NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
598530 | 2n9e | 25901 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 ACE 36 HH32 ACE 36 14.032 16.336 -45.703 2 H2 ACE 36 HH33 ACE 36 12.723 17.510 -45.206 3 H3 ACE 36 HH31 ACE 36 13.781 16.573 -44.050 4 H GLU 37 H GLU 37 12.337 15.526 -46.976 5 HA GLU 37 HA GLU 37 10.148 13.896 -45.967 6 HB2 GLU 37 HB2 GLU 37 9.841 14.447 -48.189 7 HB3 GLU 37 HB3 GLU 37 11.485 13.865 -48.604 8 HG2 GLU 37 HG2 GLU 37 9.980 12.253 -49.381 9 HG3 GLU 37 HG3 GLU 37 10.920 11.637 -48.139 10 H ASP 38 H ASP 38 13.484 13.328 -46.514 11 HA ASP 38 HA ASP 38 13.516 10.435 -45.719 12 HB2 ASP 38 HB2 ASP 38 14.264 10.778 -47.747 13 HB3 ASP 38 HB3 ASP 38 15.651 11.846 -47.140 14 H ALA 39 H ALA 39 13.328 12.780 -43.579 15 HA ALA 39 HA ALA 39 15.860 12.813 -42.169 16 HB1 ALA 39 HB1 ALA 39 13.119 13.744 -41.522 17 HB2 ALA 39 HB2 ALA 39 14.471 14.125 -40.505 18 HB3 ALA 39 HB3 ALA 39 14.357 14.734 -42.253 19 H PHE 40 H PHE 40 15.517 10.260 -42.355 20 HA PHE 40 HA PHE 40 14.373 9.055 -39.835 21 HB2 PHE 40 HB2 PHE 40 12.710 9.835 -41.869 22 HB3 PHE 40 HB3 PHE 40 13.109 8.405 -42.534 23 HD1 PHE 40 HD2 PHE 40 13.097 6.164 -40.650 24 HD2 PHE 40 HD1 PHE 40 10.935 9.889 -40.397 25 HE1 PHE 40 HE2 PHE 40 11.693 5.143 -38.908 26 HE2 PHE 40 HE1 PHE 40 9.401 8.881 -38.629 27 HZ PHE 40 HZ PHE 40 9.817 6.484 -37.939 28 H ILE 41 H ILE 41 15.439 7.342 -39.374 29 HA ILE 41 HA ILE 41 16.823 5.800 -41.442 30 HB ILE 41 HB ILE 41 18.432 6.965 -39.289 31 HG12 ILE 41 HG12 ILE 41 18.583 7.526 -42.222 32 HG13 ILE 41 HG13 ILE 41 18.114 8.694 -40.942 33 HG21 ILE 41 HG21 ILE 41 19.140 5.133 -41.707 34 HG22 ILE 41 HG22 ILE 41 20.235 5.689 -40.487 35 HG23 ILE 41 HG23 ILE 41 18.865 4.557 -40.090 36 HD11 ILE 41 HD11 ILE 41 20.248 9.113 -41.559 37 HD12 ILE 41 HD12 ILE 41 20.287 8.631 -39.878 38 HD13 ILE 41 HD13 ILE 41 20.950 7.549 -41.156 39 H VAL 42 H VAL 42 16.682 3.592 -40.655 40 HA VAL 42 HA VAL 42 15.700 3.281 -37.904 41 HB VAL 42 HB VAL 42 15.270 1.223 -40.072 42 HG11 VAL 42 HG11 VAL 42 13.399 0.667 -38.579 43 HG12 VAL 42 HG12 VAL 42 14.641 1.092 -37.405 44 HG13 VAL 42 HG13 VAL 42 13.469 2.379 -37.860 45 HG21 VAL 42 HG21 VAL 42 13.792 3.722 -39.576 46 HG22 VAL 42 HG22 VAL 42 14.509 3.173 -41.098 47 HG23 VAL 42 HG23 VAL 42 13.129 2.405 -40.443 48 H ILE 43 H ILE 43 17.017 1.986 -36.496 49 HA ILE 43 HA ILE 43 19.441 0.566 -37.554 50 HB ILE 43 HB ILE 43 19.502 2.868 -35.516 51 HG12 ILE 43 HG12 ILE 43 20.264 2.620 -38.527 52 HG13 ILE 43 HG13 ILE 43 19.204 3.798 -37.785 53 HG21 ILE 43 HG21 ILE 43 21.470 0.957 -36.710 54 HG22 ILE 43 HG22 ILE 43 21.970 2.448 -35.845 55 HG23 ILE 43 HG23 ILE 43 21.129 1.089 -34.996 56 HD11 ILE 43 HD11 ILE 43 21.212 4.984 -38.251 57 HD12 ILE 43 HD12 ILE 43 21.266 4.711 -36.448 58 HD13 ILE 43 HD13 ILE 43 22.272 3.779 -37.486 59 H SEP 44 H SEP 44 20.084 -1.331 -36.565 60 HA SEP 44 HA SEP 44 19.621 -1.568 -33.650 61 HB2 SEP 44 HB2 SEP 44 18.419 -3.532 -33.633 62 HB3 SEP 44 HB3 SEP 44 17.578 -2.676 -34.906 63 H ASP 45 H ASP 45 20.736 -3.633 -32.946 64 HA ASP 45 HA ASP 45 23.476 -3.859 -34.348 65 HB2 ASP 45 HB2 ASP 45 23.233 -1.799 -32.989 66 HB3 ASP 45 HB3 ASP 45 23.274 -2.694 -31.549 67 H SEP 46 H SEP 46 21.957 -6.035 -34.351 68 HA SEP 46 HA SEP 46 24.024 -7.746 -33.253 69 HB2 SEP 46 HB2 SEP 46 22.732 -9.435 -32.095 70 HB3 SEP 46 HB3 SEP 46 22.368 -7.909 -31.420 71 H ASP 47 H ASP 47 24.587 -9.018 -34.711 72 HA ASP 47 HA ASP 47 22.903 -9.655 -36.969 73 HB2 ASP 47 HB2 ASP 47 24.321 -7.660 -37.547 74 HB3 ASP 47 HB3 ASP 47 25.849 -8.591 -37.229 75 H GLY 48 H GLY 48 23.546 -11.527 -38.354 76 HA2 GLY 48 HA2 GLY 48 25.904 -12.971 -37.806 77 HA3 GLY 48 HA3 GLY 48 24.550 -13.655 -36.817 78 H GLU 49 H GLU 49 26.240 -14.754 -39.075 79 HA GLU 49 HA GLU 49 24.533 -15.044 -41.409 80 HB2 GLU 49 HB2 GLU 49 26.997 -15.191 -41.378 81 HB3 GLU 49 HB3 GLU 49 26.812 -16.736 -40.431 82 HG2 GLU 49 HG2 GLU 49 27.151 -17.570 -42.632 