 21 10.130 -0.160 3.833 65 HB THR 21 HB THR 21 7.796 -1.172 3.133 66 HG1 THR 21 HG1 THR 21 7.470 -3.094 4.617 67 HG21 THR 21 1HG2 THR 21 8.686 -3.414 2.785 68 HG22 THR 21 2HG2 THR 21 10.145 -2.343 2.703 69 HG23 THR 21 3HG2 THR 21 9.781 -3.285 4.162 70 H ASP 22 H ASP 22 8.509 1.008 6.496 71 HA ASP 22 HA ASP 22 6.862 2.231 6.975 72 HB2 ASP 22 HB2 ASP 22 7.041 3.468 4.252 73 HB3 ASP 22 HB1 ASP 22 6.168 4.239 5.614 74 H TYR 23 H TYR 23 6.329 -0.340 5.494 75 HA TYR 23 HA TYR 23 3.513 0.296 4.845 76 HB2 TYR 23 HB2 TYR 23 4.921 0.004 2.890 77 HB3 TYR 23 HB1 TYR 23 5.364 -1.649 3.400 78 HD1 TYR 23 HD1 TYR 23 2.265 0.447 2.854 79 HD2 TYR 23 HD2 TYR 23 4.190 -3.373 2.330 80 HE1 TYR 23 HE1 TYR 23 0.324 -0.387 1.513 81 HE2 TYR 23 HE2 TYR 23 2.236 -4.227 1.131 82 HH TYR 23 HH TYR 23 -0.043 -3.532 0.322 83 H TYR 24 H TYR 24 5.128 -0.929 7.159 84 HA TYR 24 HA TYR 24 4.181 -3.612 7.436 85 HB2 TYR 24 HB2 TYR 24 5.356 -3.467 9.591 86 HB3 TYR 24 HB1 TYR 24 6.241 -2.855 8.281 87 HD1 TYR 24 HD2 TYR 24 6.624 -0.444 8.076 88 HD2 TYR 24 HD1 TYR 24 4.703 -2.118 11.576 89 HE1 TYR 24 HE2 TYR 24 6.694 1.771 9.211 90 HE2 TYR 24 HE1 TYR 24 4.864 0.074 12.641 91 HH TYR 24 HH TYR 24 6.323 2.994 11.176 92 H LYS 25 H LYS 25 3.415 -4.041 10.064 93 HA LYS 25 HA LYS 25 0.857 -3.892 10.574 94 HB2 LYS 25 HB2 LYS 25 2.835 -4.445 12.133 95 HB3 LYS 25 HB1 LYS 25 2.759 -2.835 12.600 96 HG2 LYS 25 HG2 LYS 25 0.293 -3.315 13.291 97 HG3 LYS 25 HG1 LYS 25 0.541 -4.939 12.847 98 HD2 LYS 25 HD2 LYS 25 0.726 -4.818 15.174 99 HD3 LYS 25 HD1 LYS 25 2.184 -5.393 14.369 100 HE2 LYS 25 HE2 LYS 25 3.191 -2.973 14.685 101 HE3 LYS 25 HE1 LYS 25 1.559 -2.638 15.494 102 HZ1 LYS 25 HZ1 LYS 25 3.378 -3.177 16.996 103 HZ2 LYS 25 HZ2 LYS 25 1.962 -4.104 17.047 104 HZ3 LYS 25 HZ3 LYS 25 3.197 -4.798 16.365 105 H ILE 26 H ILE 26 2.495 -0.638 10.910 106 HA ILE 26 HA ILE 26 0.326 0.703 12.082 107 HB ILE 26 HB ILE 26 2.458 1.324 11.941 108 HG12 ILE 26 2HG1 ILE 26 2.164 3.571 11.488 109 HG13 ILE 26 1HG1 ILE 26 0.582 3.408 10.765 110 HG21 ILE 26 1HG2 ILE 26 3.607 2.026 9.878 111 HG22 ILE 26 2HG2 ILE 26 2.605 0.729 9.318 112 HG23 ILE 26 3HG2 ILE 26 2.094 2.323 9.011 113 HD11 ILE 26 HD3 ILE 26 -0.490 2.982 12.604 114 HD12 ILE 26 HD1 ILE 26 0.983 2.383 13.544 115 HD13 ILE 26 HD2 ILE 26 0.815 4.071 13.233 116 H ILE 27 H ILE 27 0.854 0.253 8.556 117 HA ILE 27 HA ILE 27 -1.807 1.263 8.015 118 HB ILE 27 HB ILE 27 -0.004 2.340 6.674 119 HG12 ILE 27 2HG1 ILE 27 -1.723 0.371 5.117 120 HG13 ILE 27 1HG1 ILE 27 -2.187 1.996 5.760 121 HG21 ILE 27 1HG2 ILE 27 0.852 -0.481 5.948 122 HG22 ILE 27 2HG2 ILE 27 1.407 1.059 5.232 123 HG23 ILE 27 3HG2 ILE 27 1.773 0.895 6.849 124 HD11 ILE 27 HD3 ILE 27 -0.207 1.248 3.532 125 HD12 ILE 27 HD1 ILE 27 -1.802 2.073 3.358 126 HD13 ILE 27 HD2 ILE 27 -0.503 2.863 4.083 127 H LYS 28 H LYS 28 0.039 -1.793 7.631 128 HA LYS 28 HA LYS 28 -1.694 -2.949 6.088 129 HB2 LYS 28 HB2 LYS 28 0.307 -3.935 6.538 130 HB3 LYS 28 HB1 LYS 28 -0.010 -4.096 8.290 131 HG2 LYS 28 HG2 LYS 28 -1.569 -5.951 7.852 132 HG3 LYS 28 HG1 LYS 28 -1.642 -5.584 6.125 133 HD2 LYS 28 HD2 LYS 28 0.556 -6.174 5.691 134 HD3 LYS 28 HD1 LYS 28 0.954 -6.409 7.415 135 HE2 LYS 28 HE2 LYS 28 0.602 -8.545 6.223 136 HE3 LYS 28 HE1 LYS 28 -0.557 -8.342 7.558 137 HZ1 LYS 28 HZ1 LYS 28 -2.173 -7.850 6.013 138 HZ2 LYS 28 HZ2 LYS 28 -1.114 -7.837 4.693 139 HZ3 LYS 28 HZ3 LYS 28 -1.629 -9.195 5.540 140 H THR 29 H THR 29 -1.867 -3.002 9.650 141 HA THR 29 HA THR 29 -4.207 -4.652 10.195 142 HB THR 29 HB THR 29 -4.459 -3.091 12.124 143 HG1 THR 29 HG1 THR 29 -2.643 -1.645 12.329 144 HG21 THR 29 1HG2 THR 29 -1.628 -3.983 11.683 145 HG22 THR 29 2HG2 THR 29 -2.288 -3.499 13.169 146 HG23 THR 29 3HG2 THR 29 -2.920 -4.955 12.417 147 H ALA 30 H ALA 30 -4.249 -1.161 9.629 148 HA ALA 30 HA ALA 30 -6.998 -0.811 9.420 149 HB1 ALA 30 HB1 ALA 30 -5.196 0.846 10.014 150 HB2 ALA 30 HB2 ALA 30 -4.641 0.804 8.429 151 HB3 ALA 30 HB3 ALA 30 -6.243 1.354 8.556 152 H ARG 31 H ARG 31 -4.718 -1.177 6.629 153 HA ARG 31 HA ARG 31 -6.880 -0.518 4.893 154 HB2 ARG 31 HB2 ARG 31 -5.522 -1.153 3.112 155 HB3 ARG 31 HB1 ARG 31 -4.322 -0.458 4.207 156 HG2 ARG 31 HG2 ARG 31 -3.637 -2.649 5.034 157 HG3 ARG 31 HG1 ARG 31 -4.853 -3.427 3.997 158 HD2 ARG 31 HD2 ARG 31 -3.886 -2.557 2.027 159 HD3 ARG 31 HD1 ARG 31 -2.435 -2.030 2.918 160 HE ARG 31 HE ARG 31 -1.748 -4.238 3.259 161 HH11 ARG 31 1HH2 ARG 31 -4.905 -4.307 1.547 162 HH12 ARG 31 2HH2 ARG 31 -4.862 -6.074 1.630 163 HH21 ARG 31 1HH1 ARG 31 -1.669 -6.363 2.667 164 HH22 ARG 31 2HH1 ARG 31 -3.133 -7.109 1.935 165 H GLU 32 H GLU 32 -5.962 -3.632 6.188 166 HA GLU 32 HA GLU 32 -7.911 -5.194 5.046 167 HB2 GLU 32 HB2 GLU 32 -6.029 -5.375 7.490 168 HB3 GLU 32 HB1 GLU 32 -7.337 -6.446 7.347 169 HG2 GLU 32 HG2 GLU 32 -6.719 -7.194 5.120 170 HG3 GLU 32 HG1 GLU 32 -5.503 -5.954 4.928 171 H GLN 33 H GLN 33 -8.086 -2.811 7.859 172 HA GLN 33 HA GLN 33 -10.600 -3.840 8.691 173 HB2 GLN 33 HB2 GLN 33 -8.659 -2.270 9.793 174 HB3 GLN 33 HB1 GLN 33 -9.520 -0.977 8.980 175 HG2 GLN 33 HG2 GLN 33 -11.052 -0.847 10.624 176 HG3 GLN 33 HG1 GLN 33 -11.610 -2.381 10.187 177 HE21 GLN 33 1HE2 GLN 33 -11.214 -1.078 13.045 178 HE22 GLN 33 2HE2 GLN 33 -10.258 -2.201 13.884 179 H LEU 34 H LEU 34 -9.624 -1.905 6.008 180 HA LEU 34 HA LEU 34 -12.287 -0.799 5.578 181 HB2 LEU 34 HB2 LEU 34 -9.533 -0.555 4.403 182 HB3 LEU 34 HB1 LEU 34 -10.977 0.340 3.716 183 HG LEU 34 HG LEU 34 -10.045 0.543 6.659 184 HD11 LEU 34 1HD1 LEU 34 -8.294 1.433 5.482 185 HD12 LEU 34 2HD1 LEU 34 -9.272 2.069 4.177 186 HD13 LEU 34 3HD1 LEU 34 -9.396 2.817 5.764 187 HD21 LEU 34 3HD2 LEU 34 -11.955 2.219 5.061 188 HD22 LEU 34 1HD2 LEU 34 -12.501 1.133 6.356 189 HD23 LEU 34 2HD2 LEU 34 -11.436 2.400 6.789 190 H GLY 35 H GLY 35 -10.746 -3.627 4.977 191 HA2 GLY 35 HA2 GLY 35 -10.724 -5.218 3.700 192 HA3 GLY 35 HA1 GLY 35 -12.357 -4.836 3.194 193 H ILE 36 H ILE 36 -10.488 -2.330 1.936 194 HA ILE 36 HA ILE 36 -10.893 -2.930 -0.738 195 HB ILE 36 HB ILE 36 -9.448 -1.118 -1.087 196 HG12 ILE 36 2HG1 ILE 36 -8.860 -0.802 1.863 197 HG13 ILE 36 1HG1 ILE 36 -7.868 -1.542 0.748 198 HG21 ILE 36 1HG2 ILE 36 -11.380 -0.375 1.224 199 HG22 ILE 36 2HG2 ILE 36 -11.007 0.575 -0.228 200 HG23 ILE 36 3HG2 ILE 36 -11.897 -0.926 -0.442 201 HD11 ILE 36 HD3 ILE 36 -8.436 1.374 0.985 202 HD12 ILE 36 HD1 ILE 36 -6.958 0.621 0.750 203 HD13 ILE 36 HD2 ILE 36 -8.157 0.810 -0.604 204 H SER 37 H SER 37 -9.870 -3.987 -2.407 205 HA SER 37 HA SER 37 -7.986 -5.898 -1.549 206 HB2 SER 37 HB2 SER 37 -7.983 -6.549 -3.796 207 HB3 SER 37 HB1 SER 37 -9.652 -6.348 -3.406 208 HG SER 37 HG SER 37 -9.527 -5.131 -5.125 209 H GLN 38 H GLN 38 -5.990 -6.437 -2.376 210 HA GLN 38 HA GLN 38 -4.049 -4.434 -2.645 211 HB2 GLN 38 HB2 GLN 38 -4.080 -7.322 -3.622 212 HB3 GLN 38 HB1 GLN 38 -2.701 -6.173 -3.924 213 HG2 GLN 38 HG2 GLN 38 -2.891 -5.738 -1.424 214 HG3 GLN 38 HG1 GLN 38 -4.097 -6.911 -1.307 215 HE21 GLN 38 1HE2 GLN 38 -3.149 -9.180 -2.496 216 HE22 GLN 38 2HE2 GLN 38 -1.604 -9.725 -1.831 217 H GLN 39 H GLN 39 -5.634 -5.856 -5.423 218 HA GLN 39 HA GLN 39 -4.624 -4.119 -7.245 219 HB2 GLN 39 HB2 GLN 39 -6.063 -6.094 -7.716 220 HB3 GLN 39 HB1 GLN 39 -7.557 -5.167 -7.337 221 HG2 GLN 39 HG2 GLN 39 -6.701 -3.614 -9.344 222 HG3 GLN 39 HG1 GLN 39 -5.306 -4.638 -9.323 223 HE21 GLN 39 1HE2 GLN 39 -8.867 -5.006 -9.699 224 HE22 GLN 39 2HE2 GLN 39 -8.807 -6.169 -10.983 225 H GLN 40 H GLN 40 -7.395 -3.465 -4.998 226 HA GLN 40 HA GLN 40 -8.081 -0.919 -6.260 227 HB2 GLN 40 HB2 GLN 40 -8.695 -2.112 -3.603 228 HB3 GLN 40 HB1 GLN 40 -9.305 -0.572 -4.160 229 HG2 GLN 40 HG2 GLN 40 -10.692 -1.297 -5.797 230 HG3 GLN 40 HG1 GLN 40 -10.069 -2.820 -5.952 231 HE21 GLN 40 1HE2 GLN 40 -11.873 -0.733 -3.665 232 HE22 GLN 40 2HE2 GLN 40 -12.662 -1.934 -2.742 233 H LEU 41 H LEU 41 -5.912 -1.795 -3.518 234 HA LEU 41 HA LEU 41 -5.261 0.865 -2.857 235 HB2 LEU 41 HB2 LEU 41 -5.136 -1.198 -1.412 236 HB3 LEU 41 HB1 LEU 41 -3.745 -1.677 -2.547 237 HG LEU 41 HG LEU 41 -2.524 0.278 -1.781 238 HD11 LEU 41 1HD1 LEU 41 -4.416 1.891 -1.193 239 HD12 LEU 41 2HD1 LEU 41 -4.680 0.969 0.248 240 HD13 LEU 41 3HD1 LEU 41 -3.173 1.585 0.115 241 HD21 LEU 41 3HD2 LEU 41 -2.002 -0.518 0.489 242 HD22 LEU 41 1HD2 LEU 41 -3.703 -1.117 0.657 243 HD23 LEU 41 2HD2 LEU 41 -2.407 -1.881 -0.362 244 H ALA 42 H ALA 42 -3.983 -1.260 -5.166 245 HA ALA 42 HA ALA 42 -1.625 0.079 -5.724 246 HB1 ALA 42 HB1 ALA 42 -1.291 -1.414 -7.455 247 HB2 ALA 42 HB2 ALA 42 -2.411 -2.332 -6.314 248 HB3 ALA 42 HB3 ALA 42 -3.023 -1.615 -7.741 249 H GLN 43 H GLN 43 -4.955 0.374 -7.196 250 HA GLN 43 HA GLN 43 -4.383 2.437 -9.061 251 HB2 GLN 43 HB2 GLN 43 -6.908 1.670 -7.566 252 HB3 GLN 43 HB1 GLN 43 -6.760 2.953 -8.802 253 HG2 GLN 43 HG2 GLN 43 -6.411 1.444 -10.493 254 HG3 GLN 43 HG1 GLN 43 -5.649 0.236 -9.449 255 HE21 GLN 43 1HE2 GLN 43 -7.240 -1.250 -8.538 256 HE22 GLN 43 2HE2 GLN 43 -8.816 -1.514 -9.259 257 H LYS 44 H LYS 44 -5.194 2.640 -5.431 258 HA LYS 44 HA LYS 44 -5.467 5.423 -5.383 259 HB2 LYS 44 HB2 LYS 44 -4.928 3.162 -3.357 260 HB3 LYS 44 HB1 LYS 44 -5.334 4.890 -2.950 261 HG2 LYS 44 HG2 LYS 44 -7.118 2.954 -4.454 262 HG3 LYS 44 HG1 LYS 44 -7.275 3.445 -2.781 263 HD2 LYS 44 HD2 LYS 44 -7.464 5.865 -3.700 264 HD3 LYS 44 HD1 LYS 44 -7.601 4.976 -5.318 265 HE2 LYS 44 HE2 LYS 44 -9.558 3.760 -4.055 266 HE3 LYS 44 HE1 LYS 44 -9.115 4.725 -2.658 267 HZ1 LYS 44 HZ1 LYS 44 -10.225 5.613 -5.296 268 HZ2 LYS 44 HZ2 LYS 44 -10.898 5.776 -3.669 269 HZ3 LYS 44 HZ3 LYS 44 -9.715 6.617 -4.222 270 H LEU 45 H LEU 45 -2.848 3.643 -6.032 271 HA LEU 45 HA LEU 45 -1.147 5.903 -5.520 272 HB2 LEU 45 HB2 LEU 45 -1.162 4.042 -3.757 273 HB3 LEU 45 HB1 LEU 45 -0.501 2.987 -4.944 274 HG LEU 45 HG LEU 45 1.613 4.456 -5.034 275 HD11 LEU 45 1HD1 LEU 45 0.013 6.155 -3.002 276 HD12 LEU 45 2HD1 LEU 45 1.741 6.188 -3.200 277 HD13 LEU 45 3HD1 LEU 45 0.787 6.524 -4.625 278 HD21 LEU 45 3HD2 LEU 45 2.351 3.706 -2.895 279 HD22 LEU 45 1HD2 LEU 45 0.692 3.633 -2.189 280 HD23 LEU 45 2HD2 LEU 45 1.329 2.537 -3.468 281 H LYS 46 H LYS 46 -2.111 4.372 -8.029 282 HA LYS 46 HA LYS 46 -1.727 4.174 -10.038 283 HB2 LYS 46 HB2 LYS 46 0.472 6.123 -9.770 284 HB3 LYS 46 HB1 LYS 46 -0.507 5.795 -11.189 285 HG2 LYS 46 HG2 LYS 46 -2.509 6.542 -10.223 286 HG3 LYS 46 HG1 LYS 46 -1.468 7.119 -8.792 287 HD2 LYS 46 HD2 LYS 46 -0.158 8.449 -10.350 288 HD3 LYS 46 HD1 LYS 46 -1.296 8.027 -11.602 289 HE2 LYS 46 HE2 LYS 46 -3.104 8.820 -10.035 290 HE3 LYS 46 HE1 LYS 46 -1.895 9.779 -9.042 291 HZ1 LYS 46 HZ1 LYS 46 -2.460 10.051 -11.883 292 HZ2 LYS 46 HZ2 LYS 46 -2.927 11.089 -10.731 293 HZ3 LYS 46 HZ3 LYS 46 -1.325 10.899 -10.940 294 H VAL 47 H VAL 47 -0.532 2.012 -8.466 295 HA VAL 47 HA VAL 47 1.588 1.331 -10.115 296 HB VAL 47 HB VAL 47 2.613 0.023 -8.144 297 HG11 VAL 47 1HG1 VAL 47 3.386 2.168 -6.869 298 HG12 VAL 47 2HG1 VAL 47 3.651 2.066 -8.676 299 HG13 VAL 47 3HG1 VAL 47 2.359 2.986 -7.991 300 HG21 VAL 47 3HG2 VAL 47 1.757 0.622 -5.941 301 HG22 VAL 47 1HG2 VAL 47 0.665 1.746 -6.363 302 HG23 VAL 47 2HG2 VAL 47 0.346 -0.008 -6.744 303 H SER 48 H SER 48 1.934 -1.628 -9.148 304 HA SER 48 HA SER 48 -0.570 -2.780 -10.119 305 HB2 SER 48 HB2 SER 48 0.960 -4.708 -10.377 306 HB3 SER 48 HB1 SER 48 1.264 -3.334 -11.383 307 HG SER 48 HG SER 48 3.151 -3.092 -10.506 308 H GLU 49 H GLU 49 -1.550 -4.378 -9.010 309 HA GLU 49 HA GLU 49 -1.419 -4.963 -6.216 310 HB2 GLU 49 HB2 GLU 49 -2.859 -5.827 -8.215 311 HB3 GLU 49 HB1 GLU 49 -1.561 -6.885 -8.539 312 HG2 GLU 49 HG2 GLU 49 -1.878 -7.942 -6.141 313 HG3 GLU 49 HG1 GLU 49 -3.141 -6.840 -5.842 314 H ASN 50 H ASN 50 0.808 -5.753 -8.810 315 HA ASN 50 HA ASN 50 2.065 -8.043 -7.485 316 HB2 ASN 50 HB2 ASN 50 1.550 -7.396 -9.975 317 HB3 ASN 50 HB1 ASN 50 3.041 -6.404 -9.856 318 HD21 ASN 50 1HD2 ASN 50 1.866 -9.507 -10.523 319 HD22 ASN 50 2HD2 ASN 50 3.456 -10.159 -10.664 320 H ILE 51 H ILE 51 2.663 -4.455 -7.649 321 HA ILE 51 HA ILE 51 5.338 -4.604 -6.640 322 HB ILE 51 HB ILE 51 3.239 -2.555 -7.383 323 HG12 ILE 51 2HG1 ILE 51 6.223 -2.744 -7.763 324 HG13 ILE 51 1HG1 ILE 51 5.065 -3.656 -8.806 325 HG21 ILE 51 1HG2 ILE 51 4.077 -1.677 -5.155 326 HG22 ILE 51 2HG2 ILE 51 5.692 -1.711 -5.784 327 HG23 ILE 51 3HG2 ILE 51 4.432 -0.719 -6.562 328 HD11 ILE 51 HD3 ILE 51 4.077 -1.367 -9.251 329 HD12 ILE 51 HD1 ILE 51 5.481 -0.695 -8.370 330 HD13 ILE 51 HD2 ILE 51 5.872 -1.635 -9.798 331 H VAL 52 H VAL 52 2.124 -4.064 -5.193 332 HA VAL 52 HA VAL 52 2.872 -3.442 -2.617 333 HB VAL 52 HB VAL 52 0.606 -3.536 -2.039 334 HG11 VAL 52 1HG1 VAL 52 0.054 -1.557 -3.534 335 HG12 VAL 52 2HG1 VAL 52 1.731 -1.581 -3.109 336 HG13 VAL 52 3HG1 VAL 52 1.199 -2.107 -4.755 337 HG21 VAL 52 3HG2 VAL 52 -0.152 -5.385 -3.432 338 HG22 VAL 52 1HG2 VAL 52 -1.232 -4.150 -3.405 339 HG23 VAL 52 2HG2 VAL 52 -0.118 -4.109 -4.846 340 H LYS 53 H LYS 53 1.739 -6.697 -4.021 341 HA LYS 53 HA LYS 53 2.397 -8.121 -1.632 342 HB2 LYS 53 HB2 LYS 53 2.709 -8.656 -4.636 343 HB3 LYS 53 HB1 LYS 53 3.185 -9.790 -3.408 344 HG2 LYS 53 HG2 LYS 53 0.877 -9.741 -2.570 345 HG3 LYS 53 HG1 LYS 53 0.341 -8.594 -3.744 346 HD2 LYS 53 HD2 LYS 53 1.147 -11.525 -4.078 347 HD3 LYS 53 HD1 LYS 53 -0.294 -10.870 -4.462 348 HE2 LYS 53 HE2 LYS 53 0.806 -9.370 -6.304 349 HE3 LYS 53 HE1 LYS 53 2.229 -10.387 -6.041 350 HZ1 LYS 53 HZ1 LYS 53 -0.372 -11.634 -6.601 351 HZ2 LYS 53 HZ2 LYS 53 0.743 -11.126 -7.755 352 HZ3 LYS 53 HZ3 LYS 53 1.096 -12.278 -6.640 353 H ARG 54 H ARG 54 4.590 -6.657 -4.027 354 HA ARG 54 HA ARG 54 6.975 -8.059 -3.072 355 HB2 ARG 54 HB2 ARG 54 6.453 -6.929 -5.223 356 HB3 ARG 54 HB1 ARG 54 7.234 -5.472 -4.550 357 HG2 ARG 54 HG2 ARG 54 9.247 -6.647 -4.252 358 HG3 ARG 54 HG1 ARG 54 8.452 -8.281 -4.409 359 HD2 ARG 54 HD2 ARG 54 7.998 -7.420 -6.789 360 HD3 ARG 54 HD1 ARG 54 9.282 -6.224 -6.451 361 HE ARG 54 HE ARG 54 10.809 -7.740 -7.015 362 HH11 ARG 54 1HH2 ARG 54 7.833 -9.710 -6.415 363 HH12 ARG 54 2HH2 ARG 54 8.522 -10.979 -7.173 364 HH21 ARG 54 1HH1 ARG 54 11.800 -9.705 -7.666 365 HH22 ARG 54 2HH1 ARG 54 10.748 -11.097 -7.836 366 H PHE 55 H PHE 55 5.483 -4.925 -2.100 367 HA PHE 55 HA PHE 55 7.517 -4.323 -0.230 368 HB2 PHE 55 HB2 PHE 55 4.560 -3.669 -0.171 369 HB3 PHE 55 HB1 PHE 55 5.860 -2.930 0.737 370 HD1 PHE 55 HD1 PHE 55 7.420 -2.956 -2.311 371 HD2 PHE 55 HD2 PHE 55 3.889 -1.412 -0.429 372 HE1 PHE 55 HE1 PHE 55 7.390 -0.951 -3.854 373 HE2 PHE 55 HE2 PHE 55 3.831 0.444 -2.069 374 HZ PHE 55 HZ PHE 55 5.559 0.532 -3.897 375 H GLU 56 H GLU 56 4.312 -5.973 0.132 376 HA GLU 56 HA GLU 56 4.584 -6.352 2.820 377 HB2 GLU 56 HB2 GLU 56 2.474 -6.665 1.167 378 HB3 GLU 56 HB1 GLU 56 3.039 -8.327 1.388 379 HG2 GLU 56 HG2 GLU 56 2.808 -8.303 3.623 380 HG3 GLU 56 HG1 GLU 56 2.357 -6.666 3.845 381 H SER 57 H SER 57 6.189 -8.120 0.298 382 HA SER 57 HA SER 57 6.978 -10.416 2.061 383 HB2 SER 57 HB2 SER 57 8.041 -11.233 0.056 384 HB3 SER 57 HB1 SER 57 6.282 -10.977 -0.153 385 HG SER 57 HG SER 57 6.573 -9.509 -1.574 386 H GLY 58 H GLY 58 8.127 -7.369 1.475 387 HA2 GLY 58 HA2 GLY 58 10.077 -6.478 2.452 388 HA3 GLY 58 HA1 GLY 58 10.698 -8.207 2.627 389 H LYS 59 H LYS 59 9.745 -7.742 -0.551 390 HA LYS 59 HA LYS 59 12.506 -7.920 -1.399 391 HB2 LYS 59 HB2 LYS 59 9.713 -8.344 -2.589 392 HB3 LYS 59 HB1 LYS 59 11.259 -8.548 -3.509 393 HG2 LYS 59 HG2 LYS 59 11.863 -10.143 -1.603 394 HG3 LYS 59 HG1 LYS 59 10.197 -9.913 -1.021 395 HD2 LYS 59 HD2 LYS 59 9.141 -10.828 -3.106 396 HD3 LYS 59 HD1 LYS 59 10.664 -10.709 -3.849 397 HE2 LYS 59 HE2 LYS 59 11.450 -12.498 -2.240 398 HE3 LYS 59 HE1 LYS 59 9.902 -12.662 -1.527 399 HZ1 LYS 59 HZ1 LYS 59 9.650 -14.151 -3.084 400 HZ2 LYS 59 HZ2 LYS 59 9.194 -13.095 -4.067 401 HZ3 LYS 59 HZ3 LYS 59 10.750 -13.372 -4.159 402 H LEU 60 H LEU 60 10.118 -5.609 -1.443 403 HA LEU 60 HA LEU 60 11.754 -3.651 -2.763 404 HB2 LEU 60 HB2 LEU 60 10.425 -4.727 -4.510 405 HB3 LEU 60 HB1 LEU 60 8.809 -4.342 -3.650 406 HG LEU 60 HG LEU 60 9.661 -1.877 -4.216 407 HD11 LEU 60 1HD1 LEU 60 11.290 -1.540 -5.722 408 HD12 LEU 60 2HD1 LEU 60 11.918 -2.676 -4.499 409 HD13 LEU 60 3HD1 LEU 60 11.581 -3.290 -6.086 410 HD21 LEU 60 3HD2 LEU 60 9.123 -3.930 -6.465 411 HD22 LEU 60 1HD2 LEU 60 7.896 -3.189 -5.387 412 HD23 LEU 60 2HD2 LEU 60 8.753 -2.226 -6.615 413 H LYS 61 H LYS 61 11.067 -1.330 -2.611 414 HA LYS 61 HA LYS 61 9.307 -0.984 -0.214 415 HB2 LYS 61 HB2 LYS 61 11.750 -0.973 -0.054 416 HB3 LYS 61 HB1 LYS 61 11.866 0.437 -1.040 417 HG2 LYS 61 HG2 LYS 61 10.702 1.788 0.343 418 HG3 LYS 61 HG1 LYS 61 10.281 0.477 1.482 419 HD2 LYS 61 HD2 LYS 61 12.420 0.306 2.293 420 HD3 LYS 61 HD1 LYS 61 13.054 1.478 1.027 421 HE2 LYS 61 HE2 LYS 61 11.912 3.281 2.008 422 HE3 LYS 61 HE1 LYS 61 11.159 2.260 3.230 423 HZ1 LYS 61 HZ1 LYS 61 13.996 3.039 2.987 424 HZ2 LYS 61 HZ2 LYS 61 12.873 3.183 4.280 425 HZ3 LYS 61 HZ3 LYS 61 13.509 1.803 3.935 426 HA PRO 62 HA PRO 62 7.473 2.157 -2.962 427 HB2 PRO 62 HB1 PRO 62 6.156 3.705 -0.968 428 HB3 PRO 62 HB2 PRO 62 5.583 2.261 -1.756 429 HG2 PRO 62 HG1 PRO 62 6.885 2.689 0.930 430 HG3 PRO 62 HG2 PRO 62 5.745 1.479 0.652 431 HD2 PRO 62 HD1 PRO 62 8.333 0.924 0.722 432 HD3 PRO 62 HD2 PRO 62 7.104 -0.088 -0.114 433 H THR 63 H THR 63 7.790 4.758 -3.313 434 HA THR 63 HA THR 63 10.463 5.559 -2.604 435 HB THR 63 HB THR 63 9.891 7.238 -4.374 436 HG1 THR 63 HG1 THR 63 7.952 7.046 -5.276 437 HG21 THR 63 1HG2 THR 63 10.870 4.947 -5.007 438 HG22 THR 63 2HG2 THR 63 9.144 4.482 -5.413 439 HG23 THR 63 3HG2 THR 63 9.902 5.795 -6.231 440 H ILE 64 H ILE 64 10.360 8.109 -2.419 441 HA ILE 64 HA ILE 64 9.146 8.769 0.039 442 HB ILE 64 HB ILE 64 10.158 11.023 -0.443 443 HG12 ILE 64 2HG1 ILE 64 11.212 9.989 -3.059 444 HG13 ILE 64 1HG1 ILE 64 9.950 11.176 -2.856 445 HG21 ILE 64 1HG2 ILE 64 12.128 8.873 -1.037 446 HG22 ILE 64 2HG2 ILE 64 12.358 10.080 0.129 447 HG23 ILE 64 3HG2 ILE 64 11.288 8.666 0.455 448 HD11 ILE 64 HD3 ILE 64 11.902 12.298 -3.159 449 HD12 ILE 64 HD1 ILE 64 11.584 12.600 -1.472 450 HD13 ILE 64 HD2 ILE 64 12.865 11.436 -1.984 451 H SER 65 H SER 65 8.245 10.421 -3.143 452 HA SER 65 HA SER 65 5.911 11.548 -2.067 453 HB2 SER 65 HB2 SER 65 5.123 11.537 -4.460 454 HB3 SER 65 HB1 SER 65 6.857 12.034 -4.445 455 HG SER 65 HG SER 65 7.459 10.131 -5.071 456 H GLN 66 H GLN 66 6.466 8.070 -2.885 457 HA GLN 66 HA GLN 66 3.645 7.457 -2.764 458 HB2 GLN 66 HB2 GLN 66 6.121 5.729 -2.855 459 HB3 GLN 66 HB1 GLN 66 4.574 5.089 -2.480 460 HG2 GLN 66 HG2 GLN 66 3.873 6.221 -4.775 461 HG3 GLN 66 HG1 GLN 66 5.478 6.755 -4.983 462 HE21 GLN 66 1HE2 GLN 66 4.071 5.351 -6.748 463 HE22 GLN 66 2HE2 GLN 66 4.789 3.731 -6.986 464 H ALA 67 H ALA 67 6.365 6.640 -0.404 465 HA ALA 67 HA ALA 67 5.177 6.214 1.941 466 HB1 ALA 67 HB1 ALA 67 7.192 7.293 2.907 467 HB2 ALA 67 HB2 ALA 67 7.564 6.199 1.588 468 HB3 ALA 67 HB3 ALA 67 7.618 7.916 1.312 469 H ARG 68 H ARG 68 5.704 9.546 0.563 470 HA ARG 68 HA ARG 68 4.330 10.874 2.374 471 HB2 ARG 68 HB2 ARG 68 5.450 11.616 0.135 472 HB3 ARG 68 HB1 ARG 68 3.748 11.722 -0.461 473 HG2 ARG 68 HG2 ARG 68 4.303 13.792 -0.037 474 HG3 ARG 68 HG1 ARG 68 3.376 13.284 1.519 475 HD2 ARG 68 HD2 ARG 68 5.269 14.587 2.306 476 HD3 ARG 68 HD1 ARG 68 5.438 12.921 2.676 477 HE ARG 68 HE ARG 68 6.860 14.400 0.499 478 HH11 ARG 68 1HH2 ARG 68 6.894 11.556 2.690 479 HH12 ARG 68 2HH2 ARG 68 8.493 11.164 2.292 480 HH21 ARG 68 1HH1 ARG 68 9.066 13.709 -0.078 481 HH22 ARG 68 2HH1 ARG 68 9.737 12.679 1.068 482 H GLN 69 H GLN 69 2.823 9.235 -0.487 483 HA GLN 69 HA GLN 69 0.140 10.045 0.127 484 HB2 GLN 69 HB2 GLN 69 1.572 8.294 -1.887 485 HB3 GLN 69 HB1 GLN 69 -0.220 8.542 -1.796 486 HG2 GLN 69 HG2 GLN 69 -0.185 10.668 -2.354 487 HG3 GLN 69 HG1 GLN 69 1.537 10.931 -2.137 488 HE21 GLN 69 1HE2 GLN 69 3.112 10.196 -3.789 489 HE22 GLN 69 2HE2 GLN 69 2.467 9.636 -5.371 490 H LEU 70 H LEU 70 1.868 6.766 0.615 491 HA LEU 70 HA LEU 70 -0.209 5.507 1.601 492 HB2 LEU 70 HB2 LEU 70 2.624 5.810 2.726 493 HB3 LEU 70 HB1 LEU 70 1.469 4.472 3.228 494 HG LEU 70 HG LEU 70 2.875 4.945 0.573 495 HD11 LEU 70 1HD1 LEU 70 3.229 2.800 2.629 496 HD12 LEU 70 2HD1 LEU 70 4.132 3.132 1.042 497 HD13 LEU 70 3HD1 LEU 70 4.322 4.130 2.465 498 HD21 LEU 70 3HD2 LEU 70 0.775 4.023 0.313 499 HD22 LEU 70 1HD2 LEU 70 2.001 2.866 -0.218 500 HD23 LEU 70 2HD2 LEU 70 1.078 2.596 1.386 501 H GLU 71 H GLU 71 1.660 8.176 3.428 502 HA GLU 71 HA GLU 71 0.567 7.633 5.985 503 HB2 GLU 71 HB2 GLU 71 1.656 9.975 4.536 504 HB3 GLU 71 HB1 GLU 71 0.970 10.154 6.164 505 HG2 GLU 71 HG2 GLU 71 2.579 8.108 6.704 506 HG3 GLU 71 HG1 GLU 71 3.385 8.564 5.185 507 H LYS 72 H LYS 72 -0.584 9.486 3.085 508 HA LYS 72 HA LYS 72 -3.140 10.360 4.158 509 HB2 LYS 72 HB2 LYS 72 -1.386 10.704 1.769 510 HB3 LYS 72 HB1 LYS 72 -3.038 11.281 1.862 511 HG2 LYS 72 HG2 LYS 72 -1.390 13.140 2.402 512 HG3 LYS 72 HG1 LYS 72 -2.723 12.778 3.496 513 HD2 LYS 72 HD2 LYS 72 -1.211 11.778 5.055 514 HD3 LYS 72 HD1 LYS 72 0.119 12.041 4.017 515 HE2 LYS 72 HE2 LYS 72 -0.729 14.589 4.042 516 HE3 LYS 72 HE1 LYS 72 -1.260 14.057 5.681 517 HZ1 LYS 72 HZ1 LYS 72 0.816 13.425 6.312 518 HZ2 LYS 72 HZ2 LYS 72 1.455 13.712 4.796 519 HZ3 LYS 72 HZ3 LYS 72 0.989 14.916 5.820 520 H ILE 73 H ILE 73 -2.356 7.363 2.779 521 HA ILE 73 HA ILE 73 -4.227 7.427 0.650 522 HB ILE 73 HB ILE 73 -2.103 5.944 0.891 523 HG12 ILE 73 2HG1 ILE 73 -4.187 4.234 0.041 524 HG13 ILE 73 1HG1 ILE 73 -3.945 5.789 -0.933 525 HG21 ILE 73 1HG2 ILE 73 -2.879 4.898 3.192 526 HG22 ILE 73 2HG2 ILE 73 -3.578 3.806 2.218 527 HG23 ILE 73 3HG2 ILE 73 -1.822 4.206 1.992 528 HD11 ILE 73 HD3 ILE 73 -1.550 5.041 -1.206 529 HD12 ILE 73 HD1 ILE 73 -1.991 3.517 -0.477 530 HD13 ILE 73 HD2 ILE 73 -2.732 4.105 -2.000 531 H LEU 74 H LEU 74 -4.686 6.074 3.946 532 HA LEU 74 HA LEU 74 -7.167 5.067 3.270 533 HB2 LEU 74 HB2 LEU 74 -5.599 4.907 5.923 534 HB3 LEU 74 HB1 LEU 74 -7.074 4.060 5.593 535 HG LEU 74 HG LEU 74 -4.424 3.781 4.278 536 HD11 LEU 74 1HD1 LEU 74 -4.433 3.246 6.506 537 HD12 LEU 74 2HD1 LEU 74 -5.839 2.245 6.410 538 HD13 LEU 74 3HD1 LEU 74 -4.287 1.749 5.601 539 HD21 LEU 74 3HD2 LEU 74 -6.871 2.279 3.384 540 HD22 LEU 74 1HD2 LEU 74 -5.660 3.184 2.420 541 HD23 LEU 74 2HD2 LEU 74 -5.180 1.742 3.192 542 H GLY 75 H GLY 75 -6.214 8.075 4.307 543 HA2 GLY 75 HA2 GLY 75 -6.601 9.660 5.549 544 HA3 GLY 75 HA1 GLY 75 -8.241 9.098 5.936 545 H ILE 76 H ILE 76 -6.603 6.425 6.827 546 HA ILE 76 HA ILE 76 -5.795 7.395 9.454 547 HB ILE 76 HB ILE 76 -7.151 5.488 10.418 548 HG12 ILE 76 2HG1 ILE 76 -8.292 4.911 7.703 549 HG13 ILE 76 1HG1 ILE 76 -6.789 4.223 8.181 550 HG21 ILE 76 1HG2 ILE 76 -9.258 6.268 10.127 551 HG22 ILE 76 2HG2 ILE 76 -8.137 7.626 10.108 552 HG23 ILE 76 3HG2 ILE 76 -8.774 7.149 8.554 553 HD11 ILE 76 HD3 ILE 76 -7.781 3.127 10.074 554 HD12 ILE 76 HD1 ILE 76 -9.343 3.915 9.898 555 HD13 ILE 76 HD2 ILE 76 -8.824 2.828 8.584 556 H LYS 77 H LYS 77 -5.459 4.753 10.659 557 HA LYS 77 HA LYS 77 -3.517 3.119 9.449 558 HB2 LYS 77 HB2 LYS 77 -1.595 4.011 10.651 559 HB3 LYS 77 HB1 LYS 77 -2.218 5.153 9.416 560 HG2 LYS 77 HG2 LYS 77 -3.208 6.548 10.967 561 HG3 LYS 77 HG1 LYS 77 -2.825 5.591 12.287 562 HD2 LYS 77 HD2 LYS 77 -0.371 6.137 12.057 563 HD3 LYS 77 HD1 LYS 77 -0.596 6.618 10.413 564 HE2 LYS 77 HE2 LYS 77 -1.579 8.281 12.767 565 HE3 LYS 77 HE1 LYS 77 -0.136 8.511 11.696 566 HZ1 LYS 77 HZ1 LYS 77 -2.917 8.777 10.748 567 HZ2 LYS 77 HZ2 LYS 77 -1.694 9.880 10.927 568 HZ3 LYS 77 HZ3 LYS 77 -1.635 8.582 9.880 569 H LEU 78 H LEU 78 -2.639 1.853 11.273 570 HA LEU 78 HA LEU 78 -1.990 1.469 13.101 571 HB2 LEU 78 HB2 LEU 78 -2.287 3.712 13.865 572 HB3 LEU 78 HB1 LEU 78 -4.059 3.484 14.268 573 HG LEU 78 HG LEU 78 -3.422 1.950 16.074 574 HD11 LEU 78 1HD1 LEU 78 -1.127 1.150 15.481 575 HD12 LEU 78 2HD1 LEU 78 -0.495 2.715 15.594 576 HD13 LEU 78 3HD1 LEU 78 -1.319 1.960 17.066 577 HD21 LEU 78 3HD2 LEU 78 -2.768 3.752 17.634 578 HD22 LEU 78 1HD2 LEU 78 -2.170 4.698 16.336 579 HD23 LEU 78 2HD2 LEU 78 -3.901 4.328 16.438 580 H VAL 79 H VAL 79 -5.379 1.336 12.774 581 HA VAL 79 HA VAL 79 -5.653 -0.435 15.023 582 HB VAL 79 HB VAL 79 -7.942 0.142 14.878 583 HG11 VAL 79 1HG1 VAL 79 -7.773 2.198 15.721 584 HG12 VAL 79 2HG1 VAL 79 -6.175 1.896 15.757 585 HG13 VAL 79 3HG1 VAL 79 -6.838 2.805 14.347 586 HG21 VAL 79 3HG2 VAL 79 -7.543 1.450 12.102 587 HG22 VAL 79 1HG2 VAL 79 -8.574 0.244 12.576 588 HG23 VAL 79 2HG2 VAL 79 -8.863 1.801 13.310 589 H THR 80 H THR 80 -6.471 -2.296 15.424 590 HA THR 80 HA THR 80 -7.253 -4.265 13.347 591 HB THR 80 HB THR 80 -7.073 -5.819 14.946 592 HG1 THR 80 HG1 THR 80 -6.358 -5.066 17.107 593 HG21 THR 80 1HG2 THR 80 -4.885 -5.910 15.182 594 HG22 THR 80 2HG2 THR 80 -4.973 -4.794 13.841 595 HG23 THR 80 3HG2 THR 80 -4.681 -4.158 15.509 596 HA PRO 81 HA PRO 81 -11.412 -3.680 14.728 597 HB2 PRO 81 HB1 PRO 81 -11.810 -6.551 15.563 598 HB3 PRO 81 HB2 PRO 81 -12.712 -5.635 14.345 599 HG2 PRO 81 HG1 PRO 81 -10.821 -7.505 13.669 600 HG3 PRO 81 HG2 PRO 81 -11.233 -6.005 12.695 601 HD2 PRO 81 HD1 PRO 81 -8.819 -6.544 14.467 602 HD3 PRO 81 HD2 PRO 81 -9.005 -5.617 12.938 603 H LEU 82 H LEU 82 -8.952 -4.575 16.715 604 HA LEU 82 HA LEU 82 -10.567 -4.570 19.188 605 HB2 LEU 82 HB2 LEU 82 -8.286 -6.184 18.047 606 HB3 LEU 82 HB1 LEU 82 -8.033 -5.550 19.642 607 HG LEU 82 HG LEU 82 -9.097 -7.785 19.760 608 HD11 LEU 82 1HD1 LEU 82 -9.252 -6.238 21.585 609 HD12 LEU 82 2HD1 LEU 82 -10.768 -5.631 20.955 610 HD13 LEU 82 3HD1 LEU 82 -10.621 -7.320 21.397 611 HD21 LEU 82 3HD2 LEU 82 -11.192 -8.318 19.048 612 HD22 LEU 82 1HD2 LEU 82 -11.628 -6.654 18.660 613 HD23 LEU 82 2HD2 LEU 82 -10.431 -7.330 17.621 614 H GLU 83 H GLU 83 -7.926 -2.918 17.519 615 HA GLU 83 HA GLU 83 -6.647 -1.887 19.700 616 HB2 GLU 83 HB2 GLU 83 -5.752 -2.137 17.460 617 HB3 GLU 83 HB1 GLU 83 -6.603 -0.573 17.052 618 HG2 GLU 83 HG2 GLU 83 -4.350 -0.134 17.447 619 HG3 GLU 83 HG1 GLU 83 -5.310 0.487 18.779 620 H ASN 84 H ASN 84 -7.365 -0.285 21.208 621 HA ASN 84 HA ASN 84 -9.759 1.112 20.401 622 HB2 ASN 84 HB2 ASN 84 -9.680 -0.337 22.499 623 HB3 ASN 84 HB1 ASN 84 -8.678 0.689 23.200 624 HD21 ASN 84 1HD2 ASN 84 -11.723 0.208 21.227 625 HD22 ASN 84 2HD2 ASN 84 -12.692 1.493 21.937 626 H ASN 85 H ASN 85 -6.871 2.113 22.620 627 HA ASN 85 HA ASN 85 -7.021 4.741 22.036 628 HB2 ASN 85 HB2 ASN 85 -5.726 3.532 23.781 629 HB3 ASN 85 HB1 ASN 85 -4.572 3.042 22.540 630 HD21 ASN 85 1HD2 ASN 85 -4.003 4.359 24.812 631 HD22 ASN 85 2HD2 ASN 85 -3.610 6.029 24.636 632 H GLU 86 H GLU 86 -6.802 5.906 20.114 633 HA GLU 86 HA GLU 86 -4.608 5.255 18.360 634 HB2 GLU 86 HB2 GLU 86 -5.942 4.921 16.448 635 HB3 GLU 86 HB1 GLU 86 -6.426 3.797 17.524 636 HG2 GLU 86 HG2 GLU 86 -8.544 4.438 16.611 637 HG3 GLU 86 HG1 GLU 86 -8.447 5.425 18.017 638 H GLU 87 H GLU 87 -5.289 7.509 20.017 639 HA GLU 87 HA GLU 87 -6.628 9.523 18.636 640 HB2 GLU 87 HB2 GLU 87 -5.934 9.274 20.985 641 HB3 GLU 87 HB1 GLU 87 -4.518 10.225 20.578 642 HG2 GLU 87 HG2 GLU 87 -5.794 11.913 19.571 643 HG3 GLU 87 HG1 GLU 87 -7.369 11.244 20.029 644 H SER 88 H SER 88 -5.916 9.950 16.532 645 HA SER 88 HA SER 88 -3.677 11.733 16.252 646 HB2 SER 88 HB2 SER 88 -3.060 10.437 14.185 647 HB3 SER 88 HB1 SER 88 -2.497 9.864 15.781 648 HG SER 88 HG SER 88 -4.470 8.366 15.550 649 H GLU 89 H GLU 89 -3.985 13.288 14.383 650 HA GLU 89 HA GLU 89 -6.723 13.561 13.684 651 HB2 GLU 89 HB2 GLU 89 -5.691 15.272 12.120 652 HB3 GLU 89 HB1 GLU 89 -5.368 15.546 13.914 653 HG2 GLU 89 HG2 GLU 89 -3.231 14.101 12.744 654 HG3 GLU 89 HG1 GLU 89 -3.515 15.415 11.641 655 H LYS 90 H LYS 90 -7.800 13.281 11.846 656 HA LYS 90 HA LYS 90 -7.125 10.899 10.282 657 HB2 LYS 90 HB2 LYS 90 -9.435 11.638 10.992 658 HB3 LYS 90 HB1 LYS 90 -9.146 13.131 9.962 659 HG2 LYS 90 HG2 LYS 90 -8.840 11.398 8.148 660 HG3 LYS 90 HG1 LYS 90 -9.681 10.174 9.139 661 HD2 LYS 90 HD2 LYS 90 -10.719 12.938 8.410 662 HD3 LYS 90 HD1 LYS 90 -10.861 11.536 7.355 663 HE2 LYS 90 HE2 LYS 90 -12.941 11.735 8.458 664 HE3 LYS 90 HE1 LYS 90 -12.231 10.298 9.121 665 HZ1 LYS 90 HZ1 LYS 90 -13.171 11.527 10.861 666 HZ2 LYS 90 HZ2 LYS 90 -11.545 11.605 11.055 667 HZ3 LYS 90 HZ3 LYS 90 -12.374 12.887 10.412 668 H GLU 91 H GLU 91 -6.002 11.081 8.413 669 HA GLU 91 HA GLU 91 -5.740 13.699 7.096 670 HB2 GLU 91 HB2 GLU 91 -3.357 12.059 8.044 671 HB3 GLU 91 HB1 GLU 91 -3.308 13.291 6.715 672 HG2 GLU 91 HG2 GLU 91 -4.248 15.041 8.496 673 HG3 GLU 91 HG1 GLU 91 -4.109 13.748 9.590 674 H PHE 92 H PHE 92 -6.487 13.450 5.257 675 HA PHE 92 HA PHE 92 -5.684 11.096 3.512 676 HB2 PHE 92 HB2 PHE 92 -8.149 11.593 4.907 677 HB3 PHE 92 HB1 PHE 92 -8.370 12.435 3.418 678 HD1 PHE 92 HD1 PHE 92 -6.843 10.387 1.557 679 HD2 PHE 92 HD2 PHE 92 -9.789 10.012 4.637 680 HE1 PHE 92 HE1 PHE 92 -7.490 8.258 0.665 681 HE2 PHE 92 HE2 PHE 92 -10.632 7.911 3.581 682 HZ PHE 92 HZ PHE 92 -9.305 6.844 1.776 683 H ASP 93 H ASP 93 -5.229 11.397 1.602 684 HA ASP 93 HA ASP 93 -4.554 13.726 0.236 685 HB2 ASP 93 HB2 ASP 93 -3.668 11.621 -0.245 686 HB3 ASP 93 HB1 ASP 93 -5.291 10.954 -0.627 687 H ASP 94 H ASP 94 -5.619 15.062 -1.293 688 HA ASP 94 HA ASP 94 -8.393 15.319 -0.817 689 HB2 ASP 94 HB2 ASP 94 -6.945 17.144 -1.127 690 HB3 ASP 94 HB1 ASP 94 -6.643 16.655 -2.774 691 H THR 95 H THR 95 -6.623 14.084 -3.725 692 HA THR 95 HA THR 95 -8.941 13.173 -4.963 693 HB THR 95 HB THR 95 -6.290 11.609 -5.089 694 HG1 THR 95 HG1 THR 95 -5.667 12.962 -6.668 695 HG21 THR 95 1HG2 THR 95 -6.948 11.119 -7.519 696 HG22 THR 95 2HG2 THR 95 -8.027 10.435 -6.234 697 HG23 THR 95 3HG2 THR 95 -8.479 11.836 -7.214 698 H GLY 96 H GLY 96 -7.084 11.820 -2.368 699 HA2 GLY 96 HA2 GLY 96 -8.279 9.308 -2.324 700 HA3 GLY 96 HA1 GLY 96 -7.571 10.011 -0.903 701 H LEU 97 H LEU 97 -9.467 12.368 -0.886 702 HA LEU 97 HA LEU 97 -11.819 11.086 0.275 703 HB2 LEU 97 HB2 LEU 97 -10.374 12.599 1.464 704 HB3 LEU 97 HB1 LEU 97 -10.558 13.898 0.297 705 HG LEU 97 HG LEU 97 -12.943 13.962 0.923 706 HD11 LEU 97 1HD1 LEU 97 -12.996 11.606 2.349 707 HD12 LEU 97 2HD1 LEU 97 -12.097 12.413 3.449 708 HD13 LEU 97 3HD1 LEU 97 -13.729 13.059 3.123 709 HD21 LEU 97 3HD2 LEU 97 -12.753 15.116 2.979 710 HD22 LEU 97 1HD2 LEU 97 -10.989 14.583 3.070 711 HD23 LEU 97 2HD2 LEU 97 -11.570 15.647 1.763 712 H THR 98 H THR 98 -11.176 13.930 -1.759 713 HA THR 98 HA THR 98 -13.911 14.388 -2.049 714 HB THR 98 HB THR 98 -11.543 15.789 -3.220 715 HG1 THR 98 HG1 THR 98 -11.270 16.620 -1.181 716 HG21 THR 98 1HG2 THR 98 -13.318 17.084 -4.081 717 HG22 THR 98 2HG2 THR 98 -14.289 16.964 -2.590 718 HG23 THR 98 3HG2 THR 98 -12.725 17.895 -2.605 719 H LEU 99 H LEU 99 -11.317 13.517 -4.285 720 HA LEU 99 HA LEU 99 -13.221 13.288 -6.562 721 HB2 LEU 99 HB2 LEU 99 -10.754 13.924 -6.807 722 HB3 LEU 99 HB1 LEU 99 -10.429 12.209 -6.468 723 HG LEU 99 HG LEU 99 -12.043 11.908 -8.504 724 HD11 LEU 99 1HD1 LEU 99 -13.169 14.110 -8.405 725 HD12 LEU 99 2HD1 LEU 99 -11.591 14.873 -8.670 726 HD13 LEU 99 3HD1 LEU 99 -12.456 13.970 -9.869 727 HD21 LEU 99 3HD2 LEU 99 -9.384 13.199 -9.066 728 HD22 LEU 99 1HD2 LEU 99 -9.788 11.420 -8.955 729 HD23 LEU 99 2HD2 LEU 99 -10.515 12.435 -10.210 730 H GLY 100 H GLY 100 -12.114 11.403 -3.937 731 HA2 GLY 100 HA2 GLY 100 -12.895 8.972 -4.972 732 HA3 GLY 100 HA1 GLY 100 -12.607 9.221 -3.260 733 H ASP 101 H ASP 101 -14.836 11.500 -3.774 734 HA ASP 101 HA ASP 101 -16.805 10.010 -2.480 735 HB2 ASP 101 HB2 ASP 101 -16.048 12.598 -2.147 736 HB3 ASP 101 HB1 ASP 101 -17.134 12.866 -3.457 737 H VAL 102 H VAL 102 -16.702 9.460 -5.150 738 HA VAL 102 HA VAL 102 -19.402 9.334 -6.093 739 HB VAL 102 HB VAL 102 -18.009 8.342 -8.174 740 HG11 VAL 102 1HG1 VAL 102 -18.679 11.139 -7.449 741 HG12 VAL 102 2HG1 VAL 102 -17.923 10.581 -9.000 742 HG13 VAL 102 3HG1 VAL 102 -19.500 10.031 -8.568 743 HG21 VAL 102 3HG2 VAL 102 -15.941 9.321 -8.392 744 HG22 VAL 102 1HG2 VAL 102 -15.959 10.227 -6.853 745 HG23 VAL 102 2HG2 VAL 102 -15.816 8.573 -6.789 746 H VAL 103 H VAL 103 -19.101 5.461 -6.368 747 HA VAL 103 HA VAL 103 -20.043 7.375 -8.102 748 HB VAL 103 HB VAL 103 -21.580 5.088 -6.884 749 HG11 VAL 103 1HG1 VAL 103 -22.478 6.757 -9.113 750 HG12 VAL 103 2HG1 VAL 103 -23.005 5.151 -9.038 751 HG13 VAL 103 3HG1 VAL 103 -23.158 6.236 -7.554 752 HG21 VAL 103 3HG2 VAL 103 -20.115 5.363 -9.546 753 HG22 VAL 103 1HG2 VAL 103 -19.364 4.453 -8.198 754 HG23 VAL 103 2HG2 VAL 103 -20.785 3.880 -9.006 755 H ASN 104 H ASN 104 -21.411 9.249 -7.720 756 HA ASN 104 HA ASN 104 -21.580 9.641 -4.887 757 HB2 ASN 104 HB2 ASN 104 -21.065 11.377 -6.900 758 HB3 ASN 104 HB1 ASN 104 -22.791 11.447 -7.049 759 HD21 ASN 104 1HD2 ASN 104 -20.115 12.718 -5.066 760 HD22 ASN 104 2HD2 ASN 104 -21.214 13.545 -4.073 761 H ILE 105 H ILE 105 -24.001 9.264 -7.390 762 HA ILE 105 HA ILE 105 -26.351 10.026 -5.947 763 HB ILE 105 HB ILE 105 -25.990 10.354 -8.274 764 HG12 ILE 105 2HG1 ILE 105 -28.534 9.037 -7.456 765 HG13 ILE 105 1HG1 ILE 105 -27.970 10.733 -7.220 766 HG21 ILE 105 1HG2 ILE 105 -26.755 7.625 -9.146 767 HG22 ILE 105 2HG2 ILE 105 -26.035 8.983 -9.960 768 HG23 ILE 105 3HG2 ILE 105 -25.081 7.924 -8.901 769 HD11 ILE 105 HD3 ILE 105 -28.558 9.481 -9.913 770 HD12 ILE 105 HD1 ILE 105 -29.381 10.655 -9.036 771 HD13 ILE 105 HD2 ILE 105 -27.728 11.131 -9.549 772 H LYS 106 H LYS 106 -24.565 7.253 -5.826 773 HA LYS 106 HA LYS 106 -26.920 5.788 -4.700 774 HB2 LYS 106 HB2 LYS 106 -24.377 4.649 -5.910 775 HB3 LYS 106 HB1 LYS 106 -25.681 3.589 -5.192 776 HG2 LYS 106 HG2 LYS 106 -27.215 4.510 -6.620 777 HG3 LYS 106 HG1 LYS 106 -26.070 5.349 -7.621 778 HD2 LYS 106 HD2 LYS 106 -24.848 3.180 -7.977 779 HD3 LYS 106 HD1 LYS 106 -26.253 2.274 -7.319 780 HE2 LYS 106 HE2 LYS 106 -27.669 3.513 -8.872 781 HE3 LYS 106 HE1 LYS 106 -26.185 4.018 -9.816 782 HZ1 LYS 106 HZ1 LYS 106 -26.956 1.932 -10.756 783 HZ2 LYS 106 HZ2 LYS 106 -25.707 1.591 -9.850 784 HZ3 LYS 106 HZ3 LYS 106 -27.161 1.218 -9.338 785 H GLU 107 H GLU 107 -26.701 4.569 -2.909 786 HA GLU 107 HA GLU 107 -25.606 5.884 -0.817 787 HB2 GLU 107 HB2 GLU 107 -26.930 3.203 -1.040 788 HB3 GLU 107 HB1 GLU 107 -26.664 3.927 0.539 789 HG2 GLU 107 HG2 GLU 107 -28.011 5.919 -0.390 790 HG3 GLU 107 HG1 GLU 107 -28.524 4.810 -1.718 791 H GLY 108 H GLY 108 -23.712 5.579 0.467 792 HA2 GLY 108 HA2 GLY 108 -21.996 4.541 1.441 793 HA3 GLY 108 HA1 GLY 108 -22.212 3.037 0.584 794 H LYS 109 H LYS 109 -22.352 4.349 -2.008 795 HA LYS 109 HA LYS 109 -21.155 5.717 -3.409 796 HB2 LYS 109 HB2 LYS 109 -18.823 4.909 -1.786 797 HB3 LYS 109 HB1 LYS 109 -18.629 5.900 -3.179 798 HG2 LYS 109 HG2 LYS 109 -19.804 7.792 -2.192 799 HG3 LYS 109 HG1 LYS 109 -20.296 6.773 -0.816 800 HD2 LYS 109 HD2 LYS 109 -18.118 6.725 0.019 801 HD3 LYS 109 HD1 LYS 109 -17.484 7.532 -1.476 802 HE2 LYS 109 HE2 LYS 109 -17.536 9.245 -0.063 803 HE3 LYS 109 HE1 LYS 109 -18.889 9.653 -0.943 804 HZ1 LYS 109 HZ1 LYS 109 -19.113 9.731 1.553 805 HZ2 LYS 109 HZ2 LYS 109 -20.205 8.702 0.936 806 HZ3 LYS 109 HZ3 LYS 109 -18.773 8.116 1.573 807 H LYS 110 H LYS 110 -21.274 2.400 -2.984 808 HA LYS 110 HA LYS 110 -21.098 0.706 -4.274 809 HB2 LYS 110 HB2 LYS 110 -22.791 2.213 -5.496 810 HB3 LYS 110 HB1 LYS 110 -21.532 2.553 -6.621 811 HG2 LYS 110 HG2 LYS 110 -21.112 0.217 -7.007 812 HG3 LYS 110 HG1 LYS 110 -22.294 -0.307 -5.886 813 HD2 LYS 110 HD2 LYS 110 -23.983 1.021 -7.520 814 HD3 LYS 110 HD1 LYS 110 -22.623 0.959 -8.613 815 HE2 LYS 110 HE2 LYS 110 -23.862 -0.894 -9.150 816 HE3 LYS 110 HE1 LYS 110 -22.323 -1.432 -8.484 817 HZ1 LYS 110 HZ1 LYS 110 -24.653 -1.306 -6.696 818 HZ2 LYS 110 HZ2 LYS 110 -24.185 -2.592 -7.647 819 HZ3 LYS 110 HZ3 LYS 110 -23.215 -2.057 -6.473 820 H LEU 111 H LEU 111 -19.001 0.394 -3.464 821 HA LEU 111 HA LEU 111 -16.847 0.977 -5.320 822 HB2 LEU 111 HB2 LEU 111 -16.181 -0.275 -2.656 823 HB3 LEU 111 HB1 LEU 111 -15.201 0.524 -3.788 824 HG LEU 111 HG LEU 111 -17.527 1.984 -2.272 825 HD11 LEU 111 1HD1 LEU 111 -14.615 1.701 -1.572 826 HD12 LEU 111 2HD1 LEU 111 -15.664 2.950 -0.942 827 HD13 LEU 111 3HD1 LEU 111 -16.012 1.353 -0.507 828 HD21 LEU 111 3HD2 LEU 111 -16.203 4.037 -2.865 829 HD22 LEU 111 1HD2 LEU 111 -15.235 3.113 -3.885 830 HD23 LEU 111 2HD2 LEU 111 -16.988 3.240 -4.233 831 H GLU 112 H GLU 112 -15.171 -0.901 -5.662 832 HA GLU 112 HA GLU 112 -16.628 -3.201 -6.613 833 HB2 GLU 112 HB2 GLU 112 -13.694 -2.556 -6.164 834 HB3 GLU 112 HB1 GLU 112 -14.129 -3.999 -6.986 835 HG2 GLU 112 HG2 GLU 112 -15.134 -2.636 -8.928 836 HG3 GLU 112 HG1 GLU 112 -14.938 -1.145 -7.929 837 H HIS 113 H HIS 113 -14.933 -3.053 -3.411 838 HA HIS 113 HA HIS 113 -15.422 -5.937 -3.155 839 HB2 HIS 113 HB2 HIS 113 -14.274 -5.621 -1.152 840 HB3 HIS 113 HB1 HIS 113 -13.294 -4.829 -2.376 841 HD2 HIS 113 HD2 HIS 113 -13.865 -4.650 0.917 842 HE1 HIS 113 HE1 HIS 113 -14.419 -0.478 -0.025 843 HE2 HIS 113 HE2 HIS 113 -14.230 -2.071 1.879 844 H HIS 114 H HIS 114 -17.816 -3.650 -3.121 845 HA HIS 114 HA HIS 114 -18.872 -4.204 -0.530 846 HB2 HIS 114 HB2 HIS 114 -19.332 -2.518 -2.952 847 HB3 HIS 114 HB1 HIS 114 -20.542 -2.526 -1.844 848 HD2 HIS 114 HD2 HIS 114 -17.385 -2.259 0.225 849 HE1 HIS 114 HE1 HIS 114 -18.936 1.657 -0.292 850 HE2 HIS 114 HE2 HIS 114 -17.377 0.152 1.171 Start of MODEL 2 1 H1 GLU 13 H1 GLU 13 29.059 -17.836 10.050 2 H2 GLU 13 H2 GLU 13 30.301 -18.288 9.199 3 H3 GLU 13 H3 GLU 13 30.325 -16.802 9.911 4 HA GLU 13 HA GLU 13 29.835 -16.167 7.798 5 HB2 GLU 13 HB2 GLU 13 29.779 -18.429 7.035 6 HB3 GLU 13 HB1 GLU 13 28.231 -18.662 7.738 7 HG2 GLU 13 HG2 GLU 13 27.575 -18.452 5.520 8 HG3 GLU 13 HG1 GLU 13 27.614 -16.704 5.886 9 H ASN 14 H ASN 14 29.317 -14.595 9.230 10 HA ASN 14 HA ASN 14 26.909 -14.135 10.292 11 HB2 ASN 14 HB2 ASN 14 27.517 -11.714 10.338 12 HB3 ASN 14 HB1 ASN 14 28.726 -12.776 10.964 13 HD21 ASN 14 1HD2 ASN 14 27.904 -10.492 8.513 14 HD22 ASN 14 2HD2 ASN 14 29.530 -10.299 7.873 15 H ALA 15 H ALA 15 27.661 -14.148 6.887 16 HA ALA 15 HA ALA 15 25.437 -12.353 6.190 17 HB1 ALA 15 HB1 ALA 15 26.036 -13.000 3.940 18 HB2 ALA 15 HB2 ALA 15 27.436 -12.419 4.872 19 HB3 ALA 15 HB3 ALA 15 27.163 -14.144 4.570 20 H GLU 16 H GLU 16 25.045 -15.327 7.522 21 HA GLU 16 HA GLU 16 22.630 -15.781 5.876 22 HB2 GLU 16 HB2 GLU 16 23.781 -17.419 8.209 23 HB3 GLU 16 HB1 GLU 16 22.616 -17.987 7.034 24 HG2 GLU 16 HG2 GLU 16 24.250 -17.536 5.256 25 HG3 GLU 16 HG1 GLU 16 25.523 -17.395 6.524 26 H LEU 17 H LEU 17 23.162 -13.710 8.296 27 HA LEU 17 HA LEU 17 20.346 -13.977 9.217 28 HB2 LEU 17 HB2 LEU 17 22.576 -12.494 10.547 29 HB3 LEU 17 HB1 LEU 17 20.920 -12.593 11.012 30 HG LEU 17 HG LEU 17 21.990 -13.840 12.619 31 HD11 LEU 17 1HD1 LEU 17 20.055 -14.606 12.133 32 HD12 LEU 17 2HD1 LEU 17 20.488 -15.764 10.790 33 HD13 LEU 17 3HD1 LEU 17 20.976 -15.950 12.573 34 HD21 LEU 17 3HD2 LEU 17 23.534 -15.456 12.249 35 HD22 LEU 17 1HD2 LEU 17 23.293 -15.556 10.464 36 HD23 LEU 17 2HD2 LEU 17 24.064 -14.103 11.183 37 H GLU 18 H GLU 18 19.511 -11.720 9.695 38 HA GLU 18 HA GLU 18 19.968 -9.673 7.751 39 HB2 GLU 18 HB2 GLU 18 19.039 -11.729 6.400 40 HB3 GLU 18 HB1 GLU 18 17.842 -11.789 7.573 41 HG2 GLU 18 HG2 GLU 18 16.928 -10.719 5.412 42 HG3 GLU 18 HG1 GLU 18 16.719 -9.735 6.780 43 H ILE 19 H ILE 19 18.855 -7.883 7.835 44 HA ILE 19 HA ILE 19 17.047 -7.437 10.148 45 HB ILE 19 HB ILE 19 18.218 -5.076 9.918 46 HG12 ILE 19 2HG1 ILE 19 20.204 -6.346 8.242 47 HG13 ILE 19 1HG1 ILE 19 18.773 -5.465 7.588 48 HG21 ILE 19 1HG2 ILE 19 20.187 -7.316 10.673 49 HG22 ILE 19 2HG2 ILE 19 20.060 -5.606 11.273 50 HG23 ILE 19 3HG2 ILE 19 18.880 -6.821 11.587 51 HD11 ILE 19 HD3 ILE 19 19.501 -3.523 8.961 52 HD12 ILE 19 HD1 ILE 19 20.962 -4.296 9.407 53 HD13 ILE 19 HD2 ILE 19 20.724 -3.933 7.723 54 H VAL 20 H VAL 20 17.033 -7.426 6.691 55 HA VAL 20 HA VAL 20 15.105 -5.256 6.590 56 HB VAL 20 HB VAL 20 14.667 -5.761 4.419 57 HG11 VAL 20 1HG1 VAL 20 17.537 -6.299 4.477 58 HG12 VAL 20 2HG1 VAL 20 16.706 -5.275 3.373 59 HG13 VAL 20 3HG1 VAL 20 16.905 -4.826 5.180 60 HG21 VAL 20 3HG2 VAL 20 15.925 -8.531 4.950 61 HG22 VAL 20 1HG2 VAL 20 14.362 -8.016 4.164 62 HG23 VAL 20 2HG2 VAL 20 15.892 -7.952 3.349 63 H THR 21 H THR 21 14.927 -8.092 8.115 64 HA THR 21 HA THR 21 12.197 -8.996 7.998 65 HB THR 21 HB THR 21 13.056 -9.731 10.316 66 HG1 THR 21 HG1 THR 21 15.611 -9.565 9.900 67 HG21 THR 21 1HG2 THR 21 14.464 -11.540 9.555 68 HG22 THR 21 2HG2 THR 21 13.191 -11.262 8.333 69 HG23 THR 21 3HG2 THR 21 14.883 -10.694 8.088 70 H ASP 22 H ASP 22 13.765 -6.110 9.202 71 HA ASP 22 HA ASP 22 11.645 -5.781 11.027 72 HB2 ASP 22 HB2 ASP 22 13.871 -5.131 11.846 73 HB3 ASP 22 HB1 ASP 22 13.895 -3.915 10.681 74 H TYR 23 H TYR 23 10.492 -5.978 8.964 75 HA TYR 23 HA TYR 23 10.449 -4.195 6.822 76 HB2 TYR 23 HB2 TYR 23 9.559 -6.416 6.745 77 HB3 TYR 23 HB1 TYR 23 8.272 -6.042 7.788 78 HD1 TYR 23 HD1 TYR 23 9.724 -4.305 4.775 79 HD2 TYR 23 HD2 TYR 23 6.256 -6.051 6.480 80 HE1 TYR 23 HE1 TYR 23 8.623 -3.877 2.695 81 HE2 TYR 23 HE2 TYR 23 5.037 -5.620 4.262 82 HH TYR 23 HH TYR 23 6.594 -4.630 1.381 83 H TYR 24 H TYR 24 9.481 -2.223 6.508 84 HA TYR 24 HA TYR 24 8.501 -0.852 8.691 85 HB2 TYR 24 HB2 TYR 24 9.551 0.366 6.842 86 HB3 TYR 24 HB1 TYR 24 8.582 -0.475 5.766 87 HD1 TYR 24 HD2 TYR 24 8.154 2.216 8.423 88 HD2 TYR 24 HD1 TYR 24 6.873 0.621 4.653 89 HE1 TYR 24 HE2 TYR 24 6.833 4.277 7.952 90 HE2 TYR 24 HE1 TYR 24 5.403 2.609 4.324 91 HH TYR 24 HH TYR 24 5.312 5.399 6.374 92 H LYS 25 H LYS 25 6.623 -0.084 9.414 93 HA LYS 25 HA LYS 25 4.613 -1.955 9.427 94 HB2 LYS 25 HB2 LYS 25 4.674 0.803 10.627 95 HB3 LYS 25 HB1 LYS 25 3.671 -0.482 11.213 96 HG2 LYS 25 HG2 LYS 25 5.331 -1.921 11.897 97 HG3 LYS 25 HG1 LYS 25 6.624 -0.933 11.441 98 HD2 LYS 25 HD2 LYS 25 6.023 0.764 13.037 99 HD3 LYS 25 HD1 LYS 25 4.521 -0.252 13.514 100 HE2 LYS 25 HE2 LYS 25 6.254 -2.087 13.948 101 HE3 LYS 25 HE1 LYS 25 7.569 -0.774 13.829 102 HZ1 LYS 25 HZ1 LYS 25 5.384 -0.691 15.689 103 HZ2 LYS 25 HZ2 LYS 25 6.854 -1.266 16.069 104 HZ3 LYS 25 HZ3 LYS 25 6.716 0.265 15.723 105 H ILE 26 H ILE 26 4.213 1.289 7.940 106 HA ILE 26 HA ILE 26 1.433 1.004 8.142 107 HB ILE 26 HB ILE 26 3.132 2.600 6.243 108 HG12 ILE 26 2HG1 ILE 26 2.739 4.523 7.743 109 HG13 ILE 26 1HG1 ILE 26 1.547 3.623 8.628 110 HG21 ILE 26 1HG2 ILE 26 1.404 4.065 6.096 111 HG22 ILE 26 2HG2 ILE 26 0.973 2.538 5.315 112 HG23 ILE 26 3HG2 ILE 26 0.139 2.860 6.816 113 HD11 ILE 26 HD3 ILE 26 4.525 3.130 8.575 114 HD12 ILE 26 HD1 ILE 26 3.699 4.235 9.713 115 HD13 ILE 26 HD2 ILE 26 3.360 2.434 9.725 116 H ILE 27 H ILE 27 3.411 0.630 5.095 117 HA ILE 27 HA ILE 27 1.475 -0.331 3.756 118 HB ILE 27 HB ILE 27 3.291 -1.624 2.413 119 HG12 ILE 27 2HG1 ILE 27 4.973 -0.320 4.657 120 HG13 ILE 27 1HG1 ILE 27 4.685 -1.963 4.560 121 HG21 ILE 27 1HG2 ILE 27 2.600 0.954 2.206 122 HG22 ILE 27 2HG2 ILE 27 3.970 1.327 3.056 123 HG23 ILE 27 3HG2 ILE 27 4.141 0.476 1.570 124 HD11 ILE 27 HD3 ILE 27 6.128 -0.069 2.556 125 HD12 ILE 27 HD1 ILE 27 6.883 -1.488 3.372 126 HD13 ILE 27 HD2 ILE 27 5.780 -1.764 2.107 127 H LYS 28 H LYS 28 3.256 -2.391 5.994 128 HA LYS 28 HA LYS 28 2.099 -4.785 5.677 129 HB2 LYS 28 HB2 LYS 28 3.992 -3.877 7.392 130 HB3 LYS 28 HB1 LYS 28 2.638 -3.527 8.419 131 HG2 LYS 28 HG2 LYS 28 1.895 -5.902 8.398 132 HG3 LYS 28 HG1 LYS 28 3.120 -6.360 7.216 133 HD2 LYS 28 HD2 LYS 28 4.877 -5.750 8.626 134 HD3 LYS 28 HD1 LYS 28 3.813 -5.117 9.942 135 HE2 LYS 28 HE2 LYS 28 2.809 -7.435 10.113 136 HE3 LYS 28 HE1 LYS 28 3.919 -8.015 8.994 137 HZ1 LYS 28 HZ1 LYS 28 4.730 -8.305 11.279 138 HZ2 LYS 28 HZ2 LYS 28 5.783 -7.433 10.534 139 HZ3 LYS 28 HZ3 LYS 28 4.766 -6.585 11.380 140 H THR 29 H THR 29 0.609 -2.118 7.616 141 HA THR 29 HA THR 29 -1.755 -3.696 7.985 142 HB THR 29 HB THR 29 -2.267 -1.550 9.238 143 HG1 THR 29 HG1 THR 29 -0.501 -0.424 7.652 144 HG21 THR 29 1HG2 THR 29 -0.498 -1.657 10.925 145 HG22 THR 29 2HG2 THR 29 -1.026 -3.284 10.512 146 HG23 THR 29 3HG2 THR 29 0.522 -2.518 9.899 147 H ALA 30 H ALA 30 -1.084 -1.860 5.362 148 HA ALA 30 HA ALA 30 -3.251 -0.199 5.088 149 HB1 ALA 30 HB1 ALA 30 -1.309 -1.396 3.139 150 HB2 ALA 30 HB2 ALA 30 -2.576 -0.253 2.707 151 HB3 ALA 30 HB3 ALA 30 -1.340 0.284 3.823 152 H ARG 31 H ARG 31 -2.953 -3.529 3.451 153 HA ARG 31 HA ARG 31 -5.183 -2.858 2.053 154 HB2 ARG 31 HB2 ARG 31 -3.310 -4.646 1.462 155 HB3 ARG 31 HB1 ARG 31 -4.009 -5.569 2.728 156 HG2 ARG 31 HG2 ARG 31 -5.148 -4.810 0.052 157 HG3 ARG 31 HG1 ARG 31 -4.441 -6.374 0.489 158 HD2 ARG 31 HD2 ARG 31 -7.165 -5.283 1.317 159 HD3 ARG 31 HD1 ARG 31 -6.936 -6.494 0.165 160 HE ARG 31 HE ARG 31 -5.759 -7.732 2.228 161 HH11 ARG 31 1HH2 ARG 31 -9.036 -6.480 1.773 162 HH12 ARG 31 2HH2 ARG 31 -9.689 -7.564 2.946 163 HH21 ARG 31 1HH1 ARG 31 -6.670 -8.964 3.986 164 HH22 ARG 31 2HH1 ARG 31 -8.325 -8.789 4.218 165 H GLU 32 H GLU 32 -4.828 -4.905 5.024 166 HA GLU 32 HA GLU 32 -7.543 -5.466 5.371 167 HB2 GLU 32 HB2 GLU 32 -5.344 -4.732 7.238 168 HB3 GLU 32 HB1 GLU 32 -6.857 -5.370 7.777 169 HG2 GLU 32 HG2 GLU 32 -6.523 -7.450 6.583 170 HG3 GLU 32 HG1 GLU 32 -4.903 -7.041 6.085 171 H GLN 33 H GLN 33 -5.796 -2.398 6.201 172 HA GLN 33 HA GLN 33 -7.980 -1.556 7.871 173 HB2 GLN 33 HB2 GLN 33 -5.202 -0.540 7.215 174 HB3 GLN 33 HB1 GLN 33 -6.307 0.762 7.493 175 HG2 GLN 33 HG2 GLN 33 -5.289 0.128 9.713 176 HG3 GLN 33 HG1 GLN 33 -7.028 0.031 9.559 177 HE21 GLN 33 1HE2 GLN 33 -4.573 -2.392 8.542 178 HE22 GLN 33 2HE2 GLN 33 -5.197 -3.675 9.484 179 H LEU 34 H LEU 34 -7.852 -1.764 4.715 180 HA LEU 34 HA LEU 34 -9.867 0.295 4.251 181 HB2 LEU 34 HB2 LEU 34 -7.989 -1.193 2.371 182 HB3 LEU 34 HB1 LEU 34 -9.153 0.147 1.950 183 HG LEU 34 HG LEU 34 -6.776 0.485 3.791 184 HD11 LEU 34 1HD1 LEU 34 -5.808 1.436 1.753 185 HD12 LEU 34 2HD1 LEU 34 -6.124 -0.357 1.487 186 HD13 LEU 34 3HD1 LEU 34 -7.038 0.871 0.747 187 HD21 LEU 34 3HD2 LEU 34 -7.062 2.851 3.345 188 HD22 LEU 34 1HD2 LEU 34 -8.628 2.555 2.460 189 HD23 LEU 34 2HD2 LEU 34 -8.460 2.198 4.121 190 H GLY 35 H GLY 35 -9.342 -3.152 4.387 191 HA2 GLY 35 HA2 GLY 35 -11.029 -4.619 4.888 192 HA3 GLY 35 HA1 GLY 35 -12.161 -3.315 4.590 193 H ILE 36 H ILE 36 -10.462 -3.206 2.041 194 HA ILE 36 HA ILE 36 -12.358 -4.471 0.117 195 HB ILE 36 HB ILE 36 -11.153 -2.897 -1.301 196 HG12 ILE 36 2HG1 ILE 36 -9.679 -1.819 1.037 197 HG13 ILE 36 1HG1 ILE 36 -9.044 -2.884 -0.212 198 HG21 ILE 36 1HG2 ILE 36 -12.240 -0.873 -0.386 199 HG22 ILE 36 2HG2 ILE 36 -13.214 -2.236 -0.202 200 HG23 ILE 36 3HG2 ILE 36 -12.330 -1.651 1.253 201 HD11 ILE 36 HD3 ILE 36 -10.032 -0.061 -0.573 202 HD12 ILE 36 HD1 ILE 36 -8.340 -0.742 -0.685 203 HD13 ILE 36 HD2 ILE 36 -9.614 -1.080 -1.924 204 H SER 37 H SER 37 -11.586 -5.481 -1.683 205 HA SER 37 HA SER 37 -9.376 -7.444 -1.385 206 HB2 SER 37 HB2 SER 37 -10.029 -8.291 -3.423 207 HB3 SER 37 HB1 SER 37 -11.495 -7.860 -2.532 208 HG SER 37 HG SER 37 -11.572 -7.022 -4.682 209 H GLN 38 H GLN 38 -7.498 -7.577 -2.611 210 HA GLN 38 HA GLN 38 -6.156 -5.219 -3.211 211 HB2 GLN 38 HB2 GLN 38 -5.701 -8.117 -4.129 212 HB3 GLN 38 HB1 GLN 38 -4.802 -6.714 -4.698 213 HG2 GLN 38 HG2 GLN 38 -4.034 -6.211 -2.366 214 HG3 GLN 38 HG1 GLN 38 -5.334 -7.132 -1.738 215 HE21 GLN 38 1HE2 GLN 38 -2.515 -7.674 -4.204 216 HE22 GLN 38 2HE2 GLN 38 -1.898 -9.043 -3.371 217 H GLN 39 H GLN 39 -8.313 -7.040 -5.393 218 HA GLN 39 HA GLN 39 -7.861 -5.304 -7.580 219 HB2 GLN 39 HB2 GLN 39 -10.172 -7.180 -6.694 220 HB3 GLN 39 HB1 GLN 39 -10.194 -6.291 -8.272 221 HG2 GLN 39 HG2 GLN 39 -8.153 -8.453 -7.543 222 HG3 GLN 39 HG1 GLN 39 -9.573 -8.642 -8.461 223 HE21 GLN 39 1HE2 GLN 39 -7.889 -9.582 -10.145 224 HE22 GLN 39 2HE2 GLN 39 -7.371 -8.319 -11.240 225 H GLN 40 H GLN 40 -10.182 -4.977 -4.829 226 HA GLN 40 HA GLN 40 -11.225 -2.591 -5.986 227 HB2 GLN 40 HB2 GLN 40 -11.093 -3.820 -3.332 228 HB3 GLN 40 HB1 GLN 40 -11.897 -2.190 -3.584 229 HG2 GLN 40 HG2 GLN 40 -13.436 -3.015 -5.195 230 HG3 GLN 40 HG1 GLN 40 -12.905 -4.678 -4.838 231 HE21 GLN 40 1HE2 GLN 40 -15.311 -2.427 -3.976 232 HE22 GLN 40 2HE2 GLN 40 -15.677 -3.086 -2.420 233 H LEU 41 H LEU 41 -8.310 -3.062 -4.083 234 HA LEU 41 HA LEU 41 -7.888 -0.323 -3.669 235 HB2 LEU 41 HB2 LEU 41 -6.900 -2.153 -2.361 236 HB3 LEU 41 HB1 LEU 41 -5.919 -2.667 -3.687 237 HG LEU 41 HG LEU 41 -4.499 -0.620 -3.486 238 HD11 LEU 41 1HD1 LEU 41 -5.097 0.766 -1.412 239 HD12 LEU 41 2HD1 LEU 41 -5.826 1.148 -3.044 240 HD13 LEU 41 3HD1 LEU 41 -6.831 0.357 -1.881 241 HD21 LEU 41 3HD2 LEU 41 -3.435 -1.264 -1.478 242 HD22 LEU 41 1HD2 LEU 41 -4.950 -1.755 -0.705 243 HD23 LEU 41 2HD2 LEU 41 -4.307 -2.662 -2.017 244 H ALA 42 H ALA 42 -7.113 -2.570 -6.351 245 HA ALA 42 HA ALA 42 -5.391 -0.709 -7.737 246 HB1 ALA 42 HB1 ALA 42 -6.806 -3.247 -8.743 247 HB2 ALA 42 HB2 ALA 42 -5.181 -2.729 -9.085 248 HB3 ALA 42 HB3 ALA 42 -5.423 -3.415 -7.611 249 H GLN 43 H GLN 43 -8.977 -1.279 -7.430 250 HA GLN 43 HA GLN 43 -9.505 0.237 -9.731 251 HB2 GLN 43 HB2 GLN 43 -11.108 -0.595 -7.322 252 HB3 GLN 43 HB1 GLN 43 -11.704 0.643 -8.581 253 HG2 GLN 43 HG2 GLN 43 -11.280 -0.801 -10.291 254 HG3 GLN 43 HG1 GLN 43 -10.714 -2.081 -9.251 255 HE21 GLN 43 1HE2 GLN 43 -12.414 -3.784 -8.242 256 HE22 GLN 43 2HE2 GLN 43 -14.011 -3.151 -8.489 257 H LYS 44 H LYS 44 -8.486 1.348 -6.539 258 HA LYS 44 HA LYS 44 -9.480 4.082 -6.701 259 HB2 LYS 44 HB2 LYS 44 -7.434 2.571 -5.069 260 HB3 LYS 44 HB1 LYS 44 -7.877 4.251 -4.730 261 HG2 LYS 44 HG2 LYS 44 -10.246 3.548 -4.250 262 HG3 LYS 44 HG1 LYS 44 -9.910 1.983 -4.756 263 HD2 LYS 44 HD2 LYS 44 -8.549 1.615 -2.729 264 HD3 LYS 44 HD1 LYS 44 -8.439 3.392 -2.518 265 HE2 LYS 44 HE2 LYS 44 -11.195 2.483 -2.423 266 HE3 LYS 44 HE1 LYS 44 -10.214 1.742 -1.164 267 HZ1 LYS 44 HZ1 LYS 44 -9.507 3.995 -0.608 268 HZ2 LYS 44 HZ2 LYS 44 -10.352 4.696 -1.717 269 HZ3 LYS 44 HZ3 LYS 44 -11.193 3.801 -0.606 270 H LEU 45 H LEU 45 -6.877 2.312 -7.829 271 HA LEU 45 HA LEU 45 -5.139 4.670 -7.872 272 HB2 LEU 45 HB2 LEU 45 -4.811 1.674 -7.346 273 HB3 LEU 45 HB1 LEU 45 -3.416 2.735 -7.634 274 HG LEU 45 HG LEU 45 -5.413 2.976 -5.347 275 HD11 LEU 45 1HD1 LEU 45 -2.413 2.257 -5.103 276 HD12 LEU 45 2HD1 LEU 45 -3.619 2.215 -3.885 277 HD13 LEU 45 3HD1 LEU 45 -3.767 1.076 -5.184 278 HD21 LEU 45 3HD2 LEU 45 -3.143 4.803 -6.188 279 HD22 LEU 45 1HD2 LEU 45 -4.779 5.191 -5.788 280 HD23 LEU 45 2HD2 LEU 45 -3.702 4.659 -4.521 281 H LYS 46 H LYS 46 -6.705 2.723 -10.061 282 HA LYS 46 HA LYS 46 -6.368 1.431 -11.673 283 HB2 LYS 46 HB2 LYS 46 -4.252 3.341 -12.500 284 HB3 LYS 46 HB1 LYS 46 -5.121 2.347 -13.621 285 HG2 LYS 46 HG2 LYS 46 -6.289 4.545 -11.944 286 HG3 LYS 46 HG1 LYS 46 -5.703 4.587 -13.691 287 HD2 LYS 46 HD2 LYS 46 -7.372 3.114 -14.391 288 HD3 LYS 46 HD1 LYS 46 -7.924 2.918 -12.637 289 HE2 LYS 46 HE2 LYS 46 -8.585 5.164 -12.556 290 HE3 LYS 46 HE1 LYS 46 -7.998 5.560 -14.234 291 HZ1 LYS 46 HZ1 LYS 46 -10.329 5.075 -14.541 292 HZ2 LYS 46 HZ2 LYS 46 -9.510 3.904 -15.090 293 HZ3 LYS 46 HZ3 LYS 46 -10.174 3.716 -13.599 294 H VAL 47 H VAL 47 -3.248 1.837 -10.210 295 HA VAL 47 HA VAL 47 -2.454 -0.577 -11.489 296 HB VAL 47 HB VAL 47 -0.143 0.319 -11.261 297 HG11 VAL 47 1HG1 VAL 47 -2.017 2.585 -12.167 298 HG12 VAL 47 2HG1 VAL 47 -0.327 2.358 -12.515 299 HG13 VAL 47 3HG1 VAL 47 -1.531 1.234 -13.079 300 HG21 VAL 47 3HG2 VAL 47 0.233 2.541 -10.203 301 HG22 VAL 47 1HG2 VAL 47 -1.464 2.525 -9.698 302 HG23 VAL 47 2HG2 VAL 47 -0.236 1.315 -9.047 303 H SER 48 H SER 48 -0.674 -1.986 -10.330 304 HA SER 48 HA SER 48 -2.052 -2.932 -7.970 305 HB2 SER 48 HB2 SER 48 -2.586 -4.839 -9.368 306 HB3 SER 48 HB1 SER 48 -3.195 -3.348 -10.063 307 HG SER 48 HG SER 48 -1.460 -3.544 -11.567 308 H GLU 49 H GLU 49 1.088 -2.477 -9.140 309 HA GLU 49 HA GLU 49 1.935 -5.205 -8.429 310 HB2 GLU 49 HB2 GLU 49 3.384 -2.987 -9.885 311 HB3 GLU 49 HB1 GLU 49 3.850 -4.753 -9.722 312 HG2 GLU 49 HG2 GLU 49 3.192 -4.708 -11.780 313 HG3 GLU 49 HG1 GLU 49 1.600 -5.198 -10.927 314 H ASN 50 H ASN 50 2.491 -1.879 -7.316 315 HA ASN 50 HA ASN 50 4.383 -3.046 -5.312 316 HB2 ASN 50 HB2 ASN 50 5.262 -1.467 -7.097 317 HB3 ASN 50 HB1 ASN 50 4.131 -0.274 -6.440 318 HD21 ASN 50 1HD2 ASN 50 6.375 0.723 -6.385 319 HD22 ASN 50 2HD2 ASN 50 7.282 0.649 -4.881 320 H ILE 51 H ILE 51 1.644 -1.040 -3.445 321 HA ILE 51 HA ILE 51 0.180 0.050 -4.744 322 HB ILE 51 HB ILE 51 2.429 1.037 -6.486 323 HG12 ILE 51 2HG1 ILE 51 2.007 1.762 -3.649 324 HG13 ILE 51 1HG1 ILE 51 3.422 1.152 -4.397 325 HG21 ILE 51 1HG2 ILE 51 -0.050 1.678 -6.808 326 HG22 ILE 51 2HG2 ILE 51 0.076 2.391 -5.172 327 HG23 ILE 51 3HG2 ILE 51 1.018 3.031 -6.552 328 HD11 ILE 51 HD3 ILE 51 2.308 3.908 -4.446 329 HD12 ILE 51 HD1 ILE 51 4.003 3.428 -4.345 330 HD13 ILE 51 HD2 ILE 51 3.280 3.337 -5.912 331 H VAL 52 H VAL 52 -0.072 -2.787 -7.090 332 HA VAL 52 HA VAL 52 -0.503 -1.848 -4.318 333 HB VAL 52 HB VAL 52 -2.048 -3.790 -6.028 334 HG11 VAL 52 1HG1 VAL 52 -1.960 -4.994 -4.142 335 HG12 VAL 52 2HG1 VAL 52 -2.094 -3.596 -3.028 336 HG13 VAL 52 3HG1 VAL 52 -3.467 -4.291 -3.817 337 HG21 VAL 52 3HG2 VAL 52 -2.541 -1.379 -6.200 338 HG22 VAL 52 1HG2 VAL 52 -3.836 -2.296 -5.330 339 HG23 VAL 52 2HG2 VAL 52 -2.727 -1.171 -4.474 340 H LYS 53 H LYS 53 0.590 -4.657 -6.160 341 HA LYS 53 HA LYS 53 0.184 -6.341 -4.224 342 HB2 LYS 53 HB2 LYS 53 0.712 -6.501 -6.571 343 HB3 LYS 53 HB1 LYS 53 2.437 -6.840 -6.019 344 HG2 LYS 53 HG2 LYS 53 1.652 -8.714 -4.669 345 HG3 LYS 53 HG1 LYS 53 -0.056 -8.450 -5.171 346 HD2 LYS 53 HD2 LYS 53 0.322 -8.989 -7.319 347 HD3 LYS 53 HD1 LYS 53 2.048 -9.109 -7.176 348 HE2 LYS 53 HE2 LYS 53 -0.024 -10.877 -5.764 349 HE3 LYS 53 HE1 LYS 53 0.592 -11.314 -7.112 350 HZ1 LYS 53 HZ1 LYS 53 2.124 -11.027 -4.650 351 HZ2 LYS 53 HZ2 LYS 53 1.914 -12.393 -5.413 352 HZ3 LYS 53 HZ3 LYS 53 2.949 -11.236 -6.013 353 H ARG 54 H ARG 54 3.284 -4.671 -4.281 354 HA ARG 54 HA ARG 54 4.660 -6.782 -3.034 355 HB2 ARG 54 HB2 ARG 54 5.296 -4.802 -4.589 356 HB3 ARG 54 HB1 ARG 54 5.743 -4.038 -3.029 357 HG2 ARG 54 HG2 ARG 54 7.345 -5.726 -2.544 358 HG3 ARG 54 HG1 ARG 54 6.937 -6.503 -4.156 359 HD2 ARG 54 HD2 ARG 54 8.006 -3.630 -3.854 360 HD3 ARG 54 HD1 ARG 54 8.912 -5.099 -4.309 361 HE ARG 54 HE ARG 54 7.159 -5.406 -6.157 362 HH11 ARG 54 1HH2 ARG 54 9.047 -2.441 -5.359 363 HH12 ARG 54 2HH2 ARG 54 8.750 -1.806 -6.951 364 HH21 ARG 54 1HH1 ARG 54 7.169 -4.578 -8.163 365 HH22 ARG 54 2HH1 ARG 54 8.183 -3.217 -8.555 366 H PHE 55 H PHE 55 2.801 -4.249 -1.519 367 HA PHE 55 HA PHE 55 4.100 -3.926 0.865 368 HB2 PHE 55 HB2 PHE 55 1.160 -4.534 0.641 369 HB3 PHE 55 HB1 PHE 55 1.946 -3.744 1.938 370 HD1 PHE 55 HD2 PHE 55 3.449 -2.247 -0.794 371 HD2 PHE 55 HD1 PHE 55 -0.467 -2.608 0.900 372 HE1 PHE 55 HE2 PHE 55 2.738 0.187 -1.583 373 HE2 PHE 55 HE1 PHE 55 -1.117 -0.462 -0.197 374 HZ PHE 55 HZ PHE 55 0.566 0.870 -1.383 375 H GLU 56 H GLU 56 2.178 -7.010 -0.098 376 HA GLU 56 HA GLU 56 2.318 -8.138 2.259 377 HB2 GLU 56 HB2 GLU 56 2.099 -10.179 1.260 378 HB3 GLU 56 HB1 GLU 56 1.262 -9.006 0.241 379 HG2 GLU 56 HG2 GLU 56 3.242 -8.914 -1.304 380 HG3 GLU 56 HG1 GLU 56 4.075 -10.147 -0.314 381 H SER 57 H SER 57 5.292 -7.337 0.570 382 HA SER 57 HA SER 57 6.362 -9.837 0.930 383 HB2 SER 57 HB2 SER 57 8.447 -8.660 0.084 384 HB3 SER 57 HB1 SER 57 7.076 -8.333 -0.904 385 HG SER 57 HG SER 57 6.738 -6.435 0.007 386 H GLY 58 H GLY 58 6.756 -7.318 3.344 387 HA2 GLY 58 HA2 GLY 58 8.024 -7.679 5.388 388 HA3 GLY 58 HA1 GLY 58 8.635 -9.217 4.751 389 H LYS 59 H LYS 59 9.129 -6.546 2.656 390 HA LYS 59 HA LYS 59 12.045 -7.160 3.055 391 HB2 LYS 59 HB2 LYS 59 10.159 -7.299 0.671 392 HB3 LYS 59 HB1 LYS 59 11.879 -6.985 0.443 393 HG2 LYS 59 HG2 LYS 59 12.469 -8.890 1.801 394 HG3 LYS 59 HG1 LYS 59 10.861 -9.304 2.236 395 HD2 LYS 59 HD2 LYS 59 10.323 -9.671 -0.275 396 HD3 LYS 59 HD1 LYS 59 11.897 -9.166 -0.656 397 HE2 LYS 59 HE2 LYS 59 12.789 -11.181 0.668 398 HE3 LYS 59 HE1 LYS 59 11.156 -11.456 1.166 399 HZ1 LYS 59 HZ1 LYS 59 10.486 -12.091 -0.878 400 HZ2 LYS 59 HZ2 LYS 59 11.844 -11.579 -1.666 401 HZ3 LYS 59 HZ3 LYS 59 11.827 -12.907 -0.684 402 H LEU 60 H LEU 60 10.277 -4.452 3.242 403 HA LEU 60 HA LEU 60 12.550 -2.897 2.370 404 HB2 LEU 60 HB2 LEU 60 10.457 -3.019 1.039 405 HB3 LEU 60 HB1 LEU 60 9.670 -2.121 2.271 406 HG LEU 60 HG LEU 60 10.868 -0.016 1.919 407 HD11 LEU 60 1HD1 LEU 60 12.226 -1.368 -0.486 408 HD12 LEU 60 2HD1 LEU 60 12.157 0.273 0.087 409 HD13 LEU 60 3HD1 LEU 60 13.020 -0.907 1.117 410 HD21 LEU 60 3HD2 LEU 60 9.764 -1.170 -0.639 411 HD22 LEU 60 1HD2 LEU 60 8.716 -0.701 0.683 412 HD23 LEU 60 2HD2 LEU 60 9.812 0.505 -0.048 413 H LYS 61 H LYS 61 13.238 -1.059 3.611 414 HA LYS 61 HA LYS 61 11.289 0.322 5.424 415 HB2 LYS 61 HB2 LYS 61 14.308 0.418 5.098 416 HB3 LYS 61 HB1 LYS 61 13.405 1.449 6.151 417 HG2 LYS 61 HG2 LYS 61 12.423 -0.668 7.242 418 HG3 LYS 61 HG1 LYS 61 13.620 -1.567 6.252 419 HD2 LYS 61 HD2 LYS 61 15.489 -0.497 7.181 420 HD3 LYS 61 HD1 LYS 61 14.594 0.666 8.090 421 HE2 LYS 61 HE2 LYS 61 14.449 -2.232 8.761 422 HE3 LYS 61 HE1 LYS 61 15.387 -0.995 9.546 423 HZ1 LYS 61 HZ1 LYS 61 12.804 -1.699 9.981 424 HZ2 LYS 61 HZ2 LYS 61 13.710 -0.466 10.728 425 HZ3 LYS 61 HZ3 LYS 61 12.881 -0.074 9.369 426 HA PRO 62 HA PRO 62 11.679 2.603 1.524 427 HB2 PRO 62 HB1 PRO 62 9.339 4.223 1.588 428 HB3 PRO 62 HB2 PRO 62 9.228 2.510 1.293 429 HG2 PRO 62 HG1 PRO 62 9.157 3.906 4.030 430 HG3 PRO 62 HG2 PRO 62 7.937 2.786 3.345 431 HD2 PRO 62 HD1 PRO 62 9.724 2.206 5.024 432 HD3 PRO 62 HD2 PRO 62 9.297 1.080 3.647 433 H THR 63 H THR 63 11.616 5.110 0.742 434 HA THR 63 HA THR 63 12.951 6.812 2.610 435 HB THR 63 HB THR 63 13.020 8.421 0.914 436 HG1 THR 63 HG1 THR 63 12.063 7.576 -1.143 437 HG21 THR 63 1HG2 THR 63 13.779 5.709 -0.203 438 HG22 THR 63 2HG2 THR 63 14.167 7.226 -0.907 439 HG23 THR 63 3HG2 THR 63 14.671 6.937 0.786 440 H ILE 64 H ILE 64 12.376 8.989 2.908 441 HA ILE 64 HA ILE 64 10.162 9.197 4.343 442 HB ILE 64 HB ILE 64 12.106 10.474 4.837 443 HG12 ILE 64 2HG1 ILE 64 11.062 12.514 5.576 444 HG13 ILE 64 1HG1 ILE 64 9.744 12.292 4.465 445 HG21 ILE 64 1HG2 ILE 64 12.754 11.226 2.537 446 HG22 ILE 64 2HG2 ILE 64 11.344 12.294 2.498 447 HG23 ILE 64 3HG2 ILE 64 12.656 12.531 3.664 448 HD11 ILE 64 HD3 ILE 64 10.550 10.152 6.531 449 HD12 ILE 64 HD1 ILE 64 9.759 11.683 7.019 450 HD13 ILE 64 HD2 ILE 64 8.912 10.519 6.003 451 H SER 65 H SER 65 10.765 10.665 0.927 452 HA SER 65 HA SER 65 8.246 11.798 0.503 453 HB2 SER 65 HB2 SER 65 8.528 11.090 -1.736 454 HB3 SER 65 HB1 SER 65 9.737 12.130 -0.870 455 HG SER 65 HG SER 65 11.219 10.332 -1.163 456 H GLN 66 H GLN 66 9.244 8.145 0.545 457 HA GLN 66 HA GLN 66 6.826 7.380 -0.875 458 HB2 GLN 66 HB2 GLN 66 9.203 5.928 0.374 459 HB3 GLN 66 HB1 GLN 66 7.811 5.181 -0.470 460 HG2 GLN 66 HG2 GLN 66 9.457 7.460 -1.767 461 HG3 GLN 66 HG1 GLN 66 9.806 5.683 -2.024 462 HE21 GLN 66 1HE2 GLN 66 8.949 7.566 -4.192 463 HE22 GLN 66 2HE2 GLN 66 7.492 6.935 -4.823 464 H ALA 67 H ALA 67 8.189 6.983 2.422 465 HA ALA 67 HA ALA 67 5.962 5.924 3.560 466 HB1 ALA 67 HB1 ALA 67 8.083 6.241 4.624 467 HB2 ALA 67 HB2 ALA 67 7.953 7.982 4.826 468 HB3 ALA 67 HB3 ALA 67 6.809 7.031 5.685 469 H ARG 68 H ARG 68 6.526 9.462 3.077 470 HA ARG 68 HA ARG 68 4.108 10.317 4.175 471 HB2 ARG 68 HB2 ARG 68 5.936 11.409 2.119 472 HB3 ARG 68 HB1 ARG 68 4.478 12.174 2.506 473 HG2 ARG 68 HG2 ARG 68 5.143 12.094 4.992 474 HG3 ARG 68 HG1 ARG 68 6.599 11.333 4.619 475 HD2 ARG 68 HD2 ARG 68 7.463 13.141 3.295 476 HD3 ARG 68 HD1 ARG 68 5.997 14.091 3.523 477 HE ARG 68 HE ARG 68 6.429 13.454 6.041 478 HH11 ARG 68 1HH2 ARG 68 8.927 14.949 3.952 479 HH12 ARG 68 2HH2 ARG 68 9.816 15.499 5.366 480 HH21 ARG 68 1HH1 ARG 68 7.766 14.131 7.727 481 HH22 ARG 68 2HH1 ARG 68 9.293 14.927 7.375 482 H GLN 69 H GLN 69 4.739 9.479 0.663 483 HA GLN 69 HA GLN 69 2.179 9.894 -0.299 484 HB2 GLN 69 HB2 GLN 69 4.566 8.146 -1.081 485 HB3 GLN 69 HB1 GLN 69 3.143 8.156 -2.095 486 HG2 GLN 69 HG2 GLN 69 3.279 10.255 -2.823 487 HG3 GLN 69 HG1 GLN 69 4.416 10.816 -1.599 488 HE21 GLN 69 1HE2 GLN 69 6.545 10.515 -2.034 489 HE22 GLN 69 2HE2 GLN 69 7.265 9.696 -3.404 490 H LEU 70 H LEU 70 3.558 6.978 1.252 491 HA LEU 70 HA LEU 70 1.419 5.298 0.430 492 HB2 LEU 70 HB2 LEU 70 3.730 5.285 2.312 493 HB3 LEU 70 HB1 LEU 70 2.705 3.763 2.157 494 HG LEU 70 HG LEU 70 4.286 4.951 -0.186 495 HD11 LEU 70 1HD1 LEU 70 5.837 3.135 0.136 496 HD12 LEU 70 2HD1 LEU 70 5.937 4.196 1.502 497 HD13 LEU 70 3HD1 LEU 70 4.981 2.828 1.828 498 HD21 LEU 70 3HD2 LEU 70 3.679 2.808 -1.266 499 HD22 LEU 70 1HD2 LEU 70 2.855 2.338 0.222 500 HD23 LEU 70 2HD2 LEU 70 2.272 3.719 -0.787 501 H GLU 71 H GLU 71 2.197 6.981 3.419 502 HA GLU 71 HA GLU 71 -0.365 6.427 4.610 503 HB2 GLU 71 HB2 GLU 71 1.400 8.967 4.419 504 HB3 GLU 71 HB1 GLU 71 -0.245 8.948 5.092 505 HG2 GLU 71 HG2 GLU 71 1.222 6.855 6.300 506 HG3 GLU 71 HG1 GLU 71 2.137 8.412 6.353 507 H LYS 72 H LYS 72 0.541 8.106 1.444 508 HA LYS 72 HA LYS 72 -1.734 9.615 1.836 509 HB2 LYS 72 HB2 LYS 72 0.425 10.083 0.771 510 HB3 LYS 72 HB1 LYS 72 -0.266 9.535 -0.777 511 HG2 LYS 72 HG2 LYS 72 -2.171 11.112 -0.384 512 HG3 LYS 72 HG1 LYS 72 -1.091 12.066 0.740 513 HD2 LYS 72 HD2 LYS 72 0.690 12.056 -0.961 514 HD3 LYS 72 HD1 LYS 72 -0.442 11.354 -2.142 515 HE2 LYS 72 HE2 LYS 72 -1.021 13.973 -0.673 516 HE3 LYS 72 HE1 LYS 72 0.058 13.842 -1.941 517 HZ1 LYS 72 HZ1 LYS 72 -2.816 12.863 -2.112 518 HZ2 LYS 72 HZ2 LYS 72 -2.281 14.374 -2.447 519 HZ3 LYS 72 HZ3 LYS 72 -1.729 13.203 -3.369 520 H ILE 73 H ILE 73 -1.361 6.506 0.069 521 HA ILE 73 HA ILE 73 -3.777 6.637 -1.348 522 HB ILE 73 HB ILE 73 -3.580 4.307 -1.456 523 HG12 ILE 73 2HG1 ILE 73 -0.806 4.539 -0.316 524 HG13 ILE 73 1HG1 ILE 73 -2.059 4.170 0.858 525 HG21 ILE 73 1HG2 ILE 73 -2.521 5.873 -3.079 526 HG22 ILE 73 2HG2 ILE 73 -1.002 5.712 -2.177 527 HG23 ILE 73 3HG2 ILE 73 -1.670 4.360 -3.035 528 HD11 ILE 73 HD3 ILE 73 -0.906 2.736 -1.519 529 HD12 ILE 73 HD1 ILE 73 -0.965 2.190 0.203 530 HD13 ILE 73 HD2 ILE 73 -2.423 2.111 -0.880 531 H LEU 74 H LEU 74 -3.401 5.501 2.146 532 HA LEU 74 HA LEU 74 -5.586 4.524 2.187 533 HB2 LEU 74 HB2 LEU 74 -4.482 6.110 4.567 534 HB3 LEU 74 HB1 LEU 74 -5.225 4.579 4.709 535 HG LEU 74 HG LEU 74 -2.512 5.033 3.449 536 HD11 LEU 74 1HD1 LEU 74 -1.813 3.962 5.543 537 HD12 LEU 74 2HD1 LEU 74 -2.663 5.457 6.041 538 HD13 LEU 74 3HD1 LEU 74 -3.425 3.897 6.173 539 HD21 LEU 74 3HD2 LEU 74 -3.863 2.371 4.282 540 HD22 LEU 74 1HD2 LEU 74 -3.507 2.979 2.635 541 HD23 LEU 74 2HD2 LEU 74 -2.195 2.636 3.665 542 H GLY 75 H GLY 75 -5.328 7.928 2.411 543 HA2 GLY 75 HA2 GLY 75 -6.962 9.548 2.865 544 HA3 GLY 75 HA1 GLY 75 -8.267 8.283 2.569 545 H ILE 76 H ILE 76 -6.292 7.142 4.862 546 HA ILE 76 HA ILE 76 -7.349 8.794 6.986 547 HB ILE 76 HB ILE 76 -7.131 6.788 8.499 548 HG12 ILE 76 2HG1 ILE 76 -6.760 5.334 5.847 549 HG13 ILE 76 1HG1 ILE 76 -5.602 5.444 7.235 550 HG21 ILE 76 1HG2 ILE 76 -9.166 5.772 7.884 551 HG22 ILE 76 2HG2 ILE 76 -9.215 7.532 7.672 552 HG23 ILE 76 3HG2 ILE 76 -9.106 6.609 6.270 553 HD11 ILE 76 HD3 ILE 76 -7.054 4.182 8.736 554 HD12 ILE 76 HD1 ILE 76 -8.006 3.666 7.299 555 HD13 ILE 76 HD2 ILE 76 -6.212 3.332 7.570 556 H LYS 77 H LYS 77 -5.666 7.755 9.110 557 HA LYS 77 HA LYS 77 -2.901 8.161 8.112 558 HB2 LYS 77 HB2 LYS 77 -3.969 8.739 10.836 559 HB3 LYS 77 HB1 LYS 77 -2.323 9.122 10.399 560 HG2 LYS 77 HG2 LYS 77 -4.941 10.284 9.281 561 HG3 LYS 77 HG1 LYS 77 -3.951 11.025 10.531 562 HD2 LYS 77 HD2 LYS 77 -2.983 10.438 7.681 563 HD3 LYS 77 HD1 LYS 77 -3.823 11.949 8.058 564 HE2 LYS 77 HE2 LYS 77 -2.007 12.601 9.530 565 HE3 LYS 77 HE1 LYS 77 -1.296 10.945 9.588 566 HZ1 LYS 77 HZ1 LYS 77 -0.789 11.012 7.473 567 HZ2 LYS 77 HZ2 LYS 77 -1.528 12.418 7.036 568 HZ3 LYS 77 HZ3 LYS 77 -0.178 12.376 8.043 569 H LEU 78 H LEU 78 -1.392 6.896 8.969 570 HA LEU 78 HA LEU 78 -1.866 5.072 11.198 571 HB2 LEU 78 HB2 LEU 78 -1.000 3.899 8.467 572 HB3 LEU 78 HB1 LEU 78 -0.915 3.075 9.887 573 HG LEU 78 HG LEU 78 -3.592 4.205 8.895 574 HD11 LEU 78 1HD1 LEU 78 -3.962 1.647 8.418 575 HD12 LEU 78 2HD1 LEU 78 -2.816 2.296 7.307 576 HD13 LEU 78 3HD1 LEU 78 -2.282 1.384 8.732 577 HD21 LEU 78 3HD2 LEU 78 -3.248 1.999 10.908 578 HD22 LEU 78 1HD2 LEU 78 -3.647 3.769 11.302 579 HD23 LEU 78 2HD2 LEU 78 -4.736 2.804 10.473 580 H VAL 79 H VAL 79 1.461 4.531 11.967 581 HA VAL 79 HA VAL 79 -1.006 3.131 11.867 582 HB VAL 79 HB VAL 79 0.356 1.340 13.183 583 HG11 VAL 79 1HG1 VAL 79 1.186 1.933 10.445 584 HG12 VAL 79 2HG1 VAL 79 1.039 0.355 11.008 585 HG13 VAL 79 3HG1 VAL 79 -0.457 1.183 10.713 586 HG21 VAL 79 3HG2 VAL 79 2.652 1.442 12.830 587 HG22 VAL 79 1HG2 VAL 79 2.529 3.055 12.038 588 HG23 VAL 79 2HG2 VAL 79 2.131 2.930 13.762 589 H THR 80 H THR 80 -2.170 2.140 13.756 590 HA THR 80 HA THR 80 -2.339 3.911 16.164 591 HB THR 80 HB THR 80 -4.367 2.749 16.439 592 HG1 THR 80 HG1 THR 80 -4.850 1.092 14.989 593 HG21 THR 80 1HG2 THR 80 -5.532 3.677 14.818 594 HG22 THR 80 2HG2 THR 80 -4.038 4.646 14.859 595 HG23 THR 80 3HG2 THR 80 -4.173 3.482 13.567 596 HA PRO 81 HA PRO 81 -0.533 0.786 18.814 597 HB2 PRO 81 HB1 PRO 81 -3.157 0.322 20.262 598 HB3 PRO 81 HB2 PRO 81 -1.646 0.515 20.858 599 HG2 PRO 81 HG1 PRO 81 -3.435 2.630 20.749 600 HG3 PRO 81 HG2 PRO 81 -1.607 2.839 20.428 601 HD2 PRO 81 HD1 PRO 81 -3.896 2.544 18.504 602 HD3 PRO 81 HD2 PRO 81 -2.575 3.755 18.368 603 H LEU 82 H LEU 82 -2.400 0.069 16.222 604 HA LEU 82 HA LEU 82 -2.760 -2.745 16.752 605 HB2 LEU 82 HB2 LEU 82 -4.151 -1.376 15.088 606 HB3 LEU 82 HB1 LEU 82 -2.673 -0.742 14.384 607 HG LEU 82 HG LEU 82 -2.218 -3.112 13.461 608 HD11 LEU 82 1HD1 LEU 82 -3.968 -3.995 15.266 609 HD12 LEU 82 2HD1 LEU 82 -5.139 -3.695 14.049 610 HD13 LEU 82 3HD1 LEU 82 -3.721 -4.754 13.712 611 HD21 LEU 82 3HD2 LEU 82 -3.002 -1.469 12.040 612 HD22 LEU 82 1HD2 LEU 82 -3.990 -2.915 11.751 613 HD23 LEU 82 2HD2 LEU 82 -4.732 -1.613 12.641 614 H GLU 83 H GLU 83 -0.310 -0.542 15.966 615 HA GLU 83 HA GLU 83 1.680 -2.617 15.557 616 HB2 GLU 83 HB2 GLU 83 0.792 -0.697 13.348 617 HB3 GLU 83 HB1 GLU 83 2.536 -1.045 13.603 618 HG2 GLU 83 HG2 GLU 83 0.343 -3.012 12.850 619 HG3 GLU 83 HG1 GLU 83 1.716 -2.449 11.911 620 H ASN 84 H ASN 84 0.970 0.916 16.077 621 HA ASN 84 HA ASN 84 3.364 0.754 17.793 622 HB2 ASN 84 HB2 ASN 84 4.169 1.817 15.569 623 HB3 ASN 84 HB1 ASN 84 2.919 2.956 15.727 624 HD21 ASN 84 1HD2 ASN 84 5.201 3.941 15.260 625 HD22 ASN 84 2HD2 ASN 84 5.694 4.872 16.672 626 H ASN 85 H ASN 85 3.074 1.435 19.619 627 HA ASN 85 HA ASN 85 0.496 2.398 20.562 628 HB2 ASN 85 HB2 ASN 85 1.325 1.845 22.667 629 HB3 ASN 85 HB1 ASN 85 2.140 0.742 21.579 630 HD21 ASN 85 1HD2 ASN 85 2.512 2.178 24.397 631 HD22 ASN 85 2HD2 ASN 85 4.206 2.378 24.373 632 H GLU 86 H GLU 86 3.175 4.409 19.629 633 HA GLU 86 HA GLU 86 1.914 6.766 20.836 634 HB2 GLU 86 HB2 GLU 86 4.816 6.136 21.208 635 HB3 GLU 86 HB1 GLU 86 4.151 7.759 21.442 636 HG2 GLU 86 HG2 GLU 86 2.706 6.917 23.217 637 HG3 GLU 86 HG1 GLU 86 3.343 5.212 22.928 638 H GLU 87 H GLU 87 2.718 8.657 19.719 639 HA GLU 87 HA GLU 87 3.505 8.450 16.875 640 HB2 GLU 87 HB2 GLU 87 2.410 10.513 18.742 641 HB3 GLU 87 HB1 GLU 87 3.099 10.956 17.151 642 HG2 GLU 87 HG2 GLU 87 1.747 9.146 16.014 643 HG3 GLU 87 HG1 GLU 87 0.889 8.831 17.451 644 H SER 88 H SER 88 5.330 7.371 18.482 645 HA SER 88 HA SER 88 7.175 9.132 19.493 646 HB2 SER 88 HB2 SER 88 8.476 7.098 20.190 647 HB3 SER 88 HB1 SER 88 6.771 7.027 20.613 648 HG SER 88 HG SER 88 6.834 5.293 19.652 649 H GLU 89 H GLU 89 6.979 7.729 16.333 650 HA GLU 89 HA GLU 89 9.861 8.004 15.961 651 HB2 GLU 89 HB2 GLU 89 7.848 6.797 14.097 652 HB3 GLU 89 HB1 GLU 89 9.637 6.652 14.004 653 HG2 GLU 89 HG2 GLU 89 9.912 5.485 16.018 654 HG3 GLU 89 HG1 GLU 89 8.269 5.399 16.371 655 H LYS 90 H LYS 90 7.167 9.861 15.653 656 HA LYS 90 HA LYS 90 7.985 11.379 13.327 657 HB2 LYS 90 HB2 LYS 90 5.979 12.308 15.346 658 HB3 LYS 90 HB1 LYS 90 6.375 12.904 13.728 659 HG2 LYS 90 HG2 LYS 90 5.514 10.906 12.604 660 HG3 LYS 90 HG1 LYS 90 5.213 10.164 14.182 661 HD2 LYS 90 HD2 LYS 90 3.593 12.050 14.775 662 HD3 LYS 90 HD1 LYS 90 4.136 12.850 13.296 663 HE2 LYS 90 HE2 LYS 90 3.058 11.286 11.942 664 HE3 LYS 90 HE1 LYS 90 2.793 10.127 13.213 665 HZ1 LYS 90 HZ1 LYS 90 1.452 12.755 13.129 666 HZ2 LYS 90 HZ2 LYS 90 0.773 11.315 12.769 667 HZ3 LYS 90 HZ3 LYS 90 1.264 11.682 14.283 668 H GLU 91 H GLU 91 8.343 13.789 13.459 669 HA GLU 91 HA GLU 91 9.806 14.725 15.628 670 HB2 GLU 91 HB2 GLU 91 11.953 14.765 14.746 671 HB3 GLU 91 HB1 GLU 91 11.446 13.098 14.801 672 HG2 GLU 91 HG2 GLU 91 10.761 13.286 12.351 673 HG3 GLU 91 HG1 GLU 91 11.511 14.898 12.350 674 H PHE 92 H PHE 92 11.266 16.824 14.432 675 HA PHE 92 HA PHE 92 9.318 18.265 12.600 676 HB2 PHE 92 HB2 PHE 92 9.277 18.968 14.954 677 HB3 PHE 92 HB1 PHE 92 11.032 18.937 14.937 678 HD1 PHE 92 HD1 PHE 92 8.134 20.357 13.289 679 HD2 PHE 92 HD2 PHE 92 12.199 20.876 14.030 680 HE1 PHE 92 HE1 PHE 92 7.970 22.655 12.271 681 HE2 PHE 92 HE2 PHE 92 12.145 23.142 12.702 682 HZ PHE 92 HZ PHE 92 10.113 23.985 11.920 683 H ASP 93 H ASP 93 10.361 19.764 11.236 684 HA ASP 93 HA ASP 93 13.143 19.518 10.636 685 HB2 ASP 93 HB2 ASP 93 12.369 17.495 9.844 686 HB3 ASP 93 HB1 ASP 93 11.080 18.132 8.997 687 H ASP 94 H ASP 94 13.702 21.269 8.978 688 HA ASP 94 HA ASP 94 11.788 23.420 9.081 689 HB2 ASP 94 HB2 ASP 94 13.607 24.720 8.197 690 HB3 ASP 94 HB1 ASP 94 14.323 23.636 9.326 691 H THR 95 H THR 95 12.217 20.949 6.830 692 HA THR 95 HA THR 95 10.656 22.569 4.854 693 HB THR 95 HB THR 95 11.615 19.760 4.335 694 HG1 THR 95 HG1 THR 95 13.447 20.993 4.872 695 HG21 THR 95 1HG2 THR 95 10.187 20.481 2.776 696 HG22 THR 95 2HG2 THR 95 10.761 22.030 2.552 697 HG23 THR 95 3HG2 THR 95 11.724 20.595 1.949 698 H GLY 96 H GLY 96 10.386 19.926 7.039 699 HA2 GLY 96 HA2 GLY 96 7.743 19.136 6.014 700 HA3 GLY 96 HA1 GLY 96 8.606 18.571 7.472 701 H LEU 97 H LEU 97 9.001 21.430 8.366 702 HA LEU 97 HA LEU 97 7.017 22.548 9.692 703 HB2 LEU 97 HB2 LEU 97 9.220 23.497 9.425 704 HB3 LEU 97 HB1 LEU 97 8.911 23.687 7.675 705 HG LEU 97 HG LEU 97 7.176 25.542 8.410 706 HD11 LEU 97 1HD1 LEU 97 8.265 25.213 11.139 707 HD12 LEU 97 2HD1 LEU 97 6.979 26.186 10.514 708 HD13 LEU 97 3HD1 LEU 97 6.627 24.504 10.634 709 HD21 LEU 97 3HD2 LEU 97 10.141 25.850 9.317 710 HD22 LEU 97 1HD2 LEU 97 9.433 26.211 7.715 711 HD23 LEU 97 2HD2 LEU 97 8.972 27.115 9.032 712 H THR 98 H THR 98 7.217 22.945 6.056 713 HA THR 98 HA THR 98 4.627 24.464 6.184 714 HB THR 98 HB THR 98 5.461 24.777 3.732 715 HG1 THR 98 HG1 THR 98 7.334 23.735 3.542 716 HG21 THR 98 1HG2 THR 98 6.902 26.119 6.072 717 HG22 THR 98 2HG2 THR 98 6.894 26.694 4.497 718 HG23 THR 98 3HG2 THR 98 5.400 26.677 5.429 719 H LEU 99 H LEU 99 5.683 21.228 5.830 720 HA LEU 99 HA LEU 99 3.190 20.515 4.250 721 HB2 LEU 99 HB2 LEU 99 5.470 19.695 3.782 722 HB3 LEU 99 HB1 LEU 99 5.447 18.802 5.289 723 HG LEU 99 HG LEU 99 3.710 17.278 4.433 724 HD11 LEU 99 1HD1 LEU 99 2.144 18.680 3.189 725 HD12 LEU 99 2HD1 LEU 99 3.383 18.965 1.978 726 HD13 LEU 99 3HD1 LEU 99 2.735 17.349 2.350 727 HD21 LEU 99 3HD2 LEU 99 5.836 17.864 2.196 728 HD22 LEU 99 1HD2 LEU 99 6.012 16.794 3.550 729 HD23 LEU 99 2HD2 LEU 99 4.780 16.464 2.350 730 H GLY 100 H GLY 100 4.041 20.568 7.508 731 HA2 GLY 100 HA2 GLY 100 2.652 20.103 9.338 732 HA3 GLY 100 HA1 GLY 100 1.397 19.604 8.268 733 H ASP 101 H ASP 101 4.311 18.142 7.447 734 HA ASP 101 HA ASP 101 3.639 15.750 9.016 735 HB2 ASP 101 HB2 ASP 101 4.290 15.989 6.292 736 HB3 ASP 101 HB1 ASP 101 5.890 15.897 6.862 737 H VAL 102 H VAL 102 4.033 16.883 10.601 738 HA VAL 102 HA VAL 102 6.740 16.786 11.804 739 HB VAL 102 HB VAL 102 4.535 18.792 11.664 740 HG11 VAL 102 1HG1 VAL 102 4.691 19.017 13.958 741 HG12 VAL 102 2HG1 VAL 102 6.433 18.903 13.961 742 HG13 VAL 102 3HG1 VAL 102 5.689 20.255 13.098 743 HG21 VAL 102 3HG2 VAL 102 6.397 20.079 10.876 744 HG22 VAL 102 1HG2 VAL 102 7.526 18.927 11.480 745 HG23 VAL 102 2HG2 VAL 102 6.499 18.538 10.068 746 H VAL 103 H VAL 103 6.983 16.307 14.004 747 HA VAL 103 HA VAL 103 5.044 15.032 15.530 748 HB VAL 103 HB VAL 103 7.427 14.964 16.045 749 HG11 VAL 103 1HG1 VAL 103 8.660 16.504 17.254 750 HG12 VAL 103 2HG1 VAL 103 8.268 17.080 15.579 751 HG13 VAL 103 3HG1 VAL 103 7.596 17.769 17.113 752 HG21 VAL 103 3HG2 VAL 103 6.449 16.087 18.645 753 HG22 VAL 103 1HG2 VAL 103 5.463 14.810 17.865 754 HG23 VAL 103 2HG2 VAL 103 7.210 14.575 18.290 755 H ASN 104 H ASN 104 3.119 15.778 15.681 756 HA ASN 104 HA ASN 104 2.601 18.548 16.427 757 HB2 ASN 104 HB2 ASN 104 1.369 17.178 14.682 758 HB3 ASN 104 HB1 ASN 104 0.631 16.363 16.114 759 HD21 ASN 104 1HD2 ASN 104 -1.031 17.046 17.000 760 HD22 ASN 104 2HD2 ASN 104 -1.703 18.695 16.985 761 H ILE 105 H ILE 105 2.784 15.580 18.017 762 HA ILE 105 HA ILE 105 1.182 16.127 20.311 763 HB ILE 105 HB ILE 105 2.346 14.186 21.424 764 HG12 ILE 105 2HG1 ILE 105 3.903 13.844 18.830 765 HG13 ILE 105 1HG1 ILE 105 4.604 14.541 20.208 766 HG21 ILE 105 1HG2 ILE 105 1.107 13.751 18.694 767 HG22 ILE 105 2HG2 ILE 105 1.225 12.614 20.008 768 HG23 ILE 105 3HG2 ILE 105 0.304 14.123 20.223 769 HD11 ILE 105 HD3 ILE 105 4.487 12.593 21.590 770 HD12 ILE 105 HD1 ILE 105 3.470 11.754 20.413 771 HD13 ILE 105 HD2 ILE 105 5.172 12.167 20.136 772 H LYS 106 H LYS 106 4.655 16.610 19.970 773 HA LYS 106 HA LYS 106 4.583 17.573 22.805 774 HB2 LYS 106 HB2 LYS 106 6.975 17.562 20.809 775 HB3 LYS 106 HB1 LYS 106 7.090 18.015 22.503 776 HG2 LYS 106 HG2 LYS 106 6.146 15.416 21.578 777 HG3 LYS 106 HG1 LYS 106 7.910 15.825 21.867 778 HD2 LYS 106 HD2 LYS 106 7.443 16.154 24.258 779 HD3 LYS 106 HD1 LYS 106 5.740 15.848 24.037 780 HE2 LYS 106 HE2 LYS 106 6.289 13.619 23.433 781 HE3 LYS 106 HE1 LYS 106 8.108 13.919 23.734 782 HZ1 LYS 106 HZ1 LYS 106 6.026 13.807 25.721 783 HZ2 LYS 106 HZ2 LYS 106 7.515 13.106 25.644 784 HZ3 LYS 106 HZ3 LYS 106 7.468 14.729 25.835 785 H GLU 107 H GLU 107 4.692 19.683 23.444 786 HA GLU 107 HA GLU 107 3.934 21.753 21.444 787 HB2 GLU 107 HB2 GLU 107 4.347 21.729 24.418 788 HB3 GLU 107 HB1 GLU 107 3.884 23.168 23.576 789 HG2 GLU 107 HG2 GLU 107 1.716 22.031 22.824 790 HG3 GLU 107 HG1 GLU 107 2.343 20.627 23.740 791 H GLY 108 H GLY 108 4.934 23.776 21.394 792 HA2 GLY 108 HA2 GLY 108 6.618 24.898 20.482 793 HA3 GLY 108 HA1 GLY 108 7.642 24.184 21.732 794 H LYS 109 H LYS 109 7.585 21.439 20.984 795 HA LYS 109 HA LYS 109 9.766 21.461 19.281 796 HB2 LYS 109 HB2 LYS 109 8.961 19.826 21.110 797 HB3 LYS 109 HB1 LYS 109 7.866 19.161 19.880 798 HG2 LYS 109 HG2 LYS 109 9.983 18.550 18.502 799 HG3 LYS 109 HG1 LYS 109 10.869 19.411 19.806 800 HD2 LYS 109 HD2 LYS 109 10.062 17.820 21.543 801 HD3 LYS 109 HD1 LYS 109 9.305 16.923 20.174 802 HE2 LYS 109 HE2 LYS 109 11.302 15.903 20.844 803 HE3 LYS 109 HE1 LYS 109 11.324 16.374 19.233 804 HZ1 LYS 109 HZ1 LYS 109 13.489 16.600 20.148 805 HZ2 LYS 109 HZ2 LYS 109 12.953 18.073 19.745 806 HZ3 LYS 109 HZ3 LYS 109 12.966 17.636 21.248 807 H LYS 110 H LYS 110 6.450 21.029 18.398 808 HA LYS 110 HA LYS 110 6.695 20.479 15.674 809 HB2 LYS 110 HB2 LYS 110 4.545 21.269 15.415 810 HB3 LYS 110 HB1 LYS 110 4.692 20.464 16.976 811 HG2 LYS 110 HG2 LYS 110 4.703 22.508 18.195 812 HG3 LYS 110 HG1 LYS 110 4.771 23.460 16.567 813 HD2 LYS 110 HD2 LYS 110 2.533 23.663 17.398 814 HD3 LYS 110 HD1 LYS 110 2.384 22.377 16.210 815 HE2 LYS 110 HE2 LYS 110 1.979 20.734 17.695 816 HE3 LYS 110 HE1 LYS 110 3.326 21.200 18.644 817 HZ1 LYS 110 HZ1 LYS 110 1.612 23.033 19.350 818 HZ2 LYS 110 HZ2 LYS 110 0.561 22.133 18.693 819 HZ3 LYS 110 HZ3 LYS 110 1.439 21.465 19.959 820 H LEU 111 H LEU 111 8.276 22.836 16.935 821 HA LEU 111 HA LEU 111 8.776 24.172 14.343 822 HB2 LEU 111 HB2 LEU 111 8.317 26.310 14.877 823 HB3 LEU 111 HB1 LEU 111 6.875 25.271 15.051 824 HG LEU 111 HG LEU 111 8.414 26.092 17.464 825 HD11 LEU 111 1HD1 LEU 111 7.444 28.078 17.777 826 HD12 LEU 111 2HD1 LEU 111 7.915 28.168 16.027 827 HD13 LEU 111 3HD1 LEU 111 6.274 27.750 16.400 828 HD21 LEU 111 3HD2 LEU 111 5.474 25.512 16.910 829 HD22 LEU 111 1HD2 LEU 111 6.453 24.551 18.050 830 HD23 LEU 111 2HD2 LEU 111 5.967 26.225 18.364 831 H GLU 112 H GLU 112 10.337 22.429 16.087 832 HA GLU 112 HA GLU 112 11.865 23.486 17.930 833 HB2 GLU 112 HB2 GLU 112 11.665 21.002 17.224 834 HB3 GLU 112 HB1 GLU 112 13.033 21.371 16.121 835 HG2 GLU 112 HG2 GLU 112 14.362 21.899 18.080 836 HG3 GLU 112 HG1 GLU 112 12.829 22.007 19.129 837 H HIS 113 H HIS 113 13.427 23.119 15.012 838 HA HIS 113 HA HIS 113 15.388 25.089 15.945 839 HB2 HIS 113 HB2 HIS 113 16.988 23.808 14.311 840 HB3 HIS 113 HB1 HIS 113 16.240 22.920 15.688 841 HD2 HIS 113 HD2 HIS 113 15.535 23.457 11.911 842 HE1 HIS 113 HE1 HIS 113 14.758 19.398 13.036 843 HE2 HIS 113 HE2 HIS 113 15.339 20.911 11.001 844 H HIS 114 H HIS 114 13.100 25.558 14.395 845 HA HIS 114 HA HIS 114 13.752 26.908 11.860 846 HB2 HIS 114 HB2 HIS 114 11.591 25.708 11.889 847 HB3 HIS 114 HB1 HIS 114 11.308 26.369 13.589 848 HD2 HIS 114 HD2 HIS 114 12.220 28.299 10.395 849 HE1 HIS 114 HE1 HIS 114 8.337 29.652 11.544 850 HE2 HIS 114 HE2 HIS 114 10.132 29.950 9.933 Start of MODEL 3 1 H1 GLU 13 H1 GLU 13 2.843 -15.770 1.603 2 H2 GLU 13 H2 GLU 13 2.471 -17.339 2.068 3 H3 GLU 13 H3 GLU 13 1.354 -16.167 1.904 4 HA GLU 13 HA GLU 13 2.505 -15.010 3.839 5 HB2 GLU 13 HB2 GLU 13 0.431 -16.431 3.860 6 HB3 GLU 13 HB1 GLU 13 1.419 -17.829 4.385 7 HG2 GLU 13 HG2 GLU 13 2.233 -16.140 6.219 8 HG3 GLU 13 HG1 GLU 13 1.072 -15.021 5.688 9 H ASN 14 H ASN 14 4.890 -15.753 2.546 10 HA ASN 14 HA ASN 14 6.397 -15.982 5.091 11 HB2 ASN 14 HB2 ASN 14 6.172 -18.260 3.989 12 HB3 ASN 14 HB1 ASN 14 6.882 -17.681 2.621 13 HD21 ASN 14 1HD2 ASN 14 8.251 -19.678 3.648 14 HD22 ASN 14 2HD2 ASN 14 9.599 -19.281 4.630 15 H ALA 15 H ALA 15 6.147 -13.599 4.415 16 HA ALA 15 HA ALA 15 8.237 -12.652 2.433 17 HB1 ALA 15 HB1 ALA 15 5.343 -12.078 2.924 18 HB2 ALA 15 HB2 ALA 15 6.398 -10.870 2.535 19 HB3 ALA 15 HB3 ALA 15 6.124 -12.180 1.359 20 H GLU 16 H GLU 16 7.973 -12.943 5.729 21 HA GLU 16 HA GLU 16 9.374 -10.390 6.172 22 HB2 GLU 16 HB2 GLU 16 8.330 -12.327 8.217 23 HB3 GLU 16 HB1 GLU 16 8.978 -10.852 8.613 24 HG2 GLU 16 HG2 GLU 16 7.166 -9.617 7.299 25 HG3 GLU 16 HG1 GLU 16 6.432 -11.255 6.943 26 H LEU 17 H LEU 17 10.368 -12.899 4.860 27 HA LEU 17 HA LEU 17 12.442 -13.893 6.734 28 HB2 LEU 17 HB2 LEU 17 10.801 -15.341 5.500 29 HB3 LEU 17 HB1 LEU 17 11.300 -14.742 4.018 30 HG LEU 17 HG LEU 17 13.645 -15.605 4.436 31 HD11 LEU 17 1HD1 LEU 17 13.665 -15.876 7.026 32 HD12 LEU 17 2HD1 LEU 17 12.339 -16.955 6.726 33 HD13 LEU 17 3HD1 LEU 17 14.004 -17.367 6.050 34 HD21 LEU 17 3HD2 LEU 17 11.335 -17.502 4.474 35 HD22 LEU 17 1HD2 LEU 17 12.376 -16.980 3.112 36 HD23 LEU 17 2HD2 LEU 17 12.979 -18.111 4.295 37 H GLU 18 H GLU 18 12.273 -11.563 4.074 38 HA GLU 18 HA GLU 18 15.164 -11.920 3.688 39 HB2 GLU 18 HB2 GLU 18 13.445 -13.059 2.166 40 HB3 GLU 18 HB1 GLU 18 12.914 -11.460 1.578 41 HG2 GLU 18 HG2 GLU 18 15.104 -11.109 0.605 42 HG3 GLU 18 HG1 GLU 18 15.628 -12.628 1.434 43 H ILE 19 H ILE 19 13.935 -9.981 5.380 44 HA ILE 19 HA ILE 19 13.331 -7.593 3.715 45 HB ILE 19 HB ILE 19 12.130 -7.154 5.619 46 HG12 ILE 19 2HG1 ILE 19 12.169 -9.996 6.460 47 HG13 ILE 19 1HG1 ILE 19 13.277 -8.782 7.171 48 HG21 ILE 19 1HG2 ILE 19 10.143 -8.568 5.000 49 HG22 ILE 19 2HG2 ILE 19 11.078 -8.188 3.503 50 HG23 ILE 19 3HG2 ILE 19 11.332 -9.737 4.285 51 HD11 ILE 19 HD3 ILE 19 10.302 -8.234 7.215 52 HD12 ILE 19 HD1 ILE 19 11.182 -9.098 8.465 53 HD13 ILE 19 HD2 ILE 19 11.662 -7.431 8.086 54 H VAL 20 H VAL 20 13.713 -5.387 4.760 55 HA VAL 20 HA VAL 20 16.181 -5.186 6.089 56 HB VAL 20 HB VAL 20 15.461 -2.755 6.335 57 HG11 VAL 20 1HG1 