NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
626698 | 6bhn | 26582 | cing | 1-original | 5 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H SER 599 HT1 SER 599 49.423 19.625 -1.025 2 HA SER 599 HA SER 599 47.340 20.042 -2.030 3 HB2 SER 599 HB2 SER 599 46.454 17.427 -0.794 4 HB3 SER 599 HB1 SER 599 45.467 18.512 -1.773 5 HG SER 599 HG SER 599 46.482 17.883 -3.548 6 H ASP 600 HN ASP 600 47.629 21.730 -0.533 7 HA ASP 600 HA ASP 600 47.044 21.325 2.263 8 HB2 ASP 600 HB2 ASP 600 47.756 23.491 2.608 9 HB3 ASP 600 HB1 ASP 600 48.574 23.149 1.090 10 H VAL 601 HN VAL 601 45.243 21.994 -0.546 11 HA VAL 601 HA VAL 601 43.096 23.470 0.416 12 HB VAL 601 HB VAL 601 43.458 23.008 -1.970 13 HG11 VAL 601 HG11 VAL 601 42.495 20.221 -1.350 14 HG12 VAL 601 HG12 VAL 601 44.123 20.680 -1.847 15 HG13 VAL 601 HG13 VAL 601 42.771 20.876 -2.964 16 HG21 VAL 601 HG21 VAL 601 40.751 22.115 -0.981 17 HG22 VAL 601 HG22 VAL 601 41.112 22.656 -2.620 18 HG23 VAL 601 HG23 VAL 601 41.263 23.778 -1.267 19 H GLU 602 HN GLU 602 43.883 20.128 0.972 20 HA GLU 602 HA GLU 602 41.321 19.210 1.721 21 HB2 GLU 602 HB2 GLU 602 43.225 17.704 1.231 22 HB3 GLU 602 HB1 GLU 602 44.013 18.248 2.705 23 HG2 GLU 602 HG2 GLU 602 42.117 17.369 4.010 24 HG3 GLU 602 HG1 GLU 602 41.404 16.759 2.518 25 H GLU 603 HN GLU 603 43.827 20.978 3.398 26 HA GLU 603 HA GLU 603 42.871 20.716 6.034 27 HB2 GLU 603 HB2 GLU 603 45.093 21.596 5.558 28 HB3 GLU 603 HB1 GLU 603 44.398 22.960 4.697 29 HG2 GLU 603 HG2 GLU 603 43.352 23.693 6.819 30 HG3 GLU 603 HG1 GLU 603 44.217 22.394 7.643 31 H ILE 604 HN ILE 604 42.203 23.015 3.445 32 HA ILE 604 HA ILE 604 40.445 24.714 4.800 33 HB ILE 604 HB ILE 604 40.339 23.945 1.869 34 HG12 ILE 604 HG12 ILE 604 42.583 24.704 2.456 35 HG13 ILE 604 HG11 ILE 604 41.768 25.926 1.488 36 HG21 ILE 604 HG21 ILE 604 39.336 26.410 3.292 37 HG22 ILE 604 HG22 ILE 604 38.344 25.125 2.602 38 HG23 ILE 604 HG23 ILE 604 39.316 26.152 1.547 39 HD11 ILE 604 HD11 ILE 604 41.295 27.201 3.530 40 HD12 ILE 604 HD12 ILE 604 43.022 26.946 3.287 41 HD13 ILE 604 HD13 ILE 604 42.149 25.981 4.476 42 H PHE 605 HN PHE 605 39.914 21.645 3.108 43 HA PHE 605 HA PHE 605 37.105 21.614 3.362 44 HB2 PHE 605 HB2 PHE 605 39.207 19.552 2.818 45 HB3 PHE 605 HB1 PHE 605 37.574 19.026 3.199 46 HD1 PHE 605 HD1 PHE 605 39.154 21.629 1.018 47 HD2 PHE 605 HD2 PHE 605 36.305 18.491 1.392 48 HE1 PHE 605 HE1 PHE 605 38.507 21.941 -1.337 49 HE2 PHE 605 HE2 PHE 605 35.652 18.797 -0.960 50 HZ PHE 605 HZ PHE 605 36.755 20.523 -2.328 51 H LYS 606 HN LYS 606 39.716 20.261 5.335 52 HA LYS 606 HA LYS 606 38.200 18.852 7.182 53 HB2 LYS 606 HB2 LYS 606 40.820 20.301 7.551 54 HB3 LYS 606 HB1 LYS 606 40.116 19.253 8.770 55 HG2 LYS 606 HG2 LYS 606 40.892 18.395 5.989 56 HG3 LYS 606 HG1 LYS 606 41.860 18.144 7.443 57 HD2 LYS 606 HD2 LYS 606 39.939 16.856 8.402 58 HD3 LYS 606 HD1 LYS 606 39.136 16.994 6.838 59 HE2 LYS 606 HE2 LYS 606 40.224 14.852 6.964 60 HE3 LYS 606 HE1 LYS 606 41.075 15.856 5.793 61 HZ1 LYS 606 HZ1 LYS 606 42.579 14.624 7.274 62 HZ2 LYS 606 HZ2 LYS 606 41.939 15.444 8.607 63 HZ3 LYS 606 HZ3 LYS 606 42.779 16.296 7.420 64 H THR 607 HN THR 607 39.211 22.258 7.350 65 HA THR 607 HA THR 607 38.006 22.653 9.890 66 HB THR 607 HB THR 607 39.904 24.009 9.098 67 HG1 THR 607 HG1 THR 607 38.551 24.808 10.761 68 HG21 THR 607 HG21 THR 607 39.269 24.354 6.775 69 HG22 THR 607 HG22 THR 607 39.486 25.911 7.575 70 HG23 THR 607 HG23 THR 607 37.863 25.290 7.279 71 H THR 608 HN THR 608 36.826 23.030 6.609 72 HA THR 608 HA THR 608 34.527 24.556 7.453 73 HB THR 608 HB THR 608 33.759 24.139 5.051 74 HG1 THR 608 HG1 THR 608 36.400 23.512 4.417 75 HG21 THR 608 HG21 THR 608 36.423 25.499 5.501 76 HG22 THR 608 HG22 THR 608 34.840 26.224 5.776 77 HG23 THR 608 HG23 THR 608 35.336 25.782 4.142 78 H THR 609 HN THR 609 35.186 21.234 6.505 79 HA THR 609 HA THR 609 32.565 20.281 6.437 80 HB THR 609 HB THR 609 34.978 18.690 7.362 81 HG1 THR 609 HG1 THR 609 35.323 19.690 5.311 82 HG21 THR 609 HG21 THR 609 32.407 17.820 6.026 83 HG22 THR 609 HG22 THR 609 32.802 17.583 7.727 84 HG23 THR 609 HG23 THR 609 33.747 16.767 6.480 85 H GLN 610 HN GLN 610 34.675 20.875 9.199 86 HA GLN 610 HA GLN 610 33.040 19.542 11.112 87 HB2 GLN 610 HB2 GLN 610 35.064 21.748 11.532 88 HB3 GLN 610 HB1 GLN 610 34.400 20.710 12.783 89 HG2 GLN 610 HG2 GLN 610 35.452 18.775 11.757 90 HG3 GLN 610 HG1 GLN 610 36.088 19.795 10.468 91 HE21 GLN 610 HE21 GLN 610 38.203 19.357 10.919 92 HE22 GLN 610 HE22 GLN 610 39.013 19.947 12.326 93 H GLU 611 HN GLU 611 33.021 22.670 9.650 94 HA GLU 611 HA GLU 611 31.376 23.906 11.674 95 HB2 GLU 611 HB2 GLU 611 32.174 24.871 8.928 96 HB3 GLU 611 HB1 GLU 611 31.254 25.817 10.089 97 HG2 GLU 611 HG2 GLU 611 34.076 24.828 10.384 98 HG3 GLU 611 HG1 GLU 611 33.541 26.493 10.166 99 H VAL 612 HN VAL 612 30.905 22.724 8.358 100 HA VAL 612 HA VAL 612 28.143 23.334 8.278 101 HB VAL 612 HB VAL 612 29.499 22.867 6.235 102 HG11 VAL 612 HG11 VAL 612 29.326 19.985 7.087 103 HG12 VAL 612 HG12 VAL 612 30.784 20.975 7.073 104 HG13 VAL 612 HG13 VAL 612 29.970 20.584 5.557 105 HG21 VAL 612 HG21 VAL 612 27.779 21.642 5.021 106 HG22 VAL 612 HG22 VAL 612 27.059 22.794 6.147 107 HG23 VAL 612 HG23 VAL 612 27.094 21.077 6.544 108 H ARG 613 HN ARG 613 29.986 20.720 9.582 109 HA ARG 613 HA ARG 613 28.020 18.793 10.023 110 HB2 ARG 613 HB2 ARG 613 30.377 18.335 10.397 111 HB3 ARG 613 HB1 ARG 613 30.465 19.563 11.642 112 HG2 ARG 613 HG2 ARG 613 28.654 17.206 12.001 113 HG3 ARG 613 HG1 ARG 613 30.387 17.040 12.280 114 HD2 ARG 613 HD2 ARG 613 28.475 18.912 13.678 115 HD3 ARG 613 HD1 ARG 613 29.321 17.534 14.378 116 HE ARG 613 HE ARG 613 31.119 19.487 13.304 117 HH11 ARG 613 HH11 ARG 613 29.160 18.717 16.113 118 HH12 ARG 613 HH12 ARG 613 30.110 19.679 17.196 119 HH21 ARG 613 HH21 ARG 613 32.376 20.771 14.752 120 HH22 ARG 613 HH22 ARG 613 31.944 20.827 16.425 121 H GLN 614 HN GLN 614 28.942 21.622 11.920 122 HA GLN 614 HA GLN 614 26.990 21.111 13.969 123 HB2 GLN 614 HB2 GLN 614 29.148 22.249 14.422 124 HB3 GLN 614 HB1 GLN 614 28.618 23.603 13.436 125 HG2 GLN 614 HG2 GLN 614 28.372 24.060 15.814 126 HG3 GLN 614 HG1 GLN 614 26.816 24.060 14.989 127 HE21 GLN 614 HE21 GLN 614 28.872 22.374 17.233 128 HE22 GLN 614 HE22 GLN 614 27.642 21.348 17.882 129 H LEU 615 HN LEU 615 27.175 22.969 11.030 130 HA LEU 615 HA LEU 615 25.092 24.779 11.384 131 HB2 LEU 615 HB2 LEU 615 26.601 24.897 9.495 132 HB3 LEU 615 HB1 LEU 615 26.011 23.366 8.884 133 HG LEU 615 HG LEU 615 23.787 24.426 8.512 134 HD11 LEU 615 HD11 LEU 615 25.255 26.953 9.233 135 HD12 LEU 615 HD12 LEU 615 23.918 26.223 10.121 136 HD13 LEU 615 HD13 LEU 615 23.652 26.873 8.504 137 HD21 LEU 615 HD21 LEU 615 26.135 25.717 7.131 138 HD22 LEU 615 HD22 LEU 615 24.474 25.704 6.539 139 HD23 LEU 615 HD23 LEU 615 25.367 24.192 6.688 140 H LEU 616 HN LEU 616 24.950 21.470 10.035 141 HA LEU 616 HA LEU 616 22.045 21.590 10.059 142 HB2 LEU 616 HB2 LEU 616 24.012 19.548 9.046 143 HB3 LEU 616 HB1 LEU 616 22.298 19.218 9.133 144 HG LEU 616 HG LEU 616 21.971 21.243 7.619 145 HD11 LEU 616 HD11 LEU 616 23.865 21.890 6.234 146 HD12 LEU 616 HD12 LEU 616 24.928 20.867 7.202 147 HD13 LEU 616 HD13 LEU 616 24.150 22.271 7.932 148 HD21 LEU 616 HD21 LEU 616 22.438 19.952 5.616 149 HD22 LEU 616 HD22 LEU 616 21.760 18.919 6.873 150 HD23 LEU 616 HD23 LEU 616 23.490 18.876 6.534 151 H ARG 617 HN ARG 617 24.053 21.290 12.453 152 HA ARG 617 HA ARG 617 24.143 20.267 14.487 153 HB2 ARG 617 HB2 ARG 617 21.221 19.789 13.846 154 HB3 ARG 617 HB1 ARG 617 21.938 19.439 15.408 155 HG2 ARG 617 HG2 ARG 617 20.878 21.518 15.649 156 HG3 ARG 617 HG1 ARG 617 22.595 21.889 15.499 157 HD2 ARG 617 HD2 ARG 617 22.293 22.477 13.169 158 HD3 ARG 617 HD1 ARG 617 20.598 22.002 13.244 159 HE ARG 617 HE ARG 617 21.307 24.032 15.146 160 HH11 ARG 617 HH11 ARG 617 20.320 23.438 11.830 161 HH12 ARG 617 HH12 ARG 617 19.644 25.015 11.605 162 HH21 ARG 617 HH21 ARG 617 20.392 26.131 14.852 163 HH22 ARG 617 HH22 ARG 617 19.676 26.537 13.327 164 H CYS 618 HN CYS 618 25.018 18.707 12.328 165 HA CYS 618 HA CYS 618 23.902 16.073 12.743 166 HB2 CYS 618 HB2 CYS 618 25.987 17.041 10.792 167 HB3 CYS 618 HB1 CYS 618 25.368 15.395 10.869 168 HG CYS 618 HG CYS 618 23.014 17.763 10.553 169 H ASP 619 HN ASP 619 25.420 14.243 12.850 170 HA ASP 619 HA ASP 619 27.286 14.669 15.038 171 HB2 ASP 619 HB2 ASP 619 25.686 12.810 15.162 172 HB3 ASP 619 HB1 ASP 619 26.331 12.149 13.664 173 H ARG 620 HN ARG 620 27.197 13.243 11.815 174 HA ARG 620 HA ARG 620 29.994 13.954 11.485 175 HB2 ARG 620 HB2 ARG 620 30.527 11.755 10.503 176 HB3 ARG 620 HB1 ARG 620 30.085 11.649 12.196 177 HG2 ARG 620 HG2 ARG 620 27.745 11.036 11.347 178 HG3 ARG 620 HG1 ARG 620 28.539 10.775 9.794 179 HD2 ARG 620 HD2 ARG 620 29.201 9.405 12.397 180 HD3 ARG 620 HD1 ARG 620 28.383 8.682 11.016 181 HE ARG 620 HE ARG 620 30.656 9.374 9.856 182 HH11 ARG 620 HH11 ARG 620 30.161 7.933 13.027 183 HH12 ARG 620 HH12 ARG 620 31.702 7.146 13.058 184 HH21 ARG 620 HH21 ARG 620 32.699 8.330 9.888 185 HH22 ARG 620 HH22 ARG 620 33.156 7.374 11.263 186 H VAL 621 HN VAL 621 30.687 14.067 9.331 187 HA VAL 621 HA VAL 621 28.644 14.204 7.255 188 HB VAL 621 HB VAL 621 30.555 16.492 7.866 189 HG11 VAL 621 HG11 VAL 621 28.520 16.200 5.657 190 HG12 VAL 621 HG12 VAL 621 30.273 16.170 5.469 191 HG13 VAL 621 HG13 VAL 621 29.468 17.649 5.994 192 HG21 VAL 621 HG21 VAL 621 27.543 16.384 8.017 193 HG22 VAL 621 HG22 VAL 621 28.531 17.826 8.249 194 HG23 VAL 621 HG23 VAL 621 28.650 16.482 9.387 195 H ALA 622 HN ALA 622 29.411 13.098 5.593 196 HA ALA 622 HA ALA 622 32.314 12.656 5.483 197 HB1 ALA 622 HB1 ALA 622 31.845 10.522 4.431 198 HB2 ALA 622 HB2 ALA 622 30.116 10.866 4.471 199 HB3 ALA 622 HB3 ALA 622 31.007 10.653 5.978 200 H VAL 623 HN VAL 623 33.364 12.595 3.543 201 HA VAL 623 HA VAL 623 31.979 13.910 1.307 202 HB VAL 623 HB VAL 623 34.967 13.834 1.841 203 HG11 VAL 623 HG11 VAL 623 34.400 13.999 -0.518 204 HG12 VAL 623 HG12 VAL 623 35.087 15.515 0.066 205 HG13 VAL 623 HG13 VAL 623 33.347 15.372 -0.181 206 HG21 VAL 623 HG21 VAL 623 34.757 16.224 2.377 207 HG22 VAL 623 HG22 VAL 623 33.863 15.212 3.516 208 HG23 VAL 623 HG23 VAL 623 33.004 16.090 2.248 209 H TYR 624 HN TYR 624 31.679 12.669 -0.458 210 HA TYR 624 HA TYR 624 33.090 10.096 -0.549 211 HB2 TYR 624 HB2 TYR 624 30.767 9.820 0.099 212 HB3 TYR 624 HB1 TYR 624 30.236 10.835 -1.230 213 HD1 TYR 624 HD1 TYR 624 29.876 9.927 -3.383 214 HD2 TYR 624 HD2 TYR 624 31.687 7.557 -0.357 215 HE1 TYR 624 HE1 TYR 624 29.558 7.933 -4.768 216 HE2 TYR 624 HE2 TYR 624 31.378 5.552 -1.740 217 HH TYR 624 HH TYR 624 30.003 4.760 -3.573 218 H ARG 625 HN ARG 625 34.500 10.180 -2.223 219 HA ARG 625 HA ARG 625 33.832 11.904 -4.502 220 HB2 ARG 625 HB2 ARG 625 35.988 12.327 -3.386 221 HB3 ARG 625 HB1 ARG 625 36.486 10.678 -3.738 222 HG2 ARG 625 HG2 ARG 625 36.364 11.150 -6.135 223 HG3 ARG 625 HG1 ARG 625 35.864 12.803 -5.782 224 HD2 ARG 625 HD2 ARG 625 38.201 12.821 -6.275 225 HD3 ARG 625 HD1 ARG 625 38.004 13.115 -4.551 226 HE ARG 625 HE ARG 625 38.670 10.796 -4.180 227 HH11 ARG 625 HH11 ARG 625 39.381 12.177 -7.344 228 HH12 ARG 625 HH12 ARG 625 40.689 11.095 -7.655 229 HH21 ARG 625 HH21 ARG 625 40.409 9.387 -4.581 230 HH22 ARG 625 HH22 ARG 625 41.267 9.482 -6.090 231 H PHE 626 HN PHE 626 33.739 11.176 -6.575 232 HA PHE 626 HA PHE 626 33.555 8.294 -6.909 233 HB2 PHE 626 HB2 PHE 626 32.853 10.607 -8.719 234 HB3 PHE 626 HB1 PHE 626 32.777 8.928 -9.236 235 HD1 PHE 626 HD1 PHE 626 31.001 11.594 -7.781 236 HD2 PHE 626 HD2 PHE 626 31.322 7.356 -7.770 237 HE1 PHE 626 HE1 PHE 626 28.717 11.428 -6.886 238 HE2 PHE 626 HE2 PHE 626 29.037 7.179 -6.879 239 HZ PHE 626 HZ PHE 626 27.731 9.217 -6.434 240 H ASN 627 HN ASN 627 35.220 7.189 -7.541 241 HA ASN 627 HA ASN 627 37.571 8.453 -8.658 242 HB2 ASN 627 HB2 ASN 627 37.022 5.512 -8.163 243 HB3 ASN 627 HB1 ASN 627 38.592 6.253 -8.437 244 HD21 ASN 627 HD21 ASN 627 39.556 7.438 -6.795 245 HD22 ASN 627 HD22 ASN 627 39.015 7.326 -5.156 246 HA PRO 628 HA PRO 628 37.072 7.527 -13.005 247 HB2 PRO 628 HB2 PRO 628 39.278 5.523 -12.724 248 HB3 PRO 628 HB1 PRO 628 39.064 6.792 -13.937 249 HG2 PRO 628 HG2 PRO 628 40.786 7.147 -11.962 250 HG3 PRO 628 HG1 PRO 628 39.739 8.481 -12.482 251 HD2 PRO 628 HD2 PRO 628 39.556 6.757 -10.059 252 HD3 PRO 628 HD1 PRO 628 39.167 8.477 -10.252 253 H ASN 629 HN ASN 629 37.347 4.784 -10.793 254 HA ASN 629 HA ASN 629 35.760 3.136 -12.633 255 HB2 ASN 629 HB2 ASN 629 37.374 2.408 -10.194 256 HB3 ASN 629 HB1 ASN 629 36.257 1.283 -10.956 257 HD21 ASN 629 HD21 ASN 629 39.291 2.901 -11.188 258 HD22 ASN 629 HD22 ASN 629 39.882 2.052 -12.571 259 H TRP 630 HN TRP 630 35.058 5.344 -10.414 260 HA TRP 630 HA TRP 630 33.316 5.802 -9.006 261 HB2 TRP 630 HB2 TRP 630 31.995 3.704 -10.756 262 HB3 TRP 630 HB1 TRP 630 31.122 4.732 -9.627 263 HD1 TRP 630 HD1 TRP 630 33.478 5.231 -12.694 264 HE1 TRP 630 HE1 TRP 630 32.622 7.270 -14.024 265 HE3 TRP 630 HE3 TRP 630 29.586 6.603 -9.678 266 HZ2 TRP 630 HZ2 TRP 630 30.575 9.189 -13.824 267 HZ3 TRP 630 HZ3 TRP 630 28.229 8.550 -10.323 268 HH2 TRP 630 HH2 TRP 630 28.714 9.815 -12.352 269 H THR 631 HN THR 631 35.154 4.110 -7.847 270 HA THR 631 HA THR 631 33.881 1.765 -6.801 271 HB THR 631 HB THR 631 36.063 1.640 -5.465 272 HG1 THR 631 HG1 THR 631 36.989 3.609 -5.595 273 HG21 THR 631 HG21 THR 631 37.262 0.868 -7.470 274 HG22 THR 631 HG22 THR 631 36.073 1.706 -8.476 275 HG23 THR 631 HG23 THR 631 35.573 0.345 -7.477 276 H GLY 632 HN GLY 632 33.994 4.983 -5.807 277 HA2 GLY 632 HA2 GLY 632 32.793 5.910 -4.042 278 HA3 GLY 632 HA1 GLY 632 32.566 4.293 -3.404 279 H GLU 633 HN GLU 633 35.139 6.739 -3.846 280 HA GLU 633 HA GLU 633 36.466 5.632 -1.481 281 HB2 GLU 633 HB2 GLU 633 37.889 5.976 -3.396 282 HB3 GLU 633 HB1 GLU 633 37.365 7.645 -3.539 283 HG2 GLU 633 HG2 GLU 633 38.378 8.046 -1.276 284 HG3 GLU 633 HG1 GLU 633 39.077 6.431 -1.390 285 H PHE 634 HN PHE 634 36.311 6.570 0.443 286 HA PHE 634 HA PHE 634 35.171 9.234 0.712 287 HB2 PHE 634 HB2 PHE 634 35.991 7.129 2.717 288 HB3 PHE 634 HB1 PHE 634 35.519 8.749 3.203 289 HD1 PHE 634 HD1 PHE 634 34.388 5.488 2.204 290 HD2 PHE 634 HD2 PHE 634 33.203 9.539 2.703 291 HE1 PHE 634 HE1 PHE 634 32.037 4.789 2.238 292 HE2 PHE 634 HE2 PHE 634 30.844 8.847 2.735 293 HZ PHE 634 HZ PHE 634 30.259 6.469 2.503 294 H VAL 635 HN VAL 635 36.428 10.972 0.709 295 HA VAL 635 HA VAL 635 39.296 10.599 1.041 296 HB VAL 635 HB VAL 635 39.550 12.893 0.194 297 HG11 VAL 635 HG11 VAL 635 37.738 11.178 -1.498 298 HG12 VAL 635 HG12 VAL 635 39.491 11.038 -1.383 299 HG13 VAL 635 HG13 VAL 635 38.766 12.483 -2.090 300 HG21 VAL 635 HG21 VAL 635 37.497 13.871 1.079 301 HG22 VAL 635 HG22 VAL 635 36.539 12.879 -0.020 302 HG23 VAL 635 HG23 VAL 635 37.610 14.123 -0.662 303 H ALA 636 HN ALA 636 36.601 11.982 2.735 304 HA ALA 636 HA ALA 636 38.142 12.362 5.092 305 HB1 ALA 636 HB1 ALA 636 38.852 14.380 3.880 306 HB2 ALA 636 HB2 ALA 636 37.908 14.781 5.314 307 HB3 ALA 636 HB3 ALA 636 37.166 14.871 3.717 308 H GLU 637 HN GLU 637 36.851 13.006 6.894 309 HA GLU 637 HA GLU 637 34.049 13.505 6.560 310 HB2 GLU 637 HB2 GLU 637 33.985 11.084 6.389 311 HB3 GLU 637 HB1 GLU 637 34.992 10.917 7.822 312 HG2 GLU 637 HG2 GLU 637 33.226 11.854 9.202 313 HG3 GLU 637 HG1 GLU 637 32.224 12.105 7.777 314 H SER 638 HN SER 638 33.217 14.543 8.294 315 HA SER 638 HA SER 638 35.033 14.944 10.569 316 HB2 SER 638 HB2 SER 638 34.436 17.004 9.326 317 HB3 SER 638 HB1 SER 638 32.731 16.683 9.639 318 HG SER 638 HG SER 638 34.523 16.818 11.797 319 H VAL 639 HN VAL 639 34.509 13.538 12.094 320 HA VAL 639 HA VAL 639 31.675 13.247 12.800 321 HB VAL 639 HB VAL 639 32.334 11.174 11.770 322 HG11 VAL 639 HG11 VAL 639 34.687 11.122 13.649 323 HG12 VAL 639 HG12 VAL 639 34.748 11.447 11.916 324 HG13 VAL 639 HG13 VAL 639 34.240 9.862 12.498 325 HG21 VAL 639 HG21 VAL 639 30.967 10.954 13.806 326 HG22 VAL 639 HG22 VAL 639 32.436 10.805 14.766 327 HG23 VAL 639 HG23 VAL 639 32.031 9.566 13.579 328 H ALA 640 HN ALA 640 31.195 13.057 14.984 329 HA ALA 640 HA ALA 640 32.813 14.469 16.780 330 HB1 ALA 640 HB1 ALA 640 30.567 12.544 17.387 331 HB2 ALA 640 HB2 ALA 640 30.381 14.260 17.025 332 HB3 ALA 640 HB3 ALA 640 31.225 13.755 18.488 333 H HIS 641 HN HIS 641 34.095 13.796 18.472 334 HA HIS 641 HA HIS 641 35.668 11.496 18.000 335 HB2 HIS 641 HB2 HIS 641 35.568 13.305 20.415 336 HB3 HIS 641 HB1 HIS 641 36.808 12.091 20.122 337 HD2 HIS 641 HD2 HIS 641 38.516 12.700 17.870 338 HE1 HIS 641 HE1 HIS 641 37.441 16.805 17.829 339 HE2 HIS 641 HE2 HIS 641 39.122 15.091 17.079 340 H THR 642 HN THR 642 32.692 11.786 19.496 341 HA THR 642 HA THR 642 32.926 9.856 21.551 342 HB THR 642 HB THR 642 30.378 9.777 21.294 343 HG1 THR 642 HG1 THR 642 29.994 10.515 19.258 344 HG21 THR 642 HG21 THR 642 31.741 12.437 21.761 345 HG22 THR 642 HG22 THR 642 31.489 11.173 22.966 346 HG23 THR 642 HG23 THR 642 30.107 12.023 22.276 347 H TRP 643 HN TRP 643 32.819 9.576 18.150 348 HA TRP 643 HA TRP 643 32.158 6.706 18.378 349 HB2 TRP 643 HB2 TRP 643 31.744 8.417 15.923 350 HB3 TRP 643 HB1 TRP 643 31.236 6.751 16.158 351 HD1 TRP 643 HD1 TRP 643 30.048 10.223 16.437 352 HE1 TRP 643 HE1 TRP 643 27.746 10.311 17.525 353 HE3 TRP 643 HE3 TRP 643 29.846 5.437 18.197 354 HZ2 TRP 643 HZ2 TRP 643 26.044 8.560 18.982 355 HZ3 TRP 643 HZ3 TRP 643 27.844 4.723 19.430 356 HH2 TRP 643 HH2 TRP 643 25.982 6.251 19.815 357 H VAL 644 HN VAL 644 32.963 5.707 16.112 358 HA VAL 644 HA VAL 644 35.816 6.017 16.144 359 HB VAL 644 HB VAL 644 34.864 3.772 15.921 360 HG11 VAL 644 HG11 VAL 644 33.708 3.061 13.878 361 HG12 VAL 644 HG12 VAL 644 33.714 4.729 13.304 362 HG13 VAL 644 HG13 VAL 644 32.806 4.299 14.752 363 HG21 VAL 644 HG21 VAL 644 37.054 4.188 14.933 364 HG22 VAL 644 HG22 VAL 644 36.287 4.624 13.406 365 HG23 VAL 644 HG23 VAL 644 36.164 2.975 14.014 366 H LYS 645 HN LYS 645 37.056 7.048 14.673 367 HA LYS 645 HA LYS 645 35.871 9.055 13.088 368 HB2 LYS 645 HB2 LYS 645 38.082 9.321 14.104 369 HB3 LYS 645 HB1 LYS 645 38.719 8.051 13.071 370 HG2 LYS 645 HG2 LYS 645 38.256 9.414 11.100 371 HG3 LYS 645 HG1 LYS 645 37.611 10.688 12.133 372 HD2 LYS 645 HD2 LYS 645 39.787 10.946 13.195 373 HD3 LYS 645 HD1 LYS 645 40.435 9.631 12.209 374 HE2 LYS 645 HE2 LYS 645 39.987 10.920 10.185 375 HE3 LYS 645 HE1 LYS 645 39.318 12.228 11.158 376 HZ1 LYS 645 HZ1 LYS 645 41.466 12.544 12.174 377 HZ2 LYS 645 HZ2 LYS 645 41.605 12.647 10.490 378 HZ3 LYS 645 HZ3 LYS 645 42.115 11.254 11.294 379 H LEU 646 HN LEU 646 36.964 5.829 12.381 380 HA LEU 646 HA LEU 646 36.600 4.459 10.599 381 HB2 LEU 646 HB2 LEU 646 34.424 5.579 10.279 382 HB3 LEU 646 HB1 LEU 646 35.206 6.828 9.333 383 HG LEU 646 HG LEU 646 35.890 4.970 7.727 384 HD11 LEU 646 HD11 LEU 646 35.488 3.081 9.190 385 HD12 LEU 646 HD12 LEU 646 34.480 2.973 7.747 386 HD13 LEU 646 HD13 LEU 646 33.774 3.492 9.280 387 HD21 LEU 646 HD21 LEU 646 34.172 6.599 7.205 388 HD22 LEU 646 HD22 LEU 646 32.973 5.644 8.079 389 HD23 LEU 646 HD23 LEU 646 33.707 5.005 6.608 390 H VAL 647 HN VAL 647 37.156 7.690 9.224 391 HA VAL 647 HA VAL 647 39.158 6.667 7.429 392 HB VAL 647 HB VAL 647 38.519 9.569 8.036 393 HG11 VAL 647 HG11 VAL 647 39.817 8.274 5.640 394 HG12 VAL 647 HG12 VAL 647 40.622 9.262 6.861 395 HG13 VAL 647 HG13 VAL 647 39.421 9.986 5.791 396 HG21 VAL 647 HG21 VAL 647 37.034 9.502 6.077 397 HG22 VAL 647 HG22 VAL 647 36.481 8.424 7.359 398 HG23 VAL 647 HG23 VAL 647 37.301 7.764 5.945 399 H GLY 648 HN GLY 648 40.405 5.734 9.221 400 HA2 GLY 648 HA2 GLY 648 42.419 7.657 10.131 401 HA3 GLY 648 HA1 GLY 648 41.627 6.652 11.332 402 HA PRO 649 HA PRO 649 44.496 3.373 10.762 403 HB2 PRO 649 HB2 PRO 649 42.377 1.427 10.062 404 HB3 PRO 649 HB1 PRO 649 43.499 1.419 11.425 405 HG2 PRO 649 HG2 PRO 649 40.912 1.974 11.777 406 HG3 PRO 649 HG1 PRO 649 42.171 2.813 12.703 407 HD2 PRO 649 HD2 PRO 649 40.613 3.765 10.328 408 HD3 PRO 649 HD1 PRO 649 41.075 4.647 11.799 409 H ASP 650 HN ASP 650 41.921 2.651 8.424 410 HA ASP 650 HA ASP 650 43.908 1.962 6.429 411 HB2 ASP 650 HB2 ASP 650 40.894 1.809 6.408 412 HB3 ASP 650 HB1 ASP 650 41.911 1.338 5.050 413 H ILE 651 HN ILE 651 41.598 4.447 7.142 414 HA ILE 651 HA ILE 651 41.233 6.528 6.329 415 HB ILE 651 HB ILE 651 43.675 6.056 4.600 416 HG12 ILE 651 HG12 ILE 651 43.351 7.626 7.171 417 HG13 ILE 651 HG11 ILE 651 44.123 6.050 7.036 418 HG21 ILE 651 HG21 ILE 651 42.205 7.736 3.630 419 HG22 ILE 651 HG22 ILE 651 43.666 8.494 4.273 420 HG23 ILE 651 HG23 ILE 651 42.146 8.595 5.169 421 HD11 ILE 651 HD11 ILE 651 45.068 8.592 5.731 422 HD12 ILE 651 HD12 ILE 651 45.845 7.015 5.608 423 HD13 ILE 651 HD13 ILE 651 45.764 7.837 7.165 424 H LYS 652 HN LYS 652 42.259 4.427 3.664 425 HA LYS 652 HA LYS 652 40.397 5.606 1.833 426 HB2 LYS 652 HB2 LYS 652 42.090 3.109 1.678 427 HB3 LYS 652 HB1 LYS 652 41.064 3.670 0.369 428 HG2 LYS 652 HG2 LYS 652 43.341 5.238 1.556 429 HG3 LYS 652 HG1 LYS 652 43.436 4.265 0.087 430 HD2 LYS 652 HD2 LYS 652 41.572 5.668 -0.846 431 HD3 LYS 652 HD1 LYS 652 41.746 6.717 0.563 432 HE2 LYS 652 HE2 LYS 652 44.063 7.155 -0.038 433 HE3 LYS 652 HE1 LYS 652 43.916 6.073 -1.420 434 HZ1 LYS 652 HZ1 LYS 652 42.453 8.618 -1.017 435 HZ2 LYS 652 HZ2 LYS 652 42.191 7.557 -2.310 436 HZ3 LYS 652 HZ3 LYS 652 43.688 8.330 -2.135 437 H THR 653 HN THR 653 38.351 5.371 2.559 438 HA THR 653 HA THR 653 37.444 2.653 3.131 439 HB THR 653 HB THR 653 35.922 5.244 3.541 440 HG1 THR 653 HG1 THR 653 37.898 5.074 4.805 441 HG21 THR 653 HG21 THR 653 34.557 3.874 5.080 442 HG22 THR 653 HG22 THR 653 35.532 2.461 4.682 443 HG23 THR 653 HG23 THR 653 34.525 3.213 3.446 444 H VAL 654 HN VAL 654 37.127 1.753 1.153 445 HA VAL 654 HA VAL 654 35.802 3.222 -0.927 446 HB VAL 654 HB VAL 654 37.714 1.749 -1.430 447 HG11 VAL 654 HG11 VAL 654 35.930 -0.507 -0.542 448 HG12 VAL 654 HG12 VAL 654 37.392 0.055 0.267 449 HG13 VAL 654 HG13 VAL 654 37.497 -0.686 -1.330 450 HG21 VAL 654 HG21 VAL 654 36.738 0.513 -3.313 451 HG22 VAL 654 HG22 VAL 654 36.106 2.155 -3.194 452 HG23 VAL 654 HG23 VAL 654 35.129 0.792 -2.649 453 H TRP 655 HN TRP 655 33.739 2.743 -1.792 454 HA TRP 655 HA TRP 655 32.163 0.763 -0.333 455 HB2 TRP 655 HB2 TRP 655 31.706 3.095 0.566 456 HB3 TRP 655 HB1 TRP 655 31.157 3.536 -1.044 457 HD1 TRP 655 HD1 TRP 655 29.343 0.984 -1.687 458 HE1 TRP 655 HE1 TRP 655 27.126 0.643 -0.431 459 HE3 TRP 655 HE3 TRP 655 30.285 3.890 2.419 460 HZ2 TRP 655 HZ2 TRP 655 25.935 1.497 1.978 461 HZ3 TRP 655 HZ3 TRP 655 28.546 4.076 4.147 462 HH2 TRP 655 HH2 TRP 655 26.417 2.905 3.930 463 H GLU 656 HN GLU 656 32.247 -0.602 -2.057 464 HA GLU 656 HA GLU 656 31.818 0.366 -4.724 465 HB2 GLU 656 HB2 GLU 656 31.980 -2.467 -3.707 466 HB3 GLU 656 HB1 GLU 656 32.052 -1.964 -5.389 467 HG2 GLU 656 HG2 GLU 656 34.132 -0.808 -4.992 468 HG3 GLU 656 HG1 GLU 656 34.047 -1.198 -3.274 469 H ASP 657 HN ASP 657 29.796 1.250 -4.685 470 HA ASP 657 HA ASP 657 27.584 -0.566 -4.082 471 HB2 ASP 657 HB2 ASP 657 27.485 1.718 -3.126 472 HB3 ASP 657 HB1 ASP 657 27.495 2.388 -4.754 473 H THR 658 HN THR 658 27.429 -1.922 -5.733 474 HA THR 658 HA THR 658 27.882 -1.414 -8.421 475 HB THR 658 HB THR 658 27.760 -3.687 -7.508 476 HG1 THR 658 HG1 THR 658 27.448 -3.776 -9.647 477 HG21 THR 658 HG21 THR 658 25.599 -4.732 -7.011 478 HG22 THR 658 HG22 THR 658 24.786 -3.195 -7.304 479 HG23 THR 658 HG23 THR 658 25.899 -3.359 -5.941 480 H HIS 659 HN HIS 659 25.160 -0.614 -6.467 481 HA HIS 659 HA HIS 659 23.177 -0.489 -8.478 482 HB2 HIS 659 HB2 HIS 659 22.503 -0.634 -6.174 483 HB3 HIS 659 HB1 HIS 659 23.435 0.792 -5.749 484 HD2 HIS 659 HD2 HIS 659 22.140 3.208 -6.138 485 HE1 HIS 659 HE1 HIS 659 18.469 1.551 -7.449 486 HE2 HIS 659 HE2 HIS 659 19.596 3.507 -6.322 487 H LEU 660 HN LEU 660 25.125 2.131 -6.869 488 HA LEU 660 HA LEU 660 24.331 4.074 -8.738 489 HB2 LEU 660 HB2 LEU 660 26.600 3.989 -6.764 490 HB3 LEU 660 HB1 LEU 660 26.126 5.407 -7.675 491 HG LEU 660 HG LEU 660 24.427 3.983 -5.629 492 HD11 LEU 660 HD11 LEU 660 24.781 5.998 -4.292 493 HD12 LEU 660 HD12 LEU 660 25.868 6.626 -5.532 494 HD13 LEU 660 HD13 LEU 660 26.299 5.168 -4.638 495 HD21 LEU 660 HD21 LEU 660 23.048 4.974 -7.362 496 HD22 LEU 660 HD22 LEU 660 23.924 6.497 -7.223 497 HD23 LEU 660 HD23 LEU 660 22.930 5.927 -5.883 498 H GLN 661 HN GLN 661 26.683 1.561 -8.971 499 HA GLN 661 HA GLN 661 28.566 3.120 -10.527 500 HB2 GLN 661 HB2 GLN 661 28.383 0.193 -9.814 501 HB3 GLN 661 HB1 GLN 661 29.558 0.795 -10.969 502 HG2 GLN 661 HG2 GLN 661 30.536 2.216 -9.237 503 HG3 GLN 661 HG1 GLN 661 29.348 1.615 -8.078 504 HE21 GLN 661 HE21 GLN 661 32.269 1.470 -8.103 505 HE22 GLN 661 HE22 GLN 661 32.666 -0.214 -7.981 506 H GLU 662 HN GLU 662 26.264 0.493 -11.004 507 HA GLU 662 HA GLU 662 26.556 0.265 -13.789 508 HB2 GLU 662 HB2 GLU 662 25.554 -1.453 -12.312 509 HB3 GLU 662 HB1 GLU 662 24.166 -0.404 -12.066 510 HG2 GLU 662 HG2 GLU 662 23.716 -0.517 -14.493 511 HG3 GLU 662 HG1 GLU 662 25.042 -1.670 -14.642 512 H THR 663 HN THR 663 24.594 2.352 -11.782 513 HA THR 663 HA THR 663 23.082 3.301 -14.076 514 HB THR 663 HB THR 663 21.885 4.701 -12.379 515 HG1 THR 663 HG1 THR 663 23.025 3.145 -10.342 516 HG21 THR 663 HG21 THR 663 20.723 2.799 -11.309 517 HG22 THR 663 HG22 THR 663 22.014 1.727 -11.851 518 HG23 THR 663 HG23 THR 663 20.983 2.535 -13.032 519 H GLN 664 HN GLN 664 26.058 3.967 -12.934 520 HA GLN 664 HA GLN 664 27.512 5.712 -13.047 521 HB2 GLN 664 HB2 GLN 664 25.526 6.503 -15.171 522 HB3 GLN 664 HB1 GLN 664 26.971 7.449 -14.851 523 HG2 GLN 664 HG2 GLN 664 26.964 4.538 -15.614 524 HG3 GLN 664 HG1 GLN 664 27.222 5.877 -16.733 525 HE21 GLN 664 HE21 GLN 664 28.572 4.014 -14.120 526 HE22 GLN 664 HE22 GLN 664 30.184 4.622 -14.268 527 H GLY 665 HN GLY 665 25.788 5.868 -10.925 528 HA2 GLY 665 HA2 GLY 665 25.766 7.604 -9.286 529 HA3 GLY 665 HA1 GLY 665 25.618 8.783 -10.583 530 H GLY 666 HN GLY 666 23.565 6.830 -11.780 531 HA2 GLY 666 HA2 GLY 666 21.284 6.604 -11.785 532 HA3 GLY 666 HA1 GLY 666 21.356 6.710 -10.030 533 H ARG 667 HN ARG 667 19.928 8.176 -9.425 534 HA ARG 667 HA ARG 667 19.149 10.397 -11.003 535 HB2 ARG 667 HB2 ARG 667 17.889 11.154 -9.035 536 HB3 ARG 667 HB1 ARG 667 17.611 9.453 -9.363 537 HG2 ARG 667 HG2 ARG 667 19.721 10.163 -7.389 538 HG3 ARG 667 HG1 ARG 667 18.035 10.369 -6.914 539 HD2 ARG 667 HD2 ARG 667 19.294 7.818 -7.936 540 HD3 ARG 667 HD1 ARG 667 18.883 8.171 -6.260 541 HE ARG 667 HE ARG 667 16.561 8.512 -7.710 542 HH11 ARG 667 HH11 ARG 667 18.764 5.858 -6.986 543 HH12 ARG 667 HH12 ARG 667 17.527 4.656 -7.136 544 HH21 ARG 667 HH21 ARG 667 14.951 6.878 -7.889 545 HH22 ARG 667 HH22 ARG 667 15.390 5.221 -7.647 546 H TYR 668 HN TYR 668 21.746 9.879 -8.847 547 HA TYR 668 HA TYR 668 22.114 12.594 -8.063 548 HB2 TYR 668 HB2 TYR 668 24.014 10.241 -7.959 549 HB3 TYR 668 HB1 TYR 668 24.307 11.807 -7.208 550 HD1 TYR 668 HD1 TYR 668 22.084 12.586 -5.780 551 HD2 TYR 668 HD2 TYR 668 23.372 8.573 -6.445 552 HE1 TYR 668 HE1 TYR 668 20.888 11.867 -3.762 553 HE2 TYR 668 HE2 TYR 668 22.175 7.857 -4.434 554 HH TYR 668 HH TYR 668 21.343 8.810 -2.349 555 H ALA 669 HN ALA 669 22.830 10.816 -10.879 556 HA ALA 669 HA ALA 669 25.109 12.275 -11.760 557 HB1 ALA 669 HB1 ALA 669 24.542 10.057 -12.641 558 HB2 ALA 669 HB2 ALA 669 24.686 11.252 -13.930 559 HB3 ALA 669 HB3 ALA 669 23.092 10.729 -13.386 560 H GLN 670 HN GLN 670 21.661 12.753 -11.978 561 HA GLN 670 HA GLN 670 21.908 14.926 -13.873 562 HB2 GLN 670 HB2 GLN 670 19.572 13.676 -12.443 563 HB3 GLN 670 HB1 GLN 670 19.395 15.177 -13.337 564 HG2 GLN 670 HG2 GLN 670 18.695 13.373 -14.737 565 HG3 GLN 670 HG1 GLN 670 20.211 14.004 -15.370 566 HE21 GLN 670 HE21 GLN 670 20.667 12.119 -16.460 567 HE22 GLN 670 HE22 GLN 670 21.146 10.669 -15.656 568 H GLY 671 HN GLY 671 22.730 14.733 -10.795 569 HA2 GLY 671 HA2 GLY 671 23.262 16.394 -9.290 570 HA3 GLY 671 HA1 GLY 671 22.557 17.564 -10.395 571 H GLU 672 HN GLU 672 20.839 14.776 -9.178 572 HA GLU 672 HA GLU 672 18.939 16.574 -7.876 573 HB2 GLU 672 HB2 GLU 672 18.165 14.838 -9.528 574 HB3 GLU 672 HB1 GLU 672 18.697 13.604 -8.398 575 HG2 GLU 672 HG2 GLU 672 17.124 14.571 -6.723 576 HG3 GLU 672 HG1 GLU 672 16.514 15.628 -7.993 577 H ASN 673 HN ASN 673 18.618 16.563 -5.689 578 HA ASN 673 HA ASN 673 20.493 14.974 -4.106 579 HB2 ASN 673 HB2 ASN 673 20.070 16.483 -2.283 580 HB3 ASN 673 HB1 ASN 673 20.300 17.462 -3.725 581 HD21 ASN 673 HD21 ASN 673 18.569 18.603 -4.561 582 HD22 ASN 673 HD22 ASN 673 17.091 18.822 -3.695 583 H PHE 674 HN PHE 674 19.686 14.008 -2.061 584 HA PHE 674 HA PHE 674 16.872 13.236 -2.178 585 HB2 PHE 674 HB2 PHE 674 18.352 11.530 -3.377 586 HB3 PHE 674 HB1 PHE 674 19.035 11.165 -1.797 587 HD1 PHE 674 HD1 PHE 674 15.684 11.510 -3.412 588 HD2 PHE 674 HD2 PHE 674 18.136 9.390 -0.655 589 HE1 PHE 674 HE1 PHE 674 13.850 9.919 -3.011 590 HE2 PHE 674 HE2 PHE 674 16.304 7.797 -0.248 591 HZ PHE 674 HZ PHE 674 14.159 8.061 -1.427 592 H VAL 675 HN VAL 675 15.953 12.937 -0.212 593 HA VAL 675 HA VAL 675 17.711 13.208 2.124 594 HB VAL 675 HB VAL 675 15.834 14.448 3.256 595 HG11 VAL 675 HG11 VAL 675 17.064 15.704 0.811 596 HG12 VAL 675 HG12 VAL 675 17.752 15.645 2.436 597 HG13 VAL 675 HG13 VAL 675 16.299 16.593 2.127 598 HG21 VAL 675 HG21 VAL 675 14.001 13.767 1.782 599 HG22 VAL 675 HG22 VAL 675 14.739 14.651 0.445 600 HG23 VAL 675 HG23 VAL 675 14.135 15.524 1.854 601 H VAL 676 HN VAL 676 17.597 11.582 3.478 602 HA VAL 676 HA VAL 676 15.191 9.895 3.435 603 HB VAL 676 HB VAL 676 18.004 9.168 4.295 604 HG11 VAL 676 HG11 VAL 676 16.337 7.959 5.584 605 HG12 VAL 676 HG12 VAL 676 17.136 6.877 4.442 606 HG13 VAL 676 HG13 VAL 676 15.515 7.479 4.100 607 HG21 VAL 676 HG21 VAL 676 16.413 8.328 1.876 608 HG22 VAL 676 HG22 VAL 676 18.009 7.723 2.320 609 HG23 VAL 676 HG23 VAL 676 17.800 9.419 1.876 610 H ASN 677 HN ASN 677 13.881 10.426 5.063 611 HA ASN 677 HA ASN 677 14.864 11.585 7.509 612 HB2 ASN 677 HB2 ASN 677 12.083 10.645 6.764 613 HB3 ASN 677 HB1 ASN 677 12.484 11.536 8.228 614 HD21 ASN 677 HD21 ASN 677 10.677 12.257 6.105 615 HD22 ASN 677 HD22 ASN 677 11.226 13.768 5.480 616 H ASP 678 HN ASP 678 14.018 8.453 6.378 617 HA ASP 678 HA ASP 678 15.361 7.195 8.527 618 HB2 ASP 678 HB2 ASP 678 13.241 7.480 9.712 619 HB3 ASP 678 HB1 ASP 678 12.370 6.746 8.365 620 H ILE 679 HN ILE 679 16.170 5.337 7.859 621 HA ILE 679 HA ILE 679 15.849 4.705 5.093 622 HB ILE 679 HB ILE 679 17.506 2.900 5.560 623 HG12 ILE 679 HG12 ILE 679 17.443 4.115 8.328 624 HG13 ILE 679 HG11 ILE 679 17.030 2.459 7.895 625 HG21 ILE 679 HG21 ILE 679 18.218 5.035 4.729 626 HG22 ILE 679 HG22 ILE 679 19.373 4.477 5.942 627 HG23 ILE 679 HG23 ILE 679 18.191 5.718 6.356 628 HD11 ILE 679 HD11 ILE 679 19.382 2.110 7.208 629 HD12 ILE 679 HD12 ILE 679 19.195 2.504 8.914 630 HD13 ILE 679 HD13 ILE 679 19.752 3.735 7.780 631 H TYR 680 HN TYR 680 14.449 3.431 7.978 632 HA TYR 680 HA TYR 680 13.787 0.916 6.694 633 HB2 TYR 680 HB2 TYR 680 13.181 1.991 9.444 634 HB3 TYR 680 HB1 TYR 680 12.595 0.435 8.862 635 HD1 TYR 680 HD1 TYR 680 15.605 2.359 9.756 636 HD2 TYR 680 HD2 TYR 680 14.048 -1.452 8.708 637 HE1 TYR 680 HE1 TYR 680 17.726 1.320 10.415 638 HE2 TYR 680 HE2 TYR 680 16.168 -2.505 9.365 639 HH TYR 680 HH TYR 680 18.671 -0.698 11.001 640 H GLN 681 HN GLN 681 12.044 3.699 8.006 641 HA GLN 681 HA GLN 681 9.456 2.864 7.324 642 HB2 GLN 681 HB2 GLN 681 9.906 4.621 8.946 643 HB3 GLN 681 HB1 GLN 681 10.564 5.648 7.684 644 HG2 GLN 681 HG2 GLN 681 8.398 5.839 6.651 645 HG3 GLN 681 HG1 GLN 681 7.715 4.700 7.810 646 HE21 GLN 681 HE21 GLN 681 6.211 6.195 8.515 647 HE22 GLN 681 HE22 GLN 681 6.652 7.530 9.521 648 H VAL 682 HN VAL 682 11.941 4.272 5.360 649 HA VAL 682 HA VAL 682 10.248 5.317 3.331 650 HB VAL 682 HB VAL 682 12.602 6.051 3.655 651 HG11 VAL 682 HG11 VAL 682 13.301 3.386 2.457 652 HG12 VAL 682 HG12 VAL 682 13.643 3.925 4.101 653 HG13 VAL 682 HG13 VAL 682 14.427 4.714 2.732 654 HG21 VAL 682 HG21 VAL 682 13.192 6.236 1.286 655 HG22 VAL 682 HG22 VAL 682 11.473 6.537 1.553 656 HG23 VAL 682 HG23 VAL 682 12.007 4.987 0.898 657 H GLY 683 HN GLY 683 11.191 2.115 4.115 658 HA2 GLY 683 HA2 GLY 683 10.312 0.164 3.196 659 HA3 GLY 683 HA1 GLY 683 9.640 1.116 1.884 660 H HIS 684 HN HIS 684 13.000 1.223 2.801 661 HA HIS 684 HA HIS 684 13.841 0.692 0.152 662 HB2 HIS 684 HB2 HIS 684 15.163 1.325 2.702 663 HB3 HIS 684 HB1 HIS 684 16.134 0.416 1.545 664 HD2 HIS 684 HD2 HIS 684 17.589 2.963 1.470 665 HE1 HIS 684 HE1 HIS 684 14.783 4.652 -1.221 666 HE2 HIS 684 HE2 HIS 684 17.184 4.541 -0.525 667 H SER 685 HN SER 685 15.422 -0.927 -0.462 668 HA SER 685 HA SER 685 14.452 -3.565 0.178 669 HB2 SER 685 HB2 SER 685 16.659 -2.729 -1.717 670 HB3 SER 685 HB1 SER 685 15.775 -4.256 -1.722 671 HG SER 685 HG SER 685 13.961 -2.385 -1.835 672 HA PRO 686 HA PRO 686 17.749 -5.019 2.817 673 HB2 PRO 686 HB2 PRO 686 18.369 -7.192 0.903 674 HB3 PRO 686 HB1 PRO 686 17.873 -7.295 2.593 675 HG2 PRO 686 HG2 PRO 686 16.171 -7.930 0.646 676 HG3 PRO 686 HG1 PRO 686 15.621 -7.059 2.089 677 HD2 PRO 686 HD2 PRO 686 16.207 -6.011 -0.650 678 HD3 PRO 686 HD1 PRO 686 14.865 -5.614 0.446 679 H CYS 687 HN CYS 687 20.035 -5.329 2.998 680 HA CYS 687 HA CYS 687 22.184 -4.760 2.673 681 HB2 CYS 687 HB2 CYS 687 22.142 -6.091 0.574 682 HB3 CYS 687 HB1 CYS 687 21.571 -4.672 -0.301 683 H HIS 688 HN HIS 688 23.552 -2.881 2.111 684 HA HIS 688 HA HIS 688 23.992 -0.668 1.920 685 HB2 HIS 688 HB2 HIS 688 22.695 -0.491 -0.112 686 HB3 HIS 688 HB1 HIS 688 21.182 -0.574 0.774 687 HD1 HIS 688 HD1 HIS 688 20.098 1.609 0.391 688 HD2 HIS 688 HD2 HIS 688 24.152 2.023 1.256 689 HE1 HIS 688 HE1 HIS 688 20.512 4.086 0.553 690 H ILE 689 HN ILE 689 20.825 -1.453 3.188 691 HA ILE 689 HA ILE 689 20.784 0.624 5.088 692 HB ILE 689 HB ILE 689 19.199 -1.950 4.963 693 HG12 ILE 689 HG12 ILE 689 18.736 -0.664 3.015 694 HG13 ILE 689 HG11 ILE 689 17.388 -0.396 4.115 695 HG21 ILE 689 HG21 ILE 689 19.218 -0.973 7.233 696 HG22 ILE 689 HG22 ILE 689 17.620 -0.961 6.490 697 HG23 ILE 689 HG23 ILE 689 18.564 0.523 6.563 698 HD11 ILE 689 HD11 ILE 689 17.882 1.718 3.251 699 HD12 ILE 689 HD12 ILE 689 19.618 1.462 3.393 700 HD13 ILE 689 HD13 ILE 689 18.648 1.699 4.842 701 H GLU 690 HN GLU 690 21.831 -2.691 5.098 702 HA GLU 690 HA GLU 690 22.124 -3.085 7.876 703 HB2 GLU 690 HB2 GLU 690 23.586 -4.959 7.259 704 HB3 GLU 690 HB1 GLU 690 22.132 -4.938 6.271 705 HG2 GLU 690 HG2 GLU 690 23.387 -3.920 4.441 706 HG3 GLU 690 HG1 GLU 690 24.842 -3.927 5.434 707 H ILE 691 HN ILE 691 24.216 -1.751 5.438 708 HA ILE 691 HA ILE 691 26.546 -1.528 7.045 709 HB ILE 691 HB ILE 691 25.894 0.149 4.610 710 HG12 ILE 691 HG12 ILE 691 27.162 -2.605 4.695 711 HG13 ILE 691 HG11 ILE 691 25.522 -2.271 4.157 712 HG21 ILE 691 HG21 ILE 691 27.863 0.825 5.912 713 HG22 ILE 691 HG22 ILE 691 28.315 0.207 4.324 714 HG23 ILE 691 HG23 ILE 691 28.522 -0.804 5.754 715 HD11 ILE 691 HD11 ILE 691 26.426 -0.895 2.330 716 HD12 ILE 691 HD12 ILE 691 26.984 -2.566 2.258 717 HD13 ILE 691 HD13 ILE 691 28.060 -1.302 2.857 718 H LEU 692 HN LEU 692 23.935 0.698 6.193 719 HA LEU 692 HA LEU 692 25.007 2.995 7.438 720 HB2 LEU 692 HB2 LEU 692 22.136 2.281 6.868 721 HB3 LEU 692 HB1 LEU 692 22.712 3.877 7.308 722 HG LEU 692 HG LEU 692 23.575 2.405 4.822 723 HD11 LEU 692 HD11 LEU 692 22.097 4.004 3.650 724 HD12 LEU 692 HD12 LEU 692 21.468 4.502 5.223 725 HD13 LEU 692 HD13 LEU 692 21.227 2.850 4.662 726 HD21 LEU 692 HD21 LEU 692 23.905 5.278 5.687 727 HD22 LEU 692 HD22 LEU 692 24.384 4.612 4.126 728 HD23 LEU 692 HD23 LEU 692 25.183 4.065 5.600 729 H GLU 693 HN GLU 693 22.732 0.532 8.573 730 HA GLU 693 HA GLU 693 22.132 1.596 11.085 731 HB2 GLU 693 HB2 GLU 693 20.944 -0.308 10.060 732 HB3 GLU 693 HB1 GLU 693 22.373 -1.308 10.254 733 HG2 GLU 693 HG2 GLU 693 20.792 -1.871 11.953 734 HG3 GLU 693 HG1 GLU 693 22.163 -1.061 12.706 735 H GLN 694 HN GLN 694 24.927 -0.153 9.938 736 HA GLN 694 HA GLN 694 26.021 -0.777 12.485 737 HB2 GLN 694 HB2 GLN 694 26.611 -2.018 10.452 738 HB3 GLN 694 HB1 GLN 694 27.380 -0.581 9.796 739 HG2 GLN 694 HG2 GLN 694 29.028 -0.628 11.576 740 HG3 GLN 694 HG1 GLN 694 28.240 -2.035 12.285 741 HE21 GLN 694 HE21 GLN 694 30.951 -1.709 11.289 742 HE22 GLN 694 HE22 GLN 694 31.159 -2.908 10.062 743 H PHE 695 HN PHE 695 26.157 2.031 10.411 744 HA PHE 695 HA PHE 695 28.367 3.219 11.862 745 HB2 PHE 695 HB2 PHE 695 26.553 4.315 9.703 746 HB3 PHE 695 HB1 PHE 695 27.815 5.263 10.471 747 HD1 PHE 695 HD1 PHE 695 30.213 3.874 10.470 748 HD2 PHE 695 HD2 PHE 695 27.051 3.516 7.629 749 HE1 PHE 695 HE1 PHE 695 31.816 3.080 8.775 750 HE2 PHE 695 HE2 PHE 695 28.663 2.719 5.946 751 HZ PHE 695 HZ PHE 695 31.037 2.500 6.523 752 H GLU 696 HN GLU 696 25.430 2.583 12.867 753 HA GLU 696 HA GLU 696 24.065 3.333 14.512 754 HB2 GLU 696 HB2 GLU 696 26.261 5.362 14.982 755 HB3 GLU 696 HB1 GLU 696 24.895 5.102 16.056 756 HG2 GLU 696 HG2 GLU 696 27.065 3.125 15.393 757 HG3 GLU 696 HG1 GLU 696 26.845 3.983 16.917 758 H VAL 697 HN VAL 697 23.811 4.293 11.828 759 HA VAL 697 HA VAL 697 22.503 6.885 12.315 760 HB VAL 697 HB VAL 697 23.915 5.909 9.811 761 HG11 VAL 697 HG11 VAL 697 21.910 7.145 9.225 762 HG12 VAL 697 HG12 VAL 697 23.362 8.059 8.828 763 HG13 VAL 697 HG13 VAL 697 22.420 8.481 10.257 764 HG21 VAL 697 HG21 VAL 697 25.434 6.704 11.537 765 HG22 VAL 697 HG22 VAL 697 24.524 8.213 11.651 766 HG23 VAL 697 HG23 VAL 697 25.389 7.814 10.166 767 H LYS 698 HN LYS 698 20.402 7.091 11.409 768 HA LYS 698 HA LYS 698 19.384 4.779 9.914 769 HB2 LYS 698 HB2 LYS 698 17.947 6.323 12.075 770 HB3 LYS 698 HB1 LYS 698 17.157 5.184 10.996 771 HG2 LYS 698 HG2 LYS 698 18.569 3.379 11.865 772 HG3 LYS 698 HG1 LYS 698 19.360 4.526 12.949 773 HD2 LYS 698 HD2 LYS 698 17.140 5.008 13.963 774 HD3 LYS 698 HD1 LYS 698 16.449 3.737 12.956 775 HE2 LYS 698 HE2 LYS 698 18.699 3.296 14.911 776 HE3 LYS 698 HE1 LYS 698 17.000 3.057 15.305 777 HZ1 LYS 698 HZ1 LYS 698 18.530 1.588 13.211 778 HZ2 LYS 698 HZ2 LYS 698 16.884 1.395 13.540 779 HZ3 LYS 698 HZ3 LYS 698 18.024 0.984 14.706 780 H ALA 699 HN ALA 699 19.868 8.126 9.985 781 HA ALA 699 HA ALA 699 18.286 8.412 7.550 782 HB1 ALA 699 HB1 ALA 699 17.369 10.538 8.291 783 HB2 ALA 699 HB2 ALA 699 18.144 10.334 9.863 784 HB3 ALA 699 HB3 ALA 699 16.865 9.229 9.360 785 H TYR 700 HN TYR 700 18.920 10.318 6.286 786 HA TYR 700 HA TYR 700 21.268 11.764 6.901 787 HB2 TYR 700 HB2 TYR 700 22.787 10.732 5.225 788 HB3 TYR 700 HB1 TYR 700 22.417 9.654 6.566 789 HD1 TYR 700 HD1 TYR 700 21.999 10.255 2.986 790 HD2 TYR 700 HD2 TYR 700 21.029 7.684 6.226 791 HE1 TYR 700 HE1 TYR 700 21.250 8.543 1.387 792 HE2 TYR 700 HE2 TYR 700 20.271 5.968 4.636 793 HH TYR 700 HH TYR 700 19.442 5.844 2.320 794 H VAL 701 HN VAL 701 22.143 12.835 4.891 795 HA VAL 701 HA VAL 701 20.064 13.232 2.868 796 HB VAL 701 HB VAL 701 19.785 15.109 4.357 797 HG11 VAL 701 HG11 VAL 701 21.626 16.633 4.930 798 HG12 VAL 701 HG12 VAL 701 22.755 15.553 4.110 799 HG13 VAL 701 HG13 VAL 701 21.892 15.001 5.545 800 HG21 VAL 701 HG21 VAL 701 21.420 16.025 1.989 801 HG22 VAL 701 HG22 VAL 701 20.252 16.993 2.888 802 HG23 VAL 701 HG23 VAL 701 19.710 15.607 1.943 803 H ILE 702 HN ILE 702 20.817 13.380 0.808 804 HA ILE 702 HA ILE 702 23.752 13.309 0.463 805 HB ILE 702 HB ILE 702 21.678 12.020 -1.326 806 HG12 ILE 702 HG12 ILE 702 21.839 10.875 0.866 807 HG13 ILE 702 HG11 ILE 702 22.413 9.872 -0.460 808 HG21 ILE 702 HG21 ILE 702 23.693 12.707 -2.501 809 HG22 ILE 702 HG22 ILE 702 23.592 10.949 -2.403 810 HG23 ILE 702 HG23 ILE 702 24.687 11.830 -1.337 811 HD11 ILE 702 HD11 ILE 702 24.111 11.377 1.514 812 HD12 ILE 702 HD12 ILE 702 24.725 10.439 0.152 813 HD13 ILE 702 HD13 ILE 702 23.851 9.633 1.457 814 H VAL 703 HN VAL 703 24.494 15.093 -0.506 815 HA VAL 703 HA VAL 703 22.826 16.304 -2.606 816 HB VAL 703 HB VAL 703 23.857 18.488 -2.125 817 HG11 VAL 703 HG11 VAL 703 22.573 17.203 0.281 818 HG12 VAL 703 HG12 VAL 703 21.741 17.967 -1.073 819 HG13 VAL 703 HG13 VAL 703 22.731 18.940 0.016 820 HG21 VAL 703 HG21 VAL 703 25.163 18.819 -0.066 821 HG22 VAL 703 HG22 VAL 703 25.979 17.756 -1.212 822 HG23 VAL 703 HG23 VAL 703 25.166 17.074 0.198 823 HA PRO 704 HA PRO 704 26.274 15.421 -5.224 824 HB2 PRO 704 HB2 PRO 704 25.542 16.753 -7.427 825 HB3 PRO 704 HB1 PRO 704 24.639 15.346 -6.853 826 HG2 PRO 704 HG2 PRO 704 23.996 18.250 -6.576 827 HG3 PRO 704 HG1 PRO 704 22.911 16.888 -6.903 828 HD2 PRO 704 HD2 PRO 704 23.285 18.066 -4.418 829 HD3 PRO 704 HD1 PRO 704 22.646 16.433 -4.684 830 H VAL 705 HN VAL 705 28.288 16.189 -5.388 831 HA VAL 705 HA VAL 705 28.706 19.099 -5.308 832 HB VAL 705 HB VAL 705 30.574 16.887 -4.413 833 HG11 VAL 705 HG11 VAL 705 31.804 18.778 -5.338 834 HG12 VAL 705 HG12 VAL 705 32.014 18.693 -3.589 835 HG13 VAL 705 HG13 VAL 705 30.918 19.884 -4.288 836 HG21 VAL 705 HG21 VAL 705 28.733 17.188 -2.862 837 HG22 VAL 705 HG22 VAL 705 29.019 18.927 -2.824 838 HG23 VAL 705 HG23 VAL 705 30.221 17.823 -2.158 839 H PHE 706 HN PHE 706 29.122 19.834 -7.277 840 HA PHE 706 HA PHE 706 30.598 18.171 -9.166 841 HB2 PHE 706 HB2 PHE 706 29.069 20.755 -9.546 842 HB3 PHE 706 HB1 PHE 706 29.952 19.930 -10.826 843 HD1 PHE 706 HD1 PHE 706 26.960 19.926 -8.748 844 HD2 PHE 706 HD2 PHE 706 29.154 17.806 -11.715 845 HE1 PHE 706 HE1 PHE 706 24.974 18.558 -9.234 846 HE2 PHE 706 HE2 PHE 706 27.174 16.435 -12.204 847 HZ PHE 706 HZ PHE 706 25.079 16.809 -10.966 848 H ALA 707 HN ALA 707 32.647 18.589 -9.739 849 HA ALA 707 HA ALA 707 33.795 21.203 -9.288 850 HB1 ALA 707 HB1 ALA 707 35.644 20.401 -7.913 851 HB2 ALA 707 HB2 ALA 707 34.972 18.773 -7.923 852 HB3 ALA 707 HB3 ALA 707 34.109 20.076 -7.109 853 H GLY 708 HN GLY 708 34.367 21.465 -11.351 854 HA2 GLY 708 HA2 GLY 708 36.284 21.186 -12.800 855 HA3 GLY 708 HA1 GLY 708 36.229 19.468 -12.439 856 H GLU 709 HN GLU 709 35.329 18.214 -13.903 857 HA GLU 709 HA GLU 709 33.742 19.506 -16.006 858 HB2 GLU 709 HB2 GLU 709 34.514 17.570 -17.422 859 HB3 GLU 709 HB1 GLU 709 35.768 18.693 -16.914 860 HG2 GLU 709 HG2 GLU 709 36.191 17.059 -14.995 861 HG3 GLU 709 HG1 GLU 709 35.226 15.919 -15.929 862 H GLN 710 HN GLN 710 33.704 16.897 -13.680 863 HA GLN 710 HA GLN 710 30.934 16.356 -14.461 864 HB2 GLN 710 HB2 GLN 710 33.112 14.299 -14.221 865 HB3 GLN 710 HB1 GLN 710 31.470 13.864 -13.786 866 HG2 GLN 710 HG2 GLN 710 31.494 13.212 -15.960 867 HG3 GLN 710 HG1 GLN 710 30.925 14.868 -16.147 868 HE21 GLN 710 HE21 GLN 710 31.681 15.030 -18.235 869 HE22 GLN 710 HE22 GLN 710 33.365 15.140 -18.610 870 H LEU 711 HN LEU 711 30.194 14.542 -12.682 871 HA LEU 711 HA LEU 711 30.017 15.964 -10.261 872 HB2 LEU 711 HB2 LEU 711 28.296 14.397 -11.069 873 HB3 LEU 711 HB1 LEU 711 29.412 13.065 -10.864 874 HG LEU 711 HG LEU 711 29.406 13.438 -8.429 875 HD11 LEU 711 HD11 LEU 711 27.335 15.539 -9.043 876 HD12 LEU 711 HD12 LEU 711 28.954 15.826 -8.404 877 HD13 LEU 711 HD13 LEU 711 27.766 14.955 -7.436 878 HD21 LEU 711 HD21 LEU 711 27.112 12.670 -8.021 879 HD22 LEU 711 HD22 LEU 711 27.845 11.847 -9.397 880 HD23 LEU 711 HD23 LEU 711 26.671 13.136 -9.663 881 H TRP 712 HN TRP 712 31.635 16.219 -8.897 882 HA TRP 712 HA TRP 712 33.944 14.565 -8.913 883 HB2 TRP 712 HB2 TRP 712 34.076 16.949 -8.377 884 HB3 TRP 712 HB1 TRP 712 33.069 16.699 -6.956 885 HD1 TRP 712 HD1 TRP 712 36.515 15.528 -8.296 886 HE1 TRP 712 HE1 TRP 712 38.088 15.237 -6.290 887 HE3 TRP 712 HE3 TRP 712 33.213 16.572 -4.534 888 HZ2 TRP 712 HZ2 TRP 712 37.948 15.430 -3.466 889 HZ3 TRP 712 HZ3 TRP 712 34.015 16.498 -2.209 890 HH2 TRP 712 HH2 TRP 712 36.330 15.940 -1.687 891 H GLY 713 HN GLY 713 31.326 15.109 -6.574 892 HA2 GLY 713 HA2 GLY 713 31.174 12.389 -5.904 893 HA3 GLY 713 HA1 GLY 713 32.154 13.234 -4.717 894 H LEU 714 HN LEU 714 30.169 12.197 -3.631 895 HA LEU 714 HA LEU 714 27.995 14.160 -3.520 896 HB2 LEU 714 HB2 LEU 714 28.126 11.382 -2.349 897 HB3 LEU 714 HB1 LEU 714 26.729 12.438 -2.343 898 HG LEU 714 HG LEU 714 28.002 11.253 -4.811 899 HD11 LEU 714 HD11 LEU 714 26.915 9.553 -3.466 900 HD12 LEU 714 HD12 LEU 714 25.982 9.878 -4.927 901 HD13 LEU 714 HD13 LEU 714 25.453 10.535 -3.378 902 HD21 LEU 714 HD21 LEU 714 25.991 12.091 -5.950 903 HD22 LEU 714 HD22 LEU 714 26.966 13.395 -5.276 904 HD23 LEU 714 HD23 LEU 714 25.488 12.886 -4.458 905 H LEU 715 HN LEU 715 27.221 14.807 -1.475 906 HA LEU 715 HA LEU 715 29.216 14.668 0.683 907 HB2 LEU 715 HB2 LEU 715 29.131 16.914 -0.378 908 HB3 LEU 715 HB1 LEU 715 27.427 17.009 0.006 909 HG LEU 715 HG LEU 715 27.982 16.949 2.415 910 HD11 LEU 715 HD11 LEU 715 30.311 17.294 3.106 911 HD12 LEU 715 HD12 LEU 715 30.831 17.071 1.435 912 HD13 LEU 715 HD13 LEU 715 30.079 15.738 2.311 913 HD21 LEU 715 HD21 LEU 715 27.670 19.082 1.273 914 HD22 LEU 715 HD22 LEU 715 29.378 19.110 0.839 915 HD23 LEU 715 HD23 LEU 715 28.897 19.215 2.532 916 H ALA 716 HN ALA 716 28.427 13.593 2.349 917 HA ALA 716 HA ALA 716 25.506 13.562 2.701 918 HB1 ALA 716 HB1 ALA 716 26.387 11.434 1.862 919 HB2 ALA 716 HB2 ALA 716 25.683 11.280 3.472 920 HB3 ALA 716 HB3 ALA 716 27.435 11.325 3.275 921 H ALA 717 HN ALA 717 24.703 13.733 4.711 922 HA ALA 717 HA ALA 717 26.612 14.018 6.914 923 HB1 ALA 717 HB1 ALA 717 24.190 15.776 6.509 924 HB2 ALA 717 HB2 ALA 717 25.861 16.249 6.191 925 HB3 ALA 717 HB3 ALA 717 25.356 15.863 7.833 926 H TYR 718 HN TYR 718 26.095 12.988 8.716 927 HA TYR 718 HA TYR 718 23.462 11.649 8.851 928 HB2 TYR 718 HB2 TYR 718 25.975 10.442 9.981 929 HB3 TYR 718 HB1 TYR 718 24.477 9.645 9.535 930 HD1 TYR 718 HD1 TYR 718 27.599 11.121 8.217 931 HD2 TYR 718 HD2 TYR 718 24.164 8.786 7.295 932 HE1 TYR 718 HE1 TYR 718 28.637 10.440 6.105 933 HE2 TYR 718 HE2 TYR 718 25.195 8.105 5.174 934 HH TYR 718 HH TYR 718 28.490 8.642 4.486 935 H GLN 719 HN GLN 719 22.623 11.390 11.047 936 HA GLN 719 HA GLN 719 24.288 12.481 13.152 937 HB2 GLN 719 HB2 GLN 719 22.708 14.190 13.872 938 HB3 GLN 719 HB1 GLN 719 23.225 14.463 12.217 939 HG2 GLN 719 HG2 GLN 719 21.100 13.524 11.408 940 HG3 GLN 719 HG1 GLN 719 20.580 13.305 13.077 941 HE21 GLN 719 HE21 GLN 719 22.387 16.036 11.830 942 HE22 GLN 719 HE22 GLN 719 21.160 17.218 12.091 943 H ASN 720 HN ASN 720 24.289 10.683 14.341 944 HA ASN 720 HA ASN 720 23.463 8.844 15.539 945 HB2 ASN 720 HB2 ASN 720 22.200 11.222 16.943 946 HB3 ASN 720 HB1 ASN 720 22.538 9.660 17.676 947 HD21 ASN 720 HD21 ASN 720 23.882 12.635 16.507 948 HD22 ASN 720 HD22 ASN 720 25.463 12.428 17.182 949 H SER 721 HN SER 721 22.074 8.031 13.808 950 HA SER 721 HA SER 721 20.138 7.129 13.071 951 HB2 SER 721 HB2 SER 721 19.666 6.474 15.396 952 HB3 SER 721 HB1 SER 721 19.005 8.071 15.731 953 HG SER 721 HG SER 721 17.212 7.087 15.209 954 H GLY 722 HN GLY 722 18.692 9.815 14.886 955 HA2 GLY 722 HA2 GLY 722 17.773 11.795 14.229 956 HA3 GLY 722 HA1 GLY 722 18.761 11.686 12.785 957 H THR 723 HN THR 723 15.921 9.988 14.118 958 HA THR 723 HA THR 723 14.811 9.583 11.511 959 HB THR 723 HB THR 723 12.767 8.934 12.936 960 HG1 THR 723 HG1 THR 723 13.248 8.501 15.099 961 HG21 THR 723 HG21 THR 723 14.220 7.318 11.814 962 HG22 THR 723 HG22 THR 723 13.768 6.726 13.412 963 HG23 THR 723 HG23 THR 723 15.371 7.411 13.147 964 H ARG 724 HN ARG 724 15.247 12.211 11.790 965 HA ARG 724 HA ARG 724 12.648 13.513 12.278 966 HB2 ARG 724 HB2 ARG 724 13.939 15.623 12.309 967 HB3 ARG 724 HB1 ARG 724 14.472 14.495 13.549 968 HG2 ARG 724 HG2 ARG 724 16.465 14.024 12.441 969 HG3 ARG 724 HG1 ARG 724 15.859 14.621 10.897 970 HD2 ARG 724 HD2 ARG 724 16.299 16.398 13.287 971 HD3 ARG 724 HD1 ARG 724 17.547 16.085 12.086 972 HE ARG 724 HE ARG 724 15.035 17.045 11.009 973 HH11 ARG 724 HH11 ARG 724 18.192 17.933 12.238 974 HH12 ARG 724 HH12 ARG 724 18.229 19.468 11.437 975 HH21 ARG 724 HH21 ARG 724 15.075 19.066 9.914 976 HH22 ARG 724 HH22 ARG 724 16.445 20.129 10.084 977 H ASP 725 HN ASP 725 12.408 15.518 10.795 978 HA ASP 725 HA ASP 725 12.735 14.613 8.040 979 HB2 ASP 725 HB2 ASP 725 11.208 16.988 9.147 980 HB3 ASP 725 HB1 ASP 725 11.217 16.475 7.467 981 H TRP 726 HN TRP 726 14.308 15.393 6.798 982 HA TRP 726 HA TRP 726 16.090 17.394 7.766 983 HB2 TRP 726 HB2 TRP 726 15.829 16.128 5.031 984 HB3 TRP 726 HB1 TRP 726 17.133 17.218 5.498 985 HD1 TRP 726 HD1 TRP 726 15.983 13.637 5.820 986 HE1 TRP 726 HE1 TRP 726 17.774 12.267 7.046 987 HE3 TRP 726 HE3 TRP 726 19.010 17.464 7.346 988 HZ2 TRP 726 HZ2 TRP 726 20.174 12.748 8.477 989 HZ3 TRP 726 HZ3 TRP 726 21.033 16.925 8.639 990 HH2 TRP 726 HH2 TRP 726 21.603 14.618 9.192 991 H ASP 727 HN ASP 727 15.772 19.486 7.747 992 HA ASP 727 HA ASP 727 13.476 20.530 6.390 993 HB2 ASP 727 HB2 ASP 727 14.116 21.210 8.704 994 HB3 ASP 727 HB1 ASP 727 15.505 22.051 8.021 995 H GLU 728 HN GLU 728 13.432 22.218 5.023 996 HA GLU 728 HA GLU 728 15.037 22.089 2.743 997 HB2 GLU 728 HB2 GLU 728 12.715 23.109 2.992 998 HB3 GLU 728 HB1 GLU 728 13.500 24.547 3.614 999 HG2 GLU 728 HG2 GLU 728 14.174 23.428 0.913 1000 HG3 GLU 728 HG1 GLU 728 12.801 24.501 1.155 1001 H SER 729 HN SER 729 15.122 24.479 5.378 1002 HA SER 729 HA SER 729 17.142 26.125 4.601 1003 HB2 SER 729 HB2 SER 729 16.902 25.193 7.447 1004 HB3 SER 729 HB1 SER 729 17.262 26.809 6.835 1005 HG SER 729 HG SER 729 14.826 25.519 7.180 1006 H GLU 730 HN GLU 730 17.481 22.878 5.931 1007 HA GLU 730 HA GLU 730 20.334 23.176 6.307 1008 HB2 GLU 730 HB2 GLU 730 18.423 20.893 6.747 1009 HB3 GLU 730 HB1 GLU 730 20.159 20.650 6.818 1010 HG2 GLU 730 HG2 GLU 730 19.631 20.962 9.031 1011 HG3 GLU 730 HG1 GLU 730 20.096 22.589 8.547 1012 H VAL 731 HN VAL 731 18.190 21.273 4.234 1013 HA VAL 731 HA VAL 731 20.143 19.837 2.853 1014 HB VAL 731 HB VAL 731 17.458 20.718 1.775 1015 HG11 VAL 731 HG11 VAL 731 19.221 18.390 1.013 1016 HG12 VAL 731 HG12 VAL 731 18.925 19.832 0.043 1017 HG13 VAL 731 HG13 VAL 731 17.607 18.709 0.378 1018 HG21 VAL 731 HG21 VAL 731 16.600 18.614 2.651 1019 HG22 VAL 731 HG22 VAL 731 17.258 19.606 3.952 1020 HG23 VAL 731 HG23 VAL 731 18.181 18.237 3.333 1021 H THR 732 HN THR 732 18.671 22.973 2.038 1022 HA THR 732 HA THR 732 19.967 23.142 -0.487 1023 HB THR 732 HB THR 732 18.712 25.357 1.145 1024 HG1 THR 732 HG1 THR 732 16.822 24.711 0.305 1025 HG21 THR 732 HG21 THR 732 20.122 26.164 -0.709 1026 HG22 THR 732 HG22 THR 732 18.414 26.459 -1.031 1027 HG23 THR 732 HG23 THR 732 19.244 25.122 -1.829 1028 H LEU 733 HN LEU 733 20.876 24.088 2.765 1029 HA LEU 733 HA LEU 733 22.925 25.891 1.848 1030 HB2 LEU 733 HB2 LEU 733 21.562 25.627 4.205 1031 HB3 LEU 733 HB1 LEU 733 23.088 24.867 4.604 1032 HG LEU 733 HG LEU 733 23.101 27.206 5.272 1033 HD11 LEU 733 HD11 LEU 733 25.130 27.945 4.167 1034 HD12 LEU 733 HD12 LEU 733 24.887 26.750 2.894 1035 HD13 LEU 733 HD13 LEU 733 25.210 26.224 4.546 1036 HD21 LEU 733 HD21 LEU 733 22.961 29.006 3.642 1037 HD22 LEU 733 HD22 LEU 733 21.482 28.049 3.649 1038 HD23 LEU 733 HD23 LEU 733 22.662 27.839 2.357 1039 H LEU 734 HN LEU 734 22.662 22.571 2.959 1040 HA LEU 734 HA LEU 734 25.385 21.969 3.221 1041 HB2 LEU 734 HB2 LEU 734 23.555 20.514 3.995 1042 HB3 LEU 734 HB1 LEU 734 23.133 20.164 2.331 1043 HG LEU 734 HG LEU 734 25.405 19.138 2.053 1044 HD11 LEU 734 HD11 LEU 734 25.502 19.476 5.042 1045 HD12 LEU 734 HD12 LEU 734 26.567 20.233 3.857 1046 HD13 LEU 734 HD13 LEU 734 26.607 18.486 4.089 1047 HD21 LEU 734 HD21 LEU 734 24.826 17.068 3.209 1048 HD22 LEU 734 HD22 LEU 734 23.417 17.779 2.419 1049 HD23 LEU 734 HD23 LEU 734 23.623 17.934 4.164 1050 H ALA 735 HN ALA 735 23.205 21.653 0.428 1051 HA ALA 735 HA ALA 735 25.114 20.652 -1.382 1052 HB1 ALA 735 HB1 ALA 735 22.699 20.527 -1.778 1053 HB2 ALA 735 HB2 ALA 735 23.530 21.301 -3.127 1054 HB3 ALA 735 HB3 ALA 735 22.639 22.280 -1.961 1055 H ARG 736 HN ARG 736 24.190 23.886 -0.476 1056 HA ARG 736 HA ARG 736 25.562 25.290 -2.500 1057 HB2 ARG 736 HB2 ARG 736 23.855 26.349 -1.099 1058 HB3 ARG 736 HB1 ARG 736 24.899 26.192 0.306 1059 HG2 ARG 736 HG2 ARG 736 26.499 27.717 -0.660 1060 HG3 ARG 736 HG1 ARG 736 25.552 27.808 -2.146 1061 HD2 ARG 736 HD2 ARG 736 23.698 28.789 -0.907 1062 HD3 ARG 736 HD1 ARG 736 24.626 28.681 0.586 1063 HE ARG 736 HE ARG 736 26.267 30.180 -0.651 1064 HH11 ARG 736 HH11 ARG 736 22.793 30.292 -1.163 1065 HH12 ARG 736 HH12 ARG 736 22.780 31.965 -1.594 1066 HH21 ARG 736 HH21 ARG 736 26.254 32.388 -1.233 1067 HH22 ARG 736 HH22 ARG 736 24.767 33.167 -1.644 1068 H ILE 737 HN ILE 737 26.536 24.562 0.859 1069 HA ILE 737 HA ILE 737 29.143 25.604 0.615 1070 HB ILE 737 HB ILE 737 28.111 23.451 2.483 1071 HG12 ILE 737 HG12 ILE 737 28.540 26.423 2.869 1072 HG13 ILE 737 HG11 ILE 737 26.984 25.611 2.738 1073 HG21 ILE 737 HG21 ILE 737 30.543 23.310 2.276 1074 HG22 ILE 737 HG22 ILE 737 30.086 23.926 3.864 1075 HG23 ILE 737 HG23 ILE 737 30.682 25.033 2.628 1076 HD11 ILE 737 HD11 ILE 737 27.507 26.164 5.042 1077 HD12 ILE 737 HD12 ILE 737 28.998 25.228 4.941 1078 HD13 ILE 737 HD13 ILE 737 27.437 24.417 4.816 1079 H GLY 738 HN GLY 738 27.789 22.419 -0.038 1080 HA2 GLY 738 HA2 GLY 738 30.143 20.982 -0.462 1081 HA3 GLY 738 HA1 GLY 738 28.609 20.655 -1.259 1082 H ASN 739 HN ASN 739 28.227 22.858 -2.804 1083 HA ASN 739 HA ASN 739 30.046 22.389 -4.950 1084 HB2 ASN 739 HB2 ASN 739 27.969 24.575 -4.653 1085 HB3 ASN 739 HB1 ASN 739 28.811 24.170 -6.142 1086 HD21 ASN 739 HD21 ASN 739 28.662 21.259 -5.374 1087 HD22 ASN 739 HD22 ASN 739 27.038 20.792 -5.746 1088 H GLN 740 HN GLN 740 29.709 24.862 -2.511 1089 HA GLN 740 HA GLN 740 31.500 26.772 -3.505 1090 HB2 GLN 740 HB2 GLN 740 30.000 27.236 -1.650 1091 HB3 GLN 740 HB1 GLN 740 30.803 26.027 -0.662 1092 HG2 GLN 740 HG2 GLN 740 32.846 27.378 -0.687 1093 HG3 GLN 740 HG1 GLN 740 32.012 28.598 -1.651 1094 HE21 GLN 740 HE21 GLN 740 33.216 28.756 1.018 1095 HE22 GLN 740 HE22 GLN 740 31.953 29.309 2.067 1096 H LEU 741 HN LEU 741 32.019 23.908 -1.502 1097 HA LEU 741 HA LEU 741 34.797 24.355 -1.097 1098 HB2 LEU 741 HB2 LEU 741 33.198 21.798 -0.948 1099 HB3 LEU 741 HB1 LEU 741 34.856 21.972 -0.409 1100 HG LEU 741 HG LEU 741 32.452 23.366 0.766 1101 HD11 LEU 741 HD11 LEU 741 32.908 21.990 2.730 1102 HD12 LEU 741 HD12 LEU 741 34.213 21.181 1.862 1103 HD13 LEU 741 HD13 LEU 741 32.546 21.001 1.316 1104 HD21 LEU 741 HD21 LEU 741 34.410 24.797 0.887 1105 HD22 LEU 741 HD22 LEU 741 35.361 23.475 1.564 1106 HD23 LEU 741 HD23 LEU 741 34.022 24.159 2.485 1107 H GLY 742 HN GLY 742 32.904 22.749 -3.592 1108 HA2 GLY 742 HA2 GLY 742 35.035 21.421 -4.868 1109 HA3 GLY 742 HA1 GLY 742 33.498 21.864 -5.599 1110 H LEU 743 HN LEU 743 33.957 24.745 -4.909 1111 HA LEU 743 HA LEU 743 35.256 25.494 -7.321 1112 HB2 LEU 743 HB2 LEU 743 34.508 27.193 -4.939 1113 HB3 LEU 743 HB1 LEU 743 34.933 27.790 -6.529 1114 HG LEU 743 HG LEU 743 32.485 26.153 -5.860 1115 HD11 LEU 743 HD11 LEU 743 31.254 28.201 -6.335 1116 HD12 LEU 743 HD12 LEU 743 32.772 29.063 -6.584 1117 HD13 LEU 743 HD13 LEU 743 32.372 28.424 -4.990 1118 HD21 LEU 743 HD21 LEU 743 31.798 26.665 -8.168 1119 HD22 LEU 743 HD22 LEU 743 33.256 25.675 -8.109 1120 HD23 LEU 743 HD23 LEU 743 33.375 27.399 -8.460 1121 H ALA 744 HN ALA 744 36.182 25.305 -3.950 1122 HA ALA 744 HA ALA 744 38.666 26.644 -4.171 1123 HB1 ALA 744 HB1 ALA 744 39.213 25.568 -2.035 1124 HB2 ALA 744 HB2 ALA 744 37.810 24.512 -2.207 1125 HB3 ALA 744 HB3 ALA 744 37.587 26.250 -2.009 1126 H LEU 745 HN LEU 745 37.595 23.382 -4.762 1127 HA LEU 745 HA LEU 745 40.151 22.182 -5.037 1128 HB2 LEU 745 HB2 LEU 745 37.894 21.009 -4.736 1129 HB3 LEU 745 HB1 LEU 745 37.605 21.341 -6.424 1130 HG LEU 745 HG LEU 745 40.041 19.788 -5.598 1131 HD11 LEU 745 HD11 LEU 745 38.749 17.736 -5.877 1132 HD12 LEU 745 HD12 LEU 745 37.276 18.689 -6.056 1133 HD13 LEU 745 HD13 LEU 745 38.152 18.699 -4.525 1134 HD21 LEU 745 HD21 LEU 745 39.877 20.571 -7.921 1135 HD22 LEU 745 HD22 LEU 745 38.318 19.761 -8.082 1136 HD23 LEU 745 HD23 LEU 745 39.782 18.813 -7.822 1137 H GLN 746 HN GLN 746 37.959 23.867 -7.206 1138 HA GLN 746 HA GLN 746 39.402 23.273 -9.594 1139 HB2 GLN 746 HB2 GLN 746 37.276 25.304 -8.916 1140 HB3 GLN 746 HB1 GLN 746 38.007 25.201 -10.512 1141 HG2 GLN 746 HG2 GLN 746 37.172 22.982 -10.823 1142 HG3 GLN 746 HG1 GLN 746 36.604 22.912 -9.157 1143 HE21 GLN 746 HE21 GLN 746 36.065 24.296 -12.317 1144 HE22 GLN 746 HE22 GLN 746 34.439 24.806 -12.021 1145 H GLN 747 HN GLN 747 39.176 26.087 -7.437 1146 HA GLN 747 HA GLN 747 40.974 27.768 -8.695 1147 HB2 GLN 747 HB2 GLN 747 39.609 28.494 -6.828 1148 HB3 GLN 747 HB1 GLN 747 40.437 27.387 -5.746 1149 HG2 GLN 747 HG2 GLN 747 42.496 28.657 -5.999 1150 HG3 GLN 747 HG1 GLN 747 41.692 29.751 -7.124 1151 HE21 GLN 747 HE21 GLN 747 40.227 31.239 -6.347 1152 HE22 GLN 747 HE22 GLN 747 40.093 31.624 -4.670 1153 H THR 748 HN THR 748 41.650 25.284 -6.235 1154 HA THR 748 HA THR 748 44.432 25.718 -6.151 1155 HB THR 748 HB THR 748 42.929 23.169 -5.499 1156 HG1 THR 748 HG1 THR 748 42.100 24.692 -4.158 1157 HG21 THR 748 HG21 THR 748 44.836 22.668 -4.053 1158 HG22 THR 748 HG22 THR 748 45.621 24.171 -4.537 1159 HG23 THR 748 HG23 THR 748 45.379 22.883 -5.717 1160 H GLU 749 HN GLU 749 42.409 23.653 -8.177 1161 HA GLU 749 HA GLU 749 44.546 22.203 -9.372 1162 HB2 GLU 749 HB2 GLU 749 41.947 21.759 -9.347 1163 HB3 GLU 749 HB1 GLU 749 41.970 22.729 -10.812 1164 HG2 GLU 749 HG2 GLU 749 42.098 20.503 -11.526 1165 HG3 GLU 749 HG1 GLU 749 43.738 21.136 -11.671 1166 H TYR 750 HN TYR 750 42.876 25.190 -10.084 1167 HA TYR 750 HA TYR 750 43.984 25.729 -12.629 1168 HB2 TYR 750 HB2 TYR 750 41.972 26.844 -11.752 1169 HB3 TYR 750 HB1 TYR 750 42.937 27.610 -10.500 1170 HD1 TYR 750 HD1 TYR 750 42.065 27.615 -14.055 1171 HD2 TYR 750 HD2 TYR 750 44.359 29.508 -11.016 1172 HE1 TYR 750 HE1 TYR 750 42.422 29.549 -15.531 1173 HE2 TYR 750 HE2 TYR 750 44.723 31.440 -12.485 1174 HH TYR 750 HH TYR 750 44.717 31.954 -14.893 1175 H LEU 751 HN LEU 751 44.914 26.630 -9.345 1176 HA LEU 751 HA LEU 751 47.204 28.139 -10.094 1177 HB2 LEU 751 HB2 LEU 751 46.510 26.783 -7.486 1178 HB3 LEU 751 HB1 LEU 751 47.845 27.895 -7.703 1179 HG LEU 751 HG LEU 751 44.931 28.605 -8.047 1180 HD11 LEU 751 HD11 LEU 751 45.468 28.125 -5.725 1181 HD12 LEU 751 HD12 LEU 751 45.209 29.853 -5.964 1182 HD13 LEU 751 HD13 LEU 751 46.847 29.221 -5.804 1183 HD21 LEU 751 HD21 LEU 751 47.424 30.303 -8.069 1184 HD22 LEU 751 HD22 LEU 751 45.772 30.917 -8.084 1185 HD23 LEU 751 HD23 LEU 751 46.371 29.970 -9.445 1186 H GLN 752 HN GLN 752 46.553 24.789 -9.624 1187 HA GLN 752 HA GLN 752 47.749 22.894 -9.830 1188 HB2 GLN 752 HB2 GLN 752 48.345 23.975 -12.033 1189 HB3 GLN 752 HB1 GLN 752 49.820 24.556 -11.274 1190 HG2 GLN 752 HG2 GLN 752 50.442 22.199 -10.805 1191 HG3 GLN 752 HG1 GLN 752 49.020 21.688 -11.710 1192 HE21 GLN 752 HE21 GLN 752 51.810 21.146 -12.234 1193 HE22 GLN 752 HE22 GLN 752 52.150 21.773 -13.810 1194 H GLN 753 HN GLN 753 48.027 22.898 -7.582 1195 HA GLN 753 HA GLN 753 50.317 24.082 -6.374 1196 HB2 GLN 753 HB2 GLN 753 48.261 23.786 -5.112 1197 HB3 GLN 753 HB1 GLN 753 48.361 22.043 -5.313 1198 HG2 GLN 753 HG2 GLN 753 50.269 21.908 -3.910 1199 HG3 GLN 753 HG1 GLN 753 50.454 23.661 -3.892 1200 HE21 GLN 753 HE21 GLN 753 49.113 24.890 -2.631 1201 HE22 GLN 753 HE22 GLN 753 48.092 24.220 -1.400 1202 H VAL 754 HN VAL 754 52.247 23.391 -6.782 1203 HA VAL 754 HA VAL 754 52.790 20.509 -6.664 1204 HB VAL 754 HB VAL 754 54.159 22.494 -8.500 1205 HG11 VAL 754 HG11 VAL 754 55.636 20.715 -7.721 1206 HG12 VAL 754 HG12 VAL 754 55.288 20.550 -9.441 1207 HG13 VAL 754 HG13 VAL 754 54.479 19.504 -8.274 1208 HG21 VAL 754 HG21 VAL 754 51.900 22.019 -9.271 1209 HG22 VAL 754 HG22 VAL 754 52.218 20.288 -9.174 1210 HG23 VAL 754 HG23 VAL 754 53.091 21.280 -10.341 1211 HHA CYC 800 HHA CYC 800 19.527 2.448 -3.331 1212 HMA1 CYC 800 HMA1 CYC 800 22.685 6.529 -0.681 1213 HMA2 CYC 800 HMA2 CYC 800 21.632 7.012 -2.064 1214 HMA3 CYC 800 HMA3 CYC 800 23.411 6.914 -2.292 1215 HAA1 CYC 800 HAA1 CYC 800 19.173 4.420 -2.432 1216 HAA2 CYC 800 HAA2 CYC 800 19.924 5.789 -1.559 1217 HBA1 CYC 800 HBA1 CYC 800 20.577 6.794 -3.833 1218 HBA2 CYC 800 HBA2 CYC 800 18.800 6.663 -3.551 1219 HHB CYC 800 HHB CYC 800 25.614 4.019 -2.636 1220 HB CYC 800 HB CYC 800 23.829 5.802 0.346 1221 HMB1 CYC 800 HMB1 CYC 800 27.759 3.941 -1.780 1222 HMB2 CYC 800 HMB2 CYC 800 27.974 5.631 -2.414 1223 HMB3 CYC 800 HMB3 CYC 800 28.939 5.067 -0.979 1224 HAB1 CYC 800 HAB1 CYC 800 29.079 6.292 0.905 1225 HAB2 CYC 800 HAB2 CYC 800 28.030 6.654 2.346 1226 HBB1 CYC 800 HBB1 CYC 800 29.081 8.783 1.399 1227 HBB2 CYC 800 HBB2 CYC 800 28.293 8.452 -0.187 1228 HBB3 CYC 800 HBB3 CYC 800 27.285 8.813 1.267 1229 HC CYC 800 HC CYC 800 23.719 -0.660 -1.645 1230 H2C CYC 800 H2C CYC 800 26.133 -3.728 -0.643 1231 H3C CYC 800 H3C CYC 800 24.895 -4.128 -3.366 1232 HMC1 CYC 800 HMC1 CYC 800 27.400 -4.075 -2.819 1233 HMC2 CYC 800 HMC2 CYC 800 26.767 -2.505 -3.437 1234 HMC3 CYC 800 HMC3 CYC 800 27.910 -2.527 -2.041 1235 HAC1 CYC 800 HAC CYC 800 24.656 -5.777 -1.634 1236 HBC1 CYC 800 HBC1 CYC 800 22.787 -5.458 -3.281 1237 HBC2 CYC 800 HBC2 CYC 800 21.867 -4.524 -2.042 1238 HBC3 CYC 800 HBC3 CYC 800 22.271 -6.260 -1.758 1239 HHD CYC 800 HHD CYC 800 22.224 -3.395 -3.725 1240 HD CYC 800 HD CYC 800 22.824 0.304 -2.959 1241 HMD1 CYC 800 HMD1 CYC 800 19.968 -3.627 -3.251 1242 HMD2 CYC 800 HMD2 CYC 800 18.424 -2.713 -3.052 1243 HMD3 CYC 800 HMD3 CYC 800 19.160 -2.894 -4.692 1244 HAD1 CYC 800 HAD1 CYC 800 18.077 1.150 -3.888 1245 HAD2 CYC 800 HAD2 CYC 800 17.660 -0.588 -4.056 1246 HBD1 CYC 800 HBD1 CYC 800 16.431 0.397 -2.129 1247 HBD2 CYC 800 HBD2 CYC 800 17.638 -0.814 -1.527 1248 HA CYC 800 HA CYC 800 23.539 2.186 -2.942 Start of MODEL 2 1 H SER 599 HT1 SER 599 46.211 17.399 3.202 2 HA SER 599 HA SER 599 48.273 18.574 1.431 3 HB2 SER 599 HB2 SER 599 45.502 17.595 0.716 4 HB3 SER 599 HB1 SER 599 46.733 18.199 -0.392 5 HG SER 599 HG SER 599 46.368 15.746 0.159 6 H ASP 600 HN ASP 600 47.592 20.568 0.417 7 HA ASP 600 HA ASP 600 46.672 22.474 2.233 8 HB2 ASP 600 HB2 ASP 600 48.088 23.120 0.411 9 HB3 ASP 600 HB1 ASP 600 46.902 22.583 -0.773 10 H VAL 601 HN VAL 601 44.956 21.443 -0.738 11 HA VAL 601 HA VAL 601 42.552 22.743 -0.073 12 HB VAL 601 HB VAL 601 43.056 22.077 -2.379 13 HG11 VAL 601 HG11 VAL 601 42.660 19.244 -1.432 14 HG12 VAL 601 HG12 VAL 601 44.171 19.965 -1.986 15 HG13 VAL 601 HG13 VAL 601 42.833 19.746 -3.113 16 HG21 VAL 601 HG21 VAL 601 40.549 20.775 -1.317 17 HG22 VAL 601 HG22 VAL 601 40.855 21.172 -3.008 18 HG23 VAL 601 HG23 VAL 601 40.727 22.460 -1.808 19 H GLU 602 HN GLU 602 43.773 19.580 0.660 20 HA GLU 602 HA GLU 602 41.453 18.348 1.633 21 HB2 GLU 602 HB2 GLU 602 43.489 17.122 1.142 22 HB3 GLU 602 HB1 GLU 602 44.353 18.003 2.390 23 HG2 GLU 602 HG2 GLU 602 42.787 16.979 4.055 24 HG3 GLU 602 HG1 GLU 602 42.185 15.959 2.745 25 H GLU 603 HN GLU 603 43.894 20.382 3.186 26 HA GLU 603 HA GLU 603 42.894 20.170 5.810 27 HB2 GLU 603 HB2 GLU 603 45.176 20.980 5.131 28 HB3 GLU 603 HB1 GLU 603 44.423 22.489 4.639 29 HG2 GLU 603 HG2 GLU 603 43.678 22.880 6.910 30 HG3 GLU 603 HG1 GLU 603 44.378 21.343 7.417 31 H ILE 604 HN ILE 604 42.288 22.467 3.183 32 HA ILE 604 HA ILE 604 40.627 24.269 4.526 33 HB ILE 604 HB ILE 604 40.304 23.336 1.657 34 HG12 ILE 604 HG12 ILE 604 42.613 24.048 2.048 35 HG13 ILE 604 HG11 ILE 604 41.774 25.223 1.044 36 HG21 ILE 604 HG21 ILE 604 39.328 25.548 1.266 37 HG22 ILE 604 HG22 ILE 604 39.497 25.924 2.980 38 HG23 ILE 604 HG23 ILE 604 38.409 24.635 2.464 39 HD11 ILE 604 HD11 ILE 604 41.474 26.658 3.012 40 HD12 ILE 604 HD12 ILE 604 43.173 26.330 2.670 41 HD13 ILE 604 HD13 ILE 604 42.359 25.483 3.984 42 H PHE 605 HN PHE 605 39.897 21.249 2.887 43 HA PHE 605 HA PHE 605 37.123 21.203 3.321 44 HB2 PHE 605 HB2 PHE 605 39.180 19.289 2.490 45 HB3 PHE 605 HB1 PHE 605 37.831 18.550 3.343 46 HD1 PHE 605 HD1 PHE 605 38.586 20.878 0.539 47 HD2 PHE 605 HD2 PHE 605 35.908 18.028 2.210 48 HE1 PHE 605 HE1 PHE 605 37.246 20.936 -1.526 49 HE2 PHE 605 HE2 PHE 605 34.561 18.076 0.149 50 HZ PHE 605 HZ PHE 605 35.229 19.533 -1.722 51 H LYS 606 HN LYS 606 39.774 19.752 5.176 52 HA LYS 606 HA LYS 606 38.205 18.565 7.180 53 HB2 LYS 606 HB2 LYS 606 41.054 19.553 7.316 54 HB3 LYS 606 HB1 LYS 606 40.291 18.525 8.520 55 HG2 LYS 606 HG2 LYS 606 40.017 16.758 6.894 56 HG3 LYS 606 HG1 LYS 606 40.662 17.796 5.623 57 HD2 LYS 606 HD2 LYS 606 42.395 16.292 6.358 58 HD3 LYS 606 HD1 LYS 606 42.792 17.930 6.878 59 HE2 LYS 606 HE2 LYS 606 41.981 17.436 9.118 60 HE3 LYS 606 HE1 LYS 606 41.503 15.819 8.606 61 HZ1 LYS 606 HZ1 LYS 606 43.615 15.811 9.779 62 HZ2 LYS 606 HZ2 LYS 606 44.284 16.859 8.635 63 HZ3 LYS 606 HZ3 LYS 606 43.816 15.303 8.180 64 H THR 607 HN THR 607 39.230 21.853 6.781 65 HA THR 607 HA THR 607 38.668 22.630 9.488 66 HB THR 607 HB THR 607 38.889 24.395 7.032 67 HG1 THR 607 HG1 THR 607 40.779 23.042 7.427 68 HG21 THR 607 HG21 THR 607 37.913 25.495 9.006 69 HG22 THR 607 HG22 THR 607 39.513 26.138 8.637 70 HG23 THR 607 HG23 THR 607 39.306 24.999 9.968 71 H THR 608 HN THR 608 36.926 22.514 6.464 72 HA THR 608 HA THR 608 34.702 24.043 7.487 73 HB THR 608 HB THR 608 34.882 22.551 4.861 74 HG1 THR 608 HG1 THR 608 36.543 24.002 4.769 75 HG21 THR 608 HG21 THR 608 32.618 23.264 5.500 76 HG22 THR 608 HG22 THR 608 33.210 24.210 4.134 77 HG23 THR 608 HG23 THR 608 33.203 24.908 5.753 78 H THR 609 HN THR 609 35.512 20.679 6.928 79 HA THR 609 HA THR 609 33.023 19.490 6.999 80 HB THR 609 HB THR 609 34.200 17.496 8.095 81 HG1 THR 609 HG1 THR 609 35.978 18.172 9.072 82 HG21 THR 609 HG21 THR 609 35.358 18.687 5.573 83 HG22 THR 609 HG22 THR 609 33.903 17.696 5.677 84 HG23 THR 609 HG23 THR 609 35.477 16.996 6.056 85 H GLN 610 HN GLN 610 34.981 20.464 9.824 86 HA GLN 610 HA GLN 610 33.042 19.486 11.676 87 HB2 GLN 610 HB2 GLN 610 35.451 21.259 11.968 88 HB3 GLN 610 HB1 GLN 610 34.334 21.038 13.304 89 HG2 GLN 610 HG2 GLN 610 36.101 19.509 13.633 90 HG3 GLN 610 HG1 GLN 610 34.716 18.566 13.088 91 HE21 GLN 610 HE21 GLN 610 37.878 19.705 12.334 92 HE22 GLN 610 HE22 GLN 610 38.109 18.753 10.912 93 H GLU 611 HN GLU 611 33.616 22.558 10.096 94 HA GLU 611 HA GLU 611 31.885 24.095 11.711 95 HB2 GLU 611 HB2 GLU 611 33.588 25.093 10.242 96 HB3 GLU 611 HB1 GLU 611 32.686 24.550 8.835 97 HG2 GLU 611 HG2 GLU 611 30.836 25.984 9.424 98 HG3 GLU 611 HG1 GLU 611 31.662 26.477 10.902 99 H VAL 612 HN VAL 612 31.364 22.502 8.564 100 HA VAL 612 HA VAL 612 28.631 23.225 8.372 101 HB VAL 612 HB VAL 612 29.941 22.497 6.402 102 HG11 VAL 612 HG11 VAL 612 29.802 19.747 7.619 103 HG12 VAL 612 HG12 VAL 612 31.254 20.724 7.396 104 HG13 VAL 612 HG13 VAL 612 30.370 20.122 5.992 105 HG21 VAL 612 HG21 VAL 612 27.518 22.410 6.286 106 HG22 VAL 612 HG22 VAL 612 27.529 20.772 6.939 107 HG23 VAL 612 HG23 VAL 612 28.229 21.094 5.352 108 H ARG 613 HN ARG 613 30.317 20.622 9.926 109 HA ARG 613 HA ARG 613 28.222 18.857 10.474 110 HB2 ARG 613 HB2 ARG 613 30.542 18.268 10.842 111 HB3 ARG 613 HB1 ARG 613 30.715 19.539 12.037 112 HG2 ARG 613 HG2 ARG 613 29.132 18.349 13.493 113 HG3 ARG 613 HG1 ARG 613 29.047 17.050 12.297 114 HD2 ARG 613 HD2 ARG 613 31.412 16.621 12.539 115 HD3 ARG 613 HD1 ARG 613 31.578 17.992 13.634 116 HE ARG 613 HE ARG 613 29.671 16.142 14.614 117 HH11 ARG 613 HH11 ARG 613 33.131 16.603 14.250 118 HH12 ARG 613 HH12 ARG 613 33.536 15.617 15.607 119 HH21 ARG 613 HH21 ARG 613 30.205 14.807 16.421 120 HH22 ARG 613 HH22 ARG 613 31.878 14.607 16.839 121 H GLN 614 HN GLN 614 29.509 21.548 12.401 122 HA GLN 614 HA GLN 614 27.585 21.331 14.469 123 HB2 GLN 614 HB2 GLN 614 29.789 22.417 14.740 124 HB3 GLN 614 HB1 GLN 614 29.273 23.705 13.663 125 HG2 GLN 614 HG2 GLN 614 29.111 24.460 15.931 126 HG3 GLN 614 HG1 GLN 614 27.488 24.283 15.265 127 HE21 GLN 614 HE21 GLN 614 29.824 23.018 17.492 128 HE22 GLN 614 HE22 GLN 614 28.730 22.030 18.393 129 H LEU 615 HN LEU 615 27.819 23.316 11.556 130 HA LEU 615 HA LEU 615 25.651 25.020 12.033 131 HB2 LEU 615 HB2 LEU 615 27.485 25.125 10.226 132 HB3 LEU 615 HB1 LEU 615 26.461 24.055 9.296 133 HG LEU 615 HG LEU 615 25.516 26.753 10.274 134 HD11 LEU 615 HD11 LEU 615 26.033 27.604 8.045 135 HD12 LEU 615 HD12 LEU 615 26.783 26.064 7.628 136 HD13 LEU 615 HD13 LEU 615 27.489 27.078 8.888 137 HD21 LEU 615 HD21 LEU 615 24.554 24.969 8.035 138 HD22 LEU 615 HD22 LEU 615 23.865 26.524 8.499 139 HD23 LEU 615 HD23 LEU 615 23.771 25.153 9.605 140 H LEU 616 HN LEU 616 25.758 21.912 10.294 141 HA LEU 616 HA LEU 616 22.920 21.937 9.818 142 HB2 LEU 616 HB2 LEU 616 25.154 20.081 9.204 143 HB3 LEU 616 HB1 LEU 616 23.542 19.401 9.260 144 HG LEU 616 HG LEU 616 24.229 19.987 6.974 145 HD11 LEU 616 HD11 LEU 616 22.233 21.228 6.338 146 HD12 LEU 616 HD12 LEU 616 21.979 21.699 8.017 147 HD13 LEU 616 HD13 LEU 616 21.865 20.002 7.550 148 HD21 LEU 616 HD21 LEU 616 25.675 21.889 7.487 149 HD22 LEU 616 HD22 LEU 616 24.271 22.829 7.988 150 HD23 LEU 616 HD23 LEU 616 24.442 22.329 6.306 151 H ARG 617 HN ARG 617 24.582 21.444 12.587 152 HA ARG 617 HA ARG 617 24.065 20.556 14.630 153 HB2 ARG 617 HB2 ARG 617 21.330 20.029 13.428 154 HB3 ARG 617 HB1 ARG 617 21.720 20.093 15.139 155 HG2 ARG 617 HG2 ARG 617 22.147 22.457 15.001 156 HG3 ARG 617 HG1 ARG 617 21.945 22.426 13.248 157 HD2 ARG 617 HD2 ARG 617 19.799 21.710 15.246 158 HD3 ARG 617 HD1 ARG 617 19.947 23.276 14.453 159 HE ARG 617 HE ARG 617 19.837 21.577 12.363 160 HH11 ARG 617 HH11 ARG 617 17.802 21.912 15.204 161 HH12 ARG 617 HH12 ARG 617 16.364 21.391 14.396 162 HH21 ARG 617 HH21 ARG 617 17.930 20.876 11.282 163 HH22 ARG 617 HH22 ARG 617 16.440 20.803 12.167 164 H CYS 618 HN CYS 618 25.365 18.902 12.808 165 HA CYS 618 HA CYS 618 24.081 16.270 13.141 166 HB2 CYS 618 HB2 CYS 618 24.407 17.106 10.799 167 HB3 CYS 618 HB1 CYS 618 26.142 17.092 11.086 168 HG CYS 618 HG CYS 618 26.410 14.713 10.173 169 H ASP 619 HN ASP 619 25.627 14.413 13.389 170 HA ASP 619 HA ASP 619 27.933 15.193 15.090 171 HB2 ASP 619 HB2 ASP 619 25.882 13.722 15.900 172 HB3 ASP 619 HB1 ASP 619 26.842 12.439 15.163 173 H ARG 620 HN ARG 620 26.953 13.221 12.339 174 HA ARG 620 HA ARG 620 29.822 12.800 11.844 175 HB2 ARG 620 HB2 ARG 620 28.864 10.644 12.355 176 HB3 ARG 620 HB1 ARG 620 27.538 10.916 11.237 177 HG2 ARG 620 HG2 ARG 620 29.029 10.809 9.354 178 HG3 ARG 620 HG1 ARG 620 30.425 10.701 10.421 179 HD2 ARG 620 HD2 ARG 620 29.717 8.536 11.214 180 HD3 ARG 620 HD1 ARG 620 28.202 8.660 10.318 181 HE ARG 620 HE ARG 620 29.298 8.005 8.426 182 HH11 ARG 620 HH11 ARG 620 31.702 8.867 10.840 183 HH12 ARG 620 HH12 ARG 620 33.053 8.474 9.822 184 HH21 ARG 620 HH21 ARG 620 31.122 7.449 7.094 185 HH22 ARG 620 HH22 ARG 620 32.726 7.703 7.704 186 H VAL 621 HN VAL 621 30.590 13.550 10.005 187 HA VAL 621 HA VAL 621 28.822 14.047 7.718 188 HB VAL 621 HB VAL 621 30.771 16.105 8.826 189 HG11 VAL 621 HG11 VAL 621 30.033 17.538 6.973 190 HG12 VAL 621 HG12 VAL 621 29.065 16.208 6.339 191 HG13 VAL 621 HG13 VAL 621 30.822 16.071 6.392 192 HG21 VAL 621 HG21 VAL 621 28.786 17.535 9.071 193 HG22 VAL 621 HG22 VAL 621 28.677 16.079 10.061 194 HG23 VAL 621 HG23 VAL 621 27.766 16.193 8.556 195 H ALA 622 HN ALA 622 29.754 13.259 5.885 196 HA ALA 622 HA ALA 622 32.663 12.842 5.972 197 HB1 ALA 622 HB1 ALA 622 32.408 10.664 4.949 198 HB2 ALA 622 HB2 ALA 622 30.656 10.867 4.904 199 HB3 ALA 622 HB3 ALA 622 31.489 10.739 6.454 200 H VAL 623 HN VAL 623 33.652 12.520 3.913 201 HA VAL 623 HA VAL 623 32.261 13.839 1.675 202 HB VAL 623 HB VAL 623 35.178 14.220 2.440 203 HG11 VAL 623 HG11 VAL 623 34.829 14.219 0.030 204 HG12 VAL 623 HG12 VAL 623 35.245 15.830 0.614 205 HG13 VAL 623 HG13 VAL 623 33.573 15.444 0.205 206 HG21 VAL 623 HG21 VAL 623 32.871 16.151 2.540 207 HG22 VAL 623 HG22 VAL 623 34.563 16.568 2.795 208 HG23 VAL 623 HG23 VAL 623 33.742 15.485 3.924 209 H TYR 624 HN TYR 624 32.626 12.869 -0.353 210 HA TYR 624 HA TYR 624 34.363 10.515 -0.311 211 HB2 TYR 624 HB2 TYR 624 31.655 10.585 -1.649 212 HB3 TYR 624 HB1 TYR 624 32.711 9.194 -1.428 213 HD1 TYR 624 HD1 TYR 624 29.824 10.709 -0.281 214 HD2 TYR 624 HD2 TYR 624 33.319 8.785 1.165 215 HE1 TYR 624 HE1 TYR 624 28.660 10.188 1.808 216 HE2 TYR 624 HE2 TYR 624 32.167 8.261 3.262 217 HH TYR 624 HH TYR 624 30.304 9.071 4.573 218 H ARG 625 HN ARG 625 35.260 10.004 -2.319 219 HA ARG 625 HA ARG 625 34.840 12.028 -4.406 220 HB2 ARG 625 HB2 ARG 625 36.967 12.481 -3.300 221 HB3 ARG 625 HB1 ARG 625 37.471 10.813 -3.541 222 HG2 ARG 625 HG2 ARG 625 37.384 11.167 -5.977 223 HG3 ARG 625 HG1 ARG 625 36.965 12.856 -5.692 224 HD2 ARG 625 HD2 ARG 625 39.084 13.182 -4.515 225 HD3 ARG 625 HD1 ARG 625 39.500 11.489 -4.790 226 HE ARG 625 HE ARG 625 38.893 12.815 -7.227 227 HH11 ARG 625 HH11 ARG 625 41.450 12.477 -4.837 228 HH12 ARG 625 HH12 ARG 625 42.714 12.787 -5.971 229 HH21 ARG 625 HH21 ARG 625 40.556 13.254 -8.709 230 HH22 ARG 625 HH22 ARG 625 42.205 13.243 -8.188 231 H PHE 626 HN PHE 626 34.583 11.253 -6.421 232 HA PHE 626 HA PHE 626 34.569 8.372 -6.701 233 HB2 PHE 626 HB2 PHE 626 33.662 10.604 -8.524 234 HB3 PHE 626 HB1 PHE 626 33.665 8.912 -9.007 235 HD1 PHE 626 HD1 PHE 626 31.802 11.500 -7.491 236 HD2 PHE 626 HD2 PHE 626 32.361 7.283 -7.472 237 HE1 PHE 626 HE1 PHE 626 29.580 11.213 -6.476 238 HE2 PHE 626 HE2 PHE 626 30.140 6.986 -6.459 239 HZ PHE 626 HZ PHE 626 28.745 8.954 -5.960 240 H ASN 627 HN ASN 627 36.265 7.368 -7.328 241 HA ASN 627 HA ASN 627 38.426 8.726 -8.703 242 HB2 ASN 627 HB2 ASN 627 39.589 6.464 -8.333 243 HB3 ASN 627 HB1 ASN 627 39.131 7.324 -6.872 244 HD21 ASN 627 HD21 ASN 627 39.077 5.504 -5.604 245 HD22 ASN 627 HD22 ASN 627 37.870 4.267 -5.793 246 HA PRO 628 HA PRO 628 37.691 7.203 -12.829 247 HB2 PRO 628 HB2 PRO 628 39.802 5.434 -13.303 248 HB3 PRO 628 HB1 PRO 628 39.833 7.179 -13.577 249 HG2 PRO 628 HG2 PRO 628 40.816 5.610 -11.229 250 HG3 PRO 628 HG1 PRO 628 41.553 7.011 -12.029 251 HD2 PRO 628 HD2 PRO 628 40.298 7.322 -9.728 252 HD3 PRO 628 HD1 PRO 628 40.073 8.511 -11.022 253 H ASN 629 HN ASN 629 37.758 5.005 -10.246 254 HA ASN 629 HA ASN 629 36.731 2.793 -11.892 255 HB2 ASN 629 HB2 ASN 629 37.567 2.706 -8.988 256 HB3 ASN 629 HB1 ASN 629 37.244 1.336 -10.043 257 HD21 ASN 629 HD21 ASN 629 38.807 0.714 -11.537 258 HD22 ASN 629 HD22 ASN 629 40.424 1.317 -11.497 259 H TRP 630 HN TRP 630 35.782 5.286 -9.820 260 HA TRP 630 HA TRP 630 33.907 5.849 -8.677 261 HB2 TRP 630 HB2 TRP 630 32.708 3.985 -10.736 262 HB3 TRP 630 HB1 TRP 630 31.734 4.947 -9.629 263 HD1 TRP 630 HD1 TRP 630 31.896 7.660 -9.930 264 HE1 TRP 630 HE1 TRP 630 32.353 9.073 -12.028 265 HE3 TRP 630 HE3 TRP 630 33.949 4.047 -12.913 266 HZ2 TRP 630 HZ2 TRP 630 33.434 8.713 -14.603 267 HZ3 TRP 630 HZ3 TRP 630 34.668 4.668 -15.184 268 HH2 TRP 630 HH2 TRP 630 34.415 6.951 -16.009 269 H THR 631 HN THR 631 35.404 4.021 -7.334 270 HA THR 631 HA THR 631 33.676 1.850 -6.489 271 HB THR 631 HB THR 631 35.657 1.167 -5.117 272 HG1 THR 631 HG1 THR 631 37.573 2.287 -5.428 273 HG21 THR 631 HG21 THR 631 36.054 1.646 -8.058 274 HG22 THR 631 HG22 THR 631 35.274 0.247 -7.323 275 HG23 THR 631 HG23 THR 631 37.004 0.520 -7.087 276 H GLY 632 HN GLY 632 33.828 4.956 -5.598 277 HA2 GLY 632 HA2 GLY 632 32.849 6.029 -3.782 278 HA3 GLY 632 HA1 GLY 632 32.508 4.442 -3.097 279 H GLU 633 HN GLU 633 35.177 6.703 -3.685 280 HA GLU 633 HA GLU 633 36.736 5.383 -1.609 281 HB2 GLU 633 HB2 GLU 633 37.661 5.940 -3.881 282 HB3 GLU 633 HB1 GLU 633 37.513 7.635 -3.457 283 HG2 GLU 633 HG2 GLU 633 39.095 7.331 -1.639 284 HG3 GLU 633 HG1 GLU 633 39.220 5.614 -2.028 285 H PHE 634 HN PHE 634 36.971 6.204 0.362 286 HA PHE 634 HA PHE 634 35.721 8.720 1.081 287 HB2 PHE 634 HB2 PHE 634 37.082 6.547 2.686 288 HB3 PHE 634 HB1 PHE 634 36.524 8.045 3.412 289 HD1 PHE 634 HD1 PHE 634 34.972 5.688 0.945 290 HD2 PHE 634 HD2 PHE 634 34.697 7.615 4.734 291 HE1 PHE 634 HE1 PHE 634 32.771 4.654 1.311 292 HE2 PHE 634 HE2 PHE 634 32.498 6.582 5.101 293 HZ PHE 634 HZ PHE 634 31.533 5.102 3.394 294 H VAL 635 HN VAL 635 36.807 10.589 1.095 295 HA VAL 635 HA VAL 635 39.721 10.471 1.066 296 HB VAL 635 HB VAL 635 39.592 12.938 0.493 297 HG11 VAL 635 HG11 VAL 635 38.261 10.991 -1.382 298 HG12 VAL 635 HG12 VAL 635 39.997 11.217 -1.180 299 HG13 VAL 635 HG13 VAL 635 39.009 12.519 -1.843 300 HG21 VAL 635 HG21 VAL 635 36.663 12.284 0.131 301 HG22 VAL 635 HG22 VAL 635 37.455 13.768 -0.400 302 HG23 VAL 635 HG23 VAL 635 37.339 13.397 1.320 303 H ALA 636 HN ALA 636 37.116 12.091 2.850 304 HA ALA 636 HA ALA 636 38.645 12.042 5.270 305 HB1 ALA 636 HB1 ALA 636 38.046 14.734 4.015 306 HB2 ALA 636 HB2 ALA 636 39.649 14.017 4.188 307 HB3 ALA 636 HB3 ALA 636 38.725 14.466 5.621 308 H GLU 637 HN GLU 637 37.367 12.748 7.091 309 HA GLU 637 HA GLU 637 34.647 13.525 6.673 310 HB2 GLU 637 HB2 GLU 637 33.694 11.527 7.816 311 HB3 GLU 637 HB1 GLU 637 34.336 11.202 6.215 312 HG2 GLU 637 HG2 GLU 637 36.249 10.130 7.102 313 HG3 GLU 637 HG1 GLU 637 35.883 10.688 8.735 314 H