83 HG3 GLU 49 HG3 GLU 49 25.569 -17.705 -42.489 84 HN1 NH2 50 HN1 NH2 50 24.498 -16.879 -38.398 85 HN2 NH2 50 HN2 NH2 50 23.497 -18.175 -38.921 86 H1 MET 1 H1 MET 1 -8.257 -32.690 -43.126 87 H2 MET 1 H2 MET 1 -8.252 -31.187 -43.842 88 H3 MET 1 H3 MET 1 -9.628 -32.101 -43.819 89 HA MET 1 HA MET 1 -10.113 -30.731 -42.374 90 HB2 MET 1 HB2 MET 1 -8.510 -32.630 -40.560 91 HB3 MET 1 HB3 MET 1 -9.874 -31.733 -40.029 92 HG2 MET 1 HG2 MET 1 -11.337 -32.977 -41.632 93 HG3 MET 1 HG3 MET 1 -10.018 -34.016 -42.049 94 HE1 MET 1 HE1 MET 1 -11.226 -36.303 -41.422 95 HE2 MET 1 HE2 MET 1 -12.525 -36.370 -40.240 96 HE3 MET 1 HE3 MET 1 -12.442 -35.140 -41.595 97 H ALA 2 H ALA 2 -9.591 -29.415 -40.464 98 HA ALA 2 HA ALA 2 -7.343 -27.630 -41.122 99 HB1 ALA 2 HB1 ALA 2 -9.321 -27.649 -38.862 100 HB2 ALA 2 HB2 ALA 2 -8.417 -26.287 -39.350 101 HB3 ALA 2 HB3 ALA 2 -9.598 -26.905 -40.496 102 H ASP 3 H ASP 3 -5.543 -27.352 -40.178 103 HA ASP 3 HA ASP 3 -4.652 -29.310 -38.141 104 HB2 ASP 3 HB2 ASP 3 -3.454 -28.934 -40.360 105 HB3 ASP 3 HB3 ASP 3 -2.888 -27.429 -39.762 106 H GLU 4 H GLU 4 -6.321 -27.038 -37.390 107 HA GLU 4 HA GLU 4 -4.957 -24.872 -36.186 108 HB2 GLU 4 HB2 GLU 4 -7.329 -24.876 -36.818 109 HB3 GLU 4 HB3 GLU 4 -7.698 -25.989 -35.514 110 HG2 GLU 4 HG2 GLU 4 -8.320 -23.648 -34.886 111 HG3 GLU 4 HG3 GLU 4 -7.103 -24.223 -33.781 112 H LYS 5 H LYS 5 -4.426 -24.336 -34.298 113 HA LYS 5 HA LYS 5 -4.730 -25.775 -31.741 114 HB2 LYS 5 HB2 LYS 5 -2.552 -26.775 -32.997 115 HB3 LYS 5 HB3 LYS 5 -1.846 -25.238 -32.556 116 HG2 LYS 5 HG2 LYS 5 -2.215 -25.788 -30.216 117 HG3 LYS 5 HG3 LYS 5 -3.246 -27.170 -30.545 118 HD2 LYS 5 HD2 LYS 5 -1.440 -28.298 -31.645 119 HD3 LYS 5 HD3 LYS 5 -0.264 -27.227 -31.069 120 HE2 LYS 5 HE2 LYS 5 -2.076 -28.361 -28.880 121 HE3 LYS 5 HE3 LYS 5 -0.667 -29.167 -29.505 122 HZ1 LYS 5 HZ1 LYS 5 -0.484 -27.574 -27.531 123 HZ2 LYS 5 HZ2 LYS 5 0.644 -27.356 -28.747 124 HZ3 LYS 5 HZ3 LYS 5 -0.667 -26.384 -28.570 125 HA PRO 6 HA PRO 6 -4.624 -21.539 -30.461 126 HB2 PRO 6 HB2 PRO 6 -4.482 -22.998 -27.705 127 HB3 PRO 6 HB3 PRO 6 -5.335 -21.513 -28.086 128 HG2 PRO 6 HG2 PRO 6 -6.606 -23.976 -27.974 129 HG3 PRO 6 HG3 PRO 6 -7.116 -22.915 -29.172 130 HD2 PRO 6 HD2 PRO 6 -5.181 -25.182 -29.343 131 HD3 PRO 6 HD3 PRO 6 -6.406 -24.577 -30.482 132 H LYS 7 H LYS 7 -2.958 -20.164 -29.780 133 HA LYS 7 HA LYS 7 -0.274 -21.312 -29.190 134 HB2 LYS 7 HB2 LYS 7 -1.016 -19.936 -31.206 135 HB3 LYS 7 HB3 LYS 7 -0.685 -18.535 -30.319 136 HG2 LYS 7 HG2 LYS 7 1.412 -19.534 -29.331 137 HG3 LYS 7 HG3 LYS 7 1.539 -20.646 -30.565 138 HD2 LYS 7 HD2 LYS 7 1.282 -19.206 -32.478 139 HD3 LYS 7 HD3 LYS 7 1.432 -17.732 -31.410 140 HE2 LYS 7 HE2 LYS 7 3.494 -18.445 -30.449 141 HE3 LYS 7 HE3 LYS 7 3.544 -19.852 -31.538 142 HZ1 LYS 7 HZ1 LYS 7 3.448 -17.031 -32.433 143 HZ2 LYS 7 HZ2 LYS 7 4.760 -18.005 -32.575 144 HZ3 LYS 7 HZ3 LYS 7 3.405 -18.360 -33.413 145 H GLU 8 H GLU 8 0.947 -20.680 -27.546 146 HA GLU 8 HA GLU 8 -0.503 -19.832 -25.148 147 HB2 GLU 8 HB2 GLU 8 1.668 -21.315 -25.278 148 HB3 GLU 8 HB3 GLU 8 2.459 -19.822 -25.651 149 HG2 GLU 8 HG2 GLU 8 2.274 -18.934 -23.421 150 HG3 GLU 8 HG3 GLU 8 1.359 -20.318 -22.872 151 H GLY 9 H GLY 9 -0.766 -17.846 -24.186 152 HA2 GLY 9 HA2 GLY 9 -0.232 -15.518 -25.547 153 HA3 GLY 9 HA3 GLY 9 -0.873 -15.530 -23.890 154 H VAL 10 H VAL 10 2.347 -16.707 -24.682 155 HA VAL 10 HA VAL 10 3.856 -14.332 -23.471 156 HB VAL 10 HB VAL 10 4.611 -17.223 -23.748 157 HG11 VAL 10 HG11 VAL 10 5.853 -15.151 -21.980 158 HG12 VAL 10 HG12 VAL 10 6.398 -16.798 -22.323 159 HG13 VAL 10 HG13 VAL 10 6.511 -15.454 -23.561 160 HG21 VAL 10 HG21 VAL 10 4.340 -17.289 -21.220 161 HG22 VAL 10 HG22 VAL 10 3.366 -15.783 -21.333 162 HG23 VAL 10 HG23 VAL 10 2.850 -17.208 -22.110 163 H LYS 11 H LYS 11 5.332 -13.276 -24.607 164 HA LYS 11 HA LYS 11 6.528 -14.467 -27.149 165 HB2 LYS 11 HB2 LYS 11 4.465 -12.766 -27.523 166 HB3 LYS 11 HB3 LYS 11 5.722 -11.570 -27.032 167 