VAL 20 15.765 -2.212 4.228 58 HG12 VAL 20 2HG1 VAL 20 16.516 -3.838 4.239 59 HG13 VAL 20 3HG1 VAL 20 14.892 -3.585 3.530 60 HG21 VAL 20 3HG2 VAL 20 12.880 -3.770 5.154 61 HG22 VAL 20 1HG2 VAL 20 13.163 -2.998 6.770 62 HG23 VAL 20 2HG2 VAL 20 13.436 -2.182 5.249 63 H THR 21 H THR 21 15.956 -3.527 8.010 64 HA THR 21 HA THR 21 15.444 -4.884 10.428 65 HB THR 21 HB THR 21 16.304 -2.697 11.313 66 HG1 THR 21 HG1 THR 21 16.703 -1.060 9.743 67 HG21 THR 21 1HG2 THR 21 18.452 -2.555 10.015 68 HG22 THR 21 2HG2 THR 21 17.910 -4.295 10.108 69 HG23 THR 21 3HG2 THR 21 17.746 -3.516 8.687 70 H ASP 22 H ASP 22 13.067 -2.790 8.844 71 HA ASP 22 HA ASP 22 11.286 -3.037 11.021 72 HB2 ASP 22 HB2 ASP 22 13.072 -1.675 12.047 73 HB3 ASP 22 HB1 ASP 22 12.955 -0.497 10.731 74 H TYR 23 H TYR 23 10.836 -3.695 8.625 75 HA TYR 23 HA TYR 23 10.089 -1.812 6.784 76 HB2 TYR 23 HB2 TYR 23 10.235 -4.177 6.459 77 HB3 TYR 23 HB1 TYR 23 8.681 -4.444 7.225 78 HD1 TYR 23 HD1 TYR 23 10.287 -2.485 4.446 79 HD2 TYR 23 HD2 TYR 23 6.611 -4.114 5.906 80 HE1 TYR 23 HE1 TYR 23 9.129 -1.834 2.404 81 HE2 TYR 23 HE2 TYR 23 5.480 -3.713 3.917 82 HH TYR 23 HH TYR 23 5.790 -2.743 1.546 83 H TYR 24 H TYR 24 8.794 -0.232 6.962 84 HA TYR 24 HA TYR 24 7.287 0.576 9.159 85 HB2 TYR 24 HB2 TYR 24 7.161 1.415 6.232 86 HB3 TYR 24 HB1 TYR 24 6.471 2.408 7.629 87 HD1 TYR 24 HD1 TYR 24 8.906 1.888 9.552 88 HD2 TYR 24 HD2 TYR 24 8.481 3.037 5.443 89 HE1 TYR 24 HE1 TYR 24 11.039 3.098 9.623 90 HE2 TYR 24 HE2 TYR 24 10.716 4.274 5.519 91 HH TYR 24 HH TYR 24 12.384 4.499 8.676 92 H LYS 25 H LYS 25 5.125 1.001 9.717 93 HA LYS 25 HA LYS 25 3.315 -1.039 8.584 94 HB2 LYS 25 HB2 LYS 25 4.747 -1.210 10.870 95 HB3 LYS 25 HB1 LYS 25 3.425 -0.110 11.413 96 HG2 LYS 25 HG2 LYS 25 1.729 -1.714 10.743 97 HG3 LYS 25 HG1 LYS 25 2.956 -2.803 10.319 98 HD2 LYS 25 HD2 LYS 25 3.676 -2.432 12.852 99 HD3 LYS 25 HD1 LYS 25 2.178 -1.742 13.027 100 HE2 LYS 25 HE2 LYS 25 0.951 -3.817 12.335 101 HE3 LYS 25 HE1 LYS 25 2.371 -4.534 11.803 102 HZ1 LYS 25 HZ1 LYS 25 2.133 -3.886 14.671 103 HZ2 LYS 25 HZ2 LYS 25 1.362 -5.119 14.090 104 HZ3 LYS 25 HZ3 LYS 25 3.017 -5.064 14.042 105 H ILE 26 H ILE 26 3.352 2.260 8.624 106 HA ILE 26 HA ILE 26 0.928 3.116 9.644 107 HB ILE 26 HB ILE 26 0.992 4.513 7.526 108 HG12 ILE 26 2HG1 ILE 26 3.918 3.666 7.267 109 HG13 ILE 26 1HG1 ILE 26 2.672 3.096 6.220 110 HG21 ILE 26 1HG2 ILE 26 1.770 5.025 9.878 111 HG22 ILE 26 2HG2 ILE 26 3.429 4.606 9.459 112 HG23 ILE 26 3HG2 ILE 26 2.787 6.008 8.755 113 HD11 ILE 26 HD3 ILE 26 3.493 5.982 6.764 114 HD12 ILE 26 HD1 ILE 26 3.775 5.002 5.195 115 HD13 ILE 26 HD2 ILE 26 2.227 5.574 5.618 116 H ILE 27 H ILE 27 1.190 1.522 6.472 117 HA ILE 27 HA ILE 27 -1.587 2.131 6.314 118 HB ILE 27 HB ILE 27 -1.770 1.250 4.064 119 HG12 ILE 27 2HG1 ILE 27 1.103 0.407 4.495 120 HG13 ILE 27 1HG1 ILE 27 -0.128 -0.724 4.708 121 HG21 ILE 27 1HG2 ILE 27 -0.464 2.768 2.946 122 HG22 ILE 27 2HG2 ILE 27 -0.943 3.486 4.494 123 HG23 ILE 27 3HG2 ILE 27 0.693 2.855 4.399 124 HD11 ILE 27 HD3 ILE 27 0.604 0.704 2.118 125 HD12 ILE 27 HD1 ILE 27 0.592 -0.996 2.451 126 HD13 ILE 27 HD2 ILE 27 -0.944 -0.307 2.291 127 H LYS 28 H LYS 28 0.130 -0.574 7.655 128 HA LYS 28 HA LYS 28 -1.395 -2.412 6.695 129 HB2 LYS 28 HB2 LYS 28 0.947 -2.314 7.876 130 HB3 LYS 28 HB1 LYS 28 0.071 -2.519 9.349 131 HG2 LYS 28 HG2 LYS 28 -1.150 -4.578 8.028 132 HG3 LYS 28 HG1 LYS 28 0.254 -4.394 7.049 133 HD2 LYS 28 HD2 LYS 28 1.728 -4.753 8.828 134 HD3 LYS 28 HD1 LYS 28 0.400 -4.753 10.073 135 HE2 LYS 28 HE2 LYS 28 0.687 -6.965 7.920 136 HE3 LYS 28 HE1 LYS 28 1.549 -6.963 9.409 137 HZ1 LYS 28 HZ1 LYS 28 -0.630 -7.976 9.410 138 HZ2 LYS 28 HZ2 LYS 28 -0.566 -6.799 10.641 139 HZ3 LYS 28 HZ3 LYS 28 -1.368 -6.593 9.261 140 H THR 29 H THR 29 -2.200 -1.390 10.097 141 HA THR 29 HA THR 29 -4.379 -3.126 10.368 142 HB THR 29 HB THR 29 -3.691 -0.372 11.661 143 HG1 THR 29 HG1 THR 29 -3.341 -3.180 11.793 144 HG21 THR 29 1HG2 THR 29 -6.141 -0.942 12.100 145 HG22 THR 29 2HG2 THR 29 -5.604 -2.550 12.574 146 HG23 THR 29 3HG2 THR 29 -5.040 -1.070 13.481 147 H ALA 30 H ALA 30 -4.181 0.154 8.723 148 HA ALA 30 HA ALA 30 -6.864 0.345 8.362 149 HB1 ALA 30 HB1 ALA 30 -4.410 1.423 6.971 150 HB2 ALA 30 HB2 ALA 30 -6.055 1.959 6.632 151 HB3 ALA 30 HB3 ALA 30 -5.382 2.163 8.294 152 H ARG 31 H ARG 31 -4.405 -0.932 5.898 153 HA ARG 31 HA ARG 31 -6.176 -1.691 3.954 154 HB2 ARG 31 HB2 ARG 31 -3.543 -1.734 4.282 155 HB3 ARG 31 HB1 ARG 31 -3.827 -3.277 4.933 156 HG2 ARG 31 HG2 ARG 31 -4.918 -3.992 2.669 157 HG3 ARG 31 HG1 ARG 31 -4.648 -2.258 2.215 158 HD2 ARG 31 HD2 ARG 31 -2.792 -3.601 1.232 159 HD3 ARG 31 HD1 ARG 31 -2.234 -2.559 2.424 160 HE ARG 31 HE ARG 31 -2.668 -5.191 3.557 161 HH11 ARG 31 1HH2 ARG 31 -0.416 -3.118 1.749 162 HH12 ARG 31 2HH2 ARG 31 0.936 -3.477 2.759 163 HH21 ARG 31 1HH1 ARG 31 -0.750 -5.833 4.762 164 HH22 ARG 31 2HH1 ARG 31 0.732 -5.061 4.184 165 H GLU 32 H GLU 32 -5.564 -3.454 7.109 166 HA GLU 32 HA GLU 32 -7.083 -5.645 6.337 167 HB2 GLU 32 HB2 GLU 32 -5.755 -4.614 8.875 168 HB3 GLU 32 HB1 GLU 32 -6.906 -6.026 8.812 169 HG2 GLU 32 HG2 GLU 32 -5.524 -7.158 7.278 170 HG3 GLU 32 HG1 GLU 32 -4.621 -5.818 6.830 171 H GLN 33 H GLN 33 -7.921 -2.583 8.110 172 HA GLN 33 HA GLN 33 -10.470 -3.504 9.046 173 HB2 GLN 33 HB2 GLN 33 -9.016 -0.874 8.528 174 HB3 GLN 33 HB1 GLN 33 -10.707 -0.836 8.961 175 HG2 GLN 33 HG2 GLN 33 -10.319 -2.146 11.039 176 HG3 GLN 33 HG1 GLN 33 -8.689 -2.291 10.629 177 HE21 GLN 33 1HE2 GLN 33 -8.776 -1.152 13.129 178 HE22 GLN 33 2HE2 GLN 33 -8.746 0.593 13.019 179 H LEU 34 H LEU 34 -9.525 -1.893 6.016 180 HA LEU 34 HA LEU 34 -12.007 -1.703 4.756 181 HB2 LEU 34 HB2 LEU 34 -9.202 -2.125 3.823 182 HB3 LEU 34 HB1 LEU 34 -10.644 -1.820 2.773 183 HG LEU 34 HG LEU 34 -9.633 0.099 4.913 184 HD11 LEU 34 1HD1 LEU 34 -8.877 0.389 1.977 185 HD12 LEU 34 2HD1 LEU 34 -8.289 1.232 3.454 186 HD13 LEU 34 3HD1 LEU 34 -7.893 -0.490 3.161 187 HD21 LEU 34 3HD2 LEU 34 -11.378 0.539 2.406 188 HD22 LEU 34 1HD2 LEU 34 -11.966 0.441 4.040 189 HD23 LEU 34 2HD2 LEU 34 -10.702 1.673 3.612 190 H GLY 35 H GLY 35 -9.942 -4.339 5.437 191 HA2 GLY 35 HA2 GLY 35 -9.660 -6.570 4.780 192 HA3 GLY 35 HA1 GLY 35 -11.421 -6.452 4.628 193 H ILE 36 H ILE 36 -10.157 -4.330 2.450 194 HA ILE 36 HA ILE 36 -11.027 -5.840 0.433 195 HB ILE 36 HB ILE 36 -10.328 -4.086 -1.103 196 HG12 ILE 36 2HG1 ILE 36 -9.154 -2.696 1.260 197 HG13 ILE 36 1HG1 ILE 36 -8.128 -3.379 0.010 198 HG21 ILE 36 1HG2 ILE 36 -12.479 -3.975 -0.082 199 HG22 ILE 36 2HG2 ILE 36 -11.837 -3.198 1.400 200 HG23 ILE 36 3HG2 ILE 36 -11.684 -2.341 -0.086 201 HD11 ILE 36 HD3 ILE 36 -9.999 -1.007 0.141 202 HD12 ILE 36 HD1 ILE 36 -8.316 -1.061 -0.330 203 HD13 ILE 36 HD2 ILE 36 -9.540 -1.625 -1.475 204 H SER 37 H SER 37 -10.155 -6.308 -1.662 205 HA SER 37 HA SER 37 -7.909 -8.063 -1.206 206 HB2 SER 37 HB2 SER 37 -8.365 -8.748 -3.570 207 HB3 SER 37 HB1 SER 37 -9.765 -8.928 -2.600 208 HG SER 37 HG SER 37 -10.645 -7.662 -4.108 209 H GLN 38 H GLN 38 -6.221 -8.277 -3.107 210 HA GLN 38 HA GLN 38 -4.678 -5.790 -3.354 211 HB2 GLN 38 HB2 GLN 38 -4.593 -8.355 -4.952 212 HB3 GLN 38 HB1 GLN 38 -3.455 -7.127 -5.148 213 HG2 GLN 38 HG2 GLN 38 -2.363 -7.295 -3.115 214 HG3 GLN 38 HG1 GLN 38 -3.758 -8.160 -2.367 215 HE21 GLN 38 1HE2 GLN 38 -1.628 -9.430 -1.707 216 HE22 GLN 38 2HE2 GLN 38 -1.186 -10.801 -2.751 217 H GLN 39 H GLN 39 -7.278 -7.381 -5.439 218 HA GLN 39 HA GLN 39 -6.785 -5.390 -7.470 219 HB2 GLN 39 HB2 GLN 39 -9.016 -7.316 -6.676 220 HB3 GLN 39 HB1 GLN 39 -9.067 -6.427 -8.165 221 HG2 GLN 39 HG2 GLN 39 -8.142 -8.297 -9.176 222 HG3 GLN 39 HG1 GLN 39 -6.744 -7.676 -8.649 223 HE21 GLN 39 1HE2 GLN 39 -5.666 -8.858 -6.814 224 HE22 GLN 39 2HE2 GLN 39 -6.339 -10.297 -6.048 225 H GLN 40 H GLN 40 -9.151 -5.412 -4.649 226 HA GLN 40 HA GLN 40 -10.630 -3.062 -5.655 227 HB2 GLN 40 HB2 GLN 40 -10.059 -4.400 -3.055 228 HB3 GLN 40 HB1 GLN 40 -11.079 -2.959 -3.071 229 HG2 GLN 40 HG2 GLN 40 -12.685 -3.878 -4.500 230 HG3 GLN 40 HG1 GLN 40 -11.806 -5.375 -4.879 231 HE21 GLN 40 1HE2 GLN 40 -14.266 -4.776 -3.692 232 HE22 GLN 40 2HE2 GLN 40 -14.420 -5.750 -2.220 233 H LEU 41 H LEU 41 -7.818 -3.520 -3.712 234 HA LEU 41 HA LEU 41 -7.327 -0.779 -3.196 235 HB2 LEU 41 HB2 LEU 41 -6.580 -2.130 -1.692 236 HB3 LEU 41 HB1 LEU 41 -5.672 -3.235 -2.772 237 HG LEU 41 HG LEU 41 -3.986 -1.202 -2.903 238 HD11 LEU 41 1HD1 LEU 41 -4.325 0.371 -1.027 239 HD12 LEU 41 2HD1 LEU 41 -5.801 0.381 -1.854 240 HD13 LEU 41 3HD1 LEU 41 -5.727 -0.639 -0.437 241 HD21 LEU 41 3HD2 LEU 41 -3.200 -1.811 -0.733 242 HD22 LEU 41 1HD2 LEU 41 -4.507 -2.887 -0.329 243 HD23 LEU 41 2HD2 LEU 41 -3.506 -3.253 -1.810 244 H ALA 42 H ALA 42 -6.342 -2.759 -5.770 245 HA ALA 42 HA ALA 42 -4.379 -1.023 -6.847 246 HB1 ALA 42 HB1 ALA 42 -4.429 -3.593 -7.350 247 HB2 ALA 42 HB2 ALA 42 -5.925 -3.498 -8.103 248 HB3 ALA 42 HB3 ALA 42 -4.473 -2.680 -8.797 249 H GLN 43 H GLN 43 -7.879 -1.642 -7.368 250 HA GLN 43 HA GLN 43 -8.231 0.311 -9.401 251 HB2 GLN 43 HB2 GLN 43 -9.995 -1.133 -7.456 252 HB3 GLN 43 HB1 GLN 43 -10.585 -0.053 -8.736 253 HG2 GLN 43 HG2 GLN 43 -9.515 -1.436 -10.548 254 HG3 GLN 43 HG1 GLN 43 -8.785 -2.400 -9.344 255 HE21 GLN 43 1HE2 GLN 43 -10.069 -4.202 -8.572 256 HE22 GLN 43 2HE2 GLN 43 -11.805 -4.423 -8.895 257 H LYS 44 H LYS 44 -8.401 0.444 -5.798 258 HA LYS 44 HA LYS 44 -9.526 3.035 -5.680 259 HB2 LYS 44 HB2 LYS 44 -9.655 1.133 -4.061 260 HB3 LYS 44 HB1 LYS 44 -7.943 1.315 -3.797 261 HG2 LYS 44 HG2 LYS 44 -8.879 2.391 -1.869 262 HG3 LYS 44 HG1 LYS 44 -8.209 3.580 -2.962 263 HD2 LYS 44 HD2 LYS 44 -10.491 4.018 -3.818 264 HD3 LYS 44 HD1 LYS 44 -11.200 2.933 -2.625 265 HE2 LYS 44 HE2 LYS 44 -10.256 4.229 -0.774 266 HE3 LYS 44 HE1 LYS 44 -9.355 5.199 -1.866 267 HZ1 LYS 44 HZ1 LYS 44 -11.579 6.376 -1.381 268 HZ2 LYS 44 HZ2 LYS 44 -11.435 5.905 -2.933 269 HZ3 LYS 44 HZ3 LYS 44 -12.307 5.086 -1.756 270 H LEU 45 H LEU 45 -6.262 1.928 -6.242 271 HA LEU 45 HA LEU 45 -5.208 4.559 -5.738 272 HB2 LEU 45 HB2 LEU 45 -3.838 1.798 -5.795 273 HB3 LEU 45 HB1 LEU 45 -2.973 3.339 -5.915 274 HG LEU 45 HG LEU 45 -3.345 4.016 -3.830 275 HD11 LEU 45 1HD1 LEU 45 -5.490 1.925 -3.408 276 HD12 LEU 45 2HD1 LEU 45 -4.772 2.908 -2.100 277 HD13 LEU 45 3HD1 LEU 45 -5.552 3.753 -3.408 278 HD21 LEU 45 3HD2 LEU 45 -3.000 1.069 -3.513 279 HD22 LEU 45 1HD2 LEU 45 -1.637 2.227 -3.716 280 HD23 LEU 45 2HD2 LEU 45 -2.584 2.345 -2.293 281 H LYS 46 H LYS 46 -6.357 2.970 -8.348 282 HA LYS 46 HA LYS 46 -6.316 2.903 -10.375 283 HB2 LYS 46 HB2 LYS 46 -4.249 5.128 -10.299 284 HB3 LYS 46 HB1 LYS 46 -5.183 4.471 -11.682 285 HG2 LYS 46 HG2 LYS 46 -6.386 5.945 -11.525 286 HG3 LYS 46 HG1 LYS 46 -7.205 5.074 -10.085 287 HD2 LYS 46 HD2 LYS 46 -6.050 6.393 -8.600 288 HD3 LYS 46 HD1 LYS 46 -5.005 7.235 -9.886 289 HE2 LYS 46 HE2 LYS 46 -7.995 7.365 -9.928 290 HE3 LYS 46 HE1 LYS 46 -7.326 8.417 -8.784 291 HZ1 LYS 46 HZ1 LYS 46 -6.599 8.163 -11.694 292 HZ2 LYS 46 HZ2 LYS 46 -7.566 9.311 -11.062 293 HZ3 LYS 46 HZ3 LYS 46 -5.940 9.313 -10.765 294 H VAL 47 H VAL 47 -3.057 2.631 -8.999 295 HA VAL 47 HA VAL 47 -1.912 1.855 -11.067 296 HB VAL 47 HB VAL 47 0.124 1.295 -9.453 297 HG11 VAL 47 1HG1 VAL 47 -0.874 3.610 -10.235 298 HG12 VAL 47 2HG1 VAL 47 -1.442 3.721 -8.502 299 HG13 VAL 47 3HG1 VAL 47 0.285 3.611 -8.967 300 HG21 VAL 47 3HG2 VAL 47 -1.053 0.257 -7.716 301 HG22 VAL 47 1HG2 VAL 47 -0.323 1.810 -7.082 302 HG23 VAL 47 2HG2 VAL 47 -2.027 1.709 -7.437 303 H SER 48 H SER 48 -0.198 -0.339 -11.083 304 HA SER 48 HA SER 48 -1.978 -2.541 -11.321 305 HB2 SER 48 HB2 SER 48 -0.222 -3.530 -12.528 306 HB3 SER 48 HB1 SER 48 -0.650 -1.932 -13.100 307 HG SER 48 HG SER 48 1.131 -1.116 -12.150 308 H GLU 49 H GLU 49 -1.444 -4.817 -10.725 309 HA GLU 49 HA GLU 49 -1.359 -4.489 -7.999 310 HB2 GLU 49 HB2 GLU 49 -1.776 -6.843 -9.886 311 HB3 GLU 49 HB1 GLU 49 -1.638 -7.068 -8.164 312 HG2 GLU 49 HG2 GLU 49 -3.608 -5.469 -7.854 313 HG3 GLU 49 HG1 GLU 49 -3.691 -5.202 -9.562 314 H ASN 50 H ASN 50 0.928 -5.308 -10.240 315 HA ASN 50 HA ASN 50 3.158 -6.641 -8.758 316 HB2 ASN 50 HB2 ASN 50 2.999 -5.986 -11.350 317 HB3 ASN 50 HB1 ASN 50 3.203 -4.409 -10.642 318 HD21 ASN 50 1HD2 ASN 50 4.699 -7.736 -11.005 319 HD22 ASN 50 2HD2 ASN 50 6.283 -7.337 -10.701 320 H ILE 51 H ILE 51 2.129 -3.285 -8.961 321 HA ILE 51 HA ILE 51 4.190 -2.418 -7.232 322 HB ILE 51 HB ILE 51 1.480 -0.961 -7.744 323 HG12 ILE 51 2HG1 ILE 51 2.299 -1.481 -9.984 324 HG13 ILE 51 1HG1 ILE 51 2.223 0.264 -9.559 325 HG21 ILE 51 1HG2 ILE 51 4.218 0.240 -7.171 326 HG22 ILE 51 2HG2 ILE 51 2.564 1.063 -7.345 327 HG23 ILE 51 3HG2 ILE 51 2.886 -0.088 -6.032 328 HD11 ILE 51 HD3 ILE 51 4.584 -1.535 -9.972 329 HD12 ILE 51 HD1 ILE 51 4.029 -0.135 -10.946 330 HD13 ILE 51 HD2 ILE 51 4.792 0.130 -9.391 331 H VAL 52 H VAL 52 0.617 -3.151 -6.811 332 HA VAL 52 HA VAL 52 0.842 -2.374 -4.218 333 HB VAL 52 HB VAL 52 -1.304 -2.995 -3.834 334 HG11 VAL 52 1HG1 VAL 52 -1.449 -2.587 -6.867 335 HG12 VAL 52 2HG1 VAL 52 -2.497 -2.106 -5.663 336 HG13 VAL 52 3HG1 VAL 52 -0.945 -1.296 -5.642 337 HG21 VAL 52 3HG2 VAL 52 -1.588 -5.306 -4.218 338 HG22 VAL 52 1HG2 VAL 52 -2.663 -4.541 -5.387 339 HG23 VAL 52 2HG2 VAL 52 -1.140 -5.192 -5.879 340 H LYS 53 H LYS 53 1.205 -5.800 -5.322 341 HA LYS 53 HA LYS 53 1.779 -6.810 -2.768 342 HB2 LYS 53 HB2 LYS 53 2.786 -7.348 -5.634 343 HB3 LYS 53 HB1 LYS 53 3.025 -8.414 -4.255 344 HG2 LYS 53 HG2 LYS 53 0.562 -8.789 -4.068 345 HG3 LYS 53 HG1 LYS 53 0.335 -7.647 -5.373 346 HD2 LYS 53 HD2 LYS 53 1.872 -10.213 -5.813 347 HD3 LYS 53 HD1 LYS 53 0.086 -10.176 -5.985 348 HE2 LYS 53 HE2 LYS 53 0.063 -8.594 -7.595 349 HE3 LYS 53 HE1 LYS 53 1.709 -8.230 -7.567 350 HZ1 LYS 53 HZ1 LYS 53 1.111 -9.875 -9.325 351 HZ2 LYS 53 HZ2 LYS 53 2.177 -10.553 -8.327 352 HZ3 LYS 53 HZ3 LYS 53 0.504 -10.869 -8.254 353 H ARG 54 H ARG 54 4.065 -4.881 -4.775 354 HA ARG 54 HA ARG 54 6.440 -5.707 -3.517 355 HB2 ARG 54 HB2 ARG 54 5.863 -4.131 -5.549 356 HB3 ARG 54 HB1 ARG 54 5.847 -2.846 -4.276 357 HG2 ARG 54 HG2 ARG 54 8.173 -3.384 -3.703 358 HG3 ARG 54 HG1 ARG 54 7.978 -4.811 -4.750 359 HD2 ARG 54 HD2 ARG 54 8.165 -1.875 -5.521 360 HD3 ARG 54 HD1 ARG 54 9.464 -2.865 -5.776 361 HE ARG 54 HE ARG 54 7.848 -4.194 -7.373 362 HH11 ARG 54 1HH2 ARG 54 8.086 -0.711 -7.025 363 HH12 ARG 54 2HH2 ARG 54 7.563 -0.432 -8.708 364 HH21 ARG 54 1HH1 ARG 54 6.948 -3.823 -9.268 365 HH22 ARG 54 2HH1 ARG 54 6.941 -2.157 -9.893 366 H PHE 55 H PHE 55 4.086 -3.098 -2.618 367 HA PHE 55 HA PHE 55 5.512 -2.433 -0.230 368 HB2 PHE 55 HB2 PHE 55 2.753 -1.725 -0.889 369 HB3 PHE 55 HB1 PHE 55 3.875 -0.982 0.175 370 HD1 PHE 55 HD2 PHE 55 6.423 -1.124 -1.921 371 HD2 PHE 55 HD1 PHE 55 2.360 0.427 -1.993 372 HE1 PHE 55 HE2 PHE 55 6.974 0.408 -3.770 373 HE2 PHE 55 HE1 PHE 55 2.945 1.912 -3.811 374 HZ PHE 55 HZ PHE 55 5.270 1.874 -4.751 375 H GLU 56 H GLU 56 2.789 -4.783 -0.884 376 HA GLU 56 HA GLU 56 1.926 -4.982 1.704 377 HB2 GLU 56 HB2 GLU 56 0.937 -5.497 -0.497 378 HB3 GLU 56 HB1 GLU 56 1.978 -6.900 -0.663 379 HG2 GLU 56 HG2 GLU 56 0.876 -7.709 1.655 380 HG3 GLU 56 HG1 GLU 56 -0.349 -6.454 1.265 381 H SER 57 H SER 57 4.609 -6.368 0.017 382 HA SER 57 HA SER 57 4.823 -8.642 1.953 383 HB2 SER 57 HB2 SER 57 5.276 -9.939 0.213 384 HB3 SER 57 HB1 SER 57 3.992 -8.791 -0.304 385 HG SER 57 HG SER 57 5.445 -8.818 -1.988 386 H GLY 58 H GLY 58 6.403 -6.001 2.048 387 HA2 GLY 58 HA2 GLY 58 8.429 -5.552 3.090 388 HA3 GLY 58 HA1 GLY 58 8.723 -7.306 3.090 389 H LYS 59 H LYS 59 8.115 -5.737 0.007 390 HA LYS 59 HA LYS 59 10.688 -6.573 -0.722 391 HB2 LYS 59 HB2 LYS 59 7.989 -6.358 -1.884 392 HB3 LYS 59 HB1 LYS 59 9.334 -6.024 -3.100 393 HG2 LYS 59 HG2 LYS 59 9.283 -8.361 -1.188 394 HG3 LYS 59 HG1 LYS 59 8.377 -8.384 -2.686 395 HD2 LYS 59 HD2 LYS 59 10.582 -7.966 -3.967 396 HD3 LYS 59 HD1 LYS 59 11.361 -8.121 -2.445 397 HE2 LYS 59 HE2 LYS 59 10.548 -10.402 -2.276 398 HE3 LYS 59 HE1 LYS 59 9.454 -10.183 -3.616 399 HZ1 LYS 59 HZ1 LYS 59 11.242 -11.527 -4.297 400 HZ2 LYS 59 HZ2 LYS 59 11.309 -10.008 -5.064 401 HZ3 LYS 59 HZ3 LYS 59 12.347 -10.506 -3.869 402 H LEU 60 H LEU 60 10.316 -3.923 0.557 403 HA LEU 60 HA LEU 60 12.079 -2.532 -1.306 404 HB2 LEU 60 HB2 LEU 60 9.509 -1.787 -0.839 405 HB3 LEU 60 HB1 LEU 60 10.339 -0.937 0.569 406 HG LEU 60 HG LEU 60 11.749 0.162 -1.100 407 HD11 LEU 60 1HD1 LEU 60 11.443 -1.343 -3.091 408 HD12 LEU 60 2HD1 LEU 60 9.725 -0.882 -3.095 409 HD13 LEU 60 3HD1 LEU 60 11.002 0.356 -3.400 410 HD21 LEU 60 3HD2 LEU 60 10.160 1.393 -0.035 411 HD22 LEU 60 1HD2 LEU 60 9.823 1.701 -1.705 412 HD23 LEU 60 2HD2 LEU 60 8.797 0.553 -0.790 413 H LYS 61 H LYS 61 13.581 -1.056 -0.544 414 HA LYS 61 HA LYS 61 13.941 -0.896 2.374 415 HB2 LYS 61 HB2 LYS 61 15.965 -1.276 1.025 416 HB3 LYS 61 HB1 LYS 61 15.480 0.134 0.019 417 HG2 LYS 61 HG2 LYS 61 15.729 1.357 2.291 418 HG3 LYS 61 HG1 LYS 61 16.727 0.007 2.810 419 HD2 LYS 61 HD2 LYS 61 18.209 0.557 0.816 420 HD3 LYS 61 HD1 LYS 61 17.267 2.031 0.634 421 HE2 LYS 61 HE2 LYS 61 19.182 2.573 2.008 422 HE3 LYS 61 HE1 LYS 61 17.684 2.509 3.090 423 HZ1 LYS 61 HZ1 LYS 61 18.144 0.507 3.822 424 HZ2 LYS 61 HZ2 LYS 61 19.344 0.082 2.817 425 HZ3 LYS 61 HZ3 LYS 61 19.619 1.270 3.902 426 HA PRO 62 HA PRO 62 11.272 2.622 1.465 427 HB2 PRO 62 HB1 PRO 62 9.867 2.755 3.698 428 HB3 PRO 62 HB2 PRO 62 9.810 1.225 2.654 429 HG2 PRO 62 HG1 PRO 62 11.544 1.515 5.139 430 HG3 PRO 62 HG2 PRO 62 10.318 0.297 4.816 431 HD2 PRO 62 HD1 PRO 62 12.927 0.137 4.288 432 HD3 PRO 62 HD2 PRO 62 11.733 -0.730 3.369 433 H THR 63 H THR 63 10.930 4.805 2.517 434 HA THR 63 HA THR 63 12.802 5.478 4.380 435 HB THR 63 HB THR 63 13.883 7.263 3.214 436 HG1 THR 63 HG1 THR 63 13.703 7.420 0.892 437 HG21 THR 63 1HG2 THR 63 14.892 5.047 2.963 438 HG22 THR 63 2HG2 THR 63 14.200 4.986 1.393 439 HG23 THR 63 3HG2 THR 63 15.399 6.264 1.748 440 H ILE 64 H ILE 64 12.610 8.247 4.524 441 HA ILE 64 HA ILE 64 10.190 8.545 5.668 442 HB ILE 64 HB ILE 64 12.568 10.282 5.025 443 HG12 ILE 64 2HG1 ILE 64 11.471 9.315 7.698 444 HG13 ILE 64 1HG1 ILE 64 12.355 8.286 6.774 445 HG21 ILE 64 1HG2 ILE 64 10.118 11.235 6.536 446 HG22 ILE 64 2HG2 ILE 64 11.640 11.960 6.545 447 HG23 ILE 64 3HG2 ILE 64 10.714 11.911 4.985 448 HD11 ILE 64 HD3 ILE 64 14.216 10.145 6.614 449 HD12 ILE 64 HD1 ILE 64 13.311 11.065 7.770 450 HD13 ILE 64 HD2 ILE 64 13.971 9.560 8.302 451 H SER 65 H SER 65 11.434 9.933 2.611 452 HA SER 65 HA SER 65 8.939 11.212 1.927 453 HB2 SER 65 HB2 SER 65 9.955 11.447 -0.222 454 HB3 SER 65 HB1 SER 65 11.320 11.594 1.009 455 HG SER 65 HG SER 65 12.110 9.770 0.442 456 H GLN 66 H GLN 66 10.158 7.828 1.349 457 HA GLN 66 HA GLN 66 8.075 7.277 -0.495 458 HB2 GLN 66 HB2 GLN 66 10.189 5.558 1.065 459 HB3 GLN 66 HB1 GLN 66 8.975 4.850 0.073 460 HG2 GLN 66 HG2 GLN 66 9.834 6.329 -1.717 461 HG3 GLN 66 HG1 GLN 66 11.152 6.894 -0.760 462 HE21 GLN 66 1HE2 GLN 66 12.806 5.461 -0.028 463 HE22 GLN 66 2HE2 GLN 66 13.091 3.882 -0.816 464 H ALA 67 H ALA 67 8.523 6.546 3.062 465 HA ALA 67 HA ALA 67 6.053 5.299 3.435 466 HB1 ALA 67 HB1 ALA 67 7.783 5.203 5.153 467 HB2 ALA 67 HB2 ALA 67 7.678 6.927 5.463 468 HB3 ALA 67 HB3 ALA 67 6.288 5.896 5.721 469 H ARG 68 H ARG 68 7.012 8.816 3.466 470 HA ARG 68 HA ARG 68 4.488 9.787 4.157 471 HB2 ARG 68 HB2 ARG 68 6.721 11.137 3.879 472 HB3 ARG 68 HB1 ARG 68 6.361 11.201 2.177 473 HG2 ARG 68 HG2 ARG 68 5.698 13.296 3.224 474 HG3 ARG 68 HG1 ARG 68 4.331 12.512 2.448 475 HD2 ARG 68 HD2 ARG 68 3.738 11.546 4.660 476 HD3 ARG 68 HD1 ARG 68 4.888 12.546 5.377 477 HE ARG 68 HE ARG 68 3.249 14.173 5.525 478 HH11 ARG 68 1HH2 ARG 68 2.388 11.873 2.741 479 HH12 ARG 68 2HH2 ARG 68 0.942 12.756 2.521 480 HH21 ARG 68 1HH1 ARG 68 1.458 15.332 4.758 481 HH22 ARG 68 2HH1 ARG 68 0.505 14.565 3.456 482 H GLN 69 H GLN 69 5.225 8.246 1.127 483 HA GLN 69 HA GLN 69 3.080 9.706 -0.304 484 HB2 GLN 69 HB2 GLN 69 5.432 7.852 -0.965 485 HB3 GLN 69 HB1 GLN 69 4.108 8.202 -2.041 486 HG2 GLN 69 HG2 GLN 69 4.745 10.552 -2.038 487 HG3 GLN 69 HG1 GLN 69 5.695 10.339 -0.621 488 HE21 GLN 69 1HE2 GLN 69 7.930 10.211 -1.066 489 HE22 GLN 69 2HE2 GLN 69 8.541 10.047 -2.668 490 H LEU 70 H LEU 70 3.959 6.479 1.148 491 HA LEU 70 HA LEU 70 2.064 5.011 -0.018 492 HB2 LEU 70 HB2 LEU 70 4.079 4.340 1.059 493 HB3 LEU 70 HB1 LEU 70 3.486 4.755 2.657 494 HG LEU 70 HG LEU 70 1.683 2.894 2.166 495 HD11 LEU 70 1HD1 LEU 70 3.730 2.432 -0.057 496 HD12 LEU 70 2HD1 LEU 70 2.504 1.210 0.511 497 HD13 LEU 70 3HD1 LEU 70 1.988 2.722 -0.192 498 HD21 LEU 70 3HD2 LEU 70 3.288 1.238 2.978 499 HD22 LEU 70 1HD2 LEU 70 4.607 2.107 2.254 500 HD23 LEU 70 2HD2 LEU 70 3.677 2.743 3.743 501 H GLU 71 H GLU 71 1.694 6.607 3.224 502 HA GLU 71 HA GLU 71 -1.039 6.050 3.684 503 HB2 GLU 71 HB2 GLU 71 -0.584 8.150 5.125 504 HB3 GLU 71 HB1 GLU 71 0.738 6.874 5.215 505 HG2 GLU 71 HG2 GLU 71 2.005 8.334 3.719 506 HG3 GLU 71 HG1 GLU 71 0.776 9.498 3.554 507 H LYS 72 H LYS 72 0.623 8.141 1.271 508 HA LYS 72 HA LYS 72 -1.789 9.797 1.052 509 HB2 LYS 72 HB2 LYS 72 0.640 10.703 1.099 510 HB3 LYS 72 HB1 LYS 72 0.688 9.944 -0.561 511 HG2 LYS 72 HG2 LYS 72 -1.205 11.292 -1.404 512 HG3 LYS 72 HG1 LYS 72 -1.511 11.826 0.286 513 HD2 LYS 72 HD2 LYS 72 0.589 13.076 0.297 514 HD3 LYS 72 HD1 LYS 72 1.124 12.388 -1.192 515 HE2 LYS 72 HE2 LYS 72 -1.029 13.424 -2.255 516 HE3 LYS 72 HE1 LYS 72 -1.246 14.246 -0.764 517 HZ1 LYS 72 HZ1 LYS 72 1.223 14.917 -1.087 518 HZ2 LYS 72 HZ2 LYS 72 1.163 14.010 -2.407 519 HZ3 LYS 72 HZ3 LYS 72 0.386 15.438 -2.452 520 H ILE 73 H ILE 73 -0.409 7.013 -0.748 521 HA ILE 73 HA ILE 73 -2.404 7.652 -2.774 522 HB ILE 73 HB ILE 73 -1.635 5.657 -3.849 523 HG12 ILE 73 2HG1 ILE 73 0.328 5.314 -1.501 524 HG13 ILE 73 1HG1 ILE 73 -1.107 4.313 -1.728 525 HG21 ILE 73 1HG2 ILE 73 -0.337 7.844 -3.874 526 HG22 ILE 73 2HG2 ILE 73 0.975 6.926 -3.141 527 HG23 ILE 73 3HG2 ILE 73 0.235 6.402 -4.713 528 HD11 ILE 73 HD3 ILE 73 1.420 4.365 -3.214 529 HD12 ILE 73 HD1 ILE 73 0.535 2.896 -2.576 530 HD13 ILE 73 HD2 ILE 73 0.086 3.634 -4.069 531 H LEU 74 H LEU 74 -2.179 5.467 0.159 532 HA LEU 74 HA LEU 74 -4.530 4.452 -0.348 533 HB2 LEU 74 HB2 LEU 74 -2.915 3.502 1.132 534 HB3 LEU 74 HB1 LEU 74 -3.090 4.831 2.207 535 HG LEU 74 HG LEU 74 -5.557 4.001 2.646 536 HD11 LEU 74 1HD1 LEU 74 -5.997 2.886 0.420 537 HD12 LEU 74 2HD1 LEU 74 -4.658 1.800 0.735 538 HD13 LEU 74 3HD1 LEU 74 -6.135 1.818 1.748 539 HD21 LEU 74 3HD2 LEU 74 -3.382 3.084 3.874 540 HD22 LEU 74 1HD2 LEU 74 -4.846 1.973 3.773 541 HD23 LEU 74 2HD2 LEU 74 -3.522 1.776 2.669 542 H GLY 75 H GLY 75 -3.521 7.426 0.647 543 HA2 GLY 75 HA2 GLY 75 -4.276 9.431 1.570 544 HA3 GLY 75 HA1 GLY 75 -5.936 8.839 1.171 545 H ILE 76 H ILE 76 -4.362 6.712 3.455 546 HA ILE 76 HA ILE 76 -5.080 8.101 5.771 547 HB ILE 76 HB ILE 76 -6.564 6.448 6.619 548 HG12 ILE 76 2HG1 ILE 76 -6.895 5.289 3.811 549 HG13 ILE 76 1HG1 ILE 76 -5.698 4.632 4.965 550 HG21 ILE 76 1HG2 ILE 76 -8.392 7.243 5.835 551 HG22 ILE 76 2HG2 ILE 76 -7.536 8.617 5.356 552 HG23 ILE 76 3HG2 ILE 76 -7.866 7.404 4.090 553 HD11 ILE 76 HD3 ILE 76 -8.693 5.102 5.623 554 HD12 ILE 76 HD1 ILE 76 -8.004 3.637 5.110 555 HD13 ILE 76 HD2 ILE 76 -7.490 4.252 6.649 556 H LYS 77 H LYS 77 -4.736 6.136 7.694 557 HA LYS 77 HA LYS 77 -2.721 4.280 7.343 558 HB2 LYS 77 HB2 LYS 77 -0.934 5.450 8.326 559 HB3 LYS 77 HB1 LYS 77 -1.316 6.207 6.716 560 HG2 LYS 77 HG2 LYS 77 -2.234 8.113 7.524 561 HG3 LYS 77 HG1 LYS 77 -2.069 7.503 9.277 562 HD2 LYS 77 HD2 LYS 77 0.311 7.592 9.002 563 HD3 LYS 77 HD1 LYS 77 0.054 7.862 7.241 564 HE2 LYS 77 HE2 LYS 77 -1.005 10.005 7.627 565 HE3 LYS 77 HE1 LYS 77 -1.118 9.723 9.248 566 HZ1 LYS 77 HZ1 LYS 77 1.326 9.838 9.461 567 HZ2 LYS 77 HZ2 LYS 77 1.367 9.999 7.736 568 HZ3 LYS 77 HZ3 LYS 77 0.767 11.193 8.751 569 H LEU 78 H LEU 78 -2.026 3.645 9.287 570 HA LEU 78 HA LEU 78 -3.134 4.510 11.825 571 HB2 LEU 78 HB2 LEU 78 -4.058 1.866 10.480 572 HB3 LEU 78 HB1 LEU 78 -3.737 2.094 12.245 573 HG LEU 78 HG LEU 78 -5.655 3.603 10.396 574 HD11 LEU 78 1HD1 LEU 78 -6.046 1.729 12.809 575 HD12 LEU 78 2HD1 LEU 78 -7.393 2.464 11.944 576 HD13 LEU 78 3HD1 LEU 78 -6.441 1.414 11.006 577 HD21 LEU 78 3HD2 LEU 78 -6.737 4.635 12.412 578 HD22 LEU 78 1HD2 LEU 78 -5.439 4.031 13.409 579 HD23 LEU 78 2HD2 LEU 78 -5.113 5.209 12.090 580 H VAL 79 H VAL 79 -0.586 3.023 13.631 581 HA VAL 79 HA VAL 79 -3.367 3.671 13.795 582 HB VAL 79 HB VAL 79 -1.373 2.965 15.998 583 HG11 VAL 79 1HG1 VAL 79 -4.468 2.724 16.138 584 HG12 VAL 79 2HG1 VAL 79 -3.158 2.002 17.216 585 HG13 VAL 79 3HG1 VAL 79 -3.346 3.668 17.073 586 HG21 VAL 79 3HG2 VAL 79 -1.365 1.113 14.423 587 HG22 VAL 79 1HG2 VAL 79 -2.235 0.640 15.891 588 HG23 VAL 79 2HG2 VAL 79 -3.175 1.087 14.481 589 H THR 80 H THR 80 -3.812 5.017 15.880 590 HA THR 80 HA THR 80 -2.968 7.883 15.495 591 HB THR 80 HB THR 80 -4.826 8.139 17.001 592 HG1 THR 80 HG1 THR 80 -5.958 5.829 16.784 593 HG21 THR 80 1HG2 THR 80 -5.296 8.208 14.678 594 HG22 THR 80 2HG2 THR 80 -5.518 6.466 14.600 595 HG23 THR 80 3HG2 THR 80 -6.560 7.506 15.611 596 HA PRO 81 HA PRO 81 -0.941 7.924 19.570 597 HB2 PRO 81 HB1 PRO 81 -3.177 9.563 20.515 598 HB3 PRO 81 HB2 PRO 81 -1.454 9.720 20.897 599 HG2 PRO 81 HG1 PRO 81 -2.403 11.210 19.048 600 HG3 PRO 81 HG2 PRO 81 -0.985 10.210 18.498 601 HD2 PRO 81 HD1 PRO 81 -3.817 9.549 17.779 602 HD3 PRO 81 HD2 PRO 81 -2.249 9.368 16.877 603 H LEU 82 H LEU 82 -4.049 6.180 19.195 604 HA LEU 82 HA LEU 82 -4.150 5.096 21.753 605 HB2 LEU 82 HB2 LEU 82 -5.690 4.934 19.818 606 HB3 LEU 82 HB1 LEU 82 -4.522 3.936 18.985 607 HG LEU 82 HG LEU 82 -4.627 2.197 20.730 608 HD11 LEU 82 1HD1 LEU 82 -6.906 3.722 22.005 609 HD12 LEU 82 2HD1 LEU 82 -6.452 2.156 22.406 610 HD13 LEU 82 3HD1 LEU 82 -5.188 3.475 22.604 611 HD21 LEU 82 3HD2 LEU 82 -6.942 1.442 19.983 612 HD22 LEU 82 1HD2 LEU 82 -7.369 3.116 19.881 613 HD23 LEU 82 2HD2 LEU 82 -6.259 2.334 18.659 614 H GLU 83 H GLU 83 -1.752 4.578 19.094 615 HA GLU 83 HA GLU 83 -0.178 2.983 21.016 616 HB2 GLU 83 HB2 GLU 83 -0.988 2.191 18.192 617 HB3 GLU 83 HB1 GLU 83 0.450 1.517 19.125 618 HG2 GLU 83 HG2 GLU 83 -1.208 0.814 20.867 619 HG3 GLU 83 HG1 GLU 83 -2.493 1.176 19.706 620 H ASN 84 H ASN 84 -0.446 5.291 18.542 621 HA ASN 84 HA ASN 84 2.319 5.583 18.318 622 HB2 ASN 84 HB2 ASN 84 2.234 3.901 16.662 623 HB3 ASN 84 HB1 ASN 84 0.748 4.622 15.829 624 HD21 ASN 84 1HD2 ASN 84 0.838 5.754 14.058 625 HD22 ASN 84 2HD2 ASN 84 2.312 6.330 13.381 626 H ASN 85 H ASN 85 3.079 7.519 17.430 627 HA ASN 85 HA ASN 85 1.011 9.556 16.821 628 HB2 ASN 85 HB2 ASN 85 1.068 9.335 19.295 629 HB3 ASN 85 HB1 ASN 85 2.834 9.732 19.166 630 HD21 ASN 85 1HD2 ASN 85 2.563 11.628 20.726 631 HD22 ASN 85 2HD2 ASN 85 1.622 12.945 20.169 632 H GLU 86 H GLU 86 1.756 11.197 15.889 633 HA GLU 86 HA GLU 86 4.580 11.197 15.034 634 HB2 GLU 86 HB2 GLU 86 2.147 12.292 13.528 635 HB3 GLU 86 HB1 GLU 86 3.695 12.259 12.821 636 HG2 GLU 86 HG2 GLU 86 3.891 9.971 13.080 637 HG3 GLU 86 HG1 GLU 86 2.205 9.744 13.660 638 H GLU 87 H GLU 87 5.736 13.094 14.409 639 HA GLU 87 HA GLU 87 5.131 15.672 15.664 640 HB2 GLU 87 HB2 GLU 87 7.037 14.729 13.592 641 HB3 GLU 87 HB1 GLU 87 7.105 16.321 14.362 642 HG2 GLU 87 HG2 GLU 87 7.137 14.577 16.491 643 HG3 GLU 87 HG1 GLU 87 8.021 13.621 15.292 644 H SER 88 H SER 88 5.343 17.731 14.213 645 HA SER 88 HA SER 88 2.781 17.667 12.645 646 HB2 SER 88 HB2 SER 88 4.213 19.851 13.883 647 HB3 SER 88 HB1 SER 88 2.639 19.857 13.027 648 HG SER 88 HG SER 88 3.318 18.458 15.411 649 H GLU 89 H GLU 89 6.208 18.311 12.223 650 HA GLU 89 HA GLU 89 6.032 19.815 9.861 651 HB2 GLU 89 HB2 GLU 89 8.137 17.754 10.677 652 HB3 GLU 89 HB1 GLU 89 8.297 18.948 9.392 653 HG2 GLU 89 HG2 GLU 89 8.129 19.738 12.324 654 HG3 GLU 89 HG1 GLU 89 9.530 19.633 11.426 655 H LYS 90 H LYS 90 5.794 16.412 10.461 656 HA LYS 90 HA LYS 90 5.923 15.400 7.738 657 HB2 LYS 90 HB2 LYS 90 4.490 14.200 10.069 658 HB3 LYS 90 HB1 LYS 90 5.100 13.395 8.644 659 HG2 LYS 90 HG2 LYS 90 7.437 14.351 9.311 660 HG3 LYS 90 HG1 LYS 90 6.771 14.469 10.972 661 HD2 LYS 90 HD2 LYS 90 7.850 12.456 10.906 662 HD3 LYS 90 HD1 LYS 90 6.150 12.038 10.732 663 HE2 LYS 90 HE2 LYS 90 6.382 11.839 8.307 664 HE3 LYS 90 HE1 LYS 90 8.018 12.226 8.267 665 HZ1 LYS 90 HZ1 LYS 90 6.967 9.813 9.544 666 HZ2 LYS 90 HZ2 LYS 90 7.911 10.002 8.137 667 HZ3 LYS 90 HZ3 LYS 90 8.509 10.261 9.613 668 H GLU 91 H GLU 91 3.633 17.545 8.831 669 HA GLU 91 HA GLU 91 1.235 16.394 7.810 670 HB2 GLU 91 HB2 GLU 91 1.249 17.935 9.403 671 HB3 GLU 91 HB1 GLU 91 2.128 19.263 8.509 672 HG2 GLU 91 HG2 GLU 91 0.483 19.844 7.264 673 HG3 GLU 91 HG1 GLU 91 -0.535 18.311 7.457 674 H PHE 92 H PHE 92 3.951 18.091 6.344 675 HA PHE 92 HA PHE 92 2.525 18.705 3.851 676 HB2 PHE 92 HB2 PHE 92 5.273 19.479 4.800 677 HB3 PHE 92 HB1 PHE 92 4.429 20.025 3.407 678 HD1 PHE 92 HD2 PHE 92 2.237 21.163 3.510 679 HD2 PHE 92 HD1 PHE 92 5.069 20.850 6.674 680 HE1 PHE 92 HE2 PHE 92 1.233 23.252 4.674 681 HE2 PHE 92 HE1 PHE 92 4.017 22.985 7.763 682 HZ PHE 92 HZ PHE 92 2.206 24.066 6.792 683 H ASP 93 H ASP 93 3.556 18.084 1.794 684 HA ASP 93 HA ASP 93 6.065 16.706 1.790 685 HB2 ASP 93 HB2 ASP 93 5.303 14.677 0.741 686 HB3 ASP 93 HB1 ASP 93 4.513 14.902 2.218 687 H ASP 94 H ASP 94 3.238 17.811 0.031 688 HA ASP 94 HA ASP 94 4.720 18.012 -2.582 689 HB2 ASP 94 HB2 ASP 94 2.633 16.801 -2.137 690 HB3 ASP 94 HB1 ASP 94 1.771 18.328 -1.859 691 H THR 95 H THR 95 3.395 20.047 -0.120 692 HA THR 95 HA THR 95 4.421 22.499 -1.478 693 HB THR 95 HB THR 95 2.350 23.656 -0.622 694 HG1 THR 95 HG1 THR 95 1.579 22.711 1.080 695 HG21 THR 95 1HG2 THR 95 0.707 22.808 -1.843 696 HG22 THR 95 2HG2 THR 95 1.988 22.195 -2.820 697 HG23 THR 95 3HG2 THR 95 1.163 21.089 -1.625 698 H GLY 96 H GLY 96 3.828 24.225 0.724 699 HA2 GLY 96 HA2 GLY 96 5.386 23.213 2.981 700 HA3 GLY 96 HA1 GLY 96 6.159 24.347 1.812 701 H LEU 97 H LEU 97 5.285 24.781 4.767 702 HA LEU 97 HA LEU 97 2.993 26.071 4.799 703 HB2 LEU 97 HB2 LEU 97 4.442 24.977 6.627 704 HB3 LEU 97 HB1 LEU 97 5.488 26.237 6.576 705 HG LEU 97 HG LEU 97 4.269 27.687 7.529 706 HD11 LEU 97 1HD1 LEU 97 1.943 27.560 8.440 707 HD12 LEU 97 2HD1 LEU 97 2.034 27.666 6.610 708 HD13 LEU 97 3HD1 LEU 97 1.799 26.109 7.293 709 HD21 LEU 97 3HD2 LEU 97 3.817 25.115 8.873 710 HD22 LEU 97 1HD2 LEU 97 5.345 26.013 8.829 711 HD23 LEU 97 2HD2 LEU 97 3.991 26.715 9.753 712 H THR 98 H THR 98 5.517 27.446 3.231 713 HA THR 98 HA THR 98 4.926 30.265 3.794 714 HB THR 98 HB THR 98 7.643 29.360 3.066 715 HG1 THR 98 HG1 THR 98 8.056 28.647 4.969 716 HG21 THR 98 1HG2 THR 98 6.265 31.489 4.784 717 HG22 THR 98 2HG2 THR 98 8.062 31.321 4.664 718 HG23 THR 98 3HG2 THR 98 7.173 31.750 3.208 719 H LEU 99 H LEU 99 5.147 31.756 2.176 720 HA LEU 99 HA LEU 99 4.153 30.947 -0.264 721 HB2 LEU 99 HB2 LEU 99 3.909 33.117 0.983 722 HB3 LEU 99 HB1 LEU 99 5.607 33.545 0.495 723 HG LEU 99 HG LEU 99 4.673 33.536 -1.853 724 HD11 LEU 99 1HD1 LEU 99 2.951 32.140 -1.920 725 HD12 LEU 99 2HD1 LEU 99 2.165 32.768 -0.459 726 HD13 LEU 99 3HD1 LEU 99 2.177 33.712 -2.047 727 HD21 LEU 99 3HD2 LEU 99 3.300 35.322 0.208 728 HD22 LEU 99 1HD2 LEU 99 4.861 35.500 -0.803 729 HD23 LEU 99 2HD2 LEU 99 3.290 35.517 -1.614 730 H GLY 100 H GLY 100 5.186 31.137 -2.567 731 HA2 GLY 100 HA2 GLY 100 7.811 30.334 -2.559 732 HA3 GLY 100 HA1 GLY 100 6.789 30.676 -3.994 733 H ASP 101 H ASP 101 7.378 33.241 -1.725 734 HA ASP 101 HA ASP 101 8.677 34.860 -3.683 735 HB2 ASP 101 HB2 ASP 101 6.673 35.532 -2.353 736 HB3 ASP 101 HB1 ASP 101 7.790 35.618 -0.859 737 H VAL 102 H VAL 102 10.084 33.070 -3.390 738 HA VAL 102 HA VAL 102 12.545 34.006 -2.115 739 HB VAL 102 HB VAL 102 13.061 31.405 -2.410 740 HG11 VAL 102 1HG1 VAL 102 11.279 32.557 -0.221 741 HG12 VAL 102 2HG1 VAL 102 12.330 31.068 -0.216 742 HG13 VAL 102 3HG1 VAL 102 13.120 32.528 -0.343 743 HG21 VAL 102 3HG2 VAL 102 11.270 29.942 -2.022 744 HG22 VAL 102 1HG2 VAL 102 10.103 31.241 -1.980 745 HG23 VAL 102 2HG2 VAL 102 10.905 30.895 -3.504 746 H VAL 103 H VAL 103 14.544 32.819 -5.175 747 HA VAL 103 HA VAL 103 14.719 32.364 -2.377 748 HB VAL 103 HB VAL 103 16.729 33.560 -4.241 749 HG11 VAL 103 1HG1 VAL 103 18.462 32.285 -2.814 750 HG12 VAL 103 2HG1 VAL 103 17.900 33.934 -2.422 751 HG13 VAL 103 3HG1 VAL 103 17.372 32.336 -1.590 752 HG21 VAL 103 3HG2 VAL 103 17.626 31.203 -4.364 753 HG22 VAL 103 1HG2 VAL 103 15.972 30.781 -3.749 754 HG23 VAL 103 2HG2 VAL 103 16.237 31.631 -5.293 755 H ASN 104 H ASN 104 15.246 33.946 -0.704 756 HA ASN 104 HA ASN 104 14.286 36.640 -0.944 757 HB2 ASN 104 HB2 ASN 104 13.916 35.401 0.997 758 HB3 ASN 104 HB1 ASN 104 15.573 35.088 1.364 759 HD21 ASN 104 1HD2 ASN 104 14.871 36.179 3.538 760 HD22 ASN 104 2HD2 ASN 104 14.838 37.857 3.572 761 H ILE 105 H ILE 105 15.557 38.260 -1.823 762 HA ILE 105 HA ILE 105 18.471 38.339 -1.142 763 HB ILE 105 HB ILE 105 18.912 39.829 -2.858 764 HG12 ILE 105 2HG1 ILE 105 16.046 39.593 -3.776 765 HG13 ILE 105 1HG1 ILE 105 16.558 40.966 -2.690 766 HG21 ILE 105 1HG2 ILE 105 18.463 38.381 -4.806 767 HG22 ILE 105 2HG2 ILE 105 19.045 37.533 -3.453 768 HG23 ILE 105 3HG2 ILE 105 17.238 37.566 -3.777 769 HD11 ILE 105 HD3 ILE 105 18.336 41.255 -4.595 770 HD12 ILE 105 HD1 ILE 105 17.344 40.124 -5.563 771 HD13 ILE 105 HD2 ILE 105 16.686 41.724 -5.023 772 H LYS 106 H LYS 106 15.836 39.694 0.304 773 HA LYS 106 HA LYS 106 17.177 42.035 1.353 774 HB2 LYS 106 HB2 LYS 106 14.869 41.832 1.377 775 HB3 LYS 106 HB1 LYS 106 14.895 40.380 2.356 776 HG2 LYS 106 HG2 LYS 106 15.503 41.491 4.304 777 HG3 LYS 106 HG1 LYS 106 15.836 43.057 3.351 778 HD2 LYS 106 HD2 LYS 106 13.635 43.458 3.021 779 HD3 LYS 106 HD1 LYS 106 13.090 41.868 3.571 780 HE2 LYS 106 HE2 LYS 106 13.639 42.394 5.797 781 HE3 LYS 106 HE1 LYS 106 14.739 43.718 5.496 782 HZ1 LYS 106 HZ1 LYS 106 11.862 43.541 5.144 783 HZ2 LYS 106 HZ2 LYS 106 12.732 44.476 6.217 784 HZ3 LYS 106 HZ3 LYS 106 12.659 44.917 4.698 785 H GLU 107 H GLU 107 17.394 38.604 1.740 786 HA GLU 107 HA GLU 107 19.167 38.551 4.020 787 HB2 GLU 107 HB2 GLU 107 17.870 36.599 3.207 788 HB3 GLU 107 HB1 GLU 107 19.090 36.425 1.847 789 HG2 GLU 107 HG2 GLU 107 20.864 36.090 3.332 790 HG3 GLU 107 HG1 GLU 107 19.851 36.429 4.754 791 H GLY 108 H GLY 108 19.657 38.845 0.442 792 HA2 GLY 108 HA2 GLY 108 21.816 40.285 0.262 793 HA3 GLY 108 HA1 GLY 108 22.607 38.755 0.687 794 H LYS 109 H LYS 109 22.701 40.318 -1.664 795 HA LYS 109 HA LYS 109 21.299 39.239 -3.877 796 HB2 LYS 109 HB2 LYS 109 23.240 40.275 -5.148 797 HB3 LYS 109 HB1 LYS 109 22.621 41.421 -3.932 798 HG2 LYS 109 HG2 LYS 109 24.409 41.000 -2.385 799 HG3 LYS 109 HG1 LYS 109 25.066 39.763 -3.418 800 HD2 LYS 109 HD2 LYS 109 26.419 41.705 -3.725 801 HD3 LYS 109 HD1 LYS 109 25.270 41.624 -5.145 802 HE2 LYS 109 HE2 LYS 109 23.723 43.152 -3.972 803 HE3 LYS 109 HE1 LYS 109 24.917 43.164 -2.653 804 HZ1 LYS 109 HZ1 LYS 109 26.469 44.276 -4.264 805 HZ2 LYS 109 HZ2 LYS 109 25.391 44.012 -5.534 806 HZ3 LYS 109 HZ3 LYS 109 24.937 44.971 -4.457 807 H LYS 110 H LYS 110 21.526 37.571 -5.186 808 HA LYS 110 HA LYS 110 23.215 35.462 -4.025 809 HB2 LYS 110 HB2 LYS 110 20.831 35.162 -4.484 810 HB3 LYS 110 HB1 LYS 110 21.155 35.132 -6.189 811 HG2 LYS 110 HG2 LYS 110 22.775 33.180 -5.834 812 HG3 LYS 110 HG1 LYS 110 22.365 33.216 -4.108 813 HD2 LYS 110 HD2 LYS 110 20.025 32.786 -4.414 814 HD3 LYS 110 HD1 LYS 110 20.285 32.717 -6.187 815 HE2 LYS 110 HE2 LYS 110 21.594 30.922 -4.062 816 HE3 LYS 110 HE1 LYS 110 20.182 30.475 -5.043 817 HZ1 LYS 110 HZ1 LYS 110 21.358 30.769 -6.911 818 HZ2 LYS 110 HZ2 LYS 110 22.815 30.911 -6.187 819 HZ3 LYS 110 HZ3 LYS 110 21.895 29.510 -5.996 820 H LEU 111 H LEU 111 24.957 36.699 -4.902 821 HA LEU 111 HA LEU 111 26.543 35.763 -6.924 822 HB2 LEU 111 HB2 LEU 111 26.476 37.726 -8.626 823 HB3 LEU 111 HB1 LEU 111 25.298 36.502 -8.688 824 HG LEU 111 HG LEU 111 23.698 38.208 -7.584 825 HD11 LEU 111 1HD1 LEU 111 25.143 39.374 -6.355 826 HD12 LEU 111 2HD1 LEU 111 26.084 39.973 -7.641 827 HD13 LEU 111 3HD1 LEU 111 24.279 40.520 -7.493 828 HD21 LEU 111 3HD2 LEU 111 25.187 39.126 -10.038 829 HD22 LEU 111 1HD2 LEU 111 23.895 37.922 -10.087 830 HD23 LEU 111 2HD2 LEU 111 23.501 39.555 -9.729 831 H GLU 112 H GLU 112 28.384 37.684 -7.563 832 HA GLU 112 HA GLU 112 29.199 38.743 -5.131 833 HB2 GLU 112 HB2 GLU 112 28.838 36.134 -4.651 834 HB3 GLU 112 HB1 GLU 112 30.230 35.909 -5.645 835 HG2 GLU 112 HG2 GLU 112 31.437 37.495 -3.861 836 HG3 GLU 112 HG1 GLU 112 29.874 37.420 -3.008 837 H HIS 113 H HIS 113 31.464 37.016 -7.114 838 HA HIS 113 HA HIS 113 32.944 39.493 -7.174 839 HB2 HIS 113 HB2 HIS 113 34.568 38.170 -8.496 840 HB3 HIS 113 HB1 HIS 113 34.154 37.264 -7.062 841 HD2 HIS 113 HD2 HIS 113 34.374 36.996 -10.725 842 HE1 HIS 113 HE1 HIS 113 31.514 34.065 -9.859 843 HE2 HIS 113 HE2 HIS 113 33.200 34.873 -11.603 844 H HIS 114 H HIS 114 30.619 38.127 -9.153 845 HA HIS 114 HA HIS 114 30.800 38.720 -11.662 846 HB2 HIS 114 HB2 HIS 114 28.255 39.499 -10.220 847 HB3 HIS 114 HB1 HIS 114 28.482 38.984 -11.827 848 HD2 HIS 114 HD2 HIS 114 27.258 36.843 -12.126 849 HE1 HIS 114 HE1 HIS 114 28.854 34.652 -8.873 850 HE2 HIS 114 HE2 HIS 114 27.212 34.613 -10.732 Start of MODEL 4 1 H1 GLU 13 H1 GLU 13 8.360 -13.349 8.527 2 H2 GLU 13 H2 GLU 13 8.127 -13.364 10.035 3 H3 GLU 13 H3 GLU 13 9.294 -14.314 9.457 4 HA GLU 13 HA GLU 13 6.357 -14.583 8.735 5 HB2 GLU 13 HB2 GLU 13 8.344 -15.532 7.326 6 HB3 GLU 13 HB1 GLU 13 8.429 -16.721 8.670 7 HG2 GLU 13 HG2 GLU 13 6.101 -17.405 7.944 8 HG3 GLU 13 HG1 GLU 13 5.882 -16.187 6.845 9 H ASN 14 H ASN 14 8.863 -16.117 11.104 10 HA ASN 14 HA ASN 14 6.872 -17.693 12.181 11 HB2 ASN 14 HB2 ASN 14 9.731 -16.999 12.747 12 HB3 ASN 14 HB1 ASN 14 8.821 -17.842 13.864 13 HD21 ASN 14 1HD2 ASN 14 9.621 -19.939 13.668 14 HD22 ASN 14 2HD2 ASN 14 9.251 -21.019 12.411 15 H ALA 15 H ALA 15 7.799 -14.413 13.187 16 HA ALA 15 HA ALA 15 6.334 -14.578 15.632 17 HB1 ALA 15 HB1 ALA 15 8.486 -13.340 15.412 18 HB2 ALA 15 HB2 ALA 15 7.759 -12.270 14.178 19 HB3 ALA 15 HB3 ALA 15 7.314 -12.223 15.925 20 H GLU 16 H GLU 16 4.863 -12.491 16.076 21 HA GLU 16 HA GLU 16 2.960 -12.056 14.006 22 HB2 GLU 16 HB2 GLU 16 2.638 -12.515 16.614 23 HB3 GLU 16 HB1 GLU 16 3.214 -10.931 16.830 24 HG2 GLU 16 HG2 GLU 16 1.411 -10.019 15.274 25 HG3 GLU 16 HG1 GLU 16 0.838 -11.670 15.125 26 H LEU 17 H LEU 17 5.718 -10.686 15.619 27 HA LEU 17 HA LEU 17 5.382 -8.060 14.521 28 HB2 LEU 17 HB2 LEU 17 7.199 -9.596 16.220 29 HB3 LEU 17 HB1 LEU 17 7.868 -8.067 15.536 30 HG LEU 17 HG LEU 17 6.839 -7.875 17.838 31 HD11 LEU 17 1HD1 LEU 17 5.519 -6.225 15.662 32 HD12 LEU 17 2HD1 LEU 17 5.771 -5.688 17.341 33 HD13 LEU 17 3HD1 LEU 17 7.111 -6.011 16.274 34 HD21 LEU 17 3HD2 LEU 17 4.132 -8.149 16.501 35 HD22 LEU 17 1HD2 LEU 17 4.922 -9.442 17.377 36 HD23 LEU 17 2HD2 LEU 17 4.466 -7.865 18.182 37 H GLU 18 H GLU 18 6.910 -6.869 13.237 38 HA GLU 18 HA GLU 18 8.870 -8.332 11.757 39 HB2 GLU 18 HB2 GLU 18 6.810 -8.441 10.394 40 HB3 GLU 18 HB1 GLU 18 6.819 -6.676 10.421 41 HG2 GLU 18 HG2 GLU 18 7.867 -7.727 8.345 42 HG3 GLU 18 HG1 GLU 18 9.030 -6.651 9.183 43 H ILE 19 H ILE 19 10.859 -7.122 11.459 44 HA ILE 19 HA ILE 19 10.600 -4.148 11.942 45 HB ILE 19 HB ILE 19 12.887 -4.279 12.398 46 HG12 ILE 19 2HG1 ILE 19 12.865 -7.351 12.314 47 HG13 ILE 19 1HG1 ILE 19 13.635 -6.216 11.286 48 HG21 ILE 19 1HG2 ILE 19 11.322 -6.348 14.088 49 HG22 ILE 19 2HG2 ILE 19 12.650 -5.333 14.668 50 HG23 ILE 19 3HG2 ILE 19 11.224 -4.493 14.207 51 HD11 ILE 19 HD3 ILE 19 15.142 -5.536 13.141 52 HD12 ILE 19 HD1 ILE 19 14.315 -6.726 14.220 53 HD13 ILE 19 HD2 ILE 19 15.112 -7.300 12.777 54 H VAL 20 H VAL 20 10.971 -6.363 9.383 55 HA VAL 20 HA VAL 20 12.857 -4.669 7.859 56 HB VAL 20 HB VAL 20 11.498 -7.297 7.618 57 HG11 VAL 20 1HG1 VAL 20 12.551 -7.744 5.424 58 HG12 VAL 20 2HG1 VAL 20 11.371 -6.459 5.358 59 HG13 VAL 20 3HG1 VAL 20 13.167 -6.055 5.395 60 HG21 VAL 20 3HG2 VAL 20 14.351 -6.316 7.750 61 HG22 VAL 20 1HG2 VAL 20 13.590 -7.405 8.876 62 HG23 VAL 20 2HG2 VAL 20 14.085 -7.945 7.308 63 H THR 21 H THR 21 9.508 -5.884 7.498 64 HA THR 21 HA THR 21 9.552 -5.021 4.917 65 HB THR 21 HB THR 21 7.054 -5.553 4.808 66 HG1 THR 21 HG1 THR 21 6.160 -6.450 6.750 67 HG21 THR 21 1HG2 THR 21 8.832 -7.730 6.142 68 HG22 THR 21 2HG2 THR 21 7.173 -8.040 5.577 69 HG23 THR 21 3HG2 THR 21 8.498 -7.461 4.499 70 H ASP 22 H ASP 22 8.164 -3.182 7.580 71 HA ASP 22 HA ASP 22 7.306 -1.405 7.919 72 HB2 ASP 22 HB2 ASP 22 9.120 -0.753 6.339 73 HB3 ASP 22 HB1 ASP 22 7.821 -0.131 5.310 74 H TYR 23 H TYR 23 6.110 -3.659 6.262 75 HA TYR 23 HA TYR 23 3.365 -2.528 5.633 76 HB2 TYR 23 HB2 TYR 23 4.771 -3.725 3.870 77 HB3 TYR 23 HB1 TYR 23 4.686 -5.167 4.720 78 HD1 TYR 23 HD1 TYR 23 2.845 -2.789 2.817 79 HD2 TYR 23 HD2 TYR 23 2.721 -6.503 4.925 80 HE1 TYR 23 HE1 TYR 23 0.810 -3.488 1.506 81 HE2 TYR 23 HE2 TYR 23 0.473 -7.084 3.778 82 HH TYR 23 HH TYR 23 -0.797 -5.093 1.117 83 H TYR 24 H TYR 24 3.931 -2.282 8.026 84 HA TYR 24 HA TYR 24 2.933 -4.491 9.555 85 HB2 TYR 24 HB2 TYR 24 3.424 -1.672 10.462 86 HB3 TYR 24 HB1 TYR 24 3.341 -3.046 11.439 87 HD1 TYR 24 HD1 TYR 24 5.235 -4.838 9.598 88 HD2 TYR 24 HD2 TYR 24 5.606 -0.961 11.378 89 HE1 TYR 24 HE1 TYR 24 7.662 -4.917 9.151 90 HE2 TYR 24 HE2 TYR 24 7.997 -1.048 10.932 91 HH TYR 24 HH TYR 24 9.644 -1.911 9.571 92 H LYS 25 H LYS 25 1.354 -2.967 11.478 93 HA LYS 25 HA LYS 25 -1.291 -3.606 10.450 94 HB2 LYS 25 HB2 LYS 25 -0.390 -2.296 12.935 95 HB3 LYS 25 HB1 LYS 25 -1.997 -2.670 12.493 96 HG2 LYS 25 HG2 LYS 25 -1.310 -5.254 12.288 97 HG3 LYS 25 HG1 LYS 25 0.335 -4.722 12.707 98 HD2 LYS 25 HD2 LYS 25 -0.820 -3.892 14.875 99 HD3 LYS 25 HD1 LYS 25 -2.294 -4.492 14.429 100 HE2 LYS 25 HE2 LYS 25 -1.427 -6.873 14.407 101 HE3 LYS 25 HE1 LYS 25 0.117 -6.281 14.577 102 HZ1 LYS 25 HZ1 LYS 25 -0.745 -5.097 16.642 103 HZ2 LYS 25 HZ2 LYS 25 -1.933 -6.090 16.711 104 HZ3 LYS 25 HZ3 LYS 25 -0.406 -6.694 16.813 105 H ILE 26 H ILE 26 0.447 -0.716 9.935 106 HA ILE 26 HA ILE 26 -1.769 1.017 9.465 107 HB ILE 26 HB ILE 26 -0.440 1.889 7.734 108 HG12 ILE 26 2HG1 ILE 26 1.956 0.372 8.755 109 HG13 ILE 26 1HG1 ILE 26 1.037 -0.347 7.484 110 HG21 ILE 26 1HG2 ILE 26 0.827 1.790 10.534 111 HG22 ILE 26 2HG2 ILE 26 1.285 2.811 9.232 112 HG23 ILE 26 3HG2 ILE 26 -0.422 2.878 9.797 113 HD11 ILE 26 HD3 ILE 26 2.297 2.322 7.158 114 HD12 ILE 26 HD1 ILE 26 3.097 0.708 6.816 115 HD13 ILE 26 HD2 ILE 26 1.666 1.311 5.882 116 H ILE 27 H ILE 27 -0.951 -1.984 7.687 117 HA ILE 27 HA ILE 27 -3.211 -1.570 6.045 118 HB ILE 27 HB ILE 27 -1.549 -0.419 4.683 119 HG12 ILE 27 2HG1 ILE 27 -1.528 -1.971 2.632 120 HG13 ILE 27 1HG1 ILE 27 -2.091 -3.202 3.503 121 HG21 ILE 27 1HG2 ILE 27 0.459 -1.404 3.887 122 HG22 ILE 27 2HG2 ILE 27 0.545 -1.398 5.621 123 HG23 ILE 27 3HG2 ILE 27 0.205 -2.927 4.778 124 HD11 ILE 27 HD3 ILE 27 -3.574 -0.468 3.338 125 HD12 ILE 27 HD1 ILE 27 -3.856 -1.845 2.221 126 HD13 ILE 27 HD2 ILE 27 -4.182 -1.975 3.929 127 H LYS 28 H LYS 28 -0.768 -3.871 7.232 128 HA LYS 28 HA LYS 28 -1.820 -5.918 5.961 129 HB2 LYS 28 HB2 LYS 28 0.370 -5.754 7.141 130 HB3 LYS 28 HB1 LYS 28 -0.370 -6.021 8.642 131 HG2 LYS 28 HG2 LYS 28 -1.260 -8.290 7.803 132 HG3 LYS 28 HG1 LYS 28 -0.606 -7.895 6.213 133 HD2 LYS 28 HD2 LYS 28 1.696 -7.864 7.070 134 HD3 LYS 28 HD1 LYS 28 1.044 -8.156 8.713 135 HE2 LYS 28 HE2 LYS 28 -0.023 -10.115 7.926 136 HE3 LYS 28 HE1 LYS 28 0.735 -9.976 6.304 137 HZ1 LYS 28 HZ1 LYS 28 2.331 -10.291 8.703 138 HZ2 LYS 28 HZ2 LYS 28 1.634 -11.550 7.953 139 HZ3 LYS 28 HZ3 LYS 28 2.787 -10.638 7.142 140 H THR 29 H THR 29 -2.831 -4.978 9.274 141 HA THR 29 HA THR 29 -4.852 -7.006 9.619 142 HB THR 29 HB THR 29 -5.538 -5.157 11.338 143 HG1 THR 29 HG1 THR 29 -3.991 -3.651 11.709 144 HG21 THR 29 1HG2 THR 29 -4.493 -6.934 12.334 145 HG22 THR 29 2HG2 THR 29 -2.896 -6.766 11.607 146 HG23 THR 29 3HG2 THR 29 -3.490 -5.630 12.848 147 H ALA 30 H ALA 30 -4.780 -3.631 8.387 148 HA ALA 30 HA ALA 30 -7.334 -3.422 8.218 149 HB1 ALA 30 HB1 ALA 30 -6.833 -1.498 6.797 150 HB2 ALA 30 HB2 ALA 30 -5.677 -1.576 8.142 151 HB3 ALA 30 HB3 ALA 30 -5.218 -2.029 6.484 152 H ARG 31 H ARG 31 -5.415 -4.437 5.435 153 HA ARG 31 HA ARG 31 -7.560 -4.672 3.575 154 HB2 ARG 31 HB2 ARG 31 -6.084 -6.349 2.421 155 HB3 ARG 31 HB1 ARG 31 -5.163 -4.870 2.952 156 HG2 ARG 31 HG2 ARG 31 -4.240 -6.134 4.769 157 HG3 ARG 31 HG1 ARG 31 -5.293 -7.453 4.498 158 HD2 ARG 31 HD2 ARG 31 -4.339 -7.913 2.349 159 HD3 ARG 31 HD1 ARG 31 -3.049 -6.640 2.692 160 HE ARG 31 HE ARG 31 -3.180 -8.752 4.759 161 HH11 ARG 31 1HH2 ARG 31 -1.791 -7.939 1.510 162 HH12 ARG 31 2HH2 ARG 31 -0.404 -8.964 1.866 163 HH21 ARG 31 1HH1 ARG 31 -1.388 -9.729 5.002 164 HH22 ARG 31 2HH1 ARG 31 -0.147 -10.007 3.774 165 H GLU 32 H GLU 32 -6.626 -7.321 6.073 166 HA GLU 32 HA GLU 32 -8.808 -8.679 5.580 167 HB2 GLU 32 HB2 GLU 32 -7.023 -8.376 8.037 168 HB3 GLU 32 HB1 GLU 32 -8.445 -9.375 8.027 169 HG2 GLU 32 HG2 GLU 32 -7.515 -10.384 5.729 170 HG3 GLU 32 HG1 GLU 32 -6.079 -9.454 6.123 171 H GLN 33 H GLN 33 -8.882 -5.790 8.013 172 HA GLN 33 HA GLN 33 -11.566 -6.473 8.655 173 HB2 GLN 33 HB2 GLN 33 -9.862 -4.062 9.171 174 HB3 GLN 33 HB1 GLN 33 -11.597 -4.355 9.724 175 HG2 GLN 33 HG2 GLN 33 -10.959 -6.430 10.853 176 HG3 GLN 33 HG1 GLN 33 -9.253 -6.140 10.401 177 HE21 GLN 33 1HE2 GLN 33 -11.862 -4.032 12.042 178 HE22 GLN 33 2HE2 GLN 33 -10.697 -3.333 13.115 179 H LEU 34 H LEU 34 -10.490 -5.091 5.671 180 HA LEU 34 HA LEU 34 -12.919 -3.661 5.219 181 HB2 LEU 34 HB2 LEU 34 -10.381 -4.229 3.655 182 HB3 LEU 34 HB1 LEU 34 -11.854 -3.436 3.025 183 HG LEU 34 HG LEU 34 -10.032 -2.476 5.261 184 HD11 LEU 34 1HD1 LEU 34 -10.012 -1.608 2.403 185 HD12 LEU 34 2HD1 LEU 34 -8.917 -0.982 3.735 186 HD13 LEU 34 3HD1 LEU 34 -8.846 -2.646 3.083 187 HD21 LEU 34 3HD2 LEU 34 -11.209 -0.269 4.860 188 HD22 LEU 34 1HD2 LEU 34 -12.358 -1.089 3.760 189 HD23 LEU 34 2HD2 LEU 34 -12.219 -1.591 5.428 190 H GLY 35 H GLY 35 -11.844 -6.863 4.981 191 HA2 GLY 35 HA2 GLY 35 -12.333 -8.744 3.832 192 HA3 GLY 35 HA1 GLY 35 -13.999 -7.989 3.652 193 H ILE 36 H ILE 36 -12.289 -5.853 2.014 194 HA ILE 36 HA ILE 36 -13.194 -6.863 -0.463 195 HB ILE 36 HB ILE 36 -12.227 -4.866 -1.352 196 HG12 ILE 36 2HG1 ILE 36 -11.003 -4.150 1.295 197 HG13 ILE 36 1HG1 ILE 36 -10.131 -4.671 -0.044 198 HG21 ILE 36 1HG2 ILE 36 -14.381 -4.921 0.092 199 HG22 ILE 36 2HG2 ILE 36 -13.470 -3.746 1.082 200 HG23 ILE 36 3HG2 ILE 36 -13.727 -3.500 -0.736 201 HD11 ILE 36 HD3 ILE 36 -9.775 -2.592 -0.260 202 HD12 ILE 36 HD1 ILE 36 -11.315 -2.528 -1.231 203 HD13 ILE 36 HD2 ILE 36 -11.385 -2.193 0.543 204 H SER 37 H SER 37 -11.985 -6.611 -2.435 205 HA SER 37 HA SER 37 -9.875 -8.675 -2.578 206 HB2 SER 37 HB2 SER 37 -10.360 -8.914 -4.801 207 HB3 SER 37 HB1 SER 37 -11.883 -8.568 -3.985 208 HG SER 37 HG SER 37 -11.712 -7.420 -5.876 209 H GLN 38 H GLN 38 -7.964 -8.422 -4.052 210 HA GLN 38 HA GLN 38 -6.685 -5.830 -3.799 211 HB2 GLN 38 HB2 GLN 38 -5.640 -8.095 -5.539 212 HB3 GLN 38 HB1 GLN 38 -4.728 -6.813 -4.939 213 HG2 GLN 38 HG2 GLN 38 -4.149 -8.483 -3.607 214 HG3 GLN 38 HG1 GLN 38 -5.066 -7.376 -2.584 215 HE21 GLN 38 1HE2 GLN 38 -5.526 -10.407 -4.705 216 HE22 GLN 38 2HE2 GLN 38 -6.687 -11.132 -3.604 217 H GLN 39 H GLN 39 -8.941 -6.986 -6.060 218 HA GLN 39 HA GLN 39 -7.987 -4.960 -7.854 219 HB2 GLN 39 HB2 GLN 39 -10.541 -6.672 -7.770 220 HB3 GLN 39 HB1 GLN 39 -10.471 -5.429 -8.947 221 HG2 GLN 39 HG2 GLN 39 -8.488 -6.458 -10.019 222 HG3 GLN 39 HG1 GLN 39 -8.321 -7.569 -8.653 223 HE21 GLN 39 1HE2 GLN 39 -8.379 -8.412 -11.505 224 HE22 GLN 39 2HE2 GLN 39 -9.704 -9.424 -11.499 225 H GLN 40 H GLN 40 -10.183 -5.101 -5.142 226 HA GLN 40 HA GLN 40 -11.277 -2.309 -5.598 227 HB2 GLN 40 HB2 GLN 40 -11.437 -4.363 -3.411 228 HB3 GLN 40 HB1 GLN 40 -12.408 -2.825 -3.470 229 HG2 GLN 40 HG2 GLN 40 -13.701 -3.661 -5.270 230 HG3 GLN 40 HG1 GLN 40 -12.692 -5.113 -5.456 231 HE21 GLN 40 1HE2 GLN 40 -15.177 -3.623 -3.326 232 HE22 GLN 40 2HE2 GLN 40 -15.393 -4.991 -2.328 233 H LEU 41 H LEU 41 -8.689 -3.779 -3.635 234 HA LEU 41 HA LEU 41 -8.237 -1.583 -2.095 235 HB2 LEU 41 HB2 LEU 41 -7.878 -3.910 -1.697 236 HB3 LEU 41 HB1 LEU 41 -6.471 -3.914 -2.925 237 HG LEU 41 HG LEU 41 -5.448 -2.274 -1.258 238 HD11 LEU 41 1HD1 LEU 41 -6.106 -2.610 1.171 239 HD12 LEU 41 2HD1 LEU 41 -7.263 -1.718 0.235 240 HD13 LEU 41 3HD1 LEU 41 -7.598 -3.389 0.586 241 HD21 LEU 41 3HD2 LEU 41 -4.829 -4.816 -1.652 242 HD22 LEU 41 1HD2 LEU 41 -4.763 -4.510 0.057 243 HD23 LEU 41 2HD2 LEU 41 -6.180 -5.221 -0.700 244 H ALA 42 H ALA 42 -7.024 -2.541 -5.407 245 HA ALA 42 HA ALA 42 -4.760 -0.795 -5.429 246 HB1 ALA 42 HB1 ALA 42 -6.416 -2.045 -7.702 247 HB2 ALA 42 HB2 ALA 42 -4.853 -1.218 -7.802 248 HB3 ALA 42 HB3 ALA 42 -5.189 -2.832 -6.968 249 H GLN 43 H GLN 43 -8.261 -0.328 -6.086 250 HA GLN 43 HA GLN 43 -8.075 2.362 -6.961 251 HB2 GLN 43 HB2 GLN 43 -10.294 0.950 -5.436 252 HB3 GLN 43 HB1 GLN 43 -10.304 2.437 -6.434 253 HG2 GLN 43 HG2 GLN 43 -9.795 0.858 -8.468 254 HG3 GLN 43 HG1 GLN 43 -9.641 -0.388 -7.361 255 HE21 GLN 43 1HE2 GLN 43 -11.195 -1.785 -8.293 256 HE22 GLN 43 2HE2 GLN 43 -12.867 -1.282 -8.337 257 H LYS 44 H LYS 44 -8.396 0.932 -3.618 258 HA LYS 44 HA LYS 44 -8.661 3.632 -2.497 259 HB2 LYS 44 HB2 LYS 44 -7.777 0.922 -1.456 260 HB3 LYS 44 HB1 LYS 44 -8.182 2.360 -0.416 261 HG2 LYS 44 HG2 LYS 44 -10.297 0.673 -1.530 262 HG3 LYS 44 HG1 LYS 44 -9.889 1.119 0.054 263 HD2 LYS 44 HD2 LYS 44 -10.488 3.447 -0.487 264 HD3 LYS 44 HD1 LYS 44 -10.965 2.795 -2.206 265 HE2 LYS 44 HE2 LYS 44 -12.540 1.241 -0.814 266 HE3 LYS 44 HE1 LYS 44 -12.024 2.253 0.567 267 HZ1 LYS 44 HZ1 LYS 44 -12.911 4.049 -0.342 268 HZ2 LYS 44 HZ2 LYS 44 -13.394 3.528 -1.718 269 HZ3 LYS 44 HZ3 LYS 44 -14.185 3.056 -0.341 270 H LEU 45 H LEU 45 -5.947 1.779 -3.282 271 HA LEU 45 HA LEU 45 -4.434 3.436 -1.527 272 HB2 LEU 45 HB2 LEU 45 -3.652 1.069 -3.118 273 HB3 LEU 45 HB1 LEU 45 -2.489 1.978 -2.040 274 HG LEU 45 HG LEU 45 -5.036 0.612 -1.170 275 HD11 LEU 45 1HD1 LEU 45 -2.204 -0.358 -0.640 276 HD12 LEU 45 2HD1 LEU 45 -3.780 -1.127 -0.244 277 HD13 LEU 45 3HD1 LEU 45 -3.198 -0.994 -1.906 278 HD21 LEU 45 3HD2 LEU 45 -4.409 2.508 0.317 279 HD22 LEU 45 1HD2 LEU 45 -4.338 0.957 1.110 280 HD23 LEU 45 2HD2 LEU 45 -2.823 1.656 0.513 281 H LYS 46 H LYS 46 -5.224 3.831 -4.772 282 HA LYS 46 HA LYS 46 -4.531 4.908 -6.512 283 HB2 LYS 46 HB2 LYS 46 -2.707 6.527 -4.853 284 HB3 LYS 46 HB1 LYS 46 -3.155 6.748 -6.541 285 HG2 LYS 46 HG2 LYS 46 -4.258 8.160 -5.543 286 HG3 LYS 46 HG1 LYS 46 -5.444 6.863 -6.068 287 HD2 LYS 46 HD2 LYS 46 -5.750 6.223 -3.615 288 HD3 LYS 46 HD1 LYS 46 -4.396 7.248 -3.186 289 HE2 LYS 46 HE2 LYS 46 -5.414 9.207 -3.798 290 HE3 LYS 46 HE1 LYS 46 -7.085 8.457 -4.012 291 HZ1 LYS 46 HZ1 LYS 46 -5.284 8.467 -1.747 292 HZ2 LYS 46 HZ2 LYS 46 -6.715 9.204 -1.738 293 HZ3 LYS 46 HZ3 LYS 46 -6.736 7.618 -1.801 294 H VAL 47 H VAL 47 -1.940 3.201 -4.814 295 HA VAL 47 HA VAL 47 -0.472 2.886 -7.062 296 HB VAL 47 HB VAL 47 0.976 1.570 -5.785 297 HG11 VAL 47 1HG1 VAL 47 0.013 3.650 -3.893 298 HG12 VAL 47 2HG1 VAL 47 1.637 2.966 -4.258 299 HG13 VAL 47 3HG1 VAL 47 0.838 3.993 -5.417 300 HG21 VAL 47 3HG2 VAL 47 -0.088 0.017 -4.577 301 HG22 VAL 47 1HG2 VAL 47 0.287 1.280 -3.272 302 HG23 VAL 47 2HG2 VAL 47 -1.347 1.204 -3.947 303 H SER 48 H SER 48 0.356 0.488 -7.763 304 HA SER 48 HA SER 48 -1.877 -1.302 -8.325 305 HB2 SER 48 HB2 SER 48 -0.093 -2.587 -9.253 306 HB3 SER 48 HB1 SER 48 -0.116 -1.070 -9.917 307 HG SER 48 HG SER 48 1.663 -0.471 -8.596 308 H GLU 49 H GLU 49 -1.790 -3.671 -7.967 309 HA GLU 49 HA GLU 49 -1.370 -4.234 -5.089 310 HB2 GLU 49 HB2 GLU 49 -2.265 -6.359 -5.514 311 HB3 GLU 49 HB1 GLU 49 -3.263 -5.213 -6.309 312 HG2 GLU 49 HG2 GLU 49 -2.063 -5.608 -8.544 313 HG3 GLU 49 HG1 GLU 49 -1.088 -6.812 -7.735 314 H ASN 50 H ASN 50 0.521 -4.527 -8.068 315 HA ASN 50 HA ASN 50 2.557 -6.012 -6.911 316 HB2 ASN 50 HB2 ASN 50 2.467 -5.743 -9.267 317 HB3 ASN 50 HB1 ASN 50 2.919 -4.022 -9.189 318 HD21 ASN 50 1HD2 ASN 50 4.808 -3.571 -9.334 319 HD22 ASN 50 2HD2 ASN 50 6.154 -4.680 -9.581 320 H ILE 51 H ILE 51 2.039 -2.419 -6.467 321 HA ILE 51 HA ILE 51 4.588 -2.279 -5.125 322 HB ILE 51 HB ILE 51 2.104 -0.511 -5.139 323 HG12 ILE 51 2HG1 ILE 51 3.678 -0.626 -7.144 324 HG13 ILE 51 1HG1 ILE 51 3.224 0.808 -6.565 325 HG21 ILE 51 1HG2 ILE 51 3.424 1.201 -3.954 326 HG22 ILE 51 2HG2 ILE 51 3.148 -0.243 -2.917 327 HG23 ILE 51 3HG2 ILE 51 4.673 -0.029 -3.587 328 HD11 ILE 51 HD3 ILE 51 5.406 1.279 -5.463 329 HD12 ILE 51 HD1 ILE 51 5.824 -0.475 -5.694 330 HD13 ILE 51 HD2 ILE 51 5.752 0.684 -7.039 331 H VAL 52 H VAL 52 1.154 -2.812 -4.131 332 HA VAL 52 HA VAL 52 1.427 -3.010 -1.449 333 HB VAL 52 HB VAL 52 -0.428 -4.339 -3.319 334 HG11 VAL 52 1HG1 VAL 52 -0.504 -5.830 -1.410 335 HG12 VAL 52 2HG1 VAL 52 -0.643 -4.270 -0.341 336 HG13 VAL 52 3HG1 VAL 52 -1.869 -4.745 -1.412 337 HG21 VAL 52 3HG2 VAL 52 -0.968 -2.164 -1.235 338 HG22 VAL 52 1HG2 VAL 52 -0.250 -1.716 -2.740 339 HG23 VAL 52 2HG2 VAL 52 -1.816 -2.502 -2.801 340 H LYS 53 H LYS 53 2.047 -5.735 -3.806 341 HA LYS 53 HA LYS 53 3.027 -7.670 -1.933 342 HB2 LYS 53 HB2 LYS 53 3.605 -6.946 -4.826 343 HB3 LYS 53 HB1 LYS 53 4.340 -8.348 -4.143 344 HG2 LYS 53 HG2 LYS 53 2.037 -9.302 -3.448 345 HG3 LYS 53 HG1 LYS 53 1.304 -7.901 -4.320 346 HD2 LYS 53 HD2 LYS 53 2.382 -8.473 -6.405 347 HD3 LYS 53 HD1 LYS 53 3.123 -9.929 -5.618 348 HE2 LYS 53 HE2 LYS 53 0.225 -9.350 -6.361 349 HE3 LYS 53 HE1 LYS 53 1.262 -10.540 -7.015 350 HZ1 LYS 53 HZ1 LYS 53 -0.272 -11.357 -5.169 351 HZ2 LYS 53 HZ2 LYS 53 1.305 -11.813 -5.071 352 HZ3 LYS 53 HZ3 LYS 53 0.729 -10.569 -4.209 353 H ARG 54 H ARG 54 4.750 -5.046 -3.793 354 HA ARG 54 HA ARG 54 7.166 -6.247 -3.190 355 HB2 ARG 54 HB2 ARG 54 6.380 -3.730 -4.402 356 HB3 ARG 54 HB1 ARG 54 8.040 -3.767 -3.582 357 HG2 ARG 54 HG2 ARG 54 8.534 -5.551 -5.168 358 HG3 ARG 54 HG1 ARG 54 6.848 -5.744 -5.652 359 HD2 ARG 54 HD2 ARG 54 7.056 -3.328 -6.562 360 HD3 ARG 54 HD1 ARG 54 8.732 -3.422 -6.025 361 HE ARG 54 HE ARG 54 7.958 -5.672 -7.673 362 HH11 ARG 54 1HH2 ARG 54 9.038 -2.363 -7.977 363 HH12 ARG 54 2HH2 ARG 54 9.188 -2.377 -9.691 364 HH21 ARG 54 1HH1 ARG 54 8.534 -5.968 -9.828 365 HH22 ARG 54 2HH1 ARG 54 9.383 -4.744 -10.646 366 H PHE 55 H PHE 55 5.359 -3.849 -1.390 367 HA PHE 55 HA PHE 55 7.234 -3.405 0.780 368 HB2 PHE 55 HB2 PHE 55 4.355 -3.196 0.580 369 HB3 PHE 55 HB1 PHE 55 5.295 -2.947 2.058 370 HD1 PHE 55 HD2 PHE 55 6.064 -1.582 -1.242 371 HD2 PHE 55 HD1 PHE 55 5.280 -0.657 2.826 372 HE1 PHE 55 HE2 PHE 55 6.401 0.780 -1.779 373 HE2 PHE 55 HE1 PHE 55 5.575 1.651 2.373 374 HZ PHE 55 HZ PHE 55 6.068 2.453 0.074 375 H GLU 56 H GLU 56 4.067 -5.633 1.059 376 HA GLU 56 HA GLU 56 4.770 -6.827 3.087 377 HB2 GLU 56 HB2 GLU 56 2.721 -7.157 1.725 378 HB3 GLU 56 HB1 GLU 56 3.625 -8.158 0.613 379 HG2 GLU 56 HG2 GLU 56 3.954 -9.827 2.666 380 HG3 GLU 56 HG1 GLU 56 3.151 -8.609 3.622 381 H SER 57 H SER 57 6.287 -7.712 -0.143 382 HA SER 57 HA SER 57 7.580 -10.074 1.132 383 HB2 SER 57 HB2 SER 57 8.252 -10.563 -1.172 384 HB3 SER 57 HB1 SER 57 6.673 -10.025 -1.231 385 HG SER 57 HG SER 57 7.686 -8.773 -2.672 386 H GLY 58 H GLY 58 8.472 -6.966 1.748 387 HA2 GLY 58 HA2 GLY 58 10.292 -6.430 3.042 388 HA3 GLY 58 HA1 GLY 58 10.889 -8.023 2.757 389 H LYS 59 H LYS 59 10.209 -6.485 -0.249 390 HA LYS 59 HA LYS 59 12.933 -6.065 -0.713 391 HB2 LYS 59 HB2 LYS 59 10.467 -6.575 -2.518 392 HB3 LYS 59 HB1 LYS 59 12.103 -6.259 -3.065 393 HG2 LYS 59 HG2 LYS 59 12.897 -8.322 -1.993 394 HG3 LYS 59 HG1 LYS 59 11.292 -8.565 -1.181 395 HD2 LYS 59 HD2 LYS 59 10.303 -8.644 -3.562 396 HD3 LYS 59 HD1 LYS 59 11.982 -8.210 -4.139 397 HE2 LYS 59 HE2 LYS 59 12.791 -10.322 -2.850 398 HE3 LYS 59 HE1 LYS 59 11.034 -10.684 -2.651 399 HZ1 LYS 59 HZ1 LYS 59 11.897 -11.865 -4.478 400 HZ2 LYS 59 HZ2 LYS 59 10.967 -10.694 -5.136 401 HZ3 LYS 59 HZ3 LYS 59 12.516 -10.474 -5.159 402 H LEU 60 H LEU 60 10.091 -4.150 -0.504 403 HA LEU 60 HA LEU 60 11.587 -1.788 -1.309 404 HB2 LEU 60 HB2 LEU 60 9.993 -2.609 -3.065 405 HB3 LEU 60 HB1 LEU 60 8.586 -2.330 -1.931 406 HG LEU 60 HG LEU 60 9.143 0.027 -1.885 407 HD11 LEU 60 1HD1 LEU 60 11.412 0.226 -2.493 408 HD12 LEU 60 2HD1 LEU 60 11.233 -0.615 -3.992 409 HD13 LEU 60 3HD1 LEU 60 10.438 0.986 -3.694 410 HD21 LEU 60 3HD2 LEU 60 8.483 -1.373 -4.542 411 HD22 LEU 60 1HD2 LEU 60 7.341 -1.047 -3.301 412 HD23 LEU 60 2HD2 LEU 60 7.961 0.338 -4.077 413 H LYS 61 H LYS 61 11.297 0.082 0.163 414 HA LYS 61 HA LYS 61 8.739 0.218 1.701 415 HB2 LYS 61 HB2 LYS 61 9.853 0.343 3.574 416 HB3 LYS 61 HB1 LYS 61 10.539 -0.892 2.782 417 HG2 LYS 61 HG2 LYS 61 12.465 0.383 2.175 418 HG3 LYS 61 HG1 LYS 61 11.774 1.884 2.883 419 HD2 LYS 61 HD2 LYS 61 13.379 0.798 4.433 420 HD3 LYS 61 HD1 LYS 61 11.616 0.890 5.032 421 HE2 LYS 61 HE2 LYS 61 11.436 -1.463 4.251 422 HE3 LYS 61 HE1 LYS 61 13.147 -1.545 3.976 423 HZ1 LYS 61 HZ1 LYS 61 12.530 -2.261 6.283 424 HZ2 LYS 61 HZ2 LYS 61 13.545 -0.945 6.316 425 HZ3 LYS 61 HZ3 LYS 61 11.954 -0.780 6.554 426 HA PRO 62 HA PRO 62 8.796 4.423 0.606 427 HB2 PRO 62 HB1 PRO 62 8.384 5.910 2.840 428 HB3 PRO 62 HB2 PRO 62 7.307 4.524 2.404 429 HG2 PRO 62 HG1 PRO 62 9.327 4.440 4.568 430 HG3 PRO 62 HG2 PRO 62 7.666 3.913 4.580 431 HD2 PRO 62 HD1 PRO 62 9.660 2.258 3.972 432 HD3 PRO 62 HD2 PRO 62 8.156 1.870 3.204 433 H THR 63 H THR 63 10.054 6.384 0.336 434 HA THR 63 HA THR 63 12.565 6.509 1.738 435 HB THR 63 HB THR 63 13.991 6.506 -0.146 436 HG1 THR 63 HG1 THR 63 12.961 5.731 -2.115 437 HG21 THR 63 1HG2 THR 63 13.653 4.441 1.021 438 HG22 THR 63 2HG2 THR 63 12.398 3.981 -0.153 439 HG23 THR 63 3HG2 THR 63 14.055 4.188 -0.677 440 H ILE 64 H ILE 64 13.961 8.583 0.737 441 HA ILE 64 HA ILE 64 12.339 10.787 0.860 442 HB ILE 64 HB ILE 64 14.681 10.593 1.655 443 HG12 ILE 64 2HG1 ILE 64 15.512 12.726 0.775 444 HG13 ILE 64 1HG1 ILE 64 14.386 12.764 -0.525 445 HG21 ILE 64 1HG2 ILE 64 16.658 10.586 0.245 446 HG22 ILE 64 2HG2 ILE 64 15.584 9.333 -0.307 447 HG23 ILE 64 3HG2 ILE 64 15.687 10.822 -1.185 448 HD11 ILE 64 HD3 ILE 64 12.444 12.951 1.072 449 HD12 ILE 64 HD1 ILE 64 13.422 12.499 2.417 450 HD13 ILE 64 HD2 ILE 64 13.663 14.062 1.693 451 H SER 65 H SER 65 14.070 9.238 -2.095 452 HA SER 65 HA SER 65 13.001 11.018 -3.941 453 HB2 SER 65 HB2 SER 65 13.225 9.084 -5.533 454 HB3 SER 65 HB1 SER 65 14.661 8.940 -4.455 455 HG SER 65 HG SER 65 14.004 7.281 -3.752 456 H GLN 66 H GLN 66 11.297 9.016 -1.702 457 HA GLN 66 HA GLN 66 8.950 9.220 -3.561 458 HB2 GLN 66 HB2 GLN 66 9.609 7.341 -1.280 459 HB3 GLN 66 HB1 GLN 66 7.944 7.513 -1.852 460 HG2 GLN 66 HG2 GLN 66 8.753 6.900 -4.129 461 HG3 GLN 66 HG1 GLN 66 10.315 6.845 -3.526 462 HE21 GLN 66 1HE2 GLN 66 10.783 5.001 -1.799 463 HE22 GLN 66 2HE2 GLN 66 9.604 3.684 -1.615 464 H ALA 67 H ALA 67 9.773 9.754 -0.181 465 HA ALA 67 HA ALA 67 7.569 9.960 1.067 466 HB1 ALA 67 HB1 ALA 67 9.537 12.275 1.153 467 HB2 ALA 67 HB2 ALA 67 8.486 11.938 2.436 468 HB3 ALA 67 HB3 ALA 67 9.670 10.681 2.108 469 H ARG 68 H ARG 68 8.139 12.945 -0.849 470 HA ARG 68 HA ARG 68 5.900 14.051 0.325 471 HB2 ARG 68 HB2 ARG 68 7.215 14.914 -2.272 472 HB3 ARG 68 HB1 ARG 68 5.986 15.908 -1.487 473 HG2 ARG 68 HG2 ARG 68 7.472 15.662 0.620 474 HG3 ARG 68 HG1 ARG 68 8.691 14.972 -0.446 475 HD2 ARG 68 HD2 ARG 68 7.273 17.629 -0.694 476 HD3 ARG 68 HD1 ARG 68 8.866 17.513 0.102 477 HE ARG 68 HE ARG 68 9.873 16.808 -1.910 478 HH11 ARG 68 1HH2 ARG 68 6.548 17.858 -2.430 479 HH12 ARG 68 2HH2 ARG 68 6.883 18.079 -4.116 480 HH21 ARG 68 1HH1 ARG 68 10.294 17.428 -4.098 481 HH22 ARG 68 2HH1 ARG 68 9.050 17.826 -5.157 482 H GLN 69 H GLN 69 5.747 12.753 -3.194 483 HA GLN 69 HA GLN 69 2.851 13.093 -3.034 484 HB2 GLN 69 HB2 GLN 69 4.245 12.942 -5.092 485 HB3 GLN 69 HB1 GLN 69 4.568 11.232 -4.804 486 HG2 GLN 69 HG2 GLN 69 2.023 10.818 -4.988 487 HG3 GLN 69 HG1 GLN 69 1.879 12.562 -5.259 488 HE21 GLN 69 1HE2 GLN 69 3.484 9.575 -6.449 489 HE22 GLN 69 2HE2 GLN 69 3.500 10.079 -8.137 490 H LEU 70 H LEU 70 5.069 10.335 -2.275 491 HA LEU 70 HA LEU 70 3.266 8.511 -2.081 492 HB2 LEU 70 HB2 LEU 70 5.626 8.084 -1.649 493 HB3 LEU 70 HB1 LEU 70 5.697 9.053 -0.277 494 HG LEU 70 HG LEU 70 4.123 7.325 0.891 495 HD11 LEU 70 1HD1 LEU 70 4.935 5.632 -1.523 496 HD12 LEU 70 2HD1 LEU 70 3.897 5.134 -0.243 497 HD13 LEU 70 3HD1 LEU 70 3.302 6.325 -1.366 498 HD21 LEU 70 3HD2 LEU 70 6.731 7.409 0.940 499 HD22 LEU 70 1HD2 LEU 70 5.713 6.087 1.502 500 HD23 LEU 70 2HD2 LEU 70 6.609 5.912 -0.076 501 H GLU 71 H GLU 71 4.015 10.701 0.771 502 HA GLU 71 HA GLU 71 2.014 9.849 2.402 503 HB2 GLU 71 HB2 GLU 71 4.007 11.495 2.560 504 HB3 GLU 71 HB1 GLU 71 2.907 12.723 1.907 505 HG2 GLU 71 HG2 GLU 71 1.437 11.804 4.135 506 HG3 GLU 71 HG1 GLU 71 3.061 11.268 4.437 507 H LYS 72 H LYS 72 1.664 12.516 -0.079 508 HA LYS 72 HA LYS 72 -0.905 13.067 0.810 509 HB2 LYS 72 HB2 LYS 72 0.664 13.610 -1.777 510 HB3 LYS 72 HB1 LYS 72 -0.840 14.375 -1.341 511 HG2 LYS 72 HG2 LYS 72 0.084 15.389 0.719 512 HG3 LYS 72 HG1 LYS 72 1.724 14.698 0.424 513 HD2 LYS 72 HD2 LYS 72 1.659 15.977 -1.784 514 HD3 LYS 72 HD1 LYS 72 0.295 16.766 -1.177 515 HE2 LYS 72 HE2 LYS 72 1.748 18.250 -0.364 516 HE3 LYS 72 HE1 LYS 72 1.489 17.257 1.016 517 HZ1 LYS 72 HZ1 LYS 72 3.754 17.688 0.602 518 HZ2 LYS 72 HZ2 LYS 72 3.590 16.070 0.427 519 HZ3 LYS 72 HZ3 LYS 72 3.742 17.060 -0.915 520 H ILE 73 H ILE 73 -0.037 10.777 -1.840 521 HA ILE 73 HA ILE 73 -2.755 10.618 -2.586 522 HB ILE 73 HB ILE 73 -2.103 8.419 -3.440 523 HG12 ILE 73 2HG1 ILE 73 0.721 8.677 -2.635 524 HG13 ILE 73 1HG1 ILE 73 -0.511 7.650 -1.793 525 HG21 ILE 73 1HG2 ILE 73 -0.158 10.700 -4.129 526 HG22 ILE 73 2HG2 ILE 73 -0.678 9.335 -5.209 527 HG23 ILE 73 3HG2 ILE 73 -1.866 10.527 -4.616 528 HD11 ILE 73 HD3 ILE 73 0.215 7.373 -4.736 529 HD12 ILE 73 HD1 ILE 73 0.969 6.537 -3.432 530 HD13 ILE 73 HD2 ILE 73 -0.826 6.383 -3.655 531 H LEU 74 H LEU 74 -1.131 9.761 0.340 532 HA LEU 74 HA LEU 74 -2.487 9.751 1.876 533 HB2 LEU 74 HB2 LEU 74 -3.975 8.240 2.688 534 HB3 LEU 74 HB1 LEU 74 -4.422 8.392 1.018 535 HG LEU 74 HG LEU 74 -2.958 6.066 2.340 536 HD11 LEU 74 1HD1 LEU 74 -5.201 6.222 3.019 537 HD12 LEU 74 2HD1 LEU 74 -5.774 6.136 1.322 538 HD13 LEU 74 3HD1 LEU 74 -4.949 4.779 1.976 539 HD21 LEU 74 3HD2 LEU 74 -4.012 6.302 -0.549 540 HD22 LEU 74 1HD2 LEU 74 -2.420 6.482 -0.196 541 HD23 LEU 74 2HD2 LEU 74 -3.199 4.878 0.162 542 H GLY 75 H GLY 75 0.077 8.211 0.862 543 HA2 GLY 75 HA2 GLY 75 1.836 7.175 1.804 544 HA3 GLY 75 HA1 GLY 75 1.181 7.492 3.395 545 H ILE 76 H ILE 76 -0.972 5.606 1.415 546 HA ILE 76 HA ILE 76 -1.815 3.916 1.261 547 HB ILE 76 HB ILE 76 -0.771 1.924 0.964 548 HG12 ILE 76 2HG1 ILE 76 1.936 2.758 1.766 549 HG13 ILE 76 1HG1 ILE 76 0.761 2.366 3.057 550 HG21 ILE 76 1HG2 ILE 76 0.894 2.294 -0.570 551 HG22 ILE 76 2HG2 ILE 76 -0.562 3.340 -0.781 552 HG23 ILE 76 3HG2 ILE 76 1.064 3.969 -0.074 553 HD11 ILE 76 HD3 ILE 76 2.029 0.608 0.858 554 HD12 ILE 76 HD1 ILE 76 2.125 0.426 2.651 555 HD13 ILE 76 HD2 ILE 76 0.652 0.082 1.779 556 H LYS 77 H LYS 77 -1.176 4.683 4.410 557 HA LYS 77 HA LYS 77 -1.850 2.286 5.675 558 HB2 LYS 77 HB2 LYS 77 -2.210 3.444 7.624 559 HB3 LYS 77 HB1 LYS 77 -0.831 4.142 6.905 560 HG2 LYS 77 HG2 LYS 77 -2.227 6.101 6.049 561 HG3 LYS 77 HG1 LYS 77 -3.529 5.426 7.055 562 HD2 LYS 77 HD2 LYS 77 -1.985 5.581 9.036 563 HD3 LYS 77 HD1 LYS 77 -0.858 6.428 7.951 564 HE2 LYS 77 HE2 LYS 77 -1.993 8.092 8.943 565 HE3 LYS 77 HE1 LYS 77 -2.799 8.053 7.368 566 HZ1 LYS 77 HZ1 LYS 77 -4.534 8.307 8.901 567 HZ2 LYS 77 HZ2 LYS 77 -4.514 6.700 8.497 568 HZ3 LYS 77 HZ3 LYS 77 -4.111 7.145 9.888 569 H LEU 78 H LEU 78 -3.878 1.419 6.515 570 HA LEU 78 HA LEU 78 -6.203 3.028 6.271 571 HB2 LEU 78 HB2 LEU 78 -5.928 0.208 4.987 572 HB3 LEU 78 HB1 LEU 78 -7.454 0.834 5.456 573 HG LEU 78 HG LEU 78 -5.555 2.163 3.505 574 HD11 LEU 78 1HD1 LEU 78 -8.182 0.711 2.817 575 HD12 LEU 78 2HD1 LEU 78 -7.101 1.468 1.710 576 HD13 LEU 78 3HD1 LEU 78 -6.531 0.074 2.596 577 HD21 LEU 78 3HD2 LEU 78 -7.234 3.652 2.828 578 HD22 LEU 78 1HD2 LEU 78 -8.438 3.010 4.108 579 HD23 LEU 78 2HD2 LEU 78 -7.027 3.873 4.540 580 H VAL 79 H VAL 79 -7.625 1.550 9.089 581 HA VAL 79 HA VAL 79 -8.390 2.541 6.454 582 HB VAL 79 HB VAL 79 -10.239 1.965 8.792 583 HG11 VAL 79 1HG1 VAL 79 -10.538 2.773 5.912 584 HG12 VAL 79 2HG1 VAL 79 -11.874 2.070 6.731 585 HG13 VAL 79 3HG1 VAL 79 -11.248 3.599 7.259 586 HG21 VAL 79 3HG2 VAL 79 -10.722 0.013 7.653 587 HG22 VAL 79 1HG2 VAL 79 -9.597 0.293 6.292 588 HG23 VAL 79 2HG2 VAL 79 -9.058 0.032 8.042 589 H THR 80 H THR 80 -9.048 4.677 6.022 590 HA THR 80 HA THR 80 -8.332 6.939 7.835 591 HB THR 80 HB THR 80 -8.732 8.186 5.723 592 HG1 THR 80 HG1 THR 80 -9.630 7.008 4.325 593 HG21 THR 80 1HG2 THR 80 -6.576 5.970 5.933 594 HG22 THR 80 2HG2 THR 80 -6.502 7.157 4.823 595 HG23 THR 80 3HG2 THR 80 -6.547 7.650 6.576 596 HA PRO 81 HA PRO 81 -12.820 6.918 8.324 597 HB2 PRO 81 HB1 PRO 81 -13.220 9.241 9.580 598 HB3 PRO 81 HB2 PRO 81 -12.276 7.982 10.457 599 HG2 PRO 81 HG1 PRO 81 -11.129 10.390 8.995 600 HG3 PRO 81 HG2 PRO 81 -10.740 9.608 10.643 601 HD2 PRO 81 HD1 PRO 81 -9.316 9.021 8.354 602 HD3 PRO 81 HD2 PRO 81 -9.662 7.817 9.684 603 H LEU 82 H LEU 82 -11.293 8.311 6.009 604 HA LEU 82 HA LEU 82 -13.665 9.273 4.596 605 HB2 LEU 82 HB2 LEU 82 -12.503 11.258 3.977 606 HB3 LEU 82 HB1 LEU 82 -13.361 11.119 5.534 607 HG LEU 82 HG LEU 82 -10.984 11.035 6.533 608 HD11 LEU 82 1HD1 LEU 82 -9.061 12.010 5.246 609 HD12 LEU 82 2HD1 LEU 82 -9.485 10.352 4.883 610 HD13 LEU 82 3HD1 LEU 82 -9.963 11.733 3.819 611 HD21 LEU 82 3HD2 LEU 82 -10.652 13.427 6.502 612 HD22 LEU 82 1HD2 LEU 82 -11.452 13.633 5.030 613 HD23 LEU 82 2HD2 LEU 82 -12.389 13.081 6.486 614 H GLU 83 H GLU 83 -12.990 9.556 2.290 615 HA GLU 83 HA GLU 83 -11.067 7.698 1.236 616 HB2 GLU 83 HB2 GLU 83 -12.696 9.892 -0.218 617 HB3 GLU 83 HB1 GLU 83 -11.674 8.841 -0.905 618 HG2 GLU 83 HG2 GLU 83 -14.193 7.984 0.644 619 HG3 GLU 83 HG1 GLU 83 -14.065 8.224 -1.033 620 H ASN 84 H ASN 84 -9.285 8.655 2.517 621 HA ASN 84 HA ASN 84 -8.437 11.089 2.350 622 HB2 ASN 84 HB2 ASN 84 -7.654 9.256 3.957 623 HB3 ASN 84 HB1 ASN 84 -6.437 8.717 2.710 624 HD21 ASN 84 1HD2 ASN 84 -4.838 10.085 2.113 625 HD22 ASN 84 2HD2 ASN 84 -4.321 11.352 3.235 626 H ASN 85 H ASN 85 -7.413 12.371 1.093 627 HA ASN 85 HA ASN 85 -4.993 11.723 -0.194 628 HB2 ASN 85 HB2 ASN 85 -6.538 11.163 -2.083 629 HB3 ASN 85 HB1 ASN 85 -7.380 12.652 -1.841 630 HD21 ASN 85 1HD2 ASN 85 -6.717 14.438 -2.943 631 HD22 ASN 85 2HD2 ASN 85 -5.362 14.506 -3.996 632 H GLU 86 H GLU 86 -3.867 13.647 -0.665 633 HA GLU 86 HA GLU 86 -5.108 16.262 0.051 634 HB2 GLU 86 HB2 GLU 86 -2.359 15.293 0.729 635 HB3 GLU 86 HB1 GLU 86 -2.816 17.008 0.962 636 HG2 GLU 86 HG2 GLU 86 -4.165 16.414 2.801 637 HG3 GLU 86 HG1 GLU 86 -4.265 14.732 2.434 638 H GLU 87 H GLU 87 -5.254 17.613 -1.310 639 HA GLU 87 HA GLU 87 -3.440 17.499 -3.650 640 HB2 GLU 87 HB2 GLU 87 -5.209 18.627 -4.927 641 HB3 GLU 87 HB1 GLU 87 -5.716 16.988 -4.475 642 HG2 GLU 87 HG2 GLU 87 -6.937 18.209 -2.536 643 HG3 GLU 87 HG1 GLU 87 -6.663 19.687 -3.494 644 H SER 88 H SER 88 -3.010 18.654 -1.228 645 HA SER 88 HA SER 88 -2.903 21.458 -1.389 646 HB2 SER 88 HB2 SER 88 -1.310 21.131 0.627 647 HB3 SER 88 HB1 SER 88 -2.789 20.032 0.577 648 HG SER 88 HG SER 88 -0.851 18.846 0.943 649 H GLU 89 H GLU 89 -0.710 19.185 -3.010 650 HA GLU 89 HA GLU 89 1.246 21.433 -3.403 651 HB2 GLU 89 HB2 GLU 89 2.002 20.290 -1.512 652 HB3 GLU 89 HB1 GLU 89 1.663 18.684 -2.468 653 HG2 GLU 89 HG2 GLU 89 3.391 19.373 -3.988 654 HG3 GLU 89 HG1 GLU 89 3.610 20.937 -3.142 655 H LYS 90 H LYS 90 1.123 21.889 -5.688 656 HA LYS 90 HA LYS 90 0.797 19.707 -7.590 657 HB2 LYS 90 HB2 LYS 90 0.951 22.684 -7.842 658 HB3 LYS 90 HB1 LYS 90 0.589 21.514 -9.075 659 HG2 LYS 90 HG2 LYS 90 -1.380 22.332 -8.728 660 HG3 LYS 90 HG1 LYS 90 -1.390 20.685 -8.087 661 HD2 LYS 90 HD2 LYS 90 -1.496 21.305 -5.906 662 HD3 LYS 90 HD1 LYS 90 -1.275 23.024 -6.191 663 HE2 LYS 90 HE2 LYS 90 -3.399 23.084 -6.048 664 HE3 LYS 90 HE1 LYS 90 -3.440 22.657 -7.743 665 HZ1 LYS 90 HZ1 LYS 90 -4.850 21.171 -5.942 666 HZ2 LYS 90 HZ2 LYS 90 -4.108 20.496 -7.245 667 HZ3 LYS 90 HZ3 LYS 90 -3.486 20.645 -5.642 668 H GLU 91 H GLU 91 3.711 21.259 -6.368 669 HA GLU 91 HA GLU 91 4.956 20.087 -8.677 670 HB2 GLU 91 HB2 GLU 91 5.792 21.905 -6.477 671 HB3 GLU 91 HB1 GLU 91 7.074 21.202 -7.383 672 HG2 GLU 91 HG2 GLU 91 4.892 22.960 -8.608 673 HG3 GLU 91 HG1 GLU 91 6.452 23.547 -8.166 674 H PHE 92 H PHE 92 5.567 18.055 -8.559 675 HA PHE 92 HA PHE 92 7.216 17.241 -6.263 676 HB2 PHE 92 HB2 PHE 92 5.060 16.209 -5.611 677 HB3 PHE 92 HB1 PHE 92 4.943 15.648 -7.261 678 HD1 PHE 92 HD1 PHE 92 7.429 15.329 -4.325 679 HD2 PHE 92 HD2 PHE 92 5.368 13.380 -7.540 680 HE1 PHE 92 HE1 PHE 92 8.264 13.229 -3.521 681 HE2 PHE 92 HE2 PHE 92 6.338 11.192 -6.761 682 HZ PHE 92 HZ PHE 92 7.917 11.211 -4.853 683 H ASP 93 H ASP 93 8.970 16.038 -7.015 684 HA ASP 93 HA ASP 93 9.017 14.434 -9.273 685 HB2 ASP 93 HB2 ASP 93 9.130 16.533 -10.517 686 HB3 ASP 93 HB1 ASP 93 10.436 17.085 -9.460 687 H ASP 94 H ASP 94 10.768 12.961 -9.135 688 HA ASP 94 HA ASP 94 12.421 13.290 -6.657 689 HB2 ASP 94 HB2 ASP 94 12.743 11.110 -6.700 690 HB3 ASP 94 HB1 ASP 94 11.083 11.203 -6.893 691 H THR 95 H THR 95 12.716 13.692 -9.944 692 HA THR 95 HA THR 95 14.926 12.676 -10.979 693 HB THR 95 HB THR 95 13.935 15.591 -11.318 694 HG1 THR 95 HG1 THR 95 12.381 13.930 -11.955 695 HG21 THR 95 1HG2 THR 95 15.700 14.006 -13.307 696 HG22 THR 95 2HG2 THR 95 14.623 15.501 -13.478 697 HG23 THR 95 3HG2 THR 95 15.951 15.568 -12.475 698 H GLY 96 H GLY 96 15.372 15.682 -8.948 699 HA2 GLY 96 HA2 GLY 96 18.238 15.598 -9.541 700 HA3 GLY 96 HA1 GLY 96 17.342 16.824 -8.681 701 H LEU 97 H LEU 97 16.190 13.923 -7.432 702 HA LEU 97 HA LEU 97 18.369 13.501 -5.460 703 HB2 LEU 97 HB2 LEU 97 15.484 12.384 -5.376 704 HB3 LEU 97 HB1 LEU 97 16.760 12.357 -4.125 705 HG LEU 97 HG LEU 97 15.226 14.772 -5.154 706 HD11 LEU 97 1HD1 LEU 97 15.207 13.417 -2.576 707 HD12 LEU 97 2HD1 LEU 97 14.018 14.770 -3.202 708 HD13 LEU 97 3HD1 LEU 97 13.947 13.144 -3.817 709 HD21 LEU 97 3HD2 LEU 97 16.956 14.869 -2.667 710 HD22 LEU 97 1HD2 LEU 97 17.662 15.181 -4.265 711 HD23 LEU 97 2HD2 LEU 97 16.310 16.146 -3.545 712 H THR 98 H THR 98 17.232 12.249 -8.317 713 HA THR 98 HA THR 98 18.185 9.571 -7.532 714 HB THR 98 HB THR 98 16.582 8.616 -8.997 715 HG1 THR 98 HG1 THR 98 14.703 10.490 -9.381 716 HG21 THR 98 1HG2 THR 98 14.472 8.997 -7.786 717 HG22 THR 98 2HG2 THR 98 15.930 8.720 -6.744 718 HG23 THR 98 3HG2 THR 98 15.164 10.389 -6.991 719 H LEU 99 H LEU 99 17.587 11.444 -10.406 720 HA LEU 99 HA LEU 99 19.889 10.102 -11.807 721 HB2 LEU 99 HB2 LEU 99 17.700 11.988 -12.725 722 HB3 LEU 99 HB1 LEU 99 18.872 11.317 -13.847 723 HG LEU 99 HG LEU 99 16.669 9.754 -12.514 724 HD11 LEU 99 1HD1 LEU 99 16.108 11.270 -14.429 725 HD12 LEU 99 2HD1 LEU 99 17.241 10.390 -15.380 726 HD13 LEU 99 3HD1 LEU 99 15.773 9.547 -14.634 727 HD21 LEU 99 3HD2 LEU 99 17.388 7.868 -13.803 728 HD22 LEU 99 1HD2 LEU 99 18.802 8.859 -14.465 729 HD23 LEU 99 2HD2 LEU 99 18.906 8.405 -12.871 730 H GLY 100 H GLY 100 19.278 12.863 -10.222 731 HA2 GLY 100 HA2 GLY 100 20.780 14.509 -9.522 732 HA3 GLY 100 HA1 GLY 100 22.002 13.678 -10.611 733 H ASP 101 H ASP 101 19.167 14.664 -12.097 734 HA ASP 101 HA ASP 101 20.647 16.070 -14.026 735 HB2 ASP 101 HB2 ASP 101 18.730 14.452 -14.506 736 HB3 ASP 101 HB1 ASP 101 17.573 15.652 -13.942 737 H VAL 102 H VAL 102 21.175 17.417 -12.033 738 HA VAL 102 HA VAL 102 20.186 20.012 -12.727 739 HB VAL 102 HB VAL 102 20.750 20.409 -10.145 740 HG11 VAL 102 1HG1 VAL 102 18.380 18.683 -10.883 741 HG12 VAL 102 2HG1 VAL 102 18.586 19.742 -9.407 742 HG13 VAL 102 3HG1 VAL 102 18.383 20.394 -10.938 743 HG21 VAL 102 3HG2 VAL 102 20.711 17.442 -10.165 744 HG22 VAL 102 1HG2 VAL 102 22.050 18.667 -9.749 745 HG23 VAL 102 2HG2 VAL 102 20.664 18.537 -8.759 746 H VAL 103 H VAL 103 23.588 21.527 -11.820 747 HA VAL 103 HA VAL 103 21.070 22.255 -10.602 748 HB VAL 103 HB VAL 103 23.076 23.770 -12.202 749 HG11 VAL 103 1HG1 VAL 103 21.036 25.023 -12.520 750 HG12 VAL 103 2HG1 VAL 103 20.509 24.800 -10.814 751 HG13 VAL 103 3HG1 VAL 103 21.918 25.819 -11.339 752 HG21 VAL 103 3HG2 VAL 103 23.702 24.740 -10.067 753 HG22 VAL 103 1HG2 VAL 103 22.235 24.117 -9.339 754 HG23 VAL 103 2HG2 VAL 103 23.706 23.056 -9.891 755 H ASN 104 H ASN 104 19.297 22.842 -11.337 756 HA ASN 104 HA ASN 104 18.298 21.969 -13.946 757 HB2 ASN 104 HB2 ASN 104 16.904 21.745 -11.797 758 HB3 ASN 104 HB1 ASN 104 16.763 23.393 -11.629 759 HD21 ASN 104 1HD2 ASN 104 16.036 20.712 -13.962 760 HD22 ASN 104 2HD2 ASN 104 14.680 21.499 -14.589 761 H ILE 105 H ILE 105 17.864 23.138 -15.691 762 HA ILE 105 HA ILE 105 18.350 26.089 -15.644 763 HB ILE 105 HB ILE 105 19.814 25.822 -17.589 764 HG12 ILE 105 2HG1 ILE 105 19.909 22.879 -16.929 765 HG13 ILE 105 1HG1 ILE 105 18.872 23.445 -18.238 766 HG21 ILE 105 1HG2 ILE 105 21.705 25.314 -16.427 767 HG22 ILE 105 2HG2 ILE 105 20.535 26.138 -15.603 768 HG23 ILE 105 3HG2 ILE 105 20.852 24.314 -15.213 769 HD11 ILE 105 HD3 ILE 105 21.031 22.533 -19.063 770 HD12 ILE 105 HD1 ILE 105 20.646 24.268 -19.477 771 HD13 ILE 105 HD2 ILE 105 21.902 23.811 -18.215 772 H LYS 106 H LYS 106 15.853 24.992 -15.646 773 HA LYS 106 HA LYS 106 15.017 24.636 -18.395 774 HB2 LYS 106 HB2 LYS 106 12.691 24.428 -17.645 775 HB3 LYS 106 HB1 LYS 106 13.798 23.223 -16.930 776 HG2 LYS 106 HG2 LYS 106 13.828 24.961 -14.920 777 HG3 LYS 106 HG1 LYS 106 12.323 25.483 -15.573 778 HD2 LYS 106 HD2 LYS 106 11.411 23.166 -15.325 779 HD3 LYS 106 HD1 LYS 106 12.907 22.763 -14.545 780 HE2 LYS 106 HE2 LYS 106 12.649 24.442 -12.883 781 HE3 LYS 106 HE1 LYS 106 11.110 25.060 -13.613 782 HZ1 LYS 106 HZ1 LYS 106 10.149 22.914 -13.233 783 HZ2 LYS 106 HZ2 LYS 106 11.316 22.583 -12.109 784 HZ3 LYS 106 HZ3 LYS 106 10.395 23.765 -11.857 785 H GLU 107 H GLU 107 14.511 26.954 -15.717 786 HA GLU 107 HA GLU 107 13.681 29.167 -17.361 787 HB2 GLU 107 HB2 GLU 107 14.887 29.047 -14.634 788 HB3 GLU 107 HB1 GLU 107 14.250 30.469 -15.434 789 HG2 GLU 107 HG2 GLU 107 11.898 29.315 -15.624 790 HG3 GLU 107 HG1 GLU 107 12.590 27.962 -14.818 791 H GLY 108 H GLY 108 16.735 27.513 -16.549 792 HA2 GLY 108 HA2 GLY 108 18.393 29.847 -17.033 793 HA3 GLY 108 HA1 GLY 108 18.903 28.159 -16.591 794 H LYS 109 H LYS 109 20.609 28.448 -17.746 795 HA LYS 109 HA LYS 109 20.382 27.445 -20.539 796 HB2 LYS 109 HB2 LYS 109 20.421 29.930 -20.705 797 HB3 LYS 109 HB1 LYS 109 21.830 30.029 -19.772 798 HG2 LYS 109 HG2 LYS 109 22.899 28.570 -21.789 799 HG3 LYS 109 HG1 LYS 109 21.261 28.682 -22.494 800 HD2 LYS 109 HD2 LYS 109 23.048 30.993 -21.904 801 HD3 LYS 109 HD1 LYS 109 22.894 30.053 -23.368 802 HE2 LYS 109 HE2 LYS 109 20.358 30.904 -23.341 803 HE3 LYS 109 HE1 LYS 109 20.784 31.801 -21.912 804 HZ1 LYS 109 HZ1 LYS 109 20.995 33.318 -23.641 805 HZ2 LYS 109 HZ2 LYS 109 22.465 33.028 -23.173 806 HZ3 LYS 109 HZ3 LYS 109 21.873 32.370 -24.548 807 H LYS 110 H LYS 110 22.225 26.136 -21.153 808 HA LYS 110 HA LYS 110 23.746 25.253 -18.935 809 HB2 LYS 110 HB2 LYS 110 22.733 23.862 -20.616 810 HB3 LYS 110 HB1 LYS 110 23.896 24.261 -21.796 811 HG2 LYS 110 HG2 LYS 110 25.700 23.454 -20.332 812 HG3 LYS 110 HG1 LYS 110 24.616 23.200 -19.018 813 HD2 LYS 110 HD2 LYS 110 23.514 21.310 -20.191 814 HD3 LYS 110 HD1 LYS 110 24.529 21.729 -21.658 815 HE2 LYS 110 HE2 LYS 110 26.431 21.019 -20.865 816 HE3 LYS 110 HE1 LYS 110 25.920 21.055 -19.183 817 HZ1 LYS 110 HZ1 LYS 110 25.857 18.724 -20.033 818 HZ2 LYS 110 HZ2 LYS 110 24.434 19.232 -19.465 819 HZ3 LYS 110 HZ3 LYS 110 24.597 19.266 -21.031 820 H LEU 111 H LEU 111 24.560 27.370 -18.347 821 HA LEU 111 HA LEU 111 26.882 28.522 -19.606 822 HB2 LEU 111 HB2 LEU 111 25.841 28.686 -16.749 823 HB3 LEU 111 HB1 LEU 111 27.126 29.640 -17.432 824 HG LEU 111 HG LEU 111 24.146 29.471 -17.642 825 HD11 LEU 111 1HD1 LEU 111 24.150 31.837 -17.106 826 HD12 LEU 111 2HD1 LEU 111 25.018 30.833 -15.870 827 HD13 LEU 111 3HD1 LEU 111 25.994 31.737 -16.925 828 HD21 LEU 111 3HD2 LEU 111 24.273 31.449 -19.426 829 HD22 LEU 111 1HD2 LEU 111 25.887 30.809 -19.718 830 HD23 LEU 111 2HD2 LEU 111 24.409 29.792 -19.918 831 H GLU 112 H GLU 112 28.890 28.549 -18.663 832 HA GLU 112 HA GLU 112 30.058 26.030 -18.635 833 HB2 GLU 112 HB2 GLU 112 32.186 27.079 -18.152 834 HB3 GLU 112 HB1 GLU 112 31.423 28.299 -19.052 835 HG2 GLU 112 HG2 GLU 112 30.742 29.429 -16.937 836 HG3 GLU 112 HG1 GLU 112 31.518 28.091 -15.983 837 H HIS 113 H HIS 113 28.701 27.301 -15.727 838 HA HIS 113 HA HIS 113 30.774 25.879 -14.313 839 HB2 HIS 113 HB2 HIS 113 29.688 26.707 -12.327 840 HB3 HIS 113 HB1 HIS 113 29.909 28.082 -13.537 841 HD2 HIS 113 HD2 HIS 113 27.450 28.753 -14.851 842 HE1 HIS 113 HE1 HIS 113 25.099 27.291 -11.678 843 HE2 HIS 113 HE2 HIS 113 25.187 28.715 -13.883 844 H HIS 114 H HIS 114 28.736 24.408 -15.992 845 HA HIS 114 HA HIS 114 26.732 23.424 -14.042 846 HB2 HIS 114 HB2 HIS 114 26.217 24.286 -16.660 847 HB3 HIS 114 HB1 HIS 114 26.876 22.791 -17.115 848 HD2 HIS 114 HD2 HIS 114 24.205 23.453 -14.346 849 HE1 HIS 114 HE1 HIS 114 22.780 20.460 -16.982 850 HE2 HIS 114 HE2 HIS 114 22.270 21.701 -14.910 Start of MODEL 5 1 H1 GLU 13 H1 GLU 13 -4.616 -7.867 17.872 2 H2 GLU 13 H2 GLU 13 -3.252 -7.215 18.401 3 H3 GLU 13 H3 GLU 13 -4.562 -6.293 18.565 4 HA GLU 13 HA GLU 13 -4.907 -6.177 16.147 5 HB2 GLU 13 HB2 GLU 13 -3.661 -4.588 17.098 6 HB3 GLU 13 HB1 GLU 13 -2.092 -5.494 17.010 7 HG2 GLU 13 HG2 GLU 13 -2.068 -3.977 15.157 8 HG3 GLU 13 HG1 GLU 13 -2.189 -5.569 14.600 9 H ASN 14 H ASN 14 -5.445 -7.979 15.171 10 HA ASN 14 HA ASN 14 -3.640 -10.102 15.174 11 HB2 ASN 14 HB2 ASN 14 -5.349 -11.296 14.820 12 HB3 ASN 14 HB1 ASN 14 -6.345 -9.969 15.072 13 HD21 ASN 14 1HD2 ASN 14 -5.174 -12.069 12.453 14 HD22 ASN 14 2HD2 ASN 14 -6.368 -11.503 11.295 15 H ALA 15 H ALA 15 -3.846 -7.552 13.034 16 HA ALA 15 HA ALA 15 -2.695 -8.515 10.553 17 HB1 ALA 15 HB1 ALA 15 -2.925 -6.303 10.028 18 HB2 ALA 15 HB2 ALA 15 -4.299 -6.541 11.233 19 HB3 ALA 15 HB3 ALA 15 -2.725 -5.702 11.605 20 H GLU 16 H GLU 16 -1.130 -8.548 13.420 21 HA GLU 16 HA GLU 16 1.372 -7.867 12.097 22 HB2 GLU 16 HB2 GLU 16 2.044 -6.885 14.006 23 HB3 GLU 16 HB1 GLU 16 0.255 -6.592 14.073 24 HG2 GLU 16 HG2 GLU 16 0.144 -8.478 15.746 25 HG3 GLU 16 HG1 GLU 16 1.862 -8.690 15.598 26 H LEU 17 H LEU 17 -0.281 -10.577 12.944 27 HA LEU 17 HA LEU 17 1.692 -12.203 14.411 28 HB2 LEU 17 HB2 LEU 17 -1.118 -12.565 13.665 29 HB3 LEU 17 HB1 LEU 17 -0.150 -13.644 14.638 30 HG LEU 17 HG LEU 17 -1.017 -10.775 15.407 31 HD11 LEU 17 1HD1 LEU 17 -2.683 -12.698 15.699 32 HD12 LEU 17 2HD1 LEU 17 -1.470 -13.402 16.693 33 HD13 LEU 17 3HD1 LEU 17 -2.176 -12.088 17.386 34 HD21 LEU 17 3HD2 LEU 17 -0.172 -11.335 17.647 35 HD22 LEU 17 1HD2 LEU 17 0.665 -12.728 17.067 36 HD23 LEU 17 2HD2 LEU 17 1.192 -11.119 16.427 37 H GLU 18 H GLU 18 0.924 -11.862 11.248 38 HA GLU 18 HA GLU 18 1.925 -14.497 10.516 39 HB2 GLU 18 HB2 GLU 18 -0.599 -12.992 9.303 40 HB3 GLU 18 HB1 GLU 18 0.077 -14.561 8.898 41 HG2 GLU 18 HG2 GLU 18 -0.297 -15.211 11.344 42 HG3 GLU 18 HG1 GLU 18 -1.072 -13.701 11.626 43 H ILE 19 H ILE 19 2.969 -11.577 10.362 44 HA ILE 19 HA ILE 19 4.071 -11.591 7.700 45 HB ILE 19 HB ILE 19 4.807 -9.221 8.674 46 HG12 ILE 19 2HG1 ILE 19 2.645 -9.786 10.629 