SER 638 HN SER 638 33.465 13.185 8.906 315 HA SER 638 HA SER 638 35.233 13.631 11.158 316 HB2 SER 638 HB2 SER 638 33.892 15.687 11.786 317 HB3 SER 638 HB1 SER 638 34.954 15.887 10.394 318 HG SER 638 HG SER 638 32.885 15.185 9.215 319 H VAL 639 HN VAL 639 34.474 12.495 12.821 320 HA VAL 639 HA VAL 639 31.606 12.249 13.221 321 HB VAL 639 HB VAL 639 32.224 10.273 11.857 322 HG11 VAL 639 HG11 VAL 639 34.548 10.036 12.511 323 HG12 VAL 639 HG12 VAL 639 33.670 8.529 12.782 324 HG13 VAL 639 HG13 VAL 639 34.056 9.580 14.143 325 HG21 VAL 639 HG21 VAL 639 31.546 9.581 14.716 326 HG22 VAL 639 HG22 VAL 639 31.273 8.547 13.314 327 HG23 VAL 639 HG23 VAL 639 30.401 10.072 13.470 328 H ALA 640 HN ALA 640 31.040 11.881 15.361 329 HA ALA 640 HA ALA 640 32.873 12.735 17.318 330 HB1 ALA 640 HB1 ALA 640 30.280 11.265 17.784 331 HB2 ALA 640 HB2 ALA 640 30.378 12.986 17.415 332 HB3 ALA 640 HB3 ALA 640 31.110 12.356 18.900 333 H HIS 641 HN HIS 641 34.223 11.639 18.601 334 HA HIS 641 HA HIS 641 35.074 9.053 17.938 335 HB2 HIS 641 HB2 HIS 641 36.525 9.158 19.915 336 HB3 HIS 641 HB1 HIS 641 36.566 10.668 19.014 337 HD2 HIS 641 HD2 HIS 641 35.378 12.873 20.345 338 HE1 HIS 641 HE1 HIS 641 35.049 10.903 24.083 339 HE2 HIS 641 HE2 HIS 641 34.747 13.073 22.838 340 H THR 642 HN THR 642 32.442 9.963 19.845 341 HA THR 642 HA THR 642 32.309 7.849 21.692 342 HB THR 642 HB THR 642 29.964 9.292 20.448 343 HG1 THR 642 HG1 THR 642 31.007 10.314 22.790 344 HG21 THR 642 HG21 THR 642 28.982 8.996 22.696 345 HG22 THR 642 HG22 THR 642 30.426 8.119 23.201 346 HG23 THR 642 HG23 THR 642 29.382 7.451 21.948 347 H TRP 643 HN TRP 643 31.618 8.081 18.303 348 HA TRP 643 HA TRP 643 30.250 5.471 18.331 349 HB2 TRP 643 HB2 TRP 643 30.285 7.319 15.965 350 HB3 TRP 643 HB1 TRP 643 29.072 6.125 16.422 351 HD1 TRP 643 HD1 TRP 643 29.592 9.722 16.372 352 HE1 TRP 643 HE1 TRP 643 27.951 10.955 17.914 353 HE3 TRP 643 HE3 TRP 643 27.865 5.717 19.041 354 HZ2 TRP 643 HZ2 TRP 643 26.153 10.301 20.000 355 HZ3 TRP 643 HZ3 TRP 643 26.185 6.110 20.794 356 HH2 TRP 643 HH2 TRP 643 25.350 8.354 21.262 357 H VAL 644 HN VAL 644 30.616 4.738 15.733 358 HA VAL 644 HA VAL 644 33.220 3.709 15.682 359 HB VAL 644 HB VAL 644 31.473 2.554 14.477 360 HG11 VAL 644 HG11 VAL 644 30.070 4.450 13.882 361 HG12 VAL 644 HG12 VAL 644 30.409 3.450 12.470 362 HG13 VAL 644 HG13 VAL 644 31.263 4.978 12.695 363 HG21 VAL 644 HG21 VAL 644 33.714 2.277 13.589 364 HG22 VAL 644 HG22 VAL 644 33.495 3.677 12.539 365 HG23 VAL 644 HG23 VAL 644 32.528 2.223 12.284 366 H LYS 645 HN LYS 645 35.052 4.740 15.322 367 HA LYS 645 HA LYS 645 35.061 7.408 14.299 368 HB2 LYS 645 HB2 LYS 645 37.475 7.360 14.697 369 HB3 LYS 645 HB1 LYS 645 36.576 6.801 16.098 370 HG2 LYS 645 HG2 LYS 645 37.070 4.461 15.395 371 HG3 LYS 645 HG1 LYS 645 38.103 5.114 14.122 372 HD2 LYS 645 HD2 LYS 645 38.445 5.547 17.091 373 HD3 LYS 645 HD1 LYS 645 39.415 4.478 16.081 374 HE2 LYS 645 HE2 LYS 645 40.235 6.378 14.808 375 HE3 LYS 645 HE1 LYS 645 39.199 7.468 15.726 376 HZ1 LYS 645 HZ1 LYS 645 41.519 7.456 16.485 377 HZ2 LYS 645 HZ2 LYS 645 41.368 5.830 16.912 378 HZ3 LYS 645 HZ3 LYS 645 40.438 6.998 17.701 379 H LEU 646 HN LEU 646 35.772 4.258 13.025 380 HA LEU 646 HA LEU 646 36.093 3.464 10.939 381 HB2 LEU 646 HB2 LEU 646 34.279 5.254 10.482 382 HB3 LEU 646 HB1 LEU 646 35.587 6.191 9.788 383 HG LEU 646 HG LEU 646 36.020 4.271 8.225 384 HD11 LEU 646 HD11 LEU 646 33.413 3.293 9.381 385 HD12 LEU 646 HD12 LEU 646 34.982 2.488 9.476 386 HD13 LEU 646 HD13 LEU 646 34.173 2.662 7.919 387 HD21 LEU 646 HD21 LEU 646 33.286 5.536 8.114 388 HD22 LEU 646 HD22 LEU 646 34.144 4.806 6.757 389 HD23 LEU 646 HD23 LEU 646 34.784 6.257 7.527 390 H VAL 647 HN VAL 647 37.312 6.800 10.650 391 HA VAL 647 HA VAL 647 39.700 5.909 9.339 392 HB VAL 647 HB VAL 647 39.074 8.657 10.463 393 HG11 VAL 647 HG11 VAL 647 40.806 9.448 8.916 394 HG12 VAL 647 HG12 VAL 647 41.146 7.783 8.449 395 HG13 VAL 647 HG13 VAL 647 41.461 8.315 10.101 396 HG21 VAL 647 HG21 VAL 647 37.419 8.027 8.803 397 HG22 VAL 647 HG22 VAL 647 38.690 7.554 7.678 398 HG23 VAL 647 HG23 VAL 647 38.501 9.248 8.130 399 H GLY 648 HN GLY 648 40.823 4.604 10.650 400 HA2 GLY 648 HA2 GLY 648 42.656 5.645 12.457 401 HA3 GLY 648 HA1 GLY 648 41.307 5.016 13.396 402 HA PRO 649 HA PRO 649 43.020 0.961 12.988 403 HB2 PRO 649 HB2 PRO 649 40.785 -0.597 12.910 404 HB3 PRO 649 HB1 PRO 649 41.367 0.176 14.388 405 HG2 PRO 649 HG2 PRO 649 39.167 1.018 12.550 406 HG3 PRO 649 HG1 PRO 649 39.226 1.060 14.320 407 HD2 PRO 649 HD2 PRO 649 39.632 3.255 12.764 408 HD3 PRO 649 HD1 PRO 649 40.382 3.046 14.357 409 H ASP 650 HN ASP 650 40.204 1.475 10.877 410 HA ASP 650 HA ASP 650 41.321 -0.278 8.851 411 HB2 ASP 650 HB2 ASP 650 38.723 1.268 8.938 412 HB3 ASP 650 HB1 ASP 650 39.198 0.182 7.636 413 H ILE 651 HN ILE 651 40.044 3.038 8.929 414 HA ILE 651 HA ILE 651 40.684 4.966 7.913 415 HB ILE 651 HB ILE 651 43.166 3.468 7.021 416 HG12 ILE 651 HG12 ILE 651 42.785 5.440 9.287 417 HG13 ILE 651 HG11 ILE 651 42.935 3.698 9.481 418 HG21 ILE 651 HG21 ILE 651 42.671 5.380 5.576 419 HG22 ILE 651 HG22 ILE 651 44.110 5.679 6.552 420 HG23 ILE 651 HG23 ILE 651 42.575 6.431 6.989 421 HD11 ILE 651 HD11 ILE 651 45.194 3.791 8.564 422 HD12 ILE 651 HD12 ILE 651 45.021 4.831 9.978 423 HD13 ILE 651 HD13 ILE 651 45.038 5.536 8.362 424 H LYS 652 HN LYS 652 41.998 2.560 5.654 425 HA LYS 652 HA LYS 652 40.872 3.851 3.404 426 HB2 LYS 652 HB2 LYS 652 41.901 1.019 3.619 427 HB3 LYS 652 HB1 LYS 652 41.649 1.922 2.133 428 HG2 LYS 652 HG2 LYS 652 43.373 3.520 2.825 429 HG3 LYS 652 HG1 LYS 652 43.637 2.580 4.294 430 HD2 LYS 652 HD2 LYS 652 44.207 0.626 2.874 431 HD3 LYS 652 HD1 LYS 652 44.074 1.667 1.455 432 HE2 LYS 652 HE2 LYS 652 45.836 3.112 2.372 433 HE3 LYS 652 HE1 LYS 652 45.976 2.044 3.763 434 HZ1 LYS 652 HZ1 LYS 652 47.677 1.561 2.137 435 HZ2 LYS 652 HZ2 LYS 652 46.514 1.295 0.943 436 HZ3 LYS 652 HZ3 LYS 652 46.620 0.254 2.264 437 H THR 653 HN THR 653 38.740 4.042 3.402 438 HA THR 653 HA THR 653 37.147 1.598 3.639 439 HB THR 653 HB THR 653 36.187 4.426 4.141 440 HG1 THR 653 HG1 THR 653 37.747 3.841 5.706 441 HG21 THR 653 HG21 THR 653 35.009 1.723 4.841 442 HG22 THR 653 HG22 THR 653 34.425 2.801 3.575 443 HG23 THR 653 HG23 THR 653 34.308 3.284 5.266 444 H VAL 654 HN VAL 654 36.231 0.962 1.781 445 HA VAL 654 HA VAL 654 35.769 2.954 -0.331 446 HB VAL 654 HB VAL 654 36.291 -0.023 -0.651 447 HG11 VAL 654 HG11 VAL 654 35.051 0.959 -2.487 448 HG12 VAL 654 HG12 VAL 654 36.680 0.512 -2.995 449 HG13 VAL 654 HG13 VAL 654 36.288 2.200 -2.674 450 HG21 VAL 654 HG21 VAL 654 38.236 2.257 -0.987 451 HG22 VAL 654 HG22 VAL 654 38.543 0.579 -1.434 452 HG23 VAL 654 HG23 VAL 654 38.288 1.009 0.258 453 H TRP 655 HN TRP 655 33.721 2.620 -1.587 454 HA TRP 655 HA TRP 655 31.878 0.705 -0.399 455 HB2 TRP 655 HB2 TRP 655 31.604 2.882 0.855 456 HB3 TRP 655 HB1 TRP 655 31.170 3.642 -0.668 457 HD1 TRP 655 HD1 TRP 655 29.194 1.187 -1.649 458 HE1 TRP 655 HE1 TRP 655 26.871 1.007 -0.542 459 HE3 TRP 655 HE3 TRP 655 30.118 3.862 2.612 460 HZ2 TRP 655 HZ2 TRP 655 25.607 1.896 1.815 461 HZ3 TRP 655 HZ3 TRP 655 28.296 4.154 4.237 462 HH2 TRP 655 HH2 TRP 655 26.091 3.192 3.845 463 H GLU 656 HN GLU 656 31.851 -0.390 -2.298 464 HA GLU 656 HA GLU 656 31.453 1.071 -4.758 465 HB2 GLU 656 HB2 GLU 656 31.837 -1.882 -4.282 466 HB3 GLU 656 HB1 GLU 656 31.780 -1.096 -5.855 467 HG2 GLU 656 HG2 GLU 656 33.766 0.194 -5.282 468 HG3 GLU 656 HG1 GLU 656 33.825 -0.597 -3.710 469 H ASP 657 HN ASP 657 29.384 1.827 -4.565 470 HA ASP 657 HA ASP 657 27.228 -0.035 -4.168 471 HB2 ASP 657 HB2 ASP 657 26.972 2.269 -3.378 472 HB3 ASP 657 HB1 ASP 657 27.145 2.863 -5.030 473 H THR 658 HN THR 658 26.898 -1.428 -5.675 474 HA THR 658 HA THR 658 27.659 -1.186 -8.342 475 HB THR 658 HB THR 658 27.452 -3.352 -7.321 476 HG1 THR 658 HG1 THR 658 25.778 -2.798 -9.531 477 HG21 THR 658 HG21 THR 658 25.650 -2.928 -5.750 478 HG22 THR 658 HG22 THR 658 25.253 -4.327 -6.753 479 HG23 THR 658 HG23 THR 658 24.496 -2.767 -7.078 480 H HIS 659 HN HIS 659 24.758 -0.165 -6.717 481 HA HIS 659 HA HIS 659 23.054 -0.132 -8.978 482 HB2 HIS 659 HB2 HIS 659 22.178 -0.024 -6.682 483 HB3 HIS 659 HB1 HIS 659 22.940 1.544 -6.460 484 HD2 HIS 659 HD2 HIS 659 20.075 0.050 -8.748 485 HE1 HIS 659 HE1 HIS 659 19.315 4.156 -8.016 486 HE2 HIS 659 HE2 HIS 659 18.359 1.982 -8.836 487 H LEU 660 HN LEU 660 24.914 2.510 -7.365 488 HA LEU 660 HA LEU 660 24.360 4.393 -9.362 489 HB2 LEU 660 HB2 LEU 660 26.698 4.263 -7.459 490 HB3 LEU 660 HB1 LEU 660 26.174 5.679 -8.344 491 HG LEU 660 HG LEU 660 24.639 4.283 -6.149 492 HD11 LEU 660 HD11 LEU 660 26.012 6.963 -6.227 493 HD12 LEU 660 HD12 LEU 660 26.536 5.543 -5.321 494 HD13 LEU 660 HD13 LEU 660 25.024 6.350 -4.901 495 HD21 LEU 660 HD21 LEU 660 23.933 6.739 -7.759 496 HD22 LEU 660 HD22 LEU 660 23.063 6.162 -6.338 497 HD23 LEU 660 HD23 LEU 660 23.102 5.183 -7.803 498 H GLN 661 HN GLN 661 27.227 2.342 -8.809 499 HA GLN 661 HA GLN 661 28.822 3.110 -10.884 500 HB2 GLN 661 HB2 GLN 661 28.371 0.336 -9.803 501 HB3 GLN 661 HB1 GLN 661 29.588 0.678 -11.022 502 HG2 GLN 661 HG2 GLN 661 30.629 2.299 -9.457 503 HG3 GLN 661 HG1 GLN 661 29.461 1.805 -8.231 504 HE21 GLN 661 HE21 GLN 661 32.389 1.615 -8.277 505 HE22 GLN 661 HE22 GLN 661 32.764 -0.060 -8.043 506 H GLU 662 HN GLU 662 26.048 0.916 -11.185 507 HA GLU 662 HA GLU 662 26.554 0.426 -13.977 508 HB2 GLU 662 HB2 GLU 662 24.198 -0.254 -12.219 509 HB3 GLU 662 HB1 GLU 662 24.337 -0.737 -13.904 510 HG2 GLU 662 HG2 GLU 662 26.294 -2.055 -13.407 511 HG3 GLU 662 HG1 GLU 662 26.282 -1.495 -11.735 512 H THR 663 HN THR 663 24.985 2.919 -12.256 513 HA THR 663 HA THR 663 23.463 3.685 -14.658 514 HB THR 663 HB THR 663 22.170 5.167 -13.039 515 HG1 THR 663 HG1 THR 663 23.116 3.391 -11.042 516 HG21 THR 663 HG21 THR 663 22.040 2.168 -12.673 517 HG22 THR 663 HG22 THR 663 21.236 3.093 -13.941 518 HG23 THR 663 HG23 THR 663 20.759 3.306 -12.256 519 H GLN 664 HN GLN 664 26.345 4.247 -13.613 520 HA GLN 664 HA GLN 664 27.895 5.890 -13.805 521 HB2 GLN 664 HB2 GLN 664 26.736 6.136 -16.039 522 HB3 GLN 664 HB1 GLN 664 25.800 7.445 -15.338 523 HG2 GLN 664 HG2 GLN 664 27.683 8.267 -16.662 524 HG3 GLN 664 HG1 GLN 664 27.820 8.731 -14.967 525 HE21 GLN 664 HE21 GLN 664 30.031 9.015 -15.097 526 HE22 GLN 664 HE22 GLN 664 31.127 7.687 -15.228 527 H GLY 665 HN GLY 665 26.135 5.879 -11.508 528 HA2 GLY 665 HA2 GLY 665 26.584 7.360 -9.629 529 HA3 GLY 665 HA1 GLY 665 26.457 8.714 -10.739 530 H GLY 666 HN GLY 666 24.072 6.665 -11.620 531 HA2 GLY 666 HA2 GLY 666 21.808 6.575 -11.291 532 HA3 GLY 666 HA1 GLY 666 22.137 6.906 -9.597 533 H ARG 667 HN ARG 667 20.549 8.328 -9.183 534 HA ARG 667 HA ARG 667 19.742 10.424 -10.901 535 HB2 ARG 667 HB2 ARG 667 18.464 11.242 -8.987 536 HB3 ARG 667 HB1 ARG 667 18.298 9.500 -9.141 537 HG2 ARG 667 HG2 ARG 667 20.124 9.310 -7.389 538 HG3 ARG 667 HG1 ARG 667 19.910 11.039 -7.125 539 HD2 ARG 667 HD2 ARG 667 17.780 8.920 -6.843 540 HD3 ARG 667 HD1 ARG 667 18.617 9.729 -5.521 541 HE ARG 667 HE ARG 667 17.380 11.631 -7.206 542 HH11 ARG 667 HH11 ARG 667 16.600 9.203 -4.777 543 HH12 ARG 667 HH12 ARG 667 15.148 10.016 -4.278 544 HH21 ARG 667 HH21 ARG 667 15.478 12.697 -6.514 545 HH22 ARG 667 HH22 ARG 667 14.517 12.006 -5.254 546 H TYR 668 HN TYR 668 22.407 10.097 -8.812 547 HA TYR 668 HA TYR 668 22.743 12.872 -8.211 548 HB2 TYR 668 HB2 TYR 668 24.654 10.552 -7.904 549 HB3 TYR 668 HB1 TYR 668 24.903 12.170 -7.247 550 HD1 TYR 668 HD1 TYR 668 23.274 8.970 -6.772 551 HD2 TYR 668 HD2 TYR 668 23.317 13.041 -5.523 552 HE1 TYR 668 HE1 TYR 668 21.972 8.374 -4.792 553 HE2 TYR 668 HE2 TYR 668 22.018 12.446 -3.529 554 HH TYR 668 HH TYR 668 20.451 10.654 -2.835 555 H ALA 669 HN ALA 669 23.400 10.942 -10.905 556 HA ALA 669 HA ALA 669 25.699 12.283 -11.892 557 HB1 ALA 669 HB1 ALA 669 23.573 10.778 -13.418 558 HB2 ALA 669 HB2 ALA 669 25.017 10.068 -12.697 559 HB3 ALA 669 HB3 ALA 669 25.169 11.221 -14.024 560 H GLN 670 HN GLN 670 22.307 12.985 -11.885 561 HA GLN 670 HA GLN 670 22.671 15.180 -13.785 562 HB2 GLN 670 HB2 GLN 670 20.160 14.037 -12.543 563 HB3 GLN 670 HB1 GLN 670 20.182 15.426 -13.617 564 HG2 GLN 670 HG2 GLN 670 19.562 13.603 -14.955 565 HG3 GLN 670 HG1 GLN 670 21.254 13.905 -15.337 566 HE21 GLN 670 HE21 GLN 670 21.619 11.833 -16.059 567 HE22 GLN 670 HE22 GLN 670 21.674 10.470 -15.002 568 H GLY 671 HN GLY 671 23.175 14.747 -10.632 569 HA2 GLY 671 HA2 GLY 671 23.676 16.387 -9.058 570 HA3 GLY 671 HA1 GLY 671 22.889 17.576 -10.083 571 H GLU 672 HN GLU 672 21.161 14.685 -9.322 572 HA GLU 672 HA GLU 672 19.224 16.259 -7.853 573 HB2 GLU 672 HB2 GLU 672 19.200 13.369 -8.720 574 HB3 GLU 672 HB1 GLU 672 17.868 14.185 -7.915 575 HG2 GLU 672 HG2 GLU 672 19.021 14.941 -10.591 576 HG3 GLU 672 HG1 GLU 672 17.530 14.035 -10.331 577 H ASN 673 HN ASN 673 19.054 16.318 -5.725 578 HA ASN 673 HA ASN 673 20.814 14.615 -4.130 579 HB2 ASN 673 HB2 ASN 673 20.433 16.189 -2.314 580 HB3 ASN 673 HB1 ASN 673 20.870 17.078 -3.766 581 HD21 ASN 673 HD21 ASN 673 19.322 18.373 -4.782 582 HD22 ASN 673 HD22 ASN 673 17.841 18.801 -4.006 583 H PHE 674 HN PHE 674 19.905 13.855 -1.986 584 HA PHE 674 HA PHE 674 17.048 13.254 -2.122 585 HB2 PHE 674 HB2 PHE 674 18.290 11.337 -3.151 586 HB3 PHE 674 HB1 PHE 674 19.139 11.119 -1.623 587 HD1 PHE 674 HD1 PHE 674 15.534 11.902 -2.101 588 HD2 PHE 674 HD2 PHE 674 18.433 8.992 -0.984 589 HE1 PHE 674 HE1 PHE 674 13.738 10.419 -1.317 590 HE2 PHE 674 HE2 PHE 674 16.637 7.506 -0.199 591 HZ PHE 674 HZ PHE 674 14.287 8.220 -0.365 592 H VAL 675 HN VAL 675 16.051 13.148 -0.186 593 HA VAL 675 HA VAL 675 17.725 13.466 2.203 594 HB VAL 675 HB VAL 675 15.798 14.750 3.208 595 HG11 VAL 675 HG11 VAL 675 16.326 16.854 2.051 596 HG12 VAL 675 HG12 VAL 675 17.107 15.934 0.764 597 HG13 VAL 675 HG13 VAL 675 17.769 15.902 2.399 598 HG21 VAL 675 HG21 VAL 675 14.167 15.775 1.674 599 HG22 VAL 675 HG22 VAL 675 14.024 14.017 1.695 600 HG23 VAL 675 HG23 VAL 675 14.826 14.820 0.345 601 H VAL 676 HN VAL 676 17.537 11.904 3.629 602 HA VAL 676 HA VAL 676 15.193 10.138 3.450 603 HB VAL 676 HB VAL 676 17.961 9.518 4.513 604 HG11 VAL 676 HG11 VAL 676 17.186 7.202 4.637 605 HG12 VAL 676 HG12 VAL 676 15.574 7.714 4.135 606 HG13 VAL 676 HG13 VAL 676 16.228 8.254 5.680 607 HG21 VAL 676 HG21 VAL 676 16.583 8.622 1.989 608 HG22 VAL 676 HG22 VAL 676 18.163 8.078 2.551 609 HG23 VAL 676 HG23 VAL 676 17.922 9.763 2.092 610 H ASN 677 HN ASN 677 13.853 10.060 5.119 611 HA ASN 677 HA ASN 677 14.604 11.351 7.629 612 HB2 ASN 677 HB2 ASN 677 12.446 11.999 6.714 613 HB3 ASN 677 HB1 ASN 677 11.941 10.315 6.621 614 HD21 ASN 677 HD21 ASN 677 12.651 12.974 8.776 615 HD22 ASN 677 HD22 ASN 677 11.785 12.349 10.135 616 H ASP 678 HN ASP 678 13.830 8.245 6.273 617 HA ASP 678 HA ASP 678 15.049 6.924 8.506 618 HB2 ASP 678 HB2 ASP 678 12.859 6.951 9.431 619 HB3 ASP 678 HB1 ASP 678 12.123 6.533 7.884 620 H ILE 679 HN ILE 679 16.115 5.197 7.864 621 HA ILE 679 HA ILE 679 16.249 4.577 5.073 622 HB ILE 679 HB ILE 679 17.953 2.906 5.737 623 HG12 ILE 679 HG12 ILE 679 17.381 3.877 8.548 624 HG13 ILE 679 HG11 ILE 679 16.968 2.287 7.919 625 HG21 ILE 679 HG21 ILE 679 18.287 5.640 6.950 626 HG22 ILE 679 HG22 ILE 679 18.605 5.189 5.275 627 HG23 ILE 679 HG23 ILE 679 19.594 4.519 6.573 628 HD11 ILE 679 HD11 ILE 679 18.973 2.217 9.291 629 HD12 ILE 679 HD12 ILE 679 19.750 3.392 8.230 630 HD13 ILE 679 HD13 ILE 679 19.335 1.790 7.618 631 H TYR 680 HN TYR 680 14.415 3.363 7.665 632 HA TYR 680 HA TYR 680 14.196 0.690 6.585 633 HB2 TYR 680 HB2 TYR 680 14.236 1.143 9.030 634 HB3 TYR 680 HB1 TYR 680 12.690 1.965 8.865 635 HD1 TYR 680 HD1 TYR 680 14.398 -1.262 8.840 636 HD2 TYR 680 HD2 TYR 680 10.649 0.708 8.510 637 HE1 TYR 680 HE1 TYR 680 13.259 -3.403 9.140 638 HE2 TYR 680 HE2 TYR 680 9.488 -1.432 8.812 639 HH TYR 680 HH TYR 680 9.905 -3.793 8.548 640 H GLN 681 HN GLN 681 11.915 3.350 7.258 641 HA GLN 681 HA GLN 681 9.714 2.139 5.979 642 HB2 GLN 681 HB2 GLN 681 9.619 3.961 7.689 643 HB3 GLN 681 HB1 GLN 681 10.149 5.086 6.449 644 HG2 GLN 681 HG2 GLN 681 8.142 4.567 5.139 645 HG3 GLN 681 HG1 GLN 681 7.610 3.475 6.416 646 HE21 GLN 681 HE21 GLN 681 6.925 4.329 8.372 647 HE22 GLN 681 HE22 GLN 681 6.490 5.992 8.548 648 H VAL 682 HN VAL 682 12.375 3.940 4.694 649 HA VAL 682 HA VAL 682 11.085 4.814 2.321 650 HB VAL 682 HB VAL 682 13.188 5.842 3.152 651 HG11 VAL 682 HG11 VAL 682 14.363 3.855 3.857 652 HG12 VAL 682 HG12 VAL 682 15.333 4.761 2.695 653 HG13 VAL 682 HG13 VAL 682 14.477 3.304 2.188 654 HG21 VAL 682 HG21 VAL 682 12.525 6.226 0.855 655 HG22 VAL 682 HG22 VAL 682 13.330 4.739 0.349 656 HG23 VAL 682 HG23 VAL 682 14.282 6.094 0.957 657 H GLY 683 HN GLY 683 12.513 1.794 3.285 658 HA2 GLY 683 HA2 GLY 683 12.012 -0.247 2.224 659 HA3 GLY 683 HA1 GLY 683 11.569 0.640 0.777 660 H HIS 684 HN HIS 684 14.600 1.163 2.462 661 HA HIS 684 HA HIS 684 16.161 0.788 0.147 662 HB2 HIS 684 HB2 HIS 684 16.817 1.007 3.063 663 HB3 HIS 684 HB1 HIS 684 18.073 0.521 1.934 664 HD2 HIS 684 HD2 HIS 684 18.518 3.342 3.382 665 HE1 HIS 684 HE1 HIS 684 17.189 5.083 -0.253 666 HE2 HIS 684 HE2 HIS 684 18.649 5.369 1.773 667 H SER 685 HN SER 685 17.640 -0.845 -0.417 668 HA SER 685 HA SER 685 16.741 -3.503 -0.110 669 HB2 SER 685 HB2 SER 685 19.501 -2.582 -0.953 670 HB3 SER 685 HB1 SER 685 18.715 -4.106 -1.372 671 HG SER 685 HG SER 685 18.033 -1.484 -2.207 672 HA PRO 686 HA PRO 686 18.403 -4.980 3.707 673 HB2 PRO 686 HB2 PRO 686 19.819 -7.085 2.130 674 HB3 PRO 686 HB1 PRO 686 18.772 -7.255 3.543 675 HG2 PRO 686 HG2 PRO 686 17.866 -7.850 1.117 676 HG3 PRO 686 HG1 PRO 686 16.829 -7.035 2.302 677 HD2 PRO 686 HD2 PRO 686 18.192 -5.924 -0.105 678 HD3 PRO 686 HD1 PRO 686 16.629 -5.485 0.612 679 H CYS 687 HN CYS 687 20.775 -5.134 1.044 680 HA CYS 687 HA CYS 687 23.075 -4.910 2.650 681 HB2 CYS 687 HB2 CYS 687 24.221 -4.300 0.563 682 HB3 CYS 687 HB1 CYS 687 23.136 -5.659 0.306 683 H HIS 688 HN HIS 688 21.123 -2.509 0.981 684 HA HIS 688 HA HIS 688 22.795 -0.303 1.556 685 HB2 HIS 688 HB2 HIS 688 21.151 -0.547 -0.370 686 HB3 HIS 688 HB1 HIS 688 19.872 -0.226 0.790 687 HD1 HIS 688 HD1 HIS 688 19.582 1.797 -1.118 688 HD2 HIS 688 HD2 HIS 688 22.727 2.098 1.606 689 HE1 HIS 688 HE1 HIS 688 20.270 4.207 -1.136 690 H ILE 689 HN ILE 689 20.012 -1.755 3.151 691 HA ILE 689 HA ILE 689 19.751 0.461 4.947 692 HB ILE 689 HB ILE 689 17.784 -0.966 4.287 693 HG12 ILE 689 HG12 ILE 689 18.335 -0.760 7.256 694 HG13 ILE 689 HG11 ILE 689 17.695 0.526 6.240 695 HG21 ILE 689 HG21 ILE 689 19.026 -2.978 6.150 696 HG22 ILE 689 HG22 ILE 689 18.799 -3.155 4.410 697 HG23 ILE 689 HG23 ILE 689 17.396 -3.070 5.479 698 HD11 ILE 689 HD11 ILE 689 16.342 -2.090 6.859 699 HD12 ILE 689 HD12 ILE 689 15.699 -0.824 5.812 700 HD13 ILE 689 HD13 ILE 689 15.936 -0.511 7.532 701 H GLU 690 HN GLU 690 21.281 -2.689 5.024 702 HA GLU 690 HA GLU 690 21.640 -2.827 7.835 703 HB2 GLU 690 HB2 GLU 690 21.650 -4.829 6.462 704 HB3 GLU 690 HB1 GLU 690 23.088 -4.271 5.621 705 HG2 GLU 690 HG2 GLU 690 24.362 -4.410 7.695 706 HG3 GLU 690 HG1 GLU 690 22.919 -4.957 8.544 707 H ILE 691 HN ILE 691 23.711 -1.655 5.195 708 HA ILE 691 HA ILE 691 26.042 -1.463 6.784 709 HB ILE 691 HB ILE 691 25.345 0.091 4.274 710 HG12 ILE 691 HG12 ILE 691 26.928 -2.470 4.602 711 HG13 ILE 691 HG11 ILE 691 25.284 -2.377 3.986 712 HG21 ILE 691 HG21 ILE 691 27.772 0.384 4.045 713 HG22 ILE 691 HG22 ILE 691 28.011 -0.431 5.591 714 HG23 ILE 691 HG23 ILE 691 27.163 1.114 5.531 715 HD11 ILE 691 HD11 ILE 691 27.722 -1.156 2.706 716 HD12 ILE 691 HD12 ILE 691 26.075 -1.059 2.085 717 HD13 ILE 691 HD13 ILE 691 26.889 -2.619 2.182 718 H LEU 692 HN LEU 692 23.389 0.706 6.118 719 HA LEU 692 HA LEU 692 24.570 2.983 7.371 720 HB2 LEU 692 HB2 LEU 692 21.807 2.334 6.422 721 HB3 LEU 692 HB1 LEU 692 22.055 3.723 7.457 722 HG LEU 692 HG LEU 692 21.989 4.406 5.126 723 HD11 LEU 692 HD11 LEU 692 24.781 4.606 6.229 724 HD12 LEU 692 HD12 LEU 692 23.424 5.652 6.646 725 HD13 LEU 692 HD13 LEU 692 24.061 5.649 5.002 726 HD21 LEU 692 HD21 LEU 692 24.342 2.565 4.745 727 HD22 LEU 692 HD22 LEU 692 23.741 3.716 3.551 728 HD23 LEU 692 HD23 LEU 692 22.729 2.363 4.060 729 H GLU 693 HN GLU 693 22.454 0.390 8.473 730 HA GLU 693 HA GLU 693 21.910 1.477 11.024 731 HB2 GLU 693 HB2 GLU 693 22.000 -1.404 10.119 732 HB3 GLU 693 HB1 GLU 693 21.382 -0.872 11.675 733 HG2 GLU 693 HG2 GLU 693 19.675 0.461 10.499 734 HG3 GLU 693 HG1 GLU 693 20.269 -0.179 8.967 735 H GLN 694 HN GLN 694 24.640 -0.178 9.691 736 HA GLN 694 HA GLN 694 25.881 -0.939 12.123 737 HB2 GLN 694 HB2 GLN 694 27.041 -0.410 9.391 738 HB3 GLN 694 HB1 GLN 694 27.956 -1.078 10.733 739 HG2 GLN 694 HG2 GLN 694 26.510 -3.015 10.797 740 HG3 GLN 694 HG1 GLN 694 25.509 -2.336 9.516 741 HE21 GLN 694 HE21 GLN 694 27.831 -1.286 8.077 742 HE22 GLN 694 HE22 GLN 694 28.564 -2.653 7.316 743 H PHE 695 HN PHE 695 25.825 2.039 10.286 744 HA PHE 695 HA PHE 695 27.863 3.243 11.987 745 HB2 PHE 695 HB2 PHE 695 26.216 4.446 9.742 746 HB3 PHE 695 HB1 PHE 695 27.477 5.292 10.623 747 HD1 PHE 695 HD1 PHE 695 26.719 3.347 7.785 748 HD2 PHE 695 HD2 PHE 695 29.877 4.191 10.524 749 HE1 PHE 695 HE1 PHE 695 28.368 2.554 6.142 750 HE2 PHE 695 HE2 PHE 695 31.514 3.392 8.874 751 HZ PHE 695 HZ PHE 695 30.761 2.575 6.688 752 H GLU 696 HN GLU 696 24.676 2.552 12.246 753 HA GLU 696 HA GLU 696 22.973 3.166 13.570 754 HB2 GLU 696 HB2 GLU 696 25.207 4.519 15.053 755 HB3 GLU 696 HB1 GLU 696 23.545 4.541 15.628 756 HG2 GLU 696 HG2 GLU 696 23.523 2.127 15.738 757 HG3 GLU 696 HG1 GLU 696 25.162 2.068 15.092 758 H VAL 697 HN VAL 697 22.571 4.374 11.456 759 HA VAL 697 HA VAL 697 21.743 7.035 12.274 760 HB VAL 697 HB VAL 697 23.788 7.381 10.973 761 HG11 VAL 697 HG11 VAL 697 23.923 6.773 8.613 762 HG12 VAL 697 HG12 VAL 697 22.371 5.945 8.735 763 HG13 VAL 697 HG13 VAL 697 23.761 5.347 9.639 764 HG21 VAL 697 HG21 VAL 697 22.858 8.885 9.243 765 HG22 VAL 697 HG22 VAL 697 22.075 9.062 10.812 766 HG23 VAL 697 HG23 VAL 697 21.271 8.169 9.522 767 H LYS 698 HN LYS 698 19.757 7.645 11.425 768 HA LYS 698 HA LYS 698 18.373 5.568 9.873 769 HB2 LYS 698 HB2 LYS 698 17.320 7.438 11.993 770 HB3 LYS 698 HB1 LYS 698 16.289 6.445 10.973 771 HG2 LYS 698 HG2 LYS 698 18.471 5.176 12.572 772 HG3 LYS 698 HG1 LYS 698 16.947 5.618 13.340 773 HD2 LYS 698 HD2 LYS 698 16.944 4.033 10.802 774 HD3 LYS 698 HD1 LYS 698 17.242 3.230 12.346 775 HE2 LYS 698 HE2 LYS 698 15.131 3.920 13.204 776 HE3 LYS 698 HE1 LYS 698 14.863 5.008 11.844 777 HZ1 LYS 698 HZ1 LYS 698 14.484 3.243 10.412 778 HZ2 LYS 698 HZ2 LYS 698 13.656 2.796 11.821 779 HZ3 LYS 698 HZ3 LYS 698 15.149 2.088 11.459 780 H ALA 699 HN ALA 699 18.913 9.018 10.299 781 HA ALA 699 HA ALA 699 17.617 9.441 7.697 782 HB1 ALA 699 HB1 ALA 699 16.296 10.457 9.465 783 HB2 ALA 699 HB2 ALA 699 17.037 11.699 8.453 784 HB3 ALA 699 HB3 ALA 699 17.714 11.334 10.041 785 H TYR 700 HN TYR 700 18.568 11.035 6.359 786 HA TYR 700 HA TYR 700 20.960 12.344 6.982 787 HB2 TYR 700 HB2 TYR 700 22.506 11.061 5.479 788 HB3 TYR 700 HB1 TYR 700 22.077 10.227 6.963 789 HD1 TYR 700 HD1 TYR 700 21.210 10.402 3.333 790 HD2 TYR 700 HD2 TYR 700 21.269 8.060 6.878 791 HE1 TYR 700 HE1 TYR 700 20.555 8.422 2.025 792 HE2 TYR 700 HE2 TYR 700 20.616 6.084 5.590 793 HH TYR 700 HH TYR 700 19.703 5.422 3.623 794 H VAL 701 HN VAL 701 22.062 13.083 4.905 795 HA VAL 701 HA VAL 701 20.123 13.406 2.750 796 HB VAL 701 HB VAL 701 19.833 15.411 4.070 797 HG11 VAL 701 HG11 VAL 701 21.903 15.346 5.343 798 HG12 VAL 701 HG12 VAL 701 21.676 16.929 4.603 799 HG13 VAL 701 HG13 VAL 701 22.819 15.784 3.902 800 HG21 VAL 701 HG21 VAL 701 19.826 15.712 1.645 801 HG22 VAL 701 HG22 VAL 701 21.564 16.014 1.670 802 HG23 VAL 701 HG23 VAL 701 20.462 17.145 2.456 803 H ILE 702 HN ILE 702 21.018 13.276 0.772 804 HA ILE 702 HA ILE 702 23.964 13.120 0.652 805 HB ILE 702 HB ILE 702 22.077 11.737 -1.257 806 HG12 ILE 702 HG12 ILE 702 21.709 10.866 1.046 807 HG13 ILE 702 HG11 ILE 702 22.393 9.661 -0.037 808 HG21 ILE 702 HG21 ILE 702 24.058 10.385 -1.791 809 HG22 ILE 702 HG22 ILE 702 25.002 11.329 -0.640 810 HG23 ILE 702 HG23 ILE 702 24.336 12.104 -2.076 811 HD11 ILE 702 HD11 ILE 702 23.407 9.566 2.163 812 HD12 ILE 702 HD12 ILE 702 23.909 11.252 2.018 813 HD13 ILE 702 HD13 ILE 702 24.590 10.029 0.941 814 H VAL 703 HN VAL 703 24.724 14.915 -0.301 815 HA VAL 703 HA VAL 703 23.288 15.883 -2.674 816 HB VAL 703 HB VAL 703 24.275 18.125 -2.267 817 HG11 VAL 703 HG11 VAL 703 22.827 18.748 -0.376 818 HG12 VAL 703 HG12 VAL 703 22.616 17.039 0.003 819 HG13 VAL 703 HG13 VAL 703 22.015 17.683 -1.524 820 HG21 VAL 703 HG21 VAL 703 26.220 17.491 -0.962 821 HG22 VAL 703 HG22 VAL 703 25.186 16.930 0.351 822 HG23 VAL 703 HG23 VAL 703 25.237 18.645 -0.061 823 HA PRO 704 HA PRO 704 27.053 14.849 -4.762 824 HB2 PRO 704 HB2 PRO 704 26.378 15.658 -7.229 825 HB3 PRO 704 HB1 PRO 704 25.622 14.250 -6.474 826 HG2 PRO 704 HG2 PRO 704 24.556 17.015 -6.819 827 HG3 PRO 704 HG1 PRO 704 23.708 15.462 -6.917 828 HD2 PRO 704 HD2 PRO 704 23.712 17.165 -4.713 829 HD3 PRO 704 HD1 PRO 704 23.284 15.444 -4.682 830 H VAL 705 HN VAL 705 28.951 15.854 -4.935 831 HA VAL 705 HA VAL 705 28.983 18.781 -5.145 832 HB VAL 705 HB VAL 705 31.197 16.906 -4.267 833 HG11 VAL 705 HG11 VAL 705 32.049 18.977 -5.239 834 HG12 VAL 705 HG12 VAL 705 32.334 18.935 -3.499 835 HG13 VAL 705 HG13 VAL 705 31.025 19.918 -4.155 836 HG21 VAL 705 HG21 VAL 705 30.761 17.778 -2.004 837 HG22 VAL 705 HG22 VAL 705 29.380 16.898 -2.659 838 HG23 VAL 705 HG23 VAL 705 29.367 18.661 -2.630 839 H PHE 706 HN PHE 706 29.592 19.674 -6.988 840 HA PHE 706 HA PHE 706 30.989 18.017 -8.967 841 HB2 PHE 706 HB2 PHE 706 29.237 20.456 -9.330 842 HB3 PHE 706 HB1 PHE 706 30.138 19.689 -10.630 843 HD1 PHE 706 HD1 PHE 706 27.311 19.350 -8.321 844 HD2 PHE 706 HD2 PHE 706 29.414 17.612 -11.587 845 HE1 PHE 706 HE1 PHE 706 25.424 17.825 -8.721 846 HE2 PHE 706 HE2 PHE 706 27.530 16.083 -11.992 847 HZ PHE 706 HZ PHE 706 25.532 16.188 -10.558 848 H ALA 707 HN ALA 707 32.858 18.695 -9.873 849 HA ALA 707 HA ALA 707 33.891 21.330 -9.110 850 HB1 ALA 707 HB1 ALA 707 36.128 20.355 -8.777 851 HB2 ALA 707 HB2 ALA 707 35.457 18.743 -9.029 852 HB3 ALA 707 HB3 ALA 707 34.957 19.700 -7.633 853 H GLY 708 HN GLY 708 33.558 22.212 -11.083 854 HA2 GLY 708 HA2 GLY 708 34.546 22.748 -13.170 855 HA3 GLY 708 HA1 GLY 708 35.153 21.097 -13.275 856 H GLU 709 HN GLU 709 34.209 20.121 -14.945 857 HA GLU 709 HA GLU 709 31.340 20.613 -15.377 858 HB2 GLU 709 HB2 GLU 709 33.389 19.528 -17.310 859 HB3 GLU 709 HB1 GLU 709 31.698 19.837 -17.671 860 HG2 GLU 709 HG2 GLU 709 32.088 22.237 -17.179 861 HG3 GLU 709 HG1 GLU 709 33.802 21.872 -16.981 862 H GLN 710 HN GLN 710 32.950 18.588 -13.637 863 HA GLN 710 HA GLN 710 31.347 16.275 -14.447 864 HB2 GLN 710 HB2 GLN 710 33.179 14.752 -14.014 865 HB3 GLN 710 HB1 GLN 710 33.648 15.918 -15.243 866 HG2 GLN 710 HG2 GLN 710 34.907 17.182 -13.582 867 HG3 GLN 710 HG1 GLN 710 34.416 16.039 -12.332 868 HE21 GLN 710 HE21 GLN 710 35.299 13.967 -12.327 869 HE22 GLN 710 HE22 GLN 710 36.727 13.581 -13.220 870 H LEU 711 HN LEU 711 31.136 14.663 -12.733 871 HA LEU 711 HA LEU 711 30.547 15.890 -10.207 872 HB2 LEU 711 HB2 LEU 711 29.088 14.172 -11.182 873 HB3 LEU 711 HB1 LEU 711 30.399 13.013 -11.131 874 HG LEU 711 HG LEU 711 30.364 13.090 -8.667 875 HD11 LEU 711 HD11 LEU 711 28.497 14.188 -7.519 876 HD12 LEU 711 HD12 LEU 711 27.989 14.905 -9.048 877 HD13 LEU 711 HD13 LEU 711 29.543 15.345 -8.339 878 HD21 LEU 711 HD21 LEU 711 28.227 11.921 -8.371 879 HD22 LEU 711 HD22 LEU 711 29.069 11.397 -9.830 880 HD23 LEU 711 HD23 LEU 711 27.700 12.501 -9.952 881 H TRP 712 HN TRP 712 31.736 15.768 -8.362 882 HA TRP 712 HA TRP 712 34.351 14.478 -8.607 883 HB2 TRP 712 HB2 TRP 712 34.439 16.845 -8.082 884 HB3 TRP 712 HB1 TRP 712 33.376 16.607 -6.698 885 HD1 TRP 712 HD1 TRP 712 36.957 15.733 -7.864 886 HE1 TRP 712 HE1 TRP 712 38.420 15.404 -5.776 887 HE3 TRP 712 HE3 TRP 712 33.342 16.147 -4.270 888 HZ2 TRP 712 HZ2 TRP 712 38.085 15.329 -2.963 889 HZ3 TRP 712 HZ3 TRP 712 33.997 15.937 -1.907 890 HH2 TRP 712 HH2 TRP 712 36.306 15.539 -1.266 891 H GLY 713 HN GLY 713 31.690 14.852 -6.269 892 HA2 GLY 713 HA2 GLY 713 31.803 12.150 -5.479 893 HA3 GLY 713 HA1 GLY 713 32.711 13.127 -4.337 894 H LEU 714 HN LEU 714 30.825 11.951 -3.162 895 HA LEU 714 HA LEU 714 28.462 13.689 -3.148 896 HB2 LEU 714 HB2 LEU 714 28.849 10.964 -1.911 897 HB3 LEU 714 HB1 LEU 714 27.365 11.890 -1.885 898 HG LEU 714 HG LEU 714 28.688 10.771 -4.358 899 HD11 LEU 714 HD11 LEU 714 26.234 9.875 -2.855 900 HD12 LEU 714 HD12 LEU 714 27.772 9.015 -2.957 901 HD13 LEU 714 HD13 LEU 714 26.784 9.231 -4.401 902 HD21 LEU 714 HD21 LEU 714 26.582 11.405 -5.462 903 HD22 LEU 714 HD22 LEU 714 27.469 12.800 -4.852 904 HD23 LEU 714 HD23 LEU 714 26.060 12.199 -3.975 905 H LEU 715 HN LEU 715 27.746 14.648 -1.286 906 HA LEU 715 HA LEU 715 29.572 14.570 1.025 907 HB2 LEU 715 HB2 LEU 715 29.543 16.762 -0.085 908 HB3 LEU 715 HB1 LEU 715 27.800 16.821 0.053 909 HG LEU 715 HG LEU 715 28.037 16.870 2.533 910 HD11 LEU 715 HD11 LEU 715 30.211 15.797 2.722 911 HD12 LEU 715 HD12 LEU 715 30.223 17.381 3.496 912 HD13 LEU 715 HD13 LEU 715 30.970 17.168 1.914 913 HD21 LEU 715 HD21 LEU 715 29.479 19.059 1.037 914 HD22 LEU 715 HD22 LEU 715 28.780 19.196 2.651 915 HD23 LEU 715 HD23 LEU 715 27.735 18.929 1.257 916 H ALA 716 HN ALA 716 28.662 13.275 2.495 917 HA ALA 716 HA ALA 716 25.751 13.455 2.862 918 HB1 ALA 716 HB1 ALA 716 26.492 11.314 1.926 919 HB2 ALA 716 HB2 ALA 716 25.767 11.133 3.524 920 HB3 ALA 716 HB3 ALA 716 27.519 11.068 3.339 921 H ALA 717 HN ALA 717 24.923 13.435 4.891 922 HA ALA 717 HA ALA 717 26.813 13.597 7.123 923 HB1 ALA 717 HB1 ALA 717 25.491 15.369 8.139 924 HB2 ALA 717 HB2 ALA 717 24.394 15.369 6.756 925 HB3 ALA 717 HB3 ALA 717 26.075 15.867 6.552 926 H TYR 718 HN TYR 718 26.290 12.417 8.823 927 HA TYR 718 HA TYR 718 23.648 11.084 8.904 928 HB2 TYR 718 HB2 TYR 718 26.308 9.896 9.701 929 HB3 TYR 718 HB1 TYR 718 24.763 9.064 9.668 930 HD1 TYR 718 HD1 TYR 718 27.702 9.940 7.829 931 HD2 TYR 718 HD2 TYR 718 23.668 8.676 7.396 932 HE1 TYR 718 HE1 TYR 718 28.190 9.185 5.548 933 HE2 TYR 718 HE2 TYR 718 24.145 7.918 5.112 934 HH TYR 718 HH TYR 718 25.713 8.240 3.356 935 H GLN 719 HN GLN 719 22.670 11.259 10.948 936 HA GLN 719 HA GLN 719 24.538 11.940 13.101 937 HB2 GLN 719 HB2 GLN 719 22.759 13.566 13.934 938 HB3 GLN 719 HB1 GLN 719 23.774 14.056 12.586 939 HG2 GLN 719 HG2 GLN 719 22.001 13.525 11.019 940 HG3 GLN 719 HG1 GLN 719 20.984 12.949 12.339 941 HE21 GLN 719 HE21 GLN 719 21.781 15.029 14.158 942 HE22 GLN 719 HE22 GLN 719 21.022 16.476 13.609 943 H ASN 720 HN ASN 720 24.411 10.035 14.075 944 HA ASN 720 HA ASN 720 23.477 8.270 15.286 945 HB2 ASN 720 HB2 ASN 720 22.728 10.636 16.995 946 HB3 ASN 720 HB1 ASN 720 23.255 9.040 17.529 947 HD21 ASN 720 HD21 ASN 720 24.345 11.752 18.004 948 HD22 ASN 720 HD22 ASN 720 26.004 11.671 17.508 949 H SER 721 HN SER 721 21.745 7.758 13.780 950 HA SER 721 HA SER 721 19.597 7.225 13.284 951 HB2 SER 721 HB2 SER 721 19.313 6.544 15.638 952 HB3 SER 721 HB1 SER 721 18.991 8.213 16.100 953 HG SER 721 HG SER 721 17.284 6.363 15.211 954 H GLY 722 HN GLY 722 18.862 10.006 15.362 955 HA2 GLY 722 HA2 GLY 722 17.870 12.028 14.924 956 HA3 GLY 722 HA1 GLY 722 19.097 12.126 13.677 957 H THR 723 HN THR 723 15.956 10.585 14.222 958 HA THR 723 HA THR 723 15.312 10.532 11.440 959 HB THR 723 HB THR 723 13.025 9.948 12.347 960 HG1 THR 723 HG1 THR 723 12.835 9.625 14.513 961 HG21 THR 723 HG21 THR 723 15.415 8.266 13.112 962 HG22 THR 723 HG22 THR 723 14.591 8.260 11.551 963 HG23 THR 723 HG23 THR 723 13.759 7.672 12.991 964 H ARG 724 HN ARG 724 15.919 13.100 12.032 965 HA ARG 724 HA ARG 724 13.585 14.704 12.577 966 HB2 ARG 724 HB2 ARG 724 14.994 16.623 12.205 967 HB3 ARG 724 HB1 ARG 724 15.891 15.459 13.170 968 HG2 ARG 724 HG2 ARG 724 17.298 14.886 11.390 969 HG3 ARG 724 HG1 ARG 724 16.202 15.565 10.187 970 HD2 ARG 724 HD2 ARG 724 18.141 17.001 10.463 971 HD3 ARG 724 HD1 ARG 724 16.690 17.821 11.035 972 HE ARG 724 HE ARG 724 17.592 16.819 13.306 973 HH11 ARG 724 HH11 ARG 724 19.311 18.489 10.746 974 HH12 ARG 724 HH12 ARG 724 20.582 19.053 11.770 975 HH21 ARG 724 HH21 ARG 724 19.215 17.573 14.693 976 HH22 ARG 724 HH22 ARG 724 20.514 18.542 14.072 977 H ASP 725 HN ASP 725 12.625 16.166 11.101 978 HA ASP 725 HA ASP 725 12.617 15.206 8.357 979 HB2 ASP 725 HB2 ASP 725 10.444 15.595 9.389 980 HB3 ASP 725 HB1 ASP 725 10.899 17.250 9.783 981 H TRP 726 HN TRP 726 14.136 16.016 7.092 982 HA TRP 726 HA TRP 726 15.680 18.272 7.659 983 HB2 TRP 726 HB2 TRP 726 15.236 16.902 5.000 984 HB3 TRP 726 HB1 TRP 726 16.529 18.044 5.351 985 HD1 TRP 726 HD1 TRP 726 15.543 14.424 5.812 986 HE1 TRP 726 HE1 TRP 726 17.491 13.138 6.885 987 HE3 TRP 726 HE3 TRP 726 18.548 18.380 7.005 988 HZ2 TRP 726 HZ2 TRP 726 19.987 13.729 8.083 989 HZ3 TRP 726 HZ3 TRP 726 20.699 17.937 8.111 990 HH2 TRP 726 HH2 TRP 726 21.402 15.658 8.639 991 H ASP 727 HN ASP 727 15.358 20.350 7.428 992 HA ASP 727 HA ASP 727 12.884 21.247 6.206 993 HB2 ASP 727 HB2 ASP 727 13.568 22.126 8.412 994 HB3 ASP 727 HB1 ASP 727 14.998 22.837 7.675 995 H GLU 728 HN GLU 728 12.762 22.895 4.738 996 HA GLU 728 HA GLU 728 14.217 22.734 2.397 997 HB2 GLU 728 HB2 GLU 728 12.715 25.104 3.506 998 HB3 GLU 728 HB1 GLU 728 13.317 25.012 1.859 999 HG2 GLU 728 HG2 GLU 728 11.405 23.027 3.044 1000 HG3 GLU 728 HG1 GLU 728 10.903 24.459 2.147 1001 H SER 729 HN SER 729 14.643 25.153 5.003 1002 HA SER 729 HA SER 729 16.766 26.520 3.836 1003 HB2 SER 729 HB2 SER 729 17.219 27.349 6.143 1004 HB3 SER 729 HB1 SER 729 15.529 27.488 5.662 1005 HG SER 729 HG SER 729 15.081 25.611 6.869 1006 H GLU 730 HN GLU 730 16.766 23.463 5.493 1007 HA GLU 730 HA GLU 730 19.591 23.549 6.105 1008 HB2 GLU 730 HB2 GLU 730 17.608 21.265 6.182 1009 HB3 GLU 730 HB1 GLU 730 19.280 21.147 6.708 1010 HG2 GLU 730 HG2 GLU 730 18.852 22.819 8.433 1011 HG3 GLU 730 HG1 GLU 730 17.175 22.935 7.901 1012 H VAL 731 HN VAL 731 17.490 21.843 3.838 1013 HA VAL 731 HA VAL 731 19.520 20.464 2.463 1014 HB VAL 731 HB VAL 731 16.834 21.337 1.372 1015 HG11 VAL 731 HG11 VAL 731 18.635 19.057 0.556 1016 HG12 VAL 731 HG12 VAL 731 18.380 20.548 -0.351 1017 HG13 VAL 731 HG13 VAL 731 17.047 19.417 -0.121 1018 HG21 VAL 731 HG21 VAL 731 16.554 20.136 3.470 1019 HG22 VAL 731 HG22 VAL 731 17.579 18.829 2.878 1020 HG23 VAL 731 HG23 VAL 731 16.020 19.141 2.115 1021 H THR 732 HN THR 732 18.150 23.700 2.023 1022 HA THR 732 HA THR 732 19.396 24.076 -0.530 1023 HB THR 732 HB THR 732 18.186 26.179 1.280 1024 HG1 THR 732 HG1 THR 732 16.673 24.512 0.846 1025 HG21 THR 732 HG21 THR 732 19.519 27.063 -0.583 1026 HG22 THR 732 HG22 THR 732 17.802 27.375 -0.839 1027 HG23 THR 732 HG23 THR 732 18.601 26.072 -1.716 1028 H LEU 733 HN LEU 733 20.139 24.849 2.832 1029 HA LEU 733 HA LEU 733 22.242 26.680 2.224 1030 HB2 LEU 733 HB2 LEU 733 20.833 26.410 4.396 1031 HB3 LEU 733 HB1 LEU 733 21.973 25.148 4.798 1032 HG LEU 733 HG LEU 733 22.859 27.973 4.212 1033 HD11 LEU 733 HD11 LEU 733 22.133 26.767 6.878 1034 HD12 LEU 733 HD12 LEU 733 21.253 28.047 6.042 1035 HD13 LEU 733 HD13 LEU 733 22.889 28.340 6.628 1036 HD21 LEU 733 HD21 LEU 733 24.814 27.311 5.527 1037 HD22 LEU 733 HD22 LEU 733 24.594 26.256 4.131 1038 HD23 LEU 733 HD23 LEU 733 24.129 25.700 5.738 1039 H LEU 734 HN LEU 734 22.025 23.244 3.030 1040 HA LEU 734 HA LEU 734 24.777 22.718 3.159 1041 HB2 LEU 734 HB2 LEU 734 23.059 21.166 3.961 1042 HB3 LEU 734 HB1 LEU 734 22.525 20.897 2.313 1043 HG LEU 734 HG LEU 734 24.745 19.910 1.796 1044 HD11 LEU 734 HD11 LEU 734 26.207 19.268 3.655 1045 HD12 LEU 734 HD12 LEU 734 25.189 20.186 4.765 1046 HD13 LEU 734 HD13 LEU 734 26.078 21.019 3.489 1047 HD21 LEU 734 HD21 LEU 734 23.262 18.634 4.085 1048 HD22 LEU 734 HD22 LEU 734 24.351 17.811 2.968 1049 HD23 LEU 734 HD23 LEU 734 22.841 18.506 2.377 1050 H ALA 735 HN ALA 735 22.501 22.682 0.439 1051 HA ALA 735 HA ALA 735 24.314 21.744 -1.504 1052 HB1 ALA 735 HB1 ALA 735 21.908 21.729 -1.874 1053 HB2 ALA 735 HB2 ALA 735 22.715 22.657 -3.140 1054 HB3 ALA 735 HB3 ALA 735 21.874 23.491 -1.832 1055 H ARG 736 HN ARG 736 23.500 24.984 -0.341 1056 HA ARG 736 HA ARG 736 24.977 26.526 -2.125 1057 HB2 ARG 736 HB2 ARG 736 23.385 27.422 -0.457 1058 HB3 ARG 736 HB1 ARG 736 24.496 26.985 0.830 1059 HG2 ARG 736 HG2 ARG 736 26.161 28.550 -0.195 1060 HG3 ARG 736 HG1 ARG 736 24.885 29.080 -1.294 1061 HD2 ARG 736 HD2 ARG 736 24.830 29.234 1.719 1062 HD3 ARG 736 HD1 ARG 736 25.051 30.588 0.615 1063 HE ARG 736 HE ARG 736 22.701 29.712 -0.210 1064 HH11 ARG 736 HH11 ARG 736 23.844 30.105 3.098 1065 HH12 ARG 736 HH12 ARG 736 22.264 30.428 3.730 1066 HH21 ARG 736 HH21 ARG 736 20.616 30.128 0.654 1067 HH22 ARG 736 HH22 ARG 736 20.436 30.435 2.348 1068 H ILE 737 HN ILE 737 25.922 25.024 0.947 1069 HA ILE 737 HA ILE 737 28.605 25.886 0.946 1070 HB ILE 737 HB ILE 737 27.423 23.392 2.201 1071 HG12 ILE 737 HG12 ILE 737 27.934 26.133 3.376 1072 HG13 ILE 737 HG11 ILE 737 26.356 25.486 2.948 1073 HG21 ILE 737 HG21 ILE 737 29.371 23.466 3.705 1074 HG22 ILE 737 HG22 ILE 737 30.029 24.809 2.770 1075 HG23 ILE 737 HG23 ILE 737 29.844 23.224 2.022 1076 HD11 ILE 737 HD11 ILE 737 28.202 24.390 5.061 1077 HD12 ILE 737 HD12 ILE 737 26.621 23.737 4.634 1078 HD13 ILE 737 HD13 ILE 737 26.748 25.348 5.339 1079 H GLY 738 HN GLY 738 27.013 23.024 -0.392 1080 HA2 GLY 738 HA2 GLY 738 29.307 21.616 -1.189 1081 HA3 GLY 738 HA1 GLY 738 27.718 21.478 -1.933 1082 H ASN 739 HN ASN 739 27.349 24.006 -2.921 1083 HA ASN 739 HA ASN 739 28.812 23.987 -5.325 1084 HB2 ASN 739 HB2 ASN 739 27.053 26.054 -4.020 1085 HB3 ASN 739 HB1 ASN 739 27.866 26.379 -5.546 1086 HD21 ASN 739 HD21 ASN 739 25.015 26.162 -4.901 1087 HD22 ASN 739 HD22 ASN 739 24.398 24.943 -5.955 1088 H GLN 740 HN GLN 740 29.193 25.831 -2.360 1089 HA GLN 740 HA GLN 740 31.240 27.544 -3.276 1090 HB2 GLN 740 HB2 GLN 740 29.900 27.988 -1.258 1091 HB3 GLN 740 HB1 GLN 740 30.645 26.610 -0.461 1092 HG2 GLN 740 HG2 GLN 740 31.623 28.717 0.269 1093 HG3 GLN 740 HG1 GLN 740 32.807 27.695 -0.545 1094 HE21 GLN 740 HE21 GLN 740 34.123 29.421 -1.046 1095 HE22 GLN 740 HE22 GLN 740 33.723 30.583 -2.259 1096 H LEU 741 HN LEU 741 31.274 24.359 -1.769 1097 HA LEU 741 HA LEU 741 34.119 24.259 -1.472 1098 HB2 LEU 741 HB2 LEU 741 32.046 22.066 -1.450 1099 HB3 LEU 741 HB1 LEU 741 33.740 21.820 -1.082 1100 HG LEU 741 HG LEU 741 31.828 23.537 0.503 1101 HD11 LEU 741 HD11 LEU 741 31.377 21.156 0.740 1102 HD12 LEU 741 HD12 LEU 741 32.065 21.821 2.220 1103 HD13 LEU 741 HD13 LEU 741 33.072 20.866 1.133 1104 HD21 LEU 741 HD21 LEU 741 34.087 24.430 0.593 1105 HD22 LEU 741 HD22 LEU 741 34.723 22.834 0.991 1106 HD23 LEU 741 HD23 LEU 741 33.671 23.671 2.130 1107 H GLY 742 HN GLY 742 31.818 23.377 -3.940 1108 HA2 GLY 742 HA2 GLY 742 33.584 21.793 -5.510 1109 HA3 GLY 742 HA1 GLY 742 32.082 22.529 -6.057 1110 H LEU 743 HN LEU 743 32.755 25.229 -5.437 1111 HA LEU 743 HA LEU 743 34.146 25.956 -7.780 1112 HB2 LEU 743 HB2 LEU 743 32.410 27.345 -6.682 1113 HB3 LEU 743 HB1 LEU 743 33.479 27.598 -5.323 1114 HG LEU 743 HG LEU 743 34.322 28.494 -8.066 1115 HD11 LEU 743 HD11 LEU 743 32.556 30.030 -6.165 1116 HD12 LEU 743 HD12 LEU 743 32.079 29.395 -7.738 1117 HD13 LEU 743 HD13 LEU 743 33.294 30.667 -7.634 1118 HD21 LEU 743 HD21 LEU 743 35.967 28.557 -6.243 1119 HD22 LEU 743 HD22 LEU 743 34.866 29.544 -5.282 1120 HD23 LEU 743 HD23 LEU 743 35.544 30.184 -6.779 1121 H ALA 744 HN ALA 744 35.033 26.012 -4.342 1122 HA ALA 744 HA ALA 744 37.639 27.007 -4.678 1123 HB1 ALA 744 HB1 ALA 744 36.482 26.960 -2.514 1124 HB2 ALA 744 HB2 ALA 744 38.060 26.179 -2.423 1125 HB3 ALA 744 HB3 ALA 744 36.595 25.200 -2.495 1126 H LEU 745 HN LEU 745 36.317 23.766 -4.806 1127 HA LEU 745 HA LEU 745 38.781 22.370 -4.865 1128 HB2 LEU 745 HB2 LEU 745 36.238 21.617 -4.553 1129 HB3 LEU 745 HB1 LEU 745 36.387 21.309 -6.267 1130 HG LEU 745 HG LEU 745 38.268 20.119 -4.240 1131 HD11 LEU 745 HD11 LEU 745 35.991 19.447 -3.725 1132 HD12 LEU 745 HD12 LEU 745 36.923 18.101 -4.381 1133 HD13 LEU 745 HD13 LEU 745 35.754 18.944 -5.399 1134 HD21 LEU 745 HD21 LEU 745 38.709 18.506 -6.029 1135 HD22 LEU 745 HD22 LEU 745 39.075 20.151 -6.552 1136 HD23 LEU 745 HD23 LEU 745 37.589 19.366 -7.086 1137 H GLN 746 HN GLN 746 36.577 23.517 -7.399 1138 HA GLN 746 HA GLN 746 38.014 22.532 -9.615 1139 HB2 GLN 746 HB2 GLN 746 35.695 23.298 -9.762 1140 HB3 GLN 746 HB1 GLN 746 36.191 24.934 -9.359 1141 HG2 GLN 746 HG2 GLN 746 37.489 25.018 -11.458 1142 HG3 GLN 746 HG1 GLN 746 36.884 23.412 -11.862 1143 HE21 GLN 746 HE21 GLN 746 36.518 25.946 -13.263 1144 HE22 GLN 746 HE22 GLN 746 34.810 26.200 -13.352 1145 H GLN 747 HN GLN 747 38.136 25.528 -7.824 1146 HA GLN 747 HA GLN 747 39.934 26.944 -9.462 1147 HB2 GLN 747 HB2 GLN 747 38.549 28.049 -7.798 1148 HB3 GLN 747 HB1 GLN 747 39.363 27.182 -6.506 1149 HG2 GLN 747 HG2 GLN 747 41.456 28.338 -7.092 1150 HG3 GLN 747 HG1 GLN 747 40.580 29.250 -8.320 1151 HE21 GLN 747 HE21 GLN 747 39.158 30.862 -7.688 1152 HE22 GLN 747 HE22 GLN 747 39.121 31.481 -6.076 1153 H THR 748 HN THR 748 40.461 24.786 -6.696 1154 HA THR 748 HA THR 748 43.303 25.266 -6.733 1155 HB THR 748 HB THR 748 43.323 23.439 -4.953 1156 HG1 THR 748 HG1 THR 748 40.539 23.893 -4.788 1157 HG21 THR 748 HG21 THR 748 41.606 25.883 -4.481 1158 HG22 THR 748 HG22 THR 748 43.367 25.838 -4.419 1159 HG23 THR 748 HG23 THR 748 42.420 24.936 -3.236 1160 H GLU 749 HN GLU 749 41.118 22.773 -7.907 1161 HA GLU 749 HA GLU 749 43.119 20.822 -8.393 1162 HB2 GLU 749 HB2 GLU 749 40.718 20.259 -8.272 1163 HB3 GLU 749 HB1 GLU 749 40.441 21.148 -9.765 1164 HG2 GLU 749 HG2 GLU 749 41.893 19.597 -10.965 1165 HG3 GLU 749 HG1 GLU 749 42.187 18.713 -9.473 1166 H TYR 750 HN TYR 750 41.648 23.313 -10.453 1167 HA TYR 750 HA TYR 750 43.236 22.614 -12.732 1168 HB2 TYR 750 HB2 TYR 750 41.045 23.729 -12.970 1169 HB3 TYR 750 HB1 TYR 750 41.697 25.158 -12.171 1170 HD1 TYR 750 HD1 TYR 750 42.170 22.991 -15.159 1171 HD2 TYR 750 HD2 TYR 750 42.753 26.827 -13.421 1172 HE1 TYR 750 HE1 TYR 750 42.962 23.846 -17.324 1173 HE2 TYR 750 HE2 TYR 750 43.543 27.693 -15.579 1174 HH TYR 750 HH TYR 750 43.148 26.018 -18.489 1175 H LEU 751 HN LEU 751 43.693 24.552 -9.947 1176 HA LEU 751 HA LEU 751 45.693 26.305 -10.884 1177 HB2 LEU 751 HB2 LEU 751 44.376 26.383 -8.684 1178 HB3 LEU 751 HB1 LEU 751 45.486 25.171 -8.090 1179 HG LEU 751 HG LEU 751 46.405 27.884 -9.057 1180 HD11 LEU 751 HD11 LEU 751 44.834 28.204 -7.230 1181 HD12 LEU 751 HD12 LEU 751 46.482 28.536 -6.698 1182 HD13 LEU 751 HD13 LEU 751 45.702 27.019 -6.255 1183 HD21 LEU 751 HD21 LEU 751 48.128 26.144 -8.942 1184 HD22 LEU 751 HD22 LEU 751 47.693 25.821 -7.264 1185 HD23 LEU 751 HD23 LEU 751 48.384 27.381 -7.709 1186 H GLN 752 HN GLN 752 45.698 23.043 -9.648 1187 HA GLN 752 HA GLN 752 48.604 22.839 -9.859 1188 HB2 GLN 752 HB2 GLN 752 46.584 20.837 -8.836 1189 HB3 GLN 752 HB1 GLN 752 48.332 20.726 -8.685 1190 HG2 GLN 752 HG2 GLN 752 48.395 22.571 -7.182 1191 HG3 GLN 752 HG1 GLN 752 46.697 22.940 -7.477 1192 HE21 GLN 752 HE21 GLN 752 45.117 21.648 -6.561 1193 HE22 GLN 752 HE22 GLN 752 45.458 20.563 -5.255 1194 H GLN 753 HN GLN 753 48.978 20.246 -10.489 1195 HA GLN 753 HA GLN 753 49.001 18.623 -12.079 1196 HB2 GLN 753 HB2 GLN 753 46.470 19.909 -13.114 1197 HB3 GLN 753 HB1 GLN 753 47.135 18.390 -13.689 1198 HG2 GLN 753 HG2 GLN 753 46.824 17.413 -11.478 1199 HG3 GLN 753 HG1 GLN 753 46.164 18.942 -10.897 1200 HE21 GLN 753 HE21 GLN 753 44.140 19.616 -11.624 1201 HE22 GLN 753 HE22 GLN 753 43.019 18.508 -12.339 1202 H VAL 754 HN VAL 754 49.463 21.799 -12.629 1203 HA VAL 754 HA VAL 754 49.965 21.595 -15.467 1204 HB VAL 754 HB VAL 754 50.751 23.980 -15.272 1205 HG11 VAL 754 HG11 VAL 754 48.478 23.450 -15.941 1206 HG12 VAL 754 HG12 VAL 754 48.500 24.905 -14.944 1207 HG13 VAL 754 HG13 VAL 754 47.980 23.369 -14.252 1208 HG21 VAL 754 HG21 VAL 754 50.224 25.219 -13.224 1209 HG22 VAL 754 HG22 VAL 754 51.421 23.961 -12.915 1210 HG23 VAL 754 HG23 VAL 754 49.742 23.717 -12.435 1211 HHA CYC 800 HHA CYC 800 19.632 3.110 -4.600 1212 HMA1 CYC 800 HMA1 CYC 800 22.809 7.067 -1.574 1213 HMA2 CYC 800 HMA2 CYC 800 21.594 7.535 -2.821 1214 HMA3 CYC 800 HMA3 CYC 800 23.351 7.523 -3.239 1215 HAA1 CYC 800 HAA1 CYC 800 20.780 6.924 -4.583 1216 HAA2 CYC 800 HAA2 CYC 800 20.113 5.436 -5.316 1217 HBA1 CYC 800 HBA1 CYC 800 19.255 6.700 -2.630 1218 HBA2 CYC 800 HBA2 CYC 800 18.662 5.107 -3.257 1219 HHB CYC 800 HHB CYC 800 25.546 4.366 -2.876 1220 HB CYC 800 HB CYC 800 23.517 6.307 -0.183 1221 HMB1 CYC 800 HMB1 CYC 800 27.415 4.951 -2.540 1222 HMB2 CYC 800 HMB2 CYC 800 28.497 6.149 -1.725 1223 HMB3 CYC 800 HMB3 CYC 800 28.298 4.479 -1.036 1224 HAB1 CYC 800 HAB1 CYC 800 27.617 6.325 2.363 1225 HAB2 CYC 800 HAB2 CYC 800 27.604 7.977 1.618 1226 HBB1 CYC 800 HBB1 CYC 800 29.263 7.244 -0.112 1227 HBB2 CYC 800 HBB2 CYC 800 29.908 6.877 1.523 1228 HBB3 CYC 800 HBB3 CYC 800 29.226 5.557 0.537 1229 HC CYC 800 HC CYC 800 23.418 -0.024 -2.307 1230 H2C CYC 800 H2C CYC 800 25.410 -3.140 -0.739 1231 H3C CYC 800 H3C CYC 800 24.870 -3.512 -3.676 1232 HMC1 CYC 800 HMC1 CYC 800 26.766 -2.002 -3.308 1233 HMC2 CYC 800 HMC2 CYC 800 27.534 -2.025 -1.675 1234 HMC3 CYC 800 HMC3 CYC 800 27.165 -3.573 -2.525 1235 HAC1 CYC 800 HAC CYC 800 24.268 -4.999 -1.675 1236 HBC1 CYC 800 HBC1 CYC 800 22.401 -6.008 -2.865 1237 HBC2 CYC 800 HBC2 CYC 800 23.569 -5.339 -4.062 1238 HBC3 CYC 800 HBC3 CYC 800 22.027 -4.474 -3.713 1239 HHD CYC 800 HHD CYC 800 22.271 -2.793 -4.555 1240 HD CYC 800 HD CYC 800 22.780 0.903 -3.717 1241 HMD1 CYC 800 HMD1 CYC 800 19.735 -2.917 -4.402 1242 HMD2 CYC 800 HMD2 CYC 800 18.418 -1.926 -5.142 1243 HMD3 CYC 800 HMD3 CYC 800 19.854 -2.399 -6.126 1244 HAD1 CYC 800 HAD1 CYC 800 18.245 1.901 -5.190 1245 HAD2 CYC 800 HAD2 CYC 800 17.938 0.278 -5.883 1246 HBD1 CYC 800 HBD1 CYC 800 16.368 1.011 -3.947 1247 HBD2 CYC 800 HBD2 CYC 800 17.178 -0.590 -3.732 1248 HA CYC 800 HA CYC 800 23.437 2.620 -3.341 Start of MODEL 3 1 H SER 599 HT1 SER 599 46.989 17.841 1.189 2 HA SER 599 HA SER 599 48.671 19.877 -0.111 3 HB2 SER 599 HB2 SER 599 45.947 18.791 -0.884 4 HB3 SER 599 HB1 SER 599 46.836 20.056 -1.732 5 HG SER 599 HG SER 599 47.390 17.290 -1.563 6 H ASP 600 HN ASP 600 47.142 21.858 -0.480 7 HA ASP 600 HA ASP 600 46.496 22.863 2.118 8 HB2 ASP 600 HB2 ASP 600 47.511 24.306 0.452 9 HB3 ASP 600 HB1 ASP 600 46.157 24.054 -0.641 10 H VAL 601 HN VAL 601 44.657 21.518 -0.499 11 HA VAL 601 HA VAL 601 42.184 22.723 0.043 12 HB VAL 601 HB VAL 601 42.695 21.644 -2.106 13 HG11 VAL 601 HG11 VAL 601 42.517 19.219 -2.368 14 HG12 VAL 601 HG12 VAL 601 42.397 19.046 -0.617 15 HG13 VAL 601 HG13 VAL 601 43.875 19.679 -1.341 16 HG21 VAL 601 HG21 VAL 601 40.253 20.525 -0.735 17 HG22 VAL 601 HG22 VAL 601 40.503 20.602 -2.479 18 HG23 VAL 601 HG23 VAL 601 40.376 22.089 -1.539 19 H GLU 602 HN GLU 602 43.643 19.801 1.443 20 HA GLU 602 HA GLU 602 41.298 18.799 2.647 21 HB2 GLU 602 HB2 GLU 602 44.123 18.558 3.700 22 HB3 GLU 602 HB1 GLU 602 42.755 17.576 4.194 23 HG2 GLU 602 HG2 GLU 602 43.659 16.144 2.716 24 HG3 GLU 602 HG1 GLU 602 42.699 17.087 1.575 25 H GLU 603 HN GLU 603 43.453 21.369 3.581 26 HA GLU 603 HA GLU 603 42.684 21.581 6.292 27 HB2 GLU 603 HB2 GLU 603 44.643 22.702 4.918 28 HB3 GLU 603 HB1 GLU 603 43.469 23.987 4.692 29 HG2 GLU 603 HG2 GLU 603 44.239 22.935 7.396 30 HG3 GLU 603 HG1 GLU 603 45.083 24.268 6.610 31 H ILE 604 HN ILE 604 41.544 23.168 3.336 32 HA ILE 604 HA ILE 604 39.581 24.786 4.463 33 HB ILE 604 HB ILE 604 39.797 23.523 1.725 34 HG12 ILE 604 HG12 ILE 604 39.993 25.944 1.037 35 HG13 ILE 604 HG11 ILE 604 40.007 26.367 2.743 36 HG21 ILE 604 HG21 ILE 604 37.577 25.345 2.649 37 HG22 ILE 604 HG22 ILE 604 37.415 23.650 2.194 38 HG23 ILE 604 HG23 ILE 604 37.871 24.848 0.983 39 HD11 ILE 604 HD11 ILE 604 42.040 24.670 1.315 40 HD12 ILE 604 HD12 ILE 604 42.062 25.074 3.032 41 HD13 ILE 604 HD13 ILE 604 42.244 26.346 1.823 42 H PHE 605 HN PHE 605 39.245 21.442 3.142 43 HA PHE 605 HA PHE 605 36.585 21.088 3.783 44 HB2 PHE 605 HB2 PHE 605 38.907 19.238 3.416 45 HB3 PHE 605 HB1 PHE 605 37.386 18.597 4.021 46 HD1 PHE 605 HD1 PHE 605 38.871 20.500 1.198 47 HD2 PHE 605 HD2 PHE 605 35.667 18.061 2.568 48 HE1 PHE 605 HE1 PHE 605 38.025 20.325 -1.108 49 HE2 PHE 605 HE2 PHE 605 34.815 17.879 0.265 50 HZ PHE 605 HZ PHE 605 35.994 19.013 -1.575 51 H LYS 606 HN LYS 606 39.470 20.314 5.719 52 HA LYS 606 HA LYS 606 38.268 19.194 7.924 53 HB2 LYS 606 HB2 LYS 606 40.683 19.235 7.560 54 HB3 LYS 606 HB1 LYS 606 40.719 20.966 7.811 55 HG2 LYS 606 HG2 LYS 606 39.711 19.201 10.001 56 HG3 LYS 606 HG1 LYS 606 41.445 19.302 9.705 57 HD2 LYS 606 HD2 LYS 606 39.601 21.624 10.310 58 HD3 LYS 606 HD1 LYS 606 40.749 20.893 11.433 59 HE2 LYS 606 HE2 LYS 606 42.584 21.517 9.869 60 HE3 LYS 606 HE1 LYS 606 41.401 22.359 8.872 61 HZ1 LYS 606 HZ1 LYS 606 42.261 23.021 11.618 62 HZ2 LYS 606 HZ2 LYS 606 40.863 23.666 10.937 63 HZ3 LYS 606 HZ3 LYS 606 42.364 23.979 10.224 64 H THR 607 HN THR 607 38.871 22.664 7.357 65 HA THR 607 HA THR 607 37.664 23.446 9.800 66 HB THR 607 HB THR 607 37.436 25.733 8.602 67 HG1 THR 607 HG1 THR 607 37.900 24.427 6.469 68 HG21 THR 607 HG21 THR 607 40.157 24.474 8.936 69 HG22 THR 607 HG22 THR 607 39.177 25.148 10.235 70 HG23 THR 607 HG23 THR 607 39.792 26.200 8.962 71 H THR 608 HN THR 608 36.373 23.140 6.515 72 HA THR 608 HA THR 608 33.862 24.292 7.060 73 HB THR 608 HB THR 608 34.627 22.295 4.919 74 HG1 THR 608 HG1 THR 608 34.508 25.146 4.918 75 HG21 THR 608 HG21 THR 608 32.197 22.424 5.234 76 HG22 THR 608 HG22 THR 608 32.673 23.167 3.707 77 HG23 THR 608 HG23 THR 608 32.266 24.180 5.092 78 H THR 609 HN THR 609 34.928 20.907 6.998 79 HA THR 609 HA THR 609 32.468 19.693 7.338 80 HB THR 609 HB THR 609 33.751 17.780 8.393 81 HG1 THR 609 HG1 THR 609 35.842 18.009 8.767 82 HG21 THR 609 HG21 THR 609 34.911 17.220 6.301 83 HG22 THR 609 HG22 THR 609 34.746 18.891 5.764 84 HG23 THR 609 HG23 THR 609 33.311 17.892 5.991 85 H GLN 610 HN GLN 610 34.685 20.813 9.958 86 HA GLN 610 HA GLN 610 33.007 19.895 12.037 87 HB2 GLN 610 HB2 GLN 610 35.387 20.336 12.362 88 HB3 GLN 610 HB1 GLN 610 35.147 22.033 11.986 89 HG2 GLN 610 HG2 GLN 610 35.372 21.867 14.334 90 HG3 GLN 610 HG1 GLN 610 33.672 22.181 14.007 91 HE21 GLN 610 HE21 GLN 610 35.019 20.980 16.315 92 HE22 GLN 610 HE22 GLN 610 34.279 19.439 16.558 93 H GLU 611 HN GLU 611 33.282 22.943 10.292 94 HA GLU 611 HA GLU 611 31.557 24.459 11.951 95 HB2 GLU 611 HB2 GLU 611 32.282 24.806 9.040 96 HB3 GLU 611 HB1 GLU 611 31.338 25.969 9.959 97 HG2 GLU 611 HG2 GLU 611 34.164 25.127 10.559 98 HG3 GLU 611 HG1 GLU 611 33.675 26.629 9.779 99 H VAL 612 HN VAL 612 30.959 22.713 8.902 100 HA VAL 612 HA VAL 612 28.194 23.342 8.854 101 HB VAL 612 HB VAL 612 29.518 22.659 6.833 102 HG11 VAL 612 HG11 VAL 612 30.728 20.778 7.775 103 HG12 VAL 612 HG12 VAL 612 29.821 20.291 6.343 104 HG13 VAL 612 HG13 VAL 612 29.222 19.878 7.950 105 HG21 VAL 612 HG21 VAL 612 27.001 21.091 7.378 106 HG22 VAL 612 HG22 VAL 612 27.696 21.386 5.784 107 HG23 VAL 612 HG23 VAL 612 27.098 22.735 6.749 108 H ARG 613 HN ARG 613 30.052 20.773 10.329 109 HA ARG 613 HA ARG 613 27.980 18.988 10.933 110 HB2 ARG 613 HB2 ARG 613 30.253 18.306 11.318 111 HB3 ARG 613 HB1 ARG 613 30.525 19.650 12.422 112 HG2 ARG 613 HG2 ARG 613 28.732 18.622 13.886 113 HG3 ARG 613 HG1 ARG 613 28.860 17.194 12.860 114 HD2 ARG 613 HD2 ARG 613 31.068 16.785 13.521 115 HD3 ARG 613 HD1 ARG 613 31.266 18.417 14.166 116 HE ARG 613 HE ARG 613 29.360 16.561 15.404 117 HH11 ARG 613 HH11 ARG 613 32.286 18.476 15.615 118 HH12 ARG 613 HH12 ARG 613 32.359 18.414 17.344 119 HH21 ARG 613 HH21 ARG 613 29.444 16.490 17.700 120 HH22 ARG 613 HH22 ARG 613 30.735 17.281 18.534 121 H GLN 614 HN GLN 614 29.282 21.719 12.739 122 HA GLN 614 HA GLN 614 27.472 21.520 14.910 123 HB2 GLN 614 HB2 GLN 614 29.123 23.841 13.914 124 HB3 GLN 614 HB1 GLN 614 28.236 23.833 15.431 125 HG2 GLN 614 HG2 GLN 614 30.490 21.984 14.689 126 HG3 GLN 614 HG1 GLN 614 30.591 23.365 15.781 127 HE21 GLN 614 HE21 GLN 614 29.569 23.251 17.783 128 HE22 GLN 614 HE22 GLN 614 29.133 21.737 18.496 129 H LEU 615 HN LEU 615 27.501 23.370 11.921 130 HA LEU 615 HA LEU 615 25.302 25.033 12.409 131 HB2 LEU 615 HB2 LEU 615 27.034 25.165 10.547 132 HB3 LEU 615 HB1 LEU 615 26.118 23.925 9.722 133 HG LEU 615 HG LEU 615 24.858 26.557 10.487 134 HD11 LEU 615 HD11 LEU 615 26.829 27.082 9.176 135 HD12 LEU 615 HD12 LEU 615 25.372 27.332 8.214 136 HD13 LEU 615 HD13 LEU 615 26.360 25.896 7.960 137 HD21 LEU 615 HD21 LEU 615 23.344 24.742 9.832 138 HD22 LEU 615 HD22 LEU 615 24.240 24.534 8.328 139 HD23 LEU 615 HD23 LEU 615 23.356 26.030 8.627 140 H LEU 616 HN LEU 616 25.487 21.770 11.099 141 HA LEU 616 HA LEU 616 22.579 21.696 10.766 142 HB2 LEU 616 HB2 LEU 616 24.692 19.666 10.056 143 HB3 LEU 616 HB1 LEU 616 22.979 19.458 9.763 144 HG LEU 616 HG LEU 616 24.738 21.566 8.507 145 HD11 LEU 616 HD11 LEU 616 25.204 19.346 7.653 146 HD12 LEU 616 HD12 LEU 616 24.350 20.304 6.444 147 HD13 LEU 616 HD13 LEU 616 23.486 19.075 7.366 148 HD21 LEU 616 HD21 LEU 616 22.473 22.392 8.802 149 HD22 LEU 616 HD22 LEU 616 21.819 20.922 8.082 150 HD23 LEU 616 HD23 LEU 616 22.770 22.036 7.101 151 H ARG 617 HN ARG 617 24.729 21.163 13.193 152 HA ARG 617 HA ARG 617 24.718 20.083 15.190 153 HB2 ARG 617 HB2 ARG 617 21.759 19.948 14.581 154 HB3 ARG 617 HB1 ARG 617 22.454 19.452 16.117 155 HG2 ARG 617 HG2 ARG 617 22.697 22.217 14.948 156 HG3 ARG 617 HG1 ARG 617 21.494 21.728 16.142 157 HD2 ARG 617 HD2 ARG 617 23.291 21.133 17.701 158 HD3 ARG 617 HD1 ARG 617 24.489 21.631 16.507 159 HE ARG 617 HE ARG 617 23.008 23.846 16.769 160 HH11 ARG 617 HH11 ARG 617 24.508 21.758 19.150 161 HH12 ARG 617 HH12 ARG 617 24.748 23.009 20.310 162 HH21 ARG 617 HH21 ARG 617 23.303 25.531 18.307 163 HH22 ARG 617 HH22 ARG 617 24.044 25.182 19.827 164 H CYS 618 HN CYS 618 25.505 18.543 13.051 165 HA CYS 618 HA CYS 618 24.235 15.957 13.519 166 HB2 CYS 618 HB2 CYS 618 25.508 15.248 11.445 167 HB3 CYS 618 HB1 CYS 618 24.244 16.447 11.199 168 HG CYS 618 HG CYS 618 25.764 18.028 9.885 169 H ASP 619 HN ASP 619 26.112 14.161 12.901 170 HA ASP 619 HA ASP 619 28.167 14.613 14.966 171 HB2 ASP 619 HB2 ASP 619 26.817 12.042 14.151 172 HB3 ASP 619 HB1 ASP 619 28.138 12.166 15.308 173 H ARG 620 HN ARG 620 27.480 12.658 12.114 174 HA ARG 620 HA ARG 620 30.346 12.791 11.500 175 HB2 ARG 620 HB2 ARG 620 29.960 10.527 11.708 176 HB3 ARG 620 HB1 ARG 620 28.322 10.634 11.079 177 HG2 ARG 620 HG2 ARG 620 28.994 10.195 8.991 178 HG3 ARG 620 HG1 ARG 620 30.328 11.343 9.087 179 HD2 ARG 620 HD2 ARG 620 31.044 9.001 8.691 180 HD3 ARG 620 HD1 ARG 620 31.722 9.706 10.156 181 HE ARG 620 HE ARG 620 29.306 8.198 10.580 182 HH11 ARG 620 HH11 ARG 620 32.814 8.022 10.295 183 HH12 ARG 620 HH12 ARG 620 32.943 6.627 11.310 184 HH21 ARG 620 HH21 ARG 620 29.488 6.290 11.900 185 HH22 ARG 620 HH22 ARG 620 31.047 5.622 12.203 186 H VAL 621 HN VAL 621 31.058 13.549 9.700 187 HA VAL 621 HA VAL 621 29.250 14.234 7.494 188 HB VAL 621 HB VAL 621 31.455 16.047 8.551 189 HG11 VAL 621 HG11 VAL 621 30.643 17.659 6.897 190 HG12 VAL 621 HG12 VAL 621 29.470 16.475 6.321 191 HG13 VAL 621 HG13 VAL 621 31.196 16.168 6.132 192 HG21 VAL 621 HG21 VAL 621 29.540 16.104 10.047 193 HG22 VAL 621 HG22 VAL 621 28.460 16.398 8.684 194 HG23 VAL 621 HG23 VAL 621 29.651 17.614 9.142 195 H ALA 622 HN ALA 622 30.025 13.188 5.748 196 HA ALA 622 HA ALA 622 32.912 12.602 5.720 197 HB1 ALA 622 HB1 ALA 622 30.720 10.751 4.806 198 HB2 ALA 622 HB2 ALA 622 31.635 10.602 6.305 199 HB3 ALA 622 HB3 ALA 622 32.452 10.424 4.752 200 H VAL 623 HN VAL 623 33.894 12.313 3.711 201 HA VAL 623 HA VAL 623 32.510 13.674 1.501 202 HB VAL 623 HB VAL 623 35.488 13.623 2.089 203 HG11 VAL 623 HG11 VAL 623 35.705 15.109 0.154 204 HG12 VAL 623 HG12 VAL 623 33.980 14.941 -0.170 205 HG13 VAL 623 HG13 VAL 623 35.044 13.541 -0.312 206 HG21 VAL 623 HG21 VAL 623 34.259 15.164 3.533 207 HG22 VAL 623 HG22 VAL 623 33.521 15.904 2.107 208 HG23 VAL 623 HG23 VAL 623 35.259 16.032 2.365 209 H TYR 624 HN TYR 624 32.310 12.568 -0.340 210 HA TYR 624 HA TYR 624 33.598 9.939 -0.509 211 HB2 TYR 624 HB2 TYR 624 31.249 9.684 -0.080 212 HB3 TYR 624 HB1 TYR 624 30.840 10.934 -1.234 213 HD1 TYR 624 HD1 TYR 624 31.241 7.438 -0.679 214 HD2 TYR 624 HD2 TYR 624 31.242 10.403 -3.726 215 HE1 TYR 624 HE1 TYR 624 30.769 5.710 -2.360 216 HE2 TYR 624 HE2 TYR 624 30.778 8.684 -5.411 217 HH TYR 624 HH TYR 624 29.813 5.523 -4.597 218 H ARG 625 HN ARG 625 34.620 9.520 -2.457 219 HA ARG 625 HA ARG 625 34.375 11.593 -4.534 220 HB2 ARG 625 HB2 ARG 625 36.479 11.874 -3.303 221 HB3 ARG 625 HB1 ARG 625 36.906 10.203 -3.634 222 HG2 ARG 625 HG2 ARG 625 36.910 10.728 -6.053 223 HG3 ARG 625 HG1 ARG 625 36.605 12.419 -5.651 224 HD2 ARG 625 HD2 ARG 625 38.974 12.056 -6.053 225 HD3 ARG 625 HD1 ARG 625 38.691 12.483 -4.368 226 HE ARG 625 HE ARG 625 39.173 10.261 -3.739 227 HH11 ARG 625 HH11 ARG 625 39.597 10.812 -7.183 228 HH12 ARG 625 HH12 ARG 625 40.564 9.400 -7.413 229 HH21 ARG 625 HH21 ARG 625 40.506 8.388 -4.047 230 HH22 ARG 625 HH22 ARG 625 41.068 8.024 -5.642 231 H PHE 626 HN PHE 626 34.253 10.902 -6.602 232 HA PHE 626 HA PHE 626 33.855 8.074 -7.018 233 HB2 PHE 626 HB2 PHE 626 33.525 10.485 -8.803 234 HB3 PHE 626 HB1 PHE 626 33.324 8.838 -9.388 235 HD1 PHE 626 HD1 PHE 626 31.927 11.459 -7.238 236 HD2 PHE 626 HD2 PHE 626 31.410 7.528 -8.775 237 HE1 PHE 626 HE1 PHE 626 29.586 11.480 -6.484 238 HE2 PHE 626 HE2 PHE 626 29.066 7.538 -8.028 239 HZ PHE 626 HZ PHE 626 28.150 9.516 -6.881 240 H ASN 627 HN ASN 627 35.288 6.741 -7.773 241 HA ASN 627 HA ASN 627 37.883 7.712 -8.677 242 HB2 ASN 627 HB2 ASN 627 36.821 5.181 -7.555 243 HB3 ASN 627 HB1 ASN 627 38.113 5.017 -8.733 244 HD21 ASN 627 HD21 ASN 627 38.076 4.439 -5.878 245 HD22 ASN 627 HD22 ASN 627 39.350 5.383 -5.182 246 HA PRO 628 HA PRO 628 37.353 6.869 -13.004 247 HB2 PRO 628 HB2 PRO 628 39.457 5.121 -13.534 248 HB3 PRO 628 HB1 PRO 628 39.574 6.882 -13.521 249 HG2 PRO 628 HG2 PRO 628 40.301 4.916 -11.399 250 HG3 PRO 628 HG1 PRO 628 41.114 6.420 -11.862 251 HD2 PRO 628 HD2 PRO 628 39.595 6.275 -9.661 252 HD3 PRO 628 HD1 PRO 628 39.634 7.740 -10.664 253 H ASN 629 HN ASN 629 37.557 4.210 -10.774 254 HA ASN 629 HA ASN 629 36.134 2.478 -12.680 255 HB2 ASN 629 HB2 ASN 629 37.650 1.810 -10.152 256 HB3 ASN 629 HB1 ASN 629 36.640 0.649 -10.999 257 HD21 ASN 629 HD21 ASN 629 39.474 0.544 -10.490 258 HD22 ASN 629 HD22 ASN 629 40.248 0.447 -12.031 259 H TRP 630 HN TRP 630 35.251 4.753 -10.717 260 HA TRP 630 HA TRP 630 33.504 5.259 -9.349 261 HB2 TRP 630 HB2 TRP 630 32.359 3.092 -11.095 262 HB3 TRP 630 HB1 TRP 630 31.371 3.882 -9.872 263 HD1 TRP 630 HD1 TRP 630 30.479 6.290 -10.405 264 HE1 TRP 630 HE1 TRP 630 30.529 7.779 -12.507 265 HE3 TRP 630 HE3 TRP 630 33.894 3.696 -13.194 266 HZ2 TRP 630 HZ2 TRP 630 31.824 7.871 -14.974 267 HZ3 TRP 630 HZ3 TRP 630 34.481 4.559 -15.423 268 HH2 TRP 630 HH2 TRP 630 33.468 6.601 -16.297 269 H THR 631 HN THR 631 35.313 3.877 -7.939 270 HA THR 631 HA THR 631 33.963 1.666 -6.631 271 HB THR 631 HB THR 631 36.185 1.387 -5.469 272 HG1 THR 631 HG1 THR 631 37.896 2.475 -6.790 273 HG21 THR 631 HG21 THR 631 37.212 0.434 -7.497 274 HG22 THR 631 HG22 THR 631 36.031 1.319 -8.470 275 HG23 THR 631 HG23 THR 631 35.493 0.053 -7.370 276 H GLY 632 HN GLY 632 33.700 4.761 -6.228 277 HA2 GLY 632 HA2 GLY 632 33.024 6.141 -4.506 278 HA3 GLY 632 HA1 GLY 632 32.400 4.660 -3.811 279 H GLU 633 HN GLU 633 35.413 6.532 -4.075 280 HA GLU 633 HA GLU 633 36.333 5.236 -1.626 281 HB2 GLU 633 HB2 GLU 633 37.815 5.350 -3.592 282 HB3 GLU 633 HB1 GLU 633 37.748 7.102 -3.523 283 HG2 GLU 633 HG2 GLU 633 38.814 7.031 -1.313 284 HG3 GLU 633 HG1 GLU 633 38.930 5.275 -1.452 285 H PHE 634 HN PHE 634 36.228 6.221 0.281 286 HA PHE 634 HA PHE 634 35.413 8.999 0.465 287 HB2 PHE 634 HB2 PHE 634 36.027 6.944 2.604 288 HB3 PHE 634 HB1 PHE 634 35.458 8.573 2.928 289 HD1 PHE 634 HD1 PHE 634 34.529 5.209 2.240 290 HD2 PHE 634 HD2 PHE 634 33.174 9.232 1.981 291 HE1 PHE 634 HE1 PHE 634 32.215 4.409 2.114 292 HE2 PHE 634 HE2 PHE 634 30.850 8.438 1.843 293 HZ PHE 634 HZ PHE 634 30.368 6.023 1.909 294 H VAL 635 HN VAL 635 36.778 10.650 0.733 295 HA VAL 635 HA VAL 635 39.609 9.984 1.043 296 HB VAL 635 HB VAL 635 40.084 12.275 0.241 297 HG11 VAL 635 HG11 VAL 635 38.268 10.652 -1.533 298 HG12 VAL 635 HG12 VAL 635 40.006 10.429 -1.332 299 HG13 VAL 635 HG13 VAL 635 39.386 11.901 -2.080 300 HG21 VAL 635 HG21 VAL 635 37.091 12.452 -0.128 301 HG22 VAL 635 HG22 VAL 635 38.268 13.622 -0.723 302 HG23 VAL 635 HG23 VAL 635 38.053 13.392 1.011 303 H ALA 636 HN ALA 636 37.040 11.522 2.773 304 HA ALA 636 HA ALA 636 38.695 11.844 5.078 305 HB1 ALA 636 HB1 ALA 636 37.694 14.367 3.752 306 HB2 ALA 636 HB2 ALA 636 39.378 13.853 3.844 307 HB3 ALA 636 HB3 ALA 636 38.500 14.265 5.317 308 H GLU 637 HN GLU 637 37.510 12.475 6.943 309 HA GLU 637 HA GLU 637 34.698 13.029 6.736 310 HB2 GLU 637 HB2 GLU 637 33.883 11.129 7.949 311 HB3 GLU 637 HB1 GLU 637 34.830 10.511 6.604 312 HG2 GLU 637 HG2 GLU 637 36.672 10.016 8.063 313 HG3 GLU 637 HG1 GLU 637 35.851 10.782 9.422 314 H SER 638 HN SER 638 33.838 13.814 8.677 315 HA SER 638 HA SER 638 35.736 14.139 10.890 316 HB2 SER 638 HB2 SER 638 33.927 16.304 9.798 317 HB3 SER 638 HB1 SER 638 35.018 16.457 11.176 318 HG SER 638 HG SER 638 36.427 15.533 9.137 319 H VAL 639 HN VAL 639 34.901 13.454 12.733 320 HA VAL 639 HA VAL 639 31.992 13.486 13.074 321 HB VAL 639 HB VAL 639 31.946 11.274 13.980 322 HG11 VAL 639 HG11 VAL 639 32.646 9.885 12.105 323 HG12 VAL 639 HG12 VAL 639 33.608 11.222 11.473 324 HG13 VAL 639 HG13 VAL 639 31.853 11.362 11.558 325 HG21 VAL 639 HG21 VAL 639 33.950 9.851 14.125 326 HG22 VAL 639 HG22 VAL 639 34.014 11.250 15.196 327 HG23 VAL 639 HG23 VAL 639 34.947 11.244 13.694 328 H ALA 640 HN ALA 640 31.373 13.222 15.370 329 HA ALA 640 HA ALA 640 32.814 14.937 17.066 330 HB1 ALA 640 HB1 ALA 640 30.762 12.867 17.847 331 HB2 ALA 640 HB2 ALA 640 30.395 14.497 17.296 332 HB3 ALA 640 HB3 ALA 640 31.268 14.252 18.807 333 H HIS 641 HN HIS 641 33.860 14.388 19.082 334 HA HIS 641 HA HIS 641 35.970 12.593 18.669 335 HB2 HIS 641 HB2 HIS 641 35.045 14.004 21.167 336 HB3 HIS 641 HB1 HIS 641 36.507 13.029 21.101 337 HD2 HIS 641 HD2 HIS 641 35.282 15.964 18.701 338 HE1 HIS 641 HE1 HIS 641 39.285 16.666 19.896 339 HE2 HIS 641 HE2 HIS 641 37.403 17.390 18.391 340 H THR 642 HN THR 642 32.854 11.997 19.998 341 HA THR 642 HA THR 642 33.641 9.630 21.448 342 HB THR 642 HB THR 642 30.842 10.529 20.722 343 HG1 THR 642 HG1 THR 642 32.697 11.524 22.479 344 HG21 THR 642 HG21 THR 642 30.999 8.206 21.520 345 HG22 THR 642 HG22 THR 642 30.197 9.234 22.709 346 HG23 THR 642 HG23 THR 642 31.877 8.756 22.948 347 H TRP 643 HN TRP 643 32.828 10.343 18.182 348 HA TRP 643 HA TRP 643 31.789 7.690 17.612 349 HB2 TRP 643 HB2 TRP 643 32.227 10.135 15.928 350 HB3 TRP 643 HB1 TRP 643 31.848 8.579 15.203 351 HD1 TRP 643 HD1 TRP 643 30.337 11.109 17.665 352 HE1 TRP 643 HE1 TRP 643 27.770 10.939 17.524 353 HE3 TRP 643 HE3 TRP 643 29.998 7.157 14.467 354 HZ2 TRP 643 HZ2 TRP 643 25.855 9.310 16.214 355 HZ3 TRP 643 HZ3 TRP 643 27.769 6.349 13.814 356 HH2 TRP 643 HH2 TRP 643 25.742 7.403 14.671 357 H VAL 644 HN VAL 644 32.664 6.627 15.585 358 HA VAL 644 HA VAL 644 35.591 6.504 15.769 359 HB VAL 644 HB VAL 644 35.434 4.185 14.987 360 HG11 VAL 644 HG11 VAL 644 35.391 4.600 17.380 361 HG12 VAL 644 HG12 VAL 644 34.412 3.193 16.967 362 HG13 VAL 644 HG13 VAL 644 33.632 4.731 17.337 363 HG21 VAL 644 HG21 VAL 644 33.400 4.380 13.629 364 HG22 VAL 644 HG22 VAL 644 32.437 4.575 15.094 365 HG23 VAL 644 HG23 VAL 644 33.270 3.052 14.782 366 H LYS 645 HN LYS 645 36.770 6.331 13.833 367 HA LYS 645 HA LYS 645 35.259 7.195 11.471 368 HB2 LYS 645 HB2 LYS 645 37.346 8.252 10.680 369 HB3 LYS 645 HB1 LYS 645 36.788 8.922 12.204 370 HG2 LYS 645 HG2 LYS 645 38.459 7.627 13.406 371 HG3 LYS 645 HG1 LYS 645 38.998 6.898 11.891 372 HD2 LYS 645 HD2 LYS 645 39.635 9.110 11.056 373 HD3 LYS 645 HD1 LYS 645 39.085 9.840 12.566 374 HE2 LYS 645 HE2 LYS 645 41.516 9.553 12.541 375 HE3 LYS 645 HE1 LYS 645 40.763 8.575 13.799 376 HZ1 LYS 645 HZ1 LYS 645 42.482 7.379 12.559 377 HZ2 LYS 645 HZ2 LYS 645 41.596 7.561 11.138 378 HZ3 LYS 645 HZ3 LYS 645 40.971 6.640 12.419 379 H LEU 646 HN LEU 646 35.900 6.421 9.430 380 HA LEU 646 HA LEU 646 37.137 3.748 9.559 381 HB2 LEU 646 HB2 LEU 646 35.089 4.924 7.687 382 HB3 LEU 646 HB1 LEU 646 35.947 3.445 7.320 383 HG LEU 646 HG LEU 646 34.961 2.484 9.453 384 HD11 LEU 646 HD11 LEU 646 32.935 3.541 10.315 385 HD12 LEU 646 HD12 LEU 646 33.205 4.926 9.259 386 HD13 LEU 646 HD13 LEU 646 34.349 4.567 10.552 387 HD21 LEU 646 HD21 LEU 646 34.125 1.878 7.267 388 HD22 LEU 646 HD22 LEU 646 33.119 3.322 7.216 389 HD23 LEU 646 HD23 LEU 646 32.777 2.050 8.391 390 H VAL 647 HN VAL 647 37.161 6.872 8.040 391 HA VAL 647 HA VAL 647 38.927 6.140 5.908 392 HB VAL 647 HB VAL 647 38.251 8.899 6.951 393 HG11 VAL 647 HG11 VAL 647 39.469 8.026 4.331 394 HG12 VAL 647 HG12 VAL 647 40.287 8.904 5.622 395 HG13 VAL 647 HG13 VAL 647 38.972 9.670 4.730 396 HG21 VAL 647 HG21 VAL 647 36.256 7.703 6.239 397 HG22 VAL 647 HG22 VAL 647 37.024 7.301 4.703 398 HG23 VAL 647 HG23 VAL 647 36.649 8.981 5.090 399 H GLY 648 HN GLY 648 41.037 6.015 5.890 400 HA2 GLY 648 HA2 GLY 648 42.630 7.533 7.813 401 HA3 GLY 648 HA1 GLY 648 42.856 5.786 7.729 402 HA PRO 649 HA PRO 649 45.407 8.209 4.468 403 HB2 PRO 649 HB2 PRO 649 47.875 7.457 5.435 404 HB3 PRO 649 HB1 PRO 649 47.082 8.987 5.825 405 HG2 PRO 649 HG2 PRO 649 47.204 6.455 7.411 406 HG3 PRO 649 HG1 PRO 649 47.336 8.134 7.966 407 HD2 PRO 649 HD2 PRO 649 45.071 6.715 8.259 408 HD3 PRO 649 HD1 PRO 649 45.050 8.457 7.921 409 H ASP 650 HN ASP 650 46.314 5.168 6.073 410 HA ASP 650 HA ASP 650 46.875 3.972 3.466 411 HB2 ASP 650 HB2 ASP 650 47.418 3.049 6.286 412 HB3 ASP 650 HB1 ASP 650 47.654 2.011 4.887 413 H ILE 651 HN ILE 651 44.283 4.393 5.403 414 HA ILE 651 HA ILE 651 43.086 1.841 4.568 415 HB ILE 651 HB ILE 651 42.251 3.256 7.101 416 HG12 ILE 651 HG12 ILE 651 44.268 1.004 6.898 417 HG13 ILE 651 HG11 ILE 651 44.671 2.679 7.256 418 HG21 ILE 651 HG21 ILE 651 41.956 0.403 6.141 419 HG22 ILE 651 HG22 ILE 651 40.688 1.629 6.164 420 HG23 ILE 651 HG23 ILE 651 41.367 1.033 7.679 421 HD11 ILE 651 HD11 ILE 651 44.609 1.299 9.262 422 HD12 ILE 651 HD12 ILE 651 42.920 0.905 8.941 423 HD13 ILE 651 HD13 ILE 651 43.384 2.566 9.311 424 H LYS 652 HN LYS 652 42.841 3.956 2.857 425 HA LYS 652 HA LYS 652 40.632 5.588 3.309 426 HB2 LYS 652 HB2 LYS 652 41.715 4.481 0.713 427 HB3 LYS 652 HB1 LYS 652 40.532 5.775 0.829 428 HG2 LYS 652 HG2 LYS 652 42.218 7.098 2.116 429 HG3 LYS 652 HG1 LYS 652 43.395 5.833 1.760 430 HD2 LYS 652 HD2 LYS 652 41.872 7.421 -0.308 431 HD3 LYS 652 HD1 LYS 652 43.532 7.745 0.195 432 HE2 LYS 652 HE2 LYS 652 44.258 5.616 -0.647 433 HE3 LYS 652 HE1 LYS 652 42.597 5.134 -0.992 434 HZ1 LYS 652 HZ1 LYS 652 44.071 7.349 -2.307 435 HZ2 LYS 652 HZ2 LYS 652 42.462 6.919 -2.615 436 HZ3 LYS 652 HZ3 LYS 652 43.714 5.842 -2.996 437 H THR 653 HN THR 653 38.488 5.273 3.118 438 HA THR 653 HA THR 653 37.638 2.521 3.022 439 HB THR 653 HB THR 653 35.974 5.002 3.498 440 HG1 THR 653 HG1 THR 653 37.859 4.314 4.985 441 HG21 THR 653 HG21 THR 653 34.647 3.014 2.883 442 HG22 THR 653 HG22 THR 653 34.402 3.436 4.579 443 HG23 THR 653 HG23 THR 653 35.454 2.088 4.147 444 H VAL 654 HN VAL 654 37.622 1.759 0.972 445 HA VAL 654 HA VAL 654 36.413 3.241 -1.175 446 HB VAL 654 HB VAL 654 38.399 1.814 -1.550 447 HG11 VAL 654 HG11 VAL 654 37.980 0.079 0.083 448 HG12 VAL 654 HG12 VAL 654 38.223 -0.630 -1.513 449 HG13 VAL 654 HG13 VAL 654 36.596 -0.494 -0.848 450 HG21 VAL 654 HG21 VAL 654 36.940 2.215 -3.437 451 HG22 VAL 654 HG22 VAL 654 35.943 0.830 -2.992 452 HG23 VAL 654 HG23 VAL 654 37.606 0.584 -3.525 453 H TRP 655 HN TRP 655 34.422 2.668 -2.230 454 HA TRP 655 HA TRP 655 32.794 0.659 -0.878 455 HB2 TRP 655 HB2 TRP 655 32.440 2.924 0.191 456 HB3 TRP 655 HB1 TRP 655 31.809 3.470 -1.357 457 HD1 TRP 655 HD1 TRP 655 29.471 2.305 -2.181 458 HE1 TRP 655 HE1 TRP 655 27.538 1.330 -0.784 459 HE3 TRP 655 HE3 TRP 655 31.924 1.717 2.246 460 HZ2 TRP 655 HZ2 TRP 655 27.122 0.436 1.852 461 HZ3 TRP 655 HZ3 TRP 655 30.703 0.790 4.159 462 HH2 TRP 655 HH2 TRP 655 28.365 0.161 3.971 463 H GLU 656 HN GLU 656 32.768 -0.574 -2.719 464 HA GLU 656 HA GLU 656 32.097 0.646 -5.234 465 HB2 GLU 656 HB2 GLU 656 33.745 -1.148 -5.204 466 HB3 GLU 656 HB1 GLU 656 32.564 -2.249 -4.509 467 HG2 GLU 656 HG2 GLU 656 31.316 -2.332 -6.488 468 HG3 GLU 656 HG1 GLU 656 32.131 -0.920 -7.156 469 H ASP 657 HN ASP 657 30.065 1.368 -5.229 470 HA ASP 657 HA ASP 657 27.911 -0.384 -4.361 471 HB2 ASP 657 HB2 ASP 657 27.599 1.850 -3.621 472 HB3 ASP 657 HB1 ASP 657 27.970 2.509 -5.212 473 H THR 658 HN THR 658 26.639 -1.463 -5.655 474 HA THR 658 HA THR 658 27.321 -1.700 -8.407 475 HB THR 658 HB THR 658 26.647 -3.680 -7.187 476 HG1 THR 658 HG1 THR 658 25.086 -2.810 -9.352 477 HG21 THR 658 HG21 THR 658 24.321 -3.996 -6.419 478 HG22 THR 658 HG22 THR 658 23.967 -2.320 -6.842 479 HG23 THR 658 HG23 THR 658 25.127 -2.680 -5.562 480 H HIS 659 HN HIS 659 24.856 0.001 -6.609 481 HA HIS 659 HA HIS 659 23.008 0.392 -8.704 482 HB2 HIS 659 HB2 HIS 659 22.433 0.781 -6.355 483 HB3 HIS 659 HB1 HIS 659 23.556 2.135 -6.294 484 HD2 HIS 659 HD2 HIS 659 19.940 1.350 -7.379 485 HE1 HIS 659 HE1 HIS 659 20.696 5.422 -8.259 486 HE2 HIS 659 HE2 HIS 659 18.955 3.708 -7.710 487 H LEU 660 HN LEU 660 25.359 2.732 -7.385 488 HA LEU 660 HA LEU 660 24.985 4.619 -9.427 489 HB2 LEU 660 HB2 LEU 660 27.315 4.173 -7.576 490 HB3 LEU 660 HB1 LEU 660 27.230 5.522 -8.691 491 HG LEU 660 HG LEU 660 25.229 4.996 -6.485 492 HD11 LEU 660 HD11 LEU 660 26.275 6.877 -5.338 493 HD12 LEU 660 HD12 LEU 660 27.491 6.982 -6.611 494 HD13 LEU 660 HD13 LEU 660 27.418 5.555 -5.576 495 HD21 LEU 660 HD21 LEU 660 24.495 7.314 -6.963 496 HD22 LEU 660 HD22 LEU 660 24.247 6.242 -8.344 497 HD23 LEU 660 HD23 LEU 660 25.605 7.364 -8.333 498 H GLN 661 HN GLN 661 27.487 2.100 -9.149 499 HA GLN 661 HA GLN 661 28.827 2.655 -11.518 500 HB2 GLN 661 HB2 GLN 661 28.488 0.176 -9.914 501 HB3 GLN 661 HB1 GLN 661 29.137 0.010 -11.538 502 HG2 GLN 661 HG2 GLN 661 30.870 1.689 -10.949 503 HG3 GLN 661 HG1 GLN 661 30.268 1.659 -9.293 504 HE21 GLN 661 HE21 GLN 661 32.287 0.959 -8.588 505 HE22 GLN 661 HE22 GLN 661 32.807 -0.684 -8.788 506 H GLU 662 HN GLU 662 26.053 0.453 -11.120 507 HA GLU 662 HA GLU 662 25.881 -0.356 -13.801 508 HB2 GLU 662 HB2 GLU 662 24.741 -1.583 -12.082 509 HB3 GLU 662 HB1 GLU 662 23.786 -0.180 -11.637 510 HG2 GLU 662 HG2 GLU 662 22.661 -0.276 -13.815 511 HG3 GLU 662 HG1 GLU 662 23.605 -1.708 -14.224 512 H THR 663 HN THR 663 24.503 2.409 -12.136 513 HA THR 663 HA THR 663 22.958 3.187 -14.461 514 HB THR 663 HB THR 663 22.304 5.132 -13.015 515 HG1 THR 663 HG1 THR 663 23.438 3.747 -10.837 516 HG21 THR 663 HG21 THR 663 20.931 3.122 -13.103 517 HG22 THR 663 HG22 THR 663 20.937 3.792 -11.471 518 HG23 THR 663 HG23 THR 663 21.920 2.377 -11.848 519 H GLN 664 HN GLN 664 26.133 3.603 -13.468 520 HA GLN 664 HA GLN 664 27.823 5.031 -13.968 521 HB2 GLN 664 HB2 GLN 664 25.995 5.316 -16.294 522 HB3 GLN 664 HB1 GLN 664 27.252 6.533 -16.120 523 HG2 GLN 664 HG2 GLN 664 27.751 3.569 -16.165 524 HG3 GLN 664 HG1 GLN 664 27.884 4.630 -17.570 525 HE21 GLN 664 HE21 GLN 664 29.268 3.763 -14.491 526 HE22 GLN 664 HE22 GLN 664 30.768 4.591 -14.709 527 H GLY 665 HN GLY 665 25.778 5.785 -12.148 528 HA2 GLY 665 HA2 GLY 665 25.958 7.754 -10.772 529 HA3 GLY 665 HA1 GLY 665 26.102 8.707 -12.244 530 H GLY 666 HN GLY 666 23.950 6.909 -13.418 531 HA2 GLY 666 HA2 GLY 666 21.687 7.062 -13.781 532 HA3 GLY 666 HA1 GLY 666 21.577 6.983 -12.028 533 H ARG 667 HN ARG 667 20.089 8.417 -11.512 534 HA ARG 667 HA ARG 667 19.695 10.928 -12.813 535 HB2 ARG 667 HB2 ARG 667 18.046 9.494 -11.412 536 HB3 ARG 667 HB1 ARG 667 18.785 10.268 -10.020 537 HG2 ARG 667 HG2 ARG 667 16.903 11.557 -10.433 538 HG3 ARG 667 HG1 ARG 667 18.199 12.477 -11.203 539 HD2 ARG 667 HD2 ARG 667 16.206 12.328 -12.631 540 HD3 ARG 667 HD1 ARG 667 17.604 11.540 -13.366 541 HE ARG 667 HE ARG 667 16.141 9.639 -11.899 542 HH11 ARG 667 HH11 ARG 667 15.824 11.568 -14.800 543 HH12 ARG 667 HH12 ARG 667 14.838 10.415 -15.623 544 HH21 ARG 667 HH21 ARG 667 14.852 8.102 -12.963 545 HH22 ARG 667 HH22 ARG 667 14.288 8.408 -14.571 546 H TYR 668 HN TYR 668 21.668 9.762 -10.257 547 HA TYR 668 HA TYR 668 22.064 12.089 -8.729 548 HB2 TYR 668 HB2 TYR 668 22.646 9.573 -8.274 549 HB3 TYR 668 HB1 TYR 668 24.175 9.985 -9.036 550 HD1 TYR 668 HD1 TYR 668 22.491 9.743 -6.001 551 HD2 TYR 668 HD2 TYR 668 25.287 12.199 -8.058 552 HE1 TYR 668 HE1 TYR 668 23.275 10.631 -3.869 553 HE2 TYR 668 HE2 TYR 668 26.089 13.088 -5.920 554 HH TYR 668 HH TYR 668 25.239 13.380 -3.629 555 H ALA 669 HN ALA 669 23.583 10.868 -11.632 556 HA ALA 669 HA ALA 669 25.905 12.447 -11.633 557 HB1 ALA 669 HB1 ALA 669 24.404 11.376 -14.015 558 HB2 ALA 669 HB2 ALA 669 25.586 10.480 -13.063 559 HB3 ALA 669 HB3 ALA 669 26.088 11.896 -13.985 560 H GLN 670 HN GLN 670 22.669 13.378 -12.105 561 HA GLN 670 HA GLN 670 23.483 15.766 -13.592 562 HB2 GLN 670 HB2 GLN 670 21.571 14.259 -14.384 563 HB3 GLN 670 HB1 GLN 670 20.648 14.922 -13.044 564 HG2 GLN 670 HG2 GLN 670 20.852 17.147 -13.949 565 HG3 GLN 670 HG1 GLN 670 21.898 16.558 -15.238 566 HE21 GLN 670 HE21 GLN 670 19.098 14.834 -14.082 567 HE22 GLN 670 HE22 GLN 670 18.149 15.035 -15.507 568 H GLY 671 HN GLY 671 23.443 14.968 -10.513 569 HA2 GLY 671 HA2 GLY 671 23.773 16.596 -8.814 570 HA3 GLY 671 HA1 GLY 671 22.775 17.713 -9.727 571 H GLU 672 HN GLU 672 21.840 14.412 -9.001 572 HA GLU 672 HA GLU 672 19.451 15.380 -7.722 573 HB2 GLU 672 HB2 GLU 672 19.534 13.352 -9.231 574 HB3 GLU 672 HB1 GLU 672 20.387 12.518 -7.942 575 HG2 GLU 672 HG2 GLU 672 18.023 11.956 -7.958 576 HG3 GLU 672 HG1 GLU 672 18.481 12.781 -6.469 577 H ASN 673 HN ASN 673 18.875 15.140 -5.591 578 HA ASN 673 HA ASN 673 20.867 14.114 -3.712 579 HB2 ASN 673 HB2 ASN 673 20.689 16.111 -2.283 580 HB3 ASN 673 HB1 ASN 673 21.308 16.541 -3.870 581 HD21 ASN 673 HD21 ASN 673 20.095 18.255 -1.942 582 HD22 ASN 673 HD22 ASN 673 18.697 18.949 -2.684 583 H PHE 674 HN PHE 674 19.884 13.882 -1.477 584 HA PHE 674 HA PHE 674 16.978 13.767 -1.464 585 HB2 PHE 674 HB2 PHE 674 17.865 11.628 -2.542 586 HB3 PHE 674 HB1 PHE 674 18.539 11.229 -0.966 587 HD1 PHE 674 HD1 PHE 674 15.307 12.227 -2.535 588 HD2 PHE 674 HD2 PHE 674 17.274 9.956 0.477 589 HE1 PHE 674 HE1 PHE 674 13.153 11.231 -1.887 590 HE2 PHE 674 HE2 PHE 674 15.124 8.957 1.132 591 HZ PHE 674 HZ PHE 674 13.059 9.594 -0.050 592 H VAL 675 HN VAL 675 16.084 13.393 0.606 593 HA VAL 675 HA VAL 675 17.985 13.532 2.838 594 HB VAL 675 HB VAL 675 16.232 14.793 4.119 595 HG11 VAL 675 HG11 VAL 675 18.097 15.986 3.205 596 HG12 VAL 675 HG12 VAL 675 16.643 16.963 3.003 597 HG13 VAL 675 HG13 VAL 675 17.317 16.087 1.628 598 HG21 VAL 675 HG21 VAL 675 14.281 14.186 2.777 599 HG22 VAL 675 HG22 VAL 675 14.932 15.093 1.413 600 HG23 VAL 675 HG23 VAL 675 14.455 15.938 2.884 601 H VAL 676 HN VAL 676 17.755 12.011 4.358 602 HA VAL 676 HA VAL 676 15.475 10.198 4.037 603 HB VAL 676 HB VAL 676 18.244 9.619 5.108 604 HG11 VAL 676 HG11 VAL 676 15.896 7.764 4.718 605 HG12 VAL 676 HG12 VAL 676 16.558 8.289 6.267 606 HG13 VAL 676 HG13 VAL 676 17.525 7.280 5.190 607 HG21 VAL 676 HG21 VAL 676 18.456 8.211 3.112 608 HG22 VAL 676 HG22 VAL 676 18.188 9.904 2.692 609 HG23 VAL 676 HG23 VAL 676 16.864 8.746 2.573 610 H ASN 677 HN ASN 677 14.033 10.226 5.560 611 HA ASN 677 HA ASN 677 14.457 11.509 8.097 612 HB2 ASN 677 HB2 ASN 677 12.129 9.830 7.138 613 HB3 ASN 677 HB1 ASN 677 12.136 10.873 8.556 614 HD21 ASN 677 HD21 ASN 677 12.060 13.096 8.273 615 HD22 ASN 677 HD22 ASN 677 11.550 13.804 6.777 616 H ASP 678 HN ASP 678 13.874 8.227 6.942 617 HA ASP 678 HA ASP 678 15.501 7.141 9.040 618 HB2 ASP 678 HB2 ASP 678 13.896 5.751 10.067 619 HB3 ASP 678 HB1 ASP 678 13.108 7.320 9.949 620 H ILE 679 HN ILE 679 16.021 4.914 8.621 621 HA ILE 679 HA ILE 679 16.323 4.529 5.789 622 HB ILE 679 HB ILE 679 17.745 2.591 6.426 623 HG12 ILE 679 HG12 ILE 679 17.156 3.524 9.253 624 HG13 ILE 679 HG11 ILE 679 16.583 2.022 8.539 625 HG21 ILE 679 HG21 ILE 679 19.539 3.959 7.389 626 HG22 ILE 679 HG22 ILE 679 18.365 5.218 7.768 627 HG23 ILE 679 HG23 ILE 679 18.694 4.798 6.087 628 HD11 ILE 679 HD11 ILE 679 18.891 