HG2 LYS 11 HG2 LYS 11 7.211 -12.224 -28.743 168 HG3 LYS 11 HG3 LYS 11 6.113 -13.661 -29.177 169 HD2 LYS 11 HD2 LYS 11 4.248 -12.074 -29.673 170 HD3 LYS 11 HD3 LYS 11 5.512 -10.736 -29.587 171 HE2 LYS 11 HE2 LYS 11 6.735 -12.564 -31.137 172 HE3 LYS 11 HE3 LYS 11 5.012 -12.901 -31.518 173 HZ1 LYS 11 HZ1 LYS 11 5.553 -11.401 -33.055 174 HZ2 LYS 11 HZ2 LYS 11 4.795 -10.483 -31.935 175 HZ3 LYS 11 HZ3 LYS 11 6.348 -10.276 -32.137 176 H THR 12 H THR 12 8.230 -15.157 -25.811 177 HA THR 12 HA THR 12 9.682 -13.222 -24.208 178 HB THR 12 HB THR 12 11.519 -15.027 -24.236 179 HG1 THR 12 HG1 THR 12 11.059 -16.330 -26.027 180 HG21 THR 12 HG21 THR 12 10.345 -16.698 -22.801 181 HG22 THR 12 HG22 THR 12 9.970 -15.032 -22.412 182 HG23 THR 12 HG23 THR 12 8.802 -16.027 -23.280 183 H GLU 13 H GLU 13 10.140 -14.091 -27.685 184 HA GLU 13 HA GLU 13 12.708 -12.881 -27.564 185 HB2 GLU 13 HB2 GLU 13 11.250 -14.001 -30.017 186 HB3 GLU 13 HB3 GLU 13 12.859 -13.255 -29.973 187 HG2 GLU 13 HG2 GLU 13 13.003 -15.662 -30.112 188 HG3 GLU 13 HG3 GLU 13 13.663 -15.073 -28.562 189 H ASN 14 H ASN 14 10.133 -11.124 -27.056 190 HA ASN 14 HA ASN 14 10.382 -8.883 -28.926 191 HB2 ASN 14 HB2 ASN 14 9.210 -9.144 -26.200 192 HB3 ASN 14 HB3 ASN 14 9.148 -7.604 -27.050 193 HD21 ASN 14 HD22 ASN 14 7.378 -9.709 -26.133 194 HD22 ASN 14 HD21 ASN 14 6.072 -9.763 -27.318 195 H ASN 15 H ASN 15 11.399 -6.726 -28.480 196 HA ASN 15 HA ASN 15 12.959 -6.470 -25.997 197 HB2 ASN 15 HB2 ASN 15 14.240 -6.859 -28.386 198 HB3 ASN 15 HB3 ASN 15 13.884 -5.223 -28.599 199 HD21 ASN 15 HD22 ASN 15 16.665 -6.754 -28.032 200 HD22 ASN 15 HD21 ASN 15 17.090 -6.328 -26.446 201 H ASP 16 H ASP 16 13.291 -4.136 -25.582 202 HA ASP 16 HA ASP 16 10.978 -2.442 -26.235 203 HB2 ASP 16 HB2 ASP 16 13.389 -1.443 -24.682 204 HB3 ASP 16 HB3 ASP 16 11.644 -1.077 -24.390 205 H HIS 17 H HIS 17 10.773 -0.785 -27.639 206 HA HIS 17 HA HIS 17 13.206 0.266 -29.013 207 HB2 HIS 17 HB2 HIS 17 10.322 0.311 -29.850 208 HB3 HIS 17 HB3 HIS 17 11.603 1.272 -30.725 209 HD2 HIS 17 HD2 HIS 17 13.835 -0.242 -31.592 210 HE1 HIS 17 HE1 HIS 17 11.573 -3.776 -32.233 211 HE2 HIS 17 HE2 HIS 17 13.670 -2.574 -32.854 212 H ILE 18 H ILE 18 13.851 2.433 -29.090 213 HA ILE 18 HA ILE 18 12.002 4.406 -27.865 214 HB ILE 18 HB ILE 18 13.757 3.662 -26.399 215 HG12 ILE 18 HG12 ILE 18 14.541 6.450 -27.031 216 HG13 ILE 18 HG13 ILE 18 12.883 6.017 -26.523 217 HG21 ILE 18 HG21 ILE 18 15.585 3.204 -28.400 218 HG22 ILE 18 HG22 ILE 18 15.988 4.849 -28.056 219 HG23 ILE 18 HG23 ILE 18 15.993 3.712 -26.747 220 HD11 ILE 18 HD11 ILE 18 13.838 5.088 -24.406 221 HD12 ILE 18 HD12 ILE 18 15.429 5.118 -25.052 222 HD13 ILE 18 HD13 ILE 18 14.562 6.665 -24.757 223 H ASN 19 H ASN 19 11.927 6.519 -28.740 224 HA ASN 19 HA ASN 19 12.933 6.736 -31.441 225 HB2 ASN 19 HB2 ASN 19 10.884 8.318 -29.822 226 HB3 ASN 19 HB3 ASN 19 11.427 8.541 -31.489 227 HD21 ASN 19 HD22 ASN 19 9.641 6.513 -29.390 228 HD22 ASN 19 HD21 ASN 19 8.673 5.806 -30.674 229 H LEU 20 H LEU 20 15.188 7.742 -31.466 230 HA LEU 20 HA LEU 20 15.368 10.241 -29.940 231 HB2 LEU 20 HB2 LEU 20 17.544 8.188 -30.819 232 HB3 LEU 20 HB3 LEU 20 17.977 9.697 -29.939 233 HG LEU 20 HG LEU 20 16.279 7.549 -28.658 234 HD11 LEU 20 HD11 LEU 20 19.163 8.510 -28.232 235 HD12 LEU 20 HD12 LEU 20 18.270 7.400 -27.199 236 HD13 LEU 20 HD13 LEU 20 18.668 6.983 -28.832 237 HD21 LEU 20 HD21 LEU 20 16.730 9.023 -26.622 238 HD22 LEU 20 HD22 LEU 20 17.461 10.184 -27.691 239 HD23 LEU 20 HD23 LEU 20 15.745 9.936 -27.878 240 H LYS 21 H LYS 21 16.058 12.022 -30.771 241 HA LYS 21 HA LYS 21 16.702 12.221 -33.643 242 HB2 LYS 21 HB2 LYS 21 16.048 14.281 -31.456 243 HB3 LYS 21 HB3 LYS 21 16.668 14.786 -32.987 244 HG2 LYS 21 HG2 LYS 21 14.023 13.463 -32.673 245 HG3 LYS 21 HG3 LYS 21 14.285 15.146 -32.504 246 HD2 LYS 21 HD2 LYS 21 15.199 14.985 -35.039 247 HD3 LYS 21 HD3 LYS 21 14.379 13.353 -34.968 248 HE2 LYS 21 HE2 LYS 21 13.264 16.175 -34.853 249 HE3 