NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
590186 | 2mp3 | 19962 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H ALA 1 H1 ALA 1 -19.904 -1.069 -17.579 2 HA ALA 1 HA ALA 1 -21.038 -3.344 -19.008 3 HB1 ALA 1 HB1 ALA 1 -21.688 -2.271 -20.869 4 HB2 ALA 1 HB2 ALA 1 -21.768 -0.857 -19.817 5 HB3 ALA 1 HB3 ALA 1 -20.337 -1.139 -20.810 6 H THR 2 H THR 2 -19.513 -3.212 -21.298 7 HA THR 2 HA THR 2 -16.814 -2.584 -20.991 8 HB THR 2 HB THR 2 -16.435 -4.125 -19.299 9 HG1 THR 2 HG1 THR 2 -15.573 -6.079 -20.518 10 HG21 THR 2 HG21 THR 2 -17.370 -6.534 -19.551 11 HG22 THR 2 HG22 THR 2 -18.505 -5.794 -20.681 12 HG23 THR 2 HG23 THR 2 -18.448 -5.249 -19.004 13 H LYS 3 H LYS 3 -19.132 -4.904 -22.287 14 HA LYS 3 HA LYS 3 -18.358 -4.354 -24.968 15 HB2 LYS 3 HB2 LYS 3 -17.400 -6.432 -25.613 16 HB3 LYS 3 HB3 LYS 3 -16.523 -5.904 -24.184 17 HG2 LYS 3 HG2 LYS 3 -18.819 -7.833 -24.043 18 HG3 LYS 3 HG3 LYS 3 -17.150 -8.350 -24.297 19 HD2 LYS 3 HD2 LYS 3 -17.128 -6.544 -22.130 20 HD3 LYS 3 HD3 LYS 3 -18.474 -7.653 -21.856 21 HE2 LYS 3 HE2 LYS 3 -15.708 -8.584 -22.587 22 HE3 LYS 3 HE3 LYS 3 -16.228 -8.353 -20.918 23 HZ1 LYS 3 HZ1 LYS 3 -17.971 -9.965 -22.594 24 HZ2 LYS 3 HZ2 LYS 3 -17.527 -10.175 -20.976 25 HZ3 LYS 3 HZ3 LYS 3 -16.474 -10.652 -22.211 26 H ALA 4 H ALA 4 -20.699 -4.611 -23.115 27 HA ALA 4 HA ALA 4 -22.254 -6.768 -24.281 28 HB1 ALA 4 HB1 ALA 4 -24.017 -5.316 -22.783 29 HB2 ALA 4 HB2 ALA 4 -23.049 -6.666 -22.191 30 HB3 ALA 4 HB3 ALA 4 -22.489 -5.009 -21.957 31 H VAL 5 H VAL 5 -21.684 -3.430 -24.819 32 HA VAL 5 HA VAL 5 -23.987 -3.317 -26.657 33 HB VAL 5 HB VAL 5 -22.647 -0.950 -25.348 34 HG11 VAL 5 HG11 VAL 5 -25.056 -1.270 -27.115 35 HG12 VAL 5 HG12 VAL 5 -24.812 0.155 -26.103 36 HG13 VAL 5 HG13 VAL 5 -23.640 -0.246 -27.360 37 HG21 VAL 5 HG21 VAL 5 -24.544 -2.807 -24.271 38 HG22 VAL 5 HG22 VAL 5 -23.811 -1.395 -23.507 39 HG23 VAL 5 HG23 VAL 5 -25.296 -1.220 -24.442 40 H CYS 6 H CYS 6 -20.673 -2.145 -26.127 41 HA CYS 6 HA CYS 6 -19.804 -2.760 -28.726 42 HB2 CYS 6 HB2 CYS 6 -21.399 -0.680 -28.999 43 HB3 CYS 6 HB3 CYS 6 -19.993 0.212 -28.430 44 HG CYS 6 HG CYS 6 -19.342 0.563 -30.912 45 H VAL 7 H VAL 7 -18.222 -3.588 -27.213 46 HA VAL 7 HA VAL 7 -16.379 -3.458 -25.820 47 HB VAL 7 HB VAL 7 -14.499 -2.227 -26.950 48 HG11 VAL 7 HG11 VAL 7 -15.783 -4.577 -27.640 49 HG12 VAL 7 HG12 VAL 7 -15.563 -3.744 -29.179 50 HG13 VAL 7 HG13 VAL 7 -14.171 -4.076 -28.150 51 HG21 VAL 7 HG21 VAL 7 -14.853 -1.224 -29.100 52 HG22 VAL 7 HG22 VAL 7 -16.558 -1.674 -29.082 53 HG23 VAL 7 HG23 VAL 7 -15.953 -0.466 -27.950 54 H LEU 8 H LEU 8 -18.037 -2.026 -24.447 55 HA LEU 8 HA LEU 8 -17.585 0.726 -24.175 56 HB2 LEU 8 HB2 LEU 8 -19.319 -1.037 -23.092 57 HB3 LEU 8 HB3 LEU 8 -18.239 -0.775 -21.724 58 HG LEU 8 HG LEU 8 -18.973 1.754 -22.843 59 HD11 LEU 8 HD11 LEU 8 -20.955 0.088 -23.470 60 HD12 LEU 8 HD12 LEU 8 -21.237 1.754 -22.962 61 HD13 LEU 8 HD13 LEU 8 -21.411 0.436 -21.802 62 HD21 LEU 8 HD21 LEU 8 -19.046 0.325 -20.259 63 HD22 LEU 8 HD22 LEU 8 -20.148 1.690 -20.436 64 HD23 LEU 8 HD23 LEU 8 -18.413 1.922 -20.659 65 H LYS 9 H LYS 9 -15.658 -1.946 -23.289 66 HA LYS 9 HA LYS 9 -14.148 -0.440 -21.297 67 HB2 LYS 9 HB2 LYS 9 -14.773 -2.920 -21.078 68 HB3 LYS 9 HB3 LYS 9 -13.520 -3.217 -22.276 69 HG2 LYS 9 HG2 LYS 9 -12.570 -3.580 -20.131 70 HG3 LYS 9 HG3 LYS 9 -11.904 -2.069 -20.759 71 HD2 LYS 9 HD2 LYS 9 -12.481 -1.786 -18.432 72 HD3 LYS 9 HD3 LYS 9 -13.576 -0.824 -19.426 73 HE2 LYS 9 HE2 LYS 9 -14.727 -2.034 -17.599 74 HE3 LYS 9 HE3 LYS 9 -15.311 -2.477 -19.202 75 HZ1 LYS 9 HZ1 LYS 9 -13.247 -4.053 -17.781 76 HZ2 LYS 9 HZ2 LYS 9 -14.179 -4.515 -19.115 77 HZ3 LYS 9 HZ3 LYS 9 -14.901 -4.356 -17.594 78 H GLY 10 H GLY 10 -14.204 -0.631 -24.572 79 HA2 GLY 10 HA2 GLY 10 -11.376 0.160 -24.734 80 HA3 GLY 10 HA3 GLY 10 -11.986 -1.065 -25.835 81 H ASP 11 H ASP 11 -13.323 2.026 -24.677 82 HA ASP 11 HA ASP 11 -13.295 3.010 -27.439 83 HB2 ASP 11 HB2 ASP 11 -15.670 2.454 -25.772 84 HB3 ASP 11 HB3 ASP 11 -15.669 4.015 -26.588 85 H GLY 12 H GLY 12 -11.846 3.549 -24.839 86 HA2 GLY 12 HA2 GLY 12 -10.965 5.381 -23.774 87 HA3 GLY 12 HA3 GLY 12 -11.558 6.327 -25.131 88 HA PRO 13 HA PRO 13 -15.351 6.402 -22.235 89 HB2 PRO 13 HB2 PRO 13 -15.428 4.696 -20.125 90 HB3 PRO 13 HB3 PRO 13 -16.008 4.258 -21.736 91 HG2 PRO 13 HG2 PRO 13 -13.392 3.622 -20.425 92 HG3 PRO 13 HG3 PRO 13 -14.442 2.572 -21.396 93 HD2 PRO 13 HD2 PRO 13 -12.226 3.756 -22.408 94 HD3 PRO 13 HD3 PRO 13 -13.671 3.434 -23.390 95 H VAL 14 H VAL 14 -12.759 5.265 -20.053 96 HA VAL 14 HA VAL 14 -13.168 7.594 -18.352 97 HB VAL 14 HB VAL 14 -11.611 6.525 -16.805 98 HG11 VAL 14 HG11 VAL 14 -14.077 5.329 -17.749 99 HG12 VAL 14 HG12 VAL 14 -13.016 4.145 -16.983 100 HG13 VAL 14 HG13 VAL 14 -13.509 5.591 -16.101 101 HG21 VAL 14 HG21 VAL 14 -11.128 4.001 -17.625 102 HG22 VAL 14 HG22 VAL 14 -11.041 4.856 -19.165 103 HG23 VAL 14 HG23 VAL 14 -9.992 5.335 -17.832 104 H GLN 15 H GLN 15 -11.118 6.575 -20.878 105 HA GLN 15 HA GLN 15 -8.996 8.442 -20.124 106 HB2 GLN 15 HB2 GLN 15 -8.511 6.082 -20.942 107 HB3 GLN 15 HB3 GLN 15 -9.038 6.626 -22.529 108 HG2 GLN 15 HG2 GLN 15 -6.692 6.777 -22.526 109 HG3 GLN 15 HG3 GLN 15 -7.288 8.428 -22.366 110 HE21 GLN 15 HE21 GLN 15 -4.738 7.938 -21.696 111 HE22 GLN 15 HE22 GLN 15 -4.529 8.003 -19.983 112 H GLY 16 H GLY 16 -11.136 7.730 -22.880 113 HA2 GLY 16 HA2 GLY 16 -10.386 9.998 -24.398 114 HA3 GLY 16 HA3 GLY 16 -11.848 9.048 -24.621 115 H ILE 17 H ILE 17 -12.836 9.499 -21.930 116 HA ILE 17 HA ILE 17 -14.053 12.080 -22.397 117 HB ILE 17 HB ILE 17 -14.503 10.121 -20.143 118 HG12 ILE 17 HG12 ILE 17 -16.077 10.591 -22.685 119 HG13 ILE 17 HG13 ILE 17 -15.068 9.188 -22.350 120 HG21 ILE 17 HG21 ILE 17 -15.170 12.354 -19.511 121 HG22 ILE 17 HG22 ILE 17 -16.072 12.543 -21.013 122 HG23 ILE 17 HG23 ILE 17 -16.604 11.372 -19.806 123 HD11 ILE 17 HD11 ILE 17 -16.655 9.006 -20.247 124 HD12 ILE 17 HD12 ILE 17 -17.748 9.891 -21.312 125 HD13 ILE 17 HD13 ILE 17 -17.097 8.332 -21.816 126 H ILE 18 H ILE 18 -11.539 10.765 -20.445 127 HA ILE 18 HA ILE 18 -11.548 12.630 -18.331 128 HB ILE 18 HB ILE 18 -9.810 10.520 -19.262 129 HG12 ILE 18 HG12 ILE 18 -11.062 10.551 -17.132 130 HG13 ILE 18 HG13 ILE 18 -9.337 10.306 -16.879 131 HG21 ILE 18 HG21 ILE 18 -8.241 12.258 -19.820 132 HG22 ILE 18 HG22 ILE 18 -8.479 13.028 -18.252 133 HG23 ILE 18 HG23 ILE 18 -7.701 11.449 -18.349 134 HD11 ILE 18 HD11 ILE 18 -9.296 12.025 -15.497 135 HD12 ILE 18 HD12 ILE 18 -9.861 13.091 -16.783 136 HD13 ILE 18 HD13 ILE 18 -11.025 12.265 -15.748 137 H ASN 19 H ASN 19 -10.085 12.666 -21.533 138 HA ASN 19 HA ASN 19 -8.848 15.258 -21.000 139 HB2 ASN 19 HB2 ASN 19 -8.365 13.062 -22.852 140 HB3 ASN 19 HB3 ASN 19 -8.372 14.625 -23.665 141 HD21 ASN 19 HD21 ASN 19 -6.859 12.689 -21.187 142 HD22 ASN 19 HD22 ASN 19 -5.408 13.621 -21.072 143 H PHE 20 H PHE 20 -11.592 13.868 -22.551 144 HA PHE 20 HA PHE 20 -12.120 16.139 -24.250 145 HB2 PHE 20 HB2 PHE 20 -13.473 13.540 -23.675 146 HB3 PHE 20 HB3 PHE 20 -14.428 14.843 -24.374 147 HD1 PHE 20 HD1 PHE 20 -10.878 13.941 -24.995 148 HD2 PHE 20 HD2 PHE 20 -14.833 14.164 -26.553 149 HE1 PHE 20 HE1 PHE 20 -10.028 13.359 -27.229 150 HE2 PHE 20 HE2 PHE 20 -13.989 13.581 -28.789 151 HZ PHE 20 HZ PHE 20 -11.583 13.179 -29.130 152 H GLU 21 H GLU 21 -13.203 14.919 -21.139 153 HA GLU 21 HA GLU 21 -15.220 16.982 -20.868 154 HB2 GLU 21 HB2 GLU 21 -15.413 14.612 -19.949 155 HB3 GLU 21 HB3 GLU 21 -14.260 15.102 -18.716 156 HG2 GLU 21 HG2 GLU 21 -15.774 16.794 -17.910 157 HG3 GLU 21 HG3 GLU 21 -16.910 16.439 -19.210 158 H GLN 22 H GLN 22 -11.907 16.748 -20.387 159 HA GLN 22 HA GLN 22 -11.885 18.765 -18.260 160 HB2 GLN 22 HB2 GLN 22 -9.832 16.863 -19.338 161 HB3 GLN 22 HB3 GLN 22 -9.327 18.291 -18.443 162 HG2 GLN 22 HG2 GLN 22 -10.738 17.554 -16.552 163 HG3 GLN 22 HG3 GLN 22 -11.107 16.080 -17.446 164 HE21 GLN 22 HE21 GLN 22 -10.084 15.614 -15.111 165 HE22 GLN 22 HE22 GLN 22 -8.412 15.181 -15.185 166 H LYS 23 H LYS 23 -10.912 18.210 -21.592 167 HA LYS 23 HA LYS 23 -9.647 20.794 -21.839 168 HB2 LYS 23 HB2 LYS 23 -10.308 18.640 -23.849 169 HB3 LYS 23 HB3 LYS 23 -9.516 20.152 -24.276 170 HG2 LYS 23 HG2 LYS 23 -8.430 18.192 -22.268 171 HG3 LYS 23 HG3 LYS 23 -7.973 18.228 -23.973 172 HD2 LYS 23 HD2 LYS 23 -6.558 19.917 -23.635 173 HD3 LYS 23 HD3 LYS 23 -7.780 20.852 -22.770 174 HE2 LYS 23 HE2 LYS 23 -6.770 18.607 -21.220 175 HE3 LYS 23 HE3 LYS 23 -5.501 19.738 -21.683 176 HZ1 LYS 23 HZ1 LYS 23 -7.976 20.863 -20.619 177 HZ2 LYS 23 HZ2 LYS 23 -6.379 21.386 -20.423 178 HZ3 LYS 23 HZ3 LYS 23 -6.955 20.073 -19.524 179 H GLU 24 H GLU 24 -12.726 19.317 -22.659 180 HA GLU 24 HA GLU 24 -13.642 21.631 -24.127 181 HB2 GLU 24 HB2 GLU 24 -14.309 19.078 -24.368 182 HB3 GLU 24 HB3 GLU 24 -15.514 19.516 -23.165 183 HG2 GLU 24 HG2 GLU 24 -16.299 21.317 -24.661 184 HG3 GLU 24 HG3 GLU 24 -15.150 20.764 -25.878 185 H SER 25 H SER 25 -13.141 21.126 -20.958 186 HA SER 25 HA SER 25 -15.458 22.761 -20.152 187 HB2 SER 25 HB2 SER 25 -14.077 20.479 -18.819 188 HB3 SER 25 HB3 SER 25 -14.697 21.773 -17.793 189 HG SER 25 HG SER 25 -16.669 21.367 -19.315 190 H ASN 26 H ASN 26 -12.337 23.039 -20.902 191 HA ASN 26 HA ASN 26 -11.973 25.312 -19.098 192 HB2 ASN 26 HB2 ASN 26 -10.123 22.968 -19.377 193 HB3 ASN 26 HB3 ASN 26 -9.466 24.562 -19.018 194 HD21 ASN 26 HD21 ASN 26 -11.399 21.927 -17.861 195 HD22 ASN 26 HD22 ASN 26 -11.464 22.431 -16.210 196 H GLY 27 H GLY 27 -10.962 23.569 -21.993 197 HA2 GLY 27 HA2 GLY 27 -9.238 25.468 -23.090 198 HA3 GLY 27 HA3 GLY 27 -10.184 24.313 -24.018 199 HA PRO 28 HA PRO 28 -12.616 27.556 -25.676 200 HB2 PRO 28 HB2 PRO 28 -15.059 26.392 -25.875 201 HB3 PRO 28 HB3 PRO 28 -13.704 25.966 -26.926 202 HG2 PRO 28 HG2 PRO 28 -14.726 24.560 -24.488 203 HG3 PRO 28 HG3 PRO 28 -14.202 23.875 -26.037 204 HD2 PRO 28 HD2 PRO 28 -12.617 23.892 -23.841 205 HD3 PRO 28 HD3 PRO 28 -11.967 24.019 -25.488 206 H VAL 29 H VAL 29 -12.755 26.811 -22.544 207 HA VAL 29 HA VAL 29 -15.104 28.492 -21.975 208 HB VAL 29 HB VAL 29 -13.646 26.697 -20.036 209 HG11 VAL 29 HG11 VAL 29 -16.463 27.585 -19.699 210 HG12 VAL 29 HG12 VAL 29 -15.236 27.226 -18.482 211 HG13 VAL 29 HG13 VAL 29 -15.176 28.746 -19.375 212 HG21 VAL 29 HG21 VAL 29 -14.611 24.972 -21.059 213 HG22 VAL 29 HG22 VAL 29 -16.166 25.625 -20.541 214 HG23 VAL 29 HG23 VAL 29 -15.522 26.038 -22.131 215 H LYS 30 H LYS 30 -11.720 27.946 -21.067 216 HA LYS 30 HA LYS 30 -11.668 30.592 -19.791 217 HB2 LYS 30 HB2 LYS 30 -10.114 28.082 -19.436 218 HB3 LYS 30 HB3 LYS 30 -9.261 29.597 -19.172 219 HG2 LYS 30 HG2 LYS 30 -10.396 30.065 -17.276 220 HG3 LYS 30 HG3 LYS 30 -11.891 29.328 -17.858 221 HD2 LYS 30 HD2 LYS 30 -10.082 27.216 -17.625 222 HD3 LYS 30 HD3 LYS 30 -9.810 28.210 -16.193 223 HE2 LYS 30 HE2 LYS 30 -12.468 27.127 -17.126 224 HE3 LYS 30 HE3 LYS 30 -11.508 26.496 -15.788 225 HZ1 LYS 30 HZ1 LYS 30 -13.322 27.968 -15.066 226 HZ2 LYS 30 HZ2 LYS 30 -12.614 29.249 -15.914 227 HZ3 LYS 30 HZ3 LYS 30 -11.800 28.549 -14.607 228 H VAL 31 H VAL 31 -10.052 28.612 -22.230 229 HA VAL 31 HA VAL 31 -8.104 30.550 -22.946 230 HB VAL 31 HB VAL 31 -9.159 28.382 -24.755 231 HG11 VAL 31 HG11 VAL 31 -6.920 30.246 -24.805 232 HG12 VAL 31 HG12 VAL 31 -6.433 28.568 -25.051 233 HG13 VAL 31 HG13 VAL 31 -7.638 29.303 -26.110 234 HG21 VAL 31 HG21 VAL 31 -7.140 28.166 -22.526 235 HG22 VAL 31 HG22 VAL 31 -8.685 27.323 -22.650 236 HG23 VAL 31 HG23 VAL 31 -7.380 26.945 -23.775 237 H TRP 32 H TRP 32 -11.431 30.386 -23.485 238 HA TRP 32 HA TRP 32 -11.217 32.443 -25.577 239 HB2 TRP 32 HB2 TRP 32 -12.030 30.032 -26.275 240 HB3 TRP 32 HB3 TRP 32 -13.552 30.572 -25.574 241 HD1 TRP 32 HD1 TRP 32 -11.114 32.638 -27.768 242 HE1 TRP 32 HE1 TRP 32 -12.419 33.484 -29.819 243 HE3 TRP 32 HE3 TRP 32 -15.586 30.316 -26.901 244 HZ2 TRP 32 HZ2 TRP 32 -15.002 33.205 -30.923 245 HZ3 TRP 32 HZ3 TRP 32 -17.423 30.659 -28.502 246 HH2 TRP 32 HH2 TRP 32 -17.134 32.074 -30.471 247 H GLY 33 H GLY 33 -11.456 32.839 -22.767 248 HA2 GLY 33 HA2 GLY 33 -13.565 34.704 -22.697 249 HA3 GLY 33 HA3 GLY 33 -14.084 33.238 -21.877 250 H SER 34 H SER 34 -11.571 32.516 -20.768 251 HA SER 34 HA SER 34 -11.573 34.289 -18.492 252 HB2 SER 34 HB2 SER 34 -11.430 31.871 -18.146 253 HB3 SER 34 HB3 SER 34 -9.928 31.811 -19.067 254 HG SER 34 HG SER 34 -10.378 32.611 -16.470 255 H ILE 35 H ILE 35 -8.954 33.023 -20.562 256 HA ILE 35 HA ILE 35 -6.993 34.820 -19.720 257 HB ILE 35 HB ILE 35 -7.047 33.786 -22.534 258 HG12 ILE 35 HG12 ILE 35 -6.831 32.219 -19.992 259 HG13 ILE 35 HG13 ILE 35 -7.649 31.800 -21.494 260 HG21 ILE 35 HG21 ILE 35 -4.777 33.929 -20.566 261 HG22 ILE 35 HG22 ILE 35 -4.690 33.716 -22.314 262 HG23 ILE 35 HG23 ILE 35 -5.209 35.261 -21.639 263 HD11 ILE 35 HD11 ILE 35 -5.206 31.761 -22.440 264 HD12 ILE 35 HD12 ILE 35 -4.792 31.509 -20.744 265 HD13 ILE 35 HD13 ILE 35 -5.870 30.380 -21.566 266 H LYS 36 H LYS 36 -9.746 35.376 -21.613 267 HA LYS 36 HA LYS 36 -8.642 37.951 -22.530 268 HB2 LYS 36 HB2 LYS 36 -10.313 35.934 -23.923 269 HB3 LYS 36 HB3 LYS 36 -10.723 37.622 -24.203 270 HG2 LYS 36 HG2 LYS 36 -9.238 37.305 -25.892 271 HG3 LYS 36 HG3 LYS 36 -8.125 37.819 -24.623 272 HD2 LYS 36 HD2 LYS 36 -7.996 35.266 -24.096 273 HD3 LYS 36 HD3 LYS 36 -8.596 35.090 -25.747 274 HE2 LYS 36 HE2 LYS 36 -6.701 36.073 -26.671 275 HE3 LYS 36 HE3 LYS 36 -6.249 36.853 -25.156 276 HZ1 LYS 36 HZ1 LYS 36 -6.227 34.159 -24.621 277 HZ2 LYS 36 HZ2 LYS 36 -4.879 35.158 -24.835 278 HZ3 LYS 36 HZ3 LYS 36 -5.507 34.295 -26.147 279 H GLY 37 H GLY 37 -10.365 36.817 -20.149 280 HA2 GLY 37 HA2 GLY 37 -12.076 39.183 -20.040 281 HA3 GLY 37 HA3 GLY 37 -12.869 37.620 -19.914 282 H LEU 38 H LEU 38 -11.677 36.125 -18.246 283 HA LEU 38 HA LEU 38 -11.904 37.448 -15.723 284 HB2 LEU 38 HB2 LEU 38 -11.119 34.651 -16.505 285 HB3 LEU 38 HB3 LEU 38 -11.205 35.193 -14.829 286 HG LEU 38 HG LEU 38 -13.581 35.380 -16.654 287 HD11 LEU 38 HD11 LEU 38 -14.316 33.223 -15.971 288 HD12 LEU 38 HD12 LEU 38 -12.945 33.035 -14.877 289 HD13 LEU 38 HD13 LEU 38 -12.686 33.042 -16.621 290 HD21 LEU 38 HD21 LEU 38 -14.685 35.047 -14.358 291 HD22 LEU 38 HD22 LEU 38 -13.946 36.610 -14.709 292 HD23 LEU 38 HD23 LEU 38 -13.099 35.439 -13.697 293 H THR 39 H THR 39 -9.213 35.698 -17.280 294 HA THR 39 HA THR 39 -7.306 36.690 -15.373 295 HB THR 39 HB THR 39 -6.068 35.677 -17.775 296 HG1 THR 39 HG1 THR 39 -8.212 34.170 -16.665 297 HG21 THR 39 HG21 THR 39 -4.832 34.474 -16.286 298 HG22 THR 39 HG22 THR 39 -6.229 34.064 -15.290 299 HG23 THR 39 HG23 THR 39 -5.495 35.663 -15.165 300 H GLU 40 H GLU 40 -8.623 37.819 -18.324 301 HA GLU 40 HA GLU 40 -6.367 39.593 -18.856 302 HB2 GLU 40 HB2 GLU 40 -7.124 38.787 -20.882 303 HB3 GLU 40 HB3 GLU 40 -8.804 38.761 -20.365 304 HG2 GLU 40 HG2 GLU 40 -7.425 41.381 -20.664 305 HG3 GLU 40 HG3 GLU 40 -7.955 40.517 -22.106 306 H GLY 41 H GLY 41 -9.536 39.618 -17.463 307 HA2 GLY 41 HA2 GLY 41 -9.574 42.557 -17.426 308 HA3 GLY 41 HA3 GLY 41 -10.940 41.510 -17.071 309 H LEU 42 H LEU 42 -9.686 39.767 -15.251 310 HA LEU 42 HA LEU 42 -9.597 41.516 -12.925 311 HB2 LEU 42 HB2 LEU 42 -9.393 38.546 -12.760 312 HB3 LEU 42 HB3 LEU 42 -10.145 39.681 -11.642 313 HG LEU 42 HG LEU 42 -11.299 39.047 -14.349 314 HD11 LEU 42 HD11 LEU 42 -11.368 36.960 -13.330 315 HD12 LEU 42 HD12 LEU 42 -12.928 37.668 -12.914 316 HD13 LEU 42 HD13 LEU 42 -11.627 37.643 -11.724 317 HD21 LEU 42 HD21 LEU 42 -13.212 40.144 -13.619 318 HD22 LEU 42 HD22 LEU 42 -11.908 41.151 -12.989 319 HD23 LEU 42 HD23 LEU 42 -12.751 40.029 -11.920 320 H HIS 43 H HIS 43 -7.500 39.542 -14.849 321 HA HIS 43 HA HIS 43 -5.291 40.118 -12.985 322 HB2 HIS 43 HB2 HIS 43 -6.184 37.606 -13.817 323 HB3 HIS 43 HB3 HIS 43 -4.745 37.908 -14.786 324 HD1 HIS 43 HD1 HIS 43 -5.551 36.227 -11.878 325 HD2 HIS 43 HD2 HIS 43 -2.651 39.070 -12.751 326 HE1 HIS 43 HE1 HIS 43 -3.786 35.952 -10.108 327 H GLY 44 H GLY 44 -6.598 40.790 -15.960 328 HA2 GLY 44 HA2 GLY 44 -3.951 41.371 -17.135 329 HA3 GLY 44 HA3 GLY 44 -5.409 41.079 -18.073 330 H PHE 45 H PHE 45 -6.913 42.756 -16.029 331 HA PHE 45 HA PHE 45 -6.022 45.386 -17.014 332 HB2 PHE 45 HB2 PHE 45 -8.030 45.017 -18.161 333 HB3 PHE 45 HB3 PHE 45 -8.779 44.218 -16.783 334 HD1 PHE 45 HD1 PHE 45 -9.663 45.531 -14.916 335 HD2 PHE 45 HD2 PHE 45 -8.053 47.394 -18.389 336 HE1 PHE 45 HE1 PHE 45 -10.739 47.648 -14.275 337 HE2 PHE 45 HE2 PHE 45 -9.126 49.515 -17.752 338 HZ PHE 45 HZ PHE 45 -10.472 49.644 -15.693 339 H HIS 46 H HIS 46 -7.043 43.470 -14.333 340 HA HIS 46 HA HIS 46 -7.227 45.804 -12.578 341 HB2 HIS 46 HB2 HIS 46 -8.986 44.383 -12.059 342 HB3 HIS 46 HB3 HIS 46 -8.031 42.930 -12.340 343 HD1 HIS 46 HD1 HIS 46 -8.065 41.740 -10.164 344 HD2 HIS 46 HD2 HIS 46 -7.296 45.798 -9.710 345 HE1 HIS 46 HE1 HIS 46 -7.563 42.061 -7.720 346 H VAL 47 H VAL 47 -5.695 42.585 -12.374 347 HA VAL 47 HA VAL 47 -3.792 43.433 -10.434 348 HB VAL 47 HB VAL 47 -3.702 40.977 -12.192 349 HG11 VAL 47 HG11 VAL 47 -1.561 41.403 -11.189 350 HG12 VAL 47 HG12 VAL 47 -2.304 41.663 -9.609 351 HG13 VAL 47 HG13 VAL 47 -2.323 40.058 -10.342 352 HG21 VAL 47 HG21 VAL 47 -4.501 40.471 -9.489 353 HG22 VAL 47 HG22 VAL 47 -5.571 41.676 -10.208 354 HG23 VAL 47 HG23 VAL 47 -5.357 40.110 -10.989 355 H HIS 48 H HIS 48 -3.306 42.322 -13.792 356 HA HIS 48 HA HIS 48 -0.642 43.283 -13.932 357 HB2 HIS 48 HB2 HIS 48 -2.622 42.259 -15.937 358 HB3 HIS 48 HB3 HIS 48 -1.126 43.004 -16.491 359 HD1 HIS 48 HD1 HIS 48 -0.960 40.381 -17.416 360 HD2 HIS 48 HD2 HIS 48 -0.296 41.088 -13.375 361 HE1 HIS 48 HE1 HIS 48 0.292 38.367 -16.577 362 H GLU 49 H GLU 49 -3.717 44.764 -14.391 363 HA GLU 49 HA GLU 49 -4.374 46.850 -15.027 364 HB2 GLU 49 HB2 GLU 49 -2.421 47.175 -13.207 365 HB3 GLU 49 HB3 GLU 49 -1.678 47.999 -14.572 366 HG2 GLU 49 HG2 GLU 49 -4.466 48.741 -14.106 367 HG3 GLU 49 HG3 GLU 49 -3.377 49.137 -12.778 368 H PHE 50 H PHE 50 -3.496 45.202 -17.119 369 HA PHE 50 HA PHE 50 -2.963 45.273 -19.329 370 HB2 PHE 50 HB2 PHE 50 -4.257 47.667 -18.772 371 HB3 PHE 50 HB3 PHE 50 -2.805 48.167 -19.633 372 HD1 PHE 50 HD1 PHE 50 -5.731 45.897 -19.851 373 HD2 PHE 50 HD2 PHE 50 -2.682 47.997 -21.952 374 HE1 PHE 50 HE1 PHE 50 -6.801 45.307 -21.986 375 HE2 PHE 50 HE2 PHE 50 -3.747 47.411 -24.091 376 HZ PHE 50 HZ PHE 50 -5.810 46.065 -24.110 377 H GLY 51 H GLY 51 -0.874 45.597 -17.170 378 HA2 GLY 51 HA2 GLY 51 1.377 45.765 -18.884 379 HA3 GLY 51 HA3 GLY 51 1.208 47.259 -17.974 380 H ASP 52 H ASP 52 1.530 47.254 -15.738 381 HA ASP 52 HA ASP 52 2.261 44.777 -14.420 382 HB2 ASP 52 HB2 ASP 52 4.238 46.878 -15.186 383 HB3 ASP 52 HB3 ASP 52 4.435 46.076 -13.630 384 H ASN 53 H ASN 53 0.127 45.911 -13.627 385 HA ASN 53 HA ASN 53 -0.948 46.746 -11.800 386 HB2 ASN 53 HB2 ASN 53 1.779 47.215 -10.584 387 HB3 ASN 53 HB3 ASN 53 0.243 47.051 -9.738 388 HD21 ASN 53 HD21 ASN 53 -0.129 45.155 -8.864 389 HD22 ASN 53 HD22 ASN 53 0.561 43.650 -9.360 390 H THR 54 H THR 54 2.032 48.689 -11.724 391 HA THR 54 HA THR 54 0.732 50.979 -12.881 392 HB THR 54 HB THR 54 1.740 51.917 -10.356 393 HG1 THR 54 HG1 THR 54 -0.524 50.244 -10.053 394 HG21 THR 54 HG21 THR 54 0.175 53.087 -11.893 395 HG22 THR 54 HG22 THR 54 -0.417 52.998 -10.234 396 HG23 THR 54 HG23 THR 54 -1.069 51.914 -11.462 397 H ALA 55 H ALA 55 3.189 49.240 -13.079 398 HA ALA 55 HA ALA 55 5.431 49.433 -13.470 399 HB1 ALA 55 HB1 ALA 55 4.716 52.258 -14.234 400 HB2 ALA 55 HB2 ALA 55 6.080 51.302 -14.817 401 HB3 ALA 55 HB3 ALA 55 4.433 50.851 -15.259 402 H GLY 56 H GLY 56 4.561 50.039 -10.760 403 HA2 GLY 56 HA2 GLY 56 6.796 51.805 -9.980 404 HA3 GLY 56 HA3 GLY 56 5.233 51.894 -9.183 405 H CYS 57 H CYS 57 4.838 48.996 -9.228 406 HA CYS 57 HA CYS 57 6.934 48.130 -7.358 407 HB2 CYS 57 HB2 CYS 57 3.982 47.642 -6.934 408 HB3 CYS 57 HB3 CYS 57 5.294 47.227 -5.838 409 HG CYS 57 HG CYS 57 4.909 49.337 -4.436 410 H THR 58 H THR 58 6.260 47.551 -10.216 411 HA THR 58 HA THR 58 6.699 44.732 -10.115 412 HB THR 58 HB THR 58 4.378 45.001 -11.806 413 HG1 THR 58 HG1 THR 58 3.831 46.603 -10.181 414 HG21 THR 58 HG21 THR 58 5.189 43.304 -9.463 415 HG22 THR 58 HG22 THR 58 5.033 42.845 -11.159 416 HG23 THR 58 HG23 THR 58 3.590 43.162 -10.194 417 H SER 59 H SER 59 7.737 47.287 -11.277 418 HA SER 59 HA SER 59 8.615 46.246 -13.757 419 HB2 SER 59 HB2 SER 59 6.116 47.488 -13.916 420 HB3 SER 59 HB3 SER 59 7.254 48.699 -14.505 421 HG SER 59 HG SER 59 6.736 47.471 -16.250 422 H ALA 60 H ALA 60 8.127 49.063 -11.710 423 HA ALA 60 HA ALA 60 10.875 49.899 -12.313 424 HB1 ALA 60 HB1 ALA 60 10.340 51.981 -12.976 425 HB2 ALA 60 HB2 ALA 60 8.784 51.251 -13.371 426 HB3 ALA 60 HB3 ALA 60 8.994 52.108 -11.843 427 H GLY 61 H GLY 61 9.815 48.416 -10.083 428 HA2 GLY 61 HA2 GLY 61 9.673 50.301 -7.872 429 HA3 GLY 61 HA3 GLY 61 9.515 48.554 -7.767 430 HA PRO 62 HA PRO 62 13.658 49.757 -6.061 431 HB2 PRO 62 HB2 PRO 62 13.446 48.227 -3.827 432 HB3 PRO 62 HB3 PRO 62 12.830 49.881 -3.922 433 HG2 PRO 62 HG2 PRO 62 11.356 47.291 -4.201 434 HG3 PRO 62 HG3 PRO 62 10.885 48.756 -3.320 435 HD2 PRO 62 HD2 PRO 62 9.899 48.148 -5.768 436 HD3 PRO 62 HD3 PRO 62 10.155 49.821 -5.230 437 H HIS 63 H HIS 63 14.247 48.446 -8.002 438 HA HIS 63 HA HIS 63 15.838 46.257 -7.303 439 HB2 HIS 63 HB2 HIS 63 14.557 44.493 -8.632 440 HB3 HIS 63 HB3 HIS 63 13.923 44.896 -7.040 441 HD1 HIS 63 HD1 HIS 63 11.599 45.914 -6.925 442 HD2 HIS 63 HD2 HIS 63 12.988 45.438 -10.812 443 HE1 HIS 63 HE1 HIS 63 9.613 46.347 -8.407 444 H PHE 64 H PHE 64 17.401 46.135 -8.780 445 HA PHE 64 HA PHE 64 16.990 47.483 -11.341 446 HB2 PHE 64 HB2 PHE 64 19.416 46.712 -9.750 447 HB3 PHE 64 HB3 PHE 64 19.561 47.086 -11.464 448 HD1 PHE 64 HD1 PHE 64 18.111 49.330 -12.071 449 HD2 PHE 64 HD2 PHE 64 19.968 48.428 -8.350 450 HE1 PHE 64 HE1 PHE 64 18.204 51.731 -11.542 451 HE2 PHE 64 HE2 PHE 64 20.066 50.828 -7.813 452 HZ PHE 64 HZ PHE 64 19.182 52.482 -9.409 453 H ASN 65 H ASN 65 16.230 44.603 -10.455 454 HA ASN 65 HA ASN 65 16.707 43.413 -13.014 455 HB2 ASN 65 HB2 ASN 65 17.881 41.390 -12.094 456 HB3 ASN 65 HB3 ASN 65 18.854 42.859 -12.092 457 HD21 ASN 65 HD21 ASN 65 17.980 40.241 -10.320 458 HD22 ASN 65 HD22 ASN 65 18.328 40.834 -8.735 459 HA PRO 66 HA PRO 66 12.841 42.100 -10.871 460 HB2 PRO 66 HB2 PRO 66 11.277 42.366 -13.074 461 HB3 PRO 66 HB3 PRO 66 11.647 43.713 -11.990 462 HG2 PRO 66 HG2 PRO 66 12.892 42.997 -14.617 463 HG3 PRO 66 HG3 PRO 66 12.411 44.590 -14.003 464 HD2 PRO 66 HD2 PRO 66 14.978 43.727 -13.965 465 HD3 PRO 66 HD3 PRO 66 14.317 44.812 -12.725 466 H LEU 67 H LEU 67 13.621 41.310 -14.267 467 HA LEU 67 HA LEU 67 13.654 38.483 -13.625 468 HB2 LEU 67 HB2 LEU 67 11.274 39.070 -14.116 469 HB3 LEU 67 HB3 LEU 67 11.782 39.528 -15.740 470 HG LEU 67 HG LEU 67 12.707 37.051 -15.766 471 HD11 LEU 67 HD11 LEU 67 10.354 36.808 -13.905 472 HD12 LEU 67 HD12 LEU 67 12.035 36.692 -13.386 473 HD13 LEU 67 HD13 LEU 67 11.380 35.513 -14.522 474 HD21 LEU 67 HD21 LEU 67 9.772 37.151 -16.069 475 HD22 LEU 67 HD22 LEU 67 11.015 36.617 -17.201 476 HD23 LEU 67 HD23 LEU 67 10.696 38.340 -16.986 477 H SER 68 H SER 68 15.719 40.175 -14.409 478 HA SER 68 HA SER 68 17.334 40.526 -15.996 479 HB2 SER 68 HB2 SER 68 17.537 38.076 -15.332 480 HB3 SER 68 HB3 SER 68 16.692 37.696 -16.832 481 HG SER 68 HG SER 68 18.523 37.923 -17.810 482 H ARG 69 H ARG 69 14.926 41.559 -16.857 483 HA ARG 69 HA ARG 69 15.342 41.877 -19.598 484 HB2 ARG 69 HB2 ARG 69 13.341 40.721 -20.500 485 HB3 ARG 69 HB3 ARG 69 14.551 39.611 -19.871 486 HG2 ARG 69 HG2 ARG 69 13.040 38.688 -18.551 487 HG3 ARG 69 HG3 ARG 69 12.746 40.244 -17.771 488 HD2 ARG 69 HD2 ARG 69 10.691 39.284 -18.703 489 HD3 ARG 69 HD3 ARG 69 11.112 40.814 -19.473 490 HE ARG 69 HE ARG 69 11.274 39.697 -21.452 491 HH11 ARG 69 HH11 ARG 69 11.627 37.403 -18.857 492 HH12 ARG 69 HH12 ARG 69 11.680 36.026 -19.908 493 HH21 ARG 69 HH21 ARG 69 11.342 37.893 -22.845 494 HH22 ARG 69 HH22 ARG 69 11.518 36.307 -22.176 495 H LYS 70 H LYS 70 13.152 41.978 -16.880 496 HA LYS 70 HA LYS 70 11.815 43.661 -16.109 497 HB2 LYS 70 HB2 LYS 70 13.584 44.991 -17.882 498 HB3 LYS 70 HB3 LYS 70 11.967 45.603 -18.210 499 HG2 LYS 70 HG2 LYS 70 12.540 47.044 -16.568 500 HG3 LYS 70 HG3 LYS 70 11.914 45.742 -15.553 501 HD2 LYS 70 HD2 LYS 70 13.970 46.315 -14.583 502 HD3 LYS 70 HD3 LYS 70 14.311 44.857 -15.517 503 HE2 LYS 70 HE2 LYS 70 15.786 45.929 -16.795 504 HE3 LYS 70 HE3 LYS 70 14.646 47.232 -17.125 505 HZ1 LYS 70 HZ1 LYS 70 15.445 48.490 -15.419 506 HZ2 LYS 70 HZ2 LYS 70 16.865 47.671 -15.838 507 HZ3 LYS 70 HZ3 LYS 70 15.957 47.160 -14.505 508 H HIS 71 H HIS 71 10.578 41.648 -17.312 509 HA HIS 71 HA HIS 71 8.674 40.988 -18.373 510 HB2 HIS 71 HB2 HIS 71 8.022 43.169 -16.901 511 HB3 HIS 71 HB3 HIS 71 7.544 43.718 -18.504 512 HD1 HIS 71 HD1 HIS 71 5.436 42.729 -19.498 513 HD2 HIS 71 HD2 HIS 71 6.580 40.893 -15.951 514 HE1 HIS 71 HE1 HIS 71 3.506 41.251 -18.852 515 H GLY 72 H GLY 72 9.206 40.385 -20.404 516 HA2 GLY 72 HA2 GLY 72 8.862 40.563 -22.717 517 HA3 GLY 72 HA3 GLY 72 8.660 42.299 -22.532 518 H GLY 73 H GLY 73 11.037 42.869 -21.132 519 HA2 GLY 73 HA2 GLY 73 13.445 42.425 -21.467 520 HA3 GLY 73 HA3 GLY 73 13.068 42.167 -23.163 521 HA PRO 74 HA PRO 74 13.905 46.371 -24.052 522 HB2 PRO 74 HB2 PRO 74 12.083 46.922 -25.988 523 HB3 PRO 74 HB3 PRO 74 13.488 45.885 -26.258 524 HG2 PRO 74 HG2 PRO 74 10.651 45.119 -25.689 525 HG3 PRO 74 HG3 PRO 74 11.783 44.423 -26.863 526 HD2 PRO 74 HD2 PRO 74 11.268 43.263 -24.471 527 HD3 PRO 74 HD3 PRO 74 12.850 43.149 -25.266 528 H LYS 75 H LYS 75 12.470 48.490 -24.685 529 HA LYS 75 HA LYS 75 11.118 50.148 -23.910 530 HB2 LYS 75 HB2 LYS 75 9.495 47.931 -24.031 531 HB3 LYS 75 HB3 LYS 75 9.293 48.452 -22.363 532 HG2 LYS 75 HG2 LYS 75 7.615 49.604 -23.427 533 HG3 LYS 75 HG3 LYS 75 8.917 50.797 -23.416 534 HD2 LYS 75 HD2 LYS 75 8.272 50.940 -25.607 535 HD3 LYS 75 HD3 LYS 75 9.494 49.673 -25.736 536 HE2 LYS 75 HE2 LYS 75 7.970 48.274 -26.542 537 HE3 LYS 75 HE3 LYS 75 7.014 48.453 -25.072 538 HZ1 LYS 75 HZ1 LYS 75 6.439 49.394 -27.652 539 HZ2 LYS 75 HZ2 LYS 75 6.614 50.730 -26.631 540 HZ3 LYS 75 HZ3 LYS 75 5.496 49.519 -26.253 541 H ASP 76 H ASP 76 10.701 51.387 -22.020 542 HA ASP 76 HA ASP 76 11.285 52.209 -19.978 543 HB2 ASP 76 HB2 ASP 76 10.739 49.321 -19.284 544 HB3 ASP 76 HB3 ASP 76 11.072 50.552 -18.068 545 H GLU 77 H GLU 77 13.426 51.316 -21.725 546 HA GLU 77 HA GLU 77 15.590 51.527 -19.915 547 HB2 GLU 77 HB2 GLU 77 16.629 49.368 -20.181 548 HB3 GLU 77 HB3 GLU 77 15.006 49.141 -19.544 549 HG2 GLU 77 HG2 GLU 77 14.233 48.626 -21.842 550 HG3 GLU 77 HG3 GLU 77 15.908 48.718 -22.382 551 H GLU 78 H GLU 78 14.536 50.477 -23.121 552 HA GLU 78 HA GLU 78 16.984 51.616 -24.277 553 HB2 GLU 78 HB2 GLU 78 15.088 49.489 -25.111 554 HB3 GLU 78 HB3 GLU 78 15.798 50.463 -26.392 555 HG2 GLU 78 HG2 GLU 78 17.707 49.482 -24.398 556 HG3 GLU 78 HG3 GLU 78 16.912 48.227 -25.348 557 H ARG 79 H ARG 79 13.493 51.472 -25.009 