1.248 8.328 629 HD12 ILE 679 HD12 ILE 679 18.484 1.642 9.999 630 HD13 ILE 679 HD13 ILE 679 19.460 2.757 9.041 631 H TYR 680 HN TYR 680 14.016 3.439 8.014 632 HA TYR 680 HA TYR 680 13.661 0.867 6.711 633 HB2 TYR 680 HB2 TYR 680 13.389 1.269 9.218 634 HB3 TYR 680 HB1 TYR 680 11.863 2.048 8.816 635 HD1 TYR 680 HD1 TYR 680 13.651 -1.110 9.069 636 HD2 TYR 680 HD2 TYR 680 9.994 0.725 7.911 637 HE1 TYR 680 HE1 TYR 680 12.567 -3.308 9.043 638 HE2 TYR 680 HE2 TYR 680 8.896 -1.475 7.886 639 HH TYR 680 HH TYR 680 10.222 -4.193 9.293 640 H GLN 681 HN GLN 681 11.675 3.753 7.296 641 HA GLN 681 HA GLN 681 9.579 2.857 5.565 642 HB2 GLN 681 HB2 GLN 681 9.110 4.234 7.520 643 HB3 GLN 681 HB1 GLN 681 10.082 5.539 6.863 644 HG2 GLN 681 HG2 GLN 681 8.493 5.871 5.076 645 HG3 GLN 681 HG1 GLN 681 7.555 4.479 5.614 646 HE21 GLN 681 HE21 GLN 681 8.492 7.751 6.340 647 HE22 GLN 681 HE22 GLN 681 7.251 8.059 7.501 648 H VAL 682 HN VAL 682 12.544 4.358 4.976 649 HA VAL 682 HA VAL 682 11.800 5.966 2.751 650 HB VAL 682 HB VAL 682 13.931 6.268 4.011 651 HG11 VAL 682 HG11 VAL 682 14.793 3.782 2.557 652 HG12 VAL 682 HG12 VAL 682 14.561 3.956 4.296 653 HG13 VAL 682 HG13 VAL 682 15.849 4.848 3.483 654 HG21 VAL 682 HG21 VAL 682 13.667 7.284 1.814 655 HG22 VAL 682 HG22 VAL 682 14.264 5.809 1.049 656 HG23 VAL 682 HG23 VAL 682 15.336 6.772 2.067 657 H GLY 683 HN GLY 683 12.148 2.590 3.155 658 HA2 GLY 683 HA2 GLY 683 11.485 0.949 1.646 659 HA3 GLY 683 HA1 GLY 683 11.394 2.176 0.395 660 H HIS 684 HN HIS 684 14.252 1.680 2.340 661 HA HIS 684 HA HIS 684 15.757 1.147 -0.061 662 HB2 HIS 684 HB2 HIS 684 16.509 1.656 2.793 663 HB3 HIS 684 HB1 HIS 684 17.689 0.963 1.686 664 HD2 HIS 684 HD2 HIS 684 15.647 3.401 -0.299 665 HE1 HIS 684 HE1 HIS 684 18.918 5.629 1.213 666 HE2 HIS 684 HE2 HIS 684 17.199 5.430 -0.610 667 H SER 685 HN SER 685 16.977 -0.655 -0.507 668 HA SER 685 HA SER 685 15.685 -3.097 0.110 669 HB2 SER 685 HB2 SER 685 18.312 -2.555 -1.285 670 HB3 SER 685 HB1 SER 685 17.476 -4.109 -1.271 671 HG SER 685 HG SER 685 15.715 -2.282 -1.992 672 HA PRO 686 HA PRO 686 17.508 -4.778 3.730 673 HB2 PRO 686 HB2 PRO 686 18.429 -7.039 2.001 674 HB3 PRO 686 HB1 PRO 686 17.585 -7.085 3.555 675 HG2 PRO 686 HG2 PRO 686 16.248 -7.524 1.317 676 HG3 PRO 686 HG1 PRO 686 15.536 -6.533 2.605 677 HD2 PRO 686 HD2 PRO 686 16.719 -5.693 0.002 678 HD3 PRO 686 HD1 PRO 686 15.355 -4.999 0.900 679 H CYS 687 HN CYS 687 19.612 -5.249 0.870 680 HA CYS 687 HA CYS 687 22.032 -5.523 2.261 681 HB2 CYS 687 HB2 CYS 687 23.120 -5.230 0.173 682 HB3 CYS 687 HB1 CYS 687 21.572 -5.968 -0.224 683 H HIS 688 HN HIS 688 20.211 -2.718 1.329 684 HA HIS 688 HA HIS 688 22.396 -0.881 1.805 685 HB2 HIS 688 HB2 HIS 688 20.546 -0.791 -0.031 686 HB3 HIS 688 HB1 HIS 688 19.554 -0.103 1.242 687 HD1 HIS 688 HD1 HIS 688 19.602 1.896 -0.642 688 HD2 HIS 688 HD2 HIS 688 23.083 1.270 1.577 689 HE1 HIS 688 HE1 HIS 688 20.953 4.002 -0.886 690 H ILE 689 HN ILE 689 19.202 -1.632 3.185 691 HA ILE 689 HA ILE 689 19.232 0.384 5.158 692 HB ILE 689 HB ILE 689 17.154 -0.756 4.440 693 HG12 ILE 689 HG12 ILE 689 17.724 -1.006 7.402 694 HG13 ILE 689 HG11 ILE 689 17.188 0.452 6.578 695 HG21 ILE 689 HG21 ILE 689 18.163 -3.108 6.018 696 HG22 ILE 689 HG22 ILE 689 18.027 -3.015 4.265 697 HG23 ILE 689 HG23 ILE 689 16.573 -2.960 5.264 698 HD11 ILE 689 HD11 ILE 689 15.627 -2.106 6.857 699 HD12 ILE 689 HD12 ILE 689 15.087 -0.661 6.003 700 HD13 ILE 689 HD13 ILE 689 15.353 -0.608 7.745 701 H GLU 690 HN GLU 690 20.488 -2.893 5.179 702 HA GLU 690 HA GLU 690 20.847 -3.076 8.003 703 HB2 GLU 690 HB2 GLU 690 20.718 -5.092 6.688 704 HB3 GLU 690 HB1 GLU 690 22.100 -4.601 5.721 705 HG2 GLU 690 HG2 GLU 690 23.548 -4.801 7.670 706 HG3 GLU 690 HG1 GLU 690 22.162 -5.266 8.655 707 H ILE 691 HN ILE 691 22.786 -1.902 5.354 708 HA ILE 691 HA ILE 691 25.247 -1.810 6.731 709 HB ILE 691 HB ILE 691 24.222 -0.453 4.253 710 HG12 ILE 691 HG12 ILE 691 26.299 -2.603 4.730 711 HG13 ILE 691 HG11 ILE 691 24.666 -2.865 4.133 712 HG21 ILE 691 HG21 ILE 691 27.001 -0.249 5.386 713 HG22 ILE 691 HG22 ILE 691 25.810 1.051 5.339 714 HG23 ILE 691 HG23 ILE 691 26.450 0.389 3.835 715 HD11 ILE 691 HD11 ILE 691 26.232 -2.969 2.316 716 HD12 ILE 691 HD12 ILE 691 26.881 -1.387 2.738 717 HD13 ILE 691 HD13 ILE 691 25.229 -1.528 2.133 718 H LEU 692 HN LEU 692 22.656 0.503 6.268 719 HA LEU 692 HA LEU 692 23.991 2.731 7.391 720 HB2 LEU 692 HB2 LEU 692 21.139 2.084 6.851 721 HB3 LEU 692 HB1 LEU 692 21.488 3.411 7.939 722 HG LEU 692 HG LEU 692 21.101 4.246 5.699 723 HD11 LEU 692 HD11 LEU 692 22.722 5.409 7.114 724 HD12 LEU 692 HD12 LEU 692 23.102 5.563 5.401 725 HD13 LEU 692 HD13 LEU 692 24.022 4.447 6.409 726 HD21 LEU 692 HD21 LEU 692 23.416 2.501 4.867 727 HD22 LEU 692 HD22 LEU 692 22.616 3.700 3.850 728 HD23 LEU 692 HD23 LEU 692 21.725 2.285 4.409 729 H GLU 693 HN GLU 693 22.123 0.141 8.824 730 HA GLU 693 HA GLU 693 21.996 1.233 11.426 731 HB2 GLU 693 HB2 GLU 693 20.562 -0.634 10.633 732 HB3 GLU 693 HB1 GLU 693 21.973 -1.681 10.605 733 HG2 GLU 693 HG2 GLU 693 22.221 -1.467 13.000 734 HG3 GLU 693 HG1 GLU 693 20.878 -0.327 13.060 735 H GLN 694 HN GLN 694 24.450 -0.481 9.653 736 HA GLN 694 HA GLN 694 26.054 -1.096 11.950 737 HB2 GLN 694 HB2 GLN 694 26.809 -1.108 9.024 738 HB3 GLN 694 HB1 GLN 694 27.765 -1.792 10.333 739 HG2 GLN 694 HG2 GLN 694 25.079 -2.722 9.351 740 HG3 GLN 694 HG1 GLN 694 26.621 -3.567 9.229 741 HE21 GLN 694 HE21 GLN 694 24.077 -4.360 10.462 742 HE22 GLN 694 HE22 GLN 694 24.449 -4.741 12.105 743 H PHE 695 HN PHE 695 25.517 1.691 10.106 744 HA PHE 695 HA PHE 695 28.055 2.885 10.900 745 HB2 PHE 695 HB2 PHE 695 25.800 3.825 9.148 746 HB3 PHE 695 HB1 PHE 695 26.979 4.969 9.779 747 HD1 PHE 695 HD1 PHE 695 26.214 2.766 7.141 748 HD2 PHE 695 HD2 PHE 695 29.492 4.356 9.349 749 HE1 PHE 695 HE1 PHE 695 27.732 2.221 5.283 750 HE2 PHE 695 HE2 PHE 695 31.014 3.810 7.478 751 HZ PHE 695 HZ PHE 695 30.128 2.744 5.453 752 H GLU 696 HN GLU 696 25.205 2.226 12.286 753 HA GLU 696 HA GLU 696 24.222 2.789 14.232 754 HB2 GLU 696 HB2 GLU 696 26.639 4.554 14.664 755 HB3 GLU 696 HB1 GLU 696 25.506 4.022 15.901 756 HG2 GLU 696 HG2 GLU 696 26.169 1.707 15.524 757 HG3 GLU 696 HG1 GLU 696 27.288 2.228 14.269 758 H VAL 697 HN VAL 697 23.438 4.170 11.925 759 HA VAL 697 HA VAL 697 22.222 6.491 13.184 760 HB VAL 697 HB VAL 697 24.273 7.344 12.063 761 HG11 VAL 697 HG11 VAL 697 22.959 6.442 9.508 762 HG12 VAL 697 HG12 VAL 697 24.377 5.705 10.249 763 HG13 VAL 697 HG13 VAL 697 24.460 7.361 9.652 764 HG21 VAL 697 HG21 VAL 697 23.144 9.152 10.792 765 HG22 VAL 697 HG22 VAL 697 22.395 8.827 12.350 766 HG23 VAL 697 HG23 VAL 697 21.650 8.224 10.871 767 H LYS 698 HN LYS 698 20.274 7.170 12.032 768 HA LYS 698 HA LYS 698 19.276 5.177 10.115 769 HB2 LYS 698 HB2 LYS 698 17.791 6.379 12.451 770 HB3 LYS 698 HB1 LYS 698 17.002 5.498 11.152 771 HG2 LYS 698 HG2 LYS 698 18.325 3.505 11.717 772 HG3 LYS 698 HG1 LYS 698 19.080 4.398 13.038 773 HD2 LYS 698 HD2 LYS 698 16.947 4.656 14.142 774 HD3 LYS 698 HD1 LYS 698 16.111 3.911 12.779 775 HE2 LYS 698 HE2 LYS 698 16.355 2.315 14.592 776 HE3 LYS 698 HE1 LYS 698 17.324 1.813 13.208 777 HZ1 LYS 698 HZ1 LYS 698 19.274 2.775 14.324 778 HZ2 LYS 698 HZ2 LYS 698 18.573 1.532 15.216 779 HZ3 LYS 698 HZ3 LYS 698 18.324 3.136 15.676 780 H ALA 699 HN ALA 699 19.874 8.434 10.663 781 HA ALA 699 HA ALA 699 18.158 9.165 8.399 782 HB1 ALA 699 HB1 ALA 699 18.553 10.830 10.889 783 HB2 ALA 699 HB2 ALA 699 17.078 9.968 10.450 784 HB3 ALA 699 HB3 ALA 699 17.646 11.309 9.455 785 H TYR 700 HN TYR 700 18.994 10.842 7.064 786 HA TYR 700 HA TYR 700 21.451 12.113 7.588 787 HB2 TYR 700 HB2 TYR 700 22.883 10.958 5.942 788 HB3 TYR 700 HB1 TYR 700 22.445 9.925 7.291 789 HD1 TYR 700 HD1 TYR 700 22.064 10.510 3.696 790 HD2 TYR 700 HD2 TYR 700 20.993 7.991 6.951 791 HE1 TYR 700 HE1 TYR 700 21.309 8.790 2.104 792 HE2 TYR 700 HE2 TYR 700 20.237 6.266 5.372 793 HH TYR 700 HH TYR 700 21.028 6.279 2.140 794 H VAL 701 HN VAL 701 22.387 13.082 5.537 795 HA VAL 701 HA VAL 701 20.252 13.680 3.615 796 HB VAL 701 HB VAL 701 20.430 15.595 5.126 797 HG11 VAL 701 HG11 VAL 701 22.681 15.246 5.947 798 HG12 VAL 701 HG12 VAL 701 22.499 16.887 5.318 799 HG13 VAL 701 HG13 VAL 701 23.340 15.664 4.364 800 HG21 VAL 701 HG21 VAL 701 21.729 16.215 2.473 801 HG22 VAL 701 HG22 VAL 701 20.881 17.363 3.510 802 HG23 VAL 701 HG23 VAL 701 19.997 16.042 2.748 803 H ILE 702 HN ILE 702 20.885 13.873 1.498 804 HA ILE 702 HA ILE 702 23.700 13.196 0.918 805 HB ILE 702 HB ILE 702 21.198 12.316 -0.540 806 HG12 ILE 702 HG12 ILE 702 21.595 11.144 1.599 807 HG13 ILE 702 HG11 ILE 702 21.734 10.077 0.207 808 HG21 ILE 702 HG21 ILE 702 24.078 11.668 -1.117 809 HG22 ILE 702 HG22 ILE 702 23.021 12.689 -2.091 810 HG23 ILE 702 HG23 ILE 702 22.679 10.966 -1.929 811 HD11 ILE 702 HD11 ILE 702 24.148 10.179 0.346 812 HD12 ILE 702 HD12 ILE 702 23.455 9.643 1.877 813 HD13 ILE 702 HD13 ILE 702 24.040 11.298 1.706 814 H VAL 703 HN VAL 703 24.710 14.785 -0.195 815 HA VAL 703 HA VAL 703 23.200 16.170 -2.298 816 HB VAL 703 HB VAL 703 24.347 18.307 -1.814 817 HG11 VAL 703 HG11 VAL 703 22.120 17.981 -0.927 818 HG12 VAL 703 HG12 VAL 703 23.088 18.936 0.196 819 HG13 VAL 703 HG13 VAL 703 22.783 17.230 0.524 820 HG21 VAL 703 HG21 VAL 703 25.337 16.943 0.689 821 HG22 VAL 703 HG22 VAL 703 25.532 18.652 0.291 822 HG23 VAL 703 HG23 VAL 703 26.324 17.423 -0.692 823 HA PRO 704 HA PRO 704 26.812 15.057 -4.645 824 HB2 PRO 704 HB2 PRO 704 26.223 16.262 -6.951 825 HB3 PRO 704 HB1 PRO 704 25.252 14.911 -6.357 826 HG2 PRO 704 HG2 PRO 704 24.679 17.844 -6.243 827 HG3 PRO 704 HG1 PRO 704 23.581 16.503 -6.615 828 HD2 PRO 704 HD2 PRO 704 23.767 17.732 -4.147 829 HD3 PRO 704 HD1 PRO 704 23.163 16.085 -4.412 830 H VAL 705 HN VAL 705 28.793 15.878 -5.314 831 HA VAL 705 HA VAL 705 29.187 18.791 -5.092 832 HB VAL 705 HB VAL 705 31.148 16.638 -4.233 833 HG11 VAL 705 HG11 VAL 705 32.266 18.608 -5.137 834 HG12 VAL 705 HG12 VAL 705 32.507 18.498 -3.393 835 HG13 VAL 705 HG13 VAL 705 31.341 19.646 -4.051 836 HG21 VAL 705 HG21 VAL 705 30.771 17.398 -1.961 837 HG22 VAL 705 HG22 VAL 705 29.242 16.891 -2.682 838 HG23 VAL 705 HG23 VAL 705 29.620 18.607 -2.529 839 H PHE 706 HN PHE 706 29.576 19.517 -7.077 840 HA PHE 706 HA PHE 706 30.965 17.813 -9.005 841 HB2 PHE 706 HB2 PHE 706 29.427 20.393 -9.366 842 HB3 PHE 706 HB1 PHE 706 30.261 19.550 -10.665 843 HD1 PHE 706 HD1 PHE 706 27.394 19.498 -8.395 844 HD2 PHE 706 HD2 PHE 706 29.389 17.499 -11.577 845 HE1 PHE 706 HE1 PHE 706 25.390 18.131 -8.786 846 HE2 PHE 706 HE2 PHE 706 27.386 16.127 -11.975 847 HZ PHE 706 HZ PHE 706 25.384 16.443 -10.580 848 H ALA 707 HN ALA 707 32.957 18.256 -9.757 849 HA ALA 707 HA ALA 707 34.136 20.858 -9.272 850 HB1 ALA 707 HB1 ALA 707 36.110 19.953 -8.166 851 HB2 ALA 707 HB2 ALA 707 35.413 18.334 -8.213 852 HB3 ALA 707 HB3 ALA 707 34.661 19.588 -7.229 853 H GLY 708 HN GLY 708 34.674 21.354 -11.275 854 HA2 GLY 708 HA2 GLY 708 36.376 21.179 -12.953 855 HA3 GLY 708 HA1 GLY 708 36.353 19.434 -12.733 856 H GLU 709 HN GLU 709 35.431 18.365 -14.321 857 HA GLU 709 HA GLU 709 33.429 19.757 -15.973 858 HB2 GLU 709 HB2 GLU 709 35.252 17.459 -16.691 859 HB3 GLU 709 HB1 GLU 709 34.082 18.207 -17.768 860 HG2 GLU 709 HG2 GLU 709 36.473 19.570 -16.553 861 HG3 GLU 709 HG1 GLU 709 36.353 18.970 -18.206 862 H GLN 710 HN GLN 710 33.924 17.102 -13.856 863 HA GLN 710 HA GLN 710 31.312 16.004 -14.641 864 HB2 GLN 710 HB2 GLN 710 33.738 14.360 -13.910 865 HB3 GLN 710 HB1 GLN 710 32.145 13.733 -14.303 866 HG2 GLN 710 HG2 GLN 710 32.358 14.547 -16.574 867 HG3 GLN 710 HG1 GLN 710 33.917 15.270 -16.187 868 HE21 GLN 710 HE21 GLN 710 35.004 14.077 -17.708 869 HE22 GLN 710 HE22 GLN 710 35.304 12.387 -17.531 870 H LEU 711 HN LEU 711 30.788 14.207 -12.886 871 HA LEU 711 HA LEU 711 30.483 15.560 -10.409 872 HB2 LEU 711 HB2 LEU 711 28.815 13.977 -11.299 873 HB3 LEU 711 HB1 LEU 711 29.979 12.675 -11.170 874 HG LEU 711 HG LEU 711 29.952 12.863 -8.729 875 HD11 LEU 711 HD11 LEU 711 27.896 15.024 -9.168 876 HD12 LEU 711 HD12 LEU 711 29.521 15.248 -8.518 877 HD13 LEU 711 HD13 LEU 711 28.330 14.317 -7.612 878 HD21 LEU 711 HD21 LEU 711 27.680 12.057 -8.355 879 HD22 LEU 711 HD22 LEU 711 28.356 11.374 -9.834 880 HD23 LEU 711 HD23 LEU 711 27.187 12.693 -9.925 881 H TRP 712 HN TRP 712 31.983 15.706 -8.886 882 HA TRP 712 HA TRP 712 34.317 13.990 -8.999 883 HB2 TRP 712 HB2 TRP 712 34.712 16.366 -8.724 884 HB3 TRP 712 HB1 TRP 712 33.678 16.415 -7.303 885 HD1 TRP 712 HD1 TRP 712 37.134 15.145 -8.438 886 HE1 TRP 712 HE1 TRP 712 38.618 14.833 -6.361 887 HE3 TRP 712 HE3 TRP 712 33.647 16.043 -4.785 888 HZ2 TRP 712 HZ2 TRP 712 38.353 14.945 -3.546 889 HZ3 TRP 712 HZ3 TRP 712 34.356 15.918 -2.420 890 HH2 TRP 712 HH2 TRP 712 36.651 15.382 -1.821 891 H GLY 713 HN GLY 713 32.054 15.070 -6.443 892 HA2 GLY 713 HA2 GLY 713 32.117 12.411 -5.319 893 HA3 GLY 713 HA1 GLY 713 32.832 13.696 -4.360 894 H LEU 714 HN LEU 714 31.202 13.030 -2.863 895 HA LEU 714 HA LEU 714 28.840 14.617 -3.175 896 HB2 LEU 714 HB2 LEU 714 27.217 12.909 -2.575 897 HB3 LEU 714 HB1 LEU 714 28.025 12.486 -4.063 898 HG LEU 714 HG LEU 714 29.490 10.961 -2.547 899 HD11 LEU 714 HD11 LEU 714 27.043 11.287 -0.811 900 HD12 LEU 714 HD12 LEU 714 28.673 11.821 -0.404 901 HD13 LEU 714 HD13 LEU 714 28.328 10.101 -0.581 902 HD21 LEU 714 HD21 LEU 714 27.975 10.140 -4.249 903 HD22 LEU 714 HD22 LEU 714 26.605 10.342 -3.157 904 HD23 LEU 714 HD23 LEU 714 27.852 9.148 -2.797 905 H LEU 715 HN LEU 715 27.727 14.941 -1.125 906 HA LEU 715 HA LEU 715 29.586 14.555 1.122 907 HB2 LEU 715 HB2 LEU 715 29.622 16.872 0.266 908 HB3 LEU 715 HB1 LEU 715 27.898 16.989 0.539 909 HG LEU 715 HG LEU 715 28.299 16.701 2.976 910 HD11 LEU 715 HD11 LEU 715 30.402 15.495 2.884 911 HD12 LEU 715 HD12 LEU 715 30.578 16.975 3.827 912 HD13 LEU 715 HD13 LEU 715 31.197 16.902 2.177 913 HD21 LEU 715 HD21 LEU 715 28.053 18.923 1.995 914 HD22 LEU 715 HD22 LEU 715 29.786 18.980 1.673 915 HD23 LEU 715 HD23 LEU 715 29.199 18.944 3.336 916 H ALA 716 HN ALA 716 28.703 13.320 2.612 917 HA ALA 716 HA ALA 716 25.793 13.469 3.013 918 HB1 ALA 716 HB1 ALA 716 25.857 11.131 3.682 919 HB2 ALA 716 HB2 ALA 716 27.599 11.087 3.415 920 HB3 ALA 716 HB3 ALA 716 26.504 11.328 2.054 921 H ALA 717 HN ALA 717 25.033 13.620 5.037 922 HA ALA 717 HA ALA 717 26.986 13.716 7.223 923 HB1 ALA 717 HB1 ALA 717 26.416 16.019 6.562 924 HB2 ALA 717 HB2 ALA 717 25.896 15.638 8.200 925 HB3 ALA 717 HB3 ALA 717 24.714 15.678 6.886 926 H TYR 718 HN TYR 718 26.421 12.689 8.993 927 HA TYR 718 HA TYR 718 23.732 11.474 9.100 928 HB2 TYR 718 HB2 TYR 718 26.358 10.280 10.033 929 HB3 TYR 718 HB1 TYR 718 24.795 9.485 10.061 930 HD1 TYR 718 HD1 TYR 718 27.516 10.682 7.878 931 HD2 TYR 718 HD2 TYR 718 23.908 8.441 8.076 932 HE1 TYR 718 HE1 TYR 718 27.974 9.764 5.647 933 HE2 TYR 718 HE2 TYR 718 24.354 7.518 5.844 934 HH TYR 718 HH TYR 718 27.364 7.813 4.295 935 H GLN 719 HN GLN 719 22.641 11.714 11.053 936 HA GLN 719 HA GLN 719 24.244 12.625 13.330 937 HB2 GLN 719 HB2 GLN 719 22.433 14.317 13.855 938 HB3 GLN 719 HB1 GLN 719 23.474 14.663 12.483 939 HG2 GLN 719 HG2 GLN 719 21.739 13.938 10.944 940 HG3 GLN 719 HG1 GLN 719 20.691 13.528 12.298 941 HE21 GLN 719 HE21 GLN 719 22.719 16.343 12.399 942 HE22 GLN 719 HE22 GLN 719 21.467 17.514 12.239 943 H ASN 720 HN ASN 720 24.038 10.849 14.510 944 HA ASN 720 HA ASN 720 23.024 9.104 15.679 945 HB2 ASN 720 HB2 ASN 720 22.709 11.742 16.920 946 HB3 ASN 720 HB1 ASN 720 21.726 10.468 17.633 947 HD21 ASN 720 HD21 ASN 720 24.968 11.530 16.918 948 HD22 ASN 720 HD22 ASN 720 25.750 10.466 18.043 949 H SER 721 HN SER 721 21.494 8.513 13.862 950 HA SER 721 HA SER 721 19.408 7.866 13.152 951 HB2 SER 721 HB2 SER 721 18.012 6.845 14.972 952 HB3 SER 721 HB1 SER 721 19.690 6.326 14.992 953 HG SER 721 HG SER 721 19.358 8.549 16.494 954 H GLY 722 HN GLY 722 16.967 8.232 15.004 955 HA2 GLY 722 HA2 GLY 722 15.462 9.904 15.571 956 HA3 GLY 722 HA1 GLY 722 16.592 11.101 14.958 957 H THR 723 HN THR 723 13.673 9.722 14.452 958 HA THR 723 HA THR 723 13.673 9.596 11.579 959 HB THR 723 HB THR 723 11.254 9.319 11.860 960 HG1 THR 723 HG1 THR 723 10.384 9.960 13.680 961 HG21 THR 723 HG21 THR 723 12.736 7.359 11.936 962 HG22 THR 723 HG22 THR 723 11.350 7.137 13.000 963 HG23 THR 723 HG23 THR 723 12.920 7.568 13.676 964 H ARG 724 HN ARG 724 14.546 12.061 12.477 965 HA ARG 724 HA ARG 724 12.423 13.992 12.527 966 HB2 ARG 724 HB2 ARG 724 14.137 15.679 12.647 967 HB3 ARG 724 HB1 ARG 724 14.557 14.364 13.732 968 HG2 ARG 724 HG2 ARG 724 16.297 13.625 12.354 969 HG3 ARG 724 HG1 ARG 724 15.691 14.521 10.960 970 HD2 ARG 724 HD2 ARG 724 16.893 15.695 13.469 971 HD3 ARG 724 HD1 ARG 724 17.650 15.628 11.876 972 HE ARG 724 HE ARG 724 15.161 17.135 12.363 973 HH11 ARG 724 HH11 ARG 724 18.468 17.044 11.140 974 HH12 ARG 724 HH12 ARG 724 18.353 18.609 10.390 975 HH21 ARG 724 HH21 ARG 724 15.034 19.177 11.372 976 HH22 ARG 724 HH22 ARG 724 16.399 19.803 10.495 977 H ASP 725 HN ASP 725 12.313 15.798 11.022 978 HA ASP 725 HA ASP 725 12.903 14.949 8.282 979 HB2 ASP 725 HB2 ASP 725 11.119 16.526 7.591 980 HB3 ASP 725 HB1 ASP 725 10.517 15.264 8.657 981 H TRP 726 HN TRP 726 14.145 16.196 7.034 982 HA TRP 726 HA TRP 726 15.724 18.200 8.327 983 HB2 TRP 726 HB2 TRP 726 15.694 17.250 5.454 984 HB3 TRP 726 HB1 TRP 726 16.907 18.319 6.155 985 HD1 TRP 726 HD1 TRP 726 15.651 14.674 6.427 986 HE1 TRP 726 HE1 TRP 726 17.551 13.231 7.377 987 HE3 TRP 726 HE3 TRP 726 19.041 18.373 7.422 988 HZ2 TRP 726 HZ2 TRP 726 20.157 13.614 8.408 989 HZ3 TRP 726 HZ3 TRP 726 21.215 17.747 8.387 990 HH2 TRP 726 HH2 TRP 726 21.759 15.418 8.869 991 H ASP 727 HN ASP 727 15.687 20.377 8.064 992 HA ASP 727 HA ASP 727 13.248 21.492 7.024 993 HB2 ASP 727 HB2 ASP 727 14.329 22.361 9.085 994 HB3 ASP 727 HB1 ASP 727 15.692 22.905 8.114 995 H GLU 728 HN GLU 728 13.038 22.836 5.352 996 HA GLU 728 HA GLU 728 14.473 22.349 3.023 997 HB2 GLU 728 HB2 GLU 728 12.820 24.791 3.662 998 HB3 GLU 728 HB1 GLU 728 13.423 24.397 2.058 999 HG2 GLU 728 HG2 GLU 728 12.176 22.247 2.186 1000 HG3 GLU 728 HG1 GLU 728 11.475 22.799 3.704 1001 H SER 729 HN SER 729 15.041 24.932 5.422 1002 HA SER 729 HA SER 729 17.020 26.270 3.932 1003 HB2 SER 729 HB2 SER 729 16.772 26.145 6.938 1004 HB3 SER 729 HB1 SER 729 17.539 27.412 5.982 1005 HG SER 729 HG SER 729 14.809 26.811 6.296 1006 H GLU 730 HN GLU 730 17.117 23.318 5.753 1007 HA GLU 730 HA GLU 730 19.965 23.395 6.260 1008 HB2 GLU 730 HB2 GLU 730 17.914 21.176 6.486 1009 HB3 GLU 730 HB1 GLU 730 19.617 20.949 6.848 1010 HG2 GLU 730 HG2 GLU 730 19.483 22.548 8.655 1011 HG3 GLU 730 HG1 GLU 730 17.804 22.901 8.251 1012 H VAL 731 HN VAL 731 17.762 21.751 4.076 1013 HA VAL 731 HA VAL 731 19.677 20.227 2.681 1014 HB VAL 731 HB VAL 731 17.036 21.210 1.594 1015 HG11 VAL 731 HG11 VAL 731 18.471 20.163 -0.058 1016 HG12 VAL 731 HG12 VAL 731 17.081 19.135 0.298 1017 HG13 VAL 731 HG13 VAL 731 18.662 18.749 0.979 1018 HG21 VAL 731 HG21 VAL 731 16.063 19.144 2.526 1019 HG22 VAL 731 HG22 VAL 731 16.648 20.238 3.779 1020 HG23 VAL 731 HG23 VAL 731 17.591 18.814 3.341 1021 H THR 732 HN THR 732 18.319 23.448 2.077 1022 HA THR 732 HA THR 732 19.523 23.701 -0.499 1023 HB THR 732 HB THR 732 18.813 26.118 -0.245 1024 HG1 THR 732 HG1 THR 732 17.259 25.292 1.948 1025 HG21 THR 732 HG21 THR 732 17.414 24.455 -1.363 1026 HG22 THR 732 HG22 THR 732 16.425 25.589 -0.436 1027 HG23 THR 732 HG23 THR 732 16.745 23.972 0.196 1028 H LEU 733 HN LEU 733 20.430 24.546 2.771 1029 HA LEU 733 HA LEU 733 22.459 26.403 1.986 1030 HB2 LEU 733 HB2 LEU 733 21.212 26.421 4.163 1031 HB3 LEU 733 HB1 LEU 733 22.096 24.987 4.626 1032 HG LEU 733 HG LEU 733 23.558 27.530 3.934 1033 HD11 LEU 733 HD11 LEU 733 21.920 28.129 5.626 1034 HD12 LEU 733 HD12 LEU 733 23.541 28.093 6.320 1035 HD13 LEU 733 HD13 LEU 733 22.423 26.762 6.620 1036 HD21 LEU 733 HD21 LEU 733 24.873 25.466 4.128 1037 HD22 LEU 733 HD22 LEU 733 24.219 25.200 5.745 1038 HD23 LEU 733 HD23 LEU 733 25.255 26.593 5.430 1039 H LEU 734 HN LEU 734 22.347 23.029 3.020 1040 HA LEU 734 HA LEU 734 25.130 22.601 3.010 1041 HB2 LEU 734 HB2 LEU 734 23.519 21.112 4.118 1042 HB3 LEU 734 HB1 LEU 734 22.898 20.624 2.554 1043 HG LEU 734 HG LEU 734 25.108 19.653 2.009 1044 HD11 LEU 734 HD11 LEU 734 26.730 19.322 3.822 1045 HD12 LEU 734 HD12 LEU 734 25.763 20.368 4.860 1046 HD13 LEU 734 HD13 LEU 734 26.521 21.022 3.408 1047 HD21 LEU 734 HD21 LEU 734 23.857 18.653 4.558 1048 HD22 LEU 734 HD22 LEU 734 24.917 17.725 3.496 1049 HD23 LEU 734 HD23 LEU 734 23.338 18.261 2.920 1050 H ALA 735 HN ALA 735 22.652 22.317 0.511 1051 HA ALA 735 HA ALA 735 24.421 21.217 -1.438 1052 HB1 ALA 735 HB1 ALA 735 22.007 20.853 -1.560 1053 HB2 ALA 735 HB2 ALA 735 22.597 21.649 -3.019 1054 HB3 ALA 735 HB3 ALA 735 21.751 22.582 -1.785 1055 H ARG 736 HN ARG 736 23.522 24.436 -0.395 1056 HA ARG 736 HA ARG 736 24.435 25.898 -2.607 1057 HB2 ARG 736 HB2 ARG 736 23.009 26.813 -0.799 1058 HB3 ARG 736 HB1 ARG 736 24.366 26.691 0.311 1059 HG2 ARG 736 HG2 ARG 736 25.572 28.181 -1.458 1060 HG3 ARG 736 HG1 ARG 736 23.925 28.581 -1.945 1061 HD2 ARG 736 HD2 ARG 736 25.111 28.910 0.809 1062 HD3 ARG 736 HD1 ARG 736 24.760 30.197 -0.338 1063 HE ARG 736 HE ARG 736 22.444 28.645 0.310 1064 HH11 ARG 736 HH11 ARG 736 24.480 31.301 1.358 1065 HH12 ARG 736 HH12 ARG 736 23.255 32.031 2.335 1066 HH21 ARG 736 HH21 ARG 736 20.815 29.605 1.622 1067 HH22 ARG 736 HH22 ARG 736 21.163 31.069 2.483 1068 H ILE 737 HN ILE 737 25.983 25.215 0.532 1069 HA ILE 737 HA ILE 737 28.450 26.387 -0.162 1070 HB ILE 737 HB ILE 737 27.728 26.020 2.186 1071 HG12 ILE 737 HG12 ILE 737 30.365 24.680 1.548 1072 HG13 ILE 737 HG11 ILE 737 30.111 26.420 1.600 1073 HG21 ILE 737 HG21 ILE 737 27.998 23.823 3.230 1074 HG22 ILE 737 HG22 ILE 737 28.376 23.123 1.656 1075 HG23 ILE 737 HG23 ILE 737 26.773 23.793 1.961 1076 HD11 ILE 737 HD11 ILE 737 31.152 25.616 3.638 1077 HD12 ILE 737 HD12 ILE 737 29.799 24.518 3.911 1078 HD13 ILE 737 HD13 ILE 737 29.545 26.263 3.970 1079 H GLY 738 HN GLY 738 27.136 23.202 -0.672 1080 HA2 GLY 738 HA2 GLY 738 29.438 21.742 -1.247 1081 HA3 GLY 738 HA1 GLY 738 27.870 21.471 -2.001 1082 H ASN 739 HN ASN 739 27.659 24.039 -3.229 1083 HA ASN 739 HA ASN 739 29.079 23.574 -5.635 1084 HB2 ASN 739 HB2 ASN 739 26.965 24.712 -5.758 1085 HB3 ASN 739 HB1 ASN 739 27.514 25.972 -4.658 1086 HD21 ASN 739 HD21 ASN 739 27.691 24.721 -7.905 1087 HD22 ASN 739 HD22 ASN 739 28.398 26.125 -8.613 1088 H GLN 740 HN GLN 740 29.540 25.868 -2.966 1089 HA GLN 740 HA GLN 740 31.729 27.230 -4.126 1090 HB2 GLN 740 HB2 GLN 740 30.813 26.942 -1.269 1091 HB3 GLN 740 HB1 GLN 740 32.279 27.816 -1.676 1092 HG2 GLN 740 HG2 GLN 740 30.629 29.456 -1.475 1093 HG3 GLN 740 HG1 GLN 740 30.830 29.234 -3.210 1094 HE21 GLN 740 HE21 GLN 740 29.172 28.270 -4.388 1095 HE22 GLN 740 HE22 GLN 740 27.584 28.080 -3.742 1096 H LEU 741 HN LEU 741 31.506 24.366 -2.102 1097 HA LEU 741 HA LEU 741 34.287 24.074 -1.645 1098 HB2 LEU 741 HB2 LEU 741 32.109 21.984 -1.685 1099 HB3 LEU 741 HB1 LEU 741 33.736 21.722 -1.089 1100 HG LEU 741 HG LEU 741 31.705 23.615 0.094 1101 HD11 LEU 741 HD11 LEU 741 32.800 21.000 1.113 1102 HD12 LEU 741 HD12 LEU 741 31.174 21.269 0.483 1103 HD13 LEU 741 HD13 LEU 741 31.687 22.064 1.972 1104 HD21 LEU 741 HD21 LEU 741 33.338 23.903 1.901 1105 HD22 LEU 741 HD22 LEU 741 33.973 24.469 0.359 1106 HD23 LEU 741 HD23 LEU 741 34.496 22.915 1.010 1107 H GLY 742 HN GLY 742 32.094 22.717 -4.092 1108 HA2 GLY 742 HA2 GLY 742 34.073 21.205 -5.433 1109 HA3 GLY 742 HA1 GLY 742 32.530 21.714 -6.104 1110 H LEU 743 HN LEU 743 33.062 24.552 -5.655 1111 HA LEU 743 HA LEU 743 34.415 25.117 -8.085 1112 HB2 LEU 743 HB2 LEU 743 32.560 26.485 -7.260 1113 HB3 LEU 743 HB1 LEU 743 33.510 26.949 -5.864 1114 HG LEU 743 HG LEU 743 35.108 28.099 -7.371 1115 HD11 LEU 743 HD11 LEU 743 33.079 27.445 -9.501 1116 HD12 LEU 743 HD12 LEU 743 34.718 26.803 -9.392 1117 HD13 LEU 743 HD13 LEU 743 34.463 28.522 -9.688 1118 HD21 LEU 743 HD21 LEU 743 32.232 28.966 -7.624 1119 HD22 LEU 743 HD22 LEU 743 33.645 29.987 -7.890 1120 HD23 LEU 743 HD23 LEU 743 33.318 29.338 -6.284 1121 H ALA 744 HN ALA 744 35.199 25.623 -4.652 1122 HA ALA 744 HA ALA 744 37.713 26.825 -5.071 1123 HB1 ALA 744 HB1 ALA 744 36.761 25.213 -2.702 1124 HB2 ALA 744 HB2 ALA 744 36.532 26.946 -2.933 1125 HB3 ALA 744 HB3 ALA 744 38.156 26.291 -2.723 1126 H LEU 745 HN LEU 745 36.700 23.481 -4.845 1127 HA LEU 745 HA LEU 745 39.235 22.288 -4.638 1128 HB2 LEU 745 HB2 LEU 745 36.882 21.263 -4.354 1129 HB3 LEU 745 HB1 LEU 745 36.899 21.071 -6.091 1130 HG LEU 745 HG LEU 745 39.034 19.866 -4.337 1131 HD11 LEU 745 HD11 LEU 745 37.763 17.787 -4.419 1132 HD12 LEU 745 HD12 LEU 745 36.440 18.627 -5.228 1133 HD13 LEU 745 HD13 LEU 745 36.877 19.054 -3.573 1134 HD21 LEU 745 HD21 LEU 745 39.314 18.345 -6.235 1135 HD22 LEU 745 HD22 LEU 745 39.544 20.022 -6.729 1136 HD23 LEU 745 HD23 LEU 745 38.037 19.190 -7.109 1137 H GLN 746 HN GLN 746 37.167 22.749 -7.523 1138 HA GLN 746 HA GLN 746 39.152 21.913 -9.340 1139 HB2 GLN 746 HB2 GLN 746 37.709 22.833 -11.091 1140 HB3 GLN 746 HB1 GLN 746 36.791 21.882 -9.934 1141 HG2 GLN 746 HG2 GLN 746 36.137 24.022 -8.828 1142 HG3 GLN 746 HG1 GLN 746 36.901 24.874 -10.170 1143 HE21 GLN 746 HE21 GLN 746 34.232 22.915 -9.164 1144 HE22 GLN 746 HE22 GLN 746 33.278 23.126 -10.596 1145 H GLN 747 HN GLN 747 38.353 25.083 -7.997 1146 HA GLN 747 HA GLN 747 39.935 26.700 -9.580 1147 HB2 GLN 747 HB2 GLN 747 38.455 27.584 -7.855 1148 HB3 GLN 747 HB1 GLN 747 39.440 26.849 -6.601 1149 HG2 GLN 747 HG2 GLN 747 41.307 28.313 -7.225 1150 HG3 GLN 747 HG1 GLN 747 40.292 29.061 -8.455 1151 HE21 GLN 747 HE21 GLN 747 40.908 28.734 -5.059 1152 HE22 GLN 747 HE22 GLN 747 39.912 30.047 -4.544 1153 H THR 748 HN THR 748 40.829 24.806 -6.722 1154 HA THR 748 HA THR 748 43.522 25.554 -6.568 1155 HB THR 748 HB THR 748 42.316 22.879 -5.802 1156 HG1 THR 748 HG1 THR 748 41.176 24.508 -4.739 1157 HG21 THR 748 HG21 THR 748 44.761 24.328 -4.760 1158 HG22 THR 748 HG22 THR 748 44.778 22.898 -5.792 1159 HG23 THR 748 HG23 THR 748 44.135 22.795 -4.154 1160 H GLU 749 HN GLU 749 41.894 23.046 -8.413 1161 HA GLU 749 HA GLU 749 44.139 21.712 -9.453 1162 HB2 GLU 749 HB2 GLU 749 41.385 22.098 -10.637 1163 HB3 GLU 749 HB1 GLU 749 42.575 20.943 -11.216 1164 HG2 GLU 749 HG2 GLU 749 41.622 20.880 -8.384 1165 HG3 GLU 749 HG1 GLU 749 40.692 20.128 -9.678 1166 H TYR 750 HN TYR 750 42.398 24.592 -10.479 1167 HA TYR 750 HA TYR 750 43.865 24.761 -12.960 1168 HB2 TYR 750 HB2 TYR 750 41.450 25.446 -12.713 1169 HB3 TYR 750 HB1 TYR 750 42.014 26.835 -11.792 1170 HD1 TYR 750 HD1 TYR 750 42.120 25.208 -15.104 1171 HD2 TYR 750 HD2 TYR 750 42.887 28.764 -12.900 1172 HE1 TYR 750 HE1 TYR 750 42.458 26.429 -17.206 1173 HE2 TYR 750 HE2 TYR 750 43.226 29.997 -15.003 1174 HH TYR 750 HH TYR 750 43.843 29.521 -17.339 1175 H LEU 751 HN LEU 751 44.027 26.185 -9.763 1176 HA LEU 751 HA LEU 751 45.539 28.467 -10.247 1177 HB2 LEU 751 HB2 LEU 751 45.725 26.567 -7.905 1178 HB3 LEU 751 HB1 LEU 751 46.471 28.150 -7.950 1179 HG LEU 751 HG LEU 751 43.509 27.579 -8.013 1180 HD11 LEU 751 HD11 LEU 751 44.529 27.206 -5.830 1181 HD12 LEU 751 HD12 LEU 751 43.499 28.636 -5.815 1182 HD13 LEU 751 HD13 LEU 751 45.251 28.813 -5.886 1183 HD21 LEU 751 HD21 LEU 751 44.014 29.545 -9.341 1184 HD22 LEU 751 HD22 LEU 751 44.994 30.203 -8.031 1185 HD23 LEU 751 HD23 LEU 751 43.253 30.019 -7.823 1186 H GLN 752 HN GLN 752 46.635 25.156 -9.795 1187 HA GLN 752 HA GLN 752 48.842 25.421 -11.516 1188 HB2 GLN 752 HB2 GLN 752 49.399 26.528 -9.049 1189 HB3 GLN 752 HB1 GLN 752 50.002 24.887 -8.875 1190 HG2 GLN 752 HG2 GLN 752 50.792 26.824 -11.045 1191 HG3 GLN 752 HG1 GLN 752 51.742 26.439 -9.614 1192 HE21 GLN 752 HE21 GLN 752 50.639 25.330 -12.716 1193 HE22 GLN 752 HE22 GLN 752 51.705 23.975 -12.834 1194 H GLN 753 HN GLN 753 47.354 23.814 -8.776 1195 HA GLN 753 HA GLN 753 46.746 21.664 -8.417 1196 HB2 GLN 753 HB2 GLN 753 46.236 21.566 -10.839 1197 HB3 GLN 753 HB1 GLN 753 47.897 21.098 -11.156 1198 HG2 GLN 753 HG2 GLN 753 47.541 19.055 -9.843 1199 HG3 GLN 753 HG1 GLN 753 45.856 19.525 -9.611 1200 HE21 GLN 753 HE21 GLN 753 46.965 17.182 -10.925 1201 HE22 GLN 753 HE22 GLN 753 46.347 17.205 -12.539 1202 H VAL 754 HN VAL 754 47.675 19.925 -7.396 1203 HA VAL 754 HA VAL 754 50.537 20.141 -6.990 1204 HB VAL 754 HB VAL 754 48.609 18.198 -5.695 1205 HG11 VAL 754 HG11 VAL 754 50.955 17.567 -5.508 1206 HG12 VAL 754 HG12 VAL 754 50.312 18.058 -3.940 1207 HG13 VAL 754 HG13 VAL 754 51.344 19.158 -4.855 1208 HG21 VAL 754 HG21 VAL 754 49.493 20.914 -4.722 1209 HG22 VAL 754 HG22 VAL 754 48.520 19.761 -3.809 1210 HG23 VAL 754 HG23 VAL 754 47.875 20.489 -5.281 1211 HHA CYC 800 HHA CYC 800 19.127 3.325 -4.427 1212 HMA1 CYC 800 HMA1 CYC 800 21.860 7.886 -4.101 1213 HMA2 CYC 800 HMA2 CYC 800 23.603 7.501 -3.897 1214 HMA3 CYC 800 HMA3 CYC 800 22.531 7.574 -2.439 1215 HAA1 CYC 800 HAA1 CYC 800 20.061 7.197 -3.792 1216 HAA2 CYC 800 HAA2 CYC 800 19.981 6.462 -5.419 1217 HBA1 CYC 800 HBA1 CYC 800 17.970 6.482 -3.424 1218 HBA2 CYC 800 HBA2 CYC 800 18.601 4.801 -3.335 1219 HHB CYC 800 HHB CYC 800 25.345 4.390 -3.756 1220 HB CYC 800 HB CYC 800 23.783 7.080 -1.390 1221 HMB1 CYC 800 HMB1 CYC 800 27.263 3.872 -2.448 1222 HMB2 CYC 800 HMB2 CYC 800 27.982 5.281 -3.347 1223 HMB3 CYC 800 HMB3 CYC 800 28.609 4.840 -1.698 1224 HAB1 CYC 800 HAB1 CYC 800 28.135 8.162 0.156 1225 HAB2 CYC 800 HAB2 CYC 800 28.976 6.637 -0.358 1226 HBB1 CYC 800 HBB1 CYC 800 28.714 6.745 2.176 1227 HBB2 CYC 800 HBB2 CYC 800 26.928 6.849 1.976 1228 HBB3 CYC 800 HBB3 CYC 800 27.810 5.356 1.472 1229 HC CYC 800 HC CYC 800 22.646 0.053 -2.075 1230 H2C CYC 800 H2C CYC 800 24.793 -3.050 -0.726 1231 H3C CYC 800 H3C CYC 800 24.320 -3.243 -3.681 1232 HMC1 CYC 800 HMC1 CYC 800 26.875 -1.776 -1.531 1233 HMC2 CYC 800 HMC2 CYC 800 26.589 -3.251 -2.529 1234 HMC3 CYC 800 HMC3 CYC 800 26.130 -1.630 -3.172 1235 HAC1 CYC 800 HAC CYC 800 23.738 -4.835 -1.717 1236 HBC1 CYC 800 HBC1 CYC 800 22.031 -5.937 -3.077 1237 HBC2 CYC 800 HBC2 CYC 800 23.265 -5.188 -4.149 1238 HBC3 CYC 800 HBC3 CYC 800 21.654 -4.410 -3.938 1239 HHD CYC 800 HHD CYC 800 21.689 -2.566 -4.560 1240 HD CYC 800 HD CYC 800 22.277 1.063 -3.850 1241 HMD1 CYC 800 HMD1 CYC 800 18.897 -2.224 -5.633 1242 HMD2 CYC 800 HMD2 CYC 800 19.081 -2.654 -3.887 1243 HMD3 CYC 800 HMD3 CYC 800 17.683 -1.650 -4.428 1244 HAD1 CYC 800 HAD1 CYC 800 17.627 2.173 -4.747 1245 HAD2 CYC 800 HAD2 CYC 800 17.157 0.511 -5.218 1246 HBD1 CYC 800 HBD1 CYC 800 15.960 1.486 -3.126 1247 HBD2 CYC 800 HBD2 CYC 800 16.740 -0.128 -2.903 1248 HA CYC 800 HA CYC 800 23.062 2.795 -3.808 Start of MODEL 4 1 H SER 599 HT1 SER 599 48.583 19.817 3.822 2 HA SER 599 HA SER 599 48.926 20.671 1.032 3 HB2 SER 599 HB2 SER 599 46.965 18.687 2.199 4 HB3 SER 599 HB1 SER 599 47.130 19.132 0.498 5 HG SER 599 HG SER 599 48.261 17.133 1.525 6 H ASP 600 HN ASP 600 47.862 22.464 0.615 7 HA ASP 600 HA ASP 600 46.529 23.933 2.596 8 HB2 ASP 600 HB2 ASP 600 47.690 24.993 0.747 9 HB3 ASP 600 HB1 ASP 600 46.550 24.298 -0.397 10 H VAL 601 HN VAL 601 45.193 22.399 -0.326 11 HA VAL 601 HA VAL 601 42.533 23.094 0.118 12 HB VAL 601 HB VAL 601 43.331 22.270 -2.032 13 HG11 VAL 601 HG11 VAL 601 43.517 19.571 -0.707 14 HG12 VAL 601 HG12 VAL 601 44.860 20.542 -1.312 15 HG13 VAL 601 HG13 VAL 601 43.680 19.871 -2.437 16 HG21 VAL 601 HG21 VAL 601 41.436 20.821 -2.617 17 HG22 VAL 601 HG22 VAL 601 40.943 22.179 -1.606 18 HG23 VAL 601 HG23 VAL 601 41.111 20.571 -0.902 19 H GLU 602 HN GLU 602 44.370 20.434 1.435 20 HA GLU 602 HA GLU 602 42.216 18.880 2.382 21 HB2 GLU 602 HB2 GLU 602 45.071 19.101 3.323 22 HB3 GLU 602 HB1 GLU 602 43.931 17.902 3.919 23 HG2 GLU 602 HG2 GLU 602 44.666 18.188 1.021 24 HG3 GLU 602 HG1 GLU 602 45.506 17.119 2.137 25 H GLU 603 HN GLU 603 44.127 21.469 3.868 26 HA GLU 603 HA GLU 603 42.869 21.288 6.404 27 HB2 GLU 603 HB2 GLU 603 45.082 22.381 5.977 28 HB3 GLU 603 HB1 GLU 603 44.226 23.699 5.190 29 HG2 GLU 603 HG2 GLU 603 43.063 24.197 7.273 30 HG3 GLU 603 HG1 GLU 603 43.907 22.867 8.064 31 H ILE 604 HN ILE 604 42.237 23.111 3.468 32 HA ILE 604 HA ILE 604 40.227 24.800 4.403 33 HB ILE 604 HB ILE 604 40.478 23.521 1.666 34 HG12 ILE 604 HG12 ILE 604 41.387 26.221 2.695 35 HG13 ILE 604 HG11 ILE 604 42.436 24.860 2.316 36 HG21 ILE 604 HG21 ILE 604 39.062 25.362 0.868 37 HG22 ILE 604 HG22 ILE 604 38.846 25.913 2.529 38 HG23 ILE 604 HG23 ILE 604 38.212 24.345 2.031 39 HD11 ILE 604 HD11 ILE 604 40.736 26.396 0.363 40 HD12 ILE 604 HD12 ILE 604 41.750 25.011 -0.036 41 HD13 ILE 604 HD13 ILE 604 42.487 26.504 0.544 42 H PHE 605 HN PHE 605 39.973 21.479 3.054 43 HA PHE 605 HA PHE 605 37.192 21.287 3.362 44 HB2 PHE 605 HB2 PHE 605 39.413 19.359 2.904 45 HB3 PHE 605 HB1 PHE 605 37.870 18.717 3.456 46 HD1 PHE 605 HD1 PHE 605 39.501 20.661 0.768 47 HD2 PHE 605 HD2 PHE 605 36.042 18.515 1.999 48 HE1 PHE 605 HE1 PHE 605 38.639 20.734 -1.537 49 HE2 PHE 605 HE2 PHE 605 35.173 18.580 -0.302 50 HZ PHE 605 HZ PHE 605 36.472 19.691 -2.074 51 H LYS 606 HN LYS 606 39.869 20.359 5.511 52 HA LYS 606 HA LYS 606 38.478 19.051 7.497 53 HB2 LYS 606 HB2 LYS 606 40.872 19.166 7.571 54 HB3 LYS 606 HB1 LYS 606 40.845 20.917 7.682 55 HG2 LYS 606 HG2 LYS 606 39.863 20.762 9.919 56 HG3 LYS 606 HG1 LYS 606 39.889 19.000 9.804 57 HD2 LYS 606 HD2 LYS 606 42.306 19.014 9.644 58 HD3 LYS 606 HD1 LYS 606 42.322 20.777 9.628 59 HE2 LYS 606 HE2 LYS 606 41.278 19.097 11.908 60 HE3 LYS 606 HE1 LYS 606 42.902 19.776 11.835 61 HZ1 LYS 606 HZ1 LYS 606 40.349 21.303 11.913 62 HZ2 LYS 606 HZ2 LYS 606 41.867 21.996 11.688 63 HZ3 LYS 606 HZ3 LYS 606 41.513 21.203 13.135 64 H THR 607 HN THR 607 39.087 22.532 7.282 65 HA THR 607 HA THR 607 37.664 23.226 9.607 66 HB THR 607 HB THR 607 38.171 25.005 7.215 67 HG1 THR 607 HG1 THR 607 40.199 24.469 7.679 68 HG21 THR 607 HG21 THR 607 37.883 25.593 10.170 69 HG22 THR 607 HG22 THR 607 36.694 25.968 8.922 70 HG23 THR 607 HG23 THR 607 38.260 26.781 8.923 71 H THR 608 HN THR 608 36.676 23.170 6.182 72 HA THR 608 HA THR 608 34.137 24.336 6.667 73 HB THR 608 HB THR 608 33.617 23.428 4.329 74 HG1 THR 608 HG1 THR 608 36.399 23.052 4.097 75 HG21 THR 608 HG21 THR 608 34.335 25.729 4.747 76 HG22 THR 608 HG22 THR 608 35.072 25.110 3.268 77 HG23 THR 608 HG23 THR 608 36.020 25.212 4.751 78 H THR 609 HN THR 609 35.174 20.975 6.240 79 HA THR 609 HA THR 609 32.674 19.758 6.289 80 HB THR 609 HB THR 609 35.191 18.590 7.518 81 HG1 THR 609 HG1 THR 609 35.588 19.256 5.378 82 HG21 THR 609 HG21 THR 609 33.135 17.323 7.993 83 HG22 THR 609 HG22 THR 609 34.192 16.438 6.894 84 HG23 THR 609 HG23 THR 609 32.771 17.273 6.268 85 H GLN 610 HN GLN 610 34.714 20.786 9.049 86 HA GLN 610 HA GLN 610 32.946 19.744 11.020 87 HB2 GLN 610 HB2 GLN 610 35.292 20.105 11.521 88 HB3 GLN 610 HB1 GLN 610 35.147 21.812 11.133 89 HG2 GLN 610 HG2 GLN 610 33.596 22.070 13.043 90 HG3 GLN 610 HG1 GLN 610 33.883 20.379 13.458 91 HE21 GLN 610 HE21 GLN 610 34.758 20.942 15.458 92 HE22 GLN 610 HE22 GLN 610 36.324 21.656 15.604 93 H GLU 611 HN GLU 611 33.459 22.856 9.473 94 HA GLU 611 HA GLU 611 31.811 24.511 10.954 95 HB2 GLU 611 HB2 GLU 611 33.310 25.321 9.214 96 HB3 GLU 611 HB1 GLU 611 32.361 24.507 7.983 97 HG2 GLU 611 HG2 GLU 611 31.904 26.868 7.964 98 HG3 GLU 611 HG1 GLU 611 30.472 25.980 8.478 99 H VAL 612 HN VAL 612 30.950 22.681 8.015 100 HA VAL 612 HA VAL 612 28.203 23.390 8.183 101 HB VAL 612 HB VAL 612 29.343 22.761 6.051 102 HG11 VAL 612 HG11 VAL 612 30.649 20.876 6.783 103 HG12 VAL 612 HG12 VAL 612 29.570 20.379 5.479 104 HG13 VAL 612 HG13 VAL 612 29.185 19.964 7.150 105 HG21 VAL 612 HG21 VAL 612 27.449 21.518 5.108 106 HG22 VAL 612 HG22 VAL 612 26.922 22.825 6.169 107 HG23 VAL 612 HG23 VAL 612 26.886 21.157 6.741 108 H ARG 613 HN ARG 613 30.110 20.821 9.543 109 HA ARG 613 HA ARG 613 28.068 18.972 10.098 110 HB2 ARG 613 HB2 ARG 613 30.509 18.503 10.330 111 HB3 ARG 613 HB1 ARG 613 30.524 19.503 11.779 112 HG2 ARG 613 HG2 ARG 613 28.864 17.976 12.796 113 HG3 ARG 613 HG1 ARG 613 28.990 16.946 11.374 114 HD2 ARG 613 HD2 ARG 613 30.432 15.944 12.880 115 HD3 ARG 613 HD1 ARG 613 31.510 16.923 11.888 116 HE ARG 613 HE ARG 613 30.690 18.419 14.124 117 HH11 ARG 613 HH11 ARG 613 32.725 15.713 13.278 118 HH12 ARG 613 HH12 ARG 613 33.753 15.871 14.663 119 HH21 ARG 613 HH21 ARG 613 32.052 18.637 15.978 120 HH22 ARG 613 HH22 ARG 613 33.370 17.539 16.200 121 H GLN 614 HN GLN 614 29.466 21.504 12.157 122 HA GLN 614 HA GLN 614 27.635 21.105 14.279 123 HB2 GLN 614 HB2 GLN 614 29.363 23.490 13.611 124 HB3 GLN 614 HB1 GLN 614 28.502 23.267 15.130 125 HG2 GLN 614 HG2 GLN 614 29.798 21.268 15.594 126 HG3 GLN 614 HG1 GLN 614 30.638 21.440 14.055 127 HE21 GLN 614 HE21 GLN 614 31.671 21.387 16.784 128 HE22 GLN 614 HE22 GLN 614 32.565 22.859 16.974 129 H LEU 615 HN LEU 615 27.483 22.865 11.330 130 HA LEU 615 HA LEU 615 25.435 24.695 12.000 131 HB2 LEU 615 HB2 LEU 615 26.837 24.950 10.012 132 HB3 LEU 615 HB1 LEU 615 26.177 23.475 9.338 133 HG LEU 615 HG LEU 615 23.939 24.586 9.257 134 HD11 LEU 615 HD11 LEU 615 24.285 26.274 10.963 135 HD12 LEU 615 HD12 LEU 615 23.861 27.031 9.429 136 HD13 LEU 615 HD13 LEU 615 25.534 27.037 9.982 137 HD21 LEU 615 HD21 LEU 615 24.457 25.958 7.301 138 HD22 LEU 615 HD22 LEU 615 25.357 24.443 7.279 139 HD23 LEU 615 HD23 LEU 615 26.166 25.942 7.737 140 H LEU 616 HN LEU 616 25.388 21.433 10.569 141 HA LEU 616 HA LEU 616 22.479 21.400 10.623 142 HB2 LEU 616 HB2 LEU 616 24.428 19.258 9.774 143 HB3 LEU 616 HB1 LEU 616 22.692 19.208 9.555 144 HG LEU 616 HG LEU 616 24.614 21.105 8.211 145 HD11 LEU 616 HD11 LEU 616 22.953 18.825 7.164 146 HD12 LEU 616 HD12 LEU 616 24.711 18.883 7.289 147 HD13 LEU 616 HD13 LEU 616 23.869 19.954 6.170 148 HD21 LEU 616 HD21 LEU 616 22.657 21.893 6.952 149 HD22 LEU 616 HD22 LEU 616 22.519 22.246 8.673 150 HD23 LEU 616 HD23 LEU 616 21.611 20.906 7.973 151 H ARG 617 HN ARG 617 24.933 20.787 12.749 152 HA ARG 617 HA ARG 617 25.035 19.956 14.849 153 HB2 ARG 617 HB2 ARG 617 22.068 19.466 14.564 154 HB3 ARG 617 HB1 ARG 617 22.978 19.459 16.069 155 HG2 ARG 617 HG2 ARG 617 23.468 21.806 15.831 156 HG3 ARG 617 HG1 ARG 617 22.676 21.838 14.254 157 HD2 ARG 617 HD2 ARG 617 20.574 21.123 15.389 158 HD3 ARG 617 HD1 ARG 617 21.405 21.329 16.933 159 HE ARG 617 HE ARG 617 21.787 23.706 15.727 160 HH11 ARG 617 HH11 ARG 617 18.931 21.783 16.373 161 HH12 ARG 617 HH12 ARG 617 17.866 23.143 16.448 162 HH21 ARG 617 HH21 ARG 617 20.378 25.511 15.807 163 HH22 ARG 617 HH22 ARG 617 18.692 25.272 16.113 164 H CYS 618 HN CYS 618 25.146 18.233 12.385 165 HA CYS 618 HA CYS 618 24.225 15.650 13.245 166 HB2 CYS 618 HB2 CYS 618 26.066 16.388 10.966 167 HB3 CYS 618 HB1 CYS 618 25.277 14.832 11.199 168 HG CYS 618 HG CYS 618 22.862 16.933 11.251 169 H ASP 619 HN ASP 619 25.535 13.877 13.815 170 HA ASP 619 HA ASP 619 27.974 14.637 15.189 171 HB2 ASP 619 HB2 ASP 619 27.876 12.413 16.197 172 HB3 ASP 619 HB1 ASP 619 26.341 13.247 16.378 173 H ARG 620 HN ARG 620 26.920 12.785 12.433 174 HA ARG 620 HA ARG 620 29.763 12.391 11.749 175 HB2 ARG 620 HB2 ARG 620 27.456 10.689 10.821 176 HB3 ARG 620 HB1 ARG 620 29.159 10.420 10.485 177 HG2 ARG 620 HG2 ARG 620 29.349 10.323 13.088 178 HG3 ARG 620 HG1 ARG 620 27.622 9.974 12.992 179 HD2 ARG 620 HD2 ARG 620 28.860 7.904 13.006 180 HD3 ARG 620 HD1 ARG 620 28.116 8.136 11.422 181 HE ARG 620 HE ARG 620 30.416 9.052 10.777 182 HH11 ARG 620 HH11 ARG 620 29.915 6.475 13.096 183 HH12 ARG 620 HH12 ARG 620 31.495 5.809 12.889 184 HH21 ARG 620 HH21 ARG 620 32.483 8.226 10.507 185 HH22 ARG 620 HH22 ARG 620 32.998 6.844 11.427 186 H VAL 621 HN VAL 621 30.455 13.485 10.068 187 HA VAL 621 HA VAL 621 28.727 13.959 7.767 188 HB VAL 621 HB VAL 621 30.325 16.141 9.156 189 HG11 VAL 621 HG11 VAL 621 30.703 16.258 6.738 190 HG12 VAL 621 HG12 VAL 621 29.699 17.602 7.285 191 HG13 VAL 621 HG13 VAL 621 28.961 16.230 6.459 192 HG21 VAL 621 HG21 VAL 621 28.080 15.773 10.045 193 HG22 VAL 621 HG22 VAL 621 27.409 15.938 8.425 194 HG23 VAL 621 HG23 VAL 621 28.181 17.317 9.200 195 H ALA 622 HN ALA 622 29.764 13.433 5.933 196 HA ALA 622 HA ALA 622 32.691 13.280 6.030 197 HB1 ALA 622 HB1 ALA 622 30.939 11.039 5.041 198 HB2 ALA 622 HB2 ALA 622 31.792 11.059 6.584 199 HB3 ALA 622 HB3 ALA 622 32.702 11.063 5.073 200 H VAL 623 HN VAL 623 33.658 12.891 3.924 201 HA VAL 623 HA VAL 623 32.084 14.085 1.747 202 HB VAL 623 HB VAL 623 35.076 14.360 2.207 203 HG11 VAL 623 HG11 VAL 623 33.320 15.478 0.023 204 HG12 VAL 623 HG12 VAL 623 34.542 14.220 -0.162 205 HG13 VAL 623 HG13 VAL 623 35.023 15.864 0.264 206 HG21 VAL 623 HG21 VAL 623 33.784 15.784 3.712 207 HG22 VAL 623 HG22 VAL 623 32.881 16.419 2.331 208 HG23 VAL 623 HG23 VAL 623 34.605 16.745 2.478 209 H TYR 624 HN TYR 624 32.036 12.971 -0.131 210 HA TYR 624 HA TYR 624 33.557 10.468 -0.250 211 HB2 TYR 624 HB2 TYR 624 31.311 9.877 0.259 212 HB3 TYR 624 HB1 TYR 624 30.663 11.108 -0.808 213 HD1 TYR 624 HD1 TYR 624 31.925 7.706 -0.553 214 HD2 TYR 624 HD2 TYR 624 30.600 10.725 -3.236 215 HE1 TYR 624 HE1 TYR 624 31.599 6.012 -2.302 216 HE2 TYR 624 HE2 TYR 624 30.278 9.045 -4.988 217 HH TYR 624 HH TYR 624 31.075 6.820 -5.565 218 H ARG 625 HN ARG 625 34.395 9.976 -2.311 219 HA ARG 625 HA ARG 625 33.869 11.999 -4.381 220 HB2 ARG 625 HB2 ARG 625 36.091 12.397 -3.413 221 HB3 ARG 625 HB1 ARG 625 36.544 10.732 -3.752 222 HG2 ARG 625 HG2 ARG 625 36.285 11.157 -6.152 223 HG3 ARG 625 HG1 ARG 625 35.858 12.830 -5.799 224 HD2 ARG 625 HD2 ARG 625 38.058 13.179 -4.795 225 HD3 ARG 625 HD1 ARG 625 38.481 11.499 -5.136 226 HE ARG 625 HE ARG 625 37.904 12.294 -7.568 227 HH11 ARG 625 HH11 ARG 625 39.714 14.036 -5.108 228 HH12 ARG 625 HH12 ARG 625 40.659 14.925 -6.253 229 HH21 ARG 625 HH21 ARG 625 39.164 13.497 -9.090 230 HH22 ARG 625 HH22 ARG 625 40.341 14.626 -8.512 231 H PHE 626 HN PHE 626 33.756 11.291 -6.482 232 HA PHE 626 HA PHE 626 33.347 8.442 -6.807 233 HB2 PHE 626 HB2 PHE 626 32.878 10.809 -8.620 234 HB3 PHE 626 HB1 PHE 626 32.693 9.146 -9.166 235 HD1 PHE 626 HD1 PHE 626 31.284 11.825 -7.156 236 HD2 PHE 626 HD2 PHE 626 30.903 7.748 -8.292 237 HE1 PHE 626 HE1 PHE 626 28.984 11.805 -6.293 238 HE2 PHE 626 HE2 PHE 626 28.598 7.716 -7.434 239 HZ PHE 626 HZ PHE 626 27.636 9.748 -6.431 240 H ASN 627 HN ASN 627 34.712 7.125 -7.714 241 HA ASN 627 HA ASN 627 37.287 8.135 -8.636 242 HB2 ASN 627 HB2 ASN 627 36.361 5.282 -8.197 243 HB3 ASN 627 HB1 ASN 627 38.019 5.815 -8.443 244 HD21 ASN 627 HD21 ASN 627 39.146 6.691 -6.748 245 HD22 ASN 627 HD22 ASN 627 38.553 6.694 -5.124 246 HA PRO 628 HA PRO 628 36.480 7.319 -12.966 247 HB2 PRO 628 HB2 PRO 628 38.965 5.695 -13.089 248 HB3 PRO 628 HB1 PRO 628 38.527 7.139 -14.008 249 HG2 PRO 628 HG2 PRO 628 40.352 7.259 -12.071 250 HG3 PRO 628 HG1 PRO 628 39.197 8.580 -12.320 251 HD2 PRO 628 HD2 PRO 628 39.182 6.408 -10.262 252 HD3 PRO 628 HD1 PRO 628 38.793 8.132 -10.079 253 H ASN 629 HN ASN 629 37.038 4.834 -10.704 254 HA ASN 629 HA ASN 629 35.977 2.738 -12.465 255 HB2 ASN 629 HB2 ASN 629 37.188 2.544 -9.697 256 HB3 ASN 629 HB1 ASN 629 36.675 1.184 -10.685 257 HD21 ASN 629 HD21 ASN 629 37.934 0.554 -12.408 258 HD22 ASN 629 HD22 ASN 629 39.545 1.133 -12.648 259 H TRP 630 HN TRP 630 34.933 5.033 -10.323 260 HA TRP 630 HA TRP 630 33.164 5.361 -8.948 261 HB2 TRP 630 HB2 TRP 630 31.993 3.291 -10.826 262 HB3 TRP 630 HB1 TRP 630 31.034 4.131 -9.612 263 HD1 TRP 630 HD1 TRP 630 30.585 6.770 -10.015 264 HE1 TRP 630 HE1 TRP 630 30.632 8.204 -12.162 265 HE3 TRP 630 HE3 TRP 630 33.150 3.578 -13.087 266 HZ2 TRP 630 HZ2 TRP 630 31.614 8.018 -14.772 267 HZ3 TRP 630 HZ3 TRP 630 33.598 4.286 -15.401 268 HH2 TRP 630 HH2 TRP 630 32.845 6.459 -16.227 269 H THR 631 HN THR 631 35.062 3.854 -7.766 270 HA THR 631 HA THR 631 33.911 1.446 -6.687 271 HB THR 631 HB THR 631 36.130 1.435 -5.385 272 HG1 THR 631 HG1 THR 631 37.432 3.076 -5.742 273 HG21 THR 631 HG21 THR 631 35.693 0.018 -7.297 274 HG22 THR 631 HG22 THR 631 37.336 0.663 -7.402 275 HG23 THR 631 HG23 THR 631 36.043 1.355 -8.388 276 H GLY 632 HN GLY 632 33.739 4.631 -5.912 277 HA2 GLY 632 HA2 GLY 632 32.753 5.715 -4.143 278 HA3 GLY 632 HA1 GLY 632 32.357 4.133 -3.495 279 H GLU 633 HN GLU 633 35.204 6.267 -3.901 280 HA GLU 633 HA GLU 633 36.196 5.207 -1.361 281 HB2 GLU 633 HB2 GLU 633 37.725 5.172 -3.309 282 HB3 GLU 633 HB1 GLU 633 37.630 6.924 -3.389 283 HG2 GLU 633 HG2 GLU 633 38.653 7.111 -1.206 284 HG3 GLU 633 HG1 GLU 633 38.688 5.356 -1.050 285 H PHE 634 HN PHE 634 36.261 6.381 0.437 286 HA PHE 634 HA PHE 634 35.186 9.068 0.449 287 HB2 PHE 634 HB2 PHE 634 36.180 7.267 2.669 288 HB3 PHE 634 HB1 PHE 634 35.576 8.896 2.927 289 HD1 PHE 634 HD1 PHE 634 34.717 5.439 2.483 290 HD2 PHE 634 HD2 PHE 634 33.191 9.410 2.353 291 HE1 PHE 634 HE1 PHE 634 32.422 4.561 2.690 292 HE2 PHE 634 HE2 PHE 634 30.900 8.539 2.557 293 HZ PHE 634 HZ PHE 634 30.515 6.115 2.725 294 H VAL 635 HN VAL 635 36.331 10.897 1.327 295 HA VAL 635 HA VAL 635 39.236 10.579 1.056 296 HB VAL 635 HB VAL 635 39.344 13.001 0.417 297 HG11 VAL 635 HG11 VAL 635 37.724 11.185 -1.366 298 HG12 VAL 635 HG12 VAL 635 39.484 11.263 -1.267 299 HG13 VAL 635 HG13 VAL 635 38.572 12.638 -1.891 300 HG21 VAL 635 HG21 VAL 635 37.207 13.735 1.331 301 HG22 VAL 635 HG22 VAL 635 36.348 12.706 0.185 302 HG23 VAL 635 HG23 VAL 635 37.294 14.078 -0.397 303 H ALA 636 HN ALA 636 36.754 12.389 2.863 304 HA ALA 636 HA ALA 636 38.469 12.355 5.195 305 HB1 ALA 636 HB1 ALA 636 37.541 14.982 4.024 306 HB2 ALA 636 HB2 ALA 636 39.202 14.392 4.037 307 HB3 ALA 636 HB3 ALA 636 38.390 14.770 5.556 308 H GLU 637 HN GLU 637 37.335 13.024 7.144 309 HA GLU 637 HA GLU 637 34.469 13.418 6.963 310 HB2 GLU 637 HB2 GLU 637 34.530 11.009 6.895 311 HB3 GLU 637 HB1 GLU 637 35.678 10.949 8.225 312 HG2 GLU 637 HG2 GLU 637 33.904 11.961 9.682 313 HG3 GLU 637 HG1 GLU 637 32.776 11.755 8.345 314 H SER 638 HN SER 638 33.646 14.446 8.702 315 HA SER 638 HA SER 638 35.465 14.906 10.962 316 HB2 SER 638 HB2 SER 638 34.788 16.958 9.657 317 HB3 SER 638 HB1 SER 638 33.112 16.617 10.090 318 HG SER 638 HG SER 638 35.173 17.648 11.615 319 H VAL 639 HN VAL 639 34.917 13.457 12.463 320 HA VAL 639 HA VAL 639 32.057 12.919 12.857 321 HB VAL 639 HB VAL 639 33.305 11.024 11.851 322 HG11 VAL 639 HG11 VAL 639 34.840 11.020 14.442 323 HG12 VAL 639 HG12 VAL 639 35.483 11.367 12.836 324 HG13 VAL 639 HG13 VAL 639 34.897 9.749 13.221 325 HG21 VAL 639 HG21 VAL 639 32.507 9.296 13.399 326 HG22 VAL 639 HG22 VAL 639 31.323 10.582 13.163 327 HG23 VAL 639 HG23 VAL 639 32.283 10.531 14.639 328 H ALA 640 HN ALA 640 31.343 12.522 14.969 329 HA ALA 640 HA ALA 640 32.525 14.049 17.009 330 HB1 ALA 640 HB1 ALA 640 30.832 13.022 18.464 331 HB2 ALA 640 HB2 ALA 640 30.452 11.865 17.188 332 HB3 ALA 640 HB3 ALA 640 30.135 13.583 16.944 333 H HIS 641 HN HIS 641 33.350 13.256 19.073 334 HA HIS 641 HA HIS 641 35.383 11.296 18.637 335 HB2 HIS 641 HB2 HIS 641 34.597 12.824 21.118 336 HB3 HIS 641 HB1 HIS 641 35.962 11.716 21.045 337 HD2 HIS 641 HD2 HIS 641 35.061 15.332 20.090 338 HE1 HIS 641 HE1 HIS 641 38.968 14.585 18.638 339 HE2 HIS 641 HE2 HIS 641 37.177 16.307 18.975 340 H THR 642 HN THR 642 32.185 11.071 19.577 341 HA THR 642 HA THR 642 32.368 8.795 21.273 342 HB THR 642 HB THR 642 29.898 8.544 20.615 343 HG1 THR 642 HG1 THR 642 29.606 9.661 18.787 344 HG21 THR 642 HG21 THR 642 30.638 9.647 22.685 345 HG22 THR 642 HG22 THR 642 29.217 10.439 22.003 346 HG23 THR 642 HG23 THR 642 30.811 11.167 21.808 347 H TRP 643 HN TRP 643 32.872 9.226 17.966 348 HA TRP 643 HA TRP 643 32.361 6.369 17.442 349 HB2 TRP 643 HB2 TRP 643 32.186 8.610 15.428 350 HB3 TRP 643 HB1 TRP 643 31.857 6.912 15.131 351 HD1 TRP 643 HD1 TRP 643 30.073 9.971 15.534 352 HE1 TRP 643 HE1 TRP 643 27.658 9.609 16.317 353 HE3 TRP 643 HE3 TRP 643 30.515 5.149 17.170 354 HZ2 TRP 643 HZ2 TRP 643 26.145 7.517 17.510 355 HZ3 TRP 643 HZ3 TRP 643 28.539 4.044 18.121 356 HH2 TRP 643 HH2 TRP 643 26.402 5.205 18.290 357 H VAL 644 HN VAL 644 33.522 6.086 15.067 358 HA VAL 644 HA VAL 644 36.313 6.919 15.421 359 HB VAL 644 HB VAL 644 36.995 4.788 14.379 360 HG11 VAL 644 HG11 VAL 644 35.220 4.391 16.784 361 HG12 VAL 644 HG12 VAL 644 36.897 4.934 16.811 362 HG13 VAL 644 HG13 VAL 644 36.507 3.307 16.256 363 HG21 VAL 644 HG21 VAL 644 34.068 4.055 14.532 364 HG22 VAL 644 HG22 VAL 644 35.380 2.977 14.051 365 HG23 VAL 644 HG23 VAL 644 34.978 4.378 13.056 366 H LYS 645 HN LYS 645 37.516 6.994 13.346 367 HA LYS 645 HA LYS 645 36.005 8.398 11.389 368 HB2 LYS 645 HB2 LYS 645 38.865 7.458 11.448 369 HB3 LYS 645 HB1 LYS 645 38.181 8.223 10.025 370 HG2 LYS 645 HG2 LYS 645 39.224 9.978 11.132 371 HG3 LYS 645 HG1 LYS 645 37.533 10.139 11.604 372 HD2 LYS 645 HD2 LYS 645 38.848 10.457 13.567 373 HD3 LYS 645 HD1 LYS 645 38.097 8.866 13.696 374 HE2 LYS 645 HE2 LYS 645 40.173 7.819 12.938 375 HE3 LYS 645 HE1 LYS 645 40.920 9.407 12.773 376 HZ1 LYS 645 HZ1 LYS 645 40.718 9.732 15.134 377 HZ2 LYS 645 HZ2 LYS 645 41.526 8.281 14.839 378 HZ3 LYS 645 HZ3 LYS 645 39.911 8.258 15.315 379 H LEU 646 HN LEU 646 34.855 7.667 9.810 380 HA LEU 646 HA LEU 646 34.659 4.844 9.280 381 HB2 LEU 646 HB2 LEU 646 32.823 6.678 9.308 382 HB3 LEU 646 HB1 LEU 646 33.372 7.051 7.693 383 HG LEU 646 HG LEU 646 32.320 4.340 8.518 384 HD11 LEU 646 HD11 LEU 646 30.594 6.003 8.817 385 HD12 LEU 646 HD12 LEU 646 30.248 5.020 7.394 386 HD13 LEU 646 HD13 LEU 646 30.900 6.649 7.205 387 HD21 LEU 646 HD21 LEU 646 32.763 5.589 5.800 388 HD22 LEU 646 HD22 LEU 646 32.042 4.009 6.102 389 HD23 LEU 646 HD23 LEU 646 33.731 4.300 6.519 390 H VAL 647 HN VAL 647 35.985 7.679 7.717 391 HA VAL 647 HA VAL 647 36.367 6.712 5.143 392 HB VAL 647 HB VAL 647 38.155 8.382 4.882 393 HG11 VAL 647 HG11 VAL 647 35.848 9.423 6.503 394 HG12 VAL 647 HG12 VAL 647 35.782 9.019 4.792 395 HG13 VAL 647 HG13 VAL 647 36.818 10.337 5.347 396 HG21 VAL 647 HG21 VAL 647 38.818 9.803 6.766 397 HG22 VAL 647 HG22 VAL 647 39.254 8.119 7.056 398 HG23 VAL 647 HG23 VAL 647 37.846 8.816 7.858 399 H GLY 648 HN GLY 648 38.253 6.144 8.021 400 HA2 GLY 648 HA2 GLY 648 39.737 4.444 8.443 401 HA3 GLY 648 HA1 GLY 648 39.516 3.893 6.789 402 HA PRO 649 HA PRO 649 43.042 7.366 7.080 403 HB2 PRO 649 HB2 PRO 649 44.154 6.235 9.605 404 HB3 PRO 649 HB1 PRO 649 44.097 7.915 9.055 405 HG2 PRO 649 HG2 PRO 649 42.440 7.074 10.952 406 HG3 PRO 649 HG1 PRO 649 41.875 8.185 9.689 407 HD2 PRO 649 HD2 PRO 649 41.427 5.239 9.962 408 HD3 PRO 649 HD1 PRO 649 40.305 6.504 9.421 409 H ASP 650 HN ASP 650 43.462 4.128 8.531 410 HA ASP 650 HA ASP 650 45.882 3.711 6.986 411 HB2 ASP 650 HB2 ASP 650 45.841 2.897 9.289 412 HB3 ASP 650 HB1 ASP 650 44.437 1.899 8.929 413 H ILE 651 HN ILE 651 42.629 2.376 7.228 414 HA ILE 651 HA ILE 651 43.000 1.303 4.527 415 HB ILE 651 HB ILE 651 42.916 -0.584 6.065 416 HG12 ILE 651 HG12 ILE 651 40.323 -0.270 4.549 417 HG13 ILE 651 HG11 ILE 651 41.852 -0.799 3.860 418 HG21 ILE 651 HG21 ILE 651 41.747 0.444 7.940 419 HG22 ILE 651 HG22 ILE 651 40.926 -1.041 7.450 420 HG23 ILE 651 HG23 ILE 651 40.263 0.528 6.988 421 HD11 ILE 651 HD11 ILE 651 41.798 -2.796 5.247 422 HD12 ILE 651 HD12 ILE 651 40.336 -2.666 4.270 423 HD13 ILE 651 HD13 ILE 651 40.290 -2.253 5.983 424 H LYS 652 HN LYS 652 41.873 2.548 3.198 425 HA LYS 652 HA LYS 652 39.675 4.097 4.060 426 HB2 LYS 652 HB2 LYS 652 40.639 3.433 1.286 427 HB3 LYS 652 HB1 LYS 652 39.320 4.542 1.622 428 HG2 LYS 652 HG2 LYS 652 40.999 5.833 3.044 429 HG3 LYS 652 HG1 LYS 652 42.233 4.854 2.241 430 HD2 LYS 652 HD2 LYS 652 41.372 5.599 0.060 431 HD3 LYS 652 HD1 LYS 652 40.193 6.613 0.887 432 HE2 LYS 652 HE2 LYS 652 42.094 7.800 1.977 433 HE3 LYS 652 HE1 LYS 652 43.191 6.868 0.957 434 HZ1 LYS 652 HZ1 LYS 652 42.871 8.866 -0.172 435 HZ2 LYS 652 HZ2 LYS 652 41.222 8.912 0.156 436 HZ3 LYS 652 HZ3 LYS 652 41.817 7.800 -0.974 437 H THR 653 HN THR 653 37.555 3.819 3.873 438 HA THR 653 HA THR 653 36.614 1.143 3.376 439 HB THR 653 HB THR 653 35.098 3.639 4.174 440 HG1 THR 653 HG1 THR 653 35.795 3.211 6.108 441 HG21 THR 653 HG21 THR 653 33.636 1.972 3.110 442 HG22 THR 653 HG22 THR 653 33.307 2.081 4.839 443 HG23 THR 653 HG23 THR 653 34.250 0.733 4.205 444 H VAL 654 HN VAL 654 36.334 0.551 1.358 445 HA VAL 654 HA VAL 654 35.655 2.461 -0.724 446 HB VAL 654 HB VAL 654 37.416 0.676 -1.025 447 HG11 VAL 654 HG11 VAL 654 36.723 -1.612 -1.528 448 HG12 VAL 654 HG12 VAL 654 35.068 -1.201 -1.077 449 HG13 VAL 654 HG13 VAL 654 36.351 -1.148 0.132 450 HG21 VAL 654 HG21 VAL 654 36.467 1.745 -2.967 451 HG22 VAL 654 HG22 VAL 654 35.124 0.602 -2.972 452 HG23 VAL 654 HG23 VAL 654 36.762 0.038 -3.302 453 H TRP 655 HN TRP 655 33.690 2.194 -2.104 454 HA TRP 655 HA TRP 655 31.651 0.470 -0.936 455 HB2 TRP 655 HB2 TRP 655 31.545 2.726 0.195 456 HB3 TRP 655 HB1 TRP 655 31.238 3.443 -1.376 457 HD1 TRP 655 HD1 TRP 655 29.117 0.974 -2.188 458 HE1 TRP 655 HE1 TRP 655 26.748 1.133 -1.220 459 HE3 TRP 655 HE3 TRP 655 30.045 4.185 1.681 460 HZ2 TRP 655 HZ2 TRP 655 25.433 2.460 0.899 461 HZ3 TRP 655 HZ3 TRP 655 28.171 4.852 3.130 462 HH2 TRP 655 HH2 TRP 655 25.914 4.007 2.745 463 H GLU 656 HN GLU 656 31.630 -0.724 -2.832 464 HA GLU 656 HA GLU 656 31.198 0.689 -5.336 465 HB2 GLU 656 HB2 GLU 656 31.559 -2.260 -4.798 466 HB3 GLU 656 HB1 GLU 656 31.375 -1.540 -6.389 467 HG2 GLU 656 HG2 GLU 656 33.440 -0.179 -5.842 468 HG3 GLU 656 HG1 GLU 656 33.662 -1.266 -4.473 469 H ASP 657 HN ASP 657 29.120 1.467 -5.138 470 HA ASP 657 HA ASP 657 26.997 -0.338 -4.397 471 HB2 ASP 657 HB2 ASP 657 26.807 2.041 -3.851 472 HB3 ASP 657 HB1 ASP 657 26.834 2.442 -5.568 473 H THR 658 HN THR 658 26.256 -1.795 -5.703 474 HA THR 658 HA THR 658 26.975 -2.059 -8.375 475 HB THR 658 HB THR 658 26.369 -4.015 -7.124 476 HG1 THR 658 HG1 THR 658 25.844 -3.973 -9.409 477 HG21 THR 658 HG21 THR 658 24.016 -4.441 -6.437 478 HG22 THR 658 HG22 THR 658 23.622 -2.781 -6.891 479 HG23 THR 658 HG23 THR 658 24.762 -3.093 -5.576 480 H HIS 659 HN HIS 659 24.171 -0.519 -6.927 481 HA HIS 659 HA HIS 659 22.616 -0.401 -9.294 482 HB2 HIS 659 HB2 HIS 659 21.666 -0.127 -7.010 483 HB3 HIS 659 HB1 HIS 659 22.498 1.416 -6.874 484 HD2 HIS 659 HD2 HIS 659 19.619 -0.141 -9.061 485 HE1 HIS 659 HE1 HIS 659 19.162 4.070 -8.959 486 HE2 HIS 659 HE2 HIS 659 18.316 1.911 -9.930 487 H LEU 660 HN LEU 660 24.422 2.237 -7.578 488 HA LEU 660 HA LEU 660 24.239 3.967 -9.763 489 HB2 LEU 660 HB2 LEU 660 25.943 3.953 -7.296 490 HB3 LEU 660 HB1 LEU 660 25.938 5.262 -8.461 491 HG LEU 660 HG LEU 660 23.509 4.349 -6.925 492 HD11 LEU 660 HD11 LEU 660 23.841 6.366 -5.588 493 HD12 LEU 660 HD12 LEU 660 25.347 6.688 -6.450 494 HD13 LEU 660 HD13 LEU 660 25.202 5.253 -5.434 495 HD21 LEU 660 HD21 LEU 660 22.997 5.442 -9.076 496 HD22 LEU 660 HD22 LEU 660 23.997 6.816 -8.618 497 HD23 LEU 660 HD23 LEU 660 22.531 6.454 -7.711 498 H GLN 661 HN GLN 661 26.352 1.308 -9.274 499 HA GLN 661 HA GLN 661 28.628 2.598 -10.547 500 HB2 GLN 661 HB2 GLN 661 28.435 0.435 -8.845 501 HB3 GLN 661 HB1 GLN 661 28.648 -0.339 -10.409 502 HG2 GLN 661 HG2 GLN 661 30.664 1.095 -10.758 503 HG3 GLN 661 HG1 GLN 661 30.465 1.660 -9.098 504 HE21 GLN 661 HE21 GLN 661 32.424 0.864 -8.467 505 HE22 GLN 661 HE22 GLN 661 32.734 -0.829 -8.245 506 H GLU 662 HN GLU 662 25.867 0.724 -11.273 507 HA GLU 662 HA GLU 662 26.605 -0.149 -13.870 508 HB2 GLU 662 HB2 GLU 662 24.808 -1.158 -12.426 509 HB3 GLU 662 HB1 GLU 662 23.849 0.284 -12.682 510 HG2 GLU 662 HG2 GLU 662 24.758 -1.512 -14.918 511 HG3 GLU 662 HG1 GLU 662 23.237 -1.719 -14.057 512 H THR 663 HN THR 663 24.507 2.450 -12.659 513 HA THR 663 HA THR 663 24.409 3.643 -15.308 514 HB THR 663 HB THR 663 23.065 4.814 -12.891 515 HG1 THR 663 HG1 THR 663 22.482 2.368 -14.210 516 HG21 THR 663 HG21 THR 663 22.896 5.981 -15.054 517 HG22 THR 663 HG22 THR 663 21.327 5.352 -14.549 518 HG23 THR 663 HG23 THR 663 22.253 4.516 -15.795 519 H GLN 664 HN GLN 664 26.871 3.690 -13.545 520 HA GLN 664 HA GLN 664 28.521 5.073 -12.803 521 HB2 GLN 664 HB2 GLN 664 29.246 6.766 -14.417 522 HB3 GLN 664 HB1 GLN 664 28.803 5.266 -15.207 523 HG2 GLN 664 HG2 GLN 664 26.724 6.223 -15.962 524 HG3 GLN 664 HG1 GLN 664 27.027 7.692 -15.041 525 HE21 GLN 664 HE21 GLN 664 29.857 7.762 -15.721 526 HE22 GLN 664 HE22 GLN 664 29.945 8.269 -17.372 527 H GLY 665 HN GLY 665 26.192 5.631 -11.356 528 HA2 GLY 665 HA2 GLY 665 25.559 7.160 -9.730 529 HA3 GLY 665 HA1 GLY 665 26.898 8.174 -10.244 530 H GLY 666 HN GLY 666 24.502 7.100 -12.475 531 HA2 GLY 666 HA2 GLY 666 23.982 9.389 -13.780 532 HA3 GLY 666 HA1 GLY 666 22.799 8.113 -13.583 533 H ARG 667 HN ARG 667 21.926 8.309 -11.069 534 HA ARG 667 HA ARG 667 20.176 10.498 -11.256 535 HB2 ARG 667 HB2 ARG 667 19.770 8.303 -10.049 536 HB3 ARG 667 HB1 ARG 667 20.710 8.972 -8.718 537 HG2 ARG 667 HG2 ARG 667 19.140 10.743 -8.414 538 HG3 ARG 667 HG1 ARG 667 18.258 10.269 -9.865 539 HD2 ARG 667 HD2 ARG 667 17.799 8.070 -8.746 540 HD3 ARG 667 HD1 ARG 667 18.481 8.760 -7.269 541 HE ARG 667 HE ARG 667 16.615 10.578 -8.079 542 HH11 ARG 667 HH11 ARG 667 16.564 7.174 -7.161 543 HH12 ARG 667 HH12 ARG 667 14.880 7.197 -6.746 544 HH21 ARG 667 HH21 ARG 667 14.427 10.601 -7.484 545 HH22 ARG 667 HH22 ARG 667 13.655 9.144 -6.936 546 H TYR 668 HN TYR 668 23.174 10.115 -9.471 547 HA TYR 668 HA TYR 668 22.750 12.611 -8.073 548 HB2 TYR 668 HB2 TYR 668 24.931 10.547 -7.988 549 HB3 TYR 668 HB1 TYR 668 25.137 12.123 -7.228 550 HD1 TYR 668 HD1 TYR 668 23.362 12.857 -5.544 551 HD2 TYR 668 HD2 TYR 668 23.805 8.805 -6.810 552 HE1 TYR 668 HE1 TYR 668 22.138 12.102 -3.557 553 HE2 TYR 668 HE2 TYR 668 22.581 8.059 -4.835 554 HH TYR 668 HH TYR 668 20.819 10.165 -2.851 555 H ALA 669 HN ALA 669 24.066 11.601 -11.001 556 HA ALA 669 HA ALA 669 25.938 13.767 -11.309 557 HB1 ALA 669 HB1 ALA 669 26.291 11.631 -12.467 558 HB2 ALA 669 HB2 ALA 669 26.167 12.970 -13.608 559 HB3 ALA 669 HB3 ALA 669 24.800 11.881 -13.376 560 H GLN 670 HN GLN 670 22.613 13.377 -11.512 561 HA GLN 670 HA GLN 670 22.212 15.542 -13.400 562 HB2 GLN 670 HB2 GLN 670 20.204 13.952 -11.801 563 HB3 GLN 670 HB1 GLN 670 19.819 15.117 -13.059 564 HG2 GLN 670 HG2 GLN 670 21.242 12.490 -13.385 565 HG3 GLN 670 HG1 GLN 670 19.633 12.917 -13.963 566 HE21 GLN 670 HE21 GLN 670 21.973 11.971 -15.426 567 HE22 GLN 670 HE22 GLN 670 22.308 13.165 -16.630 568 H GLY 671 HN GLY 671 22.791 15.191 -10.118 569 HA2 GLY 671 HA2 GLY 671 23.069 16.964 -8.623 570 HA3 GLY 671 HA1 GLY 671 22.148 17.990 -9.707 571 H GLU 672 HN GLU 672 21.010 14.854 -8.536 572 HA GLU 672 HA GLU 672 18.726 16.226 -7.368 573 HB2 GLU 672 HB2 GLU 672 18.437 14.196 -8.804 574 HB3 GLU 672 HB1 GLU 672 19.233 13.251 -7.554 575 HG2 GLU 672 HG2 GLU 672 17.460 13.765 -5.989 576 HG3 GLU 672 HG1 GLU 672 16.685 14.812 -7.175 577 H ASN 673 HN ASN 673 18.304 16.421 -5.245 578 HA ASN 673 HA ASN 673 20.401 15.628 -3.369 579 HB2 ASN 673 HB2 ASN 673 17.997 17.442 -3.029 580 HB3 ASN 673 HB1 ASN 673 19.179 17.107 -1.771 581 HD21 ASN 673 HD21 ASN 673 18.393 19.606 -3.087 582 HD22 ASN 673 HD22 ASN 673 19.851 20.287 -3.715 583 H PHE 674 HN PHE 674 20.042 14.318 -1.602 584 HA PHE 674 HA PHE 674 17.452 12.910 -1.565 585 HB2 PHE 674 HB2 PHE 674 20.195 11.915 -1.649 586 HB3 PHE 674 HB1 PHE 674 19.208 11.164 -0.401 587 HD1 PHE 674 HD1 PHE 674 19.308 11.928 -4.028 588 HD2 PHE 674 HD2 PHE 674 17.696 9.509 -0.926 589 HE1 PHE 674 HE1 PHE 674 18.292 10.454 -5.713 590 HE2 PHE 674 HE2 PHE 674 16.679 8.034 -2.587 591 HZ PHE 674 HZ PHE 674 16.974 8.501 -4.998 592 H VAL 675 HN VAL 675 16.306 13.249 0.195 593 HA VAL 675 HA VAL 675 17.722 13.690 2.728 594 HB VAL 675 HB VAL 675 15.596 14.795 3.522 595 HG11 VAL 675 HG11 VAL 675 16.969 16.036 1.146 596 HG12 VAL 675 HG12 VAL 675 17.519 16.098 2.821 597 HG13 VAL 675 HG13 VAL 675 16.019 16.903 2.352 598 HG21 VAL 675 HG21 VAL 675 14.024 13.864 1.911 599 HG22 VAL 675 HG22 VAL 675 14.872 14.663 0.589 600 HG23 VAL 675 HG23 VAL 675 14.028 15.625 1.802 601 H VAL 676 HN VAL 676 17.798 11.852 3.837 602 HA VAL 676 HA VAL 676 15.423 10.118 3.829 603 HB VAL 676 HB VAL 676 18.294 9.376 4.461 604 HG11 VAL 676 HG11 VAL 676 17.485 7.064 4.507 605 HG12 VAL 676 HG12 VAL 676 15.835 7.636 4.267 606 HG13 VAL 676 HG13 VAL 676 16.701 8.044 5.747 607 HG21 VAL 676 HG21 VAL 676 17.950 9.810 2.077 608 HG22 VAL 676 HG22 VAL 676 16.581 8.700 2.060 609 HG23 VAL 676 HG23 VAL 676 18.206 8.091 2.369 610 H ASN 677 HN ASN 677 14.284 9.993 5.641 611 HA ASN 677 HA ASN 677 15.483 10.998 8.125 612 HB2 ASN 677 HB2 ASN 677 13.034 11.055 8.903 613 HB3 ASN 677 HB1 ASN 677 13.533 12.243 7.706 614 HD21 ASN 677 HD21 ASN 677 11.356 12.497 7.110 615 HD22 ASN 677 HD22 ASN 677 10.560 11.324 6.112 616 H ASP 678 HN ASP 678 14.083 8.205 6.658 617 HA ASP 678 HA ASP 678 14.915 6.586 8.923 618 HB2 ASP 678 HB2 ASP 678 12.520 7.159 9.342 619 HB3 ASP 678 HB1 ASP 678 12.110 6.443 7.793 620 H ILE 679 HN ILE 679 16.046 4.958 8.113 621 HA ILE 679 HA ILE 679 16.289 4.523 5.345 622 HB ILE 679 HB ILE 679 17.657 2.522 5.970 623 HG12 ILE 679 HG12 ILE 679 16.995 3.426 8.785 624 HG13 ILE 679 HG11 ILE 679 16.507 1.908 8.041 625 HG21 ILE 679 HG21 ILE 679 18.672 4.691 5.657 626 HG22 ILE 679 HG22 ILE 679 19.465 3.844 6.987 627 HG23 ILE 679 HG23 ILE 679 18.308 5.133 7.325 628 HD11 ILE 679 HD11 ILE 679 19.322 2.756 8.681 629 HD12 ILE 679 HD12 ILE 679 18.868 1.251 7.885 630 HD13 ILE 679 HD13 ILE 679 18.361 1.558 9.546 631 H TYR 680 HN TYR 680 14.112 3.130 7.637 632 HA TYR 680 HA TYR 680 13.559 0.821 5.963 633 HB2 TYR 680 HB2 TYR 680 12.231 1.769 8.509 634 HB3 TYR 680 HB1 TYR 680 11.891 0.251 7.692 635 HD1 TYR 680 HD1 TYR 680 14.202 2.054 9.856 636 HD2 TYR 680 HD2 TYR 680 13.545 -1.567 7.727 637 HE1 TYR 680 HE1 TYR 680 15.967 0.965 11.175 638 HE2 TYR 680 HE2 TYR 680 15.309 -2.665 9.040 639 HH TYR 680 HH TYR 680 17.252 -2.102 10.358 640 H GLN 681 HN GLN 681 11.876 3.726 7.120 641 HA GLN 681 HA GLN 681 9.471 3.263 5.704 642 HB2 GLN 681 HB2 GLN 681 10.609 5.854 6.744 643 HB3 GLN 681 HB1 GLN 681 8.980 5.662 6.127 644 HG2 GLN 681 HG2 GLN 681 8.497 4.047 7.900 645 HG3 GLN 681 HG1 GLN 681 10.131 4.257 8.528 646 HE21 GLN 681 HE21 GLN 681 6.995 5.686 8.177 647 HE22 GLN 681 HE22 GLN 681 7.239 6.985 9.291 648 H VAL 682 HN VAL 682 12.472 4.754 4.715 649 HA VAL 682 HA VAL 682 11.403 6.040 2.416 650 HB VAL 682 HB VAL 682 13.580 6.708 3.355 651 HG11 VAL 682 HG11 VAL 682 14.417 4.534 4.007 652 HG12 VAL 682 HG12 VAL 682 15.576 5.356 2.960 653 HG13 VAL 682 HG13 VAL 682 14.564 4.064 2.315 654 HG21 VAL 682 HG21 VAL 682 13.785 5.709 0.520 655 HG22 VAL 682 HG22 VAL 682 14.815 6.938 1.255 656 HG23 VAL 682 HG23 VAL 682 13.093 7.252 1.027 657 H GLY 683 HN GLY 683 12.442 2.774 3.064 658 HA2 GLY 683 HA2 GLY 683 11.576 0.980 1.746 659 HA3 GLY 683 HA1 GLY 683 11.539 2.060 0.363 660 H HIS 684 HN HIS 684 14.328 1.821 2.466 661 HA HIS 684 HA HIS 684 16.045 1.163 0.287 662 HB2 HIS 684 HB2 HIS 684 16.474 1.315 3.262 663 HB3 HIS 684 HB1 HIS 684 17.735 0.734 2.189 664 HD2 HIS 684 HD2 HIS 684 18.216 3.474 3.862 665 HE1 HIS 684 HE1 HIS 684 17.627 5.402 0.133 666 HE2 HIS 684 HE2 HIS 684 18.762 5.516 2.383 667 H SER 685 HN SER 685 17.300 -0.717 0.009 668 HA SER 685 HA SER 685 15.937 -3.172 0.568 669 HB2 SER 685 HB2 SER 685 17.912 -4.168 -0.615 670 HB3 SER 685 HB1 SER 685 17.112 -2.898 -1.543 671 HG SER 685 HG SER 685 18.741 -1.509 -1.091 672 HA PRO 686 HA PRO 686 17.792 -4.587 4.358 673 HB2 PRO 686 HB2 PRO 686 18.828 -6.901 2.776 674 HB3 PRO 686 HB1 PRO 686 17.938 -6.895 4.303 675 HG2 PRO 686 HG2 PRO 686 16.701 -7.528 2.044 676 HG3 PRO 686 HG1 PRO 686 15.894 -6.527 3.264 677 HD2 PRO 686 HD2 PRO 686 17.096 -5.735 0.658 678 HD3 PRO 686 HD1 PRO 686 15.672 -5.081 1.492 679 H CYS 687 HN CYS 687 19.800 -5.063 1.470 680 HA CYS 687 HA CYS 687 22.308 -5.129 2.664 681 HB2 CYS 687 HB2 CYS 687 22.226 -5.713 0.390 682 HB3 CYS 687 HB1 CYS 687 21.356 -4.247 -0.049 683 H HIS 688 HN HIS 688 20.542 -2.338 1.357 684 HA HIS 688 HA HIS 688 22.560 -0.461 2.025 685 HB2 HIS 688 HB2 HIS 688 20.648 -0.310 0.268 686 HB3 HIS 688 HB1 HIS 688 19.663 0.240 1.614 687 HD1 HIS 688 HD1 HIS 688 19.959 2.180 -0.613 688 HD2 HIS 688 HD2 HIS 688 22.735 1.954 2.487 689 HE1 HIS 688 HE1 HIS 688 21.116 4.408 -0.572 690 H ILE 689 HN ILE 689 19.891 -1.862 3.721 691 HA ILE 689 HA ILE 689 19.660 0.116 5.744 692 HB ILE 689 HB ILE 689 18.742 -2.761 5.643 693 HG12 ILE 689 HG12 ILE 689 17.209 -0.156 5.489 694 HG13 ILE 689 HG11 ILE 689 17.625 -1.170 4.114 695 HG21 ILE 689 HG21 ILE 689 17.395 -2.299 7.642 696 HG22 ILE 689 HG22 ILE 689 18.162 -0.719 7.787 697 HG23 ILE 689 HG23 ILE 689 19.124 -2.185 7.973 698 HD11 ILE 689 HD11 ILE 689 16.249 -2.969 5.029 699 HD12 ILE 689 HD12 ILE 689 15.316 -1.493 4.778 700 HD13 ILE 689 HD13 ILE 689 15.829 -1.945 6.403 701 H GLU 690 HN GLU 690 21.586 -2.806 5.394 702 HA GLU 690 HA GLU 690 22.331 -2.985 8.152 703 HB2 GLU 690 HB2 GLU 690 23.618 -4.208 5.713 704 HB3 GLU 690 HB1 GLU 690 24.073 -4.574 7.368 705 HG2 GLU 690 HG2 GLU 690 21.657 -5.282 7.706 706 HG3 GLU 690 HG1 GLU 690 21.519 -5.223 5.949 707 H ILE 691 HN ILE 691 23.642 -1.332 5.378 708 HA ILE 691 HA ILE 691 26.243 -0.898 6.410 709 HB ILE 691 HB ILE 691 24.742 0.748 4.359 710 HG12 ILE 691 HG12 ILE 691 26.627 -1.589 3.947 711 HG13 ILE 691 HG11 ILE 691 24.876 -1.674 3.797 712 HG21 ILE 691 HG21 ILE 691 27.702 0.475 4.896 713 HG22 ILE 691 HG22 ILE 691 26.710 1.888 5.254 714 HG23 ILE 691 HG23 ILE 691 26.976 1.399 3.580 715 HD11 ILE 691 HD11 ILE 691 25.950 -1.525 1.623 716 HD12 ILE 691 HD12 ILE 691 26.714 -0.006 2.093 717 HD13 ILE 691 HD13 ILE 691 24.961 -0.099 1.934 718 H LEU 692 HN LEU 692 23.294 1.006 6.434 719 HA LEU 692 HA LEU 692 24.512 3.235 7.768 720 HB2 LEU 692 HB2 LEU 692 21.675 2.556 7.078 721 HB3 LEU 692 HB1 LEU 692 22.026 3.892 8.154 722 HG LEU 692 HG LEU 692 21.670 4.736 5.925 723 HD11 LEU 692 HD11 LEU 692 23.729 5.958 5.558 724 HD12 LEU 692 HD12 LEU 692 24.605 4.827 6.586 725 HD13 LEU 692 HD13 LEU 692 23.355 5.862 7.279 726 HD21 LEU 692 HD21 LEU 692 23.892 2.893 5.057 727 HD22 LEU 692 HD22 LEU 692 23.129 4.123 4.049 728 HD23 LEU 692 HD23 LEU 692 22.186 2.751 4.633 729 H GLU 693 HN GLU 693 22.589 0.474 8.777 730 HA GLU 693 HA GLU 693 22.164 1.235 11.445 731 HB2 GLU 693 HB2 GLU 693 20.968 -0.615 10.374 732 HB3 GLU 693 HB1 GLU 693 22.462 -1.531 10.266 733 HG2 GLU 693 HG2 GLU 693 22.593 -1.571 12.717 734 HG3 GLU 693 HG1 GLU 693 21.058 -0.707 12.794 735 H GLN 694 HN GLN 694 24.835 -0.442 9.874 736 HA GLN 694 HA GLN 694 26.286 -1.213 12.143 737 HB2 GLN 694 HB2 GLN 694 26.775 -2.081 9.918 738 HB3 GLN 694 HB1 GLN 694 27.260 -0.484 9.373 739 HG2 GLN 694 HG2 GLN 694 29.219 -1.801 9.767 740 HG3 GLN 694 HG1 GLN 694 29.127 -0.540 10.995 741 HE21 GLN 694 HE21 GLN 694 30.421 -1.655 12.425 742 HE22 GLN 694 HE22 GLN 694 29.895 -3.075 13.259 743 H PHE 695 HN PHE 695 26.003 1.884 10.558 744 HA PHE 695 HA PHE 695 28.203 2.935 12.182 745 HB2 PHE 695 HB2 PHE 695 26.764 4.196 9.840 746 HB3 PHE 695 HB1 PHE 695 28.109 4.919 10.716 747 HD1 PHE 695 HD1 PHE 695 27.472 3.627 7.722 748 HD2 PHE 695 HD2 PHE 695 30.011 2.797 11.039 749 HE1 PHE 695 HE1 PHE 695 29.057 2.478 6.221 750 HE2 PHE 695 HE2 PHE 695 31.593 1.650 9.546 751 HZ PHE 695 HZ PHE 695 31.115 1.488 7.137 752 H GLU 696 HN GLU 696 25.165 2.383 12.767 753 HA GLU 696 HA GLU 696 23.587 3.188 14.181 754 HB2 GLU 696 HB2 GLU 696 25.655 3.547 15.606 755 HB3 GLU 696 HB1 GLU 696 25.643 5.220 15.073 756 HG2 GLU 696 HG2 GLU 696 24.627 4.975 17.270 757 HG3 GLU 696 HG1 GLU 696 23.455 5.544 16.084 758 H VAL 697 HN VAL 697 23.723 4.219 11.529 759 HA VAL 697 HA VAL 697 22.661 6.930 11.942 760 HB VAL 697 HB VAL 697 23.832 5.679 9.442 761 HG11 VAL 697 HG11 VAL 697 23.540 7.891 8.422 762 HG12 VAL 697 HG12 VAL 697 22.678 8.432 9.867 763 HG13 VAL 697 HG13 VAL 697 22.001 7.153 8.862 764 HG21 VAL 697 HG21 VAL 697 25.576 7.395 9.699 765 HG22 VAL 697 HG22 VAL 697 25.523 6.294 11.075 766 HG23 VAL 697 HG23 VAL 697 24.831 7.910 11.213 767 H LYS 698 HN LYS 698 20.572 7.282 11.377 768 HA LYS 698 HA LYS 698 19.152 5.196 9.868 769 HB2 LYS 698 HB2 LYS 698 18.654 5.229 12.363 770 HB3 LYS 698 HB1 LYS 698 17.919 6.803 12.104 771 HG2 LYS 698 HG2 LYS 698 16.317 5.791 10.555 772 HG3 LYS 698 HG1 LYS 698 17.049 4.211 10.846 773 HD2 LYS 698 HD2 LYS 698 16.517 4.473 13.260 774 HD3 LYS 698 HD1 LYS 698 15.666 5.969 12.868 775 HE2 LYS 698 HE2 LYS 698 14.208 4.680 11.341 776 HE3 LYS 698 HE1 LYS 698 15.010 3.204 11.874 777 HZ1 LYS 698 HZ1 LYS 698 13.454 5.058 13.587 778 HZ2 LYS 698 HZ2 LYS 698 14.259 3.679 14.131 779 HZ3 LYS 698 HZ3 LYS 698 12.958 3.528 13.065 780 H ALA 699 HN ALA 699 19.479 8.570 10.725 781 HA ALA 699 HA ALA 699 17.918 9.316 8.354 782 HB1 ALA 699 HB1 ALA 699 17.481 11.452 9.466 783 HB2 ALA 699 HB2 ALA 699 18.412 10.923 10.866 784 HB3 ALA 699 HB3 ALA 699 16.905 10.105 10.449 785 H TYR 700 HN TYR 700 18.850 10.778 6.919 786 HA TYR 700 HA TYR 700 21.287 12.108 7.436 787 HB2 TYR 700 HB2 TYR 700 22.770 10.842 5.938 788 HB3 TYR 700 HB1 TYR 700 22.255 9.888 7.321 789 HD1 TYR 700 HD1 TYR 700 22.069 10.275 3.693 790 HD2 TYR 700 HD2 TYR 700 20.771 7.967 7.020 791 HE1 TYR 700 HE1 TYR 700 21.361 8.483 2.171 792 HE2 TYR 700 HE2 TYR 700 20.062 6.170 5.501 793 HH TYR 700 HH TYR 700 21.020 6.030 2.285 794 H VAL 701 HN VAL 701 22.238 13.014 5.392 795 HA VAL 701 HA VAL 701 20.229 13.336 3.291 796 HB VAL 701 HB VAL 701 19.914 15.252 4.780 797 HG11 VAL 701 HG11 VAL 701 21.686 16.884 5.173 798 HG12 VAL 701 HG12 VAL 701 22.830 15.846 4.321 799 HG13 VAL 701 HG13 VAL 701 22.099 15.301 5.832 800 HG21 VAL 701 HG21 VAL 701 20.270 17.079 3.175 801 HG22 VAL 701 HG22 VAL 701 19.619 15.637 2.395 802 HG23 VAL 701 HG23 VAL 701 21.330 16.032 2.230 803 H ILE 702 HN ILE 702 21.063 13.611 1.258 804 HA ILE 702 HA ILE 702 24.007 13.608 1.013 805 HB ILE 702 HB ILE 702 22.128 12.035 -0.755 806 HG12 ILE 702 HG12 ILE 702 23.953 10.921 1.380 807 HG13 ILE 702 HG11 ILE 702 22.223 11.168 1.606 808 HG21 ILE 702 HG21 ILE 702 24.184 10.974 -1.562 809 HG22 ILE 702 HG22 ILE 702 25.133 12.008 -0.495 810 HG23 ILE 702 HG23 ILE 702 24.210 12.720 -1.819 811 HD11 ILE 702 HD11 ILE 702 21.715 9.577 -0.107 812 HD12 ILE 702 HD12 ILE 702 22.859 8.843 1.022 813 HD13 ILE 702 HD13 ILE 702 23.417 9.437 -0.538 814 H VAL 703 HN VAL 703 24.669 15.284 -0.174 815 HA VAL 703 HA VAL 703 22.945 16.154 -2.389 816 HB VAL 703 HB VAL 703 23.827 18.446 -2.152 817 HG11 VAL 703 HG11 VAL 703 21.721 17.912 -1.083 818 HG12 VAL 703 HG12 VAL 703 22.620 19.071 -0.103 819 HG13 VAL 703 HG13 VAL 703 22.567 17.371 0.366 820 HG21 VAL 703 HG21 VAL 703 25.069 19.109 -0.146 821 HG22 VAL 703 HG22 VAL 703 25.968 17.942 -1.115 822 HG23 VAL 703 HG23 VAL 703 25.149 17.420 0.359 823 HA PRO 704 HA PRO 704 26.437 15.095 -4.870 824 HB2 PRO 704 HB2 PRO 704 25.664 16.224 -7.195 825 HB3 PRO 704 HB1 PRO 704 24.893 14.771 -6.547 826 HG2 PRO 704 HG2 PRO 704 23.967 17.613 -6.445 827 HG3 PRO 704 HG1 PRO 704 23.031 16.137 -6.743 828 HD2 PRO 704 HD2 PRO 704 23.113 17.418 -4.332 829 HD3 PRO 704 HD1 PRO 704 22.812 15.679 -4.515 830 H VAL 705 HN VAL 705 28.390 15.949 -5.257 831 HA VAL 705 HA VAL 705 28.624 18.882 -5.259 832 HB VAL 705 HB VAL 705 30.642 16.843 -4.286 833 HG11 VAL 705 HG11 VAL 705 31.731 18.787 -5.271 834 HG12 VAL 705 HG12 VAL 705 31.937 18.780 -3.520 835 HG13 VAL 705 HG13 VAL 705 30.757 19.859 -4.264 836 HG21 VAL 705 HG21 VAL 705 30.217 17.800 -2.065 837 HG22 VAL 705 HG22 VAL 705 28.767 17.067 -2.752 838 HG23 VAL 705 HG23 VAL 705 28.954 18.821 -2.754 839 H PHE 706 HN PHE 706 29.123 19.646 -7.181 840 HA PHE 706 HA PHE 706 30.669 17.996 -9.048 841 HB2 PHE 706 HB2 PHE 706 29.071 20.534 -9.494 842 HB3 PHE 706 HB1 PHE 706 29.958 19.676 -10.747 843 HD1 PHE 706 HD1 PHE 706 27.072 19.499 -8.457 844 HD2 PHE 706 HD2 PHE 706 29.067 17.730 -11.772 845 HE1 PHE 706 HE1 PHE 706 25.095 18.105 -8.898 846 HE2 PHE 706 HE2 PHE 706 27.093 16.332 -12.219 847 HZ PHE 706 HZ PHE 706 25.102 16.519 -10.782 848 H ALA 707 HN ALA 707 32.784 18.402 -9.291 849 HA ALA 707 HA ALA 707 33.753 21.104 -8.735 850 HB1 ALA 707 HB1 ALA 707 35.590 20.293 -7.372 851 HB2 ALA 707 HB2 ALA 707 35.027 18.633 -7.561 852 HB3 ALA 707 HB3 ALA 707 34.052 19.797 -6.668 853 H GLY 708 HN GLY 708 34.273 21.554 -10.785 854 HA2 GLY 708 HA2 GLY 708 36.266 21.595 -12.173 855 HA3 GLY 708 HA1 GLY 708 36.370 19.855 -11.956 856 H GLU 709 HN GLU 709 35.393 18.559 -13.365 857 HA GLU 709 HA GLU 709 34.090 19.888 -15.619 858 HB2 GLU 709 HB2 GLU 709 35.358 17.165 -15.391 859 HB3 GLU 709 HB1 GLU 709 34.601 17.797 -16.845 860 HG2 GLU 709 HG2 GLU 709 37.011 18.936 -15.453 861 HG3 GLU 709 HG1 GLU 709 37.003 18.021 -16.961 862 H GLN 710 HN GLN 710 33.631 17.102 -13.459 863 HA GLN 710 HA GLN 710 30.795 17.063 -14.214 864 HB2 GLN 710 HB2 GLN 710 32.769 14.879 -14.593 865 HB3 GLN 710 HB1 GLN 710 31.232 14.392 -13.909 866 HG2 GLN 710 HG2 GLN 710 30.989 14.075 -16.202 867 HG3 GLN 710 HG1 GLN 710 30.160 15.595 -15.884 868 HE21 GLN 710 HE21 GLN 710 30.365 16.316 -17.966 869 HE22 GLN 710 HE22 GLN 710 31.879 16.794 -18.656 870 H LEU 711 HN LEU 711 30.131 14.788 -12.756 871 HA LEU 711 HA LEU 711 29.801 15.762 -10.161 872 HB2 LEU 711 HB2 LEU 711 28.334 14.100 -11.234 873 HB3 LEU 711 HB1 LEU 711 29.636 12.930 -11.207 874 HG LEU 711 HG LEU 711 29.580 12.933 -8.746 875 HD11 LEU 711 HD11 LEU 711 28.761 15.185 -8.357 876 HD12 LEU 711 HD12 LEU 711 27.705 14.005 -7.582 877 HD13 LEU 711 HD13 LEU 711 27.214 14.769 -9.095 878 HD21 LEU 711 HD21 LEU 711 28.286 11.295 -10.010 879 HD22 LEU 711 HD22 LEU 711 26.912 12.402 -10.049 880 HD23 LEU 711 HD23 LEU 711 27.467 11.738 -8.513 881 H TRP 712 HN TRP 712 31.287 15.950 -8.642 882 HA TRP 712 HA TRP 712 33.774 14.469 -8.885 883 HB2 TRP 712 HB2 TRP 712 33.993 16.849 -8.542 884 HB3 TRP 712 HB1 TRP 712 32.953 16.785 -7.125 885 HD1 TRP 712 HD1 TRP 712 36.486 15.774 -8.269 886 HE1 TRP 712 HE1 TRP 712 37.979 15.543 -6.191 887 HE3 TRP 712 HE3 TRP 712 32.941 16.420 -4.624 888 HZ2 TRP 712 HZ2 TRP 712 37.702 15.616 -3.381 889 HZ3 TRP 712 HZ3 TRP 712 33.651 16.324 -2.257 890 HH2 TRP 712 HH2 TRP 712 35.975 15.932 -1.659 891 H GLY 713 HN GLY 713 31.400 15.219 -6.327 892 HA2 GLY 713 HA2 GLY 713 31.795 12.583 -5.239 893 HA3 GLY 713 HA1 GLY 713 32.411 13.906 -4.267 894 H LEU 714 HN LEU 714 30.930 12.978 -2.780 895 HA LEU 714 HA LEU 714 28.225 14.062 -3.078 896 HB2 LEU 714 HB2 LEU 714 28.923 11.346 -1.953 897 HB3 LEU 714 HB1 LEU 714 27.370 12.120 -1.735 898 HG LEU 714 HG LEU 714 28.551 11.227 -4.362 899 HD11 LEU 714 HD11 LEU 714 27.812 9.377 -2.966 900 HD12 LEU 714 HD12 LEU 714 26.734 9.593 -4.346 901 HD13 LEU 714 HD13 LEU 714 26.244 10.154 -2.747 902 HD21 LEU 714 HD21 LEU 714 27.213 13.211 -4.684 903 HD22 LEU 714 HD22 LEU 714 25.906 12.518 -3.722 904 HD23 LEU 714 HD23 LEU 714 26.334 11.801 -5.277 905 H LEU 715 HN LEU 715 27.463 15.030 -1.287 906 HA LEU 715 HA LEU 715 29.277 15.057 1.025 907 HB2 LEU 715 HB2 LEU 715 29.103 17.240 -0.141 908 HB3 LEU 715 HB1 LEU 715 27.375 17.230 0.137 909 HG LEU 715 HG LEU 715 27.752 17.351 2.560 910 HD11 LEU 715 HD11 LEU 715 29.875 16.189 2.704 911 HD12 LEU 715 HD12 LEU 715 30.010 17.795 3.420 912 HD13 LEU 715 HD13 LEU 715 30.670 17.488 1.814 913 HD21 LEU 715 HD21 LEU 715 28.618 19.639 2.631 914 HD22 LEU 715 HD22 LEU 715 27.494 19.411 1.291 915 HD23 LEU 715 HD23 LEU 715 29.230 19.455 0.987 916 H ALA 716 HN ALA 716 28.471 13.741 2.468 917 HA ALA 716 HA ALA 716 25.559 13.709 2.830 918 HB1 ALA 716 HB1 ALA 716 25.740 11.371 3.467 919 HB2 ALA 716 HB2 ALA 716 27.485 11.422 3.210 920 HB3 ALA 716 HB3 ALA 716 26.386 11.631 1.847 921 H ALA 717 HN ALA 717 24.768 13.762 4.804 922 HA ALA 717 HA ALA 717 26.633 13.890 7.050 923 HB1 ALA 717 HB1 ALA 717 26.076 16.193 6.465 924 HB2 ALA 717 HB2 ALA 717 25.407 15.745 8.031 925 HB3 ALA 717 HB3 ALA 717 24.354 15.824 6.614 926 H TYR 718 HN TYR 718 25.991 12.825 8.769 927 HA TYR 718 HA TYR 718 23.328 11.565 8.689 928 HB2 TYR 718 HB2 TYR 718 25.716 10.301 9.991 929 HB3 TYR 718 HB1 TYR 718 24.269 9.537 9.362 930 HD1 TYR 718 HD1 TYR 718 27.621 10.732 8.582 931 HD2 TYR 718 HD2 TYR 718 24.064 9.084 6.926 932 HE1 TYR 718 HE1 TYR 718 28.846 10.153 6.534 933 HE2 TYR 718 HE2 TYR 718 25.281 8.503 4.877 934 HH TYR 718 HH TYR 718 28.679 8.599 4.666 935 H GLN 719 HN GLN 719 22.184 11.744 10.634 936 HA GLN 719 HA GLN 719 23.793 12.775 12.857 937 HB2 GLN 719 HB2 GLN 719 22.429 14.571 11.930 938 HB3 GLN 719 HB1 GLN 719 20.979 13.609 12.176 939 HG2 GLN 719 HG2 GLN 719 21.296 13.669 14.567 940 HG3 GLN 719 HG1 GLN 719 22.815 14.538 14.371 941 HE21 GLN 719 HE21 GLN 719 22.104 16.256 15.580 942 HE22 GLN 719 HE22 GLN 719 20.930 17.386 14.995 943 H ASN 720 HN ASN 