LYS 21 HE3 LYS 21 13.012 14.935 -36.093 250 HZ1 LYS 21 HZ1 LYS 21 11.111 14.827 -34.861 251 HZ2 LYS 21 HZ2 LYS 21 11.828 13.689 -34.079 252 HZ3 LYS 21 HZ3 LYS 21 11.881 15.160 -33.408 253 H VAL 22 H VAL 22 18.415 13.391 -34.470 254 HA VAL 22 HA VAL 22 20.614 14.245 -32.663 255 HB VAL 22 HB VAL 22 20.972 12.921 -35.284 256 HG11 VAL 22 HG11 VAL 22 23.037 13.817 -33.166 257 HG12 VAL 22 HG12 VAL 22 23.381 12.862 -34.656 258 HG13 VAL 22 HG13 VAL 22 22.743 14.577 -34.615 259 HG21 VAL 22 HG21 VAL 22 20.279 11.379 -33.587 260 HG22 VAL 22 HG22 VAL 22 22.046 11.041 -33.883 261 HG23 VAL 22 HG23 VAL 22 21.399 11.957 -32.395 262 H ALA 23 H ALA 23 20.701 16.141 -32.859 263 HA ALA 23 HA ALA 23 19.796 17.735 -35.195 264 HB1 ALA 23 HB1 ALA 23 18.927 19.391 -33.542 265 HB2 ALA 23 HB2 ALA 23 18.175 17.699 -33.381 266 HB3 ALA 23 HB3 ALA 23 19.298 18.353 -32.230 267 H GLY 24 H GLY 24 21.007 19.232 -35.947 268 HA2 GLY 24 HA2 GLY 24 23.426 20.206 -34.693 269 HA3 GLY 24 HA3 GLY 24 22.743 20.409 -36.372 270 H GLN 25 H GLN 25 23.818 22.434 -34.760 271 HA GLN 25 HA GLN 25 21.675 24.214 -33.931 272 HB2 GLN 25 HB2 GLN 25 24.478 25.005 -34.393 273 HB3 GLN 25 HB3 GLN 25 23.286 25.878 -33.441 274 HG2 GLN 25 HG2 GLN 25 24.784 23.349 -32.876 275 HG3 GLN 25 HG3 GLN 25 24.587 24.706 -31.819 276 HE21 GLN 25 HE22 GLN 25 23.794 21.711 -31.527 277 HE22 GLN 25 HE21 GLN 25 22.228 21.914 -30.763 278 H ASP 26 H ASP 26 23.208 23.713 -37.162 279 HA ASP 26 HA ASP 26 21.895 25.976 -38.543 280 HB2 ASP 26 HB2 ASP 26 22.511 24.998 -40.458 281 HB3 ASP 26 HB3 ASP 26 23.840 24.727 -39.334 282 H GLY 27 H GLY 27 20.492 23.602 -36.704 283 HA2 GLY 27 HA2 GLY 27 18.237 23.165 -36.465 284 HA3 GLY 27 HA3 GLY 27 17.869 24.027 -37.966 285 H SER 28 H SER 28 20.174 21.816 -38.592 286 HA SER 28 HA SER 28 18.554 20.106 -40.172 287 HB2 SER 28 HB2 SER 28 20.749 19.062 -40.922 288 HB3 SER 28 HB3 SER 28 21.032 20.916 -40.842 289 HG SER 28 HG SER 28 22.112 20.689 -39.014 290 H VAL 29 H VAL 29 18.013 17.871 -39.845 291 HA VAL 29 HA VAL 29 18.463 16.694 -37.151 292 HB VAL 29 HB VAL 29 15.925 16.480 -37.071 293 HG11 VAL 29 HG11 VAL 29 15.542 18.474 -35.962 294 HG12 VAL 29 HG12 VAL 29 17.243 18.081 -35.631 295 HG13 VAL 29 HG13 VAL 29 16.845 19.352 -36.809 296 HG21 VAL 29 HG21 VAL 29 15.032 16.660 -39.024 297 HG22 VAL 29 HG22 VAL 29 14.505 18.029 -38.013 298 HG23 VAL 29 HG23 VAL 29 15.673 18.316 -39.304 299 H VAL 30 H VAL 30 18.055 14.477 -37.045 300 HA VAL 30 HA VAL 30 16.630 13.082 -39.223 301 HB VAL 30 HB VAL 30 19.171 11.942 -38.032 302 HG11 VAL 30 HG11 VAL 30 16.766 10.858 -39.599 303 HG12 VAL 30 HG12 VAL 30 18.421 10.126 -39.676 304 HG13 VAL 30 HG13 VAL 30 17.658 10.151 -38.198 305 HG21 VAL 30 HG21 VAL 30 19.842 13.245 -39.766 306 HG22 VAL 30 HG22 VAL 30 19.490 11.782 -40.630 307 HG23 VAL 30 HG23 VAL 30 18.285 12.963 -40.786 308 H GLN 31 H GLN 31 14.838 11.893 -38.258 309 HA GLN 31 HA GLN 31 14.766 11.202 -35.392 310 HB2 GLN 31 HB2 GLN 31 12.637 12.019 -36.649 311 HB3 GLN 31 HB3 GLN 31 12.874 10.631 -37.767 312 HG2 GLN 31 HG2 GLN 31 11.167 10.256 -36.063 313 HG3 GLN 31 HG3 GLN 31 12.603 9.212 -35.889 314 HE21 GLN 31 HE22 GLN 31 12.991 8.986 -33.480 315 HE22 GLN 31 HE21 GLN 31 13.015 10.366 -32.452 316 H PHE 32 H PHE 32 15.233 9.141 -34.582 317 HA PHE 32 HA PHE 32 15.409 6.751 -36.434 318 HB2 PHE 32 HB2 PHE 32 17.153 7.624 -34.082 319 HB3 PHE 32 HB3 PHE 32 17.285 6.101 -35.076 320 HD1 PHE 32 HD1 PHE 32 17.963 9.678 -34.791 321 HD2 PHE 32 HD2 PHE 32 18.518 6.065 -36.998 322 HE1 PHE 32 HE1 PHE 32 20.008 10.699 -35.905 323 HE2 PHE 32 HE2 PHE 32 20.341 7.225 -38.241 324 HZ PHE 32 HZ PHE 32 21.068 9.311 -37.649 325 H LYS 33 H LYS 33 15.120 4.930 -35.419 326 HA LYS 33 HA LYS 33 14.003 4.803 -32.714 327 HB2 LYS 33 HB2 LYS 33 11.931 5.088 -34.283 328 HB3 LYS 33 HB3 LYS 33 12.622 3.636 -35.193 329 HG2 LYS 33 HG2 LYS 33 12.226 2.308 -33.263 330 HG3 LYS 33 HG3 LYS 33 11.689 3.820 -32.435 331 HD2 LYS 33 HD2 