47 HG13 ILE 19 1HG1 ILE 19 4.300 -9.773 11.096 48 HG21 ILE 19 1HG2 ILE 19 2.795 -9.824 7.012 49 HG22 ILE 19 2HG2 ILE 19 1.889 -10.128 8.418 50 HG23 ILE 19 3HG2 ILE 19 2.425 -8.451 8.111 51 HD11 ILE 19 HD3 ILE 19 4.921 -7.604 10.525 52 HD12 ILE 19 HD1 ILE 19 3.302 -7.393 9.817 53 HD13 ILE 19 HD2 ILE 19 3.416 -7.569 11.473 54 H VAL 20 H VAL 20 6.280 -11.060 7.318 55 HA VAL 20 HA VAL 20 8.411 -11.808 9.025 56 HB VAL 20 HB VAL 20 9.853 -10.506 7.885 57 HG11 VAL 20 1HG1 VAL 20 9.092 -12.619 6.957 58 HG12 VAL 20 2HG1 VAL 20 8.035 -11.701 5.719 59 HG13 VAL 20 3HG1 VAL 20 9.755 -11.522 5.877 60 HG21 VAL 20 3HG2 VAL 20 9.090 -9.098 5.959 61 HG22 VAL 20 1HG2 VAL 20 7.468 -9.169 6.455 62 HG23 VAL 20 2HG2 VAL 20 8.632 -8.422 7.561 63 H THR 21 H THR 21 9.803 -10.489 10.354 64 HA THR 21 HA THR 21 8.560 -8.744 12.033 65 HB THR 21 HB THR 21 11.497 -9.301 11.710 66 HG1 THR 21 HG1 THR 21 10.909 -10.715 13.309 67 HG21 THR 21 1HG2 THR 21 11.573 -8.628 14.126 68 HG22 THR 21 2HG2 THR 21 11.717 -7.405 12.973 69 HG23 THR 21 3HG2 THR 21 10.114 -7.574 13.787 70 H ASP 22 H ASP 22 11.012 -8.016 9.440 71 HA ASP 22 HA ASP 22 10.940 -5.311 9.910 72 HB2 ASP 22 HB2 ASP 22 12.929 -6.344 9.658 73 HB3 ASP 22 HB1 ASP 22 12.550 -7.058 8.110 74 H TYR 23 H TYR 23 8.538 -5.955 9.287 75 HA TYR 23 HA TYR 23 7.622 -5.205 6.657 76 HB2 TYR 23 HB2 TYR 23 6.418 -6.710 8.675 77 HB3 TYR 23 HB1 TYR 23 5.711 -5.202 9.020 78 HD1 TYR 23 HD1 TYR 23 5.969 -7.783 6.362 79 HD2 TYR 23 HD2 TYR 23 4.154 -4.059 7.402 80 HE1 TYR 23 HE1 TYR 23 4.232 -8.293 4.760 81 HE2 TYR 23 HE2 TYR 23 2.326 -4.584 5.790 82 HH TYR 23 HH TYR 23 2.331 -7.487 3.611 83 H TYR 24 H TYR 24 7.025 -2.986 6.273 84 HA TYR 24 HA TYR 24 8.409 -0.940 7.305 85 HB2 TYR 24 HB2 TYR 24 7.327 0.254 5.905 86 HB3 TYR 24 HB1 TYR 24 7.177 -1.289 5.183 87 HD1 TYR 24 HD1 TYR 24 4.763 -2.528 5.483 88 HD2 TYR 24 HD2 TYR 24 5.486 1.580 6.438 89 HE1 TYR 24 HE1 TYR 24 2.564 -2.016 4.734 90 HE2 TYR 24 HE2 TYR 24 3.134 2.086 5.942 91 HH TYR 24 HH TYR 24 0.960 -0.463 4.766 92 H LYS 25 H LYS 25 8.534 -0.025 9.233 93 HA LYS 25 HA LYS 25 6.558 -0.194 11.191 94 HB2 LYS 25 HB2 LYS 25 8.735 1.901 11.174 95 HB3 LYS 25 HB1 LYS 25 7.669 1.258 12.514 96 HG2 LYS 25 HG2 LYS 25 8.571 -1.014 12.510 97 HG3 LYS 25 HG1 LYS 25 9.275 -0.638 11.031 98 HD2 LYS 25 HD2 LYS 25 10.979 -0.709 12.735 99 HD3 LYS 25 HD1 LYS 25 10.825 0.978 11.975 100 HE2 LYS 25 HE2 LYS 25 11.285 0.970 14.220 101 HE3 LYS 25 HE1 LYS 25 9.641 1.657 13.871 102 HZ1 LYS 25 HZ1 LYS 25 9.477 0.510 15.826 103 HZ2 LYS 25 HZ2 LYS 25 8.818 -0.534 14.655 104 HZ3 LYS 25 HZ3 LYS 25 10.306 -0.841 15.247 105 H ILE 26 H ILE 26 6.834 2.513 8.849 106 HA ILE 26 HA ILE 26 5.344 4.388 10.616 107 HB ILE 26 HB ILE 26 4.961 5.584 8.645 108 HG12 ILE 26 2HG1 ILE 26 6.529 3.473 7.002 109 HG13 ILE 26 1HG1 ILE 26 4.867 3.627 6.938 110 HG21 ILE 26 1HG2 ILE 26 7.880 4.698 8.901 111 HG22 ILE 26 2HG2 ILE 26 7.305 6.272 8.183 112 HG23 ILE 26 3HG2 ILE 26 7.031 5.995 9.849 113 HD11 ILE 26 HD3 ILE 26 5.464 6.232 6.438 114 HD12 ILE 26 HD1 ILE 26 7.035 5.376 6.145 115 HD13 ILE 26 HD2 ILE 26 5.615 4.921 5.165 116 H ILE 27 H ILE 27 3.952 1.584 9.089 117 HA ILE 27 HA ILE 27 1.648 2.501 10.143 118 HB ILE 27 HB ILE 27 0.963 1.971 7.207 119 HG12 ILE 27 2HG1 ILE 27 1.257 4.716 8.294 120 HG13 ILE 27 1HG1 ILE 27 2.570 3.893 7.332 121 HG21 ILE 27 1HG2 ILE 27 -0.288 3.192 9.611 122 HG22 ILE 27 2HG2 ILE 27 -1.056 3.187 7.931 123 HG23 ILE 27 3HG2 ILE 27 -0.962 1.827 8.957 124 HD11 ILE 27 HD3 ILE 27 0.906 3.711 5.458 125 HD12 ILE 27 HD1 ILE 27 -0.277 4.632 6.352 126 HD13 ILE 27 HD2 ILE 27 1.214 5.327 5.904 127 H LYS 28 H LYS 28 3.044 -0.213 8.100 128 HA LYS 28 HA LYS 28 2.801 -2.140 8.203 129 HB2 LYS 28 HB2 LYS 28 3.860 -1.524 10.560 130 HB3 LYS 28 HB1 LYS 28 2.283 -2.001 11.235 131 HG2 LYS 28 HG2 LYS 28 2.710 -4.286 9.961 132 HG3 LYS 28 HG1 LYS 28 4.219 -3.624 9.511 133 HD2 LYS 28 HD2 LYS 28 3.111 -3.728 12.341 134 HD3 LYS 28 HD1 LYS 28 4.012 -5.126 11.661 135 HE2 LYS 28 HE2 LYS 28 6.007 -3.847 11.351 136 HE3 LYS 28 HE1 LYS 28 5.132 -2.376 11.801 137 HZ1 LYS 28 HZ1 LYS 28 5.782 -4.652 13.600 138 HZ2 LYS 28 HZ2 LYS 28 6.402 -3.142 13.648 139 HZ3 LYS 28 HZ3 LYS 28 4.768 -3.625 14.027 140 H THR 29 H THR 29 0.242 -2.142 10.895 141 HA THR 29 HA THR 29 -1.074 -4.336 9.916 142 HB THR 29 HB THR 29 -2.757 -3.513 11.531 143 HG1 THR 29 HG1 THR 29 -2.656 -1.393 12.202 144 HG21 THR 29 1HG2 THR 29 -1.331 -2.871 13.556 145 HG22 THR 29 2HG2 THR 29 -0.558 -4.289 12.785 146 HG23 THR 29 3HG2 THR 29 0.062 -2.687 12.538 147 H ALA 30 H ALA 30 -1.434 -1.144 8.588 148 HA ALA 30 HA ALA 30 -3.944 -0.841 8.191 149 HB1 ALA 30 HB1 ALA 30 -1.572 -0.203 6.371 150 HB2 ALA 30 HB2 ALA 30 -3.135 0.592 6.370 151 HB3 ALA 30 HB3 ALA 30 -2.208 0.734 7.831 152 H ARG 31 H ARG 31 -2.175 -3.113 6.097 153 HA ARG 31 HA ARG 31 -3.461 -2.864 3.827 154 HB2 ARG 31 HB2 ARG 31 -2.711 -5.084 3.275 155 HB3 ARG 31 HB1 ARG 31 -1.579 -4.072 3.925 156 HG2 ARG 31 HG2 ARG 31 -1.672 -5.412 6.014 157 HG3 ARG 31 HG1 ARG 31 -3.064 -6.343 5.462 158 HD2 ARG 31 HD2 ARG 31 -1.877 -7.269 3.567 159 HD3 ARG 31 HD1 ARG 31 -0.373 -6.500 4.065 160 HE ARG 31 HE ARG 31 -0.857 -7.882 6.305 161 HH11 ARG 31 1HH2 ARG 31 -0.909 -9.039 2.846 162 HH12 ARG 31 2HH2 ARG 31 -0.454 -10.619 3.347 163 HH21 ARG 31 1HH1 ARG 31 -0.419 -9.873 6.789 164 HH22 ARG 31 2HH1 ARG 31 -0.092 -11.080 5.541 165 H GLU 32 H GLU 32 -5.184 -4.889 6.358 166 HA GLU 32 HA GLU 32 -7.276 -5.170 4.492 167 HB2 GLU 32 HB2 GLU 32 -6.900 -6.008 7.390 168 HB3 GLU 32 HB1 GLU 32 -8.424 -6.066 6.608 169 HG2 GLU 32 HG2 GLU 32 -7.609 -7.394 4.807 170 HG3 GLU 32 HG1 GLU 32 -5.993 -7.435 5.398 171 H GLN 33 H GLN 33 -6.693 -2.799 7.087 172 HA GLN 33 HA GLN 33 -9.242 -1.726 7.130 173 HB2 GLN 33 HB2 GLN 33 -6.484 -0.621 7.882 174 HB3 GLN 33 HB1 GLN 33 -7.853 0.367 7.897 175 HG2 GLN 33 HG2 GLN 33 -9.019 -1.329 9.456 176 HG3 GLN 33 HG1 GLN 33 -7.616 -2.406 9.225 177 HE21 GLN 33 1HE2 GLN 33 -6.218 -2.477 11.063 178 HE22 GLN 33 2HE2 GLN 33 -5.717 -0.940 11.787 179 H LEU 34 H LEU 34 -7.241 -1.659 4.448 180 HA LEU 34 HA LEU 34 -7.615 0.915 3.637 181 HB2 LEU 34 HB2 LEU 34 -6.717 -1.653 2.407 182 HB3 LEU 34 HB1 LEU 34 -7.050 -0.368 1.226 183 HG LEU 34 HG LEU 34 -5.316 -0.119 3.640 184 HD11 LEU 34 1HD1 LEU 34 -3.421 -0.855 2.126 185 HD12 LEU 34 2HD1 LEU 34 -4.774 -2.001 2.183 186 HD13 LEU 34 3HD1 LEU 34 -4.560 -0.907 0.824 187 HD21 LEU 34 3HD2 LEU 34 -5.438 1.555 1.014 188 HD22 LEU 34 1HD2 LEU 34 -5.912 2.040 2.676 189 HD23 LEU 34 2HD2 LEU 34 -4.205 1.616 2.245 190 H GLY 35 H GLY 35 -10.058 -1.195 3.976 191 HA2 GLY 35 HA2 GLY 35 -11.955 -1.846 3.257 192 HA3 GLY 35 HA1 GLY 35 -12.221 -0.253 2.596 193 H ILE 36 H ILE 36 -9.531 -1.474 1.209 194 HA ILE 36 HA ILE 36 -10.984 -2.487 -1.230 195 HB ILE 36 HB ILE 36 -10.162 -1.067 -2.669 196 HG12 ILE 36 2HG1 ILE 36 -8.188 -0.244 -0.512 197 HG13 ILE 36 1HG1 ILE 36 -7.803 -1.222 -1.817 198 HG21 ILE 36 1HG2 ILE 36 -10.616 0.679 -0.260 199 HG22 ILE 36 2HG2 ILE 36 -10.789 1.143 -1.979 200 HG23 ILE 36 3HG2 ILE 36 -11.858 -0.077 -1.192 201 HD11 ILE 36 HD3 ILE 36 -8.316 0.866 -3.388 202 HD12 ILE 36 HD1 ILE 36 -8.674 1.685 -1.803 203 HD13 ILE 36 HD2 ILE 36 -7.036 0.992 -2.219 204 H SER 37 H SER 37 -9.387 -3.478 -2.945 205 HA SER 37 HA SER 37 -7.128 -4.947 -1.604 206 HB2 SER 37 HB2 SER 37 -9.359 -6.180 -3.120 207 HB3 SER 37 HB1 SER 37 -7.876 -6.926 -2.621 208 HG SER 37 HG SER 37 -9.702 -7.132 -1.131 209 H GLN 38 H GLN 38 -5.936 -6.203 -3.408 210 HA GLN 38 HA GLN 38 -4.524 -4.389 -4.463 211 HB2 GLN 38 HB2 GLN 38 -3.263 -6.108 -5.616 212 HB3 GLN 38 HB1 GLN 38 -3.802 -6.864 -4.328 213 HG2 GLN 38 HG2 GLN 38 -5.132 -7.307 -7.087 214 HG3 GLN 38 HG1 GLN 38 -4.167 -8.290 -6.144 215 HE21 GLN 38 1HE2 GLN 38 -4.541 -9.117 -4.397 216 HE22 GLN 38 2HE2 GLN 38 -6.136 -9.591 -3.763 217 H GLN 39 H GLN 39 -7.161 -5.431 -6.492 218 HA GLN 39 HA GLN 39 -5.955 -4.312 -8.889 219 HB2 GLN 39 HB2 GLN 39 -8.011 -5.164 -9.939 220 HB3 GLN 39 HB1 GLN 39 -7.535 -6.423 -8.779 221 HG2 GLN 39 HG2 GLN 39 -9.693 -4.345 -8.589 222 HG3 GLN 39 HG1 GLN 39 -9.932 -5.978 -9.039 223 HE21 GLN 39 1HE2 GLN 39 -10.221 -7.476 -7.291 224 HE22 GLN 39 2HE2 GLN 39 -9.951 -7.103 -5.602 225 H GLN 40 H GLN 40 -8.118 -3.058 -6.460 226 HA GLN 40 HA GLN 40 -8.324 -0.422 -7.799 227 HB2 GLN 40 HB2 GLN 40 -9.147 -1.451 -5.072 228 HB3 GLN 40 HB1 GLN 40 -9.288 0.199 -5.516 229 HG2 GLN 40 HG2 GLN 40 -10.657 -0.628 -7.521 230 HG3 GLN 40 HG1 GLN 40 -10.850 -2.166 -6.620 231 HE21 GLN 40 1HE2 GLN 40 -12.180 -2.129 -4.665 232 HE22 GLN 40 2HE2 GLN 40 -13.090 -0.710 -4.185 233 H LEU 41 H LEU 41 -6.277 -1.986 -5.218 234 HA LEU 41 HA LEU 41 -5.380 0.481 -4.555 235 HB2 LEU 41 HB2 LEU 41 -5.179 -1.603 -3.179 236 HB3 LEU 41 HB1 LEU 41 -4.039 -2.262 -4.304 237 HG LEU 41 HG LEU 41 -2.500 -0.286 -3.701 238 HD11 LEU 41 1HD1 LEU 41 -4.270 0.159 -1.375 239 HD12 LEU 41 2HD1 LEU 41 -2.644 0.929 -1.805 240 HD13 LEU 41 3HD1 LEU 41 -4.190 1.246 -2.666 241 HD21 LEU 41 3HD2 LEU 41 -3.276 -2.131 -1.434 242 HD22 LEU 41 1HD2 LEU 41 -2.175 -2.584 -2.716 243 HD23 LEU 41 2HD2 LEU 41 -1.728 -1.207 -1.694 244 H ALA 42 H ALA 42 -4.196 -1.616 -7.205 245 HA ALA 42 HA ALA 42 -1.829 -0.364 -7.805 246 HB1 ALA 42 HB1 ALA 42 -2.526 -1.195 -10.034 247 HB2 ALA 42 HB2 ALA 42 -2.555 -2.392 -8.709 248 HB3 ALA 42 HB3 ALA 42 -4.115 -1.743 -9.211 249 H GLN 43 H GLN 43 -5.168 0.785 -8.376 250 HA GLN 43 HA GLN 43 -4.270 2.975 -9.924 251 HB2 GLN 43 HB2 GLN 43 -7.018 2.614 -8.481 252 HB3 GLN 43 HB1 GLN 43 -6.473 3.751 -9.757 253 HG2 GLN 43 HG2 GLN 43 -6.153 2.062 -11.354 254 HG3 GLN 43 HG1 GLN 43 -6.330 0.738 -10.252 255 HE21 GLN 43 1HE2 GLN 43 -8.232 -0.104 -11.595 256 HE22 GLN 43 2HE2 GLN 43 -9.806 0.693 -11.342 257 H LYS 44 H LYS 44 -5.390 2.613 -6.519 258 HA LYS 44 HA LYS 44 -5.383 5.393 -5.908 259 HB2 LYS 44 HB2 LYS 44 -5.255 2.653 -4.560 260 HB3 LYS 44 HB1 LYS 44 -4.915 4.049 -3.586 261 HG2 LYS 44 HG2 LYS 44 -7.328 3.493 -3.400 262 HG3 LYS 44 HG1 LYS 44 -6.896 5.079 -3.742 263 HD2 LYS 44 HD2 LYS 44 -7.546 4.456 -6.278 264 HD3 LYS 44 HD1 LYS 44 -7.798 2.829 -5.524 265 HE2 LYS 44 HE2 LYS 44 -9.605 3.793 -4.065 266 HE3 LYS 44 HE1 LYS 44 -9.245 5.372 -4.612 267 HZ1 LYS 44 HZ1 LYS 44 -9.999 4.936 -6.783 268 HZ2 LYS 44 HZ2 LYS 44 -10.342 3.330 -6.455 269 HZ3 LYS 44 HZ3 LYS 44 -11.138 4.497 -5.764 270 H LEU 45 H LEU 45 -2.529 3.560 -6.732 271 HA LEU 45 HA LEU 45 -0.961 5.294 -5.117 272 HB2 LEU 45 HB2 LEU 45 -1.828 3.305 -3.722 273 HB3 LEU 45 HB1 LEU 45 -1.202 2.231 -4.959 274 HG LEU 45 HG LEU 45 1.051 2.857 -4.377 275 HD11 LEU 45 1HD1 LEU 45 -0.233 4.500 -2.176 276 HD12 LEU 45 2HD1 LEU 45 1.474 4.057 -2.204 277 HD13 LEU 45 3HD1 LEU 45 0.787 5.098 -3.457 278 HD21 LEU 45 3HD2 LEU 45 -0.765 1.696 -2.307 279 HD22 LEU 45 1HD2 LEU 45 0.235 0.881 -3.444 280 HD23 LEU 45 2HD2 LEU 45 1.007 1.819 -2.053 281 H LYS 46 H LYS 46 -1.480 4.429 -8.028 282 HA LYS 46 HA LYS 46 -0.309 4.191 -9.874 283 HB2 LYS 46 HB2 LYS 46 1.556 6.286 -8.530 284 HB3 LYS 46 HB1 LYS 46 1.477 5.639 -10.186 285 HG2 LYS 46 HG2 LYS 46 0.573 7.758 -9.934 286 HG3 LYS 46 HG1 LYS 46 -0.558 6.572 -10.629 287 HD2 LYS 46 HD2 LYS 46 -1.746 6.532 -8.357 288 HD3 LYS 46 HD1 LYS 46 -0.571 7.754 -7.914 289 HE2 LYS 46 HE2 LYS 46 -1.401 8.957 -10.208 290 HE3 LYS 46 HE1 LYS 46 -2.957 8.224 -9.723 291 HZ1 LYS 46 HZ1 LYS 46 -1.281 9.996 -8.225 292 HZ2 LYS 46 HZ2 LYS 46 -2.829 10.302 -8.603 293 HZ3 LYS 46 HZ3 LYS 46 -2.534 9.146 -7.501 294 H VAL 47 H VAL 47 0.052 1.817 -8.698 295 HA VAL 47 HA VAL 47 2.859 1.335 -9.153 296 HB VAL 47 HB VAL 47 3.066 -0.231 -7.355 297 HG11 VAL 47 1HG1 VAL 47 3.825 2.051 -7.035 298 HG12 VAL 47 2HG1 VAL 47 2.335 2.555 -6.390 299 HG13 VAL 47 3HG1 VAL 47 3.257 1.281 -5.582 300 HG21 VAL 47 3HG2 VAL 47 0.795 -0.878 -6.910 301 HG22 VAL 47 1HG2 VAL 47 1.308 0.079 -5.522 302 HG23 VAL 47 2HG2 VAL 47 0.222 0.796 -6.851 303 H SER 48 H SER 48 3.057 -1.273 -9.599 304 HA SER 48 HA SER 48 0.765 -2.386 -11.153 305 HB2 SER 48 HB2 SER 48 2.287 -4.216 -11.569 306 HB3 SER 48 HB1 SER 48 3.158 -2.829 -11.916 307 HG SER 48 HG SER 48 4.389 -3.220 -10.201 308 H GLU 49 H GLU 49 -0.006 -4.322 -10.697 309 HA GLU 49 HA GLU 49 -0.918 -4.910 -8.004 310 HB2 GLU 49 HB2 GLU 49 -1.030 -6.124 -10.676 311 HB3 GLU 49 HB1 GLU 49 -1.140 -7.245 -9.216 312 HG2 GLU 49 HG2 GLU 49 -2.988 -6.216 -8.539 313 HG3 GLU 49 HG1 GLU 49 -2.686 -4.726 -9.488 314 H ASN 50 H ASN 50 2.048 -5.955 -9.921 315 HA ASN 50 HA ASN 50 2.856 -8.064 -8.051 316 HB2 ASN 50 HB2 ASN 50 3.435 -8.158 -10.354 317 HB3 ASN 50 HB1 ASN 50 4.012 -6.569 -10.334 318 HD21 ASN 50 1HD2 ASN 50 5.349 -9.578 -10.620 319 HD22 ASN 50 2HD2 ASN 50 6.805 -9.255 -9.722 320 H ILE 51 H ILE 51 3.436 -4.583 -8.194 321 HA ILE 51 HA ILE 51 5.334 -4.687 -5.936 322 HB ILE 51 HB ILE 51 3.431 -2.508 -7.037 323 HG12 ILE 51 2HG1 ILE 51 5.311 -3.262 -8.446 324 HG13 ILE 51 1HG1 ILE 51 5.358 -1.584 -7.898 325 HG21 ILE 51 1HG2 ILE 51 4.934 -0.904 -5.724 326 HG22 ILE 51 2HG2 ILE 51 3.578 -1.713 -4.889 327 HG23 ILE 51 3HG2 ILE 51 5.244 -2.389 -4.777 328 HD11 ILE 51 HD3 ILE 51 6.926 -1.872 -6.398 329 HD12 ILE 51 HD1 ILE 51 7.166 -3.629 -6.532 330 HD13 ILE 51 HD2 ILE 51 7.579 -2.588 -7.925 331 H VAL 52 H VAL 52 1.594 -4.798 -6.161 332 HA VAL 52 HA VAL 52 1.362 -4.251 -3.523 333 HB VAL 52 HB VAL 52 -0.727 -5.599 -5.246 334 HG11 VAL 52 1HG1 VAL 52 -0.750 -4.472 -2.407 335 HG12 VAL 52 2HG1 VAL 52 -2.121 -4.917 -3.367 336 HG13 VAL 52 3HG1 VAL 52 -0.924 -6.110 -2.956 337 HG21 VAL 52 3HG2 VAL 52 -0.057 -2.679 -4.461 338 HG22 VAL 52 1HG2 VAL 52 -0.186 -3.320 -6.108 339 HG23 VAL 52 2HG2 VAL 52 -1.610 -3.280 -5.159 340 H LYS 53 H LYS 53 1.829 -7.315 -5.275 341 HA LYS 53 HA LYS 53 1.678 -9.163 -3.091 342 HB2 LYS 53 HB2 LYS 53 2.978 -9.291 -5.886 343 HB3 LYS 53 HB1 LYS 53 2.892 -10.500 -4.642 344 HG2 LYS 53 HG2 LYS 53 0.296 -9.715 -4.868 345 HG3 LYS 53 HG1 LYS 53 0.852 -9.541 -6.482 346 HD2 LYS 53 HD2 LYS 53 1.573 -11.744 -6.813 347 HD3 LYS 53 HD1 LYS 53 1.268 -12.196 -5.163 348 HE2 LYS 53 HE2 LYS 53 -1.133 -12.022 -5.499 349 HE3 LYS 53 HE1 LYS 53 -0.910 -11.286 -7.140 350 HZ1 LYS 53 HZ1 LYS 53 -1.365 -13.740 -7.137 351 HZ2 LYS 53 HZ2 LYS 53 -0.097 -13.312 -7.915 352 HZ3 LYS 53 HZ3 LYS 53 0.169 -13.894 -6.434 353 H ARG 54 H ARG 54 4.315 -7.052 -4.190 354 HA ARG 54 HA ARG 54 6.317 -8.319 -2.614 355 HB2 ARG 54 HB2 ARG 54 6.080 -5.815 -4.346 356 HB3 ARG 54 HB1 ARG 54 7.468 -6.086 -3.274 357 HG2 ARG 54 HG2 ARG 54 7.926 -8.246 -4.379 358 HG3 ARG 54 HG1 ARG 54 6.562 -7.994 -5.579 359 HD2 ARG 54 HD2 ARG 54 7.905 -5.789 -6.064 360 HD3 ARG 54 HD1 ARG 54 9.221 -6.573 -5.265 361 HE ARG 54 HE ARG 54 7.916 -8.167 -7.392 362 HH11 ARG 54 1HH2 ARG 54 10.743 -5.885 -6.866 363 HH12 ARG 54 2HH2 ARG 54 11.609 -6.778 -8.031 364 HH21 ARG 54 1HH1 ARG 54 9.492 -9.203 -8.935 365 HH22 ARG 54 2HH1 ARG 54 10.798 -8.182 -9.263 366 H PHE 55 H PHE 55 4.125 -5.522 -1.932 367 HA PHE 55 HA PHE 55 5.263 -4.861 0.520 368 HB2 PHE 55 HB2 PHE 55 2.562 -4.768 -0.851 369 HB3 PHE 55 HB1 PHE 55 2.817 -4.047 0.784 370 HD1 PHE 55 HD2 PHE 55 5.746 -3.526 -1.107 371 HD2 PHE 55 HD1 PHE 55 1.642 -2.297 -0.389 372 HE1 PHE 55 HE2 PHE 55 6.166 -1.224 -2.142 373 HE2 PHE 55 HE1 PHE 55 2.196 0.010 -1.257 374 HZ PHE 55 HZ PHE 55 4.469 0.429 -2.103 375 H GLU 56 H GLU 56 2.555 -7.017 -0.684 376 HA GLU 56 HA GLU 56 1.397 -7.852 1.522 377 HB2 GLU 56 HB2 GLU 56 1.758 -9.381 -0.966 378 HB3 GLU 56 HB1 GLU 56 1.004 -10.048 0.327 379 HG2 GLU 56 HG2 GLU 56 -0.671 -8.142 0.456 380 HG3 GLU 56 HG1 GLU 56 -0.151 -7.582 -1.139 381 H SER 57 H SER 57 4.318 -9.045 0.156 382 HA SER 57 HA SER 57 4.683 -11.203 2.023 383 HB2 SER 57 HB2 SER 57 6.752 -11.557 0.536 384 HB3 SER 57 HB1 SER 57 5.259 -11.746 -0.227 385 HG SER 57 HG SER 57 5.974 -10.460 -1.508 386 H GLY 58 H GLY 58 5.771 -7.918 1.865 387 HA2 GLY 58 HA2 GLY 58 7.314 -6.722 3.246 388 HA3 GLY 58 HA1 GLY 58 7.882 -8.334 3.828 389 H LYS 59 H LYS 59 8.082 -8.645 0.495 390 HA LYS 59 HA LYS 59 10.830 -8.447 0.579 391 HB2 LYS 59 HB2 LYS 59 8.715 -8.925 -1.502 392 HB3 LYS 59 HB1 LYS 59 10.400 -8.664 -1.996 393 HG2 LYS 59 HG2 LYS 59 10.928 -10.540 -0.234 394 HG3 LYS 59 HG1 LYS 59 9.139 -10.752 -0.040 395 HD2 LYS 59 HD2 LYS 59 9.174 -11.317 -2.538 396 HD3 LYS 59 HD1 LYS 59 10.879 -11.186 -2.564 397 HE2 LYS 59 HE2 LYS 59 10.822 -12.921 -0.737 398 HE3 LYS 59 HE1 LYS 59 9.142 -13.037 -1.021 399 HZ1 LYS 59 HZ1 LYS 59 11.129 -13.743 -3.193 400 HZ2 LYS 59 HZ2 LYS 59 10.243 -14.818 -2.482 401 HZ3 LYS 59 HZ3 LYS 59 9.604 -13.552 -3.372 402 H LEU 60 H LEU 60 8.589 -5.968 -0.136 403 HA LEU 60 HA LEU 60 10.720 -3.958 -0.381 404 HB2 LEU 60 HB2 LEU 60 9.512 -4.739 -2.554 405 HB3 LEU 60 HB1 LEU 60 8.005 -4.404 -1.792 406 HG LEU 60 HG LEU 60 8.224 -2.071 -1.869 407 HD11 LEU 60 1HD1 LEU 60 10.835 -2.011 -1.616 408 HD12 LEU 60 2HD1 LEU 60 10.960 -2.469 -3.275 409 HD13 LEU 60 3HD1 LEU 60 10.143 -0.900 -2.874 410 HD21 LEU 60 3HD2 LEU 60 7.595 -3.130 -3.935 411 HD22 LEU 60 1HD2 LEU 60 8.335 -1.534 -4.218 412 HD23 LEU 60 2HD2 LEU 60 9.235 -3.042 -4.588 413 H LYS 61 H LYS 61 10.230 -1.948 0.335 414 HA LYS 61 HA LYS 61 7.775 -1.582 1.930 415 HB2 LYS 61 HB2 LYS 61 10.472 -0.319 2.044 416 HB3 LYS 61 HB1 LYS 61 9.223 0.256 3.019 417 HG2 LYS 61 HG2 LYS 61 9.059 -1.984 4.008 418 HG3 LYS 61 HG1 LYS 61 10.549 -2.521 3.104 419 HD2 LYS 61 HD2 LYS 61 11.837 -0.780 4.259 420 HD3 LYS 61 HD1 LYS 61 10.352 -0.146 4.989 421 HE2 LYS 61 HE2 LYS 61 9.974 -2.154 6.178 422 HE3 LYS 61 HE1 LYS 61 11.285 -2.984 5.474 423 HZ1 LYS 61 HZ1 LYS 61 11.530 -0.717 7.396 424 HZ2 LYS 61 HZ2 LYS 61 11.727 -2.298 7.796 425 HZ3 LYS 61 HZ3 LYS 61 12.765 -1.591 6.749 426 HA PRO 62 HA PRO 62 6.374 1.691 -0.664 427 HB2 PRO 62 HB1 PRO 62 5.062 3.309 1.459 428 HB3 PRO 62 HB2 PRO 62 4.422 1.953 0.519 429 HG2 PRO 62 HG1 PRO 62 5.543 1.988 3.307 430 HG3 PRO 62 HG2 PRO 62 4.190 1.162 2.734 431 HD2 PRO 62 HD1 PRO 62 6.575 -0.049 3.001 432 HD3 PRO 62 HD2 PRO 62 5.557 -0.539 1.703 433 H THR 63 H THR 63 6.626 3.875 -1.250 434 HA THR 63 HA THR 63 8.939 5.094 -0.014 435 HB THR 63 HB THR 63 9.129 6.330 -1.976 436 HG1 THR 63 HG1 THR 63 7.528 5.358 -3.733 437 HG21 THR 63 1HG2 THR 63 10.192 4.023 -1.795 438 HG22 THR 63 2HG2 THR 63 8.814 3.340 -2.726 439 HG23 THR 63 3HG2 THR 63 9.944 4.481 -3.422 440 H ILE 64 H ILE 64 8.890 7.593 -0.573 441 HA ILE 64 HA ILE 64 7.534 9.056 1.182 442 HB ILE 64 HB ILE 64 9.444 9.839 0.228 443 HG12 ILE 64 2HG1 ILE 64 7.182 11.714 -0.442 444 HG13 ILE 64 1HG1 ILE 64 7.869 11.331 1.112 445 HG21 ILE 64 1HG2 ILE 64 8.891 8.985 -2.349 446 HG22 ILE 64 2HG2 ILE 64 8.373 10.622 -2.445 447 HG23 ILE 64 3HG2 ILE 64 9.973 10.273 -1.964 448 HD11 ILE 64 HD3 ILE 64 8.983 13.361 0.299 449 HD12 ILE 64 HD1 ILE 64 10.109 12.074 0.135 450 HD13 ILE 64 HD2 ILE 64 9.155 12.749 -1.295 451 H SER 65 H SER 65 6.411 9.357 -2.402 452 HA SER 65 HA SER 65 3.875 10.491 -1.667 453 HB2 SER 65 HB2 SER 65 3.359 9.994 -4.093 454 HB3 SER 65 HB1 SER 65 4.818 10.778 -3.927 455 HG SER 65 HG SER 65 5.651 9.175 -4.974 456 H GLN 66 H GLN 66 5.139 7.370 -1.389 457 HA GLN 66 HA GLN 66 2.497 6.170 -1.964 458 HB2 GLN 66 HB2 GLN 66 5.201 4.953 -1.215 459 HB3 GLN 66 HB1 GLN 66 3.665 4.026 -1.210 460 HG2 GLN 66 HG2 GLN 66 3.264 4.480 -3.455 461 HG3 GLN 66 HG1 GLN 66 4.642 5.575 -3.694 462 HE21 GLN 66 1HE2 GLN 66 5.364 4.090 -5.444 463 HE22 GLN 66 2HE2 GLN 66 6.421 2.794 -4.985 464 H ALA 67 H ALA 67 4.733 6.140 0.913 465 HA ALA 67 HA ALA 67 3.140 5.574 2.926 466 HB1 ALA 67 HB1 ALA 67 4.449 7.319 4.306 467 HB2 ALA 67 HB2 ALA 67 5.315 6.213 3.247 468 HB3 ALA 67 HB3 ALA 67 5.196 7.890 2.798 469 H ARG 68 H ARG 68 3.454 8.989 1.684 470 HA ARG 68 HA ARG 68 1.246 10.201 2.812 471 HB2 ARG 68 HB2 ARG 68 3.221 10.832 1.104 472 HB3 ARG 68 HB1 ARG 68 1.783 10.907 -0.040 473 HG2 ARG 68 HG2 ARG 68 2.143 12.388 2.624 474 HG3 ARG 68 HG1 ARG 68 2.238 13.012 0.982 475 HD2 ARG 68 HD2 ARG 68 0.132 13.689 1.745 476 HD3 ARG 68 HD1 ARG 68 -0.197 12.186 0.805 477 HE ARG 68 HE ARG 68 0.207 11.849 3.608 478 HH11 ARG 68 1HH2 ARG 68 -2.322 12.883 1.359 479 HH12 ARG 68 2HH2 ARG 68 -3.594 12.946 2.523 480 HH21 ARG 68 1HH1 ARG 68 -1.300 11.855 5.002 481 HH22 ARG 68 2HH1 ARG 68 -3.051 12.072 4.769 482 H GLN 69 H GLN 69 1.104 8.487 -0.348 483 HA GLN 69 HA GLN 69 -1.700 9.039 -0.541 484 HB2 GLN 69 HB2 GLN 69 0.312 7.340 -2.063 485 HB3 GLN 69 HB1 GLN 69 -1.326 7.031 -2.468 486 HG2 GLN 69 HG2 GLN 69 -1.812 9.312 -3.005 487 HG3 GLN 69 HG1 GLN 69 -0.098 9.752 -2.533 488 HE21 GLN 69 1HE2 GLN 69 1.397 8.504 -3.502 489 HE22 GLN 69 2HE2 GLN 69 1.474 8.021 -5.249 490 H LEU 70 H LEU 70 -0.034 6.091 0.664 491 HA LEU 70 HA LEU 70 -2.141 4.572 1.308 492 HB2 LEU 70 HB2 LEU 70 0.589 5.113 2.536 493 HB3 LEU 70 HB1 LEU 70 -0.515 3.904 3.216 494 HG LEU 70 HG LEU 70 0.220 3.964 0.333 495 HD11 LEU 70 1HD1 LEU 70 1.681 2.259 2.363 496 HD12 LEU 70 2HD1 LEU 70 2.160 2.571 0.646 497 HD13 LEU 70 3HD1 LEU 70 2.225 3.899 1.830 498 HD21 LEU 70 3HD2 LEU 70 -0.418 1.412 0.483 499 HD22 LEU 70 1HD2 LEU 70 -0.850 1.772 2.153 500 HD23 LEU 70 2HD2 LEU 70 -1.663 2.527 0.813 501 H GLU 71 H GLU 71 -0.490 6.785 3.581 502 HA GLU 71 HA GLU 71 -2.113 7.122 5.586 503 HB2 GLU 71 HB2 GLU 71 0.186 8.207 5.142 504 HB3 GLU 71 HB1 GLU 71 -0.712 9.510 4.288 505 HG2 GLU 71 HG2 GLU 71 -2.040 9.924 6.327 506 HG3 GLU 71 HG1 GLU 71 -1.094 8.498 7.056 507 H LYS 72 H LYS 72 -2.651 8.732 2.306 508 HA LYS 72 HA LYS 72 -4.666 10.467 3.064 509 HB2 LYS 72 HB2 LYS 72 -3.283 10.230 0.958 510 HB3 LYS 72 HB1 LYS 72 -4.274 8.829 0.610 511 HG2 LYS 72 HG2 LYS 72 -6.323 10.331 0.434 512 HG3 LYS 72 HG1 LYS 72 -5.311 11.686 0.916 513 HD2 LYS 72 HD2 LYS 72 -3.916 11.410 -1.079 514 HD3 LYS 72 HD1 LYS 72 -4.881 10.005 -1.538 515 HE2 LYS 72 HE2 LYS 72 -6.768 11.629 -1.806 516 HE3 LYS 72 HE1 LYS 72 -5.868 12.904 -1.403 517 HZ1 LYS 72 HZ1 LYS 72 -5.865 12.721 -3.757 518 HZ2 LYS 72 HZ2 LYS 72 -4.325 12.603 -3.368 519 HZ3 LYS 72 HZ3 LYS 72 -5.240 11.260 -3.757 520 H ILE 73 H ILE 73 -5.046 6.952 2.280 521 HA ILE 73 HA ILE 73 -8.019 7.060 2.748 522 HB ILE 73 HB ILE 73 -6.073 4.826 2.124 523 HG12 ILE 73 2HG1 ILE 73 -8.538 5.336 0.581 524 HG13 ILE 73 1HG1 ILE 73 -7.556 6.664 0.576 525 HG21 ILE 73 1HG2 ILE 73 -7.591 3.858 3.662 526 HG22 ILE 73 2HG2 ILE 73 -8.936 4.968 3.090 527 HG23 ILE 73 3HG2 ILE 73 -8.431 3.612 2.123 528 HD11 ILE 73 HD3 ILE 73 -6.940 5.303 -1.306 529 HD12 ILE 73 HD1 ILE 73 -5.633 5.454 -0.254 530 HD13 ILE 73 HD2 ILE 73 -6.480 3.923 -0.193 531 H LEU 74 H LEU 74 -5.097 5.860 4.492 532 HA LEU 74 HA LEU 74 -6.429 4.716 6.083 533 HB2 LEU 74 HB2 LEU 74 -3.653 5.613 6.143 534 HB3 LEU 74 HB1 LEU 74 -4.136 4.450 7.365 535 HG LEU 74 HG LEU 74 -4.501 3.997 4.321 536 HD11 LEU 74 1HD1 LEU 74 -2.083 4.173 5.013 537 HD12 LEU 74 2HD1 LEU 74 -2.474 2.995 6.395 538 HD13 LEU 74 3HD1 LEU 74 -2.589 2.537 4.698 539 HD21 LEU 74 3HD2 LEU 74 -4.677 1.691 5.037 540 HD22 LEU 74 1HD2 LEU 74 -4.898 2.153 6.630 541 HD23 LEU 74 2HD2 LEU 74 -6.085 2.713 5.299 542 H GLY 75 H GLY 75 -5.119 7.923 6.470 543 HA2 GLY 75 HA2 GLY 75 -5.086 9.580 8.187 544 HA3 GLY 75 HA1 GLY 75 -6.629 8.793 8.765 545 H ILE 76 H ILE 76 -4.602 6.334 8.907 546 HA ILE 76 HA ILE 76 -3.722 6.915 11.623 547 HB ILE 76 HB ILE 76 -3.331 4.463 11.794 548 HG12 ILE 76 2HG1 ILE 76 -5.025 4.080 9.390 549 HG13 ILE 76 1HG1 ILE 76 -3.341 4.231 9.205 550 HG21 ILE 76 1HG2 ILE 76 -5.143 5.464 12.744 551 HG22 ILE 76 2HG2 ILE 76 -6.018 5.599 11.206 552 HG23 ILE 76 3HG2 ILE 76 -5.761 3.974 12.006 553 HD11 ILE 76 HD3 ILE 76 -2.946 2.415 10.909 554 HD12 ILE 76 HD1 ILE 76 -4.680 2.150 10.922 555 HD13 ILE 76 HD2 ILE 76 -3.764 1.914 9.384 556 H LYS 77 H LYS 77 -1.532 5.752 12.049 557 HA LYS 77 HA LYS 77 0.257 5.090 10.117 558 HB2 LYS 77 HB2 LYS 77 2.088 6.795 10.509 559 HB3 LYS 77 HB1 LYS 77 0.567 7.441 9.814 560 HG2 LYS 77 HG2 LYS 77 -0.008 8.539 11.968 561 HG3 LYS 77 HG1 LYS 77 1.436 7.922 12.633 562 HD2 LYS 77 HD2 LYS 77 2.785 9.144 10.976 563 HD3 LYS 77 HD1 LYS 77 1.404 9.907 10.251 564 HE2 LYS 77 HE2 LYS 77 2.004 11.520 11.575 565 HE3 LYS 77 HE1 LYS 77 0.819 10.711 12.619 566 HZ1 LYS 77 HZ1 LYS 77 2.668 9.499 13.668 567 HZ2 LYS 77 HZ2 LYS 77 3.708 10.319 12.720 568 HZ3 LYS 77 HZ3 LYS 77 2.774 11.078 13.860 569 H LEU 78 H LEU 78 2.326 4.610 11.366 570 HA LEU 78 HA LEU 78 1.986 4.484 14.275 571 HB2 LEU 78 HB2 LEU 78 2.620 2.093 12.468 572 HB3 LEU 78 HB1 LEU 78 3.220 2.101 14.100 573 HG LEU 78 HG LEU 78 0.311 2.358 13.343 574 HD11 LEU 78 1HD1 LEU 78 -0.059 0.168 14.100 575 HD12 LEU 78 2HD1 LEU 78 1.346 0.047 13.003 576 HD13 LEU 78 3HD1 LEU 78 1.329 -0.014 14.866 577 HD21 LEU 78 3HD2 LEU 78 0.272 3.346 15.464 578 HD22 LEU 78 1HD2 LEU 78 -0.056 1.685 15.825 579 HD23 LEU 78 2HD2 LEU 78 1.479 2.031 16.127 580 H VAL 79 H VAL 79 5.560 5.002 14.767 581 HA VAL 79 HA VAL 79 3.598 3.281 15.918 582 HB VAL 79 HB VAL 79 5.289 3.135 17.801 583 HG11 VAL 79 1HG1 VAL 79 5.329 1.706 15.680 584 HG12 VAL 79 2HG1 VAL 79 6.882 2.626 15.299 585 HG13 VAL 79 3HG1 VAL 79 6.798 1.709 16.717 586 HG21 VAL 79 3HG2 VAL 79 6.777 5.268 16.191 587 HG22 VAL 79 1HG2 VAL 79 6.350 5.151 17.930 588 HG23 VAL 79 2HG2 VAL 79 7.553 4.034 17.190 589 H THR 80 H THR 80 3.281 3.516 18.405 590 HA THR 80 HA THR 80 1.818 6.124 18.883 591 HB THR 80 HB THR 80 1.094 5.347 20.886 592 HG1 THR 80 HG1 THR 80 1.820 3.307 21.584 593 HG21 THR 80 1HG2 THR 80 0.100 4.134 18.882 594 HG22 THR 80 2HG2 THR 80 1.346 2.901 19.027 595 HG23 THR 80 3HG2 THR 80 0.098 3.239 20.287 596 HA PRO 81 HA PRO 81 4.985 8.344 20.906 597 HB2 PRO 81 HB1 PRO 81 3.214 8.663 23.268 598 HB3 PRO 81 HB2 PRO 81 4.095 9.939 22.290 599 HG2 PRO 81 HG1 PRO 81 1.421 9.465 21.939 600 HG3 PRO 81 HG2 PRO 81 2.483 9.906 20.611 601 HD2 PRO 81 HD1 PRO 81 1.420 7.189 21.489 602 HD3 PRO 81 HD2 PRO 81 1.705 7.758 19.803 603 H LEU 82 H LEU 82 4.366 5.233 22.023 604 HA LEU 82 HA LEU 82 5.898 5.502 24.508 605 HB2 LEU 82 HB2 LEU 82 3.790 4.185 24.353 606 HB3 LEU 82 HB1 LEU 82 4.555 3.208 23.090 607 HG LEU 82 HG LEU 82 6.344 2.404 24.501 608 HD11 LEU 82 1HD1 LEU 82 5.926 2.700 27.094 609 HD12 LEU 82 2HD1 LEU 82 6.134 4.179 26.206 610 HD13 LEU 82 3HD1 LEU 82 4.555 3.601 26.790 611 HD21 LEU 82 3HD2 LEU 82 5.089 0.839 25.774 612 HD22 LEU 82 1HD2 LEU 82 3.588 1.530 25.152 613 HD23 LEU 82 2HD2 LEU 82 4.915 0.831 24.052 614 H GLU 83 H GLU 83 6.263 4.770 21.331 615 HA GLU 83 HA GLU 83 9.135 4.079 21.565 616 HB2 GLU 83 HB2 GLU 83 7.311 2.397 20.596 617 HB3 GLU 83 HB1 GLU 83 7.470 3.354 19.151 618 HG2 GLU 83 HG2 GLU 83 10.044 3.068 19.261 619 HG3 GLU 83 HG1 GLU 83 9.895 2.073 20.672 620 H ASN 84 H ASN 84 7.355 6.613 21.180 621 HA ASN 84 HA ASN 84 9.398 7.830 19.709 622 HB2 ASN 84 HB2 ASN 84 8.475 8.849 17.870 623 HB3 ASN 84 HB1 ASN 84 7.986 7.224 17.860 624 HD21 ASN 84 1HD2 ASN 84 5.577 6.802 18.836 625 HD22 ASN 84 2HD2 ASN 84 4.457 7.993 18.295 626 H ASN 85 H ASN 85 9.813 8.499 21.738 627 HA ASN 85 HA ASN 85 7.740 9.872 23.245 628 HB2 ASN 85 HB2 ASN 85 9.931 8.352 24.022 629 HB3 ASN 85 HB1 ASN 85 10.490 9.929 24.422 630 HD21 ASN 85 1HD2 ASN 85 7.222 8.286 24.831 631 HD22 ASN 85 2HD2 ASN 85 7.226 8.731 26.527 632 H GLU 86 H GLU 86 10.094 11.083 21.314 633 HA GLU 86 HA GLU 86 11.099 13.224 22.223 634 HB2 GLU 86 HB2 GLU 86 11.208 14.146 20.048 635 HB3 GLU 86 HB1 GLU 86 11.525 12.430 20.042 636 HG2 GLU 86 HG2 GLU 86 9.300 11.974 19.108 637 HG3 GLU 86 HG1 GLU 86 8.905 13.716 19.311 638 H GLU 87 H GLU 87 10.791 15.663 21.965 639 HA GLU 87 HA GLU 87 8.368 16.446 23.023 640 HB2 GLU 87 HB2 GLU 87 10.653 18.054 21.886 641 HB3 GLU 87 HB1 GLU 87 9.311 18.816 22.747 642 HG2 GLU 87 HG2 GLU 87 9.833 17.662 24.816 643 HG3 GLU 87 HG1 GLU 87 11.046 16.627 23.978 644 H SER 88 H SER 88 6.395 16.591 21.817 645 HA SER 88 HA SER 88 6.462 17.169 18.967 646 HB2 SER 88 HB2 SER 88 4.806 15.348 20.732 647 HB3 SER 88 HB1 SER 88 4.443 15.568 19.100 648 HG SER 88 HG SER 88 6.083 13.828 19.998 649 H GLU 89 H GLU 89 6.403 19.330 20.565 650 HA GLU 89 HA GLU 89 3.894 20.573 21.094 651 HB2 GLU 89 HB2 GLU 89 5.213 22.560 21.033 652 HB3 GLU 89 HB1 GLU 89 5.917 21.300 22.026 653 HG2 GLU 89 HG2 GLU 89 7.590 21.014 20.083 654 HG3 GLU 89 HG1 GLU 89 6.933 22.351 19.280 655 H LYS 90 H LYS 90 2.540 21.672 20.023 656 HA LYS 90 HA LYS 90 2.241 21.489 17.271 657 HB2 LYS 90 HB2 LYS 90 0.916 22.959 19.466 658 HB3 LYS 90 HB1 LYS 90 0.234 22.911 17.809 659 HG2 LYS 90 HG2 LYS 90 0.127 20.353 17.977 660 HG3 LYS 90 HG1 LYS 90 0.749 20.397 19.593 661 HD2 LYS 90 HD2 LYS 90 -1.522 20.248 19.922 662 HD3 LYS 90 HD1 LYS 90 -1.033 21.964 20.270 663 HE2 LYS 90 HE2 LYS 90 -1.856 22.611 18.115 664 HE3 LYS 90 HE1 LYS 90 -2.397 21.101 17.650 665 HZ1 LYS 90 HZ1 LYS 90 -4.033 21.067 19.396 666 HZ2 LYS 90 HZ2 LYS 90 -3.323 22.369 20.053 667 HZ3 LYS 90 HZ3 LYS 90 -4.119 22.622 18.717 668 H GLU 91 H GLU 91 2.140 22.559 15.734 669 HA GLU 91 HA GLU 91 4.056 24.742 15.404 670 HB2 GLU 91 HB2 GLU 91 4.236 24.172 13.229 671 HB3 GLU 91 HB1 GLU 91 4.220 22.622 14.190 672 HG2 GLU 91 HG2 GLU 91 1.829 22.375 13.462 673 HG3 GLU 91 HG1 GLU 91 2.051 23.801 12.422 674 H PHE 92 H PHE 92 3.363 26.546 14.522 675 HA PHE 92 HA PHE 92 0.687 26.932 13.479 676 HB2 PHE 92 HB2 PHE 92 1.396 28.786 15.850 677 HB3 PHE 92 HB1 PHE 92 -0.146 28.604 15.053 678 HD1 PHE 92 HD2 PHE 92 -1.685 26.531 15.657 679 HD2 PHE 92 HD1 PHE 92 2.007 27.546 17.592 680 HE1 PHE 92 HE2 PHE 92 -2.278 25.244 17.567 681 HE2 PHE 92 HE1 PHE 92 1.487 25.954 19.445 682 HZ PHE 92 HZ PHE 92 -0.748 24.998 19.547 683 H ASP 93 H ASP 93 0.088 29.127 12.639 684 HA ASP 93 HA ASP 93 2.423 29.875 11.132 685 HB2 ASP 93 HB2 ASP 93 0.024 29.278 10.049 686 HB3 ASP 93 HB1 ASP 93 -0.502 30.716 10.711 687 H ASP 94 H ASP 94 -0.087 31.236 13.406 688 HA ASP 94 HA ASP 94 1.342 33.763 13.469 689 HB2 ASP 94 HB2 ASP 94 -1.041 33.981 12.808 690 HB3 ASP 94 HB1 ASP 94 -1.528 33.097 14.288 691 H THR 95 H THR 95 -0.726 31.996 15.588 692 HA THR 95 HA THR 95 0.925 31.932 18.045 693 HB THR 95 HB THR 95 -1.289 32.744 19.165 694 HG1 THR 95 HG1 THR 95 -1.704 34.050 16.729 695 HG21 THR 95 1HG2 THR 95 0.185 34.896 17.693 696 HG22 THR 95 2HG2 THR 95 -0.772 34.942 19.188 697 HG23 THR 95 3HG2 THR 95 0.849 34.033 19.051 698 H GLY 96 H GLY 96 0.192 30.513 19.518 699 HA2 GLY 96 HA2 GLY 96 -0.805 28.070 18.887 700 HA3 GLY 96 HA1 GLY 96 -0.557 28.638 20.473 701 H LEU 97 H LEU 97 -2.815 27.118 18.893 702 HA LEU 97 HA LEU 97 -4.910 29.122 18.702 703 HB2 LEU 97 HB2 LEU 97 -4.372 26.231 17.856 704 HB3 LEU 97 HB1 LEU 97 -5.953 26.933 17.455 705 HG LEU 97 HG LEU 97 -3.289 27.909 16.769 706 HD11 LEU 97 1HD1 LEU 97 -5.454 26.665 15.124 707 HD12 LEU 97 2HD1 LEU 97 -4.294 27.594 14.350 708 HD13 LEU 97 3HD1 LEU 97 -3.800 26.091 15.184 709 HD21 LEU 97 3HD2 LEU 97 -4.129 29.955 16.843 710 HD22 LEU 97 1HD2 LEU 97 -4.521 29.591 15.200 711 HD23 LEU 97 2HD2 LEU 97 -5.786 29.379 16.474 712 H THR 98 H THR 98 -6.930 29.183 19.537 713 HA THR 98 HA THR 98 -7.482 27.637 21.942 714 HB THR 98 HB THR 98 -7.332 30.698 21.352 715 HG1 THR 98 HG1 THR 98 -6.129 30.330 23.512 716 HG21 THR 98 1HG2 THR 98 -8.828 29.517 23.641 717 HG22 THR 98 2HG2 THR 98 -8.104 31.113 23.746 718 HG23 THR 98 3HG2 THR 98 -9.337 30.771 22.543 719 H LEU 99 H LEU 99 -9.432 27.242 22.333 720 HA LEU 99 HA LEU 99 -11.562 27.213 20.586 721 HB2 LEU 99 HB2 LEU 99 -10.983 25.755 22.497 722 HB3 LEU 99 HB1 LEU 99 -11.491 26.915 23.698 723 HG LEU 99 HG LEU 99 -13.859 26.863 22.736 724 HD11 LEU 99 1HD1 LEU 99 -12.444 24.595 21.367 725 HD12 LEU 99 2HD1 LEU 99 -14.163 24.665 21.319 726 HD13 LEU 99 3HD1 LEU 99 -13.270 25.892 20.454 727 HD21 LEU 99 3HD2 LEU 99 -14.207 24.579 23.739 728 HD22 LEU 99 1HD2 LEU 99 -12.524 24.413 24.000 729 HD23 LEU 99 2HD2 LEU 99 -13.365 25.837 24.727 730 H GLY 100 H GLY 100 -13.644 28.413 20.473 731 HA2 GLY 100 HA2 GLY 100 -14.887 30.003 20.570 732 HA3 GLY 100 HA1 GLY 100 -14.439 30.469 22.234 733 H ASP 101 H ASP 101 -11.719 30.949 20.908 734 HA ASP 101 HA ASP 101 -12.112 33.571 20.568 735 HB2 ASP 101 HB2 ASP 101 -9.568 32.033 20.848 736 HB3 ASP 101 HB1 ASP 101 -9.397 33.683 20.373 737 H VAL 102 H VAL 102 -13.243 32.461 18.661 738 HA VAL 102 HA VAL 102 -12.262 33.568 16.321 739 HB VAL 102 HB VAL 102 -14.117 31.756 15.408 740 HG11 VAL 102 1HG1 VAL 102 -11.799 31.584 14.688 741 HG12 VAL 102 2HG1 VAL 102 -11.359 31.240 16.441 742 HG13 VAL 102 3HG1 VAL 102 -12.299 30.049 15.497 743 HG21 VAL 102 3HG2 VAL 102 -14.439 29.913 16.717 744 HG22 VAL 102 1HG2 VAL 102 -13.274 30.476 17.974 745 HG23 VAL 102 2HG2 VAL 102 -14.901 31.242 17.568 746 H VAL 103 H VAL 103 -15.712 34.695 15.066 747 HA VAL 103 HA VAL 103 -13.476 33.095 14.052 748 HB VAL 103 HB VAL 103 -15.247 35.063 12.631 749 HG11 VAL 103 1HG1 VAL 103 -12.721 33.471 11.664 750 HG12 VAL 103 2HG1 VAL 103 -14.037 33.946 10.614 751 HG13 VAL 103 3HG1 VAL 103 -13.018 35.160 11.401 752 HG21 VAL 103 3HG2 VAL 103 -16.279 32.950 13.270 753 HG22 VAL 103 1HG2 VAL 103 -15.985 33.221 11.586 754 HG23 VAL 103 2HG2 VAL 103 -14.931 32.110 12.384 755 H ASN 104 H ASN 104 -11.514 33.512 13.871 756 HA ASN 104 HA ASN 104 -10.463 35.950 15.087 757 HB2 ASN 104 HB2 ASN 104 -9.498 34.007 15.751 758 HB3 ASN 104 HB1 ASN 104 -9.058 33.503 14.133 759 HD21 ASN 104 1HD2 ASN 104 -7.200 34.300 13.030 760 HD22 ASN 104 2HD2 ASN 104 -6.145 35.421 13.778 761 H ILE 105 H ILE 105 -9.444 37.603 14.054 762 HA ILE 105 HA ILE 105 -8.883 37.775 11.203 763 HB ILE 105 HB ILE 105 -9.889 39.999 10.989 764 HG12 ILE 105 2HG1 ILE 105 -10.298 40.185 13.452 765 HG13 ILE 105 1HG1 ILE 105 -11.391 40.981 12.156 766 HG21 ILE 105 1HG2 ILE 105 -12.288 39.103 10.582 767 HG22 ILE 105 2HG2 ILE 105 -10.931 37.987 10.001 768 HG23 ILE 105 3HG2 ILE 105 -11.855 37.790 11.517 769 HD11 ILE 105 HD3 ILE 105 -12.573 40.263 14.173 770 HD12 ILE 105 HD1 ILE 105 -13.077 39.379 12.698 771 HD13 ILE 105 HD2 ILE 105 -12.010 38.574 13.892 772 H LYS 106 H LYS 106 -7.791 40.211 11.050 773 HA LYS 106 HA LYS 106 -5.386 39.960 12.537 774 HB2 LYS 106 HB2 LYS 106 -5.744 40.601 10.274 775 HB3 LYS 106 HB1 LYS 106 -6.289 42.142 10.638 776 HG2 LYS 106 HG2 LYS 106 -4.009 42.435 11.894 777 HG3 LYS 106 HG1 LYS 106 -3.685 40.770 11.151 778 HD2 LYS 106 HD2 LYS 106 -3.560 41.685 9.050 779 HD3 LYS 106 HD1 LYS 106 -4.045 43.379 9.628 780 HE2 LYS 106 HE2 LYS 106 -1.715 43.438 9.432 781 HE3 LYS 106 HE1 LYS 106 -2.050 43.524 10.999 782 HZ1 LYS 106 HZ1 LYS 106 -1.623 41.036 11.210 783 HZ2 LYS 106 HZ2 LYS 106 -0.870 41.130 9.771 784 HZ3 LYS 106 HZ3 LYS 106 -0.460 42.118 11.028 785 H GLU 107 H GLU 107 -7.964 42.287 12.396 786 HA GLU 107 HA GLU 107 -7.112 43.858 14.739 787 HB2 GLU 107 HB2 GLU 107 -9.675 43.804 13.199 788 HB3 GLU 107 HB1 GLU 107 -9.166 45.113 14.309 789 HG2 GLU 107 HG2 GLU 107 -7.126 45.388 12.637 790 HG3 GLU 107 HG1 GLU 107 -8.005 44.424 11.576 791 H GLY 108 H GLY 108 -9.166 41.046 14.308 792 HA2 GLY 108 HA2 GLY 108 -10.215 41.576 17.006 793 HA3 GLY 108 HA1 GLY 108 -11.230 41.363 15.619 794 H LYS 109 H LYS 109 -11.677 40.126 17.921 795 HA LYS 109 HA LYS 109 -10.792 37.385 17.626 796 HB2 LYS 109 HB2 LYS 109 -12.451 38.745 19.712 797 HB3 LYS 109 HB1 LYS 109 -11.984 37.051 19.766 798 HG2 LYS 109 HG2 LYS 109 -10.061 39.399 19.740 799 HG3 LYS 109 HG1 LYS 109 -10.509 38.290 21.135 800 HD2 LYS 109 HD2 LYS 109 -9.847 36.372 20.088 801 HD3 LYS 109 HD1 LYS 109 -9.090 37.321 18.725 802 HE2 LYS 109 HE2 LYS 109 -8.422 37.708 21.609 803 HE3 LYS 109 HE1 LYS 109 -7.485 36.639 20.606 804 HZ1 LYS 109 HZ1 LYS 109 -6.723 39.081 20.656 805 HZ2 LYS 109 HZ2 LYS 109 -6.667 38.111 19.319 806 HZ3 LYS 109 HZ3 LYS 109 -7.808 39.331 19.496 807 H LYS 110 H LYS 110 -13.272 39.184 16.312 808 HA LYS 110 HA LYS 110 -14.917 36.984 15.723 809 HB2 LYS 110 HB2 LYS 110 -16.687 37.340 17.229 810 HB3 LYS 110 HB1 LYS 110 -15.395 37.087 18.253 811 HG2 LYS 110 HG2 LYS 110 -15.128 39.431 18.687 812 HG3 LYS 110 HG1 LYS 110 -16.472 39.838 17.496 813 HD2 LYS 110 HD2 LYS 110 -18.050 38.805 18.698 814 HD3 LYS 110 HD1 LYS 110 -16.906 38.097 19.895 815 HE2 LYS 110 HE2 LYS 110 -16.291 40.621 20.434 816 HE3 LYS 110 HE1 LYS 110 -17.634 41.042 19.456 817 HZ1 LYS 110 HZ1 LYS 110 -18.150 41.020 21.765 818 HZ2 LYS 110 HZ2 LYS 110 -19.124 40.045 21.010 819 HZ3 LYS 110 HZ3 LYS 110 -17.883 39.425 21.926 820 H LEU 111 H LEU 111 -16.930 37.565 14.485 821 HA LEU 111 HA LEU 111 -16.257 39.789 12.871 822 HB2 LEU 111 HB2 LEU 111 -18.472 37.898 12.915 823 HB3 LEU 111 HB1 LEU 111 -18.199 39.174 11.622 824 HG LEU 111 HG LEU 111 -16.430 36.815 12.297 825 HD11 LEU 111 1HD1 LEU 111 -18.555 36.169 11.079 826 HD12 LEU 111 2HD1 LEU 111 -18.093 37.304 9.862 827 HD13 LEU 111 3HD1 LEU 111 -17.057 35.876 10.123 828 HD21 LEU 111 3HD2 LEU 111 -15.084 38.696 11.492 829 HD22 LEU 111 1HD2 LEU 111 -15.073 37.556 10.209 830 HD23 LEU 111 2HD2 LEU 111 -16.222 38.902 10.104 831 H GLU 112 H GLU 112 -18.221 41.635 12.411 832 HA GLU 112 HA GLU 112 -20.087 42.413 14.234 833 HB2 GLU 112 HB2 GLU 112 -17.241 43.591 14.482 834 HB3 GLU 112 HB1 GLU 112 -18.715 44.196 15.373 835 HG2 GLU 112 HG2 GLU 112 -18.686 41.976 16.578 836 HG3 GLU 112 HG1 GLU 112 -17.111 41.784 15.839 837 H HIS 113 H HIS 113 -17.816 44.751 12.717 838 HA HIS 113 HA HIS 113 -20.054 45.697 11.231 839 HB2 HIS 113 HB2 HIS 113 -18.565 47.448 10.591 840 HB3 HIS 113 HB1 HIS 113 -18.321 46.999 12.309 841 HD2 HIS 113 HD2 HIS 113 -16.338 46.825 9.002 842 HE1 HIS 113 HE1 HIS 113 -13.784 45.550 12.121 843 HE2 HIS 113 HE2 HIS 113 -13.855 46.167 9.698 844 H HIS 114 H HIS 114 -17.771 43.254 10.611 845 HA HIS 114 HA HIS 114 -17.204 43.256 8.031 846 HB2 HIS 114 HB2 HIS 114 -17.697 40.833 9.835 847 HB3 HIS 114 HB1 HIS 114 -16.511 41.156 8.475 848 HD2 HIS 114 HD2 HIS 114 -14.266 42.433 9.083 849 HE1 HIS 114 HE1 HIS 114 -14.979 42.826 13.262 850 HE2 HIS 114 HE2 HIS 114 -13.242 43.152 11.478 Start of MODEL 6 1 H1 GLU 13 H1 GLU 13 -3.056 -16.459 10.321 2 H2 GLU 13 H2 GLU 13 -3.086 -16.652 8.682 3 H3 GLU 13 H3 GLU 13 -1.751 -16.186 9.441 4 HA GLU 13 HA GLU 13 -2.709 -14.354 8.278 5 HB2 GLU 13 HB2 GLU 13 -5.064 -15.729 8.623 6 HB3 GLU 13 HB1 GLU 13 -5.281 -14.789 9.954 7 HG2 GLU 13 HG2 GLU 13 -4.906 -12.726 8.539 8 HG3 GLU 13 HG1 GLU 13 -4.898 -13.741 7.136 9 H ASN 14 H ASN 14 -0.721 -14.235 9.779 10 HA ASN 14 HA ASN 14 -0.839 -11.835 11.392 11 HB2 ASN 14 HB2 ASN 14 -1.878 -13.786 12.852 12 HB3 ASN 14 HB1 ASN 14 -0.340 -14.587 12.604 13 HD21 ASN 14 1HD2 ASN 14 -0.197 -14.325 15.181 14 HD22 ASN 14 2HD2 ASN 14 0.332 -12.807 15.807 15 H ALA 15 H ALA 15 0.382 -12.686 9.219 16 HA ALA 15 HA ALA 15 3.018 -13.715 9.376 17 HB1 ALA 15 HB1 ALA 15 3.085 -13.135 7.109 18 HB2 ALA 15 HB2 ALA 15 1.373 -13.429 7.347 19 HB3 ALA 15 HB3 ALA 15 1.992 -11.746 7.352 20 H GLU 16 H GLU 16 2.213 -10.832 10.765 21 HA GLU 16 HA GLU 16 4.463 -9.245 10.037 22 HB2 GLU 16 HB2 GLU 16 3.334 -7.596 11.469 23 HB3 GLU 16 HB1 GLU 16 2.117 -8.371 10.641 24 HG2 GLU 16 HG2 GLU 16 1.633 -9.784 12.745 25 HG3 GLU 16 HG1 GLU 16 3.087 -8.831 13.443 26 H LEU 17 H LEU 17 4.391 -11.820 12.242 27 HA LEU 17 HA LEU 17 6.202 -10.855 14.138 28 HB2 LEU 17 HB2 LEU 17 5.618 -13.650 13.150 29 HB3 LEU 17 HB1 LEU 17 6.471 -13.288 14.607 30 HG LEU 17 HG LEU 17 3.569 -12.675 13.945 31 HD11 LEU 17 1HD1 LEU 17 4.744 -14.357 16.000 32 HD12 LEU 17 2HD1 LEU 17 2.972 -14.214 15.700 33 HD13 LEU 17 3HD1 LEU 17 4.031 -15.075 14.511 34 HD21 LEU 17 3HD2 LEU 17 3.446 -11.992 16.455 35 HD22 LEU 17 1HD2 LEU 17 5.159 -11.955 16.475 36 HD23 LEU 17 2HD2 LEU 17 4.356 -10.926 15.288 37 H GLU 18 H GLU 18 6.758 -11.220 11.095 38 HA GLU 18 HA GLU 18 9.656 -11.831 11.224 39 HB2 GLU 18 HB2 GLU 18 7.654 -12.247 8.944 40 HB3 GLU 18 HB1 GLU 18 9.261 -12.868 9.099 41 HG2 GLU 18 HG2 GLU 18 8.404 -14.081 11.258 42 HG3 GLU 18 HG1 GLU 18 6.769 -13.642 10.544 43 H ILE 19 H ILE 19 8.008 -9.061 10.784 44 HA ILE 19 HA ILE 19 9.217 -8.093 8.285 45 HB ILE 19 HB ILE 19 7.799 -6.308 8.763 46 HG12 ILE 19 2HG1 ILE 19 7.290 -7.441 11.529 47 HG13 ILE 19 1HG1 ILE 19 8.019 -5.966 11.034 48 HG21 ILE 19 1HG2 ILE 19 5.892 -7.285 8.327 49 HG22 ILE 19 2HG2 ILE 19 7.270 -8.044 7.613 50 HG23 ILE 19 3HG2 ILE 19 6.384 -8.894 9.043 51 HD11 ILE 19 HD3 ILE 19 5.106 -6.829 10.417 52 HD12 ILE 19 HD1 ILE 19 5.629 -5.726 11.764 53 HD13 ILE 19 HD2 ILE 19 5.846 -5.274 10.015 54 H VAL 20 H VAL 20 10.636 -6.049 8.246 55 HA VAL 20 HA VAL 20 12.273 -5.286 10.352 56 HB VAL 20 HB VAL 20 12.334 -3.147 9.108 57 HG11 VAL 20 1HG1 VAL 20 13.101 -4.202 6.899 58 HG12 VAL 20 2HG1 VAL 20 13.878 -5.046 8.244 59 HG13 VAL 20 3HG1 VAL 20 12.576 -5.801 7.477 60 HG21 VAL 20 3HG2 VAL 20 10.233 -2.718 8.387 61 HG22 VAL 20 1HG2 VAL 20 11.306 -2.969 7.052 62 HG23 VAL 20 2HG2 VAL 20 10.041 -4.164 7.360 63 H THR 21 H THR 21 12.423 -3.585 11.499 64 HA THR 21 HA THR 21 10.504 -2.808 13.167 65 HB THR 21 HB THR 21 13.105 -1.526 12.167 66 HG1 THR 21 HG1 THR 21 13.872 -2.345 14.059 67 HG21 THR 21 1HG2 THR 21 11.290 -0.234 14.291 68 HG22 THR 21 2HG2 THR 21 13.078 -0.270 14.540 69 HG23 THR 21 3HG2 THR 21 12.259 0.517 13.178 70 H ASP 22 H ASP 22 11.560 -0.450 10.686 71 HA ASP 22 HA ASP 22 9.646 1.109 11.420 72 HB2 ASP 22 HB2 ASP 22 11.325 0.983 8.854 73 HB3 ASP 22 HB1 ASP 22 10.505 2.489 9.462 74 H TYR 23 H TYR 23 8.263 -1.209 10.357 75 HA TYR 23 HA TYR 23 7.452 -1.111 7.641 76 HB2 TYR 23 HB2 TYR 23 7.465 -3.104 9.079 77 HB3 TYR 23 HB1 TYR 23 6.018 -2.340 9.862 78 HD1 TYR 23 HD1 TYR 23 7.220 -3.476 6.459 79 HD2 TYR 23 HD2 TYR 23 3.975 -2.462 8.981 80 HE1 TYR 23 HE1 TYR 23 5.772 -4.039 4.620 81 HE2 TYR 23 HE2 TYR 23 2.375 -3.437 7.284 82 HH TYR 23 HH TYR 23 3.531 -4.682 4.201 83 H TYR 24 H TYR 24 5.715 -0.056 6.773 84 HA TYR 24 HA TYR 24 4.138 2.011 7.836 85 HB2 TYR 24 HB2 TYR 24 2.941 1.717 5.754 86 HB3 TYR 24 HB1 TYR 24 4.394 2.536 5.801 87 HD1 TYR 24 HD1 TYR 24 2.880 -0.652 4.890 88 HD2 TYR 24 HD2 TYR 24 6.224 1.877 4.429 89 HE1 TYR 24 HE1 TYR 24 3.914 -2.376 3.327 90 HE2 TYR 24 HE2 TYR 24 7.285 0.238 2.789 91 HH TYR 24 HH TYR 24 5.823 -2.770 1.989 92 H LYS 25 H LYS 25 3.373 1.228 9.652 93 HA LYS 25 HA LYS 25 1.002 -0.589 9.625 94 HB2 LYS 25 HB2 LYS 25 2.277 0.912 11.873 95 HB3 LYS 25 HB1 LYS 25 0.909 -0.049 12.009 96 HG2 LYS 25 HG2 LYS 25 2.343 -2.071 11.237 97 HG3 LYS 25 HG1 LYS 25 3.675 -1.034 10.891 98 HD2 LYS 25 HD2 LYS 25 3.558 -0.348 13.394 99 HD3 LYS 25 HD1 LYS 25 2.265 -1.502 13.444 100 HE2 LYS 25 HE2 LYS 25 4.010 -3.297 12.712 101 HE3 LYS 25 HE1 LYS 25 5.281 -2.076 12.631 102 HZ1 LYS 25 HZ1 LYS 25 5.138 -3.327 14.719 103 HZ2 LYS 25 HZ2 LYS 25 4.910 -1.759 14.963 104 HZ3 LYS 25 HZ3 LYS 25 3.588 -2.732 14.970 105 H ILE 26 H ILE 26 1.383 3.141 9.763 106 HA ILE 26 HA ILE 26 -1.307 3.635 10.440 107 HB ILE 26 HB ILE 26 -1.158 5.669 9.316 108 HG12 ILE 26 2HG1 ILE 26 -0.009 5.184 7.151 109 HG13 ILE 26 1HG1 ILE 26 0.657 6.522 8.106 110 HG21 ILE 26 1HG2 ILE 26 0.589 6.705 10.594 111 HG22 ILE 26 2HG2 ILE 26 -0.227 5.352 11.402 112 HG23 ILE 26 3HG2 ILE 26 1.404 5.139 10.768 113 HD11 ILE 26 HD3 ILE 26 2.370 5.206 7.073 114 HD12 ILE 26 HD1 ILE 26 2.530 5.195 8.892 115 HD13 ILE 26 HD2 ILE 26 1.953 3.799 7.945 116 H ILE 27 H ILE 27 0.071 2.494 7.385 117 HA ILE 27 HA ILE 27 -2.410 2.531 5.894 118 HB ILE 27 HB ILE 27 0.358 1.316 5.231 119 HG12 ILE 27 2HG1 ILE 27 -1.163 3.654 3.964 120 HG13 ILE 27 1HG1 ILE 27 -0.126 3.852 5.446 121 HG21 ILE 27 1HG2 ILE 27 -1.261 -0.115 4.388 122 HG22 ILE 27 2HG2 ILE 27 -2.272 1.182 3.796 123 HG23 ILE 27 3HG2 ILE 27 -0.594 0.821 3.101 124 HD11 ILE 27 HD3 ILE 27 0.863 4.278 3.119 125 HD12 ILE 27 HD1 ILE 27 1.791 3.214 4.177 126 HD13 ILE 27 HD2 ILE 27 0.925 2.418 3.015 127 H LYS 28 H LYS 28 -0.663 0.005 7.742 128 HA LYS 28 HA LYS 28 -2.111 -2.099 6.925 129 HB2 LYS 28 HB2 LYS 28 0.038 -2.133 8.025 130 HB3 LYS 28 HB1 LYS 28 -0.638 -1.601 9.555 131 HG2 LYS 28 HG2 LYS 28 -2.128 -3.546 9.724 132 HG3 LYS 28 HG1 LYS 28 -1.382 -4.284 8.354 133 HD2 LYS 28 HD2 LYS 28 0.669 -4.527 9.362 134 HD3 LYS 28 HD1 LYS 28 0.341 -3.690 10.871 135 HE2 LYS 28 HE2 LYS 28 -1.081 -6.202 9.781 136 HE3 LYS 28 HE1 LYS 28 0.378 -6.260 10.813 137 HZ1 LYS 28 HZ1 LYS 28 -2.151 -5.767 11.695 138 HZ2 LYS 28 HZ2 LYS 28 -0.824 -6.327 12.427 139 HZ3 LYS 28 HZ3 LYS 28 -1.067 -4.669 12.269 140 H THR 29 H THR 29 -2.753 0.074 9.620 141 HA THR 29 HA THR 29 -4.600 -1.580 10.994 142 HB THR 29 HB THR 29 -5.178 0.437 12.111 143 HG1 THR 29 HG1 THR 29 -3.556 2.289 11.291 144 HG21 THR 29 1HG2 THR 29 -3.296 -0.511 13.214 145 HG22 THR 29 2HG2 THR 29 -2.162 0.067 11.962 146 HG23 THR 29 3HG2 THR 29 -3.031 1.270 12.995 147 H ALA 30 H ALA 30 -5.058 0.957 8.455 148 HA ALA 30 HA ALA 30 -7.871 0.613 8.228 149 HB1 ALA 30 HB1 ALA 30 -7.440 2.163 6.375 150 HB2 ALA 30 HB2 ALA 30 -6.151 2.572 7.512 151 HB3 ALA 30 HB3 ALA 30 -5.859 1.438 6.150 152 H ARG 31 H ARG 31 -5.194 -0.815 6.215 153 HA ARG 31 HA ARG 31 -6.912 -2.193 4.427 154 HB2 ARG 31 HB2 ARG 31 -4.159 -2.731 5.626 155 HB3 ARG 31 HB1 ARG 31 -5.092 -3.596 4.293 156 HG2 ARG 31 HG2 ARG 31 -4.894 -1.399 2.979 157 HG3 ARG 31 HG1 ARG 31 -4.147 -0.695 4.317 158 HD2 ARG 31 HD2 ARG 31 -2.345 -1.160 2.814 159 HD3 ARG 31 HD1 ARG 31 -2.219 -2.319 3.980 160 HE ARG 31 HE ARG 31 -3.860 -3.305 1.783 161 HH11 ARG 31 1HH2 ARG 31 -0.506 -2.783 2.926 162 HH12 ARG 31 2HH2 ARG 31 0.082 -4.123 1.978 163 HH21 ARG 31 1HH1 ARG 31 -2.919 -5.380 1.005 164 HH22 ARG 31 2HH1 ARG 31 -1.315 -5.497 0.826 165 H GLU 32 H GLU 32 -6.264 -2.934 7.983 166 HA GLU 32 HA GLU 32 -7.369 -5.646 7.816 167 HB2 GLU 32 HB2 GLU 32 -6.343 -3.701 9.888 168 HB3 GLU 32 HB1 GLU 32 -7.305 -5.072 10.481 169 HG2 GLU 32 HG2 GLU 32 -5.978 -6.682 9.790 170 HG3 GLU 32 HG1 GLU 32 -4.950 -5.445 8.835 171 H GLN 33 H GLN 33 -8.732 -2.346 8.684 172 HA GLN 33 HA GLN 33 -11.067 -3.374 9.819 173 HB2 GLN 33 HB2 GLN 33 -10.201 -0.769 8.403 174 HB3 GLN 33 HB1 GLN 33 -11.789 -0.987 9.139 175 HG2 GLN 33 HG2 GLN 33 -10.607 -1.699 11.251 176 HG3 GLN 33 HG1 GLN 33 -9.076 -1.231 10.543 177 HE21 GLN 33 1HE2 GLN 33 -9.151 -0.081 12.439 178 HE22 GLN 33 2HE2 GLN 33 -9.760 1.499 12.669 179 H LEU 34 H LEU 34 -10.292 -1.978 6.581 180 HA LEU 34 HA LEU 34 -12.596 -2.606 5.204 181 HB2 LEU 34 HB2 LEU 34 -9.631 -2.197 4.579 182 HB3 LEU 34 HB1 LEU 34 -10.769 -2.189 3.339 183 HG LEU 34 HG LEU 34 -10.924 -0.254 5.643 184 HD11 LEU 34 1HD1 LEU 34 -10.335 0.274 2.660 185 HD12 LEU 34 2HD1 LEU 34 -10.003 1.303 4.041 186 HD13 LEU 34 3HD1 LEU 34 -9.078 -0.112 3.816 187 HD21 LEU 34 3HD2 LEU 34 -13.138 -0.365 4.951 188 HD22 LEU 34 1HD2 LEU 34 -12.558 0.926 3.988 189 HD23 LEU 34 2HD2 LEU 34 -12.720 -0.650 3.173 190 H GLY 35 H GLY 35 -10.126 -4.775 6.175 191 HA2 GLY 35 HA2 GLY 35 -9.572 -6.963 5.635 192 HA3 GLY 35 HA1 GLY 35 -11.253 -6.980 4.904 193 H ILE 36 H ILE 36 -9.902 -4.807 3.071 194 HA ILE 36 HA ILE 36 -10.127 -6.032 0.793 195 HB ILE 36 HB ILE 36 -8.754 -4.193 -0.066 196 HG12 ILE 36 2HG1 ILE 36 -8.754 -3.150 2.695 197 HG13 ILE 36 1HG1 ILE 36 -7.348 -3.706 1.804 198 HG21 ILE 36 1HG2 ILE 36 -10.473 -2.698 0.422 199 HG22 ILE 36 2HG2 ILE 36 -11.136 -4.382 -0.056 200 HG23 ILE 36 3HG2 ILE 36 -11.274 -3.893 1.556 201 HD11 ILE 36 HD3 ILE 36 -7.837 -1.730 0.108 202 HD12 ILE 36 HD1 ILE 36 -9.079 -1.267 1.382 203 HD13 ILE 36 HD2 ILE 36 -7.416 -1.369 1.825 204 H SER 37 H SER 37 -9.005 -7.214 -0.593 205 HA SER 37 HA SER 37 -6.316 -8.245 -0.090 206 HB2 SER 37 HB2 SER 37 -6.734 -9.531 -2.158 207 HB3 SER 37 HB1 SER 37 -8.265 -9.320 -1.341 208 HG SER 37 HG SER 37 -8.657 -8.864 -3.416 209 H GLN 38 H GLN 38 -4.779 -8.247 -2.053 210 HA GLN 38 HA GLN 38 -3.958 -5.523 -2.514 211 HB2 GLN 38 HB2 GLN 38 -3.206 -8.227 -3.781 212 HB3 GLN 38 HB1 GLN 38 -2.565 -6.702 -4.419 213 HG2 GLN 38 HG2 GLN 38 -1.942 -6.286 -1.791 214 HG3 GLN 38 HG1 GLN 38 -2.253 -7.964 -1.662 215 HE21 GLN 38 1HE2 GLN 38 0.352 -7.515 -1.077 216 HE22 GLN 38 2HE2 GLN 38 1.286 -8.200 -2.373 217 H GLN 39 H GLN 39 -5.914 -7.791 -4.627 218 HA GLN 39 HA GLN 39 -6.031 -6.069 -6.825 219 HB2 GLN 39 HB2 GLN 39 -6.665 -8.576 -6.664 220 HB3 GLN 39 HB1 GLN 39 -7.977 -8.163 -5.716 221 HG2 GLN 39 HG2 GLN 39 -8.916 -8.327 -7.944 222 HG3 GLN 39 HG1 GLN 39 -8.703 -6.625 -7.729 223 HE21 GLN 39 1HE2 GLN 39 -7.025 -9.605 -8.969 224 HE22 GLN 39 2HE2 GLN 39 -6.209 -8.772 -10.301 225 H GLN 40 H GLN 40 -7.988 -6.157 -3.989 226 HA GLN 40 HA GLN 40 -9.905 -4.133 -4.946 227 HB2 GLN 40 HB2 GLN 40 -9.420 -5.138 -2.059 228 HB3 GLN 40 HB1 GLN 40 -10.587 -4.052 -2.525 229 HG2 GLN 40 HG2 GLN 40 -11.829 -5.778 -3.748 230 HG3 GLN 40 HG1 GLN 40 -10.400 -6.850 -3.671 231 HE21 GLN 40 1HE2 GLN 40 -13.041 -5.534 -1.834 232 HE22 GLN 40 2HE2 GLN 40 -12.718 -6.551 -0.365 233 H LEU 41 H LEU 41 -6.884 -3.972 -3.010 234 HA LEU 41 HA LEU 41 -7.077 -1.214 -2.561 235 HB2 LEU 41 HB2 LEU 41 -5.535 -2.818 -1.398 236 HB3 LEU 41 HB1 LEU 41 -4.727 -3.099 -2.885 237 HG LEU 41 HG LEU 41 -3.896 -0.746 -3.020 238 HD11 LEU 41 1HD1 LEU 41 -4.135 0.585 -0.928 239 HD12 LEU 41 2HD1 LEU 41 -5.758 0.290 -1.643 240 HD13 LEU 41 3HD1 LEU 41 -5.245 -0.706 -0.338 241 HD21 LEU 41 3HD2 LEU 41 -2.039 -1.036 -1.518 242 HD22 LEU 41 1HD2 LEU 41 -3.071 -1.797 -0.405 243 HD23 LEU 41 2HD2 LEU 41 -2.513 -2.691 -1.784 244 H ALA 42 H ALA 42 -5.521 -3.188 -5.356 245 HA ALA 42 HA ALA 42 -4.758 -1.014 -6.823 246 HB1 ALA 42 HB1 ALA 42 -4.233 -3.542 -7.188 247 HB2 ALA 42 HB2 ALA 42 -5.850 -3.765 -7.844 248 HB3 ALA 42 HB3 ALA 42 -4.709 -2.747 -8.637 249 H GLN 43 H GLN 43 -8.048 -2.426 -6.609 250 HA GLN 43 HA GLN 43 -9.129 -0.614 -8.433 251 HB2 GLN 43 HB2 GLN 43 -10.187 -2.063 -6.112 252 HB3 GLN 43 HB1 GLN 43 -11.273 -1.069 -7.148 253 HG2 GLN 43 HG2 GLN 43 -10.657 -2.425 -9.169 254 HG3 GLN 43 HG1 GLN 43 -9.438 -3.224 -8.378 255 HE21 GLN 43 1HE2 GLN 43 -9.834 -5.099 -7.184 256 HE22 GLN 43 2HE2 GLN 43 -11.345 -5.930 -7.148 257 H LYS 44 H LYS 44 -8.390 -0.078 -5.018 258 HA LYS 44 HA LYS 44 -10.071 2.183 -4.662 259 HB2 LYS 44 HB2 LYS 44 -9.348 0.925 -2.673 260 HB3 LYS 44 HB1 LYS 44 -7.635 1.149 -3.295 261 HG2 LYS 44 HG2 LYS 44 -7.961 2.366 -1.289 262 HG3 LYS 44 HG1 LYS 44 -7.830 3.582 -2.631 263 HD2 LYS 44 HD2 LYS 44 -10.278 3.664 -2.646 264 HD3 LYS 44 HD1 LYS 44 -10.303 2.742 -1.131 265 HE2 LYS 44 HE2 LYS 44 -8.335 4.450 -0.451 266 HE3 LYS 44 HE1 LYS 44 -9.262 5.575 -1.577 267 HZ1 LYS 44 HZ1 LYS 44 -10.170 4.409 0.919 268 HZ2 LYS 44 HZ2 LYS 44 -9.781 5.931 0.456 269 HZ3 LYS 44 HZ3 LYS 44 -11.078 5.072 -0.269 270 H LEU 45 H LEU 45 -7.568 1.773 -6.752 271 HA LEU 45 HA LEU 45 -6.476 4.357 -6.435 272 HB2 LEU 45 HB2 LEU 45 -5.289 2.655 -5.096 273 HB3 LEU 45 HB1 LEU 45 -4.821 1.717 -6.469 274 HG LEU 45 HG LEU 45 -3.318 3.626 -7.160 275 HD11 LEU 45 1HD1 LEU 45 -4.549 5.505 -6.180 276 HD12 LEU 45 2HD1 LEU 45 -4.225 4.865 -4.602 277 HD13 LEU 45 3HD1 LEU 45 -2.854 5.482 -5.508 278 HD21 LEU 45 3HD2 LEU 45 -2.793 2.847 -4.272 279 HD22 LEU 45 1HD2 LEU 45 -2.527 1.800 -5.687 280 HD23 LEU 45 2HD2 LEU 45 -1.618 3.320 -5.427 281 H LYS 46 H LYS 46 -7.747 2.213 -8.430 282 HA LYS 46 HA LYS 46 -8.310 2.155 -10.563 283 HB2 LYS 46 HB2 LYS 46 -7.059 4.941 -10.585 284 HB3 LYS 46 HB1 LYS 46 -7.902 4.208 -11.903 285 HG2 LYS 46 HG2 LYS 46 -9.940 3.713 -10.684 286 HG3 LYS 46 HG1 LYS 46 -9.263 4.517 -9.216 287 HD2 LYS 46 HD2 LYS 46 -10.724 5.982 -10.358 288 HD3 LYS 46 HD1 LYS 46 -9.080 6.644 -10.277 289 HE2 LYS 46 HE2 LYS 46 -8.748 6.133 -12.636 290 HE3 LYS 46 HE1 LYS 46 -10.187 5.137 -12.650 291 HZ1 LYS 46 HZ1 LYS 46 -11.528 7.217 -12.366 292 HZ2 LYS 46 HZ2 LYS 46 -10.092 8.092 -12.456 293 HZ3 LYS 46 HZ3 LYS 46 -10.558 7.205 -13.647 294 H VAL 47 H VAL 47 -5.569 1.118 -9.676 295 HA VAL 47 HA VAL 47 -4.203 1.157 -12.182 296 HB VAL 47 HB VAL 47 -2.128 0.609 -10.506 297 HG11 VAL 47 1HG1 VAL 47 -1.983 3.037 -10.189 298 HG12 VAL 47 2HG1 VAL 47 -2.512 2.661 -11.732 299 HG13 VAL 47 3HG1 VAL 47 -3.737 3.170 -10.520 300 HG21 VAL 47 3HG2 VAL 47 -3.353 0.143 -8.418 301 HG22 VAL 47 1HG2 VAL 47 -2.398 1.599 -8.293 302 HG23 VAL 47 2HG2 VAL 47 -4.189 1.706 -8.636 303 H SER 48 H SER 48 -2.349 -1.043 -12.008 304 HA SER 48 HA SER 48 -3.815 -3.549 -11.523 305 HB2 SER 48 HB2 SER 48 -1.669 -4.435 -12.408 306 HB3 SER 48 HB1 SER 48 -2.392 -3.197 -13.476 307 HG SER 48 HG SER 48 -0.943 -1.851 -12.972 308 H GLU 49 H GLU 49 -2.966 -5.349 -10.274 309 HA GLU 49 HA GLU 49 -1.830 -4.633 -7.899 310 HB2 GLU 49 HB2 GLU 49 -2.015 -7.314 -9.289 311 HB3 GLU 49 HB1 GLU 49 -1.235 -7.220 -7.782 312 HG2 GLU 49 HG2 GLU 49 -3.254 -6.291 -6.717 313 HG3 GLU 49 HG1 GLU 49 -4.132 -6.334 -8.239 314 H ASN 50 H ASN 50 -0.256 -5.151 -11.034 315 HA ASN 50 HA ASN 50 2.293 -5.677 -9.989 316 HB2 ASN 50 HB2 ASN 50 1.626 -6.054 -12.422 317 HB3 ASN 50 HB1 ASN 50 1.423 -4.334 -12.577 318 HD21 ASN 50 1HD2 ASN 50 3.824 -6.883 -11.332 319 HD22 ASN 50 2HD2 ASN 50 5.100 -6.216 -12.332 320 H ILE 51 H ILE 51 0.561 -2.591 -10.222 321 HA ILE 51 HA ILE 51 2.677 -0.939 -9.437 322 HB ILE 51 HB ILE 51 -0.271 -0.537 -9.766 323 HG12 ILE 51 2HG1 ILE 51 2.342 0.482 -11.047 324 HG13 ILE 51 1HG1 ILE 51 1.196 -0.742 -11.732 325 HG21 ILE 51 1HG2 ILE 51 1.773 1.396 -8.713 326 HG22 ILE 51 2HG2 ILE 51 0.114 1.790 -9.316 327 HG23 ILE 51 3HG2 ILE 51 0.178 0.825 -7.936 328 HD11 ILE 51 HD3 ILE 51 -0.476 1.010 -11.743 329 HD12 ILE 51 HD1 ILE 51 0.726 2.311 -11.462 330 HD13 ILE 51 HD2 ILE 51 0.882 1.198 -12.869 331 H VAL 52 H VAL 52 0.168 -2.793 -7.542 332 HA VAL 52 HA VAL 52 0.902 -1.319 -5.234 333 HB VAL 52 HB VAL 52 -0.781 -2.339 -4.147 334 HG11 VAL 52 1HG1 VAL 52 -2.104 -2.438 -6.940 335 HG12 VAL 52 2HG1 VAL 52 -2.601 -1.828 -5.294 336 HG13 VAL 52 3HG1 VAL 52 -1.459 -0.991 -6.278 337 HG21 VAL 52 3HG2 VAL 52 -0.754 -4.769 -5.896 338 HG22 VAL 52 1HG2 VAL 52 -0.278 -4.532 -4.223 339 HG23 VAL 52 2HG2 VAL 52 -1.926 -4.391 -4.654 340 H LYS 53 H LYS 53 1.659 -4.844 -6.105 341 HA LYS 53 HA LYS 53 3.403 -5.679 -4.242 342 HB2 LYS 53 HB2 LYS 53 3.301 -5.669 -7.171 343 HB3 LYS 53 HB1 LYS 53 4.586 -6.575 -6.357 344 HG2 LYS 53 HG2 LYS 53 2.910 -7.840 -5.016 345 HG3 LYS 53 HG1 LYS 53 1.543 -6.882 -5.608 346 HD2 LYS 53 HD2 LYS 53 1.857 -7.914 -7.722 347 HD3 LYS 53 HD1 LYS 53 3.361 -8.785 -7.241 348 HE2 LYS 53 HE2 LYS 53 1.477 -10.323 -7.099 349 HE3 LYS 53 HE1 LYS 53 1.890 -9.775 -5.419 350 HZ1 LYS 53 HZ1 LYS 53 -0.317 -9.786 -5.614 351 HZ2 LYS 53 HZ2 LYS 53 -0.046 -8.151 -5.925 352 HZ3 LYS 53 HZ3 LYS 53 -0.402 -9.178 -7.099 353 H ARG 54 H ARG 54 4.118 -2.820 -6.139 354 HA ARG 54 HA ARG 54 6.940 -2.860 -6.242 355 HB2 ARG 54 HB2 ARG 54 4.907 -0.577 -5.608 356 HB3 ARG 54 HB1 ARG 54 6.603 -0.389 -6.166 357 HG2 ARG 54 HG2 ARG 54 6.315 -1.462 -8.207 358 HG3 ARG 54 HG1 ARG 54 4.582 -1.764 -7.923 359 HD2 ARG 54 HD2 ARG 54 4.239 0.568 -7.878 360 HD3 ARG 54 HD1 ARG 54 5.953 0.954 -7.838 361 HE ARG 54 HE ARG 54 5.429 -0.622 -10.170 362 HH11 ARG 54 1HH2 ARG 54 4.268 2.740 -9.041 363 HH12 ARG 54 2HH2 ARG 54 4.311 3.195 -10.712 364 HH21 ARG 54 1HH1 ARG 54 5.521 0.410 -12.092 365 HH22 ARG 54 2HH1 ARG 54 5.090 2.080 -12.352 366 H PHE 55 H PHE 55 4.903 -1.719 -3.421 367 HA PHE 55 HA PHE 55 7.357 -1.818 -1.804 368 HB2 PHE 55 HB2 PHE 55 6.221 -0.628 -0.226 369 HB3 PHE 55 HB1 PHE 55 6.116 0.209 -1.768 370 HD1 PHE 55 HD1 PHE 55 4.353 -1.512 0.772 371 HD2 PHE 55 HD2 PHE 55 3.844 0.423 -3.014 372 HE1 PHE 55 HE1 PHE 55 1.801 -1.513 0.989 373 HE2 PHE 55 HE2 PHE 55 1.449 0.275 -2.892 374 HZ PHE 55 HZ PHE 55 0.409 -0.588 -0.790 375 H GLU 56 H GLU 56 3.875 -3.152 -1.696 376 HA GLU 56 HA GLU 56 3.920 -4.727 0.173 377 HB2 GLU 56 HB2 GLU 56 2.805 -5.021 -2.497 378 HB3 GLU 56 HB1 GLU 56 2.759 -6.480 -1.463 379 HG2 GLU 56 HG2 GLU 56 1.975 -3.785 -0.411 380 HG3 GLU 56 HG1 GLU 56 0.855 -4.680 -1.344 381 H SER 57 H SER 57 6.047 -5.671 -2.474 382 HA SER 57 HA SER 57 6.316 -8.383 -1.903 383 HB2 SER 57 HB2 SER 57 8.123 -6.467 -3.364 384 HB3 SER 57 HB1 SER 57 8.345 -8.160 -3.356 385 HG SER 57 HG SER 57 6.465 -6.467 -4.641 386 H GLY 58 H GLY 58 7.696 -5.776 -0.225 387 HA2 GLY 58 HA2 GLY 58 8.685 -6.069 2.008 388 HA3 GLY 58 HA1 GLY 58 8.334 -7.736 1.793 389 H LYS 59 H LYS 59 10.399 -6.637 -0.692 390 HA LYS 59 HA LYS 59 12.592 -8.080 0.417 391 HB2 LYS 59 HB2 LYS 59 12.291 -6.156 -1.976 392 HB3 LYS 59 HB1 LYS 59 13.460 -7.484 -1.897 393 HG2 LYS 59 HG2 LYS 59 10.512 -7.710 -2.408 394 HG3 LYS 59 HG1 LYS 59 11.806 -8.132 -3.387 395 HD2 LYS 59 HD2 LYS 59 12.664 -9.814 -2.083 396 HD3 LYS 59 HD1 LYS 59 11.564 -9.574 -0.694 397 HE2 LYS 59 HE2 LYS 59 9.615 -9.936 -2.526 398 HE3 LYS 59 HE1 LYS 59 10.972 -10.493 -3.549 399 HZ1 LYS 59 HZ1 LYS 59 11.549 -12.132 -2.155 400 HZ2 LYS 59 HZ2 LYS 59 10.482 -11.822 -0.990 401 HZ3 LYS 59 HZ3 LYS 59 9.935 -12.304 -2.403 402 H LEU 60 H LEU 60 11.750 -5.112 1.228 403 HA LEU 60 HA LEU 60 14.492 -4.054 1.668 404 HB2 LEU 60 HB2 LEU 60 12.656 -3.114 -0.104 405 HB3 LEU 60 HB1 LEU 60 12.189 -2.223 1.304 406 HG LEU 60 HG LEU 60 14.788 -1.780 1.431 407 HD11 LEU 60 1HD1 LEU 60 15.618 -3.063 -0.434 408 HD12 LEU 60 2HD1 LEU 60 14.213 -2.447 -1.378 409 HD13 LEU 60 3HD1 LEU 60 15.632 -1.409 -1.018 410 HD21 LEU 60 3HD2 LEU 60 12.806 -0.133 1.004 411 HD22 LEU 60 1HD2 LEU 60 14.406 0.343 0.327 412 HD23 LEU 60 2HD2 LEU 60 13.164 -0.350 -0.727 413 H LYS 61 H LYS 61 14.869 -2.457 3.190 414 HA LYS 61 HA LYS 61 12.984 -2.272 5.460 415 HB2 LYS 61 HB2 LYS 61 15.132 -2.770 5.820 416 HB3 LYS 61 HB1 LYS 61 15.767 -1.280 5.084 417 HG2 LYS 61 HG2 LYS 61 14.305 -0.006 6.706 418 HG3 LYS 61 HG1 LYS 61 14.005 -1.554 7.600 419 HD2 LYS 61 HD2 LYS 61 15.614 -0.628 8.833 420 HD3 LYS 61 HD1 LYS 61 16.353 -1.914 7.904 421 HE2 LYS 61 HE2 LYS 61 17.064 -0.050 6.194 422 HE3 LYS 61 HE1 LYS 61 16.577 1.084 7.458 423 HZ1 LYS 61 HZ1 LYS 61 18.629 -1.038 7.778 424 HZ2 LYS 61 HZ2 LYS 61 19.008 0.473 7.528 425 HZ3 LYS 61 HZ3 LYS 61 18.225 0.040 8.911 426 HA PRO 62 HA PRO 62 11.605 1.344 3.308 427 HB2 PRO 62 HB1 PRO 62 9.610 2.325 5.011 428 HB3 PRO 62 HB2 PRO 62 9.389 0.808 4.107 429 HG2 PRO 62 HG1 PRO 62 10.182 1.069 6.950 430 HG3 PRO 62 HG2 PRO 62 8.927 0.114 6.194 431 HD2 PRO 62 HD1 PRO 62 11.664 -0.633 6.767 432 HD3 PRO 62 HD2 PRO 62 10.672 -1.397 5.454 433 H THR 63 H THR 63 11.230 3.857 3.758 434 HA THR 63 HA THR 63 12.943 4.753 5.882 435 HB THR 63 HB THR 63 14.034 6.368 4.290 436 HG1 THR 63 HG1 THR 63 13.891 5.723 2.067 437 HG21 THR 63 1HG2 THR 63 15.127 4.079 4.846 438 HG22 THR 63 2HG2 THR 63 14.415 3.416 3.380 439 HG23 THR 63 3HG2 THR 63 15.486 4.788 3.256 440 H ILE 64 H ILE 64 12.891 7.546 5.632 441 HA ILE 64 HA ILE 64 10.552 8.432 6.472 442 HB ILE 64 HB ILE 64 12.781 10.012 5.234 443 HG12 ILE 64 2HG1 ILE 64 12.019 9.459 8.205 444 HG13 ILE 64 1HG1 ILE 64 13.059 8.393 7.385 445 HG21 ILE 64 1HG2 ILE 64 10.787 11.284 5.221 446 HG22 ILE 64 2HG2 ILE 64 10.331 10.776 6.802 447 HG23 ILE 64 3HG2 ILE 64 11.779 11.802 6.555 448 HD11 ILE 64 HD3 ILE 64 13.981 10.457 8.772 449 HD12 ILE 64 HD1 ILE 64 14.702 9.982 7.181 450 HD13 ILE 64 HD2 ILE 64 13.652 11.420 7.436 451 H SER 65 H SER 65 12.153 8.870 3.246 452 HA SER 65 HA SER 65 9.919 10.148 1.960 453 HB2 SER 65 HB2 SER 65 11.119 9.731 -0.085 454 HB3 SER 65 HB1 SER 65 12.280 10.400 0.950 455 HG SER 65 HG SER 65 13.392 8.629 0.531 456 H GLN 66 H GLN 66 10.625 6.612 2.279 457 HA GLN 66 HA GLN 66 8.603 5.992 0.368 458 HB2 GLN 66 HB2 GLN 66 10.030 4.461 2.518 459 HB3 GLN 66 HB1 GLN 66 8.806 3.707 1.374 460 HG2 GLN 66 HG2 GLN 66 10.227 4.729 -0.341 461 HG3 GLN 66 HG1 GLN 66 11.370 5.101 0.815 462 HE21 GLN 66 1HE2 GLN 66 13.086 3.589 0.026 463 HE22 GLN 66 2HE2 GLN 66 12.901 1.832 0.210 464 H ALA 67 H ALA 67 8.574 5.901 3.999 465 HA ALA 67 HA ALA 67 5.869 5.907 4.525 466 HB1 ALA 67 HB1 ALA 67 7.444 5.948 6.205 467 HB2 ALA 67 HB2 ALA 67 8.287 7.368 5.683 468 HB3 ALA 67 HB3 ALA 67 6.642 7.571 6.315 469 H ARG 68 H ARG 68 7.652 8.773 3.568 470 HA ARG 68 HA ARG 68 5.350 10.362 3.506 471 HB2 ARG 68 HB2 ARG 68 7.776 11.093 3.387 472 HB3 ARG 68 HB1 ARG 68 7.814 11.010 1.658 473 HG2 ARG 68 HG2 ARG 68 5.759 12.616 1.676 474 HG3 ARG 68 HG1 ARG 68 6.304 12.852 3.375 475 HD2 ARG 68 HD2 ARG 68 8.397 13.586 2.625 476 HD3 ARG 68 HD1 ARG 68 8.020 13.223 0.915 477 HE ARG 68 HE ARG 68 6.972 15.335 0.921 478 HH11 ARG 68 1HH2 ARG 68 7.226 14.395 4.370 479 HH12 ARG 68 2HH2 ARG 68 6.768 15.974 4.890 480 HH21 ARG 68 1HH1 ARG 68 6.328 17.422 1.683 481 HH22 ARG 68 2HH1 ARG 68 6.573 17.651 3.384 482 H GLN 69 H GLN 69 6.706 8.580 0.725 483 HA GLN 69 HA GLN 69 4.921 10.046 -0.987 484 HB2 GLN 69 HB2 GLN 69 6.666 7.496 -1.248 485 HB3 GLN 69 HB1 GLN 69 5.731 8.228 -2.628 486 HG2 GLN 69 HG2 GLN 69 6.942 10.049 -2.878 487 HG3 GLN 69 HG1 GLN 69 7.691 10.022 -1.284 488 HE21 GLN 69 1HE2 GLN 69 9.071 7.893 -0.998 489 HE22 GLN 69 2HE2 GLN 69 10.268 7.638 -2.225 490 H LEU 70 H LEU 70 5.069 6.776 0.397 491 HA LEU 70 HA LEU 70 2.787 5.573 -0.500 492 HB2 LEU 70 HB2 LEU 70 4.360 5.414 2.174 493 HB3 LEU 70 HB1 LEU 70 2.877 4.478 1.752 494 HG LEU 70 HG LEU 70 5.287 4.047 -0.021 495 HD11 LEU 70 1HD1 LEU 70 4.412 2.801 2.615 496 HD12 LEU 70 2HD1 LEU 70 5.474 1.995 1.371 497 HD13 LEU 70 3HD1 LEU 70 6.002 3.461 2.255 498 HD21 LEU 70 3HD2 LEU 70 4.010 2.415 -0.890 499 HD22 LEU 70 1HD2 LEU 70 2.917 2.383 0.557 500 HD23 LEU 70 2HD2 LEU 70 2.813 3.597 -0.637 501 H GLU 71 H GLU 71 2.776 7.102 2.711 502 HA GLU 71 HA GLU 71 0.138 6.990 3.308 503 HB2 GLU 71 HB2 GLU 71 2.129 9.218 3.694 504 HB3 GLU 71 HB1 GLU 71 0.603 9.317 4.364 505 HG2 GLU 71 HG2 GLU 71 0.818 7.159 5.536 506 HG3 GLU 71 HG1 GLU 71 2.567 7.154 5.262 507 H LYS 72 H LYS 72 1.577 9.009 0.846 508 HA LYS 72 HA LYS 72 -0.864 10.610 0.496 509 HB2 LYS 72 HB2 LYS 72 1.835 10.301 -0.951 510 HB3 LYS 72 HB1 LYS 72 0.545 11.315 -1.580 511 HG2 LYS 72 HG2 LYS 72 0.401 12.596 0.553 512 HG3 LYS 72 HG1 LYS 72 1.877 11.807 1.203 513 HD2 LYS 72 HD2 LYS 72 2.963 12.824 -1.014 514 HD3 LYS 72 HD1 LYS 72 1.403 13.646 -1.133 515 HE2 LYS 72 HE2 LYS 72 1.843 14.344 1.317 516 HE3 LYS 72 HE1 LYS 72 3.451 13.677 1.189 517 HZ1 LYS 72 HZ1 LYS 72 3.858 15.205 -0.823 518 HZ2 LYS 72 HZ2 LYS 72 2.537 15.915 -0.310 519 HZ3 LYS 72 HZ3 LYS 72 3.746 15.919 0.660 520 H ILE 73 H ILE 73 0.564 8.085 -1.581 521 HA ILE 73 HA ILE 73 -1.451 8.621 -3.521 522 HB ILE 73 HB ILE 73 -0.824 6.376 -4.531 523 HG12 ILE 73 2HG1 ILE 73 1.637 6.605 -2.764 524 HG13 ILE 73 1HG1 ILE 73 0.333 5.500 -2.358 525 HG21 ILE 73 1HG2 ILE 73 1.101 7.504 -5.601 526 HG22 ILE 73 2HG2 ILE 73 -0.238 8.661 -5.256 527 HG23 ILE 73 3HG2 ILE 73 1.160 8.532 -4.126 528 HD11 ILE 73 HD3 ILE 73 1.935 4.324 -3.461 529 HD12 ILE 73 HD1 ILE 73 0.584 4.384 -4.581 530 HD13 ILE 73 HD2 ILE 73 2.017 5.480 -4.812 531 H LEU 74 H LEU 74 -1.566 6.054 -0.856 532 HA LEU 74 HA LEU 74 -3.079 4.565 -2.462 533 HB2 LEU 74 HB2 LEU 74 -2.586 4.558 0.494 534 HB3 LEU 74 HB1 LEU 74 -3.195 3.059 -0.281 535 HG LEU 74 HG LEU 74 -0.513 4.285 -0.776 536 HD11 LEU 74 1HD1 LEU 74 -1.350 1.531 0.365 537 HD12 LEU 74 2HD1 LEU 74 0.275 2.120 0.070 538 HD13 LEU 74 3HD1 LEU 74 -0.824 2.854 1.283 539 HD21 LEU 74 3HD2 LEU 74 -1.761 1.700 -2.012 540 HD22 LEU 74 1HD2 LEU 74 -1.218 3.141 -2.891 541 HD23 LEU 74 2HD2 LEU 74 -0.070 2.176 -2.008 542 H GLY 75 H GLY 75 -4.147 7.150 -0.917 543 HA2 GLY 75 HA2 GLY 75 -6.248 8.066 -0.292 544 HA3 GLY 75 HA1 GLY 75 -6.996 6.779 -1.157 545 H ILE 76 H ILE 76 -5.105 5.333 1.428 546 HA ILE 76 HA ILE 76 -7.246 5.616 3.232 547 HB ILE 76 HB ILE 76 -7.048 3.133 3.825 548 HG12 ILE 76 2HG1 ILE 76 -5.424 3.103 1.347 549 HG13 ILE 76 1HG1 ILE 76 -4.825 2.853 3.015 550 HG21 ILE 76 1HG2 ILE 76 -8.766 2.364 2.397 551 HG22 ILE 76 2HG2 ILE 76 -8.836 4.125 2.189 552 HG23 ILE 76 3HG2 ILE 76 -7.973 3.227 1.019 553 HD11 ILE 76 HD3 ILE 76 -6.093 0.751 3.136 554 HD12 ILE 76 HD1 ILE 76 -6.715 1.101 1.436 555 HD13 ILE 76 HD2 ILE 76 -4.960 0.865 1.832 556 H LYS 77 H LYS 77 -6.419 4.802 5.558 557 HA LYS 77 HA LYS 77 -4.182 4.226 6.474 558 HB2 LYS 77 HB2 LYS 77 -2.910 6.065 7.181 559 HB3 LYS 77 HB1 LYS 77 -2.719 5.589 5.403 560 HG2 LYS 77 HG2 LYS 77 -4.320 7.596 5.136 561 HG3 LYS 77 HG1 LYS 77 -3.815 8.076 6.741 562 HD2 LYS 77 HD2 LYS 77 -1.381 8.051 5.984 563 HD3 LYS 77 HD1 LYS 77 -1.915 7.742 4.384 564 HE2 LYS 77 HE2 LYS 77 -2.532 10.305 5.833 565 HE3 LYS 77 HE1 LYS 77 -1.244 10.066 4.776 566 HZ1 LYS 77 HZ1 LYS 77 -3.613 10.866 4.006 567 HZ2 LYS 77 HZ2 LYS 77 -2.581 10.095 3.045 568 HZ3 LYS 77 HZ3 LYS 77 -3.932 9.329 3.761 569 H LEU 78 H LEU 78 -3.996 4.328 8.675 570 HA LEU 78 HA LEU 78 -5.943 6.035 10.026 571 HB2 LEU 78 HB2 LEU 78 -6.156 3.123 9.917 572 HB3 LEU 78 HB1 LEU 78 -6.687 4.056 11.438 573 HG LEU 78 HG LEU 78 -7.803 4.539 8.717 574 HD11 LEU 78 1HD1 LEU 78 -9.744 3.333 9.425 575 HD12 LEU 78 2HD1 LEU 78 -8.367 2.183 9.696 576 HD13 LEU 78 3HD1 LEU 78 -9.030 3.088 11.051 577 HD21 LEU 78 3HD2 LEU 78 -7.883 6.501 10.213 578 HD22 LEU 78 1HD2 LEU 78 -9.445 5.894 10.126 579 HD23 LEU 78 2HD2 LEU 78 -8.462 5.413 11.523 580 H VAL 79 H VAL 79 -3.860 5.799 13.052 581 HA VAL 79 HA VAL 79 -6.615 6.286 12.375 582 HB VAL 79 HB VAL 79 -6.516 7.250 14.692 583 HG11 VAL 79 1HG1 VAL 79 -6.560 4.833 14.525 584 HG12 VAL 79 2HG1 VAL 79 -4.853 4.770 14.846 585 HG13 VAL 79 3HG1 VAL 79 -5.979 5.562 16.048 586 HG21 VAL 79 3HG2 VAL 79 -4.440 8.570 14.705 587 HG22 VAL 79 1HG2 VAL 79 -4.374 7.376 15.983 588 HG23 VAL 79 2HG2 VAL 79 -3.599 7.034 14.407 589 H THR 80 H THR 80 -7.398 8.381 13.072 590 HA THR 80 HA THR 80 -7.081 9.987 10.689 591 HB THR 80 HB THR 80 -8.988 11.182 11.496 592 HG1 THR 80 HG1 THR 80 -8.828 9.508 13.653 593 HG21 THR 80 1HG2 THR 80 -10.480 9.056 11.499 594 HG22 THR 80 2HG2 THR 80 -9.133 8.982 10.275 595 HG23 THR 80 3HG2 THR 80 -9.151 8.106 11.706 596 HA PRO 81 HA PRO 81 -4.728 13.389 12.418 597 HB2 PRO 81 HB1 PRO 81 -6.904 15.032 11.055 598 HB3 PRO 81 HB2 PRO 81 -5.182 15.462 11.251 599 HG2 PRO 81 HG1 PRO 81 -5.869 14.002 9.011 600 HG3 PRO 81 HG2 PRO 81 -4.640 13.316 10.134 601 HD2 PRO 81 HD1 PRO 81 -7.581 12.706 9.928 602 HD3 PRO 81 HD2 PRO 81 -6.170 11.672 9.807 603 H LEU 82 H LEU 82 -7.832 12.754 13.601 604 HA LEU 82 HA LEU 82 -7.751 14.882 15.633 605 HB2 LEU 82 HB2 LEU 82 -9.806 14.819 14.553 606 HB3 LEU 82 HB1 LEU 82 -9.980 13.128 14.917 607 HG LEU 82 HG LEU 82 -9.912 13.528 17.425 608 HD11 LEU 82 1HD1 LEU 82 -8.961 15.613 17.755 609 HD12 LEU 82 2HD1 LEU 82 -9.980 16.332 16.516 610 HD13 LEU 82 3HD1 LEU 82 -10.694 15.800 18.086 611 HD21 LEU 82 3HD2 LEU 82 -12.270 13.960 17.446 612 HD22 LEU 82 1HD2 LEU 82 -12.206 14.703 15.812 613 HD23 LEU 82 2HD2 LEU 82 -11.763 13.058 16.011 614 H GLU 83 H GLU 83 -7.222 11.427 15.024 615 HA GLU 83 HA GLU 83 -6.982 10.748 17.809 616 HB2 GLU 83 HB2 GLU 83 -6.847 9.345 15.209 617 HB3 GLU 83 HB1 GLU 83 -6.508 8.501 16.785 618 HG2 GLU 83 HG2 GLU 83 -8.463 8.643 17.710 619 HG3 GLU 83 HG1 GLU 83 -9.061 9.999 16.745 620 H ASN 84 H ASN 84 -5.035 11.988 15.434 621 HA ASN 84 HA ASN 84 -2.569 11.625 17.009 622 HB2 ASN 84 HB2 ASN 84 -1.154 10.992 15.272 623 HB3 ASN 84 HB1 ASN 84 -2.508 9.870 15.169 624 HD21 ASN 84 1HD2 ASN 84 -4.376 10.903 13.540 625 HD22 ASN 84 2HD2 ASN 84 -3.657 11.350 12.020 626 H ASN 85 H ASN 85 -1.069 13.292 16.646 627 HA ASN 85 HA ASN 85 -2.154 15.947 15.643 628 HB2 ASN 85 HB2 ASN 85 -0.767 15.587 17.655 629 HB3 ASN 85 HB1 ASN 85 0.585 15.106 16.711 630 HD21 ASN 85 1HD2 ASN 85 1.800 17.138 17.345 631 HD22 ASN 85 2HD2 ASN 85 1.386 18.640 16.595 632 H GLU 86 H GLU 86 -2.432 15.407 13.409 633 HA GLU 86 HA GLU 86 -0.280 14.040 12.008 634 HB2 GLU 86 HB2 GLU 86 -2.547 13.628 11.395 635 HB3 GLU 86 HB1 GLU 86 -2.842 15.380 10.982 636 HG2 GLU 86 HG2 GLU 86 -2.604 14.132 9.002 637 HG3 GLU 86 HG1 GLU 86 -1.153 15.161 9.329 638 H GLU 87 H GLU 87 1.219 14.626 10.618 639 HA GLU 87 HA GLU 87 2.593 17.002 11.591 640 HB2 GLU 87 HB2 GLU 87 3.516 14.843 11.548 641 HB3 GLU 87 HB1 GLU 87 3.428 14.731 9.790 642 HG2 GLU 87 HG2 GLU 87 5.640 15.317 10.508 643 HG3 GLU 87 HG1 GLU 87 4.893 16.595 9.530 644 H SER 88 H SER 88 2.181 18.909 10.512 645 HA SER 88 HA SER 88 1.086 18.847 7.857 646 HB2 SER 88 HB2 SER 88 0.938 21.370 8.062 647 HB3 SER 88 HB1 SER 88 0.261 20.688 9.548 648 HG SER 88 HG SER 88 1.943 22.279 9.733 649 H GLU 89 H GLU 89 4.257 18.775 8.795 650 HA GLU 89 HA GLU 89 5.337 20.036 6.378 651 HB2 GLU 89 HB2 GLU 89 6.324 18.032 8.464 652 HB3 GLU 89 HB1 GLU 89 7.436 18.672 7.272 653 HG2 GLU 89 HG2 GLU 89 7.032 21.012 8.042 654 HG3 GLU 89 HG1 GLU 89 6.169 20.355 9.447 655 H LYS 90 H LYS 90 3.383 17.285 6.823 656 HA LYS 90 HA LYS 90 4.747 15.946 4.594 657 HB2 LYS 90 HB2 LYS 90 2.013 15.633 5.954 658 HB3 LYS 90 HB1 LYS 90 2.651 14.474 4.638 659 HG2 LYS 90 HG2 LYS 90 4.409 13.887 5.919 660 HG3 LYS 90 HG1 LYS 90 3.962 14.912 7.317 661 HD2 LYS 90 HD2 LYS 90 1.730 13.739 7.453 662 HD3 LYS 90 HD1 LYS 90 2.334 12.562 6.237 663 HE2 LYS 90 HE2 LYS 90 4.229 11.991 7.764 664 HE3 LYS 90 HE1 LYS 90 3.590 13.350 8.853 665 HZ1 LYS 90 HZ1 LYS 90 2.463 10.804 8.178 666 HZ2 LYS 90 HZ2 LYS 90 2.743 11.284 9.713 667 HZ3 LYS 90 HZ3 LYS 90 1.584 11.968 9.042 668 H GLU 91 H GLU 91 2.642 18.669 4.710 669 HA GLU 91 HA GLU 91 0.925 18.027 2.629 670 HB2 GLU 91 HB2 GLU 91 2.016 20.773 3.555 671 HB3 GLU 91 HB1 GLU 91 0.471 20.572 2.764 672 HG2 GLU 91 HG2 GLU 91 0.475 19.069 5.173 673 HG3 GLU 91 HG1 GLU 91 0.811 20.941 5.258 674 H PHE 92 H PHE 92 4.143 19.037 2.107 675 HA PHE 92 HA PHE 92 3.476 20.085 -0.506 676 HB2 PHE 92 HB2 PHE 92 6.287 20.270 0.454 677 HB3 PHE 92 HB1 PHE 92 5.483 21.434 -0.561 678 HD1 PHE 92 HD1 PHE 92 5.538 20.198 3.095 679 HD2 PHE 92 HD2 PHE 92 4.652 23.445 0.264 680 HE1 PHE 92 HE1 PHE 92 5.313 21.800 4.893 681 HE2 PHE 92 HE2 PHE 92 4.651 24.983 2.106 682 HZ PHE 92 HZ PHE 92 4.892 24.174 4.442 683 H ASP 93 H ASP 93 4.856 19.313 -2.325 684 HA ASP 93 HA ASP 93 4.788 16.676 -2.664 685 HB2 ASP 93 HB2 ASP 93 5.322 18.601 -4.248 686 HB3 ASP 93 HB1 ASP 93 6.993 18.305 -3.808 687 H ASP 94 H ASP 94 8.075 17.805 -2.474 688 HA ASP 94 HA ASP 94 8.820 14.952 -1.974 689 HB2 ASP 94 HB2 ASP 94 9.771 16.421 -3.865 690 HB3 ASP 94 HB1 ASP 94 10.486 17.479 -2.678 691 H THR 95 H THR 95 8.852 17.792 -0.229 692 HA THR 95 HA THR 95 9.628 16.695 2.290 693 HB THR 95 HB THR 95 11.756 16.843 1.177 694 HG1 THR 95 HG1 THR 95 12.807 17.780 3.069 695 HG21 THR 95 1HG2 THR 95 12.899 19.050 0.935 696 HG22 THR 95 2HG2 THR 95 11.293 19.109 0.014 697 HG23 THR 95 3HG2 THR 95 11.476 19.878 1.562 698 H GLY 96 H GLY 96 10.206 19.016 3.750 699 HA2 GLY 96 HA2 GLY 96 7.916 20.649 3.131 700 HA3 GLY 96 HA1 GLY 96 8.810 20.556 4.720 701 H LEU 97 H LEU 97 8.028 22.846 2.933 702 HA LEU 97 HA LEU 97 10.456 23.839 1.511 703 HB2 LEU 97 HB2 LEU 97 7.639 24.598 1.677 704 HB3 LEU 97 HB1 LEU 97 8.958 25.778 1.245 705 HG LEU 97 HG LEU 97 9.750 24.240 -0.525 706 HD11 LEU 97 1HD1 LEU 97 7.128 22.640 -0.357 707 HD12 LEU 97 2HD1 LEU 97 8.433 22.601 -1.560 708 HD13 LEU 97 3HD1 LEU 97 8.602 22.196 0.242 709 HD21 LEU 97 3HD2 LEU 97 6.819 25.080 -0.709 710 HD22 LEU 97 1HD2 LEU 97 8.053 26.204 -0.870 711 HD23 LEU 97 2HD2 LEU 97 7.961 24.944 -2.117 712 H THR 98 H THR 98 11.892 25.267 2.237 713 HA THR 98 HA THR 98 11.388 26.967 4.574 714 HB THR 98 HB THR 98 13.910 26.548 4.963 715 HG1 THR 98 HG1 THR 98 14.313 25.286 3.119 716 HG21 THR 98 1HG2 THR 98 13.373 24.657 6.493 717 HG22 THR 98 2HG2 THR 98 12.014 25.700 6.352 718 HG23 THR 98 3HG2 THR 98 11.982 24.087 5.570 719 H LEU 99 H LEU 99 13.215 28.647 4.748 720 HA LEU 99 HA LEU 99 13.411 30.037 2.212 721 HB2 LEU 99 HB2 LEU 99 13.462 31.015 4.549 722 HB3 LEU 99 HB1 LEU 99 14.915 30.224 4.862 723 HG LEU 99 HG LEU 99 16.057 31.680 3.181 724 HD11 LEU 99 1HD1 LEU 99 13.337 32.934 2.821 725 HD12 LEU 99 2HD1 LEU 99 14.990 33.539 2.249 726 HD13 LEU 99 3HD1 LEU 99 14.291 32.075 1.605 727 HD21 LEU 99 3HD2 LEU 99 14.303 33.062 5.216 728 HD22 LEU 99 1HD2 LEU 99 15.890 32.413 5.518 729 HD23 LEU 99 2HD2 LEU 99 15.603 33.880 4.374 730 H GLY 100 H GLY 100 16.431 28.989 3.882 731 HA2 GLY 100 HA2 GLY 100 18.205 28.168 3.065 732 HA3 GLY 100 HA1 GLY 100 17.305 27.451 1.711 733 H ASP 101 H ASP 101 16.417 30.328 1.082 734 HA ASP 101 HA ASP 101 18.434 30.639 -0.743 735 HB2 ASP 101 HB2 ASP 101 15.826 31.027 -0.867 736 HB3 ASP 101 HB1 ASP 101 16.339 32.736 -0.840 737 H VAL 102 H VAL 102 19.442 31.253 1.651 738 HA VAL 102 HA VAL 102 20.275 34.047 1.519 739 HB VAL 102 HB VAL 102 20.796 33.791 3.840 740 HG11 VAL 102 1HG1 VAL 102 18.695 34.593 2.761 741 HG12 VAL 102 2HG1 VAL 102 18.065 32.880 3.094 742 HG13 VAL 102 3HG1 VAL 102 18.598 33.977 4.406 743 HG21 VAL 102 3HG2 VAL 102 21.263 31.367 4.147 744 HG22 VAL 102 1HG2 VAL 102 19.911 31.890 5.147 745 HG23 VAL 102 2HG2 VAL 102 19.575 31.114 3.623 746 H VAL 103 H VAL 103 23.997 33.115 1.922 747 HA VAL 103 HA VAL 103 22.434 34.977 3.433 748 HB VAL 103 HB VAL 103 24.931 34.608 3.305 749 HG11 VAL 103 1HG1 VAL 103 25.253 34.984 0.732 750 HG12 VAL 103 2HG1 VAL 103 24.708 36.593 0.970 751 HG13 VAL 103 3HG1 VAL 103 26.114 36.047 1.795 752 HG21 VAL 103 3HG2 VAL 103 23.678 37.389 3.111 753 HG22 VAL 103 1HG2 VAL 103 23.915 36.443 4.647 754 HG23 VAL 103 2HG2 VAL 103 25.325 36.872 3.697 755 H ASN 104 H ASN 104 21.102 36.618 2.806 756 HA ASN 104 HA ASN 104 20.078 36.605 0.213 757 HB2 ASN 104 HB2 ASN 104 18.469 38.045 0.884 758 HB3 ASN 104 HB1 ASN 104 18.780 36.980 2.258 759 HD21 ASN 104 1HD2 ASN 104 17.411 38.881 3.139 760 HD22 ASN 104 2HD2 ASN 104 18.386 40.074 3.957 761 H ILE 105 H ILE 105 22.887 37.426 -0.091 762 HA ILE 105 HA ILE 105 22.096 39.634 -1.731 763 HB ILE 105 HB ILE 105 24.647 40.398 -1.542 764 HG12 ILE 105 2HG1 ILE 105 24.431 39.167 1.188 765 HG13 ILE 105 1HG1 ILE 105 25.438 38.493 -0.140 766 HG21 ILE 105 1HG2 ILE 105 24.109 41.983 0.312 767 HG22 ILE 105 2HG2 ILE 105 22.707 41.783 -0.619 768 HG23 ILE 105 3HG2 ILE 105 22.658 40.892 0.796 769 HD11 ILE 105 HD3 ILE 105 25.864 40.941 1.438 770 HD12 ILE 105 HD1 ILE 105 26.984 39.577 1.239 771 HD13 ILE 105 HD2 ILE 105 26.642 40.743 -0.119 772 H LYS 106 H LYS 106 23.712 39.823 -3.638 773 HA LYS 106 HA LYS 106 24.484 37.131 -4.539 774 HB2 LYS 106 HB2 LYS 106 24.014 39.735 -5.972 775 HB3 LYS 106 HB1 LYS 106 24.519 38.353 -6.869 776 HG2 LYS 106 HG2 LYS 106 22.663 37.034 -6.153 777 HG3 LYS 106 HG1 LYS 106 21.932 38.151 -5.179 778 HD2 LYS 106 HD2 LYS 106 21.599 39.734 -7.002 779 HD3 LYS 106 HD1 LYS 106 22.348 38.519 -8.213 780 HE2 LYS 106 HE2 LYS 106 20.789 36.864 -7.533 781 HE3 LYS 106 HE1 LYS 106 20.148 37.782 -6.262 782 HZ1 LYS 106 HZ1 LYS 106 19.614 38.149 -9.146 783 HZ2 LYS 106 HZ2 LYS 106 18.654 37.833 -7.987 784 HZ3 LYS 106 HZ3 LYS 106 19.190 39.354 -8.058 785 H GLU 107 H GLU 107 25.778 40.504 -4.017 786 HA GLU 107 HA GLU 107 28.405 39.959 -4.884 787 HB2 GLU 107 HB2 GLU 107 27.268 41.795 -2.799 788 HB3 GLU 107 HB1 GLU 107 28.889 41.800 -3.435 789 HG2 GLU 107 HG2 GLU 107 28.142 42.311 -5.658 790 HG3 GLU 107 HG1 GLU 107 26.454 42.392 -5.201 791 H GLY 108 H GLY 108 26.882 39.397 -1.699 792 HA2 GLY 108 HA2 GLY 108 29.284 38.038 -0.831 793 HA3 GLY 108 HA1 GLY 108 27.716 38.079 0.061 794 H LYS 109 H LYS 109 28.081 36.941 -3.197 795 HA LYS 109 HA LYS 109 28.116 34.235 -2.474 796 HB2 LYS 109 HB2 LYS 109 25.822 35.006 -1.883 797 HB3 LYS 109 HB1 LYS 109 25.407 35.166 -3.550 798 HG2 LYS 109 HG2 LYS 109 26.168 32.597 -3.694 799 HG3 LYS 109 HG1 LYS 109 26.289 32.685 -1.959 800 HD2 LYS 109 HD2 LYS 109 23.782 33.032 -3.574 801 HD3 LYS 109 HD1 LYS 109 24.303 31.619 -2.519 802 HE2 LYS 109 HE2 LYS 109 24.166 33.112 -0.509 803 HE3 LYS 109 HE1 LYS 109 23.850 34.415 -1.567 804 HZ1 LYS 109 HZ1 LYS 109 21.811 33.276 -2.210 805 HZ2 LYS 109 HZ2 LYS 109 22.042 32.017 -1.227 806 HZ3 LYS 109 HZ3 LYS 109 21.660 33.573 -0.737 807 H LYS 110 H LYS 110 29.269 36.182 -4.351 808 HA LYS 110 HA LYS 110 28.945 35.335 -7.021 809 HB2 LYS 110 HB2 LYS 110 29.633 37.625 -6.019 810 HB3 LYS 110 HB1 LYS 110 31.181 37.002 -5.777 811 HG2 LYS 110 HG2 LYS 110 31.641 36.743 -8.070 812 HG3 LYS 110 HG1 LYS 110 29.976 37.046 -8.555 813 HD2 LYS 110 HD2 LYS 110 30.364 39.446 -7.518 814 HD3 LYS 110 HD1 LYS 110 31.960 38.884 -7.321 815 HE2 LYS 110 HE2 LYS 110 32.381 38.678 -9.663 816 HE3 LYS 110 HE1 LYS 110 30.686 39.106 -10.030 817 HZ1 LYS 110 HZ1 LYS 110 31.372 41.172 -8.639 818 HZ2 LYS 110 HZ2 LYS 110 32.828 40.800 -9.060 819 HZ3 LYS 110 HZ3 LYS 110 31.667 41.071 -10.281 820 H LEU 111 H LEU 111 31.025 34.513 -4.467 821 HA LEU 111 HA LEU 111 31.990 32.102 -5.798 822 HB2 LEU 111 HB2 LEU 111 33.331 33.919 -3.904 823 HB3 LEU 111 HB1 LEU 111 33.721 32.140 -3.852 824 HG LEU 111 HG LEU 111 34.189 32.158 -6.241 825 HD11 LEU 111 1HD1 LEU 111 35.278 34.387 -7.061 826 HD12 LEU 111 2HD1 LEU 111 33.581 34.233 -7.194 827 HD13 LEU 111 3HD1 LEU 111 34.171 35.239 -5.953 828 HD21 LEU 111 3HD2 LEU 111 35.897 31.971 -4.376 829 HD22 LEU 111 1HD2 LEU 111 36.479 32.652 -5.831 830 HD23 LEU 111 2HD2 LEU 111 36.048 33.798 -4.572 831 H GLU 112 H GLU 112 32.285 30.566 -3.693 832 HA GLU 112 HA GLU 112 30.372 30.774 -1.689 833 HB2 GLU 112 HB2 GLU 112 29.544 29.001 -4.188 834 HB3 GLU 112 HB1 GLU 112 29.097 28.555 -2.575 835 HG2 GLU 112 HG2 GLU 112 27.837 30.597 -2.205 836 HG3 GLU 112 HG1 GLU 112 28.348 31.146 -3.833 837 H HIS 113 H HIS 113 32.226 28.316 -3.394 838 HA HIS 113 HA HIS 113 33.068 27.390 -0.769 839 HB2 HIS 113 HB2 HIS 113 32.216 25.054 -1.599 840 HB3 HIS 113 HB1 HIS 113 31.026 26.215 -1.031 841 HD2 HIS 113 HD2 HIS 113 28.939 26.138 -2.366 842 HE1 HIS 113 HE1 HIS 113 30.630 25.979 -6.303 843 HE2 HIS 113 HE2 HIS 113 28.616 26.589 -5.067 844 H HIS 114 H HIS 114 34.433 28.797 -2.735 845 HA HIS 114 HA HIS 114 35.847 26.903 -4.480 846 HB2 HIS 114 HB2 HIS 114 36.115 29.888 -4.180 847 HB3 HIS 114 HB1 HIS 114 36.796 28.824 -5.465 848 HD2 HIS 114 HD2 HIS 114 35.322 28.339 -7.546 849 HE1 HIS 114 HE1 HIS 114 31.635 29.905 -6.146 850 HE2 HIS 114 HE2 HIS 114 32.833 28.973 -8.170 Start of MODEL 7 1 H1 GLU 13 H1 GLU 13 -4.637 -13.593 15.612 2 H2 GLU 13 H2 GLU 13 -3.595 -12.377 15.566 3 H3 GLU 13 H3 GLU 13 -3.115 -13.942 15.329 4 HA GLU 13 HA GLU 13 -4.156 -12.897 17.937 5 HB2 GLU 13 HB2 GLU 13 -2.790 -15.411 17.438 6 HB3 GLU 13 HB1 GLU 13 -3.473 -14.789 18.967 7 HG2 GLU 13 HG2 GLU 13 -5.740 -15.000 18.037 8 HG3 GLU 13 HG1 GLU 13 -5.023 -15.536 16.493 9 H ASN 14 H ASN 14 -1.541 -11.901 15.940 10 HA ASN 14 HA ASN 14 -1.607 -9.920 17.340 11 HB2 ASN 14 HB2 ASN 14 -0.636 -10.629 19.249 12 HB3 ASN 14 HB1 ASN 14 0.626 -11.646 18.524 13 HD21 ASN 14 1HD2 ASN 14 -0.021 -9.005 20.218 14 HD22 ASN 14 2HD2 ASN 14 1.348 -7.955 19.890 15 H ALA 15 H ALA 15 -0.768 -8.189 16.292 16 HA ALA 15 HA ALA 15 -0.457 -9.019 13.594 17 HB1 ALA 15 HB1 ALA 15 -0.617 -6.363 15.088 18 HB2 ALA 15 HB2 ALA 15 -0.643 -6.544 13.291 19 HB3 ALA 15 HB3 ALA 15 -1.887 -7.248 14.259 20 H GLU 16 H GLU 16 1.954 -7.900 15.903 21 HA GLU 16 HA GLU 16 3.923 -7.010 13.922 22 HB2 GLU 16 HB2 GLU 16 3.610 -7.110 16.982 23 HB3 GLU 16 HB1 GLU 16 5.148 -6.734 16.103 24 HG2 GLU 16 HG2 GLU 16 4.110 -4.966 14.934 25 HG3 GLU 16 HG1 GLU 16 2.576 -5.188 15.828 26 H LEU 17 H LEU 17 3.084 -9.927 15.335 27 HA LEU 17 HA LEU 17 5.748 -11.204 14.706 28 HB2 LEU 17 HB2 LEU 17 3.109 -12.034 16.050 29 HB3 LEU 17 HB1 LEU 17 4.421 -13.161 15.654 30 HG LEU 17 HG LEU 17 4.848 -10.736 17.507 31 HD11 LEU 17 1HD1 LEU 17 4.585 -12.357 19.398 32 HD12 LEU 17 2HD1 LEU 17 3.044 -12.187 18.483 33 HD13 LEU 17 3HD1 LEU 17 4.113 -13.556 18.229 34 HD21 LEU 17 3HD2 LEU 17 6.403 -13.286 17.505 35 HD22 LEU 17 1HD2 LEU 17 6.799 -11.950 16.452 36 HD23 LEU 17 2HD2 LEU 17 6.745 -11.664 18.237 37 H GLU 18 H GLU 18 2.975 -10.174 13.025 38 HA