558 HA ARG 79 HA ARG 79 13.686 53.889 -26.597 559 HB2 ARG 79 HB2 ARG 79 12.171 51.760 -26.969 560 HB3 ARG 79 HB3 ARG 79 11.076 52.616 -25.892 561 HG2 ARG 79 HG2 ARG 79 10.344 53.814 -27.597 562 HG3 ARG 79 HG3 ARG 79 11.968 54.460 -27.841 563 HD2 ARG 79 HD2 ARG 79 12.303 52.091 -29.004 564 HD3 ARG 79 HD3 ARG 79 10.563 52.254 -29.239 565 HE ARG 79 HE ARG 79 11.495 54.625 -30.106 566 HH11 ARG 79 HH11 ARG 79 12.398 51.338 -30.808 567 HH12 ARG 79 HH12 ARG 79 12.915 51.687 -32.425 568 HH21 ARG 79 HH21 ARG 79 12.172 55.098 -32.232 569 HH22 ARG 79 HH22 ARG 79 12.787 53.826 -33.233 570 H HIS 80 H HIS 80 13.692 53.435 -23.420 571 HA HIS 80 HA HIS 80 11.756 55.534 -22.766 572 HB2 HIS 80 HB2 HIS 80 12.147 53.230 -21.489 573 HB3 HIS 80 HB3 HIS 80 13.374 54.182 -20.659 574 HD1 HIS 80 HD1 HIS 80 12.111 54.197 -18.433 575 HD2 HIS 80 HD2 HIS 80 9.946 55.812 -21.589 576 HE1 HIS 80 HE1 HIS 80 10.129 55.331 -17.378 577 H VAL 81 H VAL 81 15.138 54.958 -23.095 578 HA VAL 81 HA VAL 81 15.750 57.728 -22.810 579 HB VAL 81 HB VAL 81 17.555 57.062 -20.962 580 HG11 VAL 81 HG11 VAL 81 15.051 57.598 -19.611 581 HG12 VAL 81 HG12 VAL 81 16.472 58.626 -19.802 582 HG13 VAL 81 HG13 VAL 81 15.238 58.584 -21.061 583 HG21 VAL 81 HG21 VAL 81 16.904 55.455 -19.439 584 HG22 VAL 81 HG22 VAL 81 15.214 55.512 -19.939 585 HG23 VAL 81 HG23 VAL 81 16.411 54.718 -20.963 586 H GLY 82 H GLY 82 16.097 55.738 -24.806 587 HA2 GLY 82 HA2 GLY 82 18.607 54.552 -24.928 588 HA3 GLY 82 HA3 GLY 82 17.683 55.078 -26.327 589 H ASP 83 H ASP 83 17.789 57.888 -25.111 590 HA ASP 83 HA ASP 83 19.062 59.764 -25.307 591 HB2 ASP 83 HB2 ASP 83 21.545 58.068 -25.330 592 HB3 ASP 83 HB3 ASP 83 21.326 59.695 -24.690 593 H LEU 84 H LEU 84 18.076 58.507 -27.635 594 HA LEU 84 HA LEU 84 19.595 59.849 -29.616 595 HB2 LEU 84 HB2 LEU 84 20.549 58.120 -30.830 596 HB3 LEU 84 HB3 LEU 84 20.897 57.687 -29.157 597 HG LEU 84 HG LEU 84 18.858 56.451 -30.995 598 HD11 LEU 84 HD11 LEU 84 21.165 55.224 -29.497 599 HD12 LEU 84 HD12 LEU 84 21.235 55.738 -31.183 600 HD13 LEU 84 HD13 LEU 84 20.132 54.449 -30.699 601 HD21 LEU 84 HD21 LEU 84 18.207 55.034 -29.123 602 HD22 LEU 84 HD22 LEU 84 17.878 56.731 -28.769 603 HD23 LEU 84 HD23 LEU 84 19.281 55.935 -28.053 604 H GLY 85 H GLY 85 16.851 59.546 -28.593 605 HA2 GLY 85 HA2 GLY 85 15.376 59.919 -30.867 606 HA3 GLY 85 HA3 GLY 85 15.324 58.183 -30.604 607 H ASN 86 H ASN 86 15.597 59.094 -27.595 608 HA ASN 86 HA ASN 86 12.695 59.425 -27.230 609 HB2 ASN 86 HB2 ASN 86 14.063 57.355 -26.329 610 HB3 ASN 86 HB3 ASN 86 14.480 58.466 -25.029 611 HD21 ASN 86 HD21 ASN 86 11.515 57.910 -26.894 612 HD22 ASN 86 HD22 ASN 86 10.501 57.635 -25.522 613 H VAL 87 H VAL 87 15.818 60.738 -26.527 614 HA VAL 87 HA VAL 87 14.551 62.850 -24.904 615 HB VAL 87 HB VAL 87 16.250 61.374 -23.722 616 HG11 VAL 87 HG11 VAL 87 17.775 61.443 -25.805 617 HG12 VAL 87 HG12 VAL 87 18.323 62.990 -25.155 618 HG13 VAL 87 HG13 VAL 87 18.518 61.516 -24.206 619 HG21 VAL 87 HG21 VAL 87 15.866 64.205 -23.679 620 HG22 VAL 87 HG22 VAL 87 16.231 63.114 -22.342 621 HG23 VAL 87 HG23 VAL 87 17.543 63.839 -23.273 622 H THR 88 H THR 88 15.304 62.412 -27.900 623 HA THR 88 HA THR 88 16.338 65.131 -28.260 624 HB THR 88 HB THR 88 18.340 64.096 -28.710 625 HG1 THR 88 HG1 THR 88 18.260 63.653 -31.149 626 HG21 THR 88 HG21 THR 88 17.683 61.815 -28.321 627 HG22 THR 88 HG22 THR 88 18.528 61.891 -29.868 628 HG23 THR 88 HG23 THR 88 16.769 61.774 -29.828 629 H ALA 89 H ALA 89 14.842 62.289 -29.747 630 HA ALA 89 HA ALA 89 14.038 63.364 -32.165 631 HB1 ALA 89 HB1 ALA 89 13.777 60.965 -31.141 632 HB2 ALA 89 HB2 ALA 89 12.170 61.554 -30.710 633 HB3 ALA 89 HB3 ALA 89 12.678 61.532 -32.399 634 H ASP 90 H ASP 90 12.619 63.748 -28.977 635 HA ASP 90 HA ASP 90 10.560 65.505 -30.136 636 HB2 ASP 90 HB2 ASP 90 9.499 65.185 -27.792 637 HB3 ASP 90 HB3 ASP 90 9.401 63.860 -28.948 638 H LYS 91 H LYS 91 13.513 65.727 -28.875 639 HA LYS 91 HA LYS 91 12.913 68.228 -27.434 640 HB2 LYS 91 HB2 LYS 91 13.817 66.664 -25.860 641 HB3 LYS 91 HB3 LYS 91 15.110 66.213 -26.963 642 HG2 LYS 91 HG2 LYS 91 15.904 67.652 -25.156 643 HG3 LYS 91 HG3 LYS 91 16.110 68.409 -26.737 644 HD2 LYS 91 HD2 LYS 91 14.287 69.868 -26.384 645 HD3 LYS 91 HD3 LYS 91 13.715 68.941 -24.994 646 HE2 LYS 91 HE2 LYS 91 15.515 69.674 -23.647 647 HE3 LYS 91 HE3 LYS 91 16.390 70.316 -25.036 648 HZ1 LYS 91 HZ1 LYS 91 15.457 72.259 -24.579 649 HZ2 LYS 91 HZ2 LYS 91 14.442 71.583 -23.406 650 HZ3 LYS 91 HZ3 LYS 91 13.960 71.611 -25.028 651 H ASP 92 H ASP 92 15.938 66.840 -28.667 652 HA ASP 92 HA ASP 92 17.094 69.178 -29.520 653 HB2 ASP 92 HB2 ASP 92 17.380 66.465 -30.829 654 HB3 ASP 92 HB3 ASP 92 18.509 67.809 -30.981 655 H GLY 93 H GLY 93 14.842 67.100 -31.277 656 HA2 GLY 93 HA2 GLY 93 14.992 68.165 -33.815 657 HA3 GLY 93 HA3 GLY 93 13.512 67.544 -33.098 658 H VAL 94 H VAL 94 13.937 69.742 -30.966 659 HA VAL 94 HA VAL 94 12.962 71.997 -32.592 660 HB VAL 94 HB VAL 94 11.248 70.617 -31.120 661 HG11 VAL 94 HG11 VAL 94 12.062 72.681 -29.107 662 HG12 VAL 94 HG12 VAL 94 11.034 71.262 -28.895 663 HG13 VAL 94 HG13 VAL 94 12.776 71.070 -29.093 664 HG21 VAL 94 HG21 VAL 94 10.274 72.334 -32.250 665 HG22 VAL 94 HG22 VAL 94 10.180 73.001 -30.620 666 HG23 VAL 94 HG23 VAL 94 11.467 73.515 -31.711 667 H ALA 95 H ALA 95 14.867 70.865 -29.939 668 HA ALA 95 HA ALA 95 15.645 73.631 -29.288 669 HB1 ALA 95 HB1 ALA 95 15.988 71.155 -27.599 670 HB2 ALA 95 HB2 ALA 95 16.383 72.810 -27.132 671 HB3 ALA 95 HB3 ALA 95 14.703 72.350 -27.410 672 H ASP 96 H ASP 96 16.648 72.138 -31.560 673 HA ASP 96 HA ASP 96 19.381 72.708 -31.343 674 HB2 ASP 96 HB2 ASP 96 18.588 70.014 -30.500 675 HB3 ASP 96 HB3 ASP 96 19.832 70.025 -31.747 676 H VAL 97 H VAL 97 16.757 71.076 -32.921 677 HA VAL 97 HA VAL 97 18.170 71.327 -35.497 678 HB VAL 97 HB VAL 97 15.833 69.491 -35.026 679 HG11 VAL 97 HG11 VAL 97 16.021 69.254 -37.230 680 HG12 VAL 97 HG12 VAL 97 17.511 70.200 -37.266 681 HG13 VAL 97 HG13 VAL 97 17.574 68.466 -36.946 682 HG21 VAL 97 HG21 VAL 97 17.448 67.658 -34.749 683 HG22 VAL 97 HG22 VAL 97 18.764 68.831 -34.732 684 HG23 VAL 97 HG23 VAL 97 17.558 68.839 -33.445 685 H SER 98 H SER 98 16.443 73.256 -33.936 686 HA SER 98 HA SER 98 14.698 73.964 -36.177 687 HB2 SER 98 HB2 SER 98 13.313 72.762 -34.487 688 HB3 SER 98 HB3 SER 98 13.755 73.988 -33.300 689 HG SER 98 HG SER 98 11.701 74.170 -34.684 690 H ILE 99 H ILE 99 16.118 74.939 -33.084 691 HA ILE 99 HA ILE 99 15.643 77.679 -33.239 692 HB ILE 99 HB ILE 99 18.082 76.361 -32.041 693 HG12 ILE 99 HG12 ILE 99 15.375 76.937 -30.815 694 HG13 ILE 99 HG13 ILE 99 16.020 75.344 -31.192 695 HG21 ILE 99 HG21 ILE 99 18.199 78.311 -30.615 696 HG22 ILE 99 HG22 ILE 99 18.226 78.807 -32.307 697 HG23 ILE 99 HG23 ILE 99 16.747 78.978 -31.362 698 HD11 ILE 99 HD11 ILE 99 16.350 76.913 -28.835 699 HD12 ILE 99 HD12 ILE 99 16.870 75.258 -29.157 700 HD13 ILE 99 HD13 ILE 99 17.927 76.610 -29.565 701 H GLU 100 H GLU 100 18.320 75.757 -34.533 702 HA GLU 100 HA GLU 100 19.796 77.980 -35.516 703 HB2 GLU 100 HB2 GLU 100 19.941 75.171 -36.598 704 HB3 GLU 100 HB3 GLU 100 21.207 76.390 -36.574 705 HG2 GLU 100 HG2 GLU 100 21.013 76.239 -34.015 706 HG3 GLU 100 HG3 GLU 100 20.155 74.729 -34.321 707 H ASP 101 H ASP 101 17.326 75.882 -36.874 708 HA ASP 101 HA ASP 101 17.586 76.921 -39.539 709 HB2 ASP 101 HB2 ASP 101 16.761 74.706 -39.396 710 HB3 ASP 101 HB3 ASP 101 15.559 75.148 -38.185 711 H SER 102 H SER 102 16.085 77.978 -36.682 712 HA SER 102 HA SER 102 14.143 79.636 -38.114 713 HB2 SER 102 HB2 SER 102 13.824 78.256 -35.825 714 HB3 SER 102 HB3 SER 102 14.362 79.796 -35.156 715 HG SER 102 HG SER 102 12.356 80.357 -35.421 716 H VAL 103 H VAL 103 16.955 79.882 -35.996 717 HA VAL 103 HA VAL 103 16.944 82.691 -35.716 718 HB VAL 103 HB VAL 103 18.273 81.031 -34.330 719 HG11 VAL 103 HG11 VAL 103 19.294 80.175 -36.654 720 HG12 VAL 103 HG12 VAL 103 20.545 81.332 -36.195 721 HG13 VAL 103 HG13 VAL 103 20.131 80.003 -35.111 722 HG21 VAL 103 HG21 VAL 103 19.671 82.691 -33.618 723 HG22 VAL 103 HG22 VAL 103 20.134 83.158 -35.254 724 HG23 VAL 103 HG23 VAL 103 18.567 83.645 -34.609 725 H ILE 104 H ILE 104 17.966 80.599 -38.274 726 HA ILE 104 HA ILE 104 19.461 82.736 -39.593 727 HB ILE 104 HB ILE 104 19.051 79.857 -40.407 728 HG12 ILE 104 HG12 ILE 104 20.445 80.160 -38.387 729 HG13 ILE 104 HG13 ILE 104 21.378 79.549 -39.748 730 HG21 ILE 104 HG21 ILE 104 21.163 80.636 -41.844 731 HG22 ILE 104 HG22 ILE 104 19.507 80.755 -42.436 732 HG23 ILE 104 HG23 ILE 104 20.304 82.173 -41.754 733 HD11 ILE 104 HD11 ILE 104 21.852 81.842 -38.159 734 HD12 ILE 104 HD12 ILE 104 22.804 81.216 -39.505 735 HD13 ILE 104 HD13 ILE 104 21.510 82.376 -39.805 736 H SER 105 H SER 105 16.451 80.997 -39.789 737 HA SER 105 HA SER 105 15.794 81.934 -42.430 738 HB2 SER 105 HB2 SER 105 14.332 80.390 -40.308 739 HB3 SER 105 HB3 SER 105 13.455 81.047 -41.690 740 HG SER 105 HG SER 105 15.716 79.336 -41.843 741 H LEU 106 H LEU 106 15.259 82.973 -39.147 742 HA LEU 106 HA LEU 106 13.128 84.759 -39.604 743 HB2 LEU 106 HB2 LEU 106 15.023 84.177 -37.464 744 HB3 LEU 106 HB3 LEU 106 14.555 85.875 -37.535 745 HG LEU 106 HG LEU 106 13.205 84.481 -35.965 746 HD11 LEU 106 HD11 LEU 106 11.178 85.554 -36.463 747 HD12 LEU 106 HD12 LEU 106 11.504 85.556 -38.195 748 HD13 LEU 106 HD13 LEU 106 12.428 86.608 -37.122 749 HD21 LEU 106 HD21 LEU 106 11.475 83.355 -37.973 750 HD22 LEU 106 HD22 LEU 106 12.254 82.575 -36.597 751 HD23 LEU 106 HD23 LEU 106 13.113 82.720 -38.131 752 H SER 107 H SER 107 16.640 85.196 -39.667 753 HA SER 107 HA SER 107 16.272 87.947 -40.610 754 HB2 SER 107 HB2 SER 107 18.724 88.164 -40.217 755 HB3 SER 107 HB3 SER 107 17.832 87.712 -38.764 756 HG SER 107 HG SER 107 19.748 86.460 -39.095 757 H GLY 108 H GLY 108 16.738 84.858 -41.808 758 HA2 GLY 108 HA2 GLY 108 18.168 85.824 -44.193 759 HA3 GLY 108 HA3 GLY 108 18.017 84.141 -43.712 760 H ASP 109 H ASP 109 15.063 85.402 -43.176 761 HA ASP 109 HA ASP 109 14.133 85.061 -45.939 762 HB2 ASP 109 HB2 ASP 109 13.865 83.069 -44.051 763 HB3 ASP 109 HB3 ASP 109 12.318 83.907 -43.952 764 H HIS 110 H HIS 110 14.380 87.142 -43.572 765 HA HIS 110 HA HIS 110 11.758 88.358 -44.114 766 HB2 HIS 110 HB2 HIS 110 12.122 87.296 -41.744 767 HB3 HIS 110 HB3 HIS 110 13.074 88.747 -41.451 768 HD1 HIS 110 HD1 HIS 110 9.732 88.371 -43.230 769 HD2 HIS 110 HD2 HIS 110 11.435 90.322 -39.981 770 HE1 HIS 110 HE1 HIS 110 7.917 89.845 -42.304 771 H CYS 111 H CYS 111 15.087 88.611 -44.194 772 HA CYS 111 HA CYS 111 14.961 91.553 -44.299 773 HB2 CYS 111 HB2 CYS 111 16.710 89.847 -42.855 774 HB3 CYS 111 HB3 CYS 111 17.660 90.612 -44.123 775 HG CYS 111 HG CYS 111 16.045 93.083 -43.020 776 H ILE 112 H ILE 112 16.113 88.630 -45.862 777 HA ILE 112 HA ILE 112 17.042 90.207 -48.158 778 HB ILE 112 HB ILE 112 18.681 88.628 -47.364 779 HG12 ILE 112 HG12 ILE 112 17.427 87.502 -49.875 780 HG13 ILE 112 HG13 ILE 112 18.386 88.978 -49.833 781 HG21 ILE 112 HG21 ILE 112 17.125 87.096 -46.237 782 HG22 ILE 112 HG22 ILE 112 16.613 86.480 -47.807 783 HG23 ILE 112 HG23 ILE 112 18.274 86.240 -47.265 784 HD11 ILE 112 HD11 ILE 112 19.245 86.258 -50.006 785 HD12 ILE 112 HD12 ILE 112 20.186 87.743 -50.159 786 HD13 ILE 112 HD13 ILE 112 19.933 87.017 -48.571 787 H ILE 113 H ILE 113 14.882 87.554 -47.272 788 HA ILE 113 HA ILE 113 13.769 87.534 -49.980 789 HB ILE 113 HB ILE 113 13.299 85.680 -47.644 790 HG12 ILE 113 HG12 ILE 113 14.405 84.725 -50.220 791 HG13 ILE 113 HG13 ILE 113 15.462 85.758 -49.264 792 HG21 ILE 113 HG21 ILE 113 11.342 85.265 -48.650 793 HG22 ILE 113 HG22 ILE 113 11.825 86.079 -50.136 794 HG23 ILE 113 HG23 ILE 113 12.311 84.410 -49.848 795 HD11 ILE 113 HD11 ILE 113 14.901 82.995 -48.946 796 HD12 ILE 113 HD12 ILE 113 16.017 84.012 -48.034 797 HD13 ILE 113 HD13 ILE 113 14.340 83.852 -47.512 798 H GLY 114 H GLY 114 12.511 87.517 -46.635 799 HA2 GLY 114 HA2 GLY 114 9.887 88.245 -47.298 800 HA3 GLY 114 HA3 GLY 114 10.634 88.473 -45.724 801 H ARG 115 H ARG 115 12.746 90.141 -47.216 802 HA ARG 115 HA ARG 115 11.590 92.663 -46.645 803 HB2 ARG 115 HB2 ARG 115 13.959 92.405 -46.413 804 HB3 ARG 115 HB3 ARG 115 14.124 91.876 -48.082 805 HG2 ARG 115 HG2 ARG 115 12.897 94.465 -47.997 806 HG3 ARG 115 HG3 ARG 115 14.396 94.470 -47.066 807 HD2 ARG 115 HD2 ARG 115 14.054 93.589 -49.930 808 HD3 ARG 115 HD3 ARG 115 14.850 95.060 -49.369 809 HE ARG 115 HE ARG 115 15.991 92.638 -48.316 810 HH11 ARG 115 HH11 ARG 115 16.012 94.918 -50.947 811 HH12 ARG 115 HH12 ARG 115 17.630 94.536 -51.437 812 HH21 ARG 115 HH21 ARG 115 18.122 92.126 -48.952 813 HH22 ARG 115 HH22 ARG 115 18.828 92.948 -50.303 814 H THR 116 H THR 116 12.645 91.254 -49.749 815 HA THR 116 HA THR 116 11.410 93.305 -51.299 816 HB THR 116 HB THR 116 13.332 92.096 -52.180 817 HG1 THR 116 HG1 THR 116 12.087 91.283 -54.199 818 HG21 THR 116 HG21 THR 116 13.204 89.773 -52.847 819 HG22 THR 116 HG22 THR 116 11.526 89.679 -52.312 820 HG23 THR 116 HG23 THR 116 12.817 89.908 -51.133 821 H LEU 117 H LEU 117 10.490 90.048 -50.315 822 HA LEU 117 HA LEU 117 8.231 89.770 -51.966 823 HB2 LEU 117 HB2 LEU 117 9.113 87.840 -50.917 824 HB3 LEU 117 HB3 LEU 117 8.972 88.561 -49.315 825 HG LEU 117 HG LEU 117 6.574 88.338 -49.371 826 HD11 LEU 117 HD11 LEU 117 5.529 88.435 -51.327 827 HD12 LEU 117 HD12 LEU 117 6.028 86.767 -51.605 828 HD13 LEU 117 HD13 LEU 117 7.018 88.095 -52.210 829 HD21 LEU 117 HD21 LEU 117 6.563 85.733 -49.961 830 HD22 LEU 117 HD22 LEU 117 7.295 86.377 -48.492 831 HD23 LEU 117 HD23 LEU 117 8.304 85.994 -49.887 832 H VAL 118 H VAL 118 8.734 91.423 -48.938 833 HA VAL 118 HA VAL 118 5.866 91.941 -48.653 834 HB VAL 118 HB VAL 118 8.182 92.536 -46.809 835 HG11 VAL 118 HG11 VAL 118 5.386 93.485 -46.819 836 HG12 VAL 118 HG12 VAL 118 6.017 92.923 -45.270 837 HG13 VAL 118 HG13 VAL 118 6.834 94.224 -46.137 838 HG21 VAL 118 HG21 VAL 118 6.930 90.166 -47.223 839 HG22 VAL 118 HG22 VAL 118 7.684 90.642 -45.701 840 HG23 VAL 118 HG23 VAL 118 5.947 90.847 -45.925 841 H VAL 119 H VAL 119 8.796 93.439 -49.676 842 HA VAL 119 HA VAL 119 7.944 96.150 -49.345 843 HB VAL 119 HB VAL 119 10.246 94.802 -50.670 844 HG11 VAL 119 HG11 VAL 119 10.932 97.165 -51.446 845 HG12 VAL 119 HG12 VAL 119 9.798 96.247 -52.437 846 HG13 VAL 119 HG13 VAL 119 9.207 97.523 -51.371 847 HG21 VAL 119 HG21 VAL 119 11.462 95.791 -49.044 848 HG22 VAL 119 HG22 VAL 119 10.533 97.289 -49.108 849 HG23 VAL 119 HG23 VAL 119 9.901 95.895 -48.233 850 H HIS 120 H HIS 120 8.455 94.152 -52.259 851 HA HIS 120 HA HIS 120 6.368 95.750 -53.593 852 HB2 HIS 120 HB2 HIS 120 9.058 94.886 -54.516 853 HB3 HIS 120 HB3 HIS 120 7.757 94.846 -55.701 854 HD1 HIS 120 HD1 HIS 120 8.587 96.807 -57.084 855 HD2 HIS 120 HD2 HIS 120 8.039 97.746 -53.075 856 HE1 HIS 120 HE1 HIS 120 8.785 99.310 -56.947 857 H GLU 121 H GLU 121 7.764 92.587 -53.058 858 HA GLU 121 HA GLU 121 6.857 90.501 -53.222 859 HB2 GLU 121 HB2 GLU 121 4.667 90.378 -52.780 860 HB3 GLU 121 HB3 GLU 121 4.647 92.133 -52.862 861 HG2 GLU 121 HG2 GLU 121 4.255 91.831 -55.368 862 HG3 GLU 121 HG3 GLU 121 3.886 90.154 -54.975 863 H LYS 122 H LYS 122 7.473 92.535 -55.664 864 HA LYS 122 HA LYS 122 6.350 91.287 -57.931 865 HB2 LYS 122 HB2 LYS 122 7.226 93.491 -58.171 866 HB3 LYS 122 HB3 LYS 122 8.802 93.004 -57.564 867 HG2 LYS 122 HG2 LYS 122 8.082 91.460 -59.885 868 HG3 LYS 122 HG3 LYS 122 7.998 93.191 -60.222 869 HD2 LYS 122 HD2 LYS 122 10.360 92.377 -58.691 870 HD3 LYS 122 HD3 LYS 122 10.271 91.678 -60.309 871 HE2 LYS 122 HE2 LYS 122 11.198 93.606 -60.978 872 HE3 LYS 122 HE3 LYS 122 9.580 94.276 -60.778 873 HZ1 LYS 122 HZ1 LYS 122 10.142 95.049 -58.612 874 HZ2 LYS 122 HZ2 LYS 122 11.360 95.565 -59.666 875 HZ3 LYS 122 HZ3 LYS 122 11.633 94.251 -58.637 876 H ALA 123 H ALA 123 9.750 91.161 -56.850 877 HA ALA 123 HA ALA 123 10.000 88.381 -56.887 878 HB1 ALA 123 HB1 ALA 123 11.449 88.314 -59.048 879 HB2 ALA 123 HB2 ALA 123 9.693 88.196 -59.167 880 HB3 ALA 123 HB3 ALA 123 10.499 89.728 -59.507 881 H ASP 124 H ASP 124 11.497 91.508 -57.370 882 HA ASP 124 HA ASP 124 13.580 90.856 -55.499 883 HB2 ASP 124 HB2 ASP 124 14.093 90.512 -58.288 884 HB3 ASP 124 HB3 ASP 124 15.022 91.896 -57.721 885 H ASP 125 H ASP 125 15.238 92.822 -55.529 886 HA ASP 125 HA ASP 125 14.163 95.352 -56.308 887 HB2 ASP 125 HB2 ASP 125 13.690 96.272 -54.137 888 HB3 ASP 125 HB3 ASP 125 12.752 94.792 -54.316 Start of MODEL 2 1 H ALA 1 H1 ALA 1 -9.585 0.368 -9.392 2 HA ALA 1 HA ALA 1 -11.541 2.415 -10.209 3 HB1 ALA 1 HB1 ALA 1 -9.550 3.471 -11.362 4 HB2 ALA 1 HB2 ALA 1 -9.535 3.500 -9.599 5 HB3 ALA 1 HB3 ALA 1 -8.546 2.328 -10.470 6 H THR 2 H THR 2 -12.785 1.406 -11.701 7 HA THR 2 HA THR 2 -11.870 1.067 -14.311 8 HB THR 2 HB THR 2 -10.689 -0.896 -13.704 9 HG1 THR 2 HG1 THR 2 -13.092 -2.081 -14.561 10 HG21 THR 2 HG21 THR 2 -13.165 -1.626 -12.152 11 HG22 THR 2 HG22 THR 2 -11.520 -1.411 -11.550 12 HG23 THR 2 HG23 THR 2 -11.917 -2.804 -12.557 13 H LYS 3 H LYS 3 -14.196 0.182 -11.849 14 HA LYS 3 HA LYS 3 -16.406 1.132 -13.259 15 HB2 LYS 3 HB2 LYS 3 -17.539 -1.119 -13.662 16 HB3 LYS 3 HB3 LYS 3 -16.278 -0.648 -14.796 17 HG2 LYS 3 HG2 LYS 3 -15.881 -2.908 -14.348 18 HG3 LYS 3 HG3 LYS 3 -14.697 -2.038 -13.368 19 HD2 LYS 3 HD2 LYS 3 -15.916 -2.410 -11.384 20 HD3 LYS 3 HD3 LYS 3 -17.359 -2.906 -12.273 21 HE2 LYS 3 HE2 LYS 3 -14.745 -4.406 -12.138 22 HE3 LYS 3 HE3 LYS 3 -16.228 -4.829 -11.284 23 HZ1 LYS 3 HZ1 LYS 3 -16.711 -6.062 -13.050 24 HZ2 LYS 3 HZ2 LYS 3 -15.469 -5.387 -13.979 25 HZ3 LYS 3 HZ3 LYS 3 -16.979 -4.628 -13.903 26 H ALA 4 H ALA 4 -15.231 1.035 -10.603 27 HA ALA 4 HA ALA 4 -16.925 -0.575 -8.936 28 HB1 ALA 4 HB1 ALA 4 -14.712 1.331 -8.532 29 HB2 ALA 4 HB2 ALA 4 -15.872 1.199 -7.209 30 HB3 ALA 4 HB3 ALA 4 -15.017 -0.236 -7.780 31 H VAL 5 H VAL 5 -17.315 2.366 -10.550 32 HA VAL 5 HA VAL 5 -19.517 3.139 -8.748 33 HB VAL 5 HB VAL 5 -17.905 4.923 -10.579 34 HG11 VAL 5 HG11 VAL 5 -19.691 6.254 -10.525 35 HG12 VAL 5 HG12 VAL 5 -20.496 5.246 -9.321 36 HG13 VAL 5 HG13 VAL 5 -19.355 6.492 -8.811 37 HG21 VAL 5 HG21 VAL 5 -17.268 3.975 -8.047 38 HG22 VAL 5 HG22 VAL 5 -16.548 5.361 -8.867 39 HG23 VAL 5 HG23 VAL 5 -17.904 5.596 -7.766 40 H CYS 6 H CYS 6 -18.475 3.221 -12.153 41 HA CYS 6 HA CYS 6 -20.833 2.099 -13.162 42 HB2 CYS 6 HB2 CYS 6 -21.494 4.532 -12.339 43 HB3 CYS 6 HB3 CYS 6 -20.798 4.994 -13.888 44 HG CYS 6 HG CYS 6 -22.588 3.699 -15.455 45 H VAL 7 H VAL 7 -18.955 1.054 -14.135 46 HA VAL 7 HA VAL 7 -17.323 0.773 -15.734 47 HB VAL 7 HB VAL 7 -19.298 2.223 -17.490 48 HG11 VAL 7 HG11 VAL 7 -17.029 0.371 -17.910 49 HG12 VAL 7 HG12 VAL 7 -18.448 0.140 -18.933 50 HG13 VAL 7 HG13 VAL 7 -17.615 1.695 -18.916 51 HG21 VAL 7 HG21 VAL 7 -20.793 0.774 -16.603 52 HG22 VAL 7 HG22 VAL 7 -20.041 -0.341 -17.744 53 HG23 VAL 7 HG23 VAL 7 -19.548 -0.346 -16.051 54 H LEU 8 H LEU 8 -16.368 2.759 -14.330 55 HA LEU 8 HA LEU 8 -16.087 5.253 -15.626 56 HB2 LEU 8 HB2 LEU 8 -14.526 5.790 -13.974 57 HB3 LEU 8 HB3 LEU 8 -15.652 4.685 -13.189 58 HG LEU 8 HG LEU 8 -13.808 2.910 -13.911 59 HD11 LEU 8 HD11 LEU 8 -12.578 5.333 -14.599 60 HD12 LEU 8 HD12 LEU 8 -11.845 3.731 -14.531 61 HD13 LEU 8 HD13 LEU 8 -11.788 4.786 -13.121 62 HD21 LEU 8 HD21 LEU 8 -14.153 4.623 -11.520 63 HD22 LEU 8 HD22 LEU 8 -12.675 3.664 -11.617 64 HD23 LEU 8 HD23 LEU 8 -14.250 2.871 -11.685 65 H LYS 9 H LYS 9 -14.761 2.216 -16.301 66 HA LYS 9 HA LYS 9 -12.390 3.295 -17.620 67 HB2 LYS 9 HB2 LYS 9 -11.628 1.072 -17.824 68 HB3 LYS 9 HB3 LYS 9 -12.381 1.154 -16.236 69 HG2 LYS 9 HG2 LYS 9 -13.322 -0.772 -16.934 70 HG3 LYS 9 HG3 LYS 9 -14.491 0.340 -17.654 71 HD2 LYS 9 HD2 LYS 9 -12.392 0.101 -19.506 72 HD3 LYS 9 HD3 LYS 9 -12.730 -1.535 -18.935 73 HE2 LYS 9 HE2 LYS 9 -14.789 -1.580 -19.871 74 HE3 LYS 9 HE3 LYS 9 -15.078 0.134 -19.574 75 HZ1 LYS 9 HZ1 LYS 9 -14.868 -0.444 -21.952 76 HZ2 LYS 9 HZ2 LYS 9 -13.264 -0.906 -21.679 77 HZ3 LYS 9 HZ3 LYS 9 -13.732 0.702 -21.446 78 H GLY 10 H GLY 10 -15.567 2.961 -18.371 79 HA2 GLY 10 HA2 GLY 10 -14.950 2.901 -21.240 80 HA3 GLY 10 HA3 GLY 10 -16.164 1.789 -20.621 81 H ASP 11 H ASP 11 -15.443 5.232 -20.041 82 HA ASP 11 HA ASP 11 -18.124 5.897 -21.020 83 HB2 ASP 11 HB2 ASP 11 -17.072 6.295 -18.269 84 HB3 ASP 11 HB3 ASP 11 -18.004 7.620 -18.965 85 H GLY 12 H GLY 12 -15.215 6.237 -21.852 86 HA2 GLY 12 HA2 GLY 12 -13.988 7.826 -22.967 87 HA3 GLY 12 HA3 GLY 12 -15.477 8.749 -23.081 88 HA PRO 13 HA PRO 13 -13.773 10.289 -18.899 89 HB2 PRO 13 HB2 PRO 13 -11.747 8.918 -17.718 90 HB3 PRO 13 HB3 PRO 13 -13.453 8.514 -17.476 91 HG2 PRO 13 HG2 PRO 13 -11.442 7.247 -19.299 92 HG3 PRO 13 HG3 PRO 13 -12.659 6.475 -18.261 93 HD2 PRO 13 HD2 PRO 13 -13.014 6.808 -20.925 94 HD3 PRO 13 HD3 PRO 13 -14.362 6.844 -19.771 95 H VAL 14 H VAL 14 -10.929 8.645 -20.313 96 HA VAL 14 HA VAL 14 -9.446 11.150 -20.243 97 HB VAL 14 HB VAL 14 -7.500 9.844 -20.853 98 HG11 VAL 14 HG11 VAL 14 -8.640 7.987 -18.884 99 HG12 VAL 14 HG12 VAL 14 -7.210 9.017 -18.782 100 HG13 VAL 14 HG13 VAL 14 -8.810 9.697 -18.481 101 HG21 VAL 14 HG21 VAL 14 -7.723 8.036 -22.123 102 HG22 VAL 14 HG22 VAL 14 -8.402 7.183 -20.735 103 HG23 VAL 14 HG23 VAL 14 -9.467 8.021 -21.862 104 H GLN 15 H GLN 15 -11.269 9.292 -22.446 105 HA GLN 15 HA GLN 15 -9.970 10.491 -24.775 106 HB2 GLN 15 HB2 GLN 15 -10.582 8.024 -24.669 107 HB3 GLN 15 HB3 GLN 15 -12.261 8.533 -24.791 108 HG2 GLN 15 HG2 GLN 15 -11.931 8.274 -26.987 109 HG3 GLN 15 HG3 GLN 15 -11.185 9.866 -26.877 110 HE21 GLN 15 HE21 GLN 15 -10.515 8.193 -28.909 111 HE22 GLN 15 HE22 GLN 15 -8.897 7.621 -28.699 112 H GLY 16 H GLY 16 -13.216 10.172 -23.341 113 HA2 GLY 16 HA2 GLY 16 -14.489 11.931 -25.153 114 HA3 GLY 16 HA3 GLY 16 -15.106 11.455 -23.579 115 H ILE 17 H ILE 17 -12.860 12.464 -22.079 116 HA ILE 17 HA ILE 17 -13.680 15.231 -21.946 117 HB ILE 17 HB ILE 17 -11.622 13.771 -20.288 118 HG12 ILE 17 HG12 ILE 17 -14.527 14.369 -19.691 119 HG13 ILE 17 HG13 ILE 17 -13.883 12.787 -20.113 120 HG21 ILE 17 HG21 ILE 17 -12.016 15.620 -18.680 121 HG22 ILE 17 HG22 ILE 17 -11.274 16.145 -20.191 122 HG23 ILE 17 HG23 ILE 17 -12.992 16.427 -19.905 123 HD11 ILE 17 HD11 ILE 17 -12.340 13.657 -17.966 124 HD12 ILE 17 HD12 ILE 17 -14.000 14.092 -17.563 125 HD13 ILE 17 HD13 ILE 17 -13.596 12.420 -17.954 126 H ILE 18 H ILE 18 -11.093 13.429 -23.307 127 HA ILE 18 HA ILE 18 -9.066 15.388 -23.299 128 HB ILE 18 HB ILE 18 -9.457 12.791 -24.466 129 HG12 ILE 18 HG12 ILE 18 -7.707 13.416 -22.846 130 HG13 ILE 18 HG13 ILE 18 -7.018 12.711 -24.305 131 HG21 ILE 18 HG21 ILE 18 -8.197 14.856 -26.267 132 HG22 ILE 18 HG22 ILE 18 -8.098 13.111 -26.502 133 HG23 ILE 18 HG23 ILE 18 -9.660 13.924 -26.591 134 HD11 ILE 18 HD11 ILE 18 -7.141 15.502 -24.697 135 HD12 ILE 18 HD12 ILE 18 -6.457 15.214 -23.097 136 HD13 ILE 18 HD13 ILE 18 -5.717 14.478 -24.518 137 H ASN 19 H ASN 19 -11.764 14.770 -25.462 138 HA ASN 19 HA ASN 19 -10.899 16.906 -27.255 139 HB2 ASN 19 HB2 ASN 19 -12.587 14.545 -27.498 140 HB3 ASN 19 HB3 ASN 19 -13.357 15.981 -28.165 141 HD21 ASN 19 HD21 ASN 19 -13.152 14.821 -30.191 142 HD22 ASN 19 HD22 ASN 19 -11.666 14.916 -31.068 143 H PHE 20 H PHE 20 -13.151 16.274 -24.719 144 HA PHE 20 HA PHE 20 -14.881 18.496 -25.343 145 HB2 PHE 20 HB2 PHE 20 -14.824 16.310 -23.383 146 HB3 PHE 20 HB3 PHE 20 -15.453 17.827 -22.745 147 HD1 PHE 20 HD1 PHE 20 -16.940 18.996 -24.872 148 HD2 PHE 20 HD2 PHE 20 -16.563 14.886 -23.832 149 HE1 PHE 20 HE1 PHE 20 -19.118 18.535 -25.918 150 HE2 PHE 20 HE2 PHE 20 -18.740 14.419 -24.876 151 HZ PHE 20 HZ PHE 20 -20.021 16.244 -25.923 152 H GLU 21 H GLU 21 -12.188 17.832 -23.189 153 HA GLU 21 HA GLU 21 -12.428 20.391 -21.856 154 HB2 GLU 21 HB2 GLU 21 -11.602 18.198 -20.797 155 HB3 GLU 21 HB3 GLU 21 -10.093 18.504 -21.646 156 HG2 GLU 21 HG2 GLU 21 -10.497 20.891 -20.431 157 HG3 GLU 21 HG3 GLU 21 -11.212 19.784 -19.260 158 H GLN 22 H GLN 22 -11.078 19.250 -24.716 159 HA GLN 22 HA GLN 22 -9.004 21.318 -24.780 160 HB2 GLN 22 HB2 GLN 22 -9.528 18.848 -26.399 161 HB3 GLN 22 HB3 GLN 22 -8.517 20.133 -27.051 162 HG2 GLN 22 HG2 GLN 22 -7.141 19.946 -24.945 163 HG3 GLN 22 HG3 GLN 22 -8.046 18.476 -24.592 164 HE21 GLN 22 HE21 GLN 22 -6.000 17.394 -24.676 165 HE22 GLN 22 HE22 GLN 22 -5.319 16.943 -26.198 166 H LYS 23 H LYS 23 -11.934 20.265 -26.427 167 HA LYS 23 HA LYS 23 -11.820 22.362 -28.394 168 HB2 LYS 23 HB2 LYS 23 -13.974 20.388 -27.632 169 HB3 LYS 23 HB3 LYS 23 -14.163 21.574 -28.919 170 HG2 LYS 23 HG2 LYS 23 -12.065 19.415 -28.820 171 HG3 LYS 23 HG3 LYS 23 -13.541 19.381 -29.787 172 HD2 LYS 23 HD2 LYS 23 -12.434 20.412 -31.416 173 HD3 LYS 23 HD3 LYS 23 -12.282 21.824 -30.368 174 HE2 LYS 23 HE2 LYS 23 -10.272 20.458 -29.368 175 HE3 LYS 23 HE3 LYS 23 -10.321 19.651 -30.935 176 HZ1 LYS 23 HZ1 LYS 23 -9.745 22.476 -30.329 177 HZ2 LYS 23 HZ2 LYS 23 -10.318 22.035 -31.857 178 HZ3 LYS 23 HZ3 LYS 23 -8.864 21.390 -31.281 179 H GLU 24 H GLU 24 -13.485 21.797 -25.343 180 HA GLU 24 HA GLU 24 -14.993 24.266 -25.564 181 HB2 GLU 24 HB2 GLU 24 -15.504 21.916 -24.297 182 HB3 GLU 24 HB3 GLU 24 -14.888 22.878 -22.961 183 HG2 GLU 24 HG2 GLU 24 -16.664 24.287 -22.967 184 HG3 GLU 24 HG3 GLU 24 -16.928 24.127 -24.702 185 H SER 25 H SER 25 -11.892 23.839 -25.134 186 HA SER 25 HA SER 25 -11.654 25.858 -22.999 187 HB2 SER 25 HB2 SER 25 -9.965 23.477 -23.666 188 HB3 SER 25 HB3 SER 25 -9.208 24.887 -22.929 189 HG SER 25 HG SER 25 -11.226 24.581 -21.444 190 H ASN 26 H ASN 26 -11.839 25.828 -26.117 191 HA ASN 26 HA ASN 26 -10.310 28.160 -26.531 192 HB2 ASN 26 HB2 ASN 26 -8.788 25.821 -26.733 193 HB3 ASN 26 HB3 ASN 26 -9.130 26.281 -28.398 194 HD21 ASN 26 HD21 ASN 26 -7.873 27.486 -25.335 195 HD22 ASN 26 HD22 ASN 26 -6.804 28.653 -26.025 196 H GLY 27 H GLY 27 -11.923 25.363 -27.923 197 HA2 GLY 27 HA2 GLY 27 -12.405 26.444 -30.489 198 HA3 GLY 27 HA3 GLY 27 -13.312 25.138 -29.737 199 HA PRO 28 HA PRO 28 -16.629 28.105 -29.976 200 HB2 PRO 28 HB2 PRO 28 -18.543 26.441 -29.005 201 HB3 PRO 28 HB3 PRO 28 -17.946 26.353 -30.666 202 HG2 PRO 28 HG2 PRO 28 -17.200 24.686 -28.295 203 HG3 PRO 28 HG3 PRO 28 -17.515 24.178 -29.964 204 HD2 PRO 28 HD2 PRO 28 -15.010 24.474 -28.978 205 HD3 PRO 28 HD3 PRO 28 -15.411 24.790 -30.679 206 H VAL 29 H VAL 29 -14.852 28.395 -27.811 207 HA VAL 29 HA VAL 29 -16.753 29.109 -25.704 208 HB VAL 29 HB VAL 29 -14.211 27.549 -25.216 209 HG11 VAL 29 HG11 VAL 29 -14.947 27.695 -22.804 210 HG12 VAL 29 HG12 VAL 29 -14.314 29.184 -23.507 211 HG13 VAL 29 HG13 VAL 29 -16.053 28.971 -23.309 212 HG21 VAL 29 HG21 VAL 29 -15.891 26.018 -25.786 213 HG22 VAL 29 HG22 VAL 29 -15.892 26.033 -24.023 214 HG23 VAL 29 HG23 VAL 29 -17.131 26.916 -24.914 215 H LYS 30 H LYS 30 -13.466 29.356 -26.982 216 HA LYS 30 HA LYS 30 -13.192 31.979 -25.678 217 HB2 LYS 30 HB2 LYS 30 -11.238 29.906 -26.573 218 HB3 LYS 30 HB3 LYS 30 -10.727 31.588 -26.562 219 HG2 LYS 30 HG2 LYS 30 -10.425 31.549 -24.369 220 HG3 LYS 30 HG3 LYS 