LYS 33 9.698 3.974 -33.854 332 HD3 LYS 33 HD3 LYS 33 10.352 2.977 -35.092 333 HE2 LYS 33 HE2 LYS 33 10.212 0.956 -33.353 334 HE3 LYS 33 HE3 LYS 33 9.220 2.086 -32.412 335 HZ1 LYS 33 HZ1 LYS 33 7.662 2.048 -34.128 336 HZ2 LYS 33 HZ2 LYS 33 8.704 1.350 -35.172 337 HZ3 LYS 33 HZ3 LYS 33 8.120 0.446 -33.888 338 H ILE 34 H ILE 34 15.075 3.475 -31.690 339 HA ILE 34 HA ILE 34 16.451 1.167 -32.950 340 HB ILE 34 HB ILE 34 18.372 1.725 -31.832 341 HG12 ILE 34 HG12 ILE 34 17.349 4.594 -31.120 342 HG13 ILE 34 HG13 ILE 34 17.190 3.386 -29.916 343 HG21 ILE 34 HG21 ILE 34 17.721 4.414 -33.349 344 HG22 ILE 34 HG22 ILE 34 19.086 3.354 -33.470 345 HG23 ILE 34 HG23 ILE 34 17.515 2.918 -34.146 346 HD11 ILE 34 HD11 ILE 34 19.241 4.499 -29.676 347 HD12 ILE 34 HD12 ILE 34 19.391 2.721 -29.691 348 HD13 ILE 34 HD13 ILE 34 20.012 3.686 -31.083 349 H LYS 35 H LYS 35 17.331 -0.346 -31.393 350 HA LYS 35 HA LYS 35 15.245 -0.924 -29.352 351 HB2 LYS 35 HB2 LYS 35 17.739 -2.607 -30.199 352 HB3 LYS 35 HB3 LYS 35 16.656 -2.965 -28.841 353 HG2 LYS 35 HG2 LYS 35 14.918 -3.435 -30.134 354 HG3 LYS 35 HG3 LYS 35 15.579 -2.719 -31.617 355 HD2 LYS 35 HD2 LYS 35 17.237 -4.552 -31.869 356 HD3 LYS 35 HD3 LYS 35 16.885 -5.183 -30.319 357 HE2 LYS 35 HE2 LYS 35 14.600 -5.859 -31.246 358 HE3 LYS 35 HE3 LYS 35 15.174 -5.110 -32.778 359 HZ1 LYS 35 HZ1 LYS 35 16.567 -7.229 -31.338 360 HZ2 LYS 35 HZ2 LYS 35 15.561 -7.645 -32.531 361 HZ3 LYS 35 HZ3 LYS 35 16.898 -6.680 -32.829 362 H ARG 36 H ARG 36 15.828 -1.219 -26.774 363 HA ARG 36 HA ARG 36 16.983 1.305 -26.194 364 HB2 ARG 36 HB2 ARG 36 15.138 -0.144 -25.091 365 HB3 ARG 36 HB3 ARG 36 16.282 -1.024 -24.293 366 HG2 ARG 36 HG2 ARG 36 17.065 1.332 -23.136 367 HG3 ARG 36 HG3 ARG 36 15.839 2.023 -24.040 368 HD2 ARG 36 HD2 ARG 36 14.697 1.464 -22.012 369 HD3 ARG 36 HD3 ARG 36 14.201 0.130 -22.963 370 HE ARG 36 HE ARG 36 15.668 -1.318 -21.751 371 HH11 ARG 36 HH11 ARG 36 16.106 2.041 -20.797 372 HH12 ARG 36 HH12 ARG 36 16.960 1.574 -19.333 373 HH21 ARG 36 HH21 ARG 36 17.114 -1.717 -19.994 374 HH22 ARG 36 HH22 ARG 36 17.560 -0.396 -18.922 375 H HIS 37 H HIS 37 18.676 -1.648 -26.558 376 HA HIS 37 HA HIS 37 21.096 -0.576 -25.207 377 HB2 HIS 37 HB2 HIS 37 21.971 -2.941 -25.376 378 HB3 HIS 37 HB3 HIS 37 20.353 -2.865 -24.774 379 HD2 HIS 37 HD2 HIS 37 22.321 -4.921 -26.934 380 HE1 HIS 37 HE1 HIS 37 18.542 -4.987 -28.889 381 HE2 HIS 37 HE2 HIS 37 20.639 -6.310 -28.587 382 H THR 38 H THR 38 19.742 -0.096 -28.402 383 HA THR 38 HA THR 38 22.112 -0.930 -29.834 384 HB THR 38 HB THR 38 20.013 0.957 -30.538 385 HG1 THR 38 HG1 THR 38 20.298 -1.811 -30.969 386 HG21 THR 38 HG21 THR 38 22.131 0.952 -32.088 387 HG22 THR 38 HG22 THR 38 21.724 -0.659 -32.497 388 HG23 THR 38 HG23 THR 38 20.568 0.646 -32.847 389 HA PRO 39 HA PRO 39 24.677 2.380 -28.591 390 HB2 PRO 39 HB2 PRO 39 26.267 1.700 -30.998 391 HB3 PRO 39 HB3 PRO 39 26.888 1.902 -29.425 392 HG2 PRO 39 HG2 PRO 39 26.586 -0.630 -30.066 393 HG3 PRO 39 HG3 PRO 39 25.778 -0.140 -28.544 394 HD2 PRO 39 HD2 PRO 39 24.564 -0.313 -31.187 395 HD3 PRO 39 HD3 PRO 39 23.990 -0.977 -29.577 396 H LEU 40 H LEU 40 24.715 4.379 -28.627 397 HA LEU 40 HA LEU 40 23.205 5.751 -30.585 398 HB2 LEU 40 HB2 LEU 40 25.152 6.918 -28.624 399 HB3 LEU 40 HB3 LEU 40 24.067 7.846 -29.572 400 HG LEU 40 HG LEU 40 23.059 5.523 -27.644 401 HD11 LEU 40 HD11 LEU 40 23.221 8.408 -27.203 402 HD12 LEU 40 HD12 LEU 40 22.559 7.237 -26.045 403 HD13 LEU 40 HD13 LEU 40 24.316 7.211 -26.467 404 HD21 LEU 40 HD21 LEU 40 21.050 6.274 -27.643 405 HD22 LEU 40 HD22 LEU 40 21.399 7.716 -28.716 406 HD23 LEU 40 HD23 LEU 40 21.393 6.190 -29.359 407 H SER 41 H SER 41 26.609 5.009 -30.660 408 HA SER 41 HA SER 41 27.535 7.045 -32.463 409 HB2 SER 41 HB2 SER 41 29.364 5.482 -32.900 410 HB3 SER 41 HB3 SER 41 29.009 5.360 -31.193 411 HG SER 41 HG SER 41 28.759 3.606 -31.264 412 H LYS 42 H LYS 42 25.607 4.112 -33.061 413 HA LYS 42 HA LYS 42 26.206 4.110 -35.952 