GLU 18 HA GLU 18 2.809 -12.574 11.489 39 HB2 GLU 18 HB2 GLU 18 0.938 -11.144 12.670 40 HB3 GLU 18 HB1 GLU 18 0.989 -10.113 11.209 41 HG2 GLU 18 HG2 GLU 18 0.703 -12.310 9.913 42 HG3 GLU 18 HG1 GLU 18 0.250 -13.028 11.447 43 H ILE 19 H ILE 19 4.653 -10.054 11.415 44 HA ILE 19 HA ILE 19 4.653 -9.468 8.521 45 HB ILE 19 HB ILE 19 5.184 -7.192 9.190 46 HG12 ILE 19 2HG1 ILE 19 4.276 -8.013 11.889 47 HG13 ILE 19 1HG1 ILE 19 6.020 -7.626 11.630 48 HG21 ILE 19 1HG2 ILE 19 3.094 -7.596 8.390 49 HG22 ILE 19 2HG2 ILE 19 2.449 -8.148 9.997 50 HG23 ILE 19 3HG2 ILE 19 2.954 -6.546 9.735 51 HD11 ILE 19 HD3 ILE 19 5.214 -5.297 10.826 52 HD12 ILE 19 HD1 ILE 19 3.618 -5.720 11.396 53 HD13 ILE 19 HD2 ILE 19 5.042 -5.724 12.522 54 H VAL 20 H VAL 20 6.938 -8.228 7.887 55 HA VAL 20 HA VAL 20 9.231 -9.003 9.460 56 HB VAL 20 HB VAL 20 10.437 -7.481 8.082 57 HG11 VAL 20 1HG1 VAL 20 10.315 -9.833 7.552 58 HG12 VAL 20 2HG1 VAL 20 8.895 -9.571 6.578 59 HG13 VAL 20 3HG1 VAL 20 10.386 -8.810 6.080 60 HG21 VAL 20 3HG2 VAL 20 9.201 -5.703 7.099 61 HG22 VAL 20 1HG2 VAL 20 9.457 -6.818 5.808 62 HG23 VAL 20 2HG2 VAL 20 7.905 -6.746 6.575 63 H THR 21 H THR 21 10.713 -7.181 9.998 64 HA THR 21 HA THR 21 9.767 -5.401 11.883 65 HB THR 21 HB THR 21 12.296 -5.943 10.376 66 HG1 THR 21 HG1 THR 21 11.880 -5.575 13.078 67 HG21 THR 21 1HG2 THR 21 13.700 -4.319 11.312 68 HG22 THR 21 2HG2 THR 21 12.370 -3.386 10.619 69 HG23 THR 21 3HG2 THR 21 12.317 -3.668 12.367 70 H ASP 22 H ASP 22 11.079 -4.675 8.482 71 HA ASP 22 HA ASP 22 10.887 -2.138 8.981 72 HB2 ASP 22 HB2 ASP 22 12.329 -3.415 7.593 73 HB3 ASP 22 HB1 ASP 22 11.054 -3.346 6.297 74 H TYR 23 H TYR 23 8.257 -4.065 8.033 75 HA TYR 23 HA TYR 23 6.795 -2.893 5.869 76 HB2 TYR 23 HB2 TYR 23 6.707 -4.972 6.627 77 HB3 TYR 23 HB1 TYR 23 6.154 -4.465 8.270 78 HD1 TYR 23 HD2 TYR 23 3.931 -3.567 8.673 79 HD2 TYR 23 HD1 TYR 23 5.070 -5.404 4.871 80 HE1 TYR 23 HE2 TYR 23 1.607 -3.888 8.100 81 HE2 TYR 23 HE1 TYR 23 2.807 -5.923 4.430 82 HH TYR 23 HH TYR 23 0.589 -5.642 5.026 83 H TYR 24 H TYR 24 4.985 -1.587 5.984 84 HA TYR 24 HA TYR 24 4.770 0.542 7.972 85 HB2 TYR 24 HB2 TYR 24 2.858 1.284 6.636 86 HB3 TYR 24 HB1 TYR 24 4.395 1.217 5.773 87 HD1 TYR 24 HD1 TYR 24 2.516 -1.935 5.988 88 HD2 TYR 24 HD2 TYR 24 3.095 1.594 3.738 89 HE1 TYR 24 HE1 TYR 24 1.395 -3.019 4.042 90 HE2 TYR 24 HE2 TYR 24 2.055 0.643 1.909 91 HH TYR 24 HH TYR 24 0.897 -2.696 1.597 92 H LYS 25 H LYS 25 4.455 -0.528 9.774 93 HA LYS 25 HA LYS 25 2.355 -2.302 10.649 94 HB2 LYS 25 HB2 LYS 25 4.150 -0.337 12.188 95 HB3 LYS 25 HB1 LYS 25 2.996 -1.521 12.863 96 HG2 LYS 25 HG2 LYS 25 4.198 -3.377 12.056 97 HG3 LYS 25 HG1 LYS 25 5.157 -2.226 11.053 98 HD2 LYS 25 HD2 LYS 25 6.337 -1.401 12.911 99 HD3 LYS 25 HD1 LYS 25 5.420 -2.493 14.073 100 HE2 LYS 25 HE2 LYS 25 6.321 -4.436 12.858 101 HE3 LYS 25 HE1 LYS 25 6.947 -3.351 11.696 102 HZ1 LYS 25 HZ1 LYS 25 8.744 -3.978 13.380 103 HZ2 LYS 25 HZ2 LYS 25 8.544 -2.415 13.375 104 HZ3 LYS 25 HZ3 LYS 25 7.721 -3.223 14.505 105 H ILE 26 H ILE 26 2.427 1.352 10.501 106 HA ILE 26 HA ILE 26 0.179 1.507 12.224 107 HB ILE 26 HB ILE 26 -0.091 3.723 11.024 108 HG12 ILE 26 2HG1 ILE 26 2.364 3.334 9.300 109 HG13 ILE 26 1HG1 ILE 26 0.800 3.081 8.851 110 HG21 ILE 26 1HG2 ILE 26 2.741 3.142 11.947 111 HG22 ILE 26 2HG2 ILE 26 1.886 4.734 12.285 112 HG23 ILE 26 3HG2 ILE 26 1.500 3.235 13.054 113 HD11 ILE 26 HD3 ILE 26 1.708 5.184 8.197 114 HD12 ILE 26 HD1 ILE 26 0.138 5.266 8.848 115 HD13 ILE 26 HD2 ILE 26 1.550 5.727 9.917 116 H ILE 27 H ILE 27 0.417 1.170 8.711 117 HA ILE 27 HA ILE 27 -2.156 1.751 8.230 118 HB ILE 27 HB ILE 27 -0.467 -0.052 6.403 119 HG12 ILE 27 2HG1 ILE 27 0.580 2.098 6.803 120 HG13 ILE 27 1HG1 ILE 27 0.033 1.762 5.239 121 HG21 ILE 27 1HG2 ILE 27 -2.755 -0.322 5.937 122 HG22 ILE 27 2HG2 ILE 27 -3.000 1.421 5.808 123 HG23 ILE 27 3HG2 ILE 27 -1.971 0.429 4.615 124 HD11 ILE 27 HD3 ILE 27 -1.507 3.683 7.076 125 HD12 ILE 27 HD1 ILE 27 -0.234 4.112 6.048 126 HD13 ILE 27 HD2 ILE 27 -1.639 3.352 5.228 127 H LYS 28 H LYS 28 -0.882 -1.411 8.897 128 HA LYS 28 HA LYS 28 -2.295 -3.019 7.968 129 HB2 LYS 28 HB2 LYS 28 -0.230 -3.419 9.273 130 HB3 LYS 28 HB1 LYS 28 -1.392 -3.676 10.645 131 HG2 LYS 28 HG2 LYS 28 -2.460 -5.462 9.303 132 HG3 LYS 28 HG1 LYS 28 -1.112 -5.368 8.092 133 HD2 LYS 28 HD2 LYS 28 0.557 -5.764 9.808 134 HD3 LYS 28 HD1 LYS 28 -0.602 -5.688 11.079 135 HE2 LYS 28 HE2 LYS 28 -0.526 -7.644 8.749 136 HE3 LYS 28 HE1 LYS 28 0.077 -8.048 10.397 137 HZ1 LYS 28 HZ1 LYS 28 -2.094 -8.979 9.898 138 HZ2 LYS 28 HZ2 LYS 28 -2.276 -7.790 11.074 139 HZ3 LYS 28 HZ3 LYS 28 -2.701 -7.545 9.598 140 H THR 29 H THR 29 -3.240 -2.528 11.364 141 HA THR 29 HA THR 29 -5.268 -4.258 11.383 142 HB THR 29 HB THR 29 -5.036 -1.653 13.083 143 HG1 THR 29 HG1 THR 29 -3.462 -2.423 13.870 144 HG21 THR 29 1HG2 THR 29 -6.114 -2.850 14.939 145 HG22 THR 29 2HG2 THR 29 -7.070 -2.651 13.460 146 HG23 THR 29 3HG2 THR 29 -6.391 -4.211 13.909 147 H ALA 30 H ALA 30 -5.534 -0.743 10.628 148 HA ALA 30 HA ALA 30 -8.326 -0.725 10.497 149 HB1 ALA 30 HB1 ALA 30 -6.354 1.132 10.788 150 HB2 ALA 30 HB2 ALA 30 -6.446 1.055 8.972 151 HB3 ALA 30 HB3 ALA 30 -7.815 1.530 9.842 152 H ARG 31 H ARG 31 -5.990 -1.008 7.853 153 HA ARG 31 HA ARG 31 -7.924 -1.343 5.755 154 HB2 ARG 31 HB2 ARG 31 -5.455 -0.764 5.467 155 HB3 ARG 31 HB1 ARG 31 -5.110 -2.357 6.078 156 HG2 ARG 31 HG2 ARG 31 -6.317 -3.293 3.874 157 HG3 ARG 31 HG1 ARG 31 -6.713 -1.651 3.626 158 HD2 ARG 31 HD2 ARG 31 -4.959 -2.491 2.288 159 HD3 ARG 31 HD1 ARG 31 -4.137 -1.289 3.460 160 HE ARG 31 HE ARG 31 -4.145 -4.125 4.193 161 HH11 ARG 31 1HH2 ARG 31 -2.467 -2.005 1.805 162 HH12 ARG 31 2HH2 ARG 31 -1.087 -3.068 1.904 163 HH21 ARG 31 1HH1 ARG 31 -2.388 -5.463 3.895 164 HH22 ARG 31 2HH1 ARG 31 -1.033 -4.835 2.974 165 H GLU 32 H GLU 32 -6.487 -3.900 7.983 166 HA GLU 32 HA GLU 32 -7.636 -6.023 6.765 167 HB2 GLU 32 HB2 GLU 32 -6.621 -5.413 9.687 168 HB3 GLU 32 HB1 GLU 32 -7.390 -6.775 9.226 169 HG2 GLU 32 HG2 GLU 32 -5.882 -7.107 7.280 170 HG3 GLU 32 HG1 GLU 32 -5.014 -5.620 7.753 171 H GLN 33 H GLN 33 -9.063 -3.716 9.213 172 HA GLN 33 HA GLN 33 -11.441 -5.254 9.791 173 HB2 GLN 33 HB2 GLN 33 -10.596 -2.445 10.107 174 HB3 GLN 33 HB1 GLN 33 -12.182 -3.059 10.589 175 HG2 GLN 33 HG2 GLN 33 -11.070 -4.714 12.200 176 HG3 GLN 33 HG1 GLN 33 -9.491 -4.059 11.727 177 HE21 GLN 33 1HE2 GLN 33 -8.990 -3.549 14.061 178 HE22 GLN 33 2HE2 GLN 33 -10.130 -2.586 14.917 179 H LEU 34 H LEU 34 -10.504 -3.223 7.110 180 HA LEU 34 HA LEU 34 -13.083 -3.098 5.950 181 HB2 LEU 34 HB2 LEU 34 -10.491 -2.483 4.559 182 HB3 LEU 34 HB1 LEU 34 -12.171 -2.133 4.135 183 HG LEU 34 HG LEU 34 -10.672 -1.142 6.471 184 HD11 LEU 34 1HD1 LEU 34 -9.868 -0.062 4.420 185 HD12 LEU 34 2HD1 LEU 34 -11.553 0.370 3.969 186 HD13 LEU 34 3HD1 LEU 34 -10.827 1.053 5.465 187 HD21 LEU 34 3HD2 LEU 34 -12.997 -1.235 7.001 188 HD22 LEU 34 1HD2 LEU 34 -12.441 0.446 6.888 189 HD23 LEU 34 2HD2 LEU 34 -13.406 -0.399 5.556 190 H GLY 35 H GLY 35 -10.719 -5.523 5.871 191 HA2 GLY 35 HA2 GLY 35 -10.775 -7.720 4.976 192 HA3 GLY 35 HA1 GLY 35 -12.405 -7.327 4.390 193 H ILE 36 H ILE 36 -10.766 -4.977 3.107 194 HA ILE 36 HA ILE 36 -10.794 -5.853 0.468 195 HB ILE 36 HB ILE 36 -10.024 -3.571 0.060 196 HG12 ILE 36 2HG1 ILE 36 -9.523 -3.277 3.013 197 HG13 ILE 36 1HG1 ILE 36 -8.282 -3.441 1.716 198 HG21 ILE 36 1HG2 ILE 36 -11.996 -3.421 2.391 199 HG22 ILE 36 2HG2 ILE 36 -11.978 -2.489 0.856 200 HG23 ILE 36 3HG2 ILE 36 -12.422 -4.100 0.826 201 HD11 ILE 36 HD3 ILE 36 -9.206 -1.198 0.834 202 HD12 ILE 36 HD1 ILE 36 -10.150 -1.121 2.292 203 HD13 ILE 36 HD2 ILE 36 -8.413 -1.225 2.444 204 H SER 37 H SER 37 -9.446 -5.631 -1.293 205 HA SER 37 HA SER 37 -6.971 -6.970 -0.535 206 HB2 SER 37 HB2 SER 37 -7.137 -8.180 -2.761 207 HB3 SER 37 HB1 SER 37 -8.574 -8.266 -1.639 208 HG SER 37 HG SER 37 -9.092 -7.791 -3.844 209 H GLN 38 H GLN 38 -5.126 -7.039 -2.320 210 HA GLN 38 HA GLN 38 -4.107 -4.533 -2.692 211 HB2 GLN 38 HB2 GLN 38 -3.609 -7.233 -3.606 212 HB3 GLN 38 HB1 GLN 38 -2.947 -5.989 -4.625 213 HG2 GLN 38 HG2 GLN 38 -1.744 -5.046 -2.664 214 HG3 GLN 38 HG1 GLN 38 -2.794 -5.984 -1.594 215 HE21 GLN 38 1HE2 GLN 38 -1.247 -7.458 -0.376 216 HE22 GLN 38 2HE2 GLN 38 -0.504 -8.688 -1.342 217 H GLN 39 H GLN 39 -6.409 -5.994 -5.053 218 HA GLN 39 HA GLN 39 -5.854 -4.395 -7.147 219 HB2 GLN 39 HB2 GLN 39 -7.982 -4.462 -7.869 220 HB3 GLN 39 HB1 GLN 39 -7.447 -6.026 -7.308 221 HG2 GLN 39 HG2 GLN 39 -9.005 -5.431 -5.175 222 HG3 GLN 39 HG1 GLN 39 -9.537 -4.054 -6.034 223 HE21 GLN 39 1HE2 GLN 39 -9.332 -7.859 -6.372 224 HE22 GLN 39 2HE2 GLN 39 -11.006 -7.755 -6.904 225 H GLN 40 H GLN 40 -7.481 -3.473 -4.144 226 HA GLN 40 HA GLN 40 -8.594 -0.935 -4.964 227 HB2 GLN 40 HB2 GLN 40 -7.848 -1.707 -2.158 228 HB3 GLN 40 HB1 GLN 40 -9.038 -0.565 -2.748 229 HG2 GLN 40 HG2 GLN 40 -9.322 -3.594 -3.301 230 HG3 GLN 40 HG1 GLN 40 -10.000 -2.650 -1.970 231 HE21 GLN 40 1HE2 GLN 40 -11.873 -3.848 -2.906 232 HE22 GLN 40 2HE2 GLN 40 -12.823 -3.110 -4.046 233 H LEU 41 H LEU 41 -5.430 -1.907 -3.487 234 HA LEU 41 HA LEU 41 -4.542 0.650 -3.084 235 HB2 LEU 41 HB2 LEU 41 -3.813 -0.863 -1.616 236 HB3 LEU 41 HB1 LEU 41 -3.405 -2.112 -2.775 237 HG LEU 41 HG LEU 41 -1.532 -0.792 -3.593 238 HD11 LEU 41 1HD1 LEU 41 -0.543 0.919 -2.174 239 HD12 LEU 41 2HD1 LEU 41 -2.195 1.414 -2.524 240 HD13 LEU 41 3HD1 LEU 41 -1.816 0.707 -0.924 241 HD21 LEU 41 3HD2 LEU 41 -1.508 -1.804 -0.725 242 HD22 LEU 41 1HD2 LEU 41 -1.165 -2.691 -2.162 243 HD23 LEU 41 2HD2 LEU 41 -0.009 -1.502 -1.783 244 H ALA 42 H ALA 42 -4.106 -1.760 -5.655 245 HA ALA 42 HA ALA 42 -2.364 -0.554 -7.341 246 HB1 ALA 42 HB1 ALA 42 -3.094 -2.841 -7.333 247 HB2 ALA 42 HB2 ALA 42 -4.761 -2.189 -7.731 248 HB3 ALA 42 HB3 ALA 42 -3.462 -1.991 -8.876 249 H GLN 43 H GLN 43 -5.973 -0.193 -7.236 250 HA GLN 43 HA GLN 43 -6.108 1.995 -9.045 251 HB2 GLN 43 HB2 GLN 43 -7.965 0.685 -6.911 252 HB3 GLN 43 HB1 GLN 43 -8.415 1.991 -7.809 253 HG2 GLN 43 HG2 GLN 43 -7.809 0.797 -9.948 254 HG3 GLN 43 HG1 GLN 43 -7.355 -0.682 -8.943 255 HE21 GLN 43 1HE2 GLN 43 -9.003 -1.520 -7.408 256 HE22 GLN 43 2HE2 GLN 43 -10.606 -1.655 -7.968 257 H LYS 44 H LYS 44 -5.439 2.067 -5.303 258 HA LYS 44 HA LYS 44 -6.224 4.806 -5.473 259 HB2 LYS 44 HB2 LYS 44 -5.865 3.067 -3.338 260 HB3 LYS 44 HB1 LYS 44 -4.264 3.673 -3.400 261 HG2 LYS 44 HG2 LYS 44 -5.624 4.763 -1.787 262 HG3 LYS 44 HG1 LYS 44 -5.308 5.952 -3.046 263 HD2 LYS 44 HD2 LYS 44 -7.351 6.057 -3.839 264 HD3 LYS 44 HD1 LYS 44 -7.932 4.624 -2.713 265 HE2 LYS 44 HE2 LYS 44 -7.283 5.899 -0.791 266 HE3 LYS 44 HE1 LYS 44 -7.017 7.295 -1.718 267 HZ1 LYS 44 HZ1 LYS 44 -9.392 7.100 -2.505 268 HZ2 LYS 44 HZ2 LYS 44 -9.578 5.791 -1.497 269 HZ3 LYS 44 HZ3 LYS 44 -9.210 7.299 -0.902 270 H LEU 45 H LEU 45 -3.232 3.412 -6.229 271 HA LEU 45 HA LEU 45 -1.869 5.943 -6.286 272 HB2 LEU 45 HB2 LEU 45 -1.161 4.219 -4.680 273 HB3 LEU 45 HB1 LEU 45 -0.800 3.205 -6.075 274 HG LEU 45 HG LEU 45 0.851 4.401 -6.868 275 HD11 LEU 45 1HD1 LEU 45 0.460 6.422 -4.669 276 HD12 LEU 45 2HD1 LEU 45 1.927 6.391 -5.636 277 HD13 LEU 45 3HD1 LEU 45 0.366 6.609 -6.450 278 HD21 LEU 45 3HD2 LEU 45 1.287 4.044 -3.770 279 HD22 LEU 45 1HD2 LEU 45 1.244 2.740 -4.822 280 HD23 LEU 45 2HD2 LEU 45 2.500 3.946 -5.062 281 H LYS 46 H LYS 46 -3.503 4.270 -8.500 282 HA LYS 46 HA LYS 46 -3.361 3.514 -10.632 283 HB2 LYS 46 HB2 LYS 46 -2.092 6.243 -10.899 284 HB3 LYS 46 HB1 LYS 46 -2.834 5.434 -12.186 285 HG2 LYS 46 HG2 LYS 46 -5.009 5.436 -11.087 286 HG3 LYS 46 HG1 LYS 46 -4.251 6.186 -9.686 287 HD2 LYS 46 HD2 LYS 46 -3.531 8.066 -11.293 288 HD3 LYS 46 HD1 LYS 46 -4.521 7.327 -12.435 289 HE2 LYS 46 HE2 LYS 46 -6.520 7.532 -10.758 290 HE3 LYS 46 HE1 LYS 46 -5.496 8.621 -9.874 291 HZ1 LYS 46 HZ1 LYS 46 -5.090 9.693 -12.140 292 HZ2 LYS 46 HZ2 LYS 46 -6.556 9.103 -12.547 293 HZ3 LYS 46 HZ3 LYS 46 -6.430 10.099 -11.299 294 H VAL 47 H VAL 47 -2.065 1.751 -9.788 295 HA VAL 47 HA VAL 47 0.105 1.318 -11.565 296 HB VAL 47 HB VAL 47 1.355 0.104 -9.761 297 HG11 VAL 47 1HG1 VAL 47 2.374 2.167 -8.738 298 HG12 VAL 47 2HG1 VAL 47 1.853 2.513 -10.489 299 HG13 VAL 47 3HG1 VAL 47 0.935 3.052 -9.090 300 HG21 VAL 47 3HG2 VAL 47 0.981 0.664 -7.400 301 HG22 VAL 47 1HG2 VAL 47 -0.667 1.300 -7.825 302 HG23 VAL 47 2HG2 VAL 47 -0.248 -0.350 -8.088 303 H SER 48 H SER 48 0.895 -1.151 -11.331 304 HA SER 48 HA SER 48 -1.558 -2.693 -11.604 305 HB2 SER 48 HB2 SER 48 -0.050 -4.136 -12.749 306 HB3 SER 48 HB1 SER 48 -0.141 -2.631 -13.479 307 HG SER 48 HG SER 48 1.878 -2.074 -12.802 308 H GLU 49 H GLU 49 -1.332 -5.035 -10.553 309 HA GLU 49 HA GLU 49 -0.471 -4.801 -7.793 310 HB2 GLU 49 HB2 GLU 49 -1.839 -6.836 -9.559 311 HB3 GLU 49 HB1 GLU 49 -1.114 -7.384 -8.050 312 HG2 GLU 49 HG2 GLU 49 -2.509 -5.799 -6.763 313 HG3 GLU 49 HG1 GLU 49 -3.072 -4.999 -8.151 314 H ASN 50 H ASN 50 1.054 -6.009 -10.743 315 HA ASN 50 HA ASN 50 3.374 -7.237 -9.652 316 HB2 ASN 50 HB2 ASN 50 2.765 -6.947 -12.110 317 HB3 ASN 50 HB1 ASN 50 3.068 -5.235 -11.888 318 HD21 ASN 50 1HD2 ASN 50 4.678 -8.346 -11.897 319 HD22 ASN 50 2HD2 ASN 50 6.322 -7.752 -11.990 320 H ILE 51 H ILE 51 2.558 -3.828 -9.656 321 HA ILE 51 HA ILE 51 5.268 -3.072 -8.792 322 HB ILE 51 HB ILE 51 2.755 -1.602 -9.477 323 HG12 ILE 51 2HG1 ILE 51 5.648 -1.806 -10.471 324 HG13 ILE 51 1HG1 ILE 51 4.271 -2.555 -11.184 325 HG21 ILE 51 1HG2 ILE 51 3.541 -0.331 -7.718 326 HG22 ILE 51 2HG2 ILE 51 5.310 -0.458 -8.306 327 HG23 ILE 51 3HG2 ILE 51 4.161 0.461 -9.075 328 HD11 ILE 51 HD3 ILE 51 4.861 -0.602 -12.576 329 HD12 ILE 51 HD1 ILE 51 3.296 -0.358 -11.895 330 HD13 ILE 51 HD2 ILE 51 4.678 0.461 -11.200 331 H VAL 52 H VAL 52 2.049 -3.821 -7.256 332 HA VAL 52 HA VAL 52 2.850 -2.522 -4.859 333 HB VAL 52 HB VAL 52 0.902 -2.920 -3.961 334 HG11 VAL 52 1HG1 VAL 52 -0.740 -1.826 -5.561 335 HG12 VAL 52 2HG1 VAL 52 0.788 -1.493 -6.186 336 HG13 VAL 52 3HG1 VAL 52 0.018 -2.881 -6.896 337 HG21 VAL 52 3HG2 VAL 52 0.367 -5.361 -5.525 338 HG22 VAL 52 1HG2 VAL 52 0.409 -5.025 -3.885 339 HG23 VAL 52 2HG2 VAL 52 -1.001 -4.457 -4.633 340 H LYS 53 H LYS 53 2.599 -6.059 -5.934 341 HA LYS 53 HA LYS 53 2.477 -7.122 -3.459 342 HB2 LYS 53 HB2 LYS 53 2.142 -8.132 -5.762 343 HB3 LYS 53 HB1 LYS 53 3.966 -8.283 -5.705 344 HG2 LYS 53 HG2 LYS 53 3.793 -9.638 -3.774 345 HG3 LYS 53 HG1 LYS 53 2.023 -9.414 -3.660 346 HD2 LYS 53 HD2 LYS 53 1.852 -10.418 -5.892 347 HD3 LYS 53 HD1 LYS 53 3.574 -10.789 -5.888 348 HE2 LYS 53 HE2 LYS 53 3.360 -11.956 -3.751 349 HE3 LYS 53 HE1 LYS 53 1.612 -12.070 -3.952 350 HZ1 LYS 53 HZ1 LYS 53 3.268 -13.930 -4.897 351 HZ2 LYS 53 HZ2 LYS 53 2.000 -13.471 -5.782 352 HZ3 LYS 53 HZ3 LYS 53 3.448 -12.882 -6.151 353 H ARG 54 H ARG 54 5.261 -5.519 -4.896 354 HA ARG 54 HA ARG 54 7.429 -6.745 -3.658 355 HB2 ARG 54 HB2 ARG 54 7.114 -3.788 -4.424 356 HB3 ARG 54 HB1 ARG 54 8.609 -4.640 -4.169 357 HG2 ARG 54 HG2 ARG 54 8.321 -6.004 -6.113 358 HG3 ARG 54 HG1 ARG 54 6.607 -5.572 -6.233 359 HD2 ARG 54 HD2 ARG 54 7.147 -3.299 -6.766 360 HD3 ARG 54 HD1 ARG 54 8.893 -3.556 -6.707 361 HE ARG 54 HE ARG 54 7.586 -5.526 -8.456 362 HH11 ARG 54 1HH2 ARG 54 8.755 -2.181 -8.394 363 HH12 ARG 54 2HH2 ARG 54 9.058 -2.259 -10.130 364 HH21 ARG 54 1HH1 ARG 54 8.106 -5.507 -10.407 365 HH22 ARG 54 2HH1 ARG 54 8.264 -4.085 -11.373 366 H PHE 55 H PHE 55 5.843 -3.823 -2.309 367 HA PHE 55 HA PHE 55 7.441 -4.102 0.127 368 HB2 PHE 55 HB2 PHE 55 6.155 -2.245 0.842 369 HB3 PHE 55 HB1 PHE 55 7.135 -1.998 -0.584 370 HD1 PHE 55 HD2 PHE 55 6.255 -1.755 -2.754 371 HD2 PHE 55 HD1 PHE 55 3.794 -1.677 0.739 372 HE1 PHE 55 HE2 PHE 55 4.651 -0.282 -4.023 373 HE2 PHE 55 HE1 PHE 55 2.209 -0.161 -0.456 374 HZ PHE 55 HZ PHE 55 2.665 0.547 -2.683 375 H GLU 56 H GLU 56 4.003 -4.631 -1.136 376 HA GLU 56 HA GLU 56 2.744 -4.875 1.220 377 HB2 GLU 56 HB2 GLU 56 2.271 -5.980 -1.603 378 HB3 GLU 56 HB1 GLU 56 1.303 -6.582 -0.214 379 HG2 GLU 56 HG2 GLU 56 1.474 -3.619 -0.626 380 HG3 GLU 56 HG1 GLU 56 0.428 -4.595 -1.583 381 H SER 57 H SER 57 4.927 -7.128 -0.321 382 HA SER 57 HA SER 57 4.330 -9.130 1.720 383 HB2 SER 57 HB2 SER 57 6.248 -10.373 0.536 384 HB3 SER 57 HB1 SER 57 4.848 -9.913 -0.419 385 HG SER 57 HG SER 57 6.033 -8.431 -1.474 386 H GLY 58 H GLY 58 6.367 -6.450 1.923 387 HA2 GLY 58 HA2 GLY 58 7.854 -5.927 3.724 388 HA3 GLY 58 HA1 GLY 58 7.902 -7.662 4.015 389 H LYS 59 H LYS 59 8.376 -7.385 0.766 390 HA LYS 59 HA LYS 59 11.218 -7.975 1.255 391 HB2 LYS 59 HB2 LYS 59 9.147 -8.325 -0.911 392 HB3 LYS 59 HB1 LYS 59 10.863 -8.593 -1.273 393 HG2 LYS 59 HG2 LYS 59 10.895 -10.326 0.555 394 HG3 LYS 59 HG1 LYS 59 9.163 -10.049 0.871 395 HD2 LYS 59 HD2 LYS 59 8.630 -10.343 -1.472 396 HD3 LYS 59 HD1 LYS 59 10.131 -11.136 -1.672 397 HE2 LYS 59 HE2 LYS 59 7.585 -11.800 0.008 398 HE3 LYS 59 HE1 LYS 59 8.141 -12.562 -1.410 399 HZ1 LYS 59 HZ1 LYS 59 9.875 -13.557 -0.432 400 HZ2 LYS 59 HZ2 LYS 59 9.906 -12.587 0.963 401 HZ3 LYS 59 HZ3 LYS 59 8.735 -13.793 0.607 402 H LEU 60 H LEU 60 9.624 -5.233 0.171 403 HA LEU 60 HA LEU 60 12.130 -4.021 -0.758 404 HB2 LEU 60 HB2 LEU 60 10.466 -4.539 -2.707 405 HB3 LEU 60 HB1 LEU 60 9.239 -3.552 -1.885 406 HG LEU 60 HG LEU 60 10.718 -1.504 -2.090 407 HD11 LEU 60 1HD1 LEU 60 12.597 -1.719 -3.827 408 HD12 LEU 60 2HD1 LEU 60 13.051 -2.741 -2.401 409 HD13 LEU 60 3HD1 LEU 60 12.229 -3.517 -3.669 410 HD21 LEU 60 3HD2 LEU 60 9.021 -2.288 -3.806 411 HD22 LEU 60 1HD2 LEU 60 10.273 -1.186 -4.348 412 HD23 LEU 60 2HD2 LEU 60 10.392 -2.885 -4.706 413 H LYS 61 H LYS 61 12.622 -2.195 0.358 414 HA LYS 61 HA LYS 61 10.673 -0.681 1.831 415 HB2 LYS 61 HB2 LYS 61 12.840 -0.888 2.568 416 HB3 LYS 61 HB1 LYS 61 13.473 -0.276 1.036 417 HG2 LYS 61 HG2 LYS 61 13.017 1.921 1.526 418 HG3 LYS 61 HG1 LYS 61 11.669 1.448 2.650 419 HD2 LYS 61 HD2 LYS 61 13.194 0.875 4.394 420 HD3 LYS 61 HD1 LYS 61 14.558 0.817 3.222 421 HE2 LYS 61 HE2 LYS 61 14.485 3.166 3.127 422 HE3 LYS 61 HE1 LYS 61 13.009 3.326 4.184 423 HZ1 LYS 61 HZ1 LYS 61 15.716 2.346 4.951 424 HZ2 LYS 61 HZ2 LYS 61 14.841 3.622 5.638 425 HZ3 LYS 61 HZ3 LYS 61 14.544 2.032 5.799 426 HA PRO 62 HA PRO 62 9.546 1.583 -1.848 427 HB2 PRO 62 HB1 PRO 62 7.455 3.116 -0.881 428 HB3 PRO 62 HB2 PRO 62 7.307 1.292 -1.215 429 HG2 PRO 62 HG1 PRO 62 7.766 2.659 1.477 430 HG3 PRO 62 HG2 PRO 62 6.784 1.249 1.108 431 HD2 PRO 62 HD1 PRO 62 9.295 1.102 2.132 432 HD3 PRO 62 HD2 PRO 62 8.514 -0.183 1.138 433 H THR 63 H THR 63 8.948 4.408 -2.061 434 HA THR 63 HA THR 63 11.698 5.053 -1.293 435 HB THR 63 HB THR 63 11.574 6.560 -3.140 436 HG1 THR 63 HG1 THR 63 9.891 6.894 -4.309 437 HG21 THR 63 1HG2 THR 63 10.896 3.655 -3.778 438 HG22 THR 63 2HG2 THR 63 11.303 4.860 -4.945 439 HG23 THR 63 3HG2 THR 63 12.491 4.544 -3.736 440 H ILE 64 H ILE 64 12.207 7.504 -1.015 441 HA ILE 64 HA ILE 64 10.961 8.474 1.171 442 HB ILE 64 HB ILE 64 13.281 8.943 0.667 443 HG12 ILE 64 2HG1 ILE 64 11.427 11.034 1.449 444 HG13 ILE 64 1HG1 ILE 64 12.522 10.016 2.361 445 HG21 ILE 64 1HG2 ILE 64 12.210 11.069 -1.193 446 HG22 ILE 64 2HG2 ILE 64 13.837 10.696 -0.912 447 HG23 ILE 64 3HG2 ILE 64 12.823 9.539 -1.889 448 HD11 ILE 64 HD3 ILE 64 13.238 12.298 2.312 449 HD12 ILE 64 HD1 ILE 64 14.479 11.205 1.693 450 HD13 ILE 64 HD2 ILE 64 13.567 12.247 0.575 451 H SER 65 H SER 65 10.433 9.466 -2.322 452 HA SER 65 HA SER 65 8.194 11.119 -1.634 453 HB2 SER 65 HB2 SER 65 7.675 10.979 -4.007 454 HB3 SER 65 HB1 SER 65 9.345 11.420 -3.859 455 HG SER 65 HG SER 65 9.945 9.534 -4.657 456 H GLN 66 H GLN 66 8.393 7.617 -2.452 457 HA GLN 66 HA GLN 66 5.579 7.672 -2.615 458 HB2 GLN 66 HB2 GLN 66 6.998 6.089 -3.905 459 HB3 GLN 66 HB1 GLN 66 7.654 5.424 -2.478 460 HG2 GLN 66 HG2 GLN 66 5.506 4.194 -1.918 461 HG3 GLN 66 HG1 GLN 66 4.631 4.961 -3.116 462 HE21 GLN 66 1HE2 GLN 66 5.127 3.740 -5.345 463 HE22 GLN 66 2HE2 GLN 66 6.279 2.479 -5.320 464 H ALA 67 H ALA 67 7.591 6.775 0.240 465 HA ALA 67 HA ALA 67 5.406 5.888 1.710 466 HB1 ALA 67 HB1 ALA 67 7.932 5.577 2.394 467 HB2 ALA 67 HB2 ALA 67 8.042 7.316 2.357 468 HB3 ALA 67 HB3 ALA 67 7.086 6.388 3.666 469 H ARG 68 H ARG 68 6.782 9.351 1.366 470 HA ARG 68 HA ARG 68 4.977 10.631 2.997 471 HB2 ARG 68 HB2 ARG 68 7.019 11.412 2.061 472 HB3 ARG 68 HB1 ARG 68 6.267 11.501 0.414 473 HG2 ARG 68 HG2 ARG 68 6.552 13.610 1.464 474 HG3 ARG 68 HG1 ARG 68 4.776 13.133 1.222 475 HD2 ARG 68 HD2 ARG 68 4.471 12.802 3.541 476 HD3 ARG 68 HD1 ARG 68 6.214 13.107 3.868 477 HE ARG 68 HE ARG 68 4.083 14.907 2.926 478 HH11 ARG 68 1HH2 ARG 68 6.787 14.522 5.192 479 HH12 ARG 68 2HH2 ARG 68 6.662 16.142 5.775 480 HH21 ARG 68 1HH1 ARG 68 4.449 17.145 3.355 481 HH22 ARG 68 2HH1 ARG 68 5.598 17.704 4.629 482 H GLN 69 H GLN 69 4.547 9.428 -0.579 483 HA GLN 69 HA GLN 69 1.999 10.667 -0.558 484 HB2 GLN 69 HB2 GLN 69 3.662 8.815 -2.267 485 HB3 GLN 69 HB1 GLN 69 1.911 8.901 -2.549 486 HG2 GLN 69 HG2 GLN 69 2.003 11.177 -3.153 487 HG3 GLN 69 HG1 GLN 69 3.394 11.415 -2.104 488 HE21 GLN 69 1HE2 GLN 69 5.545 10.382 -2.739 489 HE22 GLN 69 2HE2 GLN 69 5.925 10.074 -4.426 490 H LEU 70 H LEU 70 3.130 7.470 0.239 491 HA LEU 70 HA LEU 70 0.999 5.953 -0.191 492 HB2 LEU 70 HB2 LEU 70 3.397 5.685 1.542 493 HB3 LEU 70 HB1 LEU 70 2.086 4.593 2.003 494 HG LEU 70 HG LEU 70 3.218 4.708 -0.771 495 HD11 LEU 70 1HD1 LEU 70 4.824 3.856 0.682 496 HD12 LEU 70 2HD1 LEU 70 3.557 2.849 1.550 497 HD13 LEU 70 3HD1 LEU 70 4.089 2.415 -0.059 498 HD21 LEU 70 3HD2 LEU 70 1.809 2.652 -1.101 499 HD22 LEU 70 1HD2 LEU 70 1.177 2.803 0.528 500 HD23 LEU 70 2HD2 LEU 70 0.712 3.878 -0.768 501 H GLU 71 H GLU 71 1.785 6.853 3.153 502 HA GLU 71 HA GLU 71 -0.482 6.113 4.307 503 HB2 GLU 71 HB2 GLU 71 0.314 7.551 6.181 504 HB3 GLU 71 HB1 GLU 71 1.684 6.624 5.477 505 HG2 GLU 71 HG2 GLU 71 2.574 8.683 4.502 506 HG3 GLU 71 HG1 GLU 71 0.983 9.503 4.845 507 H LYS 72 H LYS 72 0.012 8.776 2.197 508 HA LYS 72 HA LYS 72 -1.913 10.539 3.345 509 HB2 LYS 72 HB2 LYS 72 0.125 11.430 2.748 510 HB3 LYS 72 HB1 LYS 72 0.040 10.739 1.116 511 HG2 LYS 72 HG2 LYS 72 -1.978 12.280 0.788 512 HG3 LYS 72 HG1 LYS 72 -1.959 12.824 2.358 513 HD2 LYS 72 HD2 LYS 72 0.573 13.125 0.654 514 HD3 LYS 72 HD1 LYS 72 -0.700 14.234 0.561 515 HE2 LYS 72 HE2 LYS 72 0.802 13.568 3.171 516 HE3 LYS 72 HE1 LYS 72 1.304 14.623 1.901 517 HZ1 LYS 72 HZ1 LYS 72 -1.025 15.151 3.641 518 HZ2 LYS 72 HZ2 LYS 72 0.344 15.944 3.570 519 HZ3 LYS 72 HZ3 LYS 72 -0.728 15.967 2.281 520 H ILE 73 H ILE 73 -1.593 8.455 0.358 521 HA ILE 73 HA ILE 73 -4.138 9.248 -0.723 522 HB ILE 73 HB ILE 73 -3.781 7.439 -2.233 523 HG12 ILE 73 2HG1 ILE 73 -1.191 6.742 -1.053 524 HG13 ILE 73 1HG1 ILE 73 -2.791 5.839 -0.753 525 HG21 ILE 73 1HG2 ILE 73 -2.184 8.563 -3.546 526 HG22 ILE 73 2HG2 ILE 73 -2.914 9.712 -2.445 527 HG23 ILE 73 3HG2 ILE 73 -1.270 9.059 -2.171 528 HD11 ILE 73 HD3 ILE 73 -2.993 5.369 -3.033 529 HD12 ILE 73 HD1 ILE 73 -1.309 5.939 -3.291 530 HD13 ILE 73 HD2 ILE 73 -1.564 4.601 -2.213 531 H LEU 74 H LEU 74 -3.026 6.536 1.426 532 HA LEU 74 HA LEU 74 -5.406 5.406 1.231 533 HB2 LEU 74 HB2 LEU 74 -3.249 5.226 3.450 534 HB3 LEU 74 HB1 LEU 74 -4.558 4.017 3.335 535 HG LEU 74 HG LEU 74 -2.836 4.469 0.994 536 HD11 LEU 74 1HD1 LEU 74 -2.988 2.214 2.994 537 HD12 LEU 74 2HD1 LEU 74 -1.876 2.329 1.568 538 HD13 LEU 74 3HD1 LEU 74 -1.737 3.445 2.965 539 HD21 LEU 74 3HD2 LEU 74 -5.071 3.691 0.385 540 HD22 LEU 74 1HD2 LEU 74 -3.753 2.558 0.104 541 HD23 LEU 74 2HD2 LEU 74 -4.963 2.313 1.469 542 H GLY 75 H GLY 75 -4.404 7.931 3.199 543 HA2 GLY 75 HA2 GLY 75 -5.654 9.505 4.634 544 HA3 GLY 75 HA1 GLY 75 -7.055 8.534 4.273 545 H ILE 76 H ILE 76 -5.436 5.927 5.169 546 HA ILE 76 HA ILE 76 -6.669 6.339 7.780 547 HB ILE 76 HB ILE 76 -7.136 3.939 7.622 548 HG12 ILE 76 2HG1 ILE 76 -6.430 3.915 4.647 549 HG13 ILE 76 1HG1 ILE 76 -5.304 3.356 5.861 550 HG21 ILE 76 1HG2 ILE 76 -8.681 5.725 6.888 551 HG22 ILE 76 2HG2 ILE 76 -8.153 5.430 5.225 552 HG23 ILE 76 3HG2 ILE 76 -8.985 4.081 6.143 553 HD11 ILE 76 HD3 ILE 76 -7.288 1.818 6.672 554 HD12 ILE 76 HD1 ILE 76 -8.091 2.298 5.257 555 HD13 ILE 76 HD2 ILE 76 -6.598 1.365 5.189 556 H LYS 77 H LYS 77 -5.857 4.414 9.306 557 HA LYS 77 HA LYS 77 -3.641 2.989 9.247 558 HB2 LYS 77 HB2 LYS 77 -2.072 4.274 10.802 559 HB3 LYS 77 HB1 LYS 77 -2.222 4.812 9.127 560 HG2 LYS 77 HG2 LYS 77 -3.151 6.683 9.420 561 HG3 LYS 77 HG1 LYS 77 -3.781 6.343 11.099 562 HD2 LYS 77 HD2 LYS 77 -1.472 6.534 11.831 563 HD3 LYS 77 HD1 LYS 77 -0.963 6.754 10.160 564 HE2 LYS 77 HE2 LYS 77 -2.908 8.620 11.638 565 HE3 LYS 77 HE1 LYS 77 -1.184 8.916 11.616 566 HZ1 LYS 77 HZ1 LYS 77 -1.685 9.857 9.515 567 HZ2 LYS 77 HZ2 LYS 77 -2.546 8.562 8.996 568 HZ3 LYS 77 HZ3 LYS 77 -3.223 9.657 9.907 569 H LEU 78 H LEU 78 -3.106 2.247 11.511 570 HA LEU 78 HA LEU 78 -4.517 3.503 13.690 571 HB2 LEU 78 HB2 LEU 78 -4.809 0.405 13.553 572 HB3 LEU 78 HB1 LEU 78 -4.960 1.208 14.925 573 HG LEU 78 HG LEU 78 -6.631 2.182 12.622 574 HD11 LEU 78 1HD1 LEU 78 -7.306 0.262 14.931 575 HD12 LEU 78 2HD1 LEU 78 -8.510 0.781 13.641 576 HD13 LEU 78 3HD1 LEU 78 -7.087 -0.202 13.316 577 HD21 LEU 78 3HD2 LEU 78 -7.973 2.984 14.726 578 HD22 LEU 78 1HD2 LEU 78 -6.525 2.562 15.621 579 HD23 LEU 78 2HD2 LEU 78 -6.474 3.825 14.343 580 H VAL 79 H VAL 79 -1.564 2.927 15.464 581 HA VAL 79 HA VAL 79 -4.236 2.542 16.270 582 HB VAL 79 HB VAL 79 -3.538 3.027 18.456 583 HG11 VAL 79 1HG1 VAL 79 -1.550 1.504 16.907 584 HG12 VAL 79 2HG1 VAL 79 -1.580 1.500 18.752 585 HG13 VAL 79 3HG1 VAL 79 -2.879 0.865 17.830 586 HG21 VAL 79 3HG2 VAL 79 -0.956 4.292 17.471 587 HG22 VAL 79 1HG2 VAL 79 -2.263 4.987 18.430 588 HG23 VAL 79 2HG2 VAL 79 -1.160 3.609 18.998 589 H THR 80 H THR 80 -5.267 4.376 18.044 590 HA THR 80 HA THR 80 -6.023 6.568 16.258 591 HB THR 80 HB THR 80 -7.645 6.902 17.999 592 HG1 THR 80 HG1 THR 80 -7.574 5.387 19.792 593 HG21 THR 80 1HG2 THR 80 -8.896 5.054 17.835 594 HG22 THR 80 2HG2 THR 80 -7.939 5.042 16.323 595 HG23 THR 80 3HG2 THR 80 -7.445 3.991 17.663 596 HA PRO 81 HA PRO 81 -3.656 9.625 18.351 597 HB2 PRO 81 HB1 PRO 81 -6.292 11.101 18.290 598 HB3 PRO 81 HB2 PRO 81 -4.646 11.703 17.864 599 HG2 PRO 81 HG1 PRO 81 -6.372 11.198 16.010 600 HG3 PRO 81 HG2 PRO 81 -4.628 10.514 15.851 601 HD2 PRO 81 HD1 PRO 81 -7.093 9.066 16.886 602 HD3 PRO 81 HD2 PRO 81 -5.951 8.468 15.655 603 H LEU 82 H LEU 82 -6.309 7.984 19.640 604 HA LEU 82 HA LEU 82 -5.987 9.117 22.390 605 HB2 LEU 82 HB2 LEU 82 -7.828 7.044 21.283 606 HB3 LEU 82 HB1 LEU 82 -7.852 7.690 22.932 607 HG LEU 82 HG LEU 82 -8.611 9.124 20.432 608 HD11 LEU 82 1HD1 LEU 82 -10.925 9.025 21.464 609 HD12 LEU 82 2HD1 LEU 82 -10.184 7.387 21.328 610 HD13 LEU 82 3HD1 LEU 82 -10.189 8.231 22.902 611 HD21 LEU 82 3HD2 LEU 82 -8.736 10.138 23.209 612 HD22 LEU 82 1HD2 LEU 82 -7.398 10.507 22.214 613 HD23 LEU 82 2HD2 LEU 82 -8.914 11.042 21.618 614 H GLU 83 H GLU 83 -4.715 6.748 20.345 615 HA GLU 83 HA GLU 83 -3.561 5.668 22.885 616 HB2 GLU 83 HB2 GLU 83 -3.978 4.423 20.130 617 HB3 GLU 83 HB1 GLU 83 -2.614 3.839 21.160 618 HG2 GLU 83 HG2 GLU 83 -4.205 3.327 23.003 619 HG3 GLU 83 HG1 GLU 83 -5.568 3.716 21.879 620 H ASN 84 H ASN 84 -2.726 7.793 20.343 621 HA ASN 84 HA ASN 84 0.143 7.634 20.920 622 HB2 ASN 84 HB2 ASN 84 0.931 7.225 18.775 623 HB3 ASN 84 HB1 ASN 84 -0.037 5.931 18.974 624 HD21 ASN 84 1HD2 ASN 84 -2.511 7.446 17.950 625 HD22 ASN 84 2HD2 ASN 84 -2.014 8.248 16.450 626 H ASN 85 H ASN 85 1.209 9.459 19.493 627 HA ASN 85 HA ASN 85 -0.030 11.931 20.003 628 HB2 ASN 85 HB2 ASN 85 2.408 11.449 19.871 629 HB3 ASN 85 HB1 ASN 85 2.259 11.348 18.096 630 HD21 ASN 85 1HD2 ASN 85 2.745 13.376 16.985 631 HD22 ASN 85 2HD2 ASN 85 2.679 14.887 17.875 632 H GLU 86 H GLU 86 -0.640 13.612 18.494 633 HA GLU 86 HA GLU 86 -0.671 13.083 15.680 634 HB2 GLU 86 HB2 GLU 86 -2.832 12.290 16.530 635 HB3 GLU 86 HB1 GLU 86 -3.103 13.702 17.440 636 HG2 GLU 86 HG2 GLU 86 -4.629 13.823 15.545 637 HG3 GLU 86 HG1 GLU 86 -3.361 15.056 15.382 638 H GLU 87 H GLU 87 -0.949 14.873 14.470 639 HA GLU 87 HA GLU 87 0.612 17.221 15.429 640 HB2 GLU 87 HB2 GLU 87 0.642 15.537 12.802 641 HB3 GLU 87 HB1 GLU 87 1.627 16.887 13.140 642 HG2 GLU 87 HG2 GLU 87 2.705 15.734 15.036 643 HG3 GLU 87 HG1 GLU 87 1.649 14.407 14.878 644 H SER 88 H SER 88 0.045 19.254 14.704 645 HA SER 88 HA SER 88 -2.501 19.482 13.294 646 HB2 SER 88 HB2 SER 88 -2.072 21.985 13.696 647 HB3 SER 88 HB1 SER 88 -2.208 21.047 15.138 648 HG SER 88 HG SER 88 -0.522 22.062 15.552 649 H GLU 89 H GLU 89 0.981 19.778 12.530 650 HA GLU 89 HA GLU 89 0.709 21.330 10.095 651 HB2 GLU 89 HB2 GLU 89 2.500 21.559 11.912 652 HB3 GLU 89 HB1 GLU 89 3.103 20.021 11.442 653 HG2 GLU 89 HG2 GLU 89 3.422 20.945 9.084 654 HG3 GLU 89 HG1 GLU 89 2.621 22.380 9.562 655 H LYS 90 H LYS 90 -0.406 20.327 8.638 656 HA LYS 90 HA LYS 90 0.486 17.809 7.391 657 HB2 LYS 90 HB2 LYS 90 -1.394 17.882 9.367 658 HB3 LYS 90 HB1 LYS 90 -2.427 18.317 7.983 659 HG2 LYS 90 HG2 LYS 90 -1.220 16.088 7.046 660 HG3 LYS 90 HG1 LYS 90 -0.416 15.982 8.499 661 HD2 LYS 90 HD2 LYS 90 -3.495 15.972 8.429 662 HD3 LYS 90 HD1 LYS 90 -2.483 14.523 8.234 663 HE2 LYS 90 HE2 LYS 90 -1.383 14.881 10.366 664 HE3 LYS 90 HE1 LYS 90 -2.520 16.253 10.639 665 HZ1 LYS 90 HZ1 LYS 90 -3.462 14.080 11.643 666 HZ2 LYS 90 HZ2 LYS 90 -4.272 14.615 10.325 667 HZ3 LYS 90 HZ3 LYS 90 -3.228 13.358 10.278 668 H GLU 91 H GLU 91 -0.091 21.006 6.906 669 HA GLU 91 HA GLU 91 -1.687 20.790 4.495 670 HB2 GLU 91 HB2 GLU 91 -1.775 22.670 5.998 671 HB3 GLU 91 HB1 GLU 91 -0.060 23.060 5.500 672 HG2 GLU 91 HG2 GLU 91 -1.014 23.224 3.081 673 HG3 GLU 91 HG1 GLU 91 -2.548 22.575 3.826 674 H PHE 92 H PHE 92 1.808 21.143 5.387 675 HA PHE 92 HA PHE 92 2.602 21.411 2.756 676 HB2 PHE 92 HB2 PHE 92 3.995 19.802 4.852 677 HB3 PHE 92 HB1 PHE 92 4.691 20.292 3.260 678 HD1 PHE 92 HD2 PHE 92 4.322 23.082 2.938 679 HD2 PHE 92 HD1 PHE 92 4.495 21.082 6.761 680 HE1 PHE 92 HE2 PHE 92 4.984 25.204 4.072 681 HE2 PHE 92 HE1 PHE 92 5.494 23.169 7.756 682 HZ PHE 92 HZ PHE 92 5.669 25.153 6.398 683 H ASP 93 H ASP 93 2.808 19.971 1.043 684 HA ASP 93 HA ASP 93 1.435 17.401 1.030 685 HB2 ASP 93 HB2 ASP 93 1.758 19.304 -0.624 686 HB3 ASP 93 HB1 ASP 93 3.327 18.422 -0.995 687 H ASP 94 H ASP 94 4.768 18.521 0.704 688 HA ASP 94 HA ASP 94 5.768 15.707 0.949 689 HB2 ASP 94 HB2 ASP 94 5.710 16.492 -1.293 690 HB3 ASP 94 HB1 ASP 94 6.669 17.953 -0.867 691 H THR 95 H THR 95 6.553 19.024 1.744 692 HA THR 95 HA THR 95 8.564 18.432 3.714 693 HB THR 95 HB THR 95 9.702 17.928 1.576 694 HG1 THR 95 HG1 THR 95 10.915 18.556 3.301 695 HG21 THR 95 1HG2 THR 95 8.694 19.510 0.023 696 HG22 THR 95 2HG2 THR 95 9.346 20.846 0.976 697 HG23 THR 95 3HG2 THR 95 10.479 19.707 0.128 698 H GLY 96 H GLY 96 9.669 20.333 4.439 699 HA2 GLY 96 HA2 GLY 96 7.684 22.333 5.324 700 HA3 GLY 96 HA1 GLY 96 9.472 22.108 5.739 701 H LEU 97 H LEU 97 7.458 24.396 4.427 702 HA LEU 97 HA LEU 97 9.472 25.412 2.595 703 HB2 LEU 97 HB2 LEU 97 6.447 25.249 2.212 704 HB3 LEU 97 HB1 LEU 97 7.271 26.296 1.281 705 HG LEU 97 HG LEU 97 8.167 23.322 1.283 706 HD11 LEU 97 1HD1 LEU 97 5.671 23.445 0.938 707 HD12 LEU 97 2HD1 LEU 97 5.991 24.471 -0.395 708 HD13 LEU 97 3HD1 LEU 97 6.576 22.795 -0.442 709 HD21 LEU 97 3HD2 LEU 97 8.556 23.863 -1.111 710 HD22 LEU 97 1HD2 LEU 97 8.289 25.460 -0.928 711 HD23 LEU 97 2HD2 LEU 97 9.667 24.810 -0.046 712 H THR 98 H THR 98 9.666 27.668 2.754 713 HA THR 98 HA THR 98 7.883 29.396 4.422 714 HB THR 98 HB THR 98 10.888 29.547 4.584 715 HG1 THR 98 HG1 THR 98 10.850 28.373 6.403 716 HG21 THR 98 1HG2 THR 98 9.780 31.421 5.671 717 HG22 THR 98 2HG2 THR 98 8.601 30.289 6.333 718 HG23 THR 98 3HG2 THR 98 10.218 30.344 7.028 719 H LEU 99 H LEU 99 7.389 31.378 3.561 720 HA LEU 99 HA LEU 99 9.068 32.549 1.619 721 HB2 LEU 99 HB2 LEU 99 7.764 30.567 0.563 722 HB3 LEU 99 HB1 LEU 99 6.334 31.458 0.708 723 HG LEU 99 HG LEU 99 8.023 33.319 -0.557 724 HD11 LEU 99 1HD1 LEU 99 8.960 30.603 -1.443 725 HD12 LEU 99 2HD1 LEU 99 9.241 32.129 -2.308 726 HD13 LEU 99 3HD1 LEU 99 9.895 31.977 -0.674 727 HD21 LEU 99 3HD2 LEU 99 6.649 31.078 -2.143 728 HD22 LEU 99 1HD2 LEU 99 5.744 32.279 -1.307 729 HD23 LEU 99 2HD2 LEU 99 6.874 32.809 -2.586 730 H GLY 100 H GLY 100 5.700 32.589 2.782 731 HA2 GLY 100 HA2 GLY 100 4.376 34.184 3.614 732 HA3 GLY 100 HA1 GLY 100 5.848 35.153 3.900 733 H ASP 101 H ASP 101 5.646 34.299 0.573 734 HA ASP 101 HA ASP 101 4.439 36.854 -0.088 735 HB2 ASP 101 HB2 ASP 101 6.873 35.929 -0.741 736 HB3 ASP 101 HB1 ASP 101 6.058 34.938 -1.948 737 H VAL 102 H VAL 102 2.638 35.760 0.567 738 HA VAL 102 HA VAL 102 1.178 34.356 -1.490 739 HB VAL 102 HB VAL 102 -0.158 33.791 0.672 740 HG11 VAL 102 1HG1 VAL 102 0.886 32.188 -1.021 741 HG12 VAL 102 2HG1 VAL 102 2.398 32.519 -0.252 742 HG13 VAL 102 3HG1 VAL 102 1.049 31.784 0.765 743 HG21 VAL 102 3HG2 VAL 102 1.336 33.213 2.511 744 HG22 VAL 102 1HG2 VAL 102 2.694 33.884 1.672 745 HG23 VAL 102 2HG2 VAL 102 1.487 34.927 2.285 746 H VAL 103 H VAL 103 -2.045 36.408 -0.581 747 HA VAL 103 HA VAL 103 -1.627 33.647 -0.732 748 HB VAL 103 HB VAL 103 -3.799 34.727 -0.660 749 HG11 VAL 103 1HG1 VAL 103 -5.073 35.632 -2.486 750 HG12 VAL 103 2HG1 VAL 103 -3.646 36.442 -2.076 751 HG13 VAL 103 3HG1 VAL 103 -3.726 35.428 -3.554 752 HG21 VAL 103 3HG2 VAL 103 -5.034 33.165 -2.323 753 HG22 VAL 103 1HG2 VAL 103 -3.420 32.729 -2.780 754 HG23 VAL 103 2HG2 VAL 103 -4.037 32.492 -1.065 755 H ASN 104 H ASN 104 -1.160 32.273 -2.456 756 HA ASN 104 HA ASN 104 -0.514 33.396 -5.098 757 HB2 ASN 104 HB2 ASN 104 1.554 33.451 -4.118 758 HB3 ASN 104 HB1 ASN 104 1.295 31.921 -3.273 759 HD21 ASN 104 1HD2 ASN 104 2.367 30.396 -4.123 760 HD22 ASN 104 2HD2 ASN 104 2.894 30.121 -5.776 761 H ILE 105 H ILE 105 -1.973 32.147 -6.394 762 HA ILE 105 HA ILE 105 -3.077 29.596 -5.310 763 HB ILE 105 HB ILE 105 -4.873 29.875 -6.690 764 HG12 ILE 105 2HG1 ILE 105 -3.783 32.631 -7.540 765 HG13 ILE 105 1HG1 ILE 105 -3.610 31.189 -8.515 766 HG21 ILE 105 1HG2 ILE 105 -6.011 31.617 -5.776 767 HG22 ILE 105 2HG2 ILE 105 -4.942 30.906 -4.566 768 HG23 ILE 105 3HG2 ILE 105 -4.407 32.441 -5.206 769 HD11 ILE 105 HD3 ILE 105 -5.465 32.044 -9.496 770 HD12 ILE 105 HD1 ILE 105 -6.304 31.111 -8.158 771 HD13 ILE 105 HD2 ILE 105 -5.891 32.853 -8.042 772 H LYS 106 H LYS 106 -3.659 28.184 -7.312 773 HA LYS 106 HA LYS 106 -1.157 27.379 -8.081 774 HB2 LYS 106 HB2 LYS 106 -3.347 26.037 -7.639 775 HB3 LYS 106 HB1 LYS 106 -3.691 26.230 -9.366 776 HG2 LYS 106 HG2 LYS 106 -1.348 25.232 -9.743 777 HG3 LYS 106 HG1 LYS 106 -1.456 24.800 -8.127 778 HD2 LYS 106 HD2 LYS 106 -3.619 23.574 -8.479 779 HD3 LYS 106 HD1 LYS 106 -3.267 23.671 -10.188 780 HE2 LYS 106 HE2 LYS 106 -1.322 22.321 -8.330 781 HE3 LYS 106 HE1 LYS 106 -2.450 21.648 -9.531 782 HZ1 LYS 106 HZ1 LYS 106 -0.090 23.292 -10.033 783 HZ2 LYS 106 HZ2 LYS 106 -0.255 21.709 -10.230 784 HZ3 LYS 106 HZ3 LYS 106 -1.062 22.689 -11.248 785 H GLU 107 H GLU 107 -3.670 28.878 -9.999 786 HA GLU 107 HA GLU 107 -2.188 29.243 -12.405 787 HB2 GLU 107 HB2 GLU 107 -4.617 30.530 -11.019 788 HB3 GLU 107 HB1 GLU 107 -4.087 31.039 -12.622 789 HG2 GLU 107 HG2 GLU 107 -4.817 28.191 -11.913 790 HG3 GLU 107 HG1 GLU 107 -6.098 29.362 -12.336 791 H GLY 108 H GLY 108 -2.040 31.310 -9.501 792 HA2 GLY 108 HA2 GLY 108 0.058 32.715 -10.493 793 HA3 GLY 108 HA1 GLY 108 -1.390 33.640 -10.931 794 H LYS 109 H LYS 109 -0.009 35.289 -9.497 795 HA LYS 109 HA LYS 109 0.267 34.476 -6.804 796 HB2 LYS 109 HB2 LYS 109 1.981 35.464 -8.252 797 HB3 LYS 109 HB1 LYS 109 1.044 37.038 -8.145 798 HG2 LYS 109 HG2 LYS 109 1.401 36.926 -5.671 799 HG3 LYS 109 HG1 LYS 109 2.399 35.452 -6.011 800 HD2 LYS 109 HD2 LYS 109 4.045 36.798 -7.261 801 HD3 LYS 109 HD1 LYS 109 2.897 38.155 -7.152 802 HE2 LYS 109 HE2 LYS 109 3.220 38.289 -4.706 803 HE3 LYS 109 HE1 LYS 109 3.938 36.657 -4.798 804 HZ1 LYS 109 HZ1 LYS 109 5.252 39.203 -5.432 805 HZ2 LYS 109 HZ2 LYS 109 5.751 37.993 -4.492 806 HZ3 LYS 109 HZ3 LYS 109 5.714 37.854 -6.129 807 H LYS 110 H LYS 110 -2.466 35.337 -8.086 808 HA LYS 110 HA LYS 110 -3.699 36.299 -5.797 809 HB2 LYS 110 HB2 LYS 110 -4.586 38.370 -6.494 810 HB3 LYS 110 HB1 LYS 110 -2.753 38.445 -6.442 811 HG2 LYS 110 HG2 LYS 110 -2.695 38.276 -8.898 812 HG3 LYS 110 HG1 LYS 110 -4.404 38.545 -8.871 813 HD2 LYS 110 HD2 LYS 110 -2.222 40.359 -7.754 814 HD3 LYS 110 HD1 LYS 110 -3.349 40.552 -9.188 815 HE2 LYS 110 HE2 LYS 110 -5.194 40.848 -7.737 816 HE3 LYS 110 HE1 LYS 110 -4.273 40.547 -6.299 817 HZ1 LYS 110 HZ1 LYS 110 -4.229 42.857 -8.064 818 HZ2 LYS 110 HZ2 LYS 110 -4.345 42.883 -6.483 819 HZ3 LYS 110 HZ3 LYS 110 -2.877 42.482 -7.053 820 H LEU 111 H LEU 111 -5.890 36.626 -5.938 821 HA LEU 111 HA LEU 111 -7.574 35.257 -7.850 822 HB2 LEU 111 HB2 LEU 111 -8.243 36.623 -5.274 823 HB3 LEU 111 HB1 LEU 111 -9.334 36.323 -6.509 824 HG LEU 111 HG LEU 111 -8.774 33.897 -6.442 825 HD11 LEU 111 1HD1 LEU 111 -7.003 34.541 -4.127 826 HD12 LEU 111 2HD1 LEU 111 -7.683 32.906 -4.630 827 HD13 LEU 111 3HD1 LEU 111 -6.669 33.858 -5.760 828 HD21 LEU 111 3HD2 LEU 111 -10.023 33.235 -4.682 829 HD22 LEU 111 1HD2 LEU 111 -9.610 34.858 -3.755 830 HD23 LEU 111 2HD2 LEU 111 -10.746 34.658 -5.124 831 H GLU 112 H GLU 112 -8.960 36.360 -9.377 832 HA GLU 112 HA GLU 112 -8.478 39.115 -9.957 833 HB2 GLU 112 HB2 GLU 112 -7.522 36.839 -11.734 834 HB3 GLU 112 HB1 GLU 112 -7.658 38.485 -12.237 835 HG2 GLU 112 HG2 GLU 112 -6.154 38.964 -10.140 836 HG3 GLU 112 HG1 GLU 112 -5.745 37.179 -10.445 837 H HIS 113 H HIS 113 -9.819 36.772 -12.174 838 HA HIS 113 HA HIS 113 -12.319 38.358 -12.163 839 HB2 HIS 113 HB2 HIS 113 -12.890 37.480 -14.026 840 HB3 HIS 113 HB1 HIS 113 -11.125 37.652 -14.231 841 HD2 HIS 113 HD2 HIS 113 -13.749 35.360 -14.919 842 HE1 HIS 113 HE1 HIS 113 -10.259 33.036 -15.110 843 HE2 HIS 113 HE2 HIS 113 -12.622 33.138 -15.769 844 H HIS 114 H HIS 114 -11.054 36.044 -10.411 845 HA HIS 114 HA HIS 114 -12.841 34.004 -9.957 846 HB2 HIS 114 HB2 HIS 114 -11.250 35.541 -7.863 847 HB3 HIS 114 HB1 HIS 114 -11.803 34.059 -7.573 848 HD2 HIS 114 HD2 HIS 114 -10.516 31.891 -8.234 849 HE1 HIS 114 HE1 HIS 114 -7.400 33.558 -10.446 850 HE2 HIS 114 HE2 HIS 114 -8.308 31.489 -9.599 Start of MODEL 8 1 H1 GLU 13 H1 GLU 13 -5.563 -17.426 2.074 2 H2 GLU 13 H2 GLU 13 -5.577 -16.802 3.556 3 H3 GLU 13 H3 GLU 13 -5.176 -15.834 2.289 4 HA GLU 13 HA GLU 13 -3.408 -18.020 3.066 5 HB2 GLU 13 HB2 GLU 13 -3.562 -17.822 0.752 6 HB3 GLU 13 HB1 GLU 13 -3.579 -16.110 0.694 7 HG2 GLU 13 HG2 GLU 13 -1.257 -15.870 1.328 8 HG3 GLU 13 HG1 GLU 13 -1.141 -17.453 1.763 9 H ASN 14 H ASN 14 -1.983 -17.226 4.958 10 HA ASN 14 HA ASN 14 -2.218 -14.490 5.631 11 HB2 ASN 14 HB2 ASN 14 -2.163 -16.606 7.094 12 HB3 ASN 14 HB1 ASN 14 -0.563 -16.829 6.697 13 HD21 ASN 14 1HD2 ASN 14 -2.892 -15.351 8.813 14 HD22 ASN 14 2HD2 ASN 14 -1.608 -14.537 9.772 15 H ALA 15 H ALA 15 -0.448 -12.984 5.789 16 HA ALA 15 HA ALA 15 1.690 -13.576 3.930 17 HB1 ALA 15 HB1 ALA 15 0.262 -11.864 3.169 18 HB2 ALA 15 HB2 ALA 15 0.413 -10.965 4.766 19 HB3 ALA 15 HB3 ALA 15 1.686 -11.039 3.629 20 H GLU 16 H GLU 16 1.492 -13.499 7.122 21 HA GLU 16 HA GLU 16 3.682 -11.910 7.724 22 HB2 GLU 16 HB2 GLU 16 2.054 -13.922 9.340 23 HB3 GLU 16 HB1 GLU 16 3.253 -12.870 10.140 24 HG2 GLU 16 HG2 GLU 16 0.836 -12.004 8.444 25 HG3 GLU 16 HG1 GLU 16 0.791 -12.155 10.196 26 H LEU 17 H LEU 17 3.846 -14.645 6.464 27 HA LEU 17 HA LEU 17 5.774 -16.248 7.790 28 HB2 LEU 17 HB2 LEU 17 4.929 -16.264 4.812 29 HB3 LEU 17 HB1 LEU 17 5.530 -17.587 5.644 30 HG LEU 17 HG LEU 17 2.796 -16.525 6.076 31 HD11 LEU 17 1HD1 LEU 17 2.246 -18.881 5.689 32 HD12 LEU 17 2HD1 LEU 17 3.298 -18.291 4.315 33 HD13 LEU 17 3HD1 LEU 17 3.971 -19.266 5.631 34 HD21 LEU 17 3HD2 LEU 17 3.527 -16.805 8.299 35 HD22 LEU 17 1HD2 LEU 17 2.667 -18.339 7.833 36 HD23 LEU 17 2HD2 LEU 17 4.431 -18.187 7.980 37 H GLU 18 H GLU 18 5.991 -13.668 5.635 38 HA GLU 18 HA GLU 18 8.646 -14.453 4.623 39 HB2 GLU 18 HB2 GLU 18 7.909 -13.704 2.472 40 HB3 GLU 18 HB1 GLU 18 6.771 -14.987 3.148 41 HG2 GLU 18 HG2 GLU 18 5.148 -13.474 3.568 42 HG3 GLU 18 HG1 GLU 18 6.082 -12.084 3.138 43 H ILE 19 H ILE 19 7.772 -12.390 6.506 44 HA ILE 19 HA ILE 19 8.734 -9.822 5.426 45 HB ILE 19 HB ILE 19 7.576 -8.969 7.254 46 HG12 ILE 19 2HG1 ILE 19 6.525 -11.709 7.885 47 HG13 ILE 19 1HG1 ILE 19 7.708 -10.732 8.868 48 HG21 ILE 19 1HG2 ILE 19 5.455 -8.969 6.222 49 HG22 ILE 19 2HG2 ILE 19 6.505 -9.633 4.945 50 HG23 ILE 19 3HG2 ILE 19 5.471 -10.671 6.004 51 HD11 ILE 19 HD3 ILE 19 5.739 -10.476 10.070 52 HD12 ILE 19 HD1 ILE 19 6.165 -9.007 9.277 53 HD13 ILE 19 HD2 ILE 19 4.825 -9.937 8.646 54 H VAL 20 H VAL 20 10.081 -8.415 7.030 55 HA VAL 20 HA VAL 20 11.743 -10.074 8.832 56 HB VAL 20 HB VAL 20 12.561 -7.998 9.639 57 HG11 VAL 20 1HG1 VAL 20 13.563 -8.942 7.554 58 HG12 VAL 20 2HG1 VAL 20 12.454 -7.965 6.591 59 HG13 VAL 20 3HG1 VAL 20 13.722 -7.207 7.671 60 HG21 VAL 20 3HG2 VAL 20 10.890 -6.323 9.590 61 HG22 VAL 20 1HG2 VAL 20 12.173 -5.823 8.493 62 HG23 VAL 20 2HG2 VAL 20 10.665 -6.542 7.860 63 H THR 21 H THR 21 11.713 -9.547 11.167 64 HA THR 21 HA THR 21 9.557 -9.730 12.703 65 HB THR 21 HB THR 21 12.179 -8.385 13.449 66 HG1 THR 21 HG1 THR 21 12.778 -10.412 13.364 67 HG21 THR 21 1HG2 THR 21 11.654 -9.040 15.636 68 HG22 THR 21 2HG2 THR 21 10.475 -7.719 15.131 69 HG23 THR 21 3HG2 THR 21 9.978 -9.427 15.249 70 H ASP 22 H ASP 22 11.142 -6.528 12.363 71 HA ASP 22 HA ASP 22 8.783 -5.483 13.520 72 HB2 ASP 22 HB2 ASP 22 10.780 -5.271 14.856 73 HB3 ASP 22 HB1 ASP 22 11.627 -4.378 13.622 74 H TYR 23 H TYR 23 8.430 -5.832 10.881 75 HA TYR 23 HA TYR 23 9.273 -3.825 9.170 76 HB2 TYR 23 HB2 TYR 23 8.271 -6.138 8.485 77 HB3 TYR 23 HB1 TYR 23 6.695 -5.403 8.937 78 HD1 TYR 23 HD1 TYR 23 9.637 -5.022 6.396 79 HD2 TYR 23 HD2 TYR 23 5.548 -4.127 7.497 80 HE1 TYR 23 HE1 TYR 23 9.217 -4.079 4.188 81 HE2 TYR 23 HE2 TYR 23 5.161 -3.067 5.338 82 HH TYR 23 HH TYR 23 7.757 -2.750 2.904 83 H TYR 24 H TYR 24 7.933 -1.756 8.539 84 HA TYR 24 HA TYR 24 6.522 -0.812 10.769 85 HB2 TYR 24 HB2 TYR 24 6.837 1.200 9.872 86 HB3 TYR 24 HB1 TYR 24 8.227 0.342 9.248 87 HD1 TYR 24 HD1 TYR 24 7.570 -0.872 6.720 88 HD2 TYR 24 HD2 TYR 24 6.566 2.969 8.309 89 HE1 TYR 24 HE1 TYR 24 6.946 -0.056 4.474 90 HE2 TYR 24 HE2 TYR 24 5.901 3.743 6.023 91 HH TYR 24 HH TYR 24 6.283 1.727 3.177 92 H LYS 25 H LYS 25 4.512 0.384 10.672 93 HA LYS 25 HA LYS 25 2.457 -1.362 9.571 94 HB2 LYS 25 HB2 LYS 25 3.045 -0.404 12.528 95 HB3 LYS 25 HB1 LYS 25 1.746 -1.413 11.874 96 HG2 LYS 25 HG2 LYS 25 3.561 -2.978 11.044 97 HG3 LYS 25 HG1 LYS 25 4.744 -2.006 11.920 98 HD2 LYS 25 HD2 LYS 25 3.441 -2.484 14.029 99 HD3 LYS 25 HD1 LYS 25 2.181 -3.151 13.054 100 HE2 LYS 25 HE2 LYS 25 3.577 -4.821 14.219 101 HE3 LYS 25 HE1 LYS 25 3.507 -5.067 12.420 102 HZ1 LYS 25 HZ1 LYS 25 5.688 -4.034 12.391 103 HZ2 LYS 25 HZ2 LYS 25 5.671 -3.721 13.972 104 HZ3 LYS 25 HZ3 LYS 25 5.781 -5.270 13.521 105 H ILE 26 H ILE 26 2.979 1.717 9.001 106 HA ILE 26 HA ILE 26 1.306 3.472 10.212 107 HB ILE 26 HB ILE 26 0.913 4.347 7.809 108 HG12 ILE 26 2HG1 ILE 26 3.619 2.976 7.524 109 HG13 ILE 26 1HG1 ILE 26 2.144 2.113 7.034 110 HG21 ILE 26 1HG2 ILE 26 1.874 5.525 9.374 111 HG22 ILE 26 2HG2 ILE 26 3.424 4.544 9.503 112 HG23 ILE 26 3HG2 ILE 26 3.201 5.489 8.108 113 HD11 ILE 26 HD3 ILE 26 1.678 4.078 5.476 114 HD12 ILE 26 HD1 ILE 26 2.981 4.880 6.124 115 HD13 ILE 26 HD2 ILE 26 3.358 3.445 5.155 116 H ILE 27 H ILE 27 0.255 1.020 7.744 117 HA ILE 27 HA ILE 27 -2.422 2.063 8.137 118 HB ILE 27 HB ILE 27 -2.796 1.800 5.639 119 HG12 ILE 27 2HG1 ILE 27 0.320 1.941 5.256 120 HG13 ILE 27 1HG1 ILE 27 -0.639 0.578 5.290 121 HG21 ILE 27 1HG2 ILE 27 -2.057 4.034 5.196 122 HG22 ILE 27 2HG2 ILE 27 -2.668 3.782 6.782 123 HG23 ILE 27 3HG2 ILE 27 -0.914 4.035 6.653 124 HD11 ILE 27 HD3 ILE 27 -1.932 1.163 3.453 125 HD12 ILE 27 HD1 ILE 27 -1.148 2.822 3.268 126 HD13 ILE 27 HD2 ILE 27 -0.226 1.353 3.088 127 H LYS 28 H LYS 28 -0.421 -0.626 8.422 128 HA LYS 28 HA LYS 28 -1.629 -2.514 7.332 129 HB2 LYS 28 HB2 LYS 28 0.429 -2.397 8.902 130 HB3 LYS 28 HB1 LYS 28 -0.752 -2.673 10.236 131 HG2 LYS 28 HG2 LYS 28 -1.337 -4.902 9.178 132 HG3 LYS 28 HG1 LYS 28 -0.429 -4.591 7.855 133 HD2 LYS 28 HD2 LYS 28 1.586 -4.477 9.421 134 HD3 LYS 28 HD1 LYS 28 0.605 -4.960 10.705 135 HE2 LYS 28 HE2 LYS 28 -0.051 -7.097 9.274 136 HE3 LYS 28 HE1 LYS 28 1.157 -6.693 8.194 137 HZ1 LYS 28 HZ1 LYS 28 1.601 -7.488 10.874 138 HZ2 LYS 28 HZ2 LYS 28 1.976 -8.225 9.528 139 HZ3 LYS 28 HZ3 LYS 28 2.812 -6.840 9.826 140 H THR 29 H THR 29 -3.024 -1.531 10.521 141 HA THR 29 HA THR 29 -4.735 -3.692 10.580 142 HB THR 29 HB THR 29 -5.950 -2.262 12.437 143 HG1 THR 29 HG1 THR 29 -5.163 -0.288 12.563 144 HG21 THR 29 1HG2 THR 29 -4.153 -3.625 13.195 145 HG22 THR 29 2HG2 THR 29 -2.920 -2.569 12.500 146 HG23 THR 29 3HG2 THR 29 -3.968 -1.920 13.786 147 H ALA 30 H ALA 30 -5.224 -0.427 9.444 148 HA ALA 30 HA ALA 30 -7.810 -0.283 8.791 149 HB1 ALA 30 HB1 ALA 30 -5.123 0.922 8.304 150 HB2 ALA 30 HB2 ALA 30 -6.404 1.463 7.190 151 HB3 ALA 30 HB3 ALA 30 -6.638 1.580 8.928 152 H ARG 31 H ARG 31 -5.182 -1.636 6.765 153 HA ARG 31 HA ARG 31 -6.660 -2.066 4.421 154 HB2 ARG 31 HB2 ARG 31 -4.238 -3.582 5.469 155 HB3 ARG 31 HB1 ARG 31 -5.089 -3.906 3.953 156 HG2 ARG 31 HG2 ARG 31 -4.836 -1.367 3.371 157 HG3 ARG 31 HG1 ARG 31 -3.839 -1.271 4.719 158 HD2 ARG 31 HD2 ARG 31 -2.487 -1.459 2.701 159 HD3 ARG 31 HD1 ARG 31 -2.263 -2.874 3.791 160 HE ARG 31 HE ARG 31 -4.273 -3.501 2.146 161 HH11 ARG 31 1HH2 ARG 31 -0.739 -3.012 1.706 162 HH12 ARG 31 2HH2 ARG 31 -0.719 -3.955 0.207 163 HH21 ARG 31 1HH1 ARG 31 -4.155 -4.509 0.356 164 HH22 ARG 31 2HH1 ARG 31 -2.700 -5.008 -0.556 165 H GLU 32 H GLU 32 -6.447 -4.377 7.312 166 HA GLU 32 HA GLU 32 -8.397 -6.097 6.166 167 HB2 GLU 32 HB2 GLU 32 -6.677 -6.075 8.372 168 HB3 GLU 32 HB1 GLU 32 -8.311 -5.814 9.042 169 HG2 GLU 32 HG2 GLU 32 -9.036 -7.873 8.082 170 HG3 GLU 32 HG1 GLU 32 -7.550 -7.949 6.964 171 H GLN 33 H GLN 33 -8.917 -3.244 8.237 172 HA GLN 33 HA GLN 33 -11.431 -4.103 9.148 173 HB2 GLN 33 HB2 GLN 33 -9.717 -1.480 9.205 174 HB3 GLN 33 HB1 GLN 33 -11.256 -1.506 9.858 175 HG2 GLN 33 HG2 GLN 33 -10.774 -2.859 11.708 176 HG3 GLN 33 HG1 GLN 33 -9.283 -3.463 10.984 177 HE21 GLN 33 1HE2 GLN 33 -10.095 0.028 10.797 178 HE22 GLN 33 2HE2 GLN 33 -8.956 0.426 12.072 179 H LEU 34 H LEU 34 -10.307 -1.986 6.470 180 HA LEU 34 HA LEU 34 -12.786 -0.878 5.812 181 HB2 LEU 34 HB2 LEU 34 -10.033 -0.981 4.550 182 HB3 LEU 34 HB1 LEU 34 -11.356 0.046 3.962 183 HG LEU 34 HG LEU 34 -10.028 0.126 6.561 184 HD11 LEU 34 1HD1 LEU 34 -9.216 2.344 5.736 185 HD12 LEU 34 2HD1 LEU 34 -8.681 0.927 4.729 186 HD13 LEU 34 3HD1 LEU 34 -9.891 1.979 4.104 187 HD21 LEU 34 3HD2 LEU 34 -11.078 2.254 6.978 188 HD22 LEU 34 1HD2 LEU 34 -12.031 2.093 5.462 189 HD23 LEU 34 2HD2 LEU 34 -12.448 1.044 6.806 190 H GLY 35 H GLY 35 -11.430 -3.961 5.147 191 HA2 GLY 35 HA2 GLY 35 -12.303 -5.708 3.791 192 HA3 GLY 35 HA1 GLY 35 -13.704 -4.588 3.776 193 H ILE 36 H ILE 36 -11.044 -3.036 2.655 194 HA ILE 36 HA ILE 36 -11.641 -3.050 -0.148 195 HB ILE 36 HB ILE 36 -9.961 -1.464 -0.282 196 HG12 ILE 36 2HG1 ILE 36 -9.443 -2.049 2.641 197 HG13 ILE 36 1HG1 ILE 36 -8.335 -2.481 1.322 198 HG21 ILE 36 1HG2 ILE 36 -12.138 -0.874 0.461 199 HG22 ILE 36 2HG2 ILE 36 -11.730 -0.848 2.171 200 HG23 ILE 36 3HG2 ILE 36 -11.034 0.332 1.120 201 HD11 ILE 36 HD3 ILE 36 -7.278 -0.755 2.413 202 HD12 ILE 36 HD1 ILE 36 -7.607 -0.413 0.710 203 HD13 ILE 36 HD2 ILE 36 -8.618 0.310 2.084 204 H SER 37 H SER 37 -10.428 -3.828 -1.941 205 HA SER 37 HA SER 37 -8.651 -6.020 -1.239 206 HB2 SER 37 HB2 SER 37 -8.936 -6.902 -3.314 207 HB3 SER 37 HB1 SER 37 -10.488 -6.307 -2.870 208 HG SER 37 HG SER 37 -9.705 -5.820 -5.004 209 H GLN 38 H GLN 38 -6.859 -6.558 -2.296 210 HA GLN 38 HA GLN 38 -4.879 -4.643 -2.510 211 HB2 GLN 38 HB2 GLN 38 -4.548 -7.142 -2.371 212 HB3 GLN 38 HB1 GLN 38 -5.026 -7.199 -4.094 213 HG2 GLN 38 HG2 GLN 38 -3.213 -5.808 -4.747 214 HG3 GLN 38 HG1 GLN 38 -2.673 -5.471 -3.113 215 HE21 GLN 38 1HE2 GLN 38 -3.379 -8.041 -5.471 216 HE22 GLN 38 2HE2 GLN 38 -2.008 -9.083 -5.073 217 H GLN 39 H GLN 39 -7.030 -5.655 -5.104 218 HA GLN 39 HA GLN 39 -5.690 -4.193 -7.195 219 HB2 GLN 39 HB2 GLN 39 -7.462 -6.113 -7.539 220 HB3 GLN 39 HB1 GLN 39 -8.593 -4.744 -7.336 221 HG2 GLN 39 HG2 GLN 39 -7.668 -3.580 -9.071 222 HG3 GLN 39 HG1 GLN 39 -6.354 -4.712 -9.236 223 HE21 GLN 39 1HE2 GLN 39 -6.597 -6.516 -10.419 224 HE22 GLN 39 2HE2 GLN 39 -8.086 -7.124 -11.071 225 H GLN 40 H GLN 40 -8.077 -3.261 -4.649 226 HA GLN 40 HA GLN 40 -8.810 -0.807 -5.900 227 HB2 GLN 40 HB2 GLN 40 -9.012 -2.212 -3.234 228 HB3 GLN 40 HB1 GLN 40 -9.726 -0.561 -3.563 229 HG2 GLN 40 HG2 GLN 40 -11.019 -1.454 -5.348 230 HG3 GLN 40 HG1 GLN 40 -10.498 -3.177 -4.924 231 HE21 GLN 40 1HE2 GLN 40 -12.692 -0.533 -4.170 232 HE22 GLN 40 2HE2 GLN 40 -13.382 -1.376 -2.780 233 H LEU 41 H LEU 41 -6.313 -1.800 -3.570 234 HA LEU 41 HA LEU 41 -5.523 0.886 -3.148 235 HB2 LEU 41 HB2 LEU 41 -5.344 -0.856 -1.424 236 HB3 LEU 41 HB1 LEU 41 -4.353 -1.795 -2.481 237 HG LEU 41 HG LEU 41 -3.294 0.935 -1.668 238 HD11 LEU 41 1HD1 LEU 41 -4.320 0.314 0.365 239 HD12 LEU 41 2HD1 LEU 41 -3.709 -1.254 0.387 240 HD13 LEU 41 3HD1 LEU 41 -2.520 0.108 0.476 241 HD21 LEU 41 3HD2 LEU 41 -2.083 -0.843 -3.077 242 HD22 LEU 41 1HD2 LEU 41 -1.173 -0.356 -1.631 243 HD23 LEU 41 2HD2 LEU 41 -1.970 -1.916 -1.812 244 H ALA 42 H ALA 42 -4.680 -1.503 -5.292 245 HA ALA 42 HA ALA 42 -2.370 -0.267 -6.512 246 HB1 ALA 42 HB1 ALA 42 -2.858 -2.722 -6.892 247 HB2 ALA 42 HB2 ALA 42 -4.311 -2.425 -7.673 248 HB3 ALA 42 HB3 ALA 42 -2.890 -1.774 -8.434 249 H GLN 43 H GLN 43 -5.872 0.259 -6.862 250 HA GLN 43 HA GLN 43 -5.481 2.020 -9.232 251 HB2 GLN 43 HB2 GLN 43 -7.856 1.530 -7.414 252 HB3 GLN 43 HB1 GLN 43 -7.890 2.479 -8.796 253 HG2 GLN 43 HG2 GLN 43 -8.086 -0.418 -8.464 254 HG3 GLN 43 HG1 GLN 43 -8.898 0.651 -9.578 255 HE21 GLN 43 1HE2 GLN 43 -6.228 -1.398 -8.950 256 HE22 GLN 43 2HE2 GLN 43 -5.381 -1.343 -10.443 257 H LYS 44 H LYS 44 -5.640 2.445 -5.766 258 HA LYS 44 HA LYS 44 -6.107 5.249 -5.559 259 HB2 LYS 44 HB2 LYS 44 -4.953 3.196 -3.817 260 HB3 LYS 44 HB1 LYS 44 -5.087 4.922 -3.337 261 HG2 LYS 44 HG2 LYS 44 -7.474 4.932 -3.721 262 HG3 LYS 44 HG1 LYS 44 -7.525 3.333 -4.376 263 HD2 LYS 44 HD2 LYS 44 -6.743 2.427 -2.162 264 HD3 LYS 44 HD1 LYS 44 -6.863 4.091 -1.481 265 HE2 LYS 44 HE2 LYS 44 -8.970 3.132 -0.984 266 HE3 LYS 44 HE1 LYS 44 -9.103 4.328 -2.274 267 HZ1 LYS 44 HZ1 LYS 44 -10.032 1.690 -2.358 268 HZ2 LYS 44 HZ2 LYS 44 -9.891 2.693 -3.534 269 HZ3 LYS 44 HZ3 LYS 44 -8.662 1.753 -3.417 270 H LEU 45 H LEU 45 -3.313 3.428 -6.429 271 HA LEU 45 HA LEU 45 -1.648 5.605 -5.971 272 HB2 LEU 45 HB2 LEU 45 -1.125 2.591 -5.724 273 HB3 LEU 45 HB1 LEU 45 0.204 3.688 -5.871 274 HG LEU 45 HG LEU 45 -1.902 3.779 -3.675 275 HD11 LEU 45 1HD1 LEU 45 0.106 2.791 -2.387 276 HD12 LEU 45 2HD1 LEU 45 -1.042 1.718 -3.154 277 HD13 LEU 45 3HD1 LEU 45 0.551 2.120 -3.950 278 HD21 LEU 45 3HD2 LEU 45 -0.849 5.816 -3.852 279 HD22 LEU 45 1HD2 LEU 45 0.011 5.035 -2.432 280 HD23 LEU 45 2HD2 LEU 45 0.782 5.117 -3.987 281 H LYS 46 H LYS 46 -2.945 4.119 -8.358 282 HA LYS 46 HA LYS 46 -2.856 3.538 -10.358 283 HB2 LYS 46 HB2 LYS 46 -0.419 5.256 -10.691 284 HB3 LYS 46 HB1 LYS 46 -1.317 4.455 -11.997 285 HG2 LYS 46 HG2 LYS 46 -3.392 5.481 -11.226 286 HG3 LYS 46 HG1 LYS 46 -2.409 6.357 -10.004 287 HD2 LYS 46 HD2 LYS 46 -1.916 6.562 -13.071 288 HD3 LYS 46 HD1 LYS 46 -3.049 7.640 -12.276 289 HE2 LYS 46 HE2 LYS 46 -1.176 8.524 -10.888 290 HE3 LYS 46 HE1 LYS 46 -0.165 7.121 -11.341 291 HZ1 LYS 46 HZ1 LYS 46 -0.922 9.223 -13.195 292 HZ2 LYS 46 HZ2 LYS 46 0.597 8.902 -12.527 293 HZ3 LYS 46 HZ3 LYS 46 -0.109 7.981 -13.622 294 H VAL 47 H VAL 47 0.121 2.629 -8.798 295 HA VAL 47 HA VAL 47 0.993 1.188 -10.792 296 HB VAL 47 HB VAL 47 2.628 0.243 -8.998 297 HG11 VAL 47 1HG1 VAL 47 3.849 2.177 -8.941 298 HG12 VAL 47 2HG1 VAL 47 2.956 2.198 -10.445 299 HG13 VAL 47 3HG1 VAL 47 2.585 3.339 -9.102 300 HG21 VAL 47 3HG2 VAL 47 1.417 0.345 -7.010 301 HG22 VAL 47 1HG2 VAL 47 2.745 1.529 -6.887 302 HG23 VAL 47 2HG2 VAL 47 1.055 2.116 -7.319 303 H SER 48 H SER 48 1.857 -1.606 -9.706 304 HA SER 48 HA SER 48 -0.790 -2.682 -10.350 305 HB2 SER 48 HB2 SER 48 0.456 -4.598 -11.181 306 HB3 SER 48 HB1 SER 48 1.134 -3.061 -11.948 307 HG SER 48 HG SER 48 2.979 -3.771 -11.116 308 H GLU 49 H GLU 49 -1.319 -4.954 -9.563 309 HA GLU 49 HA GLU 49 -1.454 -5.111 -6.747 310 HB2 GLU 49 HB2 GLU 49 -2.187 -6.896 -9.020 311 HB3 GLU 49 HB1 GLU 49 -2.227 -7.384 -7.366 312 HG2 GLU 49 HG2 GLU 49 -3.703 -5.351 -6.887 313 HG3 GLU 49 HG1 GLU 49 -3.840 -5.250 -8.627 314 H ASN 50 H ASN 50 0.810 -6.359 -9.410 315 HA ASN 50 HA ASN 50 2.233 -8.021 -7.566 316 HB2 ASN 50 HB2 ASN 50 2.089 -8.641 -9.799 317 HB3 ASN 50 HB1 ASN 50 2.638 -7.053 -10.435 318 HD21 ASN 50 1HD2 ASN 50 3.443 -10.092 -8.609 319 HD22 ASN 50 2HD2 ASN 50 5.046 -10.221 -9.188 320 H ILE 51 H ILE 51 2.551 -4.668 -8.451 321 HA ILE 51 HA ILE 51 5.061 -4.357 -7.169 322 HB ILE 51 HB ILE 51 3.001 -2.457 -8.154 323 HG12 ILE 51 2HG1 ILE 51 5.962 -2.565 -8.694 324 HG13 ILE 51 1HG1 ILE 51 4.859 -3.673 -9.453 325 HG21 ILE 51 1HG2 ILE 51 5.423 -1.585 -6.621 326 HG22 ILE 51 2HG2 ILE 51 4.309 -0.635 -7.558 327 HG23 ILE 51 3HG2 ILE 51 3.735 -1.304 -6.006 328 HD11 ILE 51 HD3 ILE 51 3.585 -1.510 -10.359 329 HD12 ILE 51 HD1 ILE 51 5.094 -0.692 -9.827 330 HD13 ILE 51 HD2 ILE 51 5.181 -1.926 -10.962 331 H VAL 52 H VAL 52 1.629 -4.028 -5.754 332 HA VAL 52 HA VAL 52 2.718 -3.296 -3.288 333 HB VAL 52 HB VAL 52 0.300 -3.243 -2.594 334 HG11 VAL 52 1HG1 VAL 52 0.902 -1.897 -5.317 335 HG12 VAL 52 2HG1 VAL 52 -0.142 -1.454 -3.996 336 HG13 VAL 52 3HG1 VAL 52 1.562 -1.275 -3.806 337 HG21 VAL 52 3HG2 VAL 52 -1.422 -3.449 -4.161 338 HG22 VAL 52 1HG2 VAL 52 -0.397 -4.218 -5.319 339 HG23 VAL 52 2HG2 VAL 52 -0.603 -4.949 -3.587 340 H LYS 53 H LYS 53 1.701 -6.484 -4.517 341 HA LYS 53 HA LYS 53 2.323 -7.975 -2.244 342 HB2 LYS 53 HB2 LYS 53 1.443 -8.549 -4.590 343 HB3 LYS 53 HB1 LYS 53 2.993 -8.570 -5.235 344 HG2 LYS 53 HG2 LYS 53 3.705 -10.330 -3.579 345 HG3 LYS 53 HG1 LYS 53 2.307 -10.118 -2.640 346 HD2 LYS 53 HD2 LYS 53 0.740 -10.780 -4.335 347 HD3 LYS 53 HD1 LYS 53 2.037 -11.129 -5.520 348 HE2 LYS 53 HE2 LYS 53 3.035 -12.833 -4.066 349 HE3 LYS 53 HE1 LYS 53 1.892 -12.446 -2.845 350 HZ1 LYS 53 HZ1 LYS 53 0.056 -12.900 -4.100 351 HZ2 LYS 53 HZ2 LYS 53 0.656 -13.286 -5.368 352 HZ3 LYS 53 HZ3 LYS 53 0.959 -14.269 -3.980 353 H ARG 54 H ARG 54 4.420 -6.171 -4.480 354 HA ARG 54 HA ARG 54 6.925 -7.365 -3.610 355 HB2 ARG 54 HB2 ARG 54 6.364 -5.777 -5.797 356 HB3 ARG 54 HB1 ARG 54 7.041 -4.573 -4.675 357 HG2 ARG 54 HG2 ARG 54 8.546 -5.481 -6.303 358 HG3 ARG 54 HG1 ARG 54 9.088 -6.065 -4.668 359 HD2 ARG 54 HD2 ARG 54 7.753 -8.162 -5.322 360 HD3 ARG 54 HD1 ARG 54 7.876 -7.494 -7.036 361 HE ARG 54 HE ARG 54 10.333 -7.327 -6.531 362 HH11 ARG 54 1HH2 ARG 54 8.034 -9.905 -6.708 363 HH12 ARG 54 2HH2 ARG 54 9.120 -11.019 -7.444 364 HH21 ARG 54 1HH1 ARG 54 11.985 -9.123 -6.979 365 HH22 ARG 54 2HH1 ARG 54 11.432 -10.682 -7.193 366 H PHE 55 H PHE 55 5.079 -4.410 -2.704 367 HA PHE 55 HA PHE 55 7.002 -3.549 -0.860 368 HB2 PHE 55 HB2 PHE 55 4.008 -3.471 -0.866 369 HB3 PHE 55 HB1 PHE 55 4.931 -2.400 0.208 370 HD1 PHE 55 HD2 PHE 55 6.835 -2.329 -2.803 371 HD2 PHE 55 HD1 PHE 55 3.244 -0.710 -0.907 372 HE1 PHE 55 HE2 PHE 55 6.801 -0.496 -4.367 373 HE2 PHE 55 HE1 PHE 55 3.107 0.927 -2.740 374 HZ PHE 55 HZ PHE 55 5.016 1.072 -4.406 375 H GLU 56 H GLU 56 3.979 -5.531 -0.483 376 HA GLU 56 HA GLU 56 4.148 -5.909 2.153 377 HB2 GLU 56 HB2 GLU 56 3.054 -7.937 0.188 378 HB3 GLU 56 HB1 GLU 56 2.857 -7.893 1.841 379 HG2 GLU 56 HG2 GLU 56 2.195 -5.275 0.762 380 HG3 GLU 56 HG1 GLU 56 1.277 -6.461 -0.221 381 H SER 57 H SER 57 6.226 -7.625 -0.143 382 HA SER 57 HA SER 57 6.962 -9.610 1.884 383 HB2 SER 57 HB2 SER 57 8.069 -10.526 -0.204 384 HB3 SER 57 HB1 SER 57 6.255 -10.330 -0.306 385 HG SER 57 HG SER 57 6.988 -9.357 -2.129 386 H GLY 58 H GLY 58 7.873 -6.671 1.014 387 HA2 GLY 58 HA2 GLY 58 9.545 -5.276 1.180 388 HA3 GLY 58 HA1 GLY 58 10.367 -6.476 2.233 389 H LYS 59 H LYS 59 9.799 -6.938 -1.198 390 HA LYS 59 HA LYS 59 12.484 -7.663 -1.655 391 HB2 LYS 59 HB2 LYS 59 10.058 -8.036 -3.429 392 HB3 LYS 59 HB1 LYS 59 11.681 -8.443 -3.842 393 HG2 LYS 59 HG2 LYS 59 11.982 -9.730 -1.694 394 HG3 LYS 59 HG1 LYS 59 10.230 -9.478 -1.323 395 HD2 LYS 59 HD2 LYS 59 9.743 -10.520 -3.510 396 HD3 LYS 59 HD1 LYS 59 11.448 -11.033 -3.630 397 HE2 LYS 59 HE2 LYS 59 11.333 -11.818 -1.193 398 HE3 LYS 59 HE1 LYS 59 9.694 -11.557 -1.178 399 HZ1 LYS 59 HZ1 LYS 59 10.429 -13.778 -1.758 400 HZ2 LYS 59 HZ2 LYS 59 9.371 -13.244 -2.905 401 HZ3 LYS 59 HZ3 LYS 59 10.902 -13.270 -3.297 402 H LEU 60 H LEU 60 11.186 -4.863 -1.649 403 HA LEU 60 HA LEU 60 12.553 -3.602 -3.974 404 HB2 LEU 60 HB2 LEU 60 10.012 -3.722 -4.307 405 HB3 LEU 60 HB1 LEU 60 9.734 -3.218 -2.759 406 HG LEU 60 HG LEU 60 11.111 -1.243 -4.529 407 HD11 LEU 60 1HD1 LEU 60 9.085 -0.564 -5.572 408 HD12 LEU 60 2HD1 LEU 60 9.634 -2.281 -5.977 409 HD13 LEU 60 3HD1 LEU 60 8.351 -2.076 -4.779 410 HD21 LEU 60 3HD2 LEU 60 10.355 -0.866 -2.009 411 HD22 LEU 60 1HD2 LEU 60 9.736 0.282 -3.231 412 HD23 LEU 60 2HD2 LEU 60 8.725 -1.012 -2.650 413 H LYS 61 H LYS 61 13.470 -1.507 -3.736 414 HA LYS 61 HA LYS 61 14.252 -0.836 -1.024 415 HB2 LYS 61 HB2 LYS 61 15.657 -0.778 -3.116 416 HB3 LYS 61 HB1 LYS 61 14.696 0.568 -3.628 417 HG2 LYS 61 HG2 LYS 61 15.326 1.980 -1.765 418 HG3 LYS 61 HG1 LYS 61 16.008 0.664 -0.933 419 HD2 LYS 61 HD2 LYS 61 17.698 0.303 -2.807 420 HD3 LYS 61 HD1 LYS 61 17.092 1.929 -3.311 421 HE2 LYS 61 HE2 LYS 61 17.690 2.859 -1.080 422 HE3 LYS 61 HE1 LYS 61 18.538 1.370 -0.739 423 HZ1 LYS 61 HZ1 LYS 61 19.788 1.936 -2.853 424 HZ2 LYS 61 HZ2 LYS 61 19.002 3.423 -2.863 425 HZ3 LYS 61 HZ3 LYS 61 19.943 3.079 -1.687 426 HA PRO 62 HA PRO 62 10.527 1.699 -0.749 427 HB2 PRO 62 HB1 PRO 62 10.797 2.712 1.708 428 HB3 PRO 62 HB2 PRO 62 10.600 0.884 1.419 429 HG2 PRO 62 HG1 PRO 62 13.220 2.419 1.953 430 HG3 PRO 62 HG2 PRO 62 12.599 0.907 2.664 431 HD2 PRO 62 HD1 PRO 62 14.375 1.099 0.510 432 HD3 PRO 62 HD2 PRO 62 13.150 -0.254 0.888 433 H THR 63 H THR 63 9.878 4.050 -0.968 434 HA THR 63 HA THR 63 12.171 5.938 -0.763 435 HB THR 63 HB THR 63 11.337 7.094 -2.529 436 HG1 THR 63 HG1 THR 63 9.430 6.058 -3.575 437 HG21 THR 63 1HG2 THR 63 10.743 4.241 -3.597 438 HG22 THR 63 2HG2 THR 63 11.448 5.680 -4.407 439 HG23 THR 63 3HG2 THR 63 12.347 4.631 -3.269 440 H ILE 64 H ILE 64 11.548 8.170 -0.194 441 HA ILE 64 HA ILE 64 9.579 8.336 1.769 442 HB ILE 64 HB ILE 64 9.800 10.793 1.647 443 HG12 ILE 64 2HG1 ILE 64 12.028 10.149 -0.299 444 HG13 ILE 64 1HG1 ILE 64 10.516 10.853 -0.924 445 HG21 ILE 64 1HG2 ILE 64 11.945 10.916 2.616 446 HG22 ILE 64 2HG2 ILE 64 11.226 9.380 3.142 447 HG23 ILE 64 3HG2 ILE 64 12.516 9.525 1.889 448 HD11 ILE 64 HD3 ILE 64 12.711 12.071 0.643 449 HD12 ILE 64 HD1 ILE 64 11.967 12.632 -0.840 450 HD13 ILE 64 HD2 ILE 64 11.108 12.819 0.725 451 H SER 65 H SER 65 9.230 9.678 -1.569 452 HA SER 65 HA SER 65 6.588 10.369 -1.247 453 HB2 SER 65 HB2 SER 65 6.316 9.966 -3.581 454 HB3 SER 65 HB1 SER 65 7.877 10.837 -3.162 455 HG SER 65 HG SER 65 8.953 9.156 -3.790 456 H GLN 66 H GLN 66 7.755 6.995 -1.243 457 HA GLN 66 HA GLN 66 5.153 6.004 -1.857 458 HB2 GLN 66 HB2 GLN 66 7.882 4.894 -1.105 459 HB3 GLN 66 HB1 GLN 66 6.408 3.886 -0.912 460 HG2 GLN 66 HG2 GLN 66 5.908 4.178 -3.340 461 HG3 GLN 66 HG1 GLN 66 7.274 5.182 -3.510 462 HE21 GLN 66 1HE2 GLN 66 8.035 3.694 -5.142 463 HE22 GLN 66 2HE2 GLN 66 8.794 2.207 -4.661 464 H ALA 67 H ALA 67 6.821 5.298 1.187 465 HA ALA 67 HA ALA 67 5.088 5.339 3.218 466 HB1 ALA 67 HB1 ALA 67 6.666 6.564 4.394 467 HB2 ALA 67 HB2 ALA 67 7.510 5.410 3.351 468 HB3 ALA 67 HB3 ALA 67 7.491 7.157 2.920 469 H ARG 68 H ARG 68 5.852 8.490 2.011 470 HA ARG 68 HA ARG 68 3.820 10.006 3.291 471 HB2 ARG 68 HB2 ARG 68 5.105 10.608 0.574 472 HB3 ARG 68 HB1 ARG 68 4.089 11.662 1.411 473 HG2 ARG 68 HG2 ARG 68 5.453 11.907 3.338 474 HG3 ARG 68 HG1 ARG 68 6.656 10.812 2.626 475 HD2 ARG 68 HD2 ARG 68 6.752 12.327 0.574 476 HD3 ARG 68 HD1 ARG 68 5.894 13.462 1.598 477 HE ARG 68 HE ARG 68 8.008 12.752 3.183 478 HH11 ARG 68 1HH2 ARG 68 7.953 13.410 -0.221 479 HH12 ARG 68 2HH2 ARG 68 9.185 14.657 -0.269 480 HH21 ARG 68 1HH1 ARG 68 9.795 14.067 3.289 481 HH22 ARG 68 2HH1 ARG 68 10.433 14.834 1.848 482 H GLN 69 H GLN 69 3.415 8.282 0.067 483 HA GLN 69 HA GLN 69 0.634 9.146 -0.240 484 HB2 GLN 69 HB2 GLN 69 2.354 6.944 -1.420 485 HB3 GLN 69 HB1 GLN 69 0.562 7.057 -1.596 486 HG2 GLN 69 HG2 GLN 69 0.772 9.167 -2.808 487 HG3 GLN 69 HG1 GLN 69 2.401 9.332 -2.413 488 HE21 GLN 69 1HE2 GLN 69 4.175 8.109 -3.273 489 HE22 GLN 69 2HE2 GLN 69 3.963 7.409 -4.792 490 H LEU 70 H LEU 70 2.346 6.218 1.191 491 HA LEU 70 HA LEU 70 -0.077 4.921 1.331 492 HB2 LEU 70 HB2 LEU 70 2.418 4.695 3.009 493 HB3 LEU 70 HB1 LEU 70 1.135 3.410 3.026 494 HG LEU 70 HG LEU 70 2.493 4.049 0.453 495 HD11 LEU 70 1HD1 LEU 70 4.049 3.296 2.392 496 HD12 LEU 70 2HD1 LEU 70 3.012 1.847 2.329 497 HD13 LEU 70 3HD1 LEU 70 4.109 2.285 0.940 498 HD21 LEU 70 3HD2 LEU 70 0.377 3.094 0.167 499 HD22 LEU 70 1HD2 LEU 70 1.703 1.939 -0.106 500 HD23 LEU 70 2HD2 LEU 70 0.660 1.837 1.384 501 H GLU 71 H GLU 71 1.347 7.087 3.892 502 HA GLU 71 HA GLU 71 -0.584 6.730 5.958 503 HB2 GLU 71 HB2 GLU 71 1.477 8.631 4.828 504 HB3 GLU 71 HB1 GLU 71 0.349 9.193 6.111 505 HG2 GLU 71 HG2 GLU 71 1.080 7.248 7.542 506 HG3 GLU 71 HG1 GLU 71 2.168 6.776 6.192 507 H LYS 72 H LYS 72 -0.751 8.449 2.846 508 HA LYS 72 HA LYS 72 -2.946 10.061 3.727 509 HB2 LYS 72 HB2 LYS 72 -1.129 9.893 1.402 510 HB3 LYS 72 HB1 LYS 72 -2.741 10.741 1.351 511 HG2 LYS 72 HG2 LYS 72 -2.027 12.175 3.254 512 HG3 LYS 72 HG1 LYS 72 -0.580 11.160 3.423 513 HD2 LYS 72 HD2 LYS 72 -0.253 11.854 0.829 514 HD3 LYS 72 HD1 LYS 72 -1.334 13.082 1.345 515 HE2 LYS 72 HE2 LYS 72 0.754 14.130 1.728 516 HE3 LYS 72 HE1 LYS 72 0.205 13.501 3.359 517 HZ1 LYS 72 HZ1 LYS 72 2.136 12.218 1.523 518 HZ2 LYS 72 HZ2 LYS 72 2.489 13.071 2.914 519 HZ3 LYS 72 HZ3 LYS 72 1.661 11.646 2.932 520 H ILE 73 H ILE 73 -2.527 7.526 1.210 521 HA ILE 73 HA ILE 73 -4.851 7.754 -0.161 522 HB ILE 73 HB ILE 73 -4.595 5.211 -0.642 523 HG12 ILE 73 2HG1 ILE 73 -2.203 5.322 1.136 524 HG13 ILE 73 1HG1 ILE 73 -3.706 4.541 1.464 525 HG21 ILE 73 1HG2 ILE 73 -2.446 5.709 -1.780 526 HG22 ILE 73 2HG2 ILE 73 -3.732 6.819 -2.250 527 HG23 ILE 73 3HG2 ILE 73 -2.449 7.331 -1.139 528 HD11 ILE 73 HD3 ILE 73 -2.119 3.010 0.727 529 HD12 ILE 73 HD1 ILE 73 -3.523 3.073 -0.327 530 HD13 ILE 73 HD2 ILE 73 -1.983 3.879 -0.840 531 H LEU 74 H LEU 74 -4.916 5.626 2.866 532 HA LEU 74 HA LEU 74 -7.382 4.836 2.047 533 HB2 LEU 74 HB2 LEU 74 -6.076 4.471 4.761 534 HB3 LEU 74 HB1 LEU 74 -7.364 3.689 4.156 535 HG LEU 74 HG LEU 74 -4.405 3.596 3.304 536 HD11 LEU 74 1HD1 LEU 74 -5.147 2.167 5.230 537 HD12 LEU 74 2HD1 LEU 74 -6.310 1.426 4.052 538 HD13 LEU 74 3HD1 LEU 74 -4.537 1.314 3.796 539 HD21 LEU 74 3HD2 LEU 74 -5.665 3.464 1.114 540 HD22 LEU 74 1HD2 LEU 74 -4.924 2.040 1.411 541 HD23 LEU 74 2HD2 LEU 74 -6.747 2.253 1.782 542 H GLY 75 H GLY 75 -6.550 7.760 3.102 543 HA2 GLY 75 HA2 GLY 75 -7.615 9.564 4.076 544 HA3 GLY 75 HA1 GLY 75 -9.028 8.591 4.476 545 H ILE 76 H ILE 76 -6.647 6.684 5.731 546 HA ILE 76 HA ILE 76 -6.432 8.060 8.200 547 HB ILE 76 HB ILE 76 -7.021 5.846 9.247 548 HG12 ILE 76 2HG1 ILE 76 -8.529 5.224 6.680 549 HG13 ILE 76 1HG1 ILE 76 -6.921 4.501 7.180 550 HG21 ILE 76 1HG2 ILE 76 -9.478 6.390 9.437 551 HG22 ILE 76 2HG2 ILE 76 -8.550 7.872 9.216 552 HG23 ILE 76 3HG2 ILE 76 -9.422 7.137 7.913 553 HD11 ILE 76 HD3 ILE 76 -8.209 3.557 9.172 554 HD12 ILE 76 HD1 ILE 76 -9.717 4.250 8.501 555 HD13 ILE 76 HD2 ILE 76 -8.845 3.104 7.648 556 H LYS 77 H LYS 77 -4.942 6.369 9.824 557 HA LYS 77 HA LYS 77 -3.038 4.661 8.851 558 HB2 LYS 77 HB2 LYS 77 -1.190 5.929 8.488 559 HB3 LYS 77 HB1 LYS 77 -2.432 6.715 7.480 560 HG2 LYS 77 HG2 LYS 77 -1.330 7.627 10.090 561 HG3 LYS 77 HG1 LYS 77 -0.931 8.328 8.441 562 HD2 LYS 77 HD2 LYS 77 -3.085 8.938 8.138 563 HD3 LYS 77 HD1 LYS 77 -3.533 8.668 9.901 564 HE2 LYS 77 HE2 LYS 77 -1.204 10.260 9.158 565 HE3 LYS 77 HE1 LYS 77 -2.622 11.171 8.984 566 HZ1 LYS 77 HZ1 LYS 77 -1.896 9.783 11.454 567 HZ2 LYS 77 HZ2 LYS 77 -1.556 11.290 11.268 568 HZ3 LYS 77 HZ3 LYS 77 -3.142 10.877 11.370 569 H LEU 78 H LEU 78 -1.621 4.263 10.594 570 HA LEU 78 HA LEU 78 -1.887 5.890 13.081 571 HB2 LEU 78 HB2 LEU 78 -2.355 2.843 12.765 572 HB3 LEU 78 HB1 LEU 78 -1.917 3.448 14.287 573 HG LEU 78 HG LEU 78 -4.536 4.140 12.833 574 HD11 LEU 78 1HD1 LEU 78 -4.605 2.000 13.788 575 HD12 LEU 78 2HD1 LEU 78 -3.985 2.607 15.368 576 HD13 LEU 78 3HD1 LEU 78 -5.586 3.041 14.699 577 HD21 LEU 78 3HD2 LEU 78 -5.191 5.292 14.878 578 HD22 LEU 78 1HD2 LEU 78 -3.561 5.011 15.501 579 HD23 LEU 78 2HD2 LEU 78 -3.853 6.174 14.114 580 H VAL 79 H VAL 79 1.289 4.976 14.168 581 HA VAL 79 HA VAL 79 -1.389 5.269 15.247 582 HB VAL 79 HB VAL 79 0.098 5.342 17.394 583 HG11 VAL 79 1HG1 VAL 79 -0.069 2.723 16.105 584 HG12 VAL 79 2HG1 VAL 79 -0.367 3.189 17.808 585 HG13 VAL 79 3HG1 VAL 79 -1.566 3.635 16.591 586 HG21 VAL 79 3HG2 VAL 79 2.256 3.895 15.837 587 HG22 VAL 79 1HG2 VAL 79 2.328 5.508 16.293 588 HG23 VAL 79 2HG2 VAL 79 2.081 4.297 17.569 589 H THR 80 H THR 80 -1.806 6.701 17.029 590 HA THR 80 HA THR 80 -1.193 9.651 16.596 591 HB THR 80 HB THR 80 -3.213 9.843 17.842 592 HG1 THR 80 HG1 THR 80 -4.325 8.129 18.292 593 HG21 THR 80 1HG2 THR 80 -3.597 7.742 15.701 594 HG22 THR 80 2HG2 THR 80 -4.671 9.091 16.170 595 HG23 THR 80 3HG2 THR 80 -3.173 9.430 15.336 596 HA PRO 81 HA PRO 81 0.793 10.036 20.538 597 HB2 PRO 81 HB1 PRO 81 -1.514 12.183 20.840 598 HB3 PRO 81 HB2 PRO 81 0.079 12.320 21.497 599 HG2 PRO 81 HG1 PRO 81 -0.540 13.372 18.976 600 HG3 PRO 81 HG2 PRO 81 1.017 12.471 19.115 601 HD2 PRO 81 HD1 PRO 81 -1.728 11.515 18.048 602 HD3 PRO 81 HD2 PRO 81 -0.076 11.324 17.415 603 H LEU 82 H LEU 82 -2.253 8.657 20.248 604 HA LEU 82 HA LEU 82 -2.702 8.328 22.964 605 HB2 LEU 82 HB2 LEU 82 -4.202 7.830 21.087 606 HB3 LEU 82 HB1 LEU 82 -3.115 6.696 20.413 607 HG LEU 82 HG LEU 82 -3.478 5.173 22.542 608 HD11 LEU 82 1HD1 LEU 82 -5.580 7.193 23.268 609 HD12 LEU 82 2HD1 LEU 82 -5.316 5.606 23.934 610 HD13 LEU 82 3HD1 LEU 82 -4.012 6.814 24.108 611 HD21 LEU 82 3HD2 LEU 82 -5.827 4.539 21.828 612 HD22 LEU 82 1HD2 LEU 82 -5.793 6.045 20.816 613 HD23 LEU 82 2HD2 LEU 82 -4.695 4.616 20.522 614 H GLU 83 H GLU 83 -0.384 6.776 20.591 615 HA GLU 83 HA GLU 83 1.241 6.320 23.019 616 HB2 GLU 83 HB2 GLU 83 1.846 4.175 22.312 617 HB3 GLU 83 HB1 GLU 83 0.053 4.290 22.361 618 HG2 GLU 83 HG2 GLU 83 -0.176 4.289 20.057 619 HG3 GLU 83 HG1 GLU 83 1.617 4.561 19.781 620 H ASN 84 H ASN 84 1.259 8.163 20.239 621 HA ASN 84 HA ASN 84 4.076 8.303 20.014 622 HB2 ASN 84 HB2 ASN 84 3.672 6.013 18.949 623 HB3 ASN 84 HB1 ASN 84 2.583 6.926 17.826 624 HD21 ASN 84 1HD2 ASN 84 5.752 6.828 19.160 625 HD22 ASN 84 2HD2 ASN 84 6.598 7.342 17.693 626 H ASN 85 H ASN 85 4.762 9.984 18.899 627 HA ASN 85 HA ASN 85 2.943 11.751 17.329 628 HB2 ASN 85 HB2 ASN 85 3.357 12.211 19.885 629 HB3 ASN 85 HB1 ASN 85 5.041 12.582 19.310 630 HD21 ASN 85 1HD2 ASN 85 3.394 14.536 20.683 631 HD22 ASN 85 2HD2 ASN 85 2.839 15.703 19.492 632 H GLU 86 H GLU 86 4.361 13.314 16.328 633 HA GLU 86 HA GLU 86 6.929 12.382 15.427 634 HB2 GLU 86 HB2 GLU 86 5.167 11.085 14.074 635 HB3 GLU 86 HB1 GLU 86 4.656 12.575 13.464 636 HG2 GLU 86 HG2 GLU 86 6.246 11.311 11.971 637 HG3 GLU 86 HG1 GLU 86 6.591 13.022 12.271 638 H GLU 87 H GLU 87 7.856 14.064 14.069 639 HA GLU 87 HA GLU 87 7.126 16.719 14.494 640 HB2 GLU 87 HB2 GLU 87 9.351 15.919 13.828 641 HB3 GLU 87 HB1 GLU 87 8.902 15.549 12.230 642 HG2 GLU 87 HG2 GLU 87 10.095 17.524 12.371 643 HG3 GLU 87 HG1 GLU 87 8.503 17.885 11.641 644 H SER 88 H SER 88 5.781 18.073 13.501 645 HA SER 88 HA SER 88 3.429 17.013 12.017 646 HB2 SER 88 HB2 SER 88 4.244 19.779 12.884 647 HB3 SER 88 HB1 SER 88 2.541 19.191 12.454 648 HG SER 88 HG SER 88 4.138 18.973 14.742 649 H GLU 89 H GLU 89 6.291 18.812 10.974 650 HA GLU 89 HA GLU 89 5.107 19.446 8.448 651 HB2 GLU 89 HB2 GLU 89 8.018 19.492 9.195 652 HB3 GLU 89 HB1 GLU 89 7.401 20.149 7.731 653 HG2 GLU 89 HG2 GLU 89 6.213 21.852 8.628 654 HG3 GLU 89 HG1 GLU 89 6.007 21.105 10.160 655 H LYS 90 H LYS 90 6.251 16.463 9.618 656 HA LYS 90 HA LYS 90 7.115 15.597 7.070 657 HB2 LYS 90 HB2 LYS 90 5.988 13.940 9.327 658 HB3 LYS 90 HB1 LYS 90 6.788 13.269 7.928 659 HG2 LYS 90 HG2 LYS 90 8.841 14.142 8.120 660 HG3 LYS 90 HG1 LYS 90 8.374 15.273 9.436 661 HD2 LYS 90 HD2 LYS 90 8.322 13.377 10.993 662 HD3 LYS 90 HD1 LYS 90 8.275 12.263 9.689 663 HE2 LYS 90 HE2 LYS 90 10.470 12.787 8.928 664 HE3 LYS 90 HE1 LYS 90 10.600 14.129 10.285 665 HZ1 LYS 90 HZ1 LYS 90 10.320 11.309 10.636 666 HZ2 LYS 90 HZ2 LYS 90 11.674 11.965 11.003 667 HZ3 LYS 90 HZ3 LYS 90 10.388 12.480 11.868 668 H GLU 91 H GLU 91 3.947 16.156 8.270 669 HA GLU 91 HA GLU 91 2.400 14.219 7.192 670 HB2 GLU 91 HB2 GLU 91 1.965 15.603 8.940 671 HB3 GLU 91 HB1 GLU 91 1.706 17.111 7.897 672 HG2 GLU 91 HG2 GLU 91 -0.120 16.517 6.856 673 HG3 GLU 91 HG1 GLU 91 -0.031 14.850 7.390 674 H PHE 92 H PHE 92 3.563 17.137 5.524 675 HA PHE 92 HA PHE 92 1.619 17.239 3.491 676 HB2 PHE 92 HB2 PHE 92 4.424 18.290 3.787 677 HB3 PHE 92 HB1 PHE 92 3.187 18.842 2.544 678 HD1 PHE 92 HD2 PHE 92 1.244 19.947 3.140 679 HD2 PHE 92 HD1 PHE 92 4.209 18.999 6.023 680 HE1 PHE 92 HE2 PHE 92 0.432 21.916 4.648 681 HE2 PHE 92 HE1 PHE 92 3.303 20.814 7.605 682 HZ PHE 92 HZ PHE 92 1.430 22.102 6.844 683 H ASP 93 H ASP 93 2.389 17.245 1.063 684 HA ASP 93 HA ASP 93 3.305 14.636 0.240 685 HB2 ASP 93 HB2 ASP 93 1.599 15.594 -0.911 686 HB3 ASP 93 HB1 ASP 93 2.490 17.210 -1.168 687 H ASP 94 H ASP 94 5.065 17.764 0.358 688 HA ASP 94 HA ASP 94 7.455 16.000 -0.056 689 HB2 ASP 94 HB2 ASP 94 6.950 16.881 -2.205 690 HB3 ASP 94 HB1 ASP 94 7.115 18.481 -1.631 691 H THR 95 H THR 95 6.290 19.147 0.805 692 HA THR 95 HA THR 95 8.294 19.587 2.999 693 HB THR 95 HB THR 95 8.423 21.970 1.936 694 HG1 THR 95 HG1 THR 95 8.124 21.652 -0.491 695 HG21 THR 95 1HG2 THR 95 10.229 20.119 1.731 696 HG22 THR 95 2HG2 THR 95 9.536 19.812 0.112 697 HG23 THR 95 3HG2 THR 95 10.211 21.316 0.385 698 H GLY 96 H GLY 96 7.809 21.228 4.392 699 HA2 GLY 96 HA2 GLY 96 5.034 21.226 5.005 700 HA3 GLY 96 HA1 GLY 96 6.247 21.943 5.964 701 H LEU 97 H LEU 97 3.832 23.070 5.336 702 HA LEU 97 HA LEU 97 3.863 24.659 3.022 703 HB2 LEU 97 HB2 LEU 97 1.955 23.475 3.571 704 HB3 LEU 97 HB1 LEU 97 1.799 24.292 5.171 705 HG LEU 97 HG LEU 97 1.036 26.310 4.177 706 HD11 LEU 97 1HD1 LEU 97 2.202 25.823 1.846 707 HD12 LEU 97 2HD1 LEU 97 0.898 24.714 1.732 708 HD13 LEU 97 3HD1 LEU 97 0.467 26.515 1.803 709 HD21 LEU 97 3HD2 LEU 97 -0.554 24.776 4.879 710 HD22 LEU 97 1HD2 LEU 97 -1.031 25.536 3.316 711 HD23 LEU 97 2HD2 LEU 97 -0.383 23.833 3.373 712 H THR 98 H THR 98 4.192 25.462 6.259 713 HA THR 98 HA THR 98 4.202 28.434 5.901 714 HB THR 98 HB THR 98 3.425 26.520 8.129 715 HG1 THR 98 HG1 THR 98 1.516 27.664 7.674 716 HG21 THR 98 1HG2 THR 98 4.397 28.492 9.393 717 HG22 THR 98 2HG2 THR 98 3.644 29.588 8.129 718 HG23 THR 98 3HG2 THR 98 2.743 28.659 9.349 719 H LEU 99 H LEU 99 5.776 29.730 6.657 720 HA LEU 99 HA LEU 99 8.240 28.495 7.672 721 HB2 LEU 99 HB2 LEU 99 8.439 30.125 5.886 722 HB3 LEU 99 HB1 LEU 99 7.328 31.241 6.670 723 HG LEU 99 HG LEU 99 8.775 31.626 8.476 724 HD11 LEU 99 1HD1 LEU 99 11.330 31.055 8.132 725 HD12 LEU 99 2HD1 LEU 99 10.330 29.615 8.172 726 HD13 LEU 99 3HD1 LEU 99 10.730 30.268 6.618 727 HD21 LEU 99 3HD2 LEU 99 9.710 32.567 5.790 728 HD22 LEU 99 1HD2 LEU 99 8.433 33.268 6.922 729 HD23 LEU 99 2HD2 LEU 99 10.135 33.297 7.360 730 H GLY 100 H GLY 100 8.870 28.671 9.714 731 HA2 GLY 100 HA2 GLY 100 6.905 29.869 11.575 732 HA3 GLY 100 HA1 GLY 100 8.198 28.729 12.085 733 H ASP 101 H ASP 101 9.948 30.696 10.252 734 HA ASP 101 HA ASP 101 10.740 31.582 12.734 735 HB2 ASP 101 HB2 ASP 101 12.023 30.290 10.794 736 HB3 ASP 101 HB1 ASP 101 12.464 31.896 10.185 737 H VAL 102 H VAL 102 8.957 33.168 11.943 738 HA VAL 102 HA VAL 102 10.024 35.831 11.520 739 HB VAL 102 HB VAL 102 7.478 35.796 10.575 740 HG11 VAL 102 1HG1 VAL 102 9.682 36.312 9.393 741 HG12 VAL 102 2HG1 VAL 102 9.690 34.541 9.050 742 HG13 VAL 102 3HG1 VAL 102 8.524 35.531 8.323 743 HG21 VAL 102 3HG2 VAL 102 6.828 33.694 11.101 744 HG22 VAL 102 1HG2 VAL 102 6.694 34.092 9.430 745 HG23 VAL 102 2HG2 VAL 102 8.011 32.952 9.935 746 H VAL 103 H VAL 103 7.238 37.152 13.937 747 HA VAL 103 HA VAL 103 8.492 37.679 11.138 748 HB VAL 103 HB VAL 103 7.530 39.829 11.460 749 HG11 VAL 103 1HG1 VAL 103 6.354 38.018 10.149 750 HG12 VAL 103 2HG1 VAL 103 5.731 37.367 11.652 751 HG13 VAL 103 3HG1 VAL 103 5.066 38.901 11.008 752 HG21 VAL 103 3HG2 VAL 103 5.843 40.385 12.789 753 HG22 VAL 103 1HG2 VAL 103 5.803 38.803 13.712 754 HG23 VAL 103 2HG2 VAL 103 7.127 39.960 13.885 755 H ASN 104 H ASN 104 9.761 37.452 14.228 756 HA ASN 104 HA ASN 104 11.386 39.838 14.339 757 HB2 ASN 104 HB2 ASN 104 10.999 38.248 16.119 758 HB3 ASN 104 HB1 ASN 104 11.633 36.882 15.224 759 HD21 ASN 104 1HD2 ASN 104 12.234 39.803 17.186 760 HD22 ASN 104 2HD2 ASN 104 14.029 39.674 17.026 761 H ILE 105 H ILE 105 12.487 40.715 13.086 762 HA ILE 105 HA ILE 105 14.172 39.283 11.110 763 HB ILE 105 HB ILE 105 13.572 42.196 11.239 764 HG12 ILE 105 2HG1 ILE 105 12.713 40.147 9.139 765 HG13 ILE 105 1HG1 ILE 105 11.750 40.623 10.570 766 HG21 ILE 105 1HG2 ILE 105 15.089 40.525 9.239 767 HG22 ILE 105 2HG2 ILE 105 14.590 42.215 8.896 768 HG23 ILE 105 3HG2 ILE 105 15.785 41.810 10.190 769 HD11 ILE 105 HD3 ILE 105 12.603 42.506 8.297 770 HD12 ILE 105 HD1 ILE 105 11.133 41.882 8.550 771 HD13 ILE 105 HD2 ILE 105 11.761 42.988 9.827 772 H LYS 106 H LYS 106 16.287 39.133 11.061 773 HA LYS 106 HA LYS 106 17.562 39.564 13.602 774 HB2 LYS 106 HB2 LYS 106 18.364 38.158 11.118 775 HB3 LYS 106 HB1 LYS 106 19.141 37.906 12.622 776 HG2 LYS 106 HG2 LYS 106 16.406 36.910 11.710 777 HG3 LYS 106 HG1 LYS 106 17.729 35.992 12.108 778 HD2 LYS 106 HD2 LYS 106 17.670 36.817 14.487 779 HD3 LYS 106 HD1 LYS 106 16.222 37.779 14.097 780 HE2 LYS 106 HE2 LYS 106 16.418 34.740 14.296 781 HE3 LYS 106 HE1 LYS 106 15.628 35.818 15.318 782 HZ1 LYS 106 HZ1 LYS 106 14.769 35.271 12.562 783 HZ2 LYS 106 HZ2 LYS 106 14.011 35.047 13.987 784 HZ3 LYS 106 HZ3 LYS 106 14.336 36.578 13.277 785 H GLU 107 H GLU 107 17.614 40.753 10.254 786 HA GLU 107 HA GLU 107 19.954 42.439 10.379 787 HB2 GLU 107 HB2 GLU 107 18.897 41.583 8.297 788 HB3 GLU 107 HB1 GLU 107 17.355 42.047 8.865 789 HG2 GLU 107 HG2 GLU 107 17.871 44.453 8.340 790 HG3 GLU 107 HG1 GLU 107 19.547 43.975 8.012 791 H GLY 108 H GLY 108 17.023 42.174 12.141 792 HA2 GLY 108 HA2 GLY 108 15.816 44.634 11.884 793 HA3 GLY 108 HA1 GLY 108 15.782 43.451 13.211 794 H LYS 109 H LYS 109 18.776 44.283 13.449 795 HA LYS 109 HA LYS 109 18.344 46.702 15.136 796 HB2 LYS 109 HB2 LYS 109 20.085 44.269 15.821 797 HB3 LYS 109 HB1 LYS 109 19.870 45.805 16.781 798 HG2 LYS 109 HG2 LYS 109 17.737 45.459 17.328 799 HG3 LYS 109 HG1 LYS 109 17.663 43.888 16.485 800 HD2 LYS 109 HD2 LYS 109 19.556 43.078 17.853 801 HD3 LYS 109 HD1 LYS 109 19.680 44.611 18.646 802 HE2 LYS 109 HE2 LYS 109 17.200 42.879 18.577 803 HE3 LYS 109 HE1 LYS 109 18.459 42.757 19.872 804 HZ1 LYS 109 HZ1 LYS 109 16.507 44.224 20.586 805 HZ2 LYS 109 HZ2 LYS 109 17.942 44.945 20.607 806 HZ3 LYS 109 HZ3 LYS 109 16.896 45.137 19.305 807 H LYS 110 H LYS 110 19.536 46.038 12.313 808 HA LYS 110 HA LYS 110 22.197 46.783 12.431 809 HB2 LYS 110 HB2 LYS 110 21.219 45.311 10.782 810 HB3 LYS 110 HB1 LYS 110 20.212 46.724 10.151 811 HG2 LYS 110 HG2 LYS 110 22.063 47.770 9.134 812 HG3 LYS 110 HG1 LYS 110 23.107 47.097 10.382 813 HD2 LYS 110 HD2 LYS 110 23.300 45.017 9.293 814 HD3 LYS 110 HD1 LYS 110 21.847 45.280 8.254 815 HE2 LYS 110 HE2 LYS 110 22.925 47.068 7.121 816 HE3 LYS 110 HE1 LYS 110 24.474 46.775 7.942 817 HZ1 LYS 110 HZ1 LYS 110 24.704 45.415 6.067 818 HZ2 LYS 110 HZ2 LYS 110 23.897 44.385 7.135 819 HZ3 LYS 110 HZ3 LYS 110 23.131 45.062 5.944 820 H LEU 111 H LEU 111 22.450 48.684 13.546 821 HA LEU 111 HA LEU 111 22.386 51.213 12.541 822 HB2 LEU 111 HB2 LEU 111 20.520 52.236 13.914 823 HB3 LEU 111 HB1 LEU 111 20.093 51.360 12.514 824 HG LEU 111 HG LEU 111 19.314 49.512 13.913 825 HD11 LEU 111 1HD1 LEU 111 18.928 50.415 16.410 826 HD12 LEU 111 2HD1 LEU 111 20.478 49.558 16.180 827 HD13 LEU 111 3HD1 LEU 111 20.425 51.316 16.097 828 HD21 LEU 111 3HD2 LEU 111 17.354 50.820 14.959 829 HD22 LEU 111 1HD2 LEU 111 18.123 52.151 14.128 830 HD23 LEU 111 2HD2 LEU 111 17.727 50.816 13.192 831 H GLU 112 H GLU 112 22.502 52.777 14.615 832 HA GLU 112 HA GLU 112 23.857 51.601 16.824 833 HB2 GLU 112 HB2 GLU 112 25.657 51.497 14.988 834 HB3 GLU 112 HB1 GLU 112 25.442 53.227 14.705 835 HG2 GLU 112 HG2 GLU 112 26.375 53.932 16.715 836 HG3 GLU 112 HG1 GLU 112 26.299 52.370 17.527 837 H HIS 113 H HIS 113 24.720 54.564 16.011 838 HA HIS 113 HA HIS 113 23.423 55.552 18.471 839 HB2 HIS 113 HB2 HIS 113 24.810 57.392 18.344 840 HB3 HIS 113 HB1 HIS 113 25.762 56.012 17.892 841 HD2 HIS 113 HD2 HIS 113 26.304 59.038 17.560 842 HE1 HIS 113 HE1 HIS 113 25.872 58.484 13.455 843 HE2 HIS 113 HE2 HIS 113 26.875 60.015 15.121 844 H HIS 114 H HIS 114 22.290 55.492 15.462 845 HA HIS 114 HA HIS 114 20.789 57.403 14.538 846 HB2 HIS 114 HB2 HIS 114 19.924 54.728 15.502 847 HB3 HIS 114 HB1 HIS 114 19.065 55.686 14.247 848 HD2 HIS 114 HD2 HIS 114 19.471 55.099 11.861 849 HE1 HIS 114 HE1 HIS 114 23.159 53.173 12.267 850 HE2 HIS 114 HE2 HIS 114 21.214 53.497 10.727 Start of MODEL 9 1 H1 GLU 13 H1 GLU 13 12.269 -20.752 19.230 2 H2 GLU 13 H2 GLU 13 11.731 -19.190 19.225 3 H3 GLU 13 H3 GLU 13 10.915 -20.214 18.448 4 HA GLU 13 HA GLU 13 13.753 -19.982 17.916 5 HB2 GLU 13 HB2 GLU 13 12.816 -21.741 16.636 6 HB3 GLU 13 HB1 GLU 13 11.468 -20.636 16.126 7 HG2 GLU 13 HG2 GLU 13 12.642 -20.951 14.325 8 HG3 GLU 13 HG1 GLU 13 13.191 -19.309 14.878 9 H ASN 14 H ASN 14 10.830 -18.267 16.542 10 HA ASN 14 HA ASN 14 12.663 -16.303 15.264 11 HB2 ASN 14 HB2 ASN 14 11.171 -17.678 13.936 12 HB3 ASN 14 HB1 ASN 14 9.729 -17.106 14.858 13 HD21 ASN 14 1HD2 ASN 14 12.438 -16.102 12.646 14 HD22 ASN 14 2HD2 ASN 14 11.577 -14.638 12.076 15 H ALA 15 H ALA 15 12.310 -14.079 15.639 16 HA ALA 15 HA ALA 15 11.597 -13.450 18.275 17 HB1 ALA 15 HB1 ALA 15 13.403 -12.431 17.076 18 HB2 ALA 15 HB2 ALA 15 12.193 -11.824 15.797 19 HB3 ALA 15 HB3 ALA 15 12.238 -11.152 17.378 20 H GLU 16 H GLU 16 10.280 -11.463 18.808 21 HA GLU 16 HA GLU 16 7.654 -12.678 18.371 22 HB2 GLU 16 HB2 GLU 16 8.468 -10.349 20.168 23 HB3 GLU 16 HB1 GLU 16 6.922 -11.110 20.297 24 HG2 GLU 16 HG2 GLU 16 7.768 -13.063 21.196 25 HG3 GLU 16 HG1 GLU 16 9.498 -12.754 20.811 26 H LEU 17 H LEU 17 9.208 -10.527 16.591 27 HA LEU 17 HA LEU 17 7.207 -8.954 15.387 28 HB2 LEU 17 HB2 LEU 17 7.608 -6.767 16.535 29 HB3 LEU 17 HB1 LEU 17 6.716 -7.952 17.477 30 HG LEU 17 HG LEU 17 8.520 -8.462 18.846 31 HD11 LEU 17 1HD1 LEU 17 10.673 -7.193 18.820 32 HD12 LEU 17 2HD1 LEU 17 10.524 -8.212 17.349 33 HD13 LEU 17 