30 -12.051 30.920 -24.097 221 HD2 LYS 30 HD2 LYS 30 -11.107 28.650 -24.770 222 HD3 LYS 30 HD3 LYS 30 -9.513 29.388 -24.601 223 HE2 LYS 30 HE2 LYS 30 -9.804 28.502 -22.502 224 HE3 LYS 30 HE3 LYS 30 -10.444 30.127 -22.264 225 HZ1 LYS 30 HZ1 LYS 30 -11.773 28.033 -21.490 226 HZ2 LYS 30 HZ2 LYS 30 -12.285 28.004 -23.101 227 HZ3 LYS 30 HZ3 LYS 30 -12.578 29.368 -22.146 228 H VAL 31 H VAL 31 -13.222 30.336 -28.760 229 HA VAL 31 HA VAL 31 -12.255 32.475 -30.343 230 HB VAL 31 HB VAL 31 -14.098 30.227 -31.168 231 HG11 VAL 31 HG11 VAL 31 -14.208 31.451 -33.049 232 HG12 VAL 31 HG12 VAL 31 -12.802 32.427 -32.617 233 HG13 VAL 31 HG13 VAL 31 -12.582 30.833 -33.339 234 HG21 VAL 31 HG21 VAL 31 -11.410 30.151 -30.287 235 HG22 VAL 31 HG22 VAL 31 -12.374 28.841 -30.967 236 HG23 VAL 31 HG23 VAL 31 -11.406 29.867 -32.026 237 H TRP 32 H TRP 32 -15.131 32.101 -28.641 238 HA TRP 32 HA TRP 32 -16.946 33.400 -30.394 239 HB2 TRP 32 HB2 TRP 32 -16.923 32.548 -27.566 240 HB3 TRP 32 HB3 TRP 32 -17.976 33.912 -27.930 241 HD1 TRP 32 HD1 TRP 32 -17.413 30.249 -29.046 242 HE1 TRP 32 HE1 TRP 32 -19.661 29.319 -29.887 243 HE3 TRP 32 HE3 TRP 32 -20.228 34.505 -28.718 244 HZ2 TRP 32 HZ2 TRP 32 -22.280 30.264 -30.350 245 HZ3 TRP 32 HZ3 TRP 32 -22.595 34.407 -29.378 246 HH2 TRP 32 HH2 TRP 32 -23.598 32.329 -30.177 247 H GLY 33 H GLY 33 -14.252 34.557 -28.815 248 HA2 GLY 33 HA2 GLY 33 -13.921 36.991 -29.543 249 HA3 GLY 33 HA3 GLY 33 -15.363 37.278 -28.583 250 H SER 34 H SER 34 -13.380 34.834 -27.322 251 HA SER 34 HA SER 34 -12.721 36.470 -25.044 252 HB2 SER 34 HB2 SER 34 -13.416 34.145 -24.719 253 HB3 SER 34 HB3 SER 34 -12.035 33.586 -25.666 254 HG SER 34 HG SER 34 -12.117 34.056 -23.079 255 H ILE 35 H ILE 35 -10.725 34.384 -27.143 256 HA ILE 35 HA ILE 35 -8.255 35.399 -26.342 257 HB ILE 35 HB ILE 35 -7.439 34.565 -28.601 258 HG12 ILE 35 HG12 ILE 35 -10.266 33.520 -28.820 259 HG13 ILE 35 HG13 ILE 35 -9.672 34.912 -29.719 260 HG21 ILE 35 HG21 ILE 35 -8.833 32.241 -27.595 261 HG22 ILE 35 HG22 ILE 35 -7.113 32.629 -27.556 262 HG23 ILE 35 HG23 ILE 35 -8.181 33.226 -26.284 263 HD11 ILE 35 HD11 ILE 35 -8.769 33.606 -31.261 264 HD12 ILE 35 HD12 ILE 35 -7.917 32.654 -30.045 265 HD13 ILE 35 HD13 ILE 35 -9.576 32.243 -30.484 266 H LYS 36 H LYS 36 -10.674 36.851 -28.238 267 HA LYS 36 HA LYS 36 -8.766 38.895 -29.174 268 HB2 LYS 36 HB2 LYS 36 -10.061 39.253 -31.111 269 HB3 LYS 36 HB3 LYS 36 -9.963 37.504 -30.946 270 HG2 LYS 36 HG2 LYS 36 -12.239 38.020 -29.574 271 HG3 LYS 36 HG3 LYS 36 -12.283 39.293 -30.796 272 HD2 LYS 36 HD2 LYS 36 -11.924 36.348 -31.354 273 HD3 LYS 36 HD3 LYS 36 -13.435 37.243 -31.531 274 HE2 LYS 36 HE2 LYS 36 -12.824 37.699 -33.620 275 HE3 LYS 36 HE3 LYS 36 -11.548 38.721 -32.955 276 HZ1 LYS 36 HZ1 LYS 36 -10.571 36.158 -32.813 277 HZ2 LYS 36 HZ2 LYS 36 -10.119 37.351 -33.924 278 HZ3 LYS 36 HZ3 LYS 36 -11.330 36.238 -34.323 279 H GLY 37 H GLY 37 -10.738 38.418 -26.751 280 HA2 GLY 37 HA2 GLY 37 -11.484 41.239 -26.593 281 HA3 GLY 37 HA3 GLY 37 -12.787 40.065 -26.468 282 H LEU 38 H LEU 38 -12.326 38.277 -24.802 283 HA LEU 38 HA LEU 38 -11.985 39.539 -22.279 284 HB2 LEU 38 HB2 LEU 38 -13.156 37.213 -23.202 285 HB3 LEU 38 HB3 LEU 38 -11.796 36.635 -22.242 286 HG LEU 38 HG LEU 38 -14.047 38.404 -21.286 287 HD11 LEU 38 HD11 LEU 38 -14.757 36.123 -21.568 288 HD12 LEU 38 HD12 LEU 38 -14.562 36.461 -19.849 289 HD13 LEU 38 HD13 LEU 38 -13.335 35.534 -20.711 290 HD21 LEU 38 HD21 LEU 38 -11.922 38.984 -20.216 291 HD22 LEU 38 HD22 LEU 38 -11.683 37.293 -19.776 292 HD23 LEU 38 HD23 LEU 38 -13.026 38.204 -19.084 293 H THR 39 H THR 39 -10.157 36.866 -23.783 294 HA THR 39 HA THR 39 -8.003 37.094 -21.917 295 HB THR 39 HB THR 39 -7.212 35.745 -24.339 296 HG1 THR 39 HG1 THR 39 -9.747 35.042 -23.239 297 HG21 THR 39 HG21 THR 39 -7.987 34.421 -21.760 298 HG22 THR 39 HG22 THR 39 -6.543 35.429 -21.859 299 HG23 THR 39 HG23 THR 39 -6.693 34.001 -22.880 300 H GLU 40 H GLU 40 -8.808 38.663 -24.858 301 HA GLU 40 HA GLU 40 -6.066 39.489 -25.395 302 HB2 GLU 40 HB2 GLU 40 -6.984 39.245 -27.453 303 HB3 GLU 40 HB3 GLU 40 -8.621 39.513 -26.868 304 HG2 GLU 40 HG2 GLU 40 -8.324 41.878 -26.905 305 HG3 GLU 40 HG3 GLU 40 -6.601 41.711 -27.237 306 H GLY 41 H GLY 41 -8.782 40.567 -23.654 307 HA2 GLY 41 HA2 GLY 41 -7.779 43.341 -23.646 308 HA3 GLY 41 HA3 GLY 41 -9.413 42.860 -23.210 309 H LEU 42 H LEU 42 -8.320 40.549 -21.650 310 HA LEU 42 HA LEU 42 -7.829 42.053 -19.202 311 HB2 LEU 42 HB2 LEU 42 -9.520 40.448 -18.947 312 HB3 LEU 42 HB3 LEU 42 -8.593 39.213 -19.794 313 HG LEU 42 HG LEU 42 -7.177 40.023 -17.439 314 HD11 LEU 42 HD11 LEU 42 -9.744 40.502 -16.938 315 HD12 LEU 42 HD12 LEU 42 -8.654 39.821 -15.731 316 HD13 LEU 42 HD13 LEU 42 -9.734 38.764 -16.641 317 HD21 LEU 42 HD21 LEU 42 -6.867 37.914 -18.605 318 HD22 LEU 42 HD22 LEU 42 -8.529 37.448 -18.239 319 HD23 LEU 42 HD23 LEU 42 -7.357 37.629 -16.934 320 H HIS 43 H HIS 43 -6.311 39.578 -21.210 321 HA HIS 43 HA HIS 43 -3.831 39.949 -19.660 322 HB2 HIS 43 HB2 HIS 43 -5.200 37.588 -19.983 323 HB3 HIS 43 HB3 HIS 43 -4.000 37.500 -21.270 324 HD1 HIS 43 HD1 HIS 43 -3.972 38.376 -17.558 325 HD2 HIS 43 HD2 HIS 43 -1.719 36.356 -20.407 326 HE1 HIS 43 HE1 HIS 43 -2.011 37.414 -16.308 327 H GLY 44 H GLY 44 -5.366 40.212 -22.685 328 HA2 GLY 44 HA2 GLY 44 -2.808 40.275 -24.129 329 HA3 GLY 44 HA3 GLY 44 -4.401 40.203 -24.868 330 H PHE 45 H PHE 45 -4.045 42.411 -22.274 331 HA PHE 45 HA PHE 45 -3.062 44.650 -23.684 332 HB2 PHE 45 HB2 PHE 45 -4.982 44.790 -24.990 333 HB3 PHE 45 HB3 PHE 45 -6.025 44.202 -23.698 334 HD1 PHE 45 HD1 PHE 45 -6.810 45.703 -21.955 335 HD2 PHE 45 HD2 PHE 45 -4.380 47.109 -25.153 336 HE1 PHE 45 HE1 PHE 45 -7.423 48.019 -21.396 337 HE2 PHE 45 HE2 PHE 45 -4.987 49.428 -24.600 338 HZ PHE 45 HZ PHE 45 -6.512 49.884 -22.721 339 H HIS 46 H HIS 46 -4.948 43.321 -21.070 340 HA HIS 46 HA HIS 46 -4.691 45.690 -19.426 341 HB2 HIS 46 HB2 HIS 46 -6.211 43.208 -19.346 342 HB3 HIS 46 HB3 HIS 46 -5.506 43.597 -17.779 343 HD1 HIS 46 HD1 HIS 46 -8.604 43.827 -18.971 344 HD2 HIS 46 HD2 HIS 46 -5.988 46.839 -17.808 345 HE1 HIS 46 HE1 HIS 46 -10.057 45.803 -18.416 346 H VAL 47 H VAL 47 -3.511 42.329 -19.276 347 HA VAL 47 HA VAL 47 -1.585 43.073 -17.224 348 HB VAL 47 HB VAL 47 -2.134 40.389 -18.496 349 HG11 VAL 47 HG11 VAL 47 -0.071 39.960 -17.688 350 HG12 VAL 47 HG12 VAL 47 -0.104 41.331 -16.576 351 HG13 VAL 47 HG13 VAL 47 -0.927 39.829 -16.153 352 HG21 VAL 47 HG21 VAL 47 -2.810 40.415 -15.766 353 HG22 VAL 47 HG22 VAL 47 -3.515 41.869 -16.470 354 HG23 VAL 47 HG23 VAL 47 -3.898 40.288 -17.149 355 H HIS 48 H HIS 48 -1.715 42.353 -20.622 356 HA HIS 48 HA HIS 48 1.211 42.677 -20.770 357 HB2 HIS 48 HB2 HIS 48 -0.592 41.029 -22.552 358 HB3 HIS 48 HB3 HIS 48 1.119 41.319 -22.858 359 HD1 HIS 48 HD1 HIS 48 2.655 39.609 -21.948 360 HD2 HIS 48 HD2 HIS 48 -0.988 39.635 -19.951 361 HE1 HIS 48 HE1 HIS 48 2.762 37.688 -20.329 362 H GLU 49 H GLU 49 -0.658 44.820 -20.768 363 HA GLU 49 HA GLU 49 -1.632 45.851 -23.047 364 HB2 GLU 49 HB2 GLU 49 -1.151 46.925 -20.659 365 HB3 GLU 49 HB3 GLU 49 0.172 47.677 -21.538 366 HG2 GLU 49 HG2 GLU 49 -1.190 49.022 -22.718 367 HG3 GLU 49 HG3 GLU 49 -2.466 47.811 -22.834 368 H PHE 50 H PHE 50 1.807 45.812 -22.183 369 HA PHE 50 HA PHE 50 2.582 45.704 -24.935 370 HB2 PHE 50 HB2 PHE 50 2.142 48.246 -24.066 371 HB3 PHE 50 HB3 PHE 50 3.844 48.049 -23.669 372 HD1 PHE 50 HD1 PHE 50 1.522 47.342 -26.504 373 HD2 PHE 50 HD2 PHE 50 5.369 48.675 -25.261 374 HE1 PHE 50 HE1 PHE 50 2.113 47.805 -28.846 375 HE2 PHE 50 HE2 PHE 50 5.966 49.141 -27.601 376 HZ PHE 50 HZ PHE 50 4.339 48.705 -29.397 377 H GLY 51 H GLY 51 2.962 44.161 -22.521 378 HA2 GLY 51 HA2 GLY 51 5.224 42.945 -22.574 379 HA3 GLY 51 HA3 GLY 51 5.849 44.500 -22.040 380 H ASP 52 H ASP 52 3.916 45.264 -20.223 381 HA ASP 52 HA ASP 52 3.359 43.175 -18.350 382 HB2 ASP 52 HB2 ASP 52 5.754 44.922 -17.977 383 HB3 ASP 52 HB3 ASP 52 4.815 44.462 -16.560 384 H ASN 53 H ASN 53 1.572 44.794 -19.432 385 HA ASN 53 HA ASN 53 -0.208 46.097 -18.848 386 HB2 ASN 53 HB2 ASN 53 0.317 45.078 -16.520 387 HB3 ASN 53 HB3 ASN 53 1.035 46.646 -16.166 388 HD21 ASN 53 HD21 ASN 53 -1.255 45.398 -14.936 389 HD22 ASN 53 HD22 ASN 53 -2.592 46.463 -15.186 390 H THR 54 H THR 54 2.468 47.597 -17.033 391 HA THR 54 HA THR 54 2.699 49.751 -18.930 392 HB THR 54 HB THR 54 2.199 50.986 -16.356 393 HG1 THR 54 HG1 THR 54 -0.217 50.611 -16.769 394 HG21 THR 54 HG21 THR 54 2.097 52.515 -18.035 395 HG22 THR 54 HG22 THR 54 0.393 52.068 -18.020 396 HG23 THR 54 HG23 THR 54 1.483 51.347 -19.205 397 H ALA 55 H ALA 55 4.277 47.669 -17.390 398 HA ALA 55 HA ALA 55 6.286 47.456 -16.327 399 HB1 ALA 55 HB1 ALA 55 6.666 48.916 -18.525 400 HB2 ALA 55 HB2 ALA 55 7.200 50.090 -17.322 401 HB3 ALA 55 HB3 ALA 55 7.976 48.509 -17.416 402 H GLY 56 H GLY 56 4.162 48.838 -14.848 403 HA2 GLY 56 HA2 GLY 56 5.886 50.361 -12.995 404 HA3 GLY 56 HA3 GLY 56 4.256 50.889 -13.379 405 H CYS 57 H CYS 57 3.151 48.196 -13.391 406 HA CYS 57 HA CYS 57 3.370 47.524 -10.533 407 HB2 CYS 57 HB2 CYS 57 0.792 47.483 -12.108 408 HB3 CYS 57 HB3 CYS 57 0.990 47.231 -10.378 409 HG CYS 57 HG CYS 57 0.169 49.945 -11.811 410 H THR 58 H THR 58 4.488 46.363 -13.071 411 HA THR 58 HA THR 58 4.081 43.620 -12.395 412 HB THR 58 HB THR 58 3.439 43.725 -15.202 413 HG1 THR 58 HG1 THR 58 2.420 45.723 -14.583 414 HG21 THR 58 HG21 THR 58 1.742 42.746 -12.910 415 HG22 THR 58 HG22 THR 58 3.115 41.843 -13.552 416 HG23 THR 58 HG23 THR 58 1.728 42.190 -14.583 417 H SER 59 H SER 59 6.186 45.694 -12.886 418 HA SER 59 HA SER 59 8.121 43.999 -14.060 419 HB2 SER 59 HB2 SER 59 6.636 45.535 -15.919 420 HB3 SER 59 HB3 SER 59 8.233 46.274 -15.808 421 HG SER 59 HG SER 59 8.362 44.672 -17.330 422 H ALA 60 H ALA 60 7.159 47.249 -13.138 423 HA ALA 60 HA ALA 60 9.740 48.356 -12.877 424 HB1 ALA 60 HB1 ALA 60 8.213 50.029 -12.853 425 HB2 ALA 60 HB2 ALA 60 7.016 49.074 -11.976 426 HB3 ALA 60 HB3 ALA 60 8.363 49.809 -11.108 427 H GLY 61 H GLY 61 8.066 46.049 -11.000 428 HA2 GLY 61 HA2 GLY 61 9.081 46.566 -8.431 429 HA3 GLY 61 HA3 GLY 61 8.561 44.994 -9.023 430 HA PRO 62 HA PRO 62 13.103 44.767 -8.147 431 HB2 PRO 62 HB2 PRO 62 12.970 42.381 -6.861 432 HB3 PRO 62 HB3 PRO 62 12.723 43.928 -6.043 433 HG2 PRO 62 HG2 PRO 62 10.693 41.970 -7.050 434 HG3 PRO 62 HG3 PRO 62 10.720 42.866 -5.519 435 HD2 PRO 62 HD2 PRO 62 9.201 43.627 -7.627 436 HD3 PRO 62 HD3 PRO 62 9.906 44.792 -6.490 437 H HIS 63 H HIS 63 14.337 42.400 -8.317 438 HA HIS 63 HA HIS 63 15.081 40.779 -9.733 439 HB2 HIS 63 HB2 HIS 63 12.330 40.413 -9.637 440 HB3 HIS 63 HB3 HIS 63 12.686 40.463 -11.361 441 HD1 HIS 63 HD1 HIS 63 13.802 38.440 -12.377 442 HD2 HIS 63 HD2 HIS 63 13.646 38.289 -8.227 443 HE1 HIS 63 HE1 HIS 63 14.528 36.113 -11.760 444 H PHE 64 H PHE 64 15.117 43.648 -10.430 445 HA PHE 64 HA PHE 64 15.430 43.349 -13.344 446 HB2 PHE 64 HB2 PHE 64 14.070 45.473 -11.774 447 HB3 PHE 64 HB3 PHE 64 15.024 45.994 -13.159 448 HD1 PHE 64 HD1 PHE 64 12.659 43.194 -12.436 449 HD2 PHE 64 HD2 PHE 64 13.782 46.367 -15.039 450 HE1 PHE 64 HE1 PHE 64 10.791 42.623 -13.930 451 HE2 PHE 64 HE2 PHE 64 11.913 45.802 -16.538 452 HZ PHE 64 HZ PHE 64 10.415 43.927 -15.985 453 H ASN 65 H ASN 65 17.622 42.693 -12.473 454 HA ASN 65 HA ASN 65 19.281 45.009 -11.782 455 HB2 ASN 65 HB2 ASN 65 19.582 42.052 -11.421 456 HB3 ASN 65 HB3 ASN 65 21.026 43.059 -11.485 457 HD21 ASN 65 HD21 ASN 65 21.393 42.364 -9.308 458 HD22 ASN 65 HD22 ASN 65 20.571 43.144 -8.003 459 HA PRO 66 HA PRO 66 21.267 45.217 -15.688 460 HB2 PRO 66 HB2 PRO 66 23.845 45.723 -15.002 461 HB3 PRO 66 HB3 PRO 66 22.554 46.918 -14.836 462 HG2 PRO 66 HG2 PRO 66 23.767 45.136 -12.758 463 HG3 PRO 66 HG3 PRO 66 23.333 46.853 -12.645 464 HD2 PRO 66 HD2 PRO 66 21.772 44.885 -11.633 465 HD3 PRO 66 HD3 PRO 66 21.103 46.395 -12.288 466 H LEU 67 H LEU 67 20.860 42.562 -14.966 467 HA LEU 67 HA LEU 67 22.697 41.210 -16.573 468 HB2 LEU 67 HB2 LEU 67 23.750 39.781 -14.772 469 HB3 LEU 67 HB3 LEU 67 24.363 41.425 -14.940 470 HG LEU 67 HG LEU 67 22.267 41.373 -12.982 471 HD11 LEU 67 HD11 LEU 67 24.140 39.108 -12.931 472 HD12 LEU 67 HD12 LEU 67 22.560 39.298 -12.173 473 HD13 LEU 67 HD13 LEU 67 23.990 40.003 -11.417 474 HD21 LEU 67 HD21 LEU 67 25.123 42.159 -13.196 475 HD22 LEU 67 HD22 LEU 67 24.429 41.989 -11.585 476 HD23 LEU 67 HD23 LEU 67 23.716 43.117 -12.738 477 H SER 68 H SER 68 19.842 41.445 -15.826 478 HA SER 68 HA SER 68 19.164 38.678 -16.102 479 HB2 SER 68 HB2 SER 68 18.565 40.098 -13.506 480 HB3 SER 68 HB3 SER 68 17.662 38.681 -14.043 481 HG SER 68 HG SER 68 20.004 37.837 -14.294 482 H ARG 69 H ARG 69 18.769 41.234 -17.462 483 HA ARG 69 HA ARG 69 16.065 40.910 -18.218 484 HB2 ARG 69 HB2 ARG 69 15.270 43.183 -17.490 485 HB3 ARG 69 HB3 ARG 69 15.479 42.020 -16.187 486 HG2 ARG 69 HG2 ARG 69 16.759 43.479 -15.134 487 HG3 ARG 69 HG3 ARG 69 17.928 43.376 -16.451 488 HD2 ARG 69 HD2 ARG 69 16.149 45.040 -17.568 489 HD3 ARG 69 HD3 ARG 69 15.892 45.440 -15.869 490 HE ARG 69 HE ARG 69 18.659 45.411 -16.634 491 HH11 ARG 69 HH11 ARG 69 15.750 47.319 -16.506 492 HH12 ARG 69 HH12 ARG 69 16.588 48.835 -16.494 493 HH21 ARG 69 HH21 ARG 69 19.776 47.400 -16.621 494 HH22 ARG 69 HH22 ARG 69 18.880 48.879 -16.562 495 H LYS 70 H LYS 70 18.892 43.000 -18.100 496 HA LYS 70 HA LYS 70 18.522 44.823 -20.043 497 HB2 LYS 70 HB2 LYS 70 20.811 43.391 -18.995 498 HB3 LYS 70 HB3 LYS 70 21.034 43.778 -20.695 499 HG2 LYS 70 HG2 LYS 70 21.329 45.949 -20.279 500 HG3 LYS 70 HG3 LYS 70 19.991 46.006 -19.130 501 HD2 LYS 70 HD2 LYS 70 21.689 46.377 -17.669 502 HD3 LYS 70 HD3 LYS 70 21.732 44.612 -17.664 503 HE2 LYS 70 HE2 LYS 70 23.807 44.629 -18.456 504 HE3 LYS 70 HE3 LYS 70 23.298 45.584 -19.848 505 HZ1 LYS 70 HZ1 LYS 70 24.544 47.198 -19.009 506 HZ2 LYS 70 HZ2 LYS 70 24.753 46.397 -17.534 507 HZ3 LYS 70 HZ3 LYS 70 23.393 47.370 -17.780 508 H HIS 71 H HIS 71 19.132 41.385 -20.574 509 HA HIS 71 HA HIS 71 19.614 41.152 -23.206 510 HB2 HIS 71 HB2 HIS 71 17.544 39.560 -21.677 511 HB3 HIS 71 HB3 HIS 71 18.257 39.078 -23.216 512 HD1 HIS 71 HD1 HIS 71 18.515 38.106 -19.936 513 HD2 HIS 71 HD2 HIS 71 21.373 39.326 -22.693 514 HE1 HIS 71 HE1 HIS 71 20.696 37.173 -19.102 515 H GLY 72 H GLY 72 16.446 41.896 -21.800 516 HA2 GLY 72 HA2 GLY 72 15.551 42.680 -24.507 517 HA3 GLY 72 HA3 GLY 72 14.485 41.889 -23.354 518 H GLY 73 H GLY 73 16.168 43.714 -21.362 519 HA2 GLY 73 HA2 GLY 73 15.797 45.709 -20.286 520 HA3 GLY 73 HA3 GLY 73 15.414 46.370 -21.868 521 HA PRO 74 HA PRO 74 11.616 46.032 -19.026 522 HB2 PRO 74 HB2 PRO 74 11.350 48.666 -18.423 523 HB3 PRO 74 HB3 PRO 74 12.292 47.543 -17.433 524 HG2 PRO 74 HG2 PRO 74 13.232 49.496 -19.499 525 HG3 PRO 74 HG3 PRO 74 13.921 49.137 -17.905 526 HD2 PRO 74 HD2 PRO 74 14.943 48.120 -20.199 527 HD3 PRO 74 HD3 PRO 74 14.991 47.238 -18.659 528 H LYS 75 H LYS 75 12.666 48.198 -21.568 529 HA LYS 75 HA LYS 75 11.622 49.000 -23.423 530 HB2 LYS 75 HB2 LYS 75 9.311 47.180 -22.761 531 HB3 LYS 75 HB3 LYS 75 9.775 47.802 -24.339 532 HG2 LYS 75 HG2 LYS 75 11.407 45.872 -22.699 533 HG3 LYS 75 HG3 LYS 75 10.340 45.427 -24.034 534 HD2 LYS 75 HD2 LYS 75 11.892 47.380 -25.160 535 HD3 LYS 75 HD3 LYS 75 13.031 46.577 -24.077 536 HE2 LYS 75 HE2 LYS 75 12.237 44.394 -25.087 537 HE3 LYS 75 HE3 LYS 75 11.416 45.364 -26.309 538 HZ1 LYS 75 HZ1 LYS 75 14.201 46.029 -25.886 539 HZ2 LYS 75 HZ2 LYS 75 13.336 45.856 -27.330 540 HZ3 LYS 75 HZ3 LYS 75 13.932 44.486 -26.531 541 H ASP 76 H ASP 76 9.732 50.293 -24.145 542 HA ASP 76 HA ASP 76 8.314 52.046 -23.836 543 HB2 ASP 76 HB2 ASP 76 7.466 50.115 -21.710 544 HB3 ASP 76 HB3 ASP 76 6.751 51.725 -21.744 545 H GLU 77 H GLU 77 10.993 51.955 -22.468 546 HA GLU 77 HA GLU 77 10.734 54.429 -21.067 547 HB2 GLU 77 HB2 GLU 77 11.519 53.705 -18.888 548 HB3 GLU 77 HB3 GLU 77 10.027 52.868 -19.292 549 HG2 GLU 77 HG2 GLU 77 11.381 50.915 -20.007 550 HG3 GLU 77 HG3 GLU 77 12.818 51.754 -19.424 551 H GLU 78 H GLU 78 12.750 51.598 -21.716 552 HA GLU 78 HA GLU 78 15.118 53.332 -21.806 553 HB2 GLU 78 HB2 GLU 78 14.737 50.378 -21.441 554 HB3 GLU 78 HB3 GLU 78 16.283 51.011 -21.993 555 HG2 GLU 78 HG2 GLU 78 14.918 51.910 -19.470 556 HG3 GLU 78 HG3 GLU 78 16.111 50.616 -19.535 557 H ARG 79 H ARG 79 13.749 50.580 -23.621 558 HA ARG 79 HA ARG 79 15.257 51.285 -25.975 559 HB2 ARG 79 HB2 ARG 79 14.355 48.922 -25.051 560 HB3 ARG 79 HB3 ARG 79 13.048 49.318 -26.161 561 HG2 ARG 79 HG2 ARG 79 15.704 49.713 -27.300 562 HG3 ARG 79 HG3 ARG 79 15.370 48.046 -26.828 563 HD2 ARG 79 HD2 ARG 79 13.074 48.568 -28.054 564 HD3 ARG 79 HD3 ARG 79 14.086 49.735 -28.905 565 HE ARG 79 HE ARG 79 15.211 47.093 -28.796 566 HH11 ARG 79 HH11 ARG 79 13.069 49.225 -30.525 567 HH12 ARG 79 HH12 ARG 79 13.216 48.369 -32.025 568 HH21 ARG 79 HH21 ARG 79 15.413 45.957 -30.766 569 HH22 ARG 79 HH22 ARG 79 14.550 46.511 -32.159 570 H HIS 80 H HIS 80 12.573 52.557 -24.625 571 HA HIS 80 HA HIS 80 11.041 52.911 -27.073 572 HB2 HIS 80 HB2 HIS 80 10.171 52.626 -24.582 573 HB3 HIS 80 HB3 HIS 80 10.379 54.376 -24.559 574 HD1 HIS 80 HD1 HIS 80 8.892 52.024 -27.165 575 HD2 HIS 80 HD2 HIS 80 7.960 55.465 -25.033 576 HE1 HIS 80 HE1 HIS 80 6.622 52.730 -27.986 577 H VAL 81 H VAL 81 13.369 54.599 -25.155 578 HA VAL 81 HA VAL 81 13.416 56.753 -27.114 579 HB VAL 81 HB VAL 81 13.589 58.455 -25.232 580 HG11 VAL 81 HG11 VAL 81 11.474 59.029 -25.694 581 HG12 VAL 81 HG12 VAL 81 11.459 57.589 -26.714 582 HG13 VAL 81 HG13 VAL 81 10.828 57.511 -25.070 583 HG21 VAL 81 HG21 VAL 81 12.715 57.954 -23.100 584 HG22 VAL 81 HG22 VAL 81 12.086 56.396 -23.636 585 HG23 VAL 81 HG23 VAL 81 13.826 56.636 -23.474 586 H GLY 82 H GLY 82 15.164 54.517 -26.348 587 HA2 GLY 82 HA2 GLY 82 17.340 55.264 -24.788 588 HA3 GLY 82 HA3 GLY 82 17.418 54.137 -26.135 589 H ASP 83 H ASP 83 17.913 54.941 -28.235 590 HA ASP 83 HA ASP 83 19.792 57.115 -28.165 591 HB2 ASP 83 HB2 ASP 83 18.903 55.841 -30.722 592 HB3 ASP 83 HB3 ASP 83 20.510 56.385 -30.243 593 H LEU 84 H LEU 84 17.472 58.240 -27.466 594 HA LEU 84 HA LEU 84 17.116 60.270 -29.404 595 HB2 LEU 84 HB2 LEU 84 14.819 59.905 -30.018 596 HB3 LEU 84 HB3 LEU 84 15.783 58.502 -30.475 597 HG LEU 84 HG LEU 84 14.914 57.564 -28.175 598 HD11 LEU 84 HD11 LEU 84 13.212 59.917 -28.696 599 HD12 LEU 84 HD12 LEU 84 13.618 59.118 -27.177 600 HD13 LEU 84 HD13 LEU 84 12.379 58.434 -28.228 601 HD21 LEU 84 HD21 LEU 84 13.417 56.285 -29.366 602 HD22 LEU 84 HD22 LEU 84 14.454 56.894 -30.656 603 HD23 LEU 84 HD23 LEU 84 12.883 57.641 -30.359 604 H GLY 85 H GLY 85 17.434 59.518 -26.435 605 HA2 GLY 85 HA2 GLY 85 16.460 61.830 -25.296 606 HA3 GLY 85 HA3 GLY 85 15.174 60.648 -25.104 607 H ASN 86 H ASN 86 17.293 58.490 -24.939 608 HA ASN 86 HA ASN 86 17.761 58.793 -22.073 609 HB2 ASN 86 HB2 ASN 86 16.765 56.694 -23.371 610 HB3 ASN 86 HB3 ASN 86 18.470 56.289 -23.529 611 HD21 ASN 86 HD21 ASN 86 16.128 57.357 -21.091 612 HD22 ASN 86 HD22 ASN 86 16.751 56.374 -19.814 613 H VAL 87 H VAL 87 19.510 58.270 -25.089 614 HA VAL 87 HA VAL 87 22.061 58.427 -23.648 615 HB VAL 87 HB VAL 87 21.730 57.848 -26.583 616 HG11 VAL 87 HG11 VAL 87 23.951 58.205 -24.880 617 HG12 VAL 87 HG12 VAL 87 23.886 56.492 -25.302 618 HG13 VAL 87 HG13 VAL 87 23.943 57.713 -26.574 619 HG21 VAL 87 HG21 VAL 87 21.100 56.149 -24.283 620 HG22 VAL 87 HG22 VAL 87 20.621 55.992 -25.972 621 HG23 VAL 87 HG23 VAL 87 22.202 55.416 -25.447 622 H THR 88 H THR 88 19.943 60.515 -24.927 623 HA THR 88 HA THR 88 21.894 62.216 -26.287 624 HB THR 88 HB THR 88 18.964 62.809 -25.871 625 HG1 THR 88 HG1 THR 88 20.273 61.232 -27.824 626 HG21 THR 88 HG21 THR 88 19.386 64.680 -27.004 627 HG22 THR 88 HG22 THR 88 20.105 63.756 -28.323 628 HG23 THR 88 HG23 THR 88 21.103 64.282 -26.967 629 H ALA 89 H ALA 89 20.842 61.698 -23.189 630 HA ALA 89 HA ALA 89 21.160 62.822 -21.234 631 HB1 ALA 89 HB1 ALA 89 22.954 64.174 -21.104 632 HB2 ALA 89 HB2 ALA 89 23.215 63.660 -22.770 633 HB3 ALA 89 HB3 ALA 89 22.414 65.195 -22.436 634 H ASP 90 H ASP 90 18.734 63.125 -22.590 635 HA ASP 90 HA ASP 90 16.825 64.360 -22.561 636 HB2 ASP 90 HB2 ASP 90 18.206 66.165 -20.574 637 HB3 ASP 90 HB3 ASP 90 16.478 65.866 -20.742 638 H LYS 91 H LYS 91 16.614 65.287 -24.515 639 HA LYS 91 HA LYS 91 16.895 68.048 -24.840 640 HB2 LYS 91 HB2 LYS 91 19.258 67.778 -24.955 641 HB3 LYS 91 HB3 LYS 91 19.117 66.388 -26.022 642 HG2 LYS 91 HG2 LYS 91 19.873 68.408 -27.191 643 HG3 LYS 91 HG3 LYS 91 18.342 67.796 -27.822 644 HD2 LYS 91 HD2 LYS 91 17.142 69.468 -26.468 645 HD3 LYS 91 HD3 LYS 91 18.690 70.099 -25.901 646 HE2 LYS 91 HE2 LYS 91 19.255 70.437 -28.367 647 HE3 LYS 91 HE3 LYS 91 17.543 70.166 -28.678 648 HZ1 LYS 91 HZ1 LYS 91 17.075 72.008 -27.112 649 HZ2 LYS 91 HZ2 LYS 91 17.921 72.498 -28.492 650 HZ3 LYS 91 HZ3 LYS 91 18.736 72.319 -27.020 651 H ASP 92 H ASP 92 16.741 64.885 -26.340 652 HA ASP 92 HA ASP 92 15.130 66.021 -28.526 653 HB2 ASP 92 HB2 ASP 92 16.489 63.321 -28.416 654 HB3 ASP 92 HB3 ASP 92 15.657 64.021 -29.803 655 H GLY 93 H GLY 93 15.288 63.312 -26.232 656 HA2 GLY 93 HA2 GLY 93 12.420 62.830 -26.704 657 HA3 GLY 93 HA3 GLY 93 13.543 61.665 -26.017 658 H VAL 94 H VAL 94 13.938 64.829 -24.835 659 HA VAL 94 HA VAL 94 12.139 64.376 -22.568 660 HB VAL 94 HB VAL 94 15.032 65.126 -22.147 661 HG11 VAL 94 HG11 VAL 94 13.380 65.888 -20.460 662 HG12 VAL 94 HG12 VAL 94 12.931 64.203 -20.188 663 HG13 VAL 94 HG13 VAL 94 14.565 64.754 -19.815 664 HG21 VAL 94 HG21 VAL 94 13.684 62.448 -22.108 665 HG22 VAL 94 HG22 VAL 94 15.207 62.916 -22.866 666 HG23 VAL 94 HG23 VAL 94 15.104 62.766 -21.112 667 H ALA 95 H ALA 95 14.371 66.549 -24.236 668 HA ALA 95 HA ALA 95 12.868 68.841 -23.153 669 HB1 ALA 95 HB1 ALA 95 15.620 68.372 -23.226 670 HB2 ALA 95 HB2 ALA 95 15.318 69.595 -24.460 671 HB3 ALA 95 HB3 ALA 95 14.802 69.873 -22.796 672 H ASP 96 H ASP 96 12.036 67.201 -25.412 673 HA ASP 96 HA ASP 96 11.479 69.315 -27.262 674 HB2 ASP 96 HB2 ASP 96 13.638 67.412 -27.833 675 HB3 ASP 96 HB3 ASP 96 12.429 67.514 -29.107 676 H VAL 97 H VAL 97 11.343 65.912 -26.425 677 HA VAL 97 HA VAL 97 9.015 65.477 -28.118 678 HB VAL 97 HB VAL 97 10.976 63.790 -27.614 679 HG11 VAL 97 HG11 VAL 97 9.028 63.008 -25.458 680 HG12 VAL 97 HG12 VAL 97 10.603 62.295 -25.816 681 HG13 VAL 97 HG13 VAL 97 10.503 63.921 -25.137 682 HG21 VAL 97 HG21 VAL 97 8.316 62.486 -27.518 683 HG22 VAL 97 HG22 VAL 97 8.636 63.580 -28.861 684 HG23 VAL 97 HG23 VAL 97 9.685 62.190 -28.589 685 H SER 98 H SER 98 9.588 66.696 -25.091 686 HA SER 98 HA SER 98 6.901 65.913 -24.170 687 HB2 SER 98 HB2 SER 98 9.318 65.333 -22.895 688 HB3 SER 98 HB3 SER 98 8.665 66.707 -22.004 689 HG SER 98 HG SER 98 7.881 64.750 -21.162 690 H ILE 99 H ILE 99 9.370 68.404 -24.336 691 HA ILE 99 HA ILE 99 8.194 70.441 -22.894 692 HB ILE 99 HB ILE 99 9.688 70.770 -25.498 693 HG12 ILE 99 HG12 ILE 99 10.969 69.416 -23.921 694 HG13 ILE 99 HG13 ILE 99 11.690 71.014 -24.075 695 HG21 ILE 99 HG21 ILE 99 10.344 72.959 -24.448 696 HG22 ILE 99 HG22 ILE 99 8.651 72.824 -24.928 697 HG23 ILE 99 HG23 ILE 99 9.101 72.658 -23.232 698 HD11 ILE 99 HD11 ILE 99 10.662 71.685 -21.974 699 HD12 ILE 99 HD12 ILE 99 9.918 70.093 -21.823 700 HD13 ILE 99 HD13 ILE 99 11.672 70.257 -21.766 701 H GLU 100 H GLU 100 7.577 69.470 -26.241 702 HA GLU 100 HA GLU 100 5.769 71.583 -26.813 703 HB2 GLU 100 HB2 GLU 100 5.794 68.893 -28.170 704 HB3 GLU 100 HB3 GLU 100 5.301 70.441 -28.842 705 HG2 GLU 100 HG2 GLU 100 7.934 70.837 -28.078 706 HG3 GLU 100 HG3 GLU 100 7.911 69.209 -28.751 707 H ASP 101 H ASP 101 5.409 68.340 -25.520 708 HA ASP 101 HA ASP 101 2.539 68.360 -25.639 709 HB2 ASP 101 HB2 ASP 101 3.534 66.214 -25.730 710 HB3 ASP 101 HB3 ASP 101 4.554 66.543 -24.330 711 H SER 102 H SER 102 4.867 69.685 -23.553 712 HA SER 102 HA SER 102 3.024 69.787 -21.281 713 HB2 SER 102 HB2 SER 102 5.856 69.643 -21.522 714 HB3 SER 102 HB3 SER 102 5.463 71.181 -20.753 715 HG SER 102 HG SER 102 4.668 68.588 -19.923 716 H VAL 103 H VAL 103 4.781 71.899 -23.504 717 HA VAL 103 HA VAL 103 3.996 74.357 -22.387 718 HB VAL 103 HB VAL 103 5.799 73.974 -24.135 719 HG11 VAL 103 HG11 VAL 103 4.373 72.686 -25.691 720 HG12 VAL 103 HG12 VAL 103 3.459 74.158 -26.030 721 HG13 VAL 103 HG13 VAL 103 5.167 74.059 -26.461 722 HG21 VAL 103 HG21 VAL 103 4.955 76.187 -25.390 723 HG22 VAL 103 HG22 VAL 103 3.857 76.199 -24.009 724 HG23 VAL 103 HG23 VAL 103 5.601 76.198 -23.748 725 H ILE 104 H ILE 104 2.316 72.085 -24.382 726 HA ILE 104 HA ILE 104 0.213 74.011 -25.019 727 HB ILE 104 HB ILE 104 0.535 71.130 -25.864 728 HG12 ILE 104 HG12 ILE 104 0.812 73.638 -27.526 729 HG13 ILE 104 HG13 ILE 104 2.181 72.819 -26.782 730 HG21 ILE 104 HG21 ILE 104 -1.604 73.156 -26.341 731 HG22 ILE 104 HG22 ILE 104 -1.233 71.971 -27.593 732 HG23 ILE 104 HG23 ILE 104 -1.744 71.432 -25.995 733 HD11 ILE 104 HD11 ILE 104 1.501 70.764 -28.049 734 HD12 ILE 104 HD12 ILE 104 0.355 71.779 -28.924 735 HD13 ILE 104 HD13 ILE 104 2.083 72.109 -29.031 736 H SER 105 H SER 105 0.816 71.160 -23.072 737 HA SER 105 HA SER 105 -1.920 70.778 -22.314 738 HB2 SER 105 HB2 SER 105 0.697 69.660 -21.326 739 HB3 SER 105 HB3 SER 105 -0.827 69.295 -20.515 740 HG SER 105 HG SER 105 0.186 68.235 -22.769 741 H LEU 106 H LEU 106 0.738 72.675 -21.159 742 HA LEU 106 HA LEU 106 -0.105 73.102 -18.510 743 HB2 LEU 106 HB2 LEU 106 1.846 74.222 -20.345 744 HB3 LEU 106 HB3 LEU 106 1.147 75.449 -19.288 745 HG LEU 106 HG LEU 106 3.216 74.588 -18.359 746 HD11 LEU 106 HD11 LEU 106 2.392 74.780 -16.304 747 HD12 LEU 106 HD12 LEU 106 1.467 73.286 -16.455 748 HD13 LEU 106 HD13 LEU 106 0.788 74.805 -17.038 749 HD21 LEU 106 HD21 LEU 106 1.995 72.016 -19.059 750 HD22 LEU 106 HD22 LEU 106 2.749 72.057 -17.465 751 HD23 LEU 106 HD23 LEU 106 3.694 72.462 -18.898 752 H SER 107 H SER 107 -0.764 74.889 -21.500 753 HA SER 107 HA SER 107 -2.686 76.568 -20.053 754 HB2 SER 107 HB2 SER 107 -2.699 77.949 -22.118 755 HB3 SER 107 HB3 SER 107 -1.084 77.781 -21.431 756 HG SER 107 HG SER 107 -1.105 77.453 -23.702 757 H GLY 108 H GLY 108 -2.582 73.775 -21.897 758 HA2 GLY 108 HA2 GLY 108 -5.292 74.173 -22.972 759 HA3 GLY 108 HA3 GLY 108 -4.167 72.922 -23.477 760 H ASP 109 H ASP 109 -3.858 72.951 -20.250 761 HA ASP 109 HA ASP 109 -6.160 71.195 -19.759 762 HB2 ASP 109 HB2 ASP 109 -3.607 70.225 -20.159 763 HB3 ASP 109 HB3 ASP 109 -3.717 70.326 -18.404 764 H HIS 110 H HIS 110 -5.027 73.984 -18.971 765 HA HIS 110 HA HIS 110 -5.508 73.655 -16.084 766 HB2 HIS 110 HB2 HIS 110 -3.116 74.269 -16.792 767 HB3 HIS 110 HB3 HIS 110 -3.782 75.838 -17.234 768 HD1 HIS 110 HD1 HIS 110 -4.041 77.513 -15.396 769 HD2 HIS 110 HD2 HIS 110 -3.396 73.670 -13.956 770 HE1 HIS 110 HE1 HIS 110 -3.734 77.770 -12.914 771 H CYS 111 H CYS 111 -6.354 75.196 -19.002 772 HA CYS 111 HA CYS 111 -8.054 77.109 -17.543 773 HB2 CYS 111 HB2 CYS 111 -6.305 77.447 -19.832 774 HB3 CYS 111 HB3 CYS 111 -7.950 77.938 -20.209 775 HG CYS 