414 HB2 LYS 42 HB2 LYS 42 23.819 2.837 -34.473 415 HB3 LYS 42 HB3 LYS 42 24.185 2.653 -36.097 416 HG2 LYS 42 HG2 LYS 42 26.501 1.536 -35.325 417 HG3 LYS 42 HG3 LYS 42 25.831 1.754 -33.700 418 HD2 LYS 42 HD2 LYS 42 25.408 -0.272 -34.077 419 HD3 LYS 42 HD3 LYS 42 23.873 0.391 -34.322 420 HE2 LYS 42 HE2 LYS 42 24.168 0.271 -36.824 421 HE3 LYS 42 HE3 LYS 42 25.886 -0.187 -36.633 422 HZ1 LYS 42 HZ1 LYS 42 24.900 -2.128 -36.912 423 HZ2 LYS 42 HZ2 LYS 42 24.972 -2.226 -35.294 424 HZ3 LYS 42 HZ3 LYS 42 23.581 -1.912 -36.037 425 H LEU 43 H LEU 43 24.116 5.950 -34.017 426 HA LEU 43 HA LEU 43 22.418 6.892 -36.164 427 HB2 LEU 43 HB2 LEU 43 22.675 7.810 -33.255 428 HB3 LEU 43 HB3 LEU 43 21.649 8.452 -34.480 429 HG LEU 43 HG LEU 43 20.337 6.453 -34.719 430 HD11 LEU 43 HD11 LEU 43 21.826 4.621 -34.330 431 HD12 LEU 43 HD12 LEU 43 22.375 5.244 -32.795 432 HD13 LEU 43 HD13 LEU 43 20.823 4.485 -33.006 433 HD21 LEU 43 HD21 LEU 43 20.707 7.309 -31.838 434 HD22 LEU 43 HD22 LEU 43 19.749 8.095 -32.981 435 HD23 LEU 43 HD23 LEU 43 19.276 6.439 -32.396 436 H MET 44 H MET 44 25.052 7.941 -34.155 437 HA MET 44 HA MET 44 25.313 10.619 -35.485 438 HB2 MET 44 HB2 MET 44 26.976 9.179 -33.310 439 HB3 MET 44 HB3 MET 44 27.160 10.893 -33.803 440 HG2 MET 44 HG2 MET 44 24.911 11.353 -32.808 441 HG3 MET 44 HG3 MET 44 24.802 9.621 -32.399 442 HE1 MET 44 HE1 MET 44 27.877 9.646 -29.760 443 HE2 MET 44 HE2 MET 44 26.711 8.533 -30.748 444 HE3 MET 44 HE3 MET 44 28.213 9.287 -31.329 445 H LYS 45 H LYS 45 26.952 7.706 -36.088 446 HA LYS 45 HA LYS 45 28.818 9.055 -37.771 447 HB2 LYS 45 HB2 LYS 45 27.899 6.228 -37.725 448 HB3 LYS 45 HB3 LYS 45 29.204 6.812 -38.910 449 HG2 LYS 45 HG2 LYS 45 30.671 7.210 -37.072 450 HG3 LYS 45 HG3 LYS 45 29.531 6.893 -35.792 451 HD2 LYS 45 HD2 LYS 45 29.315 4.598 -36.559 452 HD3 LYS 45 HD3 LYS 45 30.447 4.953 -37.956 453 HE2 LYS 45 HE2 LYS 45 32.078 5.572 -36.323 454 HE3 LYS 45 HE3 LYS 45 30.944 4.938 -35.054 455 HZ1 LYS 45 HZ1 LYS 45 32.900 3.288 -36.188 456 HZ2 LYS 45 HZ2 LYS 45 31.419 2.722 -35.737 457 HZ3 LYS 45 HZ3 LYS 45 31.809 3.137 -37.285 458 H ALA 46 H ALA 46 25.517 7.505 -38.186 459 HA ALA 46 HA ALA 46 25.405 8.089 -41.055 460 HB1 ALA 46 HB1 ALA 46 22.993 7.892 -39.350 461 HB2 ALA 46 HB2 ALA 46 23.275 7.632 -41.084 462 HB3 ALA 46 HB3 ALA 46 24.034 6.562 -39.841 463 H TYR 47 H TYR 47 24.437 10.207 -38.215 464 HA TYR 47 HA TYR 47 23.342 12.321 -39.843 465 HB2 TYR 47 HB2 TYR 47 22.957 12.090 -37.493 466 HB3 TYR 47 HB3 TYR 47 24.815 12.362 -37.152 467 HD1 TYR 47 HD1 TYR 47 21.614 13.875 -38.036 468 HD2 TYR 47 HD2 TYR 47 25.806 14.459 -37.118 469 HE1 TYR 47 HE1 TYR 47 21.350 16.427 -38.044 470 HE2 TYR 47 HE2 TYR 47 25.515 16.805 -37.149 471 HH TYR 47 HH TYR 47 22.623 18.493 -38.350 472 H CYS 48 H CYS 48 26.566 11.781 -38.589 473 HA CYS 48 HA CYS 48 27.631 14.205 -39.623 474 HB2 CYS 48 HB2 CYS 48 28.789 12.790 -37.813 475 HB3 CYS 48 HB3 CYS 48 29.065 11.526 -39.025 476 HG CYS 48 HG CYS 48 30.645 13.475 -40.414 477 H GLU 49 H GLU 49 27.512 10.976 -41.088 478 HA GLU 49 HA GLU 49 28.866 11.635 -43.450 479 HB2 GLU 49 HB2 GLU 49 26.755 9.603 -42.927 480 HB3 GLU 49 HB3 GLU 49 27.545 9.678 -44.582 481 HG2 GLU 49 HG2 GLU 49 29.669 9.571 -43.272 482 HG3 GLU 49 HG3 GLU 49 28.755 8.796 -41.941 483 H ARG 50 H ARG 50 25.372 11.753 -42.925 484 HA ARG 50 HA ARG 50 24.624 12.632 -45.616 485 HB2 ARG 50 HB2 ARG 50 23.383 12.584 -42.908 486 HB3 ARG 50 HB3 ARG 50 22.592 13.705 -44.009 487 HG2 ARG 50 HG2 ARG 50 21.974 12.111 -45.420 488 HG3 ARG 50 HG3 ARG 50 23.145 10.877 -44.976 489 HD2 ARG 50 HD2 ARG 50 21.914 10.898 -42.721 490 HD3 ARG 50 HD3 ARG 50 20.614 11.685 -43.585 491 HE ARG 50 HE ARG 50 21.540 8.949 -44.010 492 HH11 ARG 50 HH11 ARG 50 19.141 11.329 -44.979 493 HH12 ARG 50 HH12 ARG 50 18.026 10.042 -45.388 494 HH21 ARG 50 HH21 ARG 50 19.879 7.388 -44.759 495 HH22 ARG 50 HH22 ARG 50 18.352 8.001 -44.968 496 H GLN 51 H GLN 51 25.682 14.319 -42.722 