3HD1 LEU 17 10.343 -6.418 17.364 34 HD21 LEU 17 3HD2 LEU 17 8.750 -6.501 20.104 35 HD22 LEU 17 1HD2 LEU 17 8.526 -5.428 18.705 36 HD23 LEU 17 2HD2 LEU 17 7.165 -6.488 19.247 37 H GLU 18 H GLU 18 7.857 -7.188 14.101 38 HA GLU 18 HA GLU 18 10.798 -7.351 13.357 39 HB2 GLU 18 HB2 GLU 18 9.350 -8.900 12.018 40 HB3 GLU 18 HB1 GLU 18 8.324 -7.572 11.564 41 HG2 GLU 18 HG2 GLU 18 9.592 -8.094 9.897 42 HG3 GLU 18 HG1 GLU 18 9.951 -6.415 10.287 43 H ILE 19 H ILE 19 11.741 -5.691 12.275 44 HA ILE 19 HA ILE 19 10.496 -3.035 12.883 45 HB ILE 19 HB ILE 19 12.583 -2.358 13.472 46 HG12 ILE 19 2HG1 ILE 19 13.383 -5.195 13.877 47 HG13 ILE 19 1HG1 ILE 19 13.902 -4.146 12.464 48 HG21 ILE 19 1HG2 ILE 19 11.507 -4.579 15.229 49 HG22 ILE 19 2HG2 ILE 19 12.442 -3.108 15.704 50 HG23 ILE 19 3HG2 ILE 19 10.808 -2.947 15.119 51 HD11 ILE 19 HD3 ILE 19 14.524 -3.807 15.488 52 HD12 ILE 19 HD1 ILE 19 15.622 -4.259 14.185 53 HD13 ILE 19 HD2 ILE 19 14.940 -2.615 14.184 54 H VAL 20 H VAL 20 12.344 -5.037 10.479 55 HA VAL 20 HA VAL 20 13.256 -2.675 9.031 56 HB VAL 20 HB VAL 20 12.914 -5.505 8.280 57 HG11 VAL 20 1HG1 VAL 20 14.271 -3.146 6.847 58 HG12 VAL 20 2HG1 VAL 20 14.524 -4.847 6.374 59 HG13 VAL 20 3HG1 VAL 20 12.983 -4.038 6.159 60 HG21 VAL 20 3HG2 VAL 20 15.243 -5.492 8.334 61 HG22 VAL 20 1HG2 VAL 20 15.215 -3.902 9.249 62 HG23 VAL 20 2HG2 VAL 20 14.463 -5.309 9.959 63 H THR 21 H THR 21 10.335 -4.755 8.661 64 HA THR 21 HA THR 21 10.077 -4.424 6.080 65 HB THR 21 HB THR 21 7.549 -4.928 7.820 66 HG1 THR 21 HG1 THR 21 8.319 -6.983 7.876 67 HG21 THR 21 1HG2 THR 21 7.932 -6.556 5.450 68 HG22 THR 21 2HG2 THR 21 6.471 -6.014 6.203 69 HG23 THR 21 3HG2 THR 21 7.423 -4.810 5.312 70 H ASP 22 H ASP 22 8.239 -2.693 8.423 71 HA ASP 22 HA ASP 22 7.209 -0.984 8.618 72 HB2 ASP 22 HB2 ASP 22 7.977 0.030 5.930 73 HB3 ASP 22 HB1 ASP 22 6.797 0.836 6.814 74 H TYR 23 H TYR 23 6.437 -3.025 6.091 75 HA TYR 23 HA TYR 23 3.561 -2.272 5.862 76 HB2 TYR 23 HB2 TYR 23 4.777 -2.969 3.840 77 HB3 TYR 23 HB1 TYR 23 4.979 -4.548 4.504 78 HD1 TYR 23 HD2 TYR 23 2.979 -5.966 4.552 79 HD2 TYR 23 HD1 TYR 23 2.757 -2.008 2.946 80 HE1 TYR 23 HE2 TYR 23 0.770 -6.532 3.470 81 HE2 TYR 23 HE1 TYR 23 0.883 -2.590 1.625 82 HH TYR 23 HH TYR 23 -0.728 -4.270 1.149 83 H TYR 24 H TYR 24 3.506 -2.347 8.066 84 HA TYR 24 HA TYR 24 2.822 -4.960 9.289 85 HB2 TYR 24 HB2 TYR 24 2.803 -2.367 10.702 86 HB3 TYR 24 HB1 TYR 24 2.917 -3.971 11.431 87 HD1 TYR 24 HD1 TYR 24 5.046 -5.385 9.975 88 HD2 TYR 24 HD2 TYR 24 4.848 -1.221 11.211 89 HE1 TYR 24 HE1 TYR 24 7.501 -5.172 9.988 90 HE2 TYR 24 HE2 TYR 24 7.306 -1.104 11.139 91 HH TYR 24 HH TYR 24 9.112 -2.024 10.680 92 H LYS 25 H LYS 25 1.027 -4.530 11.208 93 HA LYS 25 HA LYS 25 -1.386 -5.113 9.902 94 HB2 LYS 25 HB2 LYS 25 -1.036 -4.170 12.727 95 HB3 LYS 25 HB1 LYS 25 -2.415 -5.044 11.953 96 HG2 LYS 25 HG2 LYS 25 -0.980 -6.895 11.462 97 HG3 LYS 25 HG1 LYS 25 0.334 -6.089 12.357 98 HD2 LYS 25 HD2 LYS 25 -1.114 -6.146 14.290 99 HD3 LYS 25 HD1 LYS 25 -2.397 -7.039 13.324 100 HE2 LYS 25 HE2 LYS 25 -0.929 -8.921 13.077 101 HE3 LYS 25 HE1 LYS 25 0.499 -7.959 13.547 102 HZ1 LYS 25 HZ1 LYS 25 -0.274 -8.055 15.852 103 HZ2 LYS 25 HZ2 LYS 25 -1.602 -8.925 15.432 104 HZ3 LYS 25 HZ3 LYS 25 -0.203 -9.576 15.267 105 H ILE 26 H ILE 26 -0.331 -1.953 10.978 106 HA ILE 26 HA ILE 26 -2.393 -0.140 10.272 107 HB ILE 26 HB ILE 26 -0.602 0.947 8.981 108 HG12 ILE 26 2HG1 ILE 26 1.219 -1.058 10.405 109 HG13 ILE 26 1HG1 ILE 26 0.905 -1.086 8.659 110 HG21 ILE 26 1HG2 ILE 26 0.304 1.782 11.154 111 HG22 ILE 26 2HG2 ILE 26 -1.452 1.606 11.079 112 HG23 ILE 26 3HG2 ILE 26 -0.544 0.374 11.908 113 HD11 ILE 26 HD3 ILE 26 2.345 1.122 10.150 114 HD12 ILE 26 HD1 ILE 26 2.871 -0.013 8.858 115 HD13 ILE 26 HD2 ILE 26 1.869 1.275 8.431 116 H ILE 27 H ILE 27 -1.054 -2.531 7.992 117 HA ILE 27 HA ILE 27 -3.050 -1.753 6.260 118 HB ILE 27 HB ILE 27 -1.302 -0.176 5.353 119 HG12 ILE 27 2HG1 ILE 27 -0.797 -1.307 3.056 120 HG13 ILE 27 1HG1 ILE 27 -1.608 -2.675 3.612 121 HG21 ILE 27 1HG2 ILE 27 0.648 -2.478 5.283 122 HG22 ILE 27 2HG2 ILE 27 0.888 -0.888 4.572 123 HG23 ILE 27 3HG2 ILE 27 0.550 -1.084 6.359 124 HD11 ILE 27 HD3 ILE 27 -3.029 0.037 3.847 125 HD12 ILE 27 HD1 ILE 27 -3.093 -0.886 2.380 126 HD13 ILE 27 HD2 ILE 27 -3.757 -1.563 3.840 127 H LYS 28 H LYS 28 -0.361 -4.186 6.635 128 HA LYS 28 HA LYS 28 -1.195 -5.956 5.066 129 HB2 LYS 28 HB2 LYS 28 0.790 -5.826 6.468 130 HB3 LYS 28 HB1 LYS 28 -0.138 -6.582 7.876 131 HG2 LYS 28 HG2 LYS 28 -0.609 -8.601 6.664 132 HG3 LYS 28 HG1 LYS 28 0.181 -8.020 5.210 133 HD2 LYS 28 HD2 LYS 28 2.252 -7.709 6.646 134 HD3 LYS 28 HD1 LYS 28 1.460 -8.363 7.994 135 HE2 LYS 28 HE2 LYS 28 1.221 -10.526 6.788 136 HE3 LYS 28 HE1 LYS 28 1.956 -9.787 5.376 137 HZ1 LYS 28 HZ1 LYS 28 3.871 -9.393 6.983 138 HZ2 LYS 28 HZ2 LYS 28 2.984 -10.260 8.107 139 HZ3 LYS 28 HZ3 LYS 28 3.517 -11.016 6.749 140 H THR 29 H THR 29 -2.607 -5.927 8.393 141 HA THR 29 HA THR 29 -4.485 -7.920 7.566 142 HB THR 29 HB THR 29 -5.359 -7.496 9.876 143 HG1 THR 29 HG1 THR 29 -4.420 -5.848 10.950 144 HG21 THR 29 1HG2 THR 29 -3.341 -8.082 11.318 145 HG22 THR 29 2HG2 THR 29 -3.261 -9.028 9.832 146 HG23 THR 29 3HG2 THR 29 -2.202 -7.734 9.981 147 H ALA 30 H ALA 30 -4.299 -4.446 7.546 148 HA ALA 30 HA ALA 30 -6.975 -3.938 8.179 149 HB1 ALA 30 HB1 ALA 30 -4.724 -2.295 8.065 150 HB2 ALA 30 HB2 ALA 30 -5.262 -2.045 6.441 151 HB3 ALA 30 HB3 ALA 30 -6.377 -1.700 7.756 152 H ARG 31 H ARG 31 -5.455 -4.087 5.016 153 HA ARG 31 HA ARG 31 -7.582 -3.459 3.320 154 HB2 ARG 31 HB2 ARG 31 -6.270 -4.861 1.751 155 HB3 ARG 31 HB1 ARG 31 -5.262 -3.871 2.890 156 HG2 ARG 31 HG2 ARG 31 -4.845 -5.881 4.194 157 HG3 ARG 31 HG1 ARG 31 -5.729 -6.846 3.074 158 HD2 ARG 31 HD2 ARG 31 -4.150 -6.222 1.343 159 HD3 ARG 31 HD1 ARG 31 -3.214 -5.266 2.536 160 HE ARG 31 HE ARG 31 -3.254 -7.517 3.842 161 HH11 ARG 31 1HH2 ARG 31 -2.576 -7.396 0.285 162 HH12 ARG 31 2HH2 ARG 31 -1.369 -8.610 0.373 163 HH21 ARG 31 1HH1 ARG 31 -1.785 -9.070 3.819 164 HH22 ARG 31 2HH1 ARG 31 -0.570 -9.297 2.613 165 H GLU 32 H GLU 32 -6.984 -6.599 5.083 166 HA GLU 32 HA GLU 32 -9.138 -7.932 3.917 167 HB2 GLU 32 HB2 GLU 32 -7.782 -8.856 6.462 168 HB3 GLU 32 HB1 GLU 32 -8.677 -9.711 5.210 169 HG2 GLU 32 HG2 GLU 32 -6.844 -9.263 3.581 170 HG3 GLU 32 HG1 GLU 32 -5.902 -8.456 4.886 171 H GLN 33 H GLN 33 -8.714 -6.192 6.939 172 HA GLN 33 HA GLN 33 -11.177 -7.090 8.083 173 HB2 GLN 33 HB2 GLN 33 -9.126 -5.055 8.833 174 HB3 GLN 33 HB1 GLN 33 -10.598 -5.294 9.741 175 HG2 GLN 33 HG2 GLN 33 -9.734 -7.438 10.318 176 HG3 GLN 33 HG1 GLN 33 -8.524 -7.675 9.079 177 HE21 GLN 33 1HE2 GLN 33 -7.416 -8.196 11.258 178 HE22 GLN 33 2HE2 GLN 33 -6.500 -6.835 11.891 179 H LEU 34 H LEU 34 -10.471 -4.617 5.946 180 HA LEU 34 HA LEU 34 -13.079 -3.473 6.084 181 HB2 LEU 34 HB2 LEU 34 -10.811 -2.332 5.529 182 HB3 LEU 34 HB1 LEU 34 -10.898 -3.043 3.962 183 HG LEU 34 HG LEU 34 -13.020 -1.936 3.490 184 HD11 LEU 34 1HD1 LEU 34 -12.708 -1.102 6.304 185 HD12 LEU 34 2HD1 LEU 34 -13.837 -0.245 5.128 186 HD13 LEU 34 3HD1 LEU 34 -14.105 -1.933 5.510 187 HD21 LEU 34 3HD2 LEU 34 -12.287 0.293 3.380 188 HD22 LEU 34 1HD2 LEU 34 -10.909 -0.018 4.575 189 HD23 LEU 34 2HD2 LEU 34 -10.870 -0.734 2.954 190 H GLY 35 H GLY 35 -11.770 -6.118 4.607 191 HA2 GLY 35 HA2 GLY 35 -12.595 -7.839 3.480 192 HA3 GLY 35 HA1 GLY 35 -14.163 -7.051 3.444 193 H ILE 36 H ILE 36 -12.181 -4.919 2.062 194 HA ILE 36 HA ILE 36 -13.105 -5.415 -0.640 195 HB ILE 36 HB ILE 36 -11.906 -3.360 -1.143 196 HG12 ILE 36 2HG1 ILE 36 -11.160 -3.124 1.706 197 HG13 ILE 36 1HG1 ILE 36 -10.070 -3.841 0.455 198 HG21 ILE 36 1HG2 ILE 36 -14.101 -2.913 -0.426 199 HG22 ILE 36 2HG2 ILE 36 -13.726 -3.100 1.301 200 HG23 ILE 36 3HG2 ILE 36 -13.297 -1.728 0.368 201 HD11 ILE 36 HD3 ILE 36 -11.187 -1.004 0.295 202 HD12 ILE 36 HD1 ILE 36 -9.632 -1.384 1.046 203 HD13 ILE 36 HD2 ILE 36 -9.787 -1.789 -0.627 204 H SER 37 H SER 37 -11.864 -5.326 -2.502 205 HA SER 37 HA SER 37 -9.933 -7.543 -2.252 206 HB2 SER 37 HB2 SER 37 -10.217 -8.000 -4.575 207 HB3 SER 37 HB1 SER 37 -11.790 -7.706 -3.885 208 HG SER 37 HG SER 37 -11.903 -6.445 -5.550 209 H GLN 38 H GLN 38 -8.079 -7.681 -3.823 210 HA GLN 38 HA GLN 38 -6.332 -5.683 -3.513 211 HB2 GLN 38 HB2 GLN 38 -5.735 -7.958 -4.214 212 HB3 GLN 38 HB1 GLN 38 -6.389 -7.684 -5.802 213 HG2 GLN 38 HG2 GLN 38 -4.147 -7.553 -6.246 214 HG3 GLN 38 HG1 GLN 38 -4.802 -6.092 -6.470 215 HE21 GLN 38 1HE2 GLN 38 -4.530 -4.348 -4.881 216 HE22 GLN 38 2HE2 GLN 38 -3.390 -4.479 -3.517 217 H GLN 39 H GLN 39 -8.460 -6.222 -6.382 218 HA GLN 39 HA GLN 39 -7.469 -4.173 -7.875 219 HB2 GLN 39 HB2 GLN 39 -9.559 -4.137 -9.006 220 HB3 GLN 39 HB1 GLN 39 -8.811 -5.882 -8.812 221 HG2 GLN 39 HG2 GLN 39 -10.520 -6.355 -7.226 222 HG3 GLN 39 HG1 GLN 39 -11.208 -4.686 -7.249 223 HE21 GLN 39 1HE2 GLN 39 -12.336 -4.063 -9.273 224 HE22 GLN 39 2HE2 GLN 39 -12.974 -5.316 -10.343 225 H GLN 40 H GLN 40 -10.164 -4.052 -5.503 226 HA GLN 40 HA GLN 40 -10.817 -1.374 -5.804 227 HB2 GLN 40 HB2 GLN 40 -10.885 -3.095 -3.369 228 HB3 GLN 40 HB1 GLN 40 -11.644 -1.519 -3.469 229 HG2 GLN 40 HG2 GLN 40 -13.243 -2.176 -5.232 230 HG3 GLN 40 HG1 GLN 40 -12.389 -3.648 -5.414 231 HE21 GLN 40 1HE2 GLN 40 -14.947 -1.984 -3.867 232 HE22 GLN 40 2HE2 GLN 40 -15.297 -3.280 -2.728 233 H LEU 41 H LEU 41 -8.238 -2.867 -3.783 234 HA LEU 41 HA LEU 41 -7.721 -0.585 -2.240 235 HB2 LEU 41 HB2 LEU 41 -7.176 -3.099 -1.865 236 HB3 LEU 41 HB1 LEU 41 -5.756 -2.787 -2.965 237 HG LEU 41 HG LEU 41 -4.947 -1.302 -1.289 238 HD11 LEU 41 1HD1 LEU 41 -6.868 -0.710 0.058 239 HD12 LEU 41 2HD1 LEU 41 -7.368 -2.449 0.230 240 HD13 LEU 41 3HD1 LEU 41 -6.073 -1.860 1.165 241 HD21 LEU 41 3HD2 LEU 41 -3.906 -3.386 -1.306 242 HD22 LEU 41 1HD2 LEU 41 -4.269 -3.184 0.363 243 HD23 LEU 41 2HD2 LEU 41 -5.336 -4.216 -0.528 244 H ALA 42 H ALA 42 -6.298 -1.425 -5.387 245 HA ALA 42 HA ALA 42 -4.213 0.515 -5.240 246 HB1 ALA 42 HB1 ALA 42 -4.598 -1.599 -6.757 247 HB2 ALA 42 HB2 ALA 42 -5.655 -0.543 -7.780 248 HB3 ALA 42 HB3 ALA 42 -4.002 -0.143 -7.536 249 H GLN 43 H GLN 43 -7.723 0.562 -6.225 250 HA GLN 43 HA GLN 43 -7.580 3.121 -7.391 251 HB2 GLN 43 HB2 GLN 43 -9.684 1.202 -6.249 252 HB3 GLN 43 HB1 GLN 43 -10.098 2.833 -6.848 253 HG2 GLN 43 HG2 GLN 43 -9.089 2.277 -9.098 254 HG3 GLN 43 HG1 GLN 43 -9.010 0.584 -8.467 255 HE21 GLN 43 1HE2 GLN 43 -11.010 2.983 -9.926 256 HE22 GLN 43 2HE2 GLN 43 -12.458 1.926 -9.912 257 H LYS 44 H LYS 44 -7.716 1.867 -4.019 258 HA LYS 44 HA LYS 44 -8.621 4.448 -3.020 259 HB2 LYS 44 HB2 LYS 44 -9.429 2.030 -2.560 260 HB3 LYS 44 HB1 LYS 44 -7.906 1.799 -1.666 261 HG2 LYS 44 HG2 LYS 44 -8.298 3.375 -0.170 262 HG3 LYS 44 HG1 LYS 44 -9.754 4.083 -0.902 263 HD2 LYS 44 HD2 LYS 44 -10.917 1.887 -0.403 264 HD3 LYS 44 HD1 LYS 44 -9.391 1.362 0.346 265 HE2 LYS 44 HE2 LYS 44 -11.065 2.019 2.055 266 HE3 LYS 44 HE1 LYS 44 -9.678 3.240 1.957 267 HZ1 LYS 44 HZ1 LYS 44 -11.049 4.578 0.689 268 HZ2 LYS 44 HZ2 LYS 44 -12.311 3.522 0.850 269 HZ3 LYS 44 HZ3 LYS 44 -11.726 4.328 2.163 270 H LEU 45 H LEU 45 -5.397 3.227 -3.520 271 HA LEU 45 HA LEU 45 -4.539 4.976 -1.315 272 HB2 LEU 45 HB2 LEU 45 -3.645 2.115 -1.774 273 HB3 LEU 45 HB1 LEU 45 -2.944 3.078 -0.617 274 HG LEU 45 HG LEU 45 -5.750 1.962 -0.493 275 HD11 LEU 45 1HD1 LEU 45 -3.995 0.191 0.024 276 HD12 LEU 45 2HD1 LEU 45 -3.134 1.258 0.955 277 HD13 LEU 45 3HD1 LEU 45 -4.646 0.678 1.552 278 HD21 LEU 45 3HD2 LEU 45 -5.492 2.684 1.964 279 HD22 LEU 45 1HD2 LEU 45 -4.361 3.948 1.285 280 HD23 LEU 45 2HD2 LEU 45 -5.983 3.856 0.701 281 H LYS 46 H LYS 46 -4.445 4.689 -4.324 282 HA LYS 46 HA LYS 46 -3.504 5.069 -6.102 283 HB2 LYS 46 HB2 LYS 46 -1.260 6.394 -4.583 284 HB3 LYS 46 HB1 LYS 46 -1.410 6.271 -6.358 285 HG2 LYS 46 HG2 LYS 46 -3.536 7.467 -6.193 286 HG3 LYS 46 HG1 LYS 46 -3.288 7.756 -4.446 287 HD2 LYS 46 HD2 LYS 46 -1.655 9.322 -4.825 288 HD3 LYS 46 HD1 LYS 46 -1.389 8.813 -6.555 289 HE2 LYS 46 HE2 LYS 46 -3.547 9.551 -7.169 290 HE3 LYS 46 HE1 LYS 46 -3.928 9.939 -5.505 291 HZ1 LYS 46 HZ1 LYS 46 -2.778 11.845 -5.615 292 HZ2 LYS 46 HZ2 LYS 46 -1.700 11.313 -6.687 293 HZ3 LYS 46 HZ3 LYS 46 -3.176 11.737 -7.231 294 H VAL 47 H VAL 47 -1.318 3.472 -3.874 295 HA VAL 47 HA VAL 47 0.392 2.559 -5.690 296 HB VAL 47 HB VAL 47 1.162 1.030 -3.924 297 HG11 VAL 47 1HG1 VAL 47 1.848 2.877 -2.446 298 HG12 VAL 47 2HG1 VAL 47 1.754 3.365 -4.146 299 HG13 VAL 47 3HG1 VAL 47 0.500 3.896 -3.000 300 HG21 VAL 47 3HG2 VAL 47 -1.202 2.027 -2.264 301 HG22 VAL 47 1HG2 VAL 47 -0.828 0.303 -2.662 302 HG23 VAL 47 2HG2 VAL 47 0.288 1.195 -1.702 303 H SER 48 H SER 48 1.081 0.127 -6.423 304 HA SER 48 HA SER 48 -1.358 -1.049 -7.308 305 HB2 SER 48 HB2 SER 48 -0.121 -1.845 -9.127 306 HB3 SER 48 HB1 SER 48 0.334 -0.250 -8.855 307 HG SER 48 HG SER 48 2.220 -1.162 -8.973 308 H GLU 49 H GLU 49 -1.668 -3.514 -7.536 309 HA GLU 49 HA GLU 49 -1.000 -5.017 -5.316 310 HB2 GLU 49 HB2 GLU 49 -1.722 -6.914 -6.520 311 HB3 GLU 49 HB1 GLU 49 -2.529 -5.588 -7.329 312 HG2 GLU 49 HG2 GLU 49 -0.096 -6.811 -8.480 313 HG3 GLU 49 HG1 GLU 49 -1.848 -7.270 -8.849 314 H ASN 50 H ASN 50 1.253 -4.268 -7.851 315 HA ASN 50 HA ASN 50 3.222 -6.219 -6.905 316 HB2 ASN 50 HB2 ASN 50 2.995 -5.569 -9.170 317 HB3 ASN 50 HB1 ASN 50 3.478 -3.929 -9.032 318 HD21 ASN 50 1HD2 ASN 50 4.432 -6.726 -10.199 319 HD22 ASN 50 2HD2 ASN 50 6.138 -6.622 -9.955 320 H ILE 51 H ILE 51 2.579 -2.918 -6.274 321 HA ILE 51 HA ILE 51 4.857 -2.397 -4.685 322 HB ILE 51 HB ILE 51 2.122 -1.308 -4.403 323 HG12 ILE 51 2HG1 ILE 51 3.116 -0.562 -6.601 324 HG13 ILE 51 1HG1 ILE 51 3.143 0.735 -5.445 325 HG21 ILE 51 1HG2 ILE 51 4.497 -0.498 -2.975 326 HG22 ILE 51 2HG2 ILE 51 3.409 0.748 -3.245 327 HG23 ILE 51 3HG2 ILE 51 2.767 -0.732 -2.397 328 HD11 ILE 51 HD3 ILE 51 5.488 -0.973 -6.229 329 HD12 ILE 51 HD1 ILE 51 5.318 0.765 -6.426 330 HD13 ILE 51 HD2 ILE 51 5.575 0.242 -4.843 331 H VAL 52 H VAL 52 1.569 -3.877 -3.869 332 HA VAL 52 HA VAL 52 2.143 -4.184 -1.327 333 HB VAL 52 HB VAL 52 0.705 -6.171 -3.219 334 HG11 VAL 52 1HG1 VAL 52 -0.419 -6.509 -0.704 335 HG12 VAL 52 2HG1 VAL 52 1.201 -7.334 -1.042 336 HG13 VAL 52 3HG1 VAL 52 1.105 -5.969 -0.111 337 HG21 VAL 52 3HG2 VAL 52 -0.088 -3.978 -3.106 338 HG22 VAL 52 1HG2 VAL 52 -1.246 -5.086 -2.264 339 HG23 VAL 52 2HG2 VAL 52 -0.215 -3.971 -1.310 340 H LYS 53 H LYS 53 2.986 -6.894 -3.661 341 HA LYS 53 HA LYS 53 4.370 -8.569 -2.005 342 HB2 LYS 53 HB2 LYS 53 4.667 -7.782 -4.899 343 HB3 LYS 53 HB1 LYS 53 5.622 -9.045 -4.300 344 HG2 LYS 53 HG2 LYS 53 3.712 -10.369 -3.647 345 HG3 LYS 53 HG1 LYS 53 2.607 -9.012 -3.697 346 HD2 LYS 53 HD2 LYS 53 2.825 -8.988 -6.153 347 HD3 LYS 53 HD1 LYS 53 4.271 -9.961 -6.101 348 HE2 LYS 53 HE2 LYS 53 2.942 -11.931 -5.176 349 HE3 LYS 53 HE1 LYS 53 1.495 -10.909 -5.050 350 HZ1 LYS 53 HZ1 LYS 53 1.813 -10.787 -7.590 351 HZ2 LYS 53 HZ2 LYS 53 2.969 -11.767 -7.500 352 HZ3 LYS 53 HZ3 LYS 53 1.586 -12.361 -7.028 353 H ARG 54 H ARG 54 5.702 -5.633 -3.602 354 HA ARG 54 HA ARG 54 8.350 -6.095 -2.851 355 HB2 ARG 54 HB2 ARG 54 6.533 -3.893 -3.527 356 HB3 ARG 54 HB1 ARG 54 8.218 -3.492 -3.039 357 HG2 ARG 54 HG2 ARG 54 9.090 -4.687 -4.975 358 HG3 ARG 54 HG1 ARG 54 7.392 -5.095 -5.477 359 HD2 ARG 54 HD2 ARG 54 6.978 -2.570 -5.501 360 HD3 ARG 54 HD1 ARG 54 8.699 -2.281 -5.105 361 HE ARG 54 HE ARG 54 8.008 -3.899 -7.485 362 HH11 ARG 54 1HH2 ARG 54 8.961 -0.628 -6.299 363 HH12 ARG 54 2HH2 ARG 54 8.923 0.035 -7.878 364 HH21 ARG 54 1HH1 ARG 54 8.462 -3.126 -9.565 365 HH22 ARG 54 2HH1 ARG 54 8.945 -1.419 -9.605 366 H PHE 55 H PHE 55 5.851 -4.311 -1.000 367 HA PHE 55 HA PHE 55 7.619 -3.511 1.201 368 HB2 PHE 55 HB2 PHE 55 4.826 -3.256 0.410 369 HB3 PHE 55 HB1 PHE 55 5.506 -2.701 1.963 370 HD1 PHE 55 HD2 PHE 55 7.570 -2.349 -1.108 371 HD2 PHE 55 HD1 PHE 55 4.861 -0.512 1.583 372 HE1 PHE 55 HE2 PHE 55 8.149 -0.119 -2.043 373 HE2 PHE 55 HE1 PHE 55 5.097 1.651 0.403 374 HZ PHE 55 HZ PHE 55 6.947 1.838 -1.413 375 H GLU 56 H GLU 56 4.413 -5.544 1.023 376 HA GLU 56 HA GLU 56 4.499 -6.846 3.180 377 HB2 GLU 56 HB2 GLU 56 3.026 -7.223 1.048 378 HB3 GLU 56 HB1 GLU 56 4.304 -8.542 0.692 379 HG2 GLU 56 HG2 GLU 56 3.790 -9.574 2.856 380 HG3 GLU 56 HG1 GLU 56 2.631 -8.257 3.134 381 H SER 57 H SER 57 7.221 -7.366 0.884 382 HA SER 57 HA SER 57 7.825 -9.946 2.159 383 HB2 SER 57 HB2 SER 57 9.442 -10.091 0.504 384 HB3 SER 57 HB1 SER 57 7.891 -10.082 -0.166 385 HG SER 57 HG SER 57 8.194 -7.959 -0.855 386 H GLY 58 H GLY 58 8.436 -6.704 2.849 387 HA2 GLY 58 HA2 GLY 58 9.827 -5.528 4.007 388 HA3 GLY 58 HA1 GLY 58 10.620 -7.007 4.547 389 H LYS 59 H LYS 59 10.760 -6.609 1.124 390 HA LYS 59 HA LYS 59 13.351 -6.131 1.197 391 HB2 LYS 59 HB2 LYS 59 12.179 -7.895 -0.357 392 HB3 LYS 59 HB1 LYS 59 11.489 -6.518 -1.125 393 HG2 LYS 59 HG2 LYS 59 13.427 -5.808 -2.058 394 HG3 LYS 59 HG1 LYS 59 14.462 -6.525 -0.867 395 HD2 LYS 59 HD2 LYS 59 13.921 -8.808 -1.855 396 HD3 LYS 59 HD1 LYS 59 12.879 -8.039 -2.965 397 HE2 LYS 59 HE2 LYS 59 14.935 -6.647 -3.770 398 HE3 LYS 59 HE1 LYS 59 15.900 -7.627 -2.700 399 HZ1 LYS 59 HZ1 LYS 59 15.896 -8.593 -4.994 400 HZ2 LYS 59 HZ2 LYS 59 15.415 -9.536 -3.927 401 HZ3 LYS 59 HZ3 LYS 59 14.280 -8.934 -4.825 402 H LEU 60 H LEU 60 10.746 -4.021 0.620 403 HA LEU 60 HA LEU 60 12.364 -1.807 0.131 404 HB2 LEU 60 HB2 LEU 60 11.496 -3.158 -2.207 405 HB3 LEU 60 HB1 LEU 60 9.898 -2.490 -1.724 406 HG LEU 60 HG LEU 60 10.851 -0.244 -1.740 407 HD11 LEU 60 1HD1 LEU 60 12.767 0.131 -3.321 408 HD12 LEU 60 2HD1 LEU 60 13.286 -0.651 -1.716 409 HD13 LEU 60 3HD1 LEU 60 13.181 -1.552 -3.258 410 HD21 LEU 60 3HD2 LEU 60 10.678 0.106 -4.019 411 HD22 LEU 60 1HD2 LEU 60 10.874 -1.673 -4.301 412 HD23 LEU 60 2HD2 LEU 60 9.448 -0.988 -3.450 413 H LYS 61 H LYS 61 11.459 0.271 0.776 414 HA LYS 61 HA LYS 61 8.679 0.337 1.639 415 HB2 LYS 61 HB2 LYS 61 9.276 1.525 3.514 416 HB3 LYS 61 HB1 LYS 61 9.947 -0.017 3.547 417 HG2 LYS 61 HG2 LYS 61 12.107 1.109 2.650 418 HG3 LYS 61 HG1 LYS 61 11.227 2.705 2.996 419 HD2 LYS 61 HD2 LYS 61 12.862 2.262 4.715 420 HD3 LYS 61 HD1 LYS 61 11.257 2.253 5.341 421 HE2 LYS 61 HE2 LYS 61 11.665 -0.425 5.014 422 HE3 LYS 61 HE1 LYS 61 13.394 0.201 5.119 423 HZ1 LYS 61 HZ1 LYS 61 11.250 0.567 7.040 424 HZ2 LYS 61 HZ2 LYS 61 12.336 -0.486 7.201 425 HZ3 LYS 61 HZ3 LYS 61 12.754 1.221 7.177 426 HA PRO 62 HA PRO 62 8.207 3.890 -0.747 427 HB2 PRO 62 HB1 PRO 62 8.650 5.904 1.357 428 HB3 PRO 62 HB2 PRO 62 7.365 5.818 0.147 429 HG2 PRO 62 HG1 PRO 62 6.761 4.777 2.628 430 HG3 PRO 62 HG2 PRO 62 6.310 3.851 1.225 431 HD2 PRO 62 HD1 PRO 62 8.692 3.509 2.994 432 HD3 PRO 62 HD2 PRO 62 7.555 2.325 2.385 433 H THR 63 H THR 63 9.362 5.371 -2.204 434 HA THR 63 HA THR 63 12.165 5.786 -1.658 435 HB THR 63 HB THR 63 12.285 5.153 -4.130 436 HG1 THR 63 HG1 THR 63 10.176 4.703 -5.072 437 HG21 THR 63 1HG2 THR 63 10.491 3.196 -2.631 438 HG22 THR 63 2HG2 THR 63 11.415 2.899 -4.142 439 HG23 THR 63 3HG2 THR 63 12.215 3.245 -2.679 440 H ILE 64 H ILE 64 13.096 7.317 -3.543 441 HA ILE 64 HA ILE 64 12.233 9.866 -3.315 442 HB ILE 64 HB ILE 64 14.310 9.717 -4.046 443 HG12 ILE 64 2HG1 ILE 64 14.457 11.266 -5.977 444 HG13 ILE 64 1HG1 ILE 64 12.859 10.952 -6.385 445 HG21 ILE 64 1HG2 ILE 64 13.463 8.446 -6.688 446 HG22 ILE 64 2HG2 ILE 64 15.130 8.968 -6.057 447 HG23 ILE 64 3HG2 ILE 64 14.273 7.712 -5.284 448 HD11 ILE 64 HD3 ILE 64 12.118 11.835 -4.152 449 HD12 ILE 64 HD1 ILE 64 13.857 12.176 -3.813 450 HD13 ILE 64 HD2 ILE 64 13.120 13.050 -5.123 451 H SER 65 H SER 65 11.327 7.594 -6.094 452 HA SER 65 HA SER 65 9.692 9.739 -7.253 453 HB2 SER 65 HB2 SER 65 8.935 7.745 -8.736 454 HB3 SER 65 HB1 SER 65 10.621 7.702 -8.661 455 HG SER 65 HG SER 65 10.481 5.969 -7.437 456 H GLN 66 H GLN 66 8.938 7.401 -4.664 457 HA GLN 66 HA GLN 66 6.098 7.794 -5.150 458 HB2 GLN 66 HB2 GLN 66 7.762 6.237 -3.201 459 HB3 GLN 66 HB1 GLN 66 6.052 6.281 -3.213 460 HG2 GLN 66 HG2 GLN 66 6.439 5.433 -5.775 461 HG3 GLN 66 HG1 GLN 66 8.039 5.064 -5.258 462 HE21 GLN 66 1HE2 GLN 66 4.823 4.184 -5.037 463 HE22 GLN 66 2HE2 GLN 66 5.095 2.513 -4.534 464 H ALA 67 H ALA 67 8.497 8.702 -2.654 465 HA ALA 67 HA ALA 67 6.697 8.679 -0.634 466 HB1 ALA 67 HB1 ALA 67 8.218 10.088 0.636 467 HB2 ALA 67 HB2 ALA 67 9.050 8.749 -0.241 468 HB3 ALA 67 HB3 ALA 67 9.171 10.372 -0.919 469 H ARG 68 H ARG 68 7.551 11.883 -2.149 470 HA ARG 68 HA ARG 68 6.287 13.307 -0.230 471 HB2 ARG 68 HB2 ARG 68 6.840 14.027 -3.094 472 HB3 ARG 68 HB1 ARG 68 6.173 15.214 -1.988 473 HG2 ARG 68 HG2 ARG 68 7.979 15.177 -0.455 474 HG3 ARG 68 HG1 ARG 68 8.652 13.699 -1.075 475 HD2 ARG 68 HD2 ARG 68 10.067 15.356 -1.935 476 HD3 ARG 68 HD1 ARG 68 9.135 14.740 -3.215 477 HE ARG 68 HE ARG 68 7.940 17.160 -2.117 478 HH11 ARG 68 1HH2 ARG 68 11.054 16.432 -3.859 479 HH12 ARG 68 2HH2 ARG 68 11.002 18.101 -4.446 480 HH21 ARG 68 1HH1 ARG 68 8.254 19.117 -2.762 481 HH22 ARG 68 2HH1 ARG 68 9.535 19.549 -3.882 482 H GLN 69 H GLN 69 4.557 12.564 -3.343 483 HA GLN 69 HA GLN 69 1.966 13.258 -2.304 484 HB2 GLN 69 HB2 GLN 69 2.520 13.092 -4.553 485 HB3 GLN 69 HB1 GLN 69 3.058 11.344 -4.412 486 HG2 GLN 69 HG2 GLN 69 0.648 10.768 -3.808 487 HG3 GLN 69 HG1 GLN 69 0.217 12.426 -4.217 488 HE21 GLN 69 1HE2 GLN 69 1.827 9.558 -5.569 489 HE22 GLN 69 2HE2 GLN 69 1.341 9.751 -7.254 490 H LEU 70 H LEU 70 3.527 9.965 -2.145 491 HA LEU 70 HA LEU 70 1.590 8.527 -1.223 492 HB2 LEU 70 HB2 LEU 70 3.709 7.801 -1.918 493 HB3 LEU 70 HB1 LEU 70 4.562 8.281 -0.442 494 HG LEU 70 HG LEU 70 2.122 6.474 -0.059 495 HD11 LEU 70 1HD1 LEU 70 2.898 5.736 -2.223 496 HD12 LEU 70 2HD1 LEU 70 4.528 5.442 -1.539 497 HD13 LEU 70 3HD1 LEU 70 3.097 4.533 -0.851 498 HD21 LEU 70 3HD2 LEU 70 3.716 7.013 1.624 499 HD22 LEU 70 1HD2 LEU 70 3.643 5.267 1.238 500 HD23 LEU 70 2HD2 LEU 70 5.090 6.299 0.791 501 H GLU 71 H GLU 71 3.884 10.277 0.975 502 HA GLU 71 HA GLU 71 2.744 9.827 3.488 503 HB2 GLU 71 HB2 GLU 71 4.038 12.303 2.342 504 HB3 GLU 71 HB1 GLU 71 3.585 11.993 3.974 505 HG2 GLU 71 HG2 GLU 71 5.065 9.831 3.785 506 HG3 GLU 71 HG1 GLU 71 5.735 10.486 2.244 507 H LYS 72 H LYS 72 1.829 12.413 1.124 508 HA LYS 72 HA LYS 72 0.162 13.649 2.912 509 HB2 LYS 72 HB2 LYS 72 0.688 13.779 0.021 510 HB3 LYS 72 HB1 LYS 72 -0.527 14.853 0.745 511 HG2 LYS 72 HG2 LYS 72 1.177 15.740 2.355 512 HG3 LYS 72 HG1 LYS 72 2.336 14.637 1.539 513 HD2 LYS 72 HD2 LYS 72 1.731 15.912 -0.595 514 HD3 LYS 72 HD1 LYS 72 0.856 17.035 0.385 515 HE2 LYS 72 HE2 LYS 72 3.029 17.908 -0.050 516 HE3 LYS 72 HE1 LYS 72 3.117 17.617 1.672 517 HZ1 LYS 72 HZ1 LYS 72 4.216 15.573 -0.218 518 HZ2 LYS 72 HZ2 LYS 72 4.962 16.843 0.585 519 HZ3 LYS 72 HZ3 LYS 72 4.354 15.672 1.364 520 H ILE 73 H ILE 73 -0.639 11.230 0.355 521 HA ILE 73 HA ILE 73 -3.289 11.785 0.481 522 HB ILE 73 HB ILE 73 -3.501 9.582 -0.816 523 HG12 ILE 73 2HG1 ILE 73 -0.519 9.469 -0.874 524 HG13 ILE 73 1HG1 ILE 73 -1.479 8.622 0.349 525 HG21 ILE 73 1HG2 ILE 73 -2.495 10.613 -2.764 526 HG22 ILE 73 2HG2 ILE 73 -3.289 11.856 -1.844 527 HG23 ILE 73 3HG2 ILE 73 -1.528 11.661 -1.805 528 HD11 ILE 73 HD3 ILE 73 -2.413 7.269 -1.511 529 HD12 ILE 73 HD1 ILE 73 -1.599 8.320 -2.718 530 HD13 ILE 73 HD2 ILE 73 -0.679 7.307 -1.607 531 H LEU 74 H LEU 74 -1.483 10.215 2.795 532 HA LEU 74 HA LEU 74 -2.684 9.942 4.613 533 HB2 LEU 74 HB2 LEU 74 -3.768 7.853 5.274 534 HB3 LEU 74 HB1 LEU 74 -4.604 8.657 3.989 535 HG LEU 74 HG LEU 74 -2.824 6.123 4.000 536 HD11 LEU 74 1HD1 LEU 74 -5.660 6.579 3.279 537 HD12 LEU 74 2HD1 LEU 74 -4.780 4.989 3.261 538 HD13 LEU 74 3HD1 LEU 74 -5.110 5.829 4.740 539 HD21 LEU 74 3HD2 LEU 74 -3.532 5.918 1.462 540 HD22 LEU 74 1HD2 LEU 74 -4.049 7.594 1.583 541 HD23 LEU 74 2HD2 LEU 74 -2.323 7.129 1.718 542 H GLY 75 H GLY 75 -0.448 8.480 2.695 543 HA2 GLY 75 HA2 GLY 75 1.611 7.282 3.082 544 HA3 GLY 75 HA1 GLY 75 1.337 7.505 4.790 545 H ILE 76 H ILE 76 -0.836 6.057 2.531 546 HA ILE 76 HA ILE 76 -1.833 4.363 2.153 547 HB ILE 76 HB ILE 76 -0.771 2.569 1.352 548 HG12 ILE 76 2HG1 ILE 76 1.910 3.280 2.538 549 HG13 ILE 76 1HG1 ILE 76 0.782 2.067 3.204 550 HG21 ILE 76 1HG2 ILE 76 -0.712 4.570 0.053 551 HG22 ILE 76 2HG2 ILE 76 0.744 5.073 0.884 552 HG23 ILE 76 3HG2 ILE 76 0.748 3.711 -0.267 553 HD11 ILE 76 HD3 ILE 76 2.415 1.023 1.869 554 HD12 ILE 76 HD1 ILE 76 0.865 0.960 0.903 555 HD13 ILE 76 HD2 ILE 76 2.165 2.022 0.501 556 H LYS 77 H LYS 77 -1.306 4.666 5.282 557 HA LYS 77 HA LYS 77 -1.588 2.136 6.487 558 HB2 LYS 77 HB2 LYS 77 -1.729 3.264 8.456 559 HB3 LYS 77 HB1 LYS 77 -0.383 3.806 7.481 560 HG2 LYS 77 HG2 LYS 77 -1.734 5.779 6.755 561 HG3 LYS 77 HG1 LYS 77 -3.104 5.122 7.838 562 HD2 LYS 77 HD2 LYS 77 -1.427 5.517 9.777 563 HD3 LYS 77 HD1 LYS 77 -0.318 6.318 8.599 564 HE2 LYS 77 HE2 LYS 77 -2.923 7.492 8.533 565 HE3 LYS 77 HE1 LYS 77 -2.269 7.507 10.164 566 HZ1 LYS 77 HZ1 LYS 77 -0.922 8.516 7.832 567 HZ2 LYS 77 HZ2 LYS 77 -1.601 9.427 9.030 568 HZ3 LYS 77 HZ3 LYS 77 -0.333 8.532 9.407 569 H LEU 78 H LEU 78 -3.597 1.305 7.430 570 HA LEU 78 HA LEU 78 -6.006 2.799 6.536 571 HB2 LEU 78 HB2 LEU 78 -5.418 0.053 5.648 572 HB3 LEU 78 HB1 LEU 78 -7.084 0.380 6.190 573 HG LEU 78 HG LEU 78 -5.397 1.756 4.114 574 HD11 LEU 78 1HD1 LEU 78 -6.808 0.779 2.456 575 HD12 LEU 78 2HD1 LEU 78 -5.816 -0.386 3.334 576 HD13 LEU 78 3HD1 LEU 78 -7.542 -0.250 3.781 577 HD21 LEU 78 3HD2 LEU 78 -7.633 2.620 3.176 578 HD22 LEU 78 1HD2 LEU 78 -8.425 2.111 4.583 579 HD23 LEU 78 2HD2 LEU 78 -7.160 3.397 4.677 580 H VAL 79 H VAL 79 -7.823 1.803 9.331 581 HA VAL 79 HA VAL 79 -8.372 2.202 6.562 582 HB VAL 79 HB VAL 79 -10.637 2.244 7.071 583 HG11 VAL 79 1HG1 VAL 79 -10.820 0.008 7.981 584 HG12 VAL 79 2HG1 VAL 79 -9.482 0.004 6.927 585 HG13 VAL 79 3HG1 VAL 79 -9.108 0.229 8.679 586 HG21 VAL 79 3HG2 VAL 79 -9.838 2.357 9.889 587 HG22 VAL 79 1HG2 VAL 79 -10.805 3.574 8.905 588 HG23 VAL 79 2HG2 VAL 79 -11.480 1.993 9.344 589 H THR 80 H THR 80 -9.848 3.862 5.819 590 HA THR 80 HA THR 80 -9.521 6.837 6.568 591 HB THR 80 HB THR 80 -10.910 7.018 4.527 592 HG1 THR 80 HG1 THR 80 -11.564 5.150 3.679 593 HG21 THR 80 1HG2 THR 80 -8.988 6.458 3.106 594 HG22 THR 80 2HG2 THR 80 -8.550 7.430 4.569 595 HG23 THR 80 3HG2 THR 80 -8.132 5.745 4.428 596 HA PRO 81 HA PRO 81 -13.562 5.979 8.605 597 HB2 PRO 81 HB1 PRO 81 -13.277 8.349 10.056 598 HB3 PRO 81 HB2 PRO 81 -13.032 6.669 10.588 599 HG2 PRO 81 HG1 PRO 81 -11.014 8.778 9.976 600 HG3 PRO 81 HG2 PRO 81 -11.021 7.506 11.166 601 HD2 PRO 81 HD1 PRO 81 -10.092 7.681 8.392 602 HD3 PRO 81 HD2 PRO 81 -9.676 6.333 9.394 603 H LEU 82 H LEU 82 -11.482 8.432 6.988 604 HA LEU 82 HA LEU 82 -13.406 8.570 4.921 605 HB2 LEU 82 HB2 LEU 82 -13.831 10.891 5.052 606 HB3 LEU 82 HB1 LEU 82 -14.109 10.290 6.714 607 HG LEU 82 HG LEU 82 -11.734 11.882 5.650 608 HD11 LEU 82 1HD1 LEU 82 -13.998 12.614 7.496 609 HD12 LEU 82 2HD1 LEU 82 -12.769 13.680 6.942 610 HD13 LEU 82 3HD1 LEU 82 -13.961 13.072 5.807 611 HD21 LEU 82 3HD2 LEU 82 -10.960 10.494 7.614 612 HD22 LEU 82 1HD2 LEU 82 -10.953 12.128 8.001 613 HD23 LEU 82 2HD2 LEU 82 -12.339 11.071 8.577 614 H GLU 83 H GLU 83 -12.669 9.881 3.107 615 HA GLU 83 HA GLU 83 -9.792 9.474 2.427 616 HB2 GLU 83 HB2 GLU 83 -11.593 9.115 0.843 617 HB3 GLU 83 HB1 GLU 83 -11.930 10.809 0.790 618 HG2 GLU 83 HG2 GLU 83 -9.564 11.198 -0.025 619 HG3 GLU 83 HG1 GLU 83 -9.290 9.446 0.300 620 H ASN 84 H ASN 84 -8.197 10.775 3.050 621 HA ASN 84 HA ASN 84 -8.708 13.735 3.142 622 HB2 ASN 84 HB2 ASN 84 -8.213 12.712 5.437 623 HB3 ASN 84 HB1 ASN 84 -6.676 12.357 4.753 624 HD21 ASN 84 1HD2 ASN 84 -5.110 13.781 5.268 625 HD22 ASN 84 2HD2 ASN 84 -5.497 15.475 5.608 626 H ASN 85 H ASN 85 -6.934 15.040 2.578 627 HA ASN 85 HA ASN 85 -4.480 13.825 1.823 628 HB2 ASN 85 HB2 ASN 85 -5.689 14.173 -0.393 629 HB3 ASN 85 HB1 ASN 85 -5.656 15.909 -0.082 630 HD21 ASN 85 1HD2 ASN 85 -4.360 16.303 -1.931 631 HD22 ASN 85 2HD2 ASN 85 -2.725 15.672 -2.163 632 H GLU 86 H GLU 86 -2.731 15.111 2.213 633 HA GLU 86 HA GLU 86 -3.169 17.524 3.924 634 HB2 GLU 86 HB2 GLU 86 -0.866 15.786 3.495 635 HB3 GLU 86 HB1 GLU 86 -0.658 17.576 3.880 636 HG2 GLU 86 HG2 GLU 86 -1.948 17.297 5.795 637 HG3 GLU 86 HG1 GLU 86 -2.549 15.661 5.272 638 H GLU 87 H GLU 87 -3.506 19.456 2.961 639 HA GLU 87 HA GLU 87 -2.928 19.895 0.215 640 HB2 GLU 87 HB2 GLU 87 -3.902 21.957 0.441 641 HB3 GLU 87 HB1 GLU 87 -4.839 20.772 1.424 642 HG2 GLU 87 HG2 GLU 87 -3.882 21.725 3.593 643 HG3 GLU 87 HG1 GLU 87 -2.891 22.810 2.626 644 H SER 88 H SER 88 -0.629 19.624 2.353 645 HA SER 88 HA SER 88 0.788 21.941 2.760 646 HB2 SER 88 HB2 SER 88 2.685 20.263 2.986 647 HB3 SER 88 HB1 SER 88 1.179 20.354 4.078 648 HG SER 88 HG SER 88 1.922 18.193 3.390 649 H GLU 89 H GLU 89 0.776 19.803 -0.178 650 HA GLU 89 HA GLU 89 2.180 21.498 -1.854 651 HB2 GLU 89 HB2 GLU 89 4.185 21.246 -0.696 652 HB3 GLU 89 HB1 GLU 89 4.133 19.476 -0.685 653 HG2 GLU 89 HG2 GLU 89 4.146 19.448 -3.189 654 HG3 GLU 89 HG1 GLU 89 4.420 21.258 -3.133 655 H LYS 90 H LYS 90 0.952 21.243 -3.492 656 HA LYS 90 HA LYS 90 -0.097 18.863 -4.416 657 HB2 LYS 90 HB2 LYS 90 -1.258 21.037 -4.695 658 HB3 LYS 90 HB1 LYS 90 0.192 21.432 -5.792 659 HG2 LYS 90 HG2 LYS 90 -0.611 19.892 -7.446 660 HG3 LYS 90 HG1 LYS 90 -1.437 19.067 -6.298 661 HD2 LYS 90 HD2 LYS 90 -3.241 20.732 -6.228 662 HD3 LYS 90 HD1 LYS 90 -2.358 21.891 -7.105 663 HE2 LYS 90 HE2 LYS 90 -2.712 19.121 -8.437 664 HE3 LYS 90 HE1 LYS 90 -4.140 20.146 -8.201 665 HZ1 LYS 90 HZ1 LYS 90 -2.998 20.174 -10.159 666 HZ2 LYS 90 HZ2 LYS 90 -3.028 21.767 -9.618 667 HZ3 LYS 90 HZ3 LYS 90 -1.658 20.924 -9.605 668 H GLU 91 H GLU 91 2.588 20.768 -5.661 669 HA GLU 91 HA GLU 91 2.532 19.445 -8.160 670 HB2 GLU 91 HB2 GLU 91 4.471 21.188 -6.860 671 HB3 GLU 91 HB1 GLU 91 4.909 20.624 -8.401 672 HG2 GLU 91 HG2 GLU 91 2.546 21.717 -9.093 673 HG3 GLU 91 HG1 GLU 91 2.609 22.554 -7.553 674 H PHE 92 H PHE 92 3.475 17.439 -8.732 675 HA PHE 92 HA PHE 92 5.496 16.325 -6.927 676 HB2 PHE 92 HB2 PHE 92 3.380 15.712 -5.909 677 HB3 PHE 92 HB1 PHE 92 2.782 15.149 -7.490 678 HD1 PHE 92 HD1 PHE 92 5.302 14.482 -4.705 679 HD2 PHE 92 HD2 PHE 92 3.092 13.051 -8.062 680 HE1 PHE 92 HE1 PHE 92 6.264 12.194 -4.347 681 HE2 PHE 92 HE2 PHE 92 3.762 10.723 -7.476 682 HZ PHE 92 HZ PHE 92 5.467 10.368 -5.576 683 H ASP 93 H ASP 93 7.100 15.645 -7.999 684 HA ASP 93 HA ASP 93 7.326 13.619 -9.855 685 HB2 ASP 93 HB2 ASP 93 6.393 14.971 -11.384 686 HB3 ASP 93 HB1 ASP 93 7.310 16.403 -11.033 687 H ASP 94 H ASP 94 9.171 13.162 -10.452 688 HA ASP 94 HA ASP 94 11.523 13.939 -8.813 689 HB2 ASP 94 HB2 ASP 94 12.163 11.719 -8.542 690 HB3 ASP 94 HB1 ASP 94 10.493 11.970 -7.959 691 H THR 95 H THR 95 10.456 13.439 -12.059 692 HA THR 95 HA THR 95 12.667 12.529 -13.308 693 HB THR 95 HB THR 95 10.878 14.781 -14.251 694 HG1 THR 95 HG1 THR 95 9.500 13.231 -13.694 695 HG21 THR 95 1HG2 THR 95 12.025 12.408 -15.833 696 HG22 THR 95 2HG2 THR 95 11.027 13.743 -16.287 697 HG23 THR 95 3HG2 THR 95 12.724 14.045 -15.933 698 H GLY 96 H GLY 96 12.350 15.868 -12.214 699 HA2 GLY 96 HA2 GLY 96 14.595 16.813 -13.687 700 HA3 GLY 96 HA1 GLY 96 13.622 17.645 -12.471 701 H LEU 97 H LEU 97 14.463 14.969 -10.830 702 HA LEU 97 HA LEU 97 17.059 15.978 -9.918 703 HB2 LEU 97 HB2 LEU 97 15.288 15.864 -8.254 704 HB3 LEU 97 HB1 LEU 97 14.870 14.271 -8.589 705 HG LEU 97 HG LEU 97 17.008 13.471 -7.565 706 HD11 LEU 97 1HD1 LEU 97 17.641 16.404 -7.088 707 HD12 LEU 97 2HD1 LEU 97 18.419 15.052 -6.267 708 HD13 LEU 97 3HD1 LEU 97 18.606 15.118 -7.968 709 HD21 LEU 97 3HD2 LEU 97 16.126 13.982 -5.278 710 HD22 LEU 97 1HD2 LEU 97 15.311 15.363 -6.036 711 HD23 LEU 97 2HD2 LEU 97 14.877 13.757 -6.523 712 H THR 98 H THR 98 15.334 12.964 -10.603 713 HA THR 98 HA THR 98 17.530 11.231 -9.958 714 HB THR 98 HB THR 98 15.737 9.517 -10.469 715 HG1 THR 98 HG1 THR 98 13.608 11.047 -10.713 716 HG21 THR 98 1HG2 THR 98 15.880 10.688 -8.217 717 HG22 THR 98 2HG2 THR 98 14.646 11.863 -8.765 718 HG23 THR 98 3HG2 THR 98 14.317 10.114 -8.629 719 H LEU 99 H LEU 99 15.492 11.556 -12.865 720 HA LEU 99 HA LEU 99 17.702 10.657 -14.651 721 HB2 LEU 99 HB2 LEU 99 15.282 10.436 -15.297 722 HB3 LEU 99 HB1 LEU 99 15.101 12.223 -15.192 723 HG LEU 99 HG LEU 99 16.541 12.431 -17.149 724 HD11 LEU 99 1HD1 LEU 99 17.310 10.324 -18.435 725 HD12 LEU 99 2HD1 LEU 99 18.176 10.789 -17.063 726 HD13 LEU 99 3HD1 LEU 99 16.958 9.502 -16.927 727 HD21 LEU 99 3HD2 LEU 99 14.189 12.064 -17.539 728 HD22 LEU 99 1HD2 LEU 99 14.956 10.889 -18.728 729 HD23 LEU 99 2HD2 LEU 99 14.285 10.353 -17.216 730 H GLY 100 H GLY 100 16.715 13.465 -13.029 731 HA2 GLY 100 HA2 GLY 100 17.582 15.580 -12.901 732 HA3 GLY 100 HA1 GLY 100 19.082 15.077 -13.550 733 H ASP 101 H ASP 101 15.667 15.269 -14.939 734 HA ASP 101 HA ASP 101 16.795 16.401 -17.364 735 HB2 ASP 101 HB2 ASP 101 14.872 14.561 -16.945 736 HB3 ASP 101 HB1 ASP 101 13.880 15.987 -16.960 737 H VAL 102 H VAL 102 17.422 18.168 -15.621 738 HA VAL 102 HA VAL 102 15.865 20.479 -16.444 739 HB VAL 102 HB VAL 102 17.508 21.346 -14.350 740 HG11 VAL 102 1HG1 VAL 102 15.620 21.102 -12.933 741 HG12 VAL 102 2HG1 VAL 102 14.830 21.389 -14.432 742 HG13 VAL 102 3HG1 VAL 102 14.969 19.722 -13.913 743 HG21 VAL 102 3HG2 VAL 102 18.598 19.320 -14.240 744 HG22 VAL 102 1HG2 VAL 102 17.710 19.644 -12.703 745 HG23 VAL 102 2HG2 VAL 102 17.094 18.430 -13.884 746 H VAL 103 H VAL 103 18.839 22.240 -17.547 747 HA VAL 103 HA VAL 103 16.543 22.783 -15.735 748 HB VAL 103 HB VAL 103 17.956 24.798 -17.536 749 HG11 VAL 103 1HG1 VAL 103 16.704 26.452 -15.917 750 HG12 VAL 103 2HG1 VAL 103 15.819 25.617 -17.144 751 HG13 VAL 103 3HG1 VAL 103 15.866 24.941 -15.465 752 HG21 VAL 103 3HG2 VAL 103 18.997 25.532 -15.348 753 HG22 VAL 103 1HG2 VAL 103 18.312 24.033 -14.682 754 HG23 VAL 103 2HG2 VAL 103 19.532 24.020 -15.970 755 H ASN 104 H ASN 104 14.666 22.623 -16.183 756 HA ASN 104 HA ASN 104 13.822 22.073 -18.886 757 HB2 ASN 104 HB2 ASN 104 13.001 20.611 -17.194 758 HB3 ASN 104 HB1 ASN 104 12.247 21.896 -16.274 759 HD21 ASN 104 1HD2 ASN 104 10.385 20.239 -16.520 760 HD22 ASN 104 2HD2 ASN 104 9.553 20.171 -18.064 761 H ILE 105 H ILE 105 13.013 23.639 -20.174 762 HA ILE 105 HA ILE 105 12.150 26.358 -19.024 763 HB ILE 105 HB ILE 105 13.244 27.401 -20.696 764 HG12 ILE 105 2HG1 ILE 105 14.036 24.918 -22.089 765 HG13 ILE 105 1HG1 ILE 105 12.691 26.076 -22.642 766 HG21 ILE 105 1HG2 ILE 105 14.643 26.473 -18.938 767 HG22 ILE 105 2HG2 ILE 105 15.118 25.118 -20.017 768 HG23 ILE 105 3HG2 ILE 105 15.603 26.813 -20.412 769 HD11 ILE 105 HD3 ILE 105 14.359 26.691 -23.946 770 HD12 ILE 105 HD1 ILE 105 14.297 27.929 -22.694 771 HD13 ILE 105 HD2 ILE 105 15.600 26.718 -22.680 772 H LYS 106 H LYS 106 10.994 23.686 -20.482 773 HA LYS 106 HA LYS 106 9.142 24.965 -22.265 774 HB2 LYS 106 HB2 LYS 106 10.327 23.291 -23.049 775 HB3 LYS 106 HB1 LYS 106 10.007 22.045 -21.833 776 HG2 LYS 106 HG2 LYS 106 7.869 21.700 -22.716 777 HG3 LYS 106 HG1 LYS 106 7.995 23.185 -23.746 778 HD2 LYS 106 HD2 LYS 106 9.825 22.431 -25.015 779 HD3 LYS 106 HD1 LYS 106 10.135 21.043 -24.026 780 HE2 LYS 106 HE2 LYS 106 7.503 21.549 -25.519 781 HE3 LYS 106 HE1 LYS 106 8.888 20.766 -26.384 782 HZ1 LYS 106 HZ1 LYS 106 7.652 19.046 -25.641 783 HZ2 LYS 106 HZ2 LYS 106 8.862 19.125 -24.662 784 HZ3 LYS 106 HZ3 LYS 106 7.414 19.629 -24.133 785 H GLU 107 H GLU 107 9.209 23.393 -19.219 786 HA GLU 107 HA GLU 107 6.314 23.640 -18.603 787 HB2 GLU 107 HB2 GLU 107 7.979 21.198 -18.272 788 HB3 GLU 107 HB1 GLU 107 6.384 21.380 -17.621 789 HG2 GLU 107 HG2 GLU 107 5.377 21.756 -19.718 790 HG3 GLU 107 HG1 GLU 107 6.839 21.568 -20.620 791 H GLY 108 H GLY 108 9.791 23.260 -17.637 792 HA2 GLY 108 HA2 GLY 108 9.304 22.669 -14.983 793 HA3 GLY 108 HA1 GLY 108 10.787 23.407 -15.719 794 H LYS 109 H LYS 109 10.508 23.857 -13.228 795 HA LYS 109 HA LYS 109 10.001 26.770 -13.116 796 HB2 LYS 109 HB2 LYS 109 8.998 24.700 -11.070 797 HB3 LYS 109 HB1 LYS 109 8.944 26.440 -10.825 798 HG2 LYS 109 HG2 LYS 109 7.570 26.538 -12.984 799 HG3 LYS 109 HG1 LYS 109 7.363 24.883 -12.846 800 HD2 LYS 109 HD2 LYS 109 6.471 25.193 -10.392 801 HD3 LYS 109 HD1 LYS 109 6.490 26.915 -10.737 802 HE2 LYS 109 HE2 LYS 109 5.278 26.521 -13.012 803 HE3 LYS 109 HE1 LYS 109 4.926 24.970 -12.291 804 HZ1 LYS 109 HZ1 LYS 109 4.171 26.048 -10.344 805 HZ2 LYS 109 HZ2 LYS 109 4.195 27.532 -10.935 806 HZ3 LYS 109 HZ3 LYS 109 3.198 26.349 -11.628 807 H LYS 110 H LYS 110 12.568 25.800 -13.435 808 HA LYS 110 HA LYS 110 14.016 25.384 -10.984 809 HB2 LYS 110 HB2 LYS 110 14.570 24.225 -13.124 810 HB3 LYS 110 HB1 LYS 110 14.938 25.827 -13.828 811 HG2 LYS 110 HG2 LYS 110 16.370 24.635 -11.435 812 HG3 LYS 110 HG1 LYS 110 16.667 24.114 -13.042 813 HD2 LYS 110 HD2 LYS 110 17.259 26.719 -13.443 814 HD3 LYS 110 HD1 LYS 110 16.967 26.806 -11.710 815 HE2 LYS 110 HE2 LYS 110 18.603 25.304 -11.118 816 HE3 LYS 110 HE1 LYS 110 19.037 25.125 -12.962 817 HZ1 LYS 110 HZ1 LYS 110 20.677 26.639 -11.724 818 HZ2 LYS 110 HZ2 LYS 110 19.788 27.402 -12.724 819 HZ3 LYS 110 HZ3 LYS 110 19.476 27.463 -11.147 820 H LEU 111 H LEU 111 13.580 27.206 -9.642 821 HA LEU 111 HA LEU 111 13.480 29.636 -10.867 822 HB2 LEU 111 HB2 LEU 111 13.111 28.965 -7.993 823 HB3 LEU 111 HB1 LEU 111 12.584 30.442 -8.657 824 HG LEU 111 HG LEU 111 11.590 27.845 -9.682 825 HD11 LEU 111 1HD1 LEU 111 10.150 29.528 -7.676 826 HD12 LEU 111 2HD1 LEU 111 9.629 27.980 -8.258 827 HD13 LEU 111 3HD1 LEU 111 10.963 27.974 -7.233 828 HD21 LEU 111 3HD2 LEU 111 10.496 30.539 -9.994 829 HD22 LEU 111 1HD2 LEU 111 11.338 29.450 -11.250 830 HD23 LEU 111 2HD2 LEU 111 9.662 29.166 -10.552 831 H GLU 112 H GLU 112 14.459 31.653 -9.884 832 HA GLU 112 HA GLU 112 17.130 31.895 -10.154 833 HB2 GLU 112 HB2 GLU 112 15.311 33.783 -9.996 834 HB3 GLU 112 HB1 GLU 112 15.414 33.607 -8.258 835 HG2 GLU 112 HG2 GLU 112 17.857 34.429 -8.424 836 HG3 GLU 112 HG1 GLU 112 17.829 34.157 -10.078 837 H HIS 113 H HIS 113 15.759 31.012 -7.000 838 HA HIS 113 HA HIS 113 18.255 31.648 -5.767 839 HB2 HIS 113 HB2 HIS 113 16.883 31.340 -3.690 840 HB3 HIS 113 HB1 HIS 113 16.254 32.528 -4.852 841 HD2 HIS 113 HD2 HIS 113 15.150 29.810 -2.706 842 HE1 HIS 113 HE1 HIS 113 12.576 29.457 -6.083 843 HE2 HIS 113 HE2 HIS 113 13.051 28.676 -3.589 844 H HIS 114 H HIS 114 17.022 29.030 -7.384 845 HA HIS 114 HA HIS 114 17.790 26.918 -5.527 846 HB2 HIS 114 HB2 HIS 114 17.030 26.722 -8.527 847 HB3 HIS 114 HB1 HIS 114 17.090 25.387 -7.352 848 HD2 HIS 114 HD2 HIS 114 15.195 26.942 -5.056 849 HE1 HIS 114 HE1 HIS 114 12.357 25.840 -7.977 850 HE2 HIS 114 HE2 HIS 114 12.733 26.326 -5.552 Start of MODEL 10 1 H1 GLU 13 H1 GLU 13 26.484 -7.603 -7.230 2 H2 GLU 13 H2 GLU 13 25.910 -6.326 -8.231 3 H3 GLU 13 H3 GLU 13 26.380 -6.065 -6.763 4 HA GLU 13 HA GLU 13 24.228 -6.093 -6.741 5 HB2 GLU 13 HB2 GLU 13 22.930 -8.369 -7.104 6 HB3 GLU 13 HB1 GLU 13 23.783 -7.746 -8.587 7 HG2 GLU 13 HG2 GLU 13 25.430 -9.371 -8.419 8 HG3 GLU 13 HG1 GLU 13 25.159 -9.792 -6.786 9 H ASN 14 H ASN 14 22.773 -7.403 -4.887 10 HA ASN 14 HA ASN 14 23.627 -8.784 -2.917 11 HB2 ASN 14 HB2 ASN 14 25.457 -7.146 -2.615 12 HB3 ASN 14 HB1 ASN 14 24.386 -5.866 -2.607 13 HD21 ASN 14 1HD2 ASN 14 25.512 -5.468 -0.347 14 HD22 ASN 14 2HD2 ASN 14 24.776 -6.214 1.031 15 H ALA 15 H ALA 15 21.859 -9.269 -2.034 16 HA ALA 15 HA ALA 15 19.413 -7.977 -2.496 17 HB1 ALA 15 HB1 ALA 15 20.383 -10.269 -0.632 18 HB2 ALA 15 HB2 ALA 15 18.626 -10.021 -1.089 19 HB3 ALA 15 HB3 ALA 15 19.929 -10.436 -2.234 20 H GLU 16 H GLU 16 21.639 -7.720 0.205 21 HA GLU 16 HA GLU 16 19.744 -6.915 2.161 22 HB2 GLU 16 HB2 GLU 16 22.684 -6.365 1.761 23 HB3 GLU 16 HB1 GLU 16 21.803 -6.270 3.341 24 HG2 GLU 16 HG2 GLU 16 22.298 -8.786 1.824 25 HG3 GLU 16 HG1 GLU 16 23.029 -8.303 3.423 26 H LEU 17 H LEU 17 20.390 -5.337 -0.478 27 HA LEU 17 HA LEU 17 19.829 -2.609 0.608 28 HB2 LEU 17 HB2 LEU 17 21.055 -3.679 -1.968 29 HB3 LEU 17 HB1 LEU 17 20.847 -1.979 -1.546 30 HG LEU 17 HG LEU 17 22.915 -3.678 -0.149 31 HD11 LEU 17 1HD1 LEU 17 24.295 -1.942 -1.292 32 HD12 LEU 17 2HD1 LEU 17 23.580 -3.092 -2.324 33 HD13 LEU 17 3HD1 LEU 17 22.863 -1.523 -2.264 34 HD21 LEU 17 3HD2 LEU 17 21.972 -2.026 1.567 35 HD22 LEU 17 1HD2 LEU 17 23.423 -1.466 0.828 36 HD23 LEU 17 2HD2 LEU 17 21.915 -0.855 0.237 37 H GLU 18 H GLU 18 17.921 -4.913 -0.436 38 HA GLU 18 HA GLU 18 16.433 -3.242 -2.322 39 HB2 GLU 18 HB2 GLU 18 16.969 -6.242 -2.740 40 HB3 GLU 18 HB1 GLU 18 16.070 -5.061 -3.713 41 HG2 GLU 18 HG2 GLU 18 18.071 -3.675 -4.113 42 HG3 GLU 18 HG1 GLU 18 18.966 -4.852 -3.076 43 H ILE 19 H ILE 19 15.934 -3.781 0.390 44 HA ILE 19 HA ILE 19 13.249 -5.125 0.474 45 HB ILE 19 HB ILE 19 13.936 -5.893 2.722 46 HG12 ILE 19 2HG1 ILE 19 16.644 -5.157 1.957 47 HG13 ILE 19 1HG1 ILE 19 15.667 -4.373 3.148 48 HG21 ILE 19 1HG2 ILE 19 15.630 -6.878 0.422 49 HG22 ILE 19 2HG2 ILE 19 14.901 -7.804 1.708 50 HG23 ILE 19 3HG2 ILE 19 13.871 -7.160 0.426 51 HD11 ILE 19 HD3 ILE 19 17.365 -5.949 3.960 52 HD12 ILE 19 HD1 ILE 19 15.726 -6.319 4.733 53 HD13 ILE 19 HD2 ILE 19 16.290 -7.323 3.498 54 H VAL 20 H VAL 20 11.748 -4.489 2.163 55 HA VAL 20 HA VAL 20 11.539 -1.710 2.816 56 HB VAL 20 HB VAL 20 9.770 -3.321 2.373 57 HG11 VAL 20 1HG1 VAL 20 8.682 -4.483 4.171 58 HG12 VAL 20 2HG1 VAL 20 10.408 -5.091 4.006 59 HG13 VAL 20 3HG1 VAL 20 9.890 -3.955 5.258 60 HG21 VAL 20 3HG2 VAL 20 9.604 -0.967 3.191 61 HG22 VAL 20 1HG2 VAL 20 8.221 -2.028 3.614 62 HG23 VAL 20 2HG2 VAL 20 9.436 -1.488 4.804 63 H THR 21 H THR 21 12.099 -0.763 4.947 64 HA THR 21 HA THR 21 13.906 -2.398 6.363 65 HB THR 21 HB THR 21 12.812 0.245 7.567 66 HG1 THR 21 HG1 THR 21 14.783 -0.183 5.529 67 HG21 THR 21 1HG2 THR 21 15.477 -1.145 7.594 68 HG22 THR 21 2HG2 THR 21 15.266 0.493 8.290 69 HG23 THR 21 3HG2 THR 21 14.393 -0.934 8.932 70 H ASP 22 H ASP 22 10.807 -1.257 7.316 71 HA ASP 22 HA ASP 22 10.314 -3.246 9.063 72 HB2 ASP 22 HB2 ASP 22 11.872 -2.439 10.548 73 HB3 ASP 22 HB1 ASP 22 11.523 -0.708 10.254 74 H TYR 23 H TYR 23 8.262 -3.096 8.114 75 HA TYR 23 HA TYR 23 7.290 -0.739 6.948 76 HB2 TYR 23 HB2 TYR 23 7.149 -2.987 5.966 77 HB3 TYR 23 HB1 TYR 23 5.828 -3.391 6.999 78 HD1 TYR 23 HD1 TYR 23 6.726 -0.522 4.618 79 HD2 TYR 23 HD2 TYR 23 3.638 -3.244 5.910 80 HE1 TYR 23 HE1 TYR 23 5.073 0.636 3.325 81 HE2 TYR 23 HE2 TYR 23 2.036 -2.056 4.656 82 HH TYR 23 HH TYR 23 1.573 -0.101 3.281 83 H TYR 24 H TYR 24 5.197 0.107 6.997 84 HA TYR 24 HA TYR 24 4.613 1.060 9.725 85 HB2 TYR 24 HB2 TYR 24 3.130 1.739 7.272 86 HB3 TYR 24 HB1 TYR 24 3.068 2.486 8.889 87 HD1 TYR 24 HD1 TYR 24 5.012 3.911 9.585 88 HD2 TYR 24 HD2 TYR 24 4.784 2.296 5.662 89 HE1 TYR 24 HE1 TYR 24 6.510 5.681 8.778 90 HE2 TYR 24 HE2 TYR 24 6.143 4.242 4.776 91 HH TYR 24 HH TYR 24 7.398 6.840 6.755 92 H LYS 25 H LYS 25 3.283 0.424 11.204 93 HA LYS 25 HA LYS 25 1.269 -1.494 10.539 94 HB2 LYS 25 HB2 LYS 25 2.492 -0.652 13.151 95 HB3 LYS 25 HB1 LYS 25 1.310 -1.933 12.926 96 HG2 LYS 25 HG2 LYS 25 2.958 -3.122 11.485 97 HG3 LYS 25 HG1 LYS 25 4.146 -1.914 11.631 98 HD2 LYS 25 HD2 LYS 25 3.045 -3.666 13.868 99 HD3 LYS 25 HD1 LYS 25 4.573 -3.834 13.040 100 HE2 LYS 25 HE2 LYS 25 3.738 -1.545 14.830 101 HE3 LYS 25 HE1 LYS 25 4.768 -2.878 15.279 102 HZ1 LYS 25 HZ1 LYS 25 6.331 -2.046 13.377 103 HZ2 LYS 25 HZ2 LYS 25 5.439 -0.654 13.563 104 HZ3 LYS 25 HZ3 LYS 25 6.347 -1.319 14.775 105 H ILE 26 H ILE 26 1.373 1.887 11.195 106 HA ILE 26 HA ILE 26 -1.205 2.026 12.774 107 HB ILE 26 HB ILE 26 -1.232 4.266 12.412 108 HG12 ILE 26 2HG1 ILE 26 0.905 3.905 10.320 109 HG13 ILE 26 1HG1 ILE 26 -0.671 4.485 10.296 110 HG21 ILE 26 1HG2 ILE 26 1.517 3.216 13.047 111 HG22 ILE 26 2HG2 ILE 26 0.986 4.934 13.415 112 HG23 ILE 26 3HG2 ILE 26 0.243 3.655 14.252 113 HD11 ILE 26 HD3 ILE 26 1.729 6.139 10.961 114 HD12 ILE 26 HD1 ILE 26 0.141 6.526 10.395 115 HD13 ILE 26 HD2 ILE 26 0.289 6.350 12.087 116 H ILE 27 H ILE 27 -0.362 1.992 9.360 117 HA ILE 27 HA ILE 27 -2.915 2.462 8.501 118 HB ILE 27 HB ILE 27 -2.071 1.648 6.275 119 HG12 ILE 27 2HG1 ILE 27 0.670 1.292 7.731 120 HG13 ILE 27 1HG1 ILE 27 -0.472 -0.101 7.538 121 HG21 ILE 27 1HG2 ILE 27 -0.350 3.498 6.153 122 HG22 ILE 27 2HG2 ILE 27 -1.831 3.873 7.170 123 HG23 ILE 27 3HG2 ILE 27 -0.161 3.389 7.834 124 HD11 ILE 27 HD3 ILE 27 -0.179 0.592 5.057 125 HD12 ILE 27 HD1 ILE 27 1.049 1.686 5.650 126 HD13 ILE 27 HD2 ILE 27 1.369 0.081 5.943 127 H LYS 28 H LYS 28 -1.507 -0.387 9.620 128 HA LYS 28 HA LYS 28 -2.535 -2.228 8.606 129 HB2 LYS 28 HB2 LYS 28 -0.930 -2.462 10.581 130 HB3 LYS 28 HB1 LYS 28 -2.255 -2.646 11.631 131 HG2 LYS 28 HG2 LYS 28 -2.951 -4.714 10.041 132 HG3 LYS 28 HG1 LYS 28 -1.480 -4.303 9.229 133 HD2 LYS 28 HD2 LYS 28 -0.539 -5.890 10.686 134 HD3 LYS 28 HD1 LYS 28 -0.332 -4.480 11.593 135 HE2 LYS 28 HE2 LYS 28 -2.870 -4.995 12.413 136 HE3 LYS 28 HE1 LYS 28 -2.637 -6.580 11.703 137 HZ1 LYS 28 HZ1 LYS 28 -0.482 -6.494 13.119 138 HZ2 LYS 28 HZ2 LYS 28 -1.181 -5.501 14.010 139 HZ3 LYS 28 HZ3 LYS 28 -1.894 -6.944 13.820 140 H THR 29 H THR 29 -4.376 -1.474 11.722 141 HA THR 29 HA THR 29 -6.245 -3.459 11.153 142 HB THR 29 HB THR 29 -6.187 -1.065 13.180 143 HG1 THR 29 HG1 THR 29 -5.332 -3.743 13.366 144 HG21 THR 29 1HG2 THR 29 -7.644 -3.656 13.387 145 HG22 THR 29 2HG2 THR 29 -7.411 -2.499 14.780 146 HG23 THR 29 3HG2 THR 29 -8.337 -2.020 13.421 147 H ALA 30 H ALA 30 -6.124 -0.192 10.254 148 HA ALA 30 HA ALA 30 -8.929 0.128 9.733 149 HB1 ALA 30 HB1 ALA 30 -7.323 2.030 10.220 150 HB2 ALA 30 HB2 ALA 30 -6.306 1.643 8.888 151 HB3 ALA 30 HB3 ALA 30 -7.906 2.198 8.491 152 H ARG 31 H ARG 31 -6.126 -0.244 7.511 153 HA ARG 31 HA ARG 31 -7.350 -0.827 5.109 154 HB2 ARG 31 HB2 ARG 31 -4.867 -0.616 5.543 155 HB3 ARG 31 HB1 ARG 31 -4.987 -2.171 6.428 156 HG2 ARG 31 HG2 ARG 31 -5.653 -3.263 4.408 157 HG3 ARG 31 HG1 ARG 31 -5.918 -1.800 3.608 158 HD2 ARG 31 HD2 ARG 31 -3.503 -1.516 3.113 159 HD3 ARG 31 HD1 ARG 31 -3.046 -2.679 4.372 160 HE ARG 31 HE ARG 31 -4.743 -3.694 2.193 161 HH11 ARG 31 1HH2 ARG 31 -1.343 -3.613 3.383 162 HH12 ARG 31 2HH2 ARG 31 -1.149 -5.219 2.689 163 HH21 ARG 31 1HH1 ARG 31 -4.130 -5.537 1.221 164 HH22 ARG 31 2HH1 ARG 31 -2.458 -6.118 1.435 165 H GLU 32 H GLU 32 -7.149 -2.855 8.084 166 HA GLU 32 HA GLU 32 -8.143 -5.244 6.802 167 HB2 GLU 32 HB2 GLU 32 -6.693 -4.623 9.009 168 HB3 GLU 32 HB1 GLU 32 -8.266 -4.550 9.711 169 HG2 GLU 32 HG2 GLU 32 -8.990 -6.670 9.090 170 HG3 GLU 32 HG1 GLU 32 -7.657 -6.994 8.078 171 H GLN 33 H GLN 33 -9.918 -2.723 9.078 172 HA GLN 33 HA GLN 33 -12.357 -3.812 8.656 173 HB2 GLN 33 HB2 GLN 33 -11.235 -0.963 9.132 174 HB3 GLN 33 HB1 GLN 33 -12.973 -1.341 9.168 175 HG2 GLN 33 HG2 GLN 33 -12.448 -2.923 11.022 176 HG3 GLN 33 HG1 GLN 33 -10.775 -2.316 11.036 177 HE21 GLN 33 1HE2 GLN 33 -12.381 -2.345 13.307 178 HE22 GLN 33 2HE2 GLN 33 -12.629 -0.744 13.824 179 H LEU 34 H LEU 34 -10.434 -2.299 6.192 180 HA LEU 34 HA LEU 34 -12.595 -1.105 4.810 181 HB2 LEU 34 HB2 LEU 34 -10.111 -0.451 4.805 182 HB3 LEU 34 HB1 LEU 34 -9.761 -1.686 3.675 183 HG LEU 34 HG LEU 34 -11.215 -0.527 1.948 184 HD11 LEU 34 1HD1 LEU 34 -12.426 1.531 2.463 185 HD12 LEU 34 2HD1 LEU 34 -13.142 0.216 3.115 186 HD13 LEU 34 3HD1 LEU 34 -12.060 1.267 4.206 187 HD21 LEU 34 3HD2 LEU 34 -8.981 0.356 2.280 188 HD22 LEU 34 1HD2 LEU 34 -10.185 1.491 1.783 189 HD23 LEU 34 2HD2 LEU 34 -9.687 1.558 3.446 190 H GLY 35 H GLY 35 -11.031 -4.087 4.878 191 HA2 GLY 35 HA2 GLY 35 -11.466 -6.095 4.195 192 HA3 GLY 35 HA1 GLY 35 -13.100 -5.553 3.615 193 H ILE 36 H ILE 36 -11.054 -3.588 1.948 194 HA ILE 36 HA ILE 36 -11.511 -5.106 -0.408 195 HB ILE 36 HB ILE 36 -10.680 -3.254 -1.588 196 HG12 ILE 36 2HG1 ILE 36 -9.619 -2.208 1.107 197 HG13 ILE 36 1HG1 ILE 36 -8.594 -2.696 -0.289 198 HG21 ILE 36 1HG2 ILE 36 -12.400 -2.122 0.692 199 HG22 ILE 36 2HG2 ILE 36 -12.223 -1.505 -0.904 200 HG23 ILE 36 3HG2 ILE 36 -12.890 -3.057 -0.701 201 HD11 ILE 36 HD3 ILE 36 -8.580 -0.452 -0.433 202 HD12 ILE 36 HD1 ILE 36 -9.635 -0.936 -1.764 203 HD13 ILE 36 HD2 ILE 36 -10.322 -0.302 -0.309 204 H SER 37 H SER 37 -10.034 -5.737 -2.020 205 HA SER 37 HA SER 37 -7.922 -7.291 -0.816 206 HB2 SER 37 HB2 SER 37 -8.124 -8.593 -2.736 207 HB3 SER 37 HB1 SER 37 -9.691 -8.152 -2.180 208 HG SER 37 HG SER 37 -9.787 -7.826 -4.312 209 H GLN 38 H GLN 38 -5.900 -7.733 -1.982 210 HA GLN 38 HA GLN 38 -4.444 -5.526 -2.986 211 HB2 GLN 38 HB2 GLN 38 -4.420 -8.362 -3.950 212 HB3 GLN 38 HB1 GLN 38 -3.204 -7.262 -4.516 213 HG2 GLN 38 HG2 GLN 38 -2.490 -6.975 -2.091 214 HG3 GLN 38 HG1 GLN 38 -3.718 -8.369 -1.730 215 HE21 GLN 38 1HE2 GLN 38 -0.878 -8.079 -1.057 216 HE22 GLN 38 2HE2 GLN 38 0.038 -9.214 -2.001 217 H GLN 39 H GLN 39 -6.798 -7.421 -4.938 218 HA GLN 39 HA GLN 39 -5.999 -6.170 -7.290 219 HB2 GLN 39 HB2 GLN 39 -8.397 -7.804 -6.426 220 HB3 GLN 39 HB1 GLN 39 -8.173 -7.017 -8.096 221 HG2 GLN 39 HG2 GLN 39 -7.635 -9.370 -8.028 222 HG3 GLN 39 HG1 GLN 39 -6.230 -8.306 -8.429 223 HE21 GLN 39 1HE2 GLN 39 -4.746 -9.994 -7.636 224 HE22 GLN 39 2HE2 GLN 39 -4.766 -10.637 -5.974 225 H GLN 40 H GLN 40 -8.375 -5.136 -4.864 226 HA GLN 40 HA GLN 40 -9.356 -3.022 -6.359 227 HB2 GLN 40 HB2 GLN 40 -9.352 -3.905 -3.495 228 HB3 GLN 40 HB1 GLN 40 -10.147 -2.428 -3.920 229 HG2 GLN 40 HG2 GLN 40 -11.530 -3.614 -5.469 230 HG3 GLN 40 HG1 GLN 40 -10.830 -5.103 -5.310 231 HE21 GLN 40 1HE2 GLN 40 -13.190 -2.956 -3.882 232 HE22 GLN 40 2HE2 GLN 40 -13.844 -4.140 -2.765 233 H LEU 41 H LEU 41 -6.665 -3.268 -4.073 234 HA LEU 41 HA LEU 41 -6.470 -0.551 -3.717 235 HB2 LEU 41 HB2 LEU 41 -5.817 -2.132 -2.158 236 HB3 LEU 41 HB1 LEU 41 -4.551 -2.800 -3.168 237 HG LEU 41 HG LEU 41 -3.184 -0.750 -2.924 238 HD11 LEU 41 1HD1 LEU 41 -3.619 0.816 -1.248 239 HD12 LEU 41 2HD1 LEU 41 -5.002 0.784 -2.395 240 HD13 LEU 41 3HD1 LEU 41 -5.189 0.144 -0.767 241 HD21 LEU 41 3HD2 LEU 41 -2.709 -2.678 -1.547 242 HD22 LEU 41 1HD2 LEU 41 -2.575 -1.188 -0.533 243 HD23 LEU 41 2HD2 LEU 41 -3.939 -2.297 -0.415 244 H ALA 42 H ALA 42 -5.177 -2.614 -6.136 245 HA ALA 42 HA ALA 42 -3.148 -0.934 -7.327 246 HB1 ALA 42 HB1 ALA 42 -3.337 -3.358 -7.465 247 HB2 ALA 42 HB2 ALA 42 -4.842 -3.276 -8.161 248 HB3 ALA 42 HB3 ALA 42 -3.480 -2.528 -9.154 249 H GLN 43 H GLN 43 -6.783 -1.078 -7.381 250 HA GLN 43 HA GLN 43 -7.085 0.753 -9.617 251 HB2 GLN 43 HB2 GLN 43 -9.138 -0.535 -7.878 252 HB3 GLN 43 HB1 GLN 43 -9.454 0.445 -9.262 253 HG2 GLN 43 HG2 GLN 43 -8.300 -2.286 -9.226 254 HG3 GLN 43 HG1 GLN 43 -9.844 -1.890 -9.791 255 HE21 GLN 43 1HE2 GLN 43 -7.893 -3.441 -11.127 256 HE22 GLN 43 2HE2 GLN 43 -7.150 -2.557 -12.426 257 H LYS 44 H LYS 44 -6.922 0.986 -6.072 258 HA LYS 44 HA LYS 44 -8.034 3.510 -5.867 259 HB2 LYS 44 HB2 LYS 44 -7.585 1.556 -4.223 260 HB3 LYS 44 HB1 LYS 44 -5.942 2.162 -4.096 261 HG2 LYS 44 HG2 LYS 44 -6.875 3.064 -2.322 262 HG3 LYS 44 HG1 LYS 44 -7.021 4.478 -3.428 263 HD2 LYS 44 HD2 LYS 44 -9.364 3.562 -3.946 264 HD3 LYS 44 HD1 LYS 44 -9.136 2.377 -2.725 265 HE2 LYS 44 HE2 LYS 44 -8.872 4.015 -0.980 266 HE3 LYS 44 HE1 LYS 44 -8.854 5.402 -2.154 267 HZ1 LYS 44 HZ1 LYS 44 -11.197 3.793 -1.524 268 HZ2 LYS 44 HZ2 LYS 44 -10.885 5.267 -1.145 269 HZ3 LYS 44 HZ3 LYS 44 -11.144 5.077 -2.642 270 H LEU 45 H LEU 45 -4.911 2.369 -6.921 271 HA LEU 45 HA LEU 45 -3.583 4.966 -6.752 272 HB2 LEU 45 HB2 LEU 45 -2.890 2.062 -6.448 273 HB3 LEU 45 HB1 LEU 45 -1.609 3.191 -6.691 274 HG LEU 45 HG LEU 45 -3.520 3.190 -4.325 275 HD11 LEU 45 1HD1 LEU 45 -1.356 2.123 -3.161 276 HD12 LEU 45 2HD1 LEU 45 -2.005 1.091 -4.263 277 HD13 LEU 45 3HD1 LEU 45 -0.649 2.150 -4.765 278 HD21 LEU 45 3HD2 LEU 45 -2.648 5.384 -4.765 279 HD22 LEU 45 1HD2 LEU 45 -1.809 4.633 -3.358 280 HD23 LEU 45 2HD2 LEU 45 -0.970 4.848 -4.859 281 H LYS 46 H LYS 46 -5.045 3.006 -8.880 282 HA LYS 46 HA LYS 46 -4.996 2.335 -10.982 283 HB2 LYS 46 HB2 LYS 46 -3.671 4.998 -11.205 284 HB3 LYS 46 HB1 LYS 46 -4.205 4.034 -12.544 285 HG2 LYS 46 HG2 LYS 46 -6.488 3.973 -11.519 286 HG3 LYS 46 HG1 LYS 46 -5.853 4.980 -10.192 287 HD2 LYS 46 HD2 LYS 46 -7.174 6.368 -11.785 288 HD3 LYS 46 HD1 LYS 46 -5.541 6.842 -11.550 289 HE2 LYS 46 HE2 LYS 46 -5.166 5.283 -13.689 290 HE3 LYS 46 HE1 LYS 46 -6.861 5.380 -13.976 291 HZ1 LYS 46 HZ1 LYS 46 -5.565 7.146 -15.187 292 HZ2 LYS 46 HZ2 LYS 46 -6.400 7.962 -13.986 293 HZ3 LYS 46 HZ3 LYS 46 -4.913 7.657 -13.806 294 H VAL 47 H VAL 47 -2.043 2.101 -9.468 295 HA VAL 47 HA VAL 47 -0.464 1.527 -11.496 296 HB VAL 47 HB VAL 47 1.055 0.554 -9.823 297 HG11 VAL 47 1HG1 VAL 47 1.520 2.763 -8.960 298 HG12 VAL 47 2HG1 VAL 47 0.694 3.080 -10.349 299 HG13 VAL 47 3HG1 VAL 47 -0.252 3.058 -8.786 300 HG21 VAL 47 3HG2 VAL 47 0.176 1.272 -7.409 301 HG22 VAL 47 1HG2 VAL 47 -1.467 0.759 -7.970 302 HG23 VAL 47 2HG2 VAL 47 -0.100 -0.337 -8.020 303 H SER 48 H SER 48 0.876 -1.068 -10.586 304 HA SER 48 HA SER 48 -1.088 -2.978 -11.546 305 HB2 SER 48 HB2 SER 48 0.941 -4.334 -12.076 306 HB3 SER 48 HB1 SER 48 1.039 -2.772 -12.868 307 HG SER 48 HG SER 48 2.792 -2.705 -11.781 308 H GLU 49 H GLU 49 -0.783 -5.088 -10.870 309 HA GLU 49 HA GLU 49 -1.315 -5.486 -8.038 310 HB2 GLU 49 HB2 GLU 49 -2.061 -6.887 -10.140 311 HB3 GLU 49 HB1 GLU 49 -0.600 -7.805 -9.832 312 HG2 GLU 49 HG2 GLU 49 -1.517 -7.863 -7.364 313 HG3 GLU 49 HG1 GLU 49 -3.040 -7.376 -8.109 314 H ASN 50 H ASN 50 1.557 -5.765 -10.089 315 HA ASN 50 HA ASN 50 3.182 -6.695 -7.922 316 HB2 ASN 50 HB2 ASN 50 3.633 -7.237 -10.307 317 HB3 ASN 50 HB1 ASN 50 4.034 -5.491 -10.616 318 HD21 ASN 50 1HD2 ASN 50 5.148 -8.539 -9.116 319 HD22 ASN 50 2HD2 ASN 50 6.711 -7.786 -8.673 320 H ILE 51 H ILE 51 2.653 -3.314 -8.978 321 HA ILE 51 HA ILE 51 4.512 -2.204 -7.135 322 HB ILE 51 HB ILE 51 2.168 -1.284 -8.619 323 HG12 ILE 51 2HG1 ILE 51 5.199 -0.763 -8.860 324 HG13 ILE 51 1HG1 ILE 51 4.409 -1.965 -9.915 325 HG21 ILE 51 1HG2 ILE 51 2.791 1.090 -8.030 326 HG22 ILE 51 2HG2 ILE 51 2.598 0.131 -6.559 327 HG23 ILE 51 3HG2 ILE 51 4.183 0.398 -7.066 328 HD11 ILE 51 HD3 ILE 51 4.857 0.099 -11.003 329 HD12 ILE 51 HD1 ILE 51 3.113 -0.273 -10.961 330 HD13 ILE 51 HD2 ILE 51 3.880 1.003 -9.918 331 H VAL 52 H VAL 52 1.097 -3.287 -6.624 332 HA VAL 52 HA VAL 52 1.332 -2.352 -3.984 333 HB VAL 52 HB VAL 52 -0.713 -3.528 -3.493 334 HG11 VAL 52 1HG1 VAL 52 -0.868 -1.837 -6.161 335 HG12 VAL 52 2HG1 VAL 52 -2.269 -2.247 -5.116 336 HG13 VAL 52 3HG1 VAL 52 -0.889 -1.338 -4.438 337 HG21 VAL 52 3HG2 VAL 52 -0.564 -5.465 -5.154 338 HG22 VAL 52 1HG2 VAL 52 -2.152 -4.672 -5.020 339 HG23 VAL 52 2HG2 VAL 52 -1.094 -4.209 -6.337 340 H LYS 53 H LYS 53 1.582 -5.712 -5.344 341 HA LYS 53 HA LYS 53 2.256 -6.858 -2.931 342 HB2 LYS 53 HB2 LYS 53 2.957 -7.249 -5.817 343 HB3 LYS 53 HB1 LYS 53 3.666 -8.308 -4.617 344 HG2 LYS 53 HG2 LYS 53 1.352 -8.795 -3.734 345 HG3 LYS 53 HG1 LYS 53 0.704 -7.746 -4.967 346 HD2 LYS 53 HD2 LYS 53 1.297 -9.283 -6.740 347 HD3 LYS 53 HD1 LYS 53 2.408 -10.212 -5.700 348 HE2 LYS 53 HE2 LYS 53 0.131 -10.581 -4.385 349 HE3 LYS 53 HE1 LYS 53 -0.646 -9.916 -5.833 350 HZ1 LYS 53 HZ1 LYS 53 1.184 -12.248 -5.880 351 HZ2 LYS 53 HZ2 LYS 53 -0.462 -12.407 -5.904 352 HZ3 LYS 53 HZ3 LYS 53 0.278 -11.697 -7.097 353 H ARG 54 H ARG 54 4.223 -4.478 -4.452 354 HA ARG 54 HA ARG 54 6.670 -5.551 -4.002 355 HB2 ARG 54 HB2 ARG 54 5.986 -3.459 -5.271 356 HB3 ARG 54 HB1 ARG 54 6.058 -2.527 -3.865 357 HG2 ARG 54 HG2 ARG 54 8.412 -3.030 -3.517 358 HG3 ARG 54 HG1 ARG 54 8.424 -4.168 -4.959 359 HD2 ARG 54 HD2 ARG 54 7.509 -1.965 -6.049 360 HD3 ARG 54 HD1 ARG 54 8.087 -1.154 -4.632 361 HE ARG 54 HE ARG 54 10.248 -2.716 -5.505 362 HH11 ARG 54 1HH2 ARG 54 8.662 0.389 -6.738 363 HH12 ARG 54 2HH2 ARG 54 10.064 0.589 -7.760 364 HH21 ARG 54 1HH1 ARG 54 11.850 -2.121 -6.871 365 HH22 ARG 54 2HH1 ARG 54 11.785 -0.484 -7.588 366 H PHE 55 H PHE 55 4.587 -4.026 -1.727 367 HA PHE 55 HA PHE 55 6.664 -3.730 0.370 368 HB2 PHE 55 HB2 PHE 55 5.126 -2.434 1.511 369 HB3 PHE 55 HB1 PHE 55 5.037 -1.878 -0.157 370 HD1 PHE 55 HD2 PHE 55 3.111 -3.734 2.555 371 HD2 PHE 55 HD1 PHE 55 3.059 -1.802 -1.341 372 HE1 PHE 55 HE2 PHE 55 0.804 -3.625 2.736 373 HE2 PHE 55 HE1 PHE 55 0.614 -1.965 -1.254 374 HZ PHE 55 HZ PHE 55 -0.548 -2.788 0.862 375 H GLU 56 H GLU 56 3.289 -5.163 -0.050 376 HA GLU 56 HA GLU 56 3.075 -6.795 1.992 377 HB2 GLU 56 HB2 GLU 56 2.384 -7.672 -0.900 378 HB3 GLU 56 HB1 GLU 56 1.835 -8.396 0.543 379 HG2 GLU 56 HG2 GLU 56 1.181 -5.516 0.500 380 HG3 GLU 56 HG1 GLU 56 0.418 -6.480 -0.811 381 H SER 57 H SER 57 5.321 -7.365 -0.731 382 HA SER 57 HA SER 57 6.073 -9.946 0.278 383 HB2 SER 57 HB2 SER 57 7.352 -10.057 -1.743 384 HB3 SER 57 HB1 SER 57 5.667 -9.429 -2.072 385 HG SER 57 HG SER 57 7.230 -8.100 -3.191 386 H GLY 58 H GLY 58 7.181 -6.610 0.393 387 HA2 GLY 58 HA2 GLY 58 8.767 -5.625 1.705 388 HA3 GLY 58 HA1 GLY 58 9.373 -7.327 2.006 389 H LYS 59 H LYS 59 9.110 -6.518 -1.407 390 HA LYS 59 HA LYS 59 11.876 -6.532 -1.779 391 HB2 LYS 59 HB2 LYS 59 9.418 -6.690 -3.508 392 HB3 LYS 59 HB1 LYS 59 11.131 -7.075 -3.953 393 HG2 LYS 59 HG2 LYS 59 9.375 -8.574 -1.899 394 HG3 LYS 59 HG1 LYS 59 9.616 -8.932 -3.572 395 HD2 LYS 59 HD2 LYS 59 12.110 -9.124 -3.223 396 HD3 LYS 59 HD1 LYS 59 11.797 -8.915 -1.469 397 HE2 LYS 59 HE2 LYS 59 10.327 -10.990 -1.545 398 HE3 LYS 59 HE1 LYS 59 10.734 -11.090 -3.242 399 HZ1 LYS 59 HZ1 LYS 59 12.835 -11.127 -1.238 400 HZ2 LYS 59 HZ2 LYS 59 12.143 -12.490 -1.829 401 HZ3 LYS 59 HZ3 LYS 59 12.826 -11.494 -2.880 402 H LEU 60 H LEU 60 10.870 -3.997 -0.727 403 HA LEU 60 HA LEU 60 10.646 -2.178 -2.815 404 HB2 LEU 60 HB2 LEU 60 9.379 -2.809 -0.474 405 HB3 LEU 60 HB1 LEU 60 10.421 -1.372 -0.022 406 HG LEU 60 HG LEU 60 8.073 -1.407 -1.854 407 HD11 LEU 60 1HD1 LEU 60 7.000 -0.155 -0.073 408 HD12 LEU 60 2HD1 LEU 60 7.581 -1.590 0.637 409 HD13 LEU 60 3HD1 LEU 60 8.535 -0.142 0.896 410 HD21 LEU 60 3HD2 LEU 60 9.849 0.270 -2.666 411 HD22 LEU 60 1HD2 LEU 60 8.414 1.097 -2.086 412 HD23 LEU 60 2HD2 LEU 60 9.934 0.910 -1.176 413 H LYS 61 H LYS 61 11.808 -0.389 -3.139 414 HA LYS 61 HA LYS 61 14.243 0.056 -1.411 415 HB2 LYS 61 HB2 LYS 61 13.740 0.182 -4.295 416 HB3 LYS 61 HB1 LYS 61 15.017 1.045 -3.517 417 HG2 LYS 61 HG2 LYS 61 15.981 -0.980 -2.881 418 HG3 LYS 61 HG1 LYS 61 14.487 -1.905 -2.966 419 HD2 LYS 61 HD2 LYS 61 15.890 -2.699 -4.753 420 HD3 LYS 61 HD1 LYS 61 14.651 -1.787 -5.589 421 HE2 LYS 61 HE2 LYS 61 16.087 0.230 -5.417 422 HE3 LYS 61 HE1 LYS 61 17.421 -0.854 -5.069 423 HZ1 LYS 61 HZ1 LYS 61 17.369 -1.730 -7.188 424 HZ2 LYS 61 HZ2 LYS 61 15.867 -1.274 -7.576 425 HZ3 LYS 61 HZ3 LYS 61 17.081 -0.174 -7.396 426 HA PRO 62 HA PRO 62 11.451 3.704 -1.049 427 HB2 PRO 62 HB1 PRO 62 11.252 4.186 1.662 428 HB3 PRO 62 HB2 PRO 62 10.440 2.749 1.077 429 HG2 PRO 62 HG1 PRO 62 13.304 2.859 2.123 430 HG3 PRO 62 HG2 PRO 62 12.005 1.779 2.670 431 HD2 PRO 62 HD1 PRO 62 13.786 0.974 0.862 432 HD3 PRO 62 HD2 PRO 62 12.035 0.667 0.437 433 H THR 63 H THR 63 11.506 5.898 -0.689 434 HA THR 63 HA THR 63 13.784 6.954 0.703 435 HB THR 63 HB THR 63 13.708 8.895 -1.037 436 HG1 THR 63 HG1 THR 63 12.673 8.185 -3.002 437 HG21 THR 63 1HG2 THR 63 14.136 6.241 -2.552 438 HG22 THR 63 2HG2 THR 63 15.032 7.731 -2.719 439 HG23 THR 63 3HG2 THR 63 15.220 6.689 -1.243 440 H ILE 64 H ILE 64 13.362 9.499 0.966 441 HA ILE 64 HA ILE 64 11.264 9.845 2.778 442 HB ILE 64 HB ILE 64 11.677 12.344 2.163 443 HG12 ILE 64 2HG1 ILE 64 14.025 11.127 0.592 444 HG13 ILE 64 1HG1 ILE 64 12.617 11.739 -0.164 445 HG21 ILE 64 1HG2 ILE 64 12.605 11.135 4.033 446 HG22 ILE 64 2HG2 ILE 64 14.122 10.871 3.024 447 HG23 ILE 64 3HG2 ILE 64 13.527 12.480 3.368 448 HD11 ILE 64 HD3 ILE 64 13.410 14.101 0.688 449 HD12 ILE 64 HD1 ILE 64 14.678 13.141 1.550 450 HD13 ILE 64 HD2 ILE 64 14.620 13.278 -0.202 451 H SER 65 H SER 65 10.949 10.594 -0.753 452 HA SER 65 HA SER 65 8.174 11.477 -0.546 453 HB2 SER 65 HB2 SER 65 8.069 11.025 -2.877 454 HB3 SER 65 HB1 SER 65 9.477 12.028 -2.643 455 HG SER 65 HG SER 65 10.789 10.363 -3.086 456 H GLN 66 H GLN 66 9.756 8.331 -0.700 457 HA GLN 66 HA GLN 66 7.314 7.084 -1.192 458 HB2 GLN 66 HB2 GLN 66 9.978 5.858 -0.374 459 HB3 GLN 66 HB1 GLN 66 8.561 4.904 -0.793 460 HG2 GLN 66 HG2 GLN 66 8.378 5.712 -3.018 461 HG3 GLN 66 HG1 GLN 66 9.665 6.910 -2.721 462 HE21 GLN 66 1HE2 GLN 66 11.517 6.315 -3.497 463 HE22 GLN 66 2HE2 GLN 66 12.218 4.727 -3.804 464 H ALA 67 H ALA 67 9.400 7.054 1.697 465 HA ALA 67 HA ALA 67 7.738 6.296 3.668 466 HB1 ALA 67 HB1 ALA 67 10.017 7.157 3.982 467 HB2 ALA 67 HB2 ALA 67 9.402 8.817 3.768 468 HB3 ALA 67 HB3 ALA 67 8.919 7.928 5.113 469 H ARG 68 H ARG 68 7.590 9.683 2.327 470 HA ARG 68 HA ARG 68 5.299 10.382 3.695 471 HB2 ARG 68 HB2 ARG 68 6.754 11.290 1.280 472 HB3 ARG 68 HB1 ARG 68 5.161 11.917 1.439 473 HG2 ARG 68 HG2 ARG 68 5.679 12.898 3.616 474 HG3 ARG 68 HG1 ARG 68 7.234 12.101 3.682 475 HD2 ARG 68 HD2 ARG 68 6.419 13.916 1.568 476 HD3 ARG 68 HD1 ARG 68 7.001 14.570 3.171 477 HE ARG 68 HE ARG 68 9.204 13.476 2.640 478 HH11 ARG 68 1HH2 ARG 68 7.263 13.777 -0.291 479 HH12 ARG 68 2HH2 ARG 68 8.585 14.369 -1.251 480 HH21 ARG 68 1HH1 ARG 68 10.842 14.405 1.391 481 HH22 ARG 68 2HH1 ARG 68 10.717 14.231 -0.339 482 H GLN 69 H GLN 69 5.516 8.422 0.721 483 HA GLN 69 HA GLN 69 2.680 8.876 -0.133 484 HB2 GLN 69 HB2 GLN 69 5.078 7.378 -1.217 485 HB3 GLN 69 HB1 GLN 69 3.506 7.150 -1.769 486 HG2 GLN 69 HG2 GLN 69 3.305 9.513 -2.422 487 HG3 GLN 69 HG1 GLN 69 4.726 9.919 -1.500 488 HE21 GLN 69 1HE2 GLN 69 6.761 9.023 -2.449 489 HE22 GLN 69 2HE2 GLN 69 6.903 8.613 -4.208 490 H LEU 70 H LEU 70 4.474 6.423 1.531 491 HA LEU 70 HA LEU 70 2.611 4.455 1.146 492 HB2 LEU 70 HB2 LEU 70 5.132 4.709 2.825 493 HB3 LEU 70 HB1 LEU 70 4.170 3.136 2.563 494 HG LEU 70 HG LEU 70 5.291 4.455 0.226 495 HD11 LEU 70 1HD1 LEU 70 7.027 2.858 0.227 496 HD12 LEU 70 2HD1 LEU 70 7.062 3.886 1.690 497 HD13 LEU 70 3HD1 LEU 70 6.520 2.299 1.917 498 HD21 LEU 70 3HD2 LEU 70 3.145 2.833 0.272 499 HD22 LEU 70 1HD2 LEU 70 4.448 2.598 -0.899 500 HD23 LEU 70 2HD2 LEU 70 4.338 1.591 0.531 501 H GLU 71 H GLU 71 3.277 6.249 4.236 502 HA GLU 71 HA GLU 71 1.156 5.195 5.715 503 HB2 GLU 71 HB2 GLU 71 2.522 7.881 5.509 504 HB3 GLU 71 HB1 GLU 71 0.896 7.687 6.344 505 HG2 GLU 71 HG2 GLU 71 1.599 6.009 7.683 506 HG3 GLU 71 HG1 GLU 71 3.248 6.036 7.011 507 H LYS 72 H LYS 72 1.064 7.276 2.708 508 HA LYS 72 HA LYS 72 -1.590 7.939 3.465 509 HB2 LYS 72 HB2 LYS 72 0.283 8.921 1.233 510 HB3 LYS 72 HB1 LYS 72 -1.360 9.399 1.476 511 HG2 LYS 72 HG2 LYS 72 -0.915 10.254 3.743 512 HG3 LYS 72 HG1 LYS 72 0.860 9.800 3.469 513 HD2 LYS 72 HD2 LYS 72 0.819 11.234 1.474 514 HD3 LYS 72 HD1 LYS 72 -0.738 11.782 1.895 515 HE2 LYS 72 HE2 LYS 72 0.638 13.435 2.898 516 HE3 LYS 72 HE1 LYS 72 0.250 12.309 4.233 517 HZ1 LYS 72 HZ1 LYS 72 2.625 12.415 2.509 518 HZ2 LYS 72 HZ2 LYS 72 2.594 12.786 4.194 519 HZ3 LYS 72 HZ3 LYS 72 2.377 11.236 3.671 520 H ILE 73 H ILE 73 -0.526 5.243 1.751 521 HA ILE 73 HA ILE 73 -1.793 5.185 -0.601 522 HB ILE 73 HB ILE 73 -2.251 2.803 -0.386 523 HG12 ILE 73 2HG1 ILE 73 -0.745 3.006 2.189 524 HG13 ILE 73 1HG1 ILE 73 -2.449 2.529 1.971 525 HG21 ILE 73 1HG2 ILE 73 0.364 4.167 0.004 526 HG22 ILE 73 2HG2 ILE 73 0.351 2.487 -0.561 527 HG23 ILE 73 3HG2 ILE 73 -0.403 3.675 -1.551 528 HD11 ILE 73 HD3 ILE 73 -1.345 0.438 2.359 529 HD12 ILE 73 HD1 ILE 73 -1.430 0.605 0.547 530 HD13 ILE 73 HD2 ILE 73 -0.011 1.123 1.457 531 H LEU 74 H LEU 74 -3.504 4.152 2.388 532 HA LEU 74 HA LEU 74 -5.887 4.566 0.998 533 HB2 LEU 74 HB2 LEU 74 -5.217 3.262 3.714 534 HB3 LEU 74 HB1 LEU 74 -6.865 3.459 3.051 535 HG LEU 74 HG LEU 74 -4.850 2.069 1.454 536 HD11 LEU 74 1HD1 LEU 74 -6.725 0.876 3.529 537 HD12 LEU 74 2HD1 LEU 74 -5.707 0.055 2.258 538 HD13 LEU 74 3HD1 LEU 74 -4.994 0.996 3.522 539 HD21 LEU 74 3HD2 LEU 74 -6.707 2.871 0.174 540 HD22 LEU 74 1HD2 LEU 74 -6.923 1.128 0.423 541 HD23 LEU 74 2HD2 LEU 74 -7.852 2.383 1.408 542 H GLY 75 H GLY 75 -4.105 6.325 2.798 543 HA2 GLY 75 HA2 GLY 75 -4.248 8.650 3.723 544 HA3 GLY 75 HA1 GLY 75 -5.956 8.505 3.318 545 H ILE 76 H ILE 76 -5.725 5.878 5.326 546 HA ILE 76 HA ILE 76 -6.418 7.421 7.612 547 HB ILE 76 HB ILE 76 -8.101 5.737 7.923 548 HG12 ILE 76 2HG1 ILE 76 -7.372 4.493 5.222 549 HG13 ILE 76 1HG1 ILE 76 -6.565 3.930 6.652 550 HG21 ILE 76 1HG2 ILE 76 -8.631 7.645 6.650 551 HG22 ILE 76 2HG2 ILE 76 -8.484 6.690 5.143 552 HG23 ILE 76 3HG2 ILE 76 -9.648 6.304 6.501 553 HD11 ILE 76 HD3 ILE 76 -9.629 3.892 5.927 554 HD12 ILE 76 HD1 ILE 76 -8.466 2.533 6.008 555 HD13 ILE 76 HD2 ILE 76 -9.070 3.491 7.427 556 H LYS 77 H LYS 77 -6.591 5.552 9.713 557 HA LYS 77 HA LYS 77 -4.343 3.794 9.846 558 HB2 LYS 77 HB2 LYS 77 -3.013 5.186 11.376 559 HB3 LYS 77 HB1 LYS 77 -3.161 5.908 9.793 560 HG2 LYS 77 HG2 LYS 77 -4.367 7.661 10.451 561 HG3 LYS 77 HG1 LYS 77 -4.942 6.915 12.015 562 HD2 LYS 77 HD2 LYS 77 -3.048 7.090 13.119 563 HD3 LYS 77 HD1 LYS 77 -2.035 7.580 11.692 564 HE2 LYS 77 HE2 LYS 77 -3.167 9.628 11.462 565 HE3 LYS 77 HE1 LYS 77 -4.248 9.113 12.897 566 HZ1 LYS 77 HZ1 LYS 77 -1.294 9.422 13.100 567 HZ2 LYS 77 HZ2 LYS 77 -2.378 10.563 13.595 568 HZ3 LYS 77 HZ3 LYS 77 -2.362 9.116 14.260 569 H LEU 78 H LEU 78 -4.284 2.779 11.782 570 HA LEU 78 HA LEU 78 -6.042 3.681 13.833 571 HB2 LEU 78 HB2 LEU 78 -6.558 0.930 12.696 572 HB3 LEU 78 HB1 LEU 78 -6.753 1.134 14.400 573 HG LEU 78 HG LEU 78 -8.056 2.756 12.261 574 HD11 LEU 78 1HD1 LEU 78 -10.184 1.503 12.656 575 HD12 LEU 78 2HD1 LEU 78 -8.992 0.559 11.944 576 HD13 LEU 78 3HD1 LEU 78 -9.341 0.458 13.769 577 HD21 LEU 78 3HD2 LEU 78 -8.660 2.696 15.201 578 HD22 LEU 78 1HD2 LEU 78 -8.109 4.039 14.185 579 HD23 LEU 78 2HD2 LEU 78 -9.740 3.493 14.081 580 H VAL 79 H VAL 79 -3.726 2.207 16.166 581 HA VAL 79 HA VAL 79 -6.561 2.791 15.962 582 HB VAL 79 HB VAL 79 -6.284 2.116 18.555 583 HG11 VAL 79 1HG1 VAL 79 -7.028 -0.071 18.036 584 HG12 VAL 79 2HG1 VAL 79 -7.680 0.978 16.728 585 HG13 VAL 79 3HG1 VAL 79 -6.301 -0.101 16.460 586 HG21 VAL 79 3HG2 VAL 79 -3.842 1.861 18.292 587 HG22 VAL 79 1HG2 VAL 79 -4.733 0.442 19.103 588 HG23 VAL 79 2HG2 VAL 79 -4.118 0.300 17.524 589 H THR 80 H THR 80 -7.665 3.753 17.690 590 HA THR 80 HA THR 80 -6.672 6.605 18.152 591 HB THR 80 HB THR 80 -8.850 7.183 18.284 592 HG1 THR 80 HG1 THR 80 -9.651 4.479 18.368 593 HG21 THR 80 1HG2 THR 80 -8.836 5.003 16.235 594 HG22 THR 80 2HG2 THR 80 -9.786 6.566 16.272 595 HG23 THR 80 3HG2 THR 80 -8.114 6.695 16.088 596 HA PRO 81 HA PRO 81 -6.575 6.065 22.555 597 HB2 PRO 81 HB1 PRO 81 -8.921 7.912 22.566 598 HB3 PRO 81 HB2 PRO 81 -7.646 7.979 23.722 599 HG2 PRO 81 HG1 PRO 81 -7.565 9.746 21.721 600 HG3 PRO 81 HG2 PRO 81 -6.076 8.883 22.109 601 HD2 PRO 81 HD1 PRO 81 -8.049 8.334 19.956 602 HD3 PRO 81 HD2 PRO 81 -6.205 8.130 19.906 603 H LEU 82 H LEU 82 -9.362 5.136 20.785 604 HA LEU 82 HA LEU 82 -10.738 3.907 22.903 605 HB2 LEU 82 HB2 LEU 82 -10.658 3.174 19.990 606 HB3 LEU 82 HB1 LEU 82 -11.703 2.396 21.202 607 HG LEU 82 HG LEU 82 -12.068 5.251 20.739 608 HD11 LEU 82 1HD1 LEU 82 -12.542 4.352 18.613 609 HD12 LEU 82 2HD1 LEU 82 -13.257 2.880 19.376 610 HD13 LEU 82 3HD1 LEU 82 -14.102 4.482 19.500 611 HD21 LEU 82 3HD2 LEU 82 -14.101 4.923 21.804 612 HD22 LEU 82 1HD2 LEU 82 -14.070 3.244 21.889 613 HD23 LEU 82 2HD2 LEU 82 -12.953 4.315 22.888 614 H GLU 83 H GLU 83 -7.783 3.210 21.463 615 HA GLU 83 HA GLU 83 -7.373 0.951 23.348 616 HB2 GLU 83 HB2 GLU 83 -8.067 0.090 21.129 617 HB3 GLU 83 HB1 GLU 83 -6.545 0.511 20.575 618 HG2 GLU 83 HG2 GLU 83 -6.779 -1.922 21.361 619 HG3 GLU 83 HG1 GLU 83 -5.565 -0.996 22.363 620 H ASN 84 H ASN 84 -5.897 3.386 21.345 621 HA ASN 84 HA ASN 84 -3.687 3.366 23.322 622 HB2 ASN 84 HB2 ASN 84 -3.062 1.847 21.544 623 HB3 ASN 84 HB1 ASN 84 -3.072 3.202 20.376 624 HD21 ASN 84 1HD2 ASN 84 -1.472 1.830 23.083 625 HD22 ASN 84 2HD2 ASN 84 -0.124 2.893 23.210 626 H ASN 85 H ASN 85 -2.497 5.295 23.469 627 HA ASN 85 HA ASN 85 -3.533 7.631 21.972 628 HB2 ASN 85 HB2 ASN 85 -4.559 7.458 24.000 629 HB3 ASN 85 HB1 ASN 85 -3.083 7.049 24.810 630 HD21 ASN 85 1HD2 ASN 85 -2.011 8.851 25.965 631 HD22 ASN 85 2HD2 ASN 85 -1.990 10.487 25.392 632 H GLU 86 H GLU 86 -2.052 9.116 21.104 633 HA GLU 86 HA GLU 86 0.531 8.434 20.808 634 HB2 GLU 86 HB2 GLU 86 -0.943 9.934 19.348 635 HB3 GLU 86 HB1 GLU 86 -0.762 11.178 20.560 636 HG2 GLU 86 HG2 GLU 86 1.425 11.655 20.142 637 HG3 GLU 86 HG1 GLU 86 1.675 10.088 19.289 638 H GLU 87 H GLU 87 1.975 8.178 22.139 639 HA GLU 87 HA GLU 87 2.389 10.146 24.268 640 HB2 GLU 87 HB2 GLU 87 1.070 8.254 25.069 641 HB3 GLU 87 HB1 GLU 87 2.203 7.120 24.528 642 HG2 GLU 87 HG2 GLU 87 3.815 8.182 26.196 643 HG3 GLU 87 HG1 GLU 87 2.525 9.230 26.770 644 H SER 88 H SER 88 3.987 11.129 22.923 645 HA SER 88 HA SER 88 6.178 9.448 22.044 646 HB2 SER 88 HB2 SER 88 5.374 12.345 21.702 647 HB3 SER 88 HB1 SER 88 6.812 11.852 20.922 648 HG SER 88 HG SER 88 4.766 10.187 20.174 649 H GLU 89 H GLU 89 5.675 11.212 24.869 650 HA GLU 89 HA GLU 89 8.373 11.967 25.302 651 HB2 GLU 89 HB2 GLU 89 7.676 12.129 27.683 652 HB3 GLU 89 HB1 GLU 89 6.428 12.667 26.673 653 HG2 GLU 89 HG2 GLU 89 5.485 10.311 26.479 654 HG3 GLU 89 HG1 GLU 89 6.420 9.962 27.997 655 H LYS 90 H LYS 90 7.123 8.895 25.175 656 HA LYS 90 HA LYS 90 9.498 7.649 26.424 657 HB2 LYS 90 HB2 LYS 90 7.206 6.486 24.986 658 HB3 LYS 90 HB1 LYS 90 8.462 5.523 25.768 659 HG2 LYS 90 HG2 LYS 90 7.831 6.651 27.997 660 HG3 LYS 90 HG1 LYS 90 6.556 7.520 27.168 661 HD2 LYS 90 HD2 LYS 90 5.337 5.526 26.558 662 HD3 LYS 90 HD1 LYS 90 6.637 4.510 27.139 663 HE2 LYS 90 HE2 LYS 90 6.439 5.189 29.379 664 HE3 LYS 90 HE1 LYS 90 5.359 6.555 28.825 665 HZ1 LYS 90 HZ1 LYS 90 3.716 5.084 28.404 666 HZ2 LYS 90 HZ2 LYS 90 4.647 3.764 28.451 667 HZ3 LYS 90 HZ3 LYS 90 4.230 4.391 29.875 668 H GLU 91 H GLU 91 8.954 8.853 23.303 669 HA GLU 91 HA GLU 91 10.958 6.903 22.223 670 HB2 GLU 91 HB2 GLU 91 8.546 8.216 21.027 671 HB3 GLU 91 HB1 GLU 91 9.813 7.485 20.082 672 HG2 GLU 91 HG2 GLU 91 9.491 5.307 21.226 673 HG3 GLU 91 HG1 GLU 91 8.198 6.032 22.220 674 H PHE 92 H PHE 92 9.852 10.308 22.249 675 HA PHE 92 HA PHE 92 12.089 11.119 20.503 676 HB2 PHE 92 HB2 PHE 92 9.519 12.288 21.321 677 HB3 PHE 92 HB1 PHE 92 10.851 13.176 20.402 678 HD1 PHE 92 HD1 PHE 92 11.307 12.622 18.141 679 HD2 PHE 92 HD2 PHE 92 8.305 10.465 20.272 680 HE1 PHE 92 HE1 PHE 92 10.563 11.492 16.008 681 HE2 PHE 92 HE2 PHE 92 7.538 9.403 18.151 682 HZ PHE 92 HZ PHE 92 8.551 10.095 15.962 683 H ASP 93 H ASP 93 13.685 12.591 21.248 684 HA ASP 93 HA ASP 93 13.743 13.788 23.913 685 HB2 ASP 93 HB2 ASP 93 15.678 13.365 21.994 686 HB3 ASP 93 HB1 ASP 93 14.994 14.616 21.172 687 H ASP 94 H ASP 94 12.202 15.131 21.048 688 HA ASP 94 HA ASP 94 11.522 17.318 23.000 689 HB2 ASP 94 HB2 ASP 94 13.499 17.722 21.458 690 HB3 ASP 94 HB1 ASP 94 12.479 17.634 20.180 691 H THR 95 H THR 95 9.911 15.081 21.234 692 HA THR 95 HA THR 95 7.797 16.872 20.156 693 HB THR 95 HB THR 95 8.487 13.868 19.545 694 HG1 THR 95 HG1 THR 95 9.950 15.220 18.618 695 HG21 THR 95 1HG2 THR 95 6.000 14.431 19.067 696 HG22 THR 95 2HG2 THR 95 6.535 15.861 18.159 697 HG23 THR 95 3HG2 THR 95 6.963 14.334 17.539 698 H GLY 96 H GLY 96 5.650 16.573 21.000 699 HA2 GLY 96 HA2 GLY 96 4.127 16.070 22.478 700 HA3 GLY 96 HA1 GLY 96 4.654 14.438 22.427 701 H LEU 97 H LEU 97 6.981 16.768 23.437 702 HA LEU 97 HA LEU 97 7.143 15.654 26.099 703 HB2 LEU 97 HB2 LEU 97 8.755 16.708 23.999 704 HB3 LEU 97 HB1 LEU 97 9.120 17.762 25.370 705 HG LEU 97 HG LEU 97 10.736 16.108 25.323 706 HD11 LEU 97 1HD1 LEU 97 8.841 15.473 27.636 707 HD12 LEU 97 2HD1 LEU 97 10.581 15.321 27.600 708 HD13 LEU 97 3HD1 LEU 97 9.939 16.919 27.494 709 HD21 LEU 97 3HD2 LEU 97 9.899 14.030 24.345 710 HD22 LEU 97 1HD2 LEU 97 10.178 13.665 25.995 711 HD23 LEU 97 2HD2 LEU 97 8.506 14.074 25.532 712 H THR 98 H THR 98 6.170 18.659 24.703 713 HA THR 98 HA THR 98 5.002 19.241 27.259 714 HB THR 98 HB THR 98 7.172 20.300 27.447 715 HG1 THR 98 HG1 THR 98 5.962 21.654 28.622 716 HG21 THR 98 1HG2 THR 98 6.443 22.057 25.251 717 HG22 THR 98 2HG2 THR 98 7.947 22.059 26.322 718 HG23 THR 98 3HG2 THR 98 7.613 20.679 25.253 719 H LEU 99 H LEU 99 3.039 20.249 27.205 720 HA LEU 99 HA LEU 99 2.240 21.446 24.697 721 HB2 LEU 99 HB2 LEU 99 0.843 19.505 25.539 722 HB3 LEU 99 HB1 LEU 99 0.682 20.353 27.001 723 HG LEU 99 HG LEU 99 -0.682 22.151 25.808 724 HD11 LEU 99 1HD1 LEU 99 0.420 22.371 23.722 725 HD12 LEU 99 2HD1 LEU 99 0.149 20.751 23.234 726 HD13 LEU 99 3HD1 LEU 99 -1.135 21.909 23.288 727 HD21 LEU 99 3HD2 LEU 99 -1.604 19.353 25.026 728 HD22 LEU 99 1HD2 LEU 99 -1.855 20.153 26.587 729 HD23 LEU 99 2HD2 LEU 99 -2.658 20.787 25.266 730 H GLY 100 H GLY 100 2.871 22.046 28.172 731 HA2 GLY 100 HA2 GLY 100 3.332 23.943 29.140 732 HA3 GLY 100 HA1 GLY 100 2.774 24.899 27.742 733 H ASP 101 H ASP 101 0.589 22.456 28.761 734 HA ASP 101 HA ASP 101 -1.339 24.545 29.349 735 HB2 ASP 101 HB2 ASP 101 -1.956 22.835 27.684 736 HB3 ASP 101 HB1 ASP 101 -1.425 21.502 28.858 737 H VAL 102 H VAL 102 -1.254 25.370 31.057 738 HA VAL 102 HA VAL 102 -1.285 23.926 33.612 739 HB VAL 102 HB VAL 102 -0.872 26.121 34.469 740 HG11 VAL 102 1HG1 VAL 102 1.366 26.178 33.954 741 HG12 VAL 102 2HG1 VAL 102 0.809 24.521 34.132 742 HG13 VAL 102 3HG1 VAL 102 1.165 25.142 32.505 743 HG21 VAL 102 3HG2 VAL 102 -0.191 27.029 31.710 744 HG22 VAL 102 1HG2 VAL 102 -1.750 27.533 32.352 745 HG23 VAL 102 2HG2 VAL 102 -0.268 27.985 33.182 746 H VAL 103 H VAL 103 -4.335 25.816 34.800 747 HA VAL 103 HA VAL 103 -1.824 25.079 36.000 748 HB VAL 103 HB VAL 103 -4.578 24.285 36.903 749 HG11 VAL 103 1HG1 VAL 103 -1.876 24.507 38.304 750 HG12 VAL 103 2HG1 VAL 103 -3.515 24.208 39.110 751 HG13 VAL 103 3HG1 VAL 103 -2.797 23.066 37.983 752 HG21 VAL 103 3HG2 VAL 103 -4.290 26.846 36.698 753 HG22 VAL 103 1HG2 VAL 103 -4.383 26.154 38.371 754 HG23 VAL 103 2HG2 VAL 103 -2.812 26.643 37.689 755 H ASN 104 H ASN 104 -0.756 23.142 36.030 756 HA ASN 104 HA ASN 104 -1.719 21.017 34.222 757 HB2 ASN 104 HB2 ASN 104 0.501 22.002 33.844 758 HB3 ASN 104 HB1 ASN 104 0.911 21.719 35.528 759 HD21 ASN 104 1HD2 ASN 104 2.735 20.827 34.391 760 HD22 ASN 104 2HD2 ASN 104 2.675 19.054 34.300 761 H ILE 105 H ILE 105 -2.846 19.323 34.999 762 HA ILE 105 HA ILE 105 -2.362 18.384 37.746 763 HB ILE 105 HB ILE 105 -4.590 17.663 37.786 764 HG12 ILE 105 2HG1 ILE 105 -5.013 18.928 35.121 765 HG13 ILE 105 1HG1 ILE 105 -5.250 17.196 35.603 766 HG21 ILE 105 1HG2 ILE 105 -3.956 19.833 38.705 767 HG22 ILE 105 2HG2 ILE 105 -4.396 20.703 37.378 768 HG23 ILE 105 3HG2 ILE 105 -5.628 19.769 38.288 769 HD11 ILE 105 HD3 ILE 105 -7.312 18.397 35.227 770 HD12 ILE 105 HD1 ILE 105 -7.256 17.777 36.910 771 HD13 ILE 105 HD2 ILE 105 -7.072 19.465 36.506 772 H LYS 106 H LYS 106 -1.617 17.560 34.660 773 HA LYS 106 HA LYS 106 -1.193 14.691 35.324 774 HB2 LYS 106 HB2 LYS 106 0.092 16.422 33.372 775 HB3 LYS 106 HB1 LYS 106 0.227 14.712 33.242 776 HG2 LYS 106 HG2 LYS 106 -1.969 14.333 32.514 777 HG3 LYS 106 HG1 LYS 106 -2.373 16.041 32.740 778 HD2 LYS 106 HD2 LYS 106 -2.195 15.644 30.418 779 HD3 LYS 106 HD1 LYS 106 -1.015 16.775 30.940 780 HE2 LYS 106 HE2 LYS 106 0.699 15.119 30.978 781 HE3 LYS 106 HE1 LYS 106 -0.454 13.812 30.864 782 HZ1 LYS 106 HZ1 LYS 106 0.210 15.587 28.592 783 HZ2 LYS 106 HZ2 LYS 106 0.246 13.850 28.688 784 HZ3 LYS 106 HZ3 LYS 106 -1.085 14.636 28.671 785 H GLU 107 H GLU 107 0.166 17.833 36.170 786 HA GLU 107 HA GLU 107 2.427 16.625 37.312 787 HB2 GLU 107 HB2 GLU 107 1.899 19.057 37.048 788 HB3 GLU 107 HB1 GLU 107 0.894 18.858 38.484 789 HG2 GLU 107 HG2 GLU 107 2.834 18.118 39.768 790 HG3 GLU 107 HG1 GLU 107 3.848 18.188 38.386 791 H GLY 108 H GLY 108 -0.953 16.513 37.761 792 HA2 GLY 108 HA2 GLY 108 -1.446 14.554 39.405 793 HA3 GLY 108 HA1 GLY 108 -0.819 15.736 40.685 794 H LYS 109 H LYS 109 -2.825 14.280 40.813 795 HA LYS 109 HA LYS 109 -5.291 15.424 39.931 796 HB2 LYS 109 HB2 LYS 109 -4.583 12.980 40.236 797 HB3 LYS 109 HB1 LYS 109 -4.867 13.262 41.909 798 HG2 LYS 109 HG2 LYS 109 -7.323 13.942 40.967 799 HG3 LYS 109 HG1 LYS 109 -6.808 13.031 39.603 800 HD2 LYS 109 HD2 LYS 109 -6.248 11.106 41.084 801 HD3 LYS 109 HD1 LYS 109 -6.766 11.938 42.510 802 HE2 LYS 109 HE2 LYS 109 -9.035 12.320 41.220 803 HE3 LYS 109 HE1 LYS 109 -8.554 11.262 40.078 804 HZ1 LYS 109 HZ1 LYS 109 -9.193 10.643 42.832 805 HZ2 LYS 109 HZ2 LYS 109 -9.731 9.919 41.472 806 HZ3 LYS 109 HZ3 LYS 109 -8.257 9.601 42.097 807 H LYS 110 H LYS 110 -4.144 17.341 41.312 808 HA LYS 110 HA LYS 110 -5.033 17.527 44.036 809 HB2 LYS 110 HB2 LYS 110 -4.124 19.895 43.702 810 HB3 LYS 110 HB1 LYS 110 -2.963 18.603 43.409 811 HG2 LYS 110 HG2 LYS 110 -2.933 19.027 41.165 812 HG3 LYS 110 HG1 LYS 110 -4.358 20.085 41.194 813 HD2 LYS 110 HD2 LYS 110 -2.618 21.573 41.111 814 HD3 LYS 110 HD1 LYS 110 -3.138 21.702 42.748 815 HE2 LYS 110 HE2 LYS 110 -1.447 20.189 43.507 816 HE3 LYS 110 HE1 LYS 110 -0.808 19.953 41.872 817 HZ1 LYS 110 HZ1 LYS 110 -0.199 22.186 41.738 818 HZ2 LYS 110 HZ2 LYS 110 -0.947 22.529 43.148 819 HZ3 LYS 110 HZ3 LYS 110 0.426 21.647 43.184 820 H LEU 111 H LEU 111 -6.301 18.265 40.857 821 HA LEU 111 HA LEU 111 -8.836 19.101 42.058 822 HB2 LEU 111 HB2 LEU 111 -8.297 19.364 39.124 823 HB3 LEU 111 HB1 LEU 111 -9.619 19.995 40.026 824 HG LEU 111 HG LEU 111 -6.957 21.241 40.338 825 HD11 LEU 111 1HD1 LEU 111 -9.334 21.979 38.708 826 HD12 LEU 111 2HD1 LEU 111 -7.749 22.966 38.948 827 HD13 LEU 111 3HD1 LEU 111 -7.940 21.544 38.106 828 HD21 LEU 111 3HD2 LEU 111 -8.162 22.964 41.635 829 HD22 LEU 111 1HD2 LEU 111 -9.680 22.207 41.120 830 HD23 LEU 111 2HD2 LEU 111 -8.567 21.465 42.395 831 H GLU 112 H GLU 112 -10.613 17.890 41.263 832 HA GLU 112 HA GLU 112 -10.354 15.121 40.688 833 HB2 GLU 112 HB2 GLU 112 -8.948 15.185 42.679 834 HB3 GLU 112 HB1 GLU 112 -10.223 15.989 43.628 835 HG2 GLU 112 HG2 GLU 112 -11.520 13.820 43.457 836 HG3 GLU 112 HG1 GLU 112 -10.398 13.331 42.252 837 H HIS 113 H HIS 113 -12.464 16.726 43.031 838 HA HIS 113 HA HIS 113 -14.521 15.178 41.723 839 HB2 HIS 113 HB2 HIS 113 -15.668 15.734 43.954 840 HB3 HIS 113 HB1 HIS 113 -13.956 15.160 44.077 841 HD2 HIS 113 HD2 HIS 113 -12.414 16.504 45.434 842 HE1 HIS 113 HE1 HIS 113 -14.601 20.173 45.604 843 HE2 HIS 113 HE2 HIS 113 -12.499 18.997 46.371 844 H HIS 114 H HIS 114 -13.493 17.834 40.946 845 HA HIS 114 HA HIS 114 -15.259 19.908 40.988 846 HB2 HIS 114 HB2 HIS 114 -14.226 20.951 39.096 847 HB3 HIS 114 HB1 HIS 114 -13.114 20.503 40.350 848 HD2 HIS 114 HD2 HIS 114 -13.257 20.197 36.743 849 HE1 HIS 114 HE1 HIS 114 -10.298 17.434 38.075 850 HE2 HIS 114 HE2 HIS 114 -11.298 18.706 36.011 Start of MODEL 11 1 H1 GLU 13 H1 GLU 13 24.050 -9.762 -6.052 2 H2 GLU 13 H2 GLU 13 25.648 -9.555 -5.846 3 H3 GLU 13 H3 GLU 13 24.855 -10.686 -5.037 4 HA GLU 13 HA GLU 13 25.468 -8.886 -3.603 5 HB2 GLU 13 HB2 GLU 13 24.580 -6.718 -3.715 6 HB3 GLU 13 HB1 GLU 13 25.074 -7.221 -5.327 7 HG2 GLU 13 HG2 GLU 13 22.243 -7.533 -4.482 8 HG3 GLU 13 HG1 GLU 13 22.947 -5.975 -5.091 9 H ASN 14 H ASN 14 24.092 -8.057 -1.801 10 HA ASN 14 HA ASN 14 22.219 -10.250 -1.067 11 HB2 ASN 14 HB2 ASN 14 24.417 -9.624 0.218 12 HB3 ASN 14 HB1 ASN 14 23.712 -8.038 0.362 13 HD21 ASN 14 1HD2 ASN 14 24.653 -9.222 2.611 14 HD22 ASN 14 2HD2 ASN 14 23.303 -9.593 3.614 15 H ALA 15 H ALA 15 20.226 -9.653 0.245 16 HA ALA 15 HA ALA 15 19.067 -7.140 -0.679 17 HB1 ALA 15 HB1 ALA 15 17.161 -8.296 -1.369 18 HB2 ALA 15 HB2 ALA 15 18.537 -9.155 -2.114 19 HB3 ALA 15 HB3 ALA 15 17.772 -9.837 -0.736 20 H GLU 16 H GLU 16 20.116 -8.410 2.190 21 HA GLU 