720 24.062 10.990 13.888 944 HA ASN 720 HA ASN 720 23.577 9.054 15.057 945 HB2 ASN 720 HB2 ASN 720 23.700 11.343 16.408 946 HB3 ASN 720 HB1 ASN 720 22.090 10.831 16.901 947 HD21 ASN 720 HD21 ASN 720 25.461 9.999 16.822 948 HD22 ASN 720 HD22 ASN 720 25.409 8.878 18.149 949 H SER 721 HN SER 721 22.027 8.156 13.464 950 HA SER 721 HA SER 721 20.070 7.116 12.921 951 HB2 SER 721 HB2 SER 721 19.084 5.789 14.784 952 HB3 SER 721 HB1 SER 721 20.838 5.668 14.705 953 HG SER 721 HG SER 721 20.181 7.728 16.281 954 H GLY 722 HN GLY 722 17.758 6.916 14.914 955 HA2 GLY 722 HA2 GLY 722 15.838 8.042 15.433 956 HA3 GLY 722 HA1 GLY 722 16.731 9.543 15.247 957 H THR 723 HN THR 723 14.368 9.885 14.450 958 HA THR 723 HA THR 723 14.243 9.399 11.551 959 HB THR 723 HB THR 723 11.801 10.136 12.007 960 HG1 THR 723 HG1 THR 723 11.513 10.520 14.081 961 HG21 THR 723 HG21 THR 723 12.851 7.440 12.865 962 HG22 THR 723 HG22 THR 723 12.428 7.918 11.222 963 HG23 THR 723 HG23 THR 723 11.174 7.794 12.455 964 H ARG 724 HN ARG 724 15.837 11.365 12.465 965 HA ARG 724 HA ARG 724 14.713 13.920 12.805 966 HB2 ARG 724 HB2 ARG 724 17.060 13.114 13.352 967 HB3 ARG 724 HB1 ARG 724 17.430 13.294 11.650 968 HG2 ARG 724 HG2 ARG 724 16.402 15.591 13.285 969 HG3 ARG 724 HG1 ARG 724 18.110 15.163 13.254 970 HD2 ARG 724 HD2 ARG 724 17.727 15.253 10.645 971 HD3 ARG 724 HD1 ARG 724 16.387 16.304 11.111 972 HE ARG 724 HE ARG 724 18.979 16.901 12.273 973 HH11 ARG 724 HH11 ARG 724 16.584 17.698 9.833 974 HH12 ARG 724 HH12 ARG 724 17.335 19.208 9.405 975 HH21 ARG 724 HH21 ARG 724 19.953 18.913 11.730 976 HH22 ARG 724 HH22 ARG 724 19.237 19.904 10.492 977 H ASP 725 HN ASP 725 13.405 14.843 11.335 978 HA ASP 725 HA ASP 725 13.721 14.405 8.502 979 HB2 ASP 725 HB2 ASP 725 11.810 16.041 10.151 980 HB3 ASP 725 HB1 ASP 725 11.892 16.246 8.407 981 H TRP 726 HN TRP 726 14.119 16.046 6.961 982 HA TRP 726 HA TRP 726 15.931 18.105 8.002 983 HB2 TRP 726 HB2 TRP 726 15.832 16.886 5.235 984 HB3 TRP 726 HB1 TRP 726 17.031 18.032 5.826 985 HD1 TRP 726 HD1 TRP 726 16.027 14.354 6.075 986 HE1 TRP 726 HE1 TRP 726 17.945 13.035 7.159 987 HE3 TRP 726 HE3 TRP 726 19.038 18.266 7.408 988 HZ2 TRP 726 HZ2 TRP 726 20.417 13.583 8.416 989 HZ3 TRP 726 HZ3 TRP 726 21.164 17.779 8.545 990 HH2 TRP 726 HH2 TRP 726 21.838 15.485 9.037 991 H ASP 727 HN ASP 727 15.829 20.212 7.213 992 HA ASP 727 HA ASP 727 13.188 20.971 6.214 993 HB2 ASP 727 HB2 ASP 727 13.920 22.200 8.143 994 HB3 ASP 727 HB1 ASP 727 15.461 22.581 7.388 995 H GLU 728 HN GLU 728 12.847 22.151 4.376 996 HA GLU 728 HA GLU 728 14.398 21.574 2.136 997 HB2 GLU 728 HB2 GLU 728 12.008 22.253 2.069 998 HB3 GLU 728 HB1 GLU 728 12.504 23.906 2.404 999 HG2 GLU 728 HG2 GLU 728 13.773 23.958 0.326 1000 HG3 GLU 728 HG1 GLU 728 13.297 22.296 -0.012 1001 H SER 729 HN SER 729 14.234 24.674 3.908 1002 HA SER 729 HA SER 729 16.162 25.994 2.304 1003 HB2 SER 729 HB2 SER 729 15.400 26.584 5.170 1004 HB3 SER 729 HB1 SER 729 16.139 27.704 4.026 1005 HG SER 729 HG SER 729 14.282 27.680 2.813 1006 H GLU 730 HN GLU 730 16.353 23.776 4.883 1007 HA GLU 730 HA GLU 730 18.998 24.408 5.777 1008 HB2 GLU 730 HB2 GLU 730 17.499 23.379 7.325 1009 HB3 GLU 730 HB1 GLU 730 17.145 22.072 6.209 1010 HG2 GLU 730 HG2 GLU 730 19.377 21.191 6.493 1011 HG3 GLU 730 HG1 GLU 730 19.794 22.541 7.549 1012 H VAL 731 HN VAL 731 17.588 21.747 3.869 1013 HA VAL 731 HA VAL 731 20.127 20.629 3.253 1014 HB VAL 731 HB VAL 731 18.956 19.158 1.694 1015 HG11 VAL 731 HG11 VAL 731 17.451 18.101 3.310 1016 HG12 VAL 731 HG12 VAL 731 17.497 19.559 4.296 1017 HG13 VAL 731 HG13 VAL 731 18.964 18.611 4.057 1018 HG21 VAL 731 HG21 VAL 731 17.354 20.741 0.749 1019 HG22 VAL 731 HG22 VAL 731 16.521 20.842 2.300 1020 HG23 VAL 731 HG23 VAL 731 16.519 19.327 1.395 1021 H THR 732 HN THR 732 18.187 23.104 1.761 1022 HA THR 732 HA THR 732 19.486 23.012 -0.774 1023 HB THR 732 HB THR 732 18.072 25.366 0.530 1024 HG1 THR 732 HG1 THR 732 16.663 23.587 0.313 1025 HG21 THR 732 HG21 THR 732 18.669 24.781 -2.378 1026 HG22 THR 732 HG22 THR 732 19.493 25.984 -1.388 1027 HG23 THR 732 HG23 THR 732 17.781 26.177 -1.765 1028 H LEU 733 HN LEU 733 20.134 24.471 2.322 1029 HA LEU 733 HA LEU 733 22.136 26.303 1.429 1030 HB2 LEU 733 HB2 LEU 733 20.700 26.088 3.690 1031 HB3 LEU 733 HB1 LEU 733 22.128 25.224 4.211 1032 HG LEU 733 HG LEU 733 22.128 28.071 3.190 1033 HD11 LEU 733 HD11 LEU 733 20.915 27.886 5.291 1034 HD12 LEU 733 HD12 LEU 733 22.454 28.715 5.514 1035 HD13 LEU 733 HD13 LEU 733 22.279 27.033 6.014 1036 HD21 LEU 733 HD21 LEU 733 24.272 26.441 4.545 1037 HD22 LEU 733 HD22 LEU 733 24.388 28.150 4.129 1038 HD23 LEU 733 HD23 LEU 733 24.257 26.939 2.853 1039 H LEU 734 HN LEU 734 22.057 23.024 2.704 1040 HA LEU 734 HA LEU 734 24.809 22.576 2.979 1041 HB2 LEU 734 HB2 LEU 734 23.159 21.082 3.935 1042 HB3 LEU 734 HB1 LEU 734 22.568 20.661 2.342 1043 HG LEU 734 HG LEU 734 24.763 19.608 1.846 1044 HD11 LEU 734 HD11 LEU 734 26.273 19.120 3.710 1045 HD12 LEU 734 HD12 LEU 734 25.309 20.168 4.752 1046 HD13 LEU 734 HD13 LEU 734 26.164 20.844 3.365 1047 HD21 LEU 734 HD21 LEU 734 24.406 17.633 3.248 1048 HD22 LEU 734 HD22 LEU 734 22.891 18.260 2.597 1049 HD23 LEU 734 HD23 LEU 734 23.323 18.568 4.279 1050 H ALA 735 HN ALA 735 22.635 21.903 0.243 1051 HA ALA 735 HA ALA 735 24.538 20.806 -1.495 1052 HB1 ALA 735 HB1 ALA 735 22.118 20.655 -1.864 1053 HB2 ALA 735 HB2 ALA 735 22.949 21.296 -3.281 1054 HB3 ALA 735 HB3 ALA 735 22.065 22.384 -2.209 1055 H ARG 736 HN ARG 736 23.715 24.080 -0.764 1056 HA ARG 736 HA ARG 736 25.131 25.292 -2.926 1057 HB2 ARG 736 HB2 ARG 736 24.272 26.455 -0.276 1058 HB3 ARG 736 HB1 ARG 736 24.988 27.394 -1.578 1059 HG2 ARG 736 HG2 ARG 736 23.109 26.687 -3.041 1060 HG3 ARG 736 HG1 ARG 736 22.371 25.914 -1.638 1061 HD2 ARG 736 HD2 ARG 736 21.413 28.108 -1.982 1062 HD3 ARG 736 HD1 ARG 736 22.341 28.083 -0.483 1063 HE ARG 736 HE ARG 736 24.169 29.143 -1.839 1064 HH11 ARG 736 HH11 ARG 736 20.782 29.571 -2.689 1065 HH12 ARG 736 HH12 ARG 736 21.056 31.071 -3.497 1066 HH21 ARG 736 HH21 ARG 736 24.520 31.116 -2.910 1067 HH22 ARG 736 HH22 ARG 736 23.186 31.953 -3.632 1068 H ILE 737 HN ILE 737 25.950 24.852 0.514 1069 HA ILE 737 HA ILE 737 28.552 25.895 0.355 1070 HB ILE 737 HB ILE 737 27.480 23.771 2.231 1071 HG12 ILE 737 HG12 ILE 737 27.796 26.762 2.578 1072 HG13 ILE 737 HG11 ILE 737 26.274 25.903 2.366 1073 HG21 ILE 737 HG21 ILE 737 29.992 25.435 2.450 1074 HG22 ILE 737 HG22 ILE 737 29.913 23.698 2.159 1075 HG23 ILE 737 HG23 ILE 737 29.363 24.358 3.699 1076 HD11 ILE 737 HD11 ILE 737 26.628 24.751 4.488 1077 HD12 ILE 737 HD12 ILE 737 26.645 26.503 4.693 1078 HD13 ILE 737 HD13 ILE 737 28.160 25.601 4.696 1079 H GLY 738 HN GLY 738 27.335 22.594 -0.060 1080 HA2 GLY 738 HA2 GLY 738 29.773 21.259 -0.291 1081 HA3 GLY 738 HA1 GLY 738 28.265 20.739 -1.028 1082 H ASN 739 HN ASN 739 27.784 22.695 -2.870 1083 HA ASN 739 HA ASN 739 29.717 21.985 -4.862 1084 HB2 ASN 739 HB2 ASN 739 27.183 23.596 -4.939 1085 HB3 ASN 739 HB1 ASN 739 28.267 23.547 -6.326 1086 HD21 ASN 739 HD21 ASN 739 26.054 21.750 -4.355 1087 HD22 ASN 739 HD22 ASN 739 25.948 20.360 -5.383 1088 H GLN 740 HN GLN 740 29.224 24.701 -2.789 1089 HA GLN 740 HA GLN 740 30.719 26.602 -4.271 1090 HB2 GLN 740 HB2 GLN 740 29.198 27.146 -2.352 1091 HB3 GLN 740 HB1 GLN 740 30.393 26.451 -1.267 1092 HG2 GLN 740 HG2 GLN 740 32.019 28.135 -2.004 1093 HG3 GLN 740 HG1 GLN 740 30.792 28.838 -3.055 1094 HE21 GLN 740 HE21 GLN 740 29.043 29.927 -2.125 1095 HE22 GLN 740 HE22 GLN 740 29.100 30.504 -0.498 1096 H LEU 741 HN LEU 741 31.526 24.032 -2.071 1097 HA LEU 741 HA LEU 741 34.263 24.739 -1.677 1098 HB2 LEU 741 HB2 LEU 741 32.910 22.045 -1.446 1099 HB3 LEU 741 HB1 LEU 741 34.515 22.424 -0.858 1100 HG LEU 741 HG LEU 741 31.934 23.602 0.173 1101 HD11 LEU 741 HD11 LEU 741 32.403 22.322 2.186 1102 HD12 LEU 741 HD12 LEU 741 33.838 21.632 1.428 1103 HD13 LEU 741 HD13 LEU 741 32.236 21.261 0.788 1104 HD21 LEU 741 HD21 LEU 741 33.340 24.585 1.926 1105 HD22 LEU 741 HD22 LEU 741 33.757 25.204 0.329 1106 HD23 LEU 741 HD23 LEU 741 34.779 23.990 1.097 1107 H GLY 742 HN GLY 742 32.455 23.133 -4.138 1108 HA2 GLY 742 HA2 GLY 742 34.506 21.673 -5.386 1109 HA3 GLY 742 HA1 GLY 742 33.029 22.238 -6.155 1110 H LEU 743 HN LEU 743 33.548 25.052 -5.599 1111 HA LEU 743 HA LEU 743 35.081 25.664 -7.898 1112 HB2 LEU 743 HB2 LEU 743 33.902 27.326 -5.693 1113 HB3 LEU 743 HB1 LEU 743 34.977 28.052 -6.867 1114 HG LEU 743 HG LEU 743 33.404 27.312 -8.670 1115 HD11 LEU 743 HD11 LEU 743 32.300 25.494 -7.495 1116 HD12 LEU 743 HD12 LEU 743 31.131 26.690 -8.056 1117 HD13 LEU 743 HD13 LEU 743 31.597 26.644 -6.356 1118 HD21 LEU 743 HD21 LEU 743 31.733 29.051 -8.205 1119 HD22 LEU 743 HD22 LEU 743 33.374 29.589 -7.850 1120 HD23 LEU 743 HD23 LEU 743 32.295 29.127 -6.534 1121 H ALA 744 HN ALA 744 35.744 25.721 -4.444 1122 HA ALA 744 HA ALA 744 38.314 26.890 -4.611 1123 HB1 ALA 744 HB1 ALA 744 37.056 26.800 -2.516 1124 HB2 ALA 744 HB2 ALA 744 38.636 26.036 -2.335 1125 HB3 ALA 744 HB3 ALA 744 37.189 25.042 -2.504 1126 H LEU 745 HN LEU 745 37.163 23.556 -4.675 1127 HA LEU 745 HA LEU 745 39.723 22.349 -4.715 1128 HB2 LEU 745 HB2 LEU 745 37.575 21.186 -4.142 1129 HB3 LEU 745 HB1 LEU 745 37.142 21.254 -5.833 1130 HG LEU 745 HG LEU 745 39.723 19.943 -5.150 1131 HD11 LEU 745 HD11 LEU 745 37.032 18.675 -4.698 1132 HD12 LEU 745 HD12 LEU 745 38.225 19.063 -3.456 1133 HD13 LEU 745 HD13 LEU 745 38.584 17.838 -4.675 1134 HD21 LEU 745 HD21 LEU 745 38.995 20.172 -7.479 1135 HD22 LEU 745 HD22 LEU 745 37.506 19.305 -7.099 1136 HD23 LEU 745 HD23 LEU 745 39.059 18.479 -6.990 1137 H GLN 746 HN GLN 746 37.498 23.409 -7.245 1138 HA GLN 746 HA GLN 746 39.009 22.406 -9.419 1139 HB2 GLN 746 HB2 GLN 746 36.630 23.072 -9.606 1140 HB3 GLN 746 HB1 GLN 746 37.095 24.750 -9.359 1141 HG2 GLN 746 HG2 GLN 746 38.408 24.690 -11.419 1142 HG3 GLN 746 HG1 GLN 746 37.941 23.010 -11.668 1143 HE21 GLN 746 HE21 GLN 746 35.793 25.469 -10.416 1144 HE22 GLN 746 HE22 GLN 746 34.751 25.530 -11.791 1145 H GLN 747 HN GLN 747 38.993 25.419 -7.626 1146 HA GLN 747 HA GLN 747 40.780 26.851 -9.258 1147 HB2 GLN 747 HB2 GLN 747 39.357 27.863 -7.482 1148 HB3 GLN 747 HB1 GLN 747 40.388 27.111 -6.271 1149 HG2 GLN 747 HG2 GLN 747 41.062 29.372 -6.469 1150 HG3 GLN 747 HG1 GLN 747 42.310 28.387 -7.230 1151 HE21 GLN 747 HE21 GLN 747 41.731 31.176 -7.632 1152 HE22 GLN 747 HE22 GLN 747 41.361 31.368 -9.309 1153 H THR 748 HN THR 748 41.241 24.559 -6.646 1154 HA THR 748 HA THR 748 43.983 24.939 -6.219 1155 HB THR 748 HB THR 748 42.400 22.368 -5.949 1156 HG1 THR 748 HG1 THR 748 41.670 24.325 -4.732 1157 HG21 THR 748 HG21 THR 748 44.115 21.692 -4.369 1158 HG22 THR 748 HG22 THR 748 44.948 23.233 -4.570 1159 HG23 THR 748 HG23 THR 748 44.872 22.091 -5.910 1160 H GLU 749 HN GLU 749 42.245 22.749 -8.420 1161 HA GLU 749 HA GLU 749 44.644 21.674 -9.531 1162 HB2 GLU 749 HB2 GLU 749 41.767 21.510 -10.411 1163 HB3 GLU 749 HB1 GLU 749 43.078 20.712 -11.266 1164 HG2 GLU 749 HG2 GLU 749 43.611 19.481 -9.170 1165 HG3 GLU 749 HG1 GLU 749 42.175 20.198 -8.440 1166 H TYR 750 HN TYR 750 42.566 24.360 -10.289 1167 HA TYR 750 HA TYR 750 43.588 24.759 -12.933 1168 HB2 TYR 750 HB2 TYR 750 41.342 25.548 -12.192 1169 HB3 TYR 750 HB1 TYR 750 42.134 26.729 -11.155 1170 HD1 TYR 750 HD1 TYR 750 42.105 25.640 -14.727 1171 HD2 TYR 750 HD2 TYR 750 42.417 28.876 -11.982 1172 HE1 TYR 750 HE1 TYR 750 42.158 27.220 -16.603 1173 HE2 TYR 750 HE2 TYR 750 42.473 30.466 -13.857 1174 HH TYR 750 HH TYR 750 41.807 29.479 -17.120 1175 H LEU 751 HN LEU 751 44.311 26.060 -9.740 1176 HA LEU 751 HA LEU 751 46.114 28.076 -10.516 1177 HB2 LEU 751 HB2 LEU 751 45.027 27.515 -8.201 1178 HB3 LEU 751 HB1 LEU 751 46.417 26.478 -7.983 1179 HG LEU 751 HG LEU 751 46.670 28.654 -6.860 1180 HD11 LEU 751 HD11 LEU 751 48.671 27.480 -7.578 1181 HD12 LEU 751 HD12 LEU 751 48.885 29.227 -7.681 1182 HD13 LEU 751 HD13 LEU 751 48.593 28.285 -9.145 1183 HD21 LEU 751 HD21 LEU 751 46.920 30.698 -8.118 1184 HD22 LEU 751 HD22 LEU 751 45.342 29.981 -8.444 1185 HD23 LEU 751 HD23 LEU 751 46.641 29.837 -9.630 1186 H GLN 752 HN GLN 752 46.665 24.745 -9.448 1187 HA GLN 752 HA GLN 752 48.905 24.528 -11.260 1188 HB2 GLN 752 HB2 GLN 752 49.951 25.373 -9.196 1189 HB3 GLN 752 HB1 GLN 752 49.241 24.044 -8.292 1190 HG2 GLN 752 HG2 GLN 752 50.551 22.448 -9.564 1191 HG3 GLN 752 HG1 GLN 752 51.227 23.754 -10.536 1192 HE21 GLN 752 HE21 GLN 752 53.314 23.276 -9.933 1193 HE22 GLN 752 HE22 GLN 752 53.922 23.611 -8.349 1194 H GLN 753 HN GLN 753 47.928 22.687 -8.405 1195 HA GLN 753 HA GLN 753 46.362 20.755 -9.747 1196 HB2 GLN 753 HB2 GLN 753 49.262 20.139 -9.393 1197 HB3 GLN 753 HB1 GLN 753 48.111 18.862 -9.036 1198 HG2 GLN 753 HG2 GLN 753 47.179 19.132 -11.312 1199 HG3 GLN 753 HG1 GLN 753 48.441 20.315 -11.649 1200 HE21 GLN 753 HE21 GLN 753 47.896 17.777 -12.919 1201 HE22 GLN 753 HE22 GLN 753 49.334 16.832 -12.753 1202 H VAL 754 HN VAL 754 48.783 20.561 -7.172 1203 HA VAL 754 HA VAL 754 46.611 20.227 -5.226 1204 HB VAL 754 HB VAL 754 49.286 18.789 -5.163 1205 HG11 VAL 754 HG11 VAL 754 46.872 18.552 -3.369 1206 HG12 VAL 754 HG12 VAL 754 48.427 19.267 -2.943 1207 HG13 VAL 754 HG13 VAL 754 48.314 17.540 -3.284 1208 HG21 VAL 754 HG21 VAL 754 46.539 17.690 -5.775 1209 HG22 VAL 754 HG22 VAL 754 48.009 16.734 -5.585 1210 HG23 VAL 754 HG23 VAL 754 47.865 17.872 -6.924 1211 HHA CYC 800 HHA CYC 800 19.481 2.356 -4.217 1212 HMA1 CYC 800 HMA1 CYC 800 21.303 7.062 -3.122 1213 HMA2 CYC 800 HMA2 CYC 800 23.101 7.017 -3.141 1214 HMA3 CYC 800 HMA3 CYC 800 22.222 6.692 -1.606 1215 HAA1 CYC 800 HAA1 CYC 800 18.987 4.383 -3.455 1216 HAA2 CYC 800 HAA2 CYC 800 19.641 5.989 -3.007 1217 HBA1 CYC 800 HBA1 CYC 800 19.959 4.762 -5.826 1218 HBA2 CYC 800 HBA2 CYC 800 20.265 6.474 -5.334 1219 HHB CYC 800 HHB CYC 800 25.395 4.090 -3.309 1220 HB CYC 800 HB CYC 800 23.698 6.451 -0.706 1221 HMB1 CYC 800 HMB1 CYC 800 27.595 4.381 -2.732 1222 HMB2 CYC 800 HMB2 CYC 800 27.614 5.891 -3.748 1223 HMB3 CYC 800 HMB3 CYC 800 28.734 5.736 -2.323 1224 HAB1 CYC 800 HAB1 CYC 800 27.585 8.974 -0.304 1225 HAB2 CYC 800 HAB2 CYC 800 28.663 8.025 -1.414 1226 HBB1 CYC 800 HBB1 CYC 800 29.509 7.989 0.979 1227 HBB2 CYC 800 HBB2 CYC 800 27.960 7.238 1.507 1228 HBB3 CYC 800 HBB3 CYC 800 29.073 6.341 0.400 1229 HC CYC 800 HC CYC 800 23.916 -0.478 -2.495 1230 H2C CYC 800 H2C CYC 800 26.043 -3.454 -0.826 1231 H3C CYC 800 H3C CYC 800 24.823 -4.289 -3.456 1232 HMC1 CYC 800 HMC1 CYC 800 27.954 -2.719 -2.391 1233 HMC2 CYC 800 HMC2 CYC 800 27.349 -4.377 -2.771 1234 HMC3 CYC 800 HMC3 CYC 800 26.853 -2.987 -3.790 1235 HAC1 CYC 800 HAC CYC 800 24.505 -5.544 -1.411 1236 HBC1 CYC 800 HBC1 CYC 800 22.137 -6.010 -1.595 1237 HBC2 CYC 800 HBC2 CYC 800 22.704 -5.460 -3.207 1238 HBC3 CYC 800 HBC3 CYC 800 21.769 -4.334 -2.152 1239 HHD CYC 800 HHD CYC 800 22.230 -3.459 -4.004 1240 HD CYC 800 HD CYC 800 22.775 0.336 -3.530 1241 HMD1 CYC 800 HMD1 CYC 800 20.099 -3.565 -4.778 1242 HMD2 CYC 800 HMD2 CYC 800 19.254 -3.333 -3.201 1243 HMD3 CYC 800 HMD3 CYC 800 18.512 -2.712 -4.724 1244 HAD1 CYC 800 HAD1 CYC 800 17.964 0.241 -5.333 1245 HAD2 CYC 800 HAD2 CYC 800 17.578 -0.964 -4.066 1246 HBD1 CYC 800 HBD1 CYC 800 17.695 2.082 -3.809 1247 HBD2 CYC 800 HBD2 CYC 800 16.422 0.931 -3.279 1248 HA CYC 800 HA CYC 800 23.423 2.267 -3.511 Start of MODEL 5 1 H SER 599 HT1 SER 599 48.743 18.879 1.620 2 HA SER 599 HA SER 599 48.751 20.496 -0.150 3 HB2 SER 599 HB2 SER 599 46.160 19.132 -0.935 4 HB3 SER 599 HB1 SER 599 46.769 20.633 -1.630 5 HG SER 599 HG SER 599 48.632 19.451 -2.313 6 H ASP 600 HN ASP 600 47.497 22.475 0.023 7 HA ASP 600 HA ASP 600 46.676 23.043 2.631 8 HB2 ASP 600 HB2 ASP 600 45.856 25.191 1.666 9 HB3 ASP 600 HB1 ASP 600 47.495 24.783 1.168 10 H VAL 601 HN VAL 601 44.884 21.976 -0.146 11 HA VAL 601 HA VAL 601 42.278 22.610 0.470 12 HB VAL 601 HB VAL 601 43.255 20.019 -0.759 13 HG11 VAL 601 HG11 VAL 601 41.063 19.931 -1.840 14 HG12 VAL 601 HG12 VAL 601 40.571 21.375 -0.955 15 HG13 VAL 601 HG13 VAL 601 40.920 19.883 -0.082 16 HG21 VAL 601 HG21 VAL 601 44.125 21.977 -1.925 17 HG22 VAL 601 HG22 VAL 601 42.490 22.628 -2.058 18 HG23 VAL 601 HG23 VAL 601 42.919 21.144 -2.906 19 H GLU 602 HN GLU 602 44.265 20.015 1.788 20 HA GLU 602 HA GLU 602 42.372 18.463 3.093 21 HB2 GLU 602 HB2 GLU 602 45.228 19.131 3.732 22 HB3 GLU 602 HB1 GLU 602 44.286 18.073 4.770 23 HG2 GLU 602 HG2 GLU 602 44.687 17.588 1.837 24 HG3 GLU 602 HG1 GLU 602 45.742 16.932 3.089 25 H GLU 603 HN GLU 603 44.267 21.123 4.501 26 HA GLU 603 HA GLU 603 42.925 21.086 6.975 27 HB2 GLU 603 HB2 GLU 603 45.172 22.038 6.671 28 HB3 GLU 603 HB1 GLU 603 44.490 23.335 5.700 29 HG2 GLU 603 HG2 GLU 603 43.339 24.238 7.577 30 HG3 GLU 603 HG1 GLU 603 43.734 22.833 8.566 31 H ILE 604 HN ILE 604 42.471 23.057 4.073 32 HA ILE 604 HA ILE 604 40.544 24.815 5.097 33 HB ILE 604 HB ILE 604 40.798 23.792 2.255 34 HG12 ILE 604 HG12 ILE 604 41.934 26.286 3.542 35 HG13 ILE 604 HG11 ILE 604 42.858 24.837 3.165 36 HG21 ILE 604 HG21 ILE 604 39.624 25.851 1.617 37 HG22 ILE 604 HG22 ILE 604 39.428 26.268 3.319 38 HG23 ILE 604 HG23 ILE 604 38.626 24.841 2.663 39 HD11 ILE 604 HD11 ILE 604 41.475 26.625 1.179 40 HD12 ILE 604 HD12 ILE 604 42.392 25.169 0.790 41 HD13 ILE 604 HD13 ILE 604 43.207 26.562 1.503 42 H PHE 605 HN PHE 605 40.171 21.635 3.522 43 HA PHE 605 HA PHE 605 37.366 21.559 3.527 44 HB2 PHE 605 HB2 PHE 605 39.581 19.740 3.021 45 HB3 PHE 605 HB1 PHE 605 38.227 18.933 3.799 46 HD1 PHE 605 HD1 PHE 605 39.007 21.200 0.960 47 HD2 PHE 605 HD2 PHE 605 36.497 18.144 2.515 48 HE1 PHE 605 HE1 PHE 605 37.880 21.020 -1.225 49 HE2 PHE 605 HE2 PHE 605 35.365 17.955 0.341 50 HZ PHE 605 HZ PHE 605 36.058 19.393 -1.532 51 H LYS 606 HN LYS 606 39.727 20.170 5.733 52 HA LYS 606 HA LYS 606 37.867 18.924 7.444 53 HB2 LYS 606 HB2 LYS 606 40.704 19.793 7.984 54 HB3 LYS 606 HB1 LYS 606 39.759 18.767 9.061 55 HG2 LYS 606 HG2 LYS 606 39.670 17.021 7.474 56 HG3 LYS 606 HG1 LYS 606 40.261 18.067 6.185 57 HD2 LYS 606 HD2 LYS 606 42.406 18.274 7.477 58 HD3 LYS 606 HD1 LYS 606 41.795 17.015 8.556 59 HE2 LYS 606 HE2 LYS 606 41.653 15.447 6.747 60 HE3 LYS 606 HE1 LYS 606 42.040 16.698 5.570 61 HZ1 LYS 606 HZ1 LYS 606 43.980 15.469 5.896 62 HZ2 LYS 606 HZ2 LYS 606 43.837 15.486 7.588 63 HZ3 LYS 606 HZ3 LYS 606 44.228 16.906 6.756 64 H THR 607 HN THR 607 39.296 22.142 7.566 65 HA THR 607 HA THR 607 38.231 22.849 10.090 66 HB THR 607 HB THR 607 38.984 24.651 7.768 67 HG1 THR 607 HG1 THR 607 40.622 23.161 8.817 68 HG21 THR 607 HG21 THR 607 38.663 25.274 10.708 69 HG22 THR 607 HG22 THR 607 37.583 25.800 9.418 70 HG23 THR 607 HG23 THR 607 39.241 26.395 9.476 71 H THR 608 HN THR 608 37.075 23.476 6.776 72 HA THR 608 HA THR 608 34.765 24.906 7.574 73 HB THR 608 HB THR 608 35.213 23.481 4.944 74 HG1 THR 608 HG1 THR 608 36.933 24.830 5.113 75 HG21 THR 608 HG21 THR 608 33.743 25.238 4.048 76 HG22 THR 608 HG22 THR 608 33.544 25.900 5.670 77 HG23 THR 608 HG23 THR 608 32.918 24.295 5.290 78 H THR 609 HN THR 609 35.298 21.531 6.714 79 HA THR 609 HA THR 609 32.640 20.670 6.613 80 HB THR 609 HB THR 609 34.987 19.012 7.582 81 HG1 THR 609 HG1 THR 609 35.492 19.802 5.563 82 HG21 THR 609 HG21 THR 609 32.790 17.970 7.978 83 HG22 THR 609 HG22 THR 609 33.691 17.114 6.726 84 HG23 THR 609 HG23 THR 609 32.377 18.203 6.279 85 H GLN 610 HN GLN 610 34.738 21.106 9.462 86 HA GLN 610 HA GLN 610 32.909 19.860 11.257 87 HB2 GLN 610 HB2 GLN 610 35.185 21.768 11.799 88 HB3 GLN 610 HB1 GLN 610 34.329 20.832 13.019 89 HG2 GLN 610 HG2 GLN 610 35.085 18.765 11.958 90 HG3 GLN 610 HG1 GLN 610 35.953 19.708 10.750 91 HE21 GLN 610 HE21 GLN 610 37.928 18.894 11.294 92 HE22 GLN 610 HE22 GLN 610 38.738 19.274 12.773 93 H GLU 611 HN GLU 611 33.220 22.963 9.882 94 HA GLU 611 HA GLU 611 31.583 24.331 11.826 95 HB2 GLU 611 HB2 GLU 611 32.486 25.108 9.052 96 HB3 GLU 611 HB1 GLU 611 31.454 26.128 10.044 97 HG2 GLU 611 HG2 GLU 611 33.238 26.105 11.784 98 HG3 GLU 611 HG1 GLU 611 34.270 25.263 10.629 99 H VAL 612 HN VAL 612 31.145 23.108 8.544 100 HA VAL 612 HA VAL 612 28.418 23.630 8.265 101 HB VAL 612 HB VAL 612 30.114 21.406 7.104 102 HG11 VAL 612 HG11 VAL 612 27.788 20.707 7.087 103 HG12 VAL 612 HG12 VAL 612 28.334 21.085 5.451 104 HG13 VAL 612 HG13 VAL 612 27.317 22.230 6.330 105 HG21 VAL 612 HG21 VAL 612 29.121 24.002 5.931 106 HG22 VAL 612 HG22 VAL 612 30.068 22.784 5.078 107 HG23 VAL 612 HG23 VAL 612 30.774 23.657 6.439 108 H ARG 613 HN ARG 613 30.123 20.896 9.681 109 HA ARG 613 HA ARG 613 28.032 19.158 10.168 110 HB2 ARG 613 HB2 ARG 613 30.362 18.564 10.542 111 HB3 ARG 613 HB1 ARG 613 30.463 19.709 11.872 112 HG2 ARG 613 HG2 ARG 613 28.887 18.409 13.156 113 HG3 ARG 613 HG1 ARG 613 28.675 17.296 11.804 114 HD2 ARG 613 HD2 ARG 613 30.184 16.352 13.459 115 HD3 ARG 613 HD1 ARG 613 31.035 16.670 11.950 116 HE ARG 613 HE ARG 613 31.486 18.907 13.422 117 HH11 ARG 613 HH11 ARG 613 31.882 15.493 14.077 118 HH12 ARG 613 HH12 ARG 613 33.277 15.710 15.084 119 HH21 ARG 613 HH21 ARG 613 33.337 19.205 14.783 120 HH22 ARG 613 HH22 ARG 613 34.101 17.822 15.482 121 H GLN 614 HN GLN 614 29.163 21.869 12.167 122 HA GLN 614 HA GLN 614 27.392 21.453 14.301 123 HB2 GLN 614 HB2 GLN 614 28.837 23.927 13.355 124 HB3 GLN 614 HB1 GLN 614 27.942 23.834 14.866 125 HG2 GLN 614 HG2 GLN 614 29.428 22.183 15.735 126 HG3 GLN 614 HG1 GLN 614 30.225 22.004 14.174 127 HE21 GLN 614 HE21 GLN 614 31.708 23.515 13.525 128 HE22 GLN 614 HE22 GLN 614 32.359 24.716 14.584 129 H LEU 615 HN LEU 615 27.140 23.428 11.375 130 HA LEU 615 HA LEU 615 24.676 24.667 12.045 131 HB2 LEU 615 HB2 LEU 615 26.208 24.291 9.504 132 HB3 LEU 615 HB1 LEU 615 24.559 24.870 9.423 133 HG LEU 615 HG LEU 615 25.165 26.816 10.801 134 HD11 LEU 615 HD11 LEU 615 27.975 25.742 10.645 135 HD12 LEU 615 HD12 LEU 615 26.978 25.837 12.095 136 HD13 LEU 615 HD13 LEU 615 27.501 27.314 11.288 137 HD21 LEU 615 HD21 LEU 615 25.267 26.999 8.383 138 HD22 LEU 615 HD22 LEU 615 26.930 26.408 8.391 139 HD23 LEU 615 HD23 LEU 615 26.543 27.962 9.129 140 H LEU 616 HN LEU 616 25.483 21.625 10.622 141 HA LEU 616 HA LEU 616 22.773 21.056 9.768 142 HB2 LEU 616 HB2 LEU 616 25.182 19.252 9.970 143 HB3 LEU 616 HB1 LEU 616 23.642 18.786 9.281 144 HG LEU 616 HG LEU 616 25.491 20.908 8.192 145 HD11 LEU 616 HD11 LEU 616 26.342 18.645 7.896 146 HD12 LEU 616 HD12 LEU 616 25.836 19.342 6.358 147 HD13 LEU 616 HD13 LEU 616 24.813 18.156 7.167 148 HD21 LEU 616 HD21 LEU 616 23.959 20.948 6.276 149 HD22 LEU 616 HD22 LEU 616 23.151 21.452 7.760 150 HD23 LEU 616 HD23 LEU 616 22.882 19.833 7.116 151 H ARG 617 HN ARG 617 24.563 20.891 12.619 152 HA ARG 617 HA ARG 617 24.150 20.170 14.724 153 HB2 ARG 617 HB2 ARG 617 21.328 19.751 13.711 154 HB3 ARG 617 HB1 ARG 617 21.811 19.787 15.401 155 HG2 ARG 617 HG2 ARG 617 22.508 22.108 15.167 156 HG3 ARG 617 HG1 ARG 617 22.069 22.075 13.459 157 HD2 ARG 617 HD2 ARG 617 19.737 21.586 14.109 158 HD3 ARG 617 HD1 ARG 617 20.207 21.724 15.804 159 HE ARG 617 HE ARG 617 20.839 24.021 14.164 160 HH11 ARG 617 HH11 ARG 617 18.474 22.534 16.282 161 HH12 ARG 617 HH12 ARG 617 17.707 24.026 16.694 162 HH21 ARG 617 HH21 ARG 617 19.824 25.994 14.682 163 HH22 ARG 617 HH22 ARG 617 18.472 26.016 15.760 164 H CYS 618 HN CYS 618 25.105 18.367 12.751 165 HA CYS 618 HA CYS 618 23.998 15.804 13.649 166 HB2 CYS 618 HB2 CYS 618 25.221 14.886 11.644 167 HB3 CYS 618 HB1 CYS 618 23.897 15.986 11.274 168 HG CYS 618 HG CYS 618 26.538 17.831 11.522 169 H ASP 619 HN ASP 619 25.763 14.017 13.625 170 HA ASP 619 HA ASP 619 27.882 14.923 15.424 171 HB2 ASP 619 HB2 ASP 619 26.908 12.163 14.696 172 HB3 ASP 619 HB1 ASP 619 28.222 12.489 15.820 173 H ARG 620 HN ARG 620 27.507 12.960 12.517 174 HA ARG 620 HA ARG 620 30.353 13.480 11.967 175 HB2 ARG 620 HB2 ARG 620 30.163 11.180 12.601 176 HB3 ARG 620 HB1 ARG 620 28.804 10.933 11.515 177 HG2 ARG 620 HG2 ARG 620 30.169 11.011 9.612 178 HG3 ARG 620 HG1 ARG 620 31.512 11.724 10.503 179 HD2 ARG 620 HD2 ARG 620 31.878 9.352 9.984 180 HD3 ARG 620 HD1 ARG 620 31.851 9.667 11.715 181 HE ARG 620 HE ARG 620 29.388 8.894 11.438 182 HH11 ARG 620 HH11 ARG 620 32.152 7.642 9.659 183 HH12 ARG 620 HH12 ARG 620 31.557 6.017 9.625 184 HH21 ARG 620 HH21 ARG 620 28.577 6.712 11.386 185 HH22 ARG 620 HH22 ARG 620 29.511 5.489 10.607 186 H VAL 621 HN VAL 621 30.982 13.913 9.921 187 HA VAL 621 HA VAL 621 28.995 14.038 7.774 188 HB VAL 621 HB VAL 621 30.870 16.328 8.480 189 HG11 VAL 621 HG11 VAL 621 28.863 16.083 6.236 190 HG12 VAL 621 HG12 VAL 621 30.617 16.043 6.067 191 HG13 VAL 621 HG13 VAL 621 29.819 17.517 6.614 192 HG21 VAL 621 HG21 VAL 621 27.861 16.195 8.565 193 HG22 VAL 621 HG22 VAL 621 28.840 17.633 8.865 194 HG23 VAL 621 HG23 VAL 621 28.940 16.252 9.959 195 H ALA 622 HN ALA 622 29.853 13.130 5.959 196 HA ALA 622 HA ALA 622 32.778 13.040 5.788 197 HB1 ALA 622 HB1 ALA 622 31.951 10.881 6.593 198 HB2 ALA 622 HB2 ALA 622 32.659 10.745 4.984 199 HB3 ALA 622 HB3 ALA 622 30.906 10.756 5.179 200 H VAL 623 HN VAL 623 33.552 12.524 3.641 201 HA VAL 623 HA VAL 623 31.832 13.701 1.551 202 HB VAL 623 HB VAL 623 34.866 13.696 1.612 203 HG11 VAL 623 HG11 VAL 623 32.927 15.154 -0.179 204 HG12 VAL 623 HG12 VAL 623 33.911 13.763 -0.628 205 HG13 VAL 623 HG13 VAL 623 34.685 15.296 -0.226 206 HG21 VAL 623 HG21 VAL 623 34.728 16.097 2.094 207 HG22 VAL 623 HG22 VAL 623 34.036 15.127 3.397 208 HG23 VAL 623 HG23 VAL 623 32.977 15.960 2.256 209 H TYR 624 HN TYR 624 31.629 12.514 -0.394 210 HA TYR 624 HA TYR 624 33.007 9.934 -0.403 211 HB2 TYR 624 HB2 TYR 624 30.646 9.653 0.213 212 HB3 TYR 624 HB1 TYR 624 30.155 10.588 -1.189 213 HD1 TYR 624 HD1 TYR 624 31.826 7.431 -0.171 214 HD2 TYR 624 HD2 TYR 624 29.764 9.525 -3.242 215 HE1 TYR 624 HE1 TYR 624 31.652 5.356 -1.471 216 HE2 TYR 624 HE2 TYR 624 29.588 7.460 -4.546 217 HH TYR 624 HH TYR 624 30.412 4.369 -3.232 218 H ARG 625 HN ARG 625 34.417 10.045 -2.023 219 HA ARG 625 HA ARG 625 33.814 11.825 -4.275 220 HB2 ARG 625 HB2 ARG 625 35.860 12.100 -2.726 221 HB3 ARG 625 HB1 ARG 625 36.514 10.710 -3.574 222 HG2 ARG 625 HG2 ARG 625 35.553 13.053 -5.139 223 HG3 ARG 625 HG1 ARG 625 37.103 13.141 -4.307 224 HD2 ARG 625 HD2 ARG 625 36.285 11.069 -6.335 225 HD3 ARG 625 HD1 ARG 625 37.369 12.438 -6.604 226 HE ARG 625 HE ARG 625 38.184 10.676 -4.470 227 HH11 ARG 625 HH11 ARG 625 38.360 11.310 -7.907 228 HH12 ARG 625 HH12 ARG 625 39.876 10.496 -8.105 229 HH21 ARG 625 HH21 ARG 625 40.168 9.582 -4.719 230 HH22 ARG 625 HH22 ARG 625 40.897 9.495 -6.292 231 H PHE 626 HN PHE 626 33.884 11.107 -6.358 232 HA PHE 626 HA PHE 626 33.850 8.217 -6.693 233 HB2 PHE 626 HB2 PHE 626 33.052 10.465 -8.540 234 HB3 PHE 626 HB1 PHE 626 33.004 8.764 -8.989 235 HD1 PHE 626 HD1 PHE 626 31.310 11.454 -7.345 236 HD2 PHE 626 HD2 PHE 626 31.482 7.221 -7.705 237 HE1 PHE 626 HE1 PHE 626 29.042 11.286 -6.403 238 HE2 PHE 626 HE2 PHE 626 29.215 7.042 -6.771 239 HZ PHE 626 HZ PHE 626 27.992 9.078 -6.118 240 H ASN 627 HN ASN 627 35.533 7.158 -7.380 241 HA ASN 627 HA ASN 627 37.834 8.445 -8.566 242 HB2 ASN 627 HB2 ASN 627 37.224 5.489 -8.207 243 HB3 ASN 627 HB1 ASN 627 38.798 6.188 -8.561 244 HD21 ASN 627 HD21 ASN 627 39.978 7.121 -6.924 245 HD22 ASN 627 HD22 ASN 627 39.536 6.977 -5.260 246 HA PRO 628 HA PRO 628 36.963 7.677 -12.902 247 HB2 PRO 628 HB2 PRO 628 39.210 5.720 -13.047 248 HB3 PRO 628 HB1 PRO 628 38.889 7.138 -14.054 249 HG2 PRO 628 HG2 PRO 628 40.797 7.231 -12.227 250 HG3 PRO 628 HG1 PRO 628 39.719 8.620 -12.462 251 HD2 PRO 628 HD2 PRO 628 39.683 6.537 -10.311 252 HD3 PRO 628 HD1 PRO 628 39.415 8.289 -10.184 253 H ASN 629 HN ASN 629 37.315 4.976 -10.754 254 HA ASN 629 HA ASN 629 35.731 3.274 -12.551 255 HB2 ASN 629 HB2 ASN 629 37.402 2.602 -10.131 256 HB3 ASN 629 HB1 ASN 629 36.301 1.449 -10.872 257 HD21 ASN 629 HD21 ASN 629 39.175 1.266 -10.599 258 HD22 ASN 629 HD22 ASN 629 39.808 1.126 -12.204 259 H TRP 630 HN TRP 630 35.140 5.498 -10.278 260 HA TRP 630 HA TRP 630 33.510 5.950 -8.751 261 HB2 TRP 630 HB2 TRP 630 32.014 3.996 -10.515 262 HB3 TRP 630 HB1 TRP 630 31.244 5.011 -9.299 263 HD1 TRP 630 HD1 TRP 630 31.203 7.674 -9.790 264 HE1 TRP 630 HE1 TRP 630 31.309 8.987 -11.996 265 HE3 TRP 630 HE3 TRP 630 32.986 3.985 -12.845 266 HZ2 TRP 630 HZ2 TRP 630 32.044 8.527 -14.674 267 HZ3 TRP 630 HZ3 TRP 630 33.361 4.505 -15.220 268 HH2 TRP 630 HH2 TRP 630 32.899 6.728 -16.114 269 H THR 631 HN THR 631 35.332 4.190 -7.778 270 HA THR 631 HA THR 631 34.077 1.852 -6.734 271 HB THR 631 HB THR 631 36.339 1.704 -5.498 272 HG1 THR 631 HG1 THR 631 37.700 3.289 -5.910 273 HG21 THR 631 HG21 THR 631 37.385 0.878 -7.549 274 HG22 THR 631 HG22 THR 631 36.155 1.719 -8.499 275 HG23 THR 631 HG23 THR 631 35.694 0.384 -7.446 276 H GLY 632 HN GLY 632 34.213 5.037 -5.702 277 HA2 GLY 632 HA2 GLY 632 33.020 5.886 -3.891 278 HA3 GLY 632 HA1 GLY 632 32.885 4.253 -3.266 279 H GLU 633 HN GLU 633 35.307 6.800 -3.790 280 HA GLU 633 HA GLU 633 36.800 5.739 -1.514 281 HB2 GLU 633 HB2 GLU 633 38.019 6.226 -3.574 282 HB3 GLU 633 HB1 GLU 633 37.450 7.884 -3.532 283 HG2 GLU 633 HG2 GLU 633 38.681 8.179 -1.393 284 HG3 GLU 633 HG1 GLU 633 39.353 6.562 -1.622 285 H PHE 634 HN PHE 634 36.621 6.649 0.431 286 HA PHE 634 HA PHE 634 35.309 9.235 0.696 287 HB2 PHE 634 HB2 PHE 634 36.179 7.149 2.704 288 HB3 PHE 634 HB1 PHE 634 35.580 8.731 3.180 289 HD1 PHE 634 HD1 PHE 634 34.701 5.419 2.008 290 HD2 PHE 634 HD2 PHE 634 33.233 9.350 2.713 291 HE1 PHE 634 HE1 PHE 634 32.395 4.566 1.946 292 HE2 PHE 634 HE2 PHE 634 30.924 8.503 2.650 293 HZ PHE 634 HZ PHE 634 30.504 6.110 2.267 294 H VAL 635 HN VAL 635 36.517 11.007 0.655 295 HA VAL 635 HA VAL 635 39.389 10.742 0.969 296 HB VAL 635 HB VAL 635 39.509 13.101 0.185 297 HG11 VAL 635 HG11 VAL 635 38.839 12.620 -2.122 298 HG12 VAL 635 HG12 VAL 635 37.925 11.221 -1.560 299 HG13 VAL 635 HG13 VAL 635 39.679 11.254 -1.388 300 HG21 VAL 635 HG21 VAL 635 37.497 14.155 -0.737 301 HG22 VAL 635 HG22 VAL 635 37.339 13.883 0.998 302 HG23 VAL 635 HG23 VAL 635 36.518 12.815 -0.140 303 H ALA 636 HN ALA 636 36.719 12.249 2.679 304 HA ALA 636 HA ALA 636 38.492 12.728 4.917 305 HB1 ALA 636 HB1 ALA 636 38.664 14.801 3.606 306 HB2 ALA 636 HB2 ALA 636 37.893 15.070 5.169 307 HB3 ALA 636 HB3 ALA 636 36.915 14.995 3.703 308 H GLU 637 HN GLU 637 37.412 13.030 6.887 309 HA GLU 637 HA GLU 637 34.522 12.914 6.950 310 HB2 GLU 637 HB2 GLU 637 35.089 10.556 6.807 311 HB3 GLU 637 HB1 GLU 637 36.279 10.738 8.089 312 HG2 GLU 637 HG2 GLU 637 34.466 11.294 9.658 313 HG3 GLU 637 HG1 GLU 637 33.298 11.011 8.370 314 H SER 638 HN SER 638 33.835 14.150 8.564 315 HA SER 638 HA SER 638 35.691 14.720 10.762 316 HB2 SER 638 HB2 SER 638 33.279 16.288 9.811 317 HB3 SER 638 HB1 SER 638 34.340 16.752 11.141 318 HG SER 638 HG SER 638 35.836 16.234 9.007 319 H VAL 639 HN VAL 639 35.318 13.372 12.366 320 HA VAL 639 HA VAL 639 32.535 12.746 13.053 321 HB VAL 639 HB VAL 639 33.597 10.811 11.996 322 HG11 VAL 639 HG11 VAL 639 35.489 9.663 13.067 323 HG12 VAL 639 HG12 VAL 639 35.654 11.018 14.185 324 HG13 VAL 639 HG13 VAL 639 35.916 11.263 12.457 325 HG21 VAL 639 HG21 VAL 639 33.253 10.443 14.961 326 HG22 VAL 639 HG22 VAL 639 33.215 9.156 13.753 327 HG23 VAL 639 HG23 VAL 639 31.968 10.406 13.755 328 H ALA 640 HN ALA 640 32.021 12.610 15.221 329 HA ALA 640 HA ALA 640 33.672 14.120 17.005 330 HB1 ALA 640 HB1 ALA 640 31.862 13.809 18.606 331 HB2 ALA 640 HB2 ALA 640 31.111 12.615 17.546 332 HB3 ALA 640 HB3 ALA 640 31.220 14.300 17.038 333 H HIS 641 HN HIS 641 34.357 13.349 19.110 334 HA HIS 641 HA HIS 641 35.843 10.948 18.914 335 HB2 HIS 641 HB2 HIS 641 36.545 12.936 20.230 336 HB3 HIS 641 HB1 HIS 641 35.267 12.588 21.387 337 HD2 HIS 641 HD2 HIS 641 38.195 10.299 19.984 338 HE1 HIS 641 HE1 HIS 641 38.036 10.016 24.210 339 HE2 HIS 641 HE2 HIS 641 39.157 9.195 22.115 340 H THR 642 HN THR 642 32.617 11.490 19.807 341 HA THR 642 HA THR 642 32.323 9.303 21.628 342 HB THR 642 HB THR 642 29.830 9.691 21.042 343 HG1 THR 642 HG1 THR 642 29.436 11.680 20.017 344 HG21 THR 642 HG21 THR 642 31.472 11.928 22.239 345 HG22 THR 642 HG22 THR 642 30.895 10.501 23.100 346 HG23 THR 642 HG23 THR 642 29.742 11.680 22.477 347 H TRP 643 HN TRP 643 32.659 9.566 18.279 348 HA TRP 643 HA TRP 643 31.354 6.968 17.811 349 HB2 TRP 643 HB2 TRP 643 31.989 9.234 15.926 350 HB3 TRP 643 HB1 TRP 643 31.448 7.652 15.392 351 HD1 TRP 643 HD1 TRP 643 30.169 10.582 17.583 352 HE1 TRP 643 HE1 TRP 643 27.619 10.685 17.324 353 HE3 TRP 643 HE3 TRP 643 29.503 6.470 14.639 354 HZ2 TRP 643 HZ2 TRP 643 25.588 9.207 16.032 355 HZ3 TRP 643 HZ3 TRP 643 27.226 5.884 13.929 356 HH2 TRP 643 HH2 TRP 643 25.309 7.225 14.613 357 H VAL 644 HN VAL 644 32.443 5.922 15.782 358 HA VAL 644 HA VAL 644 35.306 5.749 16.330 359 HB VAL 644 HB VAL 644 35.245 3.650 15.015 360 HG11 VAL 644 HG11 VAL 644 34.914 3.547 17.426 361 HG12 VAL 644 HG12 VAL 644 33.974 2.298 16.609 362 HG13 VAL 644 HG13 VAL 644 33.176 3.753 17.206 363 HG21 VAL 644 HG21 VAL 644 33.413 4.195 13.496 364 HG22 VAL 644 HG22 VAL 644 32.271 4.159 14.839 365 HG23 VAL 644 HG23 VAL 644 33.089 2.679 14.338 366 H LYS 645 HN LYS 645 36.770 5.651 14.488 367 HA LYS 645 HA LYS 645 35.988 7.611 12.494 368 HB2 LYS 645 HB2 LYS 645 38.646 6.283 13.021 369 HB3 LYS 645 HB1 LYS 645 38.371 7.552 11.839 370 HG2 LYS 645 HG2 LYS 645 37.725 9.075 13.661 371 HG3 LYS 645 HG1 LYS 645 38.074 7.793 14.825 372 HD2 LYS 645 HD2 LYS 645 40.394 7.713 14.013 373 HD3 LYS 645 HD1 LYS 645 40.035 9.030 12.896 374 HE2 LYS 645 HE2 LYS 645 41.159 9.831 14.917 375 HE3 LYS 645 HE1 LYS 645 39.538 10.503 14.764 376 HZ1 LYS 645 HZ1 LYS 645 40.133 9.725 17.027 377 HZ2 LYS 645 HZ2 LYS 645 40.182 8.141 16.439 378 HZ3 LYS 645 HZ3 LYS 645 38.734 9.013 16.406 379 H LEU 646 HN LEU 646 35.620 7.216 10.412 380 HA LEU 646 HA LEU 646 35.895 4.441 9.493 381 HB2 LEU 646 HB2 LEU 646 33.652 5.516 9.357 382 HB3 LEU 646 HB1 LEU 646 34.330 6.731 8.295 383 HG LEU 646 HG LEU 646 34.902 4.868 6.694 384 HD11 LEU 646 HD11 LEU 646 34.817 3.005 8.239 385 HD12 LEU 646 HD12 LEU 646 33.645 2.776 6.939 386 HD13 LEU 646 HD13 LEU 646 33.102 3.301 8.532 387 HD21 LEU 646 HD21 LEU 646 31.991 5.308 7.353 388 HD22 LEU 646 HD22 LEU 646 32.627 4.714 5.819 389 HD23 LEU 646 HD23 LEU 646 32.999 6.354 6.351 390 H VAL 647 HN VAL 647 36.613 7.798 8.755 391 HA VAL 647 HA VAL 647 38.559 6.873 6.743 392 HB VAL 647 HB VAL 647 37.401 9.653 6.964 393 HG11 VAL 647 HG11 VAL 647 38.297 9.934 4.701 394 HG12 VAL 647 HG12 VAL 647 38.968 8.305 4.769 395 HG13 VAL 647 HG13 VAL 647 39.566 9.550 5.865 396 HG21 VAL 647 HG21 VAL 647 36.586 7.449 5.073 397 HG22 VAL 647 HG22 VAL 647 35.969 9.103 5.085 398 HG23 VAL 647 HG23 VAL 647 35.637 8.028 6.441 399 H GLY 648 HN GLY 648 40.482 6.759 7.653 400 HA2 GLY 648 HA2 GLY 648 41.223 8.739 9.691 401 HA3 GLY 648 HA1 GLY 648 42.041 7.210 9.398 402 HA PRO 649 HA PRO 649 44.561 10.747 7.568 403 HB2 PRO 649 HB2 PRO 649 46.915 9.383 8.234 404 HB3 PRO 649 HB1 PRO 649 46.208 10.717 9.149 405 HG2 PRO 649 HG2 PRO 649 46.017 7.778 9.623 406 HG3 PRO 649 HG1 PRO 649 46.117 9.102 10.796 407 HD2 PRO 649 HD2 PRO 649 43.806 7.846 10.304 408 HD3 PRO 649 HD1 PRO 649 43.857 9.594 10.621 409 H ASP 650 HN ASP 650 45.539 7.320 7.589 410 HA ASP 650 HA ASP 650 45.788 7.455 4.659 411 HB2 ASP 650 HB2 ASP 650 47.383 5.648 4.813 412 HB3 ASP 650 HB1 ASP 650 47.869 6.920 5.929 413 H ILE 651 HN ILE 651 43.907 6.292 7.155 414 HA ILE 651 HA ILE 651 43.189 3.781 5.927 415 HB ILE 651 HB ILE 651 41.802 5.105 8.267 416 HG12 ILE 651 HG12 ILE 651 44.115 3.151 8.335 417 HG13 ILE 651 HG11 ILE 651 44.249 4.871 8.675 418 HG21 ILE 651 HG21 ILE 651 41.984 2.217 7.389 419 HG22 ILE 651 HG22 ILE 651 40.569 3.260 7.242 420 HG23 ILE 651 HG23 ILE 651 41.161 2.798 8.838 421 HD11 ILE 651 HD11 ILE 651 42.749 4.597 10.592 422 HD12 ILE 651 HD12 ILE 651 44.183 3.578 10.724 423 HD13 ILE 651 HD13 ILE 651 42.640 2.870 10.250 424 H LYS 652 HN LYS 652 42.593 5.100 3.903 425 HA LYS 652 HA LYS 652 40.032 6.343 3.904 426 HB2 LYS 652 HB2 LYS 652 42.080 5.624 1.900 427 HB3 LYS 652 HB1 LYS 652 40.431 5.678 1.302 428 HG2 LYS 652 HG2 LYS 652 41.544 7.797 0.944 429 HG3 LYS 652 HG1 LYS 652 40.221 7.984 2.089 430 HD2 LYS 652 HD2 LYS 652 41.833 7.926 3.943 431 HD3 LYS 652 HD1 LYS 652 43.153 7.760 2.779 432 HE2 LYS 652 HE2 LYS 652 42.558 9.916 1.792 433 HE3 LYS 652 HE1 LYS 652 41.227 10.078 2.934 434 HZ1 LYS 652 HZ1 LYS 652 43.157 11.337 3.628 435 HZ2 LYS 652 HZ2 LYS 652 44.107 9.944 3.641 436 HZ3 LYS 652 HZ3 LYS 652 42.833 10.107 4.738 437 H THR 653 HN THR 653 38.091 5.450 3.772 438 HA THR 653 HA THR 653 37.872 2.572 3.418 439 HB THR 653 HB THR 653 35.876 4.667 4.321 440 HG1 THR 653 HG1 THR 653 37.004 4.208 6.099 441 HG21 THR 653 HG21 THR 653 35.471 1.675 4.069 442 HG22 THR 653 HG22 THR 653 34.688 2.905 3.079 443 HG23 THR 653 HG23 THR 653 34.336 2.806 4.805 444 H VAL 654 HN VAL 654 37.020 1.607 1.635 445 HA VAL 654 HA VAL 654 36.100 3.337 -0.545 446 HB VAL 654 HB VAL 654 37.049 0.454 -0.616 447 HG11 VAL 654 HG11 VAL 654 35.576 0.984 -2.461 448 HG12 VAL 654 HG12 VAL 654 37.232 0.795 -3.035 449 HG13 VAL 654 HG13 VAL 654 36.542 2.407 -2.850 450 HG21 VAL 654 HG21 VAL 654 38.863 1.930 0.056 451 HG22 VAL 654 HG22 VAL 654 38.550 2.969 -1.335 452 HG23 VAL 654 HG23 VAL 654 39.127 1.320 -1.577 453 H TRP 655 HN TRP 655 34.117 2.772 -1.673 454 HA TRP 655 HA TRP 655 32.519 0.648 -0.502 455 HB2 TRP 655 HB2 TRP 655 31.960 2.669 0.841 456 HB3 TRP 655 HB1 TRP 655 31.546 3.521 -0.636 457 HD1 TRP 655 HD1 TRP 655 29.964 0.581 -1.593 458 HE1 TRP 655 HE1 TRP 655 27.540 0.355 -0.766 459 HE3 TRP 655 HE3 TRP 655 30.083 4.032 2.176 460 HZ2 TRP 655 HZ2 TRP 655 25.897 1.495 1.226 461 HZ3 TRP 655 HZ3 TRP 655 28.038 4.404 3.491 462 HH2 TRP 655 HH2 TRP 655 25.992 3.161 3.027 463 H GLU 656 HN GLU 656 32.618 -0.409 -2.432 464 HA GLU 656 HA GLU 656 32.038 0.983 -4.883 465 HB2 GLU 656 HB2 GLU 656 32.619 -1.928 -4.333 466 HB3 GLU 656 HB1 GLU 656 32.344 -1.263 -5.937 467 HG2 GLU 656 HG2 GLU 656 34.282 0.228 -5.608 468 HG3 GLU 656 HG1 GLU 656 34.575 -0.541 -4.052 469 H ASP 657 HN ASP 657 29.943 1.663 -4.721 470 HA ASP 657 HA ASP 657 27.855 -0.251 -4.195 471 HB2 ASP 657 HB2 ASP 657 27.561 2.090 -3.482 472 HB3 ASP 657 HB1 ASP 657 27.643 2.612 -5.162 473 H THR 658 HN THR 658 27.435 -1.684 -5.632 474 HA THR 658 HA THR 658 28.158 -1.552 -8.333 475 HB THR 658 HB THR 658 27.920 -3.673 -7.056 476 HG1 THR 658 HG1 THR 658 27.905 -3.833 -9.290 477 HG21 THR 658 HG21 THR 658 25.858 -3.161 -5.837 478 HG22 THR 658 HG22 THR 658 25.690 -4.660 -6.751 479 HG23 THR 658 HG23 THR 658 24.953 -3.174 -7.351 480 H HIS 659 HN HIS 659 25.312 -0.499 -6.658 481 HA HIS 659 HA HIS 659 23.555 -0.573 -8.878 482 HB2 HIS 659 HB2 HIS 659 22.780 -0.434 -6.517 483 HB3 HIS 659 HB1 HIS 659 23.384 1.218 -6.450 484 HD2 HIS 659 HD2 HIS 659 20.582 -0.782 -8.363 485 HE1 HIS 659 HE1 HIS 659 19.588 3.335 -8.330 486 HE2 HIS 659 HE2 HIS 659 18.768 0.998 -8.796 487 H LEU 660 HN LEU 660 25.273 2.235 -7.326 488 HA LEU 660 HA LEU 660 24.610 4.075 -9.268 489 HB2 LEU 660 HB2 LEU 660 27.107 3.913 -7.583 490 HB3 LEU 660 HB1 LEU 660 26.554 5.337 -8.440 491 HG LEU 660 HG LEU 660 25.122 3.994 -6.144 492 HD11 LEU 660 HD11 LEU 660 27.139 5.151 -5.440 493 HD12 LEU 660 HD12 LEU 660 25.697 6.012 -4.900 494 HD13 LEU 660 HD13 LEU 660 26.612 6.607 -6.285 495 HD21 LEU 660 HD21 LEU 660 23.639 5.956 -6.218 496 HD22 LEU 660 HD22 LEU 660 23.534 4.990 -7.688 497 HD23 LEU 660 HD23 LEU 660 24.449 6.498 -7.689 498 H GLN 661 HN GLN 661 27.569 2.105 -9.022 499 HA GLN 661 HA GLN 661 28.820 2.872 -11.345 500 HB2 GLN 661 HB2 GLN 661 28.725 0.202 -9.966 501 HB3 GLN 661 HB1 GLN 661 29.663 0.426 -11.433 502 HG2 GLN 661 HG2 GLN 661 30.929 2.228 -10.311 503 HG3 GLN 661 HG1 GLN 661 30.024 1.906 -8.832 504 HE21 GLN 661 HE21 GLN 661 32.023 1.472 -7.811 505 HE22 GLN 661 HE22 GLN 661 32.831 -0.045 -8.035 506 H GLU 662 HN GLU 662 26.063 0.731 -11.042 507 HA GLU 662 HA GLU 662 26.135 -0.137 -13.779 508 HB2 GLU 662 HB2 GLU 662 24.896 -1.008 -11.445 509 HB3 GLU 662 HB1 GLU 662 23.572 -0.449 -12.455 510 HG2 GLU 662 HG2 GLU 662 25.622 -2.538 -13.139 511 HG3 GLU 662 HG1 GLU 662 23.905 -2.783 -12.826 512 H THR 663 HN THR 663 24.067 2.074 -11.896 513 HA THR 663 HA THR 663 22.636 2.850 -14.306 514 HB THR 663 HB THR 663 21.383 2.502 -12.200 515 HG1 THR 663 HG1 THR 663 21.368 4.987 -13.525 516 HG21 THR 663 HG21 THR 663 23.027 3.309 -10.597 517 HG22 THR 663 HG22 THR 663 21.518 4.206 -10.414 518 HG23 THR 663 HG23 THR 663 22.888 4.944 -11.246 519 H GLN 664 HN GLN 664 25.543 3.655 -13.378 520 HA GLN 664 HA GLN 664 26.967 5.399 -13.617 521 HB2 GLN 664 HB2 GLN 664 25.476 5.274 -15.903 522 HB3 GLN 664 HB1 GLN 664 25.212 6.941 -15.420 523 HG2 GLN 664 HG2 GLN 664 27.948 5.719 -15.713 524 HG3 GLN 664 HG1 GLN 664 27.110 6.539 -17.024 525 HE21 GLN 664 HE21 GLN 664 29.627 7.171 -15.716 526 HE22 GLN 664 HE22 GLN 664 29.467 8.783 -15.113 527 H GLY 665 HN GLY 665 25.940 5.707 -11.338 528 HA2 GLY 665 HA2 GLY 665 25.782 7.316 -9.685 529 HA3 GLY 665 HA1 GLY 665 25.835 8.549 -10.927 530 H GLY 666 HN GLY 666 23.448 7.089 -12.212 531 HA2 GLY 666 HA2 GLY 666 21.169 7.293 -12.218 532 HA3 GLY 666 HA1 GLY 666 21.256 7.089 -10.476 533 H ARG 667 HN ARG 667 19.960 8.585 -9.680 534 HA ARG 667 HA ARG 667 19.398 11.093 -10.818 535 HB2 ARG 667 HB2 ARG 667 18.188 11.561 -8.796 536 HB3 ARG 667 HB1 ARG 667 17.941 9.871 -9.208 537 HG2 ARG 667 HG2 ARG 667 19.733 9.295 -7.558 538 HG3 ARG 667 HG1 ARG 667 19.731 10.989 -7.064 539 HD2 ARG 667 HD2 ARG 667 18.344 9.778 -5.545 540 HD3 ARG 667 HD1 ARG 667 17.295 10.758 -6.569 541 HE ARG 667 HE ARG 667 17.211 8.502 -7.906 542 HH11 ARG 667 HH11 ARG 667 17.112 8.948 -4.426 543 HH12 ARG 667 HH12 ARG 667 16.133 7.556 -4.140 544 HH21 ARG 667 HH21 ARG 667 15.927 6.639 -7.532 545 HH22 ARG 667 HH22 ARG 667 15.462 6.221 -5.925 546 H TYR 668 HN TYR 668 21.958 10.048 -8.740 547 HA TYR 668 HA TYR 668 22.542 12.654 -7.709 548 HB2 TYR 668 HB2 TYR 668 24.156 10.098 -7.589 549 HB3 TYR 668 HB1 TYR 668 24.511 11.571 -6.684 550 HD1 TYR 668 HD1 TYR 668 22.703 8.484 -6.661 551 HD2 TYR 668 HD2 TYR 668 22.652 12.462 -5.134 552 HE1 TYR 668 HE1 TYR 668 21.119 7.800 -4.924 553 HE2 TYR 668 HE2 TYR 668 21.075 11.771 -3.380 554 HH TYR 668 HH TYR 668 20.303 8.458 -2.762 555 H ALA 669 HN ALA 669 23.357 10.905 -10.533 556 HA ALA 669 HA ALA 669 25.670 12.517 -11.169 557 HB1 ALA 669 HB1 ALA 669 25.544 10.235 -12.010 558 HB2 ALA 669 HB2 ALA 669 25.571 11.379 -13.352 559 HB3 ALA 669 HB3 ALA 669 24.055 10.616 -12.872 560 H GLN 670 HN GLN 670 22.267 12.618 -11.554 561 HA GLN 670 HA GLN 670 22.189 14.514 -13.704 562 HB2 GLN 670 HB2 GLN 670 20.043 13.792 -11.703 563 HB3 GLN 670 HB1 GLN 670 19.804 14.644 -13.221 564 HG2 GLN 670 HG2 GLN 670 20.399 12.693 -14.475 565 HG3 GLN 670 HG1 GLN 670 20.850 11.836 -13.001 566 HE21 GLN 670 HE21 GLN 670 19.412 10.194 -13.329 567 HE22 GLN 670 HE22 GLN 670 17.704 10.387 -13.151 568 H GLY 671 HN GLY 671 22.514 14.628 -10.280 569 HA2 GLY 671 HA2 GLY 671 23.380 16.609 -9.233 570 HA3 GLY 671 HA1 GLY 671 22.486 17.564 -10.407 571 H GLU 672 HN GLU 672 21.073 14.825 -8.759 572 HA GLU 672 HA GLU 672 19.235 16.679 -7.440 573 HB2 GLU 672 HB2 GLU 672 18.947 13.706 -7.877 574 HB3 GLU 672 HB1 GLU 672 17.725 14.784 -7.218 575 HG2 GLU 672 HG2 GLU 672 17.760 16.010 -9.387 576 HG3 GLU 672 HG1 GLU 672 18.809 14.742 -10.016 577 H ASN 673 HN ASN 673 18.840 16.582 -5.272 578 HA ASN 673 HA ASN 673 20.813 15.106 -3.684 579 HB2 ASN 673 HB2 ASN 673 20.238 16.674 -1.858 580 HB3 ASN 673 HB1 ASN 673 20.789 17.528 -3.294 581 HD21 ASN 673 HD21 ASN 673 19.350 18.796 -4.443 582 HD22 ASN 673 HD22 ASN 673 17.799 19.230 -3.819 583 H PHE 674 HN PHE 674 19.955 14.317 -1.523 584 HA PHE 674 HA PHE 674 17.144 13.592 -1.579 585 HB2 PHE 674 HB2 PHE 674 18.486 11.825 -2.853 586 HB3 PHE 674 HB1 PHE 674 19.211 11.409 -1.304 587 HD1 PHE 674 HD1 PHE 674 15.772 12.074 -2.608 588 HD2 PHE 674 HD2 PHE 674 18.314 9.554 -0.307 589 HE1 PHE 674 HE1 PHE 674 13.867 10.592 -2.140 590 HE2 PHE 674 HE2 PHE 674 16.411 8.067 0.166 591 HZ PHE 674 HZ PHE 674 14.186 8.585 -0.749 592 H VAL 675 HN VAL 675 16.325 13.008 0.432 593 HA VAL 675 HA VAL 675 18.163 13.220 2.700 594 HB VAL 675 HB VAL 675 16.379 14.525 3.930 595 HG11 VAL 675 HG11 VAL 675 17.693 15.809 1.547 596 HG12 VAL 675 HG12 VAL 675 18.385 15.602 3.158 597 HG13 VAL 675 HG13 VAL 675 17.009 16.676 2.921 598 HG21 VAL 675 HG21 VAL 675 15.300 14.940 1.139 599 HG22 VAL 675 HG22 VAL 675 14.774 15.803 2.584 600 HG23 VAL 675 HG23 VAL 675 14.495 14.068 2.444 601 H VAL 676 HN VAL 676 17.973 11.560 4.009 602 HA VAL 676 HA VAL 676 15.453 10.053 3.980 603 HB VAL 676 HB VAL 676 18.226 9.080 4.718 604 HG11 VAL 676 HG11 VAL 676 16.464 7.939 5.981 605 HG12 VAL 676 HG12 VAL 676 17.216 6.858 4.808 606 HG13 VAL 676 HG13 VAL 676 15.631 7.556 4.473 607 HG21 VAL 676 HG21 VAL 676 16.522 8.499 2.302 608 HG22 VAL 676 HG22 VAL 676 18.080 7.758 2.670 609 HG23 VAL 676 HG23 VAL 676 17.984 9.485 2.329 610 H ASN 677 HN ASN 677 14.312 9.926 5.796 611 HA ASN 677 HA ASN 677 15.478 11.028 8.234 612 HB2 ASN 677 HB2 ASN 677 13.149 11.121 9.084 613 HB3 ASN 677 HB1 ASN 677 13.347 12.019 7.586 614 HD21 ASN 677 HD21 ASN 677 10.956 10.929 8.795 615 HD22 ASN 677 HD22 ASN 677 10.268 9.831 7.649 616 H ASP 678 HN ASP 678 13.952 8.138 6.952 617 HA ASP 678 HA ASP 678 15.355 6.569 8.932 618 HB2 ASP 678 HB2 ASP 678 13.274 6.791 10.111 619 HB3 ASP 678 HB1 ASP 678 12.343 6.448 8.652 620 H ILE 679 HN ILE 679 16.075 4.713 8.137 621 HA ILE 679 HA ILE 679 16.058 4.426 5.327 622 HB ILE 679 HB ILE 679 17.498 2.468 5.685 623 HG12 ILE 679 HG12 ILE 679 17.019 2.992 8.632 624 HG13 ILE 679 HG11 ILE 679 16.402 1.610 7.736 625 HG21 ILE 679 HG21 ILE 679 18.169 4.873 7.377 626 HG22 ILE 679 HG22 ILE 679 18.463 4.695 5.647 627 HG23 ILE 679 HG23 ILE 679 19.329 3.677 6.798 628 HD11 ILE 679 HD11 ILE 679 18.347 0.989 9.028 629 HD12 ILE 679 HD12 ILE 679 19.299 2.252 8.247 630 HD13 ILE 679 HD13 ILE 679 18.707 0.885 7.306 631 H TYR 680 HN TYR 680 14.056 3.006 7.768 632 HA TYR 680 HA TYR 680 13.306 0.772 6.072 633 HB2 TYR 680 HB2 TYR 680 12.341 1.659 8.792 634 HB3 TYR 680 HB1 TYR 680 11.670 0.279 7.930 635 HD1 TYR 680 HD1 TYR 680 14.604 1.581 9.705 636 HD2 TYR 680 HD2 TYR 680 12.922 -1.772 7.712 637 HE1 TYR 680 HE1 TYR 680 16.369 0.150 10.637 638 HE2 TYR 680 HE2 TYR 680 14.681 -3.216 8.639 639 HH TYR 680 HH TYR 680 16.898 -3.054 9.539 640 H GLN 681 HN GLN 681 11.899 3.752 7.299 641 HA GLN 681 HA GLN 681 9.358 3.482 6.135 642 HB2 GLN 681 HB2 GLN 681 9.769 5.101 7.878 643 HB3 GLN 681 HB1 GLN 681 10.933 5.950 6.871 644 HG2 GLN 681 HG2 GLN 681 9.150 6.598 5.340 645 HG3 GLN 681 HG1 GLN 681 7.979 5.724 6.327 646 HE21 GLN 681 HE21 GLN 681 6.806 7.635 6.657 647 HE22 GLN 681 HE22 GLN 681 7.357 8.853 7.754 648 H VAL 682 HN VAL 682 12.393 4.677 4.821 649 HA VAL 682 HA VAL 682 11.197 5.743 2.451 650 HB VAL 682 HB VAL 682 13.383 6.547 3.326 651 HG11 VAL 682 HG11 VAL 682 14.432 3.916 2.322 652 HG12 VAL 682 HG12 VAL 682 14.341 4.440 4.002 653 HG13 VAL 682 HG13 VAL 682 15.413 5.273 2.876 654 HG21 VAL 682 HG21 VAL 682 14.511 6.747 1.149 655 HG22 VAL 682 HG22 VAL 682 12.775 7.031 1.027 656 HG23 VAL 682 HG23 VAL 682 13.456 5.492 0.500 657 H GLY 683 HN GLY 683 12.069 2.583 3.464 658 HA2 GLY 683 HA2 GLY 683 11.494 0.592 2.432 659 HA3 GLY 683 HA1 GLY 683 10.992 1.503 1.021 660 H HIS 684 HN HIS 684 14.216 1.744 2.415 661 HA HIS 684 HA HIS 684 15.470 1.200 -0.069 662 HB2 HIS 684 HB2 HIS 684 16.471 1.477 2.735 663 HB3 HIS 684 HB1 HIS 684 17.544 0.871 1.484 664 HD2 HIS 684 HD2 HIS 684 16.293 3.124 -0.777 665 HE1 HIS 684 HE1 HIS 684 18.231 5.802 1.872 666 HE2 HIS 684 HE2 HIS 684 17.549 5.365 -0.510 667 H SER 685 HN SER 685 17.025 -0.538 -0.503 668 HA SER 685 HA SER 685 15.824 -3.089 -0.192 669 HB2 SER 685 HB2 SER 685 17.875 -3.908 -1.351 670 HB3 SER 685 HB1 SER 685 17.137 -2.535 -2.176 671 HG SER 685 HG SER 685 18.716 -1.203 -1.399 672 HA PRO 686 HA PRO 686 17.442 -4.775 3.579 673 HB2 PRO 686 HB2 PRO 686 18.602 -7.125 2.525 674 HB3 PRO 686 HB1 PRO 686 16.961 -6.958 3.153 675 HG2 PRO 686 HG2 PRO 686 17.932 -6.882 0.339 676 HG3 PRO 686 HG1 PRO 686 16.401 -7.500 0.984 677 HD2 PRO 686 HD2 PRO 686 16.517 -5.179 -0.327 678 HD3 PRO 686 HD1 PRO 686 15.450 -5.382 1.077 679 H CYS 687 HN CYS 687 19.590 -5.045 0.763 680 HA CYS 687 HA CYS 687 22.027 -5.224 2.131 681 HB2 CYS 687 HB2 CYS 687 22.075 -5.731 -0.171 682 HB3 CYS 687 HB1 CYS 687 21.280 -4.222 -0.607 683 H HIS 688 HN HIS 688 20.269 -2.409 0.895 684 HA HIS 688 HA HIS 688 22.192 -0.471 1.591 685 HB2 HIS 688 HB2 HIS 688 20.013 -0.414 0.056 686 HB3 HIS 688 HB1 HIS 688 19.280 0.174 1.539 687 HD1 HIS 688 HD1 HIS 688 19.544 1.893 -1.070 688 HD2 HIS 688 HD2 HIS 688 22.153 2.034 2.175 689 HE1 HIS 688 HE1 HIS 688 20.632 4.156 -1.173 690 H ILE 689 HN ILE 689 19.534 -2.000 3.258 691 HA ILE 689 HA ILE 689 19.398 -0.308 5.506 692 HB ILE 689 HB ILE 689 18.667 -3.229 5.214 693 HG12 ILE 689 HG12 ILE 689 17.392 -1.645 3.784 694 HG13 ILE 689 HG11 ILE 689 16.385 -2.471 4.966 695 HG21 ILE 689 HG21 ILE 689 17.981 -1.339 7.457 696 HG22 ILE 689 HG22 ILE 689 19.047 -2.741 7.553 697 HG23 ILE 689 HG23 ILE 689 17.324 -2.963 7.250 698 HD11 ILE 689 HD11 ILE 689 15.759 -0.151 4.788 699 HD12 ILE 689 HD12 ILE 689 17.411 0.349 5.161 700 HD13 ILE 689 HD13 ILE 689 16.440 -0.473 6.381 701 H GLU 690 HN GLU 690 21.123 -3.324 4.894 702 HA GLU 690 HA GLU 690 22.101 -3.756 7.490 703 HB2 GLU 690 HB2 GLU 690 23.136 -4.677 4.817 704 HB3 GLU 690 HB1 GLU 690 23.822 -5.204 6.347 705 HG2 GLU 690 HG2 GLU 690 20.953 -5.591 5.524 706 HG3 GLU 690 HG1 GLU 690 22.221 -6.808 5.382 707 H ILE 691 HN ILE 691 23.608 -2.139 4.734 708 HA ILE 691 HA ILE 691 26.062 -1.680 6.087 709 HB ILE 691 HB ILE 691 25.006 -0.171 3.686 710 HG12 ILE 691 HG12 ILE 691 26.667 -2.705 3.795 711 HG13 ILE 691 HG11 ILE 691 24.971 -2.624 3.332 712 HG21 ILE 691 HG21 ILE 691 27.819 -0.666 4.671 713 HG22 ILE 691 HG22 ILE 691 26.937 0.854 4.798 714 HG23 ILE 691 HG23 ILE 691 27.373 0.219 3.212 715 HD11 ILE 691 HD11 ILE 691 25.562 -1.260 1.400 716 HD12 ILE 691 HD12 ILE 691 26.425 -2.798 1.391 717 HD13 ILE 691 HD13 ILE 691 27.259 -1.321 1.873 718 H LEU 692 HN LEU 692 23.145 0.240 5.666 719 HA LEU 692 HA LEU 692 24.281 2.613 6.803 720 HB2 LEU 692 HB2 LEU 692 21.410 1.829 6.345 721 HB3 LEU 692 HB1 LEU 692 21.900 3.389 6.981 722 HG LEU 692 HG LEU 692 22.600 2.292 4.256 723 HD11 LEU 692 HD11 LEU 692 20.754 4.512 5.092 724 HD12 LEU 692 HD12 LEU 692 20.275 2.949 4.428 725 HD13 LEU 692 HD13 LEU 692 21.172 4.095 3.432 726 HD21 LEU 692 HD21 LEU 692 23.513 4.549 3.841 727 HD22 LEU 692 HD22 LEU 692 24.408 3.671 5.078 728 HD23 LEU 692 HD23 LEU 692 23.272 4.937 5.545 729 H GLU 693 HN GLU 693 22.390 -0.064 8.075 730 HA GLU 693 HA GLU 693 21.993 0.911 10.682 731 HB2 GLU 693 HB2 GLU 693 20.886 -1.098 9.685 732 HB3 GLU 693 HB1 GLU 693 22.413 -1.955 9.799 733 HG2 GLU 693 HG2 GLU 693 21.010 -2.624 11.612 734 HG3 GLU 693 HG1 GLU 693 22.341 -1.665 12.255 735 H GLN 694 HN GLN 694 24.723 -0.498 9.072 736 HA GLN 694 HA GLN 694 26.284 -1.171 11.329 737 HB2 GLN 694 HB2 GLN 694 26.708 -2.052 9.065 738 HB3 GLN 694 HB1 GLN 694 27.172 -0.445 8.530 739 HG2 GLN 694 HG2 GLN 694 29.164 -1.669 8.899 740 HG3 GLN 694 HG1 GLN 694 29.017 -0.505 10.214 741 HE21 GLN 694 HE21 GLN 694 30.526 -2.966 10.106 742 HE22 GLN 694 HE22 GLN 694 29.945 -3.962 11.395 743 H PHE 695 HN PHE 695 25.666 1.837 9.687 744 HA PHE 695 HA PHE 695 27.921 3.140 10.989 745 HB2 PHE 695 HB2 PHE 695 25.868 4.212 9.048 746 HB3 PHE 695 HB1 PHE 695 27.166 5.172 9.744 747 HD1 PHE 695 HD1 PHE 695 26.216 3.527 6.904 748 HD2 PHE 695 HD2 PHE 695 29.574 3.860 9.500 749 HE1 PHE 695 HE1 PHE 695 27.700 2.818 5.075 750 HE2 PHE 695 HE2 PHE 695 31.062 3.149 7.664 751 HZ PHE 695 HZ PHE 695 30.120 2.628 5.457 752 H GLU 696 HN GLU 696 24.957 2.260 11.966 753 HA GLU 696 HA GLU 696 23.557 2.835 13.663 754 HB2 GLU 696 HB2 GLU 696 25.842 2.844 14.811 755 HB3 GLU 696 HB1 GLU 696 25.785 4.593 14.693 756 HG2 GLU 696 HG2 GLU 696 23.689 4.576 16.004 757 HG3 GLU 696 HG1 GLU 696 23.858 2.831 16.191 758 H VAL 697 HN VAL 697 22.849 4.175 11.521 759 HA VAL 697 HA VAL 697 21.964 6.703 12.602 760 HB VAL 697 HB VAL 697 24.082 7.284 11.495 761 HG11 VAL 697 HG11 VAL 697 22.806 6.245 8.968 762 HG12 VAL 697 HG12 VAL 697 24.156 5.508 9.829 763 HG13 VAL 697 HG13 VAL 697 24.350 7.090 9.077 764 HG21 VAL 697 HG21 VAL 697 21.620 8.285 10.075 765 HG22 VAL 697 HG22 VAL 697 23.202 9.054 10.001 766 HG23 VAL 697 HG23 VAL 697 22.341 8.953 11.538 767 H LYS 698 HN LYS 698 20.039 7.456 11.507 768 HA LYS 698 HA LYS 698 18.933 5.647 9.451 769 HB2 LYS 698 HB2 LYS 698 17.575 7.040 11.744 770 HB3 LYS 698 HB1 LYS 698 16.688 6.431 10.362 771 HG2 LYS 698 HG2 LYS 698 17.360 4.184 10.874 772 HG3 LYS 698 HG1 LYS 698 18.379 4.764 12.199 773 HD2 LYS 698 HD2 LYS 698 16.494 5.540 13.419 774 HD3 LYS 698 HD1 LYS 698 15.421 5.293 12.042 775 HE2 LYS 698 HE2 LYS 698 16.874 3.116 13.529 776 HE3 LYS 698 HE1 LYS 698 15.183 3.557 13.769 777 HZ1 LYS 698 HZ1 LYS 698 16.430 2.415 11.348 778 HZ2 LYS 698 HZ2 LYS 698 14.880 3.098 11.347 779 HZ3 LYS 698 HZ3 LYS 698 15.210 1.736 12.308 780 H ALA 699 HN ALA 699 19.233 8.911 10.692 781 HA ALA 699 HA ALA 699 17.954 9.962 8.291 782 HB1 ALA 699 HB1 ALA 699 18.724 11.366 10.848 783 HB2 ALA 699 HB2 ALA 699 17.111 10.788 10.428 784 HB3 ALA 699 HB3 ALA 699 17.855 12.084 9.491 785 H TYR 700 HN TYR 700 19.076 10.907 6.747 786 HA TYR 700 HA TYR 700 21.588 12.148 7.247 787 HB2 TYR 700 HB2 TYR 700 22.972 10.770 5.784 788 HB3 TYR 700 HB1 TYR 700 22.330 9.798 7.097 789 HD1 TYR 700 HD1 TYR 700 22.269 10.409 3.493 790 HD2 TYR 700 HD2 TYR 700 20.731 8.020 6.657 791 HE1 TYR 700 HE1 TYR 700 21.467 8.768 1.851 792 HE2 TYR 700 HE2 TYR 700 19.923 6.373 5.022 793 HH TYR 700 HH TYR 700 20.870 6.436 1.738 794 H VAL 701 HN VAL 701 22.392 13.269 5.426 795 HA VAL 701 HA VAL 701 20.379 13.700 3.331 796 HB VAL 701 HB VAL 701 20.203 15.594 4.807 797 HG11 VAL 701 HG11 VAL 701 23.196 15.855 4.585 798 HG12 VAL 701 HG12 VAL 701 22.285 15.373 6.017 799 HG13 VAL 701 HG13 VAL 701 22.130 17.011 5.382 800 HG21 VAL 701 HG21 VAL 701 20.162 16.112 2.401 801 HG22 VAL 701 HG22 VAL 701 21.900 16.401 2.440 802 HG23 VAL 701 HG23 VAL 701 20.812 17.450 3.346 803 H ILE 702 HN ILE 702 21.128 13.792 1.284 804 HA ILE 702 HA ILE 702 24.050 13.721 0.917 805 HB ILE 702 HB ILE 702 21.938 12.184 -0.611 806 HG12 ILE 702 HG12 ILE 702 24.273 11.248 1.071 807 HG13 ILE 702 HG11 ILE 702 22.575 11.176 1.531 808 HG21 ILE 702 HG21 ILE 702 23.598 13.017 -2.169 809 HG22 ILE 702 HG22 ILE 702 23.792 11.277 -1.952 810 HG23 ILE 702 HG23 ILE 702 24.897 12.394 -1.152 811 HD11 ILE 702 HD11 ILE 702 22.143 9.609 -0.281 812 HD12 ILE 702 HD12 ILE 702 23.407 9.009 0.793 813 HD13 ILE 702 HD13 ILE 702 23.834 9.702 -0.771 814 H VAL 703 HN VAL 703 24.703 15.509 -0.055 815 HA VAL 703 HA VAL 703 23.012 16.619 -2.193 816 HB VAL 703 HB VAL 703 24.102 18.808 -1.813 817 HG11 VAL 703 HG11 VAL 703 22.806 17.649 0.650 818 HG12 VAL 703 HG12 VAL 703 21.974 18.350 -0.738 819 HG13 VAL 703 HG13 VAL 703 22.980 19.367 0.294 820 HG21 VAL 703 HG21 VAL 703 25.464 19.210 0.157 821 HG22 VAL 703 HG22 VAL 703 26.208 17.966 -0.849 822 HG23 VAL 703 HG23 VAL 703 25.338 17.513 0.618 823 HA PRO 704 HA PRO 704 26.379 15.617 -4.862 824 HB2 PRO 704 HB2 PRO 704 25.651 16.969 -7.066 825 HB3 PRO 704 HB1 PRO 704 24.746 15.562 -6.494 826 HG2 PRO 704 HG2 PRO 704 24.120 18.468 -6.191 827 HG3 PRO 704 HG1 PRO 704 23.026 17.116 -6.532 828 HD2 PRO 704 HD2 PRO 704 23.377 18.257 -4.042 829 HD3 PRO 704 HD1 PRO 704 22.788 16.606 -4.318 830 H VAL 705 HN VAL 705 28.389 16.338 -5.095 831 HA VAL 705 HA VAL 705 28.896 19.234 -5.016 832 HB VAL 705 HB VAL 705 30.740 16.960 -4.224 833 HG11 VAL 705 HG11 VAL 705 32.234 18.721 -3.393 834 HG12 VAL 705 HG12 VAL 705 31.141 19.945 -4.038 835 HG13 VAL 705 HG13 VAL 705 31.978 18.847 -5.134 836 HG21 VAL 705 HG21 VAL 705 30.475 17.797 -1.934 837 HG22 VAL 705 HG22 VAL 705 28.935 17.271 -2.614 838 HG23 VAL 705 HG23 VAL 705 29.310 18.991 -2.508 839 H PHE 706 HN PHE 706 29.434 20.032 -6.929 840 HA PHE 706 HA PHE 706 30.591 18.247 -8.933 841 HB2 PHE 706 HB2 PHE 706 29.188 20.906 -9.186 842 HB3 PHE 706 HB1 PHE 706 30.017 20.126 -10.529 843 HD1 PHE 706 HD1 PHE 706 27.125 19.988 -8.285 844 HD2 PHE 706 HD2 PHE 706 29.106 18.159 -11.581 845 HE1 PHE 706 HE1 PHE 706 25.098 18.686 -8.778 846 HE2 PHE 706 HE2 PHE 706 27.081 16.856 -12.080 847 HZ PHE 706 HZ PHE 706 25.073 17.118 -10.679 848 H ALA 707 HN ALA 707 32.652 18.336 -9.357 849 HA ALA 707 HA ALA 707 34.071 20.866 -9.209 850 HB1 ALA 707 HB1 ALA 707 35.095 18.377 -7.830 851 HB2 ALA 707 HB2 ALA 707 34.430 19.786 -7.011 852 HB3 ALA 707 HB3 ALA 707 35.921 19.929 -7.937 853 H GLY 708 HN GLY 708 34.869 21.089 -11.127 854 HA2 GLY 708 HA2 GLY 708 36.588 20.355 -12.691 855 HA3 GLY 708 HA1 GLY 708 35.954 18.723 -12.499 856 H GLU 709 HN GLU 709 35.225 18.251 -14.478 857 HA GLU 709 HA GLU 709 33.367 20.157 -15.722 858 HB2 GLU 709 HB2 GLU 709 35.081 17.979 -16.924 859 HB3 GLU 709 HB1 GLU 709 33.789 18.761 -17.813 860 HG2 GLU 709 HG2 GLU 709 35.875 19.761 -18.430 861 HG3 GLU 709 HG1 GLU 709 34.943 20.933 -17.504 862 H GLN 710 HN GLN 710 33.126 17.789 -13.666 863 HA GLN 710 HA GLN 710 30.547 16.905 -14.550 864 HB2 GLN 710 HB2 GLN 710 32.296 15.445 -15.775 865 HB3 GLN 710 HB1 GLN 710 32.659 14.765 -14.202 866 HG2 GLN 710 HG2 GLN 710 31.146 13.371 -15.567 867 HG3 GLN 710 HG1 GLN 710 30.446 13.839 -14.024 868 HE21 GLN 710 HE21 GLN 710 28.364 13.454 -14.823 869 HE22 GLN 710 HE22 GLN 710 27.595 14.547 -15.922 870 H LEU 711 HN LEU 711 30.036 14.881 -12.866 871 HA LEU 711 HA LEU 711 29.945 16.028 -10.315 872 HB2 LEU 711 HB2 LEU 711 28.344 14.345 -11.128 873 HB3 LEU 711 HB1 LEU 711 29.612 13.136 -11.127 874 HG LEU 711 HG LEU 711 29.790 13.372 -8.660 875 HD11 LEU 711 HD11 LEU 711 27.996 14.524 -7.452 876 HD12 LEU 711 HD12 LEU 711 27.367 15.137 -8.981 877 HD13 LEU 711 HD13 LEU 711 28.961 15.639 -8.418 878 HD21 LEU 711 HD21 LEU 711 27.717 12.180 -8.151 879 HD22 LEU 711 HD22 LEU 711 28.430 11.605 -9.657 880 HD23 LEU 711 HD23 LEU 711 27.041 12.690 -9.696 881 H TRP 712 HN TRP 712 31.230 15.848 -8.560 882 HA TRP 712 HA TRP 712 33.783 14.448 -8.925 883 HB2 TRP 712 HB2 TRP 712 33.924 16.854 -8.524 884 HB3 TRP 712 HB1 TRP 712 32.994 16.677 -7.042 885 HD1 TRP 712 HD1 TRP 712 36.447 15.772 -8.502 886 HE1 TRP 712 HE1 TRP 712 38.103 15.524 -6.554 887 HE3 TRP 712 HE3 TRP 712 33.180 16.279 -4.605 888 HZ2 TRP 712 HZ2 TRP 712 38.032 15.535 -3.736 889 HZ3 TRP 712 HZ3 TRP 712 34.053 16.151 -2.311 890 HH2 TRP 712 HH2 TRP 712 36.426 15.789 -1.878 891 H GLY 713 HN GLY 713 31.230 15.070 -6.560 892 HA2 GLY 713 HA2 GLY 713 31.116 12.440 -5.636 893 HA3 GLY 713 HA1 GLY 713 32.168 13.360 -4.568 894 H LEU 714 HN LEU 714 30.213 12.520 -3.253 895 HA LEU 714 HA LEU 714 28.305 14.749 -3.188 896 HB2 LEU 714 HB2 LEU 714 26.654 13.216 -2.179 897 HB3 LEU 714 HB1 LEU 714 27.113 12.763 -3.805 898 HG LEU 714 HG LEU 714 28.757 11.134 -2.578 899 HD11 LEU 714 HD11 LEU 714 26.643 11.541 -0.471 900 HD12 LEU 714 HD12 LEU 714 28.347 11.973 -0.330 901 HD13 LEU 714 HD13 LEU 714 27.877 10.280 -0.476 902 HD21 LEU 714 HD21 LEU 714 25.786 10.653 -2.731 903 HD22 LEU 714 HD22 LEU 714 27.025 9.403 -2.613 904 HD23 LEU 714 HD23 LEU 714 26.948 10.436 -4.039 905 H LEU 715 HN LEU 715 27.256 14.892 -0.961 906 HA LEU 715 HA LEU 715 29.307 14.655 1.129 907 HB2 LEU 715 HB2 LEU 715 29.278 16.968 0.233 908 HB3 LEU 715 HB1 LEU 715 27.574 17.079 0.620 909 HG LEU 715 HG LEU 715 28.137 16.827 3.026 910 HD11 LEU 715 HD11 LEU 715 30.236 15.624 2.804 911 HD12 LEU 715 HD12 LEU 715 30.464 17.109 3.728 912 HD13 LEU 715 HD13 LEU 715 30.978 17.032 2.042 913 HD21 LEU 715 HD21 LEU 715 29.060 19.077 3.297 914 HD22 LEU 715 HD22 LEU 715 27.815 19.035 2.048 915 HD23 LEU 715 HD23 LEU 715 29.519 19.093 1.594 916 H ALA 716 HN ALA 716 28.520 13.689 2.903 917 HA ALA 716 HA ALA 716 25.610 13.733 3.309 918 HB1 ALA 716 HB1 ALA 716 26.255 11.604 2.276 919 HB2 ALA 716 HB2 ALA 716 25.635 11.385 3.913 920 HB3 ALA 716 HB3 ALA 716 27.370 11.306 3.610 921 H ALA 717 HN ALA 717 24.911 13.388 5.438 922 HA ALA 717 HA ALA 717 26.933 13.685 7.534 923 HB1 ALA 717 HB1 ALA 717 25.612 15.394 8.651 924 HB2 ALA 717 HB2 ALA 717 24.417 15.347 7.351 925 HB3 ALA 717 HB3 ALA 717 26.054 15.924 7.028 926 H TYR 718 HN TYR 718 26.509 12.575 9.363 927 HA TYR 718 HA TYR 718 23.970 11.058 9.488 928 HB2 TYR 718 HB2 TYR 718 26.657 10.007 10.391 929 HB3 TYR 718 HB1 TYR 718 25.166 9.102 10.183 930 HD1 TYR 718 HD1 TYR 718 28.200 10.226 8.644 931 HD2 TYR 718 HD2 TYR 718 24.291 8.771 7.806 932 HE1 TYR 718 HE1 TYR 718 28.916 9.637 6.370 933 HE2 TYR 718 HE2 TYR 718 24.999 8.175 5.527 934 HH TYR 718 HH TYR 718 28.277 8.149 4.574 935 H GLN 719 HN GLN 719 23.020 10.895 11.555 936 HA GLN 719 HA GLN 719 24.633 11.680 13.831 937 HB2 GLN 719 HB2 GLN 719 23.092 13.400 14.618 938 HB3 GLN 719 HB1 GLN 719 23.792 13.817 13.064 939 HG2 GLN 719 HG2 GLN 719 21.723 13.167 11.949 940 HG3 GLN 719 HG1 GLN 719 21.025 12.717 13.506 941 HE21 GLN 719 HE21 GLN 719 20.572 14.343 15.013 942 HE22 GLN 719 HE22 GLN 719 20.365 15.989 14.529 943 H ASN 720 HN ASN 720 24.436 9.884 14.924 944 HA ASN 720 HA ASN 720 23.476 8.050 15.994 945 HB2 ASN 720 HB2 ASN 720 22.439 10.535 17.350 946 HB3 ASN 720 HB1 ASN 720 22.211 8.934 18.037 947 HD21 ASN 720 HD21 ASN 720 24.570 11.379 17.144 948 HD22 ASN 720 HD22 ASN 720 25.827 10.768 18.155 949 H SER 721 HN SER 721 22.175 7.349 14.144 950 HA SER 721 HA SER 721 20.243 6.491 13.298 951 HB2 SER 721 HB2 SER 721 20.134 5.539 15.633 952 HB3 SER 721 HB1 SER 721 19.131 6.909 16.091 953 HG SER 721 HG SER 721 18.536 4.671 14.590 954 H GLY 722 HN GLY 722 18.118 8.169 15.433 955 HA2 GLY 722 HA2 GLY 722 16.782 10.006 15.209 956 HA3 GLY 722 HA1 GLY 722 17.970 10.649 14.094 957 H THR 723 HN THR 723 15.113 10.846 13.967 958 HA THR 723 HA THR 723 14.832 9.871 11.234 959 HB THR 723 HB THR 723 12.613 9.632 13.292 960 HG1 THR 723 HG1 THR 723 14.621 7.889 12.438 961 HG21 THR 723 HG21 THR 723 11.703 9.906 11.085 962 HG22 THR 723 HG22 THR 723 11.571 8.197 11.502 963 HG23 THR 723 HG23 THR 723 12.847 8.750 10.414 964 H ARG 724 HN ARG 724 15.546 12.347 12.473 965 HA ARG 724 HA ARG 724 13.443 14.219 12.534 966 HB2 ARG 724 HB2 ARG 724 15.178 15.930 12.441 967 HB3 ARG 724 HB1 ARG 724 15.639 14.658 13.559 968 HG2 ARG 724 HG2 ARG 724 17.149 13.717 11.901 969 HG3 ARG 724 HG1 ARG 724 16.647 14.936 10.730 970 HD2 ARG 724 HD2 ARG 724 17.973 15.527 13.376 971 HD3 ARG 724 HD1 ARG 724 18.818 15.441 11.832 972 HE ARG 724 HE ARG 724 16.608 17.341 12.062 973 HH11 ARG 724 HH11 ARG 724 20.103 16.826 12.015 974 HH12 ARG 724 HH12 ARG 724 20.471 18.483 11.697 975 HH21 ARG 724 HH21 ARG 724 17.116 19.548 11.639 976 HH22 ARG 724 HH22 ARG 724 18.768 20.042 11.485 977 H ASP 725 HN ASP 725 12.619 15.567 11.008 978 HA ASP 725 HA ASP 725 13.078 14.828 8.248 979 HB2 ASP 725 HB2 ASP 725 10.780 15.198 9.018 980 HB3 ASP 725 HB1 ASP 725 11.182 16.856 9.460 981 H TRP 726 HN TRP 726 14.249 15.965 6.848 982 HA TRP 726 HA TRP 726 15.907 18.042 7.908 983 HB2 TRP 726 HB2 TRP 726 15.858 16.779 5.164 984 HB3 TRP 726 HB1 TRP 726 17.103 17.865 5.772 985 HD1 TRP 726 HD1 TRP 726 15.916 14.257 5.974 986 HE1 TRP 726 HE1 TRP 726 17.681 12.853 7.200 987 HE3 TRP 726 HE3 TRP 726 18.956 18.035 7.602 988 HZ2 TRP 726 HZ2 TRP 726 20.057 13.290 8.672 989 HZ3 TRP 726 HZ3 TRP 726 20.954 17.454 8.915 990 HH2 TRP 726 HH2 TRP 726 21.491 15.131 9.438 991 H ASP 727 HN ASP 727 15.462 20.082 7.800 992 HA ASP 727 HA ASP 727 13.245 21.218 6.538 993 HB2 ASP 727 HB2 ASP 727 15.837 22.470 7.410 994 HB3 ASP 727 HB1 ASP 727 14.401 23.386 6.963 995 H GLU 728 HN GLU 728 12.916 21.946 4.516 996 HA GLU 728 HA GLU 728 14.608 21.190 2.432 997 HB2 GLU 728 HB2 GLU 728 12.443 23.298 2.384 998 HB3 GLU 728 HB1 GLU 728 13.142 22.509 0.976 999 HG2 GLU 728 HG2 GLU 728 12.298 20.344 1.801 1000 HG3 GLU 728 HG1 GLU 728 11.543 21.181 3.155 1001 H SER 729 HN SER 729 14.162 24.404 3.952 1002 HA SER 729 HA SER 729 15.985 25.767 2.334 1003 HB2 SER 729 HB2 SER 729 15.223 26.327 5.204 1004 HB3 SER 729 HB1 SER 729 15.925 27.478 4.067 1005 HG SER 729 HG SER 729 13.880 27.890 3.724 1006 H GLU 730 HN GLU 730 16.510 23.527 4.900 1007 HA GLU 730 HA GLU 730 19.167 24.472 5.581 1008 HB2 GLU 730 HB2 GLU 730 17.579 23.239 7.156 1009 HB3 GLU 730 HB1 GLU 730 17.952 21.782 6.244 1010 HG2 GLU 730 HG2 GLU 730 19.361 21.680 8.085 1011 HG3 GLU 730 HG1 GLU 730 20.398 22.308 6.803 1012 H VAL 731 HN VAL 731 17.662 21.840 3.792 1013 HA VAL 731 HA VAL 731 20.018 20.535 2.950 1014 HB VAL 731 HB VAL 731 17.345 20.613 1.528 1015 HG11 VAL 731 HG11 VAL 731 19.567 18.573 1.444 1016 HG12 VAL 731 HG12 VAL 731 19.132 19.693 0.154 1017 HG13 VAL 731 HG13 VAL 731 18.005 18.425 0.639 1018 HG21 VAL 731 HG21 VAL 731 18.304 18.681 3.635 1019 HG22 VAL 731 HG22 VAL 731 16.752 18.636 2.792 1020 HG23 VAL 731 HG23 VAL 731 17.122 19.965 3.889 1021 H THR 732 HN THR 732 18.238 23.291 1.716 1022 HA THR 732 HA THR 732 19.501 23.340 -0.839 1023 HB THR 732 HB THR 732 18.104 25.614 0.606 1024 HG1 THR 732 HG1 THR 732 16.739 23.761 0.430 1025 HG21 THR 732 HG21 THR 732 19.391 26.296 -1.378 1026 HG22 THR 732 HG22 THR 732 17.658 26.436 -1.673 1027 HG23 THR 732 HG23 THR 732 18.558 25.074 -2.340 1028 H LEU 733 HN LEU 733 20.143 24.666 2.335 1029 HA LEU 733 HA LEU 733 22.154 26.517 1.548 1030 HB2 LEU 733 HB2 LEU 733 20.879 26.637 3.687 1031 HB3 LEU 733 HB1 LEU 733 21.667 25.173 4.221 1032 HG LEU 733 HG LEU 733 23.325 27.586 3.551 1033 HD11 LEU 733 HD11 LEU 733 21.584 28.407 5.043 1034 HD12 LEU 733 HD12 LEU 733 23.131 28.313 5.885 1035 HD13 LEU 733 HD13 LEU 733 21.899 27.081 6.161 1036 HD21 LEU 733 HD21 LEU 733 24.806 26.634 5.249 1037 HD22 LEU 733 HD22 LEU 733 24.448 25.444 3.999 1038 HD23 LEU 733 HD23 LEU 733 23.639 25.350 5.562 1039 H LEU 734 HN LEU 734 22.128 23.206 2.749 1040 HA LEU 734 HA LEU 734 24.912 22.814 2.822 1041 HB2 LEU 734 HB2 LEU 734 23.273 21.371 3.958 1042 HB3 LEU 734 HB1 LEU 734 22.707 20.797 2.404 1043 HG LEU 734 HG LEU 734 24.924 19.792 1.988 1044 HD11 LEU 734 HD11 LEU 734 26.317 21.234 3.320 1045 HD12 LEU 734 HD12 LEU 734 26.486 19.568 3.881 1046 HD13 LEU 734 HD13 LEU 734 25.502 20.711 4.793 1047 HD21 LEU 734 HD21 LEU 734 23.611 18.957 4.564 1048 HD22 LEU 734 HD22 LEU 734 24.693 17.963 3.588 1049 HD23 LEU 734 HD23 LEU 734 23.128 18.462 2.943 1050 H ALA 735 HN ALA 735 22.530 22.461 0.255 1051 HA ALA 735 HA ALA 735 24.278 21.175 -1.601 1052 HB1 ALA 735 HB1 ALA 735 21.829 21.029 -1.782 1053 HB2 ALA 735 HB2 ALA 735 22.555 21.659 -3.259 1054 HB3 ALA 735 HB3 ALA 735 21.757 22.756 -2.131 1055 H ARG 736 HN ARG 736 23.442 24.461 -0.829 1056 HA ARG 736 HA ARG 736 24.641 25.794 -2.999 1057 HB2 ARG 736 HB2 ARG 736 23.116 26.833 -1.288 1058 HB3 ARG 736 HB1 ARG 736 24.448 26.783 -0.144 1059 HG2 ARG 736 HG2 ARG 736 24.381 28.982 -0.987 1060 HG3 ARG 736 HG1 ARG 736 25.749 28.198 -1.780 1061 HD2 ARG 736 HD2 ARG 736 24.481 29.482 -3.397 1062 HD3 ARG 736 HD1 ARG 736 24.327 27.760 -3.743 1063 HE ARG 736 HE ARG 736 22.244 29.083 -2.166 1064 HH11 ARG 736 HH11 ARG 736 23.224 27.551 -5.165 1065 HH12 ARG 736 HH12 ARG 736 21.614 27.365 -5.753 1066 HH21 ARG 736 HH21 ARG 736 20.099 28.823 -2.935 1067 HH22 ARG 736 HH22 ARG 736 19.823 28.082 -4.473 1068 H ILE 737 HN ILE 737 25.879 24.925 0.202 1069 HA ILE 737 HA ILE 737 28.483 25.936 -0.162 1070 HB ILE 737 HB ILE 737 27.548 23.707 1.667 1071 HG12 ILE 737 HG12 ILE 737 27.939 26.666 2.180 1072 HG13 ILE 737 HG11 ILE 737 26.390 25.840 2.058 1073 HG21 ILE 737 HG21 ILE 737 30.088 25.340 1.755 1074 HG22 ILE 737 HG22 ILE 737 29.966 23.630 1.344 1075 HG23 ILE 737 HG23 ILE 737 29.572 24.174 2.974 1076 HD11 ILE 737 HD11 ILE 737 26.927 24.542 4.055 1077 HD12 ILE 737 HD12 ILE 737 26.987 26.275 4.371 1078 HD13 ILE 737 HD13 ILE 737 28.483 25.364 4.169 1079 H GLY 738 HN GLY 738 26.981 22.871 -1.017 1080 HA2 GLY 738 HA2 GLY 738 29.358 21.407 -1.483 1081 HA3 GLY 738 HA1 GLY 738 27.769 21.043 -2.144 1082 H ASN 739 HN ASN 739 27.368 23.476 -3.538 1083 HA ASN 739 HA ASN 739 28.757 22.908 -5.954 1084 HB2 ASN 739 HB2 ASN 739 26.493 23.914 -5.920 1085 HB3 ASN 739 HB1 ASN 739 27.168 25.381 -5.218 1086 HD21 ASN 739 HD21 ASN 739 26.769 23.505 -8.084 1087 HD22 ASN 739 HD22 ASN 739 27.419 24.659 -9.193 1088 H GLN 740 HN GLN 740 29.025 25.467 -3.532 1089 HA GLN 740 HA GLN 740 31.087 26.908 -4.840 1090 HB2 GLN 740 HB2 GLN 740 29.622 27.914 -3.148 1091 HB3 GLN 740 HB1 GLN 740 30.310 26.862 -1.920 1092 HG2 GLN 740 HG2 GLN 740 32.497 27.917 -2.261 1093 HG3 GLN 740 HG1 GLN 740 31.777 28.992 -3.462 1094 HE21 GLN 740 HE21 GLN 740 31.987 28.188 -0.097 1095 HE22 GLN 740 HE22 GLN 740 31.267 29.639 0.501 1096 H LEU 741 HN LEU 741 31.053 24.237 -2.586 1097 HA LEU 741 HA LEU 741 33.744 24.274 -1.793 1098 HB2 LEU 741 HB2 LEU 741 31.929 22.908 -0.767 1099 HB3 LEU 741 HB1 LEU 741 31.952 21.874 -2.179 1100 HG LEU 741 HG LEU 741 34.293 21.246 -1.639 1101 HD11 LEU 741 HD11 LEU 741 35.177 21.786 0.580 1102 HD12 LEU 741 HD12 LEU 741 33.794 22.840 0.874 1103 HD13 LEU 741 HD13 LEU 741 34.948 23.234 -0.400 1104 HD21 LEU 741 HD21 LEU 741 32.422 19.851 -0.926 1105 HD22 LEU 741 HD22 LEU 741 32.284 20.785 0.564 1106 HD23 LEU 741 HD23 LEU 741 33.727 19.816 0.261 1107 H GLY 742 HN GLY 742 32.132 23.024 -4.640 1108 HA2 GLY 742 HA2 GLY 742 34.304 21.541 -5.674 1109 HA3 GLY 742 HA1 GLY 742 32.925 22.134 -6.591 1110 H LEU 743 HN LEU 743 33.582 24.942 -5.660 1111 HA LEU 743 HA LEU 743 35.151 25.680 -7.898 1112 HB2 LEU 743 HB2 LEU 743 33.364 27.063 -6.705 1113 HB3 LEU 743 HB1 LEU 743 34.560 27.384 -5.472 1114 HG LEU 743 HG LEU 743 34.995 28.142 -8.366 1115 HD11 LEU 743 HD11 LEU 743 32.952 29.212 -7.589 1116 HD12 LEU 743 HD12 LEU 743 34.252 30.390 -7.768 1117 HD13 LEU 743 HD13 LEU 743 33.796 29.815 -6.164 1118 HD21 LEU 743 HD21 LEU 743 36.592 29.733 -7.416 1119 HD22 LEU 743 HD22 LEU 743 36.994 28.083 -6.939 1120 HD23 LEU 743 HD23 LEU 743 36.206 29.165 -5.791 1121 H ALA 744 HN ALA 744 35.809 25.388 -4.429 1122 HA ALA 744 HA ALA 744 38.451 26.367 -4.466 1123 HB1 ALA 744 HB1 ALA 744 37.172 26.066 -2.393 1124 HB2 ALA 744 HB2 ALA 744 38.722 25.224 -2.320 1125 HB3 ALA 744 HB3 ALA 744 37.238 24.317 -2.608 1126 H LEU 745 HN LEU 745 37.102 23.165 -4.959 1127 HA LEU 745 HA LEU 745 39.532 21.744 -5.161 1128 HB2 LEU 745 HB2 LEU 745 36.775 21.224 -6.249 1129 HB3 LEU 745 HB1 LEU 745 38.099 20.091 -6.439 1130 HG LEU 745 HG LEU 745 37.133 21.029 -3.744 1131 HD11 LEU 745 HD11 LEU 745 36.377 18.535 -5.260 1132 HD12 LEU 745 HD12 LEU 745 35.309 19.898 -4.924 1133 HD13 LEU 745 HD13 LEU 745 35.929 18.916 -3.598 1134 HD21 LEU 745 HD21 LEU 745 38.784 18.683 -4.638 1135 HD22 LEU 745 HD22 LEU 745 38.318 19.045 -2.974 1136 HD23 LEU 745 HD23 LEU 745 39.401 20.134 -3.848 1137 H GLN 746 HN GLN 746 37.479 23.340 -7.542 1138 HA GLN 746 HA GLN 746 38.968 22.575 -9.822 1139 HB2 GLN 746 HB2 GLN 746 36.976 24.717 -9.220 1140 HB3 GLN 746 HB1 GLN 746 37.844 24.737 -10.748 1141 HG2 GLN 746 HG2 GLN 746 36.955 22.566 -11.314 1142 HG3 GLN 746 HG1 GLN 746 36.164 22.457 -9.741 1143 HE21 GLN 746 HE21 GLN 746 35.113 22.494 -12.546 1144 HE22 GLN 746 HE22 GLN 746 33.932 23.750 -12.544 1145 H GLN 747 HN GLN 747 38.941 25.484 -7.818 1146 HA GLN 747 HA GLN 747 40.759 27.016 -9.221 1147 HB2 GLN 747 HB2 GLN 747 39.366 27.850 -7.380 1148 HB3 GLN 747 HB1 GLN 747 40.334 26.933 -6.235 1149 HG2 GLN 747 HG2 GLN 747 42.299 28.264 -6.855 1150 HG3 GLN 747 HG1 GLN 747 41.295 29.195 -7.966 1151 HE21 GLN 747 HE21 GLN 747 41.681 31.103 -6.911 1152 HE22 GLN 747 HE22 GLN 747 40.994 31.472 -5.366 1153 H THR 748 HN THR 748 41.453 24.915 -6.420 1154 HA THR 748 HA THR 748 44.217 25.372 -6.448 1155 HB THR 748 HB THR 748 44.309 23.171 -5.135 1156 HG1 THR 748 HG1 THR 748 41.511 23.435 -4.911 1157 HG21 THR 748 HG21 THR 748 43.306 24.205 -3.155 1158 HG22 THR 748 HG22 THR 748 42.454 25.359 -4.178 1159 HG23 THR 748 HG23 THR 748 44.214 25.399 -4.083 1160 H GLU 749 HN GLU 749 42.308 22.736 -7.874 1161 HA GLU 749 HA GLU 749 44.442 21.259 -8.940 1162 HB2 GLU 749 HB2 GLU 749 42.217 20.323 -8.780 1163 HB3 GLU 749 HB1 GLU 749 41.578 21.549 -9.860 1164 HG2 GLU 749 HG2 GLU 749 41.807 19.408 -10.982 1165 HG3 GLU 749 HG1 GLU 749 42.864 20.619 -11.702 1166 H TYR 750 HN TYR 750 42.440 23.798 -10.390 1167 HA TYR 750 HA TYR 750 43.613 23.807 -12.936 1168 HB2 TYR 750 HB2 TYR 750 41.452 24.897 -12.282 1169 HB3 TYR 750 HB1 TYR 750 42.385 26.157 -11.486 1170 HD1 TYR 750 HD1 TYR 750 41.565 24.644 -14.749 1171 HD2 TYR 750 HD2 TYR 750 43.345 27.941 -12.739 1172 HE1 TYR 750 HE1 TYR 750 41.640 25.885 -16.865 1173 HE2 TYR 750 HE2 TYR 750 43.425 29.190 -14.853 1174 HH TYR 750 HH TYR 750 43.449 28.731 -17.256 1175 H LEU 751 HN LEU 751 44.449 25.511 -9.966 1176 HA LEU 751 HA LEU 751 46.450 27.139 -11.147 1177 HB2 LEU 751 HB2 LEU 751 45.986 26.328 -8.286 1178 HB3 LEU 751 HB1 LEU 751 47.238 27.448 -8.781 1179 HG LEU 751 HG LEU 751 44.273 27.864 -9.139 1180 HD11 LEU 751 HD11 LEU 751 46.231 29.139 -7.241 1181 HD12 LEU 751 HD12 LEU 751 44.953 28.003 -6.813 1182 HD13 LEU 751 HD13 LEU 751 44.541 29.598 -7.443 1183 HD21 LEU 751 HD21 LEU 751 45.526 28.940 -10.916 1184 HD22 LEU 751 HD22 LEU 751 46.615 29.668 -9.737 1185 HD23 LEU 751 HD23 LEU 751 44.920 30.152 -9.787 1186 H GLN 752 HN GLN 752 46.775 24.277 -9.009 1187 HA GLN 752 HA GLN 752 48.830 23.067 -10.480 1188 HB2 GLN 752 HB2 GLN 752 50.820 23.617 -9.160 1189 HB3 GLN 752 HB1 GLN 752 50.156 25.052 -9.928 1190 HG2 GLN 752 HG2 GLN 752 49.015 25.558 -7.741 1191 HG3 GLN 752 HG1 GLN 752 49.962 24.253 -7.035 1192 HE21 GLN 752 HE21 GLN 752 52.275 24.885 -8.755 1193 HE22 GLN 752 HE22 GLN 752 52.972 26.309 -8.072 1194 H GLN 753 HN GLN 753 47.433 23.666 -7.317 1195 HA GLN 753 HA GLN 753 47.084 22.413 -5.474 1196 HB2 GLN 753 HB2 GLN 753 45.835 20.923 -6.958 1197 HB3 GLN 753 HB1 GLN 753 47.318 20.100 -7.422 1198 HG2 GLN 753 HG2 GLN 753 47.595 19.293 -5.132 1199 HG3 GLN 753 HG1 GLN 753 46.120 20.129 -4.656 1200 HE21 GLN 753 HE21 GLN 753 47.461 17.466 -6.437 1201 HE22 GLN 753 HE22 GLN 753 45.984 16.586 -6.622 1202 H VAL 754 HN VAL 754 48.818 22.901 -4.263 1203 HA VAL 754 HA VAL 754 51.431 22.008 -4.739 1204 HB VAL 754 HB VAL 754 51.916 22.744 -2.386 1205 HG11 VAL 754 HG11 VAL 754 50.381 24.687 -4.108 1206 HG12 VAL 754 HG12 VAL 754 52.089 24.282 -4.267 1207 HG13 VAL 754 HG13 VAL 754 51.512 25.119 -2.827 1208 HG21 VAL 754 HG21 VAL 754 49.750 22.231 -1.367 1209 HG22 VAL 754 HG22 VAL 754 48.977 23.459 -2.370 1210 HG23 VAL 754 HG23 VAL 754 50.156 23.933 -1.149 1211 HHA CYC 800 HHA CYC 800 20.070 2.571 -4.550 1212 HMA1 CYC 800 HMA1 CYC 800 23.214 6.783 -1.777 1213 HMA2 CYC 800 HMA2 CYC 800 22.043 7.136 -3.069 1214 HMA3 CYC 800 HMA3 CYC 800 23.784 7.031 -3.475 1215 HAA1 CYC 800 HAA1 CYC 800 20.935 6.447 -4.356 1216 HAA2 CYC 800 HAA2 CYC 800 20.723 5.070 -5.444 1217 HBA1 CYC 800 HBA1 CYC 800 19.146 4.084 -3.604 1218 HBA2 CYC 800 HBA2 CYC 800 18.549 5.454 -4.601 1219 HHB CYC 800 HHB CYC 800 25.917 3.942 -2.560 1220 HB CYC 800 HB CYC 800 23.643 6.106 -0.235 1221 HMB1 CYC 800 HMB1 CYC 800 28.159 5.534 -2.087 1222 HMB2 CYC 800 HMB2 CYC 800 28.901 5.210 -0.461 1223 HMB3 CYC 800 HMB3 CYC 800 27.884 3.938 -1.270 1224 HAB1 CYC 800 HAB1 CYC 800 28.652 6.330 1.498 1225 HAB2 CYC 800 HAB2 CYC 800 27.332 6.911 2.602 1226 HBB1 CYC 800 HBB1 CYC 800 28.791 8.841 1.784 1227 HBB2 CYC 800 HBB2 CYC 800 28.366 8.417 0.082 1228 HBB3 CYC 800 HBB3 CYC 800 27.087 9.002 1.217 1229 HC CYC 800 HC CYC 800 24.320 -0.532 -2.669 1230 H2C CYC 800 H2C CYC 800 26.113 -3.690 -0.958 1231 H3C CYC 800 H3C CYC 800 25.041 -4.363 -3.699 1232 HMC1 CYC 800 HMC1 CYC 800 28.190 -3.049 -2.334 1233 HMC2 CYC 800 HMC2 CYC 800 27.508 -4.644 -2.826 1234 HMC3 CYC 800 HMC3 CYC 800 27.196 -3.192 -3.824 1235 HAC1 CYC 800 HAC CYC 800 24.527 -5.630 -1.673 1236 HBC1 CYC 800 HBC1 CYC 800 22.188 -6.040 -2.116 1237 HBC2 CYC 800 HBC2 CYC 800 22.927 -5.487 -3.656 1238 HBC3 CYC 800 HBC3 CYC 800 21.913 -4.351 -2.685 1239 HHD CYC 800 HHD CYC 800 22.514 -3.380 -4.343 1240 HD CYC 800 HD CYC 800 23.203 0.365 -3.626 1241 HMD1 CYC 800 HMD1 CYC 800 20.331 -3.502 -4.358 1242 HMD2 CYC 800 HMD2 CYC 800 18.795 -2.556 -4.380 1243 HMD3 CYC 800 HMD3 CYC 800 19.757 -2.747 -5.897 1244 HAD1 CYC 800 HAD1 CYC 800 18.691 1.390 -5.198 1245 HAD2 CYC 800 HAD2 CYC 800 18.380 -0.276 -5.775 1246 HBD1 CYC 800 HBD1 CYC 800 16.667 0.458 -4.090 1247 HBD2 CYC 800 HBD2 CYC 800 17.616 -0.956 -3.486 1248 HA CYC 800 HA CYC 800 23.844 