111 HG CYS 111 -7.032 79.149 -17.274 776 H ILE 112 H ILE 112 -7.905 74.600 -19.941 777 HA ILE 112 HA ILE 112 -10.761 74.912 -20.533 778 HB ILE 112 HB ILE 112 -8.812 73.033 -21.862 779 HG12 ILE 112 HG12 ILE 112 -8.064 75.334 -22.197 780 HG13 ILE 112 HG13 ILE 112 -8.725 74.686 -23.694 781 HG21 ILE 112 HG21 ILE 112 -11.655 73.785 -22.299 782 HG22 ILE 112 HG22 ILE 112 -10.658 73.405 -23.702 783 HG23 ILE 112 HG23 ILE 112 -10.871 72.211 -22.422 784 HD11 ILE 112 HD11 ILE 112 -9.971 76.670 -21.821 785 HD12 ILE 112 HD12 ILE 112 -9.531 76.883 -23.516 786 HD13 ILE 112 HD13 ILE 112 -10.885 75.841 -23.081 787 H ILE 113 H ILE 113 -8.402 72.484 -19.465 788 HA ILE 113 HA ILE 113 -10.596 70.711 -18.677 789 HB ILE 113 HB ILE 113 -7.635 70.135 -18.590 790 HG12 ILE 113 HG12 ILE 113 -8.345 70.632 -20.890 791 HG13 ILE 113 HG13 ILE 113 -7.959 68.923 -20.699 792 HG21 ILE 113 HG21 ILE 113 -8.368 68.399 -17.383 793 HG22 ILE 113 HG22 ILE 113 -10.047 68.664 -17.854 794 HG23 ILE 113 HG23 ILE 113 -8.966 67.767 -18.918 795 HD11 ILE 113 HD11 ILE 113 -10.000 69.429 -22.054 796 HD12 ILE 113 HD12 ILE 113 -10.251 68.324 -20.701 797 HD13 ILE 113 HD13 ILE 113 -10.757 70.009 -20.570 798 H GLY 114 H GLY 114 -7.529 71.892 -17.272 799 HA2 GLY 114 HA2 GLY 114 -8.082 71.111 -14.638 800 HA3 GLY 114 HA3 GLY 114 -6.945 72.368 -15.106 801 H ARG 115 H ARG 115 -9.426 73.647 -16.480 802 HA ARG 115 HA ARG 115 -10.019 75.411 -14.301 803 HB2 ARG 115 HB2 ARG 115 -9.817 76.132 -16.693 804 HB3 ARG 115 HB3 ARG 115 -11.329 75.297 -17.019 805 HG2 ARG 115 HG2 ARG 115 -12.544 76.985 -16.232 806 HG3 ARG 115 HG3 ARG 115 -11.548 77.129 -14.783 807 HD2 ARG 115 HD2 ARG 115 -9.837 78.155 -16.546 808 HD3 ARG 115 HD3 ARG 115 -11.339 78.534 -17.385 809 HE ARG 115 HE ARG 115 -11.408 79.303 -14.634 810 HH11 ARG 115 HH11 ARG 115 -10.296 80.246 -17.795 811 HH12 ARG 115 HH12 ARG 115 -10.284 81.941 -17.429 812 HH21 ARG 115 HH21 ARG 115 -11.396 81.530 -14.140 813 HH22 ARG 115 HH22 ARG 115 -10.909 82.669 -15.349 814 H THR 116 H THR 116 -11.589 72.704 -15.835 815 HA THR 116 HA THR 116 -14.015 73.152 -14.246 816 HB THR 116 HB THR 116 -14.371 70.866 -15.847 817 HG1 THR 116 HG1 THR 116 -13.423 72.990 -17.468 818 HG21 THR 116 HG21 THR 116 -15.936 72.798 -15.182 819 HG22 THR 116 HG22 THR 116 -16.143 72.078 -16.778 820 HG23 THR 116 HG23 THR 116 -15.299 73.617 -16.608 821 H LEU 117 H LEU 117 -11.579 70.676 -14.975 822 HA LEU 117 HA LEU 117 -12.558 68.662 -13.304 823 HB2 LEU 117 HB2 LEU 117 -10.836 68.273 -14.973 824 HB3 LEU 117 HB3 LEU 117 -9.714 69.295 -14.078 825 HG LEU 117 HG LEU 117 -10.733 67.093 -12.473 826 HD11 LEU 117 HD11 LEU 117 -8.956 65.654 -13.957 827 HD12 LEU 117 HD12 LEU 117 -9.837 66.540 -15.200 828 HD13 LEU 117 HD13 LEU 117 -10.712 65.518 -14.060 829 HD21 LEU 117 HD21 LEU 117 -8.673 68.712 -12.258 830 HD22 LEU 117 HD22 LEU 117 -7.881 67.480 -13.241 831 HD23 LEU 117 HD23 LEU 117 -8.584 67.049 -11.680 832 H VAL 118 H VAL 118 -11.005 71.626 -12.551 833 HA VAL 118 HA VAL 118 -10.404 70.742 -9.820 834 HB VAL 118 HB VAL 118 -9.630 73.291 -11.245 835 HG11 VAL 118 HG11 VAL 118 -9.084 72.306 -8.456 836 HG12 VAL 118 HG12 VAL 118 -8.102 73.544 -9.239 837 HG13 VAL 118 HG13 VAL 118 -9.819 73.830 -8.952 838 HG21 VAL 118 HG21 VAL 118 -7.383 72.384 -11.252 839 HG22 VAL 118 HG22 VAL 118 -7.938 70.932 -10.417 840 HG23 VAL 118 HG23 VAL 118 -8.482 71.267 -12.062 841 H VAL 119 H VAL 119 -12.344 73.018 -11.663 842 HA VAL 119 HA VAL 119 -13.444 74.244 -9.277 843 HB VAL 119 HB VAL 119 -14.056 74.626 -12.208 844 HG11 VAL 119 HG11 VAL 119 -15.249 76.729 -11.154 845 HG12 VAL 119 HG12 VAL 119 -16.097 75.191 -11.339 846 HG13 VAL 119 HG13 VAL 119 -15.427 75.648 -9.773 847 HG21 VAL 119 HG21 VAL 119 -12.617 76.297 -10.156 848 HG22 VAL 119 HG22 VAL 119 -11.938 75.557 -11.603 849 HG23 VAL 119 HG23 VAL 119 -13.084 76.886 -11.752 850 H HIS 120 H HIS 120 -14.927 72.634 -12.099 851 HA HIS 120 HA HIS 120 -17.168 71.831 -10.393 852 HB2 HIS 120 HB2 HIS 120 -17.171 72.909 -12.890 853 HB3 HIS 120 HB3 HIS 120 -17.264 71.194 -13.272 854 HD1 HIS 120 HD1 HIS 120 -19.402 73.937 -12.762 855 HD2 HIS 120 HD2 HIS 120 -19.463 69.978 -11.502 856 HE1 HIS 120 HE1 HIS 120 -21.794 73.464 -12.149 857 H GLU 121 H GLU 121 -14.750 70.481 -9.970 858 HA GLU 121 HA GLU 121 -14.372 68.121 -11.381 859 HB2 GLU 121 HB2 GLU 121 -12.987 67.452 -9.658 860 HB3 GLU 121 HB3 GLU 121 -13.021 69.193 -9.416 861 HG2 GLU 121 HG2 GLU 121 -14.782 68.879 -7.708 862 HG3 GLU 121 HG3 GLU 121 -14.613 67.134 -7.906 863 H LYS 122 H LYS 122 -16.775 68.950 -8.995 864 HA LYS 122 HA LYS 122 -17.632 66.322 -8.375 865 HB2 LYS 122 HB2 LYS 122 -18.301 67.960 -6.843 866 HB3 LYS 122 HB3 LYS 122 -18.864 69.047 -8.106 867 HG2 LYS 122 HG2 LYS 122 -20.870 67.975 -8.333 868 HG3 LYS 122 HG3 LYS 122 -20.231 66.428 -7.773 869 HD2 LYS 122 HD2 LYS 122 -20.360 68.738 -5.885 870 HD3 LYS 122 HD3 LYS 122 -21.827 67.827 -6.245 871 HE2 LYS 122 HE2 LYS 122 -20.725 65.765 -5.546 872 HE3 LYS 122 HE3 LYS 122 -19.242 66.659 -5.215 873 HZ1 LYS 122 HZ1 LYS 122 -20.036 67.408 -3.278 874 HZ2 LYS 122 HZ2 LYS 122 -21.135 66.130 -3.392 875 HZ3 LYS 122 HZ3 LYS 122 -21.592 67.684 -3.881 876 H ALA 123 H ALA 123 -18.202 68.426 -11.055 877 HA ALA 123 HA ALA 123 -19.269 68.097 -13.042 878 HB1 ALA 123 HB1 ALA 123 -19.709 65.922 -13.803 879 HB2 ALA 123 HB2 ALA 123 -18.332 65.752 -12.712 880 HB3 ALA 123 HB3 ALA 123 -19.949 65.305 -12.167 881 H ASP 124 H ASP 124 -20.667 68.431 -10.213 882 HA ASP 124 HA ASP 124 -23.211 69.089 -11.249 883 HB2 ASP 124 HB2 ASP 124 -24.432 67.376 -9.708 884 HB3 ASP 124 HB3 ASP 124 -23.875 66.864 -11.298 885 H ASP 125 H ASP 125 -21.121 70.224 -9.624 886 HA ASP 125 HA ASP 125 -21.939 70.312 -6.897 887 HB2 ASP 125 HB2 ASP 125 -20.205 71.837 -6.569 888 HB3 ASP 125 HB3 ASP 125 -19.634 70.894 -7.944 Start of MODEL 3 1 H ALA 1 H1 ALA 1 -14.310 6.371 4.922 2 HA ALA 1 HA ALA 1 -15.115 3.854 3.632 3 HB1 ALA 1 HB1 ALA 1 -14.285 5.888 1.726 4 HB2 ALA 1 HB2 ALA 1 -15.680 4.813 1.698 5 HB3 ALA 1 HB3 ALA 1 -15.753 6.325 2.601 6 H THR 2 H THR 2 -13.351 3.974 1.487 7 HA THR 2 HA THR 2 -10.688 4.551 2.399 8 HB THR 2 HB THR 2 -11.173 2.410 3.582 9 HG1 THR 2 HG1 THR 2 -9.185 2.435 1.544 10 HG21 THR 2 HG21 THR 2 -10.871 0.667 1.319 11 HG22 THR 2 HG22 THR 2 -12.294 1.686 1.106 12 HG23 THR 2 HG23 THR 2 -12.133 0.685 2.550 13 H LYS 3 H LYS 3 -12.556 4.983 0.101 14 HA LYS 3 HA LYS 3 -11.204 3.634 -2.096 15 HB2 LYS 3 HB2 LYS 3 -13.373 5.718 -2.310 16 HB3 LYS 3 HB3 LYS 3 -12.906 4.518 -3.508 17 HG2 LYS 3 HG2 LYS 3 -14.505 3.201 -2.735 18 HG3 LYS 3 HG3 LYS 3 -13.616 3.073 -1.214 19 HD2 LYS 3 HD2 LYS 3 -14.795 4.959 -0.303 20 HD3 LYS 3 HD3 LYS 3 -15.573 5.279 -1.855 21 HE2 LYS 3 HE2 LYS 3 -15.922 2.685 -0.374 22 HE3 LYS 3 HE3 LYS 3 -16.961 4.080 -0.091 23 HZ1 LYS 3 HZ1 LYS 3 -16.869 2.269 -2.352 24 HZ2 LYS 3 HZ2 LYS 3 -17.048 3.903 -2.752 25 HZ3 LYS 3 HZ3 LYS 3 -18.167 3.157 -1.726 26 H ALA 4 H ALA 4 -11.713 6.931 -0.890 27 HA ALA 4 HA ALA 4 -10.240 8.254 -2.890 28 HB1 ALA 4 HB1 ALA 4 -11.342 8.935 -0.250 29 HB2 ALA 4 HB2 ALA 4 -9.961 9.905 -0.765 30 HB3 ALA 4 HB3 ALA 4 -11.408 9.821 -1.774 31 H VAL 5 H VAL 5 -9.224 6.224 -0.376 32 HA VAL 5 HA VAL 5 -6.597 7.419 -0.075 33 HB VAL 5 HB VAL 5 -7.354 4.705 0.958 34 HG11 VAL 5 HG11 VAL 5 -5.032 5.418 1.182 35 HG12 VAL 5 HG12 VAL 5 -5.554 6.885 2.012 36 HG13 VAL 5 HG13 VAL 5 -5.812 5.307 2.759 37 HG21 VAL 5 HG21 VAL 5 -8.136 5.886 3.036 38 HG22 VAL 5 HG22 VAL 5 -8.158 7.375 2.095 39 HG23 VAL 5 HG23 VAL 5 -9.208 6.032 1.641 40 H CYS 6 H CYS 6 -7.964 4.407 -1.381 41 HA CYS 6 HA CYS 6 -6.202 4.279 -3.556 42 HB2 CYS 6 HB2 CYS 6 -4.894 2.237 -2.782 43 HB3 CYS 6 HB3 CYS 6 -4.413 3.779 -2.084 44 HG CYS 6 HG CYS 6 -4.724 1.211 -0.415 45 H VAL 7 H VAL 7 -8.468 3.936 -4.220 46 HA VAL 7 HA VAL 7 -8.945 1.266 -4.929 47 HB VAL 7 HB VAL 7 -10.044 2.043 -2.351 48 HG11 VAL 7 HG11 VAL 7 -12.054 2.561 -3.553 49 HG12 VAL 7 HG12 VAL 7 -11.949 1.057 -4.471 50 HG13 VAL 7 HG13 VAL 7 -12.277 1.013 -2.738 51 HG21 VAL 7 HG21 VAL 7 -10.554 -0.650 -3.365 52 HG22 VAL 7 HG22 VAL 7 -8.864 -0.154 -3.477 53 HG23 VAL 7 HG23 VAL 7 -9.689 -0.126 -1.918 54 H LEU 8 H LEU 8 -10.281 4.460 -4.335 55 HA LEU 8 HA LEU 8 -12.560 4.295 -5.950 56 HB2 LEU 8 HB2 LEU 8 -11.928 6.125 -4.325 57 HB3 LEU 8 HB3 LEU 8 -10.863 6.753 -5.581 58 HG LEU 8 HG LEU 8 -12.926 6.940 -7.043 59 HD11 LEU 8 HD11 LEU 8 -14.531 6.953 -4.540 60 HD12 LEU 8 HD12 LEU 8 -14.184 5.407 -5.314 61 HD13 LEU 8 HD13 LEU 8 -15.034 6.668 -6.207 62 HD21 LEU 8 HD21 LEU 8 -13.606 9.051 -6.038 63 HD22 LEU 8 HD22 LEU 8 -11.852 8.864 -5.975 64 HD23 LEU 8 HD23 LEU 8 -12.822 8.597 -4.525 65 H LYS 9 H LYS 9 -9.233 4.442 -6.772 66 HA LYS 9 HA LYS 9 -9.775 5.305 -9.508 67 HB2 LYS 9 HB2 LYS 9 -7.103 4.515 -8.362 68 HB3 LYS 9 HB3 LYS 9 -7.422 5.500 -9.784 69 HG2 LYS 9 HG2 LYS 9 -8.628 7.022 -7.965 70 HG3 LYS 9 HG3 LYS 9 -7.444 6.231 -6.918 71 HD2 LYS 9 HD2 LYS 9 -5.630 7.013 -8.266 72 HD3 LYS 9 HD3 LYS 9 -6.739 7.613 -9.503 73 HE2 LYS 9 HE2 LYS 9 -6.561 9.585 -8.467 74 HE3 LYS 9 HE3 LYS 9 -7.614 8.891 -7.238 75 HZ1 LYS 9 HZ1 LYS 9 -5.325 9.948 -6.605 76 HZ2 LYS 9 HZ2 LYS 9 -4.727 8.426 -7.032 77 HZ3 LYS 9 HZ3 LYS 9 -5.884 8.566 -5.807 78 H GLY 10 H GLY 10 -9.942 2.487 -7.843 79 HA2 GLY 10 HA2 GLY 10 -9.484 0.930 -10.294 80 HA3 GLY 10 HA3 GLY 10 -8.741 0.400 -8.793 81 H ASP 11 H ASP 11 -11.978 1.706 -9.469 82 HA ASP 11 HA ASP 11 -13.097 -0.723 -8.233 83 HB2 ASP 11 HB2 ASP 11 -13.617 2.077 -7.813 84 HB3 ASP 11 HB3 ASP 11 -15.087 1.271 -8.356 85 H GLY 12 H GLY 12 -12.907 1.122 -11.104 86 HA2 GLY 12 HA2 GLY 12 -13.615 -0.247 -13.089 87 HA3 GLY 12 HA3 GLY 12 -15.157 -0.407 -12.260 88 HA PRO 13 HA PRO 13 -16.622 3.514 -13.651 89 HB2 PRO 13 HB2 PRO 13 -16.791 5.231 -11.554 90 HB3 PRO 13 HB3 PRO 13 -17.878 3.851 -11.757 91 HG2 PRO 13 HG2 PRO 13 -15.445 4.107 -10.031 92 HG3 PRO 13 HG3 PRO 13 -17.018 3.382 -9.648 93 HD2 PRO 13 HD2 PRO 13 -14.854 1.899 -10.323 94 HD3 PRO 13 HD3 PRO 13 -16.511 1.410 -10.729 95 H VAL 14 H VAL 14 -13.518 3.446 -12.305 96 HA VAL 14 HA VAL 14 -12.805 6.187 -12.739 97 HB VAL 14 HB VAL 14 -11.611 4.794 -11.098 98 HG11 VAL 14 HG11 VAL 14 -9.824 3.395 -12.808 99 HG12 VAL 14 HG12 VAL 14 -10.934 2.742 -11.603 100 HG13 VAL 14 HG13 VAL 14 -11.473 2.970 -13.266 101 HG21 VAL 14 HG21 VAL 14 -9.405 5.581 -11.586 102 HG22 VAL 14 HG22 VAL 14 -9.761 5.672 -13.311 103 HG23 VAL 14 HG23 VAL 14 -10.549 6.778 -12.186 104 H GLN 15 H GLN 15 -13.214 3.498 -14.762 105 HA GLN 15 HA GLN 15 -11.392 4.530 -16.804 106 HB2 GLN 15 HB2 GLN 15 -11.454 2.078 -16.243 107 HB3 GLN 15 HB3 GLN 15 -13.080 2.029 -16.907 108 HG2 GLN 15 HG2 GLN 15 -12.206 1.639 -18.895 109 HG3 GLN 15 HG3 GLN 15 -11.494 3.250 -18.862 110 HE21 GLN 15 HE21 GLN 15 -9.447 3.183 -19.413 111 HE22 GLN 15 HE22 GLN 15 -8.302 1.972 -18.955 112 H GLY 16 H GLY 16 -14.814 3.974 -16.183 113 HA2 GLY 16 HA2 GLY 16 -15.594 4.871 -18.825 114 HA3 GLY 16 HA3 GLY 16 -16.672 4.428 -17.511 115 H ILE 17 H ILE 17 -15.277 6.248 -15.633 116 HA ILE 17 HA ILE 17 -16.767 8.632 -16.324 117 HB ILE 17 HB ILE 17 -15.138 7.964 -13.872 118 HG12 ILE 17 HG12 ILE 17 -18.134 8.103 -14.279 119 HG13 ILE 17 HG13 ILE 17 -17.198 6.616 -14.202 120 HG21 ILE 17 HG21 ILE 17 -15.154 10.348 -14.165 121 HG22 ILE 17 HG22 ILE 17 -16.892 10.340 -14.467 122 HG23 ILE 17 HG23 ILE 17 -16.273 9.930 -12.868 123 HD11 ILE 17 HD11 ILE 17 -18.202 6.932 -12.085 124 HD12 ILE 17 HD12 ILE 17 -16.486 7.304 -11.901 125 HD13 ILE 17 HD13 ILE 17 -17.665 8.610 -12.006 126 H ILE 18 H ILE 18 -13.442 7.582 -16.166 127 HA ILE 18 HA ILE 18 -12.198 10.111 -16.185 128 HB ILE 18 HB ILE 18 -11.358 7.337 -16.759 129 HG12 ILE 18 HG12 ILE 18 -11.101 8.459 -14.554 130 HG13 ILE 18 HG13 ILE 18 -9.571 7.906 -15.222 131 HG21 ILE 18 HG21 ILE 18 -10.484 8.246 -18.750 132 HG22 ILE 18 HG22 ILE 18 -9.968 9.724 -17.941 133 HG23 ILE 18 HG23 ILE 18 -9.134 8.205 -17.617 134 HD11 ILE 18 HD11 ILE 18 -8.735 9.951 -15.157 135 HD12 ILE 18 HD12 ILE 18 -10.120 10.613 -16.024 136 HD13 ILE 18 HD13 ILE 18 -10.178 10.442 -14.271 137 H ASN 19 H ASN 19 -13.509 8.096 -18.739 138 HA ASN 19 HA ASN 19 -12.511 9.908 -20.795 139 HB2 ASN 19 HB2 ASN 19 -13.398 7.134 -20.709 140 HB3 ASN 19 HB3 ASN 19 -14.131 8.023 -22.040 141 HD21 ASN 19 HD21 ASN 19 -11.878 5.944 -21.639 142 HD22 ASN 19 HD22 ASN 19 -10.615 6.546 -22.653 143 H PHE 20 H PHE 20 -15.376 9.220 -19.011 144 HA PHE 20 HA PHE 20 -17.161 10.510 -20.881 145 HB2 PHE 20 HB2 PHE 20 -17.443 9.186 -18.221 146 HB3 PHE 20 HB3 PHE 20 -18.694 10.321 -18.722 147 HD1 PHE 20 HD1 PHE 20 -16.775 8.066 -20.935 148 HD2 PHE 20 HD2 PHE 20 -20.497 8.848 -19.025 149 HE1 PHE 20 HE1 PHE 20 -17.833 6.299 -22.281 150 HE2 PHE 20 HE2 PHE 20 -21.562 7.081 -20.368 151 HZ PHE 20 HZ PHE 20 -20.229 5.803 -21.997 152 H GLU 21 H GLU 21 -15.465 11.319 -17.919 153 HA GLU 21 HA GLU 21 -16.777 13.891 -17.689 154 HB2 GLU 21 HB2 GLU 21 -16.165 12.657 -15.662 155 HB3 GLU 21 HB3 GLU 21 -14.471 12.709 -16.132 156 HG2 GLU 21 HG2 GLU 21 -14.196 14.754 -15.312 157 HG3 GLU 21 HG3 GLU 21 -15.681 15.345 -16.057 158 H GLN 22 H GLN 22 -14.176 12.613 -19.403 159 HA GLN 22 HA GLN 22 -12.763 15.174 -19.539 160 HB2 GLN 22 HB2 GLN 22 -12.052 12.361 -20.294 161 HB3 GLN 22 HB3 GLN 22 -11.176 13.711 -21.003 162 HG2 GLN 22 HG2 GLN 22 -10.495 14.468 -18.814 163 HG3 GLN 22 HG3 GLN 22 -11.457 13.203 -18.051 164 HE21 GLN 22 HE21 GLN 22 -9.449 12.604 -17.025 165 HE22 GLN 22 HE22 GLN 22 -8.325 11.600 -17.869 166 H LYS 23 H LYS 23 -14.449 12.828 -21.569 167 HA LYS 23 HA LYS 23 -14.020 14.219 -24.015 168 HB2 LYS 23 HB2 LYS 23 -15.936 12.058 -23.168 169 HB3 LYS 23 HB3 LYS 23 -15.983 12.757 -24.780 170 HG2 LYS 23 HG2 LYS 23 -13.575 11.426 -23.558 171 HG3 LYS 23 HG3 LYS 23 -14.711 10.648 -24.664 172 HD2 LYS 23 HD2 LYS 23 -13.577 11.458 -26.395 173 HD3 LYS 23 HD3 LYS 23 -13.894 13.101 -25.835 174 HE2 LYS 23 HE2 LYS 23 -11.920 12.806 -24.280 175 HE3 LYS 23 HE3 LYS 23 -11.551 11.331 -25.171 176 HZ1 LYS 23 HZ1 LYS 23 -10.553 13.689 -25.821 177 HZ2 LYS 23 HZ2 LYS 23 -11.966 13.740 -26.754 178 HZ3 LYS 23 HZ3 LYS 23 -10.855 12.481 -26.968 179 H GLU 24 H GLU 24 -16.588 14.217 -21.599 180 HA GLU 24 HA GLU 24 -18.208 16.057 -23.150 181 HB2 GLU 24 HB2 GLU 24 -18.707 14.189 -21.099 182 HB3 GLU 24 HB3 GLU 24 -19.082 15.768 -20.422 183 HG2 GLU 24 HG2 GLU 24 -20.843 16.107 -21.811 184 HG3 GLU 24 HG3 GLU 24 -20.134 15.167 -23.123 185 H SER 25 H SER 25 -15.468 16.507 -21.589 186 HA SER 25 HA SER 25 -16.287 19.087 -20.423 187 HB2 SER 25 HB2 SER 25 -14.231 17.085 -19.563 188 HB3 SER 25 HB3 SER 25 -13.984 18.792 -19.192 189 HG SER 25 HG SER 25 -16.373 17.406 -18.563 190 H ASN 26 H ASN 26 -15.278 18.097 -23.187 191 HA ASN 26 HA ASN 26 -13.912 20.467 -23.885 192 HB2 ASN 26 HB2 ASN 26 -12.256 18.333 -22.898 193 HB3 ASN 26 HB3 ASN 26 -11.909 18.606 -24.602 194 HD21 ASN 26 HD21 ASN 26 -11.303 19.604 -21.476 195 HD22 ASN 26 HD22 ASN 26 -10.523 21.106 -21.825 196 H GLY 27 H GLY 27 -14.566 17.088 -24.663 197 HA2 GLY 27 HA2 GLY 27 -14.222 17.306 -27.463 198 HA3 GLY 27 HA3 GLY 27 -15.139 16.059 -26.635 199 HA PRO 28 HA PRO 28 -18.517 17.947 -28.853 200 HB2 PRO 28 HB2 PRO 28 -20.379 16.128 -28.084 201 HB3 PRO 28 HB3 PRO 28 -19.193 15.810 -29.355 202 HG2 PRO 28 HG2 PRO 28 -19.155 14.981 -26.478 203 HG3 PRO 28 HG3 PRO 28 -18.735 14.038 -27.919 204 HD2 PRO 28 HD2 PRO 28 -16.865 15.177 -26.326 205 HD3 PRO 28 HD3 PRO 28 -16.634 14.976 -28.073 206 H VAL 29 H VAL 29 -17.816 19.303 -26.572 207 HA VAL 29 HA VAL 29 -20.435 19.947 -25.475 208 HB VAL 29 HB VAL 29 -18.090 19.197 -23.727 209 HG11 VAL 29 HG11 VAL 29 -18.879 20.964 -22.524 210 HG12 VAL 29 HG12 VAL 29 -20.507 20.835 -23.191 211 HG13 VAL 29 HG13 VAL 29 -19.975 19.712 -21.941 212 HG21 VAL 29 HG21 VAL 29 -19.273 17.248 -24.349 213 HG22 VAL 29 HG22 VAL 29 -19.836 17.661 -22.727 214 HG23 VAL 29 HG23 VAL 29 -20.836 18.037 -24.131 215 H LYS 30 H LYS 30 -16.963 20.679 -25.461 216 HA LYS 30 HA LYS 30 -17.618 23.532 -25.167 217 HB2 LYS 30 HB2 LYS 30 -15.217 21.895 -24.443 218 HB3 LYS 30 HB3 LYS 30 -15.031 23.616 -24.751 219 HG2 LYS 30 HG2 LYS 30 -15.978 24.192 -22.807 220 HG3 LYS 30 HG3 LYS 30 -17.224 22.948 -22.931 221 HD2 LYS 30 HD2 LYS 30 -15.005 21.436 -22.512 222 HD3 LYS 30 HD3 LYS 30 -14.609 22.885 -21.587 223 HE2 LYS 30 HE2 LYS 30 -17.107 22.561 -20.745 224 HE3 LYS 30 HE3 LYS 30 -16.764 20.883 -21.171 225 HZ1 LYS 30 HZ1 LYS 30 -16.175 21.967 -18.808 226 HZ2 LYS 30 HZ2 LYS 30 -14.714 22.223 -19.618 227 HZ3 LYS 30 HZ3 LYS 30 -15.335 20.657 -19.470 228 H VAL 31 H VAL 31 -16.061 21.168 -27.205 229 HA VAL 31 HA VAL 31 -14.555 22.780 -28.883 230 HB VAL 31 HB VAL 31 -14.702 20.247 -28.899 231 HG11 VAL 31 HG11 VAL 31 -16.429 19.132 -29.849 232 HG12 VAL 31 HG12 VAL 31 -17.321 20.573 -29.360 233 HG13 VAL 31 HG13 VAL 31 -16.753 20.407 -31.023 234 HG21 VAL 31 HG21 VAL 31 -14.906 20.887 -31.725 235 HG22 VAL 31 HG22 VAL 31 -13.923 22.055 -30.840 236 HG23 VAL 31 HG23 VAL 31 -13.514 20.341 -30.789 237 H TRP 32 H TRP 32 -17.944 22.668 -28.497 238 HA TRP 32 HA TRP 32 -18.927 23.316 -30.998 239 HB2 TRP 32 HB2 TRP 32 -20.408 22.855 -29.136 240 HB3 TRP 32 HB3 TRP 32 -19.844 24.292 -28.286 241 HD1 TRP 32 HD1 TRP 32 -21.519 26.206 -28.425 242 HE1 TRP 32 HE1 TRP 32 -23.269 27.021 -30.129 243 HE3 TRP 32 HE3 TRP 32 -20.801 22.694 -32.072 244 HZ2 TRP 32 HZ2 TRP 32 -24.220 26.273 -32.678 245 HZ3 TRP 32 HZ3 TRP 32 -22.171 22.814 -34.111 246 HH2 TRP 32 HH2 TRP 32 -23.846 24.567 -34.405 247 H GLY 33 H GLY 33 -17.969 25.616 -28.437 248 HA2 GLY 33 HA2 GLY 33 -16.911 27.428 -30.433 249 HA3 GLY 33 HA3 GLY 33 -18.353 28.008 -29.612 250 H SER 34 H SER 34 -16.278 25.982 -27.783 251 HA SER 34 HA SER 34 -15.671 28.169 -25.997 252 HB2 SER 34 HB2 SER 34 -16.320 25.930 -25.139 253 HB3 SER 34 HB3 SER 34 -14.840 25.262 -25.828 254 HG SER 34 HG SER 34 -14.432 25.733 -23.698 255 H ILE 35 H ILE 35 -13.658 25.669 -27.560 256 HA ILE 35 HA ILE 35 -11.197 26.874 -27.055 257 HB ILE 35 HB ILE 35 -11.658 25.305 -29.567 258 HG12 ILE 35 HG12 ILE 35 -11.908 24.365 -26.734 259 HG13 ILE 35 HG13 ILE 35 -12.870 23.927 -28.140 260 HG21 ILE 35 HG21 ILE 35 -9.452 24.640 -29.335 261 HG22 ILE 35 HG22 ILE 35 -9.414 26.300 -28.743 262 HG23 ILE 35 HG23 ILE 35 -9.432 24.957 -27.602 263 HD11 ILE 35 HD11 ILE 35 -10.260 22.859 -27.216 264 HD12 ILE 35 HD12 ILE 35 -11.678 22.011 -27.835 265 HD13 ILE 35 HD13 ILE 35 -10.607 22.868 -28.945 266 H LYS 36 H LYS 36 -13.661 27.824 -29.186 267 HA LYS 36 HA LYS 36 -11.801 29.627 -30.590 268 HB2 LYS 36 HB2 LYS 36 -13.608 29.655 -32.400 269 HB3 LYS 36 HB3 LYS 36 -12.630 28.199 -32.264 270 HG2 LYS 36 HG2 LYS 36 -14.403 26.935 -31.815 271 HG3 LYS 36 HG3 LYS 36 -15.021 28.080 -30.622 272 HD2 LYS 36 HD2 LYS 36 -16.631 27.875 -32.392 273 HD3 LYS 36 HD3 LYS 36 -15.882 29.471 -32.499 274 HE2 LYS 36 HE2 LYS 36 -14.272 27.831 -34.063 275 HE3 LYS 36 HE3 LYS 36 -15.917 27.307 -34.421 276 HZ1 LYS 36 HZ1 LYS 36 -15.846 29.010 -35.860 277 HZ2 LYS 36 HZ2 LYS 36 -14.596 29.808 -35.047 278 HZ3 LYS 36 HZ3 LYS 36 -16.191 29.959 -34.503 279 H GLY 37 H GLY 37 -13.698 29.718 -28.098 280 HA2 GLY 37 HA2 GLY 37 -14.549 32.460 -28.616 281 HA3 GLY 37 HA3 GLY 37 -15.813 31.314 -28.197 282 H LEU 38 H LEU 38 -15.124 29.917 -26.180 283 HA LEU 38 HA LEU 38 -14.874 31.770 -24.018 284 HB2 LEU 38 HB2 LEU 38 -15.066 28.774 -24.159 285 HB3 LEU 38 HB3 LEU 38 -14.882 29.640 -22.633 286 HG LEU 38 HG LEU 38 -17.133 30.401 -24.429 287 HD11 LEU 38 HD11 LEU 38 -18.427 28.599 -23.042 288 HD12 LEU 38 HD12 LEU 38 -16.855 27.805 -22.993 289 HD13 LEU 38 HD13 LEU 38 -17.615 28.162 -24.545 290 HD21 LEU 38 HD21 LEU 38 -17.366 31.700 -22.615 291 HD22 LEU 38 HD22 LEU 38 -16.346 30.662 -21.618 292 HD23 LEU 38 HD23 LEU 38 -18.043 30.253 -21.870 293 H THR 39 H THR 39 -12.907 28.963 -25.008 294 HA THR 39 HA THR 39 -10.743 29.737 -23.274 295 HB THR 39 HB THR 39 -9.935 27.814 -25.258 296 HG1 THR 39 HG1 THR 39 -12.452 27.394 -23.997 297 HG21 THR 39 HG21 THR 39 -10.606 26.985 -22.493 298 HG22 THR 39 HG22 THR 39 -9.408 28.268 -22.669 299 HG23 THR 39 HG23 THR 39 -9.145 26.703 -23.438 300 H GLU 40 H GLU 40 -11.706 30.466 -26.467 301 HA GLU 40 HA GLU 40 -9.011 31.225 -27.298 302 HB2 GLU 40 HB2 GLU 40 -9.957 30.318 -29.161 303 HB3 GLU 40 HB3 GLU 40 -11.592 30.742 -28.669 304 HG2 GLU 40 HG2 GLU 40 -11.009 31.955 -30.655 305 HG3 GLU 40 HG3 GLU 40 -11.145 33.078 -29.304 306 H GLY 41 H GLY 41 -12.007 32.621 -26.212 307 HA2 GLY 41 HA2 GLY 41 -11.045 35.323 -26.844 308 HA3 GLY 41 HA3 GLY 41 -12.685 34.901 -26.376 309 H LEU 42 H LEU 42 -12.095 33.345 -24.102 310 HA LEU 42 HA LEU 42 -11.419 35.483 -22.245 311 HB2 LEU 42 HB2 LEU 42 -12.236 32.763 -21.353 312 HB3 LEU 42 HB3 LEU 42 -12.592 34.335 -20.639 313 HG LEU 42 HG LEU 42 -13.839 33.359 -23.201 314 HD11 LEU 42 HD11 LEU 42 -15.864 33.016 -21.705 315 HD12 LEU 42 HD12 LEU 42 -14.733 33.043 -20.352 316 HD13 LEU 42 HD13 LEU 42 -14.582 31.808 -21.599 317 HD21 LEU 42 HD21 LEU 42 -14.431 35.630 -21.313 318 HD22 LEU 42 HD22 LEU 42 -15.529 35.102 -22.587 319 HD23 LEU 42 HD23 LEU 42 -13.934 35.733 -23.001 320 H HIS 43 H HIS 43 -10.119 32.527 -23.485 321 HA HIS 43 HA HIS 43 -7.857 32.764 -21.611 322 HB2 HIS 43 HB2 HIS 43 -9.548 30.586 -21.876 323 HB3 HIS 43 HB3 HIS 43 -8.149 30.137 -22.845 324 HD1 HIS 43 HD1 HIS 43 -5.764 30.532 -21.452 325 HD2 HIS 43 HD2 HIS 43 -9.253 29.962 -19.268 326 HE1 HIS 43 HE1 HIS 43 -5.012 29.834 -19.156 327 H GLY 44 H GLY 44 -8.831 33.122 -24.755 328 HA2 GLY 44 HA2 GLY 44 -6.141 32.488 -25.798 329 HA3 GLY 44 HA3 GLY 44 -7.606 32.474 -26.771 330 H PHE 45 H PHE 45 -8.494 34.985 -25.340 331 HA PHE 45 HA PHE 45 -6.717 36.868 -26.747 332 HB2 PHE 45 HB2 PHE 45 -8.663 36.862 -28.058 333 HB3 PHE 45 HB3 PHE 45 -9.717 36.735 -26.653 334 HD1 PHE 45 HD1 PHE 45 -10.183 38.702 -25.270 335 HD2 PHE 45 HD2 PHE 45 -7.859 38.972 -28.825 336 HE1 PHE 45 HE1 PHE 45 -10.492 41.142 -25.280 337 HE2 PHE 45 HE2 PHE 45 -8.163 41.414 -28.842 338 HZ PHE 45 HZ PHE 45 -9.480 42.502 -27.068 339 H HIS 46 H HIS 46 -8.380 36.046 -23.865 340 HA HIS 46 HA HIS 46 -7.920 38.694 -22.697 341 HB2 HIS 46 HB2 HIS 46 -10.078 38.037 -22.133 342 HB3 HIS 46 HB3 HIS 46 -9.623 36.347 -21.939 343 HD1 HIS 46 HD1 HIS 46 -10.138 35.816 -19.576 344 HD2 HIS 46 HD2 HIS 46 -8.194 39.469 -19.960 345 HE1 HIS 46 HE1 HIS 46 -9.715 36.603 -17.224 346 H VAL 47 H VAL 47 -7.067 35.293 -22.293 347 HA VAL 47 HA VAL 47 -5.198 35.989 -20.148 348 HB VAL 47 HB VAL 47 -6.003 33.275 -21.207 349 HG11 VAL 47 HG11 VAL 47 -4.059 34.160 -19.129 350 HG12 VAL 47 HG12 VAL 47 -4.957 32.660 -18.882 351 HG13 VAL 47 HG13 VAL 47 -3.934 32.853 -20.307 352 HG21 VAL 47 HG21 VAL 47 -7.539 34.949 -19.728 353 HG22 VAL 47 HG22 VAL 47 -7.647 33.191 -19.675 354 HG23 VAL 47 HG23 VAL 47 -6.699 34.053 -18.463 355 H HIS 48 H HIS 48 -5.295 34.775 -23.440 356 HA HIS 48 HA HIS 48 -2.363 34.623 -23.481 357 HB2 HIS 48 HB2 HIS 48 -4.512 33.427 -25.212 358 HB3 HIS 48 HB3 HIS 48 -2.854 33.559 -25.796 359 HD1 HIS 48 HD1 HIS 48 -3.321 32.801 -22.198 360 HD2 HIS 48 HD2 HIS 48 -2.681 30.726 -25.741 361 HE1 HIS 48 HE1 HIS 48 -2.674 30.472 -21.505 362 H GLU 49 H GLU 49 -5.096 36.333 -24.785 363 HA GLU 49 HA GLU 49 -5.292 38.135 -26.164 364 HB2 GLU 49 HB2 GLU 49 -3.421 38.750 -24.283 365 HB3 GLU 49 HB3 GLU 49 -2.515 39.036 -25.762 366 HG2 GLU 49 HG2 GLU 49 -3.415 41.094 -25.489 367 HG3 GLU 49 HG3 GLU 49 -4.709 40.351 -26.425 368 H PHE 50 H PHE 50 -4.274 35.650 -27.302 369 HA PHE 50 HA PHE 50 -3.527 34.872 -29.304 370 HB2 PHE 50 HB2 PHE 50 -4.589 37.404 -29.846 371 HB3 PHE 50 HB3 PHE 50 -3.030 37.381 -30.664 372 HD1 PHE 50 HD1 PHE 50 -5.775 34.906 -30.118 373 HD2 PHE 50 HD2 PHE 50 -3.203 36.868 -32.885 374 HE1 PHE 50 HE1 PHE 50 -6.766 33.605 -31.957 375 HE2 PHE 50 HE2 PHE 50 -4.192 35.571 -34.728 376 HZ PHE 50 HZ PHE 50 -5.972 33.937 -34.265 377 H GLY 51 H GLY 51 -1.695 36.122 -27.135 378 HA2 GLY 51 HA2 GLY 51 0.684 35.286 -27.401 379 HA3 GLY 51 HA3 GLY 51 0.725 36.335 -28.811 380 H ASP 52 H ASP 52 -0.801 38.466 -27.592 381 HA ASP 52 HA ASP 52 1.326 39.904 -26.401 382 HB2 ASP 52 HB2 ASP 52 -1.552 40.720 -26.126 383 HB3 ASP 52 HB3 ASP 52 -0.130 41.736 -26.337 384 H ASN 53 H ASN 53 -1.054 37.796 -25.123 385 HA ASN 53 HA ASN 53 -1.314 36.954 -23.014 386 HB2 ASN 53 HB2 ASN 53 0.673 38.930 -21.927 387 HB3 ASN 53 HB3 ASN 53 0.309 37.303 -21.362 388 HD21 ASN 53 HD21 ASN 53 0.646 35.638 -23.265 389 HD22 ASN 53 HD22 ASN 53 2.193 35.758 -24.028 390 H THR 54 H THR 54 -0.678 40.458 -22.787 391 HA THR 54 HA THR 54 -3.375 40.814 -21.695 392 HB THR 54 HB THR 54 -2.149 42.624 -20.169 393 HG1 THR 54 HG1 THR 54 -0.081 42.263 -19.977 394 HG21 THR 54 HG21 THR 54 -3.039 39.875 -19.788 395 HG22 THR 54 HG22 THR 54 -3.322 41.302 -18.792 396 HG23 THR 54 HG23 THR 54 -1.835 40.374 -18.600 397 H ALA 55 H ALA 55 -1.468 41.519 -24.117 398 HA ALA 55 HA ALA 55 -1.222 43.226 -25.609 399 HB1 ALA 55 HB1 ALA 55 -3.928 43.075 -24.869 400 HB2 ALA 55 HB2 ALA 55 -3.529 44.794 -24.947 401 HB3 ALA 55 HB3 ALA 55 -3.246 43.760 -26.347 402 H GLY 56 H GLY 56 -0.246 43.593 -22.784 403 HA2 GLY 56 HA2 GLY 56 0.007 46.533 -22.905 404 HA3 GLY 56 HA3 GLY 56 -0.226 45.693 -21.378 405 H CYS 57 H CYS 57 1.510 43.456 -22.203 406 HA CYS 57 HA CYS 57 4.087 44.822 -21.817 407 HB2 CYS 57 HB2 CYS 57 2.900 42.355 -20.708 408 HB3 CYS 57 HB3 CYS 57 4.598 42.236 -21.151 409 HG CYS 57 HG CYS 57 3.206 43.688 -18.525 410 H THR 58 H THR 58 2.422 43.730 -24.282 411 HA THR 58 HA THR 58 4.759 43.095 -25.838 412 HB THR 58 HB THR 58 2.961 41.004 -26.528 413 HG1 THR 58 HG1 THR 58 2.186 41.120 -24.378 414 HG21 THR 58 HG21 THR 58 4.857 39.668 -26.381 415 HG22 THR 58 HG22 THR 58 5.524 40.587 -25.031 416 HG23 THR 58 HG23 THR 58 5.543 41.266 -26.658 417 H SER 59 H SER 59 2.330 44.932 -25.632 418 HA SER 59 HA SER 59 1.878 45.120 -28.470 419 HB2 SER 59 HB2 SER 59 -0.232 44.339 -28.626 420 HB3 SER 59 HB3 SER 59 0.078 43.553 -27.078 421 HG SER 59 HG SER 59 -1.746 45.337 -27.571 422 H ALA 60 H ALA 60 1.103 46.233 -25.218 423 HA ALA 60 HA ALA 60 1.087 48.990 -26.244 424 HB1 ALA 60 HB1 ALA 60 -1.214 48.020 -25.627 425 HB2 ALA 60 HB2 ALA 60 -0.667 48.177 -23.956 426 HB3 ALA 60 HB3 ALA 60 -0.773 49.604 -24.987 427 H GLY 61 H GLY 61 3.336 47.679 -25.211 428 HA2 GLY 61 HA2 GLY 61 3.634 48.383 -22.425 429 HA3 GLY 61 HA3 GLY 61 4.874 47.705 -23.470 430 HA PRO 62 HA PRO 62 5.901 52.158 -22.630 431 HB2 PRO 62 HB2 PRO 62 8.492 51.687 -21.968 432 HB3 PRO 62 HB3 PRO 62 7.172 51.614 -20.794 433 HG2 PRO 62 HG2 PRO 62 8.543 49.384 -22.244 434 HG3 PRO 62 HG3 PRO 62 8.060 49.479 -20.541 435 HD2 PRO 62 HD2 PRO 62 6.617 48.130 -22.392 436 HD3 PRO 62 HD3 PRO 62 5.865 48.943 -21.005 437 H HIS 63 H HIS 63 5.552 52.111 -25.023 438 HA HIS 63 HA HIS 63 8.094 52.558 -26.361 439 HB2 HIS 63 HB2 HIS 63 6.907 50.109 -26.687 440 HB3 HIS 63 HB3 HIS 63 6.248 51.014 -28.045 441 HD1 HIS 63 HD1 HIS 