16 HA GLU 16 17.723 -8.401 3.726 22 HB2 GLU 16 HB2 GLU 16 20.802 -8.331 4.288 23 HB3 GLU 16 HB1 GLU 16 19.567 -8.162 5.518 24 HG2 GLU 16 HG2 GLU 16 19.507 -10.480 3.476 25 HG3 GLU 16 HG1 GLU 16 20.635 -10.496 4.877 26 H LEU 17 H LEU 17 20.221 -6.030 2.907 27 HA LEU 17 HA LEU 17 19.144 -3.927 4.522 28 HB2 LEU 17 HB2 LEU 17 21.380 -4.035 2.584 29 HB3 LEU 17 HB1 LEU 17 20.891 -2.679 3.546 30 HG LEU 17 HG LEU 17 21.693 -5.325 4.834 31 HD11 LEU 17 1HD1 LEU 17 23.028 -2.686 4.564 32 HD12 LEU 17 2HD1 LEU 17 23.876 -4.099 5.184 33 HD13 LEU 17 3HD1 LEU 17 23.401 -4.045 3.450 34 HD21 LEU 17 3HD2 LEU 17 20.873 -2.579 5.911 35 HD22 LEU 17 1HD2 LEU 17 20.317 -4.280 6.263 36 HD23 LEU 17 2HD2 LEU 17 21.833 -3.774 6.836 37 H GLU 18 H GLU 18 18.210 -5.089 1.728 38 HA GLU 18 HA GLU 18 17.604 -2.544 0.342 39 HB2 GLU 18 HB2 GLU 18 18.530 -5.266 -0.559 40 HB3 GLU 18 HB1 GLU 18 17.951 -3.998 -1.707 41 HG2 GLU 18 HG2 GLU 18 20.400 -3.811 0.187 42 HG3 GLU 18 HG1 GLU 18 20.355 -4.229 -1.593 43 H ILE 19 H ILE 19 16.092 -4.957 1.834 44 HA ILE 19 HA ILE 19 13.415 -4.412 0.575 45 HB ILE 19 HB ILE 19 12.659 -6.172 1.928 46 HG12 ILE 19 2HG1 ILE 19 14.468 -7.847 2.660 47 HG13 ILE 19 1HG1 ILE 19 15.501 -6.436 2.991 48 HG21 ILE 19 1HG2 ILE 19 13.380 -6.418 -0.354 49 HG22 ILE 19 2HG2 ILE 19 14.892 -7.192 0.218 50 HG23 ILE 19 3HG2 ILE 19 13.268 -7.882 0.595 51 HD11 ILE 19 HD3 ILE 19 14.142 -7.321 4.973 52 HD12 ILE 19 HD1 ILE 19 14.062 -5.605 4.594 53 HD13 ILE 19 HD2 ILE 19 12.689 -6.702 4.260 54 H VAL 20 H VAL 20 11.698 -4.124 2.436 55 HA VAL 20 HA VAL 20 12.266 -1.616 3.534 56 HB VAL 20 HB VAL 20 10.194 -2.884 2.911 57 HG11 VAL 20 1HG1 VAL 20 10.118 -3.325 5.941 58 HG12 VAL 20 2HG1 VAL 20 8.895 -3.818 4.954 59 HG13 VAL 20 3HG1 VAL 20 10.511 -4.628 4.839 60 HG21 VAL 20 3HG2 VAL 20 10.259 -0.455 3.745 61 HG22 VAL 20 1HG2 VAL 20 8.728 -1.295 4.174 62 HG23 VAL 20 2HG2 VAL 20 9.886 -0.987 5.355 63 H THR 21 H THR 21 11.753 -0.825 5.505 64 HA THR 21 HA THR 21 13.704 -1.788 7.426 65 HB THR 21 HB THR 21 12.872 0.176 8.757 66 HG1 THR 21 HG1 THR 21 11.562 1.625 7.372 67 HG21 THR 21 1HG2 THR 21 13.601 0.879 5.780 68 HG22 THR 21 2HG2 THR 21 13.640 2.047 7.022 69 HG23 THR 21 3HG2 THR 21 14.720 0.720 7.063 70 H ASP 22 H ASP 22 10.292 -1.083 7.760 71 HA ASP 22 HA ASP 22 9.631 -3.414 9.212 72 HB2 ASP 22 HB2 ASP 22 10.964 -2.678 11.083 73 HB3 ASP 22 HB1 ASP 22 10.464 -1.039 10.771 74 H TYR 23 H TYR 23 7.967 -3.097 7.583 75 HA TYR 23 HA TYR 23 7.124 -0.616 6.848 76 HB2 TYR 23 HB2 TYR 23 7.183 -2.390 5.276 77 HB3 TYR 23 HB1 TYR 23 5.868 -3.199 6.109 78 HD1 TYR 23 HD1 TYR 23 6.721 0.015 4.351 79 HD2 TYR 23 HD2 TYR 23 3.657 -2.644 5.490 80 HE1 TYR 23 HE1 TYR 23 5.284 0.754 2.387 81 HE2 TYR 23 HE2 TYR 23 2.101 -1.778 3.868 82 HH TYR 23 HH TYR 23 1.986 -0.297 1.948 83 H TYR 24 H TYR 24 5.168 0.516 6.750 84 HA TYR 24 HA TYR 24 4.725 1.476 9.126 85 HB2 TYR 24 HB2 TYR 24 3.024 1.728 6.702 86 HB3 TYR 24 HB1 TYR 24 2.990 2.798 8.135 87 HD1 TYR 24 HD1 TYR 24 5.240 3.815 8.872 88 HD2 TYR 24 HD2 TYR 24 4.584 2.451 4.782 89 HE1 TYR 24 HE1 TYR 24 7.056 5.147 8.091 90 HE2 TYR 24 HE2 TYR 24 6.804 3.472 4.195 91 HH TYR 24 HH TYR 24 8.646 5.253 6.423 92 H LYS 25 H LYS 25 3.140 1.824 10.708 93 HA LYS 25 HA LYS 25 1.340 -0.506 10.942 94 HB2 LYS 25 HB2 LYS 25 2.463 1.452 12.846 95 HB3 LYS 25 HB1 LYS 25 1.285 0.072 13.154 96 HG2 LYS 25 HG2 LYS 25 2.866 -1.547 12.331 97 HG3 LYS 25 HG1 LYS 25 4.050 -0.289 11.895 98 HD2 LYS 25 HD2 LYS 25 4.218 0.378 14.262 99 HD3 LYS 25 HD1 LYS 25 3.123 -0.973 14.728 100 HE2 LYS 25 HE2 LYS 25 5.288 -1.728 15.194 101 HE3 LYS 25 HE1 LYS 25 4.711 -2.567 13.813 102 HZ1 LYS 25 HZ1 LYS 25 5.768 -0.813 12.417 103 HZ2 LYS 25 HZ2 LYS 25 6.442 -0.111 13.726 104 HZ3 LYS 25 HZ3 LYS 25 6.886 -1.619 13.336 105 H ILE 26 H ILE 26 1.091 3.134 10.958 106 HA ILE 26 HA ILE 26 -1.440 3.411 11.994 107 HB ILE 26 HB ILE 26 -1.402 5.598 10.756 108 HG12 ILE 26 2HG1 ILE 26 0.985 4.716 9.260 109 HG13 ILE 26 1HG1 ILE 26 -0.588 5.028 8.640 110 HG21 ILE 26 1HG2 ILE 26 0.265 6.504 12.002 111 HG22 ILE 26 2HG2 ILE 26 -0.060 5.072 12.949 112 HG23 ILE 26 3HG2 ILE 26 1.371 5.256 11.903 113 HD11 ILE 26 HD3 ILE 26 -0.475 7.403 9.507 114 HD12 ILE 26 HD1 ILE 26 1.257 7.015 9.854 115 HD13 ILE 26 HD2 ILE 26 0.624 7.119 8.209 116 H ILE 27 H ILE 27 -0.343 2.660 8.822 117 HA ILE 27 HA ILE 27 -2.757 2.978 7.581 118 HB ILE 27 HB ILE 27 -1.897 2.069 5.610 119 HG12 ILE 27 2HG1 ILE 27 0.185 0.685 7.248 120 HG13 ILE 27 1HG1 ILE 27 -1.178 -0.092 6.561 121 HG21 ILE 27 1HG2 ILE 27 -0.979 4.171 6.591 122 HG22 ILE 27 2HG2 ILE 27 0.536 3.401 6.986 123 HG23 ILE 27 3HG2 ILE 27 0.037 3.374 5.356 124 HD11 ILE 27 HD3 ILE 27 0.699 -0.499 4.889 125 HD12 ILE 27 HD1 ILE 27 -0.164 0.868 4.227 126 HD13 ILE 27 HD2 ILE 27 1.302 1.085 5.140 127 H LYS 28 H LYS 28 -1.547 0.052 9.224 128 HA LYS 28 HA LYS 28 -2.768 -1.727 8.101 129 HB2 LYS 28 HB2 LYS 28 -1.092 -1.882 9.739 130 HB3 LYS 28 HB1 LYS 28 -2.247 -1.813 11.067 131 HG2 LYS 28 HG2 LYS 28 -3.304 -3.963 10.075 132 HG3 LYS 28 HG1 LYS 28 -2.055 -3.875 8.785 133 HD2 LYS 28 HD2 LYS 28 -0.327 -3.874 10.667 134 HD3 LYS 28 HD1 LYS 28 -1.672 -4.032 11.773 135 HE2 LYS 28 HE2 LYS 28 -1.205 -5.740 9.276 136 HE3 LYS 28 HE1 LYS 28 -0.386 -6.138 10.862 137 HZ1 LYS 28 HZ1 LYS 28 -2.282 -7.523 10.511 138 HZ2 LYS 28 HZ2 LYS 28 -2.572 -6.466 11.746 139 HZ3 LYS 28 HZ3 LYS 28 -3.320 -6.340 10.289 140 H THR 29 H THR 29 -4.533 -0.822 11.050 141 HA THR 29 HA THR 29 -6.760 -2.419 10.746 142 HB THR 29 HB THR 29 -6.661 0.297 12.125 143 HG1 THR 29 HG1 THR 29 -6.099 -1.030 13.775 144 HG21 THR 29 1HG2 THR 29 -8.984 -0.688 12.299 145 HG22 THR 29 2HG2 THR 29 -8.246 -2.266 12.673 146 HG23 THR 29 3HG2 THR 29 -8.131 -0.821 13.757 147 H ALA 30 H ALA 30 -6.278 0.669 9.213 148 HA ALA 30 HA ALA 30 -8.936 1.003 8.498 149 HB1 ALA 30 HB1 ALA 30 -6.755 2.638 8.530 150 HB2 ALA 30 HB2 ALA 30 -6.483 1.926 6.936 151 HB3 ALA 30 HB3 ALA 30 -7.989 3.016 7.420 152 H ARG 31 H ARG 31 -6.149 -0.388 6.347 153 HA ARG 31 HA ARG 31 -8.024 -0.881 4.234 154 HB2 ARG 31 HB2 ARG 31 -6.482 -2.044 3.174 155 HB3 ARG 31 HB1 ARG 31 -5.721 -0.639 3.850 156 HG2 ARG 31 HG2 ARG 31 -4.653 -1.902 5.657 157 HG3 ARG 31 HG1 ARG 31 -5.640 -3.302 5.416 158 HD2 ARG 31 HD2 ARG 31 -3.729 -2.167 3.280 159 HD3 ARG 31 HD1 ARG 31 -3.167 -3.252 4.609 160 HE ARG 31 HE ARG 31 -5.394 -4.427 3.313 161 HH11 ARG 31 1HH2 ARG 31 -1.882 -3.950 2.874 162 HH12 ARG 31 2HH2 ARG 31 -1.934 -5.088 1.485 163 HH21 ARG 31 1HH1 ARG 31 -5.277 -5.853 1.702 164 HH22 ARG 31 2HH1 ARG 31 -3.674 -6.375 1.118 165 H GLU 32 H GLU 32 -7.036 -2.811 7.272 166 HA GLU 32 HA GLU 32 -8.342 -5.132 6.755 167 HB2 GLU 32 HB2 GLU 32 -7.604 -3.603 9.249 168 HB3 GLU 32 HB1 GLU 32 -8.305 -5.193 9.226 169 HG2 GLU 32 HG2 GLU 32 -6.672 -6.113 7.770 170 HG3 GLU 32 HG1 GLU 32 -5.789 -4.643 7.573 171 H GLN 33 H GLN 33 -10.098 -2.032 7.493 172 HA GLN 33 HA GLN 33 -12.406 -3.248 8.675 173 HB2 GLN 33 HB2 GLN 33 -12.158 -0.889 6.929 174 HB3 GLN 33 HB1 GLN 33 -13.442 -1.235 8.075 175 HG2 GLN 33 HG2 GLN 33 -10.740 -0.164 8.799 176 HG3 GLN 33 HG1 GLN 33 -12.277 0.660 8.848 177 HE21 GLN 33 1HE2 GLN 33 -10.180 -1.534 10.528 178 HE22 GLN 33 2HE2 GLN 33 -11.169 -1.796 11.977 179 H LEU 34 H LEU 34 -11.182 -2.555 5.461 180 HA LEU 34 HA LEU 34 -13.470 -3.382 3.941 181 HB2 LEU 34 HB2 LEU 34 -10.552 -2.707 3.054 182 HB3 LEU 34 HB1 LEU 34 -11.967 -2.582 2.099 183 HG LEU 34 HG LEU 34 -11.410 -0.789 4.369 184 HD11 LEU 34 1HD1 LEU 34 -10.079 -0.587 2.347 185 HD12 LEU 34 2HD1 LEU 34 -11.555 -0.279 1.360 186 HD13 LEU 34 3HD1 LEU 34 -11.242 0.918 2.403 187 HD21 LEU 34 3HD2 LEU 34 -13.749 -1.095 2.463 188 HD22 LEU 34 1HD2 LEU 34 -13.899 -1.040 4.206 189 HD23 LEU 34 2HD2 LEU 34 -13.457 0.379 3.306 190 H GLY 35 H GLY 35 -10.616 -4.718 5.282 191 HA2 GLY 35 HA2 GLY 35 -9.528 -6.562 5.164 192 HA3 GLY 35 HA1 GLY 35 -10.970 -7.393 4.446 193 H ILE 36 H ILE 36 -10.174 -4.950 2.294 194 HA ILE 36 HA ILE 36 -10.100 -6.707 0.300 195 HB ILE 36 HB ILE 36 -9.118 -4.731 -1.030 196 HG12 ILE 36 2HG1 ILE 36 -9.303 -3.158 1.470 197 HG13 ILE 36 1HG1 ILE 36 -7.942 -3.652 0.583 198 HG21 ILE 36 1HG2 ILE 36 -11.562 -5.445 -0.697 199 HG22 ILE 36 2HG2 ILE 36 -11.657 -4.153 0.538 200 HG23 ILE 36 3HG2 ILE 36 -11.310 -3.821 -1.178 201 HD11 ILE 36 HD3 ILE 36 -9.957 -1.791 -0.758 202 HD12 ILE 36 HD1 ILE 36 -8.323 -1.424 -0.115 203 HD13 ILE 36 HD2 ILE 36 -8.490 -2.523 -1.472 204 H SER 37 H SER 37 -8.392 -7.726 -1.046 205 HA SER 37 HA SER 37 -5.487 -7.025 -0.491 206 HB2 SER 37 HB2 SER 37 -5.002 -9.340 -0.586 207 HB3 SER 37 HB1 SER 37 -6.383 -9.288 0.504 208 HG SER 37 HG SER 37 -6.847 -10.830 -0.853 209 H GLN 38 H GLN 38 -4.227 -7.973 -2.018 210 HA GLN 38 HA GLN 38 -3.707 -6.595 -3.788 211 HB2 GLN 38 HB2 GLN 38 -3.801 -9.461 -4.727 212 HB3 GLN 38 HB1 GLN 38 -2.890 -8.083 -5.549 213 HG2 GLN 38 HG2 GLN 38 -1.456 -7.868 -3.355 214 HG3 GLN 38 HG1 GLN 38 -2.260 -9.116 -2.705 215 HE21 GLN 38 1HE2 GLN 38 -1.519 -11.238 -3.010 216 HE22 GLN 38 2HE2 GLN 38 -0.312 -11.557 -4.266 217 H GLN 39 H GLN 39 -6.179 -8.839 -5.293 218 HA GLN 39 HA GLN 39 -6.209 -7.351 -7.703 219 HB2 GLN 39 HB2 GLN 39 -8.400 -8.973 -6.338 220 HB3 GLN 39 HB1 GLN 39 -8.332 -8.456 -8.121 221 HG2 GLN 39 HG2 GLN 39 -6.527 -9.865 -8.519 222 HG3 GLN 39 HG1 GLN 39 -6.293 -10.301 -6.771 223 HE21 GLN 39 1HE2 GLN 39 -8.170 -10.845 -9.695 224 HE22 GLN 39 2HE2 GLN 39 -9.105 -12.152 -9.161 225 H GLN 40 H GLN 40 -8.264 -6.889 -4.764 226 HA GLN 40 HA GLN 40 -9.781 -4.852 -6.029 227 HB2 GLN 40 HB2 GLN 40 -9.483 -6.026 -3.260 228 HB3 GLN 40 HB1 GLN 40 -10.282 -4.442 -3.459 229 HG2 GLN 40 HG2 GLN 40 -11.849 -5.254 -5.056 230 HG3 GLN 40 HG1 GLN 40 -10.990 -6.847 -5.092 231 HE21 GLN 40 1HE2 GLN 40 -11.076 -7.920 -2.656 232 HE22 GLN 40 2HE2 GLN 40 -12.558 -7.738 -1.823 233 H LEU 41 H LEU 41 -6.561 -4.990 -4.234 234 HA LEU 41 HA LEU 41 -6.715 -2.405 -3.214 235 HB2 LEU 41 HB2 LEU 41 -5.896 -4.474 -2.388 236 HB3 LEU 41 HB1 LEU 41 -4.455 -4.329 -3.519 237 HG LEU 41 HG LEU 41 -4.047 -2.115 -2.377 238 HD11 LEU 41 1HD1 LEU 41 -5.883 -3.208 -0.374 239 HD12 LEU 41 2HD1 LEU 41 -4.734 -1.948 0.019 240 HD13 LEU 41 3HD1 LEU 41 -6.109 -1.646 -1.086 241 HD21 LEU 41 3HD2 LEU 41 -2.600 -4.241 -1.850 242 HD22 LEU 41 1HD2 LEU 41 -2.839 -3.173 -0.539 243 HD23 LEU 41 2HD2 LEU 41 -3.690 -4.730 -0.592 244 H ALA 42 H ALA 42 -5.428 -3.922 -6.120 245 HA ALA 42 HA ALA 42 -4.009 -2.003 -7.393 246 HB1 ALA 42 HB1 ALA 42 -4.530 -3.408 -9.326 247 HB2 ALA 42 HB2 ALA 42 -4.328 -4.377 -7.902 248 HB3 ALA 42 HB3 ALA 42 -5.967 -4.038 -8.561 249 H GLN 43 H GLN 43 -7.611 -2.596 -7.109 250 HA GLN 43 HA GLN 43 -8.322 -0.262 -8.736 251 HB2 GLN 43 HB2 GLN 43 -10.146 -1.792 -6.912 252 HB3 GLN 43 HB1 GLN 43 -10.451 -0.759 -8.349 253 HG2 GLN 43 HG2 GLN 43 -9.155 -2.429 -9.752 254 HG3 GLN 43 HG1 GLN 43 -9.298 -3.557 -8.306 255 HE21 GLN 43 1HE2 GLN 43 -10.974 -2.954 -11.303 256 HE22 GLN 43 2HE2 GLN 43 -12.409 -3.760 -10.593 257 H LYS 44 H LYS 44 -7.432 -0.729 -5.237 258 HA LYS 44 HA LYS 44 -9.137 1.530 -4.562 259 HB2 LYS 44 HB2 LYS 44 -8.476 -0.518 -2.948 260 HB3 LYS 44 HB1 LYS 44 -7.063 0.542 -2.748 261 HG2 LYS 44 HG2 LYS 44 -8.517 0.972 -0.928 262 HG3 LYS 44 HG1 LYS 44 -8.413 2.338 -1.750 263 HD2 LYS 44 HD2 LYS 44 -10.668 1.566 -2.996 264 HD3 LYS 44 HD1 LYS 44 -10.521 0.201 -1.744 265 HE2 LYS 44 HE2 LYS 44 -12.052 1.606 -0.969 266 HE3 LYS 44 HE1 LYS 44 -10.560 2.180 -0.062 267 HZ1 LYS 44 HZ1 LYS 44 -10.353 3.841 -1.690 268 HZ2 LYS 44 HZ2 LYS 44 -11.861 3.463 -2.347 269 HZ3 LYS 44 HZ3 LYS 44 -11.708 4.016 -0.784 270 H LEU 45 H LEU 45 -5.985 1.056 -5.928 271 HA LEU 45 HA LEU 45 -5.318 3.787 -5.275 272 HB2 LEU 45 HB2 LEU 45 -3.907 1.764 -4.283 273 HB3 LEU 45 HB1 LEU 45 -3.556 1.226 -5.863 274 HG LEU 45 HG LEU 45 -2.399 3.473 -6.260 275 HD11 LEU 45 1HD1 LEU 45 -3.637 4.923 -4.885 276 HD12 LEU 45 2HD1 LEU 45 -2.898 4.053 -3.376 277 HD13 LEU 45 3HD1 LEU 45 -1.995 4.989 -4.642 278 HD21 LEU 45 3HD2 LEU 45 -0.569 3.089 -4.552 279 HD22 LEU 45 1HD2 LEU 45 -1.713 1.841 -3.944 280 HD23 LEU 45 2HD2 LEU 45 -0.902 1.770 -5.626 281 H LYS 46 H LYS 46 -6.606 1.838 -7.680 282 HA LYS 46 HA LYS 46 -6.804 1.712 -9.774 283 HB2 LYS 46 HB2 LYS 46 -6.234 4.648 -10.071 284 HB3 LYS 46 HB1 LYS 46 -7.448 3.633 -10.790 285 HG2 LYS 46 HG2 LYS 46 -8.538 3.217 -8.623 286 HG3 LYS 46 HG1 LYS 46 -7.715 4.726 -8.121 287 HD2 LYS 46 HD2 LYS 46 -9.723 4.539 -10.362 288 HD3 LYS 46 HD1 LYS 46 -9.961 5.146 -8.706 289 HE2 LYS 46 HE2 LYS 46 -8.110 6.874 -9.098 290 HE3 LYS 46 HE1 LYS 46 -7.904 6.256 -10.651 291 HZ1 LYS 46 HZ1 LYS 46 -10.248 6.920 -11.119 292 HZ2 LYS 46 HZ2 LYS 46 -10.468 7.421 -9.618 293 HZ3 LYS 46 HZ3 LYS 46 -9.351 8.194 -10.560 294 H VAL 47 H VAL 47 -4.576 0.927 -9.092 295 HA VAL 47 HA VAL 47 -2.709 1.407 -11.176 296 HB VAL 47 HB VAL 47 -0.910 0.526 -9.887 297 HG11 VAL 47 1HG1 VAL 47 -1.701 2.818 -9.779 298 HG12 VAL 47 2HG1 VAL 47 -2.674 2.412 -8.413 299 HG13 VAL 47 3HG1 VAL 47 -0.948 2.304 -8.182 300 HG21 VAL 47 3HG2 VAL 47 -2.938 0.011 -7.686 301 HG22 VAL 47 1HG2 VAL 47 -1.936 -1.212 -8.470 302 HG23 VAL 47 2HG2 VAL 47 -1.092 -0.005 -7.533 303 H SER 48 H SER 48 -1.219 -1.026 -11.522 304 HA SER 48 HA SER 48 -3.118 -3.168 -11.974 305 HB2 SER 48 HB2 SER 48 -0.970 -4.213 -12.906 306 HB3 SER 48 HB1 SER 48 -1.338 -2.644 -13.689 307 HG SER 48 HG SER 48 0.396 -1.848 -12.877 308 H GLU 49 H GLU 49 -2.741 -5.446 -11.344 309 HA GLU 49 HA GLU 49 -2.027 -5.526 -8.587 310 HB2 GLU 49 HB2 GLU 49 -2.113 -7.827 -10.557 311 HB3 GLU 49 HB1 GLU 49 -2.088 -7.901 -8.811 312 HG2 GLU 49 HG2 GLU 49 -4.206 -8.291 -9.156 313 HG3 GLU 49 HG1 GLU 49 -4.213 -6.540 -8.715 314 H ASN 50 H ASN 50 0.067 -5.644 -11.410 315 HA ASN 50 HA ASN 50 2.262 -6.601 -9.893 316 HB2 ASN 50 HB2 ASN 50 2.012 -6.968 -12.179 317 HB3 ASN 50 HB1 ASN 50 2.109 -5.217 -12.520 318 HD21 ASN 50 1HD2 ASN 50 4.203 -5.003 -13.522 319 HD22 ASN 50 2HD2 ASN 50 5.626 -5.764 -13.068 320 H ILE 51 H ILE 51 0.918 -3.393 -10.292 321 HA ILE 51 HA ILE 51 3.183 -2.011 -9.257 322 HB ILE 51 HB ILE 51 0.361 -1.253 -9.805 323 HG12 ILE 51 2HG1 ILE 51 3.117 -0.029 -10.456 324 HG13 ILE 51 1HG1 ILE 51 2.337 -1.310 -11.397 325 HG21 ILE 51 1HG2 ILE 51 2.490 0.312 -8.355 326 HG22 ILE 51 2HG2 ILE 51 0.839 0.926 -8.846 327 HG23 ILE 51 3HG2 ILE 51 1.081 -0.199 -7.477 328 HD11 ILE 51 HD3 ILE 51 1.115 1.474 -10.919 329 HD12 ILE 51 HD1 ILE 51 2.090 1.121 -12.267 330 HD13 ILE 51 HD2 ILE 51 0.689 0.189 -12.169 331 H VAL 52 H VAL 52 0.401 -3.440 -7.471 332 HA VAL 52 HA VAL 52 1.211 -2.247 -5.129 333 HB VAL 52 HB VAL 52 -0.312 -3.804 -3.961 334 HG11 VAL 52 1HG1 VAL 52 -1.330 -2.136 -6.272 335 HG12 VAL 52 2HG1 VAL 52 -2.190 -2.461 -4.846 336 HG13 VAL 52 3HG1 VAL 52 -0.827 -1.473 -4.655 337 HG21 VAL 52 3HG2 VAL 52 -0.240 -5.742 -5.569 338 HG22 VAL 52 1HG2 VAL 52 -1.894 -5.147 -5.246 339 HG23 VAL 52 2HG2 VAL 52 -1.088 -4.769 -6.753 340 H LYS 53 H LYS 53 2.258 -5.327 -6.461 341 HA LYS 53 HA LYS 53 3.060 -6.840 -4.420 342 HB2 LYS 53 HB2 LYS 53 3.904 -6.245 -7.175 343 HB3 LYS 53 HB1 LYS 53 5.079 -7.263 -6.230 344 HG2 LYS 53 HG2 LYS 53 3.105 -8.837 -5.827 345 HG3 LYS 53 HG1 LYS 53 1.953 -7.665 -6.517 346 HD2 LYS 53 HD2 LYS 53 2.964 -8.031 -8.678 347 HD3 LYS 53 HD1 LYS 53 4.088 -9.274 -7.925 348 HE2 LYS 53 HE2 LYS 53 2.240 -10.107 -9.257 349 HE3 LYS 53 HE1 LYS 53 2.245 -10.746 -7.642 350 HZ1 LYS 53 HZ1 LYS 53 0.407 -8.754 -8.464 351 HZ2 LYS 53 HZ2 LYS 53 0.120 -10.292 -8.044 352 HZ3 LYS 53 HZ3 LYS 53 0.566 -9.186 -6.888 353 H ARG 54 H ARG 54 5.432 -4.058 -5.310 354 HA ARG 54 HA ARG 54 7.116 -4.990 -3.378 355 HB2 ARG 54 HB2 ARG 54 6.227 -2.330 -4.759 356 HB3 ARG 54 HB1 ARG 54 7.469 -2.183 -3.544 357 HG2 ARG 54 HG2 ARG 54 9.123 -3.360 -4.608 358 HG3 ARG 54 HG1 ARG 54 7.940 -4.135 -5.758 359 HD2 ARG 54 HD2 ARG 54 7.617 -1.952 -6.752 360 HD3 ARG 54 HD1 ARG 54 8.941 -1.345 -5.635 361 HE ARG 54 HE ARG 54 10.493 -2.336 -6.859 362 HH11 ARG 54 1HH2 ARG 54 7.477 -3.306 -8.350 363 HH12 ARG 54 2HH2 ARG 54 8.331 -3.796 -9.866 364 HH21 ARG 54 1HH1 ARG 54 11.415 -3.450 -8.632 365 HH22 ARG 54 2HH1 ARG 54 10.521 -3.456 -10.167 366 H PHE 55 H PHE 55 4.153 -3.071 -2.895 367 HA PHE 55 HA PHE 55 5.171 -2.081 -0.338 368 HB2 PHE 55 HB2 PHE 55 2.344 -2.142 -1.363 369 HB3 PHE 55 HB1 PHE 55 3.052 -1.080 -0.119 370 HD1 PHE 55 HD1 PHE 55 5.255 0.259 -1.310 371 HD2 PHE 55 HD2 PHE 55 1.487 -0.905 -3.043 372 HE1 PHE 55 HE1 PHE 55 5.598 1.874 -3.107 373 HE2 PHE 55 HE2 PHE 55 1.757 1.015 -4.732 374 HZ PHE 55 HZ PHE 55 3.828 2.182 -4.868 375 H GLU 56 H GLU 56 2.834 -4.795 -1.632 376 HA GLU 56 HA GLU 56 1.982 -5.395 0.833 377 HB2 GLU 56 HB2 GLU 56 1.237 -5.850 -1.759 378 HB3 GLU 56 HB1 GLU 56 2.378 -7.186 -1.666 379 HG2 GLU 56 HG2 GLU 56 0.156 -8.174 -1.129 380 HG3 GLU 56 HG1 GLU 56 1.411 -8.385 -0.006 381 H SER 57 H SER 57 4.871 -6.604 -1.083 382 HA SER 57 HA SER 57 5.147 -8.810 0.651 383 HB2 SER 57 HB2 SER 57 7.174 -9.130 -0.744 384 HB3 SER 57 HB1 SER 57 5.704 -8.983 -1.694 385 HG SER 57 HG SER 57 7.005 -7.608 -2.598 386 H GLY 58 H GLY 58 6.623 -5.636 0.390 387 HA2 GLY 58 HA2 GLY 58 7.818 -4.543 2.250 388 HA3 GLY 58 HA1 GLY 58 8.136 -6.067 2.922 389 H LYS 59 H LYS 59 8.461 -6.338 -0.480 390 HA LYS 59 HA LYS 59 11.238 -6.265 -0.642 391 HB2 LYS 59 HB2 LYS 59 9.359 -7.088 -2.755 392 HB3 LYS 59 HB1 LYS 59 11.044 -7.185 -2.730 393 HG2 LYS 59 HG2 LYS 59 11.325 -8.704 -1.035 394 HG3 LYS 59 HG1 LYS 59 9.571 -8.725 -0.680 395 HD2 LYS 59 HD2 LYS 59 9.280 -9.533 -3.037 396 HD3 LYS 59 HD1 LYS 59 11.010 -9.556 -3.253 397 HE2 LYS 59 HE2 LYS 59 9.602 -11.208 -1.112 398 HE3 LYS 59 HE1 LYS 59 10.076 -11.784 -2.711 399 HZ1 LYS 59 HZ1 LYS 59 12.306 -11.153 -2.226 400 HZ2 LYS 59 HZ2 LYS 59 12.065 -10.976 -0.625 401 HZ3 LYS 59 HZ3 LYS 59 11.836 -12.388 -1.251 402 H LEU 60 H LEU 60 10.300 -3.813 -0.277 403 HA LEU 60 HA LEU 60 11.022 -1.901 -2.485 404 HB2 LEU 60 HB2 LEU 60 8.626 -2.221 -1.501 405 HB3 LEU 60 HB1 LEU 60 9.393 -1.961 0.076 406 HG LEU 60 HG LEU 60 10.118 0.309 -0.654 407 HD11 LEU 60 1HD1 LEU 60 9.218 1.383 -2.558 408 HD12 LEU 60 2HD1 LEU 60 10.135 0.076 -3.272 409 HD13 LEU 60 3HD1 LEU 60 8.403 -0.115 -3.065 410 HD21 LEU 60 3HD2 LEU 60 7.716 1.162 -0.720 411 HD22 LEU 60 1HD2 LEU 60 7.196 -0.474 -0.411 412 HD23 LEU 60 2HD2 LEU 60 8.346 0.175 0.718 413 H LYS 61 H LYS 61 12.882 -0.741 -2.172 414 HA LYS 61 HA LYS 61 13.706 -0.302 0.572 415 HB2 LYS 61 HB2 LYS 61 15.138 -0.840 -1.102 416 HB3 LYS 61 HB1 LYS 61 14.728 0.463 -2.093 417 HG2 LYS 61 HG2 LYS 61 15.704 2.078 -0.741 418 HG3 LYS 61 HG1 LYS 61 15.652 1.147 0.747 419 HD2 LYS 61 HD2 LYS 61 17.503 -0.233 0.018 420 HD3 LYS 61 HD1 LYS 61 17.430 0.306 -1.635 421 HE2 LYS 61 HE2 LYS 61 18.216 2.632 -0.644 422 HE3 LYS 61 HE1 LYS 61 18.551 1.729 0.781 423 HZ1 LYS 61 HZ1 LYS 61 20.467 1.913 -0.818 424 HZ2 LYS 61 HZ2 LYS 61 19.967 0.309 -0.681 425 HZ3 LYS 61 HZ3 LYS 61 19.644 1.067 -1.950 426 HA PRO 62 HA PRO 62 11.462 3.681 0.694 427 HB2 PRO 62 HB1 PRO 62 11.483 4.168 3.226 428 HB3 PRO 62 HB2 PRO 62 10.546 2.802 2.477 429 HG2 PRO 62 HG1 PRO 62 13.191 2.531 3.988 430 HG3 PRO 62 HG2 PRO 62 11.825 1.500 4.008 431 HD2 PRO 62 HD1 PRO 62 13.968 1.022 2.335 432 HD3 PRO 62 HD2 PRO 62 12.337 0.408 2.044 433 H THR 63 H THR 63 12.190 5.873 2.127 434 HA THR 63 HA THR 63 14.877 6.290 2.567 435 HB THR 63 HB THR 63 15.251 8.160 1.091 436 HG1 THR 63 HG1 THR 63 13.415 8.747 -0.472 437 HG21 THR 63 1HG2 THR 63 14.150 6.139 -0.892 438 HG22 THR 63 2HG2 THR 63 15.242 7.399 -1.190 439 HG23 THR 63 3HG2 THR 63 15.712 6.039 -0.060 440 H ILE 64 H ILE 64 15.218 8.623 3.252 441 HA ILE 64 HA ILE 64 13.380 9.443 5.144 442 HB ILE 64 HB ILE 64 14.624 11.552 5.215 443 HG12 ILE 64 2HG1 ILE 64 16.510 10.142 3.256 444 HG13 ILE 64 1HG1 ILE 64 15.490 11.469 2.768 445 HG21 ILE 64 1HG2 ILE 64 14.883 9.585 6.545 446 HG22 ILE 64 2HG2 ILE 64 16.095 8.846 5.361 447 HG23 ILE 64 3HG2 ILE 64 16.431 10.354 6.260 448 HD11 ILE 64 HD3 ILE 64 16.648 12.867 4.519 449 HD12 ILE 64 HD1 ILE 64 17.925 11.582 4.506 450 HD13 ILE 64 HD2 ILE 64 17.509 12.571 3.070 451 H SER 65 H SER 65 13.725 10.930 1.815 452 HA SER 65 HA SER 65 11.171 12.196 2.101 453 HB2 SER 65 HB2 SER 65 11.315 12.499 -0.377 454 HB3 SER 65 HB1 SER 65 12.865 12.907 0.249 455 HG SER 65 HG SER 65 13.836 11.194 -0.543 456 H GLN 66 H GLN 66 11.671 8.827 1.075 457 HA GLN 66 HA GLN 66 9.156 8.769 -0.037 458 HB2 GLN 66 HB2 GLN 66 10.972 6.667 0.870 459 HB3 GLN 66 HB1 GLN 66 9.359 6.213 0.288 460 HG2 GLN 66 HG2 GLN 66 11.404 7.780 -1.285 461 HG3 GLN 66 HG1 GLN 66 11.253 6.064 -1.419 462 HE21 GLN 66 1HE2 GLN 66 10.626 8.584 -3.193 463 HE22 GLN 66 2HE2 GLN 66 9.222 8.052 -4.041 464 H ALA 67 H ALA 67 9.922 8.079 3.323 465 HA ALA 67 HA ALA 67 8.055 6.593 4.078 466 HB1 ALA 67 HB1 ALA 67 9.293 8.849 5.562 467 HB2 ALA 67 HB2 ALA 67 8.321 7.471 6.410 468 HB3 ALA 67 HB3 ALA 67 9.709 7.138 5.399 469 H ARG 68 H ARG 68 7.217 10.058 4.730 470 HA ARG 68 HA ARG 68 4.477 9.641 5.430 471 HB2 ARG 68 HB2 ARG 68 5.636 12.099 4.142 472 HB3 ARG 68 HB1 ARG 68 4.149 11.970 5.167 473 HG2 ARG 68 HG2 ARG 68 6.967 11.730 6.186 474 HG3 ARG 68 HG1 ARG 68 5.933 13.204 6.130 475 HD2 ARG 68 HD2 ARG 68 5.773 12.227 8.264 476 HD3 ARG 68 HD1 ARG 68 4.236 11.807 7.496 477 HE ARG 68 HE ARG 68 4.710 9.707 7.830 478 HH11 ARG 68 1HH2 ARG 68 7.671 11.441 8.652 479 HH12 ARG 68 2HH2 ARG 68 8.500 10.002 9.172 480 HH21 ARG 68 1HH1 ARG 68 5.983 7.780 8.258 481 HH22 ARG 68 2HH1 ARG 68 7.516 7.940 9.035 482 H GLN 69 H GLN 69 6.041 9.356 2.431 483 HA GLN 69 HA GLN 69 3.804 10.269 0.743 484 HB2 GLN 69 HB2 GLN 69 6.314 8.819 -0.114 485 HB3 GLN 69 HB1 GLN 69 5.096 9.660 -1.066 486 HG2 GLN 69 HG2 GLN 69 5.645 11.799 -0.088 487 HG3 GLN 69 HG1 GLN 69 6.891 11.023 0.940 488 HE21 GLN 69 1HE2 GLN 69 8.781 11.893 -0.100 489 HE22 GLN 69 2HE2 GLN 69 9.134 11.598 -1.844 490 H LEU 70 H LEU 70 5.374 7.274 1.916 491 HA LEU 70 HA LEU 70 3.716 5.472 0.453 492 HB2 LEU 70 HB2 LEU 70 5.780 5.127 2.665 493 HB3 LEU 70 HB1 LEU 70 4.856 3.796 1.950 494 HG LEU 70 HG LEU 70 6.463 5.641 0.069 495 HD11 LEU 70 1HD1 LEU 70 8.443 4.129 0.408 496 HD12 LEU 70 2HD1 LEU 70 7.888 4.738 1.962 497 HD13 LEU 70 3HD1 LEU 70 7.449 3.058 1.363 498 HD21 LEU 70 3HD2 LEU 70 5.006 4.160 -1.134 499 HD22 LEU 70 1HD2 LEU 70 6.572 3.474 -1.142 500 HD23 LEU 70 2HD2 LEU 70 5.371 2.772 -0.041 501 H GLU 71 H GLU 71 3.860 6.549 4.011 502 HA GLU 71 HA GLU 71 1.218 5.556 4.425 503 HB2 GLU 71 HB2 GLU 71 2.607 8.129 5.138 504 HB3 GLU 71 HB1 GLU 71 1.055 7.729 5.797 505 HG2 GLU 71 HG2 GLU 71 2.136 5.800 6.977 506 HG3 GLU 71 HG1 GLU 71 3.593 5.908 5.964 507 H LYS 72 H LYS 72 2.193 8.054 1.952 508 HA LYS 72 HA LYS 72 -0.477 9.188 2.048 509 HB2 LYS 72 HB2 LYS 72 1.675 10.330 1.616 510 HB3 LYS 72 HB1 LYS 72 1.621 9.813 -0.036 511 HG2 LYS 72 HG2 LYS 72 -0.660 10.918 -0.230 512 HG3 LYS 72 HG1 LYS 72 -0.625 11.357 1.443 513 HD2 LYS 72 HD2 LYS 72 1.700 12.513 0.807 514 HD3 LYS 72 HD1 LYS 72 1.061 12.188 -0.855 515 HE2 LYS 72 HE2 LYS 72 -0.966 13.272 -0.299 516 HE3 LYS 72 HE1 LYS 72 -0.390 13.734 1.349 517 HZ1 LYS 72 HZ1 LYS 72 1.471 14.898 -0.059 518 HZ2 LYS 72 HZ2 LYS 72 0.340 14.905 -1.274 519 HZ3 LYS 72 HZ3 LYS 72 0.043 15.589 0.171 520 H ILE 73 H ILE 73 0.891 6.504 0.085 521 HA ILE 73 HA ILE 73 -0.426 7.092 -2.116 522 HB ILE 73 HB ILE 73 0.009 4.690 -2.971 523 HG12 ILE 73 2HG1 ILE 73 1.414 4.477 -0.254 524 HG13 ILE 73 1HG1 ILE 73 -0.149 3.638 -0.553 525 HG21 ILE 73 1HG2 ILE 73 2.129 4.991 -3.092 526 HG22 ILE 73 2HG2 ILE 73 1.202 6.491 -3.435 527 HG23 ILE 73 3HG2 ILE 73 2.182 6.323 -1.911 528 HD11 ILE 73 HD3 ILE 73 1.643 2.070 -0.899 529 HD12 ILE 73 HD1 ILE 73 1.128 2.502 -2.539 530 HD13 ILE 73 HD2 ILE 73 2.547 3.269 -1.718 531 H LEU 74 H LEU 74 -1.845 4.576 -0.002 532 HA LEU 74 HA LEU 74 -4.188 4.566 -1.343 533 HB2 LEU 74 HB2 LEU 74 -3.316 3.472 1.412 534 HB3 LEU 74 HB1 LEU 74 -4.938 3.120 0.742 535 HG LEU 74 HG LEU 74 -2.230 2.491 -0.391 536 HD11 LEU 74 1HD1 LEU 74 -4.158 0.954 1.387 537 HD12 LEU 74 2HD1 LEU 74 -3.074 0.106 0.294 538 HD13 LEU 74 3HD1 LEU 74 -2.354 1.045 1.529 539 HD21 LEU 74 3HD2 LEU 74 -4.045 2.677 -2.086 540 HD22 LEU 74 1HD2 LEU 74 -3.485 0.954 -1.881 541 HD23 LEU 74 2HD2 LEU 74 -5.034 1.546 -1.170 542 H GLY 75 H GLY 75 -2.844 6.461 0.951 543 HA2 GLY 75 HA2 GLY 75 -3.196 8.293 2.195 544 HA3 GLY 75 HA1 GLY 75 -4.763 8.397 1.306 545 H ILE 76 H ILE 76 -4.882 5.599 3.034 546 HA ILE 76 HA ILE 76 -6.595 6.524 4.749 547 HB ILE 76 HB ILE 76 -6.857 4.104 5.307 548 HG12 ILE 76 2HG1 ILE 76 -4.235 3.873 3.735 549 HG13 ILE 76 1HG1 ILE 76 -4.584 3.450 5.355 550 HG21 ILE 76 1HG2 ILE 76 -6.534 4.184 2.374 551 HG22 ILE 76 2HG2 ILE 76 -7.697 3.376 3.368 552 HG23 ILE 76 3HG2 ILE 76 -7.814 5.153 3.138 553 HD11 ILE 76 HD3 ILE 76 -4.237 1.464 4.035 554 HD12 ILE 76 HD1 ILE 76 -5.800 1.651 4.708 555 HD13 ILE 76 HD2 ILE 76 -5.560 1.841 2.893 556 H LYS 77 H LYS 77 -6.504 5.403 7.205 557 HA LYS 77 HA LYS 77 -4.199 4.679 8.522 558 HB2 LYS 77 HB2 LYS 77 -3.665 6.569 9.875 559 HB3 LYS 77 HB1 LYS 77 -3.095 6.727 8.248 560 HG2 LYS 77 HG2 LYS 77 -4.499 8.409 7.703 561 HG3 LYS 77 HG1 LYS 77 -5.844 7.731 8.707 562 HD2 LYS 77 HD2 LYS 77 -5.377 9.770 9.515 563 HD3 LYS 77 HD1 LYS 77 -4.759 8.524 10.688 564 HE2 LYS 77 HE2 LYS 77 -2.469 9.099 9.792 565 HE3 LYS 77 HE1 LYS 77 -3.116 10.457 8.886 566 HZ1 LYS 77 HZ1 LYS 77 -4.076 11.167 11.067 567 HZ2 LYS 77 HZ2 LYS 77 -3.233 9.862 11.770 568 HZ3 LYS 77 HZ3 LYS 77 -2.400 11.074 11.143 569 H LEU 78 H LEU 78 -4.577 3.879 10.483 570 HA LEU 78 HA LEU 78 -6.535 5.117 12.213 571 HB2 LEU 78 HB2 LEU 78 -6.713 2.264 11.275 572 HB3 LEU 78 HB1 LEU 78 -7.270 2.751 12.977 573 HG LEU 78 HG LEU 78 -8.443 3.624 10.237 574 HD11 LEU 78 1HD1 LEU 78 -10.404 2.201 10.929 575 HD12 LEU 78 2HD1 LEU 78 -8.806 1.376 10.722 576 HD13 LEU 78 3HD1 LEU 78 -9.369 1.820 12.324 577 HD21 LEU 78 3HD2 LEU 78 -10.171 4.749 11.581 578 HD22 LEU 78 1HD2 LEU 78 -9.198 4.373 12.994 579 HD23 LEU 78 2HD2 LEU 78 -8.495 5.422 11.717 580 H VAL 79 H VAL 79 -4.599 3.725 14.787 581 HA VAL 79 HA VAL 79 -7.499 4.070 14.475 582 HB VAL 79 HB VAL 79 -7.605 3.077 16.727 583 HG11 VAL 79 1HG1 VAL 79 -6.028 1.277 14.900 584 HG12 VAL 79 2HG1 VAL 79 -6.876 0.752 16.253 585 HG13 VAL 79 3HG1 VAL 79 -7.784 1.645 14.877 586 HG21 VAL 79 3HG2 VAL 79 -5.575 3.767 17.716 587 HG22 VAL 79 1HG2 VAL 79 -5.679 1.980 17.747 588 HG23 VAL 79 2HG2 VAL 79 -4.616 2.730 16.590 589 H THR 80 H THR 80 -8.642 5.323 16.016 590 HA THR 80 HA THR 80 -7.349 8.039 16.529 591 HB THR 80 HB THR 80 -9.464 8.875 16.282 592 HG1 THR 80 HG1 THR 80 -10.477 6.321 16.493 593 HG21 THR 80 1HG2 THR 80 -9.634 6.575 14.329 594 HG22 THR 80 2HG2 THR 80 -10.578 8.081 14.505 595 HG23 THR 80 3HG2 THR 80 -8.749 8.043 14.225 596 HA PRO 81 HA PRO 81 -7.697 7.827 20.825 597 HB2 PRO 81 HB1 PRO 81 -9.924 9.863 20.819 598 HB3 PRO 81 HB2 PRO 81 -8.335 9.949 21.711 599 HG2 PRO 81 HG1 PRO 81 -8.670 11.434 19.663 600 HG3 PRO 81 HG2 PRO 81 -7.090 10.662 19.994 601 HD2 PRO 81 HD1 PRO 81 -9.303 9.927 18.028 602 HD3 PRO 81 HD2 PRO 81 -7.478 9.803 17.908 603 H LEU 82 H LEU 82 -10.559 7.030 19.033 604 HA LEU 82 HA LEU 82 -12.005 6.060 21.347 605 HB2 LEU 82 HB2 LEU 82 -12.164 5.587 18.365 606 HB3 LEU 82 HB1 LEU 82 -13.319 4.900 19.485 607 HG LEU 82 HG LEU 82 -12.870 7.862 18.900 608 HD11 LEU 82 1HD1 LEU 82 -15.268 7.727 18.079 609 HD12 LEU 82 2HD1 LEU 82 -14.119 6.585 17.269 610 HD13 LEU 82 3HD1 LEU 82 -15.209 6.001 18.465 611 HD21 LEU 82 3HD2 LEU 82 -14.988 8.118 20.283 612 HD22 LEU 82 1HD2 LEU 82 -14.791 6.507 20.893 613 HD23 LEU 82 2HD2 LEU 82 -13.649 7.841 21.370 614 H GLU 83 H GLU 83 -9.271 5.017 19.799 615 HA GLU 83 HA GLU 83 -9.222 2.495 21.363 616 HB2 GLU 83 HB2 GLU 83 -9.353 2.653 18.541 617 HB3 GLU 83 HB1 GLU 83 -7.621 2.257 18.967 618 HG2 GLU 83 HG2 GLU 83 -8.770 0.322 18.514 619 HG3 GLU 83 HG1 GLU 83 -8.454 0.421 20.322 620 H ASN 84 H ASN 84 -7.094 5.022 19.756 621 HA ASN 84 HA ASN 84 -5.333 4.750 22.093 622 HB2 ASN 84 HB2 ASN 84 -4.726 2.924 20.481 623 HB3 ASN 84 HB1 ASN 84 -4.183 4.230 19.392 624 HD21 ASN 84 1HD2 ASN 84 -1.691 4.548 19.753 625 HD22 ASN 84 2HD2 ASN 84 -1.026 4.255 21.225 626 H ASN 85 H ASN 85 -3.841 6.482 22.286 627 HA ASN 85 HA ASN 85 -4.449 8.755 20.600 628 HB2 ASN 85 HB2 ASN 85 -5.840 8.828 22.459 629 HB3 ASN 85 HB1 ASN 85 -4.552 8.589 23.645 630 HD21 ASN 85 1HD2 ASN 85 -4.519 10.600 24.829 631 HD22 ASN 85 2HD2 ASN 85 -4.839 12.154 24.046 632 H GLU 86 H GLU 86 -2.729 10.108 20.030 633 HA GLU 86 HA GLU 86 -0.063 9.768 21.447 634 HB2 GLU 86 HB2 GLU 86 -0.767 9.301 18.510 635 HB3 GLU 86 HB1 GLU 86 0.843 9.481 19.188 636 HG2 GLU 86 HG2 GLU 86 0.416 7.538 20.762 637 HG3 GLU 86 HG1 GLU 86 -0.951 7.193 19.724 638 H GLU 87 H GLU 87 0.767 11.513 21.780 639 HA GLU 87 HA GLU 87 0.025 14.169 20.449 640 HB2 GLU 87 HB2 GLU 87 0.367 13.701 23.403 641 HB3 GLU 87 HB1 GLU 87 -0.265 15.109 22.468 642 HG2 GLU 87 HG2 GLU 87 -1.816 13.493 21.612 643 HG3 GLU 87 HG1 GLU 87 -1.486 12.369 23.013 644 H SER 88 H SER 88 1.604 15.584 19.999 645 HA SER 88 HA SER 88 4.282 14.514 20.063 646 HB2 SER 88 HB2 SER 88 4.753 16.522 18.876 647 HB3 SER 88 HB1 SER 88 3.218 15.824 18.262 648 HG SER 88 HG SER 88 2.283 17.712 18.724 649 H GLU 89 H GLU 89 2.385 16.267 22.427 650 HA GLU 89 HA GLU 89 4.446 17.672 23.811 651 HB2 GLU 89 HB2 GLU 89 2.766 17.739 25.573 652 HB3 GLU 89 HB1 GLU 89 2.036 17.983 24.060 653 HG2 GLU 89 HG2 GLU 89 0.662 16.255 24.175 654 HG3 GLU 89 HG1 GLU 89 1.834 15.163 24.869 655 H LYS 90 H LYS 90 4.084 14.264 23.297 656 HA LYS 90 HA LYS 90 6.170 14.025 25.433 657 HB2 LYS 90 HB2 LYS 90 4.454 11.903 24.123 658 HB3 LYS 90 HB1 LYS 90 5.715 11.559 25.266 659 HG2 LYS 90 HG2 LYS 90 4.534 12.637 27.113 660 HG3 LYS 90 HG1 LYS 90 3.390 13.336 26.089 661 HD2 LYS 90 HD2 LYS 90 2.388 11.235 25.388 662 HD3 LYS 90 HD1 LYS 90 3.555 10.262 26.280 663 HE2 LYS 90 HE2 LYS 90 1.638 10.294 27.505 664 HE3 LYS 90 HE1 LYS 90 3.125 10.805 28.274 665 HZ1 LYS 90 HZ1 LYS 90 2.212 13.206 27.886 666 HZ2 LYS 90 HZ2 LYS 90 1.023 12.573 27.056 667 HZ3 LYS 90 HZ3 LYS 90 1.214 12.393 28.759 668 H GLU 91 H GLU 91 6.664 15.080 22.830 669 HA GLU 91 HA GLU 91 8.815 13.227 21.967 670 HB2 GLU 91 HB2 GLU 91 6.924 14.748 20.350 671 HB3 GLU 91 HB1 GLU 91 8.431 13.909 19.754 672 HG2 GLU 91 HG2 GLU 91 7.537 11.823 20.566 673 HG3 GLU 91 HG1 GLU 91 5.935 12.398 20.921 674 H PHE 92 H PHE 92 7.734 16.672 22.560 675 HA PHE 92 HA PHE 92 9.989 17.814 21.188 676 HB2 PHE 92 HB2 PHE 92 7.469 18.786 22.511 677 HB3 PHE 92 HB1 PHE 92 8.642 19.996 21.864 678 HD1 PHE 92 HD1 PHE 92 9.388 18.662 19.239 679 HD2 PHE 92 HD2 PHE 92 5.717 19.518 21.099 680 HE1 PHE 92 HE1 PHE 92 8.260 18.422 16.989 681 HE2 PHE 92 HE2 PHE 92 4.596 19.287 18.913 682 HZ PHE 92 HZ PHE 92 5.883 18.691 16.837 683 H ASP 93 H ASP 93 11.231 19.198 22.327 684 HA ASP 93 HA ASP 93 11.928 18.449 25.126 685 HB2 ASP 93 HB2 ASP 93 13.604 18.403 23.306 686 HB3 ASP 93 HB1 ASP 93 13.387 20.086 23.009 687 H ASP 94 H ASP 94 10.916 21.386 23.251 688 HA ASP 94 HA ASP 94 10.950 22.902 25.775 689 HB2 ASP 94 HB2 ASP 94 12.354 23.356 23.783 690 HB3 ASP 94 HB1 ASP 94 10.866 23.876 23.007 691 H THR 95 H THR 95 8.621 21.346 23.911 692 HA THR 95 HA THR 95 6.490 23.256 24.368 693 HB THR 95 HB THR 95 6.975 21.722 21.781 694 HG1 THR 95 HG1 THR 95 7.696 24.353 22.341 695 HG21 THR 95 1HG2 THR 95 4.910 23.982 22.140 696 HG22 THR 95 2HG2 THR 95 5.444 23.043 20.695 697 HG23 THR 95 3HG2 THR 95 4.521 22.370 21.978 698 H GLY 96 H GLY 96 4.401 22.412 24.023 699 HA2 GLY 96 HA2 GLY 96 2.703 20.964 24.733 700 HA3 GLY 96 HA1 GLY 96 3.916 19.619 24.696 701 H LEU 97 H LEU 97 4.532 22.547 26.498 702 HA LEU 97 HA LEU 97 4.631 20.937 28.909 703 HB2 LEU 97 HB2 LEU 97 5.432 23.802 28.828 704 HB3 LEU 97 HB1 LEU 97 5.889 22.439 29.837 705 HG LEU 97 HG LEU 97 6.494 22.816 26.868 706 HD11 LEU 97 1HD1 LEU 97 8.017 23.667 29.318 707 HD12 LEU 97 2HD1 LEU 97 8.853 23.472 27.757 708 HD13 LEU 97 3HD1 LEU 97 7.606 24.719 28.019 709 HD21 LEU 97 3HD2 LEU 97 7.943 20.936 28.742 710 HD22 LEU 97 1HD2 LEU 97 6.863 20.440 27.493 711 HD23 LEU 97 2HD2 LEU 97 8.351 21.348 27.086 712 H THR 98 H THR 98 2.355 22.812 27.591 713 HA THR 98 HA THR 98 0.774 22.919 30.068 714 HB THR 98 HB THR 98 1.857 24.999 29.984 715 HG1 THR 98 HG1 THR 98 0.221 25.937 30.639 716 HG21 THR 98 1HG2 THR 98 1.607 25.048 27.265 717 HG22 THR 98 2HG2 THR 98 0.150 25.864 27.806 718 HG23 THR 98 3HG2 THR 98 1.732 26.510 28.360 719 H LEU 99 H LEU 99 -1.267 22.369 29.769 720 HA LEU 99 HA LEU 99 -2.638 21.480 27.645 721 HB2 LEU 99 HB2 LEU 99 -3.472 21.277 29.926 722 HB3 LEU 99 HB1 LEU 99 -3.636 22.994 30.114 723 HG LEU 99 HG LEU 99 -5.530 22.910 28.474 724 HD11 LEU 99 1HD1 LEU 99 -6.368 20.902 27.646 725 HD12 LEU 99 2HD1 LEU 99 -4.696 21.062 26.871 726 HD13 LEU 99 3HD1 LEU 99 -4.958 19.996 28.222 727 HD21 LEU 99 3HD2 LEU 99 -5.947 20.625 30.326 728 HD22 LEU 99 1HD2 LEU 99 -5.618 22.198 30.968 729 HD23 LEU 99 2HD2 LEU 99 -6.989 21.956 29.890 730 H GLY 100 H GLY 100 -1.804 24.648 28.347 731 HA2 GLY 100 HA2 GLY 100 -2.154 26.766 27.408 732 HA3 GLY 100 HA1 GLY 100 -2.911 25.905 26.035 733 H ASP 101 H ASP 101 -4.441 25.051 28.885 734 HA ASP 101 HA ASP 101 -6.573 27.067 28.574 735 HB2 ASP 101 HB2 ASP 101 -7.269 24.731 29.282 736 HB3 ASP 101 HB1 ASP 101 -6.189 24.874 30.658 737 H VAL 102 H VAL 102 -6.014 28.898 28.702 738 HA VAL 102 HA VAL 102 -4.663 29.907 31.026 739 HB VAL 102 HB VAL 102 -4.330 31.960 29.433 740 HG11 VAL 102 1HG1 VAL 102 -2.371 30.977 28.552 741 HG12 VAL 102 2HG1 VAL 102 -2.571 30.288 30.158 742 HG13 VAL 102 3HG1 VAL 102 -3.069 29.332 28.876 743 HG21 VAL 102 3HG2 VAL 102 -5.152 29.920 27.327 744 HG22 VAL 102 1HG2 VAL 102 -6.096 31.345 27.772 745 HG23 VAL 102 2HG2 VAL 102 -4.486 31.505 27.156 746 H VAL 103 H VAL 103 -7.149 32.615 31.677 747 HA VAL 103 HA VAL 103 -4.195 32.329 31.295 748 HB VAL 103 HB VAL 103 -5.947 33.761 33.429 749 HG11 VAL 103 1HG1 VAL 103 -3.868 33.163 34.457 750 HG12 VAL 103 2HG1 VAL 103 -2.904 33.945 33.075 751 HG13 VAL 103 3HG1 VAL 103 -3.878 34.868 34.210 752 HG21 VAL 103 3HG2 VAL 103 -4.408 34.750 31.038 753 HG22 VAL 103 1HG2 VAL 103 -6.171 34.885 31.401 754 HG23 VAL 103 2HG2 VAL 103 -5.108 35.798 32.325 755 H ASN 104 H ASN 104 -3.012 30.797 32.274 756 HA ASN 104 HA ASN 104 -4.179 28.906 33.958 757 HB2 ASN 104 HB2 ASN 104 -2.599 28.093 32.323 758 HB3 ASN 104 HB1 ASN 104 -1.458 29.213 32.816 759 HD21 ASN 104 1HD2 ASN 104 -0.102 26.905 33.146 760 HD22 ASN 104 2HD2 ASN 104 -0.491 25.843 34.362 761 H ILE 105 H ILE 105 -4.540 29.457 35.990 762 HA ILE 105 HA ILE 105 -2.782 31.191 37.510 763 HB ILE 105 HB ILE 105 -4.322 31.160 39.248 764 HG12 ILE 105 2HG1 ILE 105 -5.369 28.982 39.278 765 HG13 ILE 105 1HG1 ILE 105 -6.541 30.173 38.996 766 HG21 ILE 105 1HG2 ILE 105 -5.364 31.873 36.517 767 HG22 ILE 105 2HG2 ILE 105 -6.219 32.317 38.050 768 HG23 ILE 105 3HG2 ILE 105 -4.741 32.955 37.814 769 HD11 ILE 105 HD3 ILE 105 -5.716 28.145 36.953 770 HD12 ILE 105 HD1 ILE 105 -7.200 28.498 37.850 771 HD13 ILE 105 HD2 ILE 105 -6.759 29.638 36.659 772 H LYS 106 H LYS 106 -2.663 27.757 37.049 773 HA LYS 106 HA LYS 106 -1.732 26.920 39.694 774 HB2 LYS 106 HB2 LYS 106 -2.468 25.434 38.221 775 HB3 LYS 106 HB1 LYS 106 -1.168 25.752 36.983 776 HG2 LYS 106 HG2 LYS 106 0.516 25.062 38.463 777 HG3 LYS 106 HG1 LYS 106 -0.518 25.086 39.887 778 HD2 LYS 106 HD2 LYS 106 -0.233 22.799 39.438 779 HD3 LYS 106 HD1 LYS 106 -1.858 23.297 39.145 780 HE2 LYS 106 HE2 LYS 106 -1.640 21.774 37.610 781 HE3 LYS 106 HE1 LYS 106 -1.353 23.155 36.620 782 HZ1 LYS 106 HZ1 LYS 106 0.845 21.710 37.972 783 HZ2 LYS 106 HZ2 LYS 106 0.210 21.170 36.575 784 HZ3 LYS 106 HZ3 LYS 106 0.948 22.618 36.587 785 H GLU 107 H GLU 107 0.003 28.243 36.613 786 HA GLU 107 HA GLU 107 2.453 28.170 37.822 787 HB2 GLU 107 HB2 GLU 107 1.117 29.386 35.388 788 HB3 GLU 107 HB1 GLU 107 2.842 29.614 35.624 789 HG2 GLU 107 HG2 GLU 107 1.675 26.886 35.587 790 HG3 GLU 107 HG1 GLU 107 2.338 27.807 34.084 791 H GLY 108 H GLY 108 -0.085 30.291 38.331 792 HA2 GLY 108 HA2 GLY 108 1.307 31.608 40.340 793 HA3 GLY 108 HA1 GLY 108 1.505 32.675 38.923 794 H LYS 109 H LYS 109 0.045 32.510 41.597 795 HA LYS 109 HA LYS 109 -2.233 34.226 40.655 796 HB2 LYS 109 HB2 LYS 109 -3.238 32.042 41.013 797 HB3 LYS 109 HB1 LYS 109 -2.346 31.910 42.566 798 HG2 LYS 109 HG2 LYS 109 -3.976 33.795 43.410 799 HG3 LYS 109 HG1 LYS 109 -4.763 33.677 41.891 800 HD2 LYS 109 HD2 LYS 109 -5.259 31.313 42.271 801 HD3 LYS 109 HD1 LYS 109 -4.281 31.405 43.799 802 HE2 LYS 109 HE2 LYS 109 -5.773 33.110 44.733 803 HE3 LYS 109 HE1 LYS 109 -6.921 32.974 43.389 804 HZ1 LYS 109 HZ1 LYS 109 -7.610 31.687 45.109 805 HZ2 LYS 109 HZ2 LYS 109 -7.030 30.563 44.030 806 HZ3 LYS 109 HZ3 LYS 109 -6.179 30.899 45.329 807 H LYS 110 H LYS 110 -2.203 36.130 42.164 808 HA LYS 110 HA LYS 110 -1.790 35.982 44.738 809 HB2 LYS 110 HB2 LYS 110 0.348 36.954 45.188 810 HB3 LYS 110 HB1 LYS 110 0.653 35.342 44.426 811 HG2 LYS 110 HG2 LYS 110 0.993 36.541 42.225 812 HG3 LYS 110 HG1 LYS 110 0.923 38.012 43.217 813 HD2 LYS 110 HD2 LYS 110 2.953 37.668 44.283 814 HD3 LYS 110 HD1 LYS 110 3.041 36.019 44.071 815 HE2 LYS 110 HE2 LYS 110 3.418 36.432 41.556 816 HE3 LYS 110 HE1 LYS 110 3.653 38.132 42.024 817 HZ1 LYS 110 HZ1 LYS 110 5.140 36.212 43.546 818 HZ2 LYS 110 HZ2 LYS 110 5.534 36.444 41.882 819 HZ3 LYS 110 HZ3 LYS 110 5.732 37.568 42.894 820 H LEU 111 H LEU 111 -2.010 37.606 41.768 821 HA LEU 111 HA LEU 111 -2.366 40.289 42.839 822 HB2 LEU 111 HB2 LEU 111 -3.427 39.175 40.287 823 HB3 LEU 111 HB1 LEU 111 -3.078 40.873 40.627 824 HG LEU 111 HG LEU 111 -0.859 38.741 40.559 825 HD11 LEU 111 1HD1 LEU 111 -1.967 40.784 38.344 826 HD12 LEU 111 2HD1 LEU 111 -0.615 39.700 38.147 827 HD13 LEU 111 3HD1 LEU 111 -2.181 39.015 38.464 828 HD21 LEU 111 3HD2 LEU 111 -0.945 41.799 40.653 829 HD22 LEU 111 1HD2 LEU 111 -0.162 40.614 41.785 830 HD23 LEU 111 2HD2 LEU 111 0.371 40.863 40.064 831 H GLU 112 H GLU 112 -4.948 40.892 41.626 832 HA GLU 112 HA GLU 112 -6.724 39.728 43.568 833 HB2 GLU 112 HB2 GLU 112 -4.930 40.746 45.072 834 HB3 GLU 112 HB1 GLU 112 -5.227 42.302 44.228 835 HG2 GLU 112 HG2 GLU 112 -7.549 42.278 45.092 836 HG3 GLU 112 HG1 GLU 112 -7.326 40.636 45.560 837 H HIS 113 H HIS 113 -6.253 42.874 42.026 838 HA HIS 113 HA HIS 113 -9.185 42.757 41.269 839 HB2 HIS 113 HB2 HIS 113 -9.204 45.150 41.534 840 HB3 HIS 113 HB1 HIS 113 -8.775 44.328 42.971 841 HD2 HIS 113 HD2 HIS 113 -6.071 44.779 43.695 842 HE1 HIS 113 HE1 HIS 113 -5.144 47.626 40.640 843 HE2 HIS 113 HE2 HIS 113 -4.266 46.528 42.770 844 H HIS 114 H HIS 114 -6.583 41.862 39.992 845 HA HIS 114 HA HIS 114 -5.639 43.734 38.033 846 HB2 HIS 114 HB2 HIS 114 -4.581 41.799 37.210 847 HB3 HIS 114 HB1 HIS 114 -4.309 41.999 38.859 848 HD2 HIS 114 HD2 HIS 114 -5.141 39.310 36.447 849 HE1 HIS 114 HE1 HIS 114 -6.698 37.660 40.034 850 HE2 HIS 114 HE2 HIS 114 -6.041 37.211 37.621 Start of MODEL 12 1 H1 GLU 13 H1 GLU 13 21.188 -20.027 -3.538 2 H2 GLU 13 H2 GLU 13 21.065 -19.496 -2.059 3 H3 GLU 13 H3 GLU 13 19.727 -19.445 -2.881 4 HA GLU 13 HA GLU 13 22.211 -17.753 -3.278 5 HB2 GLU 13 HB2 GLU 13 19.567 -17.803 -4.830 6 HB3 GLU 13 HB1 GLU 13 20.908 -16.615 -4.942 7 HG2 GLU 13 HG2 GLU 13 22.445 -18.289 -5.770 8 HG3 GLU 13 HG1 GLU 13 21.260 -19.539 -5.667 9 H ASN 14 H ASN 14 21.400 -15.217 -3.107 10 HA ASN 14 HA ASN 14 20.919 -15.466 -0.378 11 HB2 ASN 14 HB2 ASN 14 22.805 -14.220 -1.501 12 HB3 ASN 14 HB1 ASN 14 21.639 -13.250 -2.168 13 HD21 ASN 14 1HD2 ASN 14 23.324 -11.741 -0.862 14 HD22 ASN 14 2HD2 ASN 14 22.862 -11.334 0.805 15 H ALA 15 H ALA 15 19.014 -14.563 0.616 16 HA ALA 15 HA ALA 15 16.809 -13.892 -1.222 17 HB1 ALA 15 HB1 ALA 15 15.561 -14.492 0.812 18 HB2 ALA 15 HB2 ALA 15 16.790 -15.755 0.523 19 HB3 ALA 15 HB3 ALA 15 17.002 -14.478 1.837 20 H GLU 16 H GLU 16 18.863 -12.121 0.726 21 HA GLU 16 HA GLU 16 16.822 -10.062 1.339 22 HB2 GLU 16 HB2 GLU 16 19.622 -9.970 2.418 23 HB3 GLU 16 HB1 GLU 16 18.125 -9.449 3.125 24 HG2 GLU 16 HG2 GLU 16 17.493 -11.933 3.491 25 HG3 GLU 16 HG1 GLU 16 19.198 -12.283 2.780 26 H LEU 17 H LEU 17 17.809 -10.092 -1.346 27 HA LEU 17 HA LEU 17 19.605 -7.771 -1.581 28 HB2 LEU 17 HB2 LEU 17 18.253 -9.557 -3.619 29 HB3 LEU 17 HB1 LEU 17 19.503 -8.427 -3.953 30 HG LEU 17 HG LEU 17 19.740 -11.049 -2.213 31 HD11 LEU 17 1HD1 LEU 17 20.800 -11.958 -4.179 32 HD12 LEU 17 2HD1 LEU 17 19.232 -11.335 -4.632 33 HD13 LEU 17 3HD1 LEU 17 20.829 -10.460 -5.007 34 HD21 LEU 17 3HD2 LEU 17 22.117 -10.715 -2.404 35 HD22 LEU 17 1HD2 LEU 17 21.880 -9.223 -3.346 36 HD23 LEU 17 2HD2 LEU 17 21.513 -9.276 -1.590 37 H GLU 18 H GLU 18 16.188 -8.325 -1.951 38 HA GLU 18 HA GLU 18 16.025 -5.654 -3.121 39 HB2 GLU 18 HB2 GLU 18 15.611 -7.854 -4.449 40 HB3 GLU 18 HB1 GLU 18 14.194 -8.035 -3.293 41 HG2 GLU 18 HG2 GLU 18 12.922 -6.442 -4.301 42 HG3 GLU 18 HG1 GLU 18 14.244 -5.858 -5.298 43 H ILE 19 H ILE 19 15.486 -6.698 -0.229 44 HA ILE 19 HA ILE 19 12.672 -5.887 0.183 45 HB ILE 19 HB ILE 19 12.957 -7.105 2.209 46 HG12 ILE 19 2HG1 ILE 19 15.554 -8.136 1.198 47 HG13 ILE 19 1HG1 ILE 19 15.257 -6.912 2.597 48 HG21 ILE 19 1HG2 ILE 19 13.109 -9.256 1.009 49 HG22 ILE 19 2HG2 ILE 19 11.894 -8.226 0.407 50 HG23 ILE 19 3HG2 ILE 19 13.440 -8.424 -0.511 51 HD11 ILE 19 HD3 ILE 19 15.707 -9.102 3.460 52 HD12 ILE 19 HD1 ILE 19 14.056 -8.411 3.795 53 HD13 ILE 19 HD2 ILE 19 14.371 -9.727 2.549 54 H VAL 20 H VAL 20 12.145 -4.626 2.171 55 HA VAL 20 HA VAL 20 13.935 -2.393 2.680 56 HB VAL 20 HB VAL 20 11.397 -2.427 2.508 57 HG11 VAL 20 1HG1 VAL 20 11.329 -3.609 5.345 58 HG12 VAL 20 2HG1 VAL 20 10.011 -3.038 4.304 59 HG13 VAL 20 3HG1 VAL 20 10.916 -4.518 3.876 60 HG21 VAL 20 3HG2 VAL 20 11.083 -0.556 4.086 61 HG22 VAL 20 1HG2 VAL 20 12.320 -1.197 5.140 62 HG23 VAL 20 2HG2 VAL 20 12.688 -0.740 3.439 63 H THR 21 H THR 21 14.792 -1.832 4.744 64 HA THR 21 HA THR 21 15.978 -3.896 6.182 65 HB THR 21 HB THR 21 16.432 -2.120 7.943 66 HG1 THR 21 HG1 THR 21 15.052 -0.623 8.038 67 HG21 THR 21 1HG2 THR 21 17.971 -2.122 6.065 68 HG22 THR 21 2HG2 THR 21 16.844 -1.617 4.975 69 HG23 THR 21 3HG2 THR 21 17.436 -0.410 6.098 70 H ASP 22 H ASP 22 12.976 -2.150 7.141 71 HA ASP 22 HA ASP 22 11.680 -4.535 7.971 72 HB2 ASP 22 HB2 ASP 22 12.954 -4.145 9.990 73 HB3 ASP 22 HB1 ASP 22 12.557 -2.390 9.985 74 H TYR 23 H TYR 23 9.455 -4.020 7.564 75 HA TYR 23 HA TYR 23 8.698 -1.634 6.164 76 HB2 TYR 23 HB2 TYR 23 7.957 -4.089 6.267 77 HB3 TYR 23 HB1 TYR 23 6.874 -3.467 7.526 78 HD1 TYR 23 HD1 TYR 23 7.864 -2.789 3.976 79 HD2 TYR 23 HD2 TYR 23 4.821 -2.693 6.949 80 HE1 TYR 23 HE1 TYR 23 6.108 -2.056 2.181 81 HE2 TYR 23 HE2 TYR 23 3.163 -1.878 5.287 82 HH TYR 23 HH TYR 23 2.825 -1.159 3.226 83 H TYR 24 H TYR 24 7.066 -0.136 6.628 84 HA TYR 24 HA TYR 24 7.267 0.813 9.363 85 HB2 TYR 24 HB2 TYR 24 5.886 2.168 7.090 86 HB3 TYR 24 HB1 TYR 24 6.424 2.903 8.510 87 HD1 TYR 24 HD1 TYR 24 9.360 2.013 8.680 88 HD2 TYR 24 HD2 TYR 24 6.895 2.581 5.276 89 HE1 TYR 24 HE1 TYR 24 11.300 2.897 7.522 90 HE2 TYR 24 HE2 TYR 24 8.729 3.555 3.996 91 HH TYR 24 HH TYR 24 12.128 3.780 5.366 92 H LYS 25 H LYS 25 5.382 1.713 10.530 93 HA LYS 25 HA LYS 25 4.045 -0.766 11.121 94 HB2 LYS 25 HB2 LYS 25 4.755 1.695 12.700 95 HB3 LYS 25 HB1 LYS 25 4.213 0.232 13.315 96 HG2 LYS 25 HG2 LYS 25 6.583 -0.614 12.160 97 HG3 LYS 25 HG1 LYS 25 6.859 1.149 12.189 98 HD2 LYS 25 HD2 LYS 25 7.252 1.422 14.274 99 HD3 LYS 25 HD1 LYS 25 6.032 0.253 14.781 100 HE2 LYS 25 HE2 LYS 25 7.693 -1.530 13.791 101 HE3 LYS 25 HE1 LYS 25 8.793 -0.270 13.622 102 HZ1 LYS 25 HZ1 LYS 25 8.642 0.049 16.044 103 HZ2 LYS 25 HZ2 LYS 25 7.667 -1.253 16.243 104 HZ3 LYS 25 HZ3 LYS 25 9.148 -1.499 15.574 105 H ILE 26 H ILE 26 3.177 2.743 11.179 106 HA ILE 26 HA ILE 26 0.725 2.305 12.605 107 HB ILE 26 HB ILE 26 0.167 4.543 12.135 108 HG12 ILE 26 2HG1 ILE 26 2.823 4.638 10.644 109 HG13 ILE 26 1HG1 ILE 26 1.304 4.971 9.941 110 HG21 ILE 26 1HG2 ILE 26 1.752 5.352 13.795 111 HG22 ILE 26 2HG2 ILE 26 1.431 3.545 13.968 112 HG23 ILE 26 3HG2 ILE 26 2.857 4.190 13.183 113 HD11 ILE 26 HD3 ILE 26 1.098 6.984 11.510 114 HD12 ILE 26 HD1 ILE 26 2.720 6.665 12.139 115 HD13 ILE 26 HD2 ILE 26 2.407 7.026 10.400 116 H ILE 27 H ILE 27 1.590 2.502 9.121 117 HA ILE 27 HA ILE 27 -0.880 2.612 8.148 118 HB ILE 27 HB ILE 27 0.173 1.755 5.933 119 HG12 ILE 27 2HG1 ILE 27 2.752 1.894 7.639 120 HG13 ILE 27 1HG1 ILE 27 2.066 0.369 7.355 121 HG21 ILE 27 1HG2 ILE 27 1.282 3.595 5.489 122 HG22 ILE 27 2HG2 ILE 27 0.020 4.071 6.517 123 HG23 ILE 27 3HG2 ILE 27 1.690 4.018 7.183 124 HD11 ILE 27 HD3 ILE 27 3.247 2.250 5.288 125 HD12 ILE 27 HD1 ILE 27 3.623 0.574 5.694 126 HD13 ILE 27 HD2 ILE 27 2.174 1.021 4.712 127 H LYS 28 H LYS 28 0.794 -0.426 8.818 128 HA LYS 28 HA LYS 28 -0.430 -2.297 8.062 129 HB2 LYS 28 HB2 LYS 28 0.538 -1.848 10.784 130 HB3 LYS 28 HB1 LYS 28 0.070 -3.500 10.341 131 HG2 LYS 28 HG2 LYS 28 1.600 -3.192 8.229 132 HG3 LYS 28 HG1 LYS 28 2.289 -1.884 9.143 133 HD2 LYS 28 HD2 LYS 28 2.809 -3.555 10.987 134 HD3 LYS 28 HD1 LYS 28 2.165 -4.833 9.910 135 HE2 LYS 28 HE2 LYS 28 3.998 -4.255 8.358 136 HE3 LYS 28 HE1 LYS 28 4.428 -2.918 9.343 137 HZ1 LYS 28 HZ1 LYS 28 5.930 -4.736 9.932 138 HZ2 LYS 28 HZ2 LYS 28 4.950 -4.495 11.196 139 HZ3 LYS 28 HZ3 LYS 28 4.636 -5.721 10.194 140 H THR 29 H THR 29 -2.020 -1.594 11.290 141 HA THR 29 HA THR 29 -3.737 -3.858 10.695 142 HB THR 29 HB THR 29 -4.552 -3.683 12.733 143 HG1 THR 29 HG1 THR 29 -4.479 -2.157 14.072 144 HG21 THR 29 1HG2 THR 29 -2.342 -3.408 14.212 145 HG22 THR 29 2HG2 THR 29 -2.438 -4.757 13.192 146 HG23 THR 29 3HG2 THR 29 -1.476 -3.314 12.751 147 H ALA 30 H ALA 30 -4.328 -0.492 10.331 148 HA ALA 30 HA ALA 30 -7.127 -0.290 10.131 149 HB1 ALA 30 HB1 ALA 30 -5.327 1.524 10.330 150 HB2 ALA 30 HB2 ALA 30 -4.641 1.128 8.889 151 HB3 ALA 30 HB3 ALA 30 -6.293 1.778 8.825 152 H ARG 31 H ARG 31 -4.890 -1.610 7.946 153 HA ARG 31 HA ARG 31 -6.278 -1.432 5.660 154 HB2 ARG 31 HB2 ARG 31 -4.952 -3.340 4.798 155 HB3 ARG 31 HB1 ARG 31 -4.099 -2.564 5.983 156 HG2 ARG 31 HG2 ARG 31 -4.848 -4.148 7.733 157 HG3 ARG 31 HG1 ARG 31 -5.747 -4.964 6.494 158 HD2 ARG 31 HD2 ARG 31 -2.675 -4.644 6.143 159 HD3 ARG 31 HD1 ARG 31 -3.245 -5.745 7.237 160 HE ARG 31 HE ARG 31 -4.510 -6.876 5.417 161 HH11 ARG 31 1HH2 ARG 31 -1.505 -4.919 4.555 162 HH12 ARG 31 2HH2 ARG 31 -1.181 -6.200 3.435 163 HH21 ARG 31 1HH1 ARG 31 -4.089 -8.064 3.498 164 HH22 ARG 31 2HH1 ARG 31 -2.652 -7.752 2.734 165 H GLU 32 H GLU 32 -7.302 -3.820 8.119 166 HA GLU 32 HA GLU 32 -9.236 -5.057 6.642 167 HB2 GLU 32 HB2 GLU 32 -9.111 -4.519 9.667 168 HB3 GLU 32 HB1 GLU 32 -10.142 -5.652 8.873 169 HG2 GLU 32 HG2 GLU 32 -7.894 -6.698 7.777 170 HG3 GLU 32 HG1 GLU 32 -7.128 -5.754 9.015 171 H GLN 33 H GLN 33 -9.549 -1.699 7.939 172 HA GLN 33 HA GLN 33 -12.336 -1.608 8.268 173 HB2 GLN 33 HB2 GLN 33 -10.438 0.695 7.484 174 HB3 GLN 33 HB1 GLN 33 -11.967 0.633 8.220 175 HG2 GLN 33 HG2 GLN 33 -11.316 -0.292 10.320 176 HG3 GLN 33 HG1 GLN 33 -9.663 -0.572 9.658 177 HE21 GLN 33 1HE2 GLN 33 -10.528 1.298 12.072 178 HE22 GLN 33 2HE2 GLN 33 -10.105 2.824 11.507 179 H LEU 34 H LEU 34 -10.259 -1.371 5.359 180 HA LEU 34 HA LEU 34 -12.432 -0.578 3.731 181 HB2 LEU 34 HB2 LEU 34 -9.545 -1.187 3.560 182 HB3 LEU 34 HB1 LEU 34 -10.607 -0.981 2.085 183 HG LEU 34 HG LEU 34 -11.172 1.349 2.678 184 HD11 LEU 34 1HD1 LEU 34 -10.931 1.685 4.901 185 HD12 LEU 34 2HD1 LEU 34 -9.328 0.882 4.949 186 HD13 LEU 34 3HD1 LEU 34 -9.508 2.480 4.205 187 HD21 LEU 34 3HD2 LEU 34 -9.483 0.903 1.115 188 HD22 LEU 34 1HD2 LEU 34 -8.789 2.171 2.052 189 HD23 LEU 34 2HD2 LEU 34 -8.212 0.517 2.248 190 H GLY 35 H GLY 35 -10.707 -3.581 4.404 191 HA2 GLY 35 HA2 GLY 35 -11.044 -5.809 3.929 192 HA3 GLY 35 HA1 GLY 35 -12.690 -5.253 3.468 193 H ILE 36 H ILE 36 -10.877 -3.507 1.411 194 HA ILE 36 HA ILE 36 -11.755 -5.014 -0.725 195 HB ILE 36 HB ILE 36 -10.157 -3.394 -2.001 196 HG12 ILE 36 2HG1 ILE 36 -9.623 -2.089 0.640 197 HG13 ILE 36 1HG1 ILE 36 -8.582 -3.241 -0.182 198 HG21 ILE 36 1HG2 ILE 36 -12.084 -1.834 -0.329 199 HG22 ILE 36 2HG2 ILE 36 -11.469 -1.671 -1.954 200 HG23 ILE 36 3HG2 ILE 36 -12.591 -3.005 -1.557 201 HD11 ILE 36 HD3 ILE 36 -8.340 -1.722 -2.076 202 HD12 ILE 36 HD1 ILE 36 -9.589 -0.695 -1.317 203 HD13 ILE 36 HD2 ILE 36 -7.924 -0.936 -0.611 204 H SER 37 H SER 37 -10.693 -6.207 -2.440 205 HA SER 37 HA SER 37 -8.431 -7.865 -1.715 206 HB2 SER 37 HB2 SER 37 -8.987 -9.100 -3.631 207 HB3 SER 37 HB1 SER 37 -10.508 -8.484 -3.005 208 HG SER 37 HG SER 37 -10.218 -8.023 -5.398 209 H GLN 38 H GLN 38 -6.340 -8.040 -2.845 210 HA GLN 38 HA GLN 38 -5.116 -5.811 -3.339 211 HB2 GLN 38 HB2 GLN 38 -4.596 -8.720 -4.215 212 HB3 GLN 38 HB1 GLN 38 -3.583 -7.421 -4.866 213 HG2 GLN 38 HG2 GLN 38 -3.038 -6.667 -2.510 214 HG3 GLN 38 HG1 GLN 38 -3.947 -8.083 -2.011 215 HE21 GLN 38 1HE2 GLN 38 -1.695 -8.985 -1.008 216 HE22 GLN 38 2HE2 GLN 38 -0.743 -9.740 -2.237 217 H GLN 39 H GLN 39 -6.976 -7.576 -5.832 218 HA GLN 39 HA GLN 39 -6.016 -5.995 -7.972 219 HB2 GLN 39 HB2 GLN 39 -7.160 -8.290 -7.960 220 HB3 GLN 39 HB1 GLN 39 -8.670 -7.535 -7.732 221 HG2 GLN 39 HG2 GLN 39 -8.523 -6.438 -9.985 222 HG3 GLN 39 HG1 GLN 39 -6.931 -6.897 -10.244 223 HE21 GLN 39 1HE2 GLN 39 -6.342 -9.103 -10.287 224 HE22 GLN 39 2HE2 GLN 39 -7.475 -10.372 -10.763 225 H GLN 40 H GLN 40 -8.570 -5.337 -5.456 226 HA GLN 40 HA GLN 40 -9.804 -3.401 -7.234 227 HB2 GLN 40 HB2 GLN 40 -10.070 -3.876 -4.255 228 HB3 GLN 40 HB1 GLN 40 -10.870 -2.724 -5.124 229 HG2 GLN 40 HG2 GLN 40 -12.173 -4.432 -6.453 230 HG3 GLN 40 HG1 GLN 40 -11.165 -5.677 -5.887 231 HE21 GLN 40 1HE2 GLN 40 -13.998 -3.972 -5.452 232 HE22 GLN 40 2HE2 GLN 40 -14.331 -4.286 -3.798 233 H LEU 41 H LEU 41 -7.276 -3.663 -4.813 234 HA LEU 41 HA LEU 41 -6.990 -0.971 -4.219 235 HB2 LEU 41 HB2 LEU 41 -6.228 -2.701 -2.754 236 HB3 LEU 41 HB1 LEU 41 -5.137 -3.320 -3.906 237 HG LEU 41 HG LEU 41 -3.782 -1.315 -3.846 238 HD11 LEU 41 1HD1 LEU 41 -5.457 -0.298 -1.440 239 HD12 LEU 41 2HD1 LEU 41 -3.994 0.396 -2.153 240 HD13 LEU 41 3HD1 LEU 41 -5.390 0.463 -3.018 241 HD21 LEU 41 3HD2 LEU 41 -4.145 -2.571 -1.078 242 HD22 LEU 41 1HD2 LEU 41 -3.052 -3.084 -2.401 243 HD23 LEU 41 2HD2 LEU 41 -2.746 -1.556 -1.663 244 H ALA 42 H ALA 42 -5.387 -3.221 -6.419 245 HA ALA 42 HA ALA 42 -3.475 -1.519 -7.576 246 HB1 ALA 42 HB1 ALA 42 -3.605 -4.106 -7.740 247 HB2 ALA 42 HB2 ALA 42 -5.111 -3.954 -8.599 248 HB3 ALA 42 HB3 ALA 42 -3.750 -3.382 -9.433 249 H GLN 43 H GLN 43 -6.970 -2.034 -8.418 250 HA GLN 43 HA GLN 43 -7.096 0.112 -10.257 251 HB2 GLN 43 HB2 GLN 43 -9.231 -1.324 -8.505 252 HB3 GLN 43 HB1 GLN 43 -9.426 -0.075 -9.773 253 HG2 GLN 43 HG2 GLN 43 -8.580 -1.318 -11.504 254 HG3 GLN 43 HG1 GLN 43 -8.313 -2.793 -10.533 255 HE21 GLN 43 1HE2 GLN 43 -10.376 -3.641 -9.291 256 HE22 GLN 43 2HE2 GLN 43 -11.830 -3.600 -10.246 257 H LYS 44 H LYS 44 -7.008 0.191 -6.683 258 HA LYS 44 HA LYS 44 -8.561 2.603 -6.618 259 HB2 LYS 44 HB2 LYS 44 -8.438 0.965 -4.673 260 HB3 LYS 44 HB1 LYS 44 -6.675 1.487 -4.622 261 HG2 LYS 44 HG2 LYS 44 -7.196 3.588 -3.750 262 HG3 LYS 44 HG1 LYS 44 -8.839 3.611 -4.155 263 HD2 LYS 44 HD2 LYS 44 -9.061 1.540 -2.535 264 HD3 LYS 44 HD1 LYS 44 -7.332 1.809 -2.316 265 HE2 LYS 44 HE2 LYS 44 -8.384 2.746 -0.509 266 HE3 LYS 44 HE1 LYS 44 -7.871 4.154 -1.365 267 HZ1 LYS 44 HZ1 LYS 44 -10.304 3.945 -2.310 268 HZ2 LYS 44 HZ2 LYS 44 -10.649 2.902 -1.161 269 HZ3 LYS 44 HZ3 LYS 44 -10.221 4.378 -0.713 270 H LEU 45 H LEU 45 -5.189 1.755 -7.304 271 HA LEU 45 HA LEU 45 -4.478 4.461 -6.996 272 HB2 LEU 45 HB2 LEU 45 -2.747 1.951 -6.871 273 HB3 LEU 45 HB1 LEU 45 -2.232 3.590 -6.546 274 HG LEU 45 HG LEU 45 -4.283 2.123 -4.822 275 HD11 LEU 45 1HD1 LEU 45 -2.299 0.838 -4.696 276 HD12 LEU 45 2HD1 LEU 45 -1.367 2.336 -4.188 277 HD13 LEU 45 3HD1 LEU 45 -2.568 1.657 -3.214 278 HD21 LEU 45 3HD2 LEU 45 -3.884 3.892 -3.318 279 HD22 LEU 45 1HD2 LEU 45 -2.588 4.565 -4.223 280 HD23 LEU 45 2HD2 LEU 45 -4.226 4.747 -4.897 281 H LYS 46 H LYS 46 -5.261 2.292 -9.246 282 HA LYS 46 HA LYS 46 -4.861 1.789 -11.421 283 HB2 LYS 46 HB2 LYS 46 -4.409 4.783 -11.379 284 HB3 LYS 46 HB1 LYS 46 -4.590 3.801 -12.800 285 HG2 LYS 46 HG2 LYS 46 -6.533 4.481 -12.602 286 HG3 LYS 46 HG1 LYS 46 -6.802 2.932 -11.730 287 HD2 LYS 46 HD2 LYS 46 -6.530 4.457 -9.572 288 HD3 LYS 46 HD1 LYS 46 -6.531 5.691 -10.731 289 HE2 LYS 46 HE2 LYS 46 -8.861 5.485 -9.847 290 HE3 LYS 46 HE1 LYS 46 -8.683 5.543 -11.461 291 HZ1 LYS 46 HZ1 LYS 46 -8.845 2.945 -11.311 292 HZ2 LYS 46 HZ2 LYS 46 -9.141 3.163 -9.729 293 HZ3 LYS 46 HZ3 LYS 46 -10.171 3.852 -10.732 294 H VAL 47 H VAL 47 -2.897 0.740 -9.980 295 HA VAL 47 HA VAL 47 -0.718 1.060 -11.610 296 HB VAL 47 HB VAL 47 0.553 0.010 -9.527 297 HG11 VAL 47 1HG1 VAL 47 0.455 2.142 -8.262 298 HG12 VAL 47 2HG1 VAL 47 0.129 2.577 -9.874 299 HG13 VAL 47 3HG1 VAL 47 -1.230 2.387 -8.788 300 HG21 VAL 47 3HG2 VAL 47 -0.566 -0.367 -7.387 301 HG22 VAL 47 1HG2 VAL 47 -2.074 0.309 -7.978 302 HG23 VAL 47 2HG2 VAL 47 -1.590 -1.159 -8.609 303 H SER 48 H SER 48 0.757 -1.506 -11.161 304 HA SER 48 HA SER 48 -1.017 -3.617 -11.998 305 HB2 SER 48 HB2 SER 48 1.088 -4.693 -12.252 306 HB3 SER 48 HB1 SER 48 1.275 -3.133 -12.956 307 HG SER 48 HG SER 48 2.834 -2.870 -11.690 308 H GLU 49 H GLU 49 -1.099 -5.618 -10.949 309 HA GLU 49 HA GLU 49 -1.146 -5.478 -7.966 310 HB2 GLU 49 HB2 GLU 49 -1.389 -7.713 -9.886 311 HB3 GLU 49 HB1 GLU 49 -1.320 -7.938 -8.154 312 HG2 GLU 49 HG2 GLU 49 -3.309 -6.628 -7.867 313 HG3 GLU 49 HG1 GLU 49 -3.247 -6.131 -9.626 314 H ASN 50 H ASN 50 1.420 -6.200 -10.417 315 HA ASN 50 HA ASN 50 3.282 -7.358 -8.573 316 HB2 ASN 50 HB2 ASN 50 3.739 -7.004 -11.107 317 HB3 ASN 50 HB1 ASN 50 3.658 -5.275 -10.730 318 HD21 ASN 50 1HD2 ASN 50 5.261 -8.311 -9.911 319 HD22 ASN 50 2HD2 ASN 50 6.839 -7.830 -9.524 320 H ILE 51 H ILE 51 2.699 -3.799 -9.151 321 HA ILE 51 HA ILE 51 4.395 -2.920 -7.180 322 HB ILE 51 HB ILE 51 1.854 -1.811 -8.425 323 HG12 ILE 51 2HG1 ILE 51 4.065 -2.224 -9.677 324 HG13 ILE 51 1HG1 ILE 51 3.280 -0.745 -9.907 325 HG21 ILE 51 1HG2 ILE 51 1.962 -0.596 -6.363 326 HG22 ILE 51 2HG2 ILE 51 3.709 -0.657 -6.309 327 HG23 ILE 51 3HG2 ILE 51 2.970 0.366 -7.567 328 HD11 ILE 51 HD3 ILE 51 5.136 0.085 -8.149 329 HD12 ILE 51 HD1 ILE 51 5.778 -1.600 -8.459 330 HD13 ILE 51 HD2 ILE 51 5.697 -0.411 -9.764 331 H VAL 52 H VAL 52 0.883 -3.872 -6.759 332 HA VAL 52 HA VAL 52 0.833 -2.821 -4.215 333 HB VAL 52 HB VAL 52 -1.249 -3.696 -3.889 334 HG11 VAL 52 1HG1 VAL 52 -1.196 -2.048 -5.450 335 HG12 VAL 52 2HG1 VAL 52 -1.184 -3.370 -6.747 336 HG13 VAL 52 3HG1 VAL 52 -2.574 -3.189 -5.799 337 HG21 VAL 52 3HG2 VAL 52 -2.238 -5.547 -5.293 338 HG22 VAL 52 1HG2 VAL 52 -0.640 -5.895 -5.956 339 HG23 VAL 52 2HG2 VAL 52 -0.931 -6.184 -4.292 340 H LYS 53 H LYS 53 1.311 -6.306 -5.396 341 HA LYS 53 HA LYS 53 1.890 -7.497 -3.131 342 HB2 LYS 53 HB2 LYS 53 2.583 -7.676 -6.001 343 HB3 LYS 53 HB1 LYS 53 3.710 -8.576 -5.041 344 HG2 LYS 53 HG2 LYS 53 1.812 -9.763 -3.811 345 HG3 LYS 53 HG1 LYS 53 0.668 -9.067 -4.949 346 HD2 LYS 53 HD2 LYS 53 2.940 -11.007 -5.483 347 HD3 LYS 53 HD1 LYS 53 1.299 -11.299 -5.363 348 HE2 LYS 53 HE2 LYS 53 2.669 -10.015 -7.809 349 HE3 LYS 53 HE1 LYS 53 1.906 -11.489 -7.584 350 HZ1 LYS 53 HZ1 LYS 53 0.628 -9.734 -8.670 351 HZ2 LYS 53 HZ2 LYS 53 -0.198 -10.552 -7.541 352 HZ3 LYS 53 HZ3 LYS 53 0.379 -9.034 -7.180 353 H ARG 54 H ARG 54 4.136 -5.457 -4.898 354 HA ARG 54 HA ARG 54 6.403 -6.010 -3.207 355 HB2 ARG 54 HB2 ARG 54 5.737 -3.831 -5.140 356 HB3 ARG 54 HB1 ARG 54 7.103 -3.567 -4.062 357 HG2 ARG 54 HG2 ARG 54 7.990 -5.899 -4.718 358 HG3 ARG 54 HG1 ARG 54 6.558 -5.995 -5.781 359 HD2 ARG 54 HD2 ARG 54 7.489 -4.027 -7.146 360 HD3 ARG 54 HD1 ARG 54 8.812 -3.921 -5.947 361 HE ARG 54 HE ARG 54 8.476 -5.758 -8.156 362 HH11 ARG 54 1HH2 ARG 54 10.685 -4.878 -5.506 363 HH12 ARG 54 2HH2 ARG 54 11.993 -5.614 -6.333 364 HH21 ARG 54 1HH1 ARG 54 9.967 -7.319 -8.619 365 HH22 ARG 54 2HH1 ARG 54 11.554 -7.223 -7.866 366 H PHE 55 H PHE 55 3.739 -3.698 -2.686 367 HA PHE 55 HA PHE 55 4.900 -2.475 -0.449 368 HB2 PHE 55 HB2 PHE 55 1.954 -3.035 -0.795 369 HB3 PHE 55 HB1 PHE 55 2.619 -1.944 0.203 370 HD1 PHE 55 HD2 PHE 55 5.015 -1.009 -1.821 371 HD2 PHE 55 HD1 PHE 55 0.752 -1.287 -1.788 372 HE1 PHE 55 HE2 PHE 55 4.905 0.721 -3.596 373 HE2 PHE 55 HE1 PHE 55 0.631 0.367 -3.630 374 HZ PHE 55 HZ PHE 55 2.777 1.462 -4.476 375 H GLU 56 H GLU 56 2.520 -5.394 -0.867 376 HA GLU 56 HA GLU 56 2.287 -6.003 1.700 377 HB2 GLU 56 HB2 GLU 56 0.898 -6.650 -0.296 378 HB3 GLU 56 HB1 GLU 56 2.137 -7.842 -0.801 379 HG2 GLU 56 HG2 GLU 56 0.324 -8.934 0.382 380 HG3 GLU 56 HG1 GLU 56 1.782 -8.965 1.449 381 H SER 57 H SER 57 4.578 -7.508 -0.508 382 HA SER 57 HA SER 57 5.407 -9.243 1.391 383 HB2 SER 57 HB2 SER 57 7.394 -9.538 -0.362 384 HB3 SER 57 HB1 SER 57 5.701 -9.786 -0.737 385 HG SER 57 HG SER 57 5.674 -7.845 -1.879 386 H GLY 58 H GLY 58 6.342 -5.879 1.271 387 HA2 GLY 58 HA2 GLY 58 8.007 -4.723 2.180 388 HA3 GLY 58 HA1 GLY 58 8.758 -6.196 2.945 389 H LYS 59 H LYS 59 8.273 -6.197 -0.736 390 HA LYS 59 HA LYS 59 11.045 -6.537 -0.885 391 HB2 LYS 59 HB2 LYS 59 8.845 -6.988 -2.927 392 HB3 LYS 59 HB1 LYS 59 10.565 -7.087 -3.220 393 HG2 LYS 59 HG2 LYS 59 10.933 -8.709 -1.551 394 HG3 LYS 59 HG1 LYS 59 9.172 -8.899 -1.379 395 HD2 LYS 59 HD2 LYS 59 9.103 -9.642 -3.878 396 HD3 LYS 59 HD1 LYS 59 10.866 -9.302 -3.831 397 HE2 LYS 59 HE2 LYS 59 11.193 -11.111 -2.328 398 HE3 LYS 59 HE1 LYS 59 9.475 -11.003 -1.819 399 HZ1 LYS 59 HZ1 LYS 59 10.837 -12.080 -4.249 400 HZ2 LYS 59 HZ2 LYS 59 10.010 -12.973 -3.283 401 HZ3 LYS 59 HZ3 LYS 59 9.142 -11.941 -4.216 402 H LEU 60 H LEU 60 10.838 -3.919 -0.219 403 HA LEU 60 HA LEU 60 10.894 -2.335 -2.638 404 HB2 LEU 60 HB2 LEU 60 8.795 -2.480 -1.030 405 HB3 LEU 60 HB1 LEU 60 9.831 -1.434 0.062 406 HG LEU 60 HG LEU 60 9.779 0.336 -1.707 407 HD11 LEU 60 1HD1 LEU 60 9.308 -1.364 -3.537 408 HD12 LEU 60 2HD1 LEU 60 7.593 -1.247 -3.058 409 HD13 LEU 60 3HD1 LEU 60 8.487 0.212 -3.552 410 HD21 LEU 60 3HD2 LEU 60 7.202 -0.786 -0.769 411 HD22 LEU 60 1HD2 LEU 60 8.009 0.345 0.283 412 HD23 LEU 60 2HD2 LEU 60 7.437 0.913 -1.313 413 H LYS 61 H LYS 61 12.153 -0.327 -2.834 414 HA LYS 61 HA LYS 61 13.880 0.175 -0.508 415 HB2 LYS 61 HB2 LYS 61 14.653 -0.960 -2.600 416 HB3 LYS 61 HB1 LYS 61 14.288 0.409 -3.542 417 HG2 LYS 61 HG2 LYS 61 15.849 1.676 -1.664 418 HG3 LYS 61 HG1 LYS 61 16.348 -0.044 -1.475 419 HD2 LYS 61 HD2 LYS 61 16.960 -0.117 -3.861 420 HD3 LYS 61 HD1 LYS 61 16.261 1.570 -4.071 421 HE2 LYS 61 HE2 LYS 61 18.040 2.497 -2.726 422 HE3 LYS 61 HE1 LYS 61 18.640 0.992 -2.243 423 HZ1 LYS 61 HZ1 LYS 61 18.638 2.039 -5.001 424 HZ2 LYS 61 HZ2 LYS 61 19.962 1.965 -4.015 425 HZ3 LYS 61 HZ3 LYS 61 19.247 0.597 -4.412 426 HA PRO 62 HA PRO 62 10.816 3.543 -1.113 427 HB2 PRO 62 HB1 PRO 62 9.838 3.714 1.480 428 HB3 PRO 62 HB2 PRO 62 9.498 2.339 0.357 429 HG2 PRO 62 HG1 PRO 62 11.764 2.559 2.393 430 HG3 PRO 62 HG2 PRO 62 10.473 1.419 2.469 431 HD2 PRO 62 HD1 PRO 62 12.768 0.807 1.205 432 HD3 PRO 62 HD2 PRO 62 11.211 0.293 0.409 433 H THR 63 H THR 63 10.807 5.436 1.076 434 HA THR 63 HA THR 63 13.356 6.454 1.672 435 HB THR 63 HB THR 63 13.351 8.292 0.290 436 HG1 THR 63 HG1 THR 63 11.584 8.643 -1.311 437 HG21 THR 63 1HG2 THR 63 13.388 7.518 -2.028 438 HG22 THR 63 2HG2 THR 63 14.250 6.419 -0.900 439 HG23 THR 63 3HG2 THR 63 12.547 6.143 -1.618 440 H ILE 64 H ILE 64 13.032 8.700 2.609 441 HA ILE 64 HA ILE 64 11.021 8.404 4.573 442 HB ILE 64 HB ILE 64 11.692 10.429 5.439 443 HG12 ILE 64 2HG1 ILE 64 13.980 10.668 3.443 444 HG13 ILE 64 1HG1 ILE 64 12.427 11.611 3.286 445 HG21 ILE 64 1HG2 ILE 64 12.669 8.272 6.037 446 HG22 ILE 64 2HG2 ILE 64 13.918 8.500 4.776 447 HG23 ILE 64 3HG2 ILE 64 13.801 9.540 6.267 448 HD11 ILE 64 HD3 ILE 64 14.373 11.606 5.635 449 HD12 ILE 64 HD1 ILE 64 14.274 12.817 4.298 450 HD13 ILE 64 HD2 ILE 64 12.967 12.739 5.339 451 H SER 65 H SER 65 11.003 10.859 1.758 452 HA SER 65 HA SER 65 8.348 11.660 2.626 453 HB2 SER 65 HB2 SER 65 8.329 12.671 0.236 454 HB3 SER 65 HB1 SER 65 9.807 13.083 1.073 455 HG SER 65 HG SER 65 10.905 11.852 -0.049 456 H GLN 66 H GLN 66 9.508 8.792 0.682 457 HA GLN 66 HA GLN 66 6.980 8.301 -0.163 458 HB2 GLN 66 HB2 GLN 66 9.657 6.930 -0.111 459 HB3 GLN 66 HB1 GLN 66 8.392 5.889 -0.131 460 HG2 GLN 66 HG2 GLN 66 7.447 6.862 -2.309 461 HG3 GLN 66 HG1 GLN 66 8.528 8.228 -2.155 462 HE21 GLN 66 1HE2 GLN 66 8.621 4.475 -2.386 463 HE22 GLN 66 2HE2 GLN 66 9.667 4.534 -3.725 464 H ALA 67 H ALA 67 8.634 6.843 2.766 465 HA ALA 67 HA ALA 67 6.513 5.476 3.727 466 HB1 ALA 67 HB1 ALA 67 7.448 6.300 6.010 467 HB2 ALA 67 HB2 ALA 67 8.531 5.732 4.818 468 HB3 ALA 67 HB3 ALA 67 8.557 7.347 5.021 469 H ARG 68 H ARG 68 6.765 9.214 4.086 470 HA ARG 68 HA ARG 68 4.265 9.589 5.102 471 HB2 ARG 68 HB2 ARG 68 5.669 11.388 3.043 472 HB3 ARG 68 HB1 ARG 68 4.379 11.840 4.200 473 HG2 ARG 68 HG2 ARG 68 7.247 11.066 4.729 474 HG3 ARG 68 HG1 ARG 68 6.433 12.658 4.945 475 HD2 ARG 68 HD2 ARG 68 6.469 12.008 7.221 476 HD3 ARG 68 HD1 ARG 68 4.897 11.671 6.651 477 HE ARG 68 HE ARG 68 5.032 9.616 7.162 478 HH11 ARG 68 1HH2 ARG 68 8.609 10.396 6.688 479 HH12 ARG 68 2HH2 ARG 68 9.001 8.974 7.549 480 HH21 ARG 68 1HH1 ARG 68 5.624 7.820 7.998 481 HH22 ARG 68 2HH1 ARG 68 7.266 7.450 8.266 482 H GLN 69 H GLN 69 5.121 8.676 1.798 483 HA GLN 69 HA GLN 69 2.500 9.481 0.849 484 HB2 GLN 69 HB2 GLN 69 5.010 8.532 -0.500 485 HB3 GLN 69 HB1 GLN 69 3.516 8.260 -1.310 486 HG2 GLN 69 HG2 GLN 69 3.176 10.708 -1.621 487 HG3 GLN 69 HG1 GLN 69 4.056 11.032 -0.182 488 HE21 GLN 69 1HE2 GLN 69 6.357 10.767 -0.267 489 HE22 GLN 69 2HE2 GLN 69 7.232 11.142 -1.713 490 H LEU 70 H LEU 70 4.087 6.306 1.729 491 HA LEU 70 HA LEU 70 2.043 4.866 1.032 492 HB2 LEU 70 HB2 LEU 70 4.352 4.725 2.976 493 HB3 LEU 70 HB1 LEU 70 2.877 3.605 3.238 494 HG LEU 70 HG LEU 70 4.622 3.795 0.807 495 HD11 LEU 70 1HD1 LEU 70 5.949 3.259 2.781 496 HD12 LEU 70 2HD1 LEU 70 5.003 1.792 3.066 497 HD13 LEU 70 3HD1 LEU 70 5.896 1.996 1.516 498 HD21 LEU 70 3HD2 LEU 70 3.742 1.481 0.344 499 HD22 LEU 70 1HD2 LEU 70 2.821 1.606 1.696 500 HD23 LEU 70 2HD2 LEU 70 2.488 2.786 0.274 501 H GLU 71 H GLU 71 2.483 6.566 4.154 502 HA GLU 71 HA GLU 71 0.077 6.034 5.414 503 HB2 GLU 71 HB2 GLU 71 2.052 8.446 5.447 504 HB3 GLU 71 HB1 GLU 71 0.694 8.106 6.547 505 HG2 GLU 71 HG2 GLU 71 1.602 6.220 7.422 506 HG3 GLU 71 HG1 GLU 71 2.736 6.128 5.983 507 H LYS 72 H LYS 72 0.751 8.630 2.873 508 HA LYS 72 HA LYS 72 -1.879 9.635 3.180 509 HB2 LYS 72 HB2 LYS 72 0.096 10.957 2.749 510 HB3 LYS 72 HB1 LYS 72 0.495 10.016 1.319 511 HG2 LYS 72 HG2 LYS 72 -1.374 10.903 0.028 512 HG3 LYS 72 HG1 LYS 72 -2.013 11.620 1.527 513 HD2 LYS 72 HD2 LYS 72 0.117 12.806 1.733 514 HD3 LYS 72 HD1 LYS 72 0.516 12.203 0.015 515 HE2 LYS 72 HE2 LYS 72 -0.452 14.569 -0.132 516 HE3 LYS 72 HE1 LYS 72 -1.456 13.318 -0.847 517 HZ1 LYS 72 HZ1 LYS 72 -2.984 13.913 0.716 518 HZ2 LYS 72 HZ2 LYS 72 -1.958 14.150 1.899 519 HZ3 LYS 72 HZ3 LYS 72 -2.177 15.354 0.795 520 H ILE 73 H ILE 73 -0.690 7.400 0.487 521 HA ILE 73 HA ILE 73 -2.826 7.994 -1.101 522 HB ILE 73 HB ILE 73 -2.694 5.718 -1.952 523 HG12 ILE 73 2HG1 ILE 73 -0.205 5.574 -0.264 524 HG13 ILE 73 1HG1 ILE 73 -1.549 4.727 0.427 525 HG21 ILE 73 1HG2 ILE 73 -0.159 6.298 -2.518 526 HG22 ILE 73 2HG2 ILE 73 -1.656 7.237 -3.106 527 HG23 ILE 73 3HG2 ILE 73 -0.719 7.865 -1.761 528 HD11 ILE 73 HD3 ILE 73 -1.872 3.345 -1.664 529 HD12 ILE 73 HD1 ILE 73 -0.247 4.026 -2.181 530 HD13 ILE 73 HD2 ILE 73 -0.546 3.049 -0.788 531 H LEU 74 H LEU 74 -3.196 5.072 1.105 532 HA LEU 74 HA LEU 74 -5.761 5.194 0.654 533 HB2 LEU 74 HB2 LEU 74 -4.458 3.745 2.939 534 HB3 LEU 74 HB1 LEU 74 -5.973 3.301 2.192 535 HG LEU 74 HG LEU 74 -3.231 3.050 1.093 536 HD11 LEU 74 1HD1 LEU 74 -5.120 0.831 1.575 537 HD12 LEU 74 2HD1 LEU 74 -3.558 0.841 0.932 538 HD13 LEU 74 3HD1 LEU 74 -3.710 1.277 2.663 539 HD21 LEU 74 3HD2 LEU 74 -4.792 3.784 -0.782 540 HD22 LEU 74 1HD2 LEU 74 -4.435 2.082 -0.941 541 HD23 LEU 74 2HD2 LEU 74 -6.001 2.665 -0.294 542 H GLY 75 H GLY 75 -4.094 7.089 2.791 543 HA2 GLY 75 HA2 GLY 75 -4.609 8.640 4.306 544 HA3 GLY 75 HA1 GLY 75 -6.417 8.493 3.970 545 H ILE 76 H ILE 76 -5.343 5.484 5.066 546 HA ILE 76 HA ILE 76 -6.331 5.996 7.607 547 HB ILE 76 HB ILE 76 -6.278 3.383 7.535 548 HG12 ILE 76 2HG1 ILE 76 -6.168 3.884 4.555 549 HG13 ILE 76 1HG1 ILE 76 -4.717 3.481 5.516 550 HG21 ILE 76 1HG2 ILE 76 -8.464 3.311 6.409 551 HG22 ILE 76 2HG2 ILE 76 -8.361 4.781 7.301 552 HG23 ILE 76 3HG2 ILE 76 -7.987 4.772 5.519 553 HD11 ILE 76 HD3 ILE 76 -5.303 1.463 4.774 554 HD12 ILE 76 HD1 ILE 76 -6.224 1.410 6.219 555 HD13 ILE 76 HD2 ILE 76 -7.160 1.884 4.842 556 H LYS 77 H LYS 77 -5.288 4.569 9.536 557 HA LYS 77 HA LYS 77 -2.694 3.475 9.507 558 HB2 LYS 77 HB2 LYS 77 -1.388 5.238 10.635 559 HB3 LYS 77 HB1 LYS 77 -1.779 5.581 9.128 560 HG2 LYS 77 HG2 LYS 77 -3.764 7.063 9.729 561 HG3 LYS 77 HG1 LYS 77 -3.483 6.527 11.379 562 HD2 LYS 77 HD2 LYS 77 -1.166 7.489 11.242 563 HD3 LYS 77 HD1 LYS 77 -1.352 7.920 9.601 564 HE2 LYS 77 HE2 LYS 77 -2.838 9.607 9.927 565 HE3 LYS 77 HE1 LYS 77 -3.594 8.916 11.299 566 HZ1 LYS 77 HZ1 LYS 77 -0.954 10.333 11.222 567 HZ2 LYS 77 HZ2 LYS 77 -2.300 10.859 11.880 568 HZ3 LYS 77 HZ3 LYS 77 -1.496 9.628 12.619 569 H LEU 78 H LEU 78 -2.369 2.583 11.454 570 HA LEU 78 HA LEU 78 -3.854 3.409 13.724 571 HB2 LEU 78 HB2 LEU 78 -4.338 0.706 12.536 572 HB3 LEU 78 HB1 LEU 78 -4.434 0.906 14.319 573 HG LEU 78 HG LEU 78 -6.268 2.274 12.281 574 HD11 LEU 78 1HD1 LEU 78 -7.860 0.769 13.250 575 HD12 LEU 78 2HD1 LEU 78 -6.599 -0.035 12.284 576 HD13 LEU 78 3HD1 LEU 78 -6.525 -0.135 14.089 577 HD21 LEU 78 3HD2 LEU 78 -6.525 2.081 15.276 578 HD22 LEU 78 1HD2 LEU 78 -5.861 3.529 14.379 579 HD23 LEU 78 2HD2 LEU 78 -7.527 2.976 14.147 580 H VAL 79 H VAL 79 -1.323 2.122 15.859 581 HA VAL 79 HA VAL 79 -4.340 2.129 15.813 582 HB VAL 79 HB VAL 79 -4.120 1.438 18.162 583 HG11 VAL 79 1HG1 VAL 79 -4.658 -0.300 16.668 584 HG12 VAL 79 2HG1 VAL 79 -3.086 -0.289 15.931 585 HG13 VAL 79 3HG1 VAL 79 -3.369 -0.829 17.678 586 HG21 VAL 79 3HG2 VAL 79 -1.195 1.018 17.362 587 HG22 VAL 79 1HG2 VAL 79 -1.892 2.294 18.522 588 HG23 VAL 79 2HG2 VAL 79 -1.991 0.603 18.973 589 H THR 80 H THR 80 -5.281 2.879 17.870 590 HA THR 80 HA THR 80 -4.889 5.828 18.079 591 HB THR 80 HB THR 80 -7.089 5.765 19.104 592 HG1 THR 80 HG1 THR 80 -8.279 3.933 19.222 593 HG21 THR 80 1HG2 THR 80 -6.732 5.750 16.606 594 HG22 THR 80 2HG2 THR 80 -7.209 4.070 16.674 595 HG23 THR 80 3HG2 THR 80 -8.322 5.383 17.202 596 HA PRO 81 HA PRO 81 -3.655 5.561 22.509 597 HB2 PRO 81 HB1 PRO 81 -6.223 7.156 22.894 598 HB3 PRO 81 HB2 PRO 81 -4.490 7.396 23.470 599 HG2 PRO 81 HG1 PRO 81 -5.825 8.726 21.469 600 HG3 PRO 81 HG2 PRO 81 -4.031 8.674 21.500 601 HD2 PRO 81 HD1 PRO 81 -5.830 7.363 19.634 602 HD3 PRO 81 HD2 PRO 81 -4.059 7.405 19.584 603 H LEU 82 H LEU 82 -6.338 3.893 21.223 604 HA LEU 82 HA LEU 82 -7.237 3.063 23.805 605 HB2 LEU 82 HB2 LEU 82 -8.065 1.905 21.192 606 HB3 LEU 82 HB1 LEU 82 -8.699 1.488 22.773 607 HG LEU 82 HG LEU 82 -8.975 4.144 21.315 608 HD11 LEU 82 1HD1 LEU 82 -10.199 2.166 20.424 609 HD12 LEU 82 2HD1 LEU 82 -11.077 2.195 21.983 610 HD13 LEU 82 3HD1 LEU 82 -11.215 3.568 20.865 611 HD21 LEU 82 3HD2 LEU 82 -9.024 4.593 23.638 612 HD22 LEU 82 1HD2 LEU 82 -10.720 4.621 23.043 613 HD23 LEU 82 2HD2 LEU 82 -10.050 3.200 23.977 614 H GLU 83 H GLU 83 -4.634 2.499 21.808 615 HA GLU 83 HA GLU 83 -3.451 0.712 23.834 616 HB2 GLU 83 HB2 GLU 83 -4.364 -0.569 21.638 617 HB3 GLU 83 HB1 GLU 83 -3.099 0.336 20.839 618 HG2 GLU 83 HG2 GLU 83 -1.411 -0.580 22.473 619 HG3 GLU 83 HG1 GLU 83 -2.819 -1.478 23.211 620 H ASN 84 H ASN 84 -3.008 3.225 21.328 621 HA ASN 84 HA ASN 84 -0.599 4.059 22.580 622 HB2 ASN 84 HB2 ASN 84 0.129 1.802 21.309 623 HB3 ASN 84 HB1 ASN 84 0.096 2.878 19.931 624 HD21 ASN 84 1HD2 ASN 84 1.432 2.730 23.424 625 HD22 ASN 84 2HD2 ASN 84 2.803 3.626 22.900 626 H ASN 85 H ASN 85 0.521 5.708 21.658 627 HA ASN 85 HA ASN 85 -0.449 6.842 19.240 628 HB2 ASN 85 HB2 ASN 85 -1.853 7.877 21.146 629 HB3 ASN 85 HB1 ASN 85 -0.378 8.506 21.704 630 HD21 ASN 85 1HD2 ASN 85 -0.138 10.653 21.029 631 HD22 ASN 85 2HD2 ASN 85 -0.934 11.337 19.644 632 H GLU 86 H GLU 86 1.240 7.346 17.929 633 HA GLU 86 HA GLU 86 3.825 7.412 18.479 634 HB2 GLU 86 HB2 GLU 86 2.228 8.847 16.477 635 HB3 GLU 86 HB1 GLU 86 4.033 8.787 16.385 636 HG2 GLU 86 HG2 GLU 86 2.366 6.308 16.159 637 HG3 GLU 86 HG1 GLU 86 2.924 7.241 14.779 638 H GLU 87 H GLU 87 5.334 8.807 18.952 639 HA GLU 87 HA GLU 87 4.757 11.201 20.499 640 HB2 GLU 87 HB2 GLU 87 7.374 9.876 19.731 641 HB3 GLU 87 HB1 GLU 87 7.191 11.096 21.010 642 HG2 GLU 87 HG2 GLU 87 5.737 9.663 22.417 643 HG3 GLU 87 HG1 GLU 87 6.042 8.347 21.265 644 H SER 88 H SER 88 5.683 13.144 20.431 645 HA SER 88 HA SER 88 5.553 14.193 17.759 646 HB2 SER 88 HB2 SER 88 5.729 16.417 19.188 647 HB3 SER 88 HB1 SER 88 4.346 15.420 19.102 648 HG SER 88 HG SER 88 4.611 15.840 21.267 649 H GLU 89 H GLU 89 8.046 13.920 20.306 650 HA GLU 89 HA GLU 89 10.003 15.350 18.723 651 HB2 GLU 89 HB2 GLU 89 10.055 14.765 21.377 652 HB3 GLU 89 HB1 GLU 89 10.904 13.301 20.742 653 HG2 GLU 89 HG2 GLU 89 12.515 14.832 19.528 654 HG3 GLU 89 HG1 GLU 89 11.573 16.086 20.224 655 H LYS 90 H LYS 90 8.734 12.363 18.217 656 HA LYS 90 HA LYS 90 11.018 11.429 16.539 657 HB2 LYS 90 HB2 LYS 90 8.480 9.871 17.387 658 HB3 LYS 90 HB1 LYS 90 9.849 9.343 16.385 659 HG2 LYS 90 HG2 LYS 90 10.279 10.102 19.273 660 HG3 LYS 90 HG1 LYS 90 9.725 8.538 18.776 661 HD2 LYS 90 HD2 LYS 90 11.621 8.208 17.247 662 HD3 LYS 90 HD1 LYS 90 12.320 9.719 17.813 663 HE2 LYS 90 HE2 LYS 90 11.605 7.409 19.663 664 HE3 LYS 90 HE1 LYS 90 13.010 7.347 18.808 665 HZ1 LYS 90 HZ1 LYS 90 13.442 8.218 20.954 666 HZ2 LYS 90 HZ2 LYS 90 13.619 9.546 19.913 667 HZ3 LYS 90 HZ3 LYS 90 12.366 9.442 20.781 668 H GLU 91 H GLU 91 7.790 12.751 16.439 669 HA GLU 91 HA GLU 91 7.010 12.287 13.861 670 HB2 GLU 91 HB2 GLU 91 6.022 13.736 15.780 671 HB3 GLU 91 HB1 GLU 91 6.614 15.129 14.824 672 HG2 GLU 91 HG2 GLU 91 5.428 14.103 12.812 673 HG3 GLU 91 HG1 GLU 91 4.705 13.097 14.120 674 H PHE 92 H PHE 92 9.153 14.946 14.983 675 HA PHE 92 HA PHE 92 10.841 15.134 12.699 676 HB2 PHE 92 HB2 PHE 92 8.636 15.862 11.879 677 HB3 PHE 92 HB1 PHE 92 8.594 17.169 12.935 678 HD1 PHE 92 HD2 PHE 92 10.622 15.627 10.080 679 HD2 PHE 92 HD1 PHE 92 9.545 19.239 12.191 680 HE1 PHE 92 HE2 PHE 92 12.372 16.996 8.776 681 HE2 PHE 92 HE1 PHE 92 11.199 20.490 10.934 682 HZ PHE 92 HZ PHE 92 12.590 19.319 9.170 683 H ASP 93 H ASP 93 11.951 17.155 12.656 684 HA ASP 93 HA ASP 93 13.445 17.278 15.158 685 HB2 ASP 93 HB2 ASP 93 13.854 18.465 12.518 686 HB3 ASP 93 HB1 ASP 93 15.007 18.611 13.889 687 H ASP 94 H ASP 94 11.042 19.311 13.794 688 HA ASP 94 HA ASP 94 11.818 21.654 15.389 689 HB2 ASP 94 HB2 ASP 94 11.503 21.879 12.890 690 HB3 ASP 94 HB1 ASP 94 9.950 21.368 12.927 691 H THR 95 H THR 95 10.183 18.980 15.816 692 HA THR 95 HA THR 95 7.602 20.071 16.861 693 HB THR 95 HB THR 95 8.206 17.278 15.739 694 HG1 THR 95 HG1 THR 95 7.917 19.728 14.651 695 HG21 THR 95 1HG2 THR 95 5.706 17.491 15.289 696 HG22 THR 95 2HG2 THR 95 6.018 17.675 17.084 697 HG23 THR 95 3HG2 THR 95 5.721 19.065 16.101 698 H GLY 96 H GLY 96 6.658 19.004 18.661 699 HA2 GLY 96 HA2 GLY 96 6.707 17.832 20.718 700 HA3 GLY 96 HA1 GLY 96 8.226 17.269 20.323 701 H LEU 97 H LEU 97 9.021 20.273 20.038 702 HA LEU 97 HA LEU 97 10.483 20.202 22.498 703 HB2 LEU 97 HB2 LEU 97 10.818 22.196 20.385 704 HB3 LEU 97 HB1 LEU 97 11.910 21.651 21.619 705 HG LEU 97 HG LEU 97 11.148 20.086 19.236 706 HD11 LEU 97 1HD1 LEU 97 13.917 21.096 19.978 707 HD12 LEU 97 2HD1 LEU 97 13.355 20.282 18.501 708 HD13 LEU 97 3HD1 LEU 97 12.850 21.954 18.916 709 HD21 LEU 97 3HD2 LEU 97 13.166 19.269 21.231 710 HD22 LEU 97 1HD2 LEU 97 11.635 18.415 21.271 711 HD23 LEU 97 2HD2 LEU 97 12.568 18.213 19.859 712 H THR 98 H THR 98 8.146 22.329 21.277 713 HA THR 98 HA THR 98 7.715 23.309 24.009 714 HB THR 98 HB THR 98 9.270 24.993 22.906 715 HG1 THR 98 HG1 THR 98 7.770 26.773 23.618 716 HG21 THR 98 1HG2 THR 98 8.000 24.709 20.610 717 HG22 THR 98 2HG2 THR 98 6.877 25.825 21.314 718 HG23 THR 98 3HG2 THR 98 8.564 26.340 21.147 719 H LEU 99 H LEU 99 5.609 23.485 24.393 720 HA LEU 99 HA LEU 99 3.586 23.302 22.339 721 HB2 LEU 99 HB2 LEU 99 3.459 21.786 24.187 722 HB3 LEU 99 HB1 LEU 99 3.527 23.180 25.318 723 HG LEU 99 HG LEU 99 1.341 23.891 24.356 724 HD11 LEU 99 1HD1 LEU 99 1.436 22.979 22.136 725 HD12 LEU 99 2HD1 LEU 99 1.547 21.278 22.873 726 HD13 LEU 99 3HD1 LEU 99 0.079 22.167 23.095 727 HD21 LEU 99 3HD2 LEU 99 0.033 22.075 25.341 728 HD22 LEU 99 1HD2 LEU 99 1.312 20.959 25.181 729 HD23 LEU 99 2HD2 LEU 99 1.521 22.307 26.327 730 H GLY 100 H GLY 100 5.042 25.676 24.482 731 HA2 GLY 100 HA2 GLY 100 4.836 27.897 24.419 732 HA3 GLY 100 HA1 GLY 100 3.454 27.838 23.254 733 H ASP 101 H ASP 101 3.454 25.975 26.285 734 HA ASP 101 HA ASP 101 1.147 27.527 27.329 735 HB2 ASP 101 HB2 ASP 101 1.310 24.941 26.569 736 HB3 ASP 101 HB1 ASP 101 2.198 24.676 27.878 737 H VAL 102 H VAL 102 2.748 29.007 27.550 738 HA VAL 102 HA VAL 102 3.532 29.181 30.327 739 HB VAL 102 HB VAL 102 5.239 30.836 29.306 740 HG11 VAL 102 1HG1 VAL 102 6.360 29.653 27.765 741 HG12 VAL 102 2HG1 VAL 102 5.819 28.519 29.022 742 HG13 VAL 102 3HG1 VAL 102 5.018 28.612 27.414 743 HG21 VAL 102 3HG2 VAL 102 3.923 32.136 27.952 744 HG22 VAL 102 1HG2 VAL 102 5.173 31.446 27.055 745 HG23 VAL 102 2HG2 VAL 102 3.507 30.789 26.830 746 H VAL 103 H VAL 103 2.028 32.642 30.804 747 HA VAL 103 HA VAL 103 4.813 32.499 30.362 748 HB VAL 103 HB VAL 103 3.785 34.337 31.335 749 HG11 VAL 103 1HG1 VAL 103 3.397 32.922 34.000 750 HG12 VAL 103 2HG1 VAL 103 3.046 34.563 33.629 751 HG13 VAL 103 3HG1 VAL 103 2.104 33.260 32.829 752 HG21 VAL 103 3HG2 VAL 103 6.116 33.793 31.361 753 HG22 VAL 103 1HG2 VAL 103 5.711 34.925 32.590 754 HG23 VAL 103 2HG2 VAL 103 6.023 33.172 32.956 755 H ASN 104 H ASN 104 6.387 31.407 31.506 756 HA ASN 104 HA ASN 104 5.711 28.892 32.140 757 HB2 ASN 104 HB2 ASN 104 7.702 29.133 31.105 758 HB3 ASN 104 HB1 ASN 104 8.437 30.307 32.203 759 HD21 ASN 104 1HD2 ASN 104 10.222 29.070 32.604 760 HD22 ASN 104 2HD2 ASN 104 10.148 27.414 33.366 761 H ILE 105 H ILE 105 4.560 28.475 33.908 762 HA ILE 105 HA ILE 105 4.847 29.707 36.428 763 HB ILE 105 HB ILE 105 3.334 28.063 37.352 764 HG12 ILE 105 2HG1 ILE 105 2.882 26.986 34.593 765 HG13 ILE 105 1HG1 ILE 105 3.997 26.129 35.603 766 HG21 ILE 105 1HG2 ILE 105 2.545 30.143 36.241 767 HG22 ILE 105 2HG2 ILE 105 2.573 29.320 34.691 768 HG23 ILE 105 3HG2 ILE 105 1.403 28.840 35.991 769 HD11 ILE 105 HD3 ILE 105 1.084 26.679 36.432 770 HD12 ILE 105 HD1 ILE 105 1.753 25.136 36.111 771 HD13 ILE 105 HD2 ILE 105 2.356 26.122 37.486 772 H LYS 106 H LYS 106 6.791 27.167 35.105 773 HA LYS 106 HA LYS 106 7.398 26.054 37.765 774 HB2 LYS 106 HB2 LYS 106 8.640 25.683 35.045 775 HB3 LYS 106 HB1 LYS 106 9.260 24.924 36.557 776 HG2 LYS 106 HG2 LYS 106 7.112 23.839 37.034 777 HG3 LYS 106 HG1 LYS 106 6.527 24.518 35.470 778 HD2 LYS 106 HD2 LYS 106 8.030 23.473 34.226 779 HD3 LYS 106 HD1 LYS 106 8.963 22.849 35.631 780 HE2 LYS 106 HE2 LYS 106 7.560 21.102 36.140 781 HE3 LYS 106 HE1 LYS 106 6.197 21.984 35.678 782 HZ1 LYS 106 HZ1 LYS 106 6.846 21.706 33.340 783 HZ2 LYS 106 HZ2 LYS 106 8.008 20.633 33.676 784 HZ3 LYS 106 HZ3 LYS 106 6.412 20.307 34.040 785 H GLU 107 H GLU 107 8.132 28.761 36.103 786 HA GLU 107 HA GLU 107 10.421 29.627 37.740 787 HB2 GLU 107 HB2 GLU 107 10.920 29.609 35.399 788 HB3 GLU 107 HB1 GLU 107 9.477 30.380 34.950 789 HG2 GLU 107 HG2 GLU 107 10.299 32.461 36.042 790 HG3 GLU 107 HG1 GLU 107 11.670 31.558 36.772 791 H GLY 108 H GLY 108 6.988 29.804 37.282 792 HA2 GLY 108 HA2 GLY 108 6.057 30.253 39.333 793 HA3 GLY 108 HA1 GLY 108 7.064 31.796 39.461 794 H LYS 109 H LYS 109 4.441 31.809 40.041 795 HA LYS 109 HA LYS 109 3.576 33.850 37.990 796 HB2 LYS 109 HB2 LYS 109 2.230 31.853 38.074 797 HB3 LYS 109 HB1 LYS 109 1.831 32.141 39.815 798 HG2 LYS 109 HG2 LYS 109 0.847 34.352 39.215 799 HG3 LYS 109 HG1 LYS 109 1.452 34.079 37.611 800 HD2 LYS 109 HD2 LYS 109 -0.255 31.987 37.505 801 HD3 LYS 109 HD1 LYS 109 -0.657 32.361 39.098 802 HE2 LYS 109 HE2 LYS 109 -1.453 34.596 38.291 803 HE3 LYS 109 HE1 LYS 109 -0.859 34.179 36.638 804 HZ1 LYS 109 HZ1 LYS 109 -3.034 33.016 38.031 805 HZ2 LYS 109 HZ2 LYS 109 -3.209 33.937 36.787 806 HZ3 LYS 109 HZ3 LYS 109 -2.504 32.415 36.556 807 H LYS 110 H LYS 110 2.728 35.783 38.917 808 HA LYS 110 HA LYS 110 3.727 36.690 41.523 809 HB2 LYS 110 HB2 LYS 110 5.707 37.705 40.778 810 HB3 LYS 110 HB1 LYS 110 5.667 35.969 41.090 811 HG2 LYS 110 HG2 LYS 110 5.512 35.662 38.628 812 HG3 LYS 110 HG1 LYS 110 5.762 37.409 38.404 813 HD2 LYS 110 HD2 LYS 110 8.073 37.100 39.393 814 HD3 LYS 110 HD1 LYS 110 7.631 35.338 39.513 815 HE2 LYS 110 HE2 LYS 110 7.351 35.112 37.337 816 HE3 LYS 110 HE1 LYS 110 7.694 36.816 36.924 817 HZ1 LYS 110 HZ1 LYS 110 9.869 34.961 37.905 818 HZ2 LYS 110 HZ2 LYS 110 9.515 35.413 36.319 819 HZ3 LYS 110 HZ3 LYS 110 9.941 36.443 37.437 820 H LEU 111 H LEU 111 2.524 37.346 38.365 821 HA LEU 111 HA LEU 111 1.472 39.888 39.095 822 HB2 LEU 111 HB2 LEU 111 1.614 38.745 36.392 823 HB3 LEU 111 HB1 LEU 111 0.875 40.221 36.881 824 HG LEU 111 HG LEU 111 3.530 40.444 37.902 825 HD11 LEU 111 1HD1 LEU 111 3.142 39.769 34.978 826 HD12 LEU 111 2HD1 LEU 111 4.724 40.213 35.693 827 HD13 LEU 111 3HD1 LEU 111 3.977 38.660 36.092 828 HD21 LEU 111 3HD2 LEU 111 3.616 42.443 36.840 829 HD22 LEU 111 1HD2 LEU 111 2.406 41.941 35.637 830 HD23 LEU 111 2HD2 LEU 111 1.923 42.363 37.257 831 H GLU 112 H GLU 112 -1.053 39.651 37.758 832 HA GLU 112 HA GLU 112 -2.508 37.389 38.715 833 HB2 GLU 112 HB2 GLU 112 -1.550 38.301 40.977 834 HB3 GLU 112 HB1 GLU 112 -2.555 39.706 40.658 835 HG2 GLU 112 HG2 GLU 112 -4.512 38.034 40.269 836 HG3 GLU 112 HG1 GLU 112 -3.353 36.828 40.901 837 H HIS 113 H HIS 113 -3.753 40.559 39.211 838 HA HIS 113 HA HIS 113 -6.016 39.800 37.448 839 HB2 HIS 113 HB2 HIS 113 -6.964 41.684 38.568 840 HB3 HIS 113 HB1 HIS 113 -6.155 40.777 39.794 841 HD2 HIS 113 HD2 HIS 113 -6.644 44.244 38.893 842 HE1 HIS 113 HE1 HIS 113 -2.852 44.058 40.873 843 HE2 HIS 113 HE2 HIS 113 -4.746 45.656 40.034 844 H HIS 114 H HIS 114 -3.166 41.123 36.657 845 HA HIS 114 HA HIS 114 -3.794 43.204 34.908 846 HB2 HIS 114 HB2 HIS 114 -1.635 42.943 34.104 847 HB3 HIS 114 HB1 HIS 114 -1.618 42.904 35.695 848 HD2 HIS 114 HD2 HIS 114 -2.291 39.348 35.424 849 HE1 HIS 114 HE1 HIS 114 1.538 39.484 33.610 850 HE2 HIS 114 HE2 HIS 114 -0.067 38.000 34.782 Start of MODEL 13 1 H1 GLU 13 H1 GLU 13 13.860 -20.741 0.495 2 H2 GLU 13 H2 GLU 13 14.370 -20.858 -1.052 3 H3 GLU 13 H3 GLU 13 15.437 -20.415 -0.025 4 HA GLU 13 HA GLU 13 14.598 -18.498 -1.268 5 HB2 GLU 13 HB2 GLU 13 12.660 -19.592 -1.781 6 HB3 GLU 13 HB1 GLU 13 11.954 -19.222 -0.166 7 HG2 GLU 13 HG2 GLU 13 12.334 -16.768 -0.745 8 HG3 GLU 13 HG1 GLU 13 13.187 -17.249 -2.096 9 H ASN 14 H ASN 14 16.241 -17.741 0.442 10 HA ASN 14 HA ASN 14 15.244 -17.020 3.010 11 HB2 ASN 14 HB2 ASN 14 17.461 -17.928 2.788 12 HB3 ASN 14 HB1 ASN 14 17.852 -17.008 1.391 13 HD21 