2.189 -3.171 Start of MODEL 6 1 H SER 599 HT1 SER 599 47.153 20.863 -2.116 2 HA SER 599 HA SER 599 46.543 18.959 -0.829 3 HB2 SER 599 HB2 SER 599 47.966 18.447 1.210 4 HB3 SER 599 HB1 SER 599 48.706 18.038 -0.337 5 HG SER 599 HG SER 599 50.298 19.146 0.544 6 H ASP 600 HN ASP 600 46.314 21.918 -0.985 7 HA ASP 600 HA ASP 600 45.959 22.806 1.737 8 HB2 ASP 600 HB2 ASP 600 45.241 24.929 0.571 9 HB3 ASP 600 HB1 ASP 600 46.892 24.402 0.259 10 H VAL 601 HN VAL 601 43.923 21.831 -0.988 11 HA VAL 601 HA VAL 601 41.551 22.966 0.019 12 HB VAL 601 HB VAL 601 41.864 22.297 -2.359 13 HG11 VAL 601 HG11 VAL 601 41.358 19.507 -1.335 14 HG12 VAL 601 HG12 VAL 601 42.856 20.102 -2.048 15 HG13 VAL 601 HG13 VAL 601 41.396 19.990 -3.032 16 HG21 VAL 601 HG21 VAL 601 39.547 21.613 -2.709 17 HG22 VAL 601 HG22 VAL 601 39.669 22.864 -1.477 18 HG23 VAL 601 HG23 VAL 601 39.412 21.185 -1.005 19 H GLU 602 HN GLU 602 43.098 19.881 0.657 20 HA GLU 602 HA GLU 602 40.938 18.546 1.821 21 HB2 GLU 602 HB2 GLU 602 43.816 18.389 2.732 22 HB3 GLU 602 HB1 GLU 602 42.561 17.199 3.039 23 HG2 GLU 602 HG2 GLU 602 43.587 16.190 1.297 24 HG3 GLU 602 HG1 GLU 602 42.449 17.189 0.393 25 H GLU 603 HN GLU 603 43.061 21.015 3.110 26 HA GLU 603 HA GLU 603 42.115 20.821 5.790 27 HB2 GLU 603 HB2 GLU 603 44.287 21.849 5.206 28 HB3 GLU 603 HB1 GLU 603 43.433 23.157 4.399 29 HG2 GLU 603 HG2 GLU 603 42.469 23.882 6.469 30 HG3 GLU 603 HG1 GLU 603 43.147 22.494 7.317 31 H ILE 604 HN ILE 604 41.249 22.710 2.955 32 HA ILE 604 HA ILE 604 39.370 24.428 4.084 33 HB ILE 604 HB ILE 604 39.279 23.121 1.348 34 HG12 ILE 604 HG12 ILE 604 41.365 24.348 1.706 35 HG13 ILE 604 HG11 ILE 604 40.348 25.191 0.543 36 HG21 ILE 604 HG21 ILE 604 37.117 24.062 1.947 37 HG22 ILE 604 HG22 ILE 604 37.879 25.018 0.677 38 HG23 ILE 604 HG23 ILE 604 37.878 25.603 2.341 39 HD11 ILE 604 HD11 ILE 604 39.655 26.747 2.314 40 HD12 ILE 604 HD12 ILE 604 41.398 26.760 2.052 41 HD13 ILE 604 HD13 ILE 604 40.723 25.915 3.444 42 H PHE 605 HN PHE 605 38.981 21.091 2.813 43 HA PHE 605 HA PHE 605 36.282 20.766 3.346 44 HB2 PHE 605 HB2 PHE 605 38.613 18.862 3.285 45 HB3 PHE 605 HB1 PHE 605 37.001 18.300 3.697 46 HD1 PHE 605 HD1 PHE 605 39.211 19.414 1.038 47 HD2 PHE 605 HD2 PHE 605 35.223 18.328 2.031 48 HE1 PHE 605 HE1 PHE 605 38.704 19.109 -1.357 49 HE2 PHE 605 HE2 PHE 605 34.710 18.027 -0.356 50 HZ PHE 605 HZ PHE 605 36.455 18.415 -2.048 51 H LYS 606 HN LYS 606 39.085 19.981 5.360 52 HA LYS 606 HA LYS 606 37.744 18.895 7.549 53 HB2 LYS 606 HB2 LYS 606 40.364 20.389 7.502 54 HB3 LYS 606 HB1 LYS 606 39.794 19.406 8.843 55 HG2 LYS 606 HG2 LYS 606 39.874 17.422 7.487 56 HG3 LYS 606 HG1 LYS 606 40.293 18.374 6.062 57 HD2 LYS 606 HD2 LYS 606 42.375 19.077 7.176 58 HD3 LYS 606 HD1 LYS 606 41.957 18.065 8.559 59 HE2 LYS 606 HE2 LYS 606 41.979 16.090 7.113 60 HE3 LYS 606 HE1 LYS 606 42.394 17.106 5.734 61 HZ1 LYS 606 HZ1 LYS 606 44.338 16.025 6.652 62 HZ2 LYS 606 HZ2 LYS 606 44.059 16.719 8.163 63 HZ3 LYS 606 HZ3 LYS 606 44.460 17.699 6.847 64 H THR 607 HN THR 607 38.571 22.297 6.907 65 HA THR 607 HA THR 607 37.747 23.230 9.450 66 HB THR 607 HB THR 607 37.917 24.821 6.879 67 HG1 THR 607 HG1 THR 607 39.883 23.642 7.267 68 HG21 THR 607 HG21 THR 607 38.308 25.608 9.775 69 HG22 THR 607 HG22 THR 607 36.897 25.988 8.789 70 HG23 THR 607 HG23 THR 607 38.467 26.681 8.385 71 H THR 608 HN THR 608 36.150 22.764 6.355 72 HA THR 608 HA THR 608 33.792 24.226 7.113 73 HB THR 608 HB THR 608 34.193 22.396 4.738 74 HG1 THR 608 HG1 THR 608 35.685 23.980 4.475 75 HG21 THR 608 HG21 THR 608 32.380 23.710 3.737 76 HG22 THR 608 HG22 THR 608 32.245 24.662 5.214 77 HG23 THR 608 HG23 THR 608 31.840 22.946 5.232 78 H THR 609 HN THR 609 34.677 20.812 6.720 79 HA THR 609 HA THR 609 32.158 19.689 7.054 80 HB THR 609 HB THR 609 33.412 17.632 7.858 81 HG1 THR 609 HG1 THR 609 35.406 17.914 8.446 82 HG21 THR 609 HG21 THR 609 32.860 17.978 5.501 83 HG22 THR 609 HG22 THR 609 34.443 17.217 5.664 84 HG23 THR 609 HG23 THR 609 34.324 18.937 5.289 85 H GLN 610 HN GLN 610 34.546 20.646 9.597 86 HA GLN 610 HA GLN 610 33.042 19.521 11.693 87 HB2 GLN 610 HB2 GLN 610 35.451 19.918 11.818 88 HB3 GLN 610 HB1 GLN 610 35.192 21.644 11.627 89 HG2 GLN 610 HG2 GLN 610 35.650 21.111 13.931 90 HG3 GLN 610 HG1 GLN 610 33.994 21.692 13.758 91 HE21 GLN 610 HE21 GLN 610 33.298 20.722 15.610 92 HE22 GLN 610 HE22 GLN 610 33.116 19.012 15.777 93 H GLU 611 HN GLU 611 33.105 22.595 10.052 94 HA GLU 611 HA GLU 611 31.641 24.006 12.063 95 HB2 GLU 611 HB2 GLU 611 33.162 25.158 10.519 96 HB3 GLU 611 HB1 GLU 611 32.117 24.726 9.173 97 HG2 GLU 611 HG2 GLU 611 30.322 26.056 10.111 98 HG3 GLU 611 HG1 GLU 611 31.326 26.450 11.507 99 H VAL 612 HN VAL 612 30.822 22.634 8.887 100 HA VAL 612 HA VAL 612 28.107 23.371 8.969 101 HB VAL 612 HB VAL 612 29.335 22.635 6.900 102 HG11 VAL 612 HG11 VAL 612 30.452 20.674 7.790 103 HG12 VAL 612 HG12 VAL 612 29.478 20.259 6.378 104 HG13 VAL 612 HG13 VAL 612 28.898 19.869 7.998 105 HG21 VAL 612 HG21 VAL 612 26.746 21.206 7.486 106 HG22 VAL 612 HG22 VAL 612 27.416 21.494 5.880 107 HG23 VAL 612 HG23 VAL 612 26.919 22.855 6.885 108 H ARG 613 HN ARG 613 29.882 20.769 10.414 109 HA ARG 613 HA ARG 613 27.903 18.926 11.065 110 HB2 ARG 613 HB2 ARG 613 30.539 19.648 12.060 111 HB3 ARG 613 HB1 ARG 613 29.479 19.096 13.347 112 HG2 ARG 613 HG2 ARG 613 29.019 17.078 11.998 113 HG3 ARG 613 HG1 ARG 613 30.268 17.613 10.865 114 HD2 ARG 613 HD2 ARG 613 31.233 16.037 12.427 115 HD3 ARG 613 HD1 ARG 613 31.887 17.646 12.740 116 HE ARG 613 HE ARG 613 29.580 16.989 14.327 117 HH11 ARG 613 HH11 ARG 613 33.077 16.797 14.152 118 HH12 ARG 613 HH12 ARG 613 33.286 16.604 15.856 119 HH21 ARG 613 HH21 ARG 613 29.852 16.743 16.594 120 HH22 ARG 613 HH22 ARG 613 31.441 16.588 17.253 121 H GLN 614 HN GLN 614 28.970 21.741 12.850 122 HA GLN 614 HA GLN 614 27.009 21.322 14.904 123 HB2 GLN 614 HB2 GLN 614 29.272 22.291 15.349 124 HB3 GLN 614 HB1 GLN 614 28.785 23.732 14.471 125 HG2 GLN 614 HG2 GLN 614 27.013 24.124 16.118 126 HG3 GLN 614 HG1 GLN 614 27.535 22.691 17.005 127 HE21 GLN 614 HE21 GLN 614 29.501 22.743 18.115 128 HE22 GLN 614 HE22 GLN 614 30.289 24.235 18.498 129 H LEU 615 HN LEU 615 27.259 23.044 11.961 130 HA LEU 615 HA LEU 615 25.287 25.035 12.462 131 HB2 LEU 615 HB2 LEU 615 27.185 25.015 10.714 132 HB3 LEU 615 HB1 LEU 615 26.118 24.024 9.749 133 HG LEU 615 HG LEU 615 26.141 26.426 9.098 134 HD11 LEU 615 HD11 LEU 615 23.727 26.716 8.912 135 HD12 LEU 615 HD12 LEU 615 23.483 25.423 10.087 136 HD13 LEU 615 HD13 LEU 615 24.220 25.067 8.525 137 HD21 LEU 615 HD21 LEU 615 25.018 28.065 10.494 138 HD22 LEU 615 HD22 LEU 615 26.426 27.393 11.316 139 HD23 LEU 615 HD23 LEU 615 24.805 26.859 11.762 140 H LEU 616 HN LEU 616 25.237 21.939 10.643 141 HA LEU 616 HA LEU 616 22.343 22.236 10.337 142 HB2 LEU 616 HB2 LEU 616 24.267 20.284 9.091 143 HB3 LEU 616 HB1 LEU 616 22.541 20.299 8.800 144 HG LEU 616 HG LEU 616 24.492 22.480 8.057 145 HD11 LEU 616 HD11 LEU 616 22.905 20.554 6.370 146 HD12 LEU 616 HD12 LEU 616 24.646 20.507 6.643 147 HD13 LEU 616 HD13 LEU 616 23.927 21.857 5.766 148 HD21 LEU 616 HD21 LEU 616 22.565 23.517 6.927 149 HD22 LEU 616 HD22 LEU 616 22.358 23.453 8.677 150 HD23 LEU 616 HD23 LEU 616 21.506 22.303 7.645 151 H ARG 617 HN ARG 617 24.061 21.183 12.769 152 HA ARG 617 HA ARG 617 23.613 19.840 14.555 153 HB2 ARG 617 HB2 ARG 617 21.035 19.850 13.122 154 HB3 ARG 617 HB1 ARG 617 21.279 18.489 14.203 155 HG2 ARG 617 HG2 ARG 617 21.640 21.344 15.060 156 HG3 ARG 617 HG1 ARG 617 20.106 20.476 15.184 157 HD2 ARG 617 HD2 ARG 617 22.710 19.621 16.441 158 HD3 ARG 617 HD1 ARG 617 21.379 20.412 17.284 159 HE ARG 617 HE ARG 617 20.123 18.302 16.296 160 HH11 ARG 617 HH11 ARG 617 23.259 18.454 17.874 161 HH12 ARG 617 HH12 ARG 617 23.145 16.854 18.525 162 HH21 ARG 617 HH21 ARG 617 19.980 16.187 17.173 163 HH22 ARG 617 HH22 ARG 617 21.286 15.567 18.126 164 H CYS 618 HN CYS 618 24.736 18.806 11.882 165 HA CYS 618 HA CYS 618 24.105 16.007 12.088 166 HB2 CYS 618 HB2 CYS 618 25.909 15.876 10.231 167 HB3 CYS 618 HB1 CYS 618 24.347 16.596 9.861 168 HG CYS 618 HG CYS 618 25.390 18.695 8.849 169 H ASP 619 HN ASP 619 25.375 14.444 12.866 170 HA ASP 619 HA ASP 619 27.435 15.253 14.734 171 HB2 ASP 619 HB2 ASP 619 25.689 13.598 15.330 172 HB3 ASP 619 HB1 ASP 619 26.334 12.514 14.104 173 H ARG 620 HN ARG 620 27.149 13.598 11.681 174 HA ARG 620 HA ARG 620 30.085 13.520 11.490 175 HB2 ARG 620 HB2 ARG 620 28.250 11.328 10.517 176 HB3 ARG 620 HB1 ARG 620 30.006 11.344 10.433 177 HG2 ARG 620 HG2 ARG 620 30.140 11.290 12.845 178 HG3 ARG 620 HG1 ARG 620 28.383 11.326 12.959 179 HD2 ARG 620 HD2 ARG 620 28.356 9.203 11.629 180 HD3 ARG 620 HD1 ARG 620 30.110 9.146 11.813 181 HE ARG 620 HE ARG 620 29.015 9.477 14.344 182 HH11 ARG 620 HH11 ARG 620 29.082 7.060 11.808 183 HH12 ARG 620 HH12 ARG 620 28.821 5.727 12.880 184 HH21 ARG 620 HH21 ARG 620 28.690 7.699 15.784 185 HH22 ARG 620 HH22 ARG 620 28.632 6.091 15.156 186 H VAL 621 HN VAL 621 30.915 13.944 9.492 187 HA VAL 621 HA VAL 621 29.076 14.448 7.271 188 HB VAL 621 HB VAL 621 31.208 16.416 8.170 189 HG11 VAL 621 HG11 VAL 621 31.070 16.280 5.738 190 HG12 VAL 621 HG12 VAL 621 30.425 17.816 6.315 191 HG13 VAL 621 HG13 VAL 621 29.326 16.531 5.811 192 HG21 VAL 621 HG21 VAL 621 28.213 16.756 8.045 193 HG22 VAL 621 HG22 VAL 621 29.389 17.953 8.594 194 HG23 VAL 621 HG23 VAL 621 29.138 16.473 9.516 195 H ALA 622 HN ALA 622 29.744 13.192 5.736 196 HA ALA 622 HA ALA 622 32.615 12.580 5.533 197 HB1 ALA 622 HB1 ALA 622 31.999 10.468 4.501 198 HB2 ALA 622 HB2 ALA 622 30.293 10.896 4.612 199 HB3 ALA 622 HB3 ALA 622 31.237 10.640 6.081 200 H VAL 623 HN VAL 623 33.569 12.425 3.541 201 HA VAL 623 HA VAL 623 32.103 13.676 1.316 202 HB VAL 623 HB VAL 623 35.060 14.045 1.871 203 HG11 VAL 623 HG11 VAL 623 34.945 15.716 0.097 204 HG12 VAL 623 HG12 VAL 623 33.240 15.342 -0.149 205 HG13 VAL 623 HG13 VAL 623 34.468 14.123 -0.490 206 HG21 VAL 623 HG21 VAL 623 32.793 15.989 2.268 207 HG22 VAL 623 HG22 VAL 623 34.509 16.376 2.375 208 HG23 VAL 623 HG23 VAL 623 33.782 15.263 3.540 209 H TYR 624 HN TYR 624 32.248 12.634 -0.599 210 HA TYR 624 HA TYR 624 33.860 10.177 -0.627 211 HB2 TYR 624 HB2 TYR 624 31.198 10.817 -1.910 212 HB3 TYR 624 HB1 TYR 624 32.154 9.410 -2.349 213 HD1 TYR 624 HD1 TYR 624 30.715 11.066 0.668 214 HD2 TYR 624 HD2 TYR 624 31.698 7.424 -1.289 215 HE1 TYR 624 HE1 TYR 624 29.647 9.813 2.483 216 HE2 TYR 624 HE2 TYR 624 30.632 6.155 0.523 217 HH TYR 624 HH TYR 624 28.651 7.640 2.875 218 H ARG 625 HN ARG 625 34.980 9.687 -2.485 219 HA ARG 625 HA ARG 625 35.109 11.815 -4.514 220 HB2 ARG 625 HB2 ARG 625 37.171 11.696 -3.193 221 HB3 ARG 625 HB1 ARG 625 37.316 9.982 -3.557 222 HG2 ARG 625 HG2 ARG 625 37.523 10.555 -5.956 223 HG3 ARG 625 HG1 ARG 625 37.506 12.262 -5.512 224 HD2 ARG 625 HD2 ARG 625 39.501 11.892 -4.118 225 HD3 ARG 625 HD1 ARG 625 39.525 10.205 -4.629 226 HE ARG 625 HE ARG 625 39.554 12.047 -6.826 227 HH11 ARG 625 HH11 ARG 625 41.572 10.401 -4.468 228 HH12 ARG 625 HH12 ARG 625 43.004 10.520 -5.423 229 HH21 ARG 625 HH21 ARG 625 41.454 12.210 -8.085 230 HH22 ARG 625 HH22 ARG 625 42.940 11.554 -7.491 231 H PHE 626 HN PHE 626 34.574 11.188 -6.512 232 HA PHE 626 HA PHE 626 34.222 8.338 -6.945 233 HB2 PHE 626 HB2 PHE 626 33.209 10.756 -8.409 234 HB3 PHE 626 HB1 PHE 626 33.107 9.141 -9.100 235 HD1 PHE 626 HD1 PHE 626 31.173 11.455 -7.653 236 HD2 PHE 626 HD2 PHE 626 32.325 7.409 -7.026 237 HE1 PHE 626 HE1 PHE 626 29.090 11.055 -6.419 238 HE2 PHE 626 HE2 PHE 626 30.244 7.001 -5.789 239 HZ PHE 626 HZ PHE 626 28.622 8.823 -5.484 240 H ASN 627 HN ASN 627 35.677 7.235 -7.860 241 HA ASN 627 HA ASN 627 37.708 8.459 -9.532 242 HB2 ASN 627 HB2 ASN 627 37.338 5.621 -8.504 243 HB3 ASN 627 HB1 ASN 627 38.703 6.147 -9.478 244 HD21 ASN 627 HD21 ASN 627 38.684 5.036 -6.811 245 HD22 ASN 627 HD22 ASN 627 39.452 6.204 -5.792 246 HA PRO 628 HA PRO 628 36.174 7.380 -13.559 247 HB2 PRO 628 HB2 PRO 628 38.181 5.160 -13.664 248 HB3 PRO 628 HB1 PRO 628 37.768 6.359 -14.895 249 HG2 PRO 628 HG2 PRO 628 39.956 6.662 -13.436 250 HG3 PRO 628 HG1 PRO 628 38.937 8.059 -13.824 251 HD2 PRO 628 HD2 PRO 628 39.250 6.602 -11.255 252 HD3 PRO 628 HD1 PRO 628 38.878 8.313 -11.542 253 H ASN 629 HN ASN 629 36.723 4.600 -11.407 254 HA ASN 629 HA ASN 629 34.670 3.082 -12.832 255 HB2 ASN 629 HB2 ASN 629 36.587 2.256 -10.656 256 HB3 ASN 629 HB1 ASN 629 35.350 1.197 -11.323 257 HD21 ASN 629 HD21 ASN 629 38.243 0.943 -11.351 258 HD22 ASN 629 HD22 ASN 629 38.699 0.829 -13.017 259 H TRP 630 HN TRP 630 34.486 5.373 -10.609 260 HA TRP 630 HA TRP 630 33.026 5.983 -8.975 261 HB2 TRP 630 HB2 TRP 630 31.355 3.959 -10.464 262 HB3 TRP 630 HB1 TRP 630 30.708 4.940 -9.154 263 HD1 TRP 630 HD1 TRP 630 32.382 5.447 -12.620 264 HE1 TRP 630 HE1 TRP 630 31.440 7.619 -13.638 265 HE3 TRP 630 HE3 TRP 630 29.456 6.970 -8.723 266 HZ2 TRP 630 HZ2 TRP 630 29.686 9.690 -12.891 267 HZ3 TRP 630 HZ3 TRP 630 28.177 9.055 -8.955 268 HH2 TRP 630 HH2 TRP 630 28.290 10.380 -10.995 269 H THR 631 HN THR 631 34.854 4.559 -7.818 270 HA THR 631 HA THR 631 33.831 2.217 -6.508 271 HB THR 631 HB THR 631 36.046 2.275 -5.328 272 HG1 THR 631 HG1 THR 631 37.017 4.163 -5.409 273 HG21 THR 631 HG21 THR 631 35.700 1.009 -7.387 274 HG22 THR 631 HG22 THR 631 37.317 1.723 -7.370 275 HG23 THR 631 HG23 THR 631 36.032 2.454 -8.337 276 H GLY 632 HN GLY 632 33.610 5.492 -5.868 277 HA2 GLY 632 HA2 GLY 632 32.844 6.737 -4.092 278 HA3 GLY 632 HA1 GLY 632 32.128 5.237 -3.525 279 H GLU 633 HN GLU 633 35.304 6.869 -3.656 280 HA GLU 633 HA GLU 633 36.033 5.410 -1.229 281 HB2 GLU 633 HB2 GLU 633 37.540 5.478 -3.267 282 HB3 GLU 633 HB1 GLU 633 37.808 7.176 -2.904 283 HG2 GLU 633 HG2 GLU 633 38.755 6.584 -0.747 284 HG3 GLU 633 HG1 GLU 633 38.448 4.878 -1.071 285 H PHE 634 HN PHE 634 36.483 6.391 0.683 286 HA PHE 634 HA PHE 634 35.388 9.022 1.088 287 HB2 PHE 634 HB2 PHE 634 36.754 7.095 2.973 288 HB3 PHE 634 HB1 PHE 634 36.083 8.638 3.472 289 HD1 PHE 634 HD1 PHE 634 35.310 5.253 2.309 290 HD2 PHE 634 HD2 PHE 634 33.713 8.935 3.716 291 HE1 PHE 634 HE1 PHE 634 33.143 4.159 2.705 292 HE2 PHE 634 HE2 PHE 634 31.534 7.840 4.102 293 HZ PHE 634 HZ PHE 634 31.262 5.452 3.604 294 H VAL 635 HN VAL 635 36.464 10.887 1.488 295 HA VAL 635 HA VAL 635 39.410 10.754 1.475 296 HB VAL 635 HB VAL 635 39.421 13.050 0.517 297 HG11 VAL 635 HG11 VAL 635 39.725 11.167 -0.956 298 HG12 VAL 635 HG12 VAL 635 38.769 12.406 -1.768 299 HG13 VAL 635 HG13 VAL 635 37.981 10.969 -1.115 300 HG21 VAL 635 HG21 VAL 635 37.367 13.921 -0.515 301 HG22 VAL 635 HG22 VAL 635 37.237 13.806 1.239 302 HG23 VAL 635 HG23 VAL 635 36.453 12.601 0.217 303 H ALA 636 HN ALA 636 36.580 11.917 3.059 304 HA ALA 636 HA ALA 636 38.127 12.722 5.337 305 HB1 ALA 636 HB1 ALA 636 37.274 14.999 5.461 306 HB2 ALA 636 HB2 ALA 636 36.432 14.785 3.926 307 HB3 ALA 636 HB3 ALA 636 38.195 14.768 3.975 308 H GLU 637 HN GLU 637 36.900 12.887 7.201 309 HA GLU 637 HA GLU 637 34.030 12.684 7.149 310 HB2 GLU 637 HB2 GLU 637 34.414 10.351 6.873 311 HB3 GLU 637 HB1 GLU 637 35.766 10.361 7.993 312 HG2 GLU 637 HG2 GLU 637 33.854 9.252 8.985 313 HG3 GLU 637 HG1 GLU 637 34.221 10.733 9.861 314 H SER 638 HN SER 638 33.647 14.270 8.539 315 HA SER 638 HA SER 638 35.332 14.512 10.905 316 HB2 SER 638 HB2 SER 638 33.996 16.636 11.267 317 HB3 SER 638 HB1 SER 638 34.971 16.603 9.799 318 HG SER 638 HG SER 638 32.348 15.675 9.634 319 H VAL 639 HN VAL 639 34.766 13.164 12.422 320 HA VAL 639 HA VAL 639 31.917 12.800 13.029 321 HB VAL 639 HB VAL 639 32.886 10.714 12.262 322 HG11 VAL 639 HG11 VAL 639 35.007 11.118 14.363 323 HG12 VAL 639 HG12 VAL 639 35.227 11.188 12.614 324 HG13 VAL 639 HG13 VAL 639 34.795 9.663 13.390 325 HG21 VAL 639 HG21 VAL 639 32.635 10.663 15.269 326 HG22 VAL 639 HG22 VAL 639 32.544 9.260 14.206 327 HG23 VAL 639 HG23 VAL 639 31.309 10.513 14.122 328 H ALA 640 HN ALA 640 31.269 12.896 15.168 329 HA ALA 640 HA ALA 640 32.639 14.601 16.894 330 HB1 ALA 640 HB1 ALA 640 30.536 12.558 17.607 331 HB2 ALA 640 HB2 ALA 640 30.213 14.178 16.992 332 HB3 ALA 640 HB3 ALA 640 30.991 13.967 18.563 333 H HIS 641 HN HIS 641 33.887 14.243 18.725 334 HA HIS 641 HA HIS 641 35.668 12.060 18.598 335 HB2 HIS 641 HB2 HIS 641 36.761 12.951 20.519 336 HB3 HIS 641 HB1 HIS 641 36.172 14.331 19.608 337 HD2 HIS 641 HD2 HIS 641 34.371 15.956 20.974 338 HE1 HIS 641 HE1 HIS 641 34.296 13.677 24.548 339 HE2 HIS 641 HE2 HIS 641 33.858 15.917 23.504 340 H THR 642 HN THR 642 32.578 12.212 19.853 341 HA THR 642 HA THR 642 32.696 10.467 22.049 342 HB THR 642 HB THR 642 30.353 10.647 20.172 343 HG1 THR 642 HG1 THR 642 29.950 12.672 20.807 344 HG21 THR 642 HG21 THR 642 30.579 10.525 23.187 345 HG22 THR 642 HG22 THR 642 30.193 9.166 22.133 346 HG23 THR 642 HG23 THR 642 29.079 10.526 22.261 347 H TRP 643 HN TRP 643 32.723 9.975 18.597 348 HA TRP 643 HA TRP 643 32.259 7.095 18.975 349 HB2 TRP 643 HB2 TRP 643 32.135 8.536 16.339 350 HB3 TRP 643 HB1 TRP 643 31.429 6.985 16.776 351 HD1 TRP 643 HD1 TRP 643 30.710 10.654 16.692 352 HE1 TRP 643 HE1 TRP 643 28.324 11.104 17.495 353 HE3 TRP 643 HE3 TRP 643 29.626 6.022 18.548 354 HZ2 TRP 643 HZ2 TRP 643 26.240 9.677 18.772 355 HZ3 TRP 643 HZ3 TRP 643 27.411 5.649 19.547 356 HH2 TRP 643 HH2 TRP 643 25.754 7.443 19.655 357 H VAL 644 HN VAL 644 33.249 6.218 16.580 358 HA VAL 644 HA VAL 644 36.113 6.403 17.052 359 HB VAL 644 HB VAL 644 35.132 4.158 16.991 360 HG11 VAL 644 HG11 VAL 644 33.235 4.578 15.529 361 HG12 VAL 644 HG12 VAL 644 34.192 3.225 14.928 362 HG13 VAL 644 HG13 VAL 644 34.320 4.806 14.159 363 HG21 VAL 644 HG21 VAL 644 36.617 3.129 15.335 364 HG22 VAL 644 HG22 VAL 644 37.430 4.416 16.225 365 HG23 VAL 644 HG23 VAL 644 36.863 4.703 14.582 366 H LYS 645 HN LYS 645 37.552 7.123 15.537 367 HA LYS 645 HA LYS 645 36.625 8.772 13.415 368 HB2 LYS 645 HB2 LYS 645 38.754 9.162 14.647 369 HB3 LYS 645 HB1 LYS 645 39.411 7.700 13.930 370 HG2 LYS 645 HG2 LYS 645 40.265 9.592 12.746 371 HG3 LYS 645 HG1 LYS 645 39.141 8.733 11.692 372 HD2 LYS 645 HD2 LYS 645 37.403 10.365 12.170 373 HD3 LYS 645 HD1 LYS 645 38.463 11.190 13.314 374 HE2 LYS 645 HE2 LYS 645 40.040 11.633 11.442 375 HE3 LYS 645 HE1 LYS 645 38.868 10.923 10.335 376 HZ1 LYS 645 HZ1 LYS 645 38.328 13.273 12.070 377 HZ2 LYS 645 HZ2 LYS 645 37.304 12.651 10.870 378 HZ3 LYS 645 HZ3 LYS 645 38.768 13.372 10.444 379 H LEU 646 HN LEU 646 35.859 8.050 11.548 380 HA LEU 646 HA LEU 646 35.886 5.372 10.762 381 HB2 LEU 646 HB2 LEU 646 34.186 6.995 10.063 382 HB3 LEU 646 HB1 LEU 646 35.377 7.813 9.072 383 HG LEU 646 HG LEU 646 35.583 5.776 7.678 384 HD11 LEU 646 HD11 LEU 646 34.949 4.108 9.310 385 HD12 LEU 646 HD12 LEU 646 33.895 4.013 7.900 386 HD13 LEU 646 HD13 LEU 646 33.317 4.769 9.384 387 HD21 LEU 646 HD21 LEU 646 34.079 7.575 7.011 388 HD22 LEU 646 HD22 LEU 646 32.779 6.852 7.959 389 HD23 LEU 646 HD23 LEU 646 33.421 6.003 6.554 390 H VAL 647 HN VAL 647 37.430 8.027 8.946 391 HA VAL 647 HA VAL 647 39.355 6.058 7.931 392 HB VAL 647 HB VAL 647 39.812 7.672 6.105 393 HG11 VAL 647 HG11 VAL 647 37.710 7.353 4.903 394 HG12 VAL 647 HG12 VAL 647 36.901 6.949 6.416 395 HG13 VAL 647 HG13 VAL 647 38.168 5.897 5.786 396 HG21 VAL 647 HG21 VAL 647 37.537 9.248 7.321 397 HG22 VAL 647 HG22 VAL 647 38.314 9.590 5.776 398 HG23 VAL 647 HG23 VAL 647 39.231 9.738 7.275 399 H GLY 648 HN GLY 648 41.562 6.946 7.445 400 HA2 GLY 648 HA2 GLY 648 42.480 9.201 8.944 401 HA3 GLY 648 HA1 GLY 648 42.890 7.677 9.723 402 HA PRO 649 HA PRO 649 46.277 8.825 6.680 403 HB2 PRO 649 HB2 PRO 649 47.903 7.706 8.893 404 HB3 PRO 649 HB1 PRO 649 48.133 9.200 7.977 405 HG2 PRO 649 HG2 PRO 649 47.268 9.262 10.499 406 HG3 PRO 649 HG1 PRO 649 46.632 10.389 9.286 407 HD2 PRO 649 HD2 PRO 649 45.393 7.899 10.398 408 HD3 PRO 649 HD1 PRO 649 44.638 9.466 10.030 409 H ASP 650 HN ASP 650 45.662 6.018 8.684 410 HA ASP 650 HA ASP 650 46.991 4.304 6.705 411 HB2 ASP 650 HB2 ASP 650 47.701 4.067 9.078 412 HB3 ASP 650 HB1 ASP 650 46.060 3.584 9.489 413 H ILE 651 HN ILE 651 43.987 4.810 8.429 414 HA ILE 651 HA ILE 651 42.646 2.527 7.437 415 HB ILE 651 HB ILE 651 41.361 5.066 8.434 416 HG12 ILE 651 HG12 ILE 651 42.198 2.643 10.043 417 HG13 ILE 651 HG11 ILE 651 43.065 4.176 10.028 418 HG21 ILE 651 HG21 ILE 651 40.406 2.201 8.392 419 HG22 ILE 651 HG22 ILE 651 39.871 3.483 7.305 420 HG23 ILE 651 HG23 ILE 651 39.514 3.584 9.029 421 HD11 ILE 651 HD11 ILE 651 41.658 3.986 11.990 422 HD12 ILE 651 HD12 ILE 651 40.240 3.748 10.970 423 HD13 ILE 651 HD13 ILE 651 41.096 5.290 10.947 424 H LYS 652 HN LYS 652 42.057 2.201 5.478 425 HA LYS 652 HA LYS 652 41.161 4.463 3.820 426 HB2 LYS 652 HB2 LYS 652 41.763 3.088 1.837 427 HB3 LYS 652 HB1 LYS 652 43.144 3.482 2.846 428 HG2 LYS 652 HG2 LYS 652 42.965 1.208 3.858 429 HG3 LYS 652 HG1 LYS 652 41.707 0.843 2.675 430 HD2 LYS 652 HD2 LYS 652 43.316 1.360 0.866 431 HD3 LYS 652 HD1 LYS 652 44.565 1.609 2.083 432 HE2 LYS 652 HE2 LYS 652 44.819 -0.605 1.221 433 HE3 LYS 652 HE1 LYS 652 44.175 -0.735 2.857 434 HZ1 LYS 652 HZ1 LYS 652 42.632 -0.976 0.334 435 HZ2 LYS 652 HZ2 LYS 652 41.956 -1.027 1.880 436 HZ3 LYS 652 HZ3 LYS 652 43.030 -2.236 1.386 437 H THR 653 HN THR 653 39.105 4.446 3.130 438 HA THR 653 HA THR 653 37.626 1.920 3.302 439 HB THR 653 HB THR 653 36.478 4.569 4.228 440 HG1 THR 653 HG1 THR 653 38.197 2.900 5.474 441 HG21 THR 653 HG21 THR 653 35.550 1.707 4.588 442 HG22 THR 653 HG22 THR 653 34.827 2.892 3.500 443 HG23 THR 653 HG23 THR 653 34.749 3.135 5.246 444 H VAL 654 HN VAL 654 36.314 1.519 1.622 445 HA VAL 654 HA VAL 654 35.786 3.662 -0.314 446 HB VAL 654 HB VAL 654 37.684 2.092 -0.961 447 HG11 VAL 654 HG11 VAL 654 36.818 0.032 -0.066 448 HG12 VAL 654 HG12 VAL 654 37.108 -0.130 -1.798 449 HG13 VAL 654 HG13 VAL 654 35.464 0.079 -1.196 450 HG21 VAL 654 HG21 VAL 654 35.284 2.172 -2.773 451 HG22 VAL 654 HG22 VAL 654 36.927 1.779 -3.274 452 HG23 VAL 654 HG23 VAL 654 36.556 3.387 -2.652 453 H TRP 655 HN TRP 655 33.783 3.097 -1.759 454 HA TRP 655 HA TRP 655 32.065 1.108 -0.495 455 HB2 TRP 655 HB2 TRP 655 31.644 3.349 0.610 456 HB3 TRP 655 HB1 TRP 655 31.168 3.968 -0.964 457 HD1 TRP 655 HD1 TRP 655 29.333 1.466 -1.868 458 HE1 TRP 655 HE1 TRP 655 27.049 1.123 -0.738 459 HE3 TRP 655 HE3 TRP 655 30.153 4.139 2.414 460 HZ2 TRP 655 HZ2 TRP 655 25.763 1.900 1.654 461 HZ3 TRP 655 HZ3 TRP 655 28.339 4.294 4.071 462 HH2 TRP 655 HH2 TRP 655 26.192 3.197 3.696 463 H GLU 656 HN GLU 656 32.160 -0.096 -2.341 464 HA GLU 656 HA GLU 656 31.675 1.175 -4.890 465 HB2 GLU 656 HB2 GLU 656 32.202 -1.724 -4.238 466 HB3 GLU 656 HB1 GLU 656 32.146 -1.022 -5.849 467 HG2 GLU 656 HG2 GLU 656 34.077 0.382 -5.290 468 HG3 GLU 656 HG1 GLU 656 34.142 -0.363 -3.694 469 H ASP 657 HN ASP 657 29.568 1.781 -4.902 470 HA ASP 657 HA ASP 657 27.520 -0.192 -4.325 471 HB2 ASP 657 HB2 ASP 657 27.045 2.060 -3.587 472 HB3 ASP 657 HB1 ASP 657 27.326 2.695 -5.207 473 H THR 658 HN THR 658 27.072 -1.627 -5.792 474 HA THR 658 HA THR 658 27.889 -1.543 -8.447 475 HB THR 658 HB THR 658 27.521 -3.669 -7.407 476 HG1 THR 658 HG1 THR 658 25.546 -4.269 -9.001 477 HG21 THR 658 HG21 THR 658 25.766 -3.070 -5.827 478 HG22 THR 658 HG22 THR 658 25.267 -4.470 -6.781 479 HG23 THR 658 HG23 THR 658 24.614 -2.874 -7.151 480 H HIS 659 HN HIS 659 24.980 -0.334 -6.950 481 HA HIS 659 HA HIS 659 23.355 -0.278 -9.266 482 HB2 HIS 659 HB2 HIS 659 22.424 -0.073 -6.986 483 HB3 HIS 659 HB1 HIS 659 23.233 1.476 -6.796 484 HD2 HIS 659 HD2 HIS 659 22.167 3.506 -8.674 485 HE1 HIS 659 HE1 HIS 659 18.394 1.575 -8.826 486 HE2 HIS 659 HE2 HIS 659 19.639 3.738 -9.159 487 H LEU 660 HN LEU 660 25.150 2.384 -7.614 488 HA LEU 660 HA LEU 660 24.746 4.262 -9.630 489 HB2 LEU 660 HB2 LEU 660 26.922 4.065 -7.561 490 HB3 LEU 660 HB1 LEU 660 26.586 5.483 -8.530 491 HG LEU 660 HG LEU 660 24.705 4.257 -6.513 492 HD11 LEU 660 HD11 LEU 660 26.657 5.308 -5.495 493 HD12 LEU 660 HD12 LEU 660 25.190 6.230 -5.178 494 HD13 LEU 660 HD13 LEU 660 26.335 6.787 -6.399 495 HD21 LEU 660 HD21 LEU 660 23.381 6.300 -6.862 496 HD22 LEU 660 HD22 LEU 660 23.492 5.331 -8.330 497 HD23 LEU 660 HD23 LEU 660 24.478 6.783 -8.155 498 H GLN 661 HN GLN 661 26.866 1.555 -9.664 499 HA GLN 661 HA GLN 661 28.899 2.935 -11.211 500 HB2 GLN 661 HB2 GLN 661 28.654 0.071 -10.286 501 HB3 GLN 661 HB1 GLN 661 29.951 0.642 -11.326 502 HG2 GLN 661 HG2 GLN 661 30.680 2.187 -9.585 503 HG3 GLN 661 HG1 GLN 661 29.362 1.643 -8.546 504 HE21 GLN 661 HE21 GLN 661 32.215 1.571 -8.101 505 HE22 GLN 661 HE22 GLN 661 32.630 -0.093 -7.840 506 H GLU 662 HN GLU 662 26.488 0.364 -11.616 507 HA GLU 662 HA GLU 662 27.049 0.069 -14.400 508 HB2 GLU 662 HB2 GLU 662 24.644 -0.888 -12.841 509 HB3 GLU 662 HB1 GLU 662 25.108 -1.416 -14.453 510 HG2 GLU 662 HG2 GLU 662 27.291 -2.183 -13.406 511 HG3 GLU 662 HG1 GLU 662 26.504 -1.941 -11.849 512 H THR 663 HN THR 663 25.198 2.294 -12.605 513 HA THR 663 HA THR 663 23.591 3.007 -14.941 514 HB THR 663 HB THR 663 22.475 4.624 -13.350 515 HG1 THR 663 HG1 THR 663 23.662 3.103 -11.281 516 HG21 THR 663 HG21 THR 663 21.475 2.452 -13.885 517 HG22 THR 663 HG22 THR 663 21.178 2.880 -12.200 518 HG23 THR 663 HG23 THR 663 22.420 1.695 -12.603 519 H GLN 664 HN GLN 664 26.587 3.652 -13.892 520 HA GLN 664 HA GLN 664 28.147 5.250 -14.299 521 HB2 GLN 664 HB2 GLN 664 26.993 4.995 -16.592 522 HB3 GLN 664 HB1 GLN 664 26.205 6.521 -16.223 523 HG2 GLN 664 HG2 GLN 664 28.143 6.872 -17.622 524 HG3 GLN 664 HG1 GLN 664 28.388 7.602 -16.037 525 HE21 GLN 664 HE21 GLN 664 30.618 7.571 -16.322 526 HE22 GLN 664 HE22 GLN 664 31.539 6.114 -16.200 527 H GLY 665 HN GLY 665 26.348 5.675 -12.146 528 HA2 GLY 665 HA2 GLY 665 26.551 7.500 -10.596 529 HA3 GLY 665 HA1 GLY 665 26.457 8.616 -11.950 530 H GLY 666 HN GLY 666 24.276 6.798 -13.043 531 HA2 GLY 666 HA2 GLY 666 21.991 6.789 -13.096 532 HA3 GLY 666 HA1 GLY 666 22.088 6.633 -11.350 533 H ARG 667 HN ARG 667 20.568 7.957 -10.640 534 HA ARG 667 HA ARG 667 19.875 10.419 -11.847 535 HB2 ARG 667 HB2 ARG 667 18.450 10.764 -9.888 536 HB3 ARG 667 HB1 ARG 667 18.276 9.136 -10.518 537 HG2 ARG 667 HG2 ARG 667 19.780 8.318 -8.743 538 HG3 ARG 667 HG1 ARG 667 19.867 9.956 -8.094 539 HD2 ARG 667 HD2 ARG 667 17.370 8.289 -8.376 540 HD3 ARG 667 HD1 ARG 667 18.246 8.586 -6.877 541 HE ARG 667 HE ARG 667 17.344 10.962 -8.256 542 HH11 ARG 667 HH11 ARG 667 16.604 8.525 -5.829 543 HH12 ARG 667 HH12 ARG 667 15.403 9.493 -5.044 544 HH21 ARG 667 HH21 ARG 667 15.766 12.269 -7.218 545 HH22 ARG 667 HH22 ARG 667 14.924 11.646 -5.833 546 H TYR 668 HN TYR 668 22.225 9.557 -9.437 547 HA TYR 668 HA TYR 668 22.479 12.143 -8.292 548 HB2 TYR 668 HB2 TYR 668 24.137 9.650 -8.164 549 HB3 TYR 668 HB1 TYR 668 24.748 11.162 -7.493 550 HD1 TYR 668 HD1 TYR 668 22.089 8.601 -7.200 551 HD2 TYR 668 HD2 TYR 668 23.859 12.071 -5.478 552 HE1 TYR 668 HE1 TYR 668 20.780 8.257 -5.161 553 HE2 TYR 668 HE2 TYR 668 22.561 11.719 -3.424 554 HH TYR 668 HH TYR 668 20.470 10.600 -2.747 555 H ALA 669 HN ALA 669 23.672 10.732 -11.170 556 HA ALA 669 HA ALA 669 25.875 12.531 -11.517 557 HB1 ALA 669 HB1 ALA 669 25.940 11.667 -13.814 558 HB2 ALA 669 HB2 ALA 669 24.412 10.830 -13.538 559 HB3 ALA 669 HB3 ALA 669 25.850 10.364 -12.631 560 H GLN 670 HN GLN 670 22.543 12.862 -11.701 561 HA GLN 670 HA GLN 670 22.664 15.007 -13.676 562 HB2 GLN 670 HB2 GLN 670 20.278 13.733 -12.337 563 HB3 GLN 670 HB1 GLN 670 20.209 14.955 -13.598 564 HG2 GLN 670 HG2 GLN 670 21.310 12.167 -13.864 565 HG3 GLN 670 HG1 GLN 670 19.792 12.767 -14.526 566 HE21 GLN 670 HE21 GLN 670 22.045 11.582 -15.907 567 HE22 GLN 670 HE22 GLN 670 22.587 12.752 -17.059 568 H GLY 671 HN GLY 671 23.042 14.668 -10.425 569 HA2 GLY 671 HA2 GLY 671 23.467 16.553 -9.036 570 HA3 GLY 671 HA1 GLY 671 22.341 17.488 -10.007 571 H GLU 672 HN GLU 672 21.126 14.452 -9.312 572 HA GLU 672 HA GLU 672 19.017 15.471 -7.732 573 HB2 GLU 672 HB2 GLU 672 19.889 12.726 -8.538 574 HB3 GLU 672 HB1 GLU 672 18.585 12.945 -7.381 575 HG2 GLU 672 HG2 GLU 672 18.580 14.263 -10.071 576 HG3 GLU 672 HG1 GLU 672 17.938 12.642 -9.806 577 H ASN 673 HN ASN 673 19.225 16.113 -5.710 578 HA ASN 673 HA ASN 673 21.036 14.687 -3.910 579 HB2 ASN 673 HB2 ASN 673 20.822 16.515 -2.393 580 HB3 ASN 673 HB1 ASN 673 20.943 17.253 -3.983 581 HD21 ASN 673 HD21 ASN 673 19.145 18.299 -4.848 582 HD22 ASN 673 HD22 ASN 673 17.763 18.697 -3.892 583 H PHE 674 HN PHE 674 20.186 13.946 -1.808 584 HA PHE 674 HA PHE 674 17.302 13.470 -1.837 585 HB2 PHE 674 HB2 PHE 674 18.579 11.561 -2.967 586 HB3 PHE 674 HB1 PHE 674 19.214 11.189 -1.370 587 HD1 PHE 674 HD1 PHE 674 16.056 11.576 -3.275 588 HD2 PHE 674 HD2 PHE 674 17.984 9.858 0.107 589 HE1 PHE 674 HE1 PHE 674 14.050 10.231 -2.817 590 HE2 PHE 674 HE2 PHE 674 15.975 8.513 0.568 591 HZ PHE 674 HZ PHE 674 14.006 8.699 -0.895 592 H VAL 675 HN VAL 675 16.376 13.255 0.140 593 HA VAL 675 HA VAL 675 18.148 13.471 2.466 594 HB VAL 675 HB VAL 675 16.260 14.693 3.604 595 HG11 VAL 675 HG11 VAL 675 16.684 16.850 2.491 596 HG12 VAL 675 HG12 VAL 675 17.434 15.987 1.147 597 HG13 VAL 675 HG13 VAL 675 18.158 15.921 2.754 598 HG21 VAL 675 HG21 VAL 675 14.426 13.979 2.150 599 HG22 VAL 675 HG22 VAL 675 15.139 14.865 0.802 600 HG23 VAL 675 HG23 VAL 675 14.532 15.739 2.209 601 H VAL 676 HN VAL 676 17.983 11.889 3.898 602 HA VAL 676 HA VAL 676 15.658 10.096 3.712 603 HB VAL 676 HB VAL 676 18.428 9.494 4.784 604 HG11 VAL 676 HG11 VAL 676 16.068 7.662 4.341 605 HG12 VAL 676 HG12 VAL 676 16.688 8.194 5.905 606 HG13 VAL 676 HG13 VAL 676 17.678 7.168 4.867 607 HG21 VAL 676 HG21 VAL 676 18.407 9.783 2.359 608 HG22 VAL 676 HG22 VAL 676 17.100 8.606 2.229 609 HG23 VAL 676 HG23 VAL 676 18.688 8.099 2.800 610 H ASN 677 HN ASN 677 14.358 9.920 5.418 611 HA ASN 677 HA ASN 677 15.142 11.259 7.907 612 HB2 ASN 677 HB2 ASN 677 12.415 10.315 6.989 613 HB3 ASN 677 HB1 ASN 677 12.745 11.188 8.481 614 HD21 ASN 677 HD21 ASN 677 13.306 13.373 8.374 615 HD22 ASN 677 HD22 ASN 677 12.972 14.317 6.960 616 H ASP 678 HN ASP 678 14.184 8.190 6.571 617 HA ASP 678 HA ASP 678 15.209 6.787 8.874 618 HB2 ASP 678 HB2 ASP 678 12.853 7.238 9.525 619 HB3 ASP 678 HB1 ASP 678 12.307 6.453 8.048 620 H ILE 679 HN ILE 679 16.347 5.135 8.064 621 HA ILE 679 HA ILE 679 16.377 4.519 5.306 622 HB ILE 679 HB ILE 679 17.913 2.669 5.886 623 HG12 ILE 679 HG12 ILE 679 17.530 3.547 8.755 624 HG13 ILE 679 HG11 ILE 679 16.779 2.115 8.065 625 HG21 ILE 679 HG21 ILE 679 18.791 4.901 5.548 626 HG22 ILE 679 HG22 ILE 679 19.700 4.073 6.812 627 HG23 ILE 679 HG23 ILE 679 18.503 5.294 7.243 628 HD11 ILE 679 HD11 ILE 679 18.762 1.548 9.337 629 HD12 ILE 679 HD12 ILE 679 19.736 2.613 8.322 630 HD13 ILE 679 HD13 ILE 679 18.986 1.174 7.628 631 H TYR 680 HN TYR 680 14.501 3.227 7.873 632 HA TYR 680 HA TYR 680 14.026 0.682 6.581 633 HB2 TYR 680 HB2 TYR 680 14.216 0.790 9.010 634 HB3 TYR 680 HB1 TYR 680 12.899 1.948 9.085 635 HD1 TYR 680 HD1 TYR 680 13.747 -1.568 8.323 636 HD2 TYR 680 HD2 TYR 680 10.654 1.224 9.170 637 HE1 TYR 680 HE1 TYR 680 12.162 -3.425 8.646 638 HE2 TYR 680 HE2 TYR 680 9.063 -0.616 9.491 639 HH TYR 680 HH TYR 680 10.059 -3.871 9.770 640 H GLN 681 HN GLN 681 12.200 3.593 7.427 641 HA GLN 681 HA GLN 681 9.774 2.723 6.193 642 HB2 GLN 681 HB2 GLN 681 10.620 5.523 6.910 643 HB3 GLN 681 HB1 GLN 681 8.980 4.992 6.566 644 HG2 GLN 681 HG2 GLN 681 9.047 3.541 8.531 645 HG3 GLN 681 HG1 GLN 681 10.685 4.093 8.876 646 HE21 GLN 681 HE21 GLN 681 9.989 6.836 7.971 647 HE22 GLN 681 HE22 GLN 681 9.096 7.523 9.280 648 H VAL 682 HN VAL 682 12.577 4.457 5.024 649 HA VAL 682 HA VAL 682 11.330 5.579 2.725 650 HB VAL 682 HB VAL 682 13.497 6.417 3.636 651 HG11 VAL 682 HG11 VAL 682 14.548 4.283 4.127 652 HG12 VAL 682 HG12 VAL 682 15.571 5.265 3.078 653 HG13 VAL 682 HG13 VAL 682 14.646 3.922 2.404 654 HG21 VAL 682 HG21 VAL 682 13.611 5.546 0.755 655 HG22 VAL 682 HG22 VAL 682 14.570 6.837 1.480 656 HG23 VAL 682 HG23 VAL 682 12.816 7.000 1.363 657 H GLY 683 HN GLY 683 12.473 2.425 3.464 658 HA2 GLY 683 HA2 GLY 683 11.816 0.548 2.211 659 HA3 GLY 683 HA1 GLY 683 11.616 1.587 0.811 660 H HIS 684 HN HIS 684 14.531 1.687 2.748 661 HA HIS 684 HA HIS 684 16.190 1.071 0.536 662 HB2 HIS 684 HB2 HIS 684 16.642 1.377 3.470 663 HB3 HIS 684 HB1 HIS 684 17.868 0.519 2.548 664 HD2 HIS 684 HD2 HIS 684 17.652 3.855 3.828 665 HE1 HIS 684 HE1 HIS 684 19.067 4.505 -0.116 666 HE2 HIS 684 HE2 HIS 684 19.030 5.369 2.244 667 H SER 685 HN SER 685 17.071 -0.811 -0.166 668 HA SER 685 HA SER 685 15.846 -3.257 0.517 669 HB2 SER 685 HB2 SER 685 18.456 -2.758 -0.942 670 HB3 SER 685 HB1 SER 685 17.547 -4.268 -0.947 671 HG SER 685 HG SER 685 16.714 -1.747 -1.979 672 HA PRO 686 HA PRO 686 17.824 -4.984 4.075 673 HB2 PRO 686 HB2 PRO 686 19.027 -7.230 2.754 674 HB3 PRO 686 HB1 PRO 686 17.556 -7.205 3.728 675 HG2 PRO 686 HG2 PRO 686 17.868 -7.109 0.788 676 HG3 PRO 686 HG1 PRO 686 16.495 -7.669 1.756 677 HD2 PRO 686 HD2 PRO 686 16.407 -5.367 0.379 678 HD3 PRO 686 HD1 PRO 686 15.613 -5.537 1.958 679 H CYS 687 HN CYS 687 19.835 -5.141 1.138 680 HA CYS 687 HA CYS 687 22.348 -5.315 2.263 681 HB2 CYS 687 HB2 CYS 687 22.298 -5.487 -0.062 682 HB3 CYS 687 HB1 CYS 687 21.324 -4.032 -0.247 683 H HIS 688 HN HIS 688 20.491 -2.354 1.604 684 HA HIS 688 HA HIS 688 22.556 -0.648 2.578 685 HB2 HIS 688 HB2 HIS 688 19.797 -0.265 1.560 686 HB3 HIS 688 HB1 HIS 688 20.449 0.997 2.600 687 HD1 HIS 688 HD1 HIS 688 20.144 0.287 -0.854 688 HD2 HIS 688 HD2 HIS 688 23.263 1.657 1.558 689 HE1 HIS 688 HE1 HIS 688 21.742 1.432 -2.388 690 H ILE 689 HN ILE 689 19.816 -2.234 3.981 691 HA ILE 689 HA ILE 689 19.654 -0.640 6.309 692 HB ILE 689 HB ILE 689 18.821 -3.529 5.918 693 HG12 ILE 689 HG12 ILE 689 17.213 -0.967 5.732 694 HG13 ILE 689 HG11 ILE 689 17.718 -1.956 4.369 695 HG21 ILE 689 HG21 ILE 689 17.359 -3.171 7.863 696 HG22 ILE 689 HG22 ILE 689 18.043 -1.559 8.074 697 HG23 ILE 689 HG23 ILE 689 19.062 -2.983 8.284 698 HD11 ILE 689 HD11 ILE 689 15.390 -2.344 4.913 699 HD12 ILE 689 HD12 ILE 689 15.830 -2.789 6.562 700 HD13 ILE 689 HD13 ILE 689 16.342 -3.799 5.210 701 H GLU 690 HN GLU 690 21.349 -3.647 5.542 702 HA GLU 690 HA GLU 690 22.376 -4.204 8.097 703 HB2 GLU 690 HB2 GLU 690 23.621 -4.852 5.419 704 HB3 GLU 690 HB1 GLU 690 24.002 -5.625 6.949 705 HG2 GLU 690 HG2 GLU 690 21.347 -5.732 5.535 706 HG3 GLU 690 HG1 GLU 690 22.560 -7.008 5.554 707 H ILE 691 HN ILE 691 23.587 -2.180 5.501 708 HA ILE 691 HA ILE 691 26.143 -1.738 6.703 709 HB ILE 691 HB ILE 691 24.807 -0.157 4.500 710 HG12 ILE 691 HG12 ILE 691 26.783 -2.445 4.329 711 HG13 ILE 691 HG11 ILE 691 25.063 -2.565 3.970 712 HG21 ILE 691 HG21 ILE 691 27.089 0.547 3.934 713 HG22 ILE 691 HG22 ILE 691 27.702 -0.325 5.338 714 HG23 ILE 691 HG23 ILE 691 26.634 1.062 5.557 715 HD11 ILE 691 HD11 ILE 691 25.342 -0.996 2.120 716 HD12 ILE 691 HD12 ILE 691 26.387 -2.403 1.938 717 HD13 ILE 691 HD13 ILE 691 27.063 -0.870 2.485 718 H LEU 692 HN LEU 692 23.276 0.359 6.302 719 HA LEU 692 HA LEU 692 24.450 2.578 7.610 720 HB2 LEU 692 HB2 LEU 692 21.636 1.906 6.858 721 HB3 LEU 692 HB1 LEU 692 21.936 3.264 7.922 722 HG LEU 692 HG LEU 692 21.675 4.017 5.625 723 HD11 LEU 692 HD11 LEU 692 24.530 4.285 6.544 724 HD12 LEU 692 HD12 LEU 692 23.168 5.258 7.097 725 HD13 LEU 692 HD13 LEU 692 23.686 5.345 5.415 726 HD21 LEU 692 HD21 LEU 692 23.314 3.442 3.896 727 HD22 LEU 692 HD22 LEU 692 22.422 2.022 4.442 728 HD23 LEU 692 HD23 LEU 692 24.074 2.294 4.998 729 H GLU 693 HN GLU 693 22.609 -0.129 8.865 730 HA GLU 693 HA GLU 693 22.138 0.926 11.438 731 HB2 GLU 693 HB2 GLU 693 22.348 -1.899 10.415 732 HB3 GLU 693 HB1 GLU 693 22.025 -1.543 12.106 733 HG2 GLU 693 HG2 GLU 693 20.325 -0.443 9.892 734 HG3 GLU 693 HG1 GLU 693 20.032 -2.028 10.602 735 H GLN 694 HN GLN 694 24.928 -0.648 10.013 736 HA GLN 694 HA GLN 694 26.303 -1.153 12.444 737 HB2 GLN 694 HB2 GLN 694 27.267 -0.911 9.601 738 HB3 GLN 694 HB1 GLN 694 28.339 -1.289 10.942 739 HG2 GLN 694 HG2 GLN 694 25.957 -2.905 10.071 740 HG3 GLN 694 HG1 GLN 694 27.650 -3.296 9.767 741 HE21 GLN 694 HE21 GLN 694 28.947 -3.965 11.483 742 HE22 GLN 694 HE22 GLN 694 28.269 -4.544 12.966 743 H PHE 695 HN PHE 695 26.051 1.638 10.381 744 HA PHE 695 HA PHE 695 28.137 3.031 11.863 745 HB2 PHE 695 HB2 PHE 695 26.398 3.913 9.546 746 HB3 PHE 695 HB1 PHE 695 27.595 4.940 10.319 747 HD1 PHE 695 HD1 PHE 695 27.037 2.146 8.058 748 HD2 PHE 695 HD2 PHE 695 29.996 4.490 10.032 749 HE1 PHE 695 HE1 PHE 695 28.753 1.269 6.527 750 HE2 PHE 695 HE2 PHE 695 31.715 3.608 8.491 751 HZ PHE 695 HZ PHE 695 31.088 1.999 6.746 752 H GLU 696 HN GLU 696 25.037 2.273 12.391 753 HA GLU 696 HA GLU 696 23.336 2.995 13.682 754 HB2 GLU 696 HB2 GLU 696 25.301 3.162 15.301 755 HB3 GLU 696 HB1 GLU 696 25.302 4.889 14.978 756 HG2 GLU 696 HG2 GLU 696 23.151 5.164 15.935 757 HG3 GLU 696 HG1 GLU 696 22.878 3.422 15.987 758 H VAL 697 HN VAL 697 23.365 4.074 11.246 759 HA VAL 697 HA VAL 697 22.535 6.861 11.687 760 HB VAL 697 HB VAL 697 23.683 5.566 9.194 761 HG11 VAL 697 HG11 VAL 697 22.636 8.371 9.560 762 HG12 VAL 697 HG12 VAL 697 21.925 7.103 8.560 763 HG13 VAL 697 HG13 VAL 697 23.502 7.773 8.143 764 HG21 VAL 697 HG21 VAL 697 25.483 7.214 9.464 765 HG22 VAL 697 HG22 VAL 697 25.362 6.136 10.855 766 HG23 VAL 697 HG23 VAL 697 24.731 7.781 10.955 767 H LYS 698 HN LYS 698 20.474 7.394 11.021 768 HA LYS 698 HA LYS 698 18.942 5.314 9.610 769 HB2 LYS 698 HB2 LYS 698 18.453 5.741 12.137 770 HB3 LYS 698 HB1 LYS 698 17.667 7.200 11.561 771 HG2 LYS 698 HG2 LYS 698 15.836 6.047 11.118 772 HG3 LYS 698 HG1 LYS 698 16.731 5.035 9.986 773 HD2 LYS 698 HD2 LYS 698 16.536 4.586 12.966 774 HD3 LYS 698 HD1 LYS 698 15.633 3.701 11.735 775 HE2 LYS 698 HE2 LYS 698 17.663 2.788 10.827 776 HE3 LYS 698 HE1 LYS 698 18.646 3.789 11.889 777 HZ1 LYS 698 HZ1 LYS 698 18.484 1.512 12.668 778 HZ2 LYS 698 HZ2 LYS 698 16.795 1.646 12.784 779 HZ3 LYS 698 HZ3 LYS 698 17.789 2.581 13.781 780 H ALA 699 HN ALA 699 19.479 8.721 10.224 781 HA ALA 699 HA ALA 699 18.100 9.336 7.713 782 HB1 ALA 699 HB1 ALA 699 16.901 10.241 9.641 783 HB2 ALA 699 HB2 ALA 699 17.584 11.528 8.647 784 HB3 ALA 699 HB3 ALA 699 18.365 11.073 10.163 785 H TYR 700 HN TYR 700 19.048 10.975 6.440 786 HA TYR 700 HA TYR 700 21.456 12.244 7.076 787 HB2 TYR 700 HB2 TYR 700 22.992 11.032 5.537 788 HB3 TYR 700 HB1 TYR 700 22.506 10.076 6.927 789 HD1 TYR 700 HD1 TYR 700 22.169 10.481 3.289 790 HD2 TYR 700 HD2 TYR 700 21.213 8.053 6.646 791 HE1 TYR 700 HE1 TYR 700 21.519 8.657 1.778 792 HE2 TYR 700 HE2 TYR 700 20.558 6.221 5.143 793 HH TYR 700 HH TYR 700 21.337 6.215 1.854 794 H VAL 701 HN VAL 701 22.510 13.107 5.021 795 HA VAL 701 HA VAL 701 20.542 13.558 2.912 796 HB VAL 701 HB VAL 701 20.190 15.441 4.406 797 HG11 VAL 701 HG11 VAL 701 22.282 15.393 5.628 798 HG12 VAL 701 HG12 VAL 701 21.984 17.009 4.983 799 HG13 VAL 701 HG13 VAL 701 23.154 15.948 4.197 800 HG21 VAL 701 HG21 VAL 701 20.695 17.313 2.908 801 HG22 VAL 701 HG22 VAL 701 20.100 15.916 2.011 802 HG23 VAL 701 HG23 VAL 701 21.820 16.293 2.012 803 H ILE 702 HN ILE 702 21.440 13.755 0.902 804 HA ILE 702 HA ILE 702 24.388 13.818 0.757 805 HB ILE 702 HB ILE 702 22.599 12.114 -0.985 806 HG12 ILE 702 HG12 ILE 702 24.452 11.238 1.240 807 HG13 ILE 702 HG11 ILE 702 22.695 11.284 1.348 808 HG21 ILE 702 HG21 ILE 702 24.630 12.857 -2.100 809 HG22 ILE 702 HG22 ILE 702 24.706 11.128 -1.767 810 HG23 ILE 702 HG23 ILE 702 25.606 12.260 -0.759 811 HD11 ILE 702 HD11 ILE 702 24.294 9.596 -0.558 812 HD12 ILE 702 HD12 ILE 702 22.536 9.622 -0.419 813 HD13 ILE 702 HD13 ILE 702 23.520 9.035 0.923 814 H VAL 703 HN VAL 703 25.087 15.436 -0.474 815 HA VAL 703 HA VAL 703 23.434 16.237 -2.770 816 HB VAL 703 HB VAL 703 24.357 18.529 -2.584 817 HG11 VAL 703 HG11 VAL 703 22.948 17.555 -0.105 818 HG12 VAL 703 HG12 VAL 703 22.194 18.088 -1.608 819 HG13 VAL 703 HG13 VAL 703 23.076 19.241 -0.607 820 HG21 VAL 703 HG21 VAL 703 25.540 17.564 0.022 821 HG22 VAL 703 HG22 VAL 703 25.509 19.239 -0.536 822 HG23 VAL 703 HG23 VAL 703 26.438 18.031 -1.424 823 HA PRO 704 HA PRO 704 27.073 15.133 -5.052 824 HB2 PRO 704 HB2 PRO 704 26.291 15.920 -7.497 825 HB3 PRO 704 HB1 PRO 704 25.558 14.527 -6.690 826 HG2 PRO 704 HG2 PRO 704 24.519 17.313 -6.979 827 HG3 PRO 704 HG1 PRO 704 23.646 15.774 -7.078 828 HD2 PRO 704 HD2 PRO 704 23.692 17.407 -4.852 829 HD3 PRO 704 HD1 PRO 704 23.350 15.666 -4.819 830 H VAL 705 HN VAL 705 28.969 16.090 -5.512 831 HA VAL 705 HA VAL 705 29.033 19.020 -5.556 832 HB VAL 705 HB VAL 705 31.297 17.057 -5.124 833 HG11 VAL 705 HG11 VAL 705 32.620 18.979 -4.466 834 HG12 VAL 705 HG12 VAL 705 31.254 20.052 -4.770 835 HG13 VAL 705 HG13 VAL 705 32.017 19.195 -6.109 836 HG21 VAL 705 HG21 VAL 705 29.713 17.007 -3.276 837 HG22 VAL 705 HG22 VAL 705 29.789 18.764 -3.142 838 HG23 VAL 705 HG23 VAL 705 31.213 17.791 -2.777 839 H PHE 706 HN PHE 706 28.902 19.782 -7.582 840 HA PHE 706 HA PHE 706 30.187 18.377 -9.774 841 HB2 PHE 706 HB2 PHE 706 28.441 20.831 -9.674 842 HB3 PHE 706 HB1 PHE 706 29.224 20.278 -11.149 843 HD1 PHE 706 HD1 PHE 706 26.465 19.834 -8.889 844 HD2 PHE 706 HD2 PHE 706 28.640 18.040 -12.074 845 HE1 PHE 706 HE1 PHE 706 24.583 18.315 -9.314 846 HE2 PHE 706 HE2 PHE 706 26.759 16.515 -12.506 847 HZ PHE 706 HZ PHE 706 24.728 16.651 -11.127 848 H ALA 707 HN ALA 707 32.238 18.717 -10.228 849 HA ALA 707 HA ALA 707 33.310 21.418 -9.823 850 HB1 ALA 707 HB1 ALA 707 35.431 20.439 -9.060 851 HB2 ALA 707 HB2 ALA 707 34.710 18.833 -9.132 852 HB3 ALA 707 HB3 ALA 707 34.101 20.023 -7.983 853 H GLY 708 HN GLY 708 33.815 22.191 -11.733 854 HA2 GLY 708 HA2 GLY 708 35.003 22.337 -13.715 855 HA3 GLY 708 HA1 GLY 708 35.500 20.664 -13.506 856 H GLU 709 HN GLU 709 34.422 19.084 -14.536 857 HA GLU 709 HA GLU 709 32.302 19.980 -16.369 858 HB2 GLU 709 HB2 GLU 709 34.137 17.601 -16.629 859 HB3 GLU 709 HB1 GLU 709 32.961 18.139 -17.819 860 HG2 GLU 709 HG2 GLU 709 34.203 20.211 -18.123 861 HG3 GLU 709 HG1 GLU 709 35.376 19.689 -16.914 862 H GLN 710 HN GLN 710 33.246 17.294 -14.258 863 HA GLN 710 HA GLN 710 30.450 16.372 -14.319 864 HB2 GLN 710 HB2 GLN 710 32.989 14.746 -14.022 865 HB3 GLN 710 HB1 GLN 710 31.378 14.099 -13.762 866 HG2 GLN 710 HG2 GLN 710 30.804 14.516 -16.078 867 HG3 GLN 710 HG1 GLN 710 32.377 15.263 -16.354 868 HE21 GLN 710 HE21 GLN 710 34.195 13.970 -16.514 869 HE22 GLN 710 HE22 GLN 710 34.102 12.255 -16.717 870 H LEU 711 HN LEU 711 30.196 14.828 -12.236 871 HA LEU 711 HA LEU 711 30.752 16.592 -10.033 872 HB2 LEU 711 HB2 LEU 711 29.349 15.190 -8.691 873 HB3 LEU 711 HB1 LEU 711 28.543 15.515 -10.208 874 HG LEU 711 HG LEU 711 30.083 12.995 -10.062 875 HD11 LEU 711 HD11 LEU 711 28.300 11.867 -8.841 876 HD12 LEU 711 HD12 LEU 711 27.487 13.416 -8.593 877 HD13 LEU 711 HD13 LEU 711 29.063 13.119 -7.855 878 HD21 LEU 711 HD21 LEU 711 27.384 13.819 -11.134 879 HD22 LEU 711 HD22 LEU 711 28.057 12.197 -11.272 880 HD23 LEU 711 HD23 LEU 711 28.854 13.553 -12.069 881 H TRP 712 HN TRP 712 32.112 16.265 -8.440 882 HA TRP 712 HA TRP 712 34.249 14.380 -8.943 883 HB2 TRP 712 HB2 TRP 712 34.931 16.588 -8.437 884 HB3 TRP 712 HB1 TRP 712 33.848 16.674 -7.055 885 HD1 TRP 712 HD1 TRP 712 37.157 14.959 -8.108 886 HE1 TRP 712 HE1 TRP 712 38.524 14.497 -5.980 887 HE3 TRP 712 HE3 TRP 712 33.730 16.429 -4.612 888 HZ2 TRP 712 HZ2 TRP 712 38.188 14.720 -3.173 889 HZ3 TRP 712 HZ3 TRP 712 34.329 16.274 -2.229 890 HH2 TRP 712 HH2 TRP 712 36.500 15.443 -1.525 891 H GLY 713 HN GLY 713 31.982 15.160 -6.328 892 HA2 GLY 713 HA2 GLY 713 32.174 12.457 -5.365 893 HA3 GLY 713 HA1 GLY 713 32.871 13.677 -4.315 894 H LEU 714 HN LEU 714 31.303 12.819 -2.882 895 HA LEU 714 HA LEU 714 28.653 14.026 -3.227 896 HB2 LEU 714 HB2 LEU 714 29.220 11.301 -2.047 897 HB3 LEU 714 HB1 LEU 714 27.694 12.138 -1.882 898 HG LEU 714 HG LEU 714 28.910 11.102 -4.434 899 HD11 LEU 714 HD11 LEU 714 27.976 9.360 -3.046 900 HD12 LEU 714 HD12 LEU 714 26.933 9.638 -4.441 901 HD13 LEU 714 HD13 LEU 714 26.479 10.273 -2.860 902 HD21 LEU 714 HD21 LEU 714 27.754 13.166 -4.915 903 HD22 LEU 714 HD22 LEU 714 26.355 12.642 -3.979 904 HD23 LEU 714 HD23 LEU 714 26.776 11.811 -5.477 905 H LEU 715 HN LEU 715 27.922 15.086 -1.489 906 HA LEU 715 HA LEU 715 29.663 15.066 0.883 907 HB2 LEU 715 HB2 LEU 715 29.595 17.224 -0.331 908 HB3 LEU 715 HB1 LEU 715 27.857 17.270 -0.128 909 HG LEU 715 HG LEU 715 28.150 17.438 2.312 910 HD11 LEU 715 HD11 LEU 715 30.373 17.876 3.238 911 HD12 LEU 715 HD12 LEU 715 31.090 17.550 1.660 912 HD13 LEU 715 HD13 LEU 715 30.263 16.262 2.537 913 HD21 LEU 715 HD21 LEU 715 29.018 19.724 2.345 914 HD22 LEU 715 HD22 LEU 715 27.950 19.465 0.965 915 HD23 LEU 715 HD23 LEU 715 29.698 19.492 0.735 916 H ALA 716 HN ALA 716 28.748 13.744 2.315 917 HA ALA 716 HA ALA 716 25.838 13.936 2.667 918 HB1 ALA 716 HB1 ALA 716 26.524 11.807 1.664 919 HB2 ALA 716 HB2 ALA 716 25.825 11.586 3.268 920 HB3 ALA 716 HB3 ALA 716 27.574 11.500 3.048 921 H ALA 717 HN ALA 717 25.035 13.943 4.698 922 HA ALA 717 HA ALA 717 26.971 14.010 6.901 923 HB1 ALA 717 HB1 ALA 717 26.343 16.310 6.349 924 HB2 ALA 717 HB2 ALA 717 25.741 15.842 7.938 925 HB3 ALA 717 HB3 ALA 717 24.639 15.899 6.560 926 H TYR 718 HN TYR 718 26.423 12.851 8.619 927 HA TYR 718 HA TYR 718 23.701 11.686 8.719 928 HB2 TYR 718 HB2 TYR 718 26.054 10.228 9.859 929 HB3 TYR 718 HB1 TYR 718 24.551 9.584 9.221 930 HD1 TYR 718 HD1 TYR 718 27.930 10.729 8.406 931 HD2 TYR 718 HD2 TYR 718 24.323 9.116 6.830 932 HE1 TYR 718 HE1 TYR 718 29.108 10.135 6.338 933 HE2 TYR 718 HE2 TYR 718 25.494 8.520 4.751 934 HH TYR 718 HH TYR 718 28.930 8.666 4.494 935 H GLN 719 HN GLN 719 22.952 11.209 10.934 936 HA GLN 719 HA GLN 719 24.699 12.103 13.058 937 HB2 GLN 719 HB2 GLN 719 22.991 13.654 14.014 938 HB3 GLN 719 HB1 GLN 719 23.701 14.197 12.505 939 HG2 GLN 719 HG2 GLN 719 21.698 13.429 11.300 940 HG3 GLN 719 HG1 GLN 719 20.986 12.936 12.834 941 HE21 GLN 719 HE21 GLN 719 20.353 14.524 14.309 942 HE22 GLN 719 HE22 GLN 719 20.100 16.168 13.834 943 H ASN 720 HN ASN 720 24.696 10.106 13.950 944 HA ASN 720 HA ASN 720 23.800 8.185 14.936 945 HB2 ASN 720 HB2 ASN 720 23.122 8.864 17.318 946 HB3 ASN 720 HB1 ASN 720 24.716 9.351 16.758 947 HD21 ASN 720 HD21 ASN 720 25.147 11.524 16.404 948 HD22 ASN 720 HD22 ASN 720 24.100 12.776 16.966 949 H SER 721 HN SER 721 22.130 7.733 13.394 950 HA SER 721 HA SER 721 20.047 7.080 12.835 951 HB2 SER 721 HB2 SER 721 19.928 6.197 15.180 952 HB3 SER 721 HB1 SER 721 19.257 7.741 15.696 953 HG SER 721 HG SER 721 17.394 7.260 14.791 954 H GLY 722 HN GLY 722 19.021 9.540 15.184 955 HA2 GLY 722 HA2 GLY 722 17.942 11.538 14.940 956 HA3 GLY 722 HA1 GLY 722 18.972 11.767 13.540 957 H THR 723 HN THR 723 16.078 9.883 14.427 958 HA THR 723 HA THR 723 15.062 9.873 11.757 959 HB THR 723 HB THR 723 12.933 9.130 13.037 960 HG1 THR 723 HG1 THR 723 14.332 8.068 15.052 961 HG21 THR 723 HG21 THR 723 15.469 7.489 13.025 962 HG22 THR 723 HG22 THR 723 14.320 7.640 11.695 963 HG23 THR 723 HG23 THR 723 13.841 6.836 13.190 964 H ARG 724 HN ARG 724 15.509 12.460 12.367 965 HA ARG 724 HA ARG 724 12.890 13.654 12.910 966 HB2 ARG 724 HB2 ARG 724 14.152 15.797 13.220 967 HB3 ARG 724 HB1 ARG 724 14.543 14.543 14.379 968 HG2 ARG 724 HG2 ARG 724 16.608 15.518 13.850 969 HG3 ARG 724 HG1 ARG 724 16.576 14.039 12.894 970 HD2 ARG 724 HD2 ARG 724 16.097 15.231 10.902 971 HD3 ARG 724 HD1 ARG 724 15.710 16.701 11.791 972 HE ARG 724 HE ARG 724 18.449 15.679 11.941 973 HH11 ARG 724 HH11 ARG 724 16.188 18.050 10.660 974 HH12 ARG 724 HH12 ARG 724 17.423 19.185 10.216 975 HH21 ARG 724 HH21 ARG 724 20.109 17.210 11.326 976 HH22 ARG 724 HH22 ARG 724 19.627 18.712 10.596 977 H ASP 725 HN ASP 725 12.810 15.960 11.670 978 HA ASP 725 HA ASP 725 12.888 15.203 8.842 979 HB2 ASP 725 HB2 ASP 725 11.387 17.369 10.306 980 HB3 ASP 725 HB1 ASP 725 11.433 17.257 8.555 981 H TRP 726 HN TRP 726 13.702 16.606 7.256 982 HA TRP 726 HA TRP 726 15.856 18.327 8.234 983 HB2 TRP 726 HB2 TRP 726 15.325 17.236 5.456 984 HB3 TRP 726 HB1 TRP 726 16.730 18.184 5.932 985 HD1 TRP 726 HD1 TRP 726 15.261 14.672 6.176 986 HE1 TRP 726 HE1 TRP 726 17.076 13.062 7.029 987 HE3 TRP 726 HE3 TRP 726 18.868 18.092 7.381 988 HZ2 TRP 726 HZ2 TRP 726 19.691 13.223 8.079 989 HZ3 TRP 726 HZ3 TRP 726 20.998 17.279 8.304 990 HH2 TRP 726 HH2 TRP 726 21.399 14.895 8.645 991 H ASP 727 HN ASP 727 15.657 20.473 8.139 992 HA ASP 727 HA ASP 727 13.251 21.610 7.061 993 HB2 ASP 727 HB2 ASP 727 14.394 22.447 9.144 994 HB3 ASP 727 HB1 ASP 727 15.669 23.085 8.115 995 H GLU 728 HN GLU 728 13.071 23.033 5.453 996 HA GLU 728 HA GLU 728 14.442 22.646 3.070 997 HB2 GLU 728 HB2 GLU 728 12.279 23.748 3.111 998 HB3 GLU 728 HB1 GLU 728 12.977 25.140 3.931 999 HG2 GLU 728 HG2 GLU 728 14.296 25.684 2.002 1000 HG3 GLU 728 HG1 GLU 728 13.775 24.213 1.184 1001 H SER 729 HN SER 729 15.022 25.168 5.532 1002 HA SER 729 HA SER 729 17.055 26.498 4.144 1003 HB2 SER 729 HB2 SER 729 15.788 27.378 6.119 1004 HB3 SER 729 HB1 SER 729 16.717 26.287 7.144 1005 HG SER 729 HG SER 729 17.528 28.487 6.957 1006 H GLU 730 HN GLU 730 17.095 23.512 5.935 1007 HA GLU 730 HA GLU 730 19.918 23.529 6.482 1008 HB2 GLU 730 HB2 GLU 730 17.871 21.306 6.564 1009 HB3 GLU 730 HB1 GLU 730 19.558 21.092 7.004 1010 HG2 GLU 730 HG2 GLU 730 19.293 22.735 8.794 1011 HG3 GLU 730 HG1 GLU 730 17.598 22.930 8.357 1012 H VAL 731 HN VAL 731 17.821 21.795 4.207 1013 HA VAL 731 HA VAL 731 19.961 20.527 2.856 1014 HB VAL 731 HB VAL 731 17.656 19.637 2.810 1015 HG11 VAL 731 HG11 VAL 731 16.419 21.714 2.621 1016 HG12 VAL 731 HG12 VAL 731 15.970 20.599 1.329 1017 HG13 VAL 731 HG13 VAL 731 17.045 21.957 0.990 1018 HG21 VAL 731 HG21 VAL 731 19.236 18.908 1.109 1019 HG22 VAL 731 HG22 VAL 731 18.768 20.258 0.075 1020 HG23 VAL 731 HG23 VAL 731 17.604 18.986 0.445 1021 H THR 732 HN THR 732 18.502 23.686 2.520 1022 HA THR 732 HA THR 732 19.556 24.115 -0.118 1023 HB THR 732 HB THR 732 18.399 26.129 1.833 1024 HG1 THR 732 HG1 THR 732 16.773 24.713 1.397 1025 HG21 THR 732 HG21 THR 732 19.706 27.154 0.024 1026 HG22 THR 732 HG22 THR 732 17.984 27.473 -0.187 1027 HG23 THR 732 HG23 THR 732 18.779 26.242 -1.168 1028 H LEU 733 HN LEU 733 20.516 24.761 3.221 1029 HA LEU 733 HA LEU 733 22.570 26.613 2.582 1030 HB2 LEU 733 HB2 LEU 733 21.436 26.345 4.824 1031 HB3 LEU 733 HB1 LEU 733 22.297 24.838 5.023 1032 HG LEU 733 HG LEU 733 23.201 26.889 6.248 1033 HD11 LEU 733 HD11 LEU 733 25.547 26.267 5.857 1034 HD12 LEU 733 HD12 LEU 733 25.036 25.304 4.469 1035 HD13 LEU 733 HD13 LEU 733 24.496 24.871 6.090 1036 HD21 LEU 733 HD21 LEU 733 24.211 27.563 3.486 1037 HD22 LEU 733 HD22 LEU 733 24.660 28.372 4.986 1038 HD23 LEU 733 HD23 LEU 733 23.002 28.472 4.394 1039 H LEU 734 HN LEU 734 22.378 23.134 3.086 1040 HA LEU 734 HA LEU 734 25.134 22.593 2.899 1041 HB2 LEU 734 HB2 LEU 734 23.418 21.031 3.785 1042 HB3 LEU 734 HB1 LEU 734 22.823 20.801 2.154 1043 HG LEU 734 HG LEU 734 25.025 19.850 1.519 1044 HD11 LEU 734 HD11 LEU 734 26.583 19.194 3.289 1045 HD12 LEU 734 HD12 LEU 734 25.600 20.061 4.470 1046 HD13 LEU 734 HD13 LEU 734 26.415 20.945 3.180 1047 HD21 LEU 734 HD21 LEU 734 23.643 18.519 3.840 1048 HD22 LEU 734 HD22 LEU 734 24.717 17.723 2.688 1049 HD23 LEU 734 HD23 LEU 734 23.180 18.399 2.143 1050 H ALA 735 HN ALA 735 22.602 22.991 0.492 1051 HA ALA 735 HA ALA 735 24.053 22.006 -1.727 1052 HB1 ALA 735 HB1 ALA 735 21.808 24.030 -1.677 1053 HB2 ALA 735 HB2 ALA 735 21.608 22.279 -1.749 1054 HB3 ALA 735 HB3 ALA 735 22.370 23.133 -3.089 1055 H ARG 736 HN ARG 736 23.737 25.182 -0.230 1056 HA ARG 736 HA ARG 736 25.144 26.709 -2.105 1057 HB2 ARG 736 HB2 ARG 736 24.873 26.987 0.884 1058 HB3 ARG 736 HB1 ARG 736 25.710 28.169 -0.106 1059 HG2 ARG 736 HG2 ARG 736 22.807 27.402 -0.326 1060 HG3 ARG 736 HG1 ARG 736 23.449 28.881 0.390 1061 HD2 ARG 736 HD2 ARG 736 24.622 28.987 -2.028 1062 HD3 ARG 736 HD1 ARG 736 23.144 28.121 -2.445 1063 HE ARG 736 HE ARG 736 23.188 30.744 -1.103 1064 HH11 ARG 736 HH11 ARG 736 21.716 28.492 -3.364 1065 HH12 ARG 736 HH12 ARG 736 20.533 29.629 -3.906 1066 HH21 ARG 736 HH21 ARG 736 21.629 32.229 -1.825 1067 HH22 ARG 736 HH22 ARG 736 20.485 31.763 -3.038 1068 H ILE 737 HN ILE 737 26.290 25.047 0.809 1069 HA ILE 737 HA ILE 737 29.006 25.678 0.491 1070 HB ILE 737 HB ILE 737 27.515 23.636 2.096 1071 HG12 ILE 737 HG12 ILE 737 28.694 24.727 3.969 1072 HG13 ILE 737 HG11 ILE 737 29.587 25.722 2.829 1073 HG21 ILE 737 HG21 ILE 737 29.584 22.664 2.976 1074 HG22 ILE 737 HG22 ILE 737 30.515 23.576 1.789 1075 HG23 ILE 737 HG23 ILE 737 29.388 22.330 1.256 1076 HD11 ILE 737 HD11 ILE 737 27.520 26.802 2.144 1077 HD12 ILE 737 HD12 ILE 737 27.763 26.943 3.886 1078 HD13 ILE 737 HD13 ILE 737 26.607 25.774 3.246 1079 H GLY 738 HN GLY 738 27.062 23.015 -0.772 1080 HA2 GLY 738 HA2 GLY 738 29.151 21.425 -1.775 1081 HA3 GLY 738 HA1 GLY 738 27.510 21.464 -2.404 1082 H ASN 739 HN ASN 739 27.384 24.118 -3.246 1083 HA ASN 739 HA ASN 739 28.672 23.964 -5.770 1084 HB2 ASN 739 HB2 ASN 739 26.542 25.145 -5.487 1085 HB3 ASN 739 HB1 ASN 739 27.316 26.317 -4.426 1086 HD21 ASN 739 HD21 ASN 739 26.921 25.235 -7.694 1087 HD22 ASN 739 HD22 ASN 739 27.638 26.615 -8.450 1088 H GLN 740 HN GLN 740 29.234 25.980 -2.904 1089 HA GLN 740 HA GLN 740 31.403 27.456 -3.904 1090 HB2 GLN 740 HB2 GLN 740 30.800 26.638 -1.057 1091 HB3 GLN 740 HB1 GLN 740 31.960 27.873 -1.527 1092 HG2 GLN 740 HG2 GLN 740 30.186 29.221 -2.465 1093 HG3 GLN 740 HG1 GLN 740 29.006 27.968 -2.087 1094 HE21 GLN 740 HE21 GLN 740 27.805 29.312 -0.783 1095 HE22 GLN 740 HE22 GLN 740 28.339 29.827 0.776 1096 H LEU 741 HN LEU 741 31.232 24.349 -2.281 1097 HA LEU 741 HA LEU 741 34.000 23.961 -1.942 1098 HB2 LEU 741 HB2 LEU 741 32.137 22.719 -0.781 1099 HB3 LEU 741 HB1 LEU 741 31.864 21.845 -2.269 1100 HG LEU 741 HG LEU 741 33.169 20.645 -0.456 1101 HD11 LEU 741 HD11 LEU 741 34.441 20.927 -3.168 1102 HD12 LEU 741 HD12 LEU 741 33.138 19.825 -2.722 1103 HD13 LEU 741 HD13 LEU 741 34.743 19.620 -2.024 1104 HD21 LEU 741 HD21 LEU 741 35.544 21.134 -0.263 1105 HD22 LEU 741 HD22 LEU 741 34.579 22.526 0.228 1106 HD23 LEU 741 HD23 LEU 741 35.366 22.509 -1.352 1107 H GLY 742 HN GLY 742 31.744 23.114 -4.562 1108 HA2 GLY 742 HA2 GLY 742 33.507 21.615 -6.133 1109 HA3 GLY 742 HA1 GLY 742 32.128 22.527 -6.735 1110 H LEU 743 HN LEU 743 33.003 25.111 -5.921 1111 HA LEU 743 HA LEU 743 34.749 25.729 -8.090 1112 HB2 LEU 743 HB2 LEU 743 33.805 27.462 -5.803 1113 HB3 LEU 743 HB1 LEU 743 34.588 28.036 -7.261 1114 HG LEU 743 HG LEU 743 31.881 26.703 -7.136 1115 HD11 LEU 743 HD11 LEU 743 31.842 28.925 -6.167 1116 HD12 LEU 743 HD12 LEU 743 31.023 28.921 -7.730 1117 HD13 LEU 743 HD13 LEU 743 32.653 29.580 -7.590 1118 HD21 LEU 743 HD21 LEU 743 31.695 27.347 -9.491 1119 HD22 LEU 743 HD22 LEU 743 33.039 26.235 -9.236 1120 HD23 LEU 743 HD23 LEU 743 33.350 27.957 -9.457 1121 H ALA 744 HN ALA 744 35.055 25.624 -4.569 1122 HA ALA 744 HA ALA 744 37.682 26.597 -4.373 1123 HB1 ALA 744 HB1 ALA 744 36.282 24.640 -2.549 1124 HB2 ALA 744 HB2 ALA 744 36.160 26.396 -2.452 1125 HB3 ALA 744 HB3 ALA 744 37.705 25.602 -2.149 1126 H LEU 745 HN LEU 745 36.420 23.319 -4.803 1127 HA LEU 745 HA LEU 745 38.813 21.892 -4.594 1128 HB2 LEU 745 HB2 LEU 745 36.478 20.932 -4.808 1129 HB3 LEU 745 HB1 LEU 745 36.573 21.296 -6.515 1130 HG LEU 745 HG LEU 745 38.704 19.831 -6.488 1131 HD11 LEU 745 HD11 LEU 745 39.005 19.570 -4.143 1132 HD12 LEU 745 HD12 LEU 745 38.582 18.003 -4.833 1133 HD13 LEU 745 HD13 LEU 745 37.369 18.937 -3.955 1134 HD21 LEU 745 HD21 LEU 745 37.357 17.831 -6.875 1135 HD22 LEU 745 HD22 LEU 745 36.669 19.252 -7.658 1136 HD23 LEU 745 HD23 LEU 745 35.964 18.640 -6.162 1137 H GLN 746 HN GLN 746 37.252 23.366 -7.411 1138 HA GLN 746 HA GLN 746 39.202 22.567 -9.269 1139 HB2 GLN 746 HB2 GLN 746 37.166 24.777 -9.363 1140 HB3 GLN 746 HB1 GLN 746 38.231 24.393 -10.709 1141 HG2 GLN 746 HG2 GLN 746 36.091 22.678 -9.491 1142 HG3 GLN 746 HG1 GLN 746 36.191 23.302 -11.139 1143 HE21 GLN 746 HE21 GLN 746 37.723 22.387 -12.565 1144 HE22 GLN 746 HE22 GLN 746 38.359 20.802 -12.289 1145 H GLN 747 HN GLN 747 39.016 25.337 -7.140 1146 HA GLN 747 HA GLN 747 41.019 26.877 -8.327 1147 HB2 GLN 747 HB2 GLN 747 39.557 27.675 -6.497 1148 HB3 GLN 747 HB1 GLN 747 40.396 26.609 -5.380 1149 HG2 GLN 747 HG2 GLN 747 42.441 27.837 -5.660 1150 HG3 GLN 747 HG1 GLN 747 41.711 28.837 -6.915 1151 HE21 GLN 747 HE21 GLN 747 42.928 29.603 -4.378 1152 HE22 GLN 747 HE22 GLN 747 41.710 30.482 -3.521 1153 H THR 748 HN THR 748 41.286 24.455 -5.727 1154 HA THR 748 HA THR 748 44.115 24.470 -5.698 1155 HB THR 748 HB THR 748 42.202 22.303 -4.797 1156 HG1 THR 748 HG1 THR 748 43.474 24.161 -3.069 1157 HG21 THR 748 HG21 THR 748 44.039 21.568 -3.350 1158 HG22 THR 748 HG22 THR 748 45.076 22.828 -4.015 1159 HG23 THR 748 HG23 THR 748 44.520 21.509 -5.045 1160 H GLU 749 HN GLU 749 41.704 22.661 -7.499 1161 HA GLU 749 HA GLU 749 43.356 20.659 -8.605 1162 HB2 GLU 749 HB2 GLU 749 40.742 20.986 -8.571 1163 HB3 GLU 749 HB1 GLU 749 41.015 21.827 -10.085 1164 HG2 GLU 749 HG2 GLU 749 41.923 19.004 -9.587 1165 HG3 GLU 749 HG1 GLU 749 40.342 19.405 -10.245 1166 H TYR 750 HN TYR 750 42.819 24.001 -9.431 1167 HA TYR 750 HA TYR 750 44.027 23.888 -12.021 1168 HB2 TYR 750 HB2 TYR 750 42.393 25.632 -11.418 1169 HB3 TYR 750 HB1 TYR 750 43.506 26.260 -10.210 1170 HD1 TYR 750 HD1 TYR 750 43.395 25.504 -13.875 1171 HD2 TYR 750 HD2 TYR 750 44.827 28.067 -10.795 1172 HE1 TYR 750 HE1 TYR 750 44.364 26.997 -15.573 1173 HE2 TYR 750 HE2 TYR 750 45.801 29.562 -12.485 1174 HH TYR 750 HH TYR 750 45.067 29.277 -15.820 1175 H LEU 751 HN LEU 751 45.123 24.543 -8.767 1176 HA LEU 751 HA LEU 751 47.749 25.383 -9.605 1177 HB2 LEU 751 HB2 LEU 751 46.424 24.929 -6.963 1178 HB3 LEU 751 HB1 LEU 751 48.168 25.023 -7.040 1179 HG LEU 751 HG LEU 751 47.989 27.296 -7.996 1180 HD11 LEU 751 HD11 LEU 751 45.039 26.976 -7.482 1181 HD12 LEU 751 HD12 LEU 751 45.812 27.117 -9.059 1182 HD13 LEU 751 HD13 LEU 751 45.852 28.474 -7.933 1183 HD21 LEU 751 HD21 LEU 751 47.258 28.397 -5.940 1184 HD22 LEU 751 HD22 LEU 751 48.283 27.002 -5.608 1185 HD23 LEU 751 HD23 LEU 751 46.537 26.886 -5.390 1186 H GLN 752 HN GLN 752 46.313 22.532 -8.104 1187 HA GLN 752 HA GLN 752 46.974 20.409 -7.820 1188 HB2 GLN 752 HB2 GLN 752 48.931 21.035 -10.044 1189 HB3 GLN 752 HB1 GLN 752 48.660 19.428 -9.387 1190 HG2 GLN 752 HG2 GLN 752 46.315 19.550 -10.101 1191 HG3 GLN 752 HG1 GLN 752 46.625 21.142 -10.792 1192 HE21 GLN 752 HE21 GLN 752 47.112 17.726 -11.125 1193 HE22 GLN 752 HE22 GLN 752 47.741 17.763 -12.733 1194 H GLN 753 HN GLN 753 50.220 21.432 -8.699 1195 HA GLN 753 HA GLN 753 52.172 21.498 -7.588 1196 HB2 GLN 753 HB2 GLN 753 50.442 22.261 -5.226 1197 HB3 GLN 753 HB1 GLN 753 52.189 22.431 -5.298 1198 HG2 GLN 753 HG2 GLN 753 50.217 23.835 -7.093 1199 HG3 GLN 753 HG1 GLN 753 51.034 24.549 -5.704 1200 HE21 GLN 753 HE21 GLN 753 51.087 25.296 -8.534 1201 HE22 GLN 753 HE22 GLN 753 52.751 25.264 -8.997 1202 H VAL 754 HN VAL 754 50.345 20.413 -4.775 1203 HA VAL 754 HA VAL 754 51.628 17.800 -4.965 1204 HB VAL 754 HB VAL 754 51.970 17.924 -2.418 1205 HG11 VAL 754 HG11 VAL 754 53.821 17.899 -3.993 1206 HG12 VAL 754 HG12 VAL 754 54.165 18.999 -2.657 1207 HG13 VAL 754 HG13 VAL 754 53.670 19.641 -4.223 1208 HG21 VAL 754 HG21 VAL 754 51.787 20.879 -3.017 1209 HG22 VAL 754 HG22 VAL 754 52.359 20.175 -1.506 1210 HG23 VAL 754 HG23 VAL 754 50.681 19.955 -2.003 1211 HHA CYC 800 HHA CYC 800 19.775 2.193 -5.316 1212 HMA1 CYC 800 HMA1 CYC 800 22.936 7.046 -4.277 1213 HMA2 CYC 800 HMA2 CYC 800 22.535 6.666 -2.552 1214 HMA3 CYC 800 HMA3 CYC 800 21.214 6.871 -3.756 1215 HAA1 CYC 800 HAA1 CYC 800 20.686 6.107 -5.661 1216 HAA2 CYC 800 HAA2 CYC 800 20.221 4.517 -6.333 1217 HBA1 CYC 800 HBA1 CYC 800 18.979 5.838 -3.831 1218 HBA2 CYC 800 HBA2 CYC 800 18.519 4.225 -4.512 1219 HHB CYC 800 HHB CYC 800 25.462 4.247 -3.280 1220 HB CYC 800 HB CYC 800 22.797 5.865 -0.962 1221 HMB1 CYC 800 HMB1 CYC 800 28.099 5.331 -0.632 1222 HMB2 CYC 800 HMB2 CYC 800 27.291 4.161 -1.766 1223 HMB3 CYC 800 HMB3 CYC 800 27.553 5.887 -2.276 1224 HAB1 CYC 800 HAB1 CYC 800 27.466 6.111 1.493 1225 HAB2 CYC 800 HAB2 CYC 800 25.991 6.727 2.357 1226 HBB1 CYC 800 HBB1 CYC 800 26.055 8.812 0.861 1227 HBB2 CYC 800 HBB2 CYC 800 27.530 8.656 1.882 1228 HBB3 CYC 800 HBB3 CYC 800 27.597 8.215 0.130 1229 HC CYC 800 HC CYC 800 23.903 -0.285 -2.635 1230 H2C CYC 800 H2C CYC 800 26.110 -3.031 -0.689 1231 H3C CYC 800 H3C CYC 800 25.259 -4.012 -3.402 1232 HMC1 CYC 800 HMC1 CYC 800 28.082 -2.088 -2.052 1233 HMC2 CYC 800 HMC2 CYC 800 27.698 -3.792 -2.493 1234 HMC3 CYC 800 HMC3 CYC 800 27.161 -2.451 -3.557 1235 HAC1 CYC 800 HAC CYC 800 24.804 -5.205 -1.323 1236 HBC1 CYC 800 HBC1 CYC 800 22.537 -5.914 -1.807 1237 HBC2 CYC 800 HBC2 CYC 800 23.274 -5.384 -3.355 1238 HBC3 CYC 800 HBC3 CYC 800 22.100 -4.311 -2.505 1239 HHD CYC 800 HHD CYC 800 22.716 -3.421 -4.311 1240 HD CYC 800 HD CYC 800 23.047 0.354 -4.170 1241 HMD1 CYC 800 HMD1 CYC 800 20.555 -3.787 -4.568 1242 HMD2 CYC 800 HMD2 CYC 800 19.211 -3.104 -3.573 1243 HMD3 CYC 800 HMD3 CYC 800 19.134 -3.022 -5.377 1244 HAD1 CYC 800 HAD1 CYC 800 18.324 0.295 -5.905 1245 HAD2 CYC 800 HAD2 CYC 800 17.904 -1.112 -4.871 1246 HBD1 CYC 800 HBD1 CYC 800 18.389 1.766 -3.803 1247 HBD2 CYC 800 HBD2 CYC 800 16.775 1.029 -4.120 1248 HA CYC 800 HA CYC 800 23.511 2.177 -3.819 Start of MODEL 7 1 H SER 599 HT1 SER 599 48.212 20.080 0.313 2 HA SER 599 HA SER 599 47.056 18.722 2.665 3 HB2 SER 599 HB2 SER 599 49.504 20.492 2.438 4 HB3 SER 599 HB1 SER 599 48.857 19.824 3.933 5 HG SER 599 HG SER 599 50.627 18.713 2.432 6 H ASP 600 HN ASP 600 47.165 21.532 0.660 7 HA ASP 600 HA ASP 600 46.273 23.383 2.656 8 HB2 ASP 600 HB2 ASP 600 46.284 23.601 -0.360 9 HB3 ASP 600 HB1 ASP 600 45.917 24.918 0.747 10 H VAL 601 HN VAL 601 44.728 21.930 -0.197 11 HA VAL 601 HA VAL 601 42.191 23.006 0.376 12 HB VAL 601 HB VAL 601 42.865 22.204 -1.880 13 HG11 VAL 601 HG11 VAL 601 42.459 19.453 -0.735 14 HG12 VAL 601 HG12 VAL 601 43.985 20.146 -1.282 15 HG13 VAL 601 HG13 VAL 601 42.692 19.831 -2.440 16 HG21 VAL 601 HG21 VAL 601 40.350 20.942 -0.806 17 HG22 VAL 601 HG22 VAL 601 40.700 21.263 -2.505 18 HG23 VAL 601 HG23 VAL 601 40.519 22.604 -1.373 19 H GLU 602 HN GLU 602 43.745 19.996 1.317 20 HA GLU 602 HA GLU 602 41.487 18.699 2.354 21 HB2 GLU 602 HB2 GLU 602 44.362 18.466 3.273 22 HB3 GLU 602 HB1 GLU 602 43.074 17.338 3.661 23 HG2 GLU 602 HG2 GLU 602 44.011 16.209 1.933 24 HG3 GLU 602 HG1 GLU 602 42.897 17.217 1.013 25 H GLU 603 HN GLU 603 43.748 20.986 3.836 26 HA GLU 603 HA GLU 603 42.600 20.801 6.429 27 HB2 GLU 603 HB2 GLU 603 44.884 21.625 6.090 28 HB3 GLU 603 HB1 GLU 603 44.258 23.019 5.219 29 HG2 GLU 603 HG2 GLU 603 43.199 23.856 7.193 30 HG3 GLU 603 HG1 GLU 603 43.609 22.393 8.086 31 H ILE 604 HN ILE 604 42.162 23.011 3.702 32 HA ILE 604 HA ILE 604 40.313 24.741 4.881 33 HB ILE 604 HB ILE 604 40.492 23.864 1.984 34 HG12 ILE 604 HG12 ILE 604 41.591 26.326 3.360 35 HG13 ILE 604 HG11 ILE 604 42.543 24.917 2.905 36 HG21 ILE 604 HG21 ILE 604 39.263 25.928 1.463 37 HG22 ILE 604 HG22 ILE 604 39.072 26.244 3.186 38 HG23 ILE 604 HG23 ILE 604 38.304 24.833 2.461 39 HD11 ILE 604 HD11 ILE 604 42.047 25.339 0.557 40 HD12 ILE 604 HD12 ILE 604 42.811 26.737 1.313 41 HD13 ILE 604 HD13 ILE 604 41.074 26.738 1.009 42 H PHE 605 HN PHE 605 39.813 21.696 3.078 43 HA PHE 605 HA PHE 605 37.040 21.622 3.211 44 HB2 PHE 605 HB2 PHE 605 39.208 19.697 2.707 45 HB3 PHE 605 HB1 PHE 605 37.738 18.980 3.352 46 HD1 PHE 605 HD1 PHE 605 38.859 21.330 0.674 47 HD2 PHE 605 HD2 PHE 605 36.076 18.353 1.897 48 HE1 PHE 605 HE1 PHE 605 37.869 21.325 -1.588 49 HE2 PHE 605 HE2 PHE 605 35.084 18.345 -0.354 50 HZ PHE 605 HZ PHE 605 35.980 19.835 -2.098 51 H LYS 606 HN LYS 606 39.445 20.267 5.438 52 HA LYS 606 HA LYS 606 37.680 18.987 7.200 53 HB2 LYS 606 HB2 LYS 606 40.373 20.219 7.696 54 HB3 LYS 606 HB1 LYS 606 39.491 19.351 8.940 55 HG2 LYS 606 HG2 LYS 606 39.479 17.361 7.446 56 HG3 LYS 606 HG1 LYS 606 40.527 18.256 6.340 57 HD2 LYS 606 HD2 LYS 606 41.157 17.711 9.233 58 HD3 LYS 606 HD1 LYS 606 41.772 16.753 7.882 59 HE2 LYS 606 HE2 LYS 606 42.923 18.685 7.001 60 HE3 LYS 606 HE1 LYS 606 42.222 19.713 8.246 61 HZ1 LYS 606 HZ1 LYS 606 44.076 17.449 8.755 62 HZ2 LYS 606 HZ2 LYS 606 43.433 18.501 9.916 63 HZ3 LYS 606 HZ3 LYS 606 44.499 19.087 8.751 64 H THR 607 HN THR 607 38.914 22.321 7.316 65 HA THR 607 HA THR 607 37.688 22.923 9.799 66 HB THR 607 HB THR 607 38.594 24.862 7.666 67 HG1 THR 607 HG1 THR 607 40.349 23.540 8.102 68 HG21 THR 607 HG21 THR 607 39.001 26.355 9.578 69 HG22 THR 607 HG22 THR 607 38.395 25.112 10.674 70 HG23 THR 607 HG23 THR 607 37.308 25.863 9.506 71 H THR 608 HN THR 608 36.794 23.477 6.405 72 HA THR 608 HA THR 608 34.469 25.013 7.020 73 HB THR 608 HB THR 608 35.078 23.550 4.437 74 HG1 THR 608 HG1 THR 608 36.817 24.915 4.885 75 HG21 THR 608 HG21 THR 608 33.387 25.987 5.038 76 HG22 THR 608 HG22 THR 608 32.782 24.389 4.603 77 HG23 THR 608 HG23 THR 608 33.702 25.333 3.432 78 H THR 609 HN THR 609 35.048 21.631 6.196 79 HA THR 609 HA THR 609 32.380 20.791 6.031 80 HB THR 609 HB THR 609 34.781 19.149 6.895 81 HG1 THR 609 HG1 THR 609 35.206 19.865 4.879 82 HG21 THR 609 HG21 THR 609 32.633 18.065 7.410 83 HG22 THR 609 HG22 THR 609 33.492 17.225 6.120 84 HG23 THR 609 HG23 THR 609 32.130 18.277 5.733 85 H GLN 610 HN GLN 610 34.517 21.158 8.896 86 HA GLN 610 HA GLN 610 32.676 19.917 10.668 87 HB2 GLN 610 HB2 GLN 610 35.064 19.989 11.153 88 HB3 GLN 610 HB1 GLN 610 35.048 21.744 11.111 89 HG2 GLN 610 HG2 GLN 610 35.144 20.912 13.388 90 HG3 GLN 610 HG1 GLN 610 33.647 21.794 13.095 91 HE21 GLN 610 HE21 GLN 610 32.621 20.797 14.797 92 HE22 GLN 610 HE22 GLN 610 32.104 19.150 14.740 93 H GLU 611 HN GLU 611 33.244 23.119 9.435 94 HA GLU 611 HA GLU 611 31.753 24.607 11.313 95 HB2 GLU 611 HB2 GLU 611 33.346 25.630 9.742 96 HB3 GLU 611 HB1 GLU 611 32.310 25.184 8.396 97 HG2 GLU 611 HG2 GLU 611 32.025 27.511 8.896 98 HG3 GLU 611 HG1 GLU 611 30.547 26.639 9.304 99 H VAL 612 HN VAL 612 30.880 23.478 8.036 100 HA VAL 612 HA VAL 612 28.167 24.222 8.246 101 HB VAL 612 HB VAL 612 29.268 23.818 6.067 102 HG11 VAL 612 HG11 VAL 612 30.605 21.879 6.624 103 HG12 VAL 612 HG12 VAL 612 29.579 21.539 5.231 104 HG13 VAL 612 HG13 VAL 612 29.149 20.904 6.819 105 HG21 VAL 612 HG21 VAL 612 27.406 22.513 5.016 106 HG22 VAL 612 HG22 VAL 612 26.890 23.843 6.052 107 HG23 VAL 612 HG23 VAL 612 26.806 22.181 6.642 108 H ARG 613 HN ARG 613 29.919 21.385 9.236 109 HA ARG 613 HA ARG 613 27.837 19.579 9.638 110 HB2 ARG 613 HB2 ARG 613 30.131 18.874 9.888 111 HB3 ARG 613 HB1 ARG 613 30.381 20.009 11.206 112 HG2 ARG 613 HG2 ARG 613 28.608 18.742 12.467 113 HG3 ARG 613 HG1 ARG 613 28.720 17.516 11.207 114 HD2 ARG 613 HD2 ARG 613 30.863 16.907 11.813 115 HD3 ARG 613 HD1 ARG 613 31.190 18.454 12.598 116 HE ARG 613 HE ARG 613 29.081 17.028 13.874 117 HH11 ARG 613 HH11 ARG 613 32.586 17.181 13.621 118 HH12 ARG 613 HH12 ARG 613 32.854 16.589 15.224 119 HH21 ARG 613 HH21 ARG 613 29.438 16.279 16.003 120 HH22 ARG 613 HH22 ARG 613 31.044 16.102 16.602 121 H GLN 614 HN GLN 614 29.256 21.923 11.926 122 HA GLN 614 HA GLN 614 27.453 21.427 14.010 123 HB2 GLN 614 HB2 GLN 614 29.660 22.537 14.242 124 HB3 GLN 614 HB1 GLN 614 29.006 23.949 13.424 125 HG2 GLN 614 HG2 GLN 614 27.343 24.170 15.233 126 HG3 GLN 614 HG1 GLN 614 28.124 22.829 16.067 127 HE21 GLN 614 HE21 GLN 614 28.679 24.068 17.826 128 HE22 GLN 614 HE22 GLN 614 29.916 25.274 17.768 129 H LEU 615 HN LEU 615 27.378 23.647 11.281 130 HA LEU 615 HA LEU 615 25.252 25.260 12.118 131 HB2 LEU 615 HB2 LEU 615 26.147 24.498 9.345 132 HB3 LEU 615 HB1 LEU 615 24.898 25.685 9.662 133 HG LEU 615 HG LEU 615 27.786 25.894 10.518 134 HD11 LEU 615 HD11 LEU 615 27.902 27.705 8.889 135 HD12 LEU 615 HD12 LEU 615 26.232 27.394 8.416 136 HD13 LEU 615 HD13 LEU 615 27.474 26.180 8.113 137 HD21 LEU 615 HD21 LEU 615 25.482 27.817 10.843 138 HD22 LEU 615 HD22 LEU 615 27.171 28.191 11.175 139 HD23 LEU 615 HD23 LEU 615 26.336 26.972 12.135 140 H LEU 616 HN LEU 616 25.219 22.118 10.423 141 HA LEU 616 HA LEU 616 22.313 22.202 10.390 142 HB2 LEU 616 HB2 LEU 616 24.231 20.133 9.326 143 HB3 LEU 616 HB1 LEU 616 22.496 20.133 9.090 144 HG LEU 616 HG LEU 616 24.435 22.170 7.992 145 HD11 LEU 616 HD11 LEU 616 24.574 20.026 6.866 146 HD12 LEU 616 HD12 LEU 616 23.818 21.232 5.825 147 HD13 LEU 616 HD13 LEU 616 22.826 20.018 6.634 148 HD21 LEU 616 HD21 LEU 616 22.304 23.216 8.517 149 HD22 LEU 616 HD22 LEU 616 21.446 21.937 7.658 150 HD23 LEU 616 HD23 LEU 616 22.489 23.048 6.770 151 H ARG 617 HN ARG 617 24.543 21.536 12.610 152 HA ARG 617 HA ARG 617 24.626 20.394 14.565 153 HB2 ARG 617 HB2 ARG 617 21.938 21.031 14.150 154 HB3 ARG 617 HB1 ARG 617 21.919 19.334 14.604 155 HG2 ARG 617 HG2 ARG 617 23.629 21.009 16.294 156 HG3 ARG 617 HG1 ARG 617 21.918 21.428 16.336 157 HD2 ARG 617 HD2 ARG 617 22.479 19.821 18.080 158 HD3 ARG 617 HD1 ARG 617 21.354 19.131 16.919 159 HE ARG 617 HE ARG 617 23.308 17.970 15.936 160 HH11 ARG 617 HH11 ARG 617 23.468 19.081 19.267 161 HH12 ARG 617 HH12 ARG 617 24.620 17.887 19.746 162 HH21 ARG 617 HH21 ARG 617 24.836 16.358 16.594 163 HH22 ARG 617 HH22 ARG 617 25.402 16.345 18.224 164 H CYS 618 HN CYS 618 25.507 18.984 12.322 165 HA CYS 618 HA CYS 618 24.403 16.299 12.615 166 HB2 CYS 618 HB2 CYS 618 24.833 17.362 10.355 167 HB3 CYS 618 HB1 CYS 618 26.551 17.226 10.708 168 HG CYS 618 HG CYS 618 24.424 14.942 9.611 169 H ASP 619 HN ASP 619 25.946 14.462 12.843 170 HA ASP 619 HA ASP 619 28.134 15.217 14.660 171 HB2 ASP 619 HB2 ASP 619 26.489 12.713 14.438 172 HB3 ASP 619 HB1 ASP 619 27.993 12.773 15.354 173 H ARG 620 HN ARG 620 27.397 13.412 11.761 174 HA ARG 620 HA ARG 620 30.286 13.181 11.305 175 HB2 ARG 620 HB2 ARG 620 29.443 10.982 12.029 176 HB3 ARG 620 HB1 ARG 620 28.255 11.017 10.737 177 HG2 ARG 620 HG2 ARG 620 29.972 10.915 9.070 178 HG3 ARG 620 HG1 ARG 620 31.230 11.071 10.294 179 HD2 ARG 620 HD2 ARG 620 31.031 8.761 9.612 180 HD3 ARG 620 HD1 ARG 620 30.493 8.939 11.282 181 HE ARG 620 HE ARG 620 28.520 8.959 9.126 182 HH11 ARG 620 HH11 ARG 620 29.918 7.356 11.920 183 HH12 ARG 620 HH12 ARG 620 28.615 6.227 12.092 184 HH21 ARG 620 HH21 ARG 620 26.781 7.442 9.358 185 HH22 ARG 620 HH22 ARG 620 26.838 6.280 10.645 186 H VAL 621 HN VAL 621 30.902 13.871 9.368 187 HA VAL 621 HA VAL 621 29.020 13.953 7.186 188 HB VAL 621 HB VAL 621 28.618 16.135 8.087 189 HG11 VAL 621 HG11 VAL 621 30.463 17.782 8.374 190 HG12 VAL 621 HG12 VAL 621 31.597 16.438 8.217 191 HG13 VAL 621 HG13 VAL 621 30.433 16.465 9.546 192 HG21 VAL 621 HG21 VAL 621 28.798 16.051 5.663 193 HG22 VAL 621 HG22 VAL 621 30.526 16.392 5.767 194 HG23 VAL 621 HG23 VAL 621 29.354 17.608 6.280 195 H ALA 622 HN ALA 622 29.967 13.320 5.389 196 HA ALA 622 HA ALA 622 32.915 13.323 5.304 197 HB1 ALA 622 HB1 ALA 622 31.207 10.939 4.626 198 HB2 ALA 622 HB2 ALA 622 32.155 11.137 6.101 199 HB3 ALA 622 HB3 ALA 622 32.966 11.030 4.538 200 H VAL 623 HN VAL 623 33.781 12.655 3.187 201 HA VAL 623 HA VAL 623 32.117 13.320 0.898 202 HB VAL 623 HB VAL 623 33.952 14.785 -0.057 203 HG11 VAL 623 HG11 VAL 623 32.458 15.798 2.340 204 HG12 VAL 623 HG12 VAL 623 31.832 15.652 0.697 205 HG13 VAL 623 HG13 VAL 623 33.138 16.791 1.047 206 HG21 VAL 623 HG21 VAL 623 34.792 14.939 2.837 207 HG22 VAL 623 HG22 VAL 623 35.407 15.945 1.523 208 HG23 VAL 623 HG23 VAL 623 35.718 14.210 1.525 209 H TYR 624 HN TYR 624 32.874 12.500 -1.039 210 HA TYR 624 HA TYR 624 35.296 10.969 -0.989 211 HB2 TYR 624 HB2 TYR 624 34.409 8.835 -1.290 212 HB3 TYR 624 HB1 TYR 624 33.378 9.548 -0.058 213 HD1 TYR 624 HD1 TYR 624 33.554 8.669 -3.654 214 HD2 TYR 624 HD2 TYR 624 31.048 9.693 -0.377 215 HE1 TYR 624 HE1 TYR 624 31.587 8.006 -4.961 216 HE2 TYR 624 HE2 TYR 624 29.075 9.037 -1.682 217 HH TYR 624 HH TYR 624 29.284 7.251 -4.542 218 H ARG 625 HN ARG 625 35.893 10.208 -3.168 219 HA ARG 625 HA ARG 625 34.473 11.808 -5.192 220 HB2 ARG 625 HB2 ARG 625 36.572 12.118 -6.406 221 HB3 ARG 625 HB1 ARG 625 36.668 12.783 -4.786 222 HG2 ARG 625 HG2 ARG 625 37.984 10.892 -4.051 223 HG3 ARG 625 HG1 ARG 625 37.806 10.127 -5.632 224 HD2 ARG 625 HD2 ARG 625 39.127 12.799 -5.150 225 HD3 ARG 625 HD1 ARG 625 39.989 11.274 -5.338 226 HE ARG 625 HE ARG 625 38.620 11.292 -7.589 227 HH11 ARG 625 HH11 ARG 625 40.336 13.965 -6.078 228 HH12 ARG 625 HH12 ARG 625 40.702 14.743 -7.575 229 HH21 ARG 625 HH21 ARG 625 39.129 12.325 -9.578 230 HH22 ARG 625 HH22 ARG 625 40.029 13.800 -9.576 231 H PHE 626 HN PHE 626 34.232 10.975 -7.250 232 HA PHE 626 HA PHE 626 33.971 8.117 -7.259 233 HB2 PHE 626 HB2 PHE 626 33.304 10.223 -9.308 234 HB3 PHE 626 HB1 PHE 626 33.060 8.503 -9.579 235 HD1 PHE 626 HD1 PHE 626 31.839 11.479 -7.913 236 HD2 PHE 626 HD2 PHE 626 31.412 7.264 -8.257 237 HE1 PHE 626 HE1 PHE 626 29.638 11.617 -6.824 238 HE2 PHE 626 HE2 PHE 626 29.208 7.392 -7.174 239 HZ PHE 626 HZ PHE 626 28.319 9.574 -6.454 240 H ASN 627 HN ASN 627 35.454 6.779 -7.838 241 HA ASN 627 HA ASN 627 37.812 7.597 -9.291 242 HB2 ASN 627 HB2 ASN 627 36.888 5.029 -8.008 243 HB3 ASN 627 HB1 ASN 627 38.277 5.036 -9.082 244 HD21 ASN 627 HD21 ASN 627 37.553 7.753 -7.016 245 HD22 ASN 627 HD22 ASN 627 38.871 7.517 -5.925 246 HA PRO 628 HA PRO 628 36.809 6.385 -13.448 247 HB2 PRO 628 HB2 PRO 628 38.790 4.156 -13.273 248 HB3 PRO 628 HB1 PRO 628 38.623 5.416 -14.502 249 HG2 PRO 628 HG2 PRO 628 40.551 5.583 -12.696 250 HG3 PRO 628 HG1 PRO 628 39.643 7.032 -13.168 251 HD2 PRO 628 HD2 PRO 628 39.425 5.380 -10.689 252 HD3 PRO 628 HD1 PRO 628 39.299 7.140 -10.885 253 H ASN 629 HN ASN 629 36.748 3.952 -10.974 254 HA ASN 629 HA ASN 629 34.937 2.315 -12.619 255 HB2 ASN 629 HB2 ASN 629 36.603 1.525 -10.222 256 HB3 ASN 629 HB1 ASN 629 35.417 0.474 -10.988 257 HD21 ASN 629 HD21 ASN 629 35.836 -0.323 -13.063 258 HD22 ASN 629 HD22 ASN 629 37.434 -0.342 -13.723 259 H TRP 630 HN TRP 630 34.587 4.757 -10.656 260 HA TRP 630 HA TRP 630 33.095 5.502 -9.099 261 HB2 TRP 630 HB2 TRP 630 31.424 3.483 -10.606 262 HB3 TRP 630 HB1 TRP 630 30.738 4.540 -9.379 263 HD1 TRP 630 HD1 TRP 630 30.344 7.080 -10.037 264 HE1 TRP 630 HE1 TRP 630 30.404 8.353 -12.280 265 HE3 TRP 630 HE3 TRP 630 32.677 3.549 -12.913 266 HZ2 TRP 630 HZ2 TRP 630 31.317 7.918 -14.898 267 HZ3 TRP 630 HZ3 TRP 630 33.103 4.059 -15.280 268 HH2 TRP 630 HH2 TRP 630 32.437 6.197 -16.253 269 H THR 631 HN THR 631 34.831 3.876 -7.875 270 HA THR 631 HA THR 631 33.530 1.755 -6.435 271 HB THR 631 HB THR 631 35.772 1.669 -5.248 272 HG1 THR 631 HG1 THR 631 37.410 2.911 -6.233 273 HG21 THR 631 HG21 THR 631 35.214 0.222 -7.139 274 HG22 THR 631 HG22 THR 631 36.902 0.731 -7.229 275 HG23 THR 631 HG23 THR 631 35.688 1.498 -8.258 276 H GLY 632 HN GLY 632 33.676 5.030 -6.037 277 HA2 GLY 632 HA2 GLY 632 33.066 6.488 -4.371 278 HA3 GLY 632 HA1 GLY 632 32.172 5.131 -3.714 279 H GLU 633 HN GLU 633 35.550 6.332 -3.871 280 HA GLU 633 HA GLU 633 35.929 5.219 -1.196 281 HB2 GLU 633 HB2 GLU 633 37.594 4.625 -2.924 282 HB3 GLU 633 HB1 GLU 633 37.999 6.328 -3.095 283 HG2 GLU 633 HG2 GLU 633 38.829 6.421 -0.858 284 HG3 GLU 633 HG1 GLU 633 38.271 4.781 -0.531 285 H PHE 634 HN PHE 634 36.077 6.416 0.552 286 HA PHE 634 HA PHE 634 35.481 9.207 0.417 287 HB2 PHE 634 HB2 PHE 634 36.134 7.399 2.740 288 HB3 PHE 634 HB1 PHE 634 35.741 9.103 2.922 289 HD1 PHE 634 HD1 PHE 634 34.444 5.781 2.150 290 HD2 PHE 634 HD2 PHE 634 33.488 9.908 2.528 291 HE1 PHE 634 HE1 PHE 634 32.053 5.217 2.202 292 HE2 PHE 634 HE2 PHE 634 31.094 9.353 2.580 293 HZ PHE 634 HZ PHE 634 30.373 7.004 2.419 294 H VAL 635 HN VAL 635 36.721 10.939 0.675 295 HA VAL 635 HA VAL 635 39.615 10.473 0.841 296 HB VAL 635 HB VAL 635 39.883 12.714 -0.184 297 HG11 VAL 635 HG11 VAL 635 38.135 10.815 -1.737 298 HG12 VAL 635 HG12 VAL 635 39.892 10.745 -1.598 299 HG13 VAL 635 HG13 VAL 635 39.127 12.096 -2.435 300 HG21 VAL 635 HG21 VAL 635 36.871 12.644 -0.426 301 HG22 VAL 635 HG22 VAL 635 37.930 13.832 -1.186 302 HG23 VAL 635 HG23 VAL 635 37.811 13.754 0.572 303 H ALA 636 HN ALA 636 36.955 11.879 2.491 304 HA ALA 636 HA ALA 636 38.655 12.621 4.683 305 HB1 ALA 636 HB1 ALA 636 37.044 14.773 3.305 306 HB2 ALA 636 HB2 ALA 636 38.802 14.644 3.306 307 HB3 ALA 636 HB3 ALA 636 37.940 14.953 4.813 308 H GLU 637 HN GLU 637 37.507 13.011 6.594 309 HA GLU 637 HA GLU 637 34.626 12.648 6.621 310 HB2 GLU 637 HB2 GLU 637 35.376 10.359 6.744 311 HB3 GLU 637 HB1 GLU 637 36.620 10.769 7.910 312 HG2 GLU 637 HG2 GLU 637 34.838 9.597 9.011 313 HG3 GLU 637 HG1 GLU 637 34.871 11.266 9.569 314 H SER 638 HN SER 638 33.702 13.392 8.567 315 HA SER 638 HA SER 638 35.490 14.492 10.587 316 HB2 SER 