63 7.584 50.566 -30.064 442 HD2 HIS 63 HD2 HIS 63 9.960 50.745 -26.662 443 HE1 HIS 63 HE1 HIS 63 9.941 50.221 -30.871 444 H PHE 64 H PHE 64 7.269 52.962 -28.910 445 HA PHE 64 HA PHE 64 6.174 55.511 -28.864 446 HB2 PHE 64 HB2 PHE 64 6.399 53.464 -31.061 447 HB3 PHE 64 HB3 PHE 64 5.714 55.059 -31.350 448 HD1 PHE 64 HD1 PHE 64 7.205 57.062 -30.526 449 HD2 PHE 64 HD2 PHE 64 8.651 53.153 -31.385 450 HE1 PHE 64 HE1 PHE 64 9.466 57.975 -30.855 451 HE2 PHE 64 HE2 PHE 64 10.914 54.059 -31.714 452 HZ PHE 64 HZ PHE 64 11.325 56.474 -31.447 453 H ASN 65 H ASN 65 4.252 55.872 -27.903 454 HA ASN 65 HA ASN 65 1.873 54.985 -29.247 455 HB2 ASN 65 HB2 ASN 65 2.625 53.895 -26.556 456 HB3 ASN 65 HB3 ASN 65 0.927 54.164 -26.944 457 HD21 ASN 65 HD21 ASN 65 3.540 52.072 -27.196 458 HD22 ASN 65 HD22 ASN 65 2.853 50.941 -28.307 459 HA PRO 66 HA PRO 66 0.300 58.798 -27.752 460 HB2 PRO 66 HB2 PRO 66 -2.338 58.247 -27.443 461 HB3 PRO 66 HB3 PRO 66 -1.572 58.411 -29.026 462 HG2 PRO 66 HG2 PRO 66 -2.256 55.928 -27.502 463 HG3 PRO 66 HG3 PRO 66 -2.464 56.273 -29.230 464 HD2 PRO 66 HD2 PRO 66 -0.404 54.794 -28.276 465 HD3 PRO 66 HD3 PRO 66 -0.254 55.828 -29.711 466 H LEU 67 H LEU 67 1.562 57.451 -25.689 467 HA LEU 67 HA LEU 67 0.457 58.616 -23.415 468 HB2 LEU 67 HB2 LEU 67 -0.157 56.475 -22.196 469 HB3 LEU 67 HB3 LEU 67 -1.307 57.085 -23.383 470 HG LEU 67 HG LEU 67 0.490 55.196 -24.605 471 HD11 LEU 67 HD11 LEU 67 -0.798 54.410 -22.025 472 HD12 LEU 67 HD12 LEU 67 0.810 54.026 -22.634 473 HD13 LEU 67 HD13 LEU 67 -0.605 53.232 -23.323 474 HD21 LEU 67 HD21 LEU 67 -2.479 55.367 -24.151 475 HD22 LEU 67 HD22 LEU 67 -1.714 54.068 -25.067 476 HD23 LEU 67 HD23 LEU 67 -1.581 55.738 -25.621 477 H SER 68 H SER 68 2.972 57.966 -24.855 478 HA SER 68 HA SER 68 4.635 57.626 -22.576 479 HB2 SER 68 HB2 SER 68 3.792 55.229 -23.324 480 HB3 SER 68 HB3 SER 68 5.063 55.407 -24.536 481 HG SER 68 HG SER 68 5.280 55.315 -21.729 482 H ARG 69 H ARG 69 4.189 59.354 -24.935 483 HA ARG 69 HA ARG 69 6.979 59.592 -25.720 484 HB2 ARG 69 HB2 ARG 69 6.445 59.778 -28.109 485 HB3 ARG 69 HB3 ARG 69 6.043 58.186 -27.479 486 HG2 ARG 69 HG2 ARG 69 4.191 58.625 -28.739 487 HG3 ARG 69 HG3 ARG 69 3.668 59.247 -27.172 488 HD2 ARG 69 HD2 ARG 69 4.022 61.475 -27.816 489 HD3 ARG 69 HD3 ARG 69 5.008 61.006 -29.199 490 HE ARG 69 HE ARG 69 2.305 60.059 -29.356 491 HH11 ARG 69 HH11 ARG 69 4.425 62.751 -29.977 492 HH12 ARG 69 HH12 ARG 69 3.417 63.427 -31.212 493 HH21 ARG 69 HH21 ARG 69 0.969 60.939 -30.983 494 HH22 ARG 69 HH22 ARG 69 1.452 62.395 -31.783 495 H LYS 70 H LYS 70 4.630 61.015 -24.279 496 HA LYS 70 HA LYS 70 5.040 63.628 -25.582 497 HB2 LYS 70 HB2 LYS 70 2.587 62.541 -24.200 498 HB3 LYS 70 HB3 LYS 70 2.807 64.250 -24.553 499 HG2 LYS 70 HG2 LYS 70 1.758 63.789 -26.465 500 HG3 LYS 70 HG3 LYS 70 3.305 63.114 -26.980 501 HD2 LYS 70 HD2 LYS 70 1.736 61.434 -27.449 502 HD3 LYS 70 HD3 LYS 70 2.497 60.924 -25.940 503 HE2 LYS 70 HE2 LYS 70 0.360 60.653 -25.267 504 HE3 LYS 70 HE3 LYS 70 0.453 62.389 -24.972 505 HZ1 LYS 70 HZ1 LYS 70 -0.470 61.255 -27.550 506 HZ2 LYS 70 HZ2 LYS 70 -0.638 62.843 -26.991 507 HZ3 LYS 70 HZ3 LYS 70 -1.526 61.596 -26.272 508 H HIS 71 H HIS 71 3.573 62.732 -22.481 509 HA HIS 71 HA HIS 71 5.100 64.754 -21.118 510 HB2 HIS 71 HB2 HIS 71 2.829 62.983 -20.484 511 HB3 HIS 71 HB3 HIS 71 3.879 63.360 -19.122 512 HD1 HIS 71 HD1 HIS 71 1.169 64.729 -21.155 513 HD2 HIS 71 HD2 HIS 71 4.089 66.213 -18.599 514 HE1 HIS 71 HE1 HIS 71 0.428 67.058 -20.569 515 H GLY 72 H GLY 72 5.594 61.502 -21.905 516 HA2 GLY 72 HA2 GLY 72 7.715 61.313 -19.858 517 HA3 GLY 72 HA3 GLY 72 6.740 59.927 -20.323 518 H GLY 73 H GLY 73 6.998 61.383 -23.143 519 HA2 GLY 73 HA2 GLY 73 8.691 59.586 -24.351 520 HA3 GLY 73 HA3 GLY 73 8.362 61.191 -24.987 521 HA PRO 74 HA PRO 74 12.471 62.502 -24.234 522 HB2 PRO 74 HB2 PRO 74 12.195 64.965 -23.124 523 HB3 PRO 74 HB3 PRO 74 11.844 64.633 -24.825 524 HG2 PRO 74 HG2 PRO 74 9.957 64.861 -22.513 525 HG3 PRO 74 HG3 PRO 74 9.799 65.511 -24.155 526 HD2 PRO 74 HD2 PRO 74 8.538 63.253 -23.355 527 HD3 PRO 74 HD3 PRO 74 9.099 63.495 -25.022 528 H LYS 75 H LYS 75 13.791 63.844 -22.394 529 HA LYS 75 HA LYS 75 14.724 63.785 -20.320 530 HB2 LYS 75 HB2 LYS 75 11.916 63.811 -19.865 531 HB3 LYS 75 HB3 LYS 75 12.627 62.676 -18.723 532 HG2 LYS 75 HG2 LYS 75 13.449 65.548 -19.098 533 HG3 LYS 75 HG3 LYS 75 12.472 64.909 -17.775 534 HD2 LYS 75 HD2 LYS 75 14.557 63.292 -17.516 535 HD3 LYS 75 HD3 LYS 75 15.386 64.639 -18.296 536 HE2 LYS 75 HE2 LYS 75 15.530 65.591 -16.290 537 HE3 LYS 75 HE3 LYS 75 13.783 65.819 -16.350 538 HZ1 LYS 75 HZ1 LYS 75 14.164 63.210 -15.559 539 HZ2 LYS 75 HZ2 LYS 75 13.669 64.503 -14.586 540 HZ3 LYS 75 HZ3 LYS 75 15.309 64.098 -14.686 541 H ASP 76 H ASP 76 15.745 62.328 -18.898 542 HA ASP 76 HA ASP 76 16.750 60.353 -18.377 543 HB2 ASP 76 HB2 ASP 76 13.904 59.411 -18.754 544 HB3 ASP 76 HB3 ASP 76 15.189 58.389 -18.116 545 H GLU 77 H GLU 77 16.817 61.182 -21.137 546 HA GLU 77 HA GLU 77 17.883 58.844 -22.303 547 HB2 GLU 77 HB2 GLU 77 16.315 58.457 -24.104 548 HB3 GLU 77 HB3 GLU 77 15.481 58.300 -22.565 549 HG2 GLU 77 HG2 GLU 77 14.667 60.640 -22.854 550 HG3 GLU 77 HG3 GLU 77 15.361 60.618 -24.475 551 H GLU 78 H GLU 78 16.462 62.026 -22.883 552 HA GLU 78 HA GLU 78 18.442 62.513 -24.993 553 HB2 GLU 78 HB2 GLU 78 15.998 64.123 -24.233 554 HB3 GLU 78 HB3 GLU 78 17.069 64.457 -25.588 555 HG2 GLU 78 HG2 GLU 78 16.417 61.947 -26.192 556 HG3 GLU 78 HG3 GLU 78 14.977 62.394 -25.282 557 H ARG 79 H ARG 79 16.989 64.254 -22.235 558 HA ARG 79 HA ARG 79 19.301 65.998 -22.082 559 HB2 ARG 79 HB2 ARG 79 16.690 66.461 -21.608 560 HB3 ARG 79 HB3 ARG 79 17.220 66.086 -19.974 561 HG2 ARG 79 HG2 ARG 79 19.043 67.914 -21.256 562 HG3 ARG 79 HG3 ARG 79 17.392 68.534 -21.282 563 HD2 ARG 79 HD2 ARG 79 17.303 68.775 -19.034 564 HD3 ARG 79 HD3 ARG 79 18.295 67.348 -18.737 565 HE ARG 79 HE ARG 79 20.039 69.144 -19.791 566 HH11 ARG 79 HH11 ARG 79 17.805 69.204 -17.122 567 HH12 ARG 79 HH12 ARG 79 18.752 70.309 -16.184 568 HH21 ARG 79 HH21 ARG 79 21.297 70.599 -18.565 569 HH22 ARG 79 HH22 ARG 79 20.737 71.105 -17.006 570 H HIS 80 H HIS 80 18.840 62.959 -21.147 571 HA HIS 80 HA HIS 80 19.984 63.209 -18.470 572 HB2 HIS 80 HB2 HIS 80 18.082 61.536 -19.333 573 HB3 HIS 80 HB3 HIS 80 19.490 60.543 -19.694 574 HD1 HIS 80 HD1 HIS 80 18.186 62.516 -16.705 575 HD2 HIS 80 HD2 HIS 80 20.199 58.995 -17.602 576 HE1 HIS 80 HE1 HIS 80 18.531 61.358 -14.499 577 H VAL 81 H VAL 81 20.930 62.633 -21.697 578 HA VAL 81 HA VAL 81 23.651 62.032 -20.791 579 HB VAL 81 HB VAL 81 22.364 60.567 -23.094 580 HG11 VAL 81 HG11 VAL 81 24.673 59.289 -22.034 581 HG12 VAL 81 HG12 VAL 81 24.432 59.975 -23.641 582 HG13 VAL 81 HG13 VAL 81 25.065 60.981 -22.338 583 HG21 VAL 81 HG21 VAL 81 22.724 58.582 -21.456 584 HG22 VAL 81 HG22 VAL 81 22.680 59.834 -20.212 585 HG23 VAL 81 HG23 VAL 81 21.297 59.604 -21.281 586 H GLY 82 H GLY 82 21.481 63.210 -23.283 587 HA2 GLY 82 HA2 GLY 82 21.879 65.132 -24.583 588 HA3 GLY 82 HA3 GLY 82 23.592 64.996 -24.217 589 H ASP 83 H ASP 83 23.424 62.057 -24.929 590 HA ASP 83 HA ASP 83 24.041 62.414 -27.727 591 HB2 ASP 83 HB2 ASP 83 23.967 59.786 -26.254 592 HB3 ASP 83 HB3 ASP 83 24.928 60.221 -27.665 593 H LEU 84 H LEU 84 21.322 62.908 -27.095 594 HA LEU 84 HA LEU 84 20.070 61.251 -29.056 595 HB2 LEU 84 HB2 LEU 84 20.028 59.850 -26.954 596 HB3 LEU 84 HB3 LEU 84 18.949 61.063 -26.269 597 HG LEU 84 HG LEU 84 17.574 60.508 -28.487 598 HD11 LEU 84 HD11 LEU 84 19.499 58.788 -28.963 599 HD12 LEU 84 HD12 LEU 84 17.818 58.392 -29.321 600 HD13 LEU 84 HD13 LEU 84 18.573 57.777 -27.852 601 HD21 LEU 84 HD21 LEU 84 17.313 60.028 -25.790 602 HD22 LEU 84 HD22 LEU 84 17.122 58.428 -26.503 603 HD23 LEU 84 HD23 LEU 84 16.076 59.751 -27.019 604 H GLY 85 H GLY 85 20.566 64.075 -28.477 605 HA2 GLY 85 HA2 GLY 85 18.431 65.332 -29.516 606 HA3 GLY 85 HA3 GLY 85 17.974 65.200 -27.825 607 H ASN 86 H ASN 86 21.143 65.379 -27.538 608 HA ASN 86 HA ASN 86 21.139 68.323 -27.440 609 HB2 ASN 86 HB2 ASN 86 21.377 66.858 -25.288 610 HB3 ASN 86 HB3 ASN 86 23.032 66.627 -25.843 611 HD21 ASN 86 HD21 ASN 86 20.656 69.194 -25.272 612 HD22 ASN 86 HD22 ASN 86 21.790 70.342 -24.657 613 H VAL 87 H VAL 87 22.954 65.471 -28.379 614 HA VAL 87 HA VAL 87 24.966 67.200 -29.658 615 HB VAL 87 HB VAL 87 25.614 65.341 -27.945 616 HG11 VAL 87 HG11 VAL 87 25.684 63.597 -30.366 617 HG12 VAL 87 HG12 VAL 87 25.725 63.155 -28.660 618 HG13 VAL 87 HG13 VAL 87 24.213 63.684 -29.398 619 HG21 VAL 87 HG21 VAL 87 27.742 65.088 -29.012 620 HG22 VAL 87 HG22 VAL 87 27.049 65.436 -30.596 621 HG23 VAL 87 HG23 VAL 87 27.143 66.707 -29.377 622 H THR 88 H THR 88 22.197 66.104 -30.539 623 HA THR 88 HA THR 88 23.089 65.383 -33.237 624 HB THR 88 HB THR 88 22.560 63.230 -32.630 625 HG1 THR 88 HG1 THR 88 20.771 62.810 -33.767 626 HG21 THR 88 HG21 THR 88 21.920 63.689 -30.334 627 HG22 THR 88 HG22 THR 88 20.727 62.626 -31.082 628 HG23 THR 88 HG23 THR 88 20.369 64.338 -30.870 629 H ALA 89 H ALA 89 20.340 66.260 -31.168 630 HA ALA 89 HA ALA 89 18.471 66.965 -33.052 631 HB1 ALA 89 HB1 ALA 89 18.865 68.714 -30.660 632 HB2 ALA 89 HB2 ALA 89 17.369 68.134 -31.390 633 HB3 ALA 89 HB3 ALA 89 18.381 67.030 -30.457 634 H ASP 90 H ASP 90 21.356 68.701 -32.107 635 HA ASP 90 HA ASP 90 20.759 70.704 -34.183 636 HB2 ASP 90 HB2 ASP 90 21.883 71.088 -31.422 637 HB3 ASP 90 HB3 ASP 90 22.262 72.231 -32.707 638 H LYS 91 H LYS 91 22.307 68.144 -34.166 639 HA LYS 91 HA LYS 91 24.774 69.254 -35.298 640 HB2 LYS 91 HB2 LYS 91 25.495 68.524 -33.147 641 HB3 LYS 91 HB3 LYS 91 24.591 67.022 -33.277 642 HG2 LYS 91 HG2 LYS 91 26.934 66.582 -33.579 643 HG3 LYS 91 HG3 LYS 91 26.089 66.314 -35.105 644 HD2 LYS 91 HD2 LYS 91 26.742 68.807 -35.558 645 HD3 LYS 91 HD3 LYS 91 27.970 68.503 -34.327 646 HE2 LYS 91 HE2 LYS 91 28.122 66.291 -35.985 647 HE3 LYS 91 HE3 LYS 91 27.848 67.632 -37.095 648 HZ1 LYS 91 HZ1 LYS 91 29.715 68.623 -35.422 649 HZ2 LYS 91 HZ2 LYS 91 30.040 67.929 -36.928 650 HZ3 LYS 91 HZ3 LYS 91 30.173 66.998 -35.522 651 H ASP 92 H ASP 92 22.993 66.199 -34.817 652 HA ASP 92 HA ASP 92 23.931 65.127 -37.313 653 HB2 ASP 92 HB2 ASP 92 21.772 64.120 -35.447 654 HB3 ASP 92 HB3 ASP 92 22.469 63.218 -36.790 655 H GLY 93 H GLY 93 20.748 66.156 -36.077 656 HA2 GLY 93 HA2 GLY 93 19.681 66.092 -38.798 657 HA3 GLY 93 HA3 GLY 93 18.753 66.323 -37.322 658 H VAL 94 H VAL 94 21.629 68.178 -37.697 659 HA VAL 94 HA VAL 94 20.209 70.460 -38.820 660 HB VAL 94 HB VAL 94 21.404 70.450 -36.053 661 HG11 VAL 94 HG11 VAL 94 21.210 72.624 -38.009 662 HG12 VAL 94 HG12 VAL 94 20.529 73.000 -36.424 663 HG13 VAL 94 HG13 VAL 94 22.208 72.483 -36.562 664 HG21 VAL 94 HG21 VAL 94 19.042 69.785 -36.276 665 HG22 VAL 94 HG22 VAL 94 19.233 71.292 -35.381 666 HG23 VAL 94 HG23 VAL 94 18.698 71.327 -37.061 667 H ALA 95 H ALA 95 23.210 69.082 -37.590 668 HA ALA 95 HA ALA 95 24.700 70.844 -39.426 669 HB1 ALA 95 HB1 ALA 95 25.035 70.632 -36.712 670 HB2 ALA 95 HB2 ALA 95 26.283 69.558 -37.342 671 HB3 ALA 95 HB3 ALA 95 26.234 71.244 -37.850 672 H ASP 96 H ASP 96 23.423 68.249 -40.004 673 HA ASP 96 HA ASP 96 25.668 67.028 -41.325 674 HB2 ASP 96 HB2 ASP 96 24.870 66.008 -38.795 675 HB3 ASP 96 HB3 ASP 96 24.363 64.845 -40.018 676 H VAL 97 H VAL 97 22.253 67.023 -40.522 677 HA VAL 97 HA VAL 97 21.689 65.968 -43.216 678 HB VAL 97 HB VAL 97 19.927 65.452 -40.826 679 HG11 VAL 97 HG11 VAL 97 19.873 64.782 -43.697 680 HG12 VAL 97 HG12 VAL 97 19.420 63.485 -42.591 681 HG13 VAL 97 HG13 VAL 97 18.546 65.018 -42.559 682 HG21 VAL 97 HG21 VAL 97 21.129 63.052 -41.628 683 HG22 VAL 97 HG22 VAL 97 22.440 64.224 -41.488 684 HG23 VAL 97 HG23 VAL 97 21.377 63.924 -40.115 685 H SER 98 H SER 98 21.775 68.708 -41.768 686 HA SER 98 HA SER 98 19.594 69.849 -43.218 687 HB2 SER 98 HB2 SER 98 19.010 69.011 -40.596 688 HB3 SER 98 HB3 SER 98 19.195 70.762 -40.507 689 HG SER 98 HG SER 98 17.141 69.366 -41.460 690 H ILE 99 H ILE 99 22.538 70.047 -42.797 691 HA ILE 99 HA ILE 99 23.268 72.374 -41.453 692 HB ILE 99 HB ILE 99 24.544 71.399 -44.004 693 HG12 ILE 99 HG12 ILE 99 25.974 70.423 -41.793 694 HG13 ILE 99 HG13 ILE 99 24.283 70.083 -41.443 695 HG21 ILE 99 HG21 ILE 99 26.605 72.271 -42.780 696 HG22 ILE 99 HG22 ILE 99 25.479 73.466 -43.419 697 HG23 ILE 99 HG23 ILE 99 25.472 73.081 -41.699 698 HD11 ILE 99 HD11 ILE 99 24.121 68.541 -43.071 699 HD12 ILE 99 HD12 ILE 99 25.206 69.413 -44.157 700 HD13 ILE 99 HD13 ILE 99 25.868 68.446 -42.840 701 H GLU 100 H GLU 100 22.099 71.922 -44.757 702 HA GLU 100 HA GLU 100 22.460 74.636 -45.539 703 HB2 GLU 100 HB2 GLU 100 20.434 72.821 -46.801 704 HB3 GLU 100 HB3 GLU 100 21.439 74.050 -47.554 705 HG2 GLU 100 HG2 GLU 100 22.604 72.275 -48.273 706 HG3 GLU 100 HG3 GLU 100 23.345 72.376 -46.677 707 H ASP 101 H ASP 101 19.758 72.787 -44.228 708 HA ASP 101 HA ASP 101 17.863 74.914 -44.472 709 HB2 ASP 101 HB2 ASP 101 16.964 72.720 -44.418 710 HB3 ASP 101 HB3 ASP 101 17.863 72.306 -42.961 711 H SER 102 H SER 102 20.384 74.233 -42.302 712 HA SER 102 HA SER 102 19.194 75.825 -40.153 713 HB2 SER 102 HB2 SER 102 20.641 73.558 -39.983 714 HB3 SER 102 HB3 SER 102 21.942 74.741 -39.861 715 HG SER 102 HG SER 102 19.602 74.925 -38.286 716 H VAL 103 H VAL 103 21.982 75.778 -42.330 717 HA VAL 103 HA VAL 103 23.230 78.110 -41.357 718 HB VAL 103 HB VAL 103 24.234 76.373 -42.917 719 HG11 VAL 103 HG11 VAL 103 23.689 76.245 -45.105 720 HG12 VAL 103 HG12 VAL 103 22.155 76.906 -44.535 721 HG13 VAL 103 HG13 VAL 103 23.370 77.975 -45.237 722 HG21 VAL 103 HG21 VAL 103 24.650 79.154 -43.952 723 HG22 VAL 103 HG22 VAL 103 25.143 78.708 -42.317 724 HG23 VAL 103 HG23 VAL 103 25.834 77.871 -43.707 725 H ILE 104 H ILE 104 20.480 77.629 -43.388 726 HA ILE 104 HA ILE 104 20.514 80.400 -44.313 727 HB ILE 104 HB ILE 104 18.586 78.170 -44.971 728 HG12 ILE 104 HG12 ILE 104 20.688 79.391 -46.761 729 HG13 ILE 104 HG13 ILE 104 20.999 77.963 -45.780 730 HG21 ILE 104 HG21 ILE 104 17.417 80.191 -45.260 731 HG22 ILE 104 HG22 ILE 104 18.822 80.999 -45.948 732 HG23 ILE 104 HG23 ILE 104 17.987 79.748 -46.869 733 HD11 ILE 104 HD11 ILE 104 20.417 76.992 -47.754 734 HD12 ILE 104 HD12 ILE 104 18.834 77.083 -46.981 735 HD13 ILE 104 HD13 ILE 104 19.296 78.282 -48.189 736 H SER 105 H SER 105 18.817 78.271 -42.127 737 HA SER 105 HA SER 105 16.668 80.111 -41.613 738 HB2 SER 105 HB2 SER 105 15.919 78.514 -39.975 739 HB3 SER 105 HB3 SER 105 16.462 77.615 -41.392 740 HG SER 105 HG SER 105 17.820 77.985 -38.934 741 H LEU 106 H LEU 106 19.810 79.444 -40.277 742 HA LEU 106 HA LEU 106 19.483 80.662 -37.759 743 HB2 LEU 106 HB2 LEU 106 21.359 79.186 -38.357 744 HB3 LEU 106 HB3 LEU 106 21.979 80.436 -39.436 745 HG LEU 106 HG LEU 106 22.038 81.885 -37.263 746 HD11 LEU 106 HD11 LEU 106 21.164 80.718 -35.539 747 HD12 LEU 106 HD12 LEU 106 22.803 80.071 -35.441 748 HD13 LEU 106 HD13 LEU 106 21.539 79.153 -36.262 749 HD21 LEU 106 HD21 LEU 106 24.320 81.189 -36.878 750 HD22 LEU 106 HD22 LEU 106 23.978 81.170 -38.606 751 HD23 LEU 106 HD23 LEU 106 24.025 79.658 -37.701 752 H SER 107 H SER 107 20.560 81.940 -40.883 753 HA SER 107 HA SER 107 20.616 84.642 -39.746 754 HB2 SER 107 HB2 SER 107 21.883 85.302 -41.670 755 HB3 SER 107 HB3 SER 107 22.567 83.778 -41.101 756 HG SER 107 HG SER 107 22.135 84.000 -43.442 757 H GLY 108 H GLY 108 18.561 82.594 -41.416 758 HA2 GLY 108 HA2 GLY 108 17.189 84.814 -42.782 759 HA3 GLY 108 HA3 GLY 108 16.956 83.107 -43.128 760 H ASP 109 H ASP 109 17.073 83.242 -39.882 761 HA ASP 109 HA ASP 109 14.241 83.935 -39.548 762 HB2 ASP 109 HB2 ASP 109 15.104 81.319 -39.681 763 HB3 ASP 109 HB3 ASP 109 15.070 81.628 -37.947 764 H HIS 110 H HIS 110 17.110 84.870 -38.751 765 HA HIS 110 HA HIS 110 16.395 85.430 -35.955 766 HB2 HIS 110 HB2 HIS 110 18.291 83.676 -36.365 767 HB3 HIS 110 HB3 HIS 110 19.267 85.093 -36.749 768 HD1 HIS 110 HD1 HIS 110 17.470 83.437 -33.899 769 HD2 HIS 110 HD2 HIS 110 20.037 86.634 -34.572 770 HE1 HIS 110 HE1 HIS 110 18.211 84.194 -31.620 771 H CYS 111 H CYS 111 17.182 86.600 -38.979 772 HA CYS 111 HA CYS 111 18.019 89.199 -37.865 773 HB2 CYS 111 HB2 CYS 111 18.673 87.901 -40.509 774 HB3 CYS 111 HB3 CYS 111 18.941 89.611 -40.201 775 HG CYS 111 HG CYS 111 21.363 88.152 -40.011 776 H ILE 112 H ILE 112 15.886 87.529 -40.081 777 HA ILE 112 HA ILE 112 14.536 90.060 -40.719 778 HB ILE 112 HB ILE 112 15.154 88.722 -42.658 779 HG12 ILE 112 HG12 ILE 112 12.193 88.353 -42.471 780 HG13 ILE 112 HG13 ILE 112 12.853 89.980 -42.358 781 HG21 ILE 112 HG21 ILE 112 13.334 86.576 -41.585 782 HG22 ILE 112 HG22 ILE 112 14.307 86.519 -43.054 783 HG23 ILE 112 HG23 ILE 112 15.094 86.530 -41.477 784 HD11 ILE 112 HD11 ILE 112 13.099 88.053 -44.647 785 HD12 ILE 112 HD12 ILE 112 12.260 89.604 -44.617 786 HD13 ILE 112 HD13 ILE 112 14.020 89.553 -44.529 787 H ILE 113 H ILE 113 13.946 86.799 -39.480 788 HA ILE 113 HA ILE 113 11.220 87.576 -38.734 789 HB ILE 113 HB ILE 113 12.564 84.872 -38.708 790 HG12 ILE 113 HG12 ILE 113 10.175 85.239 -40.344 791 HG13 ILE 113 HG13 ILE 113 11.491 86.303 -40.824 792 HG21 ILE 113 HG21 ILE 113 10.124 85.837 -37.440 793 HG22 ILE 113 HG22 ILE 113 9.864 84.443 -38.486 794 HG23 ILE 113 HG23 ILE 113 11.030 84.349 -37.169 795 HD11 ILE 113 HD11 ILE 113 11.127 83.646 -41.541 796 HD12 ILE 113 HD12 ILE 113 12.562 84.636 -41.811 797 HD13 ILE 113 HD13 ILE 113 12.446 83.626 -40.370 798 H GLY 114 H GLY 114 13.943 85.806 -37.239 799 HA2 GLY 114 HA2 GLY 114 12.998 85.990 -34.605 800 HA3 GLY 114 HA3 GLY 114 14.672 85.716 -35.065 801 H ARG 115 H ARG 115 14.624 88.322 -36.586 802 HA ARG 115 HA ARG 115 15.584 89.948 -34.436 803 HB2 ARG 115 HB2 ARG 115 16.524 89.921 -36.773 804 HB3 ARG 115 HB3 ARG 115 15.083 90.784 -37.294 805 HG2 ARG 115 HG2 ARG 115 16.395 92.045 -35.025 806 HG3 ARG 115 HG3 ARG 115 17.431 91.921 -36.448 807 HD2 ARG 115 HD2 ARG 115 15.666 92.973 -37.800 808 HD3 ARG 115 HD3 ARG 115 14.671 93.132 -36.352 809 HE ARG 115 HE ARG 115 17.241 94.349 -36.054 810 HH11 ARG 115 HH11 ARG 115 14.039 94.800 -37.341 811 HH12 ARG 115 HH12 ARG 115 14.106 96.529 -37.255 812 HH21 ARG 115 HH21 ARG 115 17.344 96.624 -35.937 813 HH22 ARG 115 HH22 ARG 115 15.987 97.565 -36.457 814 H THR 116 H THR 116 12.535 89.421 -35.784 815 HA THR 116 HA THR 116 11.534 92.049 -34.936 816 HB THR 116 HB THR 116 9.477 90.411 -36.081 817 HG1 THR 116 HG1 THR 116 10.383 89.711 -37.899 818 HG21 THR 116 HG21 THR 116 10.776 93.033 -36.554 819 HG22 THR 116 HG22 THR 116 9.068 92.632 -36.365 820 HG23 THR 116 HG23 THR 116 9.879 92.331 -37.901 821 H LEU 117 H LEU 117 11.256 88.610 -34.322 822 HA LEU 117 HA LEU 117 9.135 88.998 -32.375 823 HB2 LEU 117 HB2 LEU 117 9.720 86.945 -34.031 824 HB3 LEU 117 HB3 LEU 117 10.498 86.391 -32.550 825 HG LEU 117 HG LEU 117 8.250 85.473 -32.784 826 HD11 LEU 117 HD11 LEU 117 9.310 86.205 -30.545 827 HD12 LEU 117 HD12 LEU 117 7.598 85.791 -30.583 828 HD13 LEU 117 HD13 LEU 117 8.095 87.482 -30.574 829 HD21 LEU 117 HD21 LEU 117 7.457 87.607 -34.025 830 HD22 LEU 117 HD22 LEU 117 7.099 88.209 -32.406 831 HD23 LEU 117 HD23 LEU 117 6.323 86.738 -32.993 832 H VAL 118 H VAL 118 12.582 88.535 -32.483 833 HA VAL 118 HA VAL 118 12.685 88.274 -29.559 834 HB VAL 118 HB VAL 118 15.016 88.006 -31.449 835 HG11 VAL 118 HG11 VAL 118 14.796 86.555 -28.871 836 HG12 VAL 118 HG12 VAL 118 16.214 87.239 -29.671 837 HG13 VAL 118 HG13 VAL 118 15.093 88.292 -28.809 838 HG21 VAL 118 HG21 VAL 118 13.313 86.403 -32.128 839 HG22 VAL 118 HG22 VAL 118 14.673 85.580 -31.366 840 HG23 VAL 118 HG23 VAL 118 13.177 85.826 -30.467 841 H VAL 119 H VAL 119 14.632 89.904 -32.067 842 HA VAL 119 HA VAL 119 15.687 91.845 -30.312 843 HB VAL 119 HB VAL 119 15.596 91.524 -33.272 844 HG11 VAL 119 HG11 VAL 119 16.177 94.097 -31.837 845 HG12 VAL 119 HG12 VAL 119 16.872 93.728 -33.417 846 HG13 VAL 119 HG13 VAL 119 15.121 93.822 -33.222 847 HG21 VAL 119 HG21 VAL 119 17.544 91.387 -31.092 848 HG22 VAL 119 HG22 VAL 119 17.519 90.554 -32.646 849 HG23 VAL 119 HG23 VAL 119 18.133 92.204 -32.540 850 H HIS 120 H HIS 120 12.775 91.727 -32.240 851 HA HIS 120 HA HIS 120 12.058 94.405 -31.235 852 HB2 HIS 120 HB2 HIS 120 12.332 93.776 -33.859 853 HB3 HIS 120 HB3 HIS 120 10.631 93.394 -33.618 854 HD1 HIS 120 HD1 HIS 120 12.777 96.122 -34.476 855 HD2 HIS 120 HD2 HIS 120 9.221 95.730 -32.364 856 HE1 HIS 120 HE1 HIS 120 11.770 98.426 -34.422 857 H GLU 121 H GLU 121 11.628 92.019 -29.785 858 HA GLU 121 HA GLU 121 9.060 90.928 -30.134 859 HB2 GLU 121 HB2 GLU 121 10.973 90.046 -28.687 860 HB3 GLU 121 HB3 GLU 121 10.453 91.209 -27.477 861 HG2 GLU 121 HG2 GLU 121 8.288 90.158 -27.333 862 HG3 GLU 121 HG3 GLU 121 8.709 89.050 -28.638 863 H LYS 122 H LYS 122 10.059 93.978 -29.014 864 HA LYS 122 HA LYS 122 7.307 94.592 -28.214 865 HB2 LYS 122 HB2 LYS 122 8.253 94.385 -26.087 866 HB3 LYS 122 HB3 LYS 122 9.797 95.051 -26.604 867 HG2 LYS 122 HG2 LYS 122 8.912 97.259 -26.673 868 HG3 LYS 122 HG3 LYS 122 7.265 96.668 -26.438 869 HD2 LYS 122 HD2 LYS 122 7.601 96.226 -24.201 870 HD3 LYS 122 HD3 LYS 122 9.346 96.036 -24.392 871 HE2 LYS 122 HE2 LYS 122 9.308 98.556 -24.984 872 HE3 LYS 122 HE3 LYS 122 7.722 98.547 -24.216 873 HZ1 LYS 122 HZ1 LYS 122 9.527 97.201 -22.549 874 HZ2 LYS 122 HZ2 LYS 122 8.703 98.648 -22.251 875 HZ3 LYS 122 HZ3 LYS 122 10.225 98.678 -22.990 876 H ALA 123 H ALA 123 10.479 96.204 -28.516 877 HA ALA 123 HA ALA 123 9.868 97.694 -30.793 878 HB1 ALA 123 HB1 ALA 123 9.162 99.036 -28.204 879 HB2 ALA 123 HB2 ALA 123 9.599 99.959 -29.643 880 HB3 ALA 123 HB3 ALA 123 8.196 98.889 -29.671 881 H ASP 124 H ASP 124 11.899 97.758 -31.507 882 HA ASP 124 HA ASP 124 14.158 98.054 -31.595 883 HB2 ASP 124 HB2 ASP 124 13.073 100.424 -31.000 884 HB3 ASP 124 HB3 ASP 124 14.041 100.207 -29.545 885 H ASP 125 H ASP 125 13.130 96.206 -29.578 886 HA ASP 125 HA ASP 125 15.534 95.622 -28.243 887 HB2 ASP 125 HB2 ASP 125 14.210 97.635 -26.945 888 HB3 ASP 125 HB3 ASP 125 13.593 96.210 -26.114 Start of MODEL 4 1 H ALA 1 H1 ALA 1 -18.070 8.815 -26.376 2 HA ALA 1 HA ALA 1 -15.248 9.490 -26.648 3 HB1 ALA 1 HB1 ALA 1 -14.816 8.386 -28.569 4 HB2 ALA 1 HB2 ALA 1 -16.065 7.296 -27.964 5 HB3 ALA 1 HB3 ALA 1 -16.472 8.532 -29.155 6 H THR 2 H THR 2 -15.304 10.589 -29.167 7 HA THR 2 HA THR 2 -17.509 12.189 -29.793 8 HB THR 2 HB THR 2 -15.988 14.340 -28.936 9 HG1 THR 2 HG1 THR 2 -16.314 12.785 -26.623 10 HG21 THR 2 HG21 THR 2 -17.938 13.978 -26.980 11 HG22 THR 2 HG22 THR 2 -18.576 13.159 -28.407 12 HG23 THR 2 HG23 THR 2 -18.115 14.858 -28.499 13 H LYS 3 H LYS 3 -14.024 11.830 -29.727 14 HA LYS 3 HA LYS 3 -13.719 12.024 -32.495 15 HB2 LYS 3 HB2 LYS 3 -12.435 14.232 -32.525 16 HB3 LYS 3 HB3 LYS 3 -14.188 14.331 -32.453 17 HG2 LYS 3 HG2 LYS 3 -13.418 15.928 -30.929 18 HG3 LYS 3 HG3 LYS 3 -13.925 14.557 -29.938 19 HD2 LYS 3 HD2 LYS 3 -11.705 13.898 -29.529 20 HD3 LYS 3 HD3 LYS 3 -11.077 14.903 -30.836 21 HE2 LYS 3 HE2 LYS 3 -10.587 15.893 -28.666 22 HE3 LYS 3 HE3 LYS 3 -11.693 16.912 -29.585 23 HZ1 LYS 3 HZ1 LYS 3 -12.064 15.732 -27.044 24 HZ2 LYS 3 HZ2 LYS 3 -13.267 15.188 -28.101 25 HZ3 LYS 3 HZ3 LYS 3 -13.047 16.847 -27.851 26 H ALA 4 H ALA 4 -12.801 10.532 -30.179 27 HA ALA 4 HA ALA 4 -9.955 11.116 -30.006 28 HB1 ALA 4 HB1 ALA 4 -11.887 9.622 -28.424 29 HB2 ALA 4 HB2 ALA 4 -10.361 8.761 -28.642 30 HB3 ALA 4 HB3 ALA 4 -10.370 10.378 -27.941 31 H VAL 5 H VAL 5 -12.133 8.752 -31.416 32 HA VAL 5 HA VAL 5 -9.824 7.537 -32.787 33 HB VAL 5 HB VAL 5 -12.351 6.038 -32.122 34 HG11 VAL 5 HG11 VAL 5 -11.096 5.094 -33.941 35 HG12 VAL 5 HG12 VAL 5 -9.600 5.179 -33.009 36 HG13 VAL 5 HG13 VAL 5 -10.885 4.074 -32.518 37 HG21 VAL 5 HG21 VAL 5 -9.780 6.172 -30.551 38 HG22 VAL 5 HG22 VAL 5 -11.384 6.669 -30.012 39 HG23 VAL 5 HG23 VAL 5 -11.041 4.964 -30.301 40 H CYS 6 H CYS 6 -13.197 8.506 -32.958 41 HA CYS 6 HA CYS 6 -13.678 7.684 -35.617 42 HB2 CYS 6 HB2 CYS 6 -14.984 9.895 -34.013 43 HB3 CYS 6 HB3 CYS 6 -15.604 9.236 -35.522 44 HG CYS 6 HG CYS 6 -15.959 6.640 -34.424 45 H VAL 7 H VAL 7 -14.573 10.859 -35.633 46 HA VAL 7 HA VAL 7 -12.652 11.513 -37.679 47 HB VAL 7 HB VAL 7 -14.698 13.386 -36.509 48 HG11 VAL 7 HG11 VAL 7 -12.741 13.789 -38.384 49 HG12 VAL 7 HG12 VAL 7 -14.153 13.425 -39.377 50 HG13 VAL 7 HG13 VAL 7 -14.209 14.751 -38.215 51 HG21 VAL 7 HG21 VAL 7 -15.068 11.023 -38.264 52 HG22 VAL 7 HG22 VAL 7 -16.158 11.733 -37.071 53 HG23 VAL 7 HG23 VAL 7 -15.978 12.482 -38.658 54 H LEU 8 H LEU 8 -11.184 11.137 -35.471 55 HA LEU 8 HA LEU 8 -10.784 13.355 -33.800 56 HB2 LEU 8 HB2 LEU 8 -9.878 11.264 -33.156 57 HB3 LEU 8 HB3 LEU 8 -8.971 11.117 -34.661 58 HG LEU 8 HG LEU 8 -8.311 13.392 -32.867 59 HD11 LEU 8 HD11 LEU 8 -6.780 11.942 -31.573 60 HD12 LEU 8 HD12 LEU 8 -7.544 10.532 -32.306 61 HD13 LEU 8 HD13 LEU 8 -8.483 11.601 -31.266 62 HD21 LEU 8 HD21 LEU 8 -5.999 12.240 -33.680 63 HD22 LEU 8 HD22 LEU 8 -6.855 13.495 -34.575 64 HD23 LEU 8 HD23 LEU 8 -7.076 11.799 -35.004 65 H LYS 9 H LYS 9 -9.981 12.843 -37.082 66 HA LYS 9 HA LYS 9 -7.927 14.916 -37.093 67 HB2 LYS 9 HB2 LYS 9 -9.004 13.280 -39.396 68 HB3 LYS 9 HB3 LYS 9 -7.581 14.312 -39.424 69 HG2 LYS 9 HG2 LYS 9 -6.302 12.665 -38.680 70 HG3 LYS 9 HG3 LYS 9 -7.369 12.390 -37.301 71 HD2 LYS 9 HD2 LYS 9 -8.440 11.414 -39.843 72 HD3 LYS 9 HD3 LYS 9 -6.940 10.627 -39.351 73 HE2 LYS 9 HE2 LYS 9 -7.938 10.126 -37.163 74 HE3 LYS 9 HE3 LYS 9 -9.440 10.889 -37.681 75 HZ1 LYS 9 HZ1 LYS 9 -8.740 9.003 -39.610 76 HZ2 LYS 9 HZ2 LYS 9 -10.056 8.965 -38.549 77 HZ3 LYS 9 HZ3 LYS 9 -8.590 8.247 -38.104 78 H GLY 10 H GLY 10 -11.205 14.839 -37.139 79 HA2 GLY 10 HA2 GLY 10 -11.315 17.410 -38.564 80 HA3 GLY 10 HA3 GLY 10 -12.467 16.148 -38.978 81 H ASP 11 H ASP 11 -11.203 17.332 -35.865 82 HA ASP 11 HA ASP 11 -13.920 18.150 -35.130 83 HB2 ASP 11 HB2 ASP 11 -12.976 15.764 -34.263 84 HB3 ASP 11 HB3 ASP 11 -12.371 16.818 -32.987 85 H GLY 12 H GLY 12 -11.270 19.448 -35.807 86 HA2 GLY 12 HA2 GLY 12 -10.127 21.324 -35.139 87 HA3 GLY 12 HA3 GLY 12 -11.441 21.602 -34.007 88 HA PRO 13 HA PRO 13 -8.559 18.825 -31.406 89 HB2 PRO 13 HB2 PRO 13 -6.528 17.515 -32.645 90 HB3 PRO 13 HB3 PRO 13 -8.160 16.848 -32.510 91 HG2 PRO 13 HG2 PRO 13 -6.870 18.246 -34.820 92 HG3 PRO 13 HG3 PRO 13 -7.890 16.797 -34.818 93 HD2 PRO 13 HD2 PRO 13 -8.841 19.246 -35.474 94 HD3 PRO 13 HD3 PRO 13 -9.841 18.016 -34.674 95 H VAL 14 H VAL 14 -6.427 19.837 -34.091 96 HA VAL 14 HA VAL 14 -4.623 21.096 -32.181 97 HB VAL 14 HB VAL 14 -3.166 21.486 -34.150 98 HG11 VAL 14 HG11 VAL 14 -2.313 19.372 -34.105 99 HG12 VAL 14 HG12 VAL 14 -3.428 19.253 -32.743 100 HG13 VAL 14 HG13 VAL 14 -3.889 18.610 -34.321 101 HG21 VAL 14 HG21 VAL 14 -3.782 21.098 -36.288 102 HG22 VAL 14 HG22 VAL 14 -4.762 19.694 -35.863 103 HG23 VAL 14 HG23 VAL 14 -5.408 21.320 -35.642 104 H GLN 15 H GLN 15 -7.187 21.952 -34.257 105 HA GLN 15 HA GLN 15 -6.344 24.749 -34.403 106 HB2 GLN 15 HB2 GLN 15 -7.271 