ASN 14 1HD2 ASN 14 16.789 -16.781 4.712 14 HD22 ASN 14 2HD2 ASN 14 17.728 -15.444 5.358 15 H ALA 15 H ALA 15 14.019 -15.193 3.279 16 HA ALA 15 HA ALA 15 13.705 -13.482 1.086 17 HB1 ALA 15 HB1 ALA 15 12.109 -14.465 2.812 18 HB2 ALA 15 HB2 ALA 15 12.747 -13.340 3.957 19 HB3 ALA 15 HB3 ALA 15 11.907 -12.700 2.425 20 H GLU 16 H GLU 16 15.718 -13.270 3.792 21 HA GLU 16 HA GLU 16 16.149 -10.640 4.540 22 HB2 GLU 16 HB2 GLU 16 17.088 -12.749 5.571 23 HB3 GLU 16 HB1 GLU 16 18.176 -12.927 4.243 24 HG2 GLU 16 HG2 GLU 16 19.319 -10.922 4.645 25 HG3 GLU 16 HG1 GLU 16 18.278 -10.285 5.829 26 H LEU 17 H LEU 17 16.849 -12.175 1.530 27 HA LEU 17 HA LEU 17 18.945 -10.496 0.558 28 HB2 LEU 17 HB2 LEU 17 17.057 -12.804 -0.212 29 HB3 LEU 17 HB1 LEU 17 17.993 -12.073 -1.536 30 HG LEU 17 HG LEU 17 19.349 -13.160 0.884 31 HD11 LEU 17 1HD1 LEU 17 20.203 -14.838 -0.792 32 HD12 LEU 17 2HD1 LEU 17 18.475 -15.101 -0.434 33 HD13 LEU 17 3HD1 LEU 17 19.063 -14.214 -1.951 34 HD21 LEU 17 3HD2 LEU 17 21.375 -12.932 -0.513 35 HD22 LEU 17 1HD2 LEU 17 20.378 -12.145 -1.830 36 HD23 LEU 17 2HD2 LEU 17 20.636 -11.437 -0.275 37 H GLU 18 H GLU 18 15.612 -10.084 0.744 38 HA GLU 18 HA GLU 18 15.447 -8.792 -1.887 39 HB2 GLU 18 HB2 GLU 18 13.721 -10.915 -0.414 40 HB3 GLU 18 HB1 GLU 18 13.019 -9.980 -1.675 41 HG2 GLU 18 HG2 GLU 18 15.090 -10.713 -3.135 42 HG3 GLU 18 HG1 GLU 18 15.345 -11.931 -1.941 43 H ILE 19 H ILE 19 14.834 -8.670 1.422 44 HA ILE 19 HA ILE 19 12.776 -6.535 1.266 45 HB ILE 19 HB ILE 19 12.671 -6.906 3.607 46 HG12 ILE 19 2HG1 ILE 19 15.115 -8.722 3.365 47 HG13 ILE 19 1HG1 ILE 19 14.758 -7.330 4.417 48 HG21 ILE 19 1HG2 ILE 19 11.698 -9.114 3.638 49 HG22 ILE 19 2HG2 ILE 19 11.269 -8.267 2.258 50 HG23 ILE 19 3HG2 ILE 19 12.548 -9.466 2.029 51 HD11 ILE 19 HD3 ILE 19 13.589 -10.028 4.529 52 HD12 ILE 19 HD1 ILE 19 14.813 -9.410 5.653 53 HD13 ILE 19 HD2 ILE 19 13.162 -8.732 5.659 54 H VAL 20 H VAL 20 12.995 -4.449 2.368 55 HA VAL 20 HA VAL 20 15.739 -3.697 3.155 56 HB VAL 20 HB VAL 20 14.177 -2.106 2.026 57 HG11 VAL 20 1HG1 VAL 20 12.698 -2.192 4.752 58 HG12 VAL 20 2HG1 VAL 20 12.400 -1.047 3.353 59 HG13 VAL 20 3HG1 VAL 20 12.104 -2.784 3.235 60 HG21 VAL 20 3HG2 VAL 20 14.911 -0.290 3.044 61 HG22 VAL 20 1HG2 VAL 20 15.054 -1.103 4.724 62 HG23 VAL 20 2HG2 VAL 20 16.113 -1.397 3.371 63 H THR 21 H THR 21 16.243 -3.361 5.141 64 HA THR 21 HA THR 21 15.545 -4.893 7.214 65 HB THR 21 HB THR 21 16.771 -3.113 8.639 66 HG1 THR 21 HG1 THR 21 17.675 -2.747 6.048 67 HG21 THR 21 1HG2 THR 21 18.300 -4.829 6.620 68 HG22 THR 21 2HG2 THR 21 18.926 -4.127 8.075 69 HG23 THR 21 3HG2 THR 21 17.640 -5.399 8.194 70 H ASP 22 H ASP 22 15.297 -1.254 7.461 71 HA ASP 22 HA ASP 22 13.601 -1.781 9.754 72 HB2 ASP 22 HB2 ASP 22 15.341 -0.399 10.190 73 HB3 ASP 22 HB1 ASP 22 14.872 0.736 8.914 74 H TYR 23 H TYR 23 11.737 -2.433 8.519 75 HA TYR 23 HA TYR 23 10.512 -0.578 6.732 76 HB2 TYR 23 HB2 TYR 23 10.861 -3.045 6.289 77 HB3 TYR 23 HB1 TYR 23 9.587 -3.449 7.265 78 HD1 TYR 23 HD1 TYR 23 10.385 -1.212 4.457 79 HD2 TYR 23 HD2 TYR 23 7.361 -3.514 6.294 80 HE1 TYR 23 HE1 TYR 23 8.913 -0.804 2.512 81 HE2 TYR 23 HE2 TYR 23 5.867 -3.299 4.283 82 HH TYR 23 HH TYR 23 5.509 -1.746 2.680 83 H TYR 24 H TYR 24 8.322 -0.105 6.426 84 HA TYR 24 HA TYR 24 7.171 1.153 8.802 85 HB2 TYR 24 HB2 TYR 24 6.095 0.799 6.009 86 HB3 TYR 24 HB1 TYR 24 5.505 1.871 7.364 87 HD1 TYR 24 HD1 TYR 24 9.006 2.218 7.596 88 HD2 TYR 24 HD2 TYR 24 5.490 3.417 5.249 89 HE1 TYR 24 HE1 TYR 24 10.226 3.994 6.635 90 HE2 TYR 24 HE2 TYR 24 6.850 5.352 4.406 91 HH TYR 24 HH TYR 24 10.270 5.739 5.403 92 H LYS 25 H LYS 25 6.000 0.446 10.112 93 HA LYS 25 HA LYS 25 4.400 -2.045 9.966 94 HB2 LYS 25 HB2 LYS 25 5.523 -0.085 12.105 95 HB3 LYS 25 HB1 LYS 25 4.433 -1.322 12.507 96 HG2 LYS 25 HG2 LYS 25 6.141 -3.021 11.693 97 HG3 LYS 25 HG1 LYS 25 7.157 -1.724 11.077 98 HD2 LYS 25 HD2 LYS 25 6.266 -2.027 13.936 99 HD3 LYS 25 HD1 LYS 25 7.704 -2.878 13.358 100 HE2 LYS 25 HE2 LYS 25 8.693 -0.721 12.811 101 HE3 LYS 25 HE1 LYS 25 7.234 0.155 13.442 102 HZ1 LYS 25 HZ1 LYS 25 7.635 -0.561 15.479 103 HZ2 LYS 25 HZ2 LYS 25 9.069 -1.412 15.121 104 HZ3 LYS 25 HZ3 LYS 25 8.909 0.234 15.035 105 H ILE 26 H ILE 26 3.660 1.457 10.097 106 HA ILE 26 HA ILE 26 1.192 1.179 11.483 107 HB ILE 26 HB ILE 26 0.967 3.491 10.547 108 HG12 ILE 26 2HG1 ILE 26 3.791 3.343 9.422 109 HG13 ILE 26 1HG1 ILE 26 2.226 3.017 8.472 110 HG21 ILE 26 1HG2 ILE 26 1.964 3.164 12.722 111 HG22 ILE 26 2HG2 ILE 26 3.579 2.992 11.987 112 HG23 ILE 26 3HG2 ILE 26 2.753 4.475 11.828 113 HD11 ILE 26 HD3 ILE 26 3.154 5.586 9.830 114 HD12 ILE 26 HD1 ILE 26 3.191 5.201 8.106 115 HD13 ILE 26 HD2 ILE 26 1.649 5.241 8.927 116 H ILE 27 H ILE 27 1.910 1.208 7.986 117 HA ILE 27 HA ILE 27 -0.753 1.126 7.228 118 HB ILE 27 HB ILE 27 0.204 0.607 4.935 119 HG12 ILE 27 2HG1 ILE 27 2.808 0.890 6.535 120 HG13 ILE 27 1HG1 ILE 27 2.189 -0.633 5.966 121 HG21 ILE 27 1HG2 ILE 27 -0.151 2.955 5.964 122 HG22 ILE 27 2HG2 ILE 27 1.519 2.958 6.259 123 HG23 ILE 27 3HG2 ILE 27 0.945 2.733 4.567 124 HD11 ILE 27 HD3 ILE 27 2.988 1.646 4.155 125 HD12 ILE 27 HD1 ILE 27 4.189 0.612 4.751 126 HD13 ILE 27 HD2 ILE 27 2.860 -0.095 3.728 127 H LYS 28 H LYS 28 0.997 -1.609 8.480 128 HA LYS 28 HA LYS 28 0.178 -3.201 6.532 129 HB2 LYS 28 HB2 LYS 28 2.035 -3.747 7.988 130 HB3 LYS 28 HB1 LYS 28 0.902 -3.897 9.375 131 HG2 LYS 28 HG2 LYS 28 -0.267 -5.884 8.193 132 HG3 LYS 28 HG1 LYS 28 0.873 -5.647 6.886 133 HD2 LYS 28 HD2 LYS 28 2.641 -6.507 8.153 134 HD3 LYS 28 HD1 LYS 28 1.595 -6.392 9.674 135 HE2 LYS 28 HE2 LYS 28 0.194 -8.111 9.047 136 HE3 LYS 28 HE1 LYS 28 1.036 -8.138 7.367 137 HZ1 LYS 28 HZ1 LYS 28 3.023 -8.731 8.497 138 HZ2 LYS 28 HZ2 LYS 28 2.278 -8.803 9.932 139 HZ3 LYS 28 HZ3 LYS 28 1.847 -9.853 8.769 140 H THR 29 H THR 29 -1.690 -3.545 9.711 141 HA THR 29 HA THR 29 -3.308 -5.562 8.437 142 HB THR 29 HB THR 29 -4.510 -5.780 10.493 143 HG1 THR 29 HG1 THR 29 -3.722 -4.457 12.184 144 HG21 THR 29 1HG2 THR 29 -1.550 -5.629 11.109 145 HG22 THR 29 2HG2 THR 29 -2.785 -6.646 11.881 146 HG23 THR 29 3HG2 THR 29 -2.318 -6.811 10.097 147 H ALA 30 H ALA 30 -3.571 -2.227 8.380 148 HA ALA 30 HA ALA 30 -6.253 -1.906 8.360 149 HB1 ALA 30 HB1 ALA 30 -4.234 -0.207 8.456 150 HB2 ALA 30 HB2 ALA 30 -4.159 -0.495 6.669 151 HB3 ALA 30 HB3 ALA 30 -5.551 0.291 7.326 152 H ARG 31 H ARG 31 -4.530 -2.982 5.386 153 HA ARG 31 HA ARG 31 -6.456 -2.328 3.549 154 HB2 ARG 31 HB2 ARG 31 -5.531 -3.982 2.229 155 HB3 ARG 31 HB1 ARG 31 -4.321 -3.322 3.172 156 HG2 ARG 31 HG2 ARG 31 -4.141 -5.312 4.471 157 HG3 ARG 31 HG1 ARG 31 -5.714 -5.937 3.907 158 HD2 ARG 31 HD2 ARG 31 -4.884 -6.273 1.731 159 HD3 ARG 31 HD1 ARG 31 -3.281 -5.579 2.095 160 HE ARG 31 HE ARG 31 -2.634 -7.662 2.609 161 HH11 ARG 31 1HH2 ARG 31 -6.075 -7.808 3.075 162 HH12 ARG 31 2HH2 ARG 31 -6.083 -9.171 4.141 163 HH21 ARG 31 1HH1 ARG 31 -2.533 -9.455 3.990 164 HH22 ARG 31 2HH1 ARG 31 -3.909 -10.218 4.639 165 H GLU 32 H GLU 32 -6.862 -4.975 5.952 166 HA GLU 32 HA GLU 32 -9.027 -6.230 4.762 167 HB2 GLU 32 HB2 GLU 32 -7.948 -5.884 7.575 168 HB3 GLU 32 HB1 GLU 32 -9.151 -7.185 7.144 169 HG2 GLU 32 HG2 GLU 32 -7.392 -7.940 5.510 170 HG3 GLU 32 HG1 GLU 32 -6.285 -6.734 6.219 171 H GLN 33 H GLN 33 -9.059 -3.235 6.736 172 HA GLN 33 HA GLN 33 -11.690 -3.241 7.546 173 HB2 GLN 33 HB2 GLN 33 -9.990 -0.908 6.646 174 HB3 GLN 33 HB1 GLN 33 -11.501 -0.848 7.710 175 HG2 GLN 33 HG2 GLN 33 -10.500 -2.206 9.354 176 HG3 GLN 33 HG1 GLN 33 -8.886 -2.153 8.496 177 HE21 GLN 33 1HE2 GLN 33 -11.289 -0.510 10.554 178 HE22 GLN 33 2HE2 GLN 33 -10.015 0.491 11.150 179 H LEU 34 H LEU 34 -10.362 -2.210 4.537 180 HA LEU 34 HA LEU 34 -12.530 -0.810 3.715 181 HB2 LEU 34 HB2 LEU 34 -10.170 -1.921 2.131 182 HB3 LEU 34 HB1 LEU 34 -11.163 -0.599 1.613 183 HG LEU 34 HG LEU 34 -9.544 -0.549 4.085 184 HD11 LEU 34 1HD1 LEU 34 -7.872 0.653 3.008 185 HD12 LEU 34 2HD1 LEU 34 -8.078 -0.821 2.180 186 HD13 LEU 34 3HD1 LEU 34 -8.708 0.735 1.427 187 HD21 LEU 34 3HD2 LEU 34 -10.508 1.886 2.571 188 HD22 LEU 34 1HD2 LEU 34 -11.303 1.092 4.015 189 HD23 LEU 34 2HD2 LEU 34 -9.729 1.781 4.243 190 H GLY 35 H GLY 35 -12.354 -3.998 3.552 191 HA2 GLY 35 HA2 GLY 35 -14.166 -5.491 2.945 192 HA3 GLY 35 HA1 GLY 35 -14.958 -4.122 2.129 193 H ILE 36 H ILE 36 -12.270 -3.694 0.802 194 HA ILE 36 HA ILE 36 -13.312 -4.863 -1.638 195 HB ILE 36 HB ILE 36 -11.747 -3.357 -2.736 196 HG12 ILE 36 2HG1 ILE 36 -10.733 -2.654 0.068 197 HG13 ILE 36 1HG1 ILE 36 -9.851 -3.434 -1.161 198 HG21 ILE 36 1HG2 ILE 36 -13.273 -2.042 -0.511 199 HG22 ILE 36 2HG2 ILE 36 -12.777 -1.226 -1.897 200 HG23 ILE 36 3HG2 ILE 36 -13.929 -2.639 -2.070 201 HD11 ILE 36 HD3 ILE 36 -10.130 -1.236 -2.638 202 HD12 ILE 36 HD1 ILE 36 -10.774 -0.609 -1.150 203 HD13 ILE 36 HD2 ILE 36 -9.106 -1.168 -1.139 204 H SER 37 H SER 37 -11.958 -5.506 -3.474 205 HA SER 37 HA SER 37 -10.616 -7.823 -2.440 206 HB2 SER 37 HB2 SER 37 -10.610 -8.683 -4.667 207 HB3 SER 37 HB1 SER 37 -12.143 -7.935 -4.351 208 HG SER 37 HG SER 37 -11.093 -7.219 -6.410 209 H GLN 38 H GLN 38 -8.366 -8.523 -3.816 210 HA GLN 38 HA GLN 38 -6.531 -6.562 -3.303 211 HB2 GLN 38 HB2 GLN 38 -6.053 -9.011 -3.485 212 HB3 GLN 38 HB1 GLN 38 -6.046 -8.769 -5.274 213 HG2 GLN 38 HG2 GLN 38 -4.211 -7.176 -5.219 214 HG3 GLN 38 HG1 GLN 38 -4.288 -7.128 -3.481 215 HE21 GLN 38 1HE2 GLN 38 -3.463 -9.008 -2.285 216 HE22 GLN 38 2HE2 GLN 38 -2.308 -10.115 -3.108 217 H GLN 39 H GLN 39 -8.084 -7.275 -6.466 218 HA GLN 39 HA GLN 39 -6.634 -5.569 -8.056 219 HB2 GLN 39 HB2 GLN 39 -7.923 -7.410 -8.697 220 HB3 GLN 39 HB1 GLN 39 -9.455 -6.508 -8.162 221 HG2 GLN 39 HG2 GLN 39 -9.130 -4.943 -9.791 222 HG3 GLN 39 HG1 GLN 39 -7.721 -5.578 -10.520 223 HE21 GLN 39 1HE2 GLN 39 -9.711 -5.398 -12.205 224 HE22 GLN 39 2HE2 GLN 39 -10.125 -6.978 -12.783 225 H GLN 40 H GLN 40 -9.184 -4.792 -5.844 226 HA GLN 40 HA GLN 40 -9.893 -2.113 -7.022 227 HB2 GLN 40 HB2 GLN 40 -10.759 -3.937 -4.815 228 HB3 GLN 40 HB1 GLN 40 -11.118 -2.060 -4.792 229 HG2 GLN 40 HG2 GLN 40 -12.362 -2.240 -6.666 230 HG3 GLN 40 HG1 GLN 40 -11.881 -3.949 -7.002 231 HE21 GLN 40 1HE2 GLN 40 -14.530 -2.056 -5.855 232 HE22 GLN 40 2HE2 GLN 40 -15.247 -3.358 -4.997 233 H LEU 41 H LEU 41 -8.091 -3.442 -4.376 234 HA LEU 41 HA LEU 41 -7.276 -1.103 -3.072 235 HB2 LEU 41 HB2 LEU 41 -7.465 -3.210 -2.075 236 HB3 LEU 41 HB1 LEU 41 -6.234 -3.925 -3.177 237 HG LEU 41 HG LEU 41 -4.669 -2.151 -2.057 238 HD11 LEU 41 1HD1 LEU 41 -6.172 -1.227 -0.421 239 HD12 LEU 41 2HD1 LEU 41 -6.664 -2.765 0.235 240 HD13 LEU 41 3HD1 LEU 41 -4.974 -2.236 0.455 241 HD21 LEU 41 3HD2 LEU 41 -3.948 -4.184 -2.079 242 HD22 LEU 41 1HD2 LEU 41 -3.887 -4.073 -0.438 243 HD23 LEU 41 2HD2 LEU 41 -5.296 -4.948 -1.069 244 H ALA 42 H ALA 42 -6.016 -2.875 -5.772 245 HA ALA 42 HA ALA 42 -3.824 -1.305 -6.003 246 HB1 ALA 42 HB1 ALA 42 -3.859 -3.422 -7.140 247 HB2 ALA 42 HB2 ALA 42 -5.326 -3.068 -8.025 248 HB3 ALA 42 HB3 ALA 42 -3.935 -2.266 -8.620 249 H GLN 43 H GLN 43 -6.936 -0.862 -7.715 250 HA GLN 43 HA GLN 43 -6.232 1.693 -8.895 251 HB2 GLN 43 HB2 GLN 43 -8.893 0.476 -8.134 252 HB3 GLN 43 HB1 GLN 43 -8.570 1.861 -9.247 253 HG2 GLN 43 HG2 GLN 43 -7.949 0.449 -10.917 254 HG3 GLN 43 HG1 GLN 43 -7.346 -0.827 -9.933 255 HE21 GLN 43 1HE2 GLN 43 -8.846 -2.790 -9.764 256 HE22 GLN 43 2HE2 GLN 43 -10.504 -2.564 -10.401 257 H LYS 44 H LYS 44 -7.248 0.866 -5.526 258 HA LYS 44 HA LYS 44 -8.334 3.485 -5.069 259 HB2 LYS 44 HB2 LYS 44 -8.821 1.278 -3.777 260 HB3 LYS 44 HB1 LYS 44 -7.184 1.353 -3.170 261 HG2 LYS 44 HG2 LYS 44 -7.728 3.490 -1.907 262 HG3 LYS 44 HG1 LYS 44 -9.076 3.760 -2.858 263 HD2 LYS 44 HD2 LYS 44 -9.976 1.542 -1.701 264 HD3 LYS 44 HD1 LYS 44 -8.450 1.807 -0.756 265 HE2 LYS 44 HE2 LYS 44 -10.069 2.675 0.743 266 HE3 LYS 44 HE1 LYS 44 -9.223 3.970 0.010 267 HZ1 LYS 44 HZ1 LYS 44 -11.490 4.416 -0.092 268 HZ2 LYS 44 HZ2 LYS 44 -10.942 4.281 -1.612 269 HZ3 LYS 44 HZ3 LYS 44 -11.783 3.118 -1.123 270 H LEU 45 H LEU 45 -5.236 2.019 -5.088 271 HA LEU 45 HA LEU 45 -3.899 4.036 -3.616 272 HB2 LEU 45 HB2 LEU 45 -3.306 1.002 -4.064 273 HB3 LEU 45 HB1 LEU 45 -2.044 2.112 -4.027 274 HG LEU 45 HG LEU 45 -2.506 3.051 -2.019 275 HD11 LEU 45 1HD1 LEU 45 -4.848 2.848 -1.707 276 HD12 LEU 45 2HD1 LEU 45 -4.804 1.042 -1.937 277 HD13 LEU 45 3HD1 LEU 45 -4.220 1.770 -0.451 278 HD21 LEU 45 3HD2 LEU 45 -2.770 0.029 -1.498 279 HD22 LEU 45 1HD2 LEU 45 -1.398 0.563 -2.400 280 HD23 LEU 45 2HD2 LEU 45 -1.721 1.103 -0.678 281 H LYS 46 H LYS 46 -4.598 3.365 -6.814 282 HA LYS 46 HA LYS 46 -3.723 3.729 -8.786 283 HB2 LYS 46 HB2 LYS 46 -2.031 5.802 -7.466 284 HB3 LYS 46 HB1 LYS 46 -2.535 5.676 -9.185 285 HG2 LYS 46 HG2 LYS 46 -4.860 6.132 -8.596 286 HG3 LYS 46 HG1 LYS 46 -4.337 6.265 -6.876 287 HD2 LYS 46 HD2 LYS 46 -4.481 8.450 -7.740 288 HD3 LYS 46 HD1 LYS 46 -2.781 8.063 -7.877 289 HE2 LYS 46 HE2 LYS 46 -3.080 7.410 -10.258 290 HE3 LYS 46 HE1 LYS 46 -4.795 7.726 -10.161 291 HZ1 LYS 46 HZ1 LYS 46 -2.586 9.588 -9.870 292 HZ2 LYS 46 HZ2 LYS 46 -3.529 9.605 -11.135 293 HZ3 LYS 46 HZ3 LYS 46 -4.162 10.152 -9.712 294 H VAL 47 H VAL 47 -2.536 1.480 -7.736 295 HA VAL 47 HA VAL 47 -0.017 1.540 -8.951 296 HB VAL 47 HB VAL 47 0.639 0.008 -6.983 297 HG11 VAL 47 1HG1 VAL 47 0.937 2.504 -6.812 298 HG12 VAL 47 2HG1 VAL 47 -0.606 2.319 -5.790 299 HG13 VAL 47 3HG1 VAL 47 0.854 1.482 -5.395 300 HG21 VAL 47 3HG2 VAL 47 -1.625 -1.058 -6.486 301 HG22 VAL 47 1HG2 VAL 47 -0.957 -0.103 -5.109 302 HG23 VAL 47 2HG2 VAL 47 -2.182 0.596 -6.131 303 H SER 48 H SER 48 0.621 -1.361 -8.693 304 HA SER 48 HA SER 48 -1.407 -2.732 -10.272 305 HB2 SER 48 HB2 SER 48 0.453 -4.309 -10.780 306 HB3 SER 48 HB1 SER 48 0.615 -2.566 -11.191 307 HG SER 48 HG SER 48 2.472 -2.953 -10.367 308 H GLU 49 H GLU 49 -1.943 -4.958 -9.527 309 HA GLU 49 HA GLU 49 -2.069 -5.512 -6.726 310 HB2 GLU 49 HB2 GLU 49 -2.080 -7.564 -9.001 311 HB3 GLU 49 HB1 GLU 49 -2.509 -7.769 -7.257 312 HG2 GLU 49 HG2 GLU 49 -4.265 -6.327 -7.302 313 HG3 GLU 49 HG1 GLU 49 -3.976 -5.823 -8.918 314 H ASN 50 H ASN 50 0.466 -5.887 -9.137 315 HA ASN 50 HA ASN 50 2.296 -7.499 -7.411 316 HB2 ASN 50 HB2 ASN 50 2.687 -7.421 -9.734 317 HB3 ASN 50 HB1 ASN 50 2.435 -5.679 -9.768 318 HD21 ASN 50 1HD2 ASN 50 4.363 -8.663 -8.839 319 HD22 ASN 50 2HD2 ASN 50 5.856 -7.766 -8.654 320 H ILE 51 H ILE 51 1.805 -3.902 -7.718 321 HA ILE 51 HA ILE 51 3.909 -3.395 -5.890 322 HB ILE 51 HB ILE 51 1.816 -1.701 -7.163 323 HG12 ILE 51 2HG1 ILE 51 4.770 -1.425 -7.245 324 HG13 ILE 51 1HG1 ILE 51 3.978 -2.684 -8.257 325 HG21 ILE 51 1HG2 ILE 51 3.216 0.277 -6.058 326 HG22 ILE 51 2HG2 ILE 51 2.145 -0.625 -4.931 327 HG23 ILE 51 3HG2 ILE 51 3.865 -1.008 -5.104 328 HD11 ILE 51 HD3 ILE 51 2.616 -0.864 -9.355 329 HD12 ILE 51 HD1 ILE 51 3.409 0.253 -8.286 330 HD13 ILE 51 HD2 ILE 51 4.375 -0.608 -9.438 331 H VAL 52 H VAL 52 0.318 -3.844 -5.341 332 HA VAL 52 HA VAL 52 0.613 -2.969 -2.743 333 HB VAL 52 HB VAL 52 -1.574 -3.708 -2.332 334 HG11 VAL 52 1HG1 VAL 52 -1.407 -2.822 -5.090 335 HG12 VAL 52 2HG1 VAL 52 -2.858 -2.666 -4.069 336 HG13 VAL 52 3HG1 VAL 52 -1.312 -1.719 -3.710 337 HG21 VAL 52 3HG2 VAL 52 -1.239 -5.346 -4.804 338 HG22 VAL 52 1HG2 VAL 52 -1.659 -6.036 -3.216 339 HG23 VAL 52 2HG2 VAL 52 -2.839 -5.043 -4.178 340 H LYS 53 H LYS 53 0.989 -6.349 -3.984 341 HA LYS 53 HA LYS 53 1.655 -7.704 -1.588 342 HB2 LYS 53 HB2 LYS 53 2.304 -7.764 -4.595 343 HB3 LYS 53 HB1 LYS 53 2.906 -8.992 -3.401 344 HG2 LYS 53 HG2 LYS 53 0.545 -9.465 -2.651 345 HG3 LYS 53 HG1 LYS 53 -0.039 -8.550 -4.015 346 HD2 LYS 53 HD2 LYS 53 1.962 -10.801 -4.230 347 HD3 LYS 53 HD1 LYS 53 0.238 -11.117 -4.182 348 HE2 LYS 53 HE2 LYS 53 1.754 -9.398 -6.205 349 HE3 LYS 53 HE1 LYS 53 1.127 -11.081 -6.418 350 HZ1 LYS 53 HZ1 LYS 53 -1.078 -10.185 -5.949 351 HZ2 LYS 53 HZ2 LYS 53 -0.472 -8.729 -6.323 352 HZ3 LYS 53 HZ3 LYS 53 -0.424 -9.767 -7.473 353 H ARG 54 H ARG 54 3.824 -5.589 -3.787 354 HA ARG 54 HA ARG 54 6.090 -6.003 -2.263 355 HB2 ARG 54 HB2 ARG 54 5.581 -5.271 -4.596 356 HB3 ARG 54 HB1 ARG 54 5.191 -3.663 -4.113 357 HG2 ARG 54 HG2 ARG 54 7.301 -3.334 -3.032 358 HG3 ARG 54 HG1 ARG 54 7.788 -4.923 -3.316 359 HD2 ARG 54 HD2 ARG 54 7.327 -2.783 -5.497 360 HD3 ARG 54 HD1 ARG 54 8.855 -3.120 -4.790 361 HE ARG 54 HE ARG 54 8.046 -5.655 -5.693 362 HH11 ARG 54 1HH2 ARG 54 8.978 -2.600 -7.253 363 HH12 ARG 54 2HH2 ARG 54 9.773 -3.485 -8.531 364 HH21 ARG 54 1HH1 ARG 54 8.467 -6.637 -7.420 365 HH22 ARG 54 2HH1 ARG 54 9.344 -5.810 -8.706 366 H PHE 55 H PHE 55 3.693 -3.462 -1.837 367 HA PHE 55 HA PHE 55 4.816 -2.109 0.354 368 HB2 PHE 55 HB2 PHE 55 2.020 -2.701 -0.403 369 HB3 PHE 55 HB1 PHE 55 2.426 -1.425 0.773 370 HD1 PHE 55 HD2 PHE 55 5.013 -0.956 -1.323 371 HD2 PHE 55 HD1 PHE 55 0.746 -0.568 -1.221 372 HE1 PHE 55 HE2 PHE 55 5.071 0.934 -2.990 373 HE2 PHE 55 HE1 PHE 55 0.785 1.208 -2.961 374 HZ PHE 55 HZ PHE 55 2.933 2.083 -3.608 375 H GLU 56 H GLU 56 2.398 -5.036 0.208 376 HA GLU 56 HA GLU 56 2.189 -5.125 2.923 377 HB2 GLU 56 HB2 GLU 56 0.769 -6.290 1.208 378 HB3 GLU 56 HB1 GLU 56 2.153 -7.455 0.973 379 HG2 GLU 56 HG2 GLU 56 1.985 -8.289 3.104 380 HG3 GLU 56 HG1 GLU 56 0.987 -6.970 3.721 381 H SER 57 H SER 57 4.901 -6.080 0.991 382 HA SER 57 HA SER 57 5.484 -8.217 2.857 383 HB2 SER 57 HB2 SER 57 6.830 -9.107 0.780 384 HB3 SER 57 HB1 SER 57 5.097 -8.868 0.564 385 HG SER 57 HG SER 57 5.655 -7.359 -0.883 386 H GLY 58 H GLY 58 6.771 -5.285 2.366 387 HA2 GLY 58 HA2 GLY 58 8.693 -4.301 3.168 388 HA3 GLY 58 HA1 GLY 58 9.292 -5.901 3.619 389 H LYS 59 H LYS 59 8.405 -5.676 0.241 390 HA LYS 59 HA LYS 59 11.226 -5.746 -0.516 391 HB2 LYS 59 HB2 LYS 59 8.680 -6.766 -1.749 392 HB3 LYS 59 HB1 LYS 59 10.326 -6.635 -2.500 393 HG2 LYS 59 HG2 LYS 59 11.103 -8.269 -0.962 394 HG3 LYS 59 HG1 LYS 59 9.819 -8.130 0.126 395 HD2 LYS 59 HD2 LYS 59 8.176 -9.056 -1.493 396 HD3 LYS 59 HD1 LYS 59 9.304 -9.231 -2.680 397 HE2 LYS 59 HE2 LYS 59 10.610 -10.926 -1.122 398 HE3 LYS 59 HE1 LYS 59 9.278 -10.641 0.072 399 HZ1 LYS 59 HZ1 LYS 59 9.311 -12.055 -2.474 400 HZ2 LYS 59 HZ2 LYS 59 8.913 -12.547 -1.033 401 HZ3 LYS 59 HZ3 LYS 59 7.939 -11.534 -1.919 402 H LEU 60 H LEU 60 9.770 -3.312 0.032 403 HA LEU 60 HA LEU 60 10.768 -1.769 -2.188 404 HB2 LEU 60 HB2 LEU 60 8.347 -1.395 -1.618 405 HB3 LEU 60 HB1 LEU 60 8.632 -1.113 -0.037 406 HG LEU 60 HG LEU 60 9.862 1.007 -0.649 407 HD11 LEU 60 1HD1 LEU 60 9.550 2.100 -2.676 408 HD12 LEU 60 2HD1 LEU 60 10.152 0.473 -3.207 409 HD13 LEU 60 3HD1 LEU 60 8.455 0.862 -3.318 410 HD21 LEU 60 3HD2 LEU 60 7.682 2.206 -1.161 411 HD22 LEU 60 1HD2 LEU 60 7.001 0.660 -1.355 412 HD23 LEU 60 2HD2 LEU 60 7.599 1.238 0.239 413 H LYS 61 H LYS 61 12.506 -0.456 -2.000 414 HA LYS 61 HA LYS 61 13.398 0.345 0.716 415 HB2 LYS 61 HB2 LYS 61 14.667 0.501 -2.014 416 HB3 LYS 61 HB1 LYS 61 15.437 1.111 -0.598 417 HG2 LYS 61 HG2 LYS 61 15.167 -1.228 0.422 418 HG3 LYS 61 HG1 LYS 61 14.889 -1.716 -1.205 419 HD2 LYS 61 HD2 LYS 61 16.969 -1.046 -1.975 420 HD3 LYS 61 HD1 LYS 61 17.576 -0.240 -0.489 421 HE2 LYS 61 HE2 LYS 61 17.085 -2.484 0.623 422 HE3 LYS 61 HE1 LYS 61 16.708 -3.078 -1.019 423 HZ1 LYS 61 HZ1 LYS 61 19.277 -3.224 -0.180 424 HZ2 LYS 61 HZ2 LYS 61 18.706 -3.107 -1.678 425 HZ3 LYS 61 HZ3 LYS 61 19.238 -1.752 -0.902 426 HA PRO 62 HA PRO 62 10.973 3.797 -0.773 427 HB2 PRO 62 HB1 PRO 62 10.185 4.980 1.568 428 HB3 PRO 62 HB2 PRO 62 9.620 3.343 1.052 429 HG2 PRO 62 HG1 PRO 62 12.016 4.038 2.920 430 HG3 PRO 62 HG2 PRO 62 10.565 3.119 3.300 431 HD2 PRO 62 HD1 PRO 62 12.793 1.860 2.245 432 HD3 PRO 62 HD2 PRO 62 11.085 1.384 1.796 433 H THR 63 H THR 63 11.109 6.382 -0.684 434 HA THR 63 HA THR 63 13.673 7.254 0.344 435 HB THR 63 HB THR 63 13.754 8.638 -1.758 436 HG1 THR 63 HG1 THR 63 12.350 8.437 -3.197 437 HG21 THR 63 1HG2 THR 63 14.237 5.650 -1.795 438 HG22 THR 63 2HG2 THR 63 14.287 6.567 -3.285 439 HG23 THR 63 3HG2 THR 63 15.271 6.904 -1.798 440 H ILE 64 H ILE 64 13.496 9.944 -0.048 441 HA ILE 64 HA ILE 64 11.705 10.624 2.077 442 HB ILE 64 HB ILE 64 12.553 12.678 2.191 443 HG12 ILE 64 2HG1 ILE 64 14.434 13.317 0.443 444 HG13 ILE 64 1HG1 ILE 64 13.731 12.329 -0.645 445 HG21 ILE 64 1HG2 ILE 64 14.753 12.144 2.627 446 HG22 ILE 64 2HG2 ILE 64 13.883 10.630 2.753 447 HG23 ILE 64 3HG2 ILE 64 14.869 10.881 1.385 448 HD11 ILE 64 HD3 ILE 64 12.934 14.834 -0.765 449 HD12 ILE 64 HD1 ILE 64 11.577 13.759 -0.364 450 HD13 ILE 64 HD2 ILE 64 12.378 14.711 0.875 451 H SER 65 H SER 65 11.049 11.205 -1.594 452 HA SER 65 HA SER 65 8.566 12.509 -1.111 453 HB2 SER 65 HB2 SER 65 8.196 11.620 -3.383 454 HB3 SER 65 HB1 SER 65 9.730 12.582 -3.314 455 HG SER 65 HG SER 65 10.708 10.815 -3.787 456 H GLN 66 H GLN 66 9.480 9.180 -1.620 457 HA GLN 66 HA GLN 66 6.858 8.166 -1.552 458 HB2 GLN 66 HB2 GLN 66 9.375 6.675 -0.901 459 HB3 GLN 66 HB1 GLN 66 7.830 6.007 -1.462 460 HG2 GLN 66 HG2 GLN 66 8.254 7.071 -3.755 461 HG3 GLN 66 HG1 GLN 66 9.735 7.601 -3.212 462 HE21 GLN 66 1HE2 GLN 66 11.592 6.156 -3.354 463 HE22 GLN 66 2HE2 GLN 66 11.268 4.596 -4.088 464 H ALA 67 H ALA 67 9.024 8.231 1.252 465 HA ALA 67 HA ALA 67 7.769 6.923 3.078 466 HB1 ALA 67 HB1 ALA 67 9.789 8.202 3.265 467 HB2 ALA 67 HB2 ALA 67 9.094 9.748 3.542 468 HB3 ALA 67 HB3 ALA 67 8.705 8.449 4.685 469 H ARG 68 H ARG 68 6.966 10.334 2.633 470 HA ARG 68 HA ARG 68 4.649 10.376 4.237 471 HB2 ARG 68 HB2 ARG 68 5.641 12.044 1.957 472 HB3 ARG 68 HB1 ARG 68 4.173 12.436 2.908 473 HG2 ARG 68 HG2 ARG 68 7.161 12.233 3.833 474 HG3 ARG 68 HG1 ARG 68 6.154 13.737 3.743 475 HD2 ARG 68 HD2 ARG 68 6.469 13.372 5.913 476 HD3 ARG 68 HD1 ARG 68 4.845 13.231 5.414 477 HE ARG 68 HE ARG 68 4.846 11.031 6.179 478 HH11 ARG 68 1HH2 ARG 68 8.220 12.021 6.016 479 HH12 ARG 68 2HH2 ARG 68 8.756 10.720 7.155 480 HH21 ARG 68 1HH1 ARG 68 5.584 9.250 7.102 481 HH22 ARG 68 2HH1 ARG 68 7.247 8.990 7.558 482 H GLN 69 H GLN 69 5.179 9.377 0.667 483 HA GLN 69 HA GLN 69 2.283 9.576 0.244 484 HB2 GLN 69 HB2 GLN 69 4.566 8.281 -1.405 485 HB3 GLN 69 HB1 GLN 69 2.992 8.200 -1.765 486 HG2 GLN 69 HG2 GLN 69 2.951 10.683 -2.292 487 HG3 GLN 69 HG1 GLN 69 4.472 10.882 -1.480 488 HE21 GLN 69 1HE2 GLN 69 6.361 10.679 -2.522 489 HE22 GLN 69 2HE2 GLN 69 6.561 9.899 -4.071 490 H LEU 70 H LEU 70 4.533 6.914 1.351 491 HA LEU 70 HA LEU 70 2.588 5.018 0.817 492 HB2 LEU 70 HB2 LEU 70 4.937 5.470 2.806 493 HB3 LEU 70 HB1 LEU 70 4.029 3.866 2.846 494 HG LEU 70 HG LEU 70 5.267 4.941 0.347 495 HD11 LEU 70 1HD1 LEU 70 6.686 3.218 2.276 496 HD12 LEU 70 2HD1 LEU 70 7.286 3.778 0.639 497 HD13 LEU 70 3HD1 LEU 70 7.062 4.904 1.977 498 HD21 LEU 70 3HD2 LEU 70 4.496 2.258 1.475 499 HD22 LEU 70 1HD2 LEU 70 3.561 3.106 0.169 500 HD23 LEU 70 2HD2 LEU 70 5.184 2.625 -0.260 501 H GLU 71 H GLU 71 3.002 7.028 3.762 502 HA GLU 71 HA GLU 71 0.784 5.865 5.144 503 HB2 GLU 71 HB2 GLU 71 1.915 8.614 4.809 504 HB3 GLU 71 HB1 GLU 71 0.586 8.288 5.943 505 HG2 GLU 71 HG2 GLU 71 1.995 6.859 7.302 506 HG3 GLU 71 HG1 GLU 71 3.417 7.223 6.142 507 H LYS 72 H LYS 72 0.787 8.427 2.522 508 HA LYS 72 HA LYS 72 -2.039 8.912 2.825 509 HB2 LYS 72 HB2 LYS 72 0.377 9.853 1.235 510 HB3 LYS 72 HB1 LYS 72 -1.308 10.542 1.065 511 HG2 LYS 72 HG2 LYS 72 -1.528 10.961 3.357 512 HG3 LYS 72 HG1 LYS 72 0.245 10.589 3.688 513 HD2 LYS 72 HD2 LYS 72 0.801 12.224 2.038 514 HD3 LYS 72 HD1 LYS 72 -0.912 12.602 1.814 515 HE2 LYS 72 HE2 LYS 72 -1.204 13.091 4.198 516 HE3 LYS 72 HE1 LYS 72 0.482 12.858 4.550 517 HZ1 LYS 72 HZ1 LYS 72 0.938 14.850 3.062 518 HZ2 LYS 72 HZ2 LYS 72 -0.731 15.106 3.088 519 HZ3 LYS 72 HZ3 LYS 72 0.224 15.058 4.407 520 H ILE 73 H ILE 73 -0.335 6.955 0.462 521 HA ILE 73 HA ILE 73 -2.559 7.082 -1.401 522 HB ILE 73 HB ILE 73 -1.510 5.017 -2.376 523 HG12 ILE 73 2HG1 ILE 73 0.256 5.105 0.061 524 HG13 ILE 73 1HG1 ILE 73 -0.751 3.861 -0.562 525 HG21 ILE 73 1HG2 ILE 73 -0.976 7.330 -3.071 526 HG22 ILE 73 2HG2 ILE 73 0.219 7.498 -1.908 527 HG23 ILE 73 3HG2 ILE 73 0.519 6.365 -3.114 528 HD11 ILE 73 HD3 ILE 73 1.866 5.066 -1.692 529 HD12 ILE 73 HD1 ILE 73 1.721 3.548 -1.098 530 HD13 ILE 73 HD2 ILE 73 0.756 4.042 -2.648 531 H LEU 74 H LEU 74 -1.731 4.626 1.129 532 HA LEU 74 HA LEU 74 -4.044 3.428 1.126 533 HB2 LEU 74 HB2 LEU 74 -1.880 2.689 2.190 534 HB3 LEU 74 HB1 LEU 74 -2.219 3.806 3.473 535 HG LEU 74 HG LEU 74 -4.253 2.779 4.104 536 HD11 LEU 74 1HD1 LEU 74 -3.910 0.949 1.757 537 HD12 LEU 74 2HD1 LEU 74 -5.073 0.682 3.198 538 HD13 LEU 74 3HD1 LEU 74 -5.287 1.956 2.156 539 HD21 LEU 74 3HD2 LEU 74 -1.989 1.819 4.942 540 HD22 LEU 74 1HD2 LEU 74 -3.293 0.575 4.772 541 HD23 LEU 74 2HD2 LEU 74 -1.967 0.913 3.498 542 H GLY 75 H GLY 75 -3.159 6.497 2.344 543 HA2 GLY 75 HA2 GLY 75 -4.068 8.171 3.509 544 HA3 GLY 75 HA1 GLY 75 -5.693 7.470 3.366 545 H ILE 76 H ILE 76 -4.201 5.058 4.822 546 HA ILE 76 HA ILE 76 -4.849 5.981 7.499 547 HB ILE 76 HB ILE 76 -6.342 4.018 7.853 548 HG12 ILE 76 2HG1 ILE 76 -6.277 3.663 4.967 549 HG13 ILE 76 1HG1 ILE 76 -5.318 2.625 6.050 550 HG21 ILE 76 1HG2 ILE 76 -7.322 5.703 5.585 551 HG22 ILE 76 2HG2 ILE 76 -8.246 5.024 6.899 552 HG23 ILE 76 3HG2 ILE 76 -7.155 6.337 7.299 553 HD11 ILE 76 HD3 ILE 76 -7.402 1.765 7.044 554 HD12 ILE 76 HD1 ILE 76 -8.355 2.812 6.047 555 HD13 ILE 76 HD2 ILE 76 -7.451 1.435 5.340 556 H LYS 77 H LYS 77 -4.740 3.884 9.145 557 HA LYS 77 HA LYS 77 -2.352 2.271 8.701 558 HB2 LYS 77 HB2 LYS 77 -1.167 3.152 10.587 559 HB3 LYS 77 HB1 LYS 77 -1.139 4.253 9.313 560 HG2 LYS 77 HG2 LYS 77 -2.808 5.572 10.278 561 HG3 LYS 77 HG1 LYS 77 -2.955 4.411 11.691 562 HD2 LYS 77 HD2 LYS 77 -0.427 4.993 12.006 563 HD3 LYS 77 HD1 LYS 77 -0.545 5.979 10.618 564 HE2 LYS 77 HE2 LYS 77 -0.604 7.683 12.267 565 HE3 LYS 77 HE1 LYS 77 -2.263 7.384 11.839 566 HZ1 LYS 77 HZ1 LYS 77 -0.777 6.735 14.210 567 HZ2 LYS 77 HZ2 LYS 77 -2.465 7.156 14.038 568 HZ3 LYS 77 HZ3 LYS 77 -1.791 5.637 13.785 569 H LEU 78 H LEU 78 -2.010 0.916 10.564 570 HA LEU 78 HA LEU 78 -3.824 1.027 12.639 571 HB2 LEU 78 HB2 LEU 78 -3.841 -1.408 10.750 572 HB3 LEU 78 HB1 LEU 78 -4.094 -1.707 12.440 573 HG LEU 78 HG LEU 78 -5.826 -0.225 10.481 574 HD11 LEU 78 1HD1 LEU 78 -6.151 -2.547 10.453 575 HD12 LEU 78 2HD1 LEU 78 -6.657 -2.448 12.211 576 HD13 LEU 78 3HD1 LEU 78 -7.611 -1.639 10.995 577 HD21 LEU 78 3HD2 LEU 78 -6.029 1.174 12.567 578 HD22 LEU 78 1HD2 LEU 78 -7.391 0.182 12.563 579 HD23 LEU 78 2HD2 LEU 78 -5.986 -0.290 13.545 580 H VAL 79 H VAL 79 -1.456 -0.468 14.798 581 HA VAL 79 HA VAL 79 -4.185 -0.939 14.255 582 HB VAL 79 HB VAL 79 -4.164 -2.223 16.286 583 HG11 VAL 79 1HG1 VAL 79 -1.676 -3.262 15.039 584 HG12 VAL 79 2HG1 VAL 79 -3.003 -4.021 15.921 585 HG13 VAL 79 3HG1 VAL 79 -3.223 -3.507 14.267 586 HG21 VAL 79 3HG2 VAL 79 -2.017 -2.737 17.641 587 HG22 VAL 79 1HG2 VAL 79 -1.322 -1.382 16.774 588 HG23 VAL 79 2HG2 VAL 79 -2.719 -1.145 17.815 589 H THR 80 H THR 80 -5.688 -0.523 16.245 590 HA THR 80 HA THR 80 -5.126 2.015 17.785 591 HB THR 80 HB THR 80 -7.604 2.081 18.002 592 HG1 THR 80 HG1 THR 80 -8.683 0.492 16.854 593 HG21 THR 80 1HG2 THR 80 -7.017 1.350 15.129 594 HG22 THR 80 2HG2 THR 80 -8.109 2.628 15.944 595 HG23 THR 80 3HG2 THR 80 -6.593 2.927 15.856 596 HA PRO 81 HA PRO 81 -4.928 0.073 21.607 597 HB2 PRO 81 HB1 PRO 81 -7.523 1.571 22.322 598 HB3 PRO 81 HB2 PRO 81 -6.077 1.185 23.367 599 HG2 PRO 81 HG1 PRO 81 -6.225 3.534 22.036 600 HG3 PRO 81 HG2 PRO 81 -4.665 2.659 21.801 601 HD2 PRO 81 HD1 PRO 81 -7.226 2.650 20.146 602 HD3 PRO 81 HD2 PRO 81 -5.611 3.049 19.504 603 H LEU 82 H LEU 82 -7.632 -0.459 19.568 604 HA LEU 82 HA LEU 82 -9.131 -2.553 20.947 605 HB2 LEU 82 HB2 LEU 82 -8.195 -2.174 18.108 606 HB3 LEU 82 HB1 LEU 82 -9.188 -3.500 18.650 607 HG LEU 82 HG LEU 82 -10.229 -0.569 18.736 608 HD11 LEU 82 1HD1 LEU 82 -10.028 -1.711 16.502 609 HD12 LEU 82 2HD1 LEU 82 -10.860 -3.125 17.267 610 HD13 LEU 82 3HD1 LEU 82 -11.635 -1.489 16.914 611 HD21 LEU 82 3HD2 LEU 82 -11.625 -3.127 19.568 612 HD22 LEU 82 1HD2 LEU 82 -11.311 -1.659 20.500 613 HD23 LEU 82 2HD2 LEU 82 -12.401 -1.676 19.149 614 H GLU 83 H GLU 83 -5.831 -2.292 19.656 615 HA GLU 83 HA GLU 83 -5.339 -4.910 20.823 616 HB2 GLU 83 HB2 GLU 83 -5.359 -5.060 18.233 617 HB3 GLU 83 HB1 GLU 83 -3.886 -4.003 18.418 618 HG2 GLU 83 HG2 GLU 83 -2.816 -5.988 18.287 619 HG3 GLU 83 HG1 GLU 83 -2.933 -5.509 19.978 620 H ASN 84 H ASN 84 -3.862 -1.674 19.765 621 HA ASN 84 HA ASN 84 -2.395 -1.723 22.082 622 HB2 ASN 84 HB2 ASN 84 -0.957 -3.036 20.583 623 HB3 ASN 84 HB1 ASN 84 -1.264 -1.763 19.330 624 HD21 ASN 84 1HD2 ASN 84 0.339 -1.869 22.648 625 HD22 ASN 84 2HD2 ASN 84 1.618 -0.810 22.092 626 H ASN 85 H ASN 85 -1.165 0.385 22.485 627 HA ASN 85 HA ASN 85 -2.500 2.590 21.057 628 HB2 ASN 85 HB2 ASN 85 -3.118 2.367 23.641 629 HB3 ASN 85 HB1 ASN 85 -1.374 2.706 23.843 630 HD21 ASN 85 1HD2 ASN 85 -2.529 4.893 25.094 631 HD22 ASN 85 2HD2 ASN 85 -3.189 6.016 24.041 632 H GLU 86 H GLU 86 -0.771 3.359 19.565 633 HA GLU 86 HA GLU 86 1.977 3.403 20.666 634 HB2 GLU 86 HB2 GLU 86 1.306 1.900 18.708 635 HB3 GLU 86 HB1 GLU 86 0.742 3.453 17.925 636 HG2 GLU 86 HG2 GLU 86 2.854 4.426 17.870 637 HG3 GLU 86 HG1 GLU 86 3.627 2.965 18.778 638 H GLU 87 H GLU 87 2.821 5.428 21.061 639 HA GLU 87 HA GLU 87 1.352 7.869 20.204 640 HB2 GLU 87 HB2 GLU 87 3.349 7.050 22.308 641 HB3 GLU 87 HB1 GLU 87 2.624 8.717 22.156 642 HG2 GLU 87 HG2 GLU 87 0.463 7.871 22.919 643 HG3 GLU 87 HG1 GLU 87 1.063 6.255 22.900 644 H SER 88 H SER 88 3.107 9.841 20.031 645 HA SER 88 HA SER 88 4.690 9.504 17.783 646 HB2 SER 88 HB2 SER 88 5.494 11.651 18.411 647 HB3 SER 88 HB1 SER 88 3.720 11.566 18.630 648 HG SER 88 HG SER 88 5.073 12.456 20.471 649 H GLU 89 H GLU 89 5.647 8.769 21.186 650 HA GLU 89 HA GLU 89 8.408 8.846 20.557 651 HB2 GLU 89 HB2 GLU 89 7.002 7.519 22.925 652 HB3 GLU 89 HB1 GLU 89 8.698 7.829 22.741 653 HG2 GLU 89 HG2 GLU 89 8.051 10.305 22.744 654 HG3 GLU 89 HG1 GLU 89 6.372 9.814 22.890 655 H LYS 90 H LYS 90 5.997 6.498 19.887 656 HA LYS 90 HA LYS 90 8.060 4.620 18.738 657 HB2 LYS 90 HB2 LYS 90 5.365 4.346 20.100 658 HB3 LYS 90 HB1 LYS 90 5.801 3.083 18.987 659 HG2 LYS 90 HG2 LYS 90 7.798 2.519 20.163 660 HG3 LYS 90 HG1 LYS 90 7.600 3.721 21.309 661 HD2 LYS 90 HD2 LYS 90 5.432 2.597 21.919 662 HD3 LYS 90 HD1 LYS 90 5.941 1.258 20.784 663 HE2 LYS 90 HE2 LYS 90 8.096 1.056 22.016 664 HE3 LYS 90 HE1 LYS 90 7.482 2.277 23.158 665 HZ1 LYS 90 HZ1 LYS 90 5.836 0.884 23.948 666 HZ2 LYS 90 HZ2 LYS 90 6.004 -0.303 22.924 667 HZ3 LYS 90 HZ3 LYS 90 7.151 0.072 24.043 668 H GLU 91 H GLU 91 5.214 6.595 17.972 669 HA GLU 91 HA GLU 91 5.024 5.258 15.452 670 HB2 GLU 91 HB2 GLU 91 3.129 6.299 16.482 671 HB3 GLU 91 HB1 GLU 91 3.878 7.906 16.232 672 HG2 GLU 91 HG2 GLU 91 3.518 7.819 13.903 673 HG3 GLU 91 HG1 GLU 91 3.267 6.072 13.910 674 H PHE 92 H PHE 92 7.132 7.788 16.485 675 HA PHE 92 HA PHE 92 8.015 8.492 13.704 676 HB2 PHE 92 HB2 PHE 92 6.087 10.029 14.757 677 HB3 PHE 92 HB1 PHE 92 7.330 10.572 15.853 678 HD1 PHE 92 HD1 PHE 92 9.379 11.854 14.782 679 HD2 PHE 92 HD2 PHE 92 6.021 10.453 12.438 680 HE1 PHE 92 HE1 PHE 92 9.672 13.688 13.234 681 HE2 PHE 92 HE2 PHE 92 6.404 12.278 10.873 682 HZ PHE 92 HZ PHE 92 8.333 13.865 11.223 683 H ASP 93 H ASP 93 9.847 7.653 13.737 684 HA ASP 93 HA ASP 93 11.597 6.954 15.551 685 HB2 ASP 93 HB2 ASP 93 11.839 6.141 13.480 686 HB3 ASP 93 HB1 ASP 93 11.499 7.567 12.568 687 H ASP 94 H ASP 94 11.115 10.245 14.728 688 HA ASP 94 HA ASP 94 13.836 11.058 15.499 689 HB2 ASP 94 HB2 ASP 94 12.757 11.897 13.294 690 HB3 ASP 94 HB1 ASP 94 11.435 12.439 14.240 691 H THR 95 H THR 95 11.321 10.422 17.161 692 HA THR 95 HA THR 95 11.817 12.649 19.050 693 HB THR 95 HB THR 95 9.220 11.985 19.781 694 HG1 THR 95 HG1 THR 95 9.121 10.583 17.849 695 HG21 THR 95 1HG2 THR 95 9.861 14.050 17.657 696 HG22 THR 95 2HG2 THR 95 8.403 13.753 18.752 697 HG23 THR 95 3HG2 THR 95 10.047 14.195 19.377 698 H GLY 96 H GLY 96 10.611 11.989 21.472 699 HA2 GLY 96 HA2 GLY 96 10.735 10.757 23.144 700 HA3 GLY 96 HA1 GLY 96 10.620 9.307 22.117 701 H LEU 97 H LEU 97 13.327 11.587 22.009 702 HA LEU 97 HA LEU 97 15.035 9.559 23.353 703 HB2 LEU 97 HB2 LEU 97 15.586 11.902 21.453 704 HB3 LEU 97 HB1 LEU 97 16.834 10.965 22.107 705 HG LEU 97 HG LEU 97 16.786 9.816 20.203 706 HD11 LEU 97 1HD1 LEU 97 14.307 8.426 21.287 707 HD12 LEU 97 2HD1 LEU 97 15.420 7.881 20.067 708 HD13 LEU 97 3HD1 LEU 97 16.017 8.129 21.760 709 HD21 LEU 97 3HD2 LEU 97 14.878 9.673 18.716 710 HD22 LEU 97 1HD2 LEU 97 14.197 10.986 19.817 711 HD23 LEU 97 2HD2 LEU 97 15.729 11.275 18.946 712 H THR 98 H THR 98 13.664 12.549 23.862 713 HA THR 98 HA THR 98 14.638 13.176 26.333 714 HB THR 98 HB THR 98 16.799 13.538 25.294 715 HG1 THR 98 HG1 THR 98 17.038 15.436 26.443 716 HG21 THR 98 1HG2 THR 98 16.053 13.965 23.095 717 HG22 THR 98 2HG2 THR 98 15.765 15.725 23.532 718 HG23 THR 98 3HG2 THR 98 17.331 15.127 23.542 719 H LEU 99 H LEU 99 14.015 15.426 27.054 720 HA LEU 99 HA LEU 99 11.750 16.604 25.526 721 HB2 LEU 99 HB2 LEU 99 11.923 16.148 28.060 722 HB3 LEU 99 HB1 LEU 99 13.013 17.476 28.134 723 HG LEU 99 HG LEU 99 11.199 19.087 27.523 724 HD11 LEU 99 1HD1 LEU 99 9.911 17.989 26.060 725 HD12 LEU 99 2HD1 LEU 99 9.504 16.711 27.141 726 HD13 LEU 99 3HD1 LEU 99 8.808 18.229 27.465 727 HD21 LEU 99 3HD2 LEU 99 10.379 16.986 29.619 728 HD22 LEU 99 1HD2 LEU 99 11.377 18.486 29.923 729 HD23 LEU 99 2HD2 LEU 99 9.731 18.646 29.536 730 H GLY 100 H GLY 100 14.907 16.711 24.935 731 HA2 GLY 100 HA2 GLY 100 16.674 18.020 24.809 732 HA3 GLY 100 HA1 GLY 100 15.793 18.966 23.731 733 H ASP 101 H ASP 101 15.545 18.369 27.205 734 HA ASP 101 HA ASP 101 15.028 21.090 27.894 735 HB2 ASP 101 HB2 ASP 101 14.102 18.934 29.178 736 HB3 ASP 101 HB1 ASP 101 15.734 18.615 29.644 737 H VAL 102 H VAL 102 16.389 22.330 27.224 738 HA VAL 102 HA VAL 102 19.016 22.357 28.248 739 HB VAL 102 HB VAL 102 19.126 24.382 26.741 740 HG11 VAL 102 1HG1 VAL 102 19.324 23.021 24.715 741 HG12 VAL 102 2HG1 VAL 102 20.155 22.274 26.053 742 HG13 VAL 102 3HG1 VAL 102 18.540 21.674 25.534 743 HG21 VAL 102 3HG2 VAL 102 16.518 23.208 25.751 744 HG22 VAL 102 1HG2 VAL 102 16.718 24.808 26.505 745 HG23 VAL 102 2HG2 VAL 102 17.518 24.471 24.948 746 H VAL 103 H VAL 103 18.782 25.653 30.068 747 HA VAL 103 HA VAL 103 20.653 25.182 27.924 748 HB VAL 103 HB VAL 103 20.825 26.854 29.410 749 HG11 VAL 103 1HG1 VAL 103 21.487 26.833 31.646 750 HG12 VAL 103 2HG1 VAL 103 20.399 25.388 31.597 751 HG13 VAL 103 3HG1 VAL 103 22.118 25.222 31.620 752 HG21 VAL 103 3HG2 VAL 103 23.213 26.889 29.686 753 HG22 VAL 103 1HG2 VAL 103 23.318 25.157 29.170 754 HG23 VAL 103 2HG2 VAL 103 22.625 26.203 28.061 755 H ASN 104 H ASN 104 21.848 23.548 27.431 756 HA ASN 104 HA ASN 104 22.070 20.827 28.565 757 HB2 ASN 104 HB2 ASN 104 23.612 20.479 27.213 758 HB3 ASN 104 HB1 ASN 104 22.611 21.725 26.333 759 HD21 ASN 104 1HD2 ASN 104 23.571 23.898 25.895 760 HD22 ASN 104 2HD2 ASN 104 25.289 24.047 26.301 761 H ILE 105 H ILE 105 22.559 20.404 30.613 762 HA ILE 105 HA ILE 105 23.789 21.966 32.416 763 HB ILE 105 HB ILE 105 24.121 19.994 33.827 764 HG12 ILE 105 2HG1 ILE 105 22.905 18.528 31.471 765 HG13 ILE 105 1HG1 ILE 105 24.634 18.376 31.878 766 HG21 ILE 105 1HG2 ILE 105 21.609 19.770 33.905 767 HG22 ILE 105 2HG2 ILE 105 22.047 21.461 33.570 768 HG23 ILE 105 3HG2 ILE 105 21.463 20.394 32.358 769 HD11 ILE 105 HD3 ILE 105 23.569 16.531 32.837 770 HD12 ILE 105 HD1 ILE 105 23.946 17.576 34.143 771 HD13 ILE 105 HD2 ILE 105 22.249 17.413 33.416 772 H LYS 106 H LYS 106 25.772 20.426 29.949 773 HA LYS 106 HA LYS 106 28.189 20.583 31.535 774 HB2 LYS 106 HB2 LYS 106 27.420 19.234 29.244 775 HB3 LYS 106 HB1 LYS 106 27.905 20.658 28.466 776 HG2 LYS 106 HG2 LYS 106 29.620 19.055 28.270 777 HG3 LYS 106 HG1 LYS 106 30.140 20.429 29.354 778 HD2 LYS 106 HD2 LYS 106 29.838 18.902 31.327 779 HD3 LYS 106 HD1 LYS 106 29.178 17.666 30.287 780 HE2 LYS 106 HE2 LYS 106 31.397 17.643 29.042 781 HE3 LYS 106 HE1 LYS 106 32.016 18.756 30.320 782 HZ1 LYS 106 HZ1 LYS 106 30.892 16.169 30.974 783 HZ2 LYS 106 HZ2 LYS 106 32.499 16.360 30.555 784 HZ3 LYS 106 HZ3 LYS 106 31.938 17.084 31.851 785 H GLU 107 H GLU 107 26.345 22.709 29.485 786 HA GLU 107 HA GLU 107 28.252 24.929 29.899 787 HB2 GLU 107 HB2 GLU 107 25.749 24.574 28.425 788 HB3 GLU 107 HB1 GLU 107 26.577 26.135 28.433 789 HG2 GLU 107 HG2 GLU 107 27.769 23.712 27.231 790 HG3 GLU 107 HG1 GLU 107 26.829 24.859 26.292 791 H GLY 108 H GLY 108 25.752 23.646 31.688 792 HA2 GLY 108 HA2 GLY 108 26.506 25.158 33.574 793 HA3 GLY 108 HA1 GLY 108 25.089 26.142 32.935 794 H LYS 109 H LYS 109 25.947 24.179 35.536 795 HA LYS 109 HA LYS 109 23.299 23.003 35.839 796 HB2 LYS 109 HB2 LYS 109 25.148 21.404 35.265 797 HB3 LYS 109 HB1 LYS 109 25.828 21.691 36.825 798 HG2 LYS 109 HG2 LYS 109 23.792 21.142 37.945 799 HG3 LYS 109 HG1 LYS 109 23.041 20.569 36.390 800 HD2 LYS 109 HD2 LYS 109 24.867 19.108 35.871 801 HD3 LYS 109 HD1 LYS 109 25.606 19.491 37.467 802 HE2 LYS 109 HE2 LYS 109 23.681 18.494 38.616 803 HE3 LYS 109 HE1 LYS 109 22.951 18.029 37.127 804 HZ1 LYS 109 HZ1 LYS 109 24.426 16.205 37.939 805 HZ2 LYS 109 HZ2 LYS 109 24.951 16.728 36.541 806 HZ3 LYS 109 HZ3 LYS 109 25.687 17.155 37.892 807 H LYS 110 H LYS 110 22.601 23.181 37.657 808 HA LYS 110 HA LYS 110 23.502 24.130 40.130 809 HB2 LYS 110 HB2 LYS 110 22.595 26.426 39.994 810 HB3 LYS 110 HB1 LYS 110 23.771 26.162 38.642 811 HG2 LYS 110 HG2 LYS 110 21.547 25.696 37.253 812 HG3 LYS 110 HG1 LYS 110 20.784 26.051 38.782 813 HD2 LYS 110 HD2 LYS 110 21.688 28.353 38.683 814 HD3 LYS 110 HD1 LYS 110 22.432 27.994 37.111 815 HE2 LYS 110 HE2 LYS 110 20.232 27.477 36.185 816 HE3 LYS 110 HE1 LYS 110 19.479 27.719 37.832 817 HZ1 LYS 110 HZ1 LYS 110 20.937 29.816 36.242 818 HZ2 LYS 110 HZ2 LYS 110 19.417 29.562 36.086 819 HZ3 LYS 110 HZ3 LYS 110 20.021 30.049 37.544 820 H LEU 111 H LEU 111 21.414 22.417 38.614 821 HA LEU 111 HA LEU 111 19.861 22.040 41.046 822 HB2 LEU 111 HB2 LEU 111 19.288 21.090 38.170 823 HB3 LEU 111 HB1 LEU 111 18.565 20.440 39.603 824 HG LEU 111 HG LEU 111 18.452 23.385 39.687 825 HD11 LEU 111 1HD1 LEU 111 18.403 23.219 37.309 826 HD12 LEU 111 2HD1 LEU 111 17.101 21.991 37.297 827 HD13 LEU 111 3HD1 LEU 111 16.845 23.686 37.991 828 HD21 LEU 111 3HD2 LEU 111 16.067 22.965 39.945 829 HD22 LEU 111 1HD2 LEU 111 16.264 21.230 39.916 830 HD23 LEU 111 2HD2 LEU 111 17.145 22.251 41.153 831 H GLU 112 H GLU 112 19.429 19.569 41.257 832 HA GLU 112 HA GLU 112 21.902 18.061 41.751 833 HB2 GLU 112 HB2 GLU 112 21.837 20.344 43.053 834 HB3 GLU 112 HB1 GLU 112 20.628 19.525 44.098 835 HG2 GLU 112 HG2 GLU 112 22.227 17.807 44.633 836 HG3 GLU 112 HG1 GLU 112 23.342 18.463 43.384 837 H HIS 113 H HIS 113 19.273 17.973 43.917 838 HA HIS 113 HA HIS 113 19.428 15.068 43.503 839 HB2 HIS 113 HB2 HIS 113 17.962 14.847 45.372 840 HB3 HIS 113 HB1 HIS 113 19.419 15.857 45.744 841 HD2 HIS 113 HD2 HIS 113 18.861 18.625 45.771 842 HE1 HIS 113 HE1 HIS 113 14.674 18.275 46.184 843 HE2 HIS 113 HE2 HIS 113 16.726 19.883 46.413 844 H HIS 114 H HIS 114 17.845 17.467 42.054 845 HA HIS 114 HA HIS 114 15.207 16.888 41.820 846 HB2 HIS 114 HB2 HIS 114 15.249 18.101 39.590 847 HB3 HIS 114 HB1 HIS 114 16.362 18.891 40.689 848 HD2 HIS 114 HD2 HIS 114 16.434 19.156 37.572 849 HE1 HIS 114 HE1 HIS 114 20.456 17.983 38.535 850 HE2 HIS 114 HE2 HIS 114 18.936 19.160 36.800 Start of MODEL 14 1 H1 GLU 13 H1 GLU 13 -5.019 -18.698 1.670 2 H2 GLU 13 H2 GLU 13 -3.815 -18.646 0.640 3 H3 GLU 13 H3 GLU 13 -3.514 -18.983 2.168 4 HA GLU 13 HA GLU 13 -2.756 -16.695 1.496 5 HB2 GLU 13 HB2 GLU 13 -5.841 -16.574 1.241 6 HB3 GLU 13 HB1 GLU 13 -4.765 -15.149 1.243 7 HG2 GLU 13 HG2 GLU 13 -3.473 -16.587 -0.538 8 HG3 GLU 13 HG1 GLU 13 -5.045 -17.398 -0.795 9 H ASN 14 H ASN 14 -2.470 -15.204 3.044 10 HA ASN 14 HA ASN 14 -3.493 -15.082 5.562 11 HB2 ASN 14 HB2 ASN 14 -2.921 -17.505 5.786 12 HB3 ASN 14 HB1 ASN 14 -1.288 -17.174 5.356 13 HD21 ASN 14 1HD2 ASN 14 -1.292 -18.314 7.589 14 HD22 ASN 14 2HD2 ASN 14 -1.291 -17.255 8.995 15 H ALA 15 H ALA 15 -2.608 -13.064 6.144 16 HA ALA 15 HA ALA 15 -0.302 -12.229 4.711 17 HB1 ALA 15 HB1 ALA 15 -2.157 -10.738 6.781 18 HB2 ALA 15 HB2 ALA 15 -1.112 -9.966 5.728 19 HB3 ALA 15 HB3 ALA 15 -2.435 -10.910 5.033 20 H GLU 16 H GLU 16 -0.687 -12.777 8.333 21 HA GLU 16 HA GLU 16 1.687 -11.910 9.170 22 HB2 GLU 16 HB2 GLU 16 0.018 -12.399 10.508 23 HB3 GLU 16 HB1 GLU 16 -0.293 -13.931 9.735 24 HG2 GLU 16 HG2 GLU 16 1.636 -15.035 10.717 25 HG3 GLU 16 HG1 GLU 16 2.378 -13.519 11.168 26 H LEU 17 H LEU 17 1.134 -14.742 7.176 27 HA LEU 17 HA LEU 17 3.678 -16.184 8.060 28 HB2 LEU 17 HB2 LEU 17 1.335 -17.057 7.475 29 HB3 LEU 17 HB1 LEU 17 1.726 -16.753 5.782 30 HG LEU 17 HG LEU 17 3.657 -18.322 6.033 31 HD11 LEU 17 1HD1 LEU 17 2.482 -18.979 8.779 32 HD12 LEU 17 2HD1 LEU 17 3.648 -19.852 7.865 33 HD13 LEU 17 3HD1 LEU 17 4.077 -18.257 8.293 34 HD21 LEU 17 3HD2 LEU 17 2.122 -20.175 5.537 35 HD22 LEU 17 1HD2 LEU 17 0.920 -19.599 6.659 36 HD23 LEU 17 2HD2 LEU 17 1.216 -18.798 5.134 37 H GLU 18 H GLU 18 3.526 -13.452 6.279 38 HA GLU 18 HA GLU 18 5.773 -14.482 4.689 39 HB2 GLU 18 HB2 GLU 18 4.874 -13.423 2.699 40 HB3 GLU 18 HB1 GLU 18 4.156 -14.872 3.302 41 HG2 GLU 18 HG2 GLU 18 2.275 -13.889 4.134 42 HG3 GLU 18 HG1 GLU 18 2.783 -12.301 4.230 43 H ILE 19 H ILE 19 5.053 -12.157 6.907 44 HA ILE 19 HA ILE 19 6.832 -10.044 5.770 45 HB ILE 19 HB ILE 19 5.657 -8.698 7.362 46 HG12 ILE 19 2HG1 ILE 19 3.526 -10.798 7.691 47 HG13 ILE 19 1HG1 ILE 19 4.903 -10.504 8.846 48 HG21 ILE 19 1HG2 ILE 19 5.043 -8.963 4.829 49 HG22 ILE 19 2HG2 ILE 19 3.514 -9.711 5.484 50 HG23 ILE 19 3HG2 ILE 19 3.897 -8.110 5.905 51 HD11 ILE 19 HD3 ILE 19 3.055 -8.167 8.197 52 HD12 ILE 19 HD1 ILE 19 2.823 -9.405 9.544 53 HD13 ILE 19 HD2 ILE 19 4.319 -8.589 9.411 54 H VAL 20 H VAL 20 8.147 -9.084 7.496 55 HA VAL 20 HA VAL 20 9.313 -10.926 9.412 56 HB VAL 20 HB VAL 20 10.726 -9.069 10.052 57 HG11 VAL 20 1HG1 VAL 20 11.610 -8.744 7.780 58 HG12 VAL 20 2HG1 VAL 20 11.833 -10.204 8.646 59 HG13 VAL 20 3HG1 VAL 20 10.554 -10.011 7.317 60 HG21 VAL 20 3HG2 VAL 20 10.653 -6.936 8.546 61 HG22 VAL 20 1HG2 VAL 20 9.153 -7.565 7.857 62 HG23 VAL 20 2HG2 VAL 20 9.294 -7.046 9.604 63 H THR 21 H THR 21 9.703 -10.417 11.723 64 HA THR 21 HA THR 21 7.322 -9.913 13.020 65 HB THR 21 HB THR 21 9.060 -9.668 15.081 66 HG1 THR 21 HG1 THR 21 11.168 -10.079 14.502 67 HG21 THR 21 1HG2 THR 21 8.040 -11.819 14.623 68 HG22 THR 21 2HG2 THR 21 9.319 -12.174 13.354 69 HG23 THR 21 3HG2 THR 21 9.705 -12.011 15.071 70 H ASP 22 H ASP 22 10.304 -7.747 12.631 71 HA ASP 22 HA ASP 22 9.197 -5.646 14.102 72 HB2 ASP 22 HB2 ASP 22 11.334 -6.045 11.919 73 HB3 ASP 22 HB1 ASP 22 11.391 -4.702 13.116 74 H TYR 23 H TYR 23 7.340 -6.165 12.067 75 HA TYR 23 HA TYR 23 7.601 -4.718 9.588 76 HB2 TYR 23 HB2 TYR 23 6.555 -6.738 9.646 77 HB3 TYR 23 HB1 TYR 23 5.448 -6.117 10.880 78 HD1 TYR 23 HD1 TYR 23 6.563 -5.469 7.357 79 HD2 TYR 23 HD2 TYR 23 3.378 -5.397 10.146 80 HE1 TYR 23 HE1 TYR 23 4.967 -5.255 5.446 81 HE2 TYR 23 HE2 TYR 23 1.680 -5.175 8.274 82 HH TYR 23 HH TYR 23 2.540 -5.555 4.821 83 H TYR 24 H TYR 24 6.601 -2.637 9.039 84 HA TYR 24 HA TYR 24 5.612 -0.778 10.807 85 HB2 TYR 24 HB2 TYR 24 4.490 0.336 8.984 86 HB3 TYR 24 HB1 TYR 24 6.243 0.123 8.999 87 HD1 TYR 24 HD2 TYR 24 7.352 -1.232 7.446 88 HD2 TYR 24 HD1 TYR 24 3.099 -0.773 7.226 89 HE1 TYR 24 HE2 TYR 24 7.435 -2.260 5.239 90 HE2 TYR 24 HE1 TYR 24 3.099 -1.858 5.039 91 HH TYR 24 HH TYR 24 4.349 -3.130 3.611 92 H LYS 25 H LYS 25 3.675 -0.191 11.634 93 HA LYS 25 HA LYS 25 1.479 -2.085 11.347 94 HB2 LYS 25 HB2 LYS 25 3.028 -1.305 13.519 95 HB3 LYS 25 HB1 LYS 25 1.716 -0.095 13.577 96 HG2 LYS 25 HG2 LYS 25 -0.005 -1.871 13.874 97 HG3 LYS 25 HG1 LYS 25 1.107 -3.065 13.352 98 HD2 LYS 25 HD2 LYS 25 1.687 -1.400 15.756 99 HD3 LYS 25 HD1 LYS 25 0.658 -2.857 15.828 100 HE2 LYS 25 HE2 LYS 25 2.587 -4.236 15.164 101 HE3 LYS 25 HE1 LYS 25 3.546 -2.767 14.723 102 HZ1 LYS 25 HZ1 LYS 25 4.382 -3.421 16.650 103 HZ2 LYS 25 HZ2 LYS 25 3.411 -2.144 17.097 104 HZ3 LYS 25 HZ3 LYS 25 2.916 -3.679 17.318 105 H ILE 26 H ILE 26 2.005 1.094 10.577 106 HA ILE 26 HA ILE 26 -0.290 2.447 11.508 107 HB ILE 26 HB ILE 26 0.010 3.885 9.416 108 HG12 ILE 26 2HG1 ILE 26 2.677 2.408 9.443 109 HG13 ILE 26 1HG1 ILE 26 1.508 2.533 8.086 110 HG21 ILE 26 1HG2 ILE 26 1.306 5.232 10.791 111 HG22 ILE 26 2HG2 ILE 26 0.412 4.306 11.815 112 HG23 ILE 26 3HG2 ILE 26 2.177 3.902 11.563 113 HD11 ILE 26 HD3 ILE 26 3.194 4.638 9.287 114 HD12 ILE 26 HD1 ILE 26 3.314 3.830 7.651 115 HD13 ILE 26 HD2 ILE 26 1.983 4.932 8.012 116 H ILE 27 H ILE 27 0.169 0.724 8.572 117 HA ILE 27 HA ILE 27 -2.549 1.078 7.913 118 HB ILE 27 HB ILE 27 -2.004 0.028 5.636 119 HG12 ILE 27 2HG1 ILE 27 0.799 0.058 6.716 120 HG13 ILE 27 1HG1 ILE 27 -0.066 -1.278 5.880 121 HG21 ILE 27 1HG2 ILE 27 -0.581 2.503 6.349 122 HG22 ILE 27 2HG2 ILE 27 -1.334 2.028 4.709 123 HG23 ILE 27 3HG2 ILE 27 -2.340 2.389 6.036 124 HD11 ILE 27 HD3 ILE 27 -0.069 0.012 3.848 125 HD12 ILE 27 HD1 ILE 27 1.098 1.212 4.717 126 HD13 ILE 27 HD2 ILE 27 1.493 -0.428 4.361 127 H LYS 28 H LYS 28 -0.932 -1.446 9.385 128 HA LYS 28 HA LYS 28 -2.063 -3.466 8.329 129 HB2 LYS 28 HB2 LYS 28 -0.250 -3.254 10.292 130 HB3 LYS 28 HB1 LYS 28 -1.635 -3.185 11.400 131 HG2 LYS 28 HG2 LYS 28 -2.280 -5.498 10.482 132 HG3 LYS 28 HG1 LYS 28 -0.936 -5.315 9.313 133 HD2 LYS 28 HD2 LYS 28 0.602 -5.302 11.324 134 HD3 LYS 28 HD1 LYS 28 -0.818 -5.603 12.324 135 HE2 LYS 28 HE2 LYS 28 0.416 -7.401 10.179 136 HE3 LYS 28 HE1 LYS 28 0.624 -7.592 11.911 137 HZ1 LYS 28 HZ1 LYS 28 -1.496 -8.299 12.212 138 HZ2 LYS 28 HZ2 LYS 28 -1.921 -8.042 10.597 139 HZ3 LYS 28 HZ3 LYS 28 -0.730 -9.128 11.087 140 H THR 29 H THR 29 -3.775 -2.471 11.449 141 HA THR 29 HA THR 29 -5.638 -4.495 11.013 142 HB THR 29 HB THR 29 -6.799 -3.570 12.825 143 HG1 THR 29 HG1 THR 29 -6.192 -1.510 13.603 144 HG21 THR 29 1HG2 THR 29 -3.831 -3.232 13.609 145 HG22 THR 29 2HG2 THR 29 -5.176 -3.810 14.657 146 HG23 THR 29 3HG2 THR 29 -4.617 -4.784 13.403 147 H ALA 30 H ALA 30 -5.494 -1.011 10.220 148 HA ALA 30 HA ALA 30 -8.018 -0.667 9.218 149 HB1 ALA 30 HB1 ALA 30 -5.260 0.554 8.785 150 HB2 ALA 30 HB2 ALA 30 -6.745 1.207 8.087 151 HB3 ALA 30 HB3 ALA 30 -6.496 1.131 9.867 152 H ARG 31 H ARG 31 -5.294 -2.220 7.284 153 HA ARG 31 HA ARG 31 -6.772 -2.240 4.777 154 HB2 ARG 31 HB2 ARG 31 -4.754 -4.173 6.211 155 HB3 ARG 31 HB1 ARG 31 -5.423 -4.411 4.657 156 HG2 ARG 31 HG2 ARG 31 -4.352 -2.444 3.707 157 HG3 ARG 31 HG1 ARG 31 -3.893 -1.887 5.336 158 HD2 ARG 31 HD2 ARG 31 -1.987 -2.579 4.243 159 HD3 ARG 31 HD1 ARG 31 -2.326 -3.627 5.550 160 HE ARG 31 HE ARG 31 -3.010 -4.376 2.750 161 HH11 ARG 31 1HH2 ARG 31 -1.276 -5.222 5.755 162 HH12 ARG 31 2HH2 ARG 31 -0.638 -6.695 5.049 163 HH21 ARG 31 1HH1 ARG 31 -2.385 -6.606 2.143 164 HH22 ARG 31 2HH1 ARG 31 -1.249 -7.426 3.161 165 H GLU 32 H GLU 32 -6.901 -4.547 7.630 166 HA GLU 32 HA GLU 32 -8.733 -6.304 6.386 167 HB2 GLU 32 HB2 GLU 32 -7.453 -5.777 9.125 168 HB3 GLU 32 HB1 GLU 32 -8.768 -6.891 8.980 169 HG2 GLU 32 HG2 GLU 32 -7.661 -8.138 7.183 170 HG3 GLU 32 HG1 GLU 32 -6.201 -7.087 7.327 171 H GLN 33 H GLN 33 -9.238 -3.405 8.489 172 HA GLN 33 HA GLN 33 -12.071 -3.854 8.773 173 HB2 GLN 33 HB2 GLN 33 -10.086 -1.666 9.227 174 HB3 GLN 33 HB1 GLN 33 -11.765 -1.486 9.610 175 HG2 GLN 33 HG2 GLN 33 -11.788 -3.264 11.231 176 HG3 GLN 33 HG1 GLN 33 -10.021 -3.591 10.905 177 HE21 GLN 33 1HE2 GLN 33 -8.478 -2.184 11.679 178 HE22 GLN 33 2HE2 GLN 33 -8.792 -1.189 13.127 179 H LEU 34 H LEU 34 -10.290 -2.063 6.287 180 HA LEU 34 HA LEU 34 -12.691 -1.499 4.874 181 HB2 LEU 34 HB2 LEU 34 -9.793 -2.012 4.004 182 HB3 LEU 34 HB1 LEU 34 -11.006 -1.268 2.917 183 HG LEU 34 HG LEU 34 -10.055 -0.129 5.593 184 HD11 LEU 34 1HD1 LEU 34 -8.663 1.405 4.016 185 HD12 LEU 34 2HD1 LEU 34 -8.495 -0.372 3.603 186 HD13 LEU 34 3HD1 LEU 34 -9.528 0.746 2.656 187 HD21 LEU 34 3HD2 LEU 34 -11.887 0.923 3.333 188 HD22 LEU 34 1HD2 LEU 34 -12.095 0.777 5.100 189 HD23 LEU 34 2HD2 LEU 34 -11.024 2.009 4.326 190 H GLY 35 H GLY 35 -10.917 -4.573 5.156 191 HA2 GLY 35 HA2 GLY 35 -11.730 -6.673 4.509 192 HA3 GLY 35 HA1 GLY 35 -13.110 -5.951 3.698 193 H ILE 36 H ILE 36 -10.935 -4.085 2.312 194 HA ILE 36 HA ILE 36 -11.942 -5.130 0.094 195 HB ILE 36 HB ILE 36 -10.481 -3.287 -1.014 196 HG12 ILE 36 2HG1 ILE 36 -9.817 -2.597 1.825 197 HG13 ILE 36 1HG1 ILE 36 -8.607 -3.208 0.624 198 HG21 ILE 36 1HG2 ILE 36 -12.168 -2.096 1.151 199 HG22 ILE 36 2HG2 ILE 36 -11.958 -1.628 -0.458 200 HG23 ILE 36 3HG2 ILE 36 -12.799 -3.114 -0.162 201 HD11 ILE 36 HD3 ILE 36 -8.938 -1.301 -0.812 202 HD12 ILE 36 HD1 ILE 36 -10.043 -0.585 0.420 203 HD13 ILE 36 HD2 ILE 36 -8.331 -0.904 0.800 204 H SER 37 H SER 37 -10.964 -5.721 -1.999 205 HA SER 37 HA SER 37 -8.887 -7.668 -1.544 206 HB2 SER 37 HB2 SER 37 -9.043 -8.270 -3.974 207 HB3 SER 37 HB1 SER 37 -10.639 -8.224 -3.047 208 HG SER 37 HG SER 37 -10.731 -6.935 -5.002 209 H GLN 38 H GLN 38 -7.018 -7.948 -3.067 210 HA GLN 38 HA GLN 38 -5.362 -5.554 -3.234 211 HB2 GLN 38 HB2 GLN 38 -4.718 -8.190 -3.564 212 HB3 GLN 38 HB1 GLN 38 -4.725 -7.510 -5.272 213 HG2 GLN 38 HG2 GLN 38 -3.191 -5.844 -4.366 214 HG3 GLN 38 HG1 GLN 38 -2.992 -6.638 -2.858 215 HE21 GLN 38 1HE2 GLN 38 -1.213 -8.022 -2.715 216 HE22 GLN 38 2HE2 GLN 38 -0.533 -8.887 -4.051 217 H GLN 39 H GLN 39 -7.453 -7.104 -5.636 218 HA GLN 39 HA GLN 39 -6.791 -5.111 -7.488 219 HB2 GLN 39 HB2 GLN 39 -9.142 -7.147 -7.300 220 HB3 GLN 39 HB1 GLN 39 -9.024 -5.896 -8.576 221 HG2 GLN 39 HG2 GLN 39 -6.997 -6.761 -9.481 222 HG3 GLN 39 HG1 GLN 39 -6.734 -7.691 -7.972 223 HE21 GLN 39 1HE2 GLN 39 -7.828 -9.836 -7.913 224 HE22 GLN 39 2HE2 GLN 39 -8.731 -10.317 -9.298 225 H GLN 40 H GLN 40 -9.040 -4.652 -4.794 226 HA GLN 40 HA GLN 40 -9.944 -2.163 -6.020 227 HB2 GLN 40 HB2 GLN 40 -10.212 -3.513 -3.207 228 HB3 GLN 40 HB1 GLN 40 -10.919 -2.000 -3.584 229 HG2 GLN 40 HG2 GLN 40 -12.353 -3.004 -5.243 230 HG3 GLN 40 HG1 GLN 40 -11.489 -4.572 -5.110 231 HE21 GLN 40 1HE2 GLN 40 -14.376 -2.768 -4.044 232 HE22 GLN 40 2HE2 GLN 40 -14.714 -3.719 -2.714 233 H LEU 41 H LEU 41 -7.196 -3.024 -3.915 234 HA LEU 41 HA LEU 41 -6.585 -0.325 -3.127 235 HB2 LEU 41 HB2 LEU 41 -5.934 -2.328 -2.026 236 HB3 LEU 41 HB1 LEU 41 -4.921 -2.808 -3.337 237 HG LEU 41 HG LEU 41 -3.619 -0.594 -2.984 238 HD11 LEU 41 1HD1 LEU 41 -5.151 0.291 -1.282 239 HD12 LEU 41 2HD1 LEU 41 -4.304 -0.945 -0.190 240 HD13 LEU 41 3HD1 LEU 41 -3.355 0.282 -0.855 241 HD21 LEU 41 3HD2 LEU 41 -3.567 -3.134 -1.330 242 HD22 LEU 41 1HD2 LEU 41 -2.561 -2.765 -2.787 243 HD23 LEU 41 2HD2 LEU 41 -2.298 -1.908 -1.283 244 H ALA 42 H ALA 42 -5.866 -2.376 -6.203 245 HA ALA 42 HA ALA 42 -3.889 -0.761 -7.184 246 HB1 ALA 42 HB1 ALA 42 -5.909 -2.627 -8.598 247 HB2 ALA 42 HB2 ALA 42 -4.281 -2.210 -9.132 248 HB3 ALA 42 HB3 ALA 42 -4.478 -3.140 -7.755 249 H GLN 43 H GLN 43 -7.464 -0.912 -7.423 250 HA GLN 43 HA GLN 43 -7.733 1.214 -9.163 251 HB2 GLN 43 HB2 GLN 43 -9.467 -0.014 -7.128 252 HB3 GLN 43 HB1 GLN 43 -10.036 1.328 -8.057 253 HG2 GLN 43 HG2 GLN 43 -9.649 0.292 -10.167 254 HG3 GLN 43 HG1 GLN 43 -8.861 -1.068 -9.443 255 HE21 GLN 43 1HE2 GLN 43 -10.200 -2.826 -8.644 256 HE22 GLN 43 2HE2 GLN 43 -12.034 -2.656 -8.816 257 H LYS 44 H LYS 44 -7.243 1.035 -5.601 258 HA LYS 44 HA LYS 44 -8.089 3.676 -5.101 259 HB2 LYS 44 HB2 LYS 44 -7.741 1.685 -3.438 260 HB3 LYS 44 HB1 LYS 44 -6.010 1.953 -3.512 261 HG2 LYS 44 HG2 LYS 44 -6.579 3.090 -1.597 262 HG3 LYS 44 HG1 LYS 44 -6.024 4.243 -2.810 263 HD2 LYS 44 HD2 LYS 44 -8.423 4.911 -3.139 264 HD3 LYS 44 HD1 LYS 44 -8.920 3.607 -1.981 265 HE2 LYS 44 HE2 LYS 44 -7.633 4.509 -0.258 266 HE3 LYS 44 HE1 LYS 44 -6.995 5.839 -1.239 267 HZ1 LYS 44 HZ1 LYS 44 -8.842 6.539 0.078 268 HZ2 LYS 44 HZ2 LYS 44 -9.290 6.666 -1.470 269 HZ3 LYS 44 HZ3 LYS 44 -9.832 5.391 -0.611 270 H LEU 45 H LEU 45 -5.146 2.519 -6.294 271 HA LEU 45 HA LEU 45 -3.842 5.055 -5.983 272 HB2 LEU 45 HB2 LEU 45 -2.783 2.222 -6.318 273 HB3 LEU 45 HB1 LEU 45 -1.860 3.768 -5.856 274 HG LEU 45 HG LEU 45 -4.010 2.606 -4.160 275 HD11 LEU 45 1HD1 LEU 45 -2.205 1.030 -4.210 276 HD12 LEU 45 2HD1 LEU 45 -0.976 2.224 -4.155 277 HD13 LEU 45 3HD1 LEU 45 -1.919 1.932 -2.703 278 HD21 LEU 45 3HD2 LEU 45 -3.582 5.044 -3.800 279 HD22 LEU 45 1HD2 LEU 45 -3.113 4.043 -2.436 280 HD23 LEU 45 2HD2 LEU 45 -1.862 4.651 -3.576 281 H LYS 46 H LYS 46 -5.498 3.945 -8.474 282 HA LYS 46 HA LYS 46 -5.412 3.731 -10.554 283 HB2 LYS 46 HB2 LYS 46 -3.517 5.975 -10.427 284 HB3 LYS 46 HB1 LYS 46 -4.350 5.316 -11.901 285 HG2 LYS 46 HG2 LYS 46 -6.502 5.633 -10.872 286 HG3 LYS 46 HG1 LYS 46 -5.668 6.752 -9.646 287 HD2 LYS 46 HD2 LYS 46 -4.828 7.976 -11.622 288 HD3 LYS 46 HD1 LYS 46 -5.734 6.857 -12.663 289 HE2 LYS 46 HE2 LYS 46 -7.828 7.689 -11.403 290 HE3 LYS 46 HE1 LYS 46 -6.721 8.773 -10.571 291 HZ1 LYS 46 HZ1 LYS 46 -6.154 9.665 -12.836 292 HZ2 LYS 46 HZ2 LYS 46 -7.426 8.928 -13.524 293 HZ3 LYS 46 HZ3 LYS 46 -7.696 9.994 -12.352 294 H VAL 47 H VAL 47 -2.022 3.288 -9.443 295 HA VAL 47 HA VAL 47 -1.140 2.308 -11.634 296 HB VAL 47 HB VAL 47 0.887 1.978 -10.118 297 HG11 VAL 47 1HG1 VAL 47 -0.599 4.343 -10.489 298 HG12 VAL 47 2HG1 VAL 47 0.246 4.427 -8.967 299 HG13 VAL 47 3HG1 VAL 47 1.101 4.188 -10.505 300 HG21 VAL 47 3HG2 VAL 47 0.015 0.988 -8.033 301 HG22 VAL 47 1HG2 VAL 47 0.665 2.611 -7.748 302 HG23 VAL 47 2HG2 VAL 47 -1.024 2.422 -7.795 303 H SER 48 H SER 48 0.185 0.048 -11.763 304 HA SER 48 HA SER 48 -1.659 -2.046 -11.478 305 HB2 SER 48 HB2 SER 48 -0.032 -3.403 -12.417 306 HB3 SER 48 HB1 SER 48 -0.129 -1.781 -13.314 307 HG SER 48 HG SER 48 1.639 -1.108 -12.406 308 H GLU 49 H GLU 49 -0.923 -4.293 -10.519 309 HA GLU 49 HA GLU 49 -0.359 -4.169 -7.834 310 HB2 GLU 49 HB2 GLU 49 -0.645 -6.328 -7.772 311 HB3 GLU 49 HB1 GLU 49 -1.656 -5.736 -9.013 312 HG2 GLU 49 HG2 GLU 49 -0.156 -6.431 -10.788 313 HG3 GLU 49 HG1 GLU 49 0.982 -7.032 -9.615 314 H ASN 50 H ASN 50 1.985 -4.491 -10.473 315 HA ASN 50 HA ASN 50 4.315 -5.307 -9.062 316 HB2 ASN 50 HB2 ASN 50 4.351 -5.102 -11.458 317 HB3 ASN 50 HB1 ASN 50 3.748 -3.513 -11.441 318 HD21 ASN 50 1HD2 ASN 50 5.245 -1.820 -11.696 319 HD22 ASN 50 2HD2 ASN 50 6.969 -2.089 -11.282 320 H ILE 51 H ILE 51 2.752 -2.183 -8.854 321 HA ILE 51 HA ILE 51 4.882 -1.378 -6.936 322 HB ILE 51 HB ILE 51 2.179 -0.042 -7.384 323 HG12 ILE 51 2HG1 ILE 51 3.041 -0.033 -9.647 324 HG13 ILE 51 1HG1 ILE 51 3.320 1.552 -8.895 325 HG21 ILE 51 1HG2 ILE 51 2.968 0.693 -5.450 326 HG22 ILE 51 2HG2 ILE 51 4.672 0.845 -5.994 327 HG23 ILE 51 3HG2 ILE 51 3.385 1.888 -6.573 328 HD11 ILE 51 HD3 ILE 51 5.231 -0.703 -9.344 329 HD12 ILE 51 HD1 ILE 51 5.249 0.861 -10.142 330 HD13 ILE 51 HD2 ILE 51 5.720 0.829 -8.456 331 H VAL 52 H VAL 52 1.526 -2.713 -6.743 332 HA VAL 52 HA VAL 52 1.331 -1.877 -4.093 333 HB VAL 52 HB VAL 52 -0.592 -2.930 -3.874 334 HG11 VAL 52 1HG1 VAL 52 -1.930 -1.771 -5.878 335 HG12 VAL 52 2HG1 VAL 52 -0.533 -0.872 -5.222 336 HG13 VAL 52 3HG1 VAL 52 -0.358 -1.849 -6.665 337 HG21 VAL 52 3HG2 VAL 52 -1.473 -4.713 -4.427 338 HG22 VAL 52 1HG2 VAL 52 -1.555 -4.311 -6.079 339 HG23 VAL 52 2HG2 VAL 52 0.025 -4.987 -5.477 340 H LYS 53 H LYS 53 2.170 -5.337 -5.235 341 HA LYS 53 HA LYS 53 2.293 -6.498 -2.835 342 HB2 LYS 53 HB2 LYS 53 3.884 -6.634 -5.382 343 HB3 LYS 53 HB1 LYS 53 3.860 -7.947 -4.254 344 HG2 LYS 53 HG2 LYS 53 1.342 -8.174 -4.638 345 HG3 LYS 53 HG1 LYS 53 1.473 -7.061 -5.963 346 HD2 LYS 53 HD2 LYS 53 1.275 -9.348 -6.442 347 HD3 LYS 53 HD1 LYS 53 2.715 -8.625 -7.223 348 HE2 LYS 53 HE2 LYS 53 3.044 -10.034 -4.615 349 HE3 LYS 53 HE1 LYS 53 2.815 -11.020 -6.168 350 HZ1 LYS 53 HZ1 LYS 53 4.733 -9.919 -7.037 351 HZ2 LYS 53 HZ2 LYS 53 4.813 -8.938 -5.724 352 HZ3 LYS 53 HZ3 LYS 53 5.069 -10.600 -5.599 353 H ARG 54 H ARG 54 4.534 -4.009 -3.839 354 HA ARG 54 HA ARG 54 6.548 -4.679 -2.099 355 HB2 ARG 54 HB2 ARG 54 5.603 -1.982 -3.192 356 HB3 ARG 54 HB1 ARG 54 7.306 -2.245 -2.611 357 HG2 ARG 54 HG2 ARG 54 7.677 -3.939 -4.231 358 HG3 ARG 54 HG1 ARG 54 6.187 -3.451 -5.194 359 HD2 ARG 54 HD2 ARG 54 7.112 -1.069 -4.778 360 HD3 ARG 54 HD1 ARG 54 8.635 -1.724 -4.410 361 HE ARG 54 HE ARG 54 7.914 -3.003 -6.772 362 HH11 ARG 54 1HH2 ARG 54 8.072 0.463 -5.988 363 HH12 ARG 54 2HH2 ARG 54 8.073 0.877 -7.665 364 HH21 ARG 54 1HH1 ARG 54 7.466 -2.451 -8.712 365 HH22 ARG 54 2HH1 ARG 54 7.617 -0.862 -9.424 366 H PHE 55 H PHE 55 3.859 -2.296 -1.703 367 HA PHE 55 HA PHE 55 4.521 -1.321 0.915 368 HB2 PHE 55 HB2 PHE 55 1.813 -1.803 -0.328 369 HB3 PHE 55 HB1 PHE 55 2.270 -0.744 0.978 370 HD1 PHE 55 HD1 PHE 55 4.179 0.987 0.360 371 HD2 PHE 55 HD2 PHE 55 1.358 -0.824 -2.292 372 HE1 PHE 55 HE1 PHE 55 4.230 3.058 -1.087 373 HE2 PHE 55 HE2 PHE 55 1.317 1.324 -3.744 374 HZ PHE 55 HZ PHE 55 2.821 3.150 -3.068 375 H GLU 56 H GLU 56 2.794 -4.330 -0.377 376 HA GLU 56 HA GLU 56 1.503 -4.740 2.060 377 HB2 GLU 56 HB2 GLU 56 1.802 -6.502 -0.431 378 HB3 GLU 56 HB1 GLU 56 0.972 -7.070 0.965 379 HG2 GLU 56 HG2 GLU 56 -0.149 -4.583 0.694 380 HG3 GLU 56 HG1 GLU 56 0.331 -4.755 -0.903 381 H SER 57 H SER 57 4.552 -5.919 0.518 382 HA SER 57 HA SER 57 4.922 -7.839 2.612 383 HB2 SER 57 HB2 SER 57 6.539 -8.659 1.078 384 HB3 SER 57 HB1 SER 57 5.241 -8.214 0.028 385 HG SER 57 HG SER 57 6.659 -7.378 -1.030 386 H GLY 58 H GLY 58 6.533 -4.743 1.690 387 HA2 GLY 58 HA2 GLY 58 7.588 -3.429 2.937 388 HA3 GLY 58 HA1 GLY 58 7.693 -4.543 4.237 389 H LYS 59 H LYS 59 9.129 -5.710 1.297 390 HA LYS 59 HA LYS 59 11.416 -6.315 2.715 391 HB2 LYS 59 HB2 LYS 59 10.429 -6.994 -0.103 392 HB3 LYS 59 HB1 LYS 59 11.777 -7.836 0.595 393 HG2 LYS 59 HG2 LYS 59 8.926 -8.021 1.277 394 HG3 LYS 59 HG1 LYS 59 9.956 -9.189 0.831 395 HD2 LYS 59 HD2 LYS 59 10.331 -7.967 3.561 396 HD3 LYS 59 HD1 LYS 59 9.344 -9.373 3.202 397 HE2 LYS 59 HE2 LYS 59 11.089 -10.603 2.398 398 HE3 LYS 59 HE1 LYS 59 12.246 -9.318 2.579 399 HZ1 LYS 59 HZ1 LYS 59 10.734 -10.292 4.983 400 HZ2 LYS 59 HZ2 LYS 59 12.116 -10.966 4.658 401 HZ3 LYS 59 HZ3 LYS 59 12.164 -9.391 4.855 402 H LEU 60 H LEU 60 10.703 -3.808 0.928 403 HA LEU 60 HA LEU 60 13.518 -3.035 0.367 404 HB2 LEU 60 HB2 LEU 60 11.503 -3.530 -1.439 405 HB3 LEU 60 HB1 LEU 60 10.932 -1.983 -0.988 406 HG LEU 60 HG LEU 60 13.203 -0.980 -1.626 407 HD11 LEU 60 1HD1 LEU 60 13.310 -3.492 -3.331 408 HD12 LEU 60 2HD1 LEU 60 14.639 -2.273 -3.027 409 HD13 LEU 60 3HD1 LEU 60 14.113 -3.431 -1.740 410 HD21 LEU 60 3HD2 LEU 60 12.610 -0.743 -3.989 411 HD22 LEU 60 1HD2 LEU 60 11.732 -2.230 -3.965 412 HD23 LEU 60 2HD2 LEU 60 11.103 -0.876 -3.068 413 H LYS 61 H LYS 61 14.357 -1.097 0.483 414 HA LYS 61 HA LYS 61 12.800 0.801 2.189 415 HB2 LYS 61 HB2 LYS 61 15.038 -0.107 3.057 416 HB3 LYS 61 HB1 LYS 61 15.764 0.861 1.740 417 HG2 LYS 61 HG2 LYS 61 15.182 2.815 2.356 418 HG3 LYS 61 HG1 LYS 61 13.879 2.191 3.478 419 HD2 LYS 61 HD2 LYS 61 15.675 3.050 4.770 420 HD3 LYS 61 HD1 LYS 61 16.124 1.343 4.785 421 HE2 LYS 61 HE2 LYS 61 17.502 2.036 2.672 422 HE3 LYS 61 HE1 LYS 61 17.125 3.702 3.245 423 HZ1 LYS 61 HZ1 LYS 61 19.182 3.201 4.203 424 HZ2 LYS 61 HZ2 LYS 61 18.132 2.931 5.453 425 HZ3 LYS 61 HZ3 LYS 61 18.646 1.702 4.642 426 HA PRO 62 HA PRO 62 12.810 2.078 -2.159 427 HB2 PRO 62 HB1 PRO 62 10.385 3.115 -2.449 428 HB3 PRO 62 HB2 PRO 62 10.606 1.350 -2.222 429 HG2 PRO 62 HG1 PRO 62 10.277 3.520 -0.025 430 HG3 PRO 62 HG2 PRO 62 9.157 2.053 -0.264 431 HD2 PRO 62 HD1 PRO 62 10.983 1.913 1.458 432 HD3 PRO 62 HD2 PRO 62 10.880 0.616 0.330 433 H THR 63 H THR 63 12.199 4.660 -3.233 434 HA THR 63 HA THR 63 13.980 6.252 -1.721 435 HB THR 63 HB THR 63 13.756 7.763 -3.650 436 HG1 THR 63 HG1 THR 63 12.349 7.101 -5.376 437 HG21 THR 63 1HG2 THR 63 14.094 5.020 -4.725 438 HG22 THR 63 2HG2 THR 63 14.965 6.589 -5.135 439 HG23 THR 63 3HG2 THR 63 15.150 5.872 -3.456 440 H ILE 64 H ILE 64 13.418 8.518 -1.948 441 HA ILE 64 HA ILE 64 11.992 9.294 0.170 442 HB ILE 64 HB ILE 64 12.283 11.335 -1.980 443 HG12 ILE 64 2HG1 ILE 64 14.540 11.475 -0.507 444 HG13 ILE 64 1HG1 ILE 64 14.339 9.738 -0.326 445 HG21 ILE 64 1HG2 ILE 64 12.628 12.792 0.010 446 HG22 ILE 64 2HG2 ILE 64 11.073 12.082 0.015 447 HG23 ILE 64 3HG2 ILE 64 12.364 11.426 1.089 448 HD11 ILE 64 HD3 ILE 64 15.749 9.995 -2.102 449 HD12 ILE 64 HD1 ILE 64 14.267 9.785 -3.030 450 HD13 ILE 64 HD2 ILE 64 14.886 11.419 -2.689 451 H SER 65 H SER 65 10.732 10.294 -3.185 452 HA SER 65 HA SER 65 8.188 10.799 -2.423 453 HB2 SER 65 HB2 SER 65 7.590 10.043 -4.817 454 HB3 SER 65 HB1 SER 65 8.871 11.238 -4.711 455 HG SER 65 HG SER 65 10.218 9.634 -5.347 456 H GLN 66 H GLN 66 9.497 7.470 -2.551 457 HA GLN 66 HA GLN 66 6.849 6.341 -2.866 458 HB2 GLN 66 HB2 GLN 66 9.721 5.323 -2.646 459 HB3 GLN 66 HB1 GLN 66 8.090 4.327 -2.972 460 HG2 GLN 66 HG2 GLN 66 8.003 5.755 -5.066 461 HG3 GLN 66 HG1 GLN 66 9.655 6.331 -4.629 462 HE21 GLN 66 1HE2 GLN 66 11.484 4.883 -5.172 463 HE22 GLN 66 2HE2 GLN 66 11.051 3.202 -5.713 464 H ALA 67 H ALA 67 9.475 6.327 -0.331 465 HA ALA 67 HA ALA 67 7.991 5.309 1.721 466 HB1 ALA 67 HB1 ALA 67 9.753 6.505 3.124 467 HB2 ALA 67 HB2 ALA 67 10.375 5.565 1.884 468 HB3 ALA 67 HB3 ALA 67 10.229 7.365 1.592 469 H ARG 68 H ARG 68 8.103 8.785 0.358 470 HA ARG 68 HA ARG 68 6.220 9.536 2.468 471 HB2 ARG 68 HB2 ARG 68 7.339 10.515 -0.156 472 HB3 ARG 68 HB1 ARG 68 6.050 11.462 0.465 473 HG2 ARG 68 HG2 ARG 68 7.417 11.509 2.666 474 HG3 ARG 68 HG1 ARG 68 8.795 11.089 1.729 475 HD2 ARG 68 HD2 ARG 68 8.233 13.121 0.307 476 HD3 ARG 68 HD1 ARG 68 6.813 13.399 1.463 477 HE ARG 68 HE ARG 68 9.625 14.038 2.051 478 HH11 ARG 68 1HH2 ARG 68 6.360 13.982 3.377 479 HH12 ARG 68 2HH2 ARG 68 6.973 14.847 4.787 480 HH21 ARG 68 1HH1 ARG 68 10.285 14.986 3.655 481 HH22 ARG 68 2HH1 ARG 68 9.278 15.201 5.023 482 H GLN 69 H GLN 69 5.706 8.101 -0.818 483 HA GLN 69 HA GLN 69 2.866 8.647 -0.695 484 HB2 GLN 69 HB2 GLN 69 4.672 6.778 -2.137 485 HB3 GLN 69 HB1 GLN 69 3.024 6.496 -2.373 486 HG2 GLN 69 HG2 GLN 69 2.554 8.683 -3.349 487 HG3 GLN 69 HG1 GLN 69 4.180 9.206 -2.926 488 HE21 GLN 69 1HE2 GLN 69 5.910 8.616 -4.005 489 HE22 GLN 69 2HE2 GLN 69 5.906 7.853 -5.571 490 H LEU 70 H LEU 70 4.858 6.135 0.409 491 HA LEU 70 HA LEU 70 3.351 3.883 0.941 492 HB2 LEU 70 HB2 LEU 70 5.811 4.247 1.236 493 HB3 LEU 70 HB1 LEU 70 5.450 5.089 2.752 494 HG LEU 70 HG LEU 70 4.817 2.218 1.931 495 HD11 LEU 70 1HD1 LEU 70 6.814 1.567 3.461 496 HD12 LEU 70 2HD1 LEU 70 7.256 2.543 2.011 497 HD13 LEU 70 3HD1 LEU 70 7.140 3.210 3.626 498 HD21 LEU 70 3HD2 LEU 70 4.716 3.237 4.842 499 HD22 LEU 70 1HD2 LEU 70 3.423 2.557 3.986 500 HD23 LEU 70 2HD2 LEU 70 4.757 1.556 4.307 501 H GLU 71 H GLU 71 3.877 6.338 3.584 502 HA GLU 71 HA GLU 71 2.008 5.228 5.434 503 HB2 GLU 71 HB2 GLU 71 3.343 7.905 4.756 504 HB3 GLU 71 HB1 GLU 71 2.313 7.685 6.106 505 HG2 GLU 71 HG2 GLU 71 3.810 5.939 7.103 506 HG3 GLU 71 HG1 GLU 71 4.814 5.877 5.698 507 H LYS 72 H LYS 72 1.751 6.828 2.430 508 HA LYS 72 HA LYS 72 -0.817 8.165 3.066 509 HB2 LYS 72 HB2 LYS 72 1.290 8.755 0.946 510 HB3 LYS 72 HB1 LYS 72 -0.395 9.405 1.110 511 HG2 LYS 72 HG2 LYS 72 0.167 9.840 3.508 512 HG3 LYS 72 HG1 LYS 72 1.816 9.757 3.286 513 HD2 LYS 72 HD2 LYS 72 1.223 11.893 3.261 514 HD3 LYS 72 HD1 LYS 72 1.734 11.532 1.586 515 HE2 LYS 72 HE2 LYS 72 -0.724 11.465 1.045 516 HE3 LYS 72 HE1 LYS 72 -1.050 11.972 2.708 517 HZ1 LYS 72 HZ1 LYS 72 -0.058 13.978 2.505 518 HZ2 LYS 72 HZ2 LYS 72 0.764 13.637 1.127 519 HZ3 LYS 72 HZ3 LYS 72 -0.895 13.856 1.173 520 H ILE 73 H ILE 73 -0.210 5.192 1.468 521 HA ILE 73 HA ILE 73 -1.912 5.539 -0.631 522 HB ILE 73 HB ILE 73 -2.151 3.009 -0.494 523 HG12 ILE 73 2HG1 ILE 73 -0.224 3.233 1.802 524 HG13 ILE 73 1HG1 ILE 73 -1.895 2.831 2.046 525 HG21 ILE 73 1HG2 ILE 73 -0.334 4.181 -1.740 526 HG22 ILE 73 2HG2 ILE 73 0.790 3.955 -0.297 527 HG23 ILE 73 3HG2 ILE 73 0.083 2.627 -1.121 528 HD11 ILE 73 HD3 ILE 73 -0.912 0.651 1.888 529 HD12 ILE 73 HD1 ILE 73 -1.568 0.922 0.273 530 HD13 ILE 73 HD2 ILE 73 0.154 1.161 0.671 531 H LEU 74 H LEU 74 -3.375 4.036 2.452 532 HA LEU 74 HA LEU 74 -5.576 3.633 1.229 533 HB2 LEU 74 HB2 LEU 74 -5.080 3.955 4.158 534 HB3 LEU 74 HB1 LEU 74 -6.426 3.111 3.419 535 HG LEU 74 HG LEU 74 -3.539 2.183 3.431 536 HD11 LEU 74 1HD1 LEU 74 -4.750 1.858 5.454 537 HD12 LEU 74 2HD1 LEU 74 -5.999 1.025 4.563 538 HD13 LEU 74 3HD1 LEU 74 -4.485 0.228 4.636 539 HD21 LEU 74 3HD2 LEU 74 -4.384 1.623 1.260 540 HD22 LEU 74 1HD2 LEU 74 -4.299 0.200 2.084 541 HD23 LEU 74 2HD2 LEU 74 -5.910 0.844 1.909 542 H GLY 75 H GLY 75 -4.418 6.523 2.181 543 HA2 GLY 75 HA2 GLY 75 -5.581 8.805 2.697 544 HA3 GLY 75 HA1 GLY 75 -7.032 7.898 2.378 545 H ILE 76 H ILE 76 -5.859 5.805 4.492 546 HA ILE 76 HA ILE 76 -6.409 7.341 6.918 547 HB ILE 76 HB ILE 76 -7.723 5.404 7.666 548 HG12 ILE 76 2HG1 ILE 76 -7.621 4.464 4.706 549 HG13 ILE 76 1HG1 ILE 76 -6.770 3.801 6.152 550 HG21 ILE 76 1HG2 ILE 76 -9.849 6.094 6.538 551 HG22 ILE 76 2HG2 ILE 76 -8.750 7.415 7.029 552 HG23 ILE 76 3HG2 ILE 76 -8.884 6.889 5.337 553 HD11 ILE 76 HD3 ILE 76 -8.410 2.382 6.377 554 HD12 ILE 76 HD1 ILE 76 -9.105 3.766 7.211 555 HD13 ILE 76 HD2 ILE 76 -9.638 3.378 5.602 556 H LYS 77 H LYS 77 -5.977 5.252 8.893 557 HA LYS 77 HA LYS 77 -4.077 3.622 8.708 558 HB2 LYS 77 HB2 LYS 77 -2.117 4.594 9.433 559 HB3 LYS 77 HB1 LYS 77 -2.461 4.834 7.777 560 HG2 LYS 77 HG2 LYS 77 -3.369 7.209 8.375 561 HG3 LYS 77 HG1 LYS 77 -2.547 6.990 9.872 562 HD2 LYS 77 HD2 LYS 77 -0.477 7.279 8.900 563 HD3 LYS 77 HD1 LYS 77 -0.975 6.427 7.351 564 HE2 LYS 77 HE2 LYS 77 -2.354 8.593 6.984 565 HE3 LYS 77 HE1 LYS 77 -1.589 9.249 8.298 566 HZ1 LYS 77 HZ1 LYS 77 -0.288 8.411 5.813 567 HZ2 LYS 77 HZ2 LYS 77 -0.231 9.849 6.480 568 HZ3 LYS 77 HZ3 LYS 77 0.609 8.593 7.209 569 H LEU 78 H LEU 78 -3.554 2.892 10.592 570 HA LEU 78 HA LEU 78 -4.829 4.268 12.754 571 HB2 LEU 78 HB2 LEU 78 -5.387 1.200 12.451 572 HB3 LEU 78 HB1 LEU 78 -5.708 1.975 13.887 573 HG LEU 78 HG LEU 78 -6.939 2.844 11.298 574 HD11 LEU 78 1HD1 LEU 78 -8.926 1.774 12.071 575 HD12 LEU 78 2HD1 LEU 78 -7.720 0.520 11.979 576 HD13 LEU 78 3HD1 LEU 78 -8.240 1.231 13.527 577 HD21 LEU 78 3HD2 LEU 78 -7.469 3.642 14.134 578 HD22 LEU 78 1HD2 LEU 78 -7.000 4.744 12.720 579 HD23 LEU 78 2HD2 LEU 78 -8.577 4.002 12.840 580 H VAL 79 H VAL 79 -2.173 3.134 14.915 581 HA VAL 79 HA VAL 79 -5.069 3.561 15.303 582 HB VAL 79 HB VAL 79 -4.196 3.351 17.736 583 HG11 VAL 79 1HG1 VAL 79 -5.560 1.532 16.588 584 HG12 VAL 79 2HG1 VAL 79 -4.050 0.932 15.900 585 HG13 VAL 79 3HG1 VAL 79 -4.345 0.933 17.609 586 HG21 VAL 79 3HG2 VAL 79 -1.831 3.642 17.032 587 HG22 VAL 79 1HG2 VAL 79 -2.133 2.319 18.163 588 HG23 VAL 79 2HG2 VAL 79 -1.947 1.887 16.477 589 H THR 80 H THR 80 -5.820 5.255 16.494 590 HA THR 80 HA THR 80 -4.715 7.972 15.926 591 HB THR 80 HB THR 80 -6.992 8.529 16.591 592 HG1 THR 80 HG1 THR 80 -7.443 5.831 17.235 593 HG21 THR 80 1HG2 THR 80 -8.084 7.576 14.777 594 HG22 THR 80 2HG2 THR 80 -6.462 7.277 14.308 595 HG23 THR 80 3HG2 THR 80 -7.376 5.977 15.048 596 HA PRO 81 HA PRO 81 -3.459 9.127 19.983 597 HB2 PRO 81 HB1 PRO 81 -5.843 10.946 20.204 598 HB3 PRO 81 HB2 PRO 81 -4.085 11.345 20.472 599 HG2 PRO 81 HG1 PRO 81 -5.450 12.106 18.268 600 HG3 PRO 81 HG2 PRO 81 -3.701 11.566 18.337 601 HD2 PRO 81 HD1 PRO 81 -6.069 10.098 17.232 602 HD3 PRO 81 HD2 PRO 81 -4.353 9.911 16.732 603 H LEU 82 H LEU 82 -6.641 7.607 19.553 604 HA LEU 82 HA LEU 82 -7.311 7.234 22.301 605 HB2 LEU 82 HB2 LEU 82 -7.547 5.270 19.979 606 HB3 LEU 82 HB1 LEU 82 -8.023 5.124 21.532 607 HG LEU 82 HG LEU 82 -9.042 7.580 19.995 608 HD11 LEU 82 1HD1 LEU 82 -9.645 5.669 18.762 609 HD12 LEU 82 2HD1 LEU 82 -10.269 4.830 20.162 610 HD13 LEU 82 3HD1 LEU 82 -11.014 6.344 19.538 611 HD21 LEU 82 3HD2 LEU 82 -10.901 7.656 21.603 612 HD22 LEU 82 1HD2 LEU 82 -10.300 6.138 22.397 613 HD23 LEU 82 2HD2 LEU 82 -9.451 7.670 22.549 614 H GLU 83 H GLU 83 -4.651 5.933 20.308 615 HA GLU 83 HA GLU 83 -3.519 4.664 22.706 616 HB2 GLU 83 HB2 GLU 83 -3.250 3.766 19.768 617 HB3 GLU 83 HB1 GLU 83 -2.644 2.968 21.275 618 HG2 GLU 83 HG2 GLU 83 -5.175 2.794 21.882 619 HG3 GLU 83 HG1 GLU 83 -5.400 3.145 20.169 620 H ASN 84 H ASN 84 -3.057 6.217 19.719 621 HA ASN 84 HA ASN 84 -0.430 7.249 20.399 622 HB2 ASN 84 HB2 ASN 84 0.183 5.032 19.484 623 HB3 ASN 84 HB1 ASN 84 -0.979 5.188 18.232 624 HD21 ASN 84 1HD2 ASN 84 1.914 6.535 19.791 625 HD22 ASN 84 2HD2 ASN 84 2.656 7.048 18.231 626 H ASN 85 H ASN 85 0.102 9.040 19.695 627 HA ASN 85 HA ASN 85 -1.447 10.386 17.571 628 HB2 ASN 85 HB2 ASN 85 -1.642 11.344 19.825 629 HB3 ASN 85 HB1 ASN 85 0.121 11.660 19.725 630 HD21 ASN 85 1HD2 ASN 85 -0.469 14.109 19.998 631 HD22 ASN 85 2HD2 ASN 85 -0.963 14.786 18.455 632 H GLU 86 H GLU 86 -0.114 11.866 16.411 633 HA GLU 86 HA GLU 86 2.670 11.792 16.125 634 HB2 GLU 86 HB2 GLU 86 1.804 9.663 14.765 635 HB3 GLU 86 HB1 GLU 86 1.639 10.877 13.526 636 HG2 GLU 86 HG2 GLU 86 4.085 11.502 14.147 637 HG3 GLU 86 HG1 GLU 86 4.133 9.805 14.829 638 H GLU 87 H GLU 87 3.506 13.650 15.186 639 HA GLU 87 HA GLU 87 1.658 15.691 14.663 640 HB2 GLU 87 HB2 GLU 87 3.931 15.966 15.614 641 HB3 GLU 87 HB1 GLU 87 4.592 15.541 13.946 642 HG2 GLU 87 HG2 GLU 87 3.469 17.466 13.039 643 HG3 GLU 87 HG1 GLU 87 2.901 17.941 14.598 644 H SER 88 H SER 88 0.572 16.496 13.272 645 HA SER 88 HA SER 88 0.104 15.144 10.852 646 HB2 SER 88 HB2 SER 88 -0.606 17.976 11.753 647 HB3 SER 88 HB1 SER 88 -1.549 17.030 10.556 648 HG SER 88 HG SER 88 -2.432 16.977 12.674 649 H GLU 89 H GLU 89 2.612 17.403 11.421 650 HA GLU 89 HA GLU 89 2.236 18.907 9.018 651 HB2 GLU 89 HB2 GLU 89 3.703 19.197 11.190 652 HB3 GLU 89 HB1 GLU 89 4.948 18.544 10.280 653 HG2 GLU 89 HG2 GLU 89 4.508 20.195 8.488 654 HG3 GLU 89 HG1 GLU 89 3.315 21.079 9.490 655 H LYS 90 H LYS 90 3.425 15.675 9.506 656 HA LYS 90 HA LYS 90 5.300 15.301 7.379 657 HB2 LYS 90 HB2 LYS 90 5.009 13.890 9.269 658 HB3 LYS 90 HB1 LYS 90 3.396 13.445 8.896 659 HG2 LYS 90 HG2 LYS 90 4.217 12.181 6.882 660 HG3 LYS 90 HG1 LYS 90 5.840 12.881 7.093 661 HD2 LYS 90 HD2 LYS 90 4.373 10.891 8.881 662 HD3 LYS 90 HD1 LYS 90 5.650 10.593 7.703 663 HE2 LYS 90 HE2 LYS 90 7.248 11.761 8.931 664 HE3 LYS 90 HE1 LYS 90 6.026 12.389 10.106 665 HZ1 LYS 90 HZ1 LYS 90 5.534 10.427 10.846 666 HZ2 LYS 90 HZ2 LYS 90 6.420 9.456 9.773 667 HZ3 LYS 90 HZ3 LYS 90 7.182 10.442 10.872 668 H GLU 91 H GLU 91 1.924 16.039 7.239 669 HA GLU 91 HA GLU 91 1.501 14.369 4.905 670 HB2 GLU 91 HB2 GLU 91 -0.178 16.067 6.624 671 HB3 GLU 91 HB1 GLU 91 -0.811 15.534 5.092 672 HG2 GLU 91 HG2 GLU 91 0.283 13.649 7.092 673 HG3 GLU 91 HG1 GLU 91 -1.381 14.223 7.176 674 H PHE 92 H PHE 92 2.895 17.423 5.216 675 HA PHE 92 HA PHE 92 2.454 17.910 2.310 676 HB2 PHE 92 HB2 PHE 92 2.102 20.319 2.539 677 HB3 PHE 92 HB1 PHE 92 0.746 19.340 3.236 678 HD1 PHE 92 HD2 PHE 92 0.411 19.435 5.687 679 HD2 PHE 92 HD1 PHE 92 3.455 21.840 3.867 680 HE1 PHE 92 HE2 PHE 92 0.891 20.441 7.820 681 HE2 PHE 92 HE1 PHE 92 3.748 23.091 5.850 682 HZ PHE 92 HZ PHE 92 2.408 22.423 7.942 683 H ASP 93 H ASP 93 3.686 18.955 1.308 684 HA ASP 93 HA ASP 93 6.558 18.905 2.195 685 HB2 ASP 93 HB2 ASP 93 5.579 16.555 1.816 686 HB3 ASP 93 HB1 ASP 93 5.315 16.909 0.081 687 H ASP 94 H ASP 94 4.680 18.692 -0.917 688 HA ASP 94 HA ASP 94 6.521 20.498 -2.120 689 HB2 ASP 94 HB2 ASP 94 5.747 18.497 -3.143 690 HB3 ASP 94 HB1 ASP 94 4.152 19.080 -3.265 691 H THR 95 H THR 95 3.693 20.714 -0.517 692 HA THR 95 HA THR 95 3.046 23.494 -1.309 693 HB THR 95 HB THR 95 0.819 22.961 -0.544 694 HG1 THR 95 HG1 THR 95 0.436 21.428 0.644 695 HG21 THR 95 1HG2 THR 95 1.578 20.499 -2.286 696 HG22 THR 95 2HG2 THR 95 0.058 21.414 -2.223 697 HG23 THR 95 3HG2 THR 95 1.506 22.147 -2.901 698 H GLY 96 H GLY 96 1.715 24.486 0.438 699 HA2 GLY 96 HA2 GLY 96 2.688 24.165 3.172 700 HA3 GLY 96 HA1 GLY 96 2.458 25.806 2.369 701 H LEU 97 H LEU 97 0.873 23.887 4.520 702 HA LEU 97 HA LEU 97 -1.763 23.899 3.261 703 HB2 LEU 97 HB2 LEU 97 -0.781 21.824 3.834 704 HB3 LEU 97 HB1 LEU 97 -0.712 22.260 5.590 705 HG LEU 97 HG LEU 97 -3.327 22.506 5.314 706 HD11 LEU 97 1HD1 LEU 97 -2.778 20.714 2.914 707 HD12 LEU 97 2HD1 LEU 97 -4.281 21.219 3.644 708 HD13 LEU 97 3HD1 LEU 97 -3.169 22.407 2.793 709 HD21 LEU 97 3HD2 LEU 97 -2.274 20.836 6.731 710 HD22 LEU 97 1HD2 LEU 97 -3.427 20.089 5.558 711 HD23 LEU 97 2HD2 LEU 97 -1.777 19.879 5.306 712 H THR 98 H THR 98 0.032 25.276 5.879 713 HA THR 98 HA THR 98 -2.356 26.129 7.402 714 HB THR 98 HB THR 98 -1.094 25.538 9.302 715 HG1 THR 98 HG1 THR 98 0.789 25.150 9.345 716 HG21 THR 98 1HG2 THR 98 -2.359 23.741 7.945 717 HG22 THR 98 2HG2 THR 98 -0.779 23.057 7.486 718 HG23 THR 98 3HG2 THR 98 -1.374 23.239 9.224 719 H LEU 99 H LEU 99 0.305 27.503 5.953 720 HA LEU 99 HA LEU 99 0.214 29.985 7.374 721 HB2 LEU 99 HB2 LEU 99 1.586 28.712 8.825 722 HB3 LEU 99 HB1 LEU 99 2.859 28.444 7.653 723 HG LEU 99 HG LEU 99 3.148 30.889 7.404 724 HD11 LEU 99 1HD1 LEU 99 2.336 32.425 9.130 725 HD12 LEU 99 2HD1 LEU 99 1.126 31.858 8.026 726 HD13 LEU 99 3HD1 LEU 99 1.123 31.154 9.608 727 HD21 LEU 99 3HD2 LEU 99 3.603 30.165 10.365 728 HD22 LEU 99 1HD2 LEU 99 4.439 29.381 9.004 729 HD23 LEU 99 2HD2 LEU 99 4.637 31.033 9.237 730 H GLY 100 H GLY 100 0.089 31.333 5.905 731 HA2 GLY 100 HA2 GLY 100 0.979 31.332 3.258 732 HA3 GLY 100 HA1 GLY 100 0.444 32.615 4.148 733 H ASP 101 H ASP 101 2.636 32.198 6.271 734 HA ASP 101 HA ASP 101 4.436 34.035 5.179 735 HB2 ASP 101 HB2 ASP 101 3.548 33.858 7.778 736 HB3 ASP 101 HB1 ASP 101 4.939 32.884 7.892 737 H VAL 102 H VAL 102 4.689 32.146 3.713 738 HA VAL 102 HA VAL 102 7.314 30.849 4.060 739 HB VAL 102 HB VAL 102 6.510 29.370 2.310 740 HG11 VAL 102 1HG1 VAL 102 5.034 28.067 3.944 741 HG12 VAL 102 2HG1 VAL 102 6.694 28.478 4.366 742 HG13 VAL 102 3HG1 VAL 102 5.253 29.394 4.982 743 HG21 VAL 102 3HG2 VAL 102 4.375 31.059 1.822 744 HG22 VAL 102 1HG2 VAL 102 4.276 29.247 1.779 745 HG23 VAL 102 2HG2 VAL 102 3.730 30.217 3.176 746 H VAL 103 H VAL 103 8.594 32.100 0.761 747 HA VAL 103 HA VAL 103 8.509 29.515 1.822 748 HB VAL 103 HB VAL 103 10.817 29.270 1.284 749 HG11 VAL 103 1HG1 VAL 103 9.303 30.867 -0.757 750 HG12 VAL 103 2HG1 VAL 103 10.579 29.633 -1.113 751 HG13 VAL 103 3HG1 VAL 103 9.139 29.125 -0.435 752 HG21 VAL 103 3HG2 VAL 103 11.991 31.331 1.849 753 HG22 VAL 103 1HG2 VAL 103 12.182 31.088 0.160 754 HG23 VAL 103 2HG2 VAL 103 10.933 32.240 0.842 755 H ASN 104 H ASN 104 9.607 28.706 3.558 756 HA ASN 104 HA ASN 104 9.378 30.157 5.942 757 HB2 ASN 104 HB2 ASN 104 8.766 27.830 5.768 758 HB3 ASN 104 HB1 ASN 104 10.488 27.507 5.411 759 HD21 ASN 104 1HD2 ASN 104 9.068 26.235 7.615 760 HD22 ASN 104 2HD2 ASN 104 9.787 26.998 9.077 761 H ILE 105 H ILE 105 10.809 31.927 6.208 762 HA ILE 105 HA ILE 105 13.607 31.805 5.765 763 HB ILE 105 HB ILE 105 11.905 33.777 7.357 764 HG12 ILE 105 2HG1 ILE 105 12.904 33.937 4.548 765 HG13 ILE 105 1HG1 ILE 105 11.196 33.557 4.900 766 HG21 ILE 105 1HG2 ILE 105 14.366 33.778 7.747 767 HG22 ILE 105 2HG2 ILE 105 14.610 34.329 6.058 768 HG23 ILE 105 3HG2 ILE 105 13.746 35.158 7.395 769 HD11 ILE 105 HD3 ILE 105 10.713 35.737 5.790 770 HD12 ILE 105 HD1 ILE 105 12.492 36.078 5.850 771 HD13 ILE 105 HD2 ILE 105 11.481 35.996 4.311 772 H LYS 106 H LYS 106 14.522 30.204 6.828 773 HA LYS 106 HA LYS 106 14.223 29.774 9.638 774 HB2 LYS 106 HB2 LYS 106 16.642 29.033 8.016 775 HB3 LYS 106 HB1 LYS 106 16.117 28.189 9.449 776 HG2 LYS 106 HG2 LYS 106 14.867 28.019 6.668 777 HG3 LYS 106 HG1 LYS 106 15.641 26.782 7.593 778 HD2 LYS 106 HD2 LYS 106 14.239 26.818 9.377 779 HD3 LYS 106 HD1 LYS 106 13.099 27.968 8.840 780 HE2 LYS 106 HE2 LYS 106 12.104 26.699 7.315 781 HE3 LYS 106 HE1 LYS 106 13.649 25.814 6.912 782 HZ1 LYS 106 HZ1 LYS 106 11.848 25.334 9.332 783 HZ2 LYS 106 HZ2 LYS 106 12.060 24.477 8.010 784 HZ3 LYS 106 HZ3 LYS 106 13.285 24.672 9.127 785 H GLU 107 H GLU 107 15.924 32.238 7.945 786 HA GLU 107 HA GLU 107 17.978 32.811 9.773 787 HB2 GLU 107 HB2 GLU 107 17.628 33.365 7.327 788 HB3 GLU 107 HB1 GLU 107 16.644 34.707 8.002 789 HG2 GLU 107 HG2 GLU 107 18.718 35.751 8.937 790 HG3 GLU 107 HG1 GLU 107 19.512 34.081 8.782 791 H GLY 108 H GLY 108 14.637 33.286 10.096 792 HA2 GLY 108 HA2 GLY 108 14.453 33.781 12.590 793 HA3 GLY 108 HA1 GLY 108 14.792 35.456 12.046 794 H LYS 109 H LYS 109 12.423 34.729 13.343 795 HA LYS 109 HA LYS 109 10.226 34.664 11.455 796 HB2 LYS 109 HB2 LYS 109 10.429 35.129 14.428 797 HB3 LYS 109 HB1 LYS 109 8.877 35.207 13.603 798 HG2 LYS 109 HG2 LYS 109 9.369 33.038 12.519 799 HG3 LYS 109 HG1 LYS 109 10.834 32.891 13.565 800 HD2 LYS 109 HD2 LYS 109 9.155 32.991 15.549 801 HD3 LYS 109 HD1 LYS 109 7.902 33.100 14.311 802 HE2 LYS 109 HE2 LYS 109 8.613 30.838 13.354 803 HE3 LYS 109 HE1 LYS 109 9.787 30.739 14.653 804 HZ1 LYS 109 HZ1 LYS 109 7.908 30.774 16.198 805 HZ2 LYS 109 HZ2 LYS 109 6.839 31.039 15.009 806 HZ3 LYS 109 HZ3 LYS 109 7.629 29.609 15.123 807 H LYS 110 H LYS 110 8.624 36.443 11.573 808 HA LYS 110 HA LYS 110 9.565 38.807 10.623 809 HB2 LYS 110 HB2 LYS 110 6.978 37.999 11.877 810 HB3 LYS 110 HB1 LYS 110 7.081 39.601 11.339 811 HG2 LYS 110 HG2 LYS 110 7.701 38.890 9.059 812 HG3 LYS 110 HG1 LYS 110 7.574 37.207 9.449 813 HD2 LYS 110 HD2 LYS 110 5.368 39.383 9.561 814 HD3 LYS 110 HD1 LYS 110 5.646 38.220 8.231 815 HE2 LYS 110 HE2 LYS 110 5.099 36.366 10.125 816 HE3 LYS 110 HE1 LYS 110 4.801 37.775 11.051 817 HZ1 LYS 110 HZ1 LYS 110 3.031 38.386 9.556 818 HZ2 LYS 110 HZ2 LYS 110 3.355 37.073 8.650 819 HZ3 LYS 110 HZ3 LYS 110 2.823 36.769 10.098 820 H LEU 111 H LEU 111 10.984 39.924 11.895 821 HA LEU 111 HA LEU 111 10.249 41.852 13.835 822 HB2 LEU 111 HB2 LEU 111 11.490 41.006 15.822 823 HB3 LEU 111 HB1 LEU 111 10.021 40.313 15.588 824 HG LEU 111 HG LEU 111 11.114 38.296 14.595 825 HD11 LEU 111 1HD1 LEU 111 13.542 38.004 14.979 826 HD12 LEU 111 2HD1 LEU 111 13.378 39.405 13.976 827 HD13 LEU 111 3HD1 LEU 111 13.702 39.607 15.700 828 HD21 LEU 111 3HD2 LEU 111 10.296 38.328 16.719 829 HD22 LEU 111 1HD2 LEU 111 11.752 37.448 16.700 830 HD23 LEU 111 2HD2 LEU 111 11.927 39.074 17.379 831 H GLU 112 H GLU 112 12.596 42.501 15.072 832 HA GLU 112 HA GLU 112 14.832 42.290 13.288 833 HB2 GLU 112 HB2 GLU 112 13.418 43.728 11.989 834 HB3 GLU 112 HB1 GLU 112 13.471 44.964 13.245 835 HG2 GLU 112 HG2 GLU 112 15.864 45.187 12.858 836 HG3 GLU 112 HG1 GLU 112 15.884 43.690 11.841 837 H HIS 113 H HIS 113 14.769 45.438 14.825 838 HA HIS 113 HA HIS 113 16.815 44.548 16.599 839 HB2 HIS 113 HB2 HIS 113 16.669 46.836 15.323 840 HB3 HIS 113 HB1 HIS 113 15.479 47.244 16.556 841 HD2 HIS 113 HD2 HIS 113 17.773 49.103 16.662 842 HE1 HIS 113 HE1 HIS 113 19.774 46.533 19.437 843 HE2 HIS 113 HE2 HIS 113 19.679 48.900 18.457 844 H HIS 114 H HIS 114 14.366 43.318 16.962 845 HA HIS 114 HA HIS 114 12.978 44.328 19.299 846 HB2 HIS 114 HB2 HIS 114 12.667 41.703 17.903 847 HB3 HIS 114 HB1 HIS 114 11.557 42.278 19.074 848 HD2 HIS 114 HD2 HIS 114 9.566 42.240 17.289 849 HE1 HIS 114 HE1 HIS 114 10.999 45.278 14.680 850 HE2 HIS 114 HE2 HIS 114 8.970 43.659 15.232 Start of MODEL 15 1 H1 GLU 13 H1 GLU 13 -4.836 -15.847 15.695 2 H2 GLU 13 H2 GLU 13 -6.179 -16.312 16.435 3 H3 GLU 13 H3 GLU 13 -5.514 -14.816 16.775 4 HA GLU 13 HA GLU 13 -5.014 -16.226 18.551 5 HB2 GLU 13 HB2 GLU 13 -5.092 -18.403 17.089 6 HB3 GLU 13 HB1 GLU 13 -3.540 -17.798 16.484 7 HG2 GLU 13 HG2 GLU 13 -3.230 -19.600 