638 HB2 SER 638 33.359 16.146 9.204 317 HB3 SER 638 HB1 SER 638 34.344 16.668 10.571 318 HG SER 638 HG SER 638 35.855 15.707 8.537 319 H VAL 639 HN VAL 639 34.813 13.358 12.265 320 HA VAL 639 HA VAL 639 31.959 13.374 12.915 321 HB VAL 639 HB VAL 639 32.509 11.191 11.859 322 HG11 VAL 639 HG11 VAL 639 34.856 11.043 12.473 323 HG12 VAL 639 HG12 VAL 639 33.976 9.600 12.978 324 HG13 VAL 639 HG13 VAL 639 34.409 10.828 14.167 325 HG21 VAL 639 HG21 VAL 639 31.583 9.739 13.597 326 HG22 VAL 639 HG22 VAL 639 30.743 11.292 13.556 327 HG23 VAL 639 HG23 VAL 639 31.933 10.966 14.814 328 H ALA 640 HN ALA 640 31.528 13.082 15.168 329 HA ALA 640 HA ALA 640 33.413 14.342 16.877 330 HB1 ALA 640 HB1 ALA 640 30.959 12.805 17.707 331 HB2 ALA 640 HB2 ALA 640 30.913 14.457 17.105 332 HB3 ALA 640 HB3 ALA 640 31.778 14.087 18.599 333 H HIS 641 HN HIS 641 34.845 13.483 18.271 334 HA HIS 641 HA HIS 641 35.740 10.827 17.923 335 HB2 HIS 641 HB2 HIS 641 37.303 11.316 19.779 336 HB3 HIS 641 HB1 HIS 641 37.283 12.597 18.574 337 HD2 HIS 641 HD2 HIS 641 37.084 12.238 22.317 338 HE1 HIS 641 HE1 HIS 641 35.327 15.998 21.441 339 HE2 HIS 641 HE2 HIS 641 36.365 14.555 23.218 340 H THR 642 HN THR 642 33.182 12.008 19.733 341 HA THR 642 HA THR 642 33.289 10.109 21.882 342 HB THR 642 HB THR 642 30.940 10.997 22.300 343 HG1 THR 642 HG1 THR 642 30.345 12.813 21.099 344 HG21 THR 642 HG21 THR 642 33.226 12.966 22.148 345 HG22 THR 642 HG22 THR 642 32.902 11.854 23.478 346 HG23 THR 642 HG23 THR 642 31.769 13.158 23.124 347 H TRP 643 HN TRP 643 32.225 10.081 18.644 348 HA TRP 643 HA TRP 643 30.403 7.831 19.153 349 HB2 TRP 643 HB2 TRP 643 30.696 9.495 16.640 350 HB3 TRP 643 HB1 TRP 643 29.480 8.256 16.934 351 HD1 TRP 643 HD1 TRP 643 29.546 11.755 16.677 352 HE1 TRP 643 HE1 TRP 643 27.802 12.933 18.155 353 HE3 TRP 643 HE3 TRP 643 28.472 7.910 19.869 354 HZ2 TRP 643 HZ2 TRP 643 26.189 12.305 20.392 355 HZ3 TRP 643 HZ3 TRP 643 26.819 8.284 21.645 356 HH2 TRP 643 HH2 TRP 643 25.704 10.434 21.902 357 H VAL 644 HN VAL 644 30.466 6.706 16.607 358 HA VAL 644 HA VAL 644 32.917 5.230 16.749 359 HB VAL 644 HB VAL 644 32.033 3.914 14.860 360 HG11 VAL 644 HG11 VAL 644 31.392 3.287 17.111 361 HG12 VAL 644 HG12 VAL 644 30.065 2.982 15.989 362 HG13 VAL 644 HG13 VAL 644 30.018 4.392 17.048 363 HG21 VAL 644 HG21 VAL 644 29.706 5.840 14.934 364 HG22 VAL 644 HG22 VAL 644 29.781 4.361 13.975 365 HG23 VAL 644 HG23 VAL 644 30.894 5.689 13.638 366 H LYS 645 HN LYS 645 34.540 5.156 15.216 367 HA LYS 645 HA LYS 645 34.829 7.607 13.686 368 HB2 LYS 645 HB2 LYS 645 37.175 6.981 13.462 369 HB3 LYS 645 HB1 LYS 645 36.678 6.893 15.145 370 HG2 LYS 645 HG2 LYS 645 37.767 4.925 15.078 371 HG3 LYS 645 HG1 LYS 645 36.252 4.341 14.393 372 HD2 LYS 645 HD2 LYS 645 37.170 4.762 12.125 373 HD3 LYS 645 HD1 LYS 645 38.706 5.217 12.866 374 HE2 LYS 645 HE2 LYS 645 37.350 2.526 12.963 375 HE3 LYS 645 HE1 LYS 645 38.854 2.933 12.143 376 HZ1 LYS 645 HZ1 LYS 645 39.328 1.812 14.193 377 HZ2 LYS 645 HZ2 LYS 645 38.393 2.903 15.073 378 HZ3 LYS 645 HZ3 LYS 645 39.828 3.420 14.339 379 H LEU 646 HN LEU 646 35.638 7.537 11.488 380 HA LEU 646 HA LEU 646 35.306 5.122 9.981 381 HB2 LEU 646 HB2 LEU 646 32.999 6.111 10.189 382 HB3 LEU 646 HB1 LEU 646 33.598 7.540 9.372 383 HG LEU 646 HG LEU 646 34.180 6.027 7.421 384 HD11 LEU 646 HD11 LEU 646 32.426 4.105 8.928 385 HD12 LEU 646 HD12 LEU 646 34.147 3.909 8.600 386 HD13 LEU 646 HD13 LEU 646 32.991 3.910 7.268 387 HD21 LEU 646 HD21 LEU 646 31.273 6.249 8.184 388 HD22 LEU 646 HD22 LEU 646 31.918 6.050 6.553 389 HD23 LEU 646 HD23 LEU 646 32.238 7.531 7.455 390 H VAL 647 HN VAL 647 36.622 5.171 8.255 391 HA VAL 647 HA VAL 647 38.103 5.864 6.677 392 HB VAL 647 HB VAL 647 37.126 8.706 7.137 393 HG11 VAL 647 HG11 VAL 647 37.826 9.076 4.810 394 HG12 VAL 647 HG12 VAL 647 38.449 7.428 4.746 395 HG13 VAL 647 HG13 VAL 647 39.174 8.601 5.845 396 HG21 VAL 647 HG21 VAL 647 36.003 6.564 5.337 397 HG22 VAL 647 HG22 VAL 647 35.631 8.279 5.174 398 HG23 VAL 647 HG23 VAL 647 35.183 7.421 6.645 399 H GLY 648 HN GLY 648 40.172 6.976 6.438 400 HA2 GLY 648 HA2 GLY 648 41.273 8.569 8.500 401 HA3 GLY 648 HA1 GLY 648 41.787 6.894 8.670 402 HA PRO 649 HA PRO 649 44.520 9.474 5.656 403 HB2 PRO 649 HB2 PRO 649 46.807 8.438 6.945 404 HB3 PRO 649 HB1 PRO 649 46.175 10.079 7.093 405 HG2 PRO 649 HG2 PRO 649 45.807 7.738 8.898 406 HG3 PRO 649 HG1 PRO 649 45.933 9.458 9.302 407 HD2 PRO 649 HD2 PRO 649 43.584 8.187 9.367 408 HD3 PRO 649 HD1 PRO 649 43.703 9.862 8.789 409 H ASP 650 HN ASP 650 45.182 6.304 7.137 410 HA ASP 650 HA ASP 650 45.735 5.228 4.452 411 HB2 ASP 650 HB2 ASP 650 46.526 4.160 7.172 412 HB3 ASP 650 HB1 ASP 650 46.852 3.351 5.646 413 H ILE 651 HN ILE 651 43.354 5.468 6.666 414 HA ILE 651 HA ILE 651 42.321 2.754 6.312 415 HB ILE 651 HB ILE 651 41.046 4.911 8.004 416 HG12 ILE 651 HG12 ILE 651 43.152 2.930 8.915 417 HG13 ILE 651 HG11 ILE 651 43.441 4.647 8.659 418 HG21 ILE 651 HG21 ILE 651 41.001 1.891 8.142 419 HG22 ILE 651 HG22 ILE 651 39.696 2.929 7.568 420 HG23 ILE 651 HG23 ILE 651 40.178 2.976 9.263 421 HD11 ILE 651 HD11 ILE 651 41.560 3.448 10.682 422 HD12 ILE 651 HD12 ILE 651 41.831 5.171 10.426 423 HD13 ILE 651 HD13 ILE 651 43.143 4.152 11.013 424 H LYS 652 HN LYS 652 42.314 4.222 3.926 425 HA LYS 652 HA LYS 652 40.089 5.669 3.347 426 HB2 LYS 652 HB2 LYS 652 40.436 4.776 1.015 427 HB3 LYS 652 HB1 LYS 652 41.851 5.492 1.769 428 HG2 LYS 652 HG2 LYS 652 42.803 3.345 2.210 429 HG3 LYS 652 HG1 LYS 652 41.319 2.530 1.728 430 HD2 LYS 652 HD2 LYS 652 42.826 2.274 -0.076 431 HD3 LYS 652 HD1 LYS 652 41.681 3.512 -0.579 432 HE2 LYS 652 HE2 LYS 652 44.378 4.133 0.620 433 HE3 LYS 652 HE1 LYS 652 44.112 3.958 -1.112 434 HZ1 LYS 652 HZ1 LYS 652 44.006 6.241 -0.616 435 HZ2 LYS 652 HZ2 LYS 652 42.981 6.011 0.695 436 HZ3 LYS 652 HZ3 LYS 652 42.402 5.757 -0.880 437 H THR 653 HN THR 653 38.017 5.250 3.254 438 HA THR 653 HA THR 653 37.126 2.478 3.323 439 HB THR 653 HB THR 653 35.508 4.980 3.848 440 HG1 THR 653 HG1 THR 653 37.421 3.839 5.341 441 HG21 THR 653 HG21 THR 653 34.185 2.989 3.267 442 HG22 THR 653 HG22 THR 653 33.963 3.427 4.960 443 HG23 THR 653 HG23 THR 653 35.009 2.073 4.528 444 H VAL 654 HN VAL 654 36.589 1.638 1.396 445 HA VAL 654 HA VAL 654 35.652 3.397 -0.732 446 HB VAL 654 HB VAL 654 37.606 1.906 -1.159 447 HG11 VAL 654 HG11 VAL 654 35.641 -0.332 -0.728 448 HG12 VAL 654 HG12 VAL 654 37.058 0.041 0.255 449 HG13 VAL 654 HG13 VAL 654 37.259 -0.516 -1.405 450 HG21 VAL 654 HG21 VAL 654 35.155 1.234 -2.774 451 HG22 VAL 654 HG22 VAL 654 36.820 0.943 -3.275 452 HG23 VAL 654 HG23 VAL 654 36.246 2.594 -3.037 453 H TRP 655 HN TRP 655 33.642 2.839 -1.922 454 HA TRP 655 HA TRP 655 31.988 0.866 -0.538 455 HB2 TRP 655 HB2 TRP 655 31.516 3.183 0.378 456 HB3 TRP 655 HB1 TRP 655 31.026 3.656 -1.240 457 HD1 TRP 655 HD1 TRP 655 29.202 1.103 -1.958 458 HE1 TRP 655 HE1 TRP 655 26.933 0.804 -0.768 459 HE3 TRP 655 HE3 TRP 655 30.056 4.020 2.158 460 HZ2 TRP 655 HZ2 TRP 655 25.679 1.696 1.591 461 HZ3 TRP 655 HZ3 TRP 655 28.265 4.248 3.828 462 HH2 TRP 655 HH2 TRP 655 26.126 3.111 3.550 463 H GLU 656 HN GLU 656 32.164 -0.468 -2.297 464 HA GLU 656 HA GLU 656 31.674 0.554 -4.932 465 HB2 GLU 656 HB2 GLU 656 32.102 -2.270 -3.951 466 HB3 GLU 656 HB1 GLU 656 31.948 -1.810 -5.642 467 HG2 GLU 656 HG2 GLU 656 33.938 -0.396 -5.428 468 HG3 GLU 656 HG1 GLU 656 34.100 -0.894 -3.746 469 H ASP 657 HN ASP 657 29.652 1.329 -4.931 470 HA ASP 657 HA ASP 657 27.480 -0.507 -4.283 471 HB2 ASP 657 HB2 ASP 657 27.173 1.667 -3.327 472 HB3 ASP 657 HB1 ASP 657 27.490 2.454 -4.871 473 H THR 658 HN THR 658 26.812 -1.756 -5.799 474 HA THR 658 HA THR 658 27.373 -1.475 -8.522 475 HB THR 658 HB THR 658 26.927 -3.657 -7.485 476 HG1 THR 658 HG1 THR 658 26.471 -3.268 -9.774 477 HG21 THR 658 HG21 THR 658 24.622 -4.330 -6.931 478 HG22 THR 658 HG22 THR 658 24.074 -2.685 -7.246 479 HG23 THR 658 HG23 THR 658 25.180 -3.005 -5.909 480 H HIS 659 HN HIS 659 24.854 -0.146 -6.534 481 HA HIS 659 HA HIS 659 22.914 0.236 -8.566 482 HB2 HIS 659 HB2 HIS 659 22.156 0.358 -6.304 483 HB3 HIS 659 HB1 HIS 659 23.356 1.578 -5.896 484 HD2 HIS 659 HD2 HIS 659 22.532 4.175 -6.250 485 HE1 HIS 659 HE1 HIS 659 18.850 3.319 -8.164 486 HE2 HIS 659 HE2 HIS 659 20.226 5.076 -6.997 487 H LEU 660 HN LEU 660 25.084 2.686 -6.995 488 HA LEU 660 HA LEU 660 24.654 4.676 -8.849 489 HB2 LEU 660 HB2 LEU 660 27.157 4.075 -7.280 490 HB3 LEU 660 HB1 LEU 660 26.836 5.583 -8.111 491 HG LEU 660 HG LEU 660 25.277 4.486 -5.770 492 HD11 LEU 660 HD11 LEU 660 26.223 6.379 -4.555 493 HD12 LEU 660 HD12 LEU 660 27.174 6.814 -5.975 494 HD13 LEU 660 HD13 LEU 660 27.477 5.289 -5.143 495 HD21 LEU 660 HD21 LEU 660 23.826 5.743 -7.269 496 HD22 LEU 660 HD22 LEU 660 24.971 7.083 -7.278 497 HD23 LEU 660 HD23 LEU 660 24.126 6.654 -5.791 498 H GLN 661 HN GLN 661 27.272 2.268 -8.837 499 HA GLN 661 HA GLN 661 28.581 2.939 -11.147 500 HB2 GLN 661 HB2 GLN 661 27.972 0.197 -10.052 501 HB3 GLN 661 HB1 GLN 661 29.043 0.458 -11.422 502 HG2 GLN 661 HG2 GLN 661 30.534 1.777 -10.045 503 HG3 GLN 661 HG1 GLN 661 29.439 1.621 -8.673 504 HE21 GLN 661 HE21 GLN 661 32.247 0.805 -9.055 505 HE22 GLN 661 HE22 GLN 661 32.290 -0.886 -8.682 506 H GLU 662 HN GLU 662 25.676 0.895 -10.950 507 HA GLU 662 HA GLU 662 25.524 0.422 -13.740 508 HB2 GLU 662 HB2 GLU 662 24.464 -0.987 -11.962 509 HB3 GLU 662 HB1 GLU 662 23.279 0.288 -11.728 510 HG2 GLU 662 HG2 GLU 662 22.327 -1.415 -13.109 511 HG3 GLU 662 HG1 GLU 662 22.595 0.026 -14.091 512 H THR 663 HN THR 663 23.869 2.731 -11.607 513 HA THR 663 HA THR 663 22.382 3.836 -13.835 514 HB THR 663 HB THR 663 21.489 5.418 -12.074 515 HG1 THR 663 HG1 THR 663 22.754 3.620 -10.262 516 HG21 THR 663 HG21 THR 663 20.110 3.683 -10.993 517 HG22 THR 663 HG22 THR 663 21.220 2.445 -11.584 518 HG23 THR 663 HG23 THR 663 20.274 3.400 -12.727 519 H GLN 664 HN GLN 664 25.461 4.188 -13.107 520 HA GLN 664 HA GLN 664 27.085 5.713 -13.486 521 HB2 GLN 664 HB2 GLN 664 24.908 6.941 -15.173 522 HB3 GLN 664 HB1 GLN 664 26.564 7.525 -15.169 523 HG2 GLN 664 HG2 GLN 664 25.954 4.658 -15.767 524 HG3 GLN 664 HG1 GLN 664 25.794 5.893 -17.013 525 HE21 GLN 664 HE21 GLN 664 28.248 6.143 -14.532 526 HE22 GLN 664 HE22 GLN 664 29.586 5.797 -15.558 527 H GLY 665 HN GLY 665 25.635 6.046 -11.104 528 HA2 GLY 665 HA2 GLY 665 26.269 7.735 -9.477 529 HA3 GLY 665 HA1 GLY 665 26.005 8.952 -10.716 530 H GLY 666 HN GLY 666 23.529 6.956 -11.204 531 HA2 GLY 666 HA2 GLY 666 21.304 6.939 -10.636 532 HA3 GLY 666 HA1 GLY 666 21.818 7.304 -8.996 533 H ARG 667 HN ARG 667 20.479 8.871 -8.369 534 HA ARG 667 HA ARG 667 19.458 10.909 -10.067 535 HB2 ARG 667 HB2 ARG 667 19.577 10.688 -7.059 536 HB3 ARG 667 HB1 ARG 667 18.735 11.969 -7.903 537 HG2 ARG 667 HG2 ARG 667 18.093 9.032 -7.999 538 HG3 ARG 667 HG1 ARG 667 17.181 10.295 -7.170 539 HD2 ARG 667 HD2 ARG 667 15.951 10.162 -9.081 540 HD3 ARG 667 HD1 ARG 667 17.148 11.345 -9.602 541 HE ARG 667 HE ARG 667 17.648 8.513 -10.134 542 HH11 ARG 667 HH11 ARG 667 16.936 11.730 -11.368 543 HH12 ARG 667 HH12 ARG 667 17.109 11.254 -13.026 544 HH21 ARG 667 HH21 ARG 667 17.889 7.902 -12.309 545 HH22 ARG 667 HH22 ARG 667 17.665 9.061 -13.572 546 H TYR 668 HN TYR 668 22.365 10.544 -8.323 547 HA TYR 668 HA TYR 668 22.923 13.309 -7.912 548 HB2 TYR 668 HB2 TYR 668 24.816 10.958 -7.835 549 HB3 TYR 668 HB1 TYR 668 25.084 12.549 -7.124 550 HD1 TYR 668 HD1 TYR 668 23.831 9.254 -6.545 551 HD2 TYR 668 HD2 TYR 668 23.391 13.317 -5.339 552 HE1 TYR 668 HE1 TYR 668 22.737 8.521 -4.484 553 HE2 TYR 668 HE2 TYR 668 22.299 12.583 -3.267 554 HH TYR 668 HH TYR 668 22.247 9.275 -2.306 555 H ALA 669 HN ALA 669 23.114 11.259 -10.588 556 HA ALA 669 HA ALA 669 25.339 12.455 -11.901 557 HB1 ALA 669 HB1 ALA 669 24.531 10.222 -12.496 558 HB2 ALA 669 HB2 ALA 669 24.532 11.297 -13.894 559 HB3 ALA 669 HB3 ALA 669 23.017 10.923 -13.070 560 H GLN 670 HN GLN 670 21.883 13.072 -11.818 561 HA GLN 670 HA GLN 670 22.118 15.181 -13.803 562 HB2 GLN 670 HB2 GLN 670 19.719 14.131 -12.288 563 HB3 GLN 670 HB1 GLN 670 19.646 15.445 -13.451 564 HG2 GLN 670 HG2 GLN 670 19.027 13.710 -14.784 565 HG3 GLN 670 HG1 GLN 670 20.768 13.661 -15.032 566 HE21 GLN 670 HE21 GLN 670 18.863 11.540 -15.373 567 HE22 GLN 670 HE22 GLN 670 19.330 10.266 -14.298 568 H GLY 671 HN GLY 671 22.360 14.850 -10.465 569 HA2 GLY 671 HA2 GLY 671 23.200 16.662 -9.166 570 HA3 GLY 671 HA1 GLY 671 22.342 17.773 -10.221 571 H GLU 672 HN GLU 672 20.663 14.975 -9.111 572 HA GLU 672 HA GLU 672 18.910 16.693 -7.565 573 HB2 GLU 672 HB2 GLU 672 18.689 13.773 -8.287 574 HB3 GLU 672 HB1 GLU 672 17.457 14.689 -7.432 575 HG2 GLU 672 HG2 GLU 672 17.229 16.158 -9.383 576 HG3 GLU 672 HG1 GLU 672 18.432 15.191 -10.232 577 H ASN 673 HN ASN 673 18.524 16.486 -5.394 578 HA ASN 673 HA ASN 673 20.636 15.141 -3.895 579 HB2 ASN 673 HB2 ASN 673 19.884 16.505 -1.979 580 HB3 ASN 673 HB1 ASN 673 20.267 17.510 -3.371 581 HD21 ASN 673 HD21 ASN 673 18.610 18.576 -4.447 582 HD22 ASN 673 HD22 ASN 673 17.031 18.757 -3.767 583 H PHE 674 HN PHE 674 20.082 13.968 -1.932 584 HA PHE 674 HA PHE 674 17.401 12.774 -2.020 585 HB2 PHE 674 HB2 PHE 674 19.287 11.353 -3.081 586 HB3 PHE 674 HB1 PHE 674 19.862 11.139 -1.432 587 HD1 PHE 674 HD1 PHE 674 16.727 10.827 -3.424 588 HD2 PHE 674 HD2 PHE 674 19.131 9.303 -0.262 589 HE1 PHE 674 HE1 PHE 674 15.162 8.950 -3.146 590 HE2 PHE 674 HE2 PHE 674 17.568 7.424 0.022 591 HZ PHE 674 HZ PHE 674 15.582 7.245 -1.422 592 H VAL 675 HN VAL 675 16.440 12.763 -0.091 593 HA VAL 675 HA VAL 675 18.132 13.148 2.278 594 HB VAL 675 HB VAL 675 16.249 14.450 3.313 595 HG11 VAL 675 HG11 VAL 675 17.509 15.570 0.815 596 HG12 VAL 675 HG12 VAL 675 18.153 15.631 2.459 597 HG13 VAL 675 HG13 VAL 675 16.697 16.534 2.047 598 HG21 VAL 675 HG21 VAL 675 15.168 14.466 0.493 599 HG22 VAL 675 HG22 VAL 675 14.572 15.462 1.821 600 HG23 VAL 675 HG23 VAL 675 14.414 13.708 1.896 601 H VAL 676 HN VAL 676 18.002 11.583 3.691 602 HA VAL 676 HA VAL 676 15.617 9.874 3.656 603 HB VAL 676 HB VAL 676 18.428 9.206 4.556 604 HG11 VAL 676 HG11 VAL 676 15.956 7.473 4.459 605 HG12 VAL 676 HG12 VAL 676 16.771 8.041 5.916 606 HG13 VAL 676 HG13 VAL 676 17.587 6.915 4.832 607 HG21 VAL 676 HG21 VAL 676 16.815 8.277 2.184 608 HG22 VAL 676 HG22 VAL 676 18.404 7.665 2.645 609 HG23 VAL 676 HG23 VAL 676 18.219 9.345 2.142 610 H ASN 677 HN ASN 677 14.286 10.404 5.210 611 HA ASN 677 HA ASN 677 15.219 11.567 7.686 612 HB2 ASN 677 HB2 ASN 677 12.414 10.811 6.818 613 HB3 ASN 677 HB1 ASN 677 12.826 11.750 8.249 614 HD21 ASN 677 HD21 ASN 677 11.166 12.458 5.965 615 HD22 ASN 677 HD22 ASN 677 11.858 13.893 5.294 616 H ASP 678 HN ASP 678 14.003 8.525 6.494 617 HA ASP 678 HA ASP 678 14.884 7.204 8.916 618 HB2 ASP 678 HB2 ASP 678 12.572 7.619 9.480 619 HB3 ASP 678 HB1 ASP 678 12.038 7.014 7.916 620 H ILE 679 HN ILE 679 15.423 5.057 8.598 621 HA ILE 679 HA ILE 679 16.082 4.424 5.880 622 HB ILE 679 HB ILE 679 17.131 2.372 6.822 623 HG12 ILE 679 HG12 ILE 679 16.334 3.564 9.491 624 HG13 ILE 679 HG11 ILE 679 15.604 2.133 8.774 625 HG21 ILE 679 HG21 ILE 679 17.872 5.026 8.030 626 HG22 ILE 679 HG22 ILE 679 18.450 4.347 6.508 627 HG23 ILE 679 HG23 ILE 679 18.912 3.602 8.041 628 HD11 ILE 679 HD11 ILE 679 18.489 2.415 9.588 629 HD12 ILE 679 HD12 ILE 679 17.742 0.972 8.898 630 HD13 ILE 679 HD13 ILE 679 17.238 1.556 10.484 631 H TYR 680 HN TYR 680 13.571 3.421 8.077 632 HA TYR 680 HA TYR 680 12.998 1.022 6.586 633 HB2 TYR 680 HB2 TYR 680 11.440 2.422 8.764 634 HB3 TYR 680 HB1 TYR 680 10.983 0.882 8.048 635 HD1 TYR 680 HD1 TYR 680 13.104 2.547 10.448 636 HD2 TYR 680 HD2 TYR 680 12.468 -1.108 8.367 637 HE1 TYR 680 HE1 TYR 680 14.525 1.379 12.074 638 HE2 TYR 680 HE2 TYR 680 13.884 -2.286 9.992 639 HH TYR 680 HH TYR 680 14.880 -0.854 12.930 640 H GLN 681 HN GLN 681 11.418 4.150 7.054 641 HA GLN 681 HA GLN 681 9.311 3.625 5.238 642 HB2 GLN 681 HB2 GLN 681 10.366 6.247 6.285 643 HB3 GLN 681 HB1 GLN 681 8.867 6.057 5.386 644 HG2 GLN 681 HG2 GLN 681 7.994 4.604 7.135 645 HG3 GLN 681 HG1 GLN 681 9.499 4.779 8.033 646 HE21 GLN 681 HE21 GLN 681 6.787 5.449 8.799 647 HE22 GLN 681 HE22 GLN 681 6.790 7.130 9.195 648 H VAL 682 HN VAL 682 12.575 4.592 4.681 649 HA VAL 682 HA VAL 682 12.073 5.918 2.197 650 HB VAL 682 HB VAL 682 14.159 6.292 3.544 651 HG11 VAL 682 HG11 VAL 682 14.991 3.622 2.430 652 HG12 VAL 682 HG12 VAL 682 14.644 3.976 4.122 653 HG13 VAL 682 HG13 VAL 682 16.019 4.741 3.325 654 HG21 VAL 682 HG21 VAL 682 14.569 5.433 0.688 655 HG22 VAL 682 HG22 VAL 682 15.663 6.462 1.613 656 HG23 VAL 682 HG23 VAL 682 14.033 7.025 1.230 657 H GLY 683 HN GLY 683 12.233 2.625 3.131 658 HA2 GLY 683 HA2 GLY 683 11.624 0.801 1.811 659 HA3 GLY 683 HA1 GLY 683 11.715 1.831 0.391 660 H HIS 684 HN HIS 684 14.304 1.527 2.716 661 HA HIS 684 HA HIS 684 16.277 1.101 0.810 662 HB2 HIS 684 HB2 HIS 684 17.793 0.557 2.644 663 HB3 HIS 684 HB1 HIS 684 16.782 1.929 3.069 664 HD2 HIS 684 HD2 HIS 684 14.372 -0.591 3.956 665 HE1 HIS 684 HE1 HIS 684 17.078 -0.773 7.212 666 HE2 HIS 684 HE2 HIS 684 14.911 -1.621 6.254 667 H SER 685 HN SER 685 17.331 -0.606 -0.021 668 HA SER 685 HA SER 685 16.048 -3.104 -0.226 669 HB2 SER 685 HB2 SER 685 18.939 -2.416 -0.812 670 HB3 SER 685 HB1 SER 685 18.041 -3.793 -1.452 671 HG SER 685 HG SER 685 17.650 -1.036 -1.967 672 HA PRO 686 HA PRO 686 17.279 -5.550 3.231 673 HB2 PRO 686 HB2 PRO 686 18.525 -7.445 1.295 674 HB3 PRO 686 HB1 PRO 686 17.366 -7.761 2.592 675 HG2 PRO 686 HG2 PRO 686 16.559 -7.709 0.070 676 HG3 PRO 686 HG1 PRO 686 15.566 -6.988 1.349 677 HD2 PRO 686 HD2 PRO 686 17.284 -5.655 -0.692 678 HD3 PRO 686 HD1 PRO 686 15.721 -5.146 -0.022 679 H CYS 687 HN CYS 687 19.778 -5.133 0.737 680 HA CYS 687 HA CYS 687 21.921 -5.911 2.416 681 HB2 CYS 687 HB2 CYS 687 23.389 -5.117 0.681 682 HB3 CYS 687 HB1 CYS 687 22.026 -5.936 -0.068 683 H HIS 688 HN HIS 688 20.199 -2.942 2.033 684 HA HIS 688 HA HIS 688 22.270 -1.282 3.151 685 HB2 HIS 688 HB2 HIS 688 19.424 -0.824 2.332 686 HB3 HIS 688 HB1 HIS 688 20.227 0.359 3.357 687 HD1 HIS 688 HD1 HIS 688 19.281 0.590 0.189 688 HD2 HIS 688 HD2 HIS 688 23.144 0.311 1.741 689 HE1 HIS 688 HE1 HIS 688 20.767 1.627 -1.513 690 H ILE 689 HN ILE 689 19.929 -3.373 4.433 691 HA ILE 689 HA ILE 689 19.228 -1.969 6.775 692 HB ILE 689 HB ILE 689 19.200 -4.962 6.330 693 HG12 ILE 689 HG12 ILE 689 17.078 -2.854 5.846 694 HG13 ILE 689 HG11 ILE 689 17.952 -3.740 4.604 695 HG21 ILE 689 HG21 ILE 689 17.689 -3.233 8.298 696 HG22 ILE 689 HG22 ILE 689 19.002 -4.343 8.693 697 HG23 ILE 689 HG23 ILE 689 17.471 -4.969 8.077 698 HD11 ILE 689 HD11 ILE 689 16.911 -5.814 5.368 699 HD12 ILE 689 HD12 ILE 689 15.723 -4.601 4.888 700 HD13 ILE 689 HD13 ILE 689 16.029 -4.906 6.599 701 H GLU 690 HN GLU 690 21.762 -4.400 6.173 702 HA GLU 690 HA GLU 690 22.624 -4.337 8.923 703 HB2 GLU 690 HB2 GLU 690 24.047 -5.484 6.517 704 HB3 GLU 690 HB1 GLU 690 24.505 -5.737 8.193 705 HG2 GLU 690 HG2 GLU 690 23.385 -7.665 7.786 706 HG3 GLU 690 HG1 GLU 690 22.053 -6.669 8.369 707 H ILE 691 HN ILE 691 23.238 -2.455 6.132 708 HA ILE 691 HA ILE 691 25.904 -1.669 6.852 709 HB ILE 691 HB ILE 691 23.996 -0.574 4.771 710 HG12 ILE 691 HG12 ILE 691 26.458 -2.322 4.515 711 HG13 ILE 691 HG11 ILE 691 24.794 -2.869 4.351 712 HG21 ILE 691 HG21 ILE 691 25.937 0.618 3.857 713 HG22 ILE 691 HG22 ILE 691 26.903 0.087 5.233 714 HG23 ILE 691 HG23 ILE 691 25.534 1.170 5.482 715 HD11 ILE 691 HD11 ILE 691 26.184 -0.892 2.553 716 HD12 ILE 691 HD12 ILE 691 24.521 -1.454 2.381 717 HD13 ILE 691 HD13 ILE 691 25.859 -2.586 2.184 718 H LEU 692 HN LEU 692 22.711 -0.077 6.816 719 HA LEU 692 HA LEU 692 23.616 2.341 7.925 720 HB2 LEU 692 HB2 LEU 692 20.936 1.053 7.663 721 HB3 LEU 692 HB1 LEU 692 21.098 2.459 8.695 722 HG LEU 692 HG LEU 692 20.292 3.088 6.483 723 HD11 LEU 692 HD11 LEU 692 21.908 4.832 5.972 724 HD12 LEU 692 HD12 LEU 692 23.112 4.020 6.969 725 HD13 LEU 692 HD13 LEU 692 21.652 4.678 7.708 726 HD21 LEU 692 HD21 LEU 692 21.719 2.882 4.504 727 HD22 LEU 692 HD22 LEU 692 21.285 1.304 5.160 728 HD23 LEU 692 HD23 LEU 692 22.894 1.966 5.448 729 H GLU 693 HN GLU 693 22.669 -0.674 9.397 730 HA GLU 693 HA GLU 693 22.514 0.271 12.064 731 HB2 GLU 693 HB2 GLU 693 21.583 -1.898 11.381 732 HB3 GLU 693 HB1 GLU 693 23.204 -2.487 11.035 733 HG2 GLU 693 HG2 GLU 693 23.721 -1.975 13.480 734 HG3 GLU 693 HG1 GLU 693 21.974 -1.850 13.690 735 H GLN 694 HN GLN 694 25.128 -1.100 10.107 736 HA GLN 694 HA GLN 694 27.071 -1.188 12.156 737 HB2 GLN 694 HB2 GLN 694 27.215 -2.431 9.998 738 HB3 GLN 694 HB1 GLN 694 27.526 -0.907 9.182 739 HG2 GLN 694 HG2 GLN 694 29.553 -0.631 10.588 740 HG3 GLN 694 HG1 GLN 694 29.259 -2.236 11.251 741 HE21 GLN 694 HE21 GLN 694 31.532 -1.263 9.749 742 HE22 GLN 694 HE22 GLN 694 31.659 -2.275 8.351 743 H PHE 695 HN PHE 695 26.189 1.262 9.783 744 HA PHE 695 HA PHE 695 28.294 3.037 10.597 745 HB2 PHE 695 HB2 PHE 695 25.971 3.297 8.711 746 HB3 PHE 695 HB1 PHE 695 26.935 4.700 9.156 747 HD1 PHE 695 HD1 PHE 695 27.262 1.255 7.777 748 HD2 PHE 695 HD2 PHE 695 28.862 5.189 7.977 749 HE1 PHE 695 HE1 PHE 695 28.914 0.667 6.053 750 HE2 PHE 695 HE2 PHE 695 30.514 4.608 6.254 751 HZ PHE 695 HZ PHE 695 30.542 2.345 5.288 752 H GLU 696 HN GLU 696 25.357 2.202 11.918 753 HA GLU 696 HA GLU 696 24.092 2.987 13.615 754 HB2 GLU 696 HB2 GLU 696 26.362 2.995 14.681 755 HB3 GLU 696 HB1 GLU 696 26.499 4.696 14.270 756 HG2 GLU 696 HG2 GLU 696 24.634 5.232 15.700 757 HG3 GLU 696 HG1 GLU 696 24.370 3.522 16.042 758 H VAL 697 HN VAL 697 23.026 4.040 11.588 759 HA VAL 697 HA VAL 697 22.263 6.674 12.409 760 HB VAL 697 HB VAL 697 24.288 7.226 11.149 761 HG11 VAL 697 HG11 VAL 697 24.462 6.806 8.753 762 HG12 VAL 697 HG12 VAL 697 22.945 5.908 8.796 763 HG13 VAL 697 HG13 VAL 697 24.354 5.296 9.660 764 HG21 VAL 697 HG21 VAL 697 23.231 8.770 9.464 765 HG22 VAL 697 HG22 VAL 697 22.577 8.875 11.094 766 HG23 VAL 697 HG23 VAL 697 21.690 8.006 9.844 767 H LYS 698 HN LYS 698 20.325 7.370 11.423 768 HA LYS 698 HA LYS 698 19.031 5.458 9.608 769 HB2 LYS 698 HB2 LYS 698 17.854 6.876 11.990 770 HB3 LYS 698 HB1 LYS 698 16.870 6.142 10.734 771 HG2 LYS 698 HG2 LYS 698 17.684 3.965 11.265 772 HG3 LYS 698 HG1 LYS 698 18.899 4.630 12.359 773 HD2 LYS 698 HD2 LYS 698 16.934 3.701 13.549 774 HD3 LYS 698 HD1 LYS 698 17.183 5.416 13.860 775 HE2 LYS 698 HE2 LYS 698 15.470 5.927 12.137 776 HE3 LYS 698 HE1 LYS 698 15.171 4.197 11.974 777 HZ1 LYS 698 HZ1 LYS 698 14.848 5.748 14.482 778 HZ2 LYS 698 HZ2 LYS 698 14.467 4.118 14.257 779 HZ3 LYS 698 HZ3 LYS 698 13.590 5.309 13.448 780 H ALA 699 HN ALA 699 19.381 8.789 10.677 781 HA ALA 699 HA ALA 699 17.949 9.693 8.289 782 HB1 ALA 699 HB1 ALA 699 17.771 11.854 9.412 783 HB2 ALA 699 HB2 ALA 699 18.697 11.232 10.777 784 HB3 ALA 699 HB3 ALA 699 17.103 10.569 10.419 785 H TYR 700 HN TYR 700 19.009 10.744 6.718 786 HA TYR 700 HA TYR 700 21.510 12.016 7.138 787 HB2 TYR 700 HB2 TYR 700 22.920 10.591 5.735 788 HB3 TYR 700 HB1 TYR 700 22.339 9.718 7.142 789 HD1 TYR 700 HD1 TYR 700 22.118 10.038 3.490 790 HD2 TYR 700 HD2 TYR 700 20.864 7.815 6.890 791 HE1 TYR 700 HE1 TYR 700 21.353 8.234 2.011 792 HE2 TYR 700 HE2 TYR 700 20.090 5.999 5.424 793 HH TYR 700 HH TYR 700 19.365 5.714 3.073 794 H VAL 701 HN VAL 701 22.414 12.900 5.146 795 HA VAL 701 HA VAL 701 20.442 13.140 2.997 796 HB VAL 701 HB VAL 701 20.065 15.109 4.342 797 HG11 VAL 701 HG11 VAL 701 21.839 16.697 4.907 798 HG12 VAL 701 HG12 VAL 701 23.031 15.617 4.187 799 HG13 VAL 701 HG13 VAL 701 22.134 15.111 5.619 800 HG21 VAL 701 HG21 VAL 701 20.085 15.434 1.903 801 HG22 VAL 701 HG22 VAL 701 21.789 15.875 1.985 802 HG23 VAL 701 HG23 VAL 701 20.577 16.890 2.767 803 H ILE 702 HN ILE 702 21.300 13.196 0.980 804 HA ILE 702 HA ILE 702 24.247 13.283 0.776 805 HB ILE 702 HB ILE 702 22.525 11.693 -1.117 806 HG12 ILE 702 HG12 ILE 702 22.133 10.845 1.217 807 HG13 ILE 702 HG11 ILE 702 22.869 9.668 0.139 808 HG21 ILE 702 HG21 ILE 702 24.628 10.480 -1.514 809 HG22 ILE 702 HG22 ILE 702 25.438 11.528 -0.352 810 HG23 ILE 702 HG23 ILE 702 24.778 12.206 -1.839 811 HD11 ILE 702 HD11 ILE 702 23.868 9.587 2.338 812 HD12 ILE 702 HD12 ILE 702 24.292 11.295 2.227 813 HD13 ILE 702 HD13 ILE 702 25.044 10.126 1.140 814 H VAL 703 HN VAL 703 24.902 14.941 -0.467 815 HA VAL 703 HA VAL 703 23.114 15.782 -2.646 816 HB VAL 703 HB VAL 703 24.003 18.086 -2.447 817 HG11 VAL 703 HG11 VAL 703 21.899 17.521 -1.374 818 HG12 VAL 703 HG12 VAL 703 22.780 18.715 -0.421 819 HG13 VAL 703 HG13 VAL 703 22.756 17.026 0.085 820 HG21 VAL 703 HG21 VAL 703 26.145 17.612 -1.408 821 HG22 VAL 703 HG22 VAL 703 25.334 17.061 0.059 822 HG23 VAL 703 HG23 VAL 703 25.228 18.754 -0.425 823 HA PRO 704 HA PRO 704 26.500 14.865 -5.308 824 HB2 PRO 704 HB2 PRO 704 25.661 16.100 -7.548 825 HB3 PRO 704 HB1 PRO 704 24.868 14.648 -6.925 826 HG2 PRO 704 HG2 PRO 704 24.045 17.511 -6.673 827 HG3 PRO 704 HG1 PRO 704 23.048 16.084 -7.001 828 HD2 PRO 704 HD2 PRO 704 23.268 17.252 -4.535 829 HD3 PRO 704 HD1 PRO 704 22.888 15.537 -4.785 830 H VAL 705 HN VAL 705 28.472 15.707 -5.566 831 HA VAL 705 HA VAL 705 28.744 18.629 -5.474 832 HB VAL 705 HB VAL 705 30.824 16.524 -4.829 833 HG11 VAL 705 HG11 VAL 705 32.153 18.400 -3.972 834 HG12 VAL 705 HG12 VAL 705 30.912 19.525 -4.520 835 HG13 VAL 705 HG13 VAL 705 31.819 18.575 -5.695 836 HG21 VAL 705 HG21 VAL 705 29.055 16.573 -3.153 837 HG22 VAL 705 HG22 VAL 705 29.237 18.319 -2.990 838 HG23 VAL 705 HG23 VAL 705 30.548 17.247 -2.497 839 H PHE 706 HN PHE 706 28.882 19.410 -7.457 840 HA PHE 706 HA PHE 706 30.352 17.948 -9.510 841 HB2 PHE 706 HB2 PHE 706 28.623 20.425 -9.690 842 HB3 PHE 706 HB1 PHE 706 29.436 19.671 -11.056 843 HD1 PHE 706 HD1 PHE 706 26.594 19.574 -8.842 844 HD2 PHE 706 HD2 PHE 706 28.757 17.404 -11.791 845 HE1 PHE 706 HE1 PHE 706 24.660 18.098 -9.168 846 HE2 PHE 706 HE2 PHE 706 26.824 15.922 -12.126 847 HZ PHE 706 HZ PHE 706 24.773 16.266 -10.814 848 H ALA 707 HN ALA 707 32.426 18.348 -9.692 849 HA ALA 707 HA ALA 707 33.367 21.089 -9.317 850 HB1 ALA 707 HB1 ALA 707 35.281 20.330 -8.039 851 HB2 ALA 707 HB2 ALA 707 34.726 18.661 -8.155 852 HB3 ALA 707 HB3 ALA 707 33.790 19.839 -7.236 853 H GLY 708 HN GLY 708 34.083 21.634 -11.241 854 HA2 GLY 708 HA2 GLY 708 35.955 21.528 -12.742 855 HA3 GLY 708 HA1 GLY 708 35.932 19.779 -12.570 856 H GLU 709 HN GLU 709 34.614 18.571 -13.849 857 HA GLU 709 HA GLU 709 33.242 20.073 -15.973 858 HB2 GLU 709 HB2 GLU 709 33.712 18.170 -17.450 859 HB3 GLU 709 HB1 GLU 709 35.187 18.858 -16.787 860 HG2 GLU 709 HG2 GLU 709 35.114 17.035 -15.050 861 HG3 GLU 709 HG1 GLU 709 33.827 16.299 -16.001 862 H GLN 710 HN GLN 710 33.017 17.241 -13.864 863 HA GLN 710 HA GLN 710 30.131 17.195 -14.277 864 HB2 GLN 710 HB2 GLN 710 31.935 14.802 -14.746 865 HB3 GLN 710 HB1 GLN 710 30.190 14.694 -14.589 866 HG2 GLN 710 HG2 GLN 710 29.879 16.028 -16.576 867 HG3 GLN 710 HG1 GLN 710 31.613 16.306 -16.700 868 HE21 GLN 710 HE21 GLN 710 29.784 15.127 -18.614 869 HE22 GLN 710 HE22 GLN 710 30.388 13.543 -18.951 870 H LEU 711 HN LEU 711 29.723 14.752 -12.928 871 HA LEU 711 HA LEU 711 29.735 15.595 -10.257 872 HB2 LEU 711 HB2 LEU 711 28.135 13.979 -11.234 873 HB3 LEU 711 HB1 LEU 711 29.426 12.801 -11.369 874 HG LEU 711 HG LEU 711 29.628 12.753 -8.914 875 HD11 LEU 711 HD11 LEU 711 27.252 14.611 -8.975 876 HD12 LEU 711 HD12 LEU 711 28.876 15.010 -8.411 877 HD13 LEU 711 HD13 LEU 711 27.906 13.825 -7.538 878 HD21 LEU 711 HD21 LEU 711 27.527 11.581 -8.477 879 HD22 LEU 711 HD22 LEU 711 28.185 11.149 -10.055 880 HD23 LEU 711 HD23 LEU 711 26.832 12.273 -9.943 881 H TRP 712 HN TRP 712 31.369 15.696 -8.906 882 HA TRP 712 HA TRP 712 33.784 14.130 -9.439 883 HB2 TRP 712 HB2 TRP 712 34.111 16.527 -9.203 884 HB3 TRP 712 HB1 TRP 712 33.280 16.524 -7.654 885 HD1 TRP 712 HD1 TRP 712 36.625 15.577 -9.262 886 HE1 TRP 712 HE1 TRP 712 38.386 15.296 -7.407 887 HE3 TRP 712 HE3 TRP 712 33.574 15.926 -5.161 888 HZ2 TRP 712 HZ2 TRP 712 38.477 15.211 -4.590 889 HZ3 TRP 712 HZ3 TRP 712 34.587 15.732 -2.921 890 HH2 TRP 712 HH2 TRP 712 36.983 15.383 -2.648 891 H GLY 713 HN GLY 713 31.627 15.006 -6.750 892 HA2 GLY 713 HA2 GLY 713 32.078 12.420 -5.556 893 HA3 GLY 713 HA1 GLY 713 32.704 13.794 -4.659 894 H LEU 714 HN LEU 714 31.202 12.905 -3.078 895 HA LEU 714 HA LEU 714 28.557 14.092 -3.384 896 HB2 LEU 714 HB2 LEU 714 29.035 11.277 -2.395 897 HB3 LEU 714 HB1 LEU 714 27.539 12.150 -2.152 898 HG LEU 714 HG LEU 714 28.691 11.160 -4.755 899 HD11 LEU 714 HD11 LEU 714 26.593 9.920 -4.876 900 HD12 LEU 714 HD12 LEU 714 26.109 10.583 -3.316 901 HD13 LEU 714 HD13 LEU 714 27.503 9.511 -3.423 902 HD21 LEU 714 HD21 LEU 714 26.705 12.145 -5.826 903 HD22 LEU 714 HD22 LEU 714 27.798 13.359 -5.171 904 HD23 LEU 714 HD23 LEU 714 26.310 12.955 -4.310 905 H LEU 715 HN LEU 715 27.668 14.817 -1.484 906 HA LEU 715 HA LEU 715 29.512 14.861 0.813 907 HB2 LEU 715 HB2 LEU 715 29.269 17.061 -0.193 908 HB3 LEU 715 HB1 LEU 715 27.527 16.936 -0.122 909 HG LEU 715 HG LEU 715 27.590 17.061 2.318 910 HD11 LEU 715 HD11 LEU 715 29.679 17.551 3.487 911 HD12 LEU 715 HD12 LEU 715 30.572 17.335 1.981 912 HD13 LEU 715 HD13 LEU 715 29.729 15.970 2.711 913 HD21 LEU 715 HD21 LEU 715 29.190 19.234 0.974 914 HD22 LEU 715 HD22 LEU 715 28.352 19.376 2.519 915 HD23 LEU 715 HD23 LEU 715 27.431 19.126 1.038 916 H ALA 716 HN ALA 716 28.820 13.563 2.346 917 HA ALA 716 HA ALA 716 25.912 13.231 2.715 918 HB1 ALA 716 HB1 ALA 716 26.379 10.970 3.465 919 HB2 ALA 716 HB2 ALA 716 28.106 11.233 3.227 920 HB3 ALA 716 HB3 ALA 716 27.016 11.232 1.843 921 H ALA 717 HN ALA 717 25.081 13.368 4.709 922 HA ALA 717 HA ALA 717 26.939 13.708 6.956 923 HB1 ALA 717 HB1 ALA 717 25.528 15.462 7.879 924 HB2 ALA 717 HB2 ALA 717 24.458 15.363 6.476 925 HB3 ALA 717 HB3 ALA 717 26.126 15.911 6.284 926 H TYR 718 HN TYR 718 26.437 12.626 8.746 927 HA TYR 718 HA TYR 718 23.854 11.183 8.892 928 HB2 TYR 718 HB2 TYR 718 26.559 10.072 9.679 929 HB3 TYR 718 HB1 TYR 718 25.037 9.206 9.670 930 HD1 TYR 718 HD1 TYR 718 27.843 10.400 7.677 931 HD2 TYR 718 HD2 TYR 718 24.070 8.442 7.523 932 HE1 TYR 718 HE1 TYR 718 28.367 9.585 5.422 933 HE2 TYR 718 HE2 TYR 718 24.584 7.622 5.262 934 HH TYR 718 HH TYR 718 26.023 8.132 3.386 935 H GLN 719 HN GLN 719 22.888 11.353 10.947 936 HA GLN 719 HA GLN 719 24.708 12.015 13.137 937 HB2 GLN 719 HB2 GLN 719 23.109 13.683 14.043 938 HB3 GLN 719 HB1 GLN 719 23.889 14.159 12.546 939 HG2 GLN 719 HG2 GLN 719 21.916 13.784 11.292 940 HG3 GLN 719 HG1 GLN 719 21.136 12.962 12.643 941 HE21 GLN 719 HE21 GLN 719 22.066 14.870 14.615 942 HE22 GLN 719 HE22 GLN 719 21.140 16.306 14.386 943 H ASN 720 HN ASN 720 24.600 10.239 14.201 944 HA ASN 720 HA ASN 720 23.744 8.395 15.328 945 HB2 ASN 720 HB2 ASN 720 22.879 10.836 16.862 946 HB3 ASN 720 HB1 ASN 720 22.832 9.209 17.532 947 HD21 ASN 720 HD21 ASN 720 24.863 11.827 16.473 948 HD22 ASN 720 HD22 ASN 720 26.325 11.207 17.162 949 H SER 721 HN SER 721 22.170 7.810 13.583 950 HA SER 721 HA SER 721 20.135 6.937 13.005 951 HB2 SER 721 HB2 SER 721 19.676 7.024 15.997 952 HB3 SER 721 HB1 SER 721 18.804 6.018 14.840 953 HG SER 721 HG SER 721 21.321 5.702 15.923 954 H GLY 722 HN GLY 722 17.704 7.518 14.873 955 HA2 GLY 722 HA2 GLY 722 16.274 9.303 15.340 956 HA3 GLY 722 HA1 GLY 722 17.324 10.359 14.411 957 H THR 723 HN THR 723 14.924 10.888 13.891 958 HA THR 723 HA THR 723 14.372 9.703 11.266 959 HB THR 723 HB THR 723 11.904 10.016 11.865 960 HG1 THR 723 HG1 THR 723 11.695 10.811 13.813 961 HG21 THR 723 HG21 THR 723 12.895 7.813 11.480 962 HG22 THR 723 HG22 THR 723 11.741 7.738 12.809 963 HG23 THR 723 HG23 THR 723 13.471 7.771 13.145 964 H ARG 724 HN ARG 724 15.537 12.158 12.371 965 HA ARG 724 HA ARG 724 13.956 14.412 12.312 966 HB2 ARG 724 HB2 ARG 724 16.310 14.424 12.996 967 HB3 ARG 724 HB1 ARG 724 16.802 14.155 11.332 968 HG2 ARG 724 HG2 ARG 724 15.789 16.319 10.718 969 HG3 ARG 724 HG1 ARG 724 15.402 16.587 12.419 970 HD2 ARG 724 HD2 ARG 724 17.797 16.445 12.964 971 HD3 ARG 724 HD1 ARG 724 18.161 16.229 11.252 972 HE ARG 724 HE ARG 724 16.635 18.580 11.683 973 HH11 ARG 724 HH11 ARG 724 19.910 17.318 11.968 974 HH12 ARG 724 HH12 ARG 724 20.651 18.883 11.847 975 HH21 ARG 724 HH21 ARG 724 17.615 20.625 11.523 976 HH22 ARG 724 HH22 ARG 724 19.337 20.774 11.601 977 H ASP 725 HN ASP 725 12.699 15.247 10.819 978 HA ASP 725 HA ASP 725 12.895 14.508 8.050 979 HB2 ASP 725 HB2 ASP 725 10.711 14.963 9.191 980 HB3 ASP 725 HB1 ASP 725 11.179 16.653 9.337 981 H TRP 726 HN TRP 726 14.498 15.316 6.897 982 HA TRP 726 HA TRP 726 15.958 17.610 7.552 983 HB2 TRP 726 HB2 TRP 726 15.751 16.148 4.919 984 HB3 TRP 726 HB1 TRP 726 16.947 17.391 5.279 985 HD1 TRP 726 HD1 TRP 726 16.260 13.730 5.718 986 HE1 TRP 726 HE1 TRP 726 18.188 12.629 7.001 987 HE3 TRP 726 HE3 TRP 726 18.731 17.945 7.225 988 HZ2 TRP 726 HZ2 TRP 726 20.474 13.439 8.465 989 HZ3 TRP 726 HZ3 TRP 726 20.780 17.695 8.564 990 HH2 TRP 726 HH2 TRP 726 21.631 15.489 9.170 991 H ASP 727 HN ASP 727 15.253 19.580 7.584 992 HA ASP 727 HA ASP 727 13.036 20.507 6.080 993 HB2 ASP 727 HB2 ASP 727 13.460 21.495 8.226 994 HB3 ASP 727 HB1 ASP 727 15.089 21.955 7.750 995 H GLU 728 HN GLU 728 12.967 21.908 4.394 996 HA GLU 728 HA GLU 728 14.827 21.482 2.356 997 HB2 GLU 728 HB2 GLU 728 12.495 22.130 1.934 998 HB3 GLU 728 HB1 GLU 728 12.847 23.746 2.529 999 HG2 GLU 728 HG2 GLU 728 14.534 23.987 0.733 1000 HG3 GLU 728 HG1 GLU 728 14.026 22.424 0.101 1001 H SER 729 HN SER 729 14.365 24.442 4.346 1002 HA SER 729 HA SER 729 16.342 25.977 3.181 1003 HB2 SER 729 HB2 SER 729 14.649 26.808 4.792 1004 HB3 SER 729 HB1 SER 729 15.501 25.978 6.091 1005 HG SER 729 HG SER 729 16.240 28.030 6.133 1006 H GLU 730 HN GLU 730 16.665 23.322 5.393 1007 HA GLU 730 HA GLU 730 19.365 23.959 6.195 1008 HB2 GLU 730 HB2 GLU 730 17.863 21.339 6.415 1009 HB3 GLU 730 HB1 GLU 730 19.364 21.740 7.235 1010 HG2 GLU 730 HG2 GLU 730 16.686 23.034 7.674 1011 HG3 GLU 730 HG1 GLU 730 17.490 21.896 8.755 1012 H VAL 731 HN VAL 731 17.767 21.737 3.975 1013 HA VAL 731 HA VAL 731 20.139 20.554 2.956 1014 HB VAL 731 HB VAL 731 17.415 20.737 1.632 1015 HG11 VAL 731 HG11 VAL 731 19.688 18.800 1.188 1016 HG12 VAL 731 HG12 VAL 731 19.181 20.076 0.083 1017 HG13 VAL 731 HG13 VAL 731 18.102 18.722 0.419 1018 HG21 VAL 731 HG21 VAL 731 17.258 19.756 3.864 1019 HG22 VAL 731 HG22 VAL 731 18.526 18.600 3.453 1020 HG23 VAL 731 HG23 VAL 731 16.975 18.545 2.615 1021 H THR 732 HN THR 732 18.403 23.503 2.247 1022 HA THR 732 HA THR 732 19.455 23.913 -0.370 1023 HB THR 732 HB THR 732 18.374 25.974 1.585 1024 HG1 THR 732 HG1 THR 732 16.939 24.137 0.995 1025 HG21 THR 732 HG21 THR 732 19.600 26.931 -0.324 1026 HG22 THR 732 HG22 THR 732 17.875 27.283 -0.426 1027 HG23 THR 732 HG23 THR 732 18.577 26.017 -1.433 1028 H LEU 733 HN LEU 733 20.408 24.700 2.912 1029 HA LEU 733 HA LEU 733 22.503 26.503 2.277 1030 HB2 LEU 733 HB2 LEU 733 21.299 26.175 4.512 1031 HB3 LEU 733 HB1 LEU 733 22.260 24.731 4.719 1032 HG LEU 733 HG LEU 733 23.477 27.484 4.421 1033 HD11 LEU 733 HD11 LEU 733 22.747 25.974 6.923 1034 HD12 LEU 733 HD12 LEU 733 22.060 27.503 6.372 1035 HD13 LEU 733 HD13 LEU 733 23.749 27.422 6.870 1036 HD21 LEU 733 HD21 LEU 733 24.993 25.610 3.952 1037 HD22 LEU 733 HD22 LEU 733 24.588 24.891 5.511 1038 HD23 LEU 733 HD23 LEU 733 25.438 26.435 5.446 1039 H LEU 734 HN LEU 734 22.291 23.048 2.945 1040 HA LEU 734 HA LEU 734 25.014 22.420 2.839 1041 HB2 LEU 734 HB2 LEU 734 23.179 20.972 3.710 1042 HB3 LEU 734 HB1 LEU 734 22.702 20.653 2.056 1043 HG LEU 734 HG LEU 734 24.935 19.630 1.657 1044 HD11 LEU 734 HD11 LEU 734 26.194 20.777 3.391 1045 HD12 LEU 734 HD12 LEU 734 26.306 19.030 3.592 1046 HD13 LEU 734 HD13 LEU 734 25.242 19.969 4.636 1047 HD21 LEU 734 HD21 LEU 734 24.462 17.572 2.902 1048 HD22 LEU 734 HD22 LEU 734 23.006 18.248 2.172 1049 HD23 LEU 734 HD23 LEU 734 23.301 18.452 3.897 1050 H ALA 735 HN ALA 735 22.609 22.722 0.292 1051 HA ALA 735 HA ALA 735 24.256 21.630 -1.767 1052 HB1 ALA 735 HB1 ALA 735 22.570 22.493 -3.304 1053 HB2 ALA 735 HB2 ALA 735 21.847 23.434 -2.000 1054 HB3 ALA 735 HB3 ALA 735 21.810 21.672 -1.941 1055 H ARG 736 HN ARG 736 23.502 24.885 -0.670 1056 HA ARG 736 HA ARG 736 24.935 26.237 -2.702 1057 HB2 ARG 736 HB2 ARG 736 24.153 27.171 0.061 1058 HB3 ARG 736 HB1 ARG 736 24.859 28.214 -1.166 1059 HG2 ARG 736 HG2 ARG 736 22.942 27.698 -2.649 1060 HG3 ARG 736 HG1 ARG 736 22.224 26.765 -1.335 1061 HD2 ARG 736 HD2 ARG 736 22.182 28.780 0.061 1062 HD3 ARG 736 HD1 ARG 736 22.893 29.705 -1.261 1063 HE ARG 736 HE ARG 736 20.579 28.474 -2.221 1064 HH11 ARG 736 HH11 ARG 736 21.482 30.987 0.053 1065 HH12 ARG 736 HH12 ARG 736 19.980 31.830 -0.081 1066 HH21 ARG 736 HH21 ARG 736 18.592 29.593 -2.415 1067 HH22 ARG 736 HH22 ARG 736 18.327 31.035 -1.492 1068 H ILE 737 HN ILE 737 25.904 25.148 0.531 1069 HA ILE 737 HA ILE 737 28.515 26.290 0.339 1070 HB ILE 737 HB ILE 737 27.477 25.756 2.536 1071 HG12 ILE 737 HG12 ILE 737 29.485 24.633 3.570 1072 HG13 ILE 737 HG11 ILE 737 30.105 24.388 1.942 1073 HG21 ILE 737 HG21 ILE 737 27.395 23.481 3.360 1074 HG22 ILE 737 HG22 ILE 737 27.968 22.881 1.804 1075 HG23 ILE 737 HG23 ILE 737 26.392 23.666 1.923 1076 HD11 ILE 737 HD11 ILE 737 31.105 26.326 3.009 1077 HD12 ILE 737 HD12 ILE 737 29.507 27.044 3.216 1078 HD13 ILE 737 HD13 ILE 737 30.160 26.794 1.597 1079 H GLY 738 HN GLY 738 27.080 23.237 -0.598 1080 HA2 GLY 738 HA2 GLY 738 29.438 21.741 -0.964 1081 HA3 GLY 738 HA1 GLY 738 27.898 21.442 -1.758 1082 H ASN 739 HN ASN 739 27.611 23.821 -3.167 1083 HA ASN 739 HA ASN 739 29.180 23.322 -5.457 1084 HB2 ASN 739 HB2 ASN 739 27.362 25.586 -4.673 1085 HB3 ASN 739 HB1 ASN 739 28.306 25.669 -6.156 1086 HD21 ASN 739 HD21 ASN 739 25.675 24.091 -4.508 1087 HD22 ASN 739 HD22 ASN 739 25.038 23.290 -5.899 1088 H GLN 740 HN GLN 740 29.532 25.604 -2.815 1089 HA GLN 740 HA GLN 740 31.627 27.125 -3.959 1090 HB2 GLN 740 HB2 GLN 740 30.238 27.876 -2.038 1091 HB3 GLN 740 HB1 GLN 740 31.026 26.671 -1.029 1092 HG2 GLN 740 HG2 GLN 740 33.172 27.784 -1.368 1093 HG3 GLN 740 HG1 GLN 740 32.389 28.987 -2.389 1094 HE21 GLN 740 HE21 GLN 740 32.959 30.683 -1.056 1095 HE22 GLN 740 HE22 GLN 740 32.240 30.939 0.492 1096 H LEU 741 HN LEU 741 31.523 24.130 -2.156 1097 HA LEU 741 HA LEU 741 34.345 23.989 -1.650 1098 HB2 LEU 741 HB2 LEU 741 32.226 21.834 -1.617 1099 HB3 LEU 741 HB1 LEU 741 33.874 21.622 -1.062 1100 HG LEU 741 HG LEU 741 31.845 23.492 0.165 1101 HD11 LEU 741 HD11 LEU 741 32.927 20.850 1.127 1102 HD12 LEU 741 HD12 LEU 741 31.288 21.159 0.554 1103 HD13 LEU 741 HD13 LEU 741 31.863 21.921 2.038 1104 HD21 LEU 741 HD21 LEU 741 34.645 22.763 1.027 1105 HD22 LEU 741 HD22 LEU 741 33.505 23.734 1.958 1106 HD23 LEU 741 HD23 LEU 741 34.116 24.330 0.415 1107 H GLY 742 HN GLY 742 32.221 23.152 -4.209 1108 HA2 GLY 742 HA2 GLY 742 33.970 21.322 -5.566 1109 HA3 GLY 742 HA1 GLY 742 32.558 22.114 -6.263 1110 H LEU 743 HN LEU 743 33.225 24.745 -5.827 1111 HA LEU 743 HA LEU 743 34.941 25.315 -7.998 1112 HB2 LEU 743 HB2 LEU 743 33.047 26.742 -7.060 1113 HB3 LEU 743 HB1 LEU 743 34.142 27.210 -5.781 1114 HG LEU 743 HG LEU 743 34.754 27.731 -8.695 1115 HD11 LEU 743 HD11 LEU 743 33.385 29.554 -6.726 1116 HD12 LEU 743 HD12 LEU 743 32.629 28.788 -8.122 1117 HD13 LEU 743 HD13 LEU 743 33.904 29.985 -8.355 1118 HD21 LEU 743 HD21 LEU 743 35.774 28.978 -6.135 1119 HD22 LEU 743 HD22 LEU 743 36.226 29.467 -7.768 1120 HD23 LEU 743 HD23 LEU 743 36.665 27.865 -7.174 1121 H ALA 744 HN ALA 744 35.346 25.496 -4.480 1122 HA ALA 744 HA ALA 744 37.939 26.545 -4.421 1123 HB1 ALA 744 HB1 ALA 744 38.051 25.698 -2.133 1124 HB2 ALA 744 HB2 ALA 744 36.633 24.692 -2.429 1125 HB3 ALA 744 HB3 ALA 744 36.488 26.449 -2.455 1126 H LEU 745 HN LEU 745 36.794 23.234 -4.741 1127 HA LEU 745 HA LEU 745 39.221 21.892 -4.378 1128 HB2 LEU 745 HB2 LEU 745 37.042 20.763 -4.508 1129 HB3 LEU 745 HB1 LEU 745 36.934 21.184 -6.205 1130 HG LEU 745 HG LEU 745 39.199 19.884 -6.363 1131 HD11 LEU 745 HD11 LEU 745 39.229 17.941 -4.857 1132 HD12 LEU 745 HD12 LEU 745 37.960 18.703 -3.895 1133 HD13 LEU 745 HD13 LEU 745 39.542 19.471 -4.037 1134 HD21 LEU 745 HD21 LEU 745 36.517 18.550 -6.104 1135 HD22 LEU 745 HD22 LEU 745 37.938 17.847 -6.875 1136 HD23 LEU 745 HD23 LEU 745 37.190 19.291 -7.555 1137 H GLN 746 HN GLN 746 37.641 22.749 -7.476 1138 HA GLN 746 HA GLN 746 39.787 22.088 -9.112 1139 HB2 GLN 746 HB2 GLN 746 37.487 22.503 -9.921 1140 HB3 GLN 746 HB1 GLN 746 37.701 24.219 -9.602 1141 HG2 GLN 746 HG2 GLN 746 39.587 24.225 -11.222 1142 HG3 GLN 746 HG1 GLN 746 39.202 22.550 -11.608 1143 HE21 GLN 746 HE21 GLN 746 38.248 25.858 -11.917 1144 HE22 GLN 746 HE22 GLN 746 37.016 25.603 -13.105 1145 H GLN 747 HN GLN 747 38.983 25.143 -7.535 1146 HA GLN 747 HA GLN 747 40.891 26.738 -8.795 1147 HB2 GLN 747 HB2 GLN 747 38.990 27.549 -7.386 1148 HB3 GLN 747 HB1 GLN 747 39.907 27.070 -5.964 1149 HG2 GLN 747 HG2 GLN 747 40.126 29.451 -6.396 1150 HG3 GLN 747 HG1 GLN 747 41.679 28.628 -6.559 1151 HE21 GLN 747 HE21 GLN 747 39.127 30.274 -8.217 1152 HE22 GLN 747 HE22 GLN 747 39.950 30.464 -9.725 1153 H THR 748 HN THR 748 41.156 24.924 -5.733 1154 HA THR 748 HA THR 748 43.772 25.809 -5.168 1155 HB THR 748 HB THR 748 43.876 23.748 -3.667 1156 HG1 THR 748 HG1 THR 748 41.104 23.543 -4.250 1157 HG21 THR 748 HG21 THR 748 43.188 25.957 -2.849 1158 HG22 THR 748 HG22 THR 748 42.263 24.675 -2.068 1159 HG23 THR 748 HG23 THR 748 41.530 25.629 -3.357 1160 H GLU 749 HN GLU 749 42.581 22.950 -6.894 1161 HA GLU 749 HA GLU 749 45.123 21.770 -7.287 1162 HB2 GLU 749 HB2 GLU 749 42.624 21.504 -8.971 1163 HB3 GLU 749 HB1 GLU 749 44.028 20.451 -9.063 1164 HG2 GLU 749 HG2 GLU 749 43.626 19.797 -6.704 1165 HG3 GLU 749 HG1 GLU 749 42.151 20.763 -6.728 1166 H TYR 750 HN TYR 750 43.198 24.031 -9.189 1167 HA TYR 750 HA TYR 750 44.937 24.165 -11.417 1168 HB2 TYR 750 HB2 TYR 750 42.614 24.905 -11.559 1169 HB3 TYR 750 HB1 TYR 750 42.919 26.170 -10.376 1170 HD1 TYR 750 HD1 TYR 750 43.829 25.032 -13.797 1171 HD2 TYR 750 HD2 TYR 750 43.667 28.289 -11.065 1172 HE1 TYR 750 HE1 TYR 750 44.398 26.585 -15.618 1173 HE2 TYR 750 HE2 TYR 750 44.235 29.847 -12.878 1174 HH TYR 750 HH TYR 750 45.393 29.753 -15.083 1175 H LEU 751 HN LEU 751 44.738 25.951 -8.394 1176 HA LEU 751 HA LEU 751 46.618 27.962 -8.998 1177 HB2 LEU 751 HB2 LEU 751 45.035 28.056 -7.107 1178 HB3 LEU 751 HB1 LEU 751 45.915 26.765 -6.315 1179 HG LEU 751 HG LEU 751 47.903 28.259 -6.186 1180 HD11 LEU 751 HD11 LEU 751 47.402 29.734 -8.048 1181 HD12 LEU 751 HD12 LEU 751 47.595 30.660 -6.560 1182 HD13 LEU 751 HD13 LEU 751 45.983 30.348 -7.200 1183 HD21 LEU 751 HD21 LEU 751 46.388 28.017 -4.292 1184 HD22 LEU 751 HD22 LEU 751 45.381 29.323 -4.918 1185 HD23 LEU 751 HD23 LEU 751 47.027 29.659 -4.383 1186 H GLN 752 HN GLN 752 46.989 24.636 -8.129 1187 HA GLN 752 HA GLN 752 49.680 24.798 -7.206 1188 HB2 GLN 752 HB2 GLN 752 48.200 22.910 -6.644 1189 HB3 GLN 752 HB1 GLN 752 48.156 22.440 -8.335 1190 HG2 GLN 752 HG2 GLN 752 50.576 22.016 -8.262 1191 HG3 GLN 752 HG1 GLN 752 50.582 22.442 -6.552 1192 HE21 GLN 752 HE21 GLN 752 51.310 20.406 -5.949 1193 HE22 GLN 752 HE22 GLN 752 50.291 19.013 -5.999 1194 H GLN 753 HN GLN 753 48.180 24.749 -10.304 1195 HA GLN 753 HA GLN 753 50.585 23.950 -11.701 1196 HB2 GLN 753 HB2 GLN 753 47.921 24.913 -12.756 1197 HB3 GLN 753 HB1 GLN 753 49.245 24.317 -13.746 1198 HG2 GLN 753 HG2 GLN 753 49.075 22.139 -12.621 1199 HG3 GLN 753 HG1 GLN 753 47.704 22.748 -11.696 1200 HE21 GLN 753 HE21 GLN 753 48.842 21.765 -14.818 1201 HE22 GLN 753 HE22 GLN 753 47.292 21.611 -15.564 1202 H VAL 754 HN VAL 754 52.057 25.524 -11.217 1203 HA VAL 754 HA VAL 754 51.490 28.167 -12.347 1204 HB VAL 754 HB VAL 754 53.257 29.036 -10.720 1205 HG11 VAL 754 HG11 VAL 754 51.644 29.220 -8.868 1206 HG12 VAL 754 HG12 VAL 754 50.653 27.974 -9.629 1207 HG13 VAL 754 HG13 VAL 754 50.900 29.523 -10.438 1208 HG21 VAL 754 HG21 VAL 754 54.206 26.879 -10.069 1209 HG22 VAL 754 HG22 VAL 754 52.662 26.405 -9.361 1210 HG23 VAL 754 HG23 VAL 754 53.579 27.740 -8.662 1211 HHA CYC 800 HHA CYC 800 19.242 3.262 -3.659 1212 HMA1 CYC 800 HMA1 CYC 800 23.647 7.305 -2.528 1213 HMA2 CYC 800 HMA2 CYC 800 22.569 7.091 -1.092 1214 HMA3 CYC 800 HMA3 CYC 800 21.901 7.668 -2.678 1215 HAA1 CYC 800 HAA1 CYC 800 19.303 5.574 -2.049 1216 HAA2 CYC 800 HAA2 CYC 800 20.189 7.002 -2.633 1217 HBA1 CYC 800 HBA1 CYC 800 18.223 6.610 -4.055 1218 HBA2 CYC 800 HBA2 CYC 800 18.761 4.933 -4.405 1219 HHB CYC 800 HHB CYC 800 25.491 4.358 -3.112 1220 HB CYC 800 HB CYC 800 23.809 6.274 -0.150 1221 HMB1 CYC 800 HMB1 CYC 800 28.873 5.063 -1.328 1222 HMB2 CYC 800 HMB2 CYC 800 27.618 4.148 -2.272 1223 HMB3 CYC 800 HMB3 CYC 800 28.063 5.843 -2.755 1224 HAB1 CYC 800 HAB1 CYC 800 29.101 6.433 0.445 1225 HAB2 CYC 800 HAB2 CYC 800 28.104 6.557 1.961 1226 HBB1 CYC 800 HBB1 CYC 800 27.358 8.859 1.326 1227 HBB2 CYC 800 HBB2 CYC 800 29.157 8.810 1.266 1228 HBB3 CYC 800 HBB3 CYC 800 28.200 8.736 -0.260 1229 HC CYC 800 HC CYC 800 23.095 -0.068 -2.207 1230 H2C CYC 800 H2C CYC 800 24.953 -3.334 -0.837 1231 H3C CYC 800 H3C CYC 800 24.118 -3.676 -3.705 1232 HMC1 CYC 800 HMC1 CYC 800 26.202 -2.287 -3.493 1233 HMC2 CYC 800 HMC2 CYC 800 27.089 -2.454 -1.934 1234 HMC3 CYC 800 HMC3 CYC 800 26.488 -3.922 -2.796 1235 HAC1 CYC 800 HAC CYC 800 23.564 -5.093 -1.690 1236 HBC1 CYC 800 HBC1 CYC 800 22.461 -5.273 -3.944 1237 HBC2 CYC 800 HBC2 CYC 800 21.123 -4.221 -3.348 1238 HBC3 CYC 800 HBC3 CYC 800 21.410 -5.821 -2.585 1239 HHD CYC 800 HHD CYC 800 21.594 -2.698 -4.439 1240 HD CYC 800 HD CYC 800 22.341 0.892 -3.354 1241 HMD1 CYC 800 HMD1 CYC 800 17.809 -1.562 -4.869 1242 HMD2 CYC 800 HMD2 CYC 800 19.166 -1.982 -5.985 1243 HMD3 CYC 800 HMD3 CYC 800 19.116 -2.683 -4.322 1244 HAD1 CYC 800 HAD1 CYC 800 17.889 2.274 -4.722 1245 HAD2 CYC 800 HAD2 CYC 800 17.426 0.685 -5.411 1246 HBD1 CYC 800 HBD1 CYC 800 15.981 1.542 -3.418 1247 HBD2 CYC 800 HBD2 CYC 800 16.642 -0.123 -3.251 1248 HA CYC 800 HA CYC 800 23.246 2.720 -3.493 Start of MODEL 8 1 H SER 599 HT1 SER 599 49.731 17.746 3.287 2 HA SER 599 HA SER 599 47.382 17.924 2.703 3 HB2 SER 599 HB2 SER 599 48.066 18.442 5.604 4 HB3 SER 599 HB1 SER 599 46.614 17.640 5.002 5 HG SER 599 HG SER 599 47.762 15.897 5.171 6 H ASP 600 HN ASP 600 48.303 20.559 2.015 7 HA ASP 600 HA ASP 600 47.250 22.599 3.603 8 HB2 ASP 600 HB2 ASP 600 48.901 22.997 1.845 9 HB3 ASP 600 HB1 ASP 600 47.701 22.598 0.620 10 H VAL 601 HN VAL 601 45.836 21.296 0.575 11 HA VAL 601 HA VAL 601 43.393 22.711 1.042 12 HB VAL 601 HB VAL 601 44.125 22.214 -1.257 13 HG11 VAL 601 HG11 VAL 601 43.846 19.947 -2.188 14 HG12 VAL 601 HG12 VAL 601 43.569 19.339 -0.556 15 HG13 VAL 601 HG13 VAL 601 45.125 20.052 -0.983 16 HG21 VAL 601 HG21 VAL 601 41.477 20.950 -0.552 17 HG22 VAL 601 HG22 VAL 601 41.964 21.472 -2.165 18 HG23 VAL 601 HG23 VAL 601 41.768 22.660 -0.876 19 H GLU 602 HN GLU 602 44.570 19.541 1.776 20 HA GLU 602 HA GLU 602 42.126 18.266 2.353 21 HB2 GLU 602 HB2 GLU 602 44.896 17.831 3.478 22 HB3 GLU 602 HB1 GLU 602 43.537 16.754 3.765 23 HG2 GLU 602 HG2 GLU 602 43.461 16.061 1.539 24 HG3 GLU 602 HG1 GLU 602 44.429 17.426 0.987 25 H GLU 603 HN GLU 603 44.264 20.305 4.271 26 HA GLU 603 HA GLU 603 42.932 20.013 6.742 27 HB2 GLU 603 HB2 GLU 603 45.245 20.969 6.366 28 HB3 GLU 603 HB1 GLU 603 44.467 22.435 5.788 29 HG2 GLU 603 HG2 GLU 603 45.014 22.868 8.016 30 HG3 GLU 603 HG1 GLU 603 43.288 22.515 8.032 31 H ILE 604 HN ILE 604 42.529 22.193 4.001 32 HA ILE 604 HA ILE 604 40.708 24.003 5.113 33 HB ILE 604 HB ILE 604 40.846 23.042 2.239 34 HG12 ILE 604 HG12 ILE 604 42.131 25.442 3.570 35 HG13 ILE 604 HG11 ILE 604 42.975 23.980 3.074 36 HG21 ILE 604 HG21 ILE 604 39.593 25.536 3.392 37 HG22 ILE 604 HG22 ILE 604 38.728 24.159 2.712 38 HG23 ILE 604 HG23 ILE 604 39.743 25.161 1.675 39 HD11 ILE 604 HD11 ILE 604 43.333 25.751 1.472 40 HD12 ILE 604 HD12 ILE 604 41.594 25.951 1.264 41 HD13 ILE 604 HD13 ILE 604 42.379 24.464 0.734 42 H PHE 605 HN PHE 605 40.150 20.921 3.413 43 HA PHE 605 HA PHE 605 37.342 20.968 3.613 44 HB2 PHE 605 HB2 PHE 605 39.401 18.888 3.063 45 HB3 PHE 605 HB1 PHE 605 37.788 18.348 3.511 46 HD1 PHE 605 HD1 PHE 605 39.732 20.236 1.018 47 HD2 PHE 605 HD2 PHE 605 35.972 18.513 2.021 48 HE1 PHE 605 HE1 PHE 605 38.981 20.537 -1.308 49 HE2 PHE 605 HE2 PHE 605 35.211 18.809 -0.306 50 HZ PHE 605 HZ PHE 605 36.718 19.825 -1.971 51 H LYS 606 HN LYS 606 39.833 19.466 5.601 52 HA LYS 606 HA LYS 606 38.156 18.180 7.449 53 HB2 LYS 606 HB2 LYS 606 40.586 17.745 7.151 54 HB3 LYS 606 HB1 LYS 606 40.928 19.279 7.931 55 HG2 LYS 606 HG2 LYS 606 39.945 18.479 9.998 56 HG3 LYS 606 HG1 LYS 606 39.515 16.953 9.221 57 HD2 LYS 606 HD2 LYS 606 41.880 16.492 8.813 58 HD3 LYS 606 HD1 LYS 606 42.310 18.026 9.570 59 HE2 LYS 606 HE2 LYS 606 41.360 17.251 11.682 60 HE3 LYS 606 HE1 LYS 606 40.911 15.724 10.923 61 HZ1 LYS 606 HZ1 LYS 606 42.987 15.586 12.196 62 HZ2 LYS 606 HZ2 LYS 606 43.694 16.731 11.176 63 HZ3 LYS 606 HZ3 LYS 606 43.222 15.229 10.563 64 H THR 607 HN THR 607 39.161 21.464 7.225 65 HA THR 607 HA THR 607 38.255 22.169 9.882 66 HB THR 607 HB THR 607 38.964 24.014 7.581 67 HG1 THR 607 HG1 THR 607 40.731 22.687 8.214 68 HG21 THR 607 HG21 THR 607 39.292 25.696 9.336 69 HG22 THR 607 HG22 THR 607 38.790 24.528 10.557 70 HG23 THR 607 HG23 THR 607 37.635 25.094 9.350 71 H THR 608 HN THR 608 37.101 22.595 6.558 72 HA THR 608 HA THR 608 34.774 24.062 7.242 73 HB THR 608 HB THR 608 35.255 22.422 4.741 74 HG1 THR 608 HG1 THR 608 36.922 23.887 4.882 75 HG21 THR 608 HG21 THR 608 33.469 24.810 5.267 76 HG22 THR 608 HG22 THR 608 32.923 23.150 5.024 77 HG23 THR 608 HG23 THR 608 33.697 24.025 3.704 78 H THR 609 HN THR 609 35.389 20.654 6.697 79 HA THR 609 HA THR 609 32.789 19.675 6.782 80 HB THR 609 HB THR 609 33.750 17.535 7.726 81 HG1 THR 609 HG1 THR 609 35.802 17.458 8.323 82 HG21 THR 609 HG21 THR 609 35.063 17.022 5.716 83 HG22 THR 609 HG22 THR 609 35.155 18.743 5.343 84 HG23 THR 609 HG23 THR 609 33.597 17.917 5.319 85 H GLN 610 HN GLN 610 34.870 20.602 9.543 86 HA GLN 610 HA GLN 610 33.125 19.684 11.564 87 HB2 GLN 610 HB2 GLN 610 35.092 21.979 11.658 88 HB3 GLN 610 HB1 GLN 610 34.449 21.096 13.035 89 HG2 GLN 610 HG2 GLN 610 35.637 19.113 12.366 90 HG3 GLN 610 HG1 GLN 610 36.187 19.905 10.890 91 HE21 GLN 610 HE21 GLN 610 38.331 19.715 11.333 92 HE22 GLN 610 HE22 GLN 610 39.129 20.584 12.602 93 H GLU 611 HN GLU 611 33.526 22.707 9.827 94 HA GLU 611 HA GLU 611 31.693 24.282 11.261 95 HB2 GLU 611 HB2 GLU 611 33.411 25.119 9.640 96 HB3 GLU 611 HB1 GLU 611 32.425 24.488 8.331 97 HG2 GLU 611 HG2 GLU 611 32.106 26.867 8.573 98 HG3 GLU 611 HG1 GLU 611 30.619 26.005 8.966 99 H VAL 612 HN VAL 612 31.338 22.358 8.300 100 HA VAL 612 HA VAL 612 28.619 22.819 7.826 101 HB VAL 612 HB VAL 612 30.330 20.403 7.184 102 HG11 VAL 612 HG11 VAL 612 27.555 21.046 6.183 103 HG12 VAL 612 HG12 VAL 612 27.988 19.723 7.268 104 HG13 VAL 612 HG13 VAL 612 28.581 19.731 5.607 105 HG21 VAL 612 HG21 VAL 612 29.358 22.699 5.484 106 HG22 VAL 612 HG22 VAL 612 30.334 21.340 4.922 107 HG23 VAL 612 HG23 VAL 612 30.999 22.481 6.092 108 H ARG 613 HN ARG 613 30.243 20.399 9.814 109 HA ARG 613 HA ARG 613 28.051 18.886 10.600 110 HB2 ARG 613 HB2 ARG 613 30.376 18.253 11.088 111 HB3 ARG 613 HB1 ARG 613 30.531 19.612 12.188 112 HG2 ARG 613 HG2 ARG 613 28.369 17.668 12.730 113 HG3 ARG 613 HG1 ARG 613 30.028 17.137 13.008 114 HD2 ARG 613 HD2 ARG 613 30.410 18.932 14.559 115 HD3 ARG 613 HD1 ARG 613 28.863 19.676 14.155 116 HE ARG 613 HE ARG 613 28.057 17.312 15.045 117 HH11 ARG 613 HH11 ARG 613 30.390 19.543 16.411 118 HH12 ARG 613 HH12 ARG 613 30.072 19.068 18.046 119 HH21 ARG 613 HH21 ARG 613 27.647 16.660 17.201 120 HH22 ARG 613 HH22 ARG 613 28.516 17.429 18.496 121 H GLN 614 HN GLN 614 29.424 21.800 12.105 122 HA GLN 614 HA GLN 614 27.550 22.044 14.167 123 HB2 GLN 614 HB2 GLN 614 29.777 23.223 13.927 124 HB3 GLN 614 HB1 GLN 614 28.992 24.306 12.788 125 HG2 GLN 614 HG2 GLN 614 29.070 25.364 14.922 126 HG3 GLN 614 HG1 GLN 614 27.395 24.939 14.570 127 HE21 GLN 614 HE21 GLN 614 30.189 24.216 16.487 128 HE22 GLN 614 HE22 GLN 614 29.376 23.258 17.677 129 H LEU 615 HN LEU 615 27.638 23.468 10.911 130 HA LEU 615 HA LEU 615 25.423 25.136 11.070 131 HB2 LEU 615 HB2 LEU 615 26.922 23.848 8.890 132 HB3 LEU 615 HB1 LEU 615 25.283 24.307 8.483 133 HG LEU 615 HG LEU 615 26.916 26.016 7.834 134 HD11 LEU 615 HD11 LEU 615 25.797 27.942 8.831 135 HD12 LEU 615 HD12 LEU 615 25.079 26.895 10.052 136 HD13 LEU 615 HD13 LEU 615 24.645 26.696 8.355 137 HD21 LEU 615 HD21 LEU 615 28.566 25.637 9.589 138 HD22 LEU 615 HD22 LEU 615 27.443 26.274 10.789 139 HD23 LEU 615 HD23 LEU 615 28.075 27.329 9.525 140 H LEU 616 HN LEU 616 25.469 21.764 9.889 141 HA LEU 616 HA LEU 616 22.586 21.789 9.692 142 HB2 LEU 616 HB2 LEU 616 24.693 19.771 9.025 143 HB3 LEU 616 HB1 LEU 616 23.007 19.304 9.092 144 HG LEU 616 HG LEU 616 22.548 21.097 7.373 145 HD11 LEU 616 HD11 LEU 616 24.419 21.869 6.016 146 HD12 LEU 616 HD12 LEU 616 25.550 21.081 7.117 147 HD13 LEU 616 HD13 LEU 616 24.561 22.428 7.683 148 HD21 LEU 616 HD21 LEU 616 23.313 19.721 5.516 149 HD22 LEU 616 HD22 LEU 616 22.655 18.730 6.819 150 HD23 LEU 616 HD23 LEU 616 24.401 18.854 6.597 151 H ARG 617 HN ARG 617 24.583 21.465 12.237 152 HA ARG 617 HA ARG 617 24.354 20.720 14.373 153 HB2 ARG 617 HB2 ARG 617 21.472 20.346 13.545 154 HB3 ARG 617 HB1 ARG 617 22.060 20.283 15.202 155 HG2 ARG 617 HG2 ARG 617 22.639 22.572 15.182 156 HG3 ARG 617 HG1 ARG 617 22.417 22.683 13.436 157 HD2 ARG 617 HD2 ARG 617 20.020 22.217 13.740 158 HD3 ARG 617 HD1 ARG 617 20.267 22.172 15.485 159 HE ARG 617 HE ARG 617 20.542 24.476 15.508 160 HH11 ARG 617 HH11 ARG 617 20.146 23.312 12.215 161 HH12 ARG 617 HH12 ARG 617 19.829 24.874 11.558 162 HH21 ARG 617 HH21 ARG 617 20.110 26.553 14.639 163 HH22 ARG 617 HH22 ARG 617 19.793 26.726 12.943 164 H CYS 618 HN CYS 618 24.850 18.828 12.109 165 HA CYS 618 HA CYS 618 23.781 16.319 13.106 166 HB2 CYS 618 HB2 CYS 618 25.661 16.870 10.804 167 HB3 CYS 618 HB1 CYS 618 24.887 15.328 11.160 168 HG CYS 618 HG CYS 618 22.786 17.921 10.775 169 H ASP 619 HN ASP 619 25.731 14.521 12.869 170 HA ASP 619 HA ASP 619 27.845 15.551 14.634 171 HB2 ASP 619 HB2 ASP 619 26.237 13.072 14.796 172 HB3 ASP 619 HB1 ASP 619 27.940 12.943 15.225 173 H ARG 620 HN ARG 620 27.123 13.270 12.052 174 HA ARG 620 HA ARG 620 30.006 13.232 11.476 175 HB2 ARG 620 HB2 ARG 620 29.014 11.009 11.940 176 HB3 ARG 620 HB1 ARG 620 27.920 11.238 10.585 177 HG2 ARG 620 HG2 ARG 620 29.857 11.381 9.073 178 HG3 ARG 620 HG1 ARG 620 30.923 11.077 10.442 179 HD2 ARG 620 HD2 ARG 620 28.829 9.219 9.319 180 HD3 ARG 620 HD1 ARG 620 30.576 9.028 9.213 181 HE ARG 620 HE ARG 620 28.880 8.350 11.421 182 HH11 ARG 620 HH11 ARG 620 32.182 9.315 10.588 183 HH12 ARG 620 HH12 ARG 620 32.874 8.480 11.934 184 HH21 ARG 620 HH21 ARG 620 29.846 7.252 13.209 185 HH22 ARG 620 HH22 ARG 620 31.566 7.326 13.416 186 H VAL 621 HN VAL 621 30.726 14.020 9.639 187 HA VAL 621 HA VAL 621 28.904 14.525 7.401 188 HB VAL 621 HB VAL 621 30.885 16.553 8.502 189 HG11 VAL 621 HG11 VAL 621 30.870 16.567 6.066 190 HG12 VAL 621 HG12 VAL 621 30.103 18.023 6.695 191 HG13 VAL 621 HG13 VAL 621 29.112 16.708 6.063 192 HG21 VAL 621 HG21 VAL 621 28.803 16.480 9.780 193 HG22 VAL 621 HG22 VAL 621 27.875 16.677 8.293 194 HG23 VAL 621 HG23 VAL 621 28.925 17.978 8.856 195 H ALA 622 HN ALA 622 29.762 13.609 5.625 196 HA ALA 622 HA ALA 622 32.679 13.320 5.541 197 HB1 ALA 622 HB1 ALA 622 32.485 11.043 4.772 198 HB2 ALA 622 HB2 ALA 622 30.726 11.145 4.818 199 HB3 ALA 622 HB3 ALA 622 31.652 11.220 6.318 200 H VAL 623 HN VAL 623 33.427 12.609 3.394 201 HA VAL 623 HA VAL 623 31.841 13.836 1.238 202 HB VAL 623 HB VAL 623 34.869 13.866 1.456 203 HG11 VAL 623 HG11 VAL 623 34.770 15.365 -0.480 204 HG12 VAL 623 HG12 VAL 623 33.017 15.169 -0.538 205 HG13 VAL 623 HG13 VAL 623 34.069 13.787 -0.842 206 HG21 VAL 623 HG21 VAL 623 32.909 16.135 1.820 207 HG22 VAL 623 HG22 VAL 623 34.665 16.282 1.806 208 HG23 VAL 623 HG23 VAL 623 33.866 15.380 3.095 209 H TYR 624 HN TYR 624 31.660 12.603 -0.609 210 HA TYR 624 HA TYR 624 32.952 9.970 -0.512 211 HB2 TYR 624 HB2 TYR 624 30.653 9.746 0.226 212 HB3 TYR 624 HB1 TYR 624 30.084 10.724 -1.115 213 HD1 TYR 624 HD1 TYR 624 31.725 7.488 -0.320 214 HD2 TYR 624 HD2 TYR 624 29.389 9.713 -3.085 215 HE1 TYR 624 HE1 TYR 624 31.301 5.442 -1.606 216 HE2 TYR 624 HE2 TYR 624 28.963 7.677 -4.380 217 HH TYR 624 HH TYR 624 29.764 4.541 -3.206 218 H ARG 625 HN ARG 625 34.341 10.021 -2.215 219 HA ARG 625 HA ARG 625 33.638 11.673 -4.528 220 HB2 ARG 625 HB2 ARG 625 35.845 11.990 -3.418 221 HB3 ARG 625 HB1 ARG 625 36.269 10.345 -3.863 222 HG2 ARG 625 HG2 ARG 625 35.819 11.084 -6.277 223 HG3 ARG 625 HG1 ARG 625 35.884 12.728 -5.641 224 HD2 ARG 625 HD2 ARG 625 38.056 12.105 -6.480 225 HD3 ARG 625 HD1 ARG 625 38.126 12.239 -4.723 226 HE ARG 625 HE ARG 625 37.563 9.577 -5.551 227 HH11 ARG 625 HH11 ARG 625 40.193 11.880 -5.208 228 HH12 ARG 625 HH12 ARG 625 41.405 10.659 -5.023 229 HH21 ARG 625 HH21 ARG 625 39.143 7.969 -5.313 230 HH22 ARG 625 HH22 ARG 625 40.801 8.414 -5.084 231 H PHE 626 HN PHE 626 33.632 10.887 -6.615 232 HA PHE 626 HA PHE 626 33.323 7.997 -6.809 233 HB2 PHE 626 HB2 PHE 626 32.577 10.241 -8.681 234 HB3 PHE 626 HB1 PHE 626 32.462 8.541 -9.123 235 HD1 PHE 626 HD1 PHE 626 30.878 11.286 -7.467 236 HD2 PHE 626 HD2 PHE 626 30.968 7.045 -7.754 237 HE1 PHE 626 HE1 PHE 626 28.646 11.171 -6.449 238 HE2 PHE 626 HE2 PHE 626 28.733 6.922 -6.740 239 HZ PHE 626 HZ PHE 626 27.567 8.988 -6.085 240 H ASN 627 HN ASN 627 34.935 6.844 -7.436 241 HA ASN 627 HA ASN 627 37.301 7.980 -8.621 242 HB2 ASN 627 HB2 ASN 627 36.478 5.202 -7.773 243 HB3 ASN 627 HB1 ASN 627 37.984 5.489 -8.625 244 HD21 ASN 627 HD21 ASN 627 39.183 4.765 -6.890 245 HD22 ASN 627 HD22 ASN 627 39.386 5.687 -5.432 246 HA PRO 628 HA PRO 628 36.652 7.097 -12.949 247 HB2 PRO 628 HB2 PRO 628 38.645 5.195 -13.480 248 HB3 PRO 628 HB1 PRO 628 38.833 6.946 -13.588 249 HG2 PRO 628 HG2 PRO 628 39.576 5.094 -11.369 250 HG3 PRO 628 HG1 PRO 628 40.424 6.533 -11.962 251 HD2 PRO 628 HD2 PRO 628 39.028 6.618 -9.700 252 HD3 PRO 628 HD1 PRO 628 39.002 7.985 -10.830 253 H ASN 629 HN ASN 629 36.960 4.401 -10.746 254 HA ASN 629 HA ASN 629 35.500 2.636 -12.568 255 HB2 ASN 629 HB2 ASN 629 36.642 1.973 -9.845 256 HB3 ASN 629 HB1 ASN 629 36.062 0.835 -11.054 257 HD21 ASN 629 HD21 ASN 629 37.327 0.476 -12.917 258 HD22 ASN 629 HD22 ASN 629 39.005 0.877 -12.947 259 H TRP 630 HN TRP 630 34.686 4.977 -10.500 260 HA TRP 630 HA TRP 630 32.902 5.551 -9.221 261 HB2 TRP 630 HB2 TRP 630 31.670 3.497 -11.051 262 HB3 TRP 630 HB1 TRP 630 30.709 4.377 -9.870 263 HD1 TRP 630 HD1 TRP 630 32.986 5.141 -12.932 264 HE1 TRP 630 HE1 TRP 630 32.088 7.287 -14.063 265 HE3 TRP 630 HE3 TRP 630 29.272 6.332 -9.624 266 HZ2 TRP 630 HZ2 TRP 630 30.093 9.213 -13.610 267 HZ3 TRP 630 HZ3 TRP 630 27.917 8.341 -10.047 268 HH2 TRP 630 HH2 TRP 630 28.320 9.749 -11.999 269 H THR 631 HN THR 631 34.654 3.603 -8.068 270 HA THR 631 HA THR 631 33.045 1.621 -6.764 271 HB THR 631 HB THR 631 35.252 1.213 -5.517 272 HG1 THR 631 HG1 THR 631 37.061 2.144 -6.626 273 HG21 THR 631 HG21 THR 631 35.094 0.997 -8.516 274 HG22 THR 631 HG22 THR 631 34.406 -0.147 -7.365 275 HG23 THR 631 HG23 THR 631 36.161 0.046 -7.479 276 H GLY 632 HN GLY 632 33.369 4.784 -6.225 277 HA2 GLY 632 HA2 GLY 632 32.623 6.141 -4.525 278 HA3 GLY 632 HA1 GLY 632 31.984 4.688 -3.785 279 H GLU 633 HN GLU 633 35.072 6.440 -4.209 280 HA GLU 633 HA GLU 633 35.958 5.284 -1.669 281 HB2 GLU 633 HB2 GLU 633 37.478 5.217 -3.635 282 HB3 GLU 633 HB1 GLU 633 37.504 6.973 -3.634 283 HG2 GLU 633 HG2 GLU 633 38.419 6.873 -1.314 284 HG3 GLU 633 HG1 GLU 633 38.563 5.127 -1.515 285 H PHE 634 HN PHE 634 35.963 6.418 0.156 286 HA PHE 634 HA PHE 634 35.044 9.146 0.203 287 HB2 PHE 634 HB2 PHE 634 35.942 7.250 2.377 288 HB3 PHE 634 HB1 PHE 634 35.473 8.912 2.706 289 HD1 PHE 634 HD1 PHE 634 34.264 5.649 1.472 290 HD2 PHE 634 HD2 PHE 634 33.198 9.541 2.814 291 HE1 PHE 634 HE1 PHE 634 31.915 4.944 1.637 292 HE2 PHE 634 HE2 PHE 634 30.845 8.844 2.982 293 HZ PHE 634 HZ PHE 634 30.202 6.541 2.394 294 H VAL 635 HN VAL 635 36.207 10.969 0.590 295 HA VAL 635 HA VAL 635 39.132 10.636 0.742 296 HB VAL 635 HB VAL 635 39.340 12.862 -0.328 297 HG11 VAL 635 HG11 VAL 635 39.495 10.865 -1.692 298 HG12 VAL 635 HG12 VAL 635 38.697 12.154 -2.590 299 HG13 VAL 635 HG13 VAL 635 37.743 10.842 -1.896 300 HG21 VAL 635 HG21 VAL 635 37.377 13.858 -1.434 301 HG22 VAL 635 HG22 VAL 635 37.201 13.828 0.320 302 HG23 VAL 635 HG23 VAL 635 36.346 12.646 -0.672 303 H ALA 636 HN ALA 636 36.409 11.787 2.362 304 HA ALA 636 HA ALA 636 38.045 12.840 4.483 305 HB1 ALA 636 HB1 ALA 636 37.727 14.828 3.086 306 HB2 ALA 636 HB2 ALA 636 36.875 14.987 4.621 307 HB3 ALA 636 HB3 ALA 636 35.981 14.599 3.152 308 H GLU 637 HN GLU 637 37.006 12.797 6.453 309 HA GLU 637 HA GLU 637 34.203 12.149 6.657 310 HB2 GLU 637 HB2 GLU 637 35.567 9.986 6.111 311 HB3 GLU 637 HB1 GLU 637 36.154 10.132 7.758 312 HG2 GLU 637 HG2 GLU 637 33.230 10.014 7.109 313 HG3 GLU 637 HG1 GLU 637 34.206 8.568 7.338 314 H SER 638 HN SER 638 33.632 13.444 8.303 315 HA SER 638 HA SER 638 35.457 13.648 10.594 316 HB2 SER 638 HB2 SER 638 33.826 15.904 9.408 317 HB3 SER 638 HB1 SER 638 34.903 16.014 10.802 318 HG SER 638 HG SER 638 36.236 14.932 8.762 319 H VAL 639 HN VAL 639 34.564 13.356 12.527 320 HA VAL 639 HA VAL 639 31.700 13.668 12.897 321 HB VAL 639 HB VAL 639 32.104 11.282 12.215 322 HG11 VAL 639 HG11 VAL 639 33.193 9.766 13.802 323 HG12 VAL 639 HG12 VAL 639 33.673 11.154 14.781 324 HG13 VAL 639 HG13 VAL 639 34.303 10.968 13.144 325 HG21 VAL 639 HG21 VAL 639 30.794 10.266 14.012 326 HG22 VAL 639 HG22 VAL 639 30.174 11.866 13.596 327 HG23 VAL 639 HG23 VAL 639 31.145 11.647 15.051 328 H ALA 640 HN ALA 640 31.137 13.694 15.192 329 HA ALA 640 HA ALA 640 32.929 15.132 16.787 330 HB1 ALA 640 HB1 ALA 640 30.514 13.540 17.659 331 HB2 ALA 640 HB2 ALA 640 30.495 15.210 17.095 332 HB3 ALA 640 HB3 ALA 640 31.320 14.797 18.597 333 H HIS 641 HN HIS 641 34.248 14.551 18.461 334 HA HIS 641 HA HIS 641 35.683 12.175 18.332 335 HB2 HIS 641 HB2 HIS 641 36.757 12.839 20.405 336 HB3 HIS 641 HB1 HIS 641 36.501 14.255 19.394 337 HD2 HIS 641 HD2 HIS 641 34.602 16.103 20.402 338 HE1 HIS 641 HE1 HIS 641 34.241 14.241 24.191 339 HE2 HIS 641 HE2 HIS 641 33.874 16.344 22.866 340 H THR 642 HN THR 642 32.628 12.596 19.711 341 HA THR 642 HA THR 642 32.771 10.662 21.791 342 HB THR 642 HB THR 642 30.265 11.568 20.378 343 HG1 THR 642 HG1 THR 642 30.407 13.297 22.091 344 HG21 THR 642 HG21 THR 642 29.297 11.351 22.631 345 HG22 THR 642 HG22 THR 642 30.868 10.856 23.259 346 HG23 THR 642 HG23 THR 642 30.019 9.830 22.104 347 H TRP 643 HN TRP 643 32.460 10.476 18.365 348 HA TRP 643 HA TRP 643 31.505 7.692 18.574 349 HB2 TRP 643 HB2 TRP 643 31.153 9.449 16.148 350 HB3 TRP 643 HB1 TRP 643 30.358 7.920 16.504 351 HD1 TRP 643 HD1 TRP 643 29.762 11.530 16.614 352 HE1 TRP 643 HE1 TRP 643 27.687 12.100 18.018 353 HE3 TRP 643 HE3 TRP 643 29.117 7.027 18.939 354 HZ2 TRP 643 HZ2 TRP 643 26.004 10.803 19.875 355 HZ3 TRP 643 HZ3 TRP 643 27.250 6.778 20.517 356 HH2 TRP 643 HH2 TRP 643 25.727 8.628 20.975 357 H VAL 644 HN VAL 644 32.237 6.317 16.711 358 HA VAL 644 HA VAL 644 35.077 6.544 16.412 359 HB VAL 644 HB VAL 644 34.924 4.487 15.057 360 HG11 VAL 644 HG11 VAL 644 33.319 4.415 17.603 361 HG12 VAL 644 HG12 VAL 644 35.074 4.288 17.459 362 HG13 VAL 644 HG13 VAL 644 34.041 3.013 16.811 363 HG21 VAL 644 HG21 VAL 644 32.811 4.916 13.919 364 HG22 VAL 644 HG22 VAL 644 31.941 4.765 15.445 365 HG23 VAL 644 HG23 VAL 644 32.758 3.363 14.755 366 H LYS 645 HN LYS 645 36.261 6.851 14.516 367 HA LYS 645 HA LYS 645 34.757 8.050 12.305 368 HB2 LYS 645 HB2 LYS 645 36.690 9.529 11.916 369 HB3 LYS 645 HB1 LYS 645 35.976 9.777 13.501 370 HG2 LYS 645 HG2 LYS 645 37.764 8.442 14.509 371 HG3 LYS 645 HG1 LYS 645 38.484 8.219 12.912 372 HD2 LYS 645 HD2 LYS 645 38.761 10.648 12.709 373 HD3 LYS 645 HD1 LYS 645 38.058 10.857 14.314 374 HE2 LYS 645 HE2 LYS 645 39.879 9.534 15.275 375 HE3 LYS 645 HE1 LYS 645 40.579 9.337 13.669 376 HZ1 LYS 645 HZ1 LYS 645 41.655 11.102 14.922 377 HZ2 LYS 645 HZ2 LYS 645 40.186 11.926 15.063 378 HZ3 LYS 645 HZ3 LYS 645 40.893 11.716 13.543 379 H LEU 646 HN LEU 646 35.668 7.810 10.220 380 HA LEU 646 HA LEU 646 36.934 5.214 9.898 381 HB2 LEU 646 HB2 LEU 646 35.685 7.166 7.991 382 HB3 LEU 646 HB1 LEU 646 36.590 5.779 7.420 383 HG LEU 646 HG LEU 646 34.973 4.303 8.642 384 HD11 LEU 646 HD11 LEU 646 32.824 5.236 9.327 385 HD12 LEU 646 HD12 LEU 646 33.422 6.861 8.997 386 HD13 LEU 646 HD13 LEU 646 34.150 5.899 10.282 387 HD21 LEU 646 HD21 LEU 646 33.785 6.143 6.577 388 HD22 LEU 646 HD22 LEU 646 33.206 4.528 6.994 389 HD23 LEU 646 HD23 LEU 646 34.794 4.734 6.254 390 H VAL 647 HN VAL 647 37.609 8.604 9.208 391 HA VAL 647 HA VAL 647 40.119 8.048 7.975 392 HB VAL 647 HB VAL 647 38.965 10.636 9.046 393 HG11 VAL 647 HG11 VAL 647 40.821 11.772 7.896 394 HG12 VAL 647 HG12 VAL 647 41.540 10.207 7.516 395 HG13 VAL 647 HG13 VAL 647 41.408 10.732 9.194 396 HG21 VAL 647 HG21 VAL 647 38.679 11.197 6.706 397 HG22 VAL 647 HG22 VAL 647 37.905 9.643 7.029 398 HG23 VAL 647 HG23 VAL 647 39.467 9.699 6.221 399 H GLY 648 HN GLY 648 41.766 7.286 8.971 400 HA2 GLY 648 HA2 GLY 648 43.390 8.145 10.815 401 HA3 GLY 648 HA1 GLY 648 42.061 7.627 11.852 402 HA PRO 649 HA PRO 649 43.636 3.513 11.633 403 HB2 PRO 649 HB2 PRO 649 41.386 2.033 11.912 404 HB3 PRO 649 HB1 PRO 649 42.084 2.959 13.245 405 HG2 PRO 649 HG2 PRO 649 39.774 3.638 11.474 406 HG3 PRO 649 HG1 PRO 649 39.949 3.868 13.223 407 HD2 PRO 649 HD2 PRO 649 40.292 5.869 11.401 408 HD3 PRO 649 HD1 PRO 649 41.119 5.824 12.971 409 H ASP 650 HN ASP 650 40.810 4.188 9.592 410 HA ASP 650 HA ASP 650 41.718 2.130 7.703 411 HB2 ASP 650 HB2 ASP 650 39.048 3.493 8.042 412 HB3 ASP 650 HB1 ASP 650 39.438 2.496 6.647 413 H ILE 651 HN ILE 651 40.192 5.336 7.558 414 HA ILE 651 HA ILE 651 40.460 7.120 6.190 415 HB ILE 651 HB ILE 651 43.085 5.844 5.378 416 HG12 ILE 651 HG12 ILE 651 42.466 8.071 7.336 417 HG13 ILE 651 HG11 ILE 651 43.000 6.447 7.755 418 HG21 ILE 651 HG21 ILE 651 42.039 8.632 4.879 419 HG22 ILE 651 HG22 ILE 651 42.256 7.371 3.668 420 HG23 ILE 651 HG23 ILE 651 43.661 8.058 4.485 421 HD11 ILE 651 HD11 ILE 651 44.591 8.487 6.216 422 HD12 ILE 651 HD12 ILE 651 45.131 6.863 6.642 423 HD13 ILE 651 HD13 ILE 651 44.817 8.049 7.910 424 H LYS 652 HN LYS 652 41.783 4.358 4.377 425 HA LYS 652 HA LYS 652 40.429 5.172 1.995 426 HB2 LYS 652 HB2 LYS 652 41.287 2.995 1.084 427 HB3 LYS 652 HB1 LYS 652 42.531 4.063 1.716 428 HG2 LYS 652 HG2 LYS 652 42.704 2.743 3.727 429 HG3 LYS 652 HG1 LYS 652 41.358 1.726 3.211 430 HD2 LYS 652 HD2 LYS 652 42.674 0.996 1.272 431 HD3 LYS 652 HD1 LYS 652 44.019 1.999 1.821 432 HE2 LYS 652 HE2 LYS 652 44.170 0.699 3.871 433 HE3 LYS 652 HE1 LYS 652 42.794 -0.282 3.368 434 HZ1 LYS 652 HZ1 LYS 652 44.893 -1.386 2.939 435 HZ2 LYS 652 HZ2 LYS 652 45.396 -0.111 1.954 436 HZ3 LYS 652 HZ3 LYS 652 44.079 -1.069 1.493 437 H THR 653 HN THR 653 38.279 5.133 2.174 438 HA THR 653 HA THR 653 37.070 2.548 2.846 439 HB THR 653 HB THR 653 35.822 5.277 3.237 440 HG1 THR 653 HG1 THR 653 37.612 4.034 4.709 441 HG21 THR 653 HG21 THR 653 34.227 3.427 2.765 442 HG22 THR 653 HG22 THR 653 34.056 4.063 4.397 443 HG23 THR 653 HG23 THR 653 34.897 2.534 4.130 444 H VAL 654 HN VAL 654 36.579 1.626 0.971 445 HA VAL 654 HA VAL 654 35.485 3.228 -1.196 446 HB VAL 654 HB VAL 654 37.402 1.709 -1.647 447 HG11 VAL 654 HG11 VAL 654 36.986 -0.023 -0.038 448 HG12 VAL 654 HG12 VAL 654 37.065 -0.726 -1.654 449 HG13 VAL 654 HG13 VAL 654 35.503 -0.488 -0.870 450 HG21 VAL 654 HG21 VAL 654 36.472 0.550 -3.602 451 HG22 VAL 654 HG22 VAL 654 35.911 2.218 -3.473 452 HG23 VAL 654 HG23 VAL 654 34.846 0.890 -3.008 453 H TRP 655 HN TRP 655 33.412 2.645 -2.157 454 HA TRP 655 HA TRP 655 31.836 0.711 -0.624 455 HB2 TRP 655 HB2 TRP 655 31.391 3.036 0.264 456 HB3 TRP 655 HB1 TRP 655 30.832 3.481 -1.340 457 HD1 TRP 655 HD1 TRP 655 29.074 0.734 -1.808 458 HE1 TRP 655 HE1 TRP 655 26.815 0.533 -0.587 459 HE3 TRP 655 HE3 TRP 655 29.861 4.152 1.918 460 HZ2 TRP 655 HZ2 TRP 655 25.540 1.677 1.652 461 HZ3 TRP 655 HZ3 TRP 655 28.066 4.540 3.555 462 HH2 TRP 655 HH2 TRP 655 25.953 3.328 3.422 463 H GLU 656 HN GLU 656 31.878 -0.676 -2.302 464 HA GLU 656 HA GLU 656 31.361 0.159 -4.992 465 HB2 GLU 656 HB2 GLU 656 32.730 -1.907 -3.942 466 HB3 GLU 656 HB1 GLU 656 31.187 -2.704 -4.198 467 HG2 GLU 656 HG2 GLU 656 32.794 -1.300 -6.321 468 HG3 GLU 656 HG1 GLU 656 32.755 -3.039 -6.052 469 H ASP 657 HN ASP 657 29.309 1.090 -4.941 470 HA ASP 657 HA ASP 657 27.098 -0.651 -4.123 471 HB2 ASP 657 HB2 ASP 657 27.057 1.681 -3.282 472 HB3 ASP 657 HB1 ASP 657 26.996 2.264 -4.943 473 H THR 658 HN THR 658 26.704 -2.054 -5.651 474 HA THR 658 HA THR 658 27.088 -1.714 -8.381 475 HB THR 658 HB THR 658 26.979 -3.921 -7.367 476 HG1 THR 658 HG1 THR 658 26.487 -4.340 -9.372 477 HG21 THR 658 HG21 THR 658 24.043 -3.341 -6.944 478 HG22 THR 658 HG22 THR 658 25.263 -3.515 -5.679 479 HG23 THR 658 HG23 THR 658 24.824 -4.901 -6.679 480 H HIS 659 HN HIS 659 24.415 -0.721 -6.385 481 HA HIS 659 HA HIS 659 22.485 -0.609 -8.464 482 HB2 HIS 659 HB2 HIS 659 21.892 -0.608 -6.036 483 HB3 HIS 659 HB1 HIS 659 22.530 1.029 -5.920 484 HD2 HIS 659 HD2 HIS 659 19.665 -0.753 -7.986 485 HE1 HIS 659 HE1 HIS 659 18.561 3.264 -7.197 486 HE2 HIS 659 HE2 HIS 659 18.035 1.174 -8.499 487 H LEU 660 HN LEU 660 24.514 1.986 -6.926 488 HA LEU 660 HA LEU 660 23.792 3.965 -8.742 489 HB2 LEU 660 HB2 LEU 660 26.377 3.593 -7.226 490 HB3 LEU 660 HB1 LEU 660 25.869 5.076 -8.007 491 HG LEU 660 HG LEU 660 24.497 3.761 -5.660 492 HD11 LEU 660 HD11 LEU 660 25.284 5.702 -4.406 493 HD12 LEU 660 HD12 LEU 660 26.148 6.275 -5.832 494 HD13 LEU 660 HD13 LEU 660 26.628 4.764 -5.060 495 HD21 LEU 660 HD21 LEU 660 23.141 5.812 -5.589 496 HD22 LEU 660 HD22 LEU 660 22.888 4.908 -7.082 497 HD23 LEU 660 HD23 LEU 660 23.897 6.355 -7.087 498 H GLN 661 HN GLN 661 26.503 1.687 -8.753 499 HA GLN 661 HA GLN 661 27.810 2.332 -11.073 500 HB2 GLN 661 HB2 GLN 661 27.104 -0.401 -10.008 501 HB3 GLN 661 HB1 GLN 661 28.199 -0.157 -11.358 502 HG2 GLN 661 HG2 GLN 661 28.673 1.166 -8.717 503 HG3 GLN 661 HG1 GLN 661 29.185 -0.491 -9.021 504 HE21 GLN 661 HE21 GLN 661 31.306 0.020 -8.804 505 HE22 GLN 661 HE22 GLN 661 32.191 0.933 -9.994 506 H GLU 662 HN GLU 662 24.898 0.347 -10.820 507 HA GLU 662 HA GLU 662 24.671 -0.176 -13.606 508 HB2 GLU 662 HB2 GLU 662 23.786 -1.656 -11.861 509 HB3 GLU 662 HB1 GLU 662 22.638 -0.418 -11.390 510 HG2 GLU 662 HG2 GLU 662 21.425 -0.646 -13.392 511 HG3 GLU 662 HG1 GLU 662 22.696 -1.619 -14.134 512 H THR 663 HN THR 663 23.756 2.491 -11.656 513 HA THR 663 HA THR 663 21.943 3.456 -13.759 514 HB THR 663 HB THR 663 21.148 5.061 -11.954 515 HG1 THR 663 HG1 THR 663 22.274 3.204 -10.129 516 HG21 THR 663 HG21 THR 663 19.848 3.082 -12.598 517 HG22 THR 663 HG22 THR 663 19.722 3.375 -10.864 518 HG23 THR 663 HG23 THR 663 20.777 2.098 -11.468 519 H GLN 664 HN GLN 664 25.047 3.650 -13.074 520 HA GLN 664 HA GLN 664 26.747 5.129 -13.248 521 HB2 GLN 664 HB2 GLN 664 24.805 5.915 -15.342 522 HB3 GLN 664 HB1 GLN 664 26.109 7.048 -15.011 523 HG2 GLN 664 HG2 GLN 664 26.515 4.140 -15.673 524 HG3 GLN 664 HG1 GLN 664 26.605 5.456 -16.843 525 HE21 GLN 664 HE21 GLN 664 28.671 3.561 -15.980 526 HE22 GLN 664 HE22 GLN 664 29.973 4.528 -15.383 527 H GLY 665 HN GLY 665 25.173 5.610 -11.023 528 HA2 GLY 665 HA2 GLY 665 25.720 7.346 -9.430 529 HA3 GLY 665 HA1 GLY 665 25.619 8.515 -10.734 530 H GLY 666 HN GLY 666 23.094 6.891 -11.561 531 HA2 GLY 666 HA2 GLY 666 20.827 7.049 -11.232 532 HA3 GLY 666 HA1 GLY 666 21.176 7.210 -9.519 533 H ARG 667 HN ARG 667 20.005 8.890 -8.837 534 HA ARG 667 HA ARG 667 19.553 11.195 -10.506 535 HB2 ARG 667 HB2 ARG 667 18.351 12.111 -8.535 536 HB3 ARG 667 HB1 ARG 667 17.775 10.528 -9.030 537 HG2 ARG 667 HG2 ARG 667 18.943 9.484 -7.210 538 HG3 ARG 667 HG1 ARG 667 19.683 11.018 -6.753 539 HD2 ARG 667 HD2 ARG 667 17.725 10.330 -5.352 540 HD3 ARG 667 HD1 ARG 667 17.570 11.916 -6.107 541 HE ARG 667 HE ARG 667 15.966 11.043 -7.587 542 HH11 ARG 667 HH11 ARG 667 17.094 8.575 -5.331 543 HH12 ARG 667 HH12 ARG 667 15.672 7.610 -5.505 544 HH21 ARG 667 HH21 ARG 667 14.096 9.733 -7.815 545 HH22 ARG 667 HH22 ARG 667 13.971 8.259 -6.914 546 H TYR 668 HN TYR 668 21.918 10.240 -8.253 547 HA TYR 668 HA TYR 668 22.690 12.782 -7.292 548 HB2 TYR 668 HB2 TYR 668 24.220 10.187 -7.507 549 HB3 TYR 668 HB1 TYR 668 24.838 11.624 -6.702 550 HD1 TYR 668 HD1 TYR 668 23.101 12.653 -4.935 551 HD2 TYR 668 HD2 TYR 668 23.228 8.564 -6.145 552 HE1 TYR 668 HE1 TYR 668 21.970 12.003 -2.858 553 HE2 TYR 668 HE2 TYR 668 22.097 7.919 -4.072 554 HH TYR 668 HH TYR 668 21.726 8.753 -1.836 555 H ALA 669 HN ALA 669 23.519 10.935 -10.139 556 HA ALA 669 HA ALA 669 25.679 12.627 -10.967 557 HB1 ALA 669 HB1 ALA 669 24.028 10.675 -12.564 558 HB2 ALA 669 HB2 ALA 669 25.529 10.307 -11.709 559 HB3 ALA 669 HB3 ALA 669 25.542 11.412 -13.083 560 H GLN 670 HN GLN 670 22.286 12.805 -11.118 561 HA GLN 670 HA GLN 670 22.237 14.607 -13.392 562 HB2 GLN 670 HB2 GLN 670 20.492 12.821 -12.947 563 HB3 GLN 670 HB1 GLN 670 19.941 13.808 -11.603 564 HG2 GLN 670 HG2 GLN 670 19.355 15.597 -13.110 565 HG3 GLN 670 HG1 GLN 670 20.020 14.697 -14.473 566 HE21 GLN 670 HE21 GLN 670 17.306 15.696 -14.008 567 HE22 GLN 670 HE22 GLN 670 16.273 14.314 -14.107 568 H GLY 671 HN GLY 671 23.049 14.916 -10.256 569 HA2 GLY 671 HA2 GLY 671 23.555 16.862 -9.104 570 HA3 GLY 671 HA1 GLY 671 22.691 17.778 -10.328 571 H GLU 672 HN GLU 672 21.108 15.112 -8.779 572 HA GLU 672 HA GLU 672 19.254 17.009 -7.572 573 HB2 GLU 672 HB2 GLU 672 18.410 15.155 -9.020 574 HB3 GLU 672 HB1 GLU 672 19.012 14.007 -7.834 575 HG2 GLU 672 HG2 GLU 672 16.602 14.394 -7.630 576 HG3 GLU 672 HG1 GLU 672 17.479 14.863 -6.173 577 H ASN 673 HN ASN 673 18.543 16.766 -5.392 578 HA ASN 673 HA ASN 673 20.656 15.716 -3.632 579 HB2 ASN 673 HB2 ASN 673 19.853 17.222 -1.927 580 HB3 ASN 673 HB1 ASN 673 20.021 18.145 -3.414 581 HD21 ASN 673 HD21 ASN 673 18.155 18.866 -4.478 582 HD22 ASN 673 HD22 ASN 673 16.619 18.906 -3.695 583 H PHE 674 HN PHE 674 20.101 14.424 -1.822 584 HA PHE 674 HA PHE 674 17.386 13.306 -1.922 585 HB2 PHE 674 HB2 PHE 674 19.247 11.869 -2.990 586 HB3 PHE 674 HB1 PHE 674 19.802 11.608 -1.342 587 HD1 PHE 674 HD1 PHE 674 16.563 11.530 -3.201 588 HD2 PHE 674 HD2 PHE 674 19.129 9.641 -0.382 589 HE1 PHE 674 HE1 PHE 674 14.955 9.684 -2.982 590 HE2 PHE 674 HE2 PHE 674 17.520 7.792 -0.156 591 HZ PHE 674 HZ PHE 674 15.432 7.812 -1.456 592 H VAL 675 HN VAL 675 16.385 13.266 -0.027 593 HA VAL 675 HA VAL 675 17.992 13.595 2.410 594 HB VAL 675 HB VAL 675 15.952 14.732 3.397 595 HG11 VAL 675 HG11 VAL 675 17.321 16.061 1.065 596 HG12 VAL 675 HG12 VAL 675 17.886 16.018 2.736 597 HG13 VAL 675 HG13 VAL 675 16.418 16.901 2.324 598 HG21 VAL 675 HG21 VAL 675 14.282 13.978 1.786 599 HG22 VAL 675 HG22 VAL 675 15.104 14.861 0.500 600 HG23 VAL 675 HG23 VAL 675 14.346 15.740 1.827 601 H VAL 676 HN VAL 676 17.910 11.937 3.739 602 HA VAL 676 HA VAL 676 15.600 10.130 3.567 603 HB VAL 676 HB VAL 676 18.406 9.531 4.534 604 HG11 VAL 676 HG11 VAL 676 16.023 7.705 4.208 605 HG12 VAL 676 HG12 VAL 676 16.748 8.212 5.735 606 HG13 VAL 676 HG13 VAL 676 17.661 7.196 4.620 607 HG21 VAL 676 HG21 VAL 676 16.955 8.667 2.036 608 HG22 VAL 676 HG22 VAL 676 18.561 8.135 2.533 609 HG23 VAL 676 HG23 VAL 676 18.281 9.826 2.119 610 H ASN 677 HN ASN 677 14.219 10.285 5.175 611 HA ASN 677 HA ASN 677 15.006 11.467 7.704 612 HB2 ASN 677 HB2 ASN 677 12.596 11.294 8.276 613 HB3 ASN 677 HB1 ASN 677 12.858 12.147 6.763 614 HD21 ASN 677 HD21 ASN 677 10.514 10.677 7.828 615 HD22 ASN 677 HD22 ASN 677 10.117 9.519 6.612 616 H ASP 678 HN ASP 678 14.133 8.357 6.376 617 HA ASP 678 HA ASP 678 15.172 7.052 8.742 618 HB2 ASP 678 HB2 ASP 678 12.846 7.229 9.344 619 HB3 ASP 678 HB1 ASP 678 12.345 6.635 7.764 620 H ILE 679 HN ILE 679 16.087 5.118 8.311 621 HA ILE 679 HA ILE 679 16.690 4.570 5.579 622 HB ILE 679 HB ILE 679 17.979 2.611 6.512 623 HG12 ILE 679 HG12 ILE 679 17.181 3.881 9.146 624 HG13 ILE 679 HG11 ILE 679 16.669 2.298 8.572 625 HG21 ILE 679 HG21 ILE 679 18.554 5.391 7.502 626 HG22 ILE 679 HG22 ILE 679 19.071 4.669 5.978 627 HG23 ILE 679 HG23 ILE 679 19.716 4.066 7.505 628 HD11 ILE 679 HD11 ILE 679 19.013 1.554 8.627 629 HD12 ILE 679 HD12 ILE 679 18.424 2.069 10.205 630 HD13 ILE 679 HD13 ILE 