497 HA GLN 51 HA GLN 51 25.318 16.937 -44.026 498 HB2 GLN 51 HB2 GLN 51 27.001 16.562 -41.524 499 HB3 GLN 51 HB3 GLN 51 26.406 18.086 -42.107 500 HG2 GLN 51 HG2 GLN 51 25.171 15.979 -40.457 501 HG3 GLN 51 HG3 GLN 51 25.002 17.652 -40.328 502 HE21 GLN 51 HE22 GLN 51 22.960 15.180 -40.725 503 HE22 GLN 51 HE21 GLN 51 21.878 15.931 -41.946 504 H GLY 52 H GLY 52 27.963 14.611 -44.004 505 HA2 GLY 52 HA2 GLY 52 29.507 14.535 -45.804 506 HA3 GLY 52 HA3 GLY 52 29.347 16.374 -45.946 507 H LEU 53 H LEU 53 29.559 15.863 -42.760 508 HA LEU 53 HA LEU 53 32.159 17.096 -42.944 509 HB2 LEU 53 HB2 LEU 53 30.651 16.260 -40.428 510 HB3 LEU 53 HB3 LEU 53 31.961 17.417 -40.554 511 HG LEU 53 HG LEU 53 29.081 17.797 -41.525 512 HD11 LEU 53 HD11 LEU 53 29.741 18.109 -39.047 513 HD12 LEU 53 HD12 LEU 53 30.888 19.310 -39.661 514 HD13 LEU 53 HD13 LEU 53 29.130 19.556 -39.965 515 HD21 LEU 53 HD21 LEU 53 30.567 18.737 -43.219 516 HD22 LEU 53 HD22 LEU 53 29.680 19.996 -42.413 517 HD23 LEU 53 HD23 LEU 53 31.430 19.615 -42.085 518 H SER 54 H SER 54 33.997 16.345 -41.397 519 HA SER 54 HA SER 54 34.303 13.460 -41.005 520 HB2 SER 54 HB2 SER 54 36.413 15.037 -41.589 521 HB3 SER 54 HB3 SER 54 35.967 15.794 -39.978 522 HG SER 54 HG SER 54 37.601 13.953 -40.346 523 H MET 55 H MET 55 33.709 12.415 -39.288 524 HA MET 55 HA MET 55 32.339 13.500 -37.220 525 HB2 MET 55 HB2 MET 55 32.354 11.078 -37.774 526 HB3 MET 55 HB3 MET 55 33.932 10.778 -37.160 527 HG2 MET 55 HG2 MET 55 33.433 11.297 -34.926 528 HG3 MET 55 HG3 MET 55 31.785 11.723 -35.417 529 HE1 MET 55 HE1 MET 55 30.324 9.754 -33.998 530 HE2 MET 55 HE2 MET 55 31.603 8.429 -33.608 531 HE3 MET 55 HE3 MET 55 31.806 10.150 -33.345 532 H ARG 56 H ARG 56 35.724 13.523 -37.552 533 HA ARG 56 HA ARG 56 36.658 13.943 -34.926 534 HB2 ARG 56 HB2 ARG 56 37.985 13.229 -37.016 535 HB3 ARG 56 HB3 ARG 56 37.936 14.926 -37.420 536 HG2 ARG 56 HG2 ARG 56 39.040 15.348 -35.053 537 HG3 ARG 56 HG3 ARG 56 39.273 13.529 -35.131 538 HD2 ARG 56 HD2 ARG 56 40.130 15.634 -37.168 539 HD3 ARG 56 HD3 ARG 56 41.248 15.039 -35.977 540 HE ARG 56 HE ARG 56 41.310 12.915 -36.939 541 HH11 ARG 56 HH11 ARG 56 39.698 15.298 -38.961 542 HH12 ARG 56 HH12 ARG 56 40.048 14.489 -40.413 543 HH21 ARG 56 HH21 ARG 56 41.468 11.705 -38.899 544 HH22 ARG 56 HH22 ARG 56 41.161 12.653 -40.367 545 H GLN 57 H GLN 57 35.367 16.259 -37.402 546 HA GLN 57 HA GLN 57 36.358 18.493 -36.082 547 HB2 GLN 57 HB2 GLN 57 35.754 19.702 -37.848 548 HB3 GLN 57 HB3 GLN 57 35.929 18.030 -38.509 549 HG2 GLN 57 HG2 GLN 57 33.546 17.766 -38.714 550 HG3 GLN 57 HG3 GLN 57 33.329 19.508 -38.401 551 HE21 GLN 57 HE22 GLN 57 34.290 21.137 -39.790 552 HE22 GLN 57 HE21 GLN 57 34.924 20.585 -41.349 553 H ILE 58 H ILE 58 33.964 16.662 -34.967 554 HA ILE 58 HA ILE 58 32.204 18.804 -34.056 555 HB ILE 58 HB ILE 58 30.206 17.420 -34.371 556 HG12 ILE 58 HG12 ILE 58 31.817 15.436 -35.921 557 HG13 ILE 58 HG13 ILE 58 31.148 15.164 -34.275 558 HG21 ILE 58 HG21 ILE 58 31.699 17.563 -36.990 559 HG22 ILE 58 HG22 ILE 58 29.947 17.817 -36.625 560 HG23 ILE 58 HG23 ILE 58 31.133 18.982 -36.034 561 HD11 ILE 58 HD11 ILE 58 28.801 15.437 -35.072 562 HD12 ILE 58 HD12 ILE 58 29.368 15.603 -36.754 563 HD13 ILE 58 HD13 ILE 58 29.790 14.167 -35.926 564 H ARG 59 H ARG 59 31.123 18.537 -32.078 565 HA ARG 59 HA ARG 59 31.784 16.309 -30.179 566 HB2 ARG 59 HB2 ARG 59 31.418 19.277 -29.515 567 HB3 ARG 59 HB3 ARG 59 31.526 17.852 -28.419 568 HG2 ARG 59 HG2 ARG 59 33.477 18.785 -30.437 569 HG3 ARG 59 HG3 ARG 59 33.550 19.340 -28.798 570 HD2 ARG 59 HD2 ARG 59 34.105 16.903 -28.173 571 HD3 ARG 59 HD3 ARG 59 34.095 16.481 -29.866 572 HE ARG 59 HE ARG 59 36.157 18.156 -28.459 573 HH11 ARG 59 HH11 ARG 59 35.086 16.818 -31.612 574 HH12 ARG 59 HH12 ARG 59 36.654 17.226 -32.330 575 HH21 ARG 59 HH21 ARG 59 37.926 18.873 -29.743 576 HH22 ARG 59 HH22 ARG 59 38.125 18.081 -31.313 577 H PHE 60 H PHE 60 30.213 15.973 -28.736 578 HA PHE 60 HA