23.487 -36.413 107 HB3 GLN 15 HB3 GLN 15 -8.832 23.551 -35.609 108 HG2 GLN 15 HG2 GLN 15 -8.765 25.335 -37.159 109 HG3 GLN 15 HG3 GLN 15 -8.604 26.037 -35.550 110 HE21 GLN 15 HE21 GLN 15 -7.738 27.886 -36.671 111 HE22 GLN 15 HE22 GLN 15 -6.072 27.903 -37.133 112 H GLY 16 H GLY 16 -9.143 22.809 -33.361 113 HA2 GLY 16 HA2 GLY 16 -10.553 24.967 -32.194 114 HA3 GLY 16 HA3 GLY 16 -10.823 23.262 -31.863 115 H ILE 17 H ILE 17 -8.148 22.739 -30.918 116 HA ILE 17 HA ILE 17 -8.495 23.676 -28.208 117 HB ILE 17 HB ILE 17 -6.328 21.912 -29.358 118 HG12 ILE 17 HG12 ILE 17 -8.876 21.176 -27.898 119 HG13 ILE 17 HG13 ILE 17 -8.586 20.953 -29.620 120 HG21 ILE 17 HG21 ILE 17 -5.618 22.918 -27.290 121 HG22 ILE 17 HG22 ILE 17 -7.142 22.489 -26.513 122 HG23 ILE 17 HG23 ILE 17 -6.012 21.223 -26.998 123 HD11 ILE 17 HD11 ILE 17 -7.982 18.890 -29.023 124 HD12 ILE 17 HD12 ILE 17 -6.466 19.645 -28.533 125 HD13 ILE 17 HD13 ILE 17 -7.727 19.344 -27.338 126 H ILE 18 H ILE 18 -6.616 24.531 -30.955 127 HA ILE 18 HA ILE 18 -4.393 25.707 -29.678 128 HB ILE 18 HB ILE 18 -5.427 25.549 -32.359 129 HG12 ILE 18 HG12 ILE 18 -3.263 24.661 -31.566 130 HG13 ILE 18 HG13 ILE 18 -3.061 25.747 -32.934 131 HG21 ILE 18 HG21 ILE 18 -4.356 28.239 -31.521 132 HG22 ILE 18 HG22 ILE 18 -4.566 27.708 -33.188 133 HG23 ILE 18 HG23 ILE 18 -5.971 27.891 -32.139 134 HD11 ILE 18 HD11 ILE 18 -1.841 25.864 -30.389 135 HD12 ILE 18 HD12 ILE 18 -1.627 26.947 -31.766 136 HD13 ILE 18 HD13 ILE 18 -2.873 27.285 -30.564 137 H ASN 19 H ASN 19 -7.604 26.904 -30.447 138 HA ASN 19 HA ASN 19 -6.916 29.569 -29.468 139 HB2 ASN 19 HB2 ASN 19 -8.995 28.443 -31.203 140 HB3 ASN 19 HB3 ASN 19 -9.604 29.633 -30.056 141 HD21 ASN 19 HD21 ASN 19 -9.328 29.753 -32.969 142 HD22 ASN 19 HD22 ASN 19 -8.361 31.148 -33.293 143 H PHE 20 H PHE 20 -8.503 26.673 -28.476 144 HA PHE 20 HA PHE 20 -9.990 27.918 -26.336 145 HB2 PHE 20 HB2 PHE 20 -9.791 25.242 -27.527 146 HB3 PHE 20 HB3 PHE 20 -9.999 25.230 -25.780 147 HD1 PHE 20 HD1 PHE 20 -11.770 27.381 -25.200 148 HD2 PHE 20 HD2 PHE 20 -11.782 24.756 -28.550 149 HE1 PHE 20 HE1 PHE 20 -14.183 27.763 -25.486 150 HE2 PHE 20 HE2 PHE 20 -14.195 25.135 -28.842 151 HZ PHE 20 HZ PHE 20 -15.400 26.639 -27.308 152 H GLU 21 H GLU 21 -6.961 26.209 -26.750 153 HA GLU 21 HA GLU 21 -6.477 26.011 -23.907 154 HB2 GLU 21 HB2 GLU 21 -5.673 24.329 -25.618 155 HB3 GLU 21 HB3 GLU 21 -4.509 25.537 -26.144 156 HG2 GLU 21 HG2 GLU 21 -4.137 25.439 -23.417 157 HG3 GLU 21 HG3 GLU 21 -4.442 23.761 -23.855 158 H GLN 22 H GLN 22 -6.094 28.369 -26.299 159 HA GLN 22 HA GLN 22 -3.921 29.712 -24.860 160 HB2 GLN 22 HB2 GLN 22 -3.567 31.025 -26.786 161 HB3 GLN 22 HB3 GLN 22 -3.874 29.401 -27.386 162 HG2 GLN 22 HG2 GLN 22 -5.220 30.531 -28.797 163 HG3 GLN 22 HG3 GLN 22 -6.362 30.329 -27.469 164 HE21 GLN 22 HE21 GLN 22 -6.619 32.328 -29.367 165 HE22 GLN 22 HE22 GLN 22 -6.373 33.860 -28.607 166 H LYS 23 H LYS 23 -7.295 30.033 -25.738 167 HA LYS 23 HA LYS 23 -7.503 32.709 -24.658 168 HB2 LYS 23 HB2 LYS 23 -9.537 30.775 -25.764 169 HB3 LYS 23 HB3 LYS 23 -9.972 32.348 -25.108 170 HG2 LYS 23 HG2 LYS 23 -8.591 33.443 -26.790 171 HG3 LYS 23 HG3 LYS 23 -8.123 31.870 -27.440 172 HD2 LYS 23 HD2 LYS 23 -10.503 31.411 -27.935 173 HD3 LYS 23 HD3 LYS 23 -10.909 33.030 -27.363 174 HE2 LYS 23 HE2 LYS 23 -9.915 34.059 -29.172 175 HE3 LYS 23 HE3 LYS 23 -8.835 32.701 -29.486 176 HZ1 LYS 23 HZ1 LYS 23 -10.502 32.795 -31.182 177 HZ2 LYS 23 HZ2 LYS 23 -11.750 32.811 -30.042 178 HZ3 LYS 23 HZ3 LYS 23 -10.794 31.429 -30.229 179 H GLU 24 H GLU 24 -8.355 29.424 -23.709 180 HA GLU 24 HA GLU 24 -9.620 30.324 -21.262 181 HB2 GLU 24 HB2 GLU 24 -10.045 28.153 -22.811 182 HB3 GLU 24 HB3 GLU 24 -8.958 27.460 -21.615 183 HG2 GLU 24 HG2 GLU 24 -10.446 27.739 -19.892 184 HG3 GLU 24 HG3 GLU 24 -11.291 29.063 -20.695 185 H SER 25 H SER 25 -6.574 30.400 -22.082 186 HA SER 25 HA SER 25 -5.589 29.370 -19.503 187 HB2 SER 25 HB2 SER 25 -4.362 29.357 -22.236 188 HB3 SER 25 HB3 SER 25 -3.315 29.410 -20.817 189 HG SER 25 HG SER 25 -4.746 27.541 -20.122 190 H ASN 26 H ASN 26 -6.599 32.095 -20.640 191 HA ASN 26 HA ASN 26 -5.014 33.725 -18.971 192 HB2 ASN 26 HB2 ASN 26 -3.781 33.260 -21.401 193 HB3 ASN 26 HB3 ASN 26 -4.590 34.803 -21.655 194 HD21 ASN 26 HD21 ASN 26 -2.365 33.080 -19.547 195 HD22 ASN 26 HD22 ASN 26 -1.514 34.480 -18.997 196 H GLY 27 H GLY 27 -7.204 33.504 -21.715 197 HA2 GLY 27 HA2 GLY 27 -8.251 36.125 -21.568 198 HA3 GLY 27 HA3 GLY 27 -9.043 34.743 -22.311 199 HA PRO 28 HA PRO 28 -12.010 35.434 -19.062 200 HB2 PRO 28 HB2 PRO 28 -13.727 33.486 -19.847 201 HB3 PRO 28 HB3 PRO 28 -13.621 35.054 -20.656 202 HG2 PRO 28 HG2 PRO 28 -12.409 32.431 -21.440 203 HG3 PRO 28 HG3 PRO 28 -13.215 33.640 -22.457 204 HD2 PRO 28 HD2 PRO 28 -10.519 33.424 -22.307 205 HD3 PRO 28 HD3 PRO 28 -11.339 34.976 -22.570 206 H VAL 29 H VAL 29 -9.694 34.029 -18.323 207 HA VAL 29 HA VAL 29 -10.868 32.035 -16.535 208 HB VAL 29 HB VAL 29 -8.456 31.507 -18.272 209 HG11 VAL 29 HG11 VAL 29 -9.466 30.165 -15.804 210 HG12 VAL 29 HG12 VAL 29 -8.673 29.210 -17.056 211 HG13 VAL 29 HG13 VAL 29 -7.811 30.538 -16.279 212 HG21 VAL 29 HG21 VAL 29 -9.899 29.458 -18.843 213 HG22 VAL 29 HG22 VAL 29 -11.234 30.382 -18.158 214 HG23 VAL 29 HG23 VAL 29 -10.350 31.010 -19.547 215 H LYS 30 H LYS 30 -8.027 33.945 -17.430 216 HA LYS 30 HA LYS 30 -7.169 33.925 -14.617 217 HB2 LYS 30 HB2 LYS 30 -5.731 34.280 -17.213 218 HB3 LYS 30 HB3 LYS 30 -5.074 35.047 -15.772 219 HG2 LYS 30 HG2 LYS 30 -4.237 33.131 -15.036 220 HG3 LYS 30 HG3 LYS 30 -5.775 32.296 -15.259 221 HD2 LYS 30 HD2 LYS 30 -5.205 32.180 -17.723 222 HD3 LYS 30 HD3 LYS 30 -3.584 32.721 -17.279 223 HE2 LYS 30 HE2 LYS 30 -3.567 30.331 -17.435 224 HE3 LYS 30 HE3 LYS 30 -3.428 30.777 -15.735 225 HZ1 LYS 30 HZ1 LYS 30 -5.949 29.957 -17.072 226 HZ2 LYS 30 HZ2 LYS 30 -5.754 30.298 -15.428 227 HZ3 LYS 30 HZ3 LYS 30 -4.994 28.948 -16.108 228 H VAL 31 H VAL 31 -8.119 35.994 -17.277 229 HA VAL 31 HA VAL 31 -7.405 38.480 -16.193 230 HB VAL 31 HB VAL 31 -9.731 37.847 -18.013 231 HG11 VAL 31 HG11 VAL 31 -9.104 40.315 -18.707 232 HG12 VAL 31 HG12 VAL 31 -10.213 39.989 -17.375 233 HG13 VAL 31 HG13 VAL 31 -8.527 40.387 -17.044 234 HG21 VAL 31 HG21 VAL 31 -7.526 39.078 -19.335 235 HG22 VAL 31 HG22 VAL 31 -6.943 37.665 -18.454 236 HG23 VAL 31 HG23 VAL 31 -8.248 37.494 -19.628 237 H TRP 32 H TRP 32 -9.782 36.257 -15.220 238 HA TRP 32 HA TRP 32 -11.748 37.998 -14.192 239 HB2 TRP 32 HB2 TRP 32 -11.319 35.209 -14.299 240 HB3 TRP 32 HB3 TRP 32 -11.523 35.614 -12.597 241 HD1 TRP 32 HD1 TRP 32 -13.391 36.154 -15.954 242 HE1 TRP 32 HE1 TRP 32 -15.916 36.199 -15.456 243 HE3 TRP 32 HE3 TRP 32 -13.218 35.797 -10.856 244 HZ2 TRP 32 HZ2 TRP 32 -17.610 36.098 -13.201 245 HZ3 TRP 32 HZ3 TRP 32 -15.337 35.780 -9.604 246 HH2 TRP 32 HH2 TRP 32 -17.485 35.927 -10.753 247 H GLY 33 H GLY 33 -9.160 36.231 -12.471 248 HA2 GLY 33 HA2 GLY 33 -8.695 38.515 -10.758 249 HA3 GLY 33 HA3 GLY 33 -9.426 37.140 -9.945 250 H SER 34 H SER 34 -7.378 36.328 -12.543 251 HA SER 34 HA SER 34 -5.485 35.126 -10.724 252 HB2 SER 34 HB2 SER 34 -6.292 33.961 -12.782 253 HB3 SER 34 HB3 SER 34 -5.439 35.165 -13.750 254 HG SER 34 HG SER 34 -4.464 32.998 -12.388 255 H ILE 35 H ILE 35 -5.079 37.217 -13.587 256 HA ILE 35 HA ILE 35 -2.434 37.932 -13.087 257 HB ILE 35 HB ILE 35 -2.959 39.981 -14.492 258 HG12 ILE 35 HG12 ILE 35 -5.637 38.607 -14.794 259 HG13 ILE 35 HG13 ILE 35 -5.378 40.054 -13.825 260 HG21 ILE 35 HG21 ILE 35 -3.027 38.731 -16.511 261 HG22 ILE 35 HG22 ILE 35 -2.146 37.758 -15.335 262 HG23 ILE 35 HG23 ILE 35 -3.823 37.372 -15.720 263 HD11 ILE 35 HD11 ILE 35 -5.733 41.283 -15.623 264 HD12 ILE 35 HD12 ILE 35 -4.306 40.570 -16.378 265 HD13 ILE 35 HD13 ILE 35 -5.890 39.831 -16.612 266 H LYS 36 H LYS 36 -5.245 38.830 -11.423 267 HA LYS 36 HA LYS 36 -3.808 41.049 -10.118 268 HB2 LYS 36 HB2 LYS 36 -6.696 40.765 -10.875 269 HB3 LYS 36 HB3 LYS 36 -6.242 41.782 -9.514 270 HG2 LYS 36 HG2 LYS 36 -5.921 43.425 -10.962 271 HG3 LYS 36 HG3 LYS 36 -4.523 42.536 -11.567 272 HD2 LYS 36 HD2 LYS 36 -5.593 42.545 -13.533 273 HD3 LYS 36 HD3 LYS 36 -6.607 41.282 -12.829 274 HE2 LYS 36 HE2 LYS 36 -7.963 43.317 -11.895 275 HE3 LYS 36 HE3 LYS 36 -7.176 44.189 -13.210 276 HZ1 LYS 36 HZ1 LYS 36 -9.142 42.016 -13.338 277 HZ2 LYS 36 HZ2 LYS 36 -8.022 42.168 -14.595 278 HZ3 LYS 36 HZ3 LYS 36 -9.064 43.450 -14.233 279 H GLY 37 H GLY 37 -4.375 37.983 -9.654 280 HA2 GLY 37 HA2 GLY 37 -4.629 38.299 -6.760 281 HA3 GLY 37 HA3 GLY 37 -5.812 37.272 -7.557 282 H LEU 38 H LEU 38 -4.687 35.643 -9.141 283 HA LEU 38 HA LEU 38 -3.020 33.996 -7.503 284 HB2 LEU 38 HB2 LEU 38 -4.002 33.738 -10.336 285 HB3 LEU 38 HB3 LEU 38 -2.991 32.525 -9.552 286 HG LEU 38 HG LEU 38 -5.758 33.353 -8.674 287 HD11 LEU 38 HD11 LEU 38 -4.755 30.875 -10.065 288 HD12 LEU 38 HD12 LEU 38 -5.847 32.092 -10.724 289 HD13 LEU 38 HD13 LEU 38 -6.370 31.069 -9.387 290 HD21 LEU 38 HD21 LEU 38 -3.867 31.257 -7.613 291 HD22 LEU 38 HD22 LEU 38 -5.563 31.413 -7.153 292 HD23 LEU 38 HD23 LEU 38 -4.424 32.704 -6.773 293 H THR 39 H THR 39 -2.529 35.477 -10.712 294 HA THR 39 HA THR 39 0.290 34.925 -10.670 295 HB THR 39 HB THR 39 -0.454 36.950 -12.598 296 HG1 THR 39 HG1 THR 39 -2.089 34.633 -12.392 297 HG21 THR 39 HG21 THR 39 0.452 35.373 -14.163 298 HG22 THR 39 HG22 THR 39 0.278 34.051 -13.009 299 HG23 THR 39 HG23 THR 39 1.452 35.332 -12.712 300 H GLU 40 H GLU 40 -1.712 37.427 -9.489 301 HA GLU 40 HA GLU 40 0.458 39.382 -9.445 302 HB2 GLU 40 HB2 GLU 40 -1.473 40.512 -10.004 303 HB3 GLU 40 HB3 GLU 40 -2.490 39.488 -9.000 304 HG2 GLU 40 HG2 GLU 40 -0.512 41.294 -7.701 305 HG3 GLU 40 HG3 GLU 40 -2.014 41.965 -8.332 306 H GLY 41 H GLY 41 -1.214 37.154 -7.385 307 HA2 GLY 41 HA2 GLY 41 0.035 38.327 -4.997 308 HA3 GLY 41 HA3 GLY 41 -1.269 37.149 -4.995 309 H LEU 42 H LEU 42 -0.154 35.300 -6.816 310 HA LEU 42 HA LEU 42 1.801 34.056 -5.055 311 HB2 LEU 42 HB2 LEU 42 0.784 32.793 -7.561 312 HB3 LEU 42 HB3 LEU 42 1.262 32.037 -6.043 313 HG LEU 42 HG LEU 42 -1.240 33.687 -6.352 314 HD11 LEU 42 HD11 LEU 42 -1.701 31.938 -7.787 315 HD12 LEU 42 HD12 LEU 42 -2.293 31.320 -6.247 316 HD13 LEU 42 HD13 LEU 42 -0.732 30.787 -6.867 317 HD21 LEU 42 HD21 LEU 42 -0.128 33.234 -4.075 318 HD22 LEU 42 HD22 LEU 42 -0.672 31.572 -4.303 319 HD23 LEU 42 HD23 LEU 42 -1.848 32.886 -4.251 320 H HIS 43 H HIS 43 1.611 35.573 -8.167 321 HA HIS 43 HA HIS 43 4.458 34.954 -8.614 322 HB2 HIS 43 HB2 HIS 43 2.338 34.335 -10.292 323 HB3 HIS 43 HB3 HIS 43 3.003 35.806 -10.993 324 HD1 HIS 43 HD1 HIS 43 3.530 32.209 -10.813 325 HD2 HIS 43 HD2 HIS 43 5.847 35.558 -11.636 326 HE1 HIS 43 HE1 HIS 43 5.590 31.336 -11.960 327 H GLY 44 H GLY 44 2.190 37.350 -7.966 328 HA2 GLY 44 HA2 GLY 44 3.896 39.459 -9.116 329 HA3 GLY 44 HA3 GLY 44 2.211 39.659 -8.659 330 H PHE 45 H PHE 45 2.778 38.110 -6.128 331 HA PHE 45 HA PHE 45 4.187 40.252 -4.678 332 HB2 PHE 45 HB2 PHE 45 1.924 40.541 -4.091 333 HB3 PHE 45 HB3 PHE 45 1.640 38.805 -3.988 334 HD1 PHE 45 HD1 PHE 45 2.361 37.540 -2.038 335 HD2 PHE 45 HD2 PHE 45 2.900 41.756 -2.268 336 HE1 PHE 45 HE1 PHE 45 2.771 37.617 0.385 337 HE2 PHE 45 HE2 PHE 45 3.314 41.839 0.156 338 HZ PHE 45 HZ PHE 45 3.248 39.768 1.487 339 H HIS 46 H HIS 46 3.955 36.943 -5.363 340 HA HIS 46 HA HIS 46 5.517 36.204 -2.987 341 HB2 HIS 46 HB2 HIS 46 3.585 34.804 -4.693 342 HB3 HIS 46 HB3 HIS 46 5.028 33.858 -4.339 343 HD1 HIS 46 HD1 HIS 46 1.786 34.333 -3.085 344 HD2 HIS 46 HD2 HIS 46 5.532 34.081 -1.306 345 HE1 HIS 46 HE1 HIS 46 1.350 33.732 -0.683 346 H VAL 47 H VAL 47 5.488 35.735 -6.518 347 HA VAL 47 HA VAL 47 8.231 34.813 -6.505 348 HB VAL 47 HB VAL 47 6.378 35.397 -8.817 349 HG11 VAL 47 HG11 VAL 47 8.143 33.772 -9.908 350 HG12 VAL 47 HG12 VAL 47 8.419 35.514 -9.844 351 HG13 VAL 47 HG13 VAL 47 9.195 34.454 -8.667 352 HG21 VAL 47 HG21 VAL 47 6.073 33.416 -7.035 353 HG22 VAL 47 HG22 VAL 47 5.663 33.249 -8.742 354 HG23 VAL 47 HG23 VAL 47 7.207 32.642 -8.143 355 H HIS 48 H HIS 48 6.548 37.460 -8.211 356 HA HIS 48 HA HIS 48 8.991 38.832 -8.777 357 HB2 HIS 48 HB2 HIS 48 6.084 39.398 -9.186 358 HB3 HIS 48 HB3 HIS 48 7.234 40.722 -9.330 359 HD1 HIS 48 HD1 HIS 48 5.841 37.882 -11.162 360 HD2 HIS 48 HD2 HIS 48 9.211 40.298 -11.418 361 HE1 HIS 48 HE1 HIS 48 6.759 37.513 -13.474 362 H GLU 49 H GLU 49 6.206 39.629 -6.690 363 HA GLU 49 HA GLU 49 6.090 40.752 -4.708 364 HB2 GLU 49 HB2 GLU 49 8.714 39.686 -4.721 365 HB3 GLU 49 HB3 GLU 49 8.840 41.351 -4.172 366 HG2 GLU 49 HG2 GLU 49 6.678 40.389 -2.769 367 HG3 GLU 49 HG3 GLU 49 7.778 39.013 -2.818 368 H PHE 50 H PHE 50 9.057 42.116 -6.132 369 HA PHE 50 HA PHE 50 7.713 44.738 -6.168 370 HB2 PHE 50 HB2 PHE 50 10.089 44.009 -4.926 371 HB3 PHE 50 HB3 PHE 50 10.616 44.823 -6.395 372 HD1 PHE 50 HD1 PHE 50 9.454 47.110 -6.889 373 HD2 PHE 50 HD2 PHE 50 9.601 45.260 -3.057 374 HE1 PHE 50 HE1 PHE 50 9.052 49.291 -5.824 375 HE2 PHE 50 HE2 PHE 50 9.199 47.439 -1.987 376 HZ PHE 50 HZ PHE 50 8.924 49.457 -3.370 377 H GLY 51 H GLY 51 8.994 42.282 -8.096 378 HA2 GLY 51 HA2 GLY 51 10.143 43.613 -10.247 379 HA3 GLY 51 HA3 GLY 51 9.275 42.089 -10.366 380 H ASP 52 H ASP 52 6.813 42.354 -10.305 381 HA ASP 52 HA ASP 52 6.079 44.688 -11.948 382 HB2 ASP 52 HB2 ASP 52 4.553 42.121 -12.127 383 HB3 ASP 52 HB3 ASP 52 4.790 43.369 -13.347 384 H ASN 53 H ASN 53 5.539 42.999 -9.077 385 HA ASN 53 HA ASN 53 4.156 43.442 -7.313 386 HB2 ASN 53 HB2 ASN 53 4.231 45.836 -8.500 387 HB3 ASN 53 HB3 ASN 53 2.538 45.450 -8.802 388 HD21 ASN 53 HD21 ASN 53 4.073 47.358 -6.980 389 HD22 ASN 53 HD22 ASN 53 3.317 47.142 -5.441 390 H THR 54 H THR 54 2.220 43.918 -10.275 391 HA THR 54 HA THR 54 0.533 41.660 -9.430 392 HB THR 54 HB THR 54 -0.765 43.597 -8.887 393 HG1 THR 54 HG1 THR 54 -2.439 43.382 -10.647 394 HG21 THR 54 HG21 THR 54 0.577 44.750 -11.116 395 HG22 THR 54 HG22 THR 54 -0.463 45.541 -9.930 396 HG23 THR 54 HG23 THR 54 -1.160 44.861 -11.401 397 H ALA 55 H ALA 55 2.559 42.839 -11.714 398 HA ALA 55 HA ALA 55 3.048 42.275 -13.863 399 HB1 ALA 55 HB1 ALA 55 2.568 39.979 -12.790 400 HB2 ALA 55 HB2 ALA 55 1.065 40.038 -13.710 401 HB3 ALA 55 HB3 ALA 55 2.615 40.099 -14.550 402 H GLY 56 H GLY 56 0.495 43.839 -13.077 403 HA2 GLY 56 HA2 GLY 56 -0.694 43.756 -15.779 404 HA3 GLY 56 HA3 GLY 56 -1.686 43.933 -14.341 405 H CYS 57 H CYS 57 0.233 45.697 -13.011 406 HA CYS 57 HA CYS 57 -0.244 48.121 -14.614 407 HB2 CYS 57 HB2 CYS 57 -0.333 47.644 -11.644 408 HB3 CYS 57 HB3 CYS 57 -0.119 49.262 -12.300 409 HG CYS 57 HG CYS 57 -2.594 48.412 -13.975 410 H THR 58 H THR 58 2.129 46.185 -14.317 411 HA THR 58 HA THR 58 4.153 48.234 -14.405 412 HB THR 58 HB THR 58 4.761 46.069 -12.438 413 HG1 THR 58 HG1 THR 58 3.057 46.799 -11.348 414 HG21 THR 58 HG21 THR 58 6.008 48.104 -11.442 415 HG22 THR 58 HG22 THR 58 5.687 48.867 -12.998 416 HG23 THR 58 HG23 THR 58 6.629 47.378 -12.924 417 H SER 59 H SER 59 2.880 45.748 -15.793 418 HA SER 59 HA SER 59 5.449 44.667 -16.728 419 HB2 SER 59 HB2 SER 59 3.150 43.214 -15.594 420 HB3 SER 59 HB3 SER 59 3.761 42.552 -17.110 421 HG SER 59 HG SER 59 5.906 42.768 -15.993 422 H ALA 60 H ALA 60 2.065 45.343 -17.408 423 HA ALA 60 HA ALA 60 2.574 46.192 -20.044 424 HB1 ALA 60 HB1 ALA 60 2.904 43.965 -20.707 425 HB2 ALA 60 HB2 ALA 60 1.551 43.386 -19.735 426 HB3 ALA 60 HB3 ALA 60 1.248 44.343 -21.187 427 H GLY 61 H GLY 61 1.280 47.541 -18.215 428 HA2 GLY 61 HA2 GLY 61 -1.601 47.091 -18.648 429 HA3 GLY 61 HA3 GLY 61 -0.907 48.022 -17.327 430 HA PRO 62 HA PRO 62 -2.195 50.718 -21.031 431 HB2 PRO 62 HB2 PRO 62 -4.446 51.794 -19.964 432 HB3 PRO 62 HB3 PRO 62 -4.456 50.316 -20.934 433 HG2 PRO 62 HG2 PRO 62 -4.517 50.629 -17.958 434 HG3 PRO 62 HG3 PRO 62 -5.451 49.528 -18.986 435 HD2 PRO 62 HD2 PRO 62 -3.260 48.728 -17.610 436 HD3 PRO 62 HD3 PRO 62 -3.711 48.027 -19.178 437 H HIS 63 H HIS 63 -2.767 51.420 -17.580 438 HA HIS 63 HA HIS 63 -0.727 53.311 -17.334 439 HB2 HIS 63 HB2 HIS 63 -2.992 54.330 -18.704 440 HB3 HIS 63 HB3 HIS 63 -2.984 55.057 -17.100 441 HD1 HIS 63 HD1 HIS 63 -1.938 55.901 -20.281 442 HD2 HIS 63 HD2 HIS 63 0.014 55.865 -16.613 443 HE1 HIS 63 HE1 HIS 63 0.006 57.473 -20.538 444 H PHE 64 H PHE 64 -0.279 53.178 -15.247 445 HA PHE 64 HA PHE 64 -2.502 52.819 -13.349 446 HB2 PHE 64 HB2 PHE 64 -1.039 51.581 -11.932 447 HB3 PHE 64 HB3 PHE 64 -0.808 50.949 -13.558 448 HD1 PHE 64 HD1 PHE 64 1.168 51.911 -14.903 449 HD2 PHE 64 HD2 PHE 64 0.778 52.267 -10.680 450 HE1 PHE 64 HE1 PHE 64 3.586 52.327 -14.720 451 HE2 PHE 64 HE2 PHE 64 3.196 52.685 -10.489 452 HZ PHE 64 HZ PHE 64 4.603 52.714 -12.510 453 H ASN 65 H ASN 65 -0.498 55.122 -14.482 454 HA ASN 65 HA ASN 65 -0.929 56.840 -12.239 455 HB2 ASN 65 HB2 ASN 65 1.669 55.495 -12.559 456 HB3 ASN 65 HB3 ASN 65 1.774 57.243 -12.377 457 HD21 ASN 65 HD21 ASN 65 0.092 58.014 -10.612 458 HD22 ASN 65 HD22 ASN 65 0.236 57.174 -9.107 459 HA PRO 66 HA PRO 66 -0.711 58.906 -16.359 460 HB2 PRO 66 HB2 PRO 66 -2.910 60.443 -15.941 461 HB3 PRO 66 HB3 PRO 66 -2.997 58.789 -16.561 462 HG2 PRO 66 HG2 PRO 66 -3.427 59.790 -13.774 463 HG3 PRO 66 HG3 PRO 66 -4.360 58.591 -14.688 464 HD2 PRO 66 HD2 PRO 66 -2.524 57.897 -12.822 465 HD3 PRO 66 HD3 PRO 66 -2.848 56.905 -14.258 466 H LEU 67 H LEU 67 1.200 59.667 -14.802 467 HA LEU 67 HA LEU 67 1.373 62.431 -15.009 468 HB2 LEU 67 HB2 LEU 67 1.410 62.974 -12.531 469 HB3 LEU 67 HB3 LEU 67 -0.169 62.751 -13.282 470 HG LEU 67 HG LEU 67 0.045 60.317 -12.370 471 HD11 LEU 67 HD11 LEU 67 1.374 61.183 -10.007 472 HD12 LEU 67 HD12 LEU 67 2.434 61.462 -11.388 473 HD13 LEU 67 HD13 LEU 67 1.786 59.849 -11.084 474 HD21 LEU 67 HD21 LEU 67 -0.497 62.700 -10.601 475 HD22 LEU 67 HD22 LEU 67 -0.989 61.042 -10.254 476 HD23 LEU 67 HD23 LEU 67 -1.654 61.885 -11.654 477 H SER 68 H SER 68 2.396 59.492 -13.440 478 HA SER 68 HA SER 68 4.922 60.424 -12.539 479 HB2 SER 68 HB2 SER 68 5.435 58.129 -12.091 480 HB3 SER 68 HB3 SER 68 3.723 58.348 -11.729 481 HG SER 68 HG SER 68 3.366 57.557 -13.941 482 H ARG 69 H ARG 69 3.746 59.997 -15.612 483 HA ARG 69 HA ARG 69 6.375 60.238 -16.766 484 HB2 ARG 69 HB2 ARG 69 5.548 58.265 -18.412 485 HB3 ARG 69 HB3 ARG 69 6.609 58.004 -17.034 486 HG2 ARG 69 HG2 ARG 69 4.967 57.022 -15.776 487 HG3 ARG 69 HG3 ARG 69 3.665 57.859 -16.627 488 HD2 ARG 69 HD2 ARG 69 5.375 55.826 -18.017 489 HD3 ARG 69 HD3 ARG 69 3.992 55.337 -17.042 490 HE ARG 69 HE ARG 69 2.933 57.194 -18.681 491 HH11 ARG 69 HH11 ARG 69 4.895 54.376 -19.251 492 HH12 ARG 69 HH12 ARG 69 4.226 54.065 -20.820 493 HH21 ARG 69 HH21 ARG 69 2.044 56.796 -20.744 494 HH22 ARG 69 HH22 ARG 69 2.606 55.443 -21.667 495 H LYS 70 H LYS 70 3.364 59.000 -18.174 496 HA LYS 70 HA LYS 70 2.042 59.781 -19.855 497 HB2 LYS 70 HB2 LYS 70 2.727 62.354 -18.438 498 HB3 LYS 70 HB3 LYS 70 1.591 62.285 -19.782 499 HG2 LYS 70 HG2 LYS 70 1.328 60.848 -17.148 500 HG3 LYS 70 HG3 LYS 70 0.413 62.264 -17.671 501 HD2 LYS 70 HD2 LYS 70 0.131 60.329 -19.699 502 HD3 LYS 70 HD3 LYS 70 -0.108 59.490 -18.164 503 HE2 LYS 70 HE2 LYS 70 -1.774 61.172 -17.519 504 HE3 LYS 70 HE3 LYS 70 -1.538 61.993 -19.061 505 HZ1 LYS 70 HZ1 LYS 70 -3.353 60.708 -19.515 506 HZ2 LYS 70 HZ2 LYS 70 -2.874 59.443 -18.499 507 HZ3 LYS 70 HZ3 LYS 70 -2.125 59.650 -20.002 508 H HIS 71 H HIS 71 3.917 62.738 -19.906 509 HA HIS 71 HA HIS 71 4.318 62.806 -22.632 510 HB2 HIS 71 HB2 HIS 71 5.817 64.034 -20.337 511 HB3 HIS 71 HB3 HIS 71 6.373 64.270 -21.992 512 HD1 HIS 71 HD1 HIS 71 2.949 64.517 -20.326 513 HD2 HIS 71 HD2 HIS 71 5.452 66.640 -22.873 514 HE1 HIS 71 HE1 HIS 71 1.687 66.611 -20.919 515 H GLY 72 H GLY 72 6.352 61.335 -20.145 516 HA2 GLY 72 HA2 GLY 72 7.673 59.774 -22.242 517 HA3 GLY 72 HA3 GLY 72 8.690 60.736 -21.181 518 H GLY 73 H GLY 73 7.772 57.704 -21.691 519 HA2 GLY 73 HA2 GLY 73 6.903 56.766 -19.174 520 HA3 GLY 73 HA3 GLY 73 7.676 55.796 -20.419 521 HA PRO 74 HA PRO 74 10.509 55.954 -16.759 522 HB2 PRO 74 HB2 PRO 74 11.068 53.297 -16.783 523 HB3 PRO 74 HB3 PRO 74 9.671 53.977 -15.939 524 HG2 PRO 74 HG2 PRO 74 9.805 52.657 -18.623 525 HG3 PRO 74 HG3 PRO 74 8.600 52.458 -17.336 526 HD2 PRO 74 HD2 PRO 74 8.168 54.016 -19.508 527 HD3 PRO 74 HD3 PRO 74 7.480 54.388 -17.915 528 H LYS 75 H LYS 75 12.729 54.526 -16.731 529 HA LYS 75 HA LYS 75 14.029 53.958 -19.131 530 HB2 LYS 75 HB2 LYS 75 13.611 56.651 -18.993 531 HB3 LYS 75 HB3 LYS 75 15.204 56.514 -18.260 532 HG2 LYS 75 HG2 LYS 75 15.942 56.646 -20.363 533 HG3 LYS 75 HG3 LYS 75 15.501 54.940 -20.448 534 HD2 LYS 75 HD2 LYS 75 14.564 56.043 -22.356 535 HD3 LYS 75 HD3 LYS 75 13.243 55.639 -21.256 536 HE2 LYS 75 HE2 LYS 75 12.624 57.773 -21.360 537 HE3 LYS 75 HE3 LYS 75 14.089 58.172 -20.464 538 HZ1 LYS 75 HZ1 LYS 75 14.770 59.294 -22.229 539 HZ2 LYS 75 HZ2 LYS 75 13.428 58.800 -23.132 540 HZ3 LYS 75 HZ3 LYS 75 14.831 57.854 -23.117 541 H ASP 76 H ASP 76 16.300 53.527 -18.855 542 HA ASP 76 HA ASP 76 18.112 52.768 -17.709 543 HB2 ASP 76 HB2 ASP 76 17.624 55.226 -16.644 544 HB3 ASP 76 HB3 ASP 76 17.526 54.213 -15.206 545 H GLU 77 H GLU 77 15.448 51.509 -17.454 546 HA GLU 77 HA GLU 77 16.101 49.464 -15.655 547 HB2 GLU 77 HB2 GLU 77 14.338 49.847 -13.935 548 HB3 GLU 77 HB3 GLU 77 15.647 51.020 -13.879 549 HG2 GLU 77 HG2 GLU 77 14.069 52.442 -15.381 550 HG3 GLU 77 HG3 GLU 77 12.816 51.381 -14.738 551 H GLU 78 H GLU 78 13.316 51.257 -16.948 552 HA GLU 78 HA GLU 78 12.046 48.699 -17.628 553 HB2 GLU 78 HB2 GLU 78 11.049 51.307 -16.786 554 HB3 GLU 78 HB3 GLU 78 10.223 50.700 -18.215 555 HG2 GLU 78 HG2 GLU 78 10.597 48.934 -15.836 556 HG3 GLU 78 HG3 GLU 78 9.308 50.137 -15.860 557 H ARG 79 H ARG 79 12.441 51.951 -19.042 558 HA ARG 79 HA ARG 79 11.956 50.963 -21.698 559 HB2 ARG 79 HB2 ARG 79 11.724 53.421 -20.495 560 HB3 ARG 79 HB3 ARG 79 13.183 53.617 -21.458 561 HG2 ARG 79 HG2 ARG 79 11.882 54.052 -23.194 562 HG3 ARG 79 HG3 ARG 79 11.368 52.364 -23.158 563 HD2 ARG 79 HD2 ARG 79 10.040 54.226 -21.273 564 HD3 ARG 79 HD3 ARG 79 9.655 54.407 -22.985 565 HE ARG 79 HE ARG 79 9.478 51.700 -22.040 566 HH11 ARG 79 HH11 ARG 79 7.794 54.727 -22.387 567 HH12 ARG 79 HH12 ARG 79 6.221 54.004 -22.358 568 HH21 ARG 79 HH21 ARG 79 7.409 50.737 -22.000 569 HH22 ARG 79 HH22 ARG 79 6.002 51.734 -22.136 570 H HIS 80 H HIS 80 14.562 50.757 -19.711 571 HA HIS 80 HA HIS 80 16.626 51.298 -21.665 572 HB2 HIS 80 HB2 HIS 80 16.733 51.540 -19.054 573 HB3 HIS 80 HB3 HIS 80 17.126 49.824 -19.104 574 HD1 HIS 80 HD1 HIS 80 18.527 51.289 -22.045 575 HD2 HIS 80 HD2 HIS 80 19.626 51.120 -18.043 576 HE1 HIS 80 HE1 HIS 80 20.984 51.815 -22.001 577 H VAL 81 H VAL 81 14.751 48.608 -20.584 578 HA VAL 81 HA VAL 81 15.940 46.927 -22.619 579 HB VAL 81 HB VAL 81 16.193 45.016 -20.946 580 HG11 VAL 81 HG11 VAL 81 18.180 47.225 -20.522 581 HG12 VAL 81 HG12 VAL 81 18.465 45.485 -20.619 582 HG13 VAL 81 HG13 VAL 81 18.031 46.392 -22.069 583 HG21 VAL 81 HG21 VAL 81 16.611 47.175 -18.914 584 HG22 VAL 81 HG22 VAL 81 15.019 46.449 -19.142 585 HG23 VAL 81 HG23 VAL 81 16.388 45.443 -18.670 586 H GLY 82 H GLY 82 13.332 48.145 -22.038 587 HA2 GLY 82 HA2 GLY 82 11.504 46.232 -21.060 588 HA3 GLY 82 HA3 GLY 82 11.105 47.597 -22.092 589 H ASP 83 H ASP 83 13.279 46.277 -23.945 590 HA ASP 83 HA ASP 83 13.334 44.807 -25.690 591 HB2 ASP 83 HB2 ASP 83 10.879 43.415 -24.667 592 HB3 ASP 83 HB3 ASP 83 12.243 42.744 -25.558 593 H LEU 84 H LEU 84 11.877 47.284 -25.750 594 HA LEU 84 HA LEU 84 10.267 46.765 -28.105 595 HB2 LEU 84 HB2 LEU 84 8.532 48.435 -27.008 596 HB3 LEU 84 HB3 LEU 84 8.412 46.688 -26.808 597 HG LEU 84 HG LEU 84 10.022 47.790 -24.707 598 HD11 LEU 84 HD11 LEU 84 7.625 49.330 -25.451 599 HD12 LEU 84 HD12 LEU 84 9.049 49.813 -24.530 600 HD13 LEU 84 HD13 LEU 84 7.763 48.894 -23.748 601 HD21 LEU 84 HD21 LEU 84 7.255 46.673 -24.430 602 HD22 LEU 84 HD22 LEU 84 8.637 46.506 -23.347 603 HD23 LEU 84 HD23 LEU 84 8.612 45.643 -24.887 604 H GLY 85 H GLY 85 10.396 49.556 -25.907 605 HA2 GLY 85 HA2 GLY 85 10.862 51.389 -28.026 606 HA3 GLY 85 HA3 GLY 85 10.974 51.746 -26.309 607 H ASN 86 H ASN 86 12.998 49.866 -25.657 608 HA ASN 86 HA ASN 86 15.294 51.388 -26.260 609 HB2 ASN 86 HB2 ASN 86 14.748 49.686 -24.298 610 HB3 ASN 86 HB3 ASN 86 15.563 48.550 -25.370 611 HD21 ASN 86 HD21 ASN 86 15.978 51.828 -24.075 612 HD22 ASN 86 HD22 ASN 86 17.676 51.682 -23.790 613 H VAL 87 H VAL 87 13.911 48.496 -27.678 614 HA VAL 87 HA VAL 87 16.194 48.243 -29.499 615 HB VAL 87 HB VAL 87 15.289 46.214 -28.314 616 HG11 VAL 87 HG11 VAL 87 12.844 47.188 -29.237 617 HG12 VAL 87 HG12 VAL 87 13.154 45.734 -30.189 618 HG13 VAL 87 HG13 VAL 87 13.141 45.649 -28.426 619 HG21 VAL 87 HG21 VAL 87 16.499 46.380 -30.651 620 HG22 VAL 87 HG22 VAL 87 15.882 44.843 -30.049 621 HG23 VAL 87 HG23 VAL 87 14.956 45.758 -31.236 622 H THR 88 H THR 88 13.377 49.900 -29.383 623 HA THR 88 HA THR 88 12.224 49.412 -31.920 624 HB THR 88 HB THR 88 12.010 51.612 -29.908 625 HG1 THR 88 HG1 THR 88 10.264 49.751 -31.155 626 HG21 THR 88 HG21 THR 88 12.023 52.968 -31.829 627 HG22 THR 88 HG22 THR 88 10.313 52.665 -31.516 628 HG23 THR 88 HG23 THR 88 11.151 51.769 -32.785 629 H ALA 89 H ALA 89 14.695 51.670 -30.792 630 HA ALA 89 HA ALA 89 16.098 51.820 -33.160 631 HB1 ALA 89 HB1 ALA 89 15.046 54.420 -33.382 632 HB2 ALA 89 HB2 ALA 89 14.906 53.090 -34.534 633 HB3 ALA 89 HB3 ALA 89 13.667 53.323 -33.300 634 H ASP 90 H ASP 90 15.039 53.378 -30.239 635 HA ASP 90 HA ASP 90 17.631 53.914 -29.329 636 HB2 ASP 90 HB2 ASP 90 16.721 55.844 -31.181 637 HB3 ASP 90 HB3 ASP 90 16.637 56.598 -29.590 638 H LYS 91 H LYS 91 14.230 54.773 -29.254 639 HA LYS 91 HA LYS 91 14.232 54.509 -26.364 640 HB2 LYS 91 HB2 LYS 91 14.633 56.831 -26.420 641 HB3 LYS 91 HB3 LYS 91 13.553 57.072 -27.788 642 HG2 LYS 91 HG2 LYS 91 12.575 57.935 -25.743 643 HG3 LYS 91 HG3 LYS 91 11.631 56.580 -26.367 644 HD2 LYS 91 HD2 LYS 91 12.612 55.089 -24.745 645 HD3 LYS 91 HD3 LYS 91 13.705 56.358 -24.187 646 HE2 LYS 91 HE2 LYS 91 11.736 55.984 -22.707 647 HE3 LYS 91 HE3 LYS 91 11.880 57.634 -23.311 648 HZ1 LYS 91 HZ1 LYS 91 9.612 56.348 -23.381 649 HZ2 LYS 91 HZ2 LYS 91 10.239 55.749 -24.833 650 HZ3 LYS 91 HZ3 LYS 91 10.049 57.414 -24.618 651 H ASP 92 H ASP 92 12.404 55.149 -29.318 652 HA ASP 92 HA ASP 92 10.617 53.108 -29.151 653 HB2 ASP 92 HB2 ASP 92 10.015 55.130 -27.163 654 HB3 ASP 92 HB3 ASP 92 8.677 54.935 -28.292 655 H GLY 93 H GLY 93 11.936 54.873 -31.013 656 HA2 GLY 93 HA2 GLY 93 11.538 55.779 -33.084 657 HA3 GLY 93 HA3 GLY 93 9.932 55.073 -32.980 658 H VAL 94 H VAL 94 11.042 57.342 -30.589 659 HA VAL 94 HA VAL 94 9.425 59.462 -31.836 660 HB VAL 94 HB VAL 94 9.314 58.592 -28.946 661 HG11 VAL 94 HG11 VAL 94 9.193 60.860 -28.664 662 HG12 VAL 94 HG12 VAL 94 8.522 61.135 -30.272 663 HG13 VAL 94 HG13 VAL 94 7.498 60.498 -28.986 664 HG21 VAL 94 HG21 VAL 94 6.782 58.640 -29.665 665 HG22 VAL 94 HG22 VAL 94 7.466 58.417 -31.275 666 HG23 VAL 94 HG23 VAL 94 7.798 57.239 -30.006 667 H ALA 95 H ALA 95 11.962 