679 19.479 3.128 9.269 631 H TYR 680 HN TYR 680 14.226 3.407 7.653 632 HA TYR 680 HA TYR 680 13.962 0.934 6.169 633 HB2 TYR 680 HB2 TYR 680 12.251 2.108 8.363 634 HB3 TYR 680 HB1 TYR 680 11.965 0.544 7.608 635 HD1 TYR 680 HD1 TYR 680 13.901 2.383 10.050 636 HD2 TYR 680 HD2 TYR 680 13.630 -1.300 7.931 637 HE1 TYR 680 HE1 TYR 680 15.409 1.336 11.682 638 HE2 TYR 680 HE2 TYR 680 15.133 -2.351 9.561 639 HH TYR 680 HH TYR 680 16.796 -1.767 11.175 640 H GLN 681 HN GLN 681 12.225 3.972 6.577 641 HA GLN 681 HA GLN 681 10.032 3.391 4.899 642 HB2 GLN 681 HB2 GLN 681 11.245 6.065 5.592 643 HB3 GLN 681 HB1 GLN 681 9.673 5.833 4.845 644 HG2 GLN 681 HG2 GLN 681 10.492 4.873 7.575 645 HG3 GLN 681 HG1 GLN 681 9.480 6.273 7.226 646 HE21 GLN 681 HE21 GLN 681 7.389 5.958 6.490 647 HE22 GLN 681 HE22 GLN 681 6.570 4.442 6.653 648 H VAL 682 HN VAL 682 13.274 4.236 4.101 649 HA VAL 682 HA VAL 682 12.738 5.434 1.570 650 HB VAL 682 HB VAL 682 14.839 5.831 2.840 651 HG11 VAL 682 HG11 VAL 682 16.649 4.186 2.728 652 HG12 VAL 682 HG12 VAL 682 15.539 3.029 1.994 653 HG13 VAL 682 HG13 VAL 682 15.264 3.592 3.642 654 HG21 VAL 682 HG21 VAL 682 15.247 4.705 0.080 655 HG22 VAL 682 HG22 VAL 682 16.352 5.798 0.917 656 HG23 VAL 682 HG23 VAL 682 14.740 6.351 0.458 657 H GLY 683 HN GLY 683 12.550 2.209 2.562 658 HA2 GLY 683 HA2 GLY 683 11.931 0.376 1.229 659 HA3 GLY 683 HA1 GLY 683 12.292 1.334 -0.202 660 H HIS 684 HN HIS 684 14.457 1.026 2.420 661 HA HIS 684 HA HIS 684 16.798 0.435 1.175 662 HB2 HIS 684 HB2 HIS 684 17.616 -0.356 3.301 663 HB3 HIS 684 HB1 HIS 684 16.491 0.971 3.589 664 HD2 HIS 684 HD2 HIS 684 13.840 0.020 4.452 665 HE1 HIS 684 HE1 HIS 684 15.396 -3.635 5.922 666 HE2 HIS 684 HE2 HIS 684 13.348 -2.213 5.650 667 H SER 685 HN SER 685 17.956 -1.358 0.605 668 HA SER 685 HA SER 685 16.565 -3.888 0.319 669 HB2 SER 685 HB2 SER 685 19.419 -3.144 -0.388 670 HB3 SER 685 HB1 SER 685 18.539 -4.568 -0.941 671 HG SER 685 HG SER 685 18.006 -1.853 -1.535 672 HA PRO 686 HA PRO 686 18.082 -5.854 3.993 673 HB2 PRO 686 HB2 PRO 686 19.131 -8.218 2.967 674 HB3 PRO 686 HB1 PRO 686 17.432 -7.945 3.365 675 HG2 PRO 686 HG2 PRO 686 18.809 -7.792 0.717 676 HG3 PRO 686 HG1 PRO 686 17.203 -8.430 1.112 677 HD2 PRO 686 HD2 PRO 686 17.499 -6.034 -0.031 678 HD3 PRO 686 HD1 PRO 686 16.250 -6.315 1.197 679 H CYS 687 HN CYS 687 20.253 -5.622 1.263 680 HA CYS 687 HA CYS 687 22.642 -6.138 2.785 681 HB2 CYS 687 HB2 CYS 687 23.805 -5.758 0.739 682 HB3 CYS 687 HB1 CYS 687 22.316 -6.588 0.295 683 H HIS 688 HN HIS 688 20.680 -3.449 1.966 684 HA HIS 688 HA HIS 688 22.758 -1.451 2.252 685 HB2 HIS 688 HB2 HIS 688 20.909 -1.436 0.504 686 HB3 HIS 688 HB1 HIS 688 19.795 -1.049 1.801 687 HD1 HIS 688 HD1 HIS 688 19.514 1.031 -0.037 688 HD2 HIS 688 HD2 HIS 688 22.904 1.003 2.389 689 HE1 HIS 688 HE1 HIS 688 20.392 3.386 -0.069 690 H ILE 689 HN ILE 689 20.093 -2.762 4.102 691 HA ILE 689 HA ILE 689 19.745 -0.572 5.856 692 HB ILE 689 HB ILE 689 18.004 -2.254 5.533 693 HG12 ILE 689 HG12 ILE 689 17.391 -2.589 7.945 694 HG13 ILE 689 HG11 ILE 689 18.974 -1.950 8.374 695 HG21 ILE 689 HG21 ILE 689 19.794 -4.117 7.075 696 HG22 ILE 689 HG22 ILE 689 19.337 -4.259 5.376 697 HG23 ILE 689 HG23 ILE 689 18.113 -4.428 6.636 698 HD11 ILE 689 HD11 ILE 689 18.413 0.156 7.275 699 HD12 ILE 689 HD12 ILE 689 17.265 -0.247 8.552 700 HD13 ILE 689 HD13 ILE 689 16.824 -0.488 6.863 701 H GLU 690 HN GLU 690 21.927 -3.329 6.034 702 HA GLU 690 HA GLU 690 22.411 -2.964 8.853 703 HB2 GLU 690 HB2 GLU 690 24.067 -4.735 8.615 704 HB3 GLU 690 HB1 GLU 690 22.524 -5.192 7.912 705 HG2 GLU 690 HG2 GLU 690 23.340 -4.883 5.710 706 HG3 GLU 690 HG1 GLU 690 24.816 -4.119 6.301 707 H ILE 691 HN ILE 691 23.640 -1.593 5.994 708 HA ILE 691 HA ILE 691 26.298 -1.144 6.942 709 HB ILE 691 HB ILE 691 24.853 0.290 4.697 710 HG12 ILE 691 HG12 ILE 691 26.601 -2.184 4.576 711 HG13 ILE 691 HG11 ILE 691 24.852 -2.178 4.398 712 HG21 ILE 691 HG21 ILE 691 26.881 1.410 5.472 713 HG22 ILE 691 HG22 ILE 691 27.119 0.726 3.864 714 HG23 ILE 691 HG23 ILE 691 27.794 -0.085 5.276 715 HD11 ILE 691 HD11 ILE 691 25.079 -0.808 2.376 716 HD12 ILE 691 HD12 ILE 691 25.939 -2.339 2.237 717 HD13 ILE 691 HD13 ILE 691 26.833 -0.851 2.555 718 H LEU 692 HN LEU 692 23.315 0.718 6.727 719 HA LEU 692 HA LEU 692 24.420 3.115 7.783 720 HB2 LEU 692 HB2 LEU 692 21.589 2.137 7.483 721 HB3 LEU 692 HB1 LEU 692 21.950 3.650 8.287 722 HG LEU 692 HG LEU 692 21.295 4.120 6.029 723 HD11 LEU 692 HD11 LEU 692 23.231 5.324 5.187 724 HD12 LEU 692 HD12 LEU 692 24.275 4.436 6.293 725 HD13 LEU 692 HD13 LEU 692 23.044 5.529 6.927 726 HD21 LEU 692 HD21 LEU 692 22.505 3.260 4.087 727 HD22 LEU 692 HD22 LEU 692 21.764 1.958 5.017 728 HD23 LEU 692 HD23 LEU 692 23.497 2.260 5.148 729 H GLU 693 HN GLU 693 23.060 0.243 9.214 730 HA GLU 693 HA GLU 693 22.716 1.232 11.831 731 HB2 GLU 693 HB2 GLU 693 23.246 -1.562 10.819 732 HB3 GLU 693 HB1 GLU 693 22.913 -1.192 12.505 733 HG2 GLU 693 HG2 GLU 693 20.737 -0.231 11.809 734 HG3 GLU 693 HG1 GLU 693 21.075 -0.765 10.163 735 H GLN 694 HN GLN 694 25.485 -0.106 10.123 736 HA GLN 694 HA GLN 694 27.186 -0.242 12.399 737 HB2 GLN 694 HB2 GLN 694 27.788 -0.185 9.444 738 HB3 GLN 694 HB1 GLN 694 29.025 -0.380 10.679 739 HG2 GLN 694 HG2 GLN 694 27.964 -2.426 11.445 740 HG3 GLN 694 HG1 GLN 694 26.683 -2.220 10.254 741 HE21 GLN 694 HE21 GLN 694 27.148 -4.184 9.310 742 HE22 GLN 694 HE22 GLN 694 28.543 -4.430 8.316 743 H PHE 695 HN PHE 695 26.352 2.264 10.133 744 HA PHE 695 HA PHE 695 28.406 4.052 11.119 745 HB2 PHE 695 HB2 PHE 695 26.169 4.365 9.125 746 HB3 PHE 695 HB1 PHE 695 27.086 5.753 9.697 747 HD1 PHE 695 HD1 PHE 695 26.995 2.990 7.422 748 HD2 PHE 695 HD2 PHE 695 29.583 5.774 9.333 749 HE1 PHE 695 HE1 PHE 695 28.719 2.549 5.723 750 HE2 PHE 695 HE2 PHE 695 31.310 5.338 7.637 751 HZ PHE 695 HZ PHE 695 30.880 3.725 5.829 752 H GLU 696 HN GLU 696 25.518 2.951 12.237 753 HA GLU 696 HA GLU 696 24.072 3.528 13.860 754 HB2 GLU 696 HB2 GLU 696 26.328 5.365 14.682 755 HB3 GLU 696 HB1 GLU 696 24.948 4.946 15.691 756 HG2 GLU 696 HG2 GLU 696 25.608 2.606 15.651 757 HG3 GLU 696 HG1 GLU 696 26.970 2.996 14.605 758 H VAL 697 HN VAL 697 23.491 4.675 11.504 759 HA VAL 697 HA VAL 697 22.260 7.168 12.372 760 HB VAL 697 HB VAL 697 24.270 7.875 11.198 761 HG11 VAL 697 HG11 VAL 697 24.638 7.353 8.842 762 HG12 VAL 697 HG12 VAL 697 23.218 6.306 8.850 763 HG13 VAL 697 HG13 VAL 697 24.626 5.889 9.825 764 HG21 VAL 697 HG21 VAL 697 21.694 8.295 9.711 765 HG22 VAL 697 HG22 VAL 697 23.160 9.193 9.353 766 HG23 VAL 697 HG23 VAL 697 22.411 9.329 10.945 767 H LYS 698 HN LYS 698 20.269 7.601 11.336 768 HA LYS 698 HA LYS 698 19.311 5.574 9.434 769 HB2 LYS 698 HB2 LYS 698 17.770 6.854 11.692 770 HB3 LYS 698 HB1 LYS 698 17.061 5.839 10.444 771 HG2 LYS 698 HG2 LYS 698 18.245 3.927 11.222 772 HG3 LYS 698 HG1 LYS 698 19.220 4.908 12.319 773 HD2 LYS 698 HD2 LYS 698 17.434 3.712 13.503 774 HD3 LYS 698 HD1 LYS 698 17.243 5.461 13.613 775 HE2 LYS 698 HE2 LYS 698 15.594 5.365 11.775 776 HE3 LYS 698 HE1 LYS 698 15.751 3.610 11.755 777 HZ1 LYS 698 HZ1 LYS 698 14.922 3.531 14.001 778 HZ2 LYS 698 HZ2 LYS 698 13.823 4.367 13.028 779 HZ3 LYS 698 HZ3 LYS 698 14.838 5.214 14.078 780 H ALA 699 HN ALA 699 19.178 8.877 10.599 781 HA ALA 699 HA ALA 699 17.840 9.706 8.133 782 HB1 ALA 699 HB1 ALA 699 17.450 11.832 9.294 783 HB2 ALA 699 HB2 ALA 699 18.329 11.227 10.699 784 HB3 ALA 699 HB3 ALA 699 16.809 10.474 10.217 785 H TYR 700 HN TYR 700 18.865 11.062 6.694 786 HA TYR 700 HA TYR 700 21.292 12.349 7.288 787 HB2 TYR 700 HB2 TYR 700 22.829 11.078 5.857 788 HB3 TYR 700 HB1 TYR 700 22.250 10.113 7.203 789 HD1 TYR 700 HD1 TYR 700 22.156 10.575 3.563 790 HD2 TYR 700 HD2 TYR 700 20.873 8.153 6.817 791 HE1 TYR 700 HE1 TYR 700 21.542 8.796 1.984 792 HE2 TYR 700 HE2 TYR 700 20.252 6.364 5.246 793 HH TYR 700 HH TYR 700 19.649 6.128 2.868 794 H VAL 701 HN VAL 701 22.301 13.278 5.307 795 HA VAL 701 HA VAL 701 20.349 13.659 3.167 796 HB VAL 701 HB VAL 701 19.914 15.514 4.654 797 HG11 VAL 701 HG11 VAL 701 22.870 16.098 4.550 798 HG12 VAL 701 HG12 VAL 701 21.975 15.487 5.940 799 HG13 VAL 701 HG13 VAL 701 21.649 17.108 5.323 800 HG21 VAL 701 HG21 VAL 701 20.424 17.416 3.212 801 HG22 VAL 701 HG22 VAL 701 19.908 16.020 2.263 802 HG23 VAL 701 HG23 VAL 701 21.616 16.448 2.346 803 H ILE 702 HN ILE 702 21.248 13.902 1.167 804 HA ILE 702 HA ILE 702 24.182 14.120 1.037 805 HB ILE 702 HB ILE 702 22.522 12.281 -0.701 806 HG12 ILE 702 HG12 ILE 702 24.365 11.583 1.599 807 HG13 ILE 702 HG11 ILE 702 22.612 11.448 1.616 808 HG21 ILE 702 HG21 ILE 702 24.514 13.134 -1.798 809 HG22 ILE 702 HG22 ILE 702 24.701 11.419 -1.429 810 HG23 ILE 702 HG23 ILE 702 25.505 12.629 -0.428 811 HD11 ILE 702 HD11 ILE 702 22.722 9.757 -0.137 812 HD12 ILE 702 HD12 ILE 702 23.668 9.287 1.275 813 HD13 ILE 702 HD13 ILE 702 24.479 9.902 -0.166 814 H VAL 703 HN VAL 703 24.844 15.689 -0.278 815 HA VAL 703 HA VAL 703 23.060 16.518 -2.472 816 HB VAL 703 HB VAL 703 23.994 18.794 -2.310 817 HG11 VAL 703 HG11 VAL 703 22.890 19.472 -0.217 818 HG12 VAL 703 HG12 VAL 703 22.804 17.777 0.263 819 HG13 VAL 703 HG13 VAL 703 21.924 18.336 -1.158 820 HG21 VAL 703 HG21 VAL 703 25.339 19.466 -0.384 821 HG22 VAL 703 HG22 VAL 703 26.168 18.241 -1.346 822 HG23 VAL 703 HG23 VAL 703 25.389 17.792 0.172 823 HA PRO 704 HA PRO 704 26.472 15.564 -5.096 824 HB2 PRO 704 HB2 PRO 704 25.776 16.849 -7.336 825 HB3 PRO 704 HB1 PRO 704 24.836 15.481 -6.725 826 HG2 PRO 704 HG2 PRO 704 24.278 18.411 -6.505 827 HG3 PRO 704 HG1 PRO 704 23.156 17.080 -6.835 828 HD2 PRO 704 HD2 PRO 704 23.495 18.258 -4.364 829 HD3 PRO 704 HD1 PRO 704 22.878 16.613 -4.617 830 H VAL 705 HN VAL 705 28.496 16.270 -5.379 831 HA VAL 705 HA VAL 705 29.003 19.168 -5.442 832 HB VAL 705 HB VAL 705 30.826 16.985 -4.386 833 HG11 VAL 705 HG11 VAL 705 32.079 18.815 -5.387 834 HG12 VAL 705 HG12 VAL 705 32.261 18.824 -3.632 835 HG13 VAL 705 HG13 VAL 705 31.182 19.981 -4.413 836 HG21 VAL 705 HG21 VAL 705 28.945 17.394 -2.887 837 HG22 VAL 705 HG22 VAL 705 29.302 19.122 -2.896 838 HG23 VAL 705 HG23 VAL 705 30.450 17.988 -2.184 839 H PHE 706 HN PHE 706 29.492 19.744 -7.447 840 HA PHE 706 HA PHE 706 30.851 17.845 -9.207 841 HB2 PHE 706 HB2 PHE 706 29.406 20.434 -9.802 842 HB3 PHE 706 HB1 PHE 706 30.234 19.464 -11.012 843 HD1 PHE 706 HD1 PHE 706 27.349 19.623 -8.742 844 HD2 PHE 706 HD2 PHE 706 29.269 17.448 -11.854 845 HE1 PHE 706 HE1 PHE 706 25.300 18.308 -9.083 846 HE2 PHE 706 HE2 PHE 706 27.222 16.128 -12.200 847 HZ PHE 706 HZ PHE 706 25.234 16.557 -10.813 848 H ALA 707 HN ALA 707 32.842 18.237 -10.048 849 HA ALA 707 HA ALA 707 34.117 20.786 -9.352 850 HB1 ALA 707 HB1 ALA 707 36.182 19.665 -8.811 851 HB2 ALA 707 HB2 ALA 707 35.484 18.100 -9.215 852 HB3 ALA 707 HB3 ALA 707 34.892 18.993 -7.812 853 H GLY 708 HN GLY 708 34.308 21.731 -11.233 854 HA2 GLY 708 HA2 GLY 708 35.376 22.047 -13.288 855 HA3 GLY 708 HA1 GLY 708 35.690 20.314 -13.364 856 H GLU 709 HN GLU 709 34.273 18.994 -14.372 857 HA GLU 709 HA GLU 709 31.865 20.286 -15.450 858 HB2 GLU 709 HB2 GLU 709 33.678 19.958 -17.124 859 HB3 GLU 709 HB1 GLU 709 33.555 18.225 -16.855 860 HG2 GLU 709 HG2 GLU 709 31.326 18.186 -17.708 861 HG3 GLU 709 HG1 GLU 709 31.286 19.946 -17.804 862 H GLN 710 HN GLN 710 33.303 17.247 -14.321 863 HA GLN 710 HA GLN 710 30.674 15.967 -14.491 864 HB2 GLN 710 HB2 GLN 710 33.383 14.739 -13.947 865 HB3 GLN 710 HB1 GLN 710 31.878 13.846 -14.087 866 HG2 GLN 710 HG2 GLN 710 31.666 14.567 -16.408 867 HG3 GLN 710 HG1 GLN 710 33.177 15.465 -16.267 868 HE21 GLN 710 HE21 GLN 710 31.713 12.318 -16.463 869 HE22 GLN 710 HE22 GLN 710 33.173 11.449 -16.776 870 H LEU 711 HN LEU 711 30.351 14.299 -12.670 871 HA LEU 711 HA LEU 711 30.154 15.751 -10.225 872 HB2 LEU 711 HB2 LEU 711 28.419 14.175 -10.973 873 HB3 LEU 711 HB1 LEU 711 29.566 12.857 -10.871 874 HG LEU 711 HG LEU 711 29.693 13.160 -8.427 875 HD11 LEU 711 HD11 LEU 711 28.063 14.612 -7.308 876 HD12 LEU 711 HD12 LEU 711 27.558 15.243 -8.874 877 HD13 LEU 711 HD13 LEU 711 29.198 15.533 -8.293 878 HD21 LEU 711 HD21 LEU 711 27.500 12.270 -7.916 879 HD22 LEU 711 HD22 LEU 711 28.080 11.593 -9.439 880 HD23 LEU 711 HD23 LEU 711 26.871 12.877 -9.444 881 H TRP 712 HN TRP 712 31.702 15.915 -8.773 882 HA TRP 712 HA TRP 712 34.029 14.204 -8.918 883 HB2 TRP 712 HB2 TRP 712 34.334 16.604 -8.609 884 HB3 TRP 712 HB1 TRP 712 33.369 16.561 -7.140 885 HD1 TRP 712 HD1 TRP 712 36.726 15.103 -8.452 886 HE1 TRP 712 HE1 TRP 712 38.352 14.942 -6.456 887 HE3 TRP 712 HE3 TRP 712 33.578 16.623 -4.722 888 HZ2 TRP 712 HZ2 TRP 712 38.298 15.400 -3.670 889 HZ3 TRP 712 HZ3 TRP 712 34.441 16.737 -2.422 890 HH2 TRP 712 HH2 TRP 712 36.749 16.139 -1.907 891 H GLY 713 HN GLY 713 31.592 15.114 -6.503 892 HA2 GLY 713 HA2 GLY 713 31.479 12.468 -5.504 893 HA3 GLY 713 HA1 GLY 713 32.433 13.503 -4.453 894 H LEU 714 HN LEU 714 30.406 12.471 -3.317 895 HA LEU 714 HA LEU 714 28.263 14.476 -3.358 896 HB2 LEU 714 HB2 LEU 714 28.279 11.755 -2.059 897 HB3 LEU 714 HB1 LEU 714 26.909 12.837 -2.191 898 HG LEU 714 HG LEU 714 28.288 11.463 -4.491 899 HD11 LEU 714 HD11 LEU 714 26.237 10.167 -4.673 900 HD12 LEU 714 HD12 LEU 714 25.589 10.977 -3.249 901 HD13 LEU 714 HD13 LEU 714 26.998 9.929 -3.099 902 HD21 LEU 714 HD21 LEU 714 27.396 13.645 -5.125 903 HD22 LEU 714 HD22 LEU 714 25.825 13.205 -4.454 904 HD23 LEU 714 HD23 LEU 714 26.463 12.339 -5.850 905 H LEU 715 HN LEU 715 27.487 15.277 -1.389 906 HA LEU 715 HA LEU 715 29.426 15.166 0.824 907 HB2 LEU 715 HB2 LEU 715 29.340 17.377 -0.306 908 HB3 LEU 715 HB1 LEU 715 27.627 17.468 0.039 909 HG LEU 715 HG LEU 715 28.114 17.536 2.450 910 HD11 LEU 715 HD11 LEU 715 31.001 17.561 1.579 911 HD12 LEU 715 HD12 LEU 715 30.190 16.269 2.464 912 HD13 LEU 715 HD13 LEU 715 30.418 17.846 3.219 913 HD21 LEU 715 HD21 LEU 715 29.088 19.783 2.496 914 HD22 LEU 715 HD22 LEU 715 27.899 19.621 1.204 915 HD23 LEU 715 HD23 LEU 715 29.622 19.585 0.827 916 H ALA 716 HN ALA 716 28.588 13.947 2.378 917 HA ALA 716 HA ALA 716 25.671 14.036 2.780 918 HB1 ALA 716 HB1 ALA 716 27.502 11.683 3.209 919 HB2 ALA 716 HB2 ALA 716 26.447 11.914 1.817 920 HB3 ALA 716 HB3 ALA 716 25.752 11.708 3.424 921 H ALA 717 HN ALA 717 24.882 14.002 4.796 922 HA ALA 717 HA ALA 717 26.787 14.161 7.014 923 HB1 ALA 717 HB1 ALA 717 25.488 15.934 8.054 924 HB2 ALA 717 HB2 ALA 717 24.386 15.963 6.673 925 HB3 ALA 717 HB3 ALA 717 26.074 16.442 6.471 926 H TYR 718 HN TYR 718 26.262 12.996 8.711 927 HA TYR 718 HA TYR 718 23.690 11.551 8.656 928 HB2 TYR 718 HB2 TYR 718 26.369 10.623 9.713 929 HB3 TYR 718 HB1 TYR 718 24.900 9.670 9.692 930 HD1 TYR 718 HD1 TYR 718 27.729 10.879 7.760 931 HD2 TYR 718 HD2 TYR 718 24.012 8.828 7.525 932 HE1 TYR 718 HE1 TYR 718 28.342 10.031 5.536 933 HE2 TYR 718 HE2 TYR 718 24.615 7.974 5.305 934 HH TYR 718 HH TYR 718 26.073 8.460 3.483 935 H GLN 719 HN GLN 719 22.464 11.614 10.545 936 HA GLN 719 HA GLN 719 23.836 12.806 12.850 937 HB2 GLN 719 HB2 GLN 719 22.499 14.503 11.669 938 HB3 GLN 719 HB1 GLN 719 21.058 13.537 11.948 939 HG2 GLN 719 HG2 GLN 719 21.374 13.778 14.361 940 HG3 GLN 719 HG1 GLN 719 22.800 14.769 14.069 941 HE21 GLN 719 HE21 GLN 719 21.537 16.060 11.729 942 HE22 GLN 719 HE22 GLN 719 20.399 17.181 12.392 943 H ASN 720 HN ASN 720 24.017 11.058 14.031 944 HA ASN 720 HA ASN 720 23.453 9.227 15.324 945 HB2 ASN 720 HB2 ASN 720 21.705 11.234 16.708 946 HB3 ASN 720 HB1 ASN 720 22.782 10.031 17.411 947 HD21 ASN 720 HD21 ASN 720 25.049 10.430 17.362 948 HD22 ASN 720 HD22 ASN 720 25.656 12.046 17.189 949 H SER 721 HN SER 721 22.189 8.106 13.651 950 HA SER 721 HA SER 721 20.355 6.971 12.893 951 HB2 SER 721 HB2 SER 721 19.118 5.752 14.699 952 HB3 SER 721 HB1 SER 721 20.869 5.654 14.855 953 HG SER 721 HG SER 721 20.190 7.772 16.211 954 H GLY 722 HN GLY 722 18.043 7.314 15.256 955 HA2 GLY 722 HA2 GLY 722 16.109 8.507 15.487 956 HA3 GLY 722 HA1 GLY 722 16.944 9.850 14.733 957 H THR 723 HN THR 723 14.562 10.001 14.083 958 HA THR 723 HA THR 723 14.359 8.963 11.338 959 HB THR 723 HB THR 723 11.858 8.958 11.703 960 HG1 THR 723 HG1 THR 723 11.779 10.032 13.698 961 HG21 THR 723 HG21 THR 723 11.824 6.688 12.683 962 HG22 THR 723 HG22 THR 723 13.495 6.909 13.204 963 HG23 THR 723 HG23 THR 723 13.105 6.870 11.485 964 H ARG 724 HN ARG 724 15.253 11.392 12.596 965 HA ARG 724 HA ARG 724 13.297 13.418 12.474 966 HB2 ARG 724 HB2 ARG 724 15.168 14.985 12.709 967 HB3 ARG 724 HB1 ARG 724 15.250 13.674 13.873 968 HG2 ARG 724 HG2 ARG 724 16.829 12.584 12.098 969 HG3 ARG 724 HG1 ARG 724 17.008 14.249 11.538 970 HD2 ARG 724 HD2 ARG 724 18.753 13.755 13.123 971 HD3 ARG 724 HD1 ARG 724 17.630 14.907 13.845 972 HE ARG 724 HE ARG 724 16.855 12.284 14.513 973 HH11 ARG 724 HH11 ARG 724 19.280 14.691 15.312 974 HH12 ARG 724 HH12 ARG 724 19.616 14.014 16.865 975 HH21 ARG 724 HH21 ARG 724 17.304 11.387 16.570 976 HH22 ARG 724 HH22 ARG 724 18.502 12.118 17.579 977 H ASP 725 HN ASP 725 12.596 14.620 10.919 978 HA ASP 725 HA ASP 725 13.346 14.054 8.205 979 HB2 ASP 725 HB2 ASP 725 11.530 15.575 7.606 980 HB3 ASP 725 HB1 ASP 725 10.992 14.415 8.817 981 H TRP 726 HN TRP 726 14.004 15.647 6.694 982 HA TRP 726 HA TRP 726 15.695 17.688 7.921 983 HB2 TRP 726 HB2 TRP 726 15.835 16.484 5.150 984 HB3 TRP 726 HB1 TRP 726 16.973 17.647 5.830 985 HD1 TRP 726 HD1 TRP 726 16.032 13.971 5.940 986 HE1 TRP 726 HE1 TRP 726 17.810 12.683 7.262 987 HE3 TRP 726 HE3 TRP 726 18.721 17.931 7.727 988 HZ2 TRP 726 HZ2 TRP 726 20.076 13.268 8.854 989 HZ3 TRP 726 HZ3 TRP 726 20.680 17.480 9.142 990 HH2 TRP 726 HH2 TRP 726 21.341 15.196 9.694 991 H ASP 727 HN ASP 727 15.646 19.783 7.234 992 HA ASP 727 HA ASP 727 13.102 20.620 6.142 993 HB2 ASP 727 HB2 ASP 727 13.892 21.747 8.123 994 HB3 ASP 727 HB1 ASP 727 15.404 22.167 7.329 995 H GLU 728 HN GLU 728 12.798 21.840 4.340 996 HA GLU 728 HA GLU 728 14.360 21.284 2.095 997 HB2 GLU 728 HB2 GLU 728 12.316 23.459 2.482 998 HB3 GLU 728 HB1 GLU 728 13.021 23.026 0.932 999 HG2 GLU 728 HG2 GLU 728 12.151 20.700 1.314 1000 HG3 GLU 728 HG1 GLU 728 11.260 21.353 2.688 1001 H SER 729 HN SER 729 14.203 24.378 3.919 1002 HA SER 729 HA SER 729 16.150 25.568 2.235 1003 HB2 SER 729 HB2 SER 729 16.201 27.390 3.930 1004 HB3 SER 729 HB1 SER 729 14.571 26.989 3.397 1005 HG SER 729 HG SER 729 14.696 25.510 5.397 1006 H GLU 730 HN GLU 730 16.331 23.444 4.892 1007 HA GLU 730 HA GLU 730 18.961 24.153 5.791 1008 HB2 GLU 730 HB2 GLU 730 17.236 22.889 7.141 1009 HB3 GLU 730 HB1 GLU 730 17.570 21.490 6.132 1010 HG2 GLU 730 HG2 GLU 730 18.839 21.171 8.067 1011 HG3 GLU 730 HG1 GLU 730 19.989 21.742 6.859 1012 H VAL 731 HN VAL 731 17.647 21.514 3.773 1013 HA VAL 731 HA VAL 731 20.174 20.439 3.085 1014 HB VAL 731 HB VAL 731 18.158 19.078 2.844 1015 HG11 VAL 731 HG11 VAL 731 16.554 19.461 1.033 1016 HG12 VAL 731 HG12 VAL 731 17.368 20.977 0.648 1017 HG13 VAL 731 HG13 VAL 731 16.567 20.778 2.206 1018 HG21 VAL 731 HG21 VAL 731 20.065 18.495 1.440 1019 HG22 VAL 731 HG22 VAL 731 19.474 19.569 0.174 1020 HG23 VAL 731 HG23 VAL 731 18.547 18.134 0.616 1021 H THR 732 HN THR 732 18.458 23.206 1.945 1022 HA THR 732 HA THR 732 19.670 23.354 -0.624 1023 HB THR 732 HB THR 732 18.321 25.491 1.054 1024 HG1 THR 732 HG1 THR 732 16.841 23.896 0.491 1025 HG21 THR 732 HG21 THR 732 19.796 26.463 -0.667 1026 HG22 THR 732 HG22 THR 732 18.097 26.740 -1.046 1027 HG23 THR 732 HG23 THR 732 18.997 25.486 -1.898 1028 H LEU 733 HN LEU 733 20.493 24.370 2.625 1029 HA LEU 733 HA LEU 733 22.525 26.224 1.899 1030 HB2 LEU 733 HB2 LEU 733 21.358 26.190 4.102 1031 HB3 LEU 733 HB1 LEU 733 22.129 24.664 4.468 1032 HG LEU 733 HG LEU 733 23.807 27.101 3.925 1033 HD11 LEU 733 HD11 LEU 733 22.545 26.359 6.562 1034 HD12 LEU 733 HD12 LEU 733 22.170 27.786 5.597 1035 HD13 LEU 733 HD13 LEU 733 23.768 27.603 6.318 1036 HD21 LEU 733 HD21 LEU 733 24.199 24.669 5.681 1037 HD22 LEU 733 HD22 LEU 733 25.372 25.960 5.425 1038 HD23 LEU 733 HD23 LEU 733 24.914 24.908 4.087 1039 H LEU 734 HN LEU 734 22.433 22.816 2.767 1040 HA LEU 734 HA LEU 734 25.203 22.338 2.745 1041 HB2 LEU 734 HB2 LEU 734 23.486 20.837 3.726 1042 HB3 LEU 734 HB1 LEU 734 22.974 20.407 2.107 1043 HG LEU 734 HG LEU 734 25.257 19.486 1.694 1044 HD11 LEU 734 HD11 LEU 734 26.675 19.016 3.635 1045 HD12 LEU 734 HD12 LEU 734 25.591 19.971 4.646 1046 HD13 LEU 734 HD13 LEU 734 26.495 20.746 3.345 1047 HD21 LEU 734 HD21 LEU 734 24.899 17.447 2.979 1048 HD22 LEU 734 HD22 LEU 734 23.381 18.050 2.311 1049 HD23 LEU 734 HD23 LEU 734 23.752 18.294 4.017 1050 H ALA 735 HN ALA 735 22.771 22.267 0.187 1051 HA ALA 735 HA ALA 735 24.406 21.088 -1.805 1052 HB1 ALA 735 HB1 ALA 735 21.959 21.133 -1.955 1053 HB2 ALA 735 HB2 ALA 735 22.707 21.856 -3.378 1054 HB3 ALA 735 HB3 ALA 735 22.004 22.887 -2.133 1055 H ARG 736 HN ARG 736 23.790 24.369 -0.801 1056 HA ARG 736 HA ARG 736 25.195 25.644 -2.930 1057 HB2 ARG 736 HB2 ARG 736 24.514 26.637 -0.164 1058 HB3 ARG 736 HB1 ARG 736 25.220 27.639 -1.424 1059 HG2 ARG 736 HG2 ARG 736 23.248 27.246 -2.826 1060 HG3 ARG 736 HG1 ARG 736 22.541 26.268 -1.536 1061 HD2 ARG 736 HD2 ARG 736 21.637 28.522 -1.484 1062 HD3 ARG 736 HD1 ARG 736 22.606 28.211 -0.044 1063 HE ARG 736 HE ARG 736 23.843 29.583 -2.317 1064 HH11 ARG 736 HH11 ARG 736 22.633 29.701 0.967 1065 HH12 ARG 736 HH12 ARG 736 23.386 31.212 1.332 1066 HH21 ARG 736 HH21 ARG 736 24.867 31.580 -1.827 1067 HH22 ARG 736 HH22 ARG 736 24.662 32.280 -0.258 1068 H ILE 737 HN ILE 737 26.102 24.655 0.343 1069 HA ILE 737 HA ILE 737 28.736 25.639 0.303 1070 HB ILE 737 HB ILE 737 27.620 23.241 1.782 1071 HG12 ILE 737 HG12 ILE 737 26.515 25.339 2.382 1072 HG13 ILE 737 HG11 ILE 737 27.512 24.764 3.713 1073 HG21 ILE 737 HG21 ILE 737 30.213 24.713 2.248 1074 HG22 ILE 737 HG22 ILE 737 30.045 23.078 1.612 1075 HG23 ILE 737 HG23 ILE 737 29.556 23.432 3.269 1076 HD11 ILE 737 HD11 ILE 737 27.713 27.158 3.472 1077 HD12 ILE 737 HD12 ILE 737 28.202 26.977 1.788 1078 HD13 ILE 737 HD13 ILE 737 29.249 26.383 3.078 1079 H GLY 738 HN GLY 738 27.354 22.551 -0.744 1080 HA2 GLY 738 HA2 GLY 738 29.760 21.258 -1.411 1081 HA3 GLY 738 HA1 GLY 738 28.185 20.909 -2.114 1082 H ASN 739 HN ASN 739 27.692 23.446 -3.244 1083 HA ASN 739 HA ASN 739 29.061 23.215 -5.713 1084 HB2 ASN 739 HB2 ASN 739 26.765 24.199 -5.407 1085 HB3 ASN 739 HB1 ASN 739 27.521 25.611 -4.678 1086 HD21 ASN 739 HD21 ASN 739 26.866 27.045 -6.217 1087 HD22 ASN 739 HD22 ASN 739 27.448 27.025 -7.846 1088 H GLN 740 HN GLN 740 29.335 25.427 -2.980 1089 HA GLN 740 HA GLN 740 31.307 27.134 -4.003 1090 HB2 GLN 740 HB2 GLN 740 30.016 27.698 -2.024 1091 HB3 GLN 740 HB1 GLN 740 30.698 26.334 -1.152 1092 HG2 GLN 740 HG2 GLN 740 32.920 27.381 -1.323 1093 HG3 GLN 740 HG1 GLN 740 32.176 28.774 -2.103 1094 HE21 GLN 740 HE21 GLN 740 33.656 28.543 0.398 1095 HE22 GLN 740 HE22 GLN 740 32.616 29.167 1.634 1096 H LEU 741 HN LEU 741 31.542 24.043 -2.327 1097 HA LEU 741 HA LEU 741 34.369 24.091 -1.982 1098 HB2 LEU 741 HB2 LEU 741 32.447 21.765 -2.066 1099 HB3 LEU 741 HB1 LEU 741 34.130 21.646 -1.594 1100 HG LEU 741 HG LEU 741 32.014 23.232 -0.134 1101 HD11 LEU 741 HD11 LEU 741 31.686 20.818 0.054 1102 HD12 LEU 741 HD12 LEU 741 32.207 21.520 1.584 1103 HD13 LEU 741 HD13 LEU 741 33.356 20.630 0.586 1104 HD21 LEU 741 HD21 LEU 741 34.215 24.235 0.107 1105 HD22 LEU 741 HD22 LEU 741 34.899 22.672 0.550 1106 HD23 LEU 741 HD23 LEU 741 33.730 23.455 1.611 1107 H GLY 742 HN GLY 742 32.259 23.289 -4.596 1108 HA2 GLY 742 HA2 GLY 742 34.028 21.648 -6.077 1109 HA3 GLY 742 HA1 GLY 742 32.633 22.511 -6.714 1110 H LEU 743 HN LEU 743 33.313 25.141 -6.206 1111 HA LEU 743 HA LEU 743 35.077 25.668 -8.355 1112 HB2 LEU 743 HB2 LEU 743 33.768 27.396 -6.278 1113 HB3 LEU 743 HB1 LEU 743 34.958 28.070 -7.369 1114 HG LEU 743 HG LEU 743 33.512 27.357 -9.287 1115 HD11 LEU 743 HD11 LEU 743 31.498 26.781 -7.125 1116 HD12 LEU 743 HD12 LEU 743 32.263 25.587 -8.173 1117 HD13 LEU 743 HD13 LEU 743 31.184 26.800 -8.861 1118 HD21 LEU 743 HD21 LEU 743 32.238 29.213 -7.282 1119 HD22 LEU 743 HD22 LEU 743 31.900 29.163 -9.013 1120 HD23 LEU 743 HD23 LEU 743 33.496 29.645 -8.439 1121 H ALA 744 HN ALA 744 35.494 25.450 -4.910 1122 HA ALA 744 HA ALA 744 37.957 26.771 -4.657 1123 HB1 ALA 744 HB1 ALA 744 36.564 26.179 -2.733 1124 HB2 ALA 744 HB2 ALA 744 38.203 25.549 -2.555 1125 HB3 ALA 744 HB3 ALA 744 36.889 24.470 -3.022 1126 H LEU 745 HN LEU 745 37.136 23.522 -5.674 1127 HA LEU 745 HA LEU 745 39.739 22.432 -5.478 1128 HB2 LEU 745 HB2 LEU 745 37.551 21.165 -5.676 1129 HB3 LEU 745 HB1 LEU 745 37.552 21.567 -7.379 1130 HG LEU 745 HG LEU 745 39.895 20.101 -6.208 1131 HD11 LEU 745 HD11 LEU 745 38.785 17.980 -6.701 1132 HD12 LEU 745 HD12 LEU 745 37.294 18.848 -7.072 1133 HD13 LEU 745 HD13 LEU 745 37.946 18.874 -5.434 1134 HD21 LEU 745 HD21 LEU 745 38.558 20.081 -8.918 1135 HD22 LEU 745 HD22 LEU 745 39.977 19.137 -8.469 1136 HD23 LEU 745 HD23 LEU 745 40.067 20.899 -8.505 1137 H GLN 746 HN GLN 746 37.951 23.882 -8.209 1138 HA GLN 746 HA GLN 746 39.999 23.615 -10.116 1139 HB2 GLN 746 HB2 GLN 746 37.728 25.587 -9.903 1140 HB3 GLN 746 HB1 GLN 746 38.876 25.638 -11.229 1141 HG2 GLN 746 HG2 GLN 746 37.004 24.467 -12.028 1142 HG3 GLN 746 HG1 GLN 746 38.238 23.249 -11.718 1143 HE21 GLN 746 HE21 GLN 746 35.220 24.596 -10.697 1144 HE22 GLN 746 HE22 GLN 746 34.767 23.303 -9.641 1145 H GLN 747 HN GLN 747 39.293 26.216 -7.830 1146 HA GLN 747 HA GLN 747 41.312 27.974 -8.706 1147 HB2 GLN 747 HB2 GLN 747 39.418 28.595 -7.196 1148 HB3 GLN 747 HB1 GLN 747 40.215 27.715 -5.900 1149 HG2 GLN 747 HG2 GLN 747 40.607 30.115 -5.732 1150 HG3 GLN 747 HG1 GLN 747 42.109 29.233 -6.004 1151 HE21 GLN 747 HE21 GLN 747 43.145 31.048 -6.827 1152 HE22 GLN 747 HE22 GLN 747 42.778 31.694 -8.387 1153 H THR 748 HN THR 748 41.303 25.392 -6.301 1154 HA THR 748 HA THR 748 43.915 25.766 -5.331 1155 HB THR 748 HB THR 748 42.280 23.222 -5.509 1156 HG1 THR 748 HG1 THR 748 41.237 24.716 -4.218 1157 HG21 THR 748 HG21 THR 748 44.663 23.843 -3.754 1158 HG22 THR 748 HG22 THR 748 44.702 22.805 -5.178 1159 HG23 THR 748 HG23 THR 748 43.737 22.340 -3.779 1160 H GLU 749 HN GLU 749 42.631 23.850 -8.017 1161 HA GLU 749 HA GLU 749 44.991 22.526 -8.746 1162 HB2 GLU 749 HB2 GLU 749 42.720 21.967 -9.584 1163 HB3 GLU 749 HB1 GLU 749 42.734 23.436 -10.545 1164 HG2 GLU 749 HG2 GLU 749 43.238 21.515 -11.919 1165 HG3 GLU 749 HG1 GLU 749 44.640 22.579 -11.818 1166 H TYR 750 HN TYR 750 43.735 25.693 -9.600 1167 HA TYR 750 HA TYR 750 45.753 26.277 -11.521 1168 HB2 TYR 750 HB2 TYR 750 43.631 27.412 -11.650 1169 HB3 TYR 750 HB1 TYR 750 43.829 28.064 -10.027 1170 HD1 TYR 750 HD1 TYR 750 45.396 28.118 -13.411 1171 HD2 TYR 750 HD2 TYR 750 44.746 30.177 -9.748 1172 HE1 TYR 750 HE1 TYR 750 46.451 30.127 -14.357 1173 HE2 TYR 750 HE2 TYR 750 45.796 32.185 -10.683 1174 HH TYR 750 HH TYR 750 47.401 32.757 -12.450 1175 H LEU 751 HN LEU 751 45.310 27.014 -8.097 1176 HA LEU 751 HA LEU 751 47.583 28.686 -7.823 1177 HB2 LEU 751 HB2 LEU 751 45.571 28.432 -6.254 1178 HB3 LEU 751 HB1 LEU 751 46.345 26.984 -5.656 1179 HG LEU 751 HG LEU 751 47.632 29.718 -5.510 1180 HD11 LEU 751 HD11 LEU 751 45.537 29.735 -4.268 1181 HD12 LEU 751 HD12 LEU 751 46.922 29.771 -3.177 1182 HD13 LEU 751 HD13 LEU 751 46.023 28.272 -3.412 1183 HD21 LEU 751 HD21 LEU 751 49.189 27.840 -5.324 1184 HD22 LEU 751 HD22 LEU 751 48.199 27.134 -4.048 1185 HD23 LEU 751 HD23 LEU 751 49.018 28.673 -3.779 1186 H GLN 752 HN GLN 752 47.034 25.252 -7.137 1187 HA GLN 752 HA GLN 752 49.779 24.796 -6.434 1188 HB2 GLN 752 HB2 GLN 752 47.910 23.539 -5.399 1189 HB3 GLN 752 HB1 GLN 752 47.560 22.811 -6.958 1190 HG2 GLN 752 HG2 GLN 752 48.787 21.259 -5.611 1191 HG3 GLN 752 HG1 GLN 752 49.803 21.790 -6.949 1192 HE21 GLN 752 HE21 GLN 752 49.281 21.900 -3.531 1193 HE22 GLN 752 HE22 GLN 752 50.818 22.570 -3.110 1194 H GLN 753 HN GLN 753 50.921 25.410 -8.248 1195 HA GLN 753 HA GLN 753 51.011 23.393 -10.350 1196 HB2 GLN 753 HB2 GLN 753 49.562 25.161 -11.242 1197 HB3 GLN 753 HB1 GLN 753 50.812 26.354 -10.918 1198 HG2 GLN 753 HG2 GLN 753 52.287 25.225 -12.518 1199 HG3 GLN 753 HG1 GLN 753 51.008 24.061 -12.859 1200 HE21 GLN 753 HE21 GLN 753 52.357 25.958 -14.628 1201 HE22 GLN 753 HE22 GLN 753 51.106 26.938 -15.305 1202 H VAL 754 HN VAL 754 52.424 26.360 -9.030 1203 HA VAL 754 HA VAL 754 54.541 26.964 -8.538 1204 HB VAL 754 HB VAL 754 55.341 24.103 -9.168 1205 HG11 VAL 754 HG11 VAL 754 57.323 24.588 -7.804 1206 HG12 VAL 754 HG12 VAL 754 56.790 26.260 -7.630 1207 HG13 VAL 754 HG13 VAL 754 57.235 25.637 -9.218 1208 HG21 VAL 754 HG21 VAL 754 54.664 25.385 -6.518 1209 HG22 VAL 754 HG22 VAL 754 55.263 23.743 -6.742 1210 HG23 VAL 754 HG23 VAL 754 53.680 24.198 -7.375 1211 HHA CYC 800 HHA CYC 800 19.267 2.507 -3.537 1212 HMA1 CYC 800 HMA1 CYC 800 23.176 6.873 -2.286 1213 HMA2 CYC 800 HMA2 CYC 800 22.302 6.532 -0.736 1214 HMA3 CYC 800 HMA3 CYC 800 21.382 7.015 -2.218 1215 HAA1 CYC 800 HAA1 CYC 800 18.952 4.576 -2.993 1216 HAA2 CYC 800 HAA2 CYC 800 19.675 6.063 -2.304 1217 HBA1 CYC 800 HBA1 CYC 800 20.032 5.063 -5.213 1218 HBA2 CYC 800 HBA2 CYC 800 20.753 6.568 -4.523 1219 HHB CYC 800 HHB CYC 800 25.291 3.816 -2.305 1220 HB CYC 800 HB CYC 800 23.457 5.956 0.411 1221 HMB1 CYC 800 HMB1 CYC 800 27.578 5.596 -2.341 1222 HMB2 CYC 800 HMB2 CYC 800 28.572 5.174 -0.876 1223 HMB3 CYC 800 HMB3 CYC 800 27.406 3.964 -1.564 1224 HAB1 CYC 800 HAB1 CYC 800 28.721 6.587 0.852 1225 HAB2 CYC 800 HAB2 CYC 800 27.703 6.995 2.296 1226 HBB1 CYC 800 HBB1 CYC 800 26.857 9.068 1.112 1227 HBB2 CYC 800 HBB2 CYC 800 28.657 9.098 1.212 1228 HBB3 CYC 800 HBB3 CYC 800 27.849 8.652 -0.339 1229 HC CYC 800 HC CYC 800 23.356 -0.638 -1.926 1230 H2C CYC 800 H2C CYC 800 25.399 -3.817 -0.589 1231 H3C CYC 800 H3C CYC 800 24.572 -4.143 -3.473 1232 HMC1 CYC 800 HMC1 CYC 800 27.456 -2.759 -1.730 1233 HMC2 CYC 800 HMC2 CYC 800 26.965 -4.297 -2.537 1234 HMC3 CYC 800 HMC3 CYC 800 26.535 -2.715 -3.283 1235 HAC1 CYC 800 HAC CYC 800 24.149 -5.619 -1.396 1236 HBC1 CYC 800 HBC1 CYC 800 22.196 -6.645 -2.460 1237 HBC2 CYC 800 HBC2 CYC 800 23.302 -6.005 -3.728 1238 HBC3 CYC 800 HBC3 CYC 800 21.793 -5.118 -3.312 1239 HHD CYC 800 HHD CYC 800 21.910 -3.359 -4.072 1240 HD CYC 800 HD CYC 800 22.494 0.304 -3.043 1241 HMD1 CYC 800 HMD1 CYC 800 19.515 -3.500 -3.947 1242 HMD2 CYC 800 HMD2 CYC 800 18.077 -2.483 -4.351 1243 HMD3 CYC 800 HMD3 CYC 800 19.366 -2.757 -5.588 1244 HAD1 CYC 800 HAD1 CYC 800 17.919 1.358 -4.379 1245 HAD2 CYC 800 HAD2 CYC 800 17.512 -0.305 -4.912 1246 HBD1 CYC 800 HBD1 CYC 800 16.107 0.593 -2.936 1247 HBD2 CYC 800 HBD2 CYC 800 16.928 -0.976 -2.637 1248 HA CYC 800 HA CYC 800 23.228 2.119 -2.768 Start of MODEL 9 1 H SER 599 HT1 SER 599 48.790 18.611 1.517 2 HA SER 599 HA SER 599 46.496 18.659 2.170 3 HB2 SER 599 HB2 SER 599 46.927 19.402 4.567 4 HB3 SER 599 HB1 SER 599 48.039 18.198 3.918 5 HG SER 599 HG SER 599 49.234 19.798 4.923 6 H ASP 600 HN ASP 600 47.255 21.379 0.722 7 HA ASP 600 HA ASP 600 46.158 23.496 2.153 8 HB2 ASP 600 HB2 ASP 600 47.427 23.802 0.074 9 HB3 ASP 600 HB1 ASP 600 46.115 23.066 -0.841 10 H VAL 601 HN VAL 601 44.557 21.343 -0.165 11 HA VAL 601 HA VAL 601 41.977 22.476 0.207 12 HB VAL 601 HB VAL 601 42.834 19.810 -0.957 13 HG11 VAL 601 HG11 VAL 601 40.112 21.106 -1.027 14 HG12 VAL 601 HG12 VAL 601 40.540 19.642 -0.143 15 HG13 VAL 601 HG13 VAL 601 40.584 19.652 -1.906 16 HG21 VAL 601 HG21 VAL 601 41.900 22.352 -2.279 17 HG22 VAL 601 HG22 VAL 601 42.381 20.865 -3.098 18 HG23 VAL 601 HG23 VAL 601 43.572 21.797 -2.190 19 H GLU 602 HN GLU 602 43.739 19.828 1.680 20 HA GLU 602 HA GLU 602 41.646 18.587 3.059 21 HB2 GLU 602 HB2 GLU 602 44.568 18.824 3.780 22 HB3 GLU 602 HB1 GLU 602 43.433 17.764 4.603 23 HG2 GLU 602 HG2 GLU 602 43.064 16.525 2.554 24 HG3 GLU 602 HG1 GLU 602 44.128 17.624 1.678 25 H GLU 603 HN GLU 603 43.760 21.263 4.020 26 HA GLU 603 HA GLU 603 42.763 21.579 6.636 27 HB2 GLU 603 HB2 GLU 603 44.881 22.580 5.607 28 HB3 GLU 603 HB1 GLU 603 43.844 23.797 4.887 29 HG2 GLU 603 HG2 GLU 603 44.011 23.298 7.849 30 HG3 GLU 603 HG1 GLU 603 45.016 24.472 7.004 31 H ILE 604 HN ILE 604 41.958 23.279 3.617 32 HA ILE 604 HA ILE 604 39.949 24.932 4.561 33 HB ILE 604 HB ILE 604 40.115 23.613 1.841 34 HG12 ILE 604 HG12 ILE 604 41.087 26.326 2.773 35 HG13 ILE 604 HG11 ILE 604 42.118 24.930 2.478 36 HG21 ILE 604 HG21 ILE 604 37.881 24.500 2.265 37 HG22 ILE 604 HG22 ILE 604 38.719 25.475 1.058 38 HG23 ILE 604 HG23 ILE 604 38.572 26.059 2.716 39 HD11 ILE 604 HD11 ILE 604 42.195 26.493 0.627 40 HD12 ILE 604 HD12 ILE 604 40.449 26.359 0.422 41 HD13 ILE 604 HD13 ILE 604 41.481 24.961 0.121 42 H PHE 605 HN PHE 605 39.631 21.632 3.235 43 HA PHE 605 HA PHE 605 36.849 21.449 3.552 44 HB2 PHE 605 HB2 PHE 605 39.060 19.496 3.152 45 HB3 PHE 605 HB1 PHE 605 37.509 18.877 3.703 46 HD1 PHE 605 HD1 PHE 605 38.425 21.548 1.254 47 HD2 PHE 605 HD2 PHE 605 36.455 17.843 1.950 48 HE1 PHE 605 HE1 PHE 605 37.604 21.553 -1.066 49 HE2 PHE 605 HE2 PHE 605 35.632 17.839 -0.367 50 HZ PHE 605 HZ PHE 605 36.205 19.696 -1.878 51 H LYS 606 HN LYS 606 39.500 20.607 5.722 52 HA LYS 606 HA LYS 606 38.006 19.281 7.666 53 HB2 LYS 606 HB2 LYS 606 40.399 19.146 7.694 54 HB3 LYS 606 HB1 LYS 606 40.548 20.883 7.905 55 HG2 LYS 606 HG2 LYS 606 39.689 20.752 10.134 56 HG3 LYS 606 HG1 LYS 606 39.297 19.044 9.931 57 HD2 LYS 606 HD2 LYS 606 41.602 18.448 9.817 58 HD3 LYS 606 HD1 LYS 606 42.094 20.139 9.710 59 HE2 LYS 606 HE2 LYS 606 40.675 18.933 12.081 60 HE3 LYS 606 HE1 LYS 606 42.426 19.113 11.960 61 HZ1 LYS 606 HZ1 LYS 606 42.138 21.493 11.758 62 HZ2 LYS 606 HZ2 LYS 606 41.419 20.947 13.184 63 HZ3 LYS 606 HZ3 LYS 606 40.458 21.336 11.851 64 H THR 607 HN THR 607 38.762 22.764 7.424 65 HA THR 607 HA THR 607 37.401 23.365 9.855 66 HB THR 607 HB THR 607 37.552 25.771 8.867 67 HG1 THR 607 HG1 THR 607 39.648 24.730 7.319 68 HG21 THR 607 HG21 THR 607 40.034 24.161 9.480 69 HG22 THR 607 HG22 THR 607 38.967 24.902 10.672 70 HG23 THR 607 HG23 THR 607 39.894 25.916 9.569 71 H THR 608 HN THR 608 36.520 23.606 6.420 72 HA THR 608 HA THR 608 34.050 24.906 6.853 73 HB THR 608 HB THR 608 33.455 23.945 4.554 74 HG1 THR 608 HG1 THR 608 36.202 23.299 4.398 75 HG21 THR 608 HG21 THR 608 36.012 25.530 4.842 76 HG22 THR 608 HG22 THR 608 34.379 26.197 4.866 77 HG23 THR 608 HG23 THR 608 35.005 25.450 3.396 78 H THR 609 HN THR 609 34.862 21.518 6.446 79 HA THR 609 HA THR 609 32.324 20.407 6.605 80 HB THR 609 HB THR 609 34.828 19.182 7.799 81 HG1 THR 609 HG1 THR 609 35.167 19.571 5.634 82 HG21 THR 609 HG21 THR 609 33.688 17.045 7.454 83 HG22 THR 609 HG22 THR 609 32.265 17.889 6.843 84 HG23 THR 609 HG23 THR 609 32.746 18.077 8.530 85 H GLN 610 HN GLN 610 34.434 21.400 9.368 86 HA GLN 610 HA GLN 610 32.730 20.477 11.381 87 HB2 GLN 610 HB2 GLN 610 35.110 21.101 11.684 88 HB3 GLN 610 HB1 GLN 610 34.690 22.781 11.408 89 HG2 GLN 610 HG2 GLN 610 33.354 22.817 13.419 90 HG3 GLN 610 HG1 GLN 610 33.646 21.096 13.671 91 HE21 GLN 610 HE21 GLN 610 34.596 21.434 15.671 92 HE22 GLN 610 HE22 GLN 610 36.173 22.113 15.842 93 H GLU 611 HN GLU 611 32.953 23.532 9.649 94 HA GLU 611 HA GLU 611 31.031 24.984 11.109 95 HB2 GLU 611 HB2 GLU 611 32.520 26.107 9.553 96 HB3 GLU 611 HB1 GLU 611 31.878 25.179 8.208 97 HG2 GLU 611 HG2 GLU 611 30.951 27.345 8.055 98 HG3 GLU 611 HG1 GLU 611 29.666 26.282 8.621 99 H VAL 612 HN VAL 612 30.760 23.051 8.146 100 HA VAL 612 HA VAL 612 28.008 23.289 7.719 101 HB VAL 612 HB VAL 612 29.852 20.978 7.054 102 HG11 VAL 612 HG11 VAL 612 27.535 20.226 7.058 103 HG12 VAL 612 HG12 VAL 612 28.167 20.299 5.411 104 HG13 VAL 612 HG13 VAL 612 27.086 21.564 5.997 105 HG21 VAL 612 HG21 VAL 612 30.511 23.077 6.017 106 HG22 VAL 612 HG22 VAL 612 28.878 23.297 5.388 107 HG23 VAL 612 HG23 VAL 612 29.875 21.963 4.807 108 H ARG 613 HN ARG 613 29.844 20.932 9.608 109 HA ARG 613 HA ARG 613 27.795 19.225 10.373 110 HB2 ARG 613 HB2 ARG 613 30.197 18.836 10.829 111 HB3 ARG 613 HB1 ARG 613 30.158 20.107 12.042 112 HG2 ARG 613 HG2 ARG 613 28.400 18.768 13.234 113 HG3 ARG 613 HG1 ARG 613 28.748 17.458 12.105 114 HD2 ARG 613 HD2 ARG 613 31.093 17.469 12.840 115 HD3 ARG 613 HD1 ARG 613 30.722 18.752 13.988 116 HE ARG 613 HE ARG 613 29.598 16.028 14.097 117 HH11 ARG 613 HH11 ARG 613 30.719 18.946 15.733 118 HH12 ARG 613 HH12 ARG 613 30.438 18.306 17.316 119 HH21 ARG 613 HH21 ARG 613 29.198 15.211 16.204 120 HH22 ARG 613 HH22 ARG 613 29.550 16.187 17.581 121 H GLN 614 HN GLN 614 29.002 22.116 12.061 122 HA GLN 614 HA GLN 614 27.115 22.047 14.139 123 HB2 GLN 614 HB2 GLN 614 29.255 23.266 14.250 124 HB3 GLN 614 HB1 GLN 614 28.657 24.409 13.057 125 HG2 GLN 614 HG2 GLN 614 26.853 25.033 14.622 126 HG3 GLN 614 HG1 GLN 614 27.567 23.958 15.821 127 HE21 GLN 614 HE21 GLN 614 27.114 26.817 15.899 128 HE22 GLN 614 HE22 GLN 614 28.648 27.550 16.198 129 H LEU 615 HN LEU 615 27.096 23.667 10.985 130 HA LEU 615 HA LEU 615 24.817 25.282 11.397 131 HB2 LEU 615 HB2 LEU 615 26.025 24.141 8.887 132 HB3 LEU 615 HB1 LEU 615 24.640 25.211 8.863 133 HG LEU 615 HG LEU 615 27.365 25.927 9.947 134 HD11 LEU 615 HD11 LEU 615 27.555 27.333 7.965 135 HD12 LEU 615 HD12 LEU 615 26.002 26.735 7.382 136 HD13 LEU 615 HD13 LEU 615 27.374 25.636 7.522 137 HD21 LEU 615 HD21 LEU 615 25.577 27.139 11.067 138 HD22 LEU 615 HD22 LEU 615 24.884 27.588 9.512 139 HD23 LEU 615 HD23 LEU 615 26.462 28.215 9.986 140 H LEU 616 HN LEU 616 25.150 21.988 10.211 141 HA LEU 616 HA LEU 616 22.283 21.783 9.759 142 HB2 LEU 616 HB2 LEU 616 24.476 19.738 9.455 143 HB3 LEU 616 HB1 LEU 616 22.796 19.475 9.032 144 HG LEU 616 HG LEU 616 24.668 21.449 7.721 145 HD11 LEU 616 HD11 LEU 616 23.497 18.848 6.753 146 HD12 LEU 616 HD12 LEU 616 25.189 19.159 7.143 147 HD13 LEU 616 HD13 LEU 616 24.433 19.977 5.776 148 HD21 LEU 616 HD21 LEU 616 22.389 22.300 7.732 149 HD22 LEU 616 HD22 LEU 616 21.793 20.764 7.106 150 HD23 LEU 616 HD23 LEU 616 22.838 21.776 6.109 151 H ARG 617 HN ARG 617 24.248 21.586 12.392 152 HA ARG 617 HA ARG 617 24.059 20.735 14.502 153 HB2 ARG 617 HB2 ARG 617 21.734 21.721 14.176 154 HB3 ARG 617 HB1 ARG 617 21.189 20.108 13.753 155 HG2 ARG 617 HG2 ARG 617 20.625 20.543 16.032 156 HG3 ARG 617 HG1 ARG 617 21.910 19.336 15.995 157 HD2 ARG 617 HD2 ARG 617 23.558 21.065 16.483 158 HD3 ARG 617 HD1 ARG 617 22.286 22.286 16.485 159 HE ARG 617 HE ARG 617 21.735 20.193 18.325 160 HH11 ARG 617 HH11 ARG 617 23.646 23.094 17.883 161 HH12 ARG 617 HH12 ARG 617 23.791 23.421 19.576 162 HH21 ARG 617 HH21 ARG 617 21.908 20.623 20.578 163 HH22 ARG 617 HH22 ARG 617 22.787 22.010 21.114 164 H CYS 618 HN CYS 618 24.943 19.071 12.385 165 HA CYS 618 HA CYS 618 23.761 16.444 12.851 166 HB2 CYS 618 HB2 CYS 618 24.317 17.500 10.548 167 HB3 CYS 618 HB1 CYS 618 25.977 17.053 10.922 168 HG CYS 618 HG CYS 618 23.591 15.237 9.661 169 H ASP 619 HN ASP 619 25.400 14.556 12.988 170 HA ASP 619 HA ASP 619 27.496 15.329 14.918 171 HB2 ASP 619 HB2 ASP 619 25.818 13.754 15.771 172 HB3 ASP 619 HB1 ASP 619 26.221 12.629 14.475 173 H ARG 620 HN ARG 620 26.943 13.077 12.151 174 HA ARG 620 HA ARG 620 29.848 13.247 11.788 175 HB2 ARG 620 HB2 ARG 620 27.966 10.947 11.380 176 HB3 ARG 620 HB1 ARG 620 29.582 10.981 10.678 177 HG2 ARG 620 HG2 ARG 620 30.615 10.746 12.675 178 HG3 ARG 620 HG1 ARG 620 29.329 11.556 13.571 179 HD2 ARG 620 HD2 ARG 620 29.395 9.215 14.148 180 HD3 ARG 620 HD1 ARG 620 27.910 9.578 13.272 181 HE ARG 620 HE ARG 620 29.976 8.664 11.543 182 HH11 ARG 620 HH11 ARG 620 27.567 7.605 13.861 183 HH12 ARG 620 HH12 ARG 620 27.398 6.028 13.154 184 HH21 ARG 620 HH21 ARG 620 29.759 6.549 10.616 185 HH22 ARG 620 HH22 ARG 620 28.644 5.435 11.331 186 H VAL 621 HN VAL 621 30.664 13.531 9.810 187 HA VAL 621 HA VAL 621 28.875 13.956 7.548 188 HB VAL 621 HB VAL 621 30.944 16.023 8.384 189 HG11 VAL 621 HG11 VAL 621 30.000 17.377 6.573 190 HG12 VAL 621 HG12 VAL 621 28.916 16.051 6.152 191 HG13 VAL 621 HG13 VAL 621 30.660 15.854 5.975 192 HG21 VAL 621 HG21 VAL 621 27.932 16.228 8.508 193 HG22 VAL 621 HG22 VAL 621 29.071 17.530 8.853 194 HG23 VAL 621 HG23 VAL 621 29.018 16.107 9.892 195 H ALA 622 HN ALA 622 29.826 13.189 5.707 196 HA ALA 622 HA ALA 622 32.706 12.666 5.860 197 HB1 ALA 622 HB1 ALA 622 32.414 10.485 4.849 198 HB2 ALA 622 HB2 ALA 622 30.667 10.722 4.801 199 HB3 ALA 622 HB3 ALA 622 31.497 10.596 6.353 200 H VAL 623 HN VAL 623 33.740 12.348 3.856 201 HA VAL 623 HA VAL 623 32.413 13.693 1.605 202 HB VAL 623 HB VAL 623 35.333 13.913 2.413 203 HG11 VAL 623 HG11 VAL 623 35.528 15.490 0.555 204 HG12 VAL 623 HG12 VAL 623 33.854 15.164 0.106 205 HG13 VAL 623 HG13 VAL 623 35.063 13.883 -0.003 206 HG21 VAL 623 HG21 VAL 623 34.852 16.291 2.744 207 HG22 VAL 623 HG22 VAL 623 33.897 15.278 3.831 208 HG23 VAL 623 HG23 VAL 623 33.151 15.991 2.398 209 H TYR 624 HN TYR 624 32.435 12.529 -0.229 210 HA TYR 624 HA TYR 624 34.143 10.135 -0.264 211 HB2 TYR 624 HB2 TYR 624 31.439 10.398 -1.603 212 HB3 TYR 624 HB1 TYR 624 32.414 8.945 -1.457 213 HD1 TYR 624 HD1 TYR 624 29.447 9.851 -0.525 214 HD2 TYR 624 HD2 TYR 624 33.131 9.046 1.440 215 HE1 TYR 624 HE1 TYR 624 28.220 9.275 1.507 216 HE2 TYR 624 HE2 TYR 624 31.904 8.462 3.489 217 HH TYR 624 HH TYR 624 29.652 8.978 4.524 218 H ARG 625 HN ARG 625 34.933 9.546 -2.346 219 HA ARG 625 HA ARG 625 34.756 11.692 -4.352 220 HB2 ARG 625 HB2 ARG 625 36.927 11.846 -3.281 221 HB3 ARG 625 HB1 ARG 625 37.203 10.126 -3.515 222 HG2 ARG 625 HG2 ARG 625 37.142 10.512 -5.973 223 HG3 ARG 625 HG1 ARG 625 37.043 12.243 -5.648 224 HD2 ARG 625 HD2 ARG 625 39.185 12.175 -4.506 225 HD3 ARG 625 HD1 ARG 625 39.271 10.427 -4.731 226 HE ARG 625 HE ARG 625 38.962 11.505 -7.249 227 HH11 ARG 625 HH11 ARG 625 41.340 11.705 -4.678 228 HH12 ARG 625 HH12 ARG 625 42.659 12.037 -5.743 229 HH21 ARG 625 HH21 ARG 625 40.704 11.915 -8.673 230 HH22 ARG 625 HH22 ARG 625 42.293 12.158 -8.035 231 H PHE 626 HN PHE 626 34.435 11.048 -6.412 232 HA PHE 626 HA PHE 626 34.212 8.174 -6.837 233 HB2 PHE 626 HB2 PHE 626 33.054 10.543 -8.275 234 HB3 PHE 626 HB1 PHE 626 33.093 8.947 -9.016 235 HD1 PHE 626 HD1 PHE 626 31.058 11.117 -7.336 236 HD2 PHE 626 HD2 PHE 626 32.279 7.044 -7.239 237 HE1 PHE 626 HE1 PHE 626 28.973 10.520 -6.180 238 HE2 PHE 626 HE2 PHE 626 30.198 6.439 -6.081 239 HZ PHE 626 HZ PHE 626 28.541 8.178 -5.551 240 H ASN 627 HN ASN 627 35.776 7.196 -7.754 241 HA ASN 627 HA ASN 627 37.811 8.609 -9.251 242 HB2 ASN 627 HB2 ASN 627 37.503 5.666 -8.554 243 HB3 ASN 627 HB1 ASN 627 38.923 6.382 -9.300 244 HD21 ASN 627 HD21 ASN 627 38.719 4.937 -6.816 245 HD22 ASN 627 HD22 ASN 627 39.284 6.005 -5.575 246 HA PRO 628 HA PRO 628 36.453 7.573 -13.389 247 HB2 PRO 628 HB2 PRO 628 38.714 5.641 -13.673 248 HB3 PRO 628 HB1 PRO 628 38.226 6.957 -14.746 249 HG2 PRO 628 HG2 PRO 628 40.344 7.245 -13.193 250 HG3 PRO 628 HG1 PRO 628 39.207 8.589 -13.403 251 HD2 PRO 628 HD2 PRO 628 39.533 6.723 -11.098 252 HD3 PRO 628 HD1 PRO 628 39.178 8.463 -11.093 253 H ASN 629 HN ASN 629 37.144 5.035 -11.141 254 HA ASN 629 HA ASN 629 35.575 3.089 -12.656 255 HB2 ASN 629 HB2 ASN 629 37.245 2.721 -10.159 256 HB3 ASN 629 HB1 ASN 629 36.401 1.437 -11.018 257 HD21 ASN 629 HD21 ASN 629 39.247 1.777 -10.461 258 HD22 ASN 629 HD22 ASN 629 40.038 1.749 -11.996 259 H TRP 630 HN TRP 630 34.937 5.489 -10.550 260 HA TRP 630 HA TRP 630 33.332 5.992 -9.003 261 HB2 TRP 630 HB2 TRP 630 31.843 4.103 -10.833 262 HB3 TRP 630 HB1 TRP 630 31.053 5.100 -9.618 263 HD1 TRP 630 HD1 TRP 630 33.229 5.538 -12.802 264 HE1 TRP 630 HE1 TRP 630 32.592 7.783 -13.896 265 HE3 TRP 630 HE3 TRP 630 29.922 7.247 -9.303 266 HZ2 TRP 630 HZ2 TRP 630 30.917 9.977 -13.353 267 HZ3 TRP 630 HZ3 TRP 630 28.845 9.423 -9.665 268 HH2 TRP 630 HH2 TRP 630 29.333 10.762 -11.649 269 H THR 631 HN THR 631 34.991 4.227 -7.812 270 HA THR 631 HA THR 631 33.543 1.942 -6.822 271 HB THR 631 HB THR 631 35.674 1.546 -5.537 272 HG1 THR 631 HG1 THR 631 37.148 3.073 -5.590 273 HG21 THR 631 HG21 THR 631 36.900 0.895 -7.557 274 HG22 THR 631 HG22 THR 631 35.827 1.918 -8.518 275 HG23 THR 631 HG23 THR 631 35.183 0.504 -7.688 276 H GLY 632 HN GLY 632 33.394 5.053 -5.897 277 HA2 GLY 632 HA2 GLY 632 32.591 6.088 -3.978 278 HA3 GLY 632 HA1 GLY 632 32.198 4.478 -3.390 279 H GLU 633 HN GLU 633 34.977 6.660 -3.841 280 HA GLU 633 HA GLU 633 36.439 5.163 -1.804 281 HB2 GLU 633 HB2 GLU 633 37.550 5.652 -3.928 282 HB3 GLU 633 HB1 GLU 633 37.291 7.369 -3.683 283 HG2 GLU 633 HG2 GLU 633 38.753 7.289 -1.712 284 HG3 GLU 633 HG1 GLU 633 39.036 5.573 -2.014 285 H PHE 634 HN PHE 634 36.690 5.882 0.214 286 HA PHE 634 HA PHE 634 35.599 8.440 1.020 287 HB2 PHE 634 HB2 PHE 634 36.918 6.184 2.551 288 HB3 PHE 634 HB1 PHE 634 36.413 7.681 3.316 289 HD1 PHE 634 HD1 PHE 634 34.800 5.344 0.866 290 HD2 PHE 634 HD2 PHE 634 34.550 7.353 4.612 291 HE1 PHE 634 HE1 PHE 634 32.570 4.376 1.233 292 HE2 PHE 634 HE2 PHE 634 32.319 6.385 4.982 293 HZ PHE 634 HZ PHE 634 31.326 4.897 3.292 294 H VAL 635 HN VAL 635 36.760 10.268 1.149 295 HA VAL 635 HA VAL 635 39.689 9.988 1.142 296 HB VAL 635 HB VAL 635 39.766 12.283 0.131 297 HG11 VAL 635 HG11 VAL 635 39.183 11.524 -2.122 298 HG12 VAL 635 HG12 VAL 635 38.293 10.166 -1.431 299 HG13 VAL 635 HG13 VAL 635 40.040 10.274 -1.218 300 HG21 VAL 635 HG21 VAL 635 37.729 13.135 -0.954 301 HG22 VAL 635 HG22 VAL 635 37.553 13.069 0.799 302 HG23 VAL 635 HG23 VAL 635 36.796 11.836 -0.210 303 H ALA 636 HN ALA 636 37.009 11.681 2.650 304 HA ALA 636 HA ALA 636 38.662 12.272 4.931 305 HB1 ALA 636 HB1 ALA 636 39.141 14.197 3.484 306 HB2 ALA 636 HB2 ALA 636 38.242 14.679 4.923 307 HB3 ALA 636 HB3 ALA 636 37.415 14.539 3.372 308 H GLU 637 HN GLU 637 37.428 12.889 6.761 309 HA GLU 637 HA GLU 637 34.595 13.147 6.551 310 HB2 GLU 637 HB2 GLU 637 34.432 11.137 8.311 311 HB3 GLU 637 HB1 GLU 637 34.244 10.900 6.583 312 HG2 GLU 637 HG2 GLU 637 35.656 9.176 7.422 313 HG3 GLU 637 HG1 GLU 637 36.642 10.267 6.464 314 H SER 638 HN SER 638 33.596 13.349 8.725 315 HA SER 638 HA SER 638 35.467 14.138 10.804 316 HB2 SER 638 HB2 SER 638 33.264 15.922 9.746 317 HB3 SER 638 HB1 SER 638 34.236 16.250 11.182 318 HG SER 638 HG SER 638 35.849 15.676 9.119 319 H VAL 639 HN VAL 639 34.848 13.463 12.708 320 HA VAL 639 HA VAL 639 32.050 12.785 13.198 321 HB VAL 639 HB VAL 639 33.086 10.696 12.482 322 HG11 VAL 639 HG11 VAL 639 35.166 11.237 14.594 323 HG12 VAL 639 HG12 VAL 639 35.411 11.240 12.848 324 HG13 VAL 639 HG13 VAL 639 35.010 9.738 13.682 325 HG21 VAL 639 HG21 VAL 639 32.858 10.690 15.490 326 HG22 VAL 639 HG22 VAL 639 32.689 9.298 14.417 327 HG23 VAL 639 HG23 VAL 639 31.495 10.596 14.377 328 H ALA 640 HN ALA 640 31.487 12.854 15.418 329 HA ALA 640 HA ALA 640 32.923 14.662 17.006 330 HB1 ALA 640 HB1 ALA 640 30.896 12.624 17.937 331 HB2 ALA 640 HB2 ALA 640 30.484 14.184 17.225 332 HB3 ALA 640 HB3 ALA 640 31.354 14.115 18.763 333 H HIS 641 HN HIS 641 34.313 14.341 18.729 334 HA HIS 641 HA HIS 641 36.127 12.216 18.430 335 HB2 HIS 641 HB2 HIS 641 35.837 14.294 20.582 336 HB3 HIS 641 HB1 HIS 641 37.103 13.072 20.632 337 HD2 HIS 641 HD2 HIS 641 36.279 16.397 18.844 338 HE1 HIS 641 HE1 HIS 641 39.963 14.975 17.297 339 HE2 HIS 641 HE2 HIS 641 38.317 16.880 17.322 340 H THR 642 HN THR 642 33.191 12.190 20.036 341 HA THR 642 HA THR 642 33.856 10.314 22.087 342 HB THR 642 HB THR 642 31.118 10.908 20.942 343 HG1 THR 642 HG1 THR 642 32.426 12.219 23.105 344 HG21 THR 642 HG21 THR 642 30.345 10.308 23.194 345 HG22 THR 642 HG22 THR 642 32.008 9.988 23.685 346 HG23 THR 642 HG23 THR 642 31.241 8.977 22.464 347 H TRP 643 HN TRP 643 33.267 10.077 18.705 348 HA TRP 643 HA TRP 643 32.557 7.225 18.966 349 HB2 TRP 643 HB2 TRP 643 32.164 8.830 16.457 350 HB3 TRP 643 HB1 TRP 643 31.347 7.355 16.963 351 HD1 TRP 643 HD1 TRP 643 30.760 10.920 16.687 352 HE1 TRP 643 HE1 TRP 643 28.775 11.686 18.114 353 HE3 TRP 643 HE3 TRP 643 30.248 6.759 19.606 354 HZ2 TRP 643 HZ2 TRP 643 27.191 10.649 20.226 355 HZ3 TRP 643 HZ3 TRP 643 28.473 6.727 21.307 356 HH2 TRP 643 HH2 TRP 643 26.977 8.632 21.608 357 H VAL 644 HN VAL 644 33.095 6.650 16.197 358 HA VAL 644 HA VAL 644 36.037 6.672 16.251 359 HB VAL 644 HB VAL 644 34.990 4.435 16.655 360 HG11 VAL 644 HG11 VAL 644 32.998 4.657 15.312 361 HG12 VAL 644 HG12 VAL 644 33.924 3.250 14.790 362 HG13 VAL 644 HG13 VAL 644 33.966 4.735 13.840 363 HG21 VAL 644 HG21 VAL 644 37.233 4.559 15.720 364 HG22 VAL 644 HG22 VAL 644 36.567 4.653 14.090 365 HG23 VAL 644 HG23 VAL 644 36.359 3.185 15.044 366 H LYS 645 HN LYS 645 37.098 6.647 14.131 367 HA LYS 645 HA LYS 645 35.763 8.407 12.268 368 HB2 LYS 645 HB2 LYS 645 38.588 7.330 12.320 369 HB3 LYS 645 HB1 LYS 645 37.983 8.517 11.176 370 HG2 LYS 645 HG2 LYS 645 37.558 10.073 13.019 371 HG3 LYS 645 HG1 LYS 645 38.170 8.880 14.163 372 HD2 LYS 645 HD2 LYS 645 40.004 10.277 13.827 373 HD3 LYS 645 HD1 LYS 645 40.320 8.937 12.728 374 HE2 LYS 645 HE2 LYS 645 39.045 11.559 11.919 375 HE3 LYS 645 HE1 LYS 645 40.757 11.192 11.745 376 HZ1 LYS 645 HZ1 LYS 645 39.710 10.807 9.675 377 HZ2 LYS 645 HZ2 LYS 645 38.474 9.900 10.348 378 HZ3 LYS 645 HZ3 LYS 645 40.054 9.277 10.307 379 H LEU 646 HN LEU 646 36.251 7.937 9.874 380 HA LEU 646 HA LEU 646 35.543 5.115 9.398 381 HB2 LEU 646 HB2 LEU 646 34.760 7.577 7.878 382 HB3 LEU 646 HB1 LEU 646 34.389 5.944 7.363 383 HG LEU 646 HG LEU 646 33.374 7.293 9.866 384 HD11 LEU 646 HD11 LEU 646 32.355 8.173 7.837 385 HD12 LEU 646 HD12 LEU 646 31.201 7.208 8.759 386 HD13 LEU 646 HD13 LEU 646 31.958 6.534 7.316 387 HD21 LEU 646 HD21 LEU 646 32.810 4.559 8.730 388 HD22 LEU 646 HD22 LEU 646 31.947 5.297 10.080 389 HD23 LEU 646 HD23 LEU 646 33.662 4.916 10.234 390 H VAL 647 HN VAL 647 37.811 7.569 8.725 391 HA VAL 647 HA VAL 647 39.223 5.722 6.960 392 HB VAL 647 HB VAL 647 37.926 7.574 5.644 393 HG11 VAL 647 HG11 VAL 647 38.579 9.465 7.012 394 HG12 VAL 647 HG12 VAL 647 39.124 9.676 5.349 395 HG13 VAL 647 HG13 VAL 647 40.272 9.198 6.600 396 HG21 VAL 647 HG21 VAL 647 39.549 6.094 4.605 397 HG22 VAL 647 HG22 VAL 647 40.869 7.127 5.154 398 HG23 VAL 647 HG23 VAL 647 39.711 7.730 3.969 399 H GLY 648 HN GLY 648 41.564 6.425 6.719 400 HA2 GLY 648 HA2 GLY 648 42.538 8.244 8.738 401 HA3 GLY 648 HA1 GLY 648 42.881 6.549 9.064 402 HA PRO 649 HA PRO 649 46.391 8.213 6.555 403 HB2 PRO 649 HB2 PRO 649 47.909 6.352 8.271 404 HB3 PRO 649 HB1 PRO 649 48.199 8.063 7.950 405 HG2 PRO 649 HG2 PRO 649 47.282 7.217 10.327 406 HG3 PRO 649 HG1 PRO 649 46.763 8.760 9.621 407 HD2 PRO 649 HD2 PRO 649 45.328 6.133 9.706 408 HD3 PRO 649 HD1 PRO 649 44.691 7.773 9.951 409 H ASP 650 HN ASP 650 46.378 4.884 7.848 410 HA ASP 650 HA ASP 650 46.837 3.926 5.106 411 HB2 ASP 650 HB2 ASP 650 47.312 2.451 7.704 412 HB3 ASP 650 HB1 ASP 650 47.740 1.893 6.090 413 H ILE 651 HN ILE 651 44.419 4.431 7.173 414 HA ILE 651 HA ILE 651 42.973 1.958 6.739 415 HB ILE 651 HB ILE 651 42.099 4.534 8.073 416 HG12 ILE 651 HG12 ILE 651 43.863 3.371 9.312 417 HG13 ILE 651 HG11 ILE 651 42.332 3.281 10.173 418 HG21 ILE 651 HG21 ILE 651 40.707 1.858 7.973 419 HG22 ILE 651 HG22 ILE 651 40.190 3.331 7.151 420 HG23 ILE 651 HG23 ILE 651 40.185 3.257 8.914 421 HD11 ILE 651 HD11 ILE 651 42.024 0.987 9.325 422 HD12 ILE 651 HD12 ILE 651 43.482 1.167 10.298 423 HD13 ILE 651 HD13 ILE 651 43.601 1.088 8.541 424 H LYS 652 HN LYS 652 41.987 1.630 4.904 425 HA LYS 652 HA LYS 652 40.949 3.945 3.404 426 HB2 LYS 652 HB2 LYS 652 41.861 1.296 2.272 427 HB3 LYS 652 HB1 LYS 652 41.292 2.678 1.352 428 HG2 LYS 652 HG2 LYS 652 43.235 3.972 2.176 429 HG3 LYS 652 HG1 LYS 652 43.819 2.515 2.981 430 HD2 LYS 652 HD2 LYS 652 43.352 2.818 0.011 431 HD3 LYS 652 HD1 LYS 652 44.921 2.866 0.812 432 HE2 LYS 652 HE2 LYS 652 43.027 0.512 0.763 433 HE3 LYS 652 HE1 LYS 652 44.487 0.676 -0.203 434 HZ1 LYS 652 HZ1 LYS 652 44.958 -0.686 1.678 435 HZ2 LYS 652 HZ2 LYS 652 44.321 0.442 2.750 436 HZ3 LYS 652 HZ3 LYS 652 45.747 0.789 1.911 437 H THR 653 HN THR 653 38.886 3.861 2.665 438 HA THR 653 HA THR 653 37.364 1.400 3.087 439 HB THR 653 HB THR 653 36.341 4.161 3.846 440 HG1 THR 653 HG1 THR 653 36.982 3.747 5.871 441 HG21 THR 653 HG21 THR 653 35.226 1.390 4.332 442 HG22 THR 653 HG22 THR 653 34.597 2.565 3.177 443 HG23 THR 653 HG23 THR 653 34.518 2.899 4.908 444 H VAL 654 HN VAL 654 36.405 0.837 1.184 445 HA VAL 654 HA VAL 654 35.729 2.982 -0.695 446 HB VAL 654 HB VAL 654 37.609 1.355 -1.297 447 HG11 VAL 654 HG11 VAL 654 36.963 -0.854 -2.137 448 HG12 VAL 654 HG12 VAL 654 35.329 -0.593 -1.526 449 HG13 VAL 654 HG13 VAL 654 36.687 -0.678 -0.404 450 HG21 VAL 654 HG21 VAL 654 36.518 2.681 -2.993 451 HG22 VAL 654 HG22 VAL 654 35.229 1.486 -3.132 452 HG23 VAL 654 HG23 VAL 654 36.875 1.069 -3.614 453 H TRP 655 HN TRP 655 33.694 2.525 -2.019 454 HA TRP 655 HA TRP 655 31.983 0.489 -0.806 455 HB2 TRP 655 HB2 TRP 655 31.603 2.689 0.379 456 HB3 TRP 655 HB1 TRP 655 31.074 3.357 -1.158 457 HD1 TRP 655 HD1 TRP 655 29.066 1.265 -2.223 458 HE1 TRP 655 HE1 TRP 655 26.883 0.717 -0.982 459 HE3 TRP 655 HE3 TRP 655 30.378 2.881 2.449 460 HZ2 TRP 655 HZ2 TRP 655 25.851 0.953 1.636 461 HZ3 TRP 655 HZ3 TRP 655 28.728 2.690 4.264 462 HH2 TRP 655 HH2 TRP 655 26.514 1.747 3.863 463 H GLU 656 HN GLU 656 31.987 -0.672 -2.684 464 HA GLU 656 HA GLU 656 31.372 0.663 -5.177 465 HB2 GLU 656 HB2 GLU 656 31.898 -2.251 -4.579 466 HB3 GLU 656 HB1 GLU 656 31.645 -1.583 -6.186 467 HG2 GLU 656 HG2 GLU 656 33.639 -0.173 -5.886 468 HG3 GLU 656 HG1 GLU 656 33.901 -0.915 -4.308 469 H ASP 657 HN ASP 657 29.300 1.350 -5.033 470 HA ASP 657 HA ASP 657 27.199 -0.518 -4.303 471 HB2 ASP 657 HB2 ASP 657 26.872 1.727 -3.530 472 HB3 ASP 657 HB1 ASP 657 27.127 2.380 -5.147 473 H THR 658 HN THR 658 26.092 -1.711 -5.671 474 HA THR 658 HA THR 658 26.881 -1.975 -8.349 475 HB THR 658 HB THR 658 24.795 -3.457 -8.472 476 HG1 THR 658 HG1 THR 658 23.453 -3.129 -6.860 477 HG21 THR 658 HG21 THR 658 26.857 -3.938 -6.322 478 HG22 THR 658 HG22 THR 658 27.020 -4.355 -8.030 479 HG23 THR 658 HG23 THR 658 25.818 -5.173 -7.030 480 H HIS 659 HN HIS 659 24.188 -0.294 -6.849 481 HA HIS 659 HA HIS 659 22.657 0.122 -9.183 482 HB2 HIS 659 HB2 HIS 659 21.767 0.403 -6.886 483 HB3 HIS 659 HB1 HIS 659 22.777 1.827 -6.683 484 HD2 HIS 659 HD2 HIS 659 21.986 4.023 -8.477 485 HE1 HIS 659 HE1 HIS 659 18.014 2.566 -8.782 486 HE2 HIS 659 HE2 HIS 659 19.570 4.483 -9.275 487 H LEU 660 HN LEU 660 24.875 2.352 -7.440 488 HA LEU 660 HA LEU 660 24.817 4.363 -9.363 489 HB2 LEU 660 HB2 LEU 660 27.051 3.632 -7.475 490 HB3 LEU 660 HB1 LEU 660 26.903 5.153 -8.330 491 HG LEU 660 HG LEU 660 25.077 4.121 -6.160 492 HD11 LEU 660 HD11 LEU 660 27.210 4.954 -5.349 493 HD12 LEU 660 HD12 LEU 660 25.899 6.046 -4.906 494 HD13 LEU 660 HD13 LEU 660 26.977 6.457 -6.241 495 HD21 LEU 660 HD21 LEU 660 24.904 6.652 -7.793 496 HD22 LEU 660 HD22 LEU 660 23.951 6.310 -6.349 497 HD23 LEU 660 HD23 LEU 660 23.751 5.317 -7.792 498 H GLN 661 HN GLN 661 27.202 1.761 -8.931 499 HA GLN 661 HA GLN 661 28.937 2.296 -10.965 500 HB2 GLN 661 HB2 GLN 661 27.941 -0.338 -9.936 501 HB3 GLN 661 HB1 GLN 661 29.134 -0.265 -11.224 502 HG2 GLN 661 HG2 GLN 661 29.476 1.040 -8.534 503 HG3 GLN 661 HG1 GLN 661 30.082 -0.563 -8.943 504 HE21 GLN 661 HE21 GLN 661 32.207 0.010 -8.637 505 HE22 GLN 661 HE22 GLN 661 33.061 1.071 -9.709 506 H GLU 662 HN GLU 662 25.919 0.440 -11.379 507 HA GLU 662 HA GLU 662 26.280 0.010 -14.154 508 HB2 GLU 662 HB2 GLU 662 23.783 -0.020 -12.474 509 HB3 GLU 662 HB1 GLU 662 23.841 -0.515 -14.157 510 HG2 GLU 662 HG2 GLU 662 25.436 -2.277 -13.572 511 HG3 GLU 662 HG1 GLU 662 25.334 -1.788 -11.880 512 H THR 663 HN THR 663 24.954 2.696 -12.377 513 HA THR 663 HA THR 663 23.875 3.816 -14.867 514 HB THR 663 HB THR 663 22.701 5.435 -13.316 515 HG1 THR 663 HG1 THR 663 23.354 3.516 -11.310 516 HG21 THR 663 HG21 THR 663 21.543 3.527 -14.313 517 HG22 THR 663 HG22 THR 663 20.976 3.806 -12.667 518 HG23 THR 663 HG23 THR 663 22.101 2.489 -13.001 519 H GLN 664 HN GLN 664 26.725 3.900 -13.454 520 HA GLN 664 HA GLN 664 28.465 5.353 -13.257 521 HB2 GLN 664 HB2 GLN 664 26.899 6.538 -15.524 522 HB3 GLN 664 HB1 GLN 664 28.343 7.348 -14.933 523 HG2 GLN 664 HG2 GLN 664 28.264 4.494 -15.886 524 HG3 GLN 664 HG1 GLN 664 28.744 5.871 -16.879 525 HE21 GLN 664 HE21 GLN 664 29.625 3.820 -14.202 526 HE22 GLN 664 HE22 GLN 664 31.274 4.332 -14.105 527 H GLY 665 HN GLY 665 26.401 5.665 -11.405 528 HA2 GLY 665 HA2 GLY 665 26.526 7.185 -9.547 529 HA3 GLY 665 HA1 GLY 665 26.819 8.491 -10.685 530 H GLY 666 HN GLY 666 24.639 7.267 -12.414 531 HA2 GLY 666 HA2 GLY 666 22.434 7.734 -12.840 532 HA3 GLY 666 HA1 GLY 666 22.175 7.083 -11.232 533 H ARG 667 HN ARG 667 21.302 8.358 -9.787 534 HA ARG 667 HA ARG 667 20.273 10.877 -10.369 535 HB2 ARG 667 HB2 ARG 667 20.816 9.641 -7.670 536 HB3 ARG 667 HB1 ARG 667 19.790 11.038 -7.950 537 HG2 ARG 667 HG2 ARG 667 18.281 9.678 -9.286 538 HG3 ARG 667 HG1 ARG 667 19.317 8.270 -9.030 539 HD2 ARG 667 HD2 ARG 667 18.941 8.456 -6.612 540 HD3 ARG 667 HD1 ARG 667 17.885 9.837 -6.888 541 HE ARG 667 HE ARG 667 17.326 7.059 -7.686 542 HH11 ARG 667 HH11 ARG 667 16.222 10.345 -7.076 543 HH12 ARG 667 HH12 ARG 667 14.544 9.900 -7.072 544 HH21 ARG 667 HH21 ARG 667 15.117 6.486 -7.673 545 HH22 ARG 667 HH22 ARG 667 13.912 7.701 -7.412 546 H TYR 668 HN TYR 668 23.244 9.974 -8.703 547 HA TYR 668 HA TYR 668 23.839 12.626 -7.856 548 HB2 TYR 668 HB2 TYR 668 25.594 10.175 -8.043 549 HB3 TYR 668 HB1 TYR 668 26.081 11.696 -7.302 550 HD1 TYR 668 HD1 TYR 668 25.081 8.528 -6.494 551 HD2 TYR 668 HD2 TYR 668 24.050 12.567 -5.610 552 HE1 TYR 668 HE1 TYR 668 24.102 7.812 -4.365 553 HE2 TYR 668 HE2 TYR 668 23.069 11.852 -3.474 554 HH TYR 668 HH TYR 668 23.587 8.792 -2.149 555 H ALA 669 HN ALA 669 24.565 10.737 -10.687 556 HA ALA 669 HA ALA 669 26.570 12.477 -11.731 557 HB1 ALA 669 HB1 ALA 669 26.251 11.263 -13.820 558 HB2 ALA 669 HB2 ALA 669 24.774 10.539 -13.187 559 HB3 ALA 669 HB3 ALA 669 26.333 10.138 -12.462 560 H GLN 670 HN GLN 670 23.111 12.304 -11.841 561 HA GLN 670 HA GLN 670 22.812 14.299 -13.881 562 HB2 GLN 670 HB2 GLN 670 21.162 12.482 -13.539 563 HB3 GLN 670 HB1 GLN 670 20.779 13.136 -11.957 564 HG2 GLN 670 HG2 GLN 670 20.480 14.855 -14.374 565 HG3 GLN 670 HG1 GLN 670 19.262 13.634 -14.017 566 HE21 GLN 670 HE21 GLN 670 19.484 13.872 -11.156 567 HE22 GLN 670 HE22 GLN 670 18.763 15.380 -10.723 568 H GLY 671 HN GLY 671 23.051 14.202 -10.430 569 HA2 GLY 671 HA2 GLY 671 23.833 16.147 -9.267 570 HA3 GLY 671 HA1 GLY 671 22.937 17.137 -10.406 571 H GLU 672 HN GLU 672 21.593 14.282 -8.856 572 HA GLU 672 HA GLU 672 19.645 16.036 -7.565 573 HB2 GLU 672 HB2 GLU 672 18.743 14.223 -8.964 574 HB3 GLU 672 HB1 GLU 672 19.574 13.037 -7.970 575 HG2 GLU 672 HG2 GLU 672 18.244 13.757 -6.030 576 HG3 GLU 672 HG1 GLU 672 17.383 14.892 -7.063 577 H ASN 673 HN ASN 673 19.510 16.278 -5.450 578 HA ASN 673 HA ASN 673 21.417 14.875 -3.734 579 HB2 ASN 673 HB2 ASN 673 20.784 16.581 -2.047 580 HB3 ASN 673 HB1 ASN 673 21.383 17.304 -3.534 581 HD21 ASN 673 HD21 ASN 673 19.743 18.475 -1.484 582 HD22 ASN 673 HD22 ASN 673 18.282 18.987 -2.252 583 H PHE 674 HN PHE 674 20.661 13.896 -1.740 584 HA PHE 674 HA PHE 674 17.840 13.083 -1.891 585 HB2 PHE 674 HB2 PHE 674 19.427 11.350 -2.819 586 HB3 PHE 674 HB1 PHE 674 20.109 11.210 -1.206 587 HD1 PHE 674 HD1 PHE 674 16.526 11.581 -2.138 588 HD2 PHE 674 HD2 PHE 674 19.572 9.017 -0.628 589 HE1 PHE 674 HE1 PHE 674 14.828 9.889 -1.599 590 HE2 PHE 674 HE2 PHE 674 17.875 7.321 -0.084 591 HZ PHE 674 HZ PHE 674 15.501 7.755 -0.569 592 H VAL 675 HN VAL 675 16.761 13.360 -0.076 593 HA VAL 675 HA VAL 675 18.261 13.699 2.429 594 HB VAL 675 HB VAL 675 16.252 15.013 3.225 595 HG11 VAL 675 HG11 VAL 675 16.830 17.051 1.941 596 HG12 VAL 675 HG12 VAL 675 17.776 16.048 0.841 597 HG13 VAL 675 HG13 VAL 675 18.237 16.174 2.539 598 HG21 VAL 675 HG21 VAL 675 14.608 14.173 1.610 599 HG22 VAL 675 HG22 VAL 675 15.495 14.949 0.298 600 HG23 VAL 675 HG23 VAL 675 14.723 15.931 1.542 601 H VAL 676 HN VAL 676 18.065 12.067 3.808 602 HA VAL 676 HA VAL 676 15.636 10.417 3.674 603 HB VAL 676 HB VAL 676 18.373 9.660 4.717 604 HG11 VAL 676 HG11 VAL 676 17.471 7.391 4.876 605 HG12 VAL 676 HG12 VAL 676 15.888 7.982 4.372 606 HG13 VAL 676 HG13 VAL 676 16.575 8.508 5.908 607 HG21 VAL 676 HG21 VAL 676 18.475 8.191 2.766 608 HG22 VAL 676 HG22 VAL 676 18.327 9.885 2.293 609 HG23 VAL 676 HG23 VAL 676 16.924 8.819 2.213 610 H ASN 677 HN ASN 677 14.242 10.907 5.202 611 HA ASN 677 HA ASN 677 14.945 12.072 7.727 612 HB2 ASN 677 HB2 ASN 677 12.775 12.529 6.672 613 HB3 ASN 677 HB1 ASN 677 12.368 10.819 6.727 614 HD21 ASN 677 HD21 ASN 677 10.550 11.107 7.941 615 HD22 ASN 677 HD22 ASN 677 10.583 11.574 9.603 616 H ASP 678 HN ASP 678 13.789 8.939 6.623 617 HA ASP 678 HA ASP 678 15.393 7.558 8.548 618 HB2 ASP 678 HB2 ASP 678 13.699 6.432 9.759 619 HB3 ASP 678 HB1 ASP 678 13.195 8.116 9.756 620 H ILE 679 HN ILE 679 15.552 5.317 8.046 621 HA ILE 679 HA ILE 679 15.339 4.907 5.198 622 HB ILE 679 HB ILE 679 16.579 2.791 5.620 623 HG12 ILE 679 HG12 ILE 679 16.602 3.771 8.487 624 HG13 ILE 679 HG11 ILE 679 15.729 2.361 7.899 625 HG21 ILE 679 HG21 ILE 679 18.687 3.890 6.243 626 HG22 ILE 679 HG22 ILE 679 17.782 5.297 6.800 627 HG23 ILE 679 HG23 ILE 679 17.758 4.853 5.093 628 HD11 ILE 679 HD11 ILE 679 17.774 1.708 9.018 629 HD12 ILE 679 HD12 ILE 679 18.719 2.722 7.929 630 HD13 ILE 679 HD13 ILE 679 17.865 1.313 7.301 631 H TYR 680 HN TYR 680 13.282 4.179 7.757 632 HA TYR 680 HA TYR 680 12.400 1.646 6.654 633 HB2 TYR 680 HB2 TYR 680 11.498 3.201 9.069 634 HB3 TYR 680 HB1 TYR 680 10.768 1.681 8.560 635 HD1 TYR 680 HD1 TYR 680 13.593 3.247 10.213 636 HD2 TYR 680 HD2 TYR 680 12.117 -0.399 8.597 637 HE1 TYR 680 HE1 TYR 680 15.327 2.007 11.438 638 HE2 TYR 680 HE2 TYR 680 13.842 -1.647 9.818 639 HH TYR 680 HH TYR 680 15.728 -0.244 12.279 640 H GLN 681 HN GLN 681 10.894 4.802 7.323 641 HA GLN 681 HA GLN 681 8.473 4.066 5.970 642 HB2 GLN 681 HB2 GLN 681 9.471 6.695 7.022 643 HB3 GLN 681 HB1 GLN 681 7.887 6.491 6.278 644 HG2 GLN 681 HG2 GLN 681 7.356 4.803 8.008 645 HG3 GLN 681 HG1 GLN 681 8.902 5.158 8.773 646 HE21 GLN 681 HE21 GLN 681 6.213 5.452 9.807 647 HE22 GLN 681 HE22 GLN 681 6.038 7.115 10.246 648 H VAL 682 HN VAL 682 11.435 5.017 4.795 649 HA VAL 682 HA VAL 682 10.404 6.442 2.502 650 HB VAL 682 HB VAL 682 12.674 6.944 3.447 651 HG11 VAL 682 HG11 VAL 682 13.382 4.695 3.986 652 HG12 VAL 682 HG12 VAL 682 14.543 5.466 2.902 653 HG13 VAL 682 HG13 VAL 682 13.404 4.274 2.273 654 HG21 VAL 682 HG21 VAL 682 12.129 7.629 1.185 655 HG22 VAL 682 HG22 VAL 682 12.625 6.051 0.573 656 HG23 VAL 682 HG23 VAL 682 13.821 7.137 1.283 657 H GLY 683 HN GLY 683 10.790 3.226 3.454 658 HA2 GLY 683 HA2 GLY 683 10.131 1.310 2.331 659 HA3 GLY 683 HA1 GLY 683 9.888 2.281 0.885 660 H HIS 684 HN HIS 684 12.888 2.240 2.696 661 HA HIS 684 HA HIS 684 14.331 1.575 0.324 662 HB2 HIS 684 HB2 HIS 684 15.080 3.041 2.369 663 HB3 HIS 684 HB1 HIS 684 15.593 1.499 3.046 664 HD2 HIS 684 HD2 HIS 684 17.402 0.092 1.100 665 HE1 HIS 684 HE1 HIS 684 18.912 3.804 -0.276 666 HE2 HIS 684 HE2 HIS 684 18.931 1.304 -0.571 667 H SER 685 HN SER 685 15.257 -0.302 -0.272 668 HA SER 685 HA SER 685 14.264 -2.719 0.905 669 HB2 SER 685 HB2 SER 685 16.217 -2.291 -1.377 670 HB3 SER 685 HB1 SER 685 15.378 -3.796 -1.001 671 HG SER 685 HG SER 685 14.108 -1.344 -1.665 672 HA PRO 686 HA PRO 686 17.713 -4.146 3.369 673 HB2 PRO 686 HB2 PRO 686 18.137 -6.427 1.499 674 HB3 PRO 686 HB1 PRO 686 17.861 -6.439 3.246 675 HG2 PRO 686 HG2 PRO 686 15.913 -7.147 1.611 676 HG3 PRO 686 HG1 PRO 686 15.565 -6.117 3.013 677 HD2 PRO 686 HD2 PRO 686 15.873 -5.358 0.135 678 HD3 PRO 686 HD1 PRO 686 14.659 -4.817 1.315 679 H CYS 687 HN CYS 687 20.012 -5.488 2.858 680 HA CYS 687 HA CYS 687 22.148 -5.328 2.129 681 HB2 CYS 687 HB2 CYS 687 21.654 -5.428 -0.188 682 HB3 CYS 687 HB1 CYS 687 20.867 -3.854 -0.179 683 H HIS 688 HN HIS 688 20.620 -2.184 1.516 684 HA HIS 688 HA HIS 688 22.858 -0.793 2.605 685 HB2 HIS 688 HB2 HIS 688 20.202 0.023 1.525 686 HB3 HIS 688 HB1 HIS 688 21.114 1.171 2.500 687 HD1 HIS 688 HD1 HIS 688 20.770 0.003 -0.926 688 HD2 HIS 688 HD2 HIS 688 23.825 1.583 1.427 689 HE1 HIS 688 HE1 HIS 688 22.530 0.771 -2.519 690 H ILE 689 HN ILE 689 19.683 -1.719 3.789 691 HA ILE 689 HA ILE 689 19.709 -0.197 6.136 692 HB ILE 689 HB ILE 689 18.414 -2.900 5.694 693 HG12 ILE 689 HG12 ILE 689 17.285 -0.103 5.395 694 HG13 ILE 689 HG11 ILE 689 17.701 -1.183 4.069 695 HG21 ILE 689 HG21 ILE 689 17.871 -0.793 7.788 696 HG22 ILE 689 HG22 ILE 689 18.582 -2.382 8.065 697 HG23 ILE 689 HG23 ILE 689 16.908 -2.246 7.530 698 HD11 ILE 689 HD11 ILE 689 15.308 -1.160 4.476 699 HD12 ILE 689 HD12 ILE 689 15.574 -1.669 6.143 700 HD13 ILE 689 HD13 ILE 689 15.983 -2.753 4.814 701 H GLU 690 HN GLU 690 20.947 -3.413 5.441 702 HA GLU 690 HA GLU 690 21.693 -4.086 8.070 703 HB2 GLU 690 HB2 GLU 690 22.651 -5.100 5.397 704 HB3 GLU 690 HB1 GLU 690 23.232 -5.744 6.920 705 HG2 GLU 690 HG2 GLU 690 21.552 -7.212 6.153 706 HG3 GLU 690 HG1 GLU 690 20.854 -6.301 7.488 707 H ILE 691 HN ILE 691 23.505 -2.588 5.417 708 HA ILE 691 HA ILE 691 25.967 -2.569 6.879 709 HB ILE 691 HB ILE 691 25.250 -1.008 4.385 710 HG12 ILE 691 HG12 ILE 691 26.661 -3.677 4.647 711 HG13 ILE 691 HG11 ILE 691 24.991 -3.472 4.130 712 HG21 ILE 691 HG21 ILE 691 27.928 -1.712 5.590 713 HG22 ILE 691 HG22 ILE 691 27.203 -0.105 5.523 714 HG23 ILE 691 HG23 ILE 691 27.686 -0.918 4.033 715 HD11 ILE 691 HD11 ILE 691 27.429 -2.432 2.695 716 HD12 ILE 691 HD12 ILE 691 25.758 -2.216 2.173 717 HD13 ILE 691 HD13 ILE 691 26.461 -3.832 2.230 718 H LEU 692 HN LEU 692 23.514 -0.127 6.110 719 HA LEU 692 HA LEU 692 24.907 2.082 7.178 720 HB2 LEU 692 HB2 LEU 692 21.946 1.647 6.827 721 HB3 LEU 692 HB1 LEU 692 22.655 3.173 7.313 722 HG LEU 692 HG LEU 692 23.178 1.776 4.686 723 HD11 LEU 692 HD11 LEU 692 21.495 4.195 5.314 724 HD12 LEU 692 HD12 LEU 692 20.894 2.604 4.845 725 HD13 LEU 692 HD13 LEU 692 21.840 3.561 3.704 726 HD21 LEU 692 HD21 LEU 692 25.077 3.119 5.404 727 HD22 LEU 692 HD22 LEU 692 24.014 4.495 5.699 728 HD23 LEU 692 HD23 LEU 692 24.248 3.899 4.056 729 H GLU 693 HN GLU 693 22.770 -0.267 8.696 730 HA GLU 693 HA GLU 693 22.552 1.161 11.134 731 HB2 GLU 693 HB2 GLU 693 20.919 -0.546 10.492 732 HB3 GLU 693 HB1 GLU 693 22.157 -1.789 10.627 733 HG2 GLU 693 HG2 GLU 693 22.270 -1.593 12.946 734 HG3 GLU 693 HG1 GLU 693 21.456 -0.030 12.942 735 H GLN 694 HN GLN 694 24.938 -1.029 9.861 736 HA GLN 694 HA GLN 694 26.249 -1.709 12.261 737 HB2 GLN 694 HB2 GLN 694 27.406 -1.334 9.488 738 HB3 GLN 694 HB1 GLN 694 28.235 -2.113 10.827 739 HG2 GLN 694 HG2 GLN 694 26.621 -3.884 10.862 740 HG3 GLN 694 HG1 GLN 694 25.649 -3.072 9.635 741 HE21 GLN 694 HE21 GLN 694 25.768 -4.772 8.216 742 HE22 GLN 694 HE22 GLN 694 27.218 -5.194 7.372 743 H PHE 695 HN PHE 695 26.498 1.042 10.107 744 HA PHE 695 HA PHE 695 28.581 2.292 11.690 745 HB2 PHE 695 HB2 PHE 695 27.044 3.245 9.264 746 HB3 PHE 695 HB1 PHE 695 28.323 4.162 10.043 747 HD1 PHE 695 HD1 PHE 695 27.536 1.294 7.927 748 HD2 PHE 695 HD2 PHE 695 30.640 3.479 9.845 749 HE1 PHE 695 HE1 PHE 695 29.202 0.146 6.528 750 HE2 PHE 695 HE2 PHE 695 32.312 2.336 8.449 751 HZ PHE 695 HZ PHE 695 31.593 0.666 6.789 752 H GLU 696 HN GLU 696 25.467 1.825 12.219 753 HA GLU 696 HA GLU 696 23.829 2.740 13.458 754 HB2 GLU 696 HB2 GLU 696 25.815 3.020 15.032 755 HB3 GLU 696 HB1 GLU 696 25.856 4.703 14.524 756 HG2 GLU 696 HG2 GLU 696 24.651 4.497 16.604 757 HG3 GLU 696 HG1 GLU 696 23.548 4.985 15.316 758 H VAL 697 HN VAL 697 23.933 3.626 10.880 759 HA VAL 697 HA VAL 697 23.106 6.430 11.167 760 HB VAL 697 HB VAL 697 24.123 4.992 8.695 761 HG11 VAL 697 HG11 VAL 697 23.985 7.180 7.585 762 HG12 VAL 697 HG12 VAL 697 23.214 7.848 9.025 763 HG13 VAL 697 HG13 VAL 697 22.401 6.592 8.093 764 HG21 VAL 697 HG21 VAL 697 25.900 5.538 10.266 765 HG22 VAL 697 HG22 VAL 697 25.348 7.212 10.332 766 HG23 VAL 697 HG23 VAL 697 26.007 6.559 8.832 767 H LYS 698 HN LYS 698 20.906 6.476 11.276 768 HA LYS 698 HA LYS 698 19.436 4.640 9.515 769 HB2 LYS 698 HB2 LYS 698 18.386 5.906 12.053 770 HB3 LYS 698 HB1 LYS 698 17.560 4.719 11.054 771 HG2 LYS 698 HG2 LYS 698 19.520 3.166 11.574 772 HG3 LYS 698 HG1 LYS 698 19.953 4.329 12.826 773 HD2 LYS 698 HD2 LYS 698 17.530 4.074 13.632 774 HD3 LYS 698 HD1 LYS 698 17.472 2.643 12.602 775 HE2 LYS 698 HE2 LYS 698 19.327 3.150 14.929 776 HE3 LYS 698 HE1 LYS 698 18.027 1.966 14.845 777 HZ1 LYS 698 HZ1 LYS 698 19.247 0.717 13.222 778 HZ2 LYS 698 HZ2 LYS 698 20.266 1.035 14.531 779 HZ3 LYS 698 HZ3 LYS 698 20.432 1.925 13.113 780 H ALA 699 HN ALA 699 20.263 7.850 10.015 781 HA ALA 699 HA ALA 699 18.346 8.684 7.994 782 HB1 ALA 699 HB1 ALA 699 17.328 9.362 10.106 783 HB2 ALA 699 HB2 ALA 699 17.895 10.775 9.214 784 HB3 ALA 699 HB3 ALA 699 18.823 10.165 10.584 785 H TYR 700 HN TYR 700 19.185 10.351 6.677 786 HA TYR 700 HA TYR 700 21.677 11.575 7.207 787 HB2 TYR 700 HB2 TYR 700 23.036 10.402 5.484 788 HB3 TYR 700 HB1 TYR 700 22.620 9.374 6.845 789 HD1 TYR 700 HD1 TYR 700 22.343 9.858 3.268 790 HD2 TYR 700 HD2 TYR 700 20.871 7.604 6.561 791 HE1 TYR 700 HE1 TYR 700 21.463 8.167 1.712 792 HE2 TYR 700 HE2 TYR 700 19.987 5.911 5.016 793 HH TYR 700 HH TYR 700 19.255 5.809 2.626 794 H VAL 701 HN VAL 701 22.586 12.585 5.208 795 HA VAL 701 HA VAL 701 20.641 13.036 3.094 796 HB VAL 701 HB VAL 701 20.123 14.835 4.651 797 HG11 VAL 701 HG11 VAL 701 21.788 16.490 5.342 798 HG12 VAL 701 HG12 VAL 701 23.050 15.554 4.542 799 HG13 VAL 701 HG13 VAL 701 22.193 14.877 5.926 800 HG21 VAL 701 HG21 VAL 701 21.768 15.887 2.352 801 HG22 VAL 701 HG22 VAL 701 20.522 16.777 3.228 802 HG23 VAL 701 HG23 VAL 701 20.087 15.367 2.261 803 H ILE 702 HN ILE 702 21.607 13.269 1.132 804 HA ILE 702 HA ILE 702 24.529 13.623 1.095 805 HB ILE 702 HB ILE 702 23.033 11.646 -0.644 806 HG12 ILE 702 HG12 ILE 702 24.810 11.123 1.752 807 HG13 ILE 702 HG11 ILE 702 23.068 10.894 1.694 808 HG21 ILE 702 HG21 ILE 702 25.281 10.873 -1.266 809 HG22 ILE 702 HG22 ILE 702 25.986 12.150 -0.276 810 HG23 ILE 702 HG23 ILE 702 25.024 12.564 -1.694 811 HD11 ILE 702 HD11 ILE 702 24.258 8.784 1.481 812 HD12 ILE 702 HD12 ILE 702 25.093 9.391 0.051 813 HD13 ILE 702 HD13 ILE 702 23.346 9.152 0.017 814 H VAL 703 HN VAL 703 25.255 14.978 -0.412 815 HA VAL 703 HA VAL 703 23.480 15.721 -2.624 816 HB VAL 703 HB VAL 703 23.344 17.527 -0.995 817 HG11 VAL 703 HG11 VAL 703 25.336 17.132 0.254 818 HG12 VAL 703 HG12 VAL 703 25.351 18.798 -0.338 819 HG13 VAL 703 HG13 VAL 703 26.341 17.569 -1.127 820 HG21 VAL 703 HG21 VAL 703 23.331 18.230 -3.311 821 HG22 VAL 703 HG22 VAL 703 25.093 18.275 -3.340 822 HG23 VAL 703 HG23 VAL 703 24.199 19.420 -2.341 823 HA PRO 704 HA PRO 704 27.134 14.693 -4.949 824 HB2 PRO 704 HB2 PRO 704 26.343 15.662 -7.361 825 HB3 PRO 704 HB1 PRO 704 25.718 14.155 -6.682 826 HG2 PRO 704 HG2 PRO 704 24.486 16.881 -6.698 827 HG3 PRO 704 HG1 PRO 704 23.728 15.307 -7.002 828 HD2 PRO 704 HD2 PRO 704 23.522 16.597 -4.631 829 HD3 PRO 704 HD1 PRO 704 23.533 14.827 -4.760 830 H VAL 705 HN VAL 705 29.019 15.692 -5.144 831 HA VAL 705 HA VAL 705 29.055 18.625 -5.359 832 HB VAL 705 HB VAL 705 31.214 16.778 -4.300 833 HG11 VAL 705 HG11 VAL 705 32.113 18.821 -5.282 834 HG12 VAL 705 HG12 VAL 705 32.304 18.827 -3.529 835 HG13 VAL 705 HG13 VAL 705 31.031 19.790 -4.280 836 HG21 VAL 705 HG21 VAL 705 29.324 18.594 -2.800 837 HG22 VAL 705 HG22 VAL 705 30.651 17.677 -2.088 838 HG23 VAL 705 HG23 VAL 705 29.282 16.831 -2.808 839 H PHE 706 HN PHE 706 29.510 19.296 -7.339 840 HA PHE 706 HA PHE 706 30.990 17.573 -9.166 841 HB2 PHE 706 HB2 PHE 706 29.441 20.129 -9.615 842 HB3 PHE 706 HB1 PHE 706 30.327 19.288 -10.879 843 HD1 PHE 706 HD1 PHE 706 27.421 19.148 -8.635 844 HD2 PHE 706 HD2 PHE 706 29.476 17.284 -11.862 845 HE1 PHE 706 HE1 PHE 706 25.443 17.757 -9.088 846 HE2 PHE 706 HE2 PHE 706 27.502 15.888 -12.318 847 HZ PHE 706 HZ PHE 706 25.483 16.123 -10.932 848 H ALA 707 HN ALA 707 32.891 18.145 -10.152 849 HA ALA 707 HA ALA 707 34.156 20.633 -9.245 850 HB1 ALA 707 HB1 ALA 707 36.302 19.487 -9.062 851 HB2 ALA 707 HB2 ALA 707 35.545 17.962 -9.513 852 HB3 ALA 707 HB3 ALA 707 35.120 18.742 -7.990 853 H GLY 708 HN GLY 708 34.291 21.844 -10.982 854 HA2 GLY 708 HA2 GLY 708 35.078 22.524 -13.043 855 HA3 GLY 708 HA1 GLY 708 35.747 20.915 -13.275 856 H GLU 709 HN GLU 709 34.657 19.454 -14.475 857 HA GLU 709 HA GLU 709 32.063 20.332 -15.566 858 HB2 GLU 709 HB2 GLU 709 34.258 18.844 -17.001 859 HB3 GLU 709 HB1 GLU 709 32.698 19.273 -17.684 860 HG2 GLU 709 HG2 GLU 709 33.235 21.634 -17.452 861 HG3 GLU 709 HG1 GLU 709 34.793 21.212 -16.742 862 H GLN 710 HN GLN 710 33.423 18.046 -13.629 863 HA GLN 710 HA GLN 710 31.365 16.097 -14.371 864 HB2 GLN 710 HB2 GLN 710 32.983 14.238 -13.911 865 HB3 GLN 710 HB1 GLN 710 33.333 15.171 -15.357 866 HG2 GLN 710 HG2 GLN 710 35.036 16.433 -14.097 867 HG3 GLN 710 HG1 GLN 710 34.712 15.418 -12.692 868 HE21 GLN 710 HE21 GLN 710 36.051 15.532 -15.900 869 HE22 GLN 710 HE22 GLN 710 36.926 14.047 -15.802 870 H LEU 711 HN LEU 711 31.083 14.414 -12.641 871 HA LEU 711 HA LEU 711 30.685 15.743 -10.148 872 HB2 LEU 711 HB2 LEU 711 29.118 14.046 -11.021 873 HB3 LEU 711 HB1 LEU 711 30.369 12.827 -10.868 874 HG LEU 711 HG LEU 711 30.378 13.189 -8.411 875 HD11 LEU 711 HD11 LEU 711 29.570 15.467 -8.338 876 HD12 LEU 711 HD12 LEU 711 28.509 14.415 -7.401 877 HD13 LEU 711 HD13 LEU 711 28.017 14.962 -9.003 878 HD21 LEU 711 HD21 LEU 711 29.077 11.388 -9.385 879 HD22 LEU 711 HD22 LEU 711 27.709 12.476 -9.612 880 HD23 LEU 711 HD23 LEU 711 28.249 12.065 -7.985 881 H TRP 712 HN TRP 712 31.924 15.685 -8.380 882 HA TRP 712 HA TRP 712 34.473 14.281 -8.610 883 HB2 TRP 712 HB2 TRP 712 34.623 16.663 -8.204 884 HB3 TRP 712 HB1 TRP 712 33.573 16.526 -6.802 885 HD1 TRP 712 HD1 TRP 712 37.146 15.667 -7.946 886 HE1 TRP 712 HE1 TRP 712 38.623 15.419 -5.861 887 HE3 TRP 712 HE3 TRP 712 33.541 16.028 -4.336 888 HZ2 TRP 712 HZ2 TRP 712 38.312 15.368 -3.050 889 HZ3 TRP 712 HZ3 TRP 712 34.215 15.872 -1.977 890 HH2 TRP 712 HH2 TRP 712 36.545 15.550 -1.346 891 H GLY 713 HN GLY 713 32.122 15.050 -6.022 892 HA2 GLY 713 HA2 GLY 713 32.338 12.331 -5.080 893 HA3 GLY 713 HA1 GLY 713 33.012 13.572 -4.038 894 H LEU 714 HN LEU 714 31.435 12.636 -2.607 895 HA LEU 714 HA LEU 714 28.782 13.857 -2.940 896 HB2 LEU 714 HB2 LEU 714 29.385 11.150 -1.779 897 HB3 LEU 714 HB1 LEU 714 27.823 11.931 -1.691 898 HG LEU 714 HG LEU 714 29.218 10.935 -4.167 899 HD11 LEU 714 HD11 LEU 714 28.268 9.170 -2.806 900 HD12 LEU 714 HD12 LEU 714 27.317 9.388 -4.275 901 HD13 LEU 714 HD13 LEU 714 26.727 10.021 -2.740 902 HD21 LEU 714 HD21 LEU 714 26.606 12.400 -3.842 903 HD22 LEU 714 HD22 LEU 714 27.093 11.543 -5.301 904 HD23 LEU 714 HD23 LEU 714 28.027 12.930 -4.744 905 H LEU 715 HN LEU 715 28.041 14.901 -1.166 906 HA LEU 715 HA LEU 715 29.743 14.790 1.229 907 HB2 LEU 715 HB2 LEU 715 29.611 16.996 0.084 908 HB3 LEU 715 HB1 LEU 715 27.878 16.996 0.334 909 HG LEU 715 HG LEU 715 28.231 17.056 2.771 910 HD11 LEU 715 HD11 LEU 715 30.377 15.920 2.887 911 HD12 LEU 715 HD12 LEU 715 30.475 17.503 3.657 912 HD13 LEU 715 HD13 LEU 715 31.152 17.263 2.045 913 HD21 LEU 715 HD21 LEU 715 29.696 19.216 1.259 914 HD22 LEU 715 HD22 LEU 715 29.046 19.356 2.892 915 HD23 LEU 715 HD23 LEU 715 27.955 19.138 1.524 916 H ALA 716 HN ALA 716 28.852 13.388 2.603 917 HA ALA 716 HA ALA 716 25.926 13.417 2.895 918 HB1 ALA 716 HB1 ALA 716 27.833 11.167 3.505 919 HB2 ALA 716 HB2 ALA 716 26.865 11.313 2.038 920 HB3 ALA 716 HB3 ALA 716 26.072 11.113 3.603 921 H ALA 717 HN ALA 717 25.034 13.722 4.831 922 HA ALA 717 HA ALA 717 26.793 13.781 7.180 923 HB1 ALA 717 HB1 ALA 717 25.609 15.725 8.036 924 HB2 ALA 717 HB2 ALA 717 24.613 15.780 6.580 925 HB3 ALA 717 HB3 ALA 717 26.350 16.082 6.477 926 H TYR 718 HN TYR 718 26.032 12.817 8.939 927 HA TYR 718 HA TYR 718 23.210 12.086 9.158 928 HB2 TYR 718 HB2 TYR 718 24.419 9.812 9.982 929 HB3 TYR 718 HB1 TYR 718 23.621 9.991 8.415 930 HD1 TYR 718 HD1 TYR 718 26.775 9.632 10.212 931 HD2 TYR 718 HD2 TYR 718 25.035 10.267 6.383 932 HE1 TYR 718 HE1 TYR 718 28.913 9.046 9.147 933 HE2 TYR 718 HE2 TYR 718 27.167 9.686 5.310 934 HH TYR 718 HH TYR 718 29.659 8.146 6.884 935 H GLN 719 HN GLN 719 22.596 11.527 11.345 936 HA GLN 719 HA GLN 719 24.821 11.897 13.206 937 HB2 GLN 719 HB2 GLN 719 23.408 13.211 14.738 938 HB3 GLN 719 HB1 GLN 719 23.687 14.020 13.207 939 HG2 GLN 719 HG2 GLN 719 21.487 13.711 12.506 940 HG3 GLN 719 HG1 GLN 719 21.198 12.426 13.678 941 HE21 GLN 719 HE21 GLN 719 22.809 15.420 14.466 942 HE22 GLN 719 HE22 GLN 719 21.560 16.055 15.465 943 H ASN 720 HN ASN 720 25.010 9.888 13.659 944 HA ASN 720 HA ASN 720 24.462 7.757 14.435 945 HB2 ASN 720 