18.266 8 HG3 GLU 13 HG1 GLU 13 -2.831 -18.032 19.045 9 H ASN 14 H ASN 14 -2.823 -15.443 15.804 10 HA ASN 14 HA ASN 14 -1.944 -13.353 17.419 11 HB2 ASN 14 HB2 ASN 14 -0.481 -15.600 18.018 12 HB3 ASN 14 HB1 ASN 14 -0.124 -15.408 16.351 13 HD21 ASN 14 1HD2 ASN 14 2.136 -15.326 17.940 14 HD22 ASN 14 2HD2 ASN 14 2.718 -13.635 18.051 15 H ALA 15 H ALA 15 -2.544 -11.888 16.133 16 HA ALA 15 HA ALA 15 -2.011 -11.587 13.414 17 HB1 ALA 15 HB1 ALA 15 -2.863 -9.242 13.902 18 HB2 ALA 15 HB2 ALA 15 -3.845 -10.393 14.702 19 HB3 ALA 15 HB3 ALA 15 -2.465 -9.586 15.570 20 H GLU 16 H GLU 16 0.535 -11.290 15.708 21 HA GLU 16 HA GLU 16 1.886 -9.661 13.713 22 HB2 GLU 16 HB2 GLU 16 2.259 -9.789 16.750 23 HB3 GLU 16 HB1 GLU 16 3.388 -9.023 15.578 24 HG2 GLU 16 HG2 GLU 16 1.456 -7.611 14.813 25 HG3 GLU 16 HG1 GLU 16 0.486 -8.339 16.143 26 H LEU 17 H LEU 17 1.513 -12.806 14.188 27 HA LEU 17 HA LEU 17 3.911 -14.074 14.771 28 HB2 LEU 17 HB2 LEU 17 1.711 -15.035 14.991 29 HB3 LEU 17 HB1 LEU 17 1.452 -15.096 13.332 30 HG LEU 17 HG LEU 17 3.681 -16.397 13.171 31 HD11 LEU 17 1HD1 LEU 17 4.317 -17.768 14.947 32 HD12 LEU 17 2HD1 LEU 17 4.748 -16.059 15.154 33 HD13 LEU 17 3HD1 LEU 17 3.442 -16.851 16.139 34 HD21 LEU 17 3HD2 LEU 17 1.379 -17.439 12.999 35 HD22 LEU 17 1HD2 LEU 17 2.585 -18.508 13.733 36 HD23 LEU 17 2HD2 LEU 17 1.343 -17.596 14.706 37 H GLU 18 H GLU 18 2.827 -12.729 11.767 38 HA GLU 18 HA GLU 18 5.013 -14.289 10.481 39 HB2 GLU 18 HB2 GLU 18 2.229 -13.265 9.495 40 HB3 GLU 18 HB1 GLU 18 3.312 -14.176 8.501 41 HG2 GLU 18 HG2 GLU 18 3.189 -16.071 10.084 42 HG3 GLU 18 HG1 GLU 18 1.721 -15.308 10.880 43 H ILE 19 H ILE 19 4.675 -11.293 11.289 44 HA ILE 19 HA ILE 19 5.922 -10.015 8.889 45 HB ILE 19 HB ILE 19 5.658 -7.959 10.249 46 HG12 ILE 19 2HG1 ILE 19 3.823 -9.614 11.944 47 HG13 ILE 19 1HG1 ILE 19 5.254 -8.684 12.413 48 HG21 ILE 19 1HG2 ILE 19 3.619 -7.631 9.358 49 HG22 ILE 19 2HG2 ILE 19 4.298 -8.875 8.335 50 HG23 ILE 19 3HG2 ILE 19 2.992 -9.236 9.618 51 HD11 ILE 19 HD3 ILE 19 3.393 -7.487 13.144 52 HD12 ILE 19 HD1 ILE 19 4.206 -6.570 11.849 53 HD13 ILE 19 HD2 ILE 19 2.637 -7.482 11.604 54 H VAL 20 H VAL 20 8.052 -8.848 9.259 55 HA VAL 20 HA VAL 20 9.521 -9.794 11.669 56 HB VAL 20 HB VAL 20 11.264 -8.407 10.772 57 HG11 VAL 20 1HG1 VAL 20 11.002 -10.645 9.938 58 HG12 VAL 20 2HG1 VAL 20 10.401 -10.099 8.450 59 HG13 VAL 20 3HG1 VAL 20 11.966 -9.509 8.933 60 HG21 VAL 20 3HG2 VAL 20 9.180 -7.482 8.725 61 HG22 VAL 20 1HG2 VAL 20 9.965 -6.405 9.814 62 HG23 VAL 20 2HG2 VAL 20 10.865 -7.202 8.523 63 H THR 21 H THR 21 10.368 -8.193 13.282 64 HA THR 21 HA THR 21 8.275 -6.570 14.130 65 HB THR 21 HB THR 21 11.150 -6.298 15.057 66 HG1 THR 21 HG1 THR 21 9.053 -7.945 15.760 67 HG21 THR 21 1HG2 THR 21 8.934 -4.819 15.773 68 HG22 THR 21 2HG2 THR 21 8.761 -6.274 16.830 69 HG23 THR 21 3HG2 THR 21 10.225 -5.233 16.909 70 H ASP 22 H ASP 22 11.056 -5.470 12.204 71 HA ASP 22 HA ASP 22 10.423 -2.814 12.754 72 HB2 ASP 22 HB2 ASP 22 12.790 -4.066 12.166 73 HB3 ASP 22 HB1 ASP 22 12.183 -4.000 10.537 74 H TYR 23 H TYR 23 8.345 -4.495 11.350 75 HA TYR 23 HA TYR 23 7.993 -3.698 8.639 76 HB2 TYR 23 HB2 TYR 23 7.414 -5.960 9.689 77 HB3 TYR 23 HB1 TYR 23 6.402 -5.160 10.780 78 HD1 TYR 23 HD1 TYR 23 6.712 -5.666 7.098 79 HD2 TYR 23 HD2 TYR 23 4.062 -4.594 10.295 80 HE1 TYR 23 HE1 TYR 23 4.773 -5.748 5.536 81 HE2 TYR 23 HE2 TYR 23 2.129 -4.683 8.813 82 HH TYR 23 HH TYR 23 2.492 -5.467 5.271 83 H TYR 24 H TYR 24 6.140 -2.526 7.976 84 HA TYR 24 HA TYR 24 5.697 -0.234 9.746 85 HB2 TYR 24 HB2 TYR 24 4.711 0.954 8.025 86 HB3 TYR 24 HB1 TYR 24 6.370 0.385 7.668 87 HD1 TYR 24 HD1 TYR 24 3.637 -1.969 6.859 88 HD2 TYR 24 HD2 TYR 24 6.573 0.935 5.582 89 HE1 TYR 24 HE1 TYR 24 3.367 -2.680 4.569 90 HE2 TYR 24 HE2 TYR 24 6.286 0.181 3.236 91 HH TYR 24 HH TYR 24 4.235 -2.583 2.382 92 H LYS 25 H LYS 25 4.705 -1.582 11.387 93 HA LYS 25 HA LYS 25 2.160 -2.513 11.276 94 HB2 LYS 25 HB2 LYS 25 3.678 -1.020 13.546 95 HB3 LYS 25 HB1 LYS 25 2.234 -1.895 13.749 96 HG2 LYS 25 HG2 LYS 25 3.792 -3.891 12.540 97 HG3 LYS 25 HG1 LYS 25 5.071 -2.727 12.781 98 HD2 LYS 25 HD2 LYS 25 4.988 -2.754 15.084 99 HD3 LYS 25 HD1 LYS 25 3.393 -3.654 15.066 100 HE2 LYS 25 HE2 LYS 25 4.776 -5.394 13.718 101 HE3 LYS 25 HE1 LYS 25 6.230 -4.608 14.412 102 HZ1 LYS 25 HZ1 LYS 25 5.600 -5.080 16.539 103 HZ2 LYS 25 HZ2 LYS 25 4.145 -5.721 15.991 104 HZ3 LYS 25 HZ3 LYS 25 5.607 -6.470 15.682 105 H ILE 26 H ILE 26 2.835 0.840 11.082 106 HA ILE 26 HA ILE 26 0.340 1.824 12.200 107 HB ILE 26 HB ILE 26 0.884 3.804 10.909 108 HG12 ILE 26 2HG1 ILE 26 3.391 2.555 9.780 109 HG13 ILE 26 1HG1 ILE 26 1.915 2.780 8.941 110 HG21 ILE 26 1HG2 ILE 26 3.129 2.825 12.700 111 HG22 ILE 26 2HG2 ILE 26 2.984 4.503 12.384 112 HG23 ILE 26 3HG2 ILE 26 1.640 3.595 13.039 113 HD11 ILE 26 HD3 ILE 26 2.086 5.280 9.227 114 HD12 ILE 26 HD1 ILE 26 3.430 5.053 10.352 115 HD13 ILE 26 HD2 ILE 26 3.417 4.517 8.548 116 H ILE 27 H ILE 27 1.393 0.577 8.949 117 HA ILE 27 HA ILE 27 -0.987 1.462 7.824 118 HB ILE 27 HB ILE 27 0.725 -0.873 6.677 119 HG12 ILE 27 2HG1 ILE 27 2.175 1.049 6.832 120 HG13 ILE 27 1HG1 ILE 27 1.607 0.843 5.071 121 HG21 ILE 27 1HG2 ILE 27 -1.427 0.831 5.525 122 HG22 ILE 27 2HG2 ILE 27 -0.409 -0.226 4.574 123 HG23 ILE 27 3HG2 ILE 27 -1.424 -0.926 5.801 124 HD11 ILE 27 HD3 ILE 27 0.248 2.806 5.418 125 HD12 ILE 27 HD1 ILE 27 0.572 2.918 7.060 126 HD13 ILE 27 HD2 ILE 27 1.970 3.128 6.051 127 H LYS 28 H LYS 28 -0.109 -1.443 9.387 128 HA LYS 28 HA LYS 28 -1.832 -3.138 8.276 129 HB2 LYS 28 HB2 LYS 28 0.285 -3.649 9.496 130 HB3 LYS 28 HB1 LYS 28 -0.541 -3.591 11.107 131 HG2 LYS 28 HG2 LYS 28 -1.970 -5.454 10.337 132 HG3 LYS 28 HG1 LYS 28 -0.992 -5.470 8.855 133 HD2 LYS 28 HD2 LYS 28 0.983 -6.044 10.176 134 HD3 LYS 28 HD1 LYS 28 0.136 -5.704 11.696 135 HE2 LYS 28 HE2 LYS 28 -0.355 -7.999 9.673 136 HE3 LYS 28 HE1 LYS 28 0.566 -8.074 11.124 137 HZ1 LYS 28 HZ1 LYS 28 -2.298 -7.823 11.038 138 HZ2 LYS 28 HZ2 LYS 28 -1.464 -8.912 11.726 139 HZ3 LYS 28 HZ3 LYS 28 -1.539 -7.402 12.382 140 H THR 29 H THR 29 -2.128 -1.649 11.441 141 HA THR 29 HA THR 29 -4.475 -3.226 12.108 142 HB THR 29 HB THR 29 -4.717 -1.722 14.087 143 HG1 THR 29 HG1 THR 29 -3.522 0.228 13.971 144 HG21 THR 29 1HG2 THR 29 -2.715 -1.990 15.151 145 HG22 THR 29 2HG2 THR 29 -2.773 -3.442 14.044 146 HG23 THR 29 3HG2 THR 29 -1.751 -2.082 13.657 147 H ALA 30 H ALA 30 -4.427 -0.066 10.494 148 HA ALA 30 HA ALA 30 -7.309 0.078 10.427 149 HB1 ALA 30 HB1 ALA 30 -6.703 1.820 8.769 150 HB2 ALA 30 HB2 ALA 30 -5.682 2.017 10.235 151 HB3 ALA 30 HB3 ALA 30 -5.006 1.221 8.845 152 H ARG 31 H ARG 31 -4.894 -1.098 7.997 153 HA ARG 31 HA ARG 31 -6.803 -1.577 6.036 154 HB2 ARG 31 HB2 ARG 31 -4.399 -1.248 5.800 155 HB3 ARG 31 HB1 ARG 31 -4.057 -2.879 6.439 156 HG2 ARG 31 HG2 ARG 31 -5.464 -3.734 4.627 157 HG3 ARG 31 HG1 ARG 31 -5.604 -2.170 3.901 158 HD2 ARG 31 HD2 ARG 31 -2.905 -2.230 3.994 159 HD3 ARG 31 HD1 ARG 31 -2.991 -3.823 4.247 160 HE ARG 31 HE ARG 31 -4.577 -3.649 1.986 161 HH11 ARG 31 1HH2 ARG 31 -1.075 -3.282 2.811 162 HH12 ARG 31 2HH2 ARG 31 -0.724 -3.105 1.085 163 HH21 ARG 31 1HH1 ARG 31 -3.834 -3.934 -0.082 164 HH22 ARG 31 2HH1 ARG 31 -2.163 -3.732 -0.511 165 H GLU 32 H GLU 32 -5.820 -3.930 8.699 166 HA GLU 32 HA GLU 32 -7.455 -6.028 7.665 167 HB2 GLU 32 HB2 GLU 32 -6.356 -5.550 10.503 168 HB3 GLU 32 HB1 GLU 32 -7.006 -7.035 9.863 169 HG2 GLU 32 HG2 GLU 32 -5.424 -6.921 7.922 170 HG3 GLU 32 HG1 GLU 32 -4.603 -5.552 8.823 171 H GLN 33 H GLN 33 -8.281 -3.255 9.860 172 HA GLN 33 HA GLN 33 -10.619 -4.469 10.774 173 HB2 GLN 33 HB2 GLN 33 -9.670 -2.232 11.552 174 HB3 GLN 33 HB1 GLN 33 -10.425 -1.494 10.122 175 HG2 GLN 33 HG2 GLN 33 -11.721 -1.170 12.051 176 HG3 GLN 33 HG1 GLN 33 -12.611 -2.043 10.913 177 HE21 GLN 33 1HE2 GLN 33 -10.224 -2.731 13.632 178 HE22 GLN 33 2HE2 GLN 33 -11.053 -4.169 14.151 179 H LEU 34 H LEU 34 -9.821 -2.673 7.932 180 HA LEU 34 HA LEU 34 -12.512 -2.163 7.044 181 HB2 LEU 34 HB2 LEU 34 -9.688 -1.864 5.844 182 HB3 LEU 34 HB1 LEU 34 -11.138 -1.195 5.038 183 HG LEU 34 HG LEU 34 -10.153 -0.337 7.796 184 HD11 LEU 34 1HD1 LEU 34 -8.648 0.471 6.122 185 HD12 LEU 34 2HD1 LEU 34 -9.864 1.106 5.129 186 HD13 LEU 34 3HD1 LEU 34 -9.811 1.690 6.828 187 HD21 LEU 34 3HD2 LEU 34 -12.431 0.143 8.087 188 HD22 LEU 34 1HD2 LEU 34 -11.980 1.537 7.160 189 HD23 LEU 34 2HD2 LEU 34 -12.706 0.157 6.417 190 H GLY 35 H GLY 35 -10.564 -4.955 6.501 191 HA2 GLY 35 HA2 GLY 35 -10.626 -6.653 5.036 192 HA3 GLY 35 HA1 GLY 35 -12.312 -6.056 4.797 193 H ILE 36 H ILE 36 -10.328 -3.650 3.769 194 HA ILE 36 HA ILE 36 -11.113 -3.896 1.088 195 HB ILE 36 HB ILE 36 -9.603 -2.059 0.768 196 HG12 ILE 36 2HG1 ILE 36 -8.837 -2.145 3.738 197 HG13 ILE 36 1HG1 ILE 36 -7.776 -2.501 2.339 198 HG21 ILE 36 1HG2 ILE 36 -11.513 -1.867 2.946 199 HG22 ILE 36 2HG2 ILE 36 -10.640 -0.457 2.050 200 HG23 ILE 36 3HG2 ILE 36 -11.757 -1.586 1.207 201 HD11 ILE 36 HD3 ILE 36 -8.826 0.233 3.140 202 HD12 ILE 36 HD1 ILE 36 -7.255 -0.378 2.747 203 HD13 ILE 36 HD2 ILE 36 -8.483 -0.236 1.445 204 H SER 37 H SER 37 -9.792 -4.093 -0.852 205 HA SER 37 HA SER 37 -7.549 -6.032 -0.309 206 HB2 SER 37 HB2 SER 37 -8.599 -7.163 -2.408 207 HB3 SER 37 HB1 SER 37 -9.516 -7.252 -0.951 208 HG SER 37 HG SER 37 -10.716 -6.601 -3.009 209 H GLN 38 H GLN 38 -6.134 -6.649 -1.930 210 HA GLN 38 HA GLN 38 -4.886 -4.629 -3.204 211 HB2 GLN 38 HB2 GLN 38 -4.760 -7.533 -3.227 212 HB3 GLN 38 HB1 GLN 38 -4.022 -6.743 -4.674 213 HG2 GLN 38 HG2 GLN 38 -2.619 -5.383 -3.218 214 HG3 GLN 38 HG1 GLN 38 -3.383 -6.031 -1.806 215 HE21 GLN 38 1HE2 GLN 38 -0.562 -6.060 -2.373 216 HE22 GLN 38 2HE2 GLN 38 -0.090 -7.820 -2.316 217 H GLN 39 H GLN 39 -7.391 -6.531 -4.662 218 HA GLN 39 HA GLN 39 -7.184 -5.477 -7.341 219 HB2 GLN 39 HB2 GLN 39 -8.595 -7.480 -6.506 220 HB3 GLN 39 HB1 GLN 39 -9.703 -6.283 -6.021 221 HG2 GLN 39 HG2 GLN 39 -9.736 -5.225 -8.341 222 HG3 GLN 39 HG1 GLN 39 -8.538 -6.316 -8.774 223 HE21 GLN 39 1HE2 GLN 39 -12.160 -6.123 -8.029 224 HE22 GLN 39 2HE2 GLN 39 -12.499 -7.756 -8.499 225 H GLN 40 H GLN 40 -8.471 -3.964 -4.335 226 HA GLN 40 HA GLN 40 -9.765 -1.837 -5.815 227 HB2 GLN 40 HB2 GLN 40 -9.152 -2.152 -2.782 228 HB3 GLN 40 HB1 GLN 40 -9.841 -0.770 -3.585 229 HG2 GLN 40 HG2 GLN 40 -11.813 -2.162 -4.451 230 HG3 GLN 40 HG1 GLN 40 -11.004 -3.543 -3.754 231 HE21 GLN 40 1HE2 GLN 40 -12.304 -0.222 -2.521 232 HE22 GLN 40 2HE2 GLN 40 -12.583 -1.123 -1.031 233 H LEU 41 H LEU 41 -6.603 -2.315 -4.111 234 HA LEU 41 HA LEU 41 -5.962 0.410 -4.117 235 HB2 LEU 41 HB2 LEU 41 -5.175 -0.990 -2.454 236 HB3 LEU 41 HB1 LEU 41 -4.605 -2.231 -3.602 237 HG LEU 41 HG LEU 41 -2.909 -0.623 -4.267 238 HD11 LEU 41 1HD1 LEU 41 -3.921 1.502 -3.426 239 HD12 LEU 41 2HD1 LEU 41 -3.718 0.986 -1.796 240 HD13 LEU 41 3HD1 LEU 41 -2.231 1.254 -2.786 241 HD21 LEU 41 3HD2 LEU 41 -2.108 -2.249 -2.670 242 HD22 LEU 41 1HD2 LEU 41 -1.591 -0.819 -1.865 243 HD23 LEU 41 2HD2 LEU 41 -3.111 -1.483 -1.367 244 H ALA 42 H ALA 42 -5.402 -2.402 -6.468 245 HA ALA 42 HA ALA 42 -3.645 -1.062 -8.123 246 HB1 ALA 42 HB1 ALA 42 -5.905 -3.037 -8.717 247 HB2 ALA 42 HB2 ALA 42 -4.446 -2.757 -9.713 248 HB3 ALA 42 HB3 ALA 42 -4.360 -3.490 -8.058 249 H GLN 43 H GLN 43 -7.296 -0.862 -8.062 250 HA GLN 43 HA GLN 43 -7.336 0.795 -10.342 251 HB2 GLN 43 HB2 GLN 43 -9.392 0.451 -8.133 252 HB3 GLN 43 HB1 GLN 43 -9.704 1.220 -9.716 253 HG2 GLN 43 HG2 GLN 43 -9.497 -0.849 -10.928 254 HG3 GLN 43 HG1 GLN 43 -8.825 -1.591 -9.513 255 HE21 GLN 43 1HE2 GLN 43 -10.092 -2.815 -8.234 256 HE22 GLN 43 2HE2 GLN 43 -11.819 -2.588 -8.036 257 H LYS 44 H LYS 44 -6.992 1.635 -6.816 258 HA LYS 44 HA LYS 44 -7.570 4.328 -7.241 259 HB2 LYS 44 HB2 LYS 44 -6.451 2.575 -4.985 260 HB3 LYS 44 HB1 LYS 44 -6.668 4.377 -4.991 261 HG2 LYS 44 HG2 LYS 44 -9.016 4.109 -5.659 262 HG3 LYS 44 HG1 LYS 44 -8.940 2.454 -5.981 263 HD2 LYS 44 HD2 LYS 44 -9.761 2.381 -3.726 264 HD3 LYS 44 HD1 LYS 44 -8.172 2.079 -3.534 265 HE2 LYS 44 HE2 LYS 44 -7.796 4.776 -3.179 266 HE3 LYS 44 HE1 LYS 44 -9.529 4.779 -3.111 267 HZ1 LYS 44 HZ1 LYS 44 -7.937 3.340 -1.186 268 HZ2 LYS 44 HZ2 LYS 44 -8.827 4.591 -0.974 269 HZ3 LYS 44 HZ3 LYS 44 -9.545 3.133 -1.341 270 H LEU 45 H LEU 45 -4.822 2.277 -7.975 271 HA LEU 45 HA LEU 45 -3.166 4.603 -7.895 272 HB2 LEU 45 HB2 LEU 45 -2.575 2.509 -6.687 273 HB3 LEU 45 HB1 LEU 45 -2.583 1.513 -8.084 274 HG LEU 45 HG LEU 45 -0.594 2.615 -8.930 275 HD11 LEU 45 1HD1 LEU 45 -0.832 4.163 -6.344 276 HD12 LEU 45 2HD1 LEU 45 0.696 4.170 -7.338 277 HD13 LEU 45 3HD1 LEU 45 -0.873 4.826 -7.997 278 HD21 LEU 45 3HD2 LEU 45 0.876 1.627 -7.317 279 HD22 LEU 45 1HD2 LEU 45 -0.287 1.781 -5.997 280 HD23 LEU 45 2HD2 LEU 45 -0.453 0.611 -7.379 281 H LYS 46 H LYS 46 -5.273 3.492 -9.946 282 HA LYS 46 HA LYS 46 -5.699 3.078 -11.976 283 HB2 LYS 46 HB2 LYS 46 -5.235 5.517 -11.664 284 HB3 LYS 46 HB1 LYS 46 -3.785 5.317 -12.720 285 HG2 LYS 46 HG2 LYS 46 -5.059 4.294 -14.444 286 HG3 LYS 46 HG1 LYS 46 -6.553 4.486 -13.472 287 HD2 LYS 46 HD2 LYS 46 -6.188 7.053 -13.638 288 HD3 LYS 46 HD1 LYS 46 -4.835 6.801 -14.545 289 HE2 LYS 46 HE2 LYS 46 -6.598 7.346 -15.995 290 HE3 LYS 46 HE1 LYS 46 -6.108 5.591 -16.251 291 HZ1 LYS 46 HZ1 LYS 46 -8.491 6.238 -16.237 292 HZ2 LYS 46 HZ2 LYS 46 -7.925 4.757 -15.516 293 HZ3 LYS 46 HZ3 LYS 46 -8.373 6.019 -14.618 294 H VAL 47 H VAL 47 -3.951 1.072 -11.285 295 HA VAL 47 HA VAL 47 -2.526 0.671 -13.640 296 HB VAL 47 HB VAL 47 -0.725 -0.559 -12.265 297 HG11 VAL 47 1HG1 VAL 47 0.546 1.359 -12.283 298 HG12 VAL 47 2HG1 VAL 47 -0.803 2.015 -13.243 299 HG13 VAL 47 3HG1 VAL 47 -0.716 2.253 -11.481 300 HG21 VAL 47 3HG2 VAL 47 -0.488 0.165 -9.917 301 HG22 VAL 47 1HG2 VAL 47 -2.163 0.709 -9.974 302 HG23 VAL 47 2HG2 VAL 47 -1.804 -0.973 -10.232 303 H SER 48 H SER 48 -1.469 -2.019 -13.045 304 HA SER 48 HA SER 48 -3.853 -3.676 -12.710 305 HB2 SER 48 HB2 SER 48 -2.524 -5.311 -14.039 306 HB3 SER 48 HB1 SER 48 -2.638 -3.779 -14.830 307 HG SER 48 HG SER 48 -0.610 -3.330 -14.295 308 H GLU 49 H GLU 49 -3.316 -5.721 -11.337 309 HA GLU 49 HA GLU 49 -2.292 -4.964 -8.779 310 HB2 GLU 49 HB2 GLU 49 -2.975 -7.651 -9.924 311 HB3 GLU 49 HB1 GLU 49 -2.707 -7.298 -8.263 312 HG2 GLU 49 HG2 GLU 49 -4.678 -6.127 -7.815 313 HG3 GLU 49 HG1 GLU 49 -4.814 -5.535 -9.426 314 H ASN 50 H ASN 50 -0.902 -6.369 -11.697 315 HA ASN 50 HA ASN 50 1.338 -7.744 -10.589 316 HB2 ASN 50 HB2 ASN 50 0.747 -8.043 -12.713 317 HB3 ASN 50 HB1 ASN 50 1.109 -6.319 -13.214 318 HD21 ASN 50 1HD2 ASN 50 2.477 -9.583 -12.393 319 HD22 ASN 50 2HD2 ASN 50 4.098 -9.239 -12.748 320 H ILE 51 H ILE 51 0.792 -4.338 -11.265 321 HA ILE 51 HA ILE 51 3.448 -3.514 -10.748 322 HB ILE 51 HB ILE 51 0.736 -1.960 -10.822 323 HG12 ILE 51 2HG1 ILE 51 1.204 -2.769 -12.960 324 HG13 ILE 51 1HG1 ILE 51 1.522 -1.011 -12.746 325 HG21 ILE 51 1HG2 ILE 51 2.416 0.089 -11.107 326 HG22 ILE 51 2HG2 ILE 51 2.027 -0.425 -9.475 327 HG23 ILE 51 3HG2 ILE 51 3.479 -0.979 -10.191 328 HD11 ILE 51 HD3 ILE 51 3.255 -2.073 -14.159 329 HD12 ILE 51 HD1 ILE 51 3.988 -1.482 -12.690 330 HD13 ILE 51 HD2 ILE 51 3.705 -3.170 -12.932 331 H VAL 52 H VAL 52 0.668 -3.949 -8.510 332 HA VAL 52 HA VAL 52 1.751 -2.459 -6.628 333 HB VAL 52 HB VAL 52 0.114 -3.241 -4.973 334 HG11 VAL 52 1HG1 VAL 52 -1.862 -2.650 -6.403 335 HG12 VAL 52 2HG1 VAL 52 -0.580 -1.736 -6.972 336 HG13 VAL 52 3HG1 VAL 52 -1.057 -3.274 -7.815 337 HG21 VAL 52 3HG2 VAL 52 -1.549 -5.122 -6.157 338 HG22 VAL 52 1HG2 VAL 52 0.099 -5.732 -6.437 339 HG23 VAL 52 2HG2 VAL 52 -0.494 -5.390 -4.812 340 H LYS 53 H LYS 53 2.336 -5.826 -7.073 341 HA LYS 53 HA LYS 53 3.195 -6.989 -4.970 342 HB2 LYS 53 HB2 LYS 53 4.521 -6.919 -7.658 343 HB3 LYS 53 HB1 LYS 53 5.030 -7.954 -6.331 344 HG2 LYS 53 HG2 LYS 53 2.350 -8.482 -6.359 345 HG3 LYS 53 HG1 LYS 53 2.417 -7.671 -7.904 346 HD2 LYS 53 HD2 LYS 53 3.879 -10.137 -7.179 347 HD3 LYS 53 HD1 LYS 53 2.376 -10.143 -8.126 348 HE2 LYS 53 HE2 LYS 53 3.745 -8.862 -9.936 349 HE3 LYS 53 HE1 LYS 53 5.082 -8.928 -8.925 350 HZ1 LYS 53 HZ1 LYS 53 5.007 -11.435 -9.104 351 HZ2 LYS 53 HZ2 LYS 53 3.756 -11.336 -10.133 352 HZ3 LYS 53 HZ3 LYS 53 4.992 -10.675 -10.604 353 H ARG 54 H ARG 54 5.158 -4.580 -6.637 354 HA ARG 54 HA ARG 54 7.662 -4.644 -5.744 355 HB2 ARG 54 HB2 ARG 54 5.895 -2.250 -6.286 356 HB3 ARG 54 HB1 ARG 54 7.563 -2.178 -6.065 357 HG2 ARG 54 HG2 ARG 54 8.106 -3.389 -8.057 358 HG3 ARG 54 HG1 ARG 54 6.455 -3.866 -8.411 359 HD2 ARG 54 HD2 ARG 54 5.975 -1.414 -8.437 360 HD3 ARG 54 HD1 ARG 54 7.719 -1.076 -8.255 361 HE ARG 54 HE ARG 54 6.901 -2.829 -10.523 362 HH11 ARG 54 1HH2 ARG 54 6.839 0.702 -9.609 363 HH12 ARG 54 2HH2 ARG 54 6.355 1.058 -11.209 364 HH21 ARG 54 1HH1 ARG 54 6.674 -2.099 -12.582 365 HH22 ARG 54 2HH1 ARG 54 6.378 -0.377 -12.858 366 H PHE 55 H PHE 55 5.654 -2.286 -3.965 367 HA PHE 55 HA PHE 55 7.430 -2.423 -1.661 368 HB2 PHE 55 HB2 PHE 55 6.055 -0.926 -0.653 369 HB3 PHE 55 HB1 PHE 55 6.304 -0.306 -2.233 370 HD1 PHE 55 HD2 PHE 55 4.591 -0.911 -4.020 371 HD2 PHE 55 HD1 PHE 55 3.891 -0.874 0.184 372 HE1 PHE 55 HE2 PHE 55 2.118 -0.716 -4.576 373 HE2 PHE 55 HE1 PHE 55 1.517 -0.506 -0.296 374 HZ PHE 55 HZ PHE 55 0.585 -0.371 -2.554 375 H GLU 56 H GLU 56 4.025 -3.648 -2.477 376 HA GLU 56 HA GLU 56 3.197 -4.285 -0.143 377 HB2 GLU 56 HB2 GLU 56 2.577 -5.917 -2.685 378 HB3 GLU 56 HB1 GLU 56 1.736 -5.954 -1.193 379 HG2 GLU 56 HG2 GLU 56 2.149 -3.238 -2.122 380 HG3 GLU 56 HG1 GLU 56 0.958 -4.405 -2.999 381 H SER 57 H SER 57 5.891 -5.892 -1.606 382 HA SER 57 HA SER 57 5.760 -8.452 -0.331 383 HB2 SER 57 HB2 SER 57 8.202 -8.273 -0.781 384 HB3 SER 57 HB1 SER 57 7.218 -7.838 -2.179 385 HG SER 57 HG SER 57 7.904 -5.882 -2.048 386 H GLY 58 H GLY 58 6.546 -5.362 0.876 387 HA2 GLY 58 HA2 GLY 58 6.786 -4.512 3.090 388 HA3 GLY 58 HA1 GLY 58 6.373 -6.183 3.548 389 H LYS 59 H LYS 59 8.879 -5.950 1.388 390 HA LYS 59 HA LYS 59 10.898 -6.626 3.299 391 HB2 LYS 59 HB2 LYS 59 10.700 -6.486 0.215 392 HB3 LYS 59 HB1 LYS 59 12.156 -6.978 0.943 393 HG2 LYS 59 HG2 LYS 59 9.389 -8.282 1.234 394 HG3 LYS 59 HG1 LYS 59 10.630 -8.931 0.128 395 HD2 LYS 59 HD2 LYS 59 10.824 -8.773 3.249 396 HD3 LYS 59 HD1 LYS 59 10.420 -10.116 2.280 397 HE2 LYS 59 HE2 LYS 59 12.544 -10.323 1.399 398 HE3 LYS 59 HE1 LYS 59 12.940 -8.655 1.950 399 HZ1 LYS 59 HZ1 LYS 59 12.556 -9.630 4.237 400 HZ2 LYS 59 HZ2 LYS 59 12.271 -11.078 3.633 401 HZ3 LYS 59 HZ3 LYS 59 13.780 -10.400 3.473 402 H LEU 60 H LEU 60 10.039 -3.801 2.448 403 HA LEU 60 HA LEU 60 12.601 -2.774 3.217 404 HB2 LEU 60 HB2 LEU 60 10.973 -2.018 0.664 405 HB3 LEU 60 HB1 LEU 60 11.765 -0.739 1.406 406 HG LEU 60 HG LEU 60 12.941 -3.251 0.182 407 HD11 LEU 60 1HD1 LEU 60 12.033 -1.376 -1.257 408 HD12 LEU 60 2HD1 LEU 60 13.230 -0.321 -0.575 409 HD13 LEU 60 3HD1 LEU 60 13.734 -1.731 -1.501 410 HD21 LEU 60 3HD2 LEU 60 14.509 -1.134 1.668 411 HD22 LEU 60 1HD2 LEU 60 14.433 -2.903 1.952 412 HD23 LEU 60 2HD2 LEU 60 15.151 -2.275 0.421 413 H LYS 61 H LYS 61 12.402 -1.646 5.171 414 HA LYS 61 HA LYS 61 10.413 -0.048 5.997 415 HB2 LYS 61 HB2 LYS 61 12.496 -0.981 7.029 416 HB3 LYS 61 HB1 LYS 61 13.334 0.408 6.332 417 HG2 LYS 61 HG2 LYS 61 11.705 1.901 7.501 418 HG3 LYS 61 HG1 LYS 61 10.923 0.363 8.186 419 HD2 LYS 61 HD2 LYS 61 13.089 -0.055 9.329 420 HD3 LYS 61 HD1 LYS 61 13.778 1.281 8.560 421 HE2 LYS 61 HE2 LYS 61 13.459 2.291 10.419 422 HE3 LYS 61 HE1 LYS 61 11.978 2.750 9.675 423 HZ1 LYS 61 HZ1 LYS 61 12.248 0.403 11.450 424 HZ2 LYS 61 HZ2 LYS 61 11.504 1.775 11.937 425 HZ3 LYS 61 HZ3 LYS 61 10.808 0.912 10.816 426 HA PRO 62 HA PRO 62 10.855 3.174 2.747 427 HB2 PRO 62 HB1 PRO 62 8.696 4.751 3.254 428 HB3 PRO 62 HB2 PRO 62 8.550 3.097 2.677 429 HG2 PRO 62 HG1 PRO 62 8.576 3.895 5.686 430 HG3 PRO 62 HG2 PRO 62 7.272 3.140 4.836 431 HD2 PRO 62 HD1 PRO 62 9.348 1.893 6.102 432 HD3 PRO 62 HD2 PRO 62 8.710 1.024 4.727 433 H THR 63 H THR 63 11.458 5.310 2.509 434 HA THR 63 HA THR 63 12.492 6.795 4.836 435 HB THR 63 HB THR 63 13.741 8.086 3.151 436 HG1 THR 63 HG1 THR 63 13.765 7.448 1.072 437 HG21 THR 63 1HG2 THR 63 15.020 6.409 4.101 438 HG22 THR 63 2HG2 THR 63 14.192 5.114 3.664 439 HG23 THR 63 3HG2 THR 63 15.194 5.913 2.463 440 H ILE 64 H ILE 64 12.630 9.427 3.706 441 HA ILE 64 HA ILE 64 10.274 10.406 4.601 442 HB ILE 64 HB ILE 64 12.576 11.582 3.051 443 HG12 ILE 64 2HG1 ILE 64 11.733 11.610 5.958 444 HG13 ILE 64 1HG1 ILE 64 13.020 10.732 5.262 445 HG21 ILE 64 1HG2 ILE 64 12.011 13.736 3.426 446 HG22 ILE 64 2HG2 ILE 64 10.580 13.004 2.743 447 HG23 ILE 64 3HG2 ILE 64 10.704 13.441 4.541 448 HD11 ILE 64 HD3 ILE 64 13.661 12.514 6.751 449 HD12 ILE 64 HD1 ILE 64 14.260 12.723 5.029 450 HD13 ILE 64 HD2 ILE 64 12.975 13.731 5.789 451 H SER 65 H SER 65 11.355 10.660 1.163 452 HA SER 65 HA SER 65 8.764 11.217 0.096 453 HB2 SER 65 HB2 SER 65 9.932 10.768 -2.009 454 HB3 SER 65 HB1 SER 65 11.143 11.505 -0.920 455 HG SER 65 HG SER 65 12.154 9.794 -1.197 456 H GLN 66 H GLN 66 10.255 8.046 0.662 457 HA GLN 66 HA GLN 66 8.289 6.701 -0.733 458 HB2 GLN 66 HB2 GLN 66 10.049 5.816 1.546 459 HB3 GLN 66 HB1 GLN 66 9.068 4.682 0.655 460 HG2 GLN 66 HG2 GLN 66 10.245 5.149 -1.469 461 HG3 GLN 66 HG1 GLN 66 11.240 6.327 -0.597 462 HE21 GLN 66 1HE2 GLN 66 13.004 5.296 0.528 463 HE22 GLN 66 2HE2 GLN 66 13.320 3.616 0.703 464 H ALA 67 H ALA 67 8.297 7.166 2.815 465 HA ALA 67 HA ALA 67 5.742 6.218 3.456 466 HB1 ALA 67 HB1 ALA 67 7.498 7.142 5.133 467 HB2 ALA 67 HB2 ALA 67 7.373 8.675 4.254 468 HB3 ALA 67 HB3 ALA 67 5.967 8.024 5.167 469 H ARG 68 H ARG 68 6.572 9.532 2.051 470 HA ARG 68 HA ARG 68 4.087 10.601 2.215 471 HB2 ARG 68 HB2 ARG 68 6.444 11.710 1.571 472 HB3 ARG 68 HB1 ARG 68 5.703 11.510 0.054 473 HG2 ARG 68 HG2 ARG 68 3.617 12.646 0.977 474 HG3 ARG 68 HG1 ARG 68 4.671 13.125 2.375 475 HD2 ARG 68 HD2 ARG 68 6.258 14.174 1.084 476 HD3 ARG 68 HD1 ARG 68 5.553 13.733 -0.499 477 HE ARG 68 HE ARG 68 3.724 15.165 -0.117 478 HH11 ARG 68 1HH2 ARG 68 6.167 15.437 2.508 479 HH12 ARG 68 2HH2 ARG 68 5.289 16.759 3.265 480 HH21 ARG 68 1HH1 ARG 68 2.588 16.678 1.258 481 HH22 ARG 68 2HH1 ARG 68 3.443 17.609 2.430 482 H GLN 69 H GLN 69 5.580 8.549 -0.491 483 HA GLN 69 HA GLN 69 3.321 8.737 -2.300 484 HB2 GLN 69 HB2 GLN 69 5.574 6.747 -1.918 485 HB3 GLN 69 HB1 GLN 69 4.568 6.811 -3.297 486 HG2 GLN 69 HG2 GLN 69 5.106 8.774 -4.149 487 HG3 GLN 69 HG1 GLN 69 5.828 9.433 -2.703 488 HE21 GLN 69 1HE2 GLN 69 8.057 8.880 -2.115 489 HE22 GLN 69 2HE2 GLN 69 9.114 8.036 -3.261 490 H LEU 70 H LEU 70 4.424 6.448 0.123 491 HA LEU 70 HA LEU 70 2.518 4.494 -0.395 492 HB2 LEU 70 HB2 LEU 70 4.721 4.033 0.947 493 HB3 LEU 70 HB1 LEU 70 4.173 5.289 2.126 494 HG LEU 70 HG LEU 70 2.384 3.767 2.842 495 HD11 LEU 70 1HD1 LEU 70 2.365 2.073 0.798 496 HD12 LEU 70 2HD1 LEU 70 3.959 1.649 1.455 497 HD13 LEU 70 3HD1 LEU 70 2.510 1.317 2.383 498 HD21 LEU 70 3HD2 LEU 70 4.390 4.131 4.031 499 HD22 LEU 70 1HD2 LEU 70 3.928 2.448 4.133 500 HD23 LEU 70 2HD2 LEU 70 5.229 3.033 2.909 501 H GLU 71 H GLU 71 2.552 6.841 2.320 502 HA GLU 71 HA GLU 71 0.227 5.941 3.615 503 HB2 GLU 71 HB2 GLU 71 1.754 8.514 3.360 504 HB3 GLU 71 HB1 GLU 71 0.234 8.427 4.284 505 HG2 GLU 71 HG2 GLU 71 1.286 6.548 5.651 506 HG3 GLU 71 HG1 GLU 71 2.676 6.693 4.815 507 H LYS 72 H LYS 72 0.696 8.025 0.656 508 HA LYS 72 HA LYS 72 -2.006 8.858 0.717 509 HB2 LYS 72 HB2 LYS 72 0.422 9.342 -1.029 510 HB3 LYS 72 HB1 LYS 72 -1.082 9.983 -1.519 511 HG2 LYS 72 HG2 LYS 72 -1.181 11.061 1.013 512 HG3 LYS 72 HG1 LYS 72 0.416 10.433 1.159 513 HD2 LYS 72 HD2 LYS 72 1.112 11.710 -0.786 514 HD3 LYS 72 HD1 LYS 72 -0.573 12.310 -1.059 515 HE2 LYS 72 HE2 LYS 72 0.884 12.952 1.611 516 HE3 LYS 72 HE1 LYS 72 0.853 13.964 0.278 517 HZ1 LYS 72 HZ1 LYS 72 -0.892 14.549 1.521 518 HZ2 LYS 72 HZ2 LYS 72 -1.396 14.282 0.110 519 HZ3 LYS 72 HZ3 LYS 72 -1.623 13.120 1.400 520 H ILE 73 H ILE 73 -0.160 6.430 -1.095 521 HA ILE 73 HA ILE 73 -2.392 6.037 -2.989 522 HB ILE 73 HB ILE 73 -1.307 3.874 -3.524 523 HG12 ILE 73 2HG1 ILE 73 0.858 4.786 -1.564 524 HG13 ILE 73 1HG1 ILE 73 -0.233 3.524 -1.217 525 HG21 ILE 73 1HG2 ILE 73 0.173 6.439 -3.706 526 HG22 ILE 73 2HG2 ILE 73 0.755 4.976 -4.548 527 HG23 ILE 73 3HG2 ILE 73 -0.825 5.554 -4.877 528 HD11 ILE 73 HD3 ILE 73 1.765 3.466 -3.491 529 HD12 ILE 73 HD1 ILE 73 1.854 2.684 -1.934 530 HD13 ILE 73 HD2 ILE 73 0.652 2.086 -2.987 531 H LEU 74 H LEU 74 -1.453 4.592 0.291 532 HA LEU 74 HA LEU 74 -3.645 3.154 0.390 533 HB2 LEU 74 HB2 LEU 74 -1.726 4.180 2.457 534 HB3 LEU 74 HB1 LEU 74 -2.981 2.900 2.832 535 HG LEU 74 HG LEU 74 -0.941 2.610 0.695 536 HD11 LEU 74 1HD1 LEU 74 -1.193 1.330 3.401 537 HD12 LEU 74 2HD1 LEU 74 0.149 1.112 2.224 538 HD13 LEU 74 3HD1 LEU 74 -0.006 2.625 3.030 539 HD21 LEU 74 3HD2 LEU 74 -2.730 1.365 0.085 540 HD22 LEU 74 1HD2 LEU 74 -1.690 0.216 0.832 541 HD23 LEU 74 2HD2 LEU 74 -3.068 0.669 1.755 542 H GLY 75 H GLY 75 -3.596 6.536 1.143 543 HA2 GLY 75 HA2 GLY 75 -4.942 8.033 2.193 544 HA3 GLY 75 HA1 GLY 75 -6.300 6.940 1.758 545 H ILE 76 H ILE 76 -4.534 4.859 3.499 546 HA ILE 76 HA ILE 76 -5.885 5.619 5.823 547 HB ILE 76 HB ILE 76 -6.044 3.068 6.397 548 HG12 ILE 76 2HG1 ILE 76 -5.424 2.897 3.477 549 HG13 ILE 76 1HG1 ILE 76 -4.320 2.498 4.784 550 HG21 ILE 76 1HG2 ILE 76 -7.471 4.096 3.971 551 HG22 ILE 76 2HG2 ILE 76 -8.247 3.040 5.244 552 HG23 ILE 76 3HG2 ILE 76 -7.785 4.678 5.556 553 HD11 ILE 76 HD3 ILE 76 -6.036 0.827 5.692 554 HD12 ILE 76 HD1 ILE 76 -7.055 1.179 4.320 555 HD13 ILE 76 HD2 ILE 76 -5.342 0.451 4.148 556 H LYS 77 H LYS 77 -4.950 4.784 8.061 557 HA LYS 77 HA LYS 77 -2.793 3.430 8.420 558 HB2 LYS 77 HB2 LYS 77 -1.068 4.959 9.141 559 HB3 LYS 77 HB1 LYS 77 -1.217 4.895 7.450 560 HG2 LYS 77 HG2 LYS 77 -2.528 7.031 7.477 561 HG3 LYS 77 HG1 LYS 77 -2.335 7.007 9.295 562 HD2 LYS 77 HD2 LYS 77 -0.012 7.390 9.132 563 HD3 LYS 77 HD1 LYS 77 0.140 7.090 7.406 564 HE2 LYS 77 HE2 LYS 77 -1.305 9.373 8.683 565 HE3 LYS 77 HE1 LYS 77 0.443 9.510 8.320 566 HZ1 LYS 77 HZ1 LYS 77 -1.212 8.604 6.149 567 HZ2 LYS 77 HZ2 LYS 77 -1.582 10.070 6.661 568 HZ3 LYS 77 HZ3 LYS 77 0.022 9.782 6.286 569 H LEU 78 H LEU 78 -2.289 3.222 10.660 570 HA LEU 78 HA LEU 78 -3.598 5.101 12.335 571 HB2 LEU 78 HB2 LEU 78 -4.160 2.094 12.342 572 HB3 LEU 78 HB1 LEU 78 -4.293 2.805 13.844 573 HG LEU 78 HG LEU 78 -6.027 3.853 11.533 574 HD11 LEU 78 1HD1 LEU 78 -6.524 2.091 13.905 575 HD12 LEU 78 2HD1 LEU 78 -7.791 2.793 12.795 576 HD13 LEU 78 3HD1 LEU 78 -6.593 1.496 12.275 577 HD21 LEU 78 3HD2 LEU 78 -7.129 5.186 13.190 578 HD22 LEU 78 1HD2 LEU 78 -6.154 4.372 14.433 579 HD23 LEU 78 2HD2 LEU 78 -5.466 5.587 13.265 580 H VAL 79 H VAL 79 -1.110 4.846 14.718 581 HA VAL 79 HA VAL 79 -3.882 5.450 14.485 582 HB VAL 79 HB VAL 79 -3.747 6.835 16.389 583 HG11 VAL 79 1HG1 VAL 79 -1.982 4.471 16.981 584 HG12 VAL 79 2HG1 VAL 79 -3.199 5.238 18.022 585 HG13 VAL 79 3HG1 VAL 79 -3.621 4.186 16.626 586 HG21 VAL 79 3HG2 VAL 79 -1.558 7.987 16.046 587 HG22 VAL 79 1HG2 VAL 79 -1.895 7.289 17.593 588 HG23 VAL 79 2HG2 VAL 79 -0.689 6.498 16.520 589 H THR 80 H THR 80 -4.535 8.034 14.976 590 HA THR 80 HA THR 80 -3.867 9.344 12.308 591 HB THR 80 HB THR 80 -5.898 10.606 12.872 592 HG1 THR 80 HG1 THR 80 -6.655 10.410 15.055 593 HG21 THR 80 1HG2 THR 80 -7.285 8.934 12.236 594 HG22 THR 80 2HG2 THR 80 -5.781 8.237 11.771 595 HG23 THR 80 3HG2 THR 80 -6.674 7.787 13.313 596 HA PRO 81 HA PRO 81 -1.258 12.249 14.077 597 HB2 PRO 81 HB1 PRO 81 -1.941 14.630 12.903 598 HB3 PRO 81 HB2 PRO 81 -1.182 13.399 12.104 599 HG2 PRO 81 HG1 PRO 81 -4.139 13.840 11.863 600 HG3 PRO 81 HG2 PRO 81 -2.903 13.546 10.556 601 HD2 PRO 81 HD1 PRO 81 -4.417 11.557 11.703 602 HD3 PRO 81 HD2 PRO 81 -2.647 11.312 11.337 603 H LEU 82 H LEU 82 -4.612 12.434 14.771 604 HA LEU 82 HA LEU 82 -4.505 14.361 17.047 605 HB2 LEU 82 HB2 LEU 82 -6.393 12.316 16.242 606 HB3 LEU 82 HB1 LEU 82 -6.701 13.591 17.522 607 HG LEU 82 HG LEU 82 -6.156 14.434 14.648 608 HD11 LEU 82 1HD1 LEU 82 -8.487 14.794 14.284 609 HD12 LEU 82 2HD1 LEU 82 -7.840 13.235 14.259 610 HD13 LEU 82 3HD1 LEU 82 -8.830 13.663 15.631 611 HD21 LEU 82 3HD2 LEU 82 -6.788 16.494 15.128 612 HD22 LEU 82 1HD2 LEU 82 -7.671 16.042 16.525 613 HD23 LEU 82 2HD2 LEU 82 -5.851 16.159 16.592 614 H GLU 83 H GLU 83 -3.191 11.324 16.610 615 HA GLU 83 HA GLU 83 -2.974 11.242 19.519 616 HB2 GLU 83 HB2 GLU 83 -3.624 8.725 17.943 617 HB3 GLU 83 HB1 GLU 83 -3.173 8.736 19.568 618 HG2 GLU 83 HG2 GLU 83 -5.384 10.369 19.921 619 HG3 GLU 83 HG1 GLU 83 -5.685 9.921 18.326 620 H ASN 84 H ASN 84 -1.334 11.287 16.513 621 HA ASN 84 HA ASN 84 1.117 10.592 18.046 622 HB2 ASN 84 HB2 ASN 84 2.142 9.497 16.628 623 HB3 ASN 84 HB1 ASN 84 0.498 8.845 16.462 624 HD21 ASN 84 1HD2 ASN 84 -0.914 10.095 14.641 625 HD22 ASN 84 2HD2 ASN 84 -0.147 9.837 13.104 626 H ASN 85 H ASN 85 2.740 11.958 17.705 627 HA ASN 85 HA ASN 85 2.389 14.377 16.126 628 HB2 ASN 85 HB2 ASN 85 3.634 14.380 18.242 629 HB3 ASN 85 HB1 ASN 85 4.546 12.955 17.633 630 HD21 ASN 85 1HD2 ASN 85 6.557 14.127 18.272 631 HD22 ASN 85 2HD2 ASN 85 7.284 15.179 17.178 632 H GLU 86 H GLU 86 2.409 14.545 14.002 633 HA GLU 86 HA GLU 86 4.821 13.566 12.708 634 HB2 GLU 86 HB2 GLU 86 2.141 12.615 12.221 635 HB3 GLU 86 HB1 GLU 86 2.735 13.447 10.825 636 HG2 GLU 86 HG2 GLU 86 4.372 11.301 12.348 637 HG3 GLU 86 HG1 GLU 86 3.113 10.968 11.043 638 H GLU 87 H GLU 87 4.904 14.643 10.503 639 HA GLU 87 HA GLU 87 4.724 17.573 10.944 640 HB2 GLU 87 HB2 GLU 87 6.714 16.763 9.868 641 HB3 GLU 87 HB1 GLU 87 5.848 15.800 8.826 642 HG2 GLU 87 HG2 GLU 87 5.118 18.004 7.618 643 HG3 GLU 87 HG1 GLU 87 5.869 18.908 8.924 644 H SER 88 H SER 88 2.940 18.733 10.474 645 HA SER 88 HA SER 88 0.703 17.321 9.326 646 HB2 SER 88 HB2 SER 88 0.472 20.182 9.807 647 HB3 SER 88 HB1 SER 88 -0.693 18.866 10.228 648 HG SER 88 HG SER 88 0.341 19.931 12.059 649 H GLU 89 H GLU 89 2.920 19.424 7.849 650 HA GLU 89 HA GLU 89 1.527 20.277 5.560 651 HB2 GLU 89 HB2 GLU 89 3.476 21.245 6.324 652 HB3 GLU 89 HB1 GLU 89 4.464 19.775 6.026 653 HG2 GLU 89 HG2 GLU 89 4.142 20.034 3.605 654 HG3 GLU 89 HG1 GLU 89 2.858 21.285 3.968 655 H LYS 90 H LYS 90 2.482 17.026 6.486 656 HA LYS 90 HA LYS 90 2.639 15.788 3.982 657 HB2 LYS 90 HB2 LYS 90 2.003 14.805 6.790 658 HB3 LYS 90 HB1 LYS 90 2.199 13.762 5.394 659 HG2 LYS 90 HG2 LYS 90 4.530 14.574 5.060 660 HG3 LYS 90 HG1 LYS 90 4.362 15.729 6.361 661 HD2 LYS 90 HD2 LYS 90 4.069 13.691 7.938 662 HD3 LYS 90 HD1 LYS 90 4.276 12.637 6.577 663 HE2 LYS 90 HE2 LYS 90 6.388 13.797 5.942 664 HE3 LYS 90 HE1 LYS 90 6.348 14.627 7.498 665 HZ1 LYS 90 HZ1 LYS 90 6.407 11.774 6.996 666 HZ2 LYS 90 HZ2 LYS 90 7.386 12.595 8.039 667 HZ3 LYS 90 HZ3 LYS 90 5.867 12.288 8.469 668 H GLU 91 H GLU 91 -0.269 17.098 5.459 669 HA GLU 91 HA GLU 91 -2.264 15.424 4.267 670 HB2 GLU 91 HB2 GLU 91 -2.014 18.256 5.117 671 HB3 GLU 91 HB1 GLU 91 -3.456 17.577 4.253 672 HG2 GLU 91 HG2 GLU 91 -2.272 16.791 6.960 673 HG3 GLU 91 HG1 GLU 91 -3.850 17.572 6.595 674 H PHE 92 H PHE 92 -0.142 18.071 2.991 675 HA PHE 92 HA PHE 92 -1.566 18.184 0.387 676 HB2 PHE 92 HB2 PHE 92 1.176 19.166 1.407 677 HB3 PHE 92 HB1 PHE 92 0.579 19.452 -0.139 678 HD1 PHE 92 HD1 PHE 92 -0.008 20.463 3.498 679 HD2 PHE 92 HD2 PHE 92 -0.970 21.210 -0.748 680 HE1 PHE 92 HE1 PHE 92 -0.894 22.479 4.020 681 HE2 PHE 92 HE2 PHE 92 -1.865 23.405 -0.042 682 HZ PHE 92 HZ PHE 92 -1.711 24.096 2.382 683 H ASP 93 H ASP 93 -0.933 17.198 -1.600 684 HA ASP 93 HA ASP 93 0.171 14.825 -1.892 685 HB2 ASP 93 HB2 ASP 93 -0.931 16.156 -3.459 686 HB3 ASP 93 HB1 ASP 93 0.549 17.151 -3.691 687 H ASP 94 H ASP 94 2.176 17.655 -2.413 688 HA ASP 94 HA ASP 94 4.629 15.954 -2.261 689 HB2 ASP 94 HB2 ASP 94 4.258 16.397 -4.506 690 HB3 ASP 94 HB1 ASP 94 3.892 18.035 -4.234 691 H THR 95 H THR 95 3.139 18.857 -1.447 692 HA THR 95 HA THR 95 4.698 19.823 0.506 693 HB THR 95 HB THR 95 6.474 20.143 -1.133 694 HG1 THR 95 HG1 THR 95 7.115 21.859 -0.421 695 HG21 THR 95 1HG2 THR 95 4.949 21.058 -3.211 696 HG22 THR 95 2HG2 THR 95 4.853 22.520 -2.153 697 HG23 THR 95 3HG2 THR 95 6.349 21.995 -2.772 698 H GLY 96 H GLY 96 4.246 21.857 1.343 699 HA2 GLY 96 HA2 GLY 96 1.521 22.700 1.335 700 HA3 GLY 96 HA1 GLY 96 2.737 23.480 2.179 701 H LEU 97 H LEU 97 0.665 23.895 -0.179 702 HA LEU 97 HA LEU 97 2.156 25.557 -2.184 703 HB2 LEU 97 HB2 LEU 97 -0.724 24.812 -1.987 704 HB3 LEU 97 HB1 LEU 97 0.012 25.410 -3.364 705 HG LEU 97 HG LEU 97 0.532 22.742 -2.190 706 HD11 LEU 97 1HD1 LEU 97 -0.335 21.761 -4.068 707 HD12 LEU 97 2HD1 LEU 97 -1.573 22.642 -3.086 708 HD13 LEU 97 3HD1 LEU 97 -1.037 23.367 -4.556 709 HD21 LEU 97 3HD2 LEU 97 2.558 23.803 -3.352 710 HD22 LEU 97 1HD2 LEU 97 2.061 22.333 -4.213 711 HD23 LEU 97 2HD2 LEU 97 1.679 24.094 -4.725 712 H THR 98 H THR 98 1.437 27.684 -2.709 713 HA THR 98 HA THR 98 0.352 29.108 -0.343 714 HB THR 98 HB THR 98 2.428 29.860 -2.434 715 HG1 THR 98 HG1 THR 98 3.202 29.091 -0.619 716 HG21 THR 98 1HG2 THR 98 0.811 31.798 -2.554 717 HG22 THR 98 2HG2 THR 98 0.754 31.748 -0.745 718 HG23 THR 98 3HG2 THR 98 2.239 32.175 -1.664 719 H LEU 99 H LEU 99 -1.552 30.218 -0.647 720 HA LEU 99 HA LEU 99 -2.983 30.317 -3.171 721 HB2 LEU 99 HB2 LEU 99 -4.041 29.758 -0.988 722 HB3 LEU 99 HB1 LEU 99 -3.515 31.301 -0.340 723 HG LEU 99 HG LEU 99 -5.103 32.539 -1.865 724 HD11 LEU 99 1HD1 LEU 99 -6.725 31.170 -3.073 725 HD12 LEU 99 2HD1 LEU 99 -5.055 31.008 -3.754 726 HD13 LEU 99 3HD1 LEU 99 -5.789 29.729 -2.755 727 HD21 LEU 99 3HD2 LEU 99 -7.066 31.852 -0.895 728 HD22 LEU 99 1HD2 LEU 99 -6.390 30.332 -0.203 729 HD23 LEU 99 2HD2 LEU 99 -5.766 31.905 0.282 730 H GLY 100 H GLY 100 -1.196 32.673 -1.154 731 HA2 GLY 100 HA2 GLY 100 -0.598 34.818 -1.721 732 HA3 GLY 100 HA1 GLY 100 -0.958 34.391 -3.386 733 H ASP 101 H ASP 101 -2.754 34.746 -0.327 734 HA ASP 101 HA ASP 101 -4.060 37.148 -1.029 735 HB2 ASP 101 HB2 ASP 101 -5.255 35.833 -2.788 736 HB3 ASP 101 HB1 ASP 101 -5.615 34.665 -1.642 737 H VAL 102 H VAL 102 -3.519 37.952 0.726 738 HA VAL 102 HA VAL 102 -4.904 37.009 3.104 739 HB VAL 102 HB VAL 102 -2.888 38.060 4.190 740 HG11 VAL 102 1HG1 VAL 102 -1.482 36.001 3.975 741 HG12 VAL 102 2HG1 VAL 102 -3.137 35.599 4.143 742 HG13 VAL 102 3HG1 VAL 102 -2.361 35.688 2.480 743 HG21 VAL 102 3HG2 VAL 102 -1.498 38.061 1.551 744 HG22 VAL 102 1HG2 VAL 102 -2.074 39.378 2.664 745 HG23 VAL 102 2HG2 VAL 102 -0.857 38.111 3.202 746 H VAL 103 H VAL 103 -5.629 40.484 4.047 747 HA VAL 103 HA VAL 103 -4.371 38.210 5.380 748 HB VAL 103 HB VAL 103 -6.386 40.245 5.913 749 HG11 VAL 103 1HG1 VAL 103 -6.214 39.379 8.526 750 HG12 VAL 103 2HG1 VAL 103 -7.131 38.440 7.515 751 HG13 VAL 103 3HG1 VAL 103 -5.420 38.006 7.739 752 HG21 VAL 103 3HG2 VAL 103 -4.219 41.278 6.208 753 HG22 VAL 103 1HG2 VAL 103 -4.689 40.857 7.799 754 HG23 VAL 103 2HG2 VAL 103 -3.657 39.741 7.000 755 H ASN 104 H ASN 104 -5.086 36.310 5.699 756 HA ASN 104 HA ASN 104 -7.767 35.406 4.920 757 HB2 ASN 104 HB2 ASN 104 -5.966 33.810 4.495 758 HB3 ASN 104 HB1 ASN 104 -5.570 33.710 6.155 759 HD21 ASN 104 1HD2 ASN 104 -7.931 32.735 3.825 760 HD22 ASN 104 2HD2 ASN 104 -8.612 31.404 4.693 761 H ILE 105 H ILE 105 -9.410 35.411 6.191 762 HA ILE 105 HA ILE 105 -9.136 35.597 9.212 763 HB ILE 105 HB ILE 105 -10.705 36.862 9.493 764 HG12 ILE 105 2HG1 ILE 105 -12.153 36.084 6.973 765 HG13 ILE 105 1HG1 ILE 105 -12.512 35.590 8.735 766 HG21 ILE 105 1HG2 ILE 105 -9.855 37.683 6.678 767 HG22 ILE 105 2HG2 ILE 105 -10.761 38.720 7.705 768 HG23 ILE 105 3HG2 ILE 105 -9.151 38.165 8.130 769 HD11 ILE 105 HD3 ILE 105 -14.233 36.995 7.835 770 HD12 ILE 105 HD1 ILE 105 -13.493 37.477 9.324 771 HD13 ILE 105 HD2 ILE 105 -13.039 38.329 7.811 772 H LYS 106 H LYS 106 -10.540 34.205 10.484 773 HA LYS 106 HA LYS 106 -10.668 31.589 9.203 774 HB2 LYS 106 HB2 LYS 106 -11.455 32.592 11.941 775 HB3 LYS 106 HB1 LYS 106 -11.329 30.893 11.484 776 HG2 LYS 106 HG2 LYS 106 -8.911 31.378 10.845 777 HG3 LYS 106 HG1 LYS 106 -9.210 32.994 11.430 778 HD2 LYS 106 HD2 LYS 106 -9.612 31.896 13.845 779 HD3 LYS 106 HD1 LYS 106 -9.488 30.425 13.239 780 HE2 LYS 106 HE2 LYS 106 -7.099 30.942 12.376 781 HE3 LYS 106 HE1 LYS 106 -7.435 32.618 12.901 782 HZ1 LYS 106 HZ1 LYS 106 -7.322 31.762 15.161 783 HZ2 LYS 106 HZ2 LYS 106 -7.317 30.173 14.692 784 HZ3 LYS 106 HZ3 LYS 106 -6.126 31.076 14.294 785 H GLU 107 H GLU 107 -12.927 34.065 10.191 786 HA GLU 107 HA GLU 107 -15.416 32.526 10.075 787 HB2 GLU 107 HB2 GLU 107 -14.755 35.392 9.908 788 HB3 GLU 107 HB1 GLU 107 -16.432 34.766 9.975 789 HG2 GLU 107 HG2 GLU 107 -14.367 34.368 12.230 790 HG3 GLU 107 HG1 GLU 107 -15.736 35.517 12.176 791 H GLY 108 H GLY 108 -13.504 34.532 7.641 792 HA2 GLY 108 HA2 GLY 108 -15.904 34.651 5.846 793 HA3 GLY 108 HA1 GLY 108 -14.549 35.685 5.997 794 H LYS 109 H LYS 109 -15.665 34.507 3.788 795 HA LYS 109 HA LYS 109 -13.323 33.296 2.466 796 HB2 LYS 109 HB2 LYS 109 -16.171 32.262 2.256 797 HB3 LYS 109 HB1 LYS 109 -14.850 31.910 1.080 798 HG2 LYS 109 HG2 LYS 109 -13.594 30.878 2.845 799 HG3 LYS 109 HG1 LYS 109 -14.826 31.382 4.032 800 HD2 LYS 109 HD2 LYS 109 -16.460 29.806 2.916 801 HD3 LYS 109 HD1 LYS 109 -15.358 29.556 1.620 802 HE2 LYS 109 HE2 LYS 109 -13.820 28.418 3.135 803 HE3 LYS 109 HE1 LYS 109 -15.026 28.588 4.427 804 HZ1 LYS 109 HZ1 LYS 109 -16.566 27.256 3.016 805 HZ2 LYS 109 HZ2 LYS 109 -15.512 27.327 1.799 806 HZ3 LYS 109 HZ3 LYS 109 -15.198 26.409 3.131 807 H LYS 110 H LYS 110 -13.946 35.980 2.456 808 HA LYS 110 HA LYS 110 -13.668 37.260 0.181 809 HB2 LYS 110 HB2 LYS 110 -15.610 36.444 -0.854 810 HB3 LYS 110 HB1 LYS 110 -16.627 36.858 0.568 811 HG2 LYS 110 HG2 LYS 110 -15.960 39.128 0.251 812 HG3 LYS 110 HG1 LYS 110 -15.180 38.852 -1.247 813 HD2 LYS 110 HD2 LYS 110 -17.521 37.967 -2.079 814 HD3 LYS 110 HD1 LYS 110 -18.106 38.711 -0.552 815 HE2 LYS 110 HE2 LYS 110 -18.419 40.307 -2.266 816 HE3 LYS 110 HE1 LYS 110 -17.193 40.841 -1.153 817 HZ1 LYS 110 HZ1 LYS 110 -16.382 39.573 -3.601 818 HZ2 LYS 110 HZ2 LYS 110 -16.510 41.225 -3.426 819 HZ3 LYS 110 HZ3 LYS 110 -15.421 40.346 -2.562 820 H LEU 111 H LEU 111 -12.741 38.972 1.011 821 HA LEU 111 HA LEU 111 -14.268 40.545 3.053 822 HB2 LEU 111 HB2 LEU 111 -11.495 40.939 2.144 823 HB3 LEU 111 HB1 LEU 111 -12.271 41.761 3.382 824 HG LEU 111 HG LEU 111 -11.500 38.927 3.749 825 HD11 LEU 111 1HD1 LEU 111 -9.726 40.419 3.939 826 HD12 LEU 111 2HD1 LEU 111 -10.510 41.531 5.069 827 HD13 LEU 111 3HD1 LEU 111 -10.110 39.877 5.563 828 HD21 LEU 111 3HD2 LEU 111 -13.707 39.365 4.879 829 HD22 LEU 111 1HD2 LEU 111 -12.290 38.820 5.857 830 HD23 LEU 111 2HD2 LEU 111 -12.824 40.528 5.909 831 H GLU 112 H GLU 112 -13.752 43.016 2.709 832 HA GLU 112 HA GLU 112 -13.804 43.868 0.004 833 HB2 GLU 112 HB2 GLU 112 -16.260 43.868 1.896 834 HB3 GLU 112 HB1 GLU 112 -16.177 45.109 0.638 835 HG2 GLU 112 HG2 GLU 112 -15.808 42.838 -0.941 836 HG3 GLU 112 HG1 GLU 112 -16.654 42.110 0.358 837 H HIS 113 H HIS 113 -15.245 46.387 1.836 838 HA HIS 113 HA HIS 113 -12.728 47.596 1.524 839 HB2 HIS 113 HB2 HIS 113 -14.171 49.558 1.997 840 HB3 HIS 113 HB1 HIS 113 -14.994 48.372 0.897 841 HD2 HIS 113 HD2 HIS 113 -16.274 50.823 2.703 842 HE1 HIS 113 HE1 HIS 113 -17.952 47.664 5.055 843 HE2 HIS 113 HE2 HIS 113 -18.112 50.156 4.461 844 H HIS 114 H HIS 114 -12.748 45.575 3.643 845 HA HIS 114 HA HIS 114 -12.584 46.565 6.233 846 HB2 HIS 114 HB2 HIS 114 -11.272 44.219 4.801 847 HB3 HIS 114 HB1 HIS 114 -11.059 44.378 6.543 848 HD2 HIS 114 HD2 HIS 114 -13.308 43.667 7.949 849 HE1 HIS 114 HE1 HIS 114 -15.696 42.482 4.655 850 HE2 HIS 114 HE2 HIS 114 -15.598 42.568 7.123 Start of MODEL 16 1 H1 GLU 13 H1 GLU 13 14.248 -19.865 8.377 2 H2 GLU 13 H2 GLU 13 14.154 -21.454 8.491 3 H3 GLU 13 H3 GLU 13 15.223 -20.748 7.407 4 HA GLU 13 HA GLU 13 13.350 -21.688 6.273 5 HB2 GLU 13 HB2 GLU 13 11.952 -19.744 8.160 6 HB3 GLU 13 HB1 GLU 13 11.248 -19.946 6.609 7 HG2 GLU 13 HG2 GLU 13 11.855 -22.171 8.715 8 HG3 GLU 13 HG1 GLU 13 10.274 -21.509 8.316 9 H ASN 14 H ASN 14 13.248 -21.049 4.224 10 HA ASN 14 HA ASN 14 13.577 -18.211 3.627 11 HB2 ASN 14 HB2 ASN 14 15.782 -19.352 3.733 12 HB3 ASN 14 HB1 ASN 14 15.248 -20.370 2.301 13 HD21 ASN 14 1HD2 ASN 14 15.684 -16.821 3.228 14 HD22 ASN 14 2HD2 ASN 14 16.213 -16.512 1.589 15 H ALA 15 H ALA 15 11.233 -18.996 3.460 16 HA ALA 15 HA ALA 15 10.620 -20.622 1.263 17 HB1 ALA 15 HB1 ALA 15 9.551 -20.418 3.522 18 HB2 ALA 15 HB2 ALA 15 8.827 -18.873 3.092 19 HB3 ALA 15 HB3 ALA 15 8.348 -20.276 2.175 20 H GLU 16 H GLU 16 11.404 -17.388 1.233 21 HA GLU 16 HA GLU 16 9.916 -16.937 -1.211 22 HB2 GLU 16 HB2 GLU 16 8.942 -14.925 -0.590 23 HB3 GLU 16 HB1 GLU 16 8.467 -16.203 0.557 24 HG2 GLU 16 HG2 GLU 16 10.562 -14.195 1.453 25 HG3 GLU 16 HG1 GLU 16 8.919 -13.809 1.519 26 H LEU 17 H LEU 17 12.744 -17.287 -0.231 27 HA LEU 17 HA LEU 17 14.746 -16.766 -0.915 28 HB2 LEU 17 HB2 LEU 17 13.815 -15.562 -3.533 29 HB3 LEU 17 HB1 LEU 17 15.110 -16.603 -3.185 30 HG LEU 17 HG LEU 17 12.256 -17.486 -3.214 31 HD11 LEU 17 1HD1 LEU 17 12.747 -18.358 -5.332 32 HD12 LEU 17 2HD1 LEU 17 13.341 -16.607 -5.421 33 HD13 LEU 17 3HD1 LEU 17 14.459 -17.937 -5.265 34 HD21 LEU 17 3HD2 LEU 17 13.349 -19.849 -3.488 35 HD22 LEU 17 1HD2 LEU 17 14.866 -19.122 -3.120 36 HD23 LEU 17 2HD2 LEU 17 13.537 -19.059 -1.927 37 H GLU 18 H GLU 18 13.625 -15.242 0.760 38 HA GLU 18 HA GLU 18 15.304 -12.974 0.406 39 HB2 GLU 18 HB2 GLU 18 12.956 -12.586 -0.268 40 HB3 GLU 18 HB1 GLU 18 12.359 -12.985 1.333 41 HG2 GLU 18 HG2 GLU 18 12.071 -10.610 1.104 42 HG3 GLU 18 HG1 GLU 18 13.102 -11.167 2.381 43 H ILE 19 H ILE 19 16.080 -11.885 2.104 44 HA ILE 19 HA ILE 19 16.138 -13.341 4.750 45 HB ILE 19 HB ILE 19 18.354 -12.142 4.864 46 HG12 ILE 19 2HG1 ILE 19 17.967 -11.587 1.959 47 HG13 ILE 19 1HG1 ILE 19 17.845 -10.350 3.265 48 HG21 ILE 19 1HG2 ILE 19 19.319 -13.956 3.934 49 HG22 ILE 19 2HG2 ILE 19 17.730 -14.534 4.126 50 HG23 ILE 19 3HG2 ILE 19 18.068 -14.016 2.572 51 HD11 ILE 19 HD3 ILE 19 20.011 -10.354 2.255 52 HD12 ILE 19 HD1 ILE 19 20.225 -10.844 3.819 53 HD13 ILE 19 HD2 ILE 19 20.265 -12.118 2.487 54 H VAL 20 H VAL 20 15.278 -10.199 3.335 55 HA VAL 20 HA VAL 20 15.156 -8.649 5.688 56 HB VAL 20 HB VAL 20 13.175 -8.534 3.394 57 HG11 VAL 20 1HG1 VAL 20 12.441 -7.245 5.521 58 HG12 VAL 20 2HG1 VAL 20 14.026 -6.503 5.518 59 HG13 VAL 20 3HG1 VAL 20 12.827 -6.172 4.229 60 HG21 VAL 20 3HG2 VAL 20 14.550 -6.618 2.633 61 HG22 VAL 20 1HG2 VAL 20 15.703 -6.880 3.928 62 HG23 VAL 20 2HG2 VAL 20 15.610 -7.964 2.602 63 H THR 21 H THR 21 13.501 -8.528 7.279 64 HA THR 21 HA THR 21 11.188 -10.197 7.279 65 HB THR 21 HB THR 21 12.175 -11.152 9.564 66 HG1 THR 21 HG1 THR 21 14.349 -11.847 9.174 67 HG21 THR 21 1HG2 THR 21 11.065 -12.409 7.784 68 HG22 THR 21 2HG2 THR 21 12.646 -12.458 6.859 69 HG23 THR 21 3HG2 THR 21 12.419 -13.286 8.447 70 H ASP 22 H ASP 22 13.315 -8.264 9.314 71 HA ASP 22 HA ASP 22 11.206 -7.099 10.784 72 HB2 ASP 22 HB2 ASP 22 13.537 -7.207 11.648 73 HB3 ASP 22 HB1 ASP 22 14.043 -6.238 10.320 74 H TYR 23 H TYR 23 10.031 -6.680 8.866 75 HA TYR 23 HA TYR 23 10.679 -4.465 7.125 76 HB2 TYR 23 HB2 TYR 23 9.743 -6.629 6.236 77 HB3 TYR 23 HB1 TYR 23 8.422 -6.420 7.262 78 HD1 TYR 23 HD1 TYR 23 10.242 -4.581 4.478 79 HD2 TYR 23 HD2 TYR 23 6.478 -5.658 6.246 80 HE1 TYR 23 HE1 TYR 23 8.916 -3.622 2.487 81 HE2 TYR 23 HE2 TYR 23 5.230 -4.562 4.484 82 HH TYR 23 HH TYR 23 6.973 -2.906 1.702 83 H TYR 24 H TYR 24 9.320 -2.489 6.738 84 HA TYR 24 HA TYR 24 8.640 -1.357 9.175 85 HB2 TYR 24 HB2 TYR 24 9.567 -0.378 7.043 86 HB3 TYR 24 HB1 TYR 24 7.854 -0.355 6.490 87 HD1 TYR 24 HD1 TYR 24 9.796 0.559 9.604 88 HD2 TYR 24 HD2 TYR 24 7.285 2.004 6.476 89 HE1 TYR 24 HE1 TYR 24 9.608 2.723 10.780 90 HE2 TYR 24 HE2 TYR 24 7.417 4.266 7.412 91 HH TYR 24 HH TYR 24 8.281 5.546 8.964 92 H LYS 25 H LYS 25 6.690 -0.493 9.995 93 HA LYS 25 HA LYS 25 4.707 -2.684 9.835 94 HB2 LYS 25 HB2 LYS 25 5.268 -0.673 12.055 95 HB3 LYS 25 HB1 LYS 25 4.254 -2.125 11.992 96 HG2 LYS 25 HG2 LYS 25 6.288 -3.499 11.863 97 HG3 LYS 25 HG1 LYS 25 7.325 -2.075 11.818 98 HD2 LYS 25 HD2 LYS 25 7.058 -1.547 13.950 99 HD3 LYS 25 HD1 LYS 25 5.423 -2.313 14.096 100 HE2 LYS 25 HE2 LYS 25 6.605 -4.452 13.692 101 HE3 LYS 25 HE1 LYS 25 8.058 -3.602 13.541 102 HZ1 LYS 25 HZ1 LYS 25 6.412 -4.087 16.025 103 HZ2 LYS 25 HZ2 LYS 25 7.940 -4.558 15.879 104 HZ3 LYS 25 HZ3 LYS 25 7.617 -2.928 15.980 105 H ILE 26 H ILE 26 4.474 0.974 9.922 106 HA ILE 26 HA ILE 26 1.577 0.693 9.959 107 HB ILE 26 HB ILE 26 2.513 2.697 10.548 108 HG12 ILE 26 2HG1 ILE 26 1.335 4.303 9.164 109 HG13 ILE 26 1HG1 ILE 26 0.877 3.076 8.031 110 HG21 ILE 26 1HG2 ILE 26 3.225 3.154 7.622 111 HG22 ILE 26 2HG2 ILE 26 3.449 4.381 8.795 112 HG23 ILE 26 3HG2 ILE 26 4.511 2.966 8.900 113 HD11 ILE 26 HD3 ILE 26 0.236 2.867 10.965 114 HD12 ILE 26 HD1 ILE 26 -0.822 3.753 9.749 115 HD13 ILE 26 HD2 ILE 26 -0.502 1.956 9.627 116 H ILE 27 H ILE 27 3.943 1.024 7.140 117 HA ILE 27 HA ILE 27 1.922 1.194 5.326 118 HB ILE 27 HB ILE 27 3.612 0.455 3.547 119 HG12 ILE 27 2HG1 ILE 27 5.640 0.303 5.792 120 HG13 ILE 27 1HG1 ILE 27 4.696 -1.091 5.238 121 HG21 ILE 27 1HG2 ILE 27 3.301 2.798 4.057 122 HG22 ILE 27 2HG2 ILE 27 4.535 2.676 5.318 123 HG23 ILE 27 3HG2 ILE 27 4.895 2.302 3.611 124 HD11 ILE 27 HD3 ILE 27 6.458 0.410 3.352 125 HD12 ILE 27 HD1 ILE 27 6.640 -1.259 3.961 126 HD13 ILE 27 HD2 ILE 27 5.384 -0.839 2.902 127 H LYS 28 H LYS 28 3.108 -1.770 6.802 128 HA LYS 28 HA LYS 28 1.849 -3.299 5.198 129 HB2 LYS 28 HB2 LYS 28 3.568 -4.072 6.716 130 HB3 LYS 28 HB1 LYS 28 2.388 -3.969 8.083 131 HG2 LYS 28 HG2 LYS 28 1.039 -5.715 6.795 132 HG3 LYS 28 HG1 LYS 28 2.230 -5.578 5.434 133 HD2 LYS 28 HD2 LYS 28 3.878 -6.650 6.629 134 HD3 LYS 28 HD1 LYS 28 2.806 -6.842 8.091 135 HE2 LYS 28 HE2 LYS 28 2.353 -8.032 5.387 136 HE3 LYS 28 HE1 LYS 28 2.915 -8.865 6.775 137 HZ1 LYS 28 HZ1 LYS 28 0.319 -7.429 6.850 138 HZ2 LYS 28 HZ2 LYS 28 0.477 -9.128 6.647 139 HZ3 LYS 28 HZ3 LYS 28 0.922 -8.284 7.964 140 H THR 29 H THR 29 0.488 -1.708 7.983 141 HA THR 29 HA THR 29 -1.480 -3.520 8.822 142 HB THR 29 HB THR 29 -2.481 -1.888 10.076 143 HG1 THR 29 HG1 THR 29 -0.725 -0.048 8.609 144 HG21 THR 29 1HG2 THR 29 -0.149 -2.731 10.915 145 HG22 THR 29 2HG2 THR 29 0.496 -1.393 10.163 146 HG23 THR 29 3HG2 THR 29 -0.719 -1.085 11.484 147 H ALA 30 H ALA 30 -1.884 -0.786 6.417 148 HA ALA 30 HA ALA 30 -4.512 -0.621 6.712 149 HB1 ALA 30 HB1 ALA 30 -4.236 0.620 4.562 150 HB2 ALA 30 HB2 ALA 30 -2.922 1.056 5.699 151 HB3 ALA 30 HB3 ALA 30 -2.571 -0.033 4.384 152 H ARG 31 H ARG 31 -3.223 -1.738 3.582 153 HA ARG 31 HA ARG 31 -5.713 -1.917 2.411 154 HB2 ARG 31 HB2 ARG 31 -3.528 -2.131 1.171 155 HB3 ARG 31 HB1 ARG 31 -3.468 -3.819 1.732 156 HG2 ARG 31 HG2 ARG 31 -5.959 -2.724 0.354 157 HG3 ARG 31 HG1 ARG 31 -4.639 -3.158 -0.637 158 HD2 ARG 31 HD2 ARG 31 -6.360 -4.946 0.928 159 HD3 ARG 31 HD1 ARG 31 -6.030 -4.902 -0.744 160 HE ARG 31 HE ARG 31 -3.568 -5.558 0.202 161 HH11 ARG 31 1HH2 ARG 31 -6.911 -7.213 0.842 162 HH12 ARG 31 2HH2 ARG 31 -6.013 -8.541 1.327 163 HH21 ARG 31 1HH1 ARG 31 -2.808 -7.529 0.701 164 HH22 ARG 31 2HH1 ARG 31 -3.834 -8.935 0.966 165 H GLU 32 H GLU 32 -3.992 -4.709 4.190 166 HA GLU 32 HA GLU 32 -5.915 -6.478 4.016 167 HB2 GLU 32 HB2 GLU 32 -3.850 -5.677 6.157 168 HB3 GLU 32 HB1 GLU 32 -4.873 -7.003 6.495 169 HG2 GLU 32 HG2 GLU 32 -4.242 -8.305 4.632 170 HG3 GLU 32 HG1 GLU 32 -3.195 -6.997 4.050 171 H GLN 33 H GLN 33 -5.689 -4.087 6.776 172 HA GLN 33 HA GLN 33 -7.857 -5.261 8.152 173 HB2 GLN 33 HB2 GLN 33 -6.282 -2.748 8.616 174 HB3 GLN 33 HB1 GLN 33 -7.744 -3.180 9.486 175 HG2 GLN 33 HG2 GLN 33 -6.789 -5.350 9.991 176 HG3 GLN 33 HG1 GLN 33 -5.282 -4.982 8.991 177 HE21 GLN 33 1HE2 GLN 33 -7.029 -3.406 11.757 178 HE22 GLN 33 2HE2 GLN 33 -5.562 -3.061 12.644 179 H LEU 34 H LEU 34 -7.780 -2.730 5.717 180 HA LEU 34 HA LEU 34 -10.333 -1.733 6.204 181 HB2 LEU 34 HB2 LEU 34 -8.370 -1.742 3.801 182 HB3 LEU 34 HB1 LEU 34 -9.765 -0.768 3.822 183 HG LEU 34 HG LEU 34 -7.658 -0.549 6.005 184 HD11 LEU 34 1HD1 LEU 34 -8.187 1.449 3.958 185 HD12 LEU 34 2HD1 LEU 34 -6.713 1.321 4.898 186 HD13 LEU 34 3HD1 LEU 34 -6.990 0.144 3.548 187 HD21 LEU 34 3HD2 LEU 34 -9.854 0.150 6.828 188 HD22 LEU 34 1HD2 LEU 34 -8.754 1.448 6.624 189 HD23 LEU 34 2HD2 LEU 34 -10.010 1.195 5.409 190 H GLY 35 H GLY 35 -9.488 -4.507 5.322 191 HA2 GLY 35 HA2 GLY 35 -10.654 -6.533 4.775 192 HA3 GLY 35 HA1 GLY 35 -12.016 -5.479 4.747 193 H ILE 36 H ILE 36 -10.265 -4.090 2.625 194 HA ILE 36 HA ILE 36 -11.626 -5.019 0.271 195 HB ILE 36 HB ILE 36 -10.283 -3.149 -0.866 196 HG12 ILE 36 2HG1 ILE 36 -9.597 -2.462 1.937 197 HG13 ILE 36 1HG1 ILE 36 -8.487 -3.264 0.922 198 HG21 ILE 36 1HG2 ILE 36 -12.147 -2.847 1.382 199 HG22 ILE 36 2HG2 ILE 36 -11.826 -1.556 0.207 200 HG23 ILE 36 3HG2 ILE 36 -12.625 -3.028 -0.308 201 HD11 ILE 36 HD3 ILE 36 -8.014 -0.854 0.986 202 HD12 ILE 36 HD1 ILE 36 -8.471 -1.302 -0.625 203 HD13 ILE 36 HD2 ILE 36 -9.566 -0.391 0.413 204 H SER 37 H SER 37 -10.683 -5.599 -1.697 205 HA SER 37 HA SER 37 -8.390 -7.380 -1.382 206 HB2 SER 37 HB2 SER 37 -9.024 -8.426 -3.303 207 HB3 SER 37 HB1 SER 37 -10.624 -7.742 -2.683 208 HG SER 37 HG SER 37 -10.174 -7.840 -4.895 209 H GLN 38 H GLN 38 -6.853 -7.669 -3.362 210 HA GLN 38 HA GLN 38 -5.392 -5.265 -3.822 211 HB2 GLN 38 HB2 GLN 38 -5.513 -7.740 -5.548 212 HB3 GLN 38 HB1 GLN 38 -4.282 -6.359 -5.716 213 HG2 GLN 38 HG2 GLN 38 -3.079 -7.972 -4.595 214 HG3 GLN 38 HG1 GLN 38 -3.552 -6.996 -3.272 215 HE21 GLN 38 1HE2 GLN 38 -3.054 -8.998 -2.031 216 HE22 GLN 38 2HE2 GLN 38 -4.204 -10.257 -1.948 217 H GLN 39 H GLN 39 -7.932 -6.965 -5.657 218 HA GLN 39 HA GLN 39 -7.709 -5.489 -8.031 219 HB2 GLN 39 HB2 GLN 39 -8.951 -7.960 -7.313 220 HB3 GLN 39 HB1 GLN 39 -10.293 -6.859 -7.459 221 HG2 GLN 39 HG2 GLN 39 -10.134 -6.508 -9.599 222 HG3 GLN 39 HG1 GLN 39 -8.469 -6.809 -9.780 223 HE21 GLN 39 1HE2 GLN 39 -7.877 -9.249 -9.307 224 HE22 GLN 39 2HE2 GLN 39 -9.043 -10.411 -10.060 225 H GLN 40 H GLN 40 -9.958 -5.156 -5.244 226 HA GLN 40 HA GLN 40 -11.343 -3.078 -6.593 227 HB2 GLN 40 HB2 GLN 40 -10.936 -3.628 -3.625 228 HB3 GLN 40 HB1 GLN 40 -12.183 -2.632 -4.457 229 HG2 GLN 40 HG2 GLN 40 -13.387 -4.526 -5.319 230 HG3 GLN 40 HG1 GLN 40 -12.153 -5.609 -4.857 231 HE21 GLN 40 1HE2 GLN 40 -15.089 -4.404 -3.815 232 HE22 GLN 40 2HE2 GLN 40 -14.857 -4.401 -2.103 233 H LEU 41 H LEU 41 -8.261 -3.000 -4.632 234 HA LEU 41 HA LEU 41 -8.568 -0.128 -4.680 235 HB2 LEU 41 HB2 LEU 41 -7.716 -1.528 -2.770 236 HB3 LEU 41 HB1 LEU 41 -6.319 -1.981 -3.823 237 HG LEU 41 HG LEU 41 -5.742 0.425 -3.822 238 HD11 LEU 41 1HD1 LEU 41 -8.090 0.876 -2.015 239 HD12 LEU 41 2HD1 LEU 41 -6.649 1.881 -1.854 240 HD13 LEU 41 3HD1 LEU 41 -7.561 1.785 -3.408 241 HD21 LEU 41 3HD2 LEU 41 -4.951 -1.164 -1.807 242 HD22 LEU 41 1HD2 LEU 41 -4.919 0.471 -1.357 243 HD23 LEU 41 2HD2 LEU 41 -6.334 -0.638 -0.925 244 H ALA 42 H ALA 42 -6.900 -2.540 -6.610 245 HA ALA 42 HA ALA 42 -5.429 -0.770 -8.141 246 HB1 ALA 42 HB1 ALA 42 -5.001 -3.061 -7.801 247 HB2 ALA 42 HB2 ALA 42 -6.570 -3.556 -8.511 248 HB3 ALA 42 HB3 ALA 42 -5.339 -2.937 -9.593 249 H GLN 43 H GLN 43 -8.998 -1.266 -8.148 250 HA GLN 43 HA GLN 43 -9.286 -0.151 -10.791 251 HB2 GLN 43 HB2 GLN 43 -11.032 -0.225 -8.158 252 HB3 GLN 43 HB1 GLN 43 -11.406 0.582 -9.716 253 HG2 GLN 43 HG2 GLN 43 -11.292 -1.461 -10.912 254 HG3 GLN 43 HG1 GLN 43 -10.928 -2.368 -9.478 255 HE21 GLN 43 1HE2 GLN 43 -13.431 -0.139 -10.830 256 HE22 GLN 43 2HE2 GLN 43 -14.827 -1.085 -10.213 257 H LYS 44 H LYS 44 -9.328 1.031 -7.401 258 HA LYS 44 HA LYS 44 -10.068 3.466 -7.914 259 HB2 LYS 44 HB2 LYS 44 -10.187 2.091 -5.856 260 HB3 LYS 44 HB1 LYS 44 -8.621 2.694 -5.449 261 HG2 LYS 44 HG2 LYS 44 -9.662 5.137 -5.648 262 HG3 LYS 44 HG1 LYS 44 -11.167 4.437 -5.993 263 HD2 LYS 44 HD2 LYS 44 -11.231 3.143 -3.812 264 HD3 LYS 44 HD1 LYS 44 -9.624 3.928 -3.499 265 HE2 LYS 44 HE2 LYS 44 -10.848 6.079 -3.854 266 HE3 LYS 44 HE1 LYS 44 -12.357 5.052 -4.080 267 HZ1 LYS 44 HZ1 LYS 44 -10.754 5.349 -1.646 268 HZ2 LYS 44 HZ2 LYS 44 -12.312 5.906 -1.930 269 HZ3 LYS 44 HZ3 LYS 44 -12.003 4.295 -1.843 270 H LEU 45 H LEU 45 -6.963 2.297 -8.392 271 HA LEU 45 HA LEU 45 -5.623 4.912 -8.259 272 HB2 LEU 45 HB2 LEU 45 -4.876 1.995 -7.629 273 HB3 LEU 45 HB1 LEU 45 -3.637 3.235 -7.663 274 HG LEU 45 HG LEU 45 -5.944 3.242 -5.800 275 HD11 LEU 45 1HD1 LEU 45 -3.833 1.621 -5.405 276 HD12 LEU 45 2HD1 LEU 45 -3.071 3.153 -4.864 277 HD13 LEU 45 3HD1 LEU 45 -4.622 2.634 -4.159 278 HD21 LEU 45 3HD2 LEU 45 -5.483 5.514 -6.113 279 HD22 LEU 45 1HD2 LEU 45 -4.683 5.105 -4.690 280 HD23 LEU 45 2HD2 LEU 45 -3.742 5.343 -6.229 281 H LYS 46 H LYS 46 -6.729 2.683 -10.221 282 HA LYS 46 HA LYS 46 -6.410 1.546 -11.971 283 HB2 LYS 46 HB2 LYS 46 -4.642 3.748 -12.774 284 HB3 LYS 46 HB1 LYS 46 -5.152 2.429 -13.856 285 HG2 LYS 46 HG2 LYS 46 -7.470 2.948 -13.691 286 HG3 LYS 46 HG1 LYS 46 -7.389 4.160 -12.574 287 HD2 LYS 46 HD2 LYS 46 -6.088 5.682 -14.021 288 HD3 LYS 46 HD1 LYS 46 -5.965 4.352 -15.153 289 HE2 LYS 46 HE2 LYS 46 -8.458 4.404 -15.410 290 HE3 LYS 46 HE1 LYS 46 -8.579 5.726 -14.272 291 HZ1 LYS 46 HZ1 LYS 46 -8.349 6.696 -16.491 292 HZ2 LYS 46 HZ2 LYS 46 -7.184 7.102 -15.416 293 HZ3 LYS 46 HZ3 LYS 46 -6.909 5.960 -16.650 294 H VAL 47 H VAL 47 -3.426 1.759 -10.332 295 HA VAL 47 HA VAL 47 -2.506 -0.515 -11.544 296 HB VAL 47 HB VAL 47 -0.289 0.328 -10.493 297 HG11 VAL 47 1HG1 VAL 47 -0.231 2.188 -12.040 298 HG12 VAL 47 2HG1 VAL 47 -1.304 0.980 -12.729 299 HG13 VAL 47 3HG1 VAL 47 -1.885 2.547 -11.997 300 HG21 VAL 47 3HG2 VAL 47 -1.866 2.796 -9.619 301 HG22 VAL 47 1HG2 VAL 47 -1.127 1.663 -8.483 302 HG23 VAL 47 2HG2 VAL 47 -0.163 2.566 -9.557 303 H SER 48 H SER 48 -1.346 -2.390 -10.210 304 HA SER 48 HA SER 48 -2.560 -2.759 -7.611 305 HB2 SER 48 HB2 SER 48 -2.662 -5.100 -8.623 306 HB3 SER 48 HB1 SER 48 -3.471 -3.996 -9.680 307 HG SER 48 HG SER 48 -1.761 -4.141 -11.013 308 H GLU 49 H GLU 49 0.650 -2.729 -8.974 309 HA GLU 49 HA GLU 49 1.565 -5.089 -7.679 310 HB2 GLU 49 HB2 GLU 49 2.820 -2.998 -9.495 311 HB3 GLU 49 HB1 GLU 49 3.579 -4.459 -8.877 312 HG2 GLU 49 HG2 GLU 49 1.757 -5.746 -10.008 313 HG3 GLU 49 HG1 GLU 49 1.216 -4.156 -10.722 314 H ASN 50 H ASN 50 1.971 -1.551 -7.243 315 HA ASN 50 HA ASN 50 3.984 -2.091 -5.109 316 HB2 ASN 50 HB2 ASN 50 4.629 -0.832 -6.948 317 HB3 ASN 50 HB1 ASN 50 3.440 0.344 -6.616 318 HD21 ASN 50 1HD2 ASN 50 4.882 2.150 -6.147 319 HD22 ASN 50 2HD2 ASN 50 6.089 2.092 -4.932 320 H ILE 51 H ILE 51 1.207 0.090 -3.195 321 HA ILE 51 HA ILE 51 -0.378 0.610 -4.514 322 HB ILE 51 HB ILE 51 1.413 1.488 -6.613 323 HG12 ILE 51 2HG1 ILE 51 1.425 2.606 -3.779 324 HG13 ILE 51 1HG1 ILE 51 2.825 1.875 -4.632 325 HG21 ILE 51 1HG2 ILE 51 -0.550 3.059 -4.909 326 HG22 ILE 51 2HG2 ILE 51 0.098 3.219 -6.582 327 HG23 ILE 51 3HG2 ILE 51 -1.181 2.011 -6.220 328 HD11 ILE 51 HD3 ILE 51 1.548 4.580 -5.171 329 HD12 ILE 51 HD1 ILE 51 3.266 4.120 -4.851 330 HD13 ILE 51 HD2 ILE 51 2.552 3.724 -6.352 331 H VAL 52 H VAL 52 -0.654 -2.579 -6.417 332 HA VAL 52 HA VAL 52 -1.337 -1.253 -3.892 333 HB VAL 52 HB VAL 52 -2.485 -3.570 -5.433 334 HG11 VAL 52 1HG1 VAL 52 -2.170 -4.388 -3.194 335 HG12 VAL 52 2HG1 VAL 52 -2.933 -2.814 -2.555 336 HG13 VAL 52 3HG1 VAL 52 -3.819 -4.039 -3.418 337 HG21 VAL 52 3HG2 VAL 52 -3.691 -1.132 -4.137 338 HG22 VAL 52 1HG2 VAL 52 -3.339 -1.272 -5.959 339 HG23 VAL 52 2HG2 VAL 52 -4.566 -2.193 -5.081 340 H LYS 53 H LYS 53 0.311 -4.139 -5.360 341 HA LYS 53 HA LYS 53 0.267 -5.565 -3.072 342 HB2 LYS 53 HB2 LYS 53 1.510 -5.842 -5.787 343 HB3 LYS 53 HB1 LYS 53 2.076 -6.912 -4.498 344 HG2 LYS 53 HG2 LYS 53 -0.186 -7.806 -4.398 345 HG3 LYS 53 HG1 LYS 53 -0.858 -6.360 -5.209 346 HD2 LYS 53 HD2 LYS 53 -0.865 -8.441 -6.561 347 HD3 LYS 53 HD1 LYS 53 -0.074 -7.230 -7.411 348 HE2 LYS 53 HE2 LYS 53 1.074 -9.174 -7.664 349 HE3 LYS 53 HE1 LYS 53 2.153 -8.315 -6.699 350 HZ1 LYS 53 HZ1 LYS 53 0.378 -10.352 -5.493 351 HZ2 LYS 53 HZ2 LYS 53 1.710 -10.735 -6.248 352 HZ3 LYS 53 HZ3 LYS 53 1.749 -9.834 -4.865 353 H ARG 54 H ARG 54 3.077 -3.505 -3.804 354 HA ARG 54 HA ARG 54 4.826 -5.376 -2.411 355 HB2 ARG 54 HB2 ARG 54 5.282 -3.924 -4.536 356 HB3 ARG 54 HB1 ARG 54 5.429 -2.595 -3.338 357 HG2 ARG 54 HG2 ARG 54 7.369 -3.558 -2.361 358 HG3 ARG 54 HG1 ARG 54 7.129 -5.121 -3.080 359 HD2 ARG 54 HD2 ARG 54 7.809 -2.551 -4.518 360 HD3 ARG 54 HD1 ARG 54 8.961 -3.715 -4.211 361 HE ARG 54 HE ARG 54 7.634 -5.344 -5.716 362 HH11 ARG 54 1HH2 ARG 54 7.053 -1.886 -6.030 363 HH12 ARG 54 2HH2 ARG 54 6.884 -2.090 -7.809 364 HH21 ARG 54 1HH1 ARG 54 7.170 -5.397 -7.966 365 HH22 ARG 54 2HH1 ARG 54 7.002 -3.900 -8.877 366 H PHE 55 H PHE 55 3.012 -2.647 -1.304 367 HA PHE 55 HA PHE 55 4.891 -1.901 0.780 368 HB2 PHE 55 HB2 PHE 55 1.900 -1.599 0.592 369 HB3 PHE 55 HB1 PHE 55 2.834 -1.015 1.843 370 HD1 PHE 55 HD2 PHE 55 4.506 -0.450 -1.455 371 HD2 PHE 55 HD1 PHE 55 1.487 0.913 1.261 372 HE1 PHE 55 HE2 PHE 55 4.473 1.586 -2.546 373 HE2 PHE 55 HE1 PHE 55 1.585 3.149 0.185 374 HZ PHE 55 HZ PHE 55 2.970 3.495 -1.982 375 H GLU 56 H GLU 56 2.509 -4.535 0.275 376 HA GLU 56 HA GLU 56 2.320 -5.042 2.915 377 HB2 GLU 56 HB2 GLU 56 1.594 -6.730 0.483 378 HB3 GLU 56 HB1 GLU 56 0.890 -6.982 2.111 379 HG2 GLU 56 HG2 GLU 56 0.284 -4.363 1.624 380 HG3 GLU 56 HG1 GLU 56 0.378 -4.793 -0.031 381 H SER 57 H SER 57 4.882 -5.684 1.126 382 HA SER 57 HA SER 57 4.836 -8.439 0.849 383 HB2 SER 57 HB2 SER 57 6.764 -8.123 -0.500 384 HB3 SER 57 HB1 SER 57 5.512 -6.975 -0.874 385 HG SER 57 HG SER 57 6.714 -5.406 -0.288 386 H GLY 58 H GLY 58 6.426 -6.872 3.397 387 HA2 GLY 58 HA2 GLY 58 7.798 -7.627 5.174 388 HA3 GLY 58 HA1 GLY 58 7.608 -9.241 4.345 389 H LYS 59 H LYS 59 8.949 -6.602 2.388 390 HA LYS 59 HA LYS 59 11.410 -8.171 2.042 391 HB2 LYS 59 HB2 LYS 59 9.473 -8.468 0.682 392 HB3 LYS 59 HB1 LYS 59 9.568 -6.901 0.032 393 HG2 LYS 59 HG2 LYS 59 11.749 -7.133 -0.853 394 HG3 LYS 59 HG1 LYS 59 11.918 -8.769 -0.207 395 HD2 LYS 59 HD2 LYS 59 9.928 -9.524 -1.423 396 HD3 LYS 59 HD1 LYS 59 9.706 -8.026 -2.206 397 HE2 LYS 59 HE2 LYS 59 10.860 -9.610 -3.563 398 HE3 LYS 59 HE1 LYS 59 12.043 -8.268 -3.268 399 HZ1 LYS 59 HZ1 LYS 59 12.999 -10.535 -3.017 400 HZ2 LYS 59 HZ2 LYS 59 13.141 -9.590 -1.810 401 HZ3 LYS 59 HZ3 LYS 59 12.032 -10.804 -1.717 402 H LEU 60 H LEU 60 10.346 -4.820 2.595 403 HA LEU 60 HA LEU 60 12.939 -4.048 1.779 404 HB2 LEU 60 HB2 LEU 60 10.659 -3.552 0.501 405 HB3 LEU 60 HB1 LEU 60 10.545 -2.169 1.641 406 HG LEU 60 HG LEU 60 12.738 -1.394 0.743 407 HD11 LEU 60 1HD1 LEU 60 12.384 -3.495 -1.484 408 HD12 LEU 60 2HD1 LEU 60 13.577 -2.172 -1.472 409 HD13 LEU 60 3HD1 LEU 60 13.806 -3.492 -0.457 410 HD21 LEU 60 3HD2 LEU 60 10.798 -1.808 -1.517 411 HD22 LEU 60 1HD2 LEU 60 10.606 -0.688 -0.198 412 HD23 LEU 60 2HD2 LEU 60 11.938 -0.422 -1.259 413 H LYS 61 H LYS 61 13.934 -2.007 2.399 414 HA LYS 61 HA LYS 61 12.789 -0.602 4.805 415 HB2 LYS 61 HB2 LYS 61 15.623 -0.817 3.645 416 HB3 LYS 61 HB1 LYS 61 15.014 0.362 4.785 417 HG2 LYS 61 HG2 LYS 61 14.525 -1.330 6.469 418 HG3 LYS 61 HG1 LYS 61 14.586 -2.564 5.274 419 HD2 LYS 61 HD2 LYS 61 17.048 -2.182 5.054 420 HD3 LYS 61 HD1 LYS 61 16.881 -0.766 6.159 421 HE2 LYS 61 HE2 LYS 61 16.071 -2.595 7.962 422 HE3 LYS 61 HE1 LYS 61 16.580 -3.718 6.795 423 HZ1 LYS 61 HZ1 LYS 61 18.808 -2.693 6.991 424 HZ2 LYS 61 HZ2 LYS 61 18.353 -1.631 8.030 425 HZ3 LYS 61 HZ3 LYS 61 18.149 -3.197 8.469 426 HA PRO 62 HA PRO 62 12.047 2.230 1.506 427 HB2 PRO 62 HB1 PRO 62 9.553 3.327 2.201 428 HB3 PRO 62 HB2 PRO 62 9.624 1.748 1.307 429 HG2 PRO 62 HG1 PRO 62 9.268 2.033 4.344 430 HG3 PRO 62 HG2 PRO 62 8.629 0.881 3.211 431 HD2 PRO 62 HD1 PRO 62 10.802 0.362 4.853 432 HD3 PRO 62 HD2 PRO 62 10.438 -0.417 3.283 433 H THR 63 H THR 63 12.028 4.315 1.392 434 HA THR 63 HA THR 63 12.988 5.651 3.787 435 HB THR 63 HB THR 63 13.472 7.632 2.517 436 HG1 THR 63 HG1 THR 63 13.386 7.127 0.175 437 HG21 THR 63 1HG2 THR 63 14.992 5.887 2.888 438 HG22 THR 63 2HG2 THR 63 14.779 5.151 1.228 439 HG23 THR 63 3HG2 THR 63 15.386 6.754 1.432 440 H ILE 64 H ILE 64 12.374 8.084 4.015 441 HA ILE 64 HA ILE 64 9.841 8.236 5.060 442 HB ILE 64 HB ILE 64 11.373 9.600 6.099 443 HG12 ILE 64 2HG1 ILE 64 10.341 11.938 5.725 444 HG13 ILE 64 1HG1 ILE 64 9.287 11.065 4.561 445 HG21 ILE 64 1HG2 ILE 64 11.625 11.295 3.654 446 HG22 ILE 64 2HG2 ILE 64 12.530 11.385 5.257 447 HG23 ILE 64 3HG2 ILE 64 12.926 10.097 4.226 448 HD11 ILE 64 HD3 ILE 64 8.423 9.758 6.532 449 HD12 ILE 64 HD1 ILE 64 9.720 10.355 7.570 450 HD13 ILE 64 HD2 ILE 64 8.381 11.427 7.012 451 H SER 65 H SER 65 11.122 9.999 2.130 452 HA SER 65 HA SER 65 8.635 10.734 1.047 453 HB2 SER 65 HB2 SER 65 9.814 11.053 -1.092 454 HB3 SER 65 HB1 SER 65 10.711 11.611 0.355 455 HG SER 65 HG SER 65 12.123 9.890 0.036 456 H GLN 66 H GLN 66 10.090 7.494 0.876 457 HA GLN 66 HA GLN 66 8.273 6.547 -1.085 458 HB2 GLN 66 HB2 GLN 66 10.256 5.326 0.770 459 HB3 GLN 66 HB1 GLN 66 9.170 4.323 -0.101 460 HG2 GLN 66 HG2 GLN 66 9.874 4.976 -2.285 461 HG3 GLN 66 HG1 GLN 66 10.985 6.030 -1.508 462 HE21 GLN 66 1HE2 GLN 66 10.074 2.555 -0.909 463 HE22 GLN 66 2HE2 GLN 66 11.670 1.885 -1.026 464 H ALA 67 H ALA 67 8.416 6.429 2.497 465 HA ALA 67 HA ALA 67 6.074 4.875 3.091 466 HB1 ALA 67 HB1 ALA 67 7.539 4.910 4.815 467 HB2 ALA 67 HB2 ALA 67 7.946 6.595 4.688 468 HB3 ALA 67 HB3 ALA 67 6.319 6.042 5.331 469 H ARG 68 H ARG 68 6.666 8.370 2.770 470 HA ARG 68 HA ARG 68 4.293 9.505 3.681 471 HB2 ARG 68 HB2 ARG 68 6.160 10.449 1.541 472 HB3 ARG 68 HB1 ARG 68 4.816 11.324 2.064 473 HG2 ARG 68 HG2 ARG 68 6.996 10.686 4.125 474 HG3 ARG 68 HG1 ARG 68 6.888 12.081 3.039 475 HD2 ARG 68 HD2 ARG 68 4.931 10.942 5.029 476 HD3 ARG 68 HD1 ARG 68 6.089 12.266 5.375 477 HE ARG 68 HE ARG 68 4.826 13.442 3.419 478 HH11 ARG 68 1HH2 ARG 68 3.377 11.558 5.893 479 HH12 ARG 68 2HH2 ARG 68 1.731 12.085 5.614 480 HH21 ARG 68 1HH1 ARG 68 2.657 13.868 2.738 481 HH22 ARG 68 2HH1 ARG 68 1.289 13.526 3.739 482 H GLN 69 H GLN 69 4.858 7.697 0.604 483 HA GLN 69 HA GLN 69 2.638 8.657 -0.869 484 HB2 GLN 69 HB2 GLN 69 4.112 5.945 -0.759 485 HB3 GLN 69 HB1 GLN 69 3.033 6.567 -2.076 486 HG2 GLN 69 HG2 GLN 69 4.376 8.440 -2.594 487 HG3 GLN 69 HG1 GLN 69 5.714 7.833 -1.604 488 HE21 GLN 69 1HE2 GLN 69 3.455 6.786 -4.207 489 HE22 GLN 69 2HE2 GLN 69 4.713 5.936 -5.115 490 H LEU 70 H LEU 70 2.542 6.478 1.988 491 HA LEU 70 HA LEU 70 0.187 5.219 1.164 492 HB2 LEU 70 HB2 LEU 70 1.798 4.463 2.748 493 HB3 LEU 70 HB1 LEU 70 1.281 5.706 3.938 494 HG LEU 70 HG LEU 70 -1.040 4.699 3.597 495 HD11 LEU 70 1HD1 LEU 70 -1.073 2.158 3.533 496 HD12 LEU 70 2HD1 LEU 70 -0.600 2.865 2.051 497 HD13 LEU 70 3HD1 LEU 70 0.607 2.126 3.175 498 HD21 LEU 70 3HD2 LEU 70 0.797 3.182 5.513 499 HD22 LEU 70 1HD2 LEU 70 0.354 4.842 5.740 500 HD23 LEU 70 2HD2 LEU 70 -0.930 3.546 5.556 501 H GLU 71 H GLU 71 0.641 7.933 3.587 502 HA GLU 71 HA GLU 71 -1.985 8.499 3.863 503 HB2 GLU 71 HB2 GLU 71 -0.012 9.564 5.107 504 HB3 GLU 71 HB1 GLU 71 0.373 10.420 3.596 505 HG2 GLU 71 HG2 GLU 71 -1.927 11.538 3.775 506 HG3 GLU 71 HG1 GLU 71 -1.864 10.994 5.506 507 H LYS 72 H LYS 72 -0.073 8.961 0.932 508 HA LYS 72 HA LYS 72 -1.639 10.912 -0.419 509 HB2 LYS 72 HB2 LYS 72 0.941 9.940 -0.351 510 HB3 LYS 72 HB1 LYS 72 0.299 9.003 -1.671 511 HG2 LYS 72 HG2 LYS 72 -0.569 11.424 -2.511 512 HG3 LYS 72 HG1 LYS 72 0.373 11.954 -1.119 513 HD2 LYS 72 HD2 LYS 72 2.474 11.080 -2.153 514 HD3 LYS 72 HD1 LYS 72 1.564 10.638 -3.599 515 HE2 LYS 72 HE2 LYS 72 2.369 12.599 -4.227 516 HE3 LYS 72 HE1 LYS 72 0.818 13.187 -3.656 517 HZ1 LYS 72 HZ1 LYS 72 1.866 13.614 -1.529 518 HZ2 LYS 72 HZ2 LYS 72 3.316 13.185 -1.996 519 HZ3 LYS 72 HZ3 LYS 72 2.615 14.497 -2.713 520 H ILE 73 H ILE 73 -1.554 7.320 -0.623 521 HA ILE 73 HA ILE 73 -3.490 7.448 -2.769 522 HB ILE 73 HB ILE 73 -3.337 4.983 -2.740 523 HG12 ILE 73 2HG1 ILE 73 -1.400 5.464 -0.485 524 HG13 ILE 73 1HG1 ILE 73 -2.930 4.697 -0.284 525 HG21 ILE 73 1HG2 ILE 73 -0.752 6.474 -2.845 526 HG22 ILE 73 2HG2 ILE 73 -1.132 4.967 -3.661 527 HG23 ILE 73 3HG2 ILE 73 -2.037 6.386 -4.093 528 HD11 ILE 73 HD3 ILE 73 -2.070 2.979 -2.077 529 HD12 ILE 73 HD1 ILE 73 -0.455 3.614 -1.817 530 HD13 ILE 73 HD2 ILE 73 -1.340 2.934 -0.433 531 H LEU 74 H LEU 74 -3.567 6.383 0.767 532 HA LEU 74 HA LEU 74 -6.204 5.886 0.754 533 HB2 LEU 74 HB2 LEU 74 -3.954 6.314 2.868 534 HB3 LEU 74 HB1 LEU 74 -5.526 5.753 3.317 535 HG LEU 74 HG LEU 74 -3.568 4.221 1.660 536 HD11 LEU 74 1HD1 LEU 74 -3.378 4.266 4.194 537 HD12 LEU 74 2HD1 LEU 74 -4.677 3.213 4.293 538 HD13 LEU 74 3HD1 LEU 74 -3.297 2.709 3.409 539 HD21 LEU 74 3HD2 LEU 74 -5.033 2.416 1.638 540 HD22 LEU 74 1HD2 LEU 74 -6.385 3.176 2.357 541 HD23 LEU 74 2HD2 LEU 74 -5.978 3.821 0.844 542 H GLY 75 H GLY 75 -4.769 8.707 0.746 543 HA2 GLY 75 HA2 GLY 75 -5.221 10.902 1.231 544 HA3 GLY 75 HA1 GLY 75 -6.852 10.373 1.800 545 H ILE 76 H ILE 76 -4.448 8.729 3.642 546 HA ILE 76 HA ILE 76 -4.234 10.489 5.646 547 HB ILE 76 HB ILE 76 -5.636 8.917 7.200 548 HG12 ILE 76 2HG1 ILE 76 -7.441 8.740 4.709 549 HG13 ILE 76 1HG1 ILE 76 -6.312 7.416 5.103 550 HG21 ILE 76 1HG2 ILE 76 -7.299 10.921 5.492 551 HG22 ILE 76 2HG2 ILE 76 -7.452 10.602 7.186 552 HG23 ILE 76 3HG2 ILE 76 -6.084 11.437 6.757 553 HD11 ILE 76 HD3 ILE 76 -7.661 7.371 7.236 554 HD12 ILE 76 HD1 ILE 76 -8.660 8.700 6.674 555 HD13 ILE 76 HD2 ILE 76 -8.683 7.243 5.764 556 H LYS 77 H LYS 77 -2.576 9.466 7.149 557 HA LYS 77 HA LYS 77 -1.812 6.828 6.273 558 HB2 LYS 77 HB2 LYS 77 -0.296 6.931 8.234 559 HB3 LYS 77 HB1 LYS 77 -0.232 8.285 7.283 560 HG2 LYS 77 HG2 LYS 77 -1.246 9.621 8.729 561 HG3 LYS 77 HG1 LYS 77 -2.033 8.283 9.715 562 HD2 LYS 77 HD2 LYS 77 0.117 7.716 10.746 563 HD3 LYS 77 HD1 LYS 77 0.990 8.772 9.592 564 HE2 LYS 77 HE2 LYS 77 -0.029 10.722 10.619 565 HE3 LYS 77 HE1 LYS 77 -0.885 9.599 11.757 566 HZ1 LYS 77 HZ1 LYS 77 0.872 9.120 12.863 567 HZ2 LYS 77 HZ2 LYS 77 1.913 9.334 11.557 568 HZ3 LYS 77 HZ3 LYS 77 1.535 10.590 12.457 569 H LEU 78 H LEU 78 -2.475 4.782 6.777 570 HA LEU 78 HA LEU 78 -4.028 4.341 9.202 571 HB2 LEU 78 HB2 LEU 78 -4.915 3.895 6.249 572 HB3 LEU 78 HB1 LEU 78 -5.416 2.681 7.351 573 HG LEU 78 HG LEU 78 -6.058 5.675 7.673 574 HD11 LEU 78 1HD1 LEU 78 -7.798 3.391 6.670 575 HD12 LEU 78 2HD1 LEU 78 -8.250 5.116 6.678 576 HD13 LEU 78 3HD1 LEU 78 -7.170 4.591 5.505 577 HD21 LEU 78 3HD2 LEU 78 -7.620 5.229 9.227 578 HD22 LEU 78 1HD2 LEU 78 -7.632 3.505 9.013 579 HD23 LEU 78 2HD2 LEU 78 -6.223 4.390 9.772 580 H VAL 79 H VAL 79 -3.144 0.965 9.328 581 HA VAL 79 HA VAL 79 -5.257 2.544 10.054 582 HB VAL 79 HB VAL 79 -6.083 0.963 11.266 583 HG11 VAL 79 1HG1 VAL 79 -6.072 -0.895 9.717 584 HG12 VAL 79 2HG1 VAL 79 -5.598 0.447 8.675 585 HG13 VAL 79 3HG1 VAL 79 -4.455 -0.641 9.317 586 HG21 VAL 79 3HG2 VAL 79 -3.231 -0.302 11.558 587 HG22 VAL 79 1HG2 VAL 79 -4.056 0.379 12.750 588 HG23 VAL 79 2HG2 VAL 79 -4.779 -1.090 12.016 589 H THR 80 H THR 80 -5.953 3.209 12.234 590 HA THR 80 HA THR 80 -4.253 5.185 13.548 591 HB THR 80 HB THR 80 -6.184 5.617 14.734 592 HG1 THR 80 HG1 THR 80 -7.419 3.411 13.580 593 HG21 THR 80 1HG2 THR 80 -6.314 6.617 12.836 594 HG22 THR 80 2HG2 THR 80 -6.632 5.258 11.772 595 HG23 THR 80 3HG2 THR 80 -7.768 5.646 12.962 596 HA PRO 81 HA PRO 81 -2.522 2.551 16.753 597 HB2 PRO 81 HB1 PRO 81 -3.493 4.758 18.478 598 HB3 PRO 81 HB2 PRO 81 -1.863 3.936 18.472 599 HG2 PRO 81 HG1 PRO 81 -2.149 6.407 17.364 600 HG3 PRO 81 HG2 PRO 81 -1.134 5.216 16.537 601 HD2 PRO 81 HD1 PRO 81 -3.845 6.082 15.706 602 HD3 PRO 81 HD2 PRO 81 -2.451 5.390 14.840 603 H LEU 82 H LEU 82 -5.843 3.344 16.386 604 HA LEU 82 HA LEU 82 -6.736 1.982 18.847 605 HB2 LEU 82 HB2 LEU 82 -8.120 3.849 17.693 606 HB3 LEU 82 HB1 LEU 82 -8.222 2.659 16.367 607 HG LEU 82 HG LEU 82 -9.372 1.170 17.670 608 HD11 LEU 82 1HD1 LEU 82 -9.188 3.299 19.760 609 HD12 LEU 82 2HD1 LEU 82 -10.723 2.197 19.725 610 HD13 LEU 82 3HD1 LEU 82 -9.053 1.558 19.933 611 HD21 LEU 82 3HD2 LEU 82 -10.587 3.803 17.406 612 HD22 LEU 82 1HD2 LEU 82 -10.532 2.544 16.152 613 HD23 LEU 82 2HD2 LEU 82 -11.553 2.178 17.457 614 H GLU 83 H GLU 83 -6.324 1.296 15.417 615 HA GLU 83 HA GLU 83 -7.067 -1.539 16.012 616 HB2 GLU 83 HB2 GLU 83 -7.046 -0.126 13.379 617 HB3 GLU 83 HB1 GLU 83 -7.307 -1.850 13.667 618 HG2 GLU 83 HG2 GLU 83 -9.337 -1.185 15.095 619 HG3 GLU 83 HG1 GLU 83 -8.896 0.494 14.896 620 H ASN 84 H ASN 84 -4.138 0.026 15.796 621 HA ASN 84 HA ASN 84 -2.800 -1.870 14.341 622 HB2 ASN 84 HB2 ASN 84 -2.050 -0.053 16.596 623 HB3 ASN 84 HB1 ASN 84 -0.834 -1.183 16.102 624 HD21 ASN 84 1HD2 ASN 84 -3.032 1.440 14.667 625 HD22 ASN 84 2HD2 ASN 84 -1.676 2.062 13.702 626 H ASN 85 H ASN 85 -2.398 -4.203 14.829 627 HA ASN 85 HA ASN 85 -2.964 -5.128 17.581 628 HB2 ASN 85 HB2 ASN 85 -3.629 -6.337 15.555 629 HB3 ASN 85 HB1 ASN 85 -1.938 -6.280 14.957 630 HD21 ASN 85 1HD2 ASN 85 -4.312 -7.862 16.834 631 HD22 ASN 85 2HD2 ASN 85 -3.374 -9.166 17.543 632 H GLU 86 H GLU 86 -0.280 -3.822 15.989 633 HA GLU 86 HA GLU 86 1.790 -4.898 17.701 634 HB2 GLU 86 HB2 GLU 86 2.262 -3.812 15.687 635 HB3 GLU 86 HB1 GLU 86 1.450 -2.283 16.243 636 HG2 GLU 86 HG2 GLU 86 3.891 -2.054 16.332 637 HG3 GLU 86 HG1 GLU 86 3.326 -2.023 18.014 638 H GLU 87 H GLU 87 1.963 -4.812 19.729 639 HA GLU 87 HA GLU 87 0.354 -3.047 21.362 640 HB2 GLU 87 HB2 GLU 87 2.458 -4.993 22.208 641 HB3 GLU 87 HB1 GLU 87 1.267 -4.352 23.282 642 HG2 GLU 87 HG2 GLU 87 -0.575 -5.594 21.844 643 HG3 GLU 87 HG1 GLU 87 0.838 -6.251 21.070 644 H SER 88 H SER 88 3.282 -2.515 19.828 645 HA SER 88 HA SER 88 4.155 -0.549 21.901 646 HB2 SER 88 HB2 SER 88 6.276 -0.438 20.703 647 HB3 SER 88 HB1 SER 88 6.157 -2.001 21.248 648 HG SER 88 HG SER 88 5.391 -2.696 19.250 649 H GLU 89 H GLU 89 2.121 -0.423 19.597 650 HA GLU 89 HA GLU 89 2.635 2.442 18.917 651 HB2 GLU 89 HB2 GLU 89 1.234 0.135 17.453 652 HB3 GLU 89 HB1 GLU 89 0.740 1.842 17.304 653 HG2 GLU 89 HG2 GLU 89 3.583 0.618 16.974 654 HG3 GLU 89 HG1 GLU 89 2.363 0.674 15.720 655 H LYS 90 H LYS 90 1.277 3.955 19.290 656 HA LYS 90 HA LYS 90 -1.124 3.578 21.005 657 HB2 LYS 90 HB2 LYS 90 -0.274 4.740 22.789 658 HB3 LYS 90 HB1 LYS 90 0.617 3.211 22.507 659 HG2 LYS 90 HG2 LYS 90 2.382 4.735 21.502 660 HG3 LYS 90 HG1 LYS 90 1.500 6.107 22.237 661 HD2 LYS 90 HD2 LYS 90 1.749 4.553 24.422 662 HD3 LYS 90 HD1 LYS 90 3.067 3.794 23.537 663 HE2 LYS 90 HE2 LYS 90 3.851 6.248 22.985 664 HE3 LYS 90 HE1 LYS 90 2.814 6.769 24.280 665 HZ1 LYS 90 HZ1 LYS 90 3.748 5.545 25.848 666 HZ2 LYS 90 HZ2 LYS 90 4.915 4.932 24.823 667 HZ3 LYS 90 HZ3 LYS 90 4.921 6.494 25.141 668 H GLU 91 H GLU 91 -1.875 5.756 21.629 669 HA GLU 91 HA GLU 91 -1.783 8.046 19.721 670 HB2 GLU 91 HB2 GLU 91 -3.232 7.378 22.237 671 HB3 GLU 91 HB1 GLU 91 -3.361 8.821 21.213 672 HG2 GLU 91 HG2 GLU 91 -4.165 7.556 19.407 673 HG3 GLU 91 HG1 GLU 91 -4.107 6.037 20.395 674 H PHE 92 H PHE 92 -0.753 9.936 20.070 675 HA PHE 92 HA PHE 92 0.958 10.140 22.410 676 HB2 PHE 92 HB2 PHE 92 2.145 8.839 20.743 677 HB3 PHE 92 HB1 PHE 92 2.210 9.980 19.558 678 HD1 PHE 92 HD1 PHE 92 3.053 9.387 23.129 679 HD2 PHE 92 HD2 PHE 92 3.908 11.560 19.635 680 HE1 PHE 92 HE1 PHE 92 5.355 9.848 24.081 681 HE2 PHE 92 HE2 PHE 92 6.353 12.005 20.555 682 HZ PHE 92 HZ PHE 92 6.767 11.350 22.929 683 H ASP 93 H ASP 93 2.249 12.366 22.017 684 HA ASP 93 HA ASP 93 1.033 14.458 20.374 685 HB2 ASP 93 HB2 ASP 93 -0.276 13.891 22.609 686 HB3 ASP 93 HB1 ASP 93 1.052 14.889 23.278 687 H ASP 94 H ASP 94 2.473 16.343 20.319 688 HA ASP 94 HA ASP 94 5.086 16.359 21.203 689 HB2 ASP 94 HB2 ASP 94 3.910 17.950 19.697 690 HB3 ASP 94 HB1 ASP 94 3.122 18.743 21.084 691 H THR 95 H THR 95 2.136 16.992 23.160 692 HA THR 95 HA THR 95 3.471 17.964 25.433 693 HB THR 95 HB THR 95 0.886 16.544 25.079 694 HG1 THR 95 HG1 THR 95 0.666 18.225 23.998 695 HG21 THR 95 1HG2 THR 95 1.473 16.457 27.446 696 HG22 THR 95 2HG2 THR 95 1.683 18.317 27.350 697 HG23 THR 95 3HG2 THR 95 0.114 17.515 27.023 698 H GLY 96 H GLY 96 2.248 14.710 24.394 699 HA2 GLY 96 HA2 GLY 96 3.669 13.373 26.597 700 HA3 GLY 96 HA1 GLY 96 3.025 12.653 24.960 701 H LEU 97 H LEU 97 4.977 14.670 23.709 702 HA LEU 97 HA LEU 97 7.524 13.192 24.051 703 HB2 LEU 97 HB2 LEU 97 6.394 14.017 21.848 704 HB3 LEU 97 HB1 LEU 97 6.847 15.602 22.317 705 HG LEU 97 HG LEU 97 9.159 15.231 22.315 706 HD11 LEU 97 1HD1 LEU 97 10.250 13.338 21.407 707 HD12 LEU 97 2HD1 LEU 97 9.154 12.909 22.871 708 HD13 LEU 97 3HD1 LEU 97 8.669 12.508 21.247 709 HD21 LEU 97 3HD2 LEU 97 7.824 14.505 19.731 710 HD22 LEU 97 1HD2 LEU 97 8.003 16.131 20.431 711 HD23 LEU 97 2HD2 LEU 97 9.397 15.240 19.872 712 H THR 98 H THR 98 6.329 16.410 24.930 713 HA THR 98 HA THR 98 8.925 17.115 26.170 714 HB THR 98 HB THR 98 7.711 18.978 27.108 715 HG1 THR 98 HG1 THR 98 5.584 19.149 25.813 716 HG21 THR 98 1HG2 THR 98 7.011 18.979 24.162 717 HG22 THR 98 2HG2 THR 98 7.347 20.372 25.258 718 HG23 THR 98 3HG2 THR 98 8.624 19.324 24.734 719 H LEU 99 H LEU 99 6.095 15.283 27.240 720 HA LEU 99 HA LEU 99 7.061 15.004 29.995 721 HB2 LEU 99 HB2 LEU 99 4.824 14.711 29.440 722 HB3 LEU 99 HB1 LEU 99 5.097 13.595 28.190 723 HG LEU 99 HG LEU 99 5.760 11.845 29.928 724 HD11 LEU 99 1HD1 LEU 99 5.372 12.506 32.318 725 HD12 LEU 99 2HD1 LEU 99 6.689 13.507 31.669 726 HD13 LEU 99 3HD1 LEU 99 5.171 14.206 31.839 727 HD21 LEU 99 3HD2 LEU 99 3.545 11.677 30.953 728 HD22 LEU 99 1HD2 LEU 99 3.220 13.404 30.388 729 HD23 LEU 99 2HD2 LEU 99 3.556 11.982 29.263 730 H GLY 100 H GLY 100 7.871 13.893 26.879 731 HA2 GLY 100 HA2 GLY 100 9.741 12.453 26.133 732 HA3 GLY 100 HA1 GLY 100 10.247 12.316 27.743 733 H ASP 101 H ASP 101 6.864 11.531 27.099 734 HA ASP 101 HA ASP 101 7.288 8.857 27.757 735 HB2 ASP 101 HB2 ASP 101 5.476 10.427 28.360 736 HB3 ASP 101 HB1 ASP 101 4.748 10.529 26.827 737 H VAL 102 H VAL 102 8.579 9.254 25.843 738 HA VAL 102 HA VAL 102 7.666 7.778 23.520 739 HB VAL 102 HB VAL 102 8.560 10.209 23.585 740 HG11 VAL 102 1HG1 VAL 102 10.678 10.969 23.463 741 HG12 VAL 102 2HG1 VAL 102 10.572 10.027 24.901 742 HG13 VAL 102 3HG1 VAL 102 11.436 9.366 23.639 743 HG21 VAL 102 3HG2 VAL 102 9.530 10.046 21.370 744 HG22 VAL 102 1HG2 VAL 102 9.916 8.323 21.568 745 HG23 VAL 102 2HG2 VAL 102 8.223 8.867 21.553 746 H VAL 103 H VAL 103 9.239 6.087 22.513 747 HA VAL 103 HA VAL 103 11.137 5.205 21.903 748 HB VAL 103 HB VAL 103 11.800 7.638 22.414 749 HG11 VAL 103 1HG1 VAL 103 13.918 7.858 23.657 750 HG12 VAL 103 2HG1 VAL 103 12.849 7.024 24.840 751 HG13 VAL 103 3HG1 VAL 103 13.930 6.067 23.884 752 HG21 VAL 103 3HG2 VAL 103 13.731 5.543 21.436 753 HG22 VAL 103 1HG2 VAL 103 12.658 6.649 20.542 754 HG23 VAL 103 2HG2 VAL 103 14.088 7.245 21.403 755 H ASN 104 H ASN 104 10.559 5.010 25.252 756 HA ASN 104 HA ASN 104 12.947 3.662 25.949 757 HB2 ASN 104 HB2 ASN 104 10.152 3.120 27.003 758 HB3 ASN 104 HB1 ASN 104 11.662 2.822 27.813 759 HD21 ASN 104 1HD2 ASN 104 9.227 5.356 27.233 760 HD22 ASN 104 2HD2 ASN 104 10.156 6.620 28.038 761 H ILE 105 H ILE 105 10.292 2.410 24.058 762 HA ILE 105 HA ILE 105 10.811 -0.334 24.413 763 HB ILE 105 HB ILE 105 9.763 -0.719 22.297 764 HG12 ILE 105 2HG1 ILE 105 10.697 1.251 21.009 765 HG13 ILE 105 1HG1 ILE 105 9.040 0.675 20.738 766 HG21 ILE 105 1HG2 ILE 105 8.354 1.498 23.903 767 HG22 ILE 105 2HG2 ILE 105 7.554 0.224 22.962 768 HG23 ILE 105 3HG2 ILE 105 8.461 -0.257 24.326 769 HD11 ILE 105 HD3 ILE 105 9.196 3.117 20.621 770 HD12 ILE 105 HD1 ILE 105 8.198 2.636 22.060 771 HD13 ILE 105 HD2 ILE 105 9.889 3.123 22.296 772 H LYS 106 H LYS 106 12.811 1.975 22.517 773 HA LYS 106 HA LYS 106 13.994 -0.208 21.101 774 HB2 LYS 106 HB2 LYS 106 14.613 2.725 21.570 775 HB3 LYS 106 HB1 LYS 106 15.578 1.658 20.454 776 HG2 LYS 106 HG2 LYS 106 13.567 1.396 19.182 777 HG3 LYS 106 HG1 LYS 106 12.733 2.737 20.164 778 HD2 LYS 106 HD2 LYS 106 14.726 4.074 19.334 779 HD3 LYS 106 HD1 LYS 106 15.122 2.711 18.276 780 HE2 LYS 106 HE2 LYS 106 12.861 2.829 17.224 781 HE3 LYS 106 HE1 LYS 106 12.400 4.194 18.239 782 HZ1 LYS 106 HZ1 LYS 106 14.527 4.187 16.216 783 HZ2 LYS 106 HZ2 LYS 106 13.146 5.025 16.261 784 HZ3 LYS 106 HZ3 LYS 106 14.354 5.395 17.310 785 H GLU 107 H GLU 107 16.492 -0.451 21.316 786 HA GLU 107 HA GLU 107 17.129 -0.808 24.154 787 HB2 GLU 107 HB2 GLU 107 17.012 -2.697 22.538 788 HB3 GLU 107 HB1 GLU 107 18.277 -1.912 21.548 789 HG2 GLU 107 HG2 GLU 107 19.948 -2.274 23.397 790 HG3 GLU 107 HG1 GLU 107 18.803 -2.770 24.491 791 H GLY 108 H GLY 108 19.446 -0.505 24.904 792 HA2 GLY 108 HA2 GLY 108 20.764 1.153 25.614 793 HA3 GLY 108 HA1 GLY 108 20.916 1.512 23.813 794 H LYS 109 H LYS 109 17.794 2.322 24.532 795 HA LYS 109 HA LYS 109 18.506 5.169 24.672 796 HB2 LYS 109 HB2 LYS 109 15.858 3.740 24.830 797 HB3 LYS 109 HB1 LYS 109 15.911 5.486 24.768 798 HG2 LYS 109 HG2 LYS 109 17.030 3.858 22.425 799 HG3 LYS 109 HG1 LYS 109 15.484 4.575 22.552 800 HD2 LYS 109 HD2 LYS 109 16.378 6.786 22.699 801 HD3 LYS 109 HD1 LYS 109 18.080 6.083 22.799 802 HE2 LYS 109 HE2 LYS 109 17.873 5.201 20.593 803 HE3 LYS 109 HE1 LYS 109 16.172 5.670 20.535 804 HZ1 LYS 109 HZ1 LYS 109 17.616 7.058 19.268 805 HZ2 LYS 109 HZ2 LYS 109 17.057 7.996 20.468 806 HZ3 LYS 109 HZ3 LYS 109 18.540 7.586 20.525 807 H LYS 110 H LYS 110 18.779 2.875 27.009 808 HA LYS 110 HA LYS 110 17.532 4.534 28.963 809 HB2 LYS 110 HB2 LYS 110 17.128 2.367 29.111 810 HB3 LYS 110 HB1 LYS 110 18.864 1.907 29.198 811 HG2 LYS 110 HG2 LYS 110 17.496 1.740 31.289 812 HG3 LYS 110 HG1 LYS 110 18.910 2.712 31.593 813 HD2 LYS 110 HD2 LYS 110 17.489 4.699 31.503 814 HD3 LYS 110 HD1 LYS 110 16.252 3.810 30.594 815 HE2 LYS 110 HE2 LYS 110 17.093 3.412 33.561 816 HE3 LYS 110 HE1 LYS 110 15.630 4.304 33.038 817 HZ1 LYS 110 HZ1 LYS 110 14.917 2.176 32.132 818 HZ2 LYS 110 HZ2 LYS 110 16.004 1.454 33.092 819 HZ3 LYS 110 HZ3 LYS 110 14.878 2.345 33.776 820 H LEU 111 H LEU 111 20.813 3.778 27.901 821 HA LEU 111 HA LEU 111 22.211 5.386 29.570 822 HB2 LEU 111 HB2 LEU 111 23.056 3.635 28.341 823 HB3 LEU 111 HB1 LEU 111 22.687 4.337 26.823 824 HG LEU 111 HG LEU 111 24.311 6.069 26.910 825 HD11 LEU 111 1HD1 LEU 111 24.343 6.774 29.144 826 HD12 LEU 111 2HD1 LEU 111 24.881 5.143 29.678 827 HD13 LEU 111 3HD1 LEU 111 25.966 6.210 28.794 828 HD21 LEU 111 3HD2 LEU 111 25.297 3.313 27.837 829 HD22 LEU 111 1HD2 LEU 111 25.209 3.830 26.161 830 HD23 LEU 111 2HD2 LEU 111 26.368 4.529 27.159 831 H GLU 112 H GLU 112 20.208 5.894 26.789 832 HA GLU 112 HA GLU 112 21.024 8.723 26.325 833 HB2 GLU 112 HB2 GLU 112 20.599 6.901 24.487 834 HB3 GLU 112 HB1 GLU 112 18.938 7.331 24.857 835 HG2 GLU 112 HG2 GLU 112 19.456 9.760 24.195 836 HG3 GLU 112 HG1 GLU 112 21.090 9.137 23.727 837 H HIS 113 H HIS 113 17.664 7.687 26.670 838 HA HIS 113 HA HIS 113 16.964 10.351 27.251 839 HB2 HIS 113 HB2 HIS 113 15.841 8.542 25.802 840 HB3 HIS 113 HB1 HIS 113 15.509 7.693 27.240 841 HD2 HIS 113 HD2 HIS 113 12.952 8.235 27.944 842 HE1 HIS 113 HE1 HIS 113 12.653 12.047 26.049 843 HE2 HIS 113 HE2 HIS 113 11.333 10.017 26.999 844 H HIS 114 H HIS 114 18.480 8.518 29.437 845 HA HIS 114 HA HIS 114 16.952 9.523 31.717 846 HB2 HIS 114 HB2 HIS 114 17.748 6.685 31.086 847 HB3 HIS 114 HB1 HIS 114 17.262 7.077 32.650 848 HD2 HIS 114 HD2 HIS 114 16.015 6.483 29.250 849 HE1 HIS 114 HE1 HIS 114 12.455 7.149 31.479 850 HE2 HIS 114 HE2 HIS 114 13.265 6.203 29.341
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