58.593 -29.547 668 HA ALA 95 HA ALA 95 12.891 61.376 -29.511 669 HB1 ALA 95 HB1 ALA 95 14.362 59.504 -27.838 670 HB2 ALA 95 HB2 ALA 95 13.587 61.031 -27.419 671 HB3 ALA 95 HB3 ALA 95 12.637 59.547 -27.475 672 H ASP 96 H ASP 96 13.230 59.736 -31.854 673 HA ASP 96 HA ASP 96 15.907 60.293 -32.467 674 HB2 ASP 96 HB2 ASP 96 15.483 57.757 -31.147 675 HB3 ASP 96 HB3 ASP 96 16.102 57.509 -32.777 676 H VAL 97 H VAL 97 12.980 58.520 -33.118 677 HA VAL 97 HA VAL 97 13.588 58.608 -36.001 678 HB VAL 97 HB VAL 97 11.490 56.850 -34.750 679 HG11 VAL 97 HG11 VAL 97 12.158 57.478 -37.390 680 HG12 VAL 97 HG12 VAL 97 12.798 55.857 -37.115 681 HG13 VAL 97 HG13 VAL 97 11.088 56.191 -36.835 682 HG21 VAL 97 HG21 VAL 97 13.435 56.100 -33.669 683 HG22 VAL 97 HG22 VAL 97 13.244 55.019 -35.047 684 HG23 VAL 97 HG23 VAL 97 14.425 56.325 -35.109 685 H SER 98 H SER 98 12.320 60.621 -34.078 686 HA SER 98 HA SER 98 10.076 61.280 -35.833 687 HB2 SER 98 HB2 SER 98 9.268 60.056 -33.733 688 HB3 SER 98 HB3 SER 98 9.773 61.489 -32.838 689 HG SER 98 HG SER 98 7.659 61.813 -33.348 690 H ILE 99 H ILE 99 12.206 62.289 -33.196 691 HA ILE 99 HA ILE 99 11.691 65.000 -33.140 692 HB ILE 99 HB ILE 99 14.410 63.715 -32.855 693 HG12 ILE 99 HG12 ILE 99 12.258 64.247 -30.793 694 HG13 ILE 99 HG13 ILE 99 12.763 62.665 -31.379 695 HG21 ILE 99 HG21 ILE 99 13.914 65.990 -31.169 696 HG22 ILE 99 HG22 ILE 99 15.206 65.723 -32.337 697 HG23 ILE 99 HG23 ILE 99 13.671 66.413 -32.864 698 HD11 ILE 99 HD11 ILE 99 14.511 64.593 -29.869 699 HD12 ILE 99 HD12 ILE 99 13.692 63.190 -29.180 700 HD13 ILE 99 HD13 ILE 99 14.950 62.968 -30.396 701 H GLU 100 H GLU 100 13.849 63.213 -35.307 702 HA GLU 100 HA GLU 100 14.867 65.498 -36.643 703 HB2 GLU 100 HB2 GLU 100 14.662 62.736 -37.830 704 HB3 GLU 100 HB3 GLU 100 15.852 63.982 -38.183 705 HG2 GLU 100 HG2 GLU 100 16.350 63.672 -35.586 706 HG3 GLU 100 HG3 GLU 100 15.722 62.064 -35.941 707 H ASP 101 H ASP 101 12.103 63.397 -37.183 708 HA ASP 101 HA ASP 101 11.440 64.536 -39.732 709 HB2 ASP 101 HB2 ASP 101 10.710 62.313 -39.429 710 HB3 ASP 101 HB3 ASP 101 10.022 62.667 -37.846 711 H SER 102 H SER 102 10.980 65.460 -36.495 712 HA SER 102 HA SER 102 8.666 67.139 -37.126 713 HB2 SER 102 HB2 SER 102 9.304 65.687 -34.869 714 HB3 SER 102 HB3 SER 102 9.749 67.330 -34.411 715 HG SER 102 HG SER 102 7.231 66.384 -35.294 716 H VAL 103 H VAL 103 12.046 67.333 -36.177 717 HA VAL 103 HA VAL 103 12.102 70.146 -35.775 718 HB VAL 103 HB VAL 103 13.807 68.475 -34.921 719 HG11 VAL 103 HG11 VAL 103 14.143 67.317 -37.074 720 HG12 VAL 103 HG12 VAL 103 14.921 68.766 -37.709 721 HG13 VAL 103 HG13 VAL 103 15.655 67.888 -36.366 722 HG21 VAL 103 HG21 VAL 103 14.154 70.868 -34.737 723 HG22 VAL 103 HG22 VAL 103 15.677 70.066 -35.121 724 HG23 VAL 103 HG23 VAL 103 14.790 70.927 -36.380 725 H ILE 104 H ILE 104 12.244 68.122 -38.572 726 HA ILE 104 HA ILE 104 13.245 70.295 -40.251 727 HB ILE 104 HB ILE 104 12.602 67.424 -40.932 728 HG12 ILE 104 HG12 ILE 104 14.595 67.696 -39.523 729 HG13 ILE 104 HG13 ILE 104 15.036 67.182 -41.147 730 HG21 ILE 104 HG21 ILE 104 14.111 68.293 -42.985 731 HG22 ILE 104 HG22 ILE 104 12.349 68.291 -42.997 732 HG23 ILE 104 HG23 ILE 104 13.224 69.769 -42.603 733 HD11 ILE 104 HD11 ILE 104 16.574 68.857 -40.377 734 HD12 ILE 104 HD12 ILE 104 15.601 69.518 -41.691 735 HD13 ILE 104 HD13 ILE 104 15.247 69.963 -40.023 736 H SER 105 H SER 105 10.318 68.627 -39.442 737 HA SER 105 HA SER 105 8.862 69.677 -41.722 738 HB2 SER 105 HB2 SER 105 6.984 68.427 -40.902 739 HB3 SER 105 HB3 SER 105 8.408 67.401 -40.733 740 HG SER 105 HG SER 105 6.887 68.686 -38.763 741 H LEU 106 H LEU 106 9.529 70.534 -38.456 742 HA LEU 106 HA LEU 106 7.289 72.360 -38.234 743 HB2 LEU 106 HB2 LEU 106 8.286 71.040 -36.317 744 HB3 LEU 106 HB3 LEU 106 9.658 72.141 -36.394 745 HG LEU 106 HG LEU 106 7.238 73.658 -36.214 746 HD11 LEU 106 HD11 LEU 106 7.377 71.241 -34.527 747 HD12 LEU 106 HD12 LEU 106 5.984 72.190 -35.045 748 HD13 LEU 106 HD13 LEU 106 6.982 72.752 -33.703 749 HD21 LEU 106 HD21 LEU 106 9.789 73.939 -35.449 750 HD22 LEU 106 HD22 LEU 106 9.082 73.429 -33.916 751 HD23 LEU 106 HD23 LEU 106 8.463 74.860 -34.739 752 H SER 107 H SER 107 10.767 72.497 -38.781 753 HA SER 107 HA SER 107 10.642 75.415 -39.005 754 HB2 SER 107 HB2 SER 107 12.819 75.450 -38.391 755 HB3 SER 107 HB3 SER 107 12.538 73.787 -37.877 756 HG SER 107 HG SER 107 14.156 73.478 -39.225 757 H GLY 108 H GLY 108 11.342 72.518 -40.885 758 HA2 GLY 108 HA2 GLY 108 12.100 73.978 -43.245 759 HA3 GLY 108 HA3 GLY 108 11.824 72.245 -43.132 760 H ASP 109 H ASP 109 9.178 73.657 -41.803 761 HA ASP 109 HA ASP 109 7.782 73.967 -44.368 762 HB2 ASP 109 HB2 ASP 109 7.516 71.722 -42.762 763 HB3 ASP 109 HB3 ASP 109 6.128 72.713 -42.317 764 H HIS 110 H HIS 110 8.768 75.710 -42.055 765 HA HIS 110 HA HIS 110 6.194 77.043 -41.524 766 HB2 HIS 110 HB2 HIS 110 7.058 76.215 -39.441 767 HB3 HIS 110 HB3 HIS 110 8.658 76.865 -39.783 768 HD1 HIS 110 HD1 HIS 110 5.328 78.673 -40.003 769 HD2 HIS 110 HD2 HIS 110 8.899 78.790 -37.880 770 HE1 HIS 110 HE1 HIS 110 5.194 80.741 -38.574 771 H CYS 111 H CYS 111 9.626 77.474 -42.218 772 HA CYS 111 HA CYS 111 9.033 80.230 -43.076 773 HB2 CYS 111 HB2 CYS 111 11.598 80.503 -42.729 774 HB3 CYS 111 HB3 CYS 111 10.534 80.534 -41.329 775 HG CYS 111 HG CYS 111 12.902 78.307 -42.171 776 H ILE 112 H ILE 112 11.203 77.474 -43.686 777 HA ILE 112 HA ILE 112 12.357 78.236 -46.043 778 HB ILE 112 HB ILE 112 11.346 75.459 -45.419 779 HG12 ILE 112 HG12 ILE 112 12.772 76.299 -43.633 780 HG13 ILE 112 HG13 ILE 112 13.639 75.081 -44.562 781 HG21 ILE 112 HG21 ILE 112 13.355 74.848 -46.880 782 HG22 ILE 112 HG22 ILE 112 11.909 75.450 -47.687 783 HG23 ILE 112 HG23 ILE 112 13.291 76.517 -47.441 784 HD11 ILE 112 HD11 ILE 112 14.261 77.876 -44.112 785 HD12 ILE 112 HD12 ILE 112 15.297 76.552 -44.646 786 HD13 ILE 112 HD13 ILE 112 14.315 77.431 -45.817 787 H ILE 113 H ILE 113 9.052 77.357 -45.498 788 HA ILE 113 HA ILE 113 8.519 77.264 -48.380 789 HB ILE 113 HB ILE 113 6.710 76.582 -46.060 790 HG12 ILE 113 HG12 ILE 113 8.129 74.820 -48.069 791 HG13 ILE 113 HG13 ILE 113 8.534 74.972 -46.362 792 HG21 ILE 113 HG21 ILE 113 6.095 77.227 -48.755 793 HG22 ILE 113 HG22 ILE 113 5.804 75.504 -48.520 794 HG23 ILE 113 HG23 ILE 113 5.007 76.682 -47.478 795 HD11 ILE 113 HD11 ILE 113 7.325 73.013 -46.438 796 HD12 ILE 113 HD12 ILE 113 6.102 74.195 -45.969 797 HD13 ILE 113 HD13 ILE 113 6.193 73.633 -47.639 798 H GLY 114 H GLY 114 7.326 78.844 -45.417 799 HA2 GLY 114 HA2 GLY 114 5.741 80.724 -46.938 800 HA3 GLY 114 HA3 GLY 114 5.937 80.692 -45.193 801 H ARG 115 H ARG 115 8.653 80.910 -44.904 802 HA ARG 115 HA ARG 115 9.114 83.619 -44.990 803 HB2 ARG 115 HB2 ARG 115 10.432 81.789 -43.772 804 HB3 ARG 115 HB3 ARG 115 11.339 81.607 -45.268 805 HG2 ARG 115 HG2 ARG 115 11.147 84.372 -44.369 806 HG3 ARG 115 HG3 ARG 115 11.956 83.307 -43.216 807 HD2 ARG 115 HD2 ARG 115 12.680 83.233 -46.120 808 HD3 ARG 115 HD3 ARG 115 13.346 84.481 -45.066 809 HE ARG 115 HE ARG 115 14.135 81.754 -45.184 810 HH11 ARG 115 HH11 ARG 115 13.716 84.426 -42.992 811 HH12 ARG 115 HH12 ARG 115 14.906 83.859 -41.867 812 HH21 ARG 115 HH21 ARG 115 15.703 80.998 -43.712 813 HH22 ARG 115 HH22 ARG 115 16.037 81.911 -42.279 814 H THR 116 H THR 116 9.417 81.302 -47.539 815 HA THR 116 HA THR 116 10.819 83.235 -49.243 816 HB THR 116 HB THR 116 11.767 80.987 -49.233 817 HG1 THR 116 HG1 THR 116 12.166 81.442 -51.254 818 HG21 THR 116 HG21 THR 116 10.559 79.058 -49.992 819 HG22 THR 116 HG22 THR 116 9.146 80.037 -50.390 820 HG23 THR 116 HG23 THR 116 9.621 79.814 -48.706 821 H LEU 117 H LEU 117 7.863 81.300 -49.079 822 HA LEU 117 HA LEU 117 6.800 82.105 -51.566 823 HB2 LEU 117 HB2 LEU 117 6.020 80.141 -50.320 824 HB3 LEU 117 HB3 LEU 117 5.355 81.199 -49.080 825 HG LEU 117 HG LEU 117 4.371 81.658 -51.824 826 HD11 LEU 117 HD11 LEU 117 4.044 79.465 -52.201 827 HD12 LEU 117 HD12 LEU 117 2.678 79.688 -51.109 828 HD13 LEU 117 HD13 LEU 117 4.199 79.037 -50.497 829 HD21 LEU 117 HD21 LEU 117 2.693 82.615 -50.714 830 HD22 LEU 117 HD22 LEU 117 3.669 82.409 -49.257 831 HD23 LEU 117 HD23 LEU 117 2.461 81.198 -49.689 832 H VAL 118 H VAL 118 7.100 83.721 -48.569 833 HA VAL 118 HA VAL 118 5.054 85.695 -49.298 834 HB VAL 118 HB VAL 118 6.564 85.377 -46.701 835 HG11 VAL 118 HG11 VAL 118 4.471 87.312 -47.628 836 HG12 VAL 118 HG12 VAL 118 4.645 86.909 -45.917 837 HG13 VAL 118 HG13 VAL 118 5.993 87.631 -46.796 838 HG21 VAL 118 HG21 VAL 118 4.576 84.432 -45.786 839 HG22 VAL 118 HG22 VAL 118 3.663 84.776 -47.257 840 HG23 VAL 118 HG23 VAL 118 4.935 83.553 -47.273 841 H VAL 119 H VAL 119 8.468 85.431 -48.374 842 HA VAL 119 HA VAL 119 8.978 88.224 -48.847 843 HB VAL 119 HB VAL 119 10.898 85.934 -48.397 844 HG11 VAL 119 HG11 VAL 119 12.132 87.602 -49.506 845 HG12 VAL 119 HG12 VAL 119 11.324 88.900 -48.622 846 HG13 VAL 119 HG13 VAL 119 12.466 87.842 -47.790 847 HG21 VAL 119 HG21 VAL 119 10.746 86.294 -46.171 848 HG22 VAL 119 HG22 VAL 119 10.494 88.030 -46.359 849 HG23 VAL 119 HG23 VAL 119 9.150 86.914 -46.601 850 H HIS 120 H HIS 120 10.214 85.242 -50.374 851 HA HIS 120 HA HIS 120 10.822 86.790 -52.785 852 HB2 HIS 120 HB2 HIS 120 11.654 84.008 -51.937 853 HB3 HIS 120 HB3 HIS 120 12.091 84.749 -53.474 854 HD1 HIS 120 HD1 HIS 120 13.854 83.918 -50.766 855 HD2 HIS 120 HD2 HIS 120 13.074 87.667 -52.377 856 HE1 HIS 120 HE1 HIS 120 15.697 85.407 -49.926 857 H GLU 121 H GLU 121 8.108 86.285 -52.247 858 HA GLU 121 HA GLU 121 7.006 84.028 -53.426 859 HB2 GLU 121 HB2 GLU 121 5.820 85.871 -52.131 860 HB3 GLU 121 HB3 GLU 121 5.797 86.782 -53.634 861 HG2 GLU 121 HG2 GLU 121 4.466 85.092 -54.701 862 HG3 GLU 121 HG3 GLU 121 4.587 84.050 -53.283 863 H LYS 122 H LYS 122 8.217 86.977 -54.897 864 HA LYS 122 HA LYS 122 7.178 86.668 -57.472 865 HB2 LYS 122 HB2 LYS 122 8.161 88.744 -57.023 866 HB3 LYS 122 HB3 LYS 122 9.629 88.017 -56.383 867 HG2 LYS 122 HG2 LYS 122 10.415 87.469 -58.538 868 HG3 LYS 122 HG3 LYS 122 8.844 87.797 -59.275 869 HD2 LYS 122 HD2 LYS 122 10.347 89.955 -57.833 870 HD3 LYS 122 HD3 LYS 122 10.727 89.555 -59.511 871 HE2 LYS 122 HE2 LYS 122 8.150 89.786 -59.847 872 HE3 LYS 122 HE3 LYS 122 8.229 90.716 -58.351 873 HZ1 LYS 122 HZ1 LYS 122 8.586 92.378 -59.820 874 HZ2 LYS 122 HZ2 LYS 122 9.253 91.368 -61.002 875 HZ3 LYS 122 HZ3 LYS 122 10.191 91.860 -59.682 876 H ALA 123 H ALA 123 9.655 84.931 -55.837 877 HA ALA 123 HA ALA 123 10.887 83.108 -56.426 878 HB1 ALA 123 HB1 ALA 123 8.709 82.469 -57.542 879 HB2 ALA 123 HB2 ALA 123 9.408 83.072 -59.045 880 HB3 ALA 123 HB3 ALA 123 10.166 81.723 -58.197 881 H ASP 124 H ASP 124 12.960 83.551 -56.755 882 HA ASP 124 HA ASP 124 14.914 84.133 -57.768 883 HB2 ASP 124 HB2 ASP 124 13.620 82.783 -59.668 884 HB3 ASP 124 HB3 ASP 124 13.645 84.360 -60.453 885 H ASP 125 H ASP 125 13.469 86.179 -56.629 886 HA ASP 125 HA ASP 125 13.418 88.403 -58.499 887 HB2 ASP 125 HB2 ASP 125 11.620 88.508 -57.002 888 HB3 ASP 125 HB3 ASP 125 12.620 88.056 -55.624 Start of MODEL 5 1 H ALA 1 H1 ALA 1 -20.749 18.117 -36.513 2 HA ALA 1 HA ALA 1 -21.415 20.932 -35.993 3 HB1 ALA 1 HB1 ALA 1 -19.062 19.954 -35.180 4 HB2 ALA 1 HB2 ALA 1 -18.644 20.362 -36.844 5 HB3 ALA 1 HB3 ALA 1 -19.268 21.607 -35.761 6 H THR 2 H THR 2 -19.793 22.049 -37.955 7 HA THR 2 HA THR 2 -20.207 20.729 -40.473 8 HB THR 2 HB THR 2 -21.555 23.290 -40.676 9 HG1 THR 2 HG1 THR 2 -22.280 22.769 -38.566 10 HG21 THR 2 HG21 THR 2 -22.941 20.720 -41.195 11 HG22 THR 2 HG22 THR 2 -21.482 21.047 -42.129 12 HG23 THR 2 HG23 THR 2 -22.837 22.172 -42.190 13 H LYS 3 H LYS 3 -18.119 22.106 -38.825 14 HA LYS 3 HA LYS 3 -17.403 24.402 -40.461 15 HB2 LYS 3 HB2 LYS 3 -15.814 23.184 -38.205 16 HB3 LYS 3 HB3 LYS 3 -15.653 24.800 -38.876 17 HG2 LYS 3 HG2 LYS 3 -16.984 25.501 -37.250 18 HG3 LYS 3 HG3 LYS 3 -18.301 24.651 -38.058 19 HD2 LYS 3 HD2 LYS 3 -17.888 22.669 -36.747 20 HD3 LYS 3 HD3 LYS 3 -16.459 23.408 -36.018 21 HE2 LYS 3 HE2 LYS 3 -19.002 24.895 -35.759 22 HE3 LYS 3 HE3 LYS 3 -18.875 23.392 -34.849 23 HZ1 LYS 3 HZ1 LYS 3 -17.239 24.219 -33.528 24 HZ2 LYS 3 HZ2 LYS 3 -18.053 25.666 -33.861 25 HZ3 LYS 3 HZ3 LYS 3 -16.639 25.275 -34.707 26 H ALA 4 H ALA 4 -16.117 21.192 -39.663 27 HA ALA 4 HA ALA 4 -13.811 21.339 -41.267 28 HB1 ALA 4 HB1 ALA 4 -14.342 18.687 -41.247 29 HB2 ALA 4 HB2 ALA 4 -13.572 19.555 -39.918 30 HB3 ALA 4 HB3 ALA 4 -15.303 19.226 -39.870 31 H VAL 5 H VAL 5 -17.084 21.118 -42.120 32 HA VAL 5 HA VAL 5 -16.650 19.746 -44.634 33 HB VAL 5 HB VAL 5 -19.161 21.227 -43.918 34 HG11 VAL 5 HG11 VAL 5 -19.210 18.572 -45.191 35 HG12 VAL 5 HG12 VAL 5 -20.129 20.030 -45.566 36 HG13 VAL 5 HG13 VAL 5 -18.472 19.859 -46.143 37 HG21 VAL 5 HG21 VAL 5 -19.933 19.055 -42.888 38 HG22 VAL 5 HG22 VAL 5 -18.239 18.565 -42.857 39 HG23 VAL 5 HG23 VAL 5 -18.764 19.979 -41.943 40 H CYS 6 H CYS 6 -17.546 23.020 -43.578 41 HA CYS 6 HA CYS 6 -16.055 24.318 -45.566 42 HB2 CYS 6 HB2 CYS 6 -18.025 25.235 -46.889 43 HB3 CYS 6 HB3 CYS 6 -17.583 23.562 -47.210 44 HG CYS 6 HG CYS 6 -19.795 22.436 -46.424 45 H VAL 7 H VAL 7 -15.663 25.249 -43.402 46 HA VAL 7 HA VAL 7 -16.828 27.785 -43.144 47 HB VAL 7 HB VAL 7 -18.239 25.665 -41.744 48 HG11 VAL 7 HG11 VAL 7 -17.167 27.968 -40.121 49 HG12 VAL 7 HG12 VAL 7 -18.498 26.927 -39.614 50 HG13 VAL 7 HG13 VAL 7 -16.887 26.249 -39.848 51 HG21 VAL 7 HG21 VAL 7 -18.816 28.003 -43.103 52 HG22 VAL 7 HG22 VAL 7 -19.968 26.990 -42.232 53 HG23 VAL 7 HG23 VAL 7 -19.231 28.377 -41.430 54 H LEU 8 H LEU 8 -15.152 25.121 -41.590 55 HA LEU 8 HA LEU 8 -13.910 26.564 -39.523 56 HB2 LEU 8 HB2 LEU 8 -14.058 24.044 -39.846 57 HB3 LEU 8 HB3 LEU 8 -12.691 24.214 -40.946 58 HG LEU 8 HG LEU 8 -11.877 25.501 -38.617 59 HD11 LEU 8 HD11 LEU 8 -12.186 23.519 -36.999 60 HD12 LEU 8 HD12 LEU 8 -13.562 23.098 -38.017 61 HD13 LEU 8 HD13 LEU 8 -13.515 24.659 -37.199 62 HD21 LEU 8 HD21 LEU 8 -10.192 24.343 -39.561 63 HD22 LEU 8 HD22 LEU 8 -11.249 23.042 -40.109 64 HD23 LEU 8 HD23 LEU 8 -10.694 23.083 -38.436 65 H LYS 9 H LYS 9 -13.410 26.608 -42.887 66 HA LYS 9 HA LYS 9 -10.674 27.601 -42.672 67 HB2 LYS 9 HB2 LYS 9 -12.440 26.778 -44.951 68 HB3 LYS 9 HB3 LYS 9 -11.024 27.777 -45.253 69 HG2 LYS 9 HG2 LYS 9 -9.842 25.907 -45.370 70 HG3 LYS 9 HG3 LYS 9 -10.099 25.715 -43.634 71 HD2 LYS 9 HD2 LYS 9 -12.174 24.472 -44.107 72 HD3 LYS 9 HD3 LYS 9 -11.855 24.628 -45.836 73 HE2 LYS 9 HE2 LYS 9 -9.549 23.551 -45.169 74 HE3 LYS 9 HE3 LYS 9 -10.471 22.968 -43.784 75 HZ1 LYS 9 HZ1 LYS 9 -11.972 21.841 -45.213 76 HZ2 LYS 9 HZ2 LYS 9 -10.412 21.428 -45.717 77 HZ3 LYS 9 HZ3 LYS 9 -11.313 22.558 -46.597 78 H GLY 10 H GLY 10 -13.683 28.871 -42.340 79 HA2 GLY 10 HA2 GLY 10 -12.723 31.534 -43.153 80 HA3 GLY 10 HA3 GLY 10 -14.330 30.999 -43.626 81 H ASP 11 H ASP 11 -12.538 30.696 -40.567 82 HA ASP 11 HA ASP 11 -14.570 32.370 -39.272 83 HB2 ASP 11 HB2 ASP 11 -14.664 29.646 -39.065 84 HB3 ASP 11 HB3 ASP 11 -13.689 30.069 -37.661 85 H GLY 12 H GLY 12 -11.669 32.602 -40.066 86 HA2 GLY 12 HA2 GLY 12 -9.781 33.586 -39.209 87 HA3 GLY 12 HA3 GLY 12 -10.783 34.095 -37.857 88 HA PRO 13 HA PRO 13 -9.302 29.816 -36.345 89 HB2 PRO 13 HB2 PRO 13 -8.120 28.132 -38.116 90 HB3 PRO 13 HB3 PRO 13 -9.870 28.198 -37.872 91 HG2 PRO 13 HG2 PRO 13 -8.209 29.456 -40.020 92 HG3 PRO 13 HG3 PRO 13 -9.763 28.614 -40.157 93 HD2 PRO 13 HD2 PRO 13 -9.563 31.315 -40.151 94 HD3 PRO 13 HD3 PRO 13 -10.964 30.458 -39.473 95 H VAL 14 H VAL 14 -6.906 29.527 -38.880 96 HA VAL 14 HA VAL 14 -4.795 30.077 -36.970 97 HB VAL 14 HB VAL 14 -3.256 29.336 -38.695 98 HG11 VAL 14 HG11 VAL 14 -5.491 27.382 -38.940 99 HG12 VAL 14 HG12 VAL 14 -3.783 27.106 -38.595 100 HG13 VAL 14 HG13 VAL 14 -4.846 27.743 -37.340 101 HG21 VAL 14 HG21 VAL 14 -5.520 29.934 -40.434 102 HG22 VAL 14 HG22 VAL 14 -3.797 29.858 -40.803 103 HG23 VAL 14 HG23 VAL 14 -4.760 28.381 -40.785 104 H GLN 15 H GLN 15 -6.539 31.785 -39.336 105 HA GLN 15 HA GLN 15 -4.410 33.748 -39.741 106 HB2 GLN 15 HB2 GLN 15 -5.829 32.866 -41.653 107 HB3 GLN 15 HB3 GLN 15 -7.166 33.775 -40.961 108 HG2 GLN 15 HG2 GLN 15 -6.338 35.191 -42.591 109 HG3 GLN 15 HG3 GLN 15 -5.602 35.802 -41.109 110 HE21 GLN 15 HE21 GLN 15 -3.584 36.377 -41.393 111 HE22 GLN 15 HE22 GLN 15 -2.432 35.601 -42.422 112 H GLY 16 H GLY 16 -7.705 33.493 -38.467 113 HA2 GLY 16 HA2 GLY 16 -7.868 36.249 -37.714 114 HA3 GLY 16 HA3 GLY 16 -8.964 34.968 -37.218 115 H ILE 17 H ILE 17 -6.740 33.339 -36.146 116 HA ILE 17 HA ILE 17 -6.658 34.574 -33.530 117 HB ILE 17 HB ILE 17 -7.008 32.047 -34.105 118 HG12 ILE 17 HG12 ILE 17 -5.813 31.469 -31.903 119 HG13 ILE 17 HG13 ILE 17 -5.345 33.164 -31.854 120 HG21 ILE 17 HG21 ILE 17 -4.021 32.031 -33.789 121 HG22 ILE 17 HG22 ILE 17 -5.084 30.698 -34.229 122 HG23 ILE 17 HG23 ILE 17 -4.802 32.012 -35.370 123 HD11 ILE 17 HD11 ILE 17 -7.691 32.035 -30.888 124 HD12 ILE 17 HD12 ILE 17 -7.325 33.752 -31.060 125 HD13 ILE 17 HD13 ILE 17 -8.165 32.895 -32.352 126 H ILE 18 H ILE 18 -4.519 34.039 -36.213 127 HA ILE 18 HA ILE 18 -2.050 34.333 -34.894 128 HB ILE 18 HB ILE 18 -2.981 34.435 -37.685 129 HG12 ILE 18 HG12 ILE 18 -1.954 32.450 -36.592 130 HG13 ILE 18 HG13 ILE 18 -1.077 32.972 -38.027 131 HG21 ILE 18 HG21 ILE 18 -1.900 36.537 -37.752 132 HG22 ILE 18 HG22 ILE 18 -0.549 35.954 -36.785 133 HG23 ILE 18 HG23 ILE 18 -0.764 35.377 -38.436 134 HD11 ILE 18 HD11 ILE 18 -0.003 32.450 -35.549 135 HD12 ILE 18 HD12 ILE 18 0.784 33.318 -36.869 136 HD13 ILE 18 HD13 ILE 18 -0.069 34.211 -35.611 137 H ASN 19 H ASN 19 -4.355 36.665 -36.149 138 HA ASN 19 HA ASN 19 -2.566 38.882 -35.507 139 HB2 ASN 19 HB2 ASN 19 -4.799 38.479 -37.320 140 HB3 ASN 19 HB3 ASN 19 -5.003 39.941 -36.360 141 HD21 ASN 19 HD21 ASN 19 -4.260 39.283 -39.249 142 HD22 ASN 19 HD22 ASN 19 -2.888 40.290 -39.551 143 H PHE 20 H PHE 20 -5.323 37.211 -34.275 144 HA PHE 20 HA PHE 20 -6.157 39.330 -32.509 145 HB2 PHE 20 HB2 PHE 20 -7.024 36.526 -33.045 146 HB3 PHE 20 HB3 PHE 20 -7.467 37.251 -31.504 147 HD1 PHE 20 HD1 PHE 20 -7.188 38.939 -34.789 148 HD2 PHE 20 HD2 PHE 20 -9.778 37.506 -31.731 149 HE1 PHE 20 HE1 PHE 20 -9.086 40.069 -35.872 150 HE2 PHE 20 HE2 PHE 20 -11.680 38.634 -32.809 151 HZ PHE 20 HZ PHE 20 -11.336 39.916 -34.882 152 H GLU 21 H GLU 21 -4.222 36.404 -32.305 153 HA GLU 21 HA GLU 21 -3.885 36.659 -29.437 154 HB2 GLU 21 HB2 GLU 21 -4.001 34.459 -30.771 155 HB3 GLU 21 HB3 GLU 21 -2.339 34.800 -31.228 156 HG2 GLU 21 HG2 GLU 21 -1.977 33.495 -29.409 157 HG3 GLU 21 HG3 GLU 21 -2.032 35.075 -28.630 158 H GLN 22 H GLN 22 -2.477 37.983 -32.182 159 HA GLN 22 HA GLN 22 0.127 38.365 -30.894 160 HB2 GLN 22 HB2 GLN 22 0.056 37.588 -33.257 161 HB3 GLN 22 HB3 GLN 22 -0.732 39.098 -33.698 162 HG2 GLN 22 HG2 GLN 22 1.335 39.807 -34.136 163 HG3 GLN 22 HG3 GLN 22 1.468 40.002 -32.390 164 HE21 GLN 22 HE21 GLN 22 3.677 39.621 -34.000 165 HE22 GLN 22 HE22 GLN 22 4.374 38.078 -33.653 166 H LYS 23 H LYS 23 -2.638 40.145 -32.164 167 HA LYS 23 HA LYS 23 -1.497 42.717 -31.533 168 HB2 LYS 23 HB2 LYS 23 -4.266 41.887 -32.409 169 HB3 LYS 23 HB3 LYS 23 -3.781 43.557 -32.150 170 HG2 LYS 23 HG2 LYS 23 -2.499 41.687 -34.129 171 HG3 LYS 23 HG3 LYS 23 -3.736 42.883 -34.520 172 HD2 LYS 23 HD2 LYS 23 -2.208 44.497 -34.646 173 HD3 LYS 23 HD3 LYS 23 -1.605 44.111 -33.033 174 HE2 LYS 23 HE2 LYS 23 -0.836 42.293 -35.243 175 HE3 LYS 23 HE3 LYS 23 -0.103 43.897 -35.229 176 HZ1 LYS 23 HZ1 LYS 23 1.363 42.689 -33.966 177 HZ2 LYS 23 HZ2 LYS 23 0.162 41.719 -33.273 178 HZ3 LYS 23 HZ3 LYS 23 0.358 43.321 -32.760 179 H GLU 24 H GLU 24 -3.710 40.445 -30.048 180 HA GLU 24 HA GLU 24 -4.398 42.312 -27.928 181 HB2 GLU 24 HB2 GLU 24 -5.863 40.390 -29.078 182 HB3 GLU 24 HB3 GLU 24 -5.170 39.446 -27.766 183 HG2 GLU 24 HG2 GLU 24 -6.005 41.213 -26.191 184 HG3 GLU 24 HG3 GLU 24 -6.875 41.912 -27.556 185 H SER 25 H SER 25 -1.705 40.751 -28.519 186 HA SER 25 HA SER 25 -1.272 39.952 -25.714 187 HB2 SER 25 HB2 SER 25 -0.273 38.758 -28.280 188 HB3 SER 25 HB3 SER 25 0.670 38.576 -26.801 189 HG SER 25 HG SER 25 -1.714 37.407 -27.534 190 H ASN 26 H ASN 26 -0.847 42.499 -27.468 191 HA ASN 26 HA ASN 26 1.265 43.589 -26.036 192 HB2 ASN 26 HB2 ASN 26 2.148 41.925 -28.206 193 HB3 ASN 26 HB3 ASN 26 2.581 43.600 -28.541 194 HD21 ASN 26 HD21 ASN 26 4.131 41.148 -27.743 195 HD22 ASN 26 HD22 ASN 26 5.084 41.666 -26.397 196 H GLY 27 H GLY 27 -0.613 43.539 -28.981 197 HA2 GLY 27 HA2 GLY 27 -0.111 46.157 -29.878 198 HA3 GLY 27 HA3 GLY 27 -1.554 45.218 -30.233 199 HA PRO 28 HA PRO 28 -2.986 48.836 -27.806 200 HB2 PRO 28 HB2 PRO 28 -5.333 49.073 -29.152 201 HB3 PRO 28 HB3 PRO 28 -3.821 49.786 -29.726 202 HG2 PRO 28 HG2 PRO 28 -5.151 47.238 -30.563 203 HG3 PRO 28 HG3 PRO 28 -4.376 48.478 -31.567 204 HD2 PRO 28 HD2 PRO 28 -3.143 46.160 -30.906 205 HD3 PRO 28 HD3 PRO 28 -2.257 47.679 -31.138 206 H VAL 29 H VAL 29 -3.038 46.289 -26.720 207 HA VAL 29 HA VAL 29 -5.681 46.286 -25.485 208 HB VAL 29 HB VAL 29 -4.471 43.719 -26.512 209 HG11 VAL 29 HG11 VAL 29 -7.169 43.355 -26.087 210 HG12 VAL 29 HG12 VAL 29 -5.871 42.850 -25.004 211 HG13 VAL 29 HG13 VAL 29 -6.684 44.393 -24.747 212 HG21 VAL 29 HG21 VAL 29 -6.774 45.292 -27.663 213 HG22 VAL 29 HG22 VAL 29 -5.171 45.147 -28.385 214 HG23 VAL 29 HG23 VAL 29 -6.200 43.723 -28.225 215 H LYS 30 H LYS 30 -2.669 44.370 -25.545 216 HA LYS 30 HA LYS 30 -2.732 43.772 -22.780 217 HB2 LYS 30 HB2 LYS 30 -1.488 42.437 -24.451 218 HB3 LYS 30 HB3 LYS 30 -0.364 43.774 -24.659 219 HG2 LYS 30 HG2 LYS 30 0.230 43.573 -22.256 220 HG3 LYS 30 HG3 LYS 30 -0.789 42.133 -22.174 221 HD2 LYS 30 HD2 LYS 30 1.232 42.206 -24.334 222 HD3 LYS 30 HD3 LYS 30 1.841 42.044 -22.684 223 HE2 LYS 30 HE2 LYS 30 0.185 40.157 -22.397 224 HE3 LYS 30 HE3 LYS 30 -0.082 40.241 -24.136 225 HZ1 LYS 30 HZ1 LYS 30 2.146 39.644 -24.556 226 HZ2 LYS 30 HZ2 LYS 30 1.597 38.565 -23.374 227 HZ3 LYS 30 HZ3 LYS 30 2.602 39.855 -22.940 228 H VAL 31 H VAL 31 -0.860 46.146 -24.654 229 HA VAL 31 HA VAL 31 0.562 47.253 -22.509 230 HB VAL 31 HB VAL 31 -0.322 48.606 -25.062 231 HG11 VAL 31 HG11 VAL 31 2.015 49.785 -24.355 232 HG12 VAL 31 HG12 VAL 31 0.418 50.439 -23.991 233 HG13 VAL 31 HG13 VAL 31 1.286 49.503 -22.775 234 HG21 VAL 31 HG21 VAL 31 1.384 47.617 -26.139 235 HG22 VAL 31 HG22 VAL 31 2.465 47.742 -24.751 236 HG23 VAL 31 HG23 VAL 31 1.293 46.428 -24.840 237 H TRP 32 H TRP 32 -2.734 47.566 -23.423 238 HA TRP 32 HA TRP 32 -3.392 50.090 -22.462 239 HB2 TRP 32 HB2 TRP 32 -4.805 48.089 -23.585 240 HB3 TRP 32 HB3 TRP 32 -5.322 47.906 -21.912 241 HD1 TRP 32 HD1 TRP 32 -7.231 49.445 -21.137 242 HE1 TRP 32 HE1 TRP 32 -8.425 51.509 -22.106 243 HE3 TRP 32 HE3 TRP 32 -4.223 50.297 -25.182 244 HZ2 TRP 32 HZ2 TRP 32 -8.132 53.264 -24.298 245 HZ3 TRP 32 HZ3 TRP 32 -4.749 52.188 -26.665 246 HH2 TRP 32 HH2 TRP 32 -6.664 53.640 -26.232 247 H GLY 33 H GLY 33 -3.648 46.990 -20.700 248 HA2 GLY 33 HA2 GLY 33 -2.682 48.183 -18.275 249 HA3 GLY 33 HA3 GLY 33 -4.415 47.897 -18.238 250 H SER 34 H SER 34 -2.561 45.720 -20.126 251 HA SER 34 HA SER 34 -3.231 43.553 -18.338 252 HB2 SER 34 HB2 SER 34 -3.482 43.243 -20.755 253 HB3 SER 34 HB3 SER 34 -1.763 43.550 -20.988 254 HG SER 34 HG SER 34 -2.657 41.254 -20.779 255 H ILE 35 H ILE 35 -0.180 44.486 -19.938 256 HA ILE 35 HA ILE 35 1.498 42.957 -18.318 257 HB ILE 35 HB ILE 35 3.296 44.610 -19.012 258 HG12 ILE 35 HG12 ILE 35 1.064 45.749 -20.705 259 HG13 ILE 35 HG13 ILE 35 1.695 46.530 -19.260 260 HG21 ILE 35 HG21 ILE 35 2.325 43.980 -21.597 261 HG22 ILE 35 HG22 ILE 35 3.542 43.131 -20.644 262 HG23 ILE 35 HG23 ILE 35 1.844 42.679 -20.507 263 HD11 ILE 35 HD11 ILE 35 3.257 47.496 -20.481 264 HD12 ILE 35 HD12 ILE 35 3.888 45.913 -20.933 265 HD13 ILE 35 HD13 ILE 35 2.647 46.682 -21.919 266 H LYS 36 H LYS 36 -0.234 45.776 -17.570 267 HA LYS 36 HA LYS 36 1.410 46.193 -15.158 268 HB2 LYS 36 HB2 LYS 36 0.113 48.123 -17.014 269 HB3 LYS 36 HB3 LYS 36 0.121 48.528 -15.303 270 HG2 LYS 36 HG2 LYS 36 2.079 49.496 -15.863 271 HG3 LYS 36 HG3 LYS 36 2.691 47.864 -15.588 272 HD2 LYS 36 HD2 LYS 36 3.115 47.517 -17.779 273 HD3 LYS 36 HD3 LYS 36 1.673 48.392 -18.301 274 HE2 LYS 36 HE2 LYS 36 3.019 50.476 -17.445 275 HE3 LYS 36 HE3 LYS 36 4.406 49.417 -17.690 276 HZ1 LYS 36 HZ1 LYS 36 3.162 50.930 -19.597 277 HZ2 LYS 36 HZ2 LYS 36 2.618 49.359 -19.912 278 HZ3 LYS 36 HZ3 LYS 36 4.278 49.690 -19.876 279 H GLY 37 H GLY 37 -1.129 44.564 -15.927 280 HA2 GLY 37 HA2 GLY 37 -2.473 45.074 -13.402 281 HA3 GLY 37 HA3 GLY 37 -3.448 45.346 -14.839 282 H LEU 38 H LEU 38 -3.174 43.410 -16.479 283 HA LEU 38 HA LEU 38 -4.267 41.133 -15.161 284 HB2 LEU 38 HB2 LEU 38 -4.448 42.134 -17.664 285 HB3 LEU 38 HB3 LEU 38 -3.296 40.825 -17.928 286 HG LEU 38 HG LEU 38 -5.000 39.294 -16.841 287 HD11 LEU 38 HD11 LEU 38 -7.046 41.343 -17.529 288 HD12 LEU 38 HD12 LEU 38 -6.251 41.418 -15.957 289 HD13 LEU 38 HD13 LEU 38 -7.148 39.972 -16.423 290 HD21 LEU 38 HD21 LEU 38 -6.547 39.895 -19.073 291 HD22 LEU 38 HD22 LEU 38 -5.192 38.765 -18.992 292 HD23 LEU 38 HD23 LEU 38 -4.920 40.435 -19.492 293 H THR 39 H THR 39 -1.305 41.541 -17.111 294 HA THR 39 HA THR 39 -0.256 39.015 -16.180 295 HB THR 39 HB THR 39 1.300 41.071 -17.735 296 HG1 THR 39 HG1 THR 39 -0.824 40.592 -18.696 297 HG21 THR 39 HG21 THR 39 1.364 38.051 -17.709 298 HG22 THR 39 HG22 THR 39 2.509 39.107 -16.884 299 HG23 THR 39 HG23 THR 39 2.422 39.105 -18.645 300 H GLU 40 H GLU 40 -0.182 42.254 -15.139 301 HA GLU 40 HA GLU 40 2.318 41.931 -13.668 302 HB2 GLU 40 HB2 GLU 40 2.410 44.097 -14.280 303 HB3 GLU 40 HB3 GLU 40 0.676 44.191 -14.553 304 HG2 GLU 40 HG2 GLU 40 0.236 44.681 -12.302 305 HG3 GLU 40 HG3 GLU 40 1.850 44.192 -11.796 306 H GLY 41 H GLY 41 -1.123 41.910 -13.183 307 HA2 GLY 41 HA2 GLY 41 -0.774 41.904 -10.267 308 HA3 GLY 41 HA3 GLY 41 -2.297 42.113 -11.118 309 H LEU 42 H LEU 42 -2.080 39.924 -12.891 310 HA LEU 42 HA LEU 42 -2.681 37.768 -11.026 311 HB2 LEU 42 HB2 LEU 42 -2.966 37.513 -13.981 312 HB3 LEU 42 HB3 LEU 42 -3.935 36.794 -12.698 313 HG LEU 42 HG LEU 42 -4.010 39.720 -13.420 314 HD11 LEU 42 HD11 LEU 42 -4.759 38.124 -15.244 315 HD12 LEU 42 HD12 LEU 42 -5.933 39.326 -14.712 316 HD13 LEU 42 HD13 LEU 42 -6.066 37.658 -14.155 317 HD21 LEU 42 HD21 LEU 42 -4.701 38.874 -11.097 318 HD22 LEU 42 HD22 LEU 42 -6.074 38.139 -11.926 319 HD23 LEU 42 HD23 LEU 42 -5.840 39.887 -11.985 320 H HIS 43 H HIS 43 -0.289 38.693 -13.352 321 HA HIS 43 HA HIS 43 1.070 36.110 -12.942 322 HB2 HIS 43 HB2 HIS 43 0.219 37.140 -15.362 323 HB3 HIS 43 HB3 HIS 43 1.919 37.592 -15.312 324 HD1 HIS 43 HD1 HIS 43 3.599 35.496 -14.823 325 HD2 HIS 43 HD2 HIS 43 -0.226 34.585 -16.163 326 HE1 HIS 43 HE1 HIS 43 3.730 33.133 -15.676 327 H GLY 44 H GLY 44 1.133 39.350 -12.262 328 HA2 GLY 44 HA2 GLY 44 4.081 39.386 -12.081 329 HA3 GLY 44 HA3 GLY 44 3.088 40.824 -12.260 330 H PHE 45 H PHE 45 1.127 39.585 -10.301 331 HA PHE 45 HA PHE 45 2.672 40.140 -7.854 332 HB2 PHE 45 HB2 PHE 45 