HB2 ASN 720 24.234 9.606 16.801 946 HB3 ASN 720 HB1 ASN 720 24.580 7.878 16.882 947 HD21 ASN 720 HD21 ASN 720 26.108 10.390 17.524 948 HD22 ASN 720 HD22 ASN 720 27.627 10.183 16.724 949 H SER 721 HN SER 721 22.345 7.563 13.262 950 HA SER 721 HA SER 721 20.317 6.513 13.290 951 HB2 SER 721 HB2 SER 721 21.247 5.145 15.093 952 HB3 SER 721 HB1 SER 721 20.784 6.360 16.281 953 HG SER 721 HG SER 721 18.557 5.949 15.327 954 H GLY 722 HN GLY 722 20.752 9.549 14.434 955 HA2 GLY 722 HA2 GLY 722 18.234 10.117 15.640 956 HA3 GLY 722 HA1 GLY 722 19.366 11.295 14.990 957 H THR 723 HN THR 723 16.400 9.827 14.602 958 HA THR 723 HA THR 723 16.150 9.973 11.755 959 HB THR 723 HB THR 723 13.731 9.595 12.246 960 HG1 THR 723 HG1 THR 723 13.457 10.316 14.303 961 HG21 THR 723 HG21 THR 723 15.719 7.642 13.422 962 HG22 THR 723 HG22 THR 723 15.249 7.747 11.726 963 HG23 THR 723 HG23 THR 723 14.070 7.247 12.938 964 H ARG 724 HN ARG 724 16.960 12.416 12.520 965 HA ARG 724 HA ARG 724 14.710 14.193 12.843 966 HB2 ARG 724 HB2 ARG 724 17.647 14.702 12.451 967 HB3 ARG 724 HB1 ARG 724 16.462 15.998 12.484 968 HG2 ARG 724 HG2 ARG 724 15.769 15.144 14.751 969 HG3 ARG 724 HG1 ARG 724 17.196 14.104 14.684 970 HD2 ARG 724 HD2 ARG 724 17.587 16.222 15.905 971 HD3 ARG 724 HD1 ARG 724 18.646 16.009 14.513 972 HE ARG 724 HE ARG 724 16.506 17.451 13.575 973 HH11 ARG 724 HH11 ARG 724 18.858 17.905 16.135 974 HH12 ARG 724 HH12 ARG 724 18.864 19.630 16.001 975 HH21 ARG 724 HH21 ARG 724 16.526 19.728 13.381 976 HH22 ARG 724 HH22 ARG 724 17.550 20.674 14.410 977 H ASP 725 HN ASP 725 13.597 15.162 11.319 978 HA ASP 725 HA ASP 725 14.147 14.574 8.563 979 HB2 ASP 725 HB2 ASP 725 11.834 14.616 9.401 980 HB3 ASP 725 HB1 ASP 725 12.008 16.320 9.808 981 H TRP 726 HN TRP 726 15.017 15.887 7.091 982 HA TRP 726 HA TRP 726 16.426 18.199 8.079 983 HB2 TRP 726 HB2 TRP 726 16.414 17.130 5.254 984 HB3 TRP 726 HB1 TRP 726 17.652 18.117 6.030 985 HD1 TRP 726 HD1 TRP 726 16.663 14.553 5.444 986 HE1 TRP 726 HE1 TRP 726 18.281 12.966 6.657 987 HE3 TRP 726 HE3 TRP 726 19.156 17.980 8.313 988 HZ2 TRP 726 HZ2 TRP 726 20.351 13.142 8.571 989 HZ3 TRP 726 HZ3 TRP 726 20.940 17.183 9.811 990 HH2 TRP 726 HH2 TRP 726 21.522 14.817 9.939 991 H ASP 727 HN ASP 727 15.482 20.117 8.152 992 HA ASP 727 HA ASP 727 13.108 20.783 6.759 993 HB2 ASP 727 HB2 ASP 727 13.829 21.802 8.939 994 HB3 ASP 727 HB1 ASP 727 15.058 22.700 8.058 995 H GLU 728 HN GLU 728 12.802 22.354 5.195 996 HA GLU 728 HA GLU 728 14.371 22.091 2.916 997 HB2 GLU 728 HB2 GLU 728 13.102 24.040 2.007 998 HB3 GLU 728 HB1 GLU 728 12.107 22.746 2.655 999 HG2 GLU 728 HG2 GLU 728 11.850 24.057 4.739 1000 HG3 GLU 728 HG1 GLU 728 12.740 25.372 3.972 1001 H SER 729 HN SER 729 14.481 24.748 5.375 1002 HA SER 729 HA SER 729 16.308 26.320 4.001 1003 HB2 SER 729 HB2 SER 729 16.778 27.287 6.262 1004 HB3 SER 729 HB1 SER 729 15.064 27.207 5.858 1005 HG SER 729 HG SER 729 16.545 25.471 7.558 1006 H GLU 730 HN GLU 730 16.783 23.351 5.666 1007 HA GLU 730 HA GLU 730 19.645 23.822 5.991 1008 HB2 GLU 730 HB2 GLU 730 17.770 21.671 6.906 1009 HB3 GLU 730 HB1 GLU 730 19.487 21.318 6.790 1010 HG2 GLU 730 HG2 GLU 730 19.026 21.932 9.033 1011 HG3 GLU 730 HG1 GLU 730 19.918 23.256 8.296 1012 H VAL 731 HN VAL 731 17.376 21.890 4.177 1013 HA VAL 731 HA VAL 731 19.200 20.318 2.740 1014 HB VAL 731 HB VAL 731 16.473 21.318 1.873 1015 HG11 VAL 731 HG11 VAL 731 18.087 18.981 0.877 1016 HG12 VAL 731 HG12 VAL 731 17.794 20.490 0.006 1017 HG13 VAL 731 HG13 VAL 731 16.450 19.403 0.369 1018 HG21 VAL 731 HG21 VAL 731 16.360 20.109 3.976 1019 HG22 VAL 731 HG22 VAL 731 17.277 18.773 3.281 1020 HG23 VAL 731 HG23 VAL 731 15.660 19.142 2.678 1021 H THR 732 HN THR 732 17.767 23.484 2.045 1022 HA THR 732 HA THR 732 19.031 23.796 -0.480 1023 HB THR 732 HB THR 732 17.945 25.974 1.321 1024 HG1 THR 732 HG1 THR 732 16.185 24.766 1.060 1025 HG21 THR 732 HG21 THR 732 19.247 26.762 -0.618 1026 HG22 THR 732 HG22 THR 732 17.537 27.151 -0.794 1027 HG23 THR 732 HG23 THR 732 18.229 25.799 -1.688 1028 H LEU 733 HN LEU 733 19.951 24.470 2.829 1029 HA LEU 733 HA LEU 733 22.017 26.333 2.254 1030 HB2 LEU 733 HB2 LEU 733 20.852 26.075 4.463 1031 HB3 LEU 733 HB1 LEU 733 21.657 24.539 4.671 1032 HG LEU 733 HG LEU 733 22.584 26.538 5.950 1033 HD11 LEU 733 HD11 LEU 733 24.924 25.862 5.622 1034 HD12 LEU 733 HD12 LEU 733 24.436 24.936 4.201 1035 HD13 LEU 733 HD13 LEU 733 23.829 24.491 5.795 1036 HD21 LEU 733 HD21 LEU 733 22.489 28.174 4.149 1037 HD22 LEU 733 HD22 LEU 733 23.667 27.243 3.224 1038 HD23 LEU 733 HD23 LEU 733 24.137 27.993 4.748 1039 H LEU 734 HN LEU 734 21.909 22.860 2.909 1040 HA LEU 734 HA LEU 734 24.660 22.363 2.697 1041 HB2 LEU 734 HB2 LEU 734 23.084 20.785 3.681 1042 HB3 LEU 734 HB1 LEU 734 22.314 20.555 2.126 1043 HG LEU 734 HG LEU 734 24.364 19.523 1.259 1044 HD11 LEU 734 HD11 LEU 734 25.393 19.881 4.069 1045 HD12 LEU 734 HD12 LEU 734 26.017 20.657 2.614 1046 HD13 LEU 734 HD13 LEU 734 26.163 18.912 2.817 1047 HD21 LEU 734 HD21 LEU 734 22.625 18.130 2.233 1048 HD22 LEU 734 HD22 LEU 734 23.358 18.311 3.828 1049 HD23 LEU 734 HD23 LEU 734 24.222 17.453 2.551 1050 H ALA 735 HN ALA 735 22.113 22.523 0.267 1051 HA ALA 735 HA ALA 735 23.664 21.503 -1.883 1052 HB1 ALA 735 HB1 ALA 735 21.238 23.298 -1.975 1053 HB2 ALA 735 HB2 ALA 735 21.207 21.537 -1.914 1054 HB3 ALA 735 HB3 ALA 735 21.888 22.358 -3.318 1055 H ARG 736 HN ARG 736 23.131 24.663 -0.551 1056 HA ARG 736 HA ARG 736 24.377 26.143 -2.656 1057 HB2 ARG 736 HB2 ARG 736 22.799 26.959 -0.715 1058 HB3 ARG 736 HB1 ARG 736 24.299 27.146 0.178 1059 HG2 ARG 736 HG2 ARG 736 23.874 28.427 -2.509 1060 HG3 ARG 736 HG1 ARG 736 23.374 29.202 -1.010 1061 HD2 ARG 736 HD2 ARG 736 26.183 28.274 -1.593 1062 HD3 ARG 736 HD1 ARG 736 25.610 29.920 -1.854 1063 HE ARG 736 HE ARG 736 24.994 29.543 0.717 1064 HH11 ARG 736 HH11 ARG 736 27.949 28.919 -1.059 1065 HH12 ARG 736 HH12 ARG 736 28.990 29.168 0.299 1066 HH21 ARG 736 HH21 ARG 736 26.364 29.919 2.528 1067 HH22 ARG 736 HH22 ARG 736 28.076 29.751 2.356 1068 H ILE 737 HN ILE 737 25.501 24.801 0.409 1069 HA ILE 737 HA ILE 737 28.155 25.783 0.219 1070 HB ILE 737 HB ILE 737 26.775 23.756 1.926 1071 HG12 ILE 737 HG12 ILE 737 27.805 25.072 3.742 1072 HG13 ILE 737 HG11 ILE 737 28.663 26.038 2.551 1073 HG21 ILE 737 HG21 ILE 737 28.763 22.517 1.273 1074 HG22 ILE 737 HG22 ILE 737 28.864 23.007 2.965 1075 HG23 ILE 737 HG23 ILE 737 29.783 23.879 1.738 1076 HD11 ILE 737 HD11 ILE 737 26.709 27.185 3.447 1077 HD12 ILE 737 HD12 ILE 737 25.676 25.886 2.850 1078 HD13 ILE 737 HD13 ILE 737 26.562 26.902 1.714 1079 H GLY 738 HN GLY 738 26.593 22.812 -0.880 1080 HA2 GLY 738 HA2 GLY 738 28.853 21.322 -1.569 1081 HA3 GLY 738 HA1 GLY 738 27.284 21.188 -2.348 1082 H ASN 739 HN ASN 739 27.108 23.756 -3.440 1083 HA ASN 739 HA ASN 739 28.541 23.455 -5.849 1084 HB2 ASN 739 HB2 ASN 739 26.353 24.677 -5.562 1085 HB3 ASN 739 HB1 ASN 739 27.239 25.983 -4.791 1086 HD21 ASN 739 HD21 ASN 739 25.608 25.856 -7.265 1087 HD22 ASN 739 HD22 ASN 739 26.630 26.477 -8.511 1088 H GLN 740 HN GLN 740 28.986 25.678 -3.110 1089 HA GLN 740 HA GLN 740 31.246 27.017 -4.143 1090 HB2 GLN 740 HB2 GLN 740 29.819 27.853 -2.285 1091 HB3 GLN 740 HB1 GLN 740 30.489 26.607 -1.246 1092 HG2 GLN 740 HG2 GLN 740 32.707 27.587 -1.483 1093 HG3 GLN 740 HG1 GLN 740 32.049 28.829 -2.548 1094 HE21 GLN 740 HE21 GLN 740 32.656 30.498 -1.201 1095 HE22 GLN 740 HE22 GLN 740 31.875 30.805 0.311 1096 H LEU 741 HN LEU 741 30.881 24.122 -2.186 1097 HA LEU 741 HA LEU 741 33.590 23.739 -1.517 1098 HB2 LEU 741 HB2 LEU 741 31.579 22.579 -0.522 1099 HB3 LEU 741 HB1 LEU 741 31.520 21.590 -1.965 1100 HG LEU 741 HG LEU 741 33.827 20.780 -1.418 1101 HD11 LEU 741 HD11 LEU 741 34.547 22.619 -0.007 1102 HD12 LEU 741 HD12 LEU 741 34.626 21.096 0.878 1103 HD13 LEU 741 HD13 LEU 741 33.301 22.223 1.177 1104 HD21 LEU 741 HD21 LEU 741 31.841 19.461 -0.896 1105 HD22 LEU 741 HD22 LEU 741 31.687 20.293 0.653 1106 HD23 LEU 741 HD23 LEU 741 33.080 19.255 0.343 1107 H GLY 742 HN GLY 742 31.620 22.618 -4.213 1108 HA2 GLY 742 HA2 GLY 742 33.643 21.111 -5.514 1109 HA3 GLY 742 HA1 GLY 742 32.185 21.734 -6.272 1110 H LEU 743 HN LEU 743 32.780 24.487 -5.567 1111 HA LEU 743 HA LEU 743 34.298 25.222 -7.835 1112 HB2 LEU 743 HB2 LEU 743 32.445 26.538 -6.677 1113 HB3 LEU 743 HB1 LEU 743 33.630 26.982 -5.472 1114 HG LEU 743 HG LEU 743 34.056 27.623 -8.385 1115 HD11 LEU 743 HD11 LEU 743 31.884 28.535 -7.735 1116 HD12 LEU 743 HD12 LEU 743 33.075 29.812 -7.974 1117 HD13 LEU 743 HD13 LEU 743 32.628 29.318 -6.341 1118 HD21 LEU 743 HD21 LEU 743 35.984 27.825 -6.871 1119 HD22 LEU 743 HD22 LEU 743 35.054 28.909 -5.837 1120 HD23 LEU 743 HD23 LEU 743 35.468 29.398 -7.480 1121 H ALA 744 HN ALA 744 35.006 25.087 -4.365 1122 HA ALA 744 HA ALA 744 37.550 26.239 -4.364 1123 HB1 ALA 744 HB1 ALA 744 36.494 24.019 -2.614 1124 HB2 ALA 744 HB2 ALA 744 36.379 25.751 -2.292 1125 HB3 ALA 744 HB3 ALA 744 37.955 24.952 -2.298 1126 H LEU 745 HN LEU 745 36.539 22.941 -5.041 1127 HA LEU 745 HA LEU 745 39.047 21.719 -5.210 1128 HB2 LEU 745 HB2 LEU 745 36.496 21.169 -6.714 1129 HB3 LEU 745 HB1 LEU 745 37.899 20.119 -6.755 1130 HG LEU 745 HG LEU 745 36.441 20.805 -4.208 1131 HD11 LEU 745 HD11 LEU 745 36.156 18.328 -5.895 1132 HD12 LEU 745 HD12 LEU 745 34.984 19.647 -5.867 1133 HD13 LEU 745 HD13 LEU 745 35.297 18.712 -4.404 1134 HD21 LEU 745 HD21 LEU 745 37.598 18.805 -3.389 1135 HD22 LEU 745 HD22 LEU 745 38.734 20.041 -3.931 1136 HD23 LEU 745 HD23 LEU 745 38.397 18.641 -4.953 1137 H GLN 746 HN GLN 746 37.032 22.939 -7.878 1138 HA GLN 746 HA GLN 746 38.875 22.692 -9.925 1139 HB2 GLN 746 HB2 GLN 746 36.475 23.264 -10.190 1140 HB3 GLN 746 HB1 GLN 746 36.821 24.881 -9.594 1141 HG2 GLN 746 HG2 GLN 746 38.429 25.118 -11.513 1142 HG3 GLN 746 HG1 GLN 746 37.765 23.613 -12.141 1143 HE21 GLN 746 HE21 GLN 746 35.091 24.304 -11.086 1144 HE22 GLN 746 HE22 GLN 746 34.458 25.473 -12.187 1145 H GLN 747 HN GLN 747 38.277 25.451 -7.793 1146 HA GLN 747 HA GLN 747 40.061 27.282 -8.850 1147 HB2 GLN 747 HB2 GLN 747 38.355 27.755 -7.125 1148 HB3 GLN 747 HB1 GLN 747 39.331 26.901 -5.945 1149 HG2 GLN 747 HG2 GLN 747 41.119 28.560 -6.253 1150 HG3 GLN 747 HG1 GLN 747 40.091 29.429 -7.394 1151 HE21 GLN 747 HE21 GLN 747 40.031 31.283 -6.135 1152 HE22 GLN 747 HE22 GLN 747 39.137 31.367 -4.659 1153 H THR 748 HN THR 748 40.668 24.751 -6.429 1154 HA THR 748 HA THR 748 43.386 25.598 -6.073 1155 HB THR 748 HB THR 748 43.557 23.450 -4.707 1156 HG1 THR 748 HG1 THR 748 40.719 23.496 -4.940 1157 HG21 THR 748 HG21 THR 748 42.303 24.411 -2.841 1158 HG22 THR 748 HG22 THR 748 41.434 25.464 -3.956 1159 HG23 THR 748 HG23 THR 748 43.170 25.669 -3.721 1160 H GLU 749 HN GLU 749 41.778 22.914 -7.768 1161 HA GLU 749 HA GLU 749 44.107 21.521 -8.477 1162 HB2 GLU 749 HB2 GLU 749 41.462 21.683 -9.929 1163 HB3 GLU 749 HB1 GLU 749 42.738 20.540 -10.321 1164 HG2 GLU 749 HG2 GLU 749 42.561 19.648 -8.004 1165 HG3 GLU 749 HG1 GLU 749 41.171 20.704 -7.757 1166 H TYR 750 HN TYR 750 42.475 24.214 -10.069 1167 HA TYR 750 HA TYR 750 44.328 24.182 -12.273 1168 HB2 TYR 750 HB2 TYR 750 42.068 26.004 -11.513 1169 HB3 TYR 750 HB1 TYR 750 43.180 26.423 -12.815 1170 HD1 TYR 750 HD1 TYR 750 40.487 24.182 -11.768 1171 HD2 TYR 750 HD2 TYR 750 43.215 25.133 -14.882 1172 HE1 TYR 750 HE1 TYR 750 39.186 22.792 -13.324 1173 HE2 TYR 750 HE2 TYR 750 41.918 23.748 -16.448 1174 HH TYR 750 HH TYR 750 40.320 21.753 -16.253 1175 H LEU 751 HN LEU 751 44.308 25.498 -9.149 1176 HA LEU 751 HA LEU 751 46.135 27.657 -9.729 1177 HB2 LEU 751 HB2 LEU 751 44.508 27.815 -7.885 1178 HB3 LEU 751 HB1 LEU 751 45.276 26.455 -7.094 1179 HG LEU 751 HG LEU 751 47.329 27.796 -6.812 1180 HD11 LEU 751 HD11 LEU 751 47.261 30.203 -7.219 1181 HD12 LEU 751 HD12 LEU 751 45.668 30.034 -7.958 1182 HD13 LEU 751 HD13 LEU 751 47.075 29.288 -8.714 1183 HD21 LEU 751 HD21 LEU 751 45.686 27.705 -5.023 1184 HD22 LEU 751 HD22 LEU 751 44.814 29.064 -5.733 1185 HD23 LEU 751 HD23 LEU 751 46.440 29.299 -5.091 1186 H GLN 752 HN GLN 752 46.273 24.337 -8.735 1187 HA GLN 752 HA GLN 752 49.006 24.393 -7.887 1188 HB2 GLN 752 HB2 GLN 752 47.361 22.762 -7.010 1189 HB3 GLN 752 HB1 GLN 752 47.235 22.042 -8.607 1190 HG2 GLN 752 HG2 GLN 752 49.881 22.175 -7.215 1191 HG3 GLN 752 HG1 GLN 752 48.716 20.923 -6.797 1192 HE21 GLN 752 HE21 GLN 752 51.355 20.742 -8.038 1193 HE22 GLN 752 HE22 GLN 752 51.118 19.906 -9.530 1194 H GLN 753 HN GLN 753 47.314 23.576 -10.857 1195 HA GLN 753 HA GLN 753 49.737 22.681 -12.160 1196 HB2 GLN 753 HB2 GLN 753 48.308 22.334 -14.118 1197 HB3 GLN 753 HB1 GLN 753 47.614 21.589 -12.683 1198 HG2 GLN 753 HG2 GLN 753 46.141 23.545 -12.429 1199 HG3 GLN 753 HG1 GLN 753 46.782 24.187 -13.939 1200 HE21 GLN 753 HE21 GLN 753 44.801 21.765 -12.474 1201 HE22 GLN 753 HE22 GLN 753 44.039 21.218 -13.932 1202 H VAL 754 HN VAL 754 50.264 23.631 -14.351 1203 HA VAL 754 HA VAL 754 49.916 26.538 -14.328 1204 HB VAL 754 HB VAL 754 52.182 26.092 -13.566 1205 HG11 VAL 754 HG11 VAL 754 53.827 24.906 -14.933 1206 HG12 VAL 754 HG12 VAL 754 52.570 24.510 -16.104 1207 HG13 VAL 754 HG13 VAL 754 52.490 23.853 -14.470 1208 HG21 VAL 754 HG21 VAL 754 51.864 28.029 -15.002 1209 HG22 VAL 754 HG22 VAL 754 52.166 27.041 -16.430 1210 HG23 VAL 754 HG23 VAL 754 53.458 27.320 -15.263 1211 HHA CYC 800 HHA CYC 800 19.540 2.033 -5.065 1212 HMA1 CYC 800 HMA1 CYC 800 22.366 6.894 -3.902 1213 HMA2 CYC 800 HMA2 CYC 800 22.471 6.421 -2.157 1214 HMA3 CYC 800 HMA3 CYC 800 20.866 6.571 -2.960 1215 HAA1 CYC 800 HAA1 CYC 800 19.854 5.894 -4.604 1216 HAA2 CYC 800 HAA2 CYC 800 19.381 4.342 -5.364 1217 HBA1 CYC 800 HBA1 CYC 800 18.741 5.302 -2.509 1218 HBA2 CYC 800 HBA2 CYC 800 18.527 3.586 -3.040 1219 HHB CYC 800 HHB CYC 800 25.255 4.200 -3.484 1220 HB CYC 800 HB CYC 800 22.975 5.606 -0.665 1221 HMB1 CYC 800 HMB1 CYC 800 27.975 5.590 -1.925 1222 HMB2 CYC 800 HMB2 CYC 800 27.936 3.970 -1.112 1223 HMB3 CYC 800 HMB3 CYC 800 27.066 4.213 -2.674 1224 HAB1 CYC 800 HAB1 CYC 800 27.038 4.992 2.096 1225 HAB2 CYC 800 HAB2 CYC 800 26.681 6.768 1.970 1226 HBB1 CYC 800 HBB1 CYC 800 29.117 6.425 1.600 1227 HBB2 CYC 800 HBB2 CYC 800 28.809 5.182 0.353 1228 HBB3 CYC 800 HBB3 CYC 800 28.370 6.905 0.030 1229 HC CYC 800 HC CYC 800 24.111 -0.749 -3.159 1230 H2C CYC 800 H2C CYC 800 25.816 -3.788 -1.099 1231 H3C CYC 800 H3C CYC 800 24.627 -4.734 -3.690 1232 HMC1 CYC 800 HMC1 CYC 800 27.870 -3.493 -2.560 1233 HMC2 CYC 800 HMC2 CYC 800 27.008 -4.992 -3.039 1234 HMC3 CYC 800 HMC3 CYC 800 26.846 -3.503 -4.040 1235 HAC1 CYC 800 HAC CYC 800 24.066 -5.635 -1.465 1236 HBC1 CYC 800 HBC1 CYC 800 21.695 -5.965 -1.863 1237 HBC2 CYC 800 HBC2 CYC 800 22.477 -5.730 -3.461 1238 HBC3 CYC 800 HBC3 CYC 800 21.539 -4.383 -2.713 1239 HHD CYC 800 HHD CYC 800 22.350 -3.692 -4.654 1240 HD CYC 800 HD CYC 800 22.841 0.083 -4.174 1241 HMD1 CYC 800 HMD1 CYC 800 18.970 -3.384 -3.878 1242 HMD2 CYC 800 HMD2 CYC 800 18.848 -3.091 -5.660 1243 HMD3 CYC 800 HMD3 CYC 800 20.281 -3.962 -4.985 1244 HAD1 CYC 800 HAD1 CYC 800 18.048 0.071 -5.889 1245 HAD2 CYC 800 HAD2 CYC 800 17.669 -1.264 -4.751 1246 HBD1 CYC 800 HBD1 CYC 800 18.043 1.720 -4.015 1247 HBD2 CYC 800 HBD2 CYC 800 16.542 0.750 -3.952 1248 HA CYC 800 HA CYC 800 23.371 2.028 -3.886 Start of MODEL 10 1 H SER 599 HT1 SER 599 48.661 19.665 2.612 2 HA SER 599 HA SER 599 48.870 20.974 0.582 3 HB2 SER 599 HB2 SER 599 48.034 19.244 -0.966 4 HB3 SER 599 HB1 SER 599 46.433 19.371 -0.241 5 HG SER 599 HG SER 599 46.856 20.601 -2.243 6 H ASP 600 HN ASP 600 47.770 22.940 0.540 7 HA ASP 600 HA ASP 600 46.456 23.616 2.934 8 HB2 ASP 600 HB2 ASP 600 46.236 25.844 1.993 9 HB3 ASP 600 HB1 ASP 600 47.828 25.199 1.614 10 H VAL 601 HN VAL 601 45.250 22.684 -0.194 11 HA VAL 601 HA VAL 601 42.633 23.700 0.100 12 HB VAL 601 HB VAL 601 43.557 23.053 -2.094 13 HG11 VAL 601 HG11 VAL 601 43.661 20.708 -2.774 14 HG12 VAL 601 HG12 VAL 601 43.259 20.215 -1.129 15 HG13 VAL 601 HG13 VAL 601 44.776 21.055 -1.452 16 HG21 VAL 601 HG21 VAL 601 41.150 23.240 -1.866 17 HG22 VAL 601 HG22 VAL 601 41.050 21.560 -1.342 18 HG23 VAL 601 HG23 VAL 601 41.552 21.939 -2.989 19 H GLU 602 HN GLU 602 44.147 20.748 1.189 20 HA GLU 602 HA GLU 602 41.783 19.295 1.764 21 HB2 GLU 602 HB2 GLU 602 44.552 19.049 2.952 22 HB3 GLU 602 HB1 GLU 602 43.263 17.865 3.130 23 HG2 GLU 602 HG2 GLU 602 43.294 17.380 0.789 24 HG3 GLU 602 HG1 GLU 602 44.416 18.704 0.484 25 H GLU 603 HN GLU 603 43.754 21.556 3.584 26 HA GLU 603 HA GLU 603 42.529 21.177 6.102 27 HB2 GLU 603 HB2 GLU 603 44.719 22.337 5.676 28 HB3 GLU 603 HB1 GLU 603 43.807 23.705 5.055 29 HG2 GLU 603 HG2 GLU 603 44.463 24.135 7.326 30 HG3 GLU 603 HG1 GLU 603 42.712 23.937 7.248 31 H ILE 604 HN ILE 604 41.743 23.112 3.298 32 HA ILE 604 HA ILE 604 39.810 24.791 4.411 33 HB ILE 604 HB ILE 604 39.903 23.644 1.609 34 HG12 ILE 604 HG12 ILE 604 40.942 26.269 2.703 35 HG13 ILE 604 HG11 ILE 604 41.934 24.889 2.245 36 HG21 ILE 604 HG21 ILE 604 38.515 25.573 0.979 37 HG22 ILE 604 HG22 ILE 604 38.400 26.037 2.677 38 HG23 ILE 604 HG23 ILE 604 37.689 24.519 2.128 39 HD11 ILE 604 HD11 ILE 604 40.207 26.528 0.403 40 HD12 ILE 604 HD12 ILE 604 41.172 25.134 -0.072 41 HD13 ILE 604 HD13 ILE 604 41.965 26.592 0.525 42 H PHE 605 HN PHE 605 39.485 21.519 2.955 43 HA PHE 605 HA PHE 605 36.722 21.285 3.163 44 HB2 PHE 605 HB2 PHE 605 38.968 19.279 3.134 45 HB3 PHE 605 HB1 PHE 605 37.294 18.769 3.297 46 HD1 PHE 605 HD1 PHE 605 39.346 21.000 1.105 47 HD2 PHE 605 HD2 PHE 605 36.218 18.133 1.388 48 HE1 PHE 605 HE1 PHE 605 39.113 21.015 -1.343 49 HE2 PHE 605 HE2 PHE 605 35.981 18.144 -1.058 50 HZ PHE 605 HZ PHE 605 37.434 19.588 -2.426 51 H LYS 606 HN LYS 606 39.271 20.472 5.422 52 HA LYS 606 HA LYS 606 37.626 19.213 7.347 53 HB2 LYS 606 HB2 LYS 606 40.085 18.988 7.358 54 HB3 LYS 606 HB1 LYS 606 40.228 20.669 7.855 55 HG2 LYS 606 HG2 LYS 606 39.054 20.167 9.937 56 HG3 LYS 606 HG1 LYS 606 38.881 18.485 9.437 57 HD2 LYS 606 HD2 LYS 606 41.310 18.235 9.423 58 HD3 LYS 606 HD1 LYS 606 41.493 19.928 9.891 59 HE2 LYS 606 HE2 LYS 606 40.301 19.475 11.981 60 HE3 LYS 606 HE1 LYS 606 40.107 17.790 11.507 61 HZ1 LYS 606 HZ1 LYS 606 42.473 17.502 11.572 62 HZ2 LYS 606 HZ2 LYS 606 41.964 18.144 13.049 63 HZ3 LYS 606 HZ3 LYS 606 42.716 19.139 11.909 64 H THR 607 HN THR 607 38.454 22.602 6.833 65 HA THR 607 HA THR 607 37.353 23.515 9.289 66 HB THR 607 HB THR 607 37.856 25.126 6.778 67 HG1 THR 607 HG1 THR 607 39.801 24.148 7.210 68 HG21 THR 607 HG21 THR 607 38.200 26.971 8.346 69 HG22 THR 607 HG22 THR 607 37.908 25.888 9.707 70 HG23 THR 607 HG23 THR 607 36.603 26.261 8.580 71 H THR 608 HN THR 608 36.237 23.497 5.890 72 HA THR 608 HA THR 608 33.794 24.811 6.405 73 HB THR 608 HB THR 608 33.106 23.868 4.165 74 HG1 THR 608 HG1 THR 608 34.743 22.760 3.009 75 HG21 THR 608 HG21 THR 608 34.729 25.195 2.892 76 HG22 THR 608 HG22 THR 608 35.805 25.225 4.288 77 HG23 THR 608 HG23 THR 608 34.242 26.038 4.363 78 H THR 609 HN THR 609 34.610 21.407 6.030 79 HA THR 609 HA THR 609 32.065 20.326 6.295 80 HB THR 609 HB THR 609 34.620 19.044 7.304 81 HG1 THR 609 HG1 THR 609 34.894 19.540 5.153 82 HG21 THR 609 HG21 THR 609 31.995 17.840 6.396 83 HG22 THR 609 HG22 THR 609 32.591 17.889 8.056 84 HG23 THR 609 HG23 THR 609 33.439 16.932 6.842 85 H GLN 610 HN GLN 610 34.312 21.377 8.937 86 HA GLN 610 HA GLN 610 32.770 20.322 11.026 87 HB2 GLN 610 HB2 GLN 610 35.116 20.996 11.274 88 HB3 GLN 610 HB1 GLN 610 34.687 22.663 10.926 89 HG2 GLN 610 HG2 GLN 610 33.320 22.713 12.969 90 HG3 GLN 610 HG1 GLN 610 33.823 21.061 13.324 91 HE21 GLN 610 HE21 GLN 610 34.787 21.667 15.248 92 HE22 GLN 610 HE22 GLN 610 36.276 22.545 15.305 93 H GLU 611 HN GLU 611 32.985 23.566 9.602 94 HA GLU 611 HA GLU 611 31.014 24.855 11.048 95 HB2 GLU 611 HB2 GLU 611 31.943 25.193 8.213 96 HB3 GLU 611 HB1 GLU 611 30.664 26.199 8.874 97 HG2 GLU 611 HG2 GLU 611 33.414 25.945 10.062 98 HG3 GLU 611 HG1 GLU 611 32.902 27.232 8.972 99 H VAL 612 HN VAL 612 30.643 22.987 8.058 100 HA VAL 612 HA VAL 612 27.874 23.264 7.759 101 HB VAL 612 HB VAL 612 29.677 20.961 6.969 102 HG11 VAL 612 HG11 VAL 612 27.892 20.304 5.419 103 HG12 VAL 612 HG12 VAL 612 26.847 21.545 6.110 104 HG13 VAL 612 HG13 VAL 612 27.378 20.187 7.102 105 HG21 VAL 612 HG21 VAL 612 29.554 21.966 4.736 106 HG22 VAL 612 HG22 VAL 612 30.253 23.076 5.914 107 HG23 VAL 612 HG23 VAL 612 28.584 23.286 5.387 108 H ARG 613 HN ARG 613 29.759 20.743 9.390 109 HA ARG 613 HA ARG 613 27.724 19.098 10.281 110 HB2 ARG 613 HB2 ARG 613 30.189 18.687 10.520 111 HB3 ARG 613 HB1 ARG 613 30.205 19.836 11.850 112 HG2 ARG 613 HG2 ARG 613 28.260 18.203 12.696 113 HG3 ARG 613 HG1 ARG 613 29.215 17.065 11.747 114 HD2 ARG 613 HD2 ARG 613 30.236 18.820 13.976 115 HD3 ARG 613 HD1 ARG 613 29.916 17.091 14.083 116 HE ARG 613 HE ARG 613 31.776 17.689 12.009 117 HH11 ARG 613 HH11 ARG 613 31.456 17.303 15.478 118 HH12 ARG 613 HH12 ARG 613 33.116 16.898 15.726 119 HH21 ARG 613 HH21 ARG 613 34.007 17.148 12.331 120 HH22 ARG 613 HH22 ARG 613 34.567 16.806 13.939 121 H GLN 614 HN GLN 614 29.255 21.775 12.059 122 HA GLN 614 HA GLN 614 27.614 21.792 14.287 123 HB2 GLN 614 HB2 GLN 614 29.794 22.964 14.005 124 HB3 GLN 614 HB1 GLN 614 28.983 24.150 12.995 125 HG2 GLN 614 HG2 GLN 614 29.228 25.075 15.166 126 HG3 GLN 614 HG1 GLN 614 27.522 24.697 14.934 127 HE21 GLN 614 HE21 GLN 614 30.458 23.820 16.566 128 HE22 GLN 614 HE22 GLN 614 29.728 22.800 17.757 129 H LEU 615 HN LEU 615 27.279 23.582 11.235 130 HA LEU 615 HA LEU 615 25.135 25.212 12.064 131 HB2 LEU 615 HB2 LEU 615 26.724 25.504 10.070 132 HB3 LEU 615 HB1 LEU 615 25.677 24.398 9.212 133 HG LEU 615 HG LEU 615 25.305 26.833 8.715 134 HD11 LEU 615 HD11 LEU 615 23.570 25.229 8.208 135 HD12 LEU 615 HD12 LEU 615 22.859 26.737 8.784 136 HD13 LEU 615 HD13 LEU 615 22.953 25.341 9.856 137 HD21 LEU 615 HD21 LEU 615 24.097 28.197 10.321 138 HD22 LEU 615 HD22 LEU 615 25.653 27.692 10.983 139 HD23 LEU 615 HD23 LEU 615 24.169 26.895 11.507 140 H LEU 616 HN LEU 616 25.185 22.065 10.393 141 HA LEU 616 HA LEU 616 22.279 22.075 10.259 142 HB2 LEU 616 HB2 LEU 616 24.406 20.249 9.196 143 HB3 LEU 616 HB1 LEU 616 22.740 19.721 9.264 144 HG LEU 616 HG LEU 616 22.133 21.687 7.831 145 HD11 LEU 616 HD11 LEU 616 25.116 21.948 7.520 146 HD12 LEU 616 HD12 LEU 616 24.043 23.112 8.293 147 HD13 LEU 616 HD13 LEU 616 23.898 22.793 6.563 148 HD21 LEU 616 HD21 LEU 616 22.963 20.677 5.762 149 HD22 LEU 616 HD22 LEU 616 22.377 19.463 6.896 150 HD23 LEU 616 HD23 LEU 616 24.110 19.719 6.697 151 H ARG 617 HN ARG 617 24.208 21.619 12.733 152 HA ARG 617 HA ARG 617 24.086 20.543 14.743 153 HB2 ARG 617 HB2 ARG 617 21.299 20.131 13.718 154 HB3 ARG 617 HB1 ARG 617 21.809 19.317 15.184 155 HG2 ARG 617 HG2 ARG 617 20.682 21.288 15.841 156 HG3 ARG 617 HG1 ARG 617 22.397 21.572 16.118 157 HD2 ARG 617 HD2 ARG 617 21.360 22.390 13.481 158 HD3 ARG 617 HD1 ARG 617 20.763 23.306 14.861 159 HE ARG 617 HE ARG 617 23.651 22.942 14.452 160 HH11 ARG 617 HH11 ARG 617 20.863 25.055 14.726 161 HH12 ARG 617 HH12 ARG 617 21.804 26.502 14.821 162 HH21 ARG 617 HH21 ARG 617 24.894 24.843 14.566 163 HH22 ARG 617 HH22 ARG 617 24.119 26.382 14.744 164 H CYS 618 HN CYS 618 24.966 19.114 12.272 165 HA CYS 618 HA CYS 618 24.230 16.366 12.707 166 HB2 CYS 618 HB2 CYS 618 26.369 17.574 10.946 167 HB3 CYS 618 HB1 CYS 618 25.855 15.891 10.919 168 HG CYS 618 HG CYS 618 23.227 17.835 10.523 169 H ASP 619 HN ASP 619 25.814 14.707 13.216 170 HA ASP 619 HA ASP 619 27.954 15.756 14.947 171 HB2 ASP 619 HB2 ASP 619 25.820 14.387 15.872 172 HB3 ASP 619 HB1 ASP 619 26.903 13.044 15.516 173 H ARG 620 HN ARG 620 27.006 13.396 12.543 174 HA ARG 620 HA ARG 620 29.858 12.793 12.177 175 HB2 ARG 620 HB2 ARG 620 27.565 10.876 11.683 176 HB3 ARG 620 HB1 ARG 620 29.274 10.533 11.457 177 HG2 ARG 620 HG2 ARG 620 29.547 11.034 13.938 178 HG3 ARG 620 HG1 ARG 620 27.791 10.970 14.028 179 HD2 ARG 620 HD2 ARG 620 29.535 8.746 12.987 180 HD3 ARG 620 HD1 ARG 620 28.910 8.839 14.630 181 HE ARG 620 HE ARG 620 27.261 8.529 12.212 182 HH11 ARG 620 HH11 ARG 620 27.718 8.136 15.678 183 HH12 ARG 620 HH12 ARG 620 26.338 7.106 15.875 184 HH21 ARG 620 HH21 ARG 620 25.431 7.166 12.493 185 HH22 ARG 620 HH22 ARG 620 25.041 6.574 14.065 186 H VAL 621 HN VAL 621 30.641 13.298 10.237 187 HA VAL 621 HA VAL 621 28.901 13.490 7.894 188 HB VAL 621 HB VAL 621 30.790 15.739 8.690 189 HG11 VAL 621 HG11 VAL 621 30.620 15.451 6.282 190 HG12 VAL 621 HG12 VAL 621 29.823 16.942 6.786 191 HG13 VAL 621 HG13 VAL 621 28.861 15.521 6.383 192 HG21 VAL 621 HG21 VAL 621 28.796 17.121 9.013 193 HG22 VAL 621 HG22 VAL 621 28.805 15.744 10.116 194 HG23 VAL 621 HG23 VAL 621 27.773 15.723 8.689 195 H ALA 622 HN ALA 622 30.015 12.892 5.965 196 HA ALA 622 HA ALA 622 32.929 12.697 6.165 197 HB1 ALA 622 HB1 ALA 622 32.027 10.509 6.785 198 HB2 ALA 622 HB2 ALA 622 32.919 10.438 5.265 199 HB3 ALA 622 HB3 ALA 622 31.155 10.437 5.254 200 H VAL 623 HN VAL 623 33.939 12.213 4.060 201 HA VAL 623 HA VAL 623 32.414 13.170 1.739 202 HB VAL 623 HB VAL 623 35.213 14.108 2.457 203 HG11 VAL 623 HG11 VAL 623 35.071 15.479 0.421 204 HG12 VAL 623 HG12 VAL 623 33.541 14.698 0.021 205 HG13 VAL 623 HG13 VAL 623 35.027 13.751 0.075 206 HG21 VAL 623 HG21 VAL 623 32.625 15.630 2.251 207 HG22 VAL 623 HG22 VAL 623 34.216 16.359 2.445 208 HG23 VAL 623 HG23 VAL 623 33.555 15.331 3.725 209 H TYR 624 HN TYR 624 32.919 12.107 -0.147 210 HA TYR 624 HA TYR 624 35.177 10.340 -0.173 211 HB2 TYR 624 HB2 TYR 624 33.779 8.376 -0.910 212 HB3 TYR 624 HB1 TYR 624 33.614 8.806 0.783 213 HD1 TYR 624 HD1 TYR 624 31.884 7.992 -2.170 214 HD2 TYR 624 HD2 TYR 624 31.583 10.370 1.340 215 HE1 TYR 624 HE1 TYR 624 29.439 8.036 -2.416 216 HE2 TYR 624 HE2 TYR 624 29.147 10.426 1.104 217 HH TYR 624 HH TYR 624 27.457 10.147 -0.613 218 H ARG 625 HN ARG 625 35.939 9.933 -2.165 219 HA ARG 625 HA ARG 625 34.681 11.508 -4.305 220 HB2 ARG 625 HB2 ARG 625 36.878 11.633 -5.331 221 HB3 ARG 625 HB1 ARG 625 36.969 12.185 -3.665 222 HG2 ARG 625 HG2 ARG 625 37.961 10.113 -2.973 223 HG3 ARG 625 HG1 ARG 625 37.724 9.420 -4.577 224 HD2 ARG 625 HD2 ARG 625 39.249 11.090 -5.515 225 HD3 ARG 625 HD1 ARG 625 39.483 11.776 -3.911 226 HE ARG 625 HE ARG 625 40.337 9.445 -3.327 227 HH11 ARG 625 HH11 ARG 625 40.666 10.820 -6.551 228 HH12 ARG 625 HH12 ARG 625 42.124 9.964 -6.894 229 HH21 ARG 625 HH21 ARG 625 42.212 8.321 -3.776 230 HH22 ARG 625 HH22 ARG 625 43.020 8.509 -5.300 231 H PHE 626 HN PHE 626 34.774 10.652 -6.465 232 HA PHE 626 HA PHE 626 34.483 7.748 -6.438 233 HB2 PHE 626 HB2 PHE 626 33.585 9.819 -8.438 234 HB3 PHE 626 HB1 PHE 626 33.427 8.084 -8.689 235 HD1 PHE 626 HD1 PHE 626 31.841 10.970 -7.497 236 HD2 PHE 626 HD2 PHE 626 32.201 6.796 -6.770 237 HE1 PHE 626 HE1 PHE 626 29.701 10.998 -6.298 238 HE2 PHE 626 HE2 PHE 626 30.056 6.814 -5.569 239 HZ PHE 626 HZ PHE 626 28.803 8.916 -5.332 240 H ASN 627 HN ASN 627 36.094 6.575 -7.074 241 HA ASN 627 HA ASN 627 38.278 7.609 -8.622 242 HB2 ASN 627 HB2 ASN 627 37.578 4.877 -7.525 243 HB3 ASN 627 HB1 ASN 627 38.955 5.103 -8.588 244 HD21 ASN 627 HD21 ASN 627 37.686 5.570 -5.427 245 HD22 ASN 627 HD22 ASN 627 39.144 6.152 -4.704 246 HA PRO 628 HA PRO 628 37.274 6.613 -12.848 247 HB2 PRO 628 HB2 PRO 628 39.012 4.179 -12.650 248 HB3 PRO 628 HB1 PRO 628 38.913 5.385 -13.943 249 HG2 PRO 628 HG2 PRO 628 40.895 5.501 -12.198 250 HG3 PRO 628 HG1 PRO 628 40.078 6.987 -12.713 251 HD2 PRO 628 HD2 PRO 628 39.882 5.514 -10.139 252 HD3 PRO 628 HD1 PRO 628 39.753 7.256 -10.449 253 H ASN 629 HN ASN 629 37.126 3.850 -10.612 254 HA ASN 629 HA ASN 629 35.055 2.649 -12.315 255 HB2 ASN 629 HB2 ASN 629 36.689 1.461 -10.076 256 HB3 ASN 629 HB1 ASN 629 35.325 0.633 -10.815 257 HD21 ASN 629 HD21 ASN 629 38.585 1.670 -11.198 258 HD22 ASN 629 HD22 ASN 629 38.915 0.810 -12.660 259 H TRP 630 HN TRP 630 34.884 4.923 -10.148 260 HA TRP 630 HA TRP 630 33.354 5.668 -8.613 261 HB2 TRP 630 HB2 TRP 630 31.627 3.636 -10.050 262 HB3 TRP 630 HB1 TRP 630 31.002 4.813 -8.902 263 HD1 TRP 630 HD1 TRP 630 32.918 4.803 -12.288 264 HE1 TRP 630 HE1 TRP 630 32.158 6.864 -13.635 265 HE3 TRP 630 HE3 TRP 630 29.806 6.932 -8.833 266 HZ2 TRP 630 HZ2 TRP 630 30.462 9.089 -13.280 267 HZ3 TRP 630 HZ3 TRP 630 28.654 9.025 -9.418 268 HH2 TRP 630 HH2 TRP 630 28.976 10.079 -11.595 269 H THR 631 HN THR 631 35.041 4.204 -7.317 270 HA THR 631 HA THR 631 33.748 1.966 -6.012 271 HB THR 631 HB THR 631 36.034 1.667 -4.996 272 HG1 THR 631 HG1 THR 631 37.581 3.064 -5.549 273 HG21 THR 631 HG21 THR 631 35.748 1.771 -7.991 274 HG22 THR 631 HG22 THR 631 35.243 0.439 -6.957 275 HG23 THR 631 HG23 THR 631 36.962 0.827 -7.121 276 H GLY 632 HN GLY 632 33.853 5.189 -5.398 277 HA2 GLY 632 HA2 GLY 632 33.228 6.447 -3.553 278 HA3 GLY 632 HA1 GLY 632 32.617 4.945 -2.888 279 H GLU 633 HN GLU 633 35.695 6.720 -3.335 280 HA GLU 633 HA GLU 633 36.764 5.361 -0.960 281 HB2 GLU 633 HB2 GLU 633 38.201 5.416 -2.929 282 HB3 GLU 633 HB1 GLU 633 38.075 7.166 -3.000 283 HG2 GLU 633 HG2 GLU 633 39.139 7.185 -0.695 284 HG3 GLU 633 HG1 GLU 633 39.514 5.486 -0.976 285 H PHE 634 HN PHE 634 36.860 6.354 0.958 286 HA PHE 634 HA PHE 634 35.909 9.061 1.237 287 HB2 PHE 634 HB2 PHE 634 36.876 7.037 3.259 288 HB3 PHE 634 HB1 PHE 634 36.326 8.650 3.692 289 HD1 PHE 634 HD1 PHE 634 35.300 5.381 2.364 290 HD2 PHE 634 HD2 PHE 634 34.005 9.212 3.685 291 HE1 PHE 634 HE1 PHE 634 32.983 4.564 2.444 292 HE2 PHE 634 HE2 PHE 634 31.683 8.402 3.768 293 HZ PHE 634 HZ PHE 634 31.170 6.076 3.147 294 H VAL 635 HN VAL 635 37.075 10.867 1.471 295 HA VAL 635 HA VAL 635 39.998 10.547 1.721 296 HB VAL 635 HB VAL 635 40.238 12.621 0.352 297 HG11 VAL 635 HG11 VAL 635 38.842 10.300 -0.965 298 HG12 VAL 635 HG12 VAL 635 40.568 10.423 -0.621 299 HG13 VAL 635 HG13 VAL 635 39.822 11.513 -1.790 300 HG21 VAL 635 HG21 VAL 635 38.011 13.562 0.674 301 HG22 VAL 635 HG22 VAL 635 37.294 12.193 -0.175 302 HG23 VAL 635 HG23 VAL 635 38.334 13.323 -1.043 303 H ALA 636 HN ALA 636 37.237 12.066 3.058 304 HA ALA 636 HA ALA 636 39.032 13.714 4.693 305 HB1 ALA 636 HB1 ALA 636 37.719 15.085 3.032 306 HB2 ALA 636 HB2 ALA 636 37.528 15.543 4.722 307 HB3 ALA 636 HB3 ALA 636 36.267 14.615 3.921 308 H GLU 637 HN GLU 637 38.342 14.135 6.835 309 HA GLU 637 HA GLU 637 36.265 12.317 7.815 310 HB2 GLU 637 HB2 GLU 637 38.775 11.492 7.937 311 HB3 GLU 637 HB1 GLU 637 38.833 12.560 9.329 312 HG2 GLU 637 HG2 GLU 637 36.986 10.210 8.952 313 HG3 GLU 637 HG1 GLU 637 38.390 10.283 10.012 314 H SER 638 HN SER 638 34.930 13.346 9.125 315 HA SER 638 HA SER 638 35.888 15.254 11.056 316 HB2 SER 638 HB2 SER 638 35.308 16.592 8.978 317 HB3 SER 638 HB1 SER 638 33.646 16.039 9.172 318 HG SER 638 HG SER 638 34.827 18.094 10.333 319 H VAL 639 HN VAL 639 35.164 14.185 12.795 320 HA VAL 639 HA VAL 639 32.305 13.675 13.016 321 HB VAL 639 HB VAL 639 33.483 11.586 12.166 322 HG11 VAL 639 HG11 VAL 639 34.722 10.246 13.804 323 HG12 VAL 639 HG12 VAL 639 34.656 11.596 14.940 324 HG13 VAL 639 HG13 VAL 639 35.536 11.762 13.421 325 HG21 VAL 639 HG21 VAL 639 31.311 11.443 13.197 326 HG22 VAL 639 HG22 VAL 639 32.035 11.434 14.806 327 HG23 VAL 639 HG23 VAL 639 32.296 10.074 13.711 328 H ALA 640 HN ALA 640 31.674 13.266 15.270 329 HA ALA 640 HA ALA 640 33.159 14.811 17.148 330 HB1 ALA 640 HB1 ALA 640 31.427 14.175 18.733 331 HB2 ALA 640 HB2 ALA 640 30.839 12.936 17.626 332 HB3 ALA 640 HB3 ALA 640 30.689 14.640 17.197 333 H HIS 641 HN HIS 641 34.254 14.048 18.991 334 HA HIS 641 HA HIS 641 35.881 11.789 18.556 335 HB2 HIS 641 HB2 HIS 641 36.462 13.828 19.927 336 HB3 HIS 641 HB1 HIS 641 35.447 13.177 21.206 337 HD2 HIS 641 HD2 HIS 641 36.583 11.061 22.662 338 HE1 HIS 641 HE1 HIS 641 40.345 11.177 20.716 339 HE2 HIS 641 HE2 HIS 641 39.034 10.249 22.649 340 H THR 642 HN THR 642 32.758 11.999 19.848 341 HA THR 642 HA THR 642 32.841 9.766 21.609 342 HB THR 642 HB THR 642 30.433 10.979 20.237 343 HG1 THR 642 HG1 THR 642 30.439 12.494 21.781 344 HG21 THR 642 HG21 THR 642 29.203 10.128 22.178 345 HG22 THR 642 HG22 THR 642 30.689 9.445 22.832 346 HG23 THR 642 HG23 THR 642 30.015 8.811 21.333 347 H TRP 643 HN TRP 643 32.616 10.066 18.170 348 HA TRP 643 HA TRP 643 31.557 7.323 18.003 349 HB2 TRP 643 HB2 TRP 643 31.488 9.380 15.803 350 HB3 TRP 643 HB1 TRP 643 30.634 7.841 15.869 351 HD1 TRP 643 HD1 TRP 643 30.054 11.387 16.380 352 HE1 TRP 643 HE1 TRP 643 27.912 11.823 17.724 353 HE3 TRP 643 HE3 TRP 643 29.266 6.666 18.167 354 HZ2 TRP 643 HZ2 TRP 643 26.120 10.351 19.332 355 HZ3 TRP 643 HZ3 TRP 643 27.311 6.265 19.607 356 HH2 TRP 643 HH2 TRP 643 25.772 8.072 20.177 357 H VAL 644 HN VAL 644 32.240 6.230 15.902 358 HA VAL 644 HA VAL 644 35.140 6.570 15.614 359 HB VAL 644 HB VAL 644 35.242 4.205 14.970 360 HG11 VAL 644 HG11 VAL 644 33.812 4.657 17.586 361 HG12 VAL 644 HG12 VAL 644 35.551 4.764 17.311 362 HG13 VAL 644 HG13 VAL 644 34.728 3.213 17.156 363 HG21 VAL 644 HG21 VAL 644 33.274 2.746 15.220 364 HG22 VAL 644 HG22 VAL 644 33.025 3.971 13.975 365 HG23 VAL 644 HG23 VAL 644 32.277 4.163 15.560 366 H LYS 645 HN LYS 645 36.043 6.152 13.538 367 HA LYS 645 HA LYS 645 34.220 6.199 11.260 368 HB2 LYS 645 HB2 LYS 645 36.291 8.269 11.905 369 HB3 LYS 645 HB1 LYS 645 35.851 7.930 10.241 370 HG2 LYS 645 HG2 LYS 645 33.875 8.731 12.356 371 HG3 LYS 645 HG1 LYS 645 34.689 9.872 11.284 372 HD2 LYS 645 HD2 LYS 645 33.772 8.381 9.381 373 HD3 LYS 645 HD1 LYS 645 32.675 7.752 10.614 374 HE2 LYS 645 HE2 LYS 645 31.593 9.558 9.429 375 HE3 LYS 645 HE1 LYS 645 31.935 10.067 11.082 376 HZ1 LYS 645 HZ1 LYS 645 33.946 11.200 10.237 377 HZ2 LYS 645 HZ2 LYS 645 32.527 11.827 9.551 378 HZ3 LYS 645 HZ3 LYS 645 33.502 10.778 8.663 379 H LEU 646 HN LEU 646 35.333 5.733 9.253 380 HA LEU 646 HA LEU 646 37.558 3.917 9.711 381 HB2 LEU 646 HB2 LEU 646 35.698 4.213 7.343 382 HB3 LEU 646 HB1 LEU 646 37.061 3.117 7.376 383 HG LEU 646 HG LEU 646 35.938 2.006 9.387 384 HD11 LEU 646 HD11 LEU 646 34.369 3.778 9.952 385 HD12 LEU 646 HD12 LEU 646 33.517 2.280 9.578 386 HD13 LEU 646 HD13 LEU 646 33.570 3.581 8.392 387 HD21 LEU 646 HD21 LEU 646 35.984 0.986 7.182 388 HD22 LEU 646 HD22 LEU 646 34.557 1.911 6.710 389 HD23 LEU 646 HD23 LEU 646 34.436 0.690 7.973 390 H VAL 647 HN VAL 647 37.017 5.306 6.571 391 HA VAL 647 HA VAL 647 38.306 6.480 5.145 392 HB VAL 647 HB VAL 647 39.134 8.124 7.558 393 HG11 VAL 647 HG11 VAL 647 40.486 8.577 5.581 394 HG12 VAL 647 HG12 VAL 647 39.416 9.941 5.913 395 HG13 VAL 647 HG13 VAL 647 39.028 8.812 4.616 396 HG21 VAL 647 HG21 VAL 647 36.720 7.997 7.477 397 HG22 VAL 647 HG22 VAL 647 36.725 8.393 5.760 398 HG23 VAL 647 HG23 VAL 647 37.238 9.597 6.941 399 H GLY 648 HN GLY 648 40.622 7.151 7.705 400 HA2 GLY 648 HA2 GLY 648 42.682 6.230 8.173 401 HA3 GLY 648 HA1 GLY 648 42.312 4.939 7.055 402 HA PRO 649 HA PRO 649 44.960 8.335 4.913 403 HB2 PRO 649 HB2 PRO 649 47.301 8.209 6.608 404 HB3 PRO 649 HB1 PRO 649 46.316 9.615 6.205 405 HG2 PRO 649 HG2 PRO 649 46.440 8.495 8.708 406 HG3 PRO 649 HG1 PRO 649 45.065 9.438 8.108 407 HD2 PRO 649 HD2 PRO 649 45.388 6.474 8.328 408 HD3 PRO 649 HD1 PRO 649 43.959 7.489 8.625 409 H ASP 650 HN ASP 650 46.357 5.635 6.754 410 HA ASP 650 HA ASP 650 48.099 4.895 4.550 411 HB2 ASP 650 HB2 ASP 650 48.894 4.687 6.886 412 HB3 ASP 650 HB1 ASP 650 47.626 3.503 7.195 413 H ILE 651 HN ILE 651 45.341 3.621 6.286 414 HA ILE 651 HA ILE 651 45.015 1.406 4.479 415 HB ILE 651 HB ILE 651 44.490 1.316 6.958 416 HG12 ILE 651 HG12 ILE 651 42.524 -0.066 6.814 417 HG13 ILE 651 HG11 ILE 651 42.050 0.642 5.285 418 HG21 ILE 651 HG21 ILE 651 42.325 2.206 7.726 419 HG22 ILE 651 HG22 ILE 651 42.176 3.059 6.188 420 HG23 ILE 651 HG23 ILE 651 43.504 3.442 7.287 421 HD11 ILE 651 HD11 ILE 651 44.029 -0.361 4.233 422 HD12 ILE 651 HD12 ILE 651 43.001 -1.574 4.997 423 HD13 ILE 651 HD13 ILE 651 44.489 -1.055 5.788 424 H LYS 652 HN LYS 652 42.316 1.362 3.974 425 HA LYS 652 HA LYS 652 41.574 3.880 2.778 426 HB2 LYS 652 HB2 LYS 652 43.073 2.879 1.099 427 HB3 LYS 652 HB1 LYS 652 42.055 1.450 1.044 428 HG2 LYS 652 HG2 LYS 652 40.219 2.757 0.147 429 HG3 LYS 652 HG1 LYS 652 41.178 4.230 0.280 430 HD2 LYS 652 HD2 LYS 652 41.889 1.844 -1.434 431 HD3 LYS 652 HD1 LYS 652 41.132 3.324 -2.021 432 HE2 LYS 652 HE2 LYS 652 43.857 3.107 -0.726 433 HE3 LYS 652 HE1 LYS 652 43.538 3.346 -2.441 434 HZ1 LYS 652 HZ1 LYS 652 42.848 5.238 -0.258 435 HZ2 LYS 652 HZ2 LYS 652 42.459 5.454 -1.891 436 HZ3 LYS 652 HZ3 LYS 652 44.076 5.432 -1.403 437 H THR 653 HN THR 653 39.419 4.108 2.624 438 HA THR 653 HA THR 653 37.794 1.733 3.215 439 HB THR 653 HB THR 653 37.026 4.631 3.658 440 HG1 THR 653 HG1 THR 653 38.786 3.427 4.989 441 HG21 THR 653 HG21 THR 653 35.207 3.662 5.031 442 HG22 THR 653 HG22 THR 653 35.755 2.043 4.599 443 HG23 THR 653 HG23 THR 653 35.109 3.112 3.357 444 H VAL 654 HN VAL 654 37.133 0.951 1.357 445 HA VAL 654 HA VAL 654 36.252 2.731 -0.791 446 HB VAL 654 HB VAL 654 36.780 -0.262 -0.761 447 HG11 VAL 654 HG11 VAL 654 36.655 -0.127 -3.208 448 HG12 VAL 654 HG12 VAL 654 36.168 1.563 -3.071 449 HG13 VAL 654 HG13 VAL 654 35.124 0.293 -2.438 450 HG21 VAL 654 HG21 VAL 654 38.427 2.003 -1.882 451 HG22 VAL 654 HG22 VAL 654 38.771 0.287 -2.100 452 HG23 VAL 654 HG23 VAL 654 38.830 0.999 -0.488 453 H TRP 655 HN TRP 655 34.084 2.513 -1.697 454 HA TRP 655 HA TRP 655 32.317 0.673 -0.335 455 HB2 TRP 655 HB2 TRP 655 32.235 2.916 0.893 456 HB3 TRP 655 HB1 TRP 655 31.605 3.608 -0.596 457 HD1 TRP 655 HD1 TRP 655 29.503 1.331 -1.371 458 HE1 TRP 655 HE1 TRP 655 27.374 1.021 0.034 459 HE3 TRP 655 HE3 TRP 655 31.062 3.595 2.945 460 HZ2 TRP 655 HZ2 TRP 655 26.472 1.669 2.633 461 HZ3 TRP 655 HZ3 TRP 655 29.498 3.713 4.841 462 HH2 TRP 655 HH2 TRP 655 27.252 2.770 4.685 463 H GLU 656 HN GLU 656 32.111 -0.417 -2.211 464 HA GLU 656 HA GLU 656 31.598 1.028 -4.661 465 HB2 GLU 656 HB2 GLU 656 33.129 -0.805 -4.821 466 HB3 GLU 656 HB1 GLU 656 31.978 -1.896 -4.065 467 HG2 GLU 656 HG2 GLU 656 30.471 -1.533 -6.012 468 HG3 GLU 656 HG1 GLU 656 31.777 -0.631 -6.777 469 H ASP 657 HN ASP 657 29.559 1.834 -4.590 470 HA ASP 657 HA ASP 657 27.383 0.016 -3.968 471 HB2 ASP 657 HB2 ASP 657 27.226 2.351 -3.172 472 HB3 ASP 657 HB1 ASP 657 27.260 2.911 -4.845 473 H THR 658 HN THR 658 26.832 -1.326 -5.459 474 HA THR 658 HA THR 658 27.552 -1.133 -8.155 475 HB THR 658 HB THR 658 27.271 -3.282 -7.051 476 HG1 THR 658 HG1 THR 658 26.582 -4.214 -8.826 477 HG21 THR 658 HG21 THR 658 25.450 -2.762 -5.542 478 HG22 THR 658 HG22 THR 658 25.018 -4.160 -6.536 479 HG23 THR 658 HG23 THR 658 24.341 -2.572 -6.907 480 H HIS 659 HN HIS 659 24.779 0.044 -6.432 481 HA HIS 659 HA HIS 659 23.016 0.149 -8.672 482 HB2 HIS 659 HB2 HIS 659 22.208 0.177 -6.316 483 HB3 HIS 659 HB1 HIS 659 22.921 1.772 -6.116 484 HD2 HIS 659 HD2 HIS 659 20.027 0.152 -8.276 485 HE1 HIS 659 HE1 HIS 659 19.203 4.267 -7.667 486 HE2 HIS 659 HE2 HIS 659 18.288 2.056 -8.443 487 H LEU 660 HN LEU 660 24.940 2.766 -6.939 488 HA LEU 660 HA LEU 660 24.452 4.711 -8.792 489 HB2 LEU 660 HB2 LEU 660 26.830 4.299 -6.992 490 HB3 LEU 660 HB1 LEU 660 26.381 5.806 -7.764 491 HG LEU 660 HG LEU 660 24.767 4.366 -5.656 492 HD11 LEU 660 HD11 LEU 660 26.427 6.875 -5.503 493 HD12 LEU 660 HD12 LEU 660 26.802 5.324 -4.751 494 HD13 LEU 660 HD13 LEU 660 25.395 6.244 -4.220 495 HD21 LEU 660 HD21 LEU 660 23.425 6.427 -5.622 496 HD22 LEU 660 HD22 LEU 660 23.322 5.585 -7.167 497 HD23 LEU 660 HD23 LEU 660 24.331 7.025 -7.013 498 H GLN 661 HN GLN 661 26.486 1.914 -9.155 499 HA GLN 661 HA GLN 661 28.402 3.249 -10.869 500 HB2 GLN 661 HB2 GLN 661 27.950 0.365 -10.097 501 HB3 GLN 661 HB1 GLN 661 29.095 0.825 -11.344 502 HG2 GLN 661 HG2 GLN 661 30.356 2.136 -9.702 503 HG3 GLN 661 HG1 GLN 661 29.202 1.672 -8.452 504 HE21 GLN 661 HE21 GLN 661 32.080 1.189 -8.696 505 HE22 GLN 661 HE22 GLN 661 32.276 -0.527 -8.581 506 H GLU 662 HN GLU 662 25.522 1.309 -11.060 507 HA GLU 662 HA GLU 662 25.657 0.859 -13.879 508 HB2 GLU 662 HB2 GLU 662 24.468 -0.612 -12.243 509 HB3 GLU 662 HB1 GLU 662 23.274 0.659 -12.041 510 HG2 GLU 662 HG2 GLU 662 22.457 -1.021 -13.542 511 HG3 GLU 662 HG1 GLU 662 22.713 0.492 -14.416 512 H THR 663 HN THR 663 23.904 3.059 -11.747 513 HA THR 663 HA THR 663 22.602 4.370 -13.971 514 HB THR 663 HB THR 663 21.657 5.839 -12.161 515 HG1 THR 663 HG1 THR 663 22.569 4.014 -10.239 516 HG21 THR 663 HG21 THR 663 20.232 4.080 -11.193 517 HG22 THR 663 HG22 THR 663 21.353 2.854 -11.787 518 HG23 THR 663 HG23 THR 663 20.451 3.852 -12.927 519 H GLN 664 HN GLN 664 25.615 4.521 -12.703 520 HA GLN 664 HA GLN 664 27.325 6.001 -12.622 521 HB2 GLN 664 HB2 GLN 664 25.761 7.254 -14.877 522 HB3 GLN 664 HB1 GLN 664 27.406 7.696 -14.448 523 HG2 GLN 664 HG2 GLN 664 28.052 5.317 -14.880 524 HG3 GLN 664 HG1 GLN 664 26.425 5.065 -15.517 525 HE21 GLN 664 HE21 GLN 664 29.486 6.607 -16.013 526 HE22 GLN 664 HE22 GLN 664 29.226 7.053 -17.659 527 H GLY 665 HN GLY 665 25.679 6.461 -10.611 528 HA2 GLY 665 HA2 GLY 665 25.805 8.213 -9.007 529 HA3 GLY 665 HA1 GLY 665 25.851 9.377 -10.320 530 H GLY 666 HN GLY 666 23.551 7.740 -11.556 531 HA2 GLY 666 HA2 GLY 666 21.255 7.879 -11.616 532 HA3 GLY 666 HA1 GLY 666 21.315 7.860 -9.861 533 H ARG 667 HN ARG 667 20.331 9.542 -8.972 534 HA ARG 667 HA ARG 667 19.739 11.899 -10.497 535 HB2 ARG 667 HB2 ARG 667 19.218 11.126 -7.637 536 HB3 ARG 667 HB1 ARG 667 18.842 12.729 -8.239 537 HG2 ARG 667 HG2 ARG 667 16.834 11.669 -8.456 538 HG3 ARG 667 HG1 ARG 667 17.516 11.435 -10.065 539 HD2 ARG 667 HD2 ARG 667 16.544 9.372 -9.309 540 HD3 ARG 667 HD1 ARG 667 18.298 9.195 -9.342 541 HE ARG 667 HE ARG 667 18.266 8.846 -7.073 542 HH11 ARG 667 HH11 ARG 667 15.232 10.413 -7.962 543 HH12 ARG 667 HH12 ARG 667 14.536 10.199 -6.392 544 HH21 ARG 667 HH21 ARG 667 17.359 8.574 -5.060 545 HH22 ARG 667 HH22 ARG 667 15.748 9.137 -4.719 546 H TYR 668 HN TYR 668 22.204 10.940 -8.300 547 HA TYR 668 HA TYR 668 22.995 13.517 -7.438 548 HB2 TYR 668 HB2 TYR 668 24.580 10.939 -7.546 549 HB3 TYR 668 HB1 TYR 668 25.047 12.388 -6.660 550 HD1 TYR 668 HD1 TYR 668 23.775 9.224 -6.151 551 HD2 TYR 668 HD2 TYR 668 22.882 13.290 -5.186 552 HE1 TYR 668 HE1 TYR 668 22.472 8.485 -4.221 553 HE2 TYR 668 HE2 TYR 668 21.580 12.540 -3.247 554 HH TYR 668 HH TYR 668 21.703 9.348 -2.081 555 H ALA 669 HN ALA 669 23.514 11.730 -10.321 556 HA ALA 669 HA ALA 669 25.784 13.344 -11.143 557 HB1 ALA 669 HB1 ALA 669 24.231 11.258 -12.665 558 HB2 ALA 669 HB2 ALA 669 25.712 10.978 -11.748 559 HB3 ALA 669 HB3 ALA 669 25.741 12.009 -13.179 560 H GLN 670 HN GLN 670 22.440 13.612 -11.158 561 HA GLN 670 HA GLN 670 22.397 15.277 -13.565 562 HB2 GLN 670 HB2 GLN 670 20.122 14.262 -11.860 563 HB3 GLN 670 HB1 GLN 670 19.947 15.223 -13.322 564 HG2 GLN 670 HG2 GLN 670 21.034 13.412 -14.601 565 HG3 GLN 670 HG1 GLN 670 21.099 12.448 -13.127 566 HE21 GLN 670 HE21 GLN 670 19.738 11.920 -15.649 567 HE22 GLN 670 HE22 GLN 670 18.066 11.716 -15.259 568 H GLY 671 HN GLY 671 22.981 15.639 -10.366 569 HA2 GLY 671 HA2 GLY 671 23.437 17.729 -9.376 570 HA3 GLY 671 HA1 GLY 671 22.354 18.486 -10.530 571 H GLU 672 HN GLU 672 21.151 15.671 -8.975 572 HA GLU 672 HA GLU 672 19.457 17.383 -7.303 573 HB2 GLU 672 HB2 GLU 672 19.003 14.634 -8.430 574 HB3 GLU 672 HB1 GLU 672 17.966 15.334 -7.197 575 HG2 GLU 672 HG2 GLU 672 17.533 17.224 -8.770 576 HG3 GLU 672 HG1 GLU 672 18.416 16.317 -9.997 577 H ASN 673 HN ASN 673 18.848 16.590 -5.207 578 HA ASN 673 HA ASN 673 20.930 14.905 -3.995 579 HB2 ASN 673 HB2 ASN 673 20.590 16.203 -1.894 580 HB3 ASN 673 HB1 ASN 673 21.210 17.183 -3.214 581 HD21 ASN 673 HD21 ASN 673 20.494 19.095 -2.366 582 HD22 ASN 673 HD22 ASN 673 18.827 19.533 -2.289 583 H PHE 674 HN PHE 674 20.097 14.066 -1.760 584 HA PHE 674 HA PHE 674 17.273 13.374 -1.874 585 HB2 PHE 674 HB2 PHE 674 18.581 11.614 -3.137 586 HB3 PHE 674 HB1 PHE 674 19.399 11.235 -1.626 587 HD1 PHE 674 HD1 PHE 674 15.827 11.882 -2.514 588 HD2 PHE 674 HD2 PHE 674 18.679 9.213 -0.824 589 HE1 PHE 674 HE1 PHE 674 14.019 10.311 -1.953 590 HE2 PHE 674 HE2 PHE 674 16.874 7.639 -0.261 591 HZ PHE 674 HZ PHE 674 14.542 8.187 -0.824 592 H VAL 675 HN VAL 675 16.393 12.905 0.116 593 HA VAL 675 HA VAL 675 18.193 13.056 2.425 594 HB VAL 675 HB VAL 675 16.423 14.377 3.638 595 HG11 VAL 675 HG11 VAL 675 17.000 16.536 2.595 596 HG12 VAL 675 HG12 VAL 675 17.687 15.664 1.224 597 HG13 VAL 675 HG13 VAL 675 18.398 15.489 2.829 598 HG21 VAL 675 HG21 VAL 675 14.514 13.892 2.214 599 HG22 VAL 675 HG22 VAL 675 15.287 14.720 0.863 600 HG23 VAL 675 HG23 VAL 675 14.790 15.633 2.287 601 H VAL 676 HN VAL 676 17.940 11.425 3.775 602 HA VAL 676 HA VAL 676 15.454 9.871 3.588 603 HB VAL 676 HB VAL 676 18.190 8.965 4.519 604 HG11 VAL 676 HG11 VAL 676 16.406 7.799 5.704 605 HG12 VAL 676 HG12 VAL 676 17.211 6.717 4.566 606 HG13 VAL 676 HG13 VAL 676 15.633 7.400 4.169 607 HG21 VAL 676 HG21 VAL 676 18.177 7.593 2.486 608 HG22 VAL 676 HG22 VAL 676 18.097 9.315 2.115 609 HG23 VAL 676 HG23 VAL 676 16.643 8.322 2.011 610 H ASN 677 HN ASN 677 14.136 9.919 5.260 611 HA ASN 677 HA ASN 677 14.984 11.122 7.748 612 HB2 ASN 677 HB2 ASN 677 12.528 10.660 8.401 613 HB3 ASN 677 HB1 ASN 677 12.828 11.850 7.146 614 HD21 ASN 677 HD21 ASN 677 10.653 11.538 6.472 615 HD22 ASN 677 HD22 ASN 677 10.213 10.170 5.513 616 H ASP 678 HN ASP 678 13.935 7.988 6.573 617 HA ASP 678 HA ASP 678 15.424 6.681 8.654 618 HB2 ASP 678 HB2 ASP 678 13.352 6.944 9.853 619 HB3 ASP 678 HB1 ASP 678 12.425 6.360 8.475 620 H ILE 679 HN ILE 679 15.995 4.622 8.114 621 HA ILE 679 HA ILE 679 16.008 4.077 5.324 622 HB ILE 679 HB ILE 679 17.247 1.997 5.958 623 HG12 ILE 679 HG12 ILE 679 16.922 3.112 8.756 624 HG13 ILE 679 HG11 ILE 679 16.206 1.622 8.151 625 HG21 ILE 679 HG21 ILE 679 18.423 4.058 5.446 626 HG22 ILE 679 HG22 ILE 679 19.244 3.202 6.751 627 HG23 ILE 679 HG23 ILE 679 18.237 4.603 7.112 628 HD11 ILE 679 HD11 ILE 679 19.148 2.171 8.468 629 HD12 ILE 679 HD12 ILE 679 18.437 0.674 7.862 630 HD13 ILE 679 HD13 ILE 679 18.147 1.179 9.527 631 H TYR 680 HN TYR 680 14.018 2.946 7.951 632 HA TYR 680 HA TYR 680 13.009 0.715 6.387 633 HB2 TYR 680 HB2 TYR 680 12.234 1.749 9.124 634 HB3 TYR 680 HB1 TYR 680 11.507 0.344 8.356 635 HD1 TYR 680 HD1 TYR 680 14.334 1.597 10.234 636 HD2 TYR 680 HD2 TYR 680 12.921 -1.677 7.910 637 HE1 TYR 680 HE1 TYR 680 16.114 0.175 11.162 638 HE2 TYR 680 HE2 TYR 680 14.697 -3.106 8.835 639 HH TYR 680 HH TYR 680 16.889 -2.882 9.859 640 H GLN 681 HN GLN 681 11.995 3.888 7.479 641 HA GLN 681 HA GLN 681 9.319 3.857 6.692 642 HB2 GLN 681 HB2 GLN 681 10.563 5.619 8.049 643 HB3 GLN 681 HB1 GLN 681 11.136 6.268 6.522 644 HG2 GLN 681 HG2 GLN 681 8.212 5.968 7.159 645 HG3 GLN 681 HG1 GLN 681 9.136 7.399 7.599 646 HE21 GLN 681 HE21 GLN 681 6.860 7.106 5.816 647 HE22 GLN 681 HE22 GLN 681 7.366 7.716 4.281 648 H VAL 682 HN VAL 682 12.217 4.698 4.830 649 HA VAL 682 HA VAL 682 10.776 5.368 2.478 650 HB VAL 682 HB VAL 682 13.026 6.242 2.852 651 HG11 VAL 682 HG11 VAL 682 14.018 4.358 3.985 652 HG12 VAL 682 HG12 VAL 682 15.001 4.835 2.600 653 HG13 VAL 682 HG13 VAL 682 13.965 3.411 2.500 654 HG21 VAL 682 HG21 VAL 682 12.231 6.109 0.557 655 HG22 VAL 682 HG22 VAL 682 12.892 4.481 0.408 656 HG23 VAL 682 HG23 VAL 682 13.975 5.858 0.629 657 H GLY 683 HN GLY 683 12.005 2.361 3.764 658 HA2 GLY 683 HA2 GLY 683 11.481 0.201 3.185 659 HA3 GLY 683 HA1 GLY 683 10.292 0.857 2.075 660 H HIS 684 HN HIS 684 13.709 1.612 1.884 661 HA HIS 684 HA HIS 684 13.777 0.771 -0.835 662 HB2 HIS 684 HB2 HIS 684 16.129 1.420 -0.840 663 HB3 HIS 684 HB1 HIS 684 15.160 2.655 -0.054 664 HD2 HIS 684 HD2 HIS 684 17.674 -0.190 1.030 665 HE1 HIS 684 HE1 HIS 684 17.638 2.860 3.967 666 HE2 HIS 684 HE2 HIS 684 18.558 0.618 3.316 667 H SER 685 HN SER 685 15.368 -0.764 -1.725 668 HA SER 685 HA SER 685 14.932 -3.344 -0.821 669 HB2 SER 685 HB2 SER 685 17.211 -2.357 -2.550 670 HB3 SER 685 HB1 SER 685 16.621 -4.018 -2.461 671 HG SER 685 HG SER 685 14.693 -3.373 -3.367 672 HA PRO 686 HA PRO 686 17.753 -4.373 2.441 673 HB2 PRO 686 HB2 PRO 686 18.648 -6.717 0.849 674 HB3 PRO 686 HB1 PRO 686 17.953 -6.658 2.470 675 HG2 PRO 686 HG2 PRO 686 16.499 -7.508 0.422 676 HG3 PRO 686 HG1 PRO 686 15.778 -6.484 1.677 677 HD2 PRO 686 HD2 PRO 686 16.693 -5.746 -1.077 678 HD3 PRO 686 HD1 PRO 686 15.240 -5.232 -0.195 679 H CYS 687 HN CYS 687 20.090 -5.346 2.761 680 HA CYS 687 HA CYS 687 22.324 -5.135 2.579 681 HB2 CYS 687 HB2 CYS 687 22.435 -5.774 0.299 682 HB3 CYS 687 HB1 CYS 687 21.680 -4.276 -0.239 683 H HIS 688 HN HIS 688 20.809 -2.400 0.947 684 HA HIS 688 HA HIS 688 22.637 -0.494 1.979 685 HB2 HIS 688 HB2 HIS 688 21.222 -0.328 -0.138 686 HB3 HIS 688 HB1 HIS 688 19.857 0.030 0.907 687 HD1 HIS 688 HD1 HIS 688 19.712 2.304 -0.402 688 HD2 HIS 688 HD2 HIS 688 23.150 1.806 1.892 689 HE1 HIS 688 HE1 HIS 688 20.723 4.603 -0.183 690 H ILE 689 HN ILE 689 19.916 -2.100 3.257 691 HA ILE 689 HA ILE 689 19.235 -0.113 5.230 692 HB ILE 689 HB ILE 689 18.488 -3.050 5.177 693 HG12 ILE 689 HG12 ILE 689 16.931 -0.667 4.144 694 HG13 ILE 689 HG11 ILE 689 17.732 -1.873 3.142 695 HG21 ILE 689 HG21 ILE 689 16.657 -2.394 6.661 696 HG22 ILE 689 HG22 ILE 689 17.241 -0.729 6.648 697 HG23 ILE 689 HG23 ILE 689 18.226 -2.002 7.369 698 HD11 ILE 689 HD11 ILE 689 16.242 -3.595 4.028 699 HD12 ILE 689 HD12 ILE 689 15.342 -2.279 3.273 700 HD13 ILE 689 HD13 ILE 689 15.443 -2.385 5.031 701 H GLU 690 HN GLU 690 20.870 -3.230 5.178 702 HA GLU 690 HA GLU 690 21.328 -3.437 7.957 703 HB2 GLU 690 HB2 GLU 690 22.805 -4.817 5.715 704 HB3 GLU 690 HB1 GLU 690 22.841 -5.283 7.406 705 HG2 GLU 690 HG2 GLU 690 21.311 -6.770 6.592 706 HG3 GLU 690 HG1 GLU 690 20.245 -5.464 7.102 707 H ILE 691 HN ILE 691 23.425 -2.277 5.336 708 HA ILE 691 HA ILE 691 25.741 -2.025 6.937 709 HB ILE 691 HB ILE 691 25.073 -0.444 4.440 710 HG12 ILE 691 HG12 ILE 691 26.537 -3.083 4.727 711 HG13 ILE 691 HG11 ILE 691 24.906 -2.892 4.092 712 HG21 ILE 691 HG21 ILE 691 27.723 -1.102 5.730 713 HG22 ILE 691 HG22 ILE 691 26.942 0.479 5.713 714 HG23 ILE 691 HG23 ILE 691 27.506 -0.242 4.205 715 HD11 ILE 691 HD11 ILE 691 25.790 -1.585 2.227 716 HD12 ILE 691 HD12 ILE 691 26.527 -3.186 2.309 717 HD13 ILE 691 HD13 ILE 691 27.421 -1.773 2.872 718 H LEU 692 HN LEU 692 23.057 0.093 6.328 719 HA LEU 692 HA LEU 692 24.261 2.405 7.519 720 HB2 LEU 692 HB2 LEU 692 21.505 1.747 6.584 721 HB3 LEU 692 HB1 LEU 692 21.703 3.089 7.696 722 HG LEU 692 HG LEU 692 21.629 3.784 5.312 723 HD11 LEU 692 HD11 LEU 692 22.701 5.202 6.946 724 HD12 LEU 692 HD12 LEU 692 23.573 5.274 5.414 725 HD13 LEU 692 HD13 LEU 692 24.217 4.325 6.753 726 HD21 LEU 692 HD21 LEU 692 22.777 1.871 4.316 727 HD22 LEU 692 HD22 LEU 692 24.274 2.338 5.125 728 HD23 LEU 692 HD23 LEU 692 23.577 3.383 3.887 729 H GLU 693 HN GLU 693 22.153 -0.165 8.683 730 HA GLU 693 HA GLU 693 21.811 0.892 11.281 731 HB2 GLU 693 HB2 GLU 693 21.468 -1.809 10.054 732 HB3 GLU 693 HB1 GLU 693 21.492 -1.679 11.806 733 HG2 GLU 693 HG2 GLU 693 19.645 -0.118 10.021 734 HG3 GLU 693 HG1 GLU 693 19.222 -1.640 10.802 735 H GLN 694 HN GLN 694 24.368 -0.911 9.767 736 HA GLN 694 HA GLN 694 25.714 -1.614 12.178 737 HB2 GLN 694 HB2 GLN 694 26.124 -2.797 10.058 738 HB3 GLN 694 HB1 GLN 694 26.810 -1.330 9.374 739 HG2 GLN 694 HG2 GLN 694 28.613 -1.392 11.004 740 HG3 GLN 694 HG1 GLN 694 27.914 -2.835 11.735 741 HE21 GLN 694 HE21 GLN 694 29.733 -4.051 11.354 742 HE22 GLN 694 HE22 GLN 694 30.169 -4.607 9.777 743 H PHE 695 HN PHE 695 25.913 1.078 9.913 744 HA PHE 695 HA PHE 695 28.050 2.360 11.382 745 HB2 PHE 695 HB2 PHE 695 27.280 2.485 8.780 746 HB3 PHE 695 HB1 PHE 695 26.469 3.915 9.399 747 HD1 PHE 695 HD1 PHE 695 29.527 2.608 8.103 748 HD2 PHE 695 HD2 PHE 695 27.965 5.598 10.724 749 HE1 PHE 695 HE1 PHE 695 31.607 3.895 7.865 750 HE2 PHE 695 HE2 PHE 695 30.052 6.879 10.492 751 HZ PHE 695 HZ PHE 695 31.871 6.031 9.066 752 H GLU 696 HN GLU 696 24.909 1.890 12.052 753 HA GLU 696 HA GLU 696 23.435 2.726 13.567 754 HB2 GLU 696 HB2 GLU 696 25.519 2.945 14.930 755 HB3 GLU 696 HB1 GLU 696 25.679 4.594 14.351 756 HG2 GLU 696 HG2 GLU 696 23.456 5.081 15.384 757 HG3 GLU 696 HG1 GLU 696 23.512 3.470 16.104 758 H VAL 697 HN VAL 697 23.263 3.721 10.979 759 HA VAL 697 HA VAL 697 22.394 6.494 11.486 760 HB VAL 697 HB VAL 697 23.638 5.377 8.954 761 HG11 VAL 697 HG11 VAL 697 21.886 6.916 8.372 762 HG12 VAL 697 HG12 VAL 697 23.453 7.669 8.076 763 HG13 VAL 697 HG13 VAL 697 22.513 8.118 9.501 764 HG21 VAL 697 HG21 VAL 697 25.269 5.851 10.698 765 HG22 VAL 697 HG22 VAL 697 24.622 7.481 10.877 766 HG23 VAL 697 HG23 VAL 697 25.414 7.008 9.375 767 H LYS 698 HN LYS 698 20.304 6.922 10.842 768 HA LYS 698 HA LYS 698 18.965 5.027 9.036 769 HB2 LYS 698 HB2 LYS 698 17.830 6.362 11.499 770 HB3 LYS 698 HB1 LYS 698 16.832 5.606 10.269 771 HG2 LYS 698 HG2 LYS 698 17.911 3.453 10.728 772 HG3 LYS 698 HG1 LYS 698 18.893 4.226 11.977 773 HD2 LYS 698 HD2 LYS 698 16.930 4.779 13.257 774 HD3 LYS 698 HD1 LYS 698 15.879 4.199 11.967 775 HE2 LYS 698 HE2 LYS 698 16.015 2.569 13.763 776 HE3 LYS 698 HE1 LYS 698 16.735 1.933 12.288 777 HZ1 LYS 698 HZ1 LYS 698 18.005 1.506 14.362 778 HZ2 LYS 698 HZ2 LYS 698 18.336 3.158 14.468 779 HZ3 LYS 698 HZ3 LYS 698 18.896 2.253 13.145 780 H ALA 699 HN ALA 699 19.239 8.289 10.286 781 HA ALA 699 HA ALA 699 17.909 9.320 7.894 782 HB1 ALA 699 HB1 ALA 699 18.552 10.677 10.516 783 HB2 ALA 699 HB2 ALA 699 16.965 10.103 10.004 784 HB3 ALA 699 HB3 ALA 699 17.742 11.434 9.146 785 H TYR 700 HN TYR 700 19.043 10.490 6.442 786 HA TYR 700 HA TYR 700 21.549 11.690 7.062 787 HB2 TYR 700 HB2 TYR 700 22.968 10.360 5.564 788 HB3 TYR 700 HB1 TYR 700 22.330 9.377 6.874 789 HD1 TYR 700 HD1 TYR 700 22.152 10.053 3.259 790 HD2 TYR 700 HD2 TYR 700 20.855 7.520 6.421 791 HE1 TYR 700 HE1 TYR 700 21.352 8.418 1.606 792 HE2 TYR 700 HE2 TYR 700 20.051 5.875 4.778 793 HH TYR 700 HH TYR 700 19.309 5.863 2.403 794 H VAL 701 HN VAL 701 22.519 12.733 5.185 795 HA VAL 701 HA VAL 701 20.590 13.208 3.026 796 HB VAL 701 HB VAL 701 20.423 15.120 4.530 797 HG11 VAL 701 HG11 VAL 701 23.403 15.422 4.193 798 HG12 VAL 701 HG12 VAL 701 22.564 14.930 5.663 799 HG13 VAL 701 HG13 VAL 701 22.342 16.560 5.024 800 HG21 VAL 701 HG21 VAL 701 20.298 15.552 2.114 801 HG22 VAL 701 HG22 VAL 701 22.035 15.857 2.085 802 HG23 VAL 701 HG23 VAL 701 20.966 16.928 2.991 803 H ILE 702 HN ILE 702 21.437 13.212 1.022 804 HA ILE 702 HA ILE 702 24.378 13.124 0.796 805 HB ILE 702 HB ILE 702 22.436 11.665 -1.013 806 HG12 ILE 702 HG12 ILE 702 22.407 10.704 1.277 807 HG13 ILE 702 HG11 ILE 702 23.072 9.594 0.085 808 HG21 ILE 702 HG21 ILE 702 24.572 12.273 -2.038 809 HG22 ILE 702 HG22 ILE 702 24.422 10.528 -1.850 810 HG23 ILE 702 HG23 ILE 702 25.433 11.449 -0.737 811 HD11 ILE 702 HD11 ILE 702 24.654 11.259 2.029 812 HD12 ILE 702 HD12 ILE 702 25.327 10.145 0.837 813 HD13 ILE 702 HD13 ILE 702 24.330 9.530 2.155 814 H VAL 703 HN VAL 703 25.046 14.924 -0.200 815 HA VAL 703 HA VAL 703 23.386 15.939 -2.404 816 HB VAL 703 HB VAL 703 24.450 18.162 -2.067 817 HG11 VAL 703 HG11 VAL 703 23.208 18.766 -0.042 818 HG12 VAL 703 HG12 VAL 703 23.031 17.057 0.352 819 HG13 VAL 703 HG13 VAL 703 22.272 17.712 -1.099 820 HG21 VAL 703 HG21 VAL 703 26.508 17.458 -0.986 821 HG22 VAL 703 HG22 VAL 703 25.602 16.902 0.422 822 HG23 VAL 703 HG23 VAL 703 25.650 18.620 0.026 823 HA PRO 704 HA PRO 704 26.709 14.904 -5.087 824 HB2 PRO 704 HB2 PRO 704 26.014 16.342 -7.250 825 HB3 PRO 704 HB1 PRO 704 25.090 14.930 -6.724 826 HG2 PRO 704 HG2 PRO 704 24.524 17.835 -6.283 827 HG3 PRO 704 HG1 PRO 704 23.408 16.533 -6.736 828 HD2 PRO 704 HD2 PRO 704 23.654 17.479 -4.191 829 HD3 PRO 704 HD1 PRO 704 23.175 15.812 -4.572 830 H VAL 705 HN VAL 705 28.752 15.577 -5.276 831 HA VAL 705 HA VAL 705 29.281 18.465 -5.104 832 HB VAL 705 HB VAL 705 31.170 16.188 -4.445 833 HG11 VAL 705 HG11 VAL 705 32.592 17.949 -3.485 834 HG12 VAL 705 HG12 VAL 705 31.450 19.169 -4.052 835 HG13 VAL 705 HG13 VAL 705 32.335 18.180 -5.214 836 HG21 VAL 705 HG21 VAL 705 30.871 16.853 -2.103 837 HG22 VAL 705 HG22 VAL 705 29.352 16.315 -2.821 838 HG23 VAL 705 HG23 VAL 705 29.661 18.037 -2.595 839 H PHE 706 HN PHE 706 29.543 19.243 -7.083 840 HA PHE 706 HA PHE 706 30.911 17.628 -9.096 841 HB2 PHE 706 HB2 PHE 706 29.229 20.123 -9.317 842 HB3 PHE 706 HB1 PHE 706 30.134 19.454 -10.670 843 HD1 PHE 706 HD1 PHE 706 27.247 19.048 -8.483 844 HD2 PHE 706 HD2 PHE 706 29.463 17.361 -11.699 845 HE1 PHE 706 HE1 PHE 706 25.361 17.562 -9.000 846 HE2 PHE 706 HE2 PHE 706 27.577 15.871 -12.223 847 HZ PHE 706 HZ PHE 706 25.522 15.971 -10.872 848 H ALA 707 HN ALA 707 32.860 18.095 -9.832 849 HA ALA 707 HA ALA 707 33.996 20.734 -9.375 850 HB1 ALA 707 HB1 ALA 707 34.705 19.401 -7.438 851 HB2 ALA 707 HB2 ALA 707 36.071 19.812 -8.474 852 HB3 ALA 707 HB3 ALA 707 35.386 18.188 -8.525 853 H GLY 708 HN GLY 708 34.064 21.188 -11.502 854 HA2 GLY 708 HA2 GLY 708 35.499 21.193 -13.408 855 HA3 GLY 708 HA1 GLY 708 35.813 19.485 -13.129 856 H GLU 709 HN GLU 709 34.757 18.099 -14.355 857 HA GLU 709 HA GLU 709 32.295 19.023 -15.690 858 HB2 GLU 709 HB2 GLU 709 34.429 17.192 -16.778 859 HB3 GLU 709 HB1 GLU 709 32.954 17.656 -17.613 860 HG2 GLU 709 HG2 GLU 709 33.662 19.903 -17.804 861 HG3 GLU 709 HG1 GLU 709 35.010 19.640 -16.699 862 H GLN 710 HN GLN 710 33.648 16.751 -13.611 863 HA GLN 710 HA GLN 710 31.444 14.869 -14.127 864 HB2 GLN 710 HB2 GLN 710 34.239 14.235 -13.174 865 HB3 GLN 710 HB1 GLN 710 32.929 13.073 -13.301 866 HG2 GLN 710 HG2 GLN 710 34.139 14.605 -15.591 867 HG3 GLN 710 HG1 GLN 710 34.482 12.926 -15.174 868 HE21 GLN 710 HE21 GLN 710 33.386 14.050 -17.614 869 HE22 GLN 710 HE22 GLN 710 31.851 13.286 -17.848 870 H LEU 711 HN LEU 711 31.048 13.442 -12.180 871 HA LEU 711 HA LEU 711 30.639 15.101 -9.865 872 HB2 LEU 711 HB2 LEU 711 28.935 13.471 -10.689 873 HB3 LEU 711 HB1 LEU 711 30.034 12.167 -10.290 874 HG LEU 711 HG LEU 711 29.900 12.827 -7.903 875 HD11 LEU 711 HD11 LEU 711 28.130 14.367 -7.202 876 HD12 LEU 711 HD12 LEU 711 27.806 14.753 -8.892 877 HD13 LEU 711 HD13 LEU 711 29.359 15.173 -8.174 878 HD21 LEU 711 HD21 LEU 711 27.623 11.999 -7.539 879 HD22 LEU 711 HD22 LEU 711 28.466 11.064 -8.774 880 HD23 LEU 711 HD23 LEU 711 27.258 12.261 -9.245 881 H TRP 712 HN TRP 712 32.378 15.451 -8.669 882 HA TRP 712 HA TRP 712 34.606 13.665 -8.581 883 HB2 TRP 712 HB2 TRP 712 35.097 15.993 -8.505 884 HB3 TRP 712 HB1 TRP 712 33.974 16.263 -7.179 885 HD1 TRP 712 HD1 TRP 712 37.517 15.016 -7.901 886 HE1 TRP 712 HE1 TRP 712 38.827 14.883 -5.689 887 HE3 TRP 712 HE3 TRP 712 33.687 15.926 -4.620 888 HZ2 TRP 712 HZ2 TRP 712 38.305 15.130 -2.914 889 HZ3 TRP 712 HZ3 TRP 712 34.182 15.959 -2.202 890 HH2 TRP 712 HH2 TRP 712 36.431 15.571 -1.371 891 H GLY 713 HN GLY 713 31.709 13.855 -6.716 892 HA2 GLY 713 HA2 GLY 713 32.362 11.963 -4.910 893 HA3 GLY 713 HA1 GLY 713 32.939 13.455 -4.186 894 H LEU 714 HN LEU 714 31.372 12.646 -2.614 895 HA LEU 714 HA LEU 714 28.821 13.968 -3.028 896 HB2 LEU 714 HB2 LEU 714 29.094 11.113 -2.071 897 HB3 LEU 714 HB1 LEU 714 27.645 12.070 -1.853 898 HG LEU 714 HG LEU 714 28.820 11.263 -4.516 899 HD11 LEU 714 HD11 LEU 714 27.869 9.367 -3.322 900 HD12 LEU 714 HD12 LEU 714 26.856 9.817 -4.694 901 HD13 LEU 714 HD13 LEU 714 26.378 10.270 -3.057 902 HD21 LEU 714 HD21 LEU 714 26.701 12.116 -5.413 903 HD22 LEU 714 HD22 LEU 714 27.687 13.370 -4.660 904 HD23 LEU 714 HD23 LEU 714 26.289 12.713 -3.804 905 H LEU 715 HN LEU 715 27.882 14.641 -1.082 906 HA LEU 715 HA LEU 715 29.755 14.604 1.189 907 HB2 LEU 715 HB2 LEU 715 29.507 16.838 0.204 908 HB3 LEU 715 HB1 LEU 715 27.772 16.747 0.417 909 HG LEU 715 HG LEU 715 28.053 16.760 2.852 910 HD11 LEU 715 HD11 LEU 715 30.216 15.655 3.003 911 HD12 LEU 715 HD12 LEU 715 30.246 17.207 3.838 912 HD13 LEU 715 HD13 LEU 715 30.992 17.048 2.248 913 HD21 LEU 715 HD21 LEU 715 29.535 18.988 1.461 914 HD22 LEU 715 HD22 LEU 715 28.827 19.065 3.075 915 HD23 LEU 715 HD23 LEU 715 27.786 18.874 1.663 916 H ALA 716 HN ALA 716 29.046 13.168 2.586 917 HA ALA 716 HA ALA 716 26.151 12.889 2.968 918 HB1 ALA 716 HB1 ALA 716 28.360 10.938 3.584 919 HB2 ALA 716 HB2 ALA 716 27.298 10.888 2.176 920 HB3 ALA 716 HB3 ALA 716 26.631 10.656 3.791 921 H ALA 717 HN ALA 717 25.267 13.300 4.825 922 HA ALA 717 HA ALA 717 26.956 13.532 7.204 923 HB1 ALA 717 HB1 ALA 717 24.717 15.440 6.510 924 HB2 ALA 717 HB2 ALA 717 26.444 15.800 6.411 925 HB3 ALA 717 HB3 ALA 717 25.705 15.460 7.974 926 H TYR 718 HN TYR 718 26.193 12.501 8.915 927 HA TYR 718 HA TYR 718 23.533 11.245 8.649 928 HB2 TYR 718 HB2 TYR 718 25.760 10.077 10.266 929 HB3 TYR 718 HB1 TYR 718 24.387 9.264 9.526 930 HD1 TYR 718 HD1 TYR 718 27.841 9.989 9.272 931 HD2 TYR 718 HD2 TYR 718 24.405 9.157 6.905 932 HE1 TYR 718 HE1 TYR 718 29.294 9.318 7.411 933 HE2 TYR 718 HE2 TYR 718 25.852 8.484 5.035 934 HH TYR 718 HH TYR 718 29.098 7.821 5.372 935 H GLN 719 HN GLN 719 22.172 11.429 10.418 936 HA GLN 719 HA GLN 719 23.454 12.515 12.828 937 HB2 GLN 719 HB2 GLN 719 20.782 13.088 11.623 938 HB3 GLN 719 HB1 GLN 719 21.038 13.290 13.350 939 HG2 GLN 719 HG2 GLN 719 22.823 14.861 12.922 940 HG3 GLN 719 HG1 GLN 719 22.623 14.636 11.185 941 HE21 GLN 719 HE21 GLN 719 22.343 16.972 12.958 942 HE22 GLN 719 HE22 GLN 719 20.780 17.617 12.601 943 H ASN 720 HN ASN 720 23.899 10.655 13.721 944 HA ASN 720 HA ASN 720 23.504 8.551 14.678 945 HB2 ASN 720 HB2 ASN 720 22.126 10.505 16.526 946 HB3 ASN 720 HB1 ASN 720 22.919 9.000 16.985 947 HD21 ASN 720 HD21 ASN 720 23.460 11.744 17.830 948 HD22 ASN 720 HD22 ASN 720 25.119 12.040 17.437 949 H SER 721 HN SER 721 22.093 7.628 13.089 950 HA SER 721 HA SER 721 20.248 6.573 12.387 951 HB2 SER 721 HB2 SER 721 18.916 5.366 14.164 952 HB3 SER 721 HB1 SER 721 20.651 5.078 14.191 953 HG SER 721 HG SER 721 20.173 7.164 15.748 954 H GLY 722 HN GLY 722 18.150 7.243 15.026 955 HA2 GLY 722 HA2 GLY 722 16.331 8.617 15.263 956 HA3 GLY 722 HA1 GLY 722 17.154 9.761 14.219 957 H THR 723 HN THR 723 14.666 9.929 13.836 958 HA THR 723 HA THR 723 14.138 8.559 11.295 959 HB THR 723 HB THR 723 11.712 8.516 11.968 960 HG1 THR 723 HG1 THR 723 12.283 8.306 14.647 961 HG21 THR 723 HG21 THR 723 13.579 6.735 13.547 962 HG22 THR 723 HG22 THR 723 13.045 6.455 11.891 963 HG23 THR 723 HG23 THR 723 11.881 6.395 13.213 964 H ARG 724 HN ARG 724 15.020 11.195 12.311 965 HA ARG 724 HA ARG 724 12.844 13.037 11.967 966 HB2 ARG 724 HB2 ARG 724 14.452 14.776 12.411 967 HB3 ARG 724 HB1 ARG 724 14.674 13.468 13.562 968 HG2 ARG 724 HG2 ARG 724 16.586 12.658 12.250 969 HG3 ARG 724 HG1 ARG 724 16.369 14.001 11.127 970 HD2 ARG 724 HD2 ARG 724 17.037 14.189 14.061 971 HD3 ARG 724 HD1 ARG 724 18.120 14.527 12.712 972 HE ARG 724 HE ARG 724 15.848 16.169 12.496 973 HH11 ARG 724 HH11 ARG 724 18.715 15.785 14.473 974 HH12 ARG 724 HH12 ARG 724 18.765 17.438 14.969 975 HH21 ARG 724 HH21 ARG 724 15.912 18.375 13.129 976 HH22 ARG 724 HH22 ARG 724 17.168 18.917 14.190 977 H ASP 725 HN ASP 725 12.636 14.611 10.399 978 HA ASP 725 HA ASP 725 13.696 13.878 7.791 979 HB2 ASP 725 HB2 ASP 725 12.028 15.472 6.900 980 HB3 ASP 725 HB1 ASP 725 11.282 14.251 7.923 981 H TRP 726 HN TRP 726 14.648 15.474 6.416 982 HA TRP 726 HA TRP 726 16.326 17.261 7.961 983 HB2 TRP 726 HB2 TRP 726 16.549 16.252 5.126 984 HB3 TRP 726 HB1 TRP 726 17.670 17.400 5.857 985 HD1 TRP 726 HD1 TRP 726 16.496 13.742 6.264 986 HE1 TRP 726 HE1 TRP 726 18.361 12.420 7.429 987 HE3 TRP 726 HE3 TRP 726 19.721 17.591 7.236 988 HZ2 TRP 726 HZ2 TRP 726 20.885 12.938 8.601 989 HZ3 TRP 726 HZ3 TRP 726 21.841 17.088 8.378 990 HH2 TRP 726 HH2 TRP 726 22.408 14.811 9.044 991 H ASP 727 HN ASP 727 16.028 19.298 8.046 992 HA ASP 727 HA ASP 727 13.879 20.652 6.905 993 HB2 ASP 727 HB2 ASP 727 16.387 21.542 8.265 994 HB3 ASP 727 HB1 ASP 727 15.227 22.714 7.647 995 H GLU 728 HN GLU 728 13.586 21.684 5.116 996 HA GLU 728 HA GLU 728 15.259 21.445 2.866 997 HB2 GLU 728 HB2 GLU 728 13.003 23.362 3.431 998 HB3 GLU 728 HB1 GLU 728 13.781 23.206 1.864 999 HG2 GLU 728 HG2 GLU 728 12.445 20.927 3.289 1000 HG3 GLU 728 HG1 GLU 728 11.635 21.970 2.121 1001 H SER 729 HN SER 729 14.567 24.260 4.888 1002 HA SER 729 HA SER 729 16.225 26.163 3.932 1003 HB2 SER 729 HB2 SER 729 14.838 26.652 5.812 1004 HB3 SER 729 HB1 SER 729 15.643 25.441 6.804 1005 HG SER 729 HG SER 729 17.315 26.738 7.107 1006 H GLU 730 HN GLU 730 17.250 23.360 5.802 1007 HA GLU 730 HA GLU 730 19.927 24.433 6.081 1008 HB2 GLU 730 HB2 GLU 730 18.942 21.710 6.920 1009 HB3 GLU 730 HB1 GLU 730 20.392 22.539 7.467 1010 HG2 GLU 730 HG2 GLU 730 17.535 23.246 8.081 1011 HG3 GLU 730 HG1 GLU 730 18.771 22.681 9.202 1012 H VAL 731 HN VAL 731 18.241 21.876 4.349 1013 HA VAL 731 HA VAL 731 20.532 20.711 3.163 1014 HB VAL 731 HB VAL 731 17.668 20.723 2.159 1015 HG11 VAL 731 HG11 VAL 731 19.252 20.123 0.397 1016 HG12 VAL 731 HG12 VAL 731 18.288 18.730 0.890 1017 HG13 VAL 731 HG13 VAL 731 19.955 18.890 1.443 1018 HG21 VAL 731 HG21 VAL 731 17.887 19.787 4.406 1019 HG22 VAL 731 HG22 VAL 731 19.141 18.688 3.830 1020 HG23 VAL 731 HG23 VAL 731 17.490 18.537 3.228 1021 H THR 732 HN THR 732 18.627 23.540 2.394 1022 HA THR 732 HA THR 732 19.590 23.789 -0.294 1023 HB THR 732 HB THR 732 18.275 25.882 1.468 1024 HG1 THR 732 HG1 THR 732 16.922 24.062 1.218 1025 HG21 THR 732 HG21 THR 732 19.402 26.800 -0.518 1026 HG22 THR 732 HG22 THR 732 17.650 26.935 -0.658 1027 HG23 THR 732 HG23 THR 732 18.511 25.675 -1.543 1028 H LEU 733 HN LEU 733 20.441 25.001 2.900 1029 HA LEU 733 HA LEU 733 22.391 26.877 2.012 1030 HB2 LEU 733 HB2 LEU 733 21.234 26.899 4.250 1031 HB3 LEU 733 HB1 LEU 733 22.156 25.484 4.694 1032 HG LEU 733 HG LEU 733 23.579 28.018 3.920 1033 HD11 LEU 733 HD11 LEU 733 23.565 28.688 6.271 1034 HD12 LEU 733 HD12 LEU 733 22.481 27.350 6.649 1035 HD13 LEU 733 HD13 LEU 733 21.932 28.660 5.605 1036 HD21 LEU 733 HD21 LEU 733 25.281 27.137 5.441 1037 HD22 LEU 733 HD22 LEU 733 24.893 25.962 4.187 1038 HD23 LEU 733 HD23 LEU 733 24.246 25.759 5.814 1039 H LEU 734 HN LEU 734 22.353 23.512 2.955 1040 HA LEU 734 HA LEU 734 25.083 22.961 3.001 1041 HB2 LEU 734 HB2 LEU 734 23.367 21.425 3.811 1042 HB3 LEU 734 HB1 LEU 734 22.768 21.205 2.180 1043 HG LEU 734 HG LEU 734 24.878 20.107 1.556 1044 HD11 LEU 734 HD11 LEU 734 26.380 21.219 3.092 1045 HD12 LEU 734 HD12 LEU 734 26.466 19.472 3.311 1046 HD13 LEU 734 HD13 LEU 734 25.570 20.462 4.463 1047 HD21 LEU 734 HD21 LEU 734 24.532 18.052 2.823 1048 HD22 LEU 734 HD22 LEU 734 22.993 18.769 2.347 1049 HD23 LEU 734 HD23 LEU 734 23.568 18.935 4.006 1050 H ALA 735 HN ALA 735 22.769 22.953 0.306 1051 HA ALA 735 HA ALA 735 24.533 21.983 -1.663 1052 HB1 ALA 735 HB1 ALA 735 22.114 23.759 -1.994 1053 HB2 ALA 735 HB2 ALA 735 22.102 21.997 -1.948 1054 HB3 ALA 735 HB3 ALA 735 22.905 22.840 -3.274 1055 H ARG 736 HN ARG 736 23.819 25.225 -0.489 1056 HA ARG 736 HA ARG 736 25.245 26.667 -2.440 1057 HB2 ARG 736 HB2 ARG 736 24.523 27.316 0.415 1058 HB3 ARG 736 HB1 ARG 736 25.325 28.461 -0.651 1059 HG2 ARG 736 HG2 ARG 736 23.448 28.494 -2.131 1060 HG3 ARG 736 HG1 ARG 736 22.671 27.179 -1.248 1061 HD2 ARG 736 HD2 ARG 736 21.727 29.410 -0.718 1062 HD3 ARG 736 HD1 ARG 736 22.383 28.576 0.687 1063 HE ARG 736 HE ARG 736 24.458 30.053 0.059 1064 HH11 ARG 736 HH11 ARG 736 21.077 31.003 -0.017 1065 HH12 ARG 736 HH12 ARG 736 21.392 32.634 0.443 1066 HH21 ARG 736 HH21 ARG 736 24.882 32.231 0.641 1067 HH22 ARG 736 HH22 ARG 736 23.571 33.346 0.807 1068 H ILE 737 HN ILE 737 26.214 25.414 0.740 1069 HA ILE 737 HA ILE 737 28.872 26.377 0.639 1070 HB ILE 737 HB ILE 737 27.774 23.986 2.146 1071 HG12 ILE 737 HG12 ILE 737 26.655 26.091 2.743 1072 HG13 ILE 737 HG11 ILE 737 27.648 25.505 4.071 1073 HG21 ILE 737 HG21 ILE 737 29.738 24.253 3.611 1074 HG22 ILE 737 HG22 ILE 737 30.358 25.497 2.527 1075 HG23 ILE 737 HG23 ILE 737 30.185 23.838 1.956 1076 HD11 ILE 737 HD11 ILE 737 27.848 27.906 3.837 1077 HD12 ILE 737 HD12 ILE 737 28.364 27.723 2.161 1078 HD13 ILE 737 HD13 ILE 737 29.386 27.126 3.469 1079 H GLY 738 HN GLY 738 27.348 23.374 -0.419 1080 HA2 GLY 738 HA2 GLY 738 29.645 21.939 -1.134 1081 HA3 GLY 738 HA1 GLY 738 28.057 21.738 -1.864 1082 H ASN 739 HN ASN 739 27.795 24.363 -2.889 1083 HA ASN 739 HA ASN 739 29.083 24.147 -5.374 1084 HB2 ASN 739 HB2 ASN 739 27.057 25.416 -5.254 1085 HB3 ASN 739 HB1 ASN 739 27.716 26.475 -4.015 1086 HD21 ASN 739 HD21 ASN 739 27.674 25.707 -7.407 1087 HD22 ASN 739 HD22 ASN 739 28.436 27.161 -7.944 1088 H GLN 740 HN GLN 740 29.757 26.266 -2.604 1089 HA GLN 740 HA GLN 740 31.982 27.587 -3.697 1090 HB2 GLN 740 HB2 GLN 740 31.390 26.970 -0.798 1091 HB3 GLN 740 HB1 GLN 740 32.550 28.159 -1.371 1092 HG2 GLN 740 HG2 GLN 740 30.759 29.459 -2.364 1093 HG3 GLN 740 HG1 GLN 740 29.582 28.245 -1.863 1094 HE21 GLN 740 HE21 GLN 740 29.764 31.070 -1.192 1095 HE22 GLN 740 HE22 GLN 740 29.834 31.148 0.537 1096 H LEU 741 HN LEU 741 31.670 24.561 -1.967 1097 HA LEU 741 HA LEU 741 34.450 24.141 -1.550 1098 HB2 LEU 741 HB2 LEU 741 32.607 23.058 -0.250 1099 HB3 LEU 741 HB1 LEU 741 32.242 22.087 -1.660 1100 HG LEU 741 HG LEU 741 34.523 21.104 -1.522 1101 HD11 LEU 741 HD11 LEU 741 34.649 22.620 1.081 1102 HD12 LEU 741 HD12 LEU 741 35.641 22.916 -0.346 1103 HD13 LEU 741 HD13 LEU 741 35.803 21.402 0.541 1104 HD21 LEU 741 HD21 LEU 741 32.596 19.953 -0.560 1105 HD22 LEU 741 HD22 LEU 741 32.824 20.824 0.957 1106 HD23 LEU 741 HD23 LEU 741 34.046 19.677 0.406 1107 H GLY 742 HN GLY 742 32.144 23.165 -4.042 1108 HA2 GLY 742 HA2 GLY 742 33.984 21.495 -5.462 1109 HA3 GLY 742 HA1 GLY 742 32.445 22.097 -6.064 1110 H LEU 743 HN LEU 743 32.992 24.861 -5.679 1111 HA LEU 743 HA LEU 743 34.248 25.503 -8.104 1112 HB2 LEU 743 HB2 LEU 743 32.550 26.877 -6.821 1113 HB3 LEU 743 HB1 LEU 743 33.836 27.337 -5.732 1114 HG LEU 743 HG LEU 743 33.984 27.941 -8.685 1115 HD11 LEU 743 HD11 LEU 743 31.909 28.903 -7.861 1116 HD12 LEU 743 HD12 LEU 743 33.102 30.169 -8.158 1117 HD13 LEU 743 HD13 LEU 743 32.770 29.641 -6.509 1118 HD21 LEU 743 HD21 LEU 743 35.258 29.234 -6.268 1119 HD22 LEU 743 HD22 LEU 743 35.501 29.709 -7.950 1120 HD23 LEU 743 HD23 LEU 743 36.063 28.134 -7.388 1121 H ALA 744 HN ALA 744 35.368 25.849 -4.742 1122 HA ALA 744 HA ALA 744 37.931 26.823 -5.356 1123 HB1 ALA 744 HB1 ALA 744 38.520 26.227 -3.065 1124 HB2 ALA 744 HB2 ALA 744 37.063 25.241 -2.935 1125 HB3 ALA 744 HB3 ALA 744 36.930 26.990 -3.122 1126 H LEU 745 HN LEU 745 36.652 23.576 -5.084 1127 HA LEU 745 HA LEU 745 39.082 22.156 -5.105 1128 HB2 LEU 745 HB2 LEU 745 36.591 21.426 -4.685 1129 HB3 LEU 745 HB1 LEU 745 36.599 21.107 -6.402 1130 HG LEU 745 HG LEU 745 38.509 19.836 -4.438 1131 HD11 LEU 745 HD11 LEU 745 36.178 19.216 -4.000 1132 HD12 LEU 745 HD12 LEU 745 37.129 17.862 -4.609 1133 HD13 LEU 745 HD13 LEU 745 36.011 18.707 -5.680 1134 HD21 LEU 745 HD21 LEU 745 37.851 19.149 -7.306 1135 HD22 LEU 745 HD22 LEU 745 38.956 18.265 -6.253 1136 HD23 LEU 745 HD23 LEU 745 39.339 19.913 -6.749 1137 H GLN 746 HN GLN 746 36.865 23.089 -7.735 1138 HA GLN 746 HA GLN 746 38.428 21.959 -9.821 1139 HB2 GLN 746 HB2 GLN 746 36.010 22.521 -10.024 1140 HB3 GLN 746 HB1 GLN 746 36.431 24.227 -9.982 1141 HG2 GLN 746 HG2 GLN 746 37.776 23.895 -12.036 1142 HG3 GLN 746 HG1 GLN 746 37.205 22.229 -12.095 1143 HE21 GLN 746 HE21 GLN 746 36.834 24.359 -14.033 1144 HE22 GLN 746 HE22 GLN 746 35.124 24.563 -14.200 1145 H GLN 747 HN GLN 747 38.270 25.094 -8.295 1146 HA GLN 747 HA GLN 747 39.921 26.550 -10.045 1147 HB2 GLN 747 HB2 GLN 747 38.496 27.541 -8.261 1148 HB3 GLN 747 HB1 GLN 747 39.608 26.911 -7.057 1149 HG2 GLN 747 HG2 GLN 747 41.396 28.300 -8.021 1150 HG3 GLN 747 HG1 GLN 747 40.233 28.966 -9.168 1151 HE21 GLN 747 HE21 GLN 747 41.800 30.324 -7.130 1152 HE22 GLN 747 HE22 GLN 747 40.662 31.110 -6.096 1153 H THR 748 HN THR 748 40.646 24.534 -7.247 1154 HA THR 748 HA THR 748 43.377 25.118 -7.042 1155 HB THR 748 HB THR 748 41.947 22.556 -6.279 1156 HG1 THR 748 HG1 THR 748 41.053 24.341 -5.203 1157 HG21 THR 748 HG21 THR 748 44.397 22.290 -6.342 1158 HG22 THR 748 HG22 THR 748 43.795 22.255 -4.684 1159 HG23 THR 748 HG23 THR 748 44.574 23.708 -5.309 1160 H GLU 749 HN GLU 749 41.634 22.910 -9.149 1161 HA GLU 749 HA GLU 749 43.888 21.417 -9.993 1162 HB2 GLU 749 HB2 GLU 749 41.152 21.843 -11.150 1163 HB3 GLU 749 HB1 GLU 749 42.374 20.924 -12.019 1164 HG2 GLU 749 HG2 GLU 749 41.389 20.295 -9.245 1165 HG3 GLU 749 HG1 GLU 749 40.840 19.505 -10.724 1166 H TYR 750 HN TYR 750 42.616 24.508 -10.945 1167 HA TYR 750 HA TYR 750 44.233 24.606 -13.350 1168 HB2 TYR 750 HB2 TYR 750 42.600 26.768 -12.003 1169 HB3 TYR 750 HB1 TYR 750 43.396 26.926 -13.562 1170 HD1 TYR 750 HD1 TYR 750 40.344 26.407 -12.073 1171 HD2 TYR 750 HD2 TYR 750 42.748 24.845 -15.212 1172 HE1 TYR 750 HE1 TYR 750 38.331 25.530 -13.167 1173 HE2 TYR 750 HE2 TYR 750 40.737 23.960 -16.318 1174 HH TYR 750 HH TYR 750 38.451 23.291 -15.712 1175 H LEU 751 HN LEU 751 44.325 25.789 -10.069 1176 HA LEU 751 HA LEU 751 46.599 27.480 -10.539 1177 HB2 LEU 751 HB2 LEU 751 44.974 26.763 -8.144 1178 HB3 LEU 751 HB1 LEU 751 46.563 27.457 -7.908 1179 HG LEU 751 HG LEU 751 44.856 29.177 -7.763 1180 HD11 LEU 751 HD11 LEU 751 46.440 29.451 -10.307 1181 HD12 LEU 751 HD12 LEU 751 47.038 29.774 -8.681 1182 HD13 LEU 751 HD13 LEU 751 45.741 30.758 -9.356 1183 HD21 LEU 751 HD21 LEU 751 43.473 29.794 -9.669 1184 HD22 LEU 751 HD22 LEU 751 43.151 28.128 -9.184 1185 HD23 LEU 751 HD23 LEU 751 44.141 28.458 -10.604 1186 H GLN 752 HN GLN 752 46.084 24.375 -8.873 1187 HA GLN 752 HA GLN 752 48.923 24.162 -8.380 1188 HB2 GLN 752 HB2 GLN 752 47.358 23.316 -6.686 1189 HB3 GLN 752 HB1 GLN 752 46.710 22.169 -7.850 1190 HG2 GLN 752 HG2 GLN 752 48.866 21.049 -7.976 1191 HG3 GLN 752 HG1 GLN 752 49.551 22.217 -6.851 1192 HE21 GLN 752 HE21 GLN 752 49.318 19.317 -6.675 1193 HE22 GLN 752 HE22 GLN 752 48.473 18.992 -5.208 1194 H GLN 753 HN GLN 753 50.054 23.881 -10.160 1195 HA GLN 753 HA GLN 753 49.356 21.596 -11.856 1196 HB2 GLN 753 HB2 GLN 753 50.388 22.786 -13.755 1197 HB3 GLN 753 HB1 GLN 753 49.012 23.661 -13.101 1198 HG2 GLN 753 HG2 GLN 753 50.305 25.461 -13.026 1199 HG3 GLN 753 HG1 GLN 753 51.207 24.676 -11.731 1200 HE21 GLN 753 HE21 GLN 753 53.163 23.668 -12.205 1201 HE22 GLN 753 HE22 GLN 753 54.027 23.975 -13.674 1202 H VAL 754 HN VAL 754 50.903 20.118 -12.156 1203 HA VAL 754 HA VAL 754 53.602 20.766 -11.269 1204 HB VAL 754 HB VAL 754 52.544 19.625 -9.393 1205 HG11 VAL 754 HG11 VAL 754 51.742 17.308 -9.579 1206 HG12 VAL 754 HG12 VAL 754 51.952 17.394 -11.328 1207 HG13 VAL 754 HG13 VAL 754 50.777 18.438 -10.530 1208 HG21 VAL 754 HG21 VAL 754 54.892 19.176 -9.764 1209 HG22 VAL 754 HG22 VAL 754 54.492 17.851 -10.857 1210 HG23 VAL 754 HG23 VAL 754 54.096 17.729 -9.143 1211 HHA CYC 800 HHA CYC 800 19.873 2.904 -4.090 1212 HMA1 CYC 800 HMA1 CYC 800 22.568 7.020 -0.937 1213 HMA2 CYC 800 HMA2 CYC 800 21.697 7.485 -2.454 1214 HMA3 CYC 800 HMA3 CYC 800 23.493 7.390 -2.450 1215 HAA1 CYC 800 HAA1 CYC 800 19.393 4.995 -3.405 1216 HAA2 CYC 800 HAA2 CYC 800 20.059 6.527 -2.769 1217 HBA1 CYC 800 HBA1 CYC 800 20.564 5.384 -5.598 1218 HBA2 CYC 800 HBA2 CYC 800 21.207 6.950 -4.970 1219 HHB CYC 800 HHB CYC 800 25.686 4.525 -2.204 1220 HB CYC 800 HB CYC 800 23.362 6.264 0.412 1221 HMB1 CYC 800 HMB1 CYC 800 28.007 5.745 -1.243 1222 HMB2 CYC 800 HMB2 CYC 800 28.550 4.995 0.323 1223 HMB3 CYC 800 HMB3 CYC 800 27.508 4.046 -0.826 1224 HAB1 CYC 800 HAB1 CYC 800 27.914 5.548 2.794 1225 HAB2 CYC 800 HAB2 CYC 800 26.835 6.859 3.440 1226 HBB1 CYC 800 HBB1 CYC 800 29.097 7.803 2.770 1227 HBB2 CYC 800 HBB2 CYC 800 28.866 7.162 1.102 1228 HBB3 CYC 800 HBB3 CYC 800 27.778 8.463 1.729 1229 HC CYC 800 HC CYC 800 23.944 -0.132 -1.842 1230 H2C CYC 800 H2C CYC 800 26.213 -3.195 -0.524 1231 H3C CYC 800 H3C CYC 800 25.206 -3.672 -3.325 1232 HMC1 CYC 800 HMC1 CYC 800 27.099 -2.162 -3.303 1233 HMC2 CYC 800 HMC2 CYC 800 28.107 -2.046 -1.815 1234 HMC3 CYC 800 HMC3 CYC 800 27.680 -3.657 -2.500 1235 HAC1 CYC 800 HAC CYC 800 24.820 -5.287 -1.616 1236 HBC1 CYC 800 HBC1 CYC 800 23.018 -4.921 -3.356 1237 HBC2 CYC 800 HBC2 CYC 800 22.061 -4.004 -2.129 1238 HBC3 CYC 800 HBC3 CYC 800 22.445 -5.749 -1.870 1239 HHD CYC 800 HHD CYC 800 22.561 -2.961 -3.897 1240 HD CYC 800 HD CYC 800 23.078 0.790 -3.157 1241 HMD1 CYC 800 HMD1 CYC 800 20.481 -3.173 -4.217 1242 HMD2 CYC 800 HMD2 CYC 800 18.929 -2.433 -3.673 1243 HMD3 CYC 800 HMD3 CYC 800 19.449 -2.277 -5.396 1244 HAD1 CYC 800 HAD1 CYC 800 18.566 1.575 -4.930 1245 HAD2 CYC 800 HAD2 CYC 800 18.194 -0.168 -5.131 1246 HBD1 CYC 800 HBD1 CYC 800 16.609 0.855 -3.507 1247 HBD2 CYC 800 HBD2 CYC 800 17.674 -0.333 -2.657 1248 HA CYC 800 HA CYC 800 23.692 2.645 -2.883
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