1.271 42.013 -8.097 333 HB3 PHE 45 HB3 PHE 45 -0.082 41.040 -8.663 334 HD1 PHE 45 HD1 PHE 45 -1.412 39.725 -7.077 335 HD2 PHE 45 HD2 PHE 45 1.698 42.322 -5.773 336 HE1 PHE 45 HE1 PHE 45 -2.312 39.647 -4.788 337 HE2 PHE 45 HE2 PHE 45 0.803 42.248 -3.483 338 HZ PHE 45 HZ PHE 45 -1.206 40.911 -2.988 339 H HIS 46 H HIS 46 0.510 38.053 -9.502 340 HA HIS 46 HA HIS 46 -0.082 36.554 -7.050 341 HB2 HIS 46 HB2 HIS 46 -2.085 36.873 -8.213 342 HB3 HIS 46 HB3 HIS 46 -1.325 36.625 -9.782 343 HD1 HIS 46 HD1 HIS 46 -1.713 34.402 -10.793 344 HD2 HIS 46 HD2 HIS 46 -2.169 34.326 -6.664 345 HE1 HIS 46 HE1 HIS 46 -2.482 32.070 -10.243 346 H VAL 47 H VAL 47 1.497 36.300 -10.175 347 HA VAL 47 HA VAL 47 2.337 33.558 -9.554 348 HB VAL 47 HB VAL 47 2.566 35.113 -12.136 349 HG11 VAL 47 HG11 VAL 47 3.316 32.278 -11.445 350 HG12 VAL 47 HG12 VAL 47 3.172 32.886 -13.096 351 HG13 VAL 47 HG13 VAL 47 4.383 33.563 -12.006 352 HG21 VAL 47 HG21 VAL 47 0.645 34.157 -12.847 353 HG22 VAL 47 HG22 VAL 47 0.920 32.668 -11.941 354 HG23 VAL 47 HG23 VAL 47 0.297 34.099 -11.118 355 H HIS 48 H HIS 48 3.488 36.801 -9.784 356 HA HIS 48 HA HIS 48 6.252 35.845 -9.414 357 HB2 HIS 48 HB2 HIS 48 5.146 38.206 -10.886 358 HB3 HIS 48 HB3 HIS 48 6.753 38.316 -10.173 359 HD1 HIS 48 HD1 HIS 48 5.827 34.992 -11.474 360 HD2 HIS 48 HD2 HIS 48 7.738 38.409 -12.861 361 HE1 HIS 48 HE1 HIS 48 7.003 34.295 -13.584 362 H GLU 49 H GLU 49 3.681 37.844 -8.215 363 HA GLU 49 HA GLU 49 3.436 39.111 -6.335 364 HB2 GLU 49 HB2 GLU 49 5.335 36.956 -5.473 365 HB3 GLU 49 HB3 GLU 49 4.872 38.226 -4.352 366 HG2 GLU 49 HG2 GLU 49 2.505 37.625 -4.702 367 HG3 GLU 49 HG3 GLU 49 3.026 36.295 -5.734 368 H PHE 50 H PHE 50 5.139 40.248 -8.215 369 HA PHE 50 HA PHE 50 6.607 41.968 -8.449 370 HB2 PHE 50 HB2 PHE 50 5.389 42.385 -5.991 371 HB3 PHE 50 HB3 PHE 50 7.108 42.503 -5.626 372 HD1 PHE 50 HD1 PHE 50 4.765 43.656 -8.298 373 HD2 PHE 50 HD2 PHE 50 8.001 44.605 -5.701 374 HE1 PHE 50 HE1 PHE 50 4.786 45.956 -9.171 375 HE2 PHE 50 HE2 PHE 50 8.026 46.908 -6.571 376 HZ PHE 50 HZ PHE 50 6.416 47.585 -8.307 377 H GLY 51 H GLY 51 7.516 39.187 -8.023 378 HA2 GLY 51 HA2 GLY 51 10.282 39.607 -8.097 379 HA3 GLY 51 HA3 GLY 51 9.861 39.120 -6.462 380 H ASP 52 H ASP 52 9.007 37.033 -6.102 381 HA ASP 52 HA ASP 52 8.703 35.165 -8.254 382 HB2 ASP 52 HB2 ASP 52 11.291 35.522 -7.625 383 HB3 ASP 52 HB3 ASP 52 10.874 34.313 -6.416 384 H ASN 53 H ASN 53 6.963 35.951 -6.278 385 HA ASN 53 HA ASN 53 5.621 35.213 -4.588 386 HB2 ASN 53 HB2 ASN 53 6.432 32.467 -5.559 387 HB3 ASN 53 HB3 ASN 53 4.935 32.912 -4.745 388 HD21 ASN 53 HD21 ASN 53 4.877 31.557 -7.107 389 HD22 ASN 53 HD22 ASN 53 4.275 32.585 -8.358 390 H THR 54 H THR 54 8.411 35.664 -3.913 391 HA THR 54 HA THR 54 8.417 34.581 -1.299 392 HB THR 54 HB THR 54 9.132 32.532 -2.450 393 HG1 THR 54 HG1 THR 54 11.348 33.691 -1.091 394 HG21 THR 54 HG21 THR 54 10.784 32.419 -3.994 395 HG22 THR 54 HG22 THR 54 11.763 33.645 -3.190 396 HG23 THR 54 HG23 THR 54 10.410 34.127 -4.214 397 H ALA 55 H ALA 55 10.199 36.075 -3.926 398 HA ALA 55 HA ALA 55 11.625 37.724 -1.941 399 HB1 ALA 55 HB1 ALA 55 13.530 37.831 -3.362 400 HB2 ALA 55 HB2 ALA 55 13.083 36.130 -3.213 401 HB3 ALA 55 HB3 ALA 55 12.672 37.025 -4.677 402 H GLY 56 H GLY 56 9.035 38.251 -3.131 403 HA2 GLY 56 HA2 GLY 56 9.712 40.769 -4.504 404 HA3 GLY 56 HA3 GLY 56 8.445 39.728 -5.130 405 H CYS 57 H CYS 57 7.391 38.964 -2.566 406 HA CYS 57 HA CYS 57 6.486 41.488 -1.406 407 HB2 CYS 57 HB2 CYS 57 4.751 39.488 -2.814 408 HB3 CYS 57 HB3 CYS 57 4.099 40.423 -1.475 409 HG CYS 57 HG CYS 57 3.672 41.336 -4.318 410 H THR 58 H THR 58 8.092 39.032 -0.654 411 HA THR 58 HA THR 58 6.888 38.697 1.967 412 HB THR 58 HB THR 58 7.415 36.128 1.702 413 HG1 THR 58 HG1 THR 58 8.038 36.674 -0.619 414 HG21 THR 58 HG21 THR 58 5.189 35.865 1.856 415 HG22 THR 58 HG22 THR 58 4.892 36.698 0.329 416 HG23 THR 58 HG23 THR 58 5.128 37.627 1.810 417 H SER 59 H SER 59 9.393 39.716 0.528 418 HA SER 59 HA SER 59 11.235 39.144 2.573 419 HB2 SER 59 HB2 SER 59 11.176 36.953 1.173 420 HB3 SER 59 HB3 SER 59 12.104 37.875 -0.009 421 HG SER 59 HG SER 59 13.787 37.884 1.291 422 H ALA 60 H ALA 60 10.657 40.179 -0.721 423 HA ALA 60 HA ALA 60 13.042 41.737 -0.957 424 HB1 ALA 60 HB1 ALA 60 11.232 42.776 -2.773 425 HB2 ALA 60 HB2 ALA 60 12.409 41.498 -3.078 426 HB3 ALA 60 HB3 ALA 60 10.758 41.085 -2.616 427 H GLY 61 H GLY 61 9.982 42.223 0.518 428 HA2 GLY 61 HA2 GLY 61 9.570 44.948 0.321 429 HA3 GLY 61 HA3 GLY 61 9.146 43.986 1.729 430 HA PRO 62 HA PRO 62 12.226 45.912 4.176 431 HB2 PRO 62 HB2 PRO 62 13.436 43.860 5.479 432 HB3 PRO 62 HB3 PRO 62 11.788 44.389 5.841 433 HG2 PRO 62 HG2 PRO 62 12.713 42.090 4.162 434 HG3 PRO 62 HG3 PRO 62 11.394 42.151 5.348 435 HD2 PRO 62 HD2 PRO 62 10.963 42.310 2.680 436 HD3 PRO 62 HD3 PRO 62 9.939 43.146 3.864 437 H HIS 63 H HIS 63 14.051 46.856 3.545 438 HA HIS 63 HA HIS 63 16.439 45.406 3.009 439 HB2 HIS 63 HB2 HIS 63 14.738 46.190 0.740 440 HB3 HIS 63 HB3 HIS 63 16.419 46.693 0.599 441 HD1 HIS 63 HD1 HIS 63 17.824 44.255 1.809 442 HD2 HIS 63 HD2 HIS 63 14.669 44.011 -0.885 443 HE1 HIS 63 HE1 HIS 63 18.028 41.990 0.736 444 H PHE 64 H PHE 64 18.083 47.072 1.890 445 HA PHE 64 HA PHE 64 18.235 49.267 3.715 446 HB2 PHE 64 HB2 PHE 64 20.059 47.826 2.191 447 HB3 PHE 64 HB3 PHE 64 20.059 49.425 1.451 448 HD1 PHE 64 HD1 PHE 64 19.864 48.148 4.955 449 HD2 PHE 64 HD2 PHE 64 21.809 50.710 2.167 450 HE1 PHE 64 HE1 PHE 64 21.340 48.970 6.745 451 HE2 PHE 64 HE2 PHE 64 23.290 51.535 3.951 452 HZ PHE 64 HZ PHE 64 23.055 50.666 6.244 453 H ASN 65 H ASN 65 17.568 48.928 0.263 454 HA ASN 65 HA ASN 65 16.264 51.525 0.276 455 HB2 ASN 65 HB2 ASN 65 18.564 50.882 -1.579 456 HB3 ASN 65 HB3 ASN 65 17.490 52.264 -1.765 457 HD21 ASN 65 HD21 ASN 65 20.043 50.847 0.107 458 HD22 ASN 65 HD22 ASN 65 20.463 52.271 0.989 459 HA PRO 66 HA PRO 66 14.032 48.316 -2.176 460 HB2 PRO 66 HB2 PRO 66 11.576 49.008 -1.248 461 HB3 PRO 66 HB3 PRO 66 12.644 47.884 -0.397 462 HG2 PRO 66 HG2 PRO 66 12.168 50.797 0.106 463 HG3 PRO 66 HG3 PRO 66 12.306 49.467 1.272 464 HD2 PRO 66 HD2 PRO 66 14.350 51.166 0.751 465 HD3 PRO 66 HD3 PRO 66 14.610 49.465 1.188 466 H LEU 67 H LEU 67 15.019 50.429 -3.501 467 HA LEU 67 HA LEU 67 13.078 51.023 -5.412 468 HB2 LEU 67 HB2 LEU 67 12.919 53.512 -4.992 469 HB3 LEU 67 HB3 LEU 67 11.981 52.468 -3.926 470 HG LEU 67 HG LEU 67 14.573 53.036 -2.790 471 HD11 LEU 67 HD11 LEU 67 13.574 55.508 -2.338 472 HD12 LEU 67 HD12 LEU 67 13.117 55.270 -4.024 473 HD13 LEU 67 HD13 LEU 67 14.808 55.139 -3.543 474 HD21 LEU 67 HD21 LEU 67 12.931 52.263 -1.343 475 HD22 LEU 67 HD22 LEU 67 11.694 53.325 -2.015 476 HD23 LEU 67 HD23 LEU 67 12.976 53.992 -1.001 477 H SER 68 H SER 68 15.912 50.313 -5.009 478 HA SER 68 HA SER 68 17.011 51.667 -7.215 479 HB2 SER 68 HB2 SER 68 18.869 52.858 -6.005 480 HB3 SER 68 HB3 SER 68 17.275 53.577 -5.775 481 HG SER 68 HG SER 68 18.859 52.988 -3.887 482 H ARG 69 H ARG 69 16.698 49.002 -6.337 483 HA ARG 69 HA ARG 69 19.207 47.926 -6.957 484 HB2 ARG 69 HB2 ARG 69 19.749 46.850 -4.775 485 HB3 ARG 69 HB3 ARG 69 19.927 48.600 -4.763 486 HG2 ARG 69 HG2 ARG 69 18.833 48.333 -2.797 487 HG3 ARG 69 HG3 ARG 69 17.439 48.478 -3.868 488 HD2 ARG 69 HD2 ARG 69 16.751 46.437 -3.324 489 HD3 ARG 69 HD3 ARG 69 18.308 45.754 -3.788 490 HE ARG 69 HE ARG 69 17.400 46.362 -1.123 491 HH11 ARG 69 HH11 ARG 69 20.160 45.814 -3.174 492 HH12 ARG 69 HH12 ARG 69 21.200 45.346 -1.870 493 HH21 ARG 69 HH21 ARG 69 18.760 45.748 0.602 494 HH22 ARG 69 HH22 ARG 69 20.402 45.307 0.277 495 H LYS 70 H LYS 70 16.092 47.500 -5.404 496 HA LYS 70 HA LYS 70 15.829 44.763 -5.365 497 HB2 LYS 70 HB2 LYS 70 13.932 47.029 -5.684 498 HB3 LYS 70 HB3 LYS 70 13.328 45.421 -6.066 499 HG2 LYS 70 HG2 LYS 70 13.618 44.660 -3.886 500 HG3 LYS 70 HG3 LYS 70 14.731 45.970 -3.477 501 HD2 LYS 70 HD2 LYS 70 12.559 46.327 -2.433 502 HD3 LYS 70 HD3 LYS 70 12.885 47.578 -3.636 503 HE2 LYS 70 HE2 LYS 70 11.274 46.808 -5.070 504 HE3 LYS 70 HE3 LYS 70 11.410 45.144 -4.500 505 HZ1 LYS 70 HZ1 LYS 70 10.026 47.402 -3.170 506 HZ2 LYS 70 HZ2 LYS 70 10.350 45.935 -2.393 507 HZ3 LYS 70 HZ3 LYS 70 9.343 45.967 -3.752 508 H HIS 71 H HIS 71 14.284 46.661 -7.943 509 HA HIS 71 HA HIS 71 14.617 44.411 -9.760 510 HB2 HIS 71 HB2 HIS 71 12.977 46.927 -9.805 511 HB3 HIS 71 HB3 HIS 71 13.241 46.012 -11.287 512 HD1 HIS 71 HD1 HIS 71 12.997 43.154 -10.055 513 HD2 HIS 71 HD2 HIS 71 10.352 46.285 -9.376 514 HE1 HIS 71 HE1 HIS 71 10.832 42.069 -9.376 515 H GLY 72 H GLY 72 17.043 45.515 -9.173 516 HA2 GLY 72 HA2 GLY 72 18.904 45.896 -10.569 517 HA3 GLY 72 HA3 GLY 72 17.823 46.547 -11.793 518 H GLY 73 H GLY 73 16.448 48.353 -9.990 519 HA2 GLY 73 HA2 GLY 73 17.371 50.138 -8.443 520 HA3 GLY 73 HA3 GLY 73 18.608 50.341 -9.675 521 HA PRO 74 HA PRO 74 16.147 53.201 -11.900 522 HB2 PRO 74 HB2 PRO 74 16.378 52.415 -14.490 523 HB3 PRO 74 HB3 PRO 74 17.707 53.154 -13.588 524 HG2 PRO 74 HG2 PRO 74 17.185 50.263 -14.166 525 HG3 PRO 74 HG3 PRO 74 18.714 51.161 -14.237 526 HD2 PRO 74 HD2 PRO 74 18.048 49.577 -12.142 527 HD3 PRO 74 HD3 PRO 74 19.031 51.043 -11.955 528 H LYS 75 H LYS 75 14.532 53.167 -13.997 529 HA LYS 75 HA LYS 75 12.452 52.645 -14.756 530 HB2 LYS 75 HB2 LYS 75 13.751 50.256 -14.697 531 HB3 LYS 75 HB3 LYS 75 12.396 49.920 -13.626 532 HG2 LYS 75 HG2 LYS 75 11.410 49.338 -15.567 533 HG3 LYS 75 HG3 LYS 75 11.066 51.066 -15.637 534 HD2 LYS 75 HD2 LYS 75 11.979 50.815 -17.706 535 HD3 LYS 75 HD3 LYS 75 13.466 51.089 -16.795 536 HE2 LYS 75 HE2 LYS 75 12.893 48.332 -16.631 537 HE3 LYS 75 HE3 LYS 75 12.676 48.800 -18.317 538 HZ1 LYS 75 HZ1 LYS 75 15.102 48.903 -16.661 539 HZ2 LYS 75 HZ2 LYS 75 14.933 49.990 -17.948 540 HZ3 LYS 75 HZ3 LYS 75 14.902 48.322 -18.238 541 H ASP 76 H ASP 76 10.241 52.177 -14.029 542 HA ASP 76 HA ASP 76 8.534 52.499 -12.558 543 HB2 ASP 76 HB2 ASP 76 9.690 50.294 -11.732 544 HB3 ASP 76 HB3 ASP 76 10.182 51.295 -10.367 545 H GLU 77 H GLU 77 10.767 54.480 -12.740 546 HA GLU 77 HA GLU 77 9.852 56.229 -10.683 547 HB2 GLU 77 HB2 GLU 77 11.925 56.535 -9.476 548 HB3 GLU 77 HB3 GLU 77 11.448 54.845 -9.390 549 HG2 GLU 77 HG2 GLU 77 13.037 54.354 -11.225 550 HG3 GLU 77 HG3 GLU 77 13.575 56.032 -11.154 551 H GLU 78 H GLU 78 12.357 55.531 -13.076 552 HA GLU 78 HA GLU 78 12.510 58.391 -13.720 553 HB2 GLU 78 HB2 GLU 78 14.650 57.302 -13.255 554 HB3 GLU 78 HB3 GLU 78 14.332 56.111 -14.509 555 HG2 GLU 78 HG2 GLU 78 14.188 58.122 -16.097 556 HG3 GLU 78 HG3 GLU 78 14.977 59.017 -14.801 557 H ARG 79 H ARG 79 12.473 55.259 -15.432 558 HA ARG 79 HA ARG 79 11.522 56.519 -17.852 559 HB2 ARG 79 HB2 ARG 79 13.048 54.328 -17.413 560 HB3 ARG 79 HB3 ARG 79 11.477 53.572 -17.633 561 HG2 ARG 79 HG2 ARG 79 11.289 54.902 -19.778 562 HG3 ARG 79 HG3 ARG 79 12.999 55.283 -19.572 563 HD2 ARG 79 HD2 ARG 79 12.688 52.494 -19.194 564 HD3 ARG 79 HD3 ARG 79 11.808 52.934 -20.657 565 HE ARG 79 HE ARG 79 14.437 54.069 -20.542 566 HH11 ARG 79 HH11 ARG 79 12.600 51.233 -21.376 567 HH12 ARG 79 HH12 ARG 79 13.771 50.649 -22.513 568 HH21 ARG 79 HH21 ARG 79 15.985 53.311 -22.035 569 HH22 ARG 79 HH22 ARG 79 15.696 51.833 -22.887 570 H HIS 80 H HIS 80 10.031 55.747 -15.070 571 HA HIS 80 HA HIS 80 7.614 54.628 -16.265 572 HB2 HIS 80 HB2 HIS 80 8.749 54.025 -13.930 573 HB3 HIS 80 HB3 HIS 80 7.741 55.359 -13.379 574 HD1 HIS 80 HD1 HIS 80 6.131 53.913 -12.037 575 HD2 HIS 80 HD2 HIS 80 6.414 52.797 -16.031 576 HE1 HIS 80 HE1 HIS 80 4.260 52.275 -12.411 577 H VAL 81 H VAL 81 8.908 57.626 -15.166 578 HA VAL 81 HA VAL 81 6.510 59.004 -16.026 579 HB VAL 81 HB VAL 81 6.499 60.407 -13.903 580 HG11 VAL 81 HG11 VAL 81 4.820 58.634 -14.570 581 HG12 VAL 81 HG12 VAL 81 5.678 57.544 -13.479 582 HG13 VAL 81 HG13 VAL 81 4.915 59.004 -12.849 583 HG21 VAL 81 HG21 VAL 81 7.658 58.029 -12.526 584 HG22 VAL 81 HG22 VAL 81 8.743 59.241 -13.208 585 HG23 VAL 81 HG23 VAL 81 7.560 59.705 -11.985 586 H GLY 82 H GLY 82 9.347 58.790 -16.813 587 HA2 GLY 82 HA2 GLY 82 10.738 61.147 -16.082 588 HA3 GLY 82 HA3 GLY 82 11.083 60.138 -17.480 589 H ASP 83 H ASP 83 7.985 60.780 -17.950 590 HA ASP 83 HA ASP 83 6.763 62.291 -19.147 591 HB2 ASP 83 HB2 ASP 83 8.966 64.322 -18.929 592 HB3 ASP 83 HB3 ASP 83 7.224 64.580 -19.009 593 H LEU 84 H LEU 84 8.803 60.493 -20.282 594 HA LEU 84 HA LEU 84 8.768 61.553 -22.960 595 HB2 LEU 84 HB2 LEU 84 11.359 60.852 -22.992 596 HB3 LEU 84 HB3 LEU 84 10.792 62.503 -22.752 597 HG LEU 84 HG LEU 84 10.956 61.151 -20.224 598 HD11 LEU 84 HD11 LEU 84 13.605 61.208 -20.448 599 HD12 LEU 84 HD12 LEU 84 13.210 60.742 -22.104 600 HD13 LEU 84 HD13 LEU 84 12.660 59.751 -20.754 601 HD21 LEU 84 HD21 LEU 84 10.988 63.618 -20.764 602 HD22 LEU 84 HD22 LEU 84 12.658 63.397 -21.284 603 HD23 LEU 84 HD23 LEU 84 12.203 63.067 -19.611 604 H GLY 85 H GLY 85 11.102 59.216 -21.755 605 HA2 GLY 85 HA2 GLY 85 10.593 57.233 -23.580 606 HA3 GLY 85 HA3 GLY 85 11.235 56.929 -21.974 607 H ASN 86 H ASN 86 8.701 58.060 -20.797 608 HA ASN 86 HA ASN 86 7.180 55.570 -20.963 609 HB2 ASN 86 HB2 ASN 86 7.955 56.869 -18.779 610 HB3 ASN 86 HB3 ASN 86 6.456 57.750 -19.057 611 HD21 ASN 86 HD21 ASN 86 4.640 56.899 -18.314 612 HD22 ASN 86 HD22 ASN 86 4.445 55.275 -17.757 613 H VAL 87 H VAL 87 6.973 58.934 -21.780 614 HA VAL 87 HA VAL 87 4.152 58.602 -22.552 615 HB VAL 87 HB VAL 87 4.803 60.502 -20.996 616 HG11 VAL 87 HG11 VAL 87 5.646 62.087 -23.344 617 HG12 VAL 87 HG12 VAL 87 6.140 62.208 -21.655 618 HG13 VAL 87 HG13 VAL 87 6.829 60.956 -22.688 619 HG21 VAL 87 HG21 VAL 87 2.866 61.360 -21.667 620 HG22 VAL 87 HG22 VAL 87 3.618 62.007 -23.123 621 HG23 VAL 87 HG23 VAL 87 2.963 60.370 -23.124 622 H THR 88 H THR 88 6.998 58.129 -23.905 623 HA THR 88 HA THR 88 6.215 59.309 -26.490 624 HB THR 88 HB THR 88 9.049 58.549 -25.853 625 HG1 THR 88 HG1 THR 88 8.179 61.210 -25.565 626 HG21 THR 88 HG21 THR 88 9.599 60.040 -27.625 627 HG22 THR 88 HG22 THR 88 7.967 60.704 -27.662 628 HG23 THR 88 HG23 THR 88 8.260 59.049 -28.199 629 H ALA 89 H ALA 89 5.989 56.550 -24.954 630 HA ALA 89 HA ALA 89 5.716 54.384 -25.607 631 HB1 ALA 89 HB1 ALA 89 4.828 55.603 -27.699 632 HB2 ALA 89 HB2 ALA 89 6.359 55.132 -28.435 633 HB3 ALA 89 HB3 ALA 89 5.254 53.898 -27.833 634 H ASP 90 H ASP 90 8.480 55.908 -25.405 635 HA ASP 90 HA ASP 90 10.132 53.743 -25.132 636 HB2 ASP 90 HB2 ASP 90 9.648 54.277 -27.903 637 HB3 ASP 90 HB3 ASP 90 11.338 54.629 -27.546 638 H LYS 91 H LYS 91 10.419 56.857 -26.853 639 HA LYS 91 HA LYS 91 11.510 58.359 -24.836 640 HB2 LYS 91 HB2 LYS 91 13.569 57.580 -24.471 641 HB3 LYS 91 HB3 LYS 91 13.369 56.376 -25.737 642 HG2 LYS 91 HG2 LYS 91 14.065 58.072 -27.401 643 HG3 LYS 91 HG3 LYS 91 14.370 59.196 -26.075 644 HD2 LYS 91 HD2 LYS 91 15.664 56.484 -26.230 645 HD3 LYS 91 HD3 LYS 91 16.375 57.919 -26.973 646 HE2 LYS 91 HE2 LYS 91 17.376 58.204 -24.988 647 HE3 LYS 91 HE3 LYS 91 15.809 58.813 -24.460 648 HZ1 LYS 91 HZ1 LYS 91 16.747 56.008 -24.197 649 HZ2 LYS 91 HZ2 LYS 91 15.247 56.598 -23.684 650 HZ3 LYS 91 HZ3 LYS 91 16.667 57.143 -22.943 651 H ASP 92 H ASP 92 11.403 57.567 -28.206 652 HA ASP 92 HA ASP 92 11.648 60.431 -28.852 653 HB2 ASP 92 HB2 ASP 92 12.733 58.037 -30.318 654 HB3 ASP 92 HB3 ASP 92 12.435 59.559 -31.151 655 H GLY 93 H GLY 93 10.081 57.360 -29.529 656 HA2 GLY 93 HA2 GLY 93 7.625 58.603 -30.199 657 HA3 GLY 93 HA3 GLY 93 8.452 58.089 -31.663 658 H VAL 94 H VAL 94 9.677 55.781 -30.262 659 HA VAL 94 HA VAL 94 7.911 54.056 -29.067 660 HB VAL 94 HB VAL 94 6.379 54.214 -30.887 661 HG11 VAL 94 HG11 VAL 94 8.640 53.496 -32.746 662 HG12 VAL 94 HG12 VAL 94 6.968 53.836 -33.198 663 HG13 VAL 94 HG13 VAL 94 7.983 55.119 -32.536 664 HG21 VAL 94 HG21 VAL 94 6.064 51.974 -31.353 665 HG22 VAL 94 HG22 VAL 94 7.790 51.664 -31.553 666 HG23 VAL 94 HG23 VAL 94 7.118 51.902 -29.939 667 H ALA 95 H ALA 95 10.589 54.634 -31.126 668 HA ALA 95 HA ALA 95 11.816 52.129 -30.210 669 HB1 ALA 95 HB1 ALA 95 12.917 52.613 -32.733 670 HB2 ALA 95 HB2 ALA 95 11.825 51.307 -32.273 671 HB3 ALA 95 HB3 ALA 95 11.175 52.808 -32.931 672 H ASP 96 H ASP 96 11.966 55.082 -29.541 673 HA ASP 96 HA ASP 96 13.574 56.513 -28.796 674 HB2 ASP 96 HB2 ASP 96 15.257 55.416 -27.820 675 HB3 ASP 96 HB3 ASP 96 14.792 53.966 -28.707 676 H VAL 97 H VAL 97 12.914 55.947 -31.786 677 HA VAL 97 HA VAL 97 14.966 57.782 -32.821 678 HB VAL 97 HB VAL 97 13.835 55.591 -34.542 679 HG11 VAL 97 HG11 VAL 97 15.691 57.786 -34.867 680 HG12 VAL 97 HG12 VAL 97 16.417 56.242 -35.322 681 HG13 VAL 97 HG13 VAL 97 14.919 56.772 -36.087 682 HG21 VAL 97 HG21 VAL 97 16.286 54.656 -34.065 683 HG22 VAL 97 HG22 VAL 97 15.982 55.420 -32.507 684 HG23 VAL 97 HG23 VAL 97 14.886 54.176 -33.106 685 H SER 98 H SER 98 11.885 57.544 -32.047 686 HA SER 98 HA SER 98 10.005 58.704 -32.601 687 HB2 SER 98 HB2 SER 98 12.090 60.334 -33.438 688 HB3 SER 98 HB3 SER 98 11.053 60.225 -34.859 689 HG SER 98 HG SER 98 10.316 61.908 -33.603 690 H ILE 99 H ILE 99 10.583 56.190 -33.829 691 HA ILE 99 HA ILE 99 10.206 56.005 -36.551 692 HB ILE 99 HB ILE 99 9.689 54.236 -34.261 693 HG12 ILE 99 HG12 ILE 99 10.655 52.625 -36.105 694 HG13 ILE 99 HG13 ILE 99 11.042 54.131 -36.929 695 HG21 ILE 99 HG21 ILE 99 8.163 53.931 -36.837 696 HG22 ILE 99 HG22 ILE 99 8.457 52.595 -35.725 697 HG23 ILE 99 HG23 ILE 99 7.525 53.994 -35.194 698 HD11 ILE 99 HD11 ILE 99 12.880 54.289 -35.720 699 HD12 ILE 99 HD12 ILE 99 11.901 54.394 -34.256 700 HD13 ILE 99 HD13 ILE 99 12.450 52.824 -34.840 701 H GLU 100 H GLU 100 7.751 56.373 -34.024 702 HA GLU 100 HA GLU 100 5.504 56.155 -35.712 703 HB2 GLU 100 HB2 GLU 100 5.915 57.443 -33.018 704 HB3 GLU 100 HB3 GLU 100 4.352 57.441 -33.827 705 HG2 GLU 100 HG2 GLU 100 5.343 54.790 -33.860 706 HG3 GLU 100 HG3 GLU 100 5.530 55.420 -32.225 707 H ASP 101 H ASP 101 7.630 58.808 -34.930 708 HA ASP 101 HA ASP 101 5.899 60.777 -36.171 709 HB2 ASP 101 HB2 ASP 101 7.063 61.658 -34.332 710 HB3 ASP 101 HB3 ASP 101 8.577 60.892 -34.806 711 H SER 102 H SER 102 8.327 58.605 -37.127 712 HA SER 102 HA SER 102 9.093 60.181 -39.465 713 HB2 SER 102 HB2 SER 102 10.676 58.711 -37.957 714 HB3 SER 102 HB3 SER 102 10.081 57.396 -38.974 715 HG SER 102 HG SER 102 11.333 58.085 -40.503 716 H VAL 103 H VAL 103 7.349 57.255 -38.591 717 HA VAL 103 HA VAL 103 6.929 56.389 -41.286 718 HB VAL 103 HB VAL 103 5.524 55.601 -38.729 719 HG11 VAL 103 HG11 VAL 103 5.316 54.530 -41.531 720 HG12 VAL 103 HG12 VAL 103 4.871 53.574 -40.114 721 HG13 VAL 103 HG13 VAL 103 4.021 55.079 -40.466 722 HG21 VAL 103 HG21 VAL 103 7.463 53.912 -40.260 723 HG22 VAL 103 HG22 VAL 103 8.044 55.125 -39.119 724 HG23 VAL 103 HG23 VAL 103 6.997 53.818 -38.562 725 H ILE 104 H ILE 104 5.375 58.612 -39.157 726 HA ILE 104 HA ILE 104 2.939 58.674 -40.769 727 HB ILE 104 HB ILE 104 3.649 60.202 -38.263 728 HG12 ILE 104 HG12 ILE 104 1.740 57.889 -38.650 729 HG13 ILE 104 HG13 ILE 104 3.361 57.740 -37.981 730 HG21 ILE 104 HG21 ILE 104 1.065 60.040 -39.808 731 HG22 ILE 104 HG22 ILE 104 1.243 60.768 -38.213 732 HG23 ILE 104 HG23 ILE 104 2.086 61.463 -39.597 733 HD11 ILE 104 HD11 ILE 104 2.347 59.647 -36.374 734 HD12 ILE 104 HD12 ILE 104 0.888 58.730 -36.751 735 HD13 ILE 104 HD13 ILE 104 2.277 57.918 -36.029 736 H SER 105 H SER 105 5.857 60.465 -40.209 737 HA SER 105 HA SER 105 4.883 62.834 -41.579 738 HB2 SER 105 HB2 SER 105 6.381 63.211 -39.727 739 HB3 SER 105 HB3 SER 105 7.586 62.125 -40.419 740 HG SER 105 HG SER 105 7.778 64.542 -40.730 741 H LEU 106 H LEU 106 6.527 59.915 -42.325 742 HA LEU 106 HA LEU 106 7.697 60.923 -44.780 743 HB2 LEU 106 HB2 LEU 106 8.845 59.218 -43.426 744 HB3 LEU 106 HB3 LEU 106 7.510 58.105 -43.722 745 HG LEU 106 HG LEU 106 8.504 59.004 -46.236 746 HD11 LEU 106 HD11 LEU 106 10.609 58.052 -44.305 747 HD12 LEU 106 HD12 LEU 106 10.590 59.557 -45.222 748 HD13 LEU 106 HD13 LEU 106 10.793 58.019 -46.058 749 HD21 LEU 106 HD21 LEU 106 7.421 56.943 -46.133 750 HD22 LEU 106 HD22 LEU 106 8.366 56.408 -44.744 751 HD23 LEU 106 HD23 LEU 106 9.118 56.511 -46.335 752 H SER 107 H SER 107 4.997 58.888 -43.778 753 HA SER 107 HA SER 107 4.156 58.595 -46.569 754 HB2 SER 107 HB2 SER 107 3.133 56.666 -45.960 755 HB3 SER 107 HB3 SER 107 4.173 56.773 -44.540 756 HG SER 107 HG SER 107 2.456 57.042 -43.376 757 H GLY 108 H GLY 108 3.182 60.028 -43.516 758 HA2 GLY 108 HA2 GLY 108 0.597 60.856 -44.503 759 HA3 GLY 108 HA3 GLY 108 1.311 61.283 -42.956 760 H ASP 109 H ASP 109 3.571 61.900 -45.286 761 HA ASP 109 HA ASP 109 2.597 64.626 -45.781 762 HB2 ASP 109 HB2 ASP 109 4.530 64.090 -43.910 763 HB3 ASP 109 HB3 ASP 109 5.494 64.434 -45.343 764 H HIS 110 H HIS 110 3.384 61.861 -47.168 765 HA HIS 110 HA HIS 110 4.622 63.166 -49.500 766 HB2 HIS 110 HB2 HIS 110 6.099 61.523 -48.197 767 HB3 HIS 110 HB3 HIS 110 5.036 60.261 -48.814 768 HD1 HIS 110 HD1 HIS 110 7.020 63.150 -50.318 769 HD2 HIS 110 HD2 HIS 110 5.997 59.199 -51.096 770 HE1 HIS 110 HE1 HIS 110 8.189 62.563 -52.467 771 H CYS 111 H CYS 111 2.082 61.265 -48.247 772 HA CYS 111 HA CYS 111 1.144 60.659 -50.974 773 HB2 CYS 111 HB2 CYS 111 1.637 58.760 -49.228 774 HB3 CYS 111 HB3 CYS 111 0.080 59.236 -48.562 775 HG CYS 111 HG CYS 111 0.777 57.511 -51.343 776 H ILE 112 H ILE 112 0.381 62.067 -47.884 777 HA ILE 112 HA ILE 112 -2.335 62.710 -48.782 778 HB ILE 112 HB ILE 112 -1.098 63.107 -46.056 779 HG12 ILE 112 HG12 ILE 112 -3.119 61.029 -46.909 780 HG13 ILE 112 HG13 ILE 112 -1.391 60.713 -46.806 781 HG21 ILE 112 HG21 ILE 112 -3.678 63.854 -47.255 782 HG22 ILE 112 HG22 ILE 112 -3.769 63.100 -45.665 783 HG23 ILE 112 HG23 ILE 112 -2.809 64.561 -45.894 784 HD11 ILE 112 HD11 ILE 112 -1.650 60.202 -44.676 785 HD12 ILE 112 HD12 ILE 112 -2.150 61.862 -44.356 786 HD13 ILE 112 HD13 ILE 112 -3.358 60.639 -44.751 787 H ILE 113 H ILE 113 0.613 64.243 -47.556 788 HA ILE 113 HA ILE 113 -0.464 66.875 -48.250 789 HB ILE 113 HB ILE 113 2.141 66.243 -46.861 790 HG12 ILE 113 HG12 ILE 113 -0.501 67.066 -45.635 791 HG13 ILE 113 HG13 ILE 113 0.158 65.434 -45.593 792 HG21 ILE 113 HG21 ILE 113 2.557 68.422 -46.951 793 HG22 ILE 113 HG22 ILE 113 1.145 68.611 -47.990 794 HG23 ILE 113 HG23 ILE 113 0.985 68.793 -46.244 795 HD11 ILE 113 HD11 ILE 113 1.881 66.046 -44.149 796 HD12 ILE 113 HD12 ILE 113 1.676 67.765 -44.487 797 HD13 ILE 113 HD13 ILE 113 0.467 66.903 -43.537 798 H GLY 114 H GLY 114 2.609 65.098 -48.671 799 HA2 GLY 114 HA2 GLY 114 3.695 66.785 -50.617 800 HA3 GLY 114 HA3 GLY 114 4.127 65.097 -50.392 801 H ARG 115 H ARG 115 1.280 64.304 -50.900 802 HA ARG 115 HA ARG 115 1.517 63.706 -53.623 803 HB2 ARG 115 HB2 ARG 115 0.135 62.337 -52.216 804 HB3 ARG 115 HB3 ARG 115 -0.888 63.707 -51.799 805 HG2 ARG 115 HG2 ARG 115 -0.709 63.099 -54.669 806 HG3 ARG 115 HG3 ARG 115 -1.495 61.871 -53.675 807 HD2 ARG 115 HD2 ARG 115 -2.474 64.372 -52.820 808 HD3 ARG 115 HD3 ARG 115 -2.511 64.387 -54.581 809 HE ARG 115 HE ARG 115 -3.590 61.968 -53.833 810 HH11 ARG 115 HH11 ARG 115 -4.302 65.332 -53.285 811 HH12 ARG 115 HH12 ARG 115 -6.011 65.079 -53.129 812 HH21 ARG 115 HH21 ARG 115 -5.836 61.624 -53.632 813 HH22 ARG 115 HH22 ARG 115 -6.882 62.969 -53.327 814 H THR 116 H THR 116 -0.780 65.953 -52.071 815 HA THR 116 HA THR 116 -1.599 67.103 -54.545 816 HB THR 116 HB THR 116 -2.043 68.837 -52.257 817 HG1 THR 116 HG1 THR 116 -2.693 67.420 -50.821 818 HG21 THR 116 HG21 THR 116 -3.338 68.707 -54.417 819 HG22 THR 116 HG22 THR 116 -4.319 68.689 -52.951 820 HG23 THR 116 HG23 THR 116 -4.020 67.191 -53.829 821 H LEU 117 H LEU 117 1.106 67.576 -52.539 822 HA LEU 117 HA LEU 117 1.567 70.327 -53.314 823 HB2 LEU 117 HB2 LEU 117 2.221 69.439 -51.093 824 HB3 LEU 117 HB3 LEU 117 3.400 68.401 -51.893 825 HG LEU 117 HG LEU 117 3.701 71.237 -52.541 826 HD11 LEU 117 HD11 LEU 117 4.540 70.487 -49.779 827 HD12 LEU 117 HD12 LEU 117 2.904 71.084 -50.061 828 HD13 LEU 117 HD13 LEU 117 4.293 72.084 -50.486 829 HD21 LEU 117 HD21 LEU 117 5.820 70.598 -52.828 830 HD22 LEU 117 HD22 LEU 117 5.224 68.950 -52.630 831 HD23 LEU 117 HD23 LEU 117 5.891 69.820 -51.248 832 H VAL 118 H VAL 118 2.540 67.138 -54.315 833 HA VAL 118 HA VAL 118 4.523 68.250 -56.166 834 HB VAL 118 HB VAL 118 5.296 65.999 -56.522 835 HG11 VAL 118 HG11 VAL 118 5.267 67.279 -53.987 836 HG12 VAL 118 HG12 VAL 118 5.182 65.537 -53.727 837 HG13 VAL 118 HG13 VAL 118 6.502 66.223 -54.673 838 HG21 VAL 118 HG21 VAL 118 3.469 64.596 -56.581 839 HG22 VAL 118 HG22 VAL 118 4.162 64.189 -55.011 840 HG23 VAL 118 HG23 VAL 118 2.770 65.268 -55.108 841 H VAL 119 H VAL 119 1.413 66.682 -56.058 842 HA VAL 119 HA VAL 119 1.206 65.849 -58.727 843 HB VAL 119 HB VAL 119 -0.832 66.603 -56.659 844 HG11 VAL 119 HG11 VAL 119 -2.442 65.543 -58.458 845 HG12 VAL 119 HG12 VAL 119 -2.092 67.272 -58.448 846 HG13 VAL 119 HG13 VAL 119 -1.254 66.208 -59.579 847 HG21 VAL 119 HG21 VAL 119 0.577 64.330 -57.044 848 HG22 VAL 119 HG22 VAL 119 -1.022 64.383 -56.302 849 HG23 VAL 119 HG23 VAL 119 -0.857 63.988 -58.012 850 H HIS 120 H HIS 120 -0.515 68.652 -57.360 851 HA HIS 120 HA HIS 120 0.156 70.172 -59.781 852 HB2 HIS 120 HB2 HIS 120 -2.590 69.869 -58.554 853 HB3 HIS 120 HB3 HIS 120 -2.185 71.084 -59.762 854 HD1 HIS 120 HD1 HIS 120 -4.006 68.228 -59.749 855 HD2 HIS 120 HD2 HIS 120 -0.667 69.311 -61.973 856 HE1 HIS 120 HE1 HIS 120 -4.057 66.767 -61.797 857 H GLU 121 H GLU 121 -0.839 70.171 -56.414 858 HA GLU 121 HA GLU 121 -0.781 71.774 -54.787 859 HB2 GLU 121 HB2 GLU 121 1.653 71.300 -55.282 860 HB3 GLU 121 HB3 GLU 121 1.656 72.753 -56.272 861 HG2 GLU 121 HG2 GLU 121 0.630 73.726 -53.974 862 HG3 GLU 121 HG3 GLU 121 1.676 72.450 -53.353 863 H LYS 122 H LYS 122 -2.435 72.439 -56.996 864 HA LYS 122 HA LYS 122 -1.985 75.208 -57.666 865 HB2 LYS 122 HB2 LYS 122 -3.757 75.005 -59.133 866 HB3 LYS 122 HB3 LYS 122 -3.192 73.341 -59.055 867 HG2 LYS 122 HG2 LYS 122 -5.516 74.498 -57.526 868 HG3 LYS 122 HG3 LYS 122 -5.612 73.443 -58.939 869 HD2 LYS 122 HD2 LYS 122 -4.200 71.806 -57.520 870 HD3 LYS 122 HD3 LYS 122 -4.721 72.795 -56.152 871 HE2 LYS 122 HE2 LYS 122 -6.328 71.121 -56.232 872 HE3 LYS 122 HE3 LYS 122 -7.095 72.451 -57.100 873 HZ1 LYS 122 HZ1 LYS 122 -6.950 69.972 -58.043 874 HZ2 LYS 122 HZ2 LYS 122 -5.536 70.610 -58.717 875 HZ3 LYS 122 HZ3 LYS 122 -7.030 71.338 -59.039 876 H ALA 123 H ALA 123 -2.962 73.767 -54.910 877 HA ALA 123 HA ALA 123 -5.216 75.400 -54.215 878 HB1 ALA 123 HB1 ALA 123 -3.423 73.775 -52.414 879 HB2 ALA 123 HB2 ALA 123 -5.017 74.414 -52.016 880 HB3 ALA 123 HB3 ALA 123 -4.852 73.163 -53.246 881 H ASP 124 H ASP 124 -1.992 76.082 -54.555 882 HA ASP 124 HA ASP 124 -2.263 78.595 -53.174 883 HB2 ASP 124 HB2 ASP 124 -0.359 78.329 -51.689 884 HB3 ASP 124 HB3 ASP 124 -1.551 77.079 -51.346 885 H ASP 125 H ASP 125 -0.133 76.332 -54.858 886 HA ASP 125 HA ASP 125 1.489 78.514 -55.894 887 HB2 ASP 125 HB2 ASP 125 2.688 76.534 -55.216 888 HB3 ASP 125 HB3 ASP 125 1.671 75.517 -56.233
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