PHE 60 27.377 16.236 -29.722 579 HB2 PHE 60 HB2 PHE 60 28.420 13.590 -28.946 580 HB3 PHE 60 HB3 PHE 60 26.810 13.951 -29.366 581 HD1 PHE 60 HD2 PHE 60 26.256 14.584 -31.745 582 HD2 PHE 60 HD1 PHE 60 30.120 13.062 -30.687 583 HE1 PHE 60 HE2 PHE 60 26.653 13.937 -34.169 584 HE2 PHE 60 HE1 PHE 60 30.475 12.284 -33.010 585 HZ PHE 60 HZ PHE 60 28.680 12.541 -34.681 586 H ARG 61 H ARG 61 25.888 16.278 -28.051 587 HA ARG 61 HA ARG 61 26.692 15.735 -25.149 588 HB2 ARG 61 HB2 ARG 61 25.383 18.109 -26.375 589 HB3 ARG 61 HB3 ARG 61 25.606 17.782 -24.602 590 HG2 ARG 61 HG2 ARG 61 28.027 17.744 -24.901 591 HG3 ARG 61 HG3 ARG 61 27.733 18.026 -26.555 592 HD2 ARG 61 HD2 ARG 61 26.292 20.160 -25.473 593 HD3 ARG 61 HD3 ARG 61 27.182 19.754 -24.059 594 HE ARG 61 HE ARG 61 29.303 19.942 -25.646 595 HH11 ARG 61 HH11 ARG 61 26.560 22.352 -25.801 596 HH12 ARG 61 HH12 ARG 61 27.820 23.444 -26.306 597 HH21 ARG 61 HH21 ARG 61 30.476 21.398 -26.412 598 HH22 ARG 61 HH22 ARG 61 29.879 22.896 -26.910 599 H PHE 62 H PHE 62 25.079 15.018 -23.777 600 HA PHE 62 HA PHE 62 22.511 15.611 -24.599 601 HB2 PHE 62 HB2 PHE 62 22.264 13.615 -25.558 602 HB3 PHE 62 HB3 PHE 62 23.194 12.718 -24.368 603 HD1 PHE 62 HD1 PHE 62 22.303 11.922 -22.163 604 HD2 PHE 62 HD2 PHE 62 19.742 13.898 -24.990 605 HE1 PHE 62 HE1 PHE 62 20.460 11.023 -20.987 606 HE2 PHE 62 HE2 PHE 62 17.752 12.930 -23.621 607 HZ PHE 62 HZ PHE 62 18.062 11.390 -21.867 608 H ASP 63 H ASP 63 21.083 15.919 -22.893 609 HA ASP 63 HA ASP 63 20.589 16.754 -20.734 610 HB2 ASP 63 HB2 ASP 63 19.629 14.526 -20.927 611 HB3 ASP 63 HB3 ASP 63 20.985 13.824 -20.160 612 H GLY 64 H GLY 64 23.196 17.365 -21.290 613 HA2 GLY 64 HA2 GLY 64 24.309 18.834 -20.251 614 HA3 GLY 64 HA3 GLY 64 24.239 18.124 -18.646 615 H GLN 65 H GLN 65 25.156 15.718 -20.913 616 HA GLN 65 HA GLN 65 28.034 16.167 -20.389 617 HB2 GLN 65 HB2 GLN 65 26.365 13.679 -19.808 618 HB3 GLN 65 HB3 GLN 65 28.176 13.746 -19.769 619 HG2 GLN 65 HG2 GLN 65 27.993 15.521 -18.099 620 HG3 GLN 65 HG3 GLN 65 26.246 15.212 -17.894 621 HE21 GLN 65 HE22 GLN 65 25.848 13.092 -16.546 622 HE22 GLN 65 HE21 GLN 65 27.089 12.184 -15.839 623 HA PRO 66 HA PRO 66 28.838 14.620 -24.470 624 HB2 PRO 66 HB2 PRO 66 30.997 12.956 -23.416 625 HB3 PRO 66 HB3 PRO 66 31.129 14.333 -24.569 626 HG2 PRO 66 HG2 PRO 66 31.989 14.622 -22.021 627 HG3 PRO 66 HG3 PRO 66 31.060 15.934 -22.805 628 HD2 PRO 66 HD2 PRO 66 30.078 13.575 -21.018 629 HD3 PRO 66 HD3 PRO 66 29.952 15.268 -20.692 630 H ILE 67 H ILE 67 28.776 12.826 -25.825 631 HA ILE 67 HA ILE 67 27.839 10.167 -24.782 632 HB ILE 67 HB ILE 67 27.430 11.212 -27.557 633 HG12 ILE 67 HG12 ILE 67 25.801 11.258 -25.098 634 HG13 ILE 67 HG13 ILE 67 25.946 12.707 -26.234 635 HG21 ILE 67 HG21 ILE 67 26.272 8.804 -26.231 636 HG22 ILE 67 HG22 ILE 67 26.119 9.352 -27.977 637 HG23 ILE 67 HG23 ILE 67 27.617 8.872 -27.435 638 HD11 ILE 67 HD11 ILE 67 23.736 12.025 -26.603 639 HD12 ILE 67 HD12 ILE 67 24.710 11.230 -27.906 640 HD13 ILE 67 HD13 ILE 67 24.165 10.332 -26.495 641 H ASN 68 H ASN 68 29.076 8.494 -24.954 642 HA ASN 68 HA ASN 68 31.583 8.636 -26.635 643 HB2 ASN 68 HB2 ASN 68 30.882 6.625 -24.564 644 HB3 ASN 68 HB3 ASN 68 32.582 6.980 -25.294 645 HD21 ASN 68 HD22 ASN 68 30.084 7.858 -22.914 646 HD22 ASN 68 HD21 ASN 68 31.109 8.933 -22.151 647 H GLU 69 H GLU 69 32.195 6.590 -27.783 648 HA GLU 69 HA GLU 69 30.391 6.069 -29.952 649 HB2 GLU 69 HB2 GLU 69 32.752 6.363 -29.981 650 HB3 GLU 69 HB3 GLU 69 33.093 4.933 -29.118 651 HG2 GLU 69 HG2 GLU 69 32.136 3.480 -30.953 652 HG3 GLU 69 HG3 GLU 69 31.449 4.879 -31.723 653 H THR 70 H THR 70 30.191 4.805 -27.001 654 HA THR 70 HA THR 70 28.799 2.148 -27.534 655 HB THR 70 HB THR 70 29.996 1.249 -25.550 656 HG1 THR 70 HG1 THR 70 30.740 3.095 -24.472 657 HG21 THR 70 HG21 THR 70 32.073 0.682 -26.523 658 HG22 THR 70 HG22 THR 70 30.834 0.768 -27.845 659 HG23 THR 70 HG23 THR 70 32.110 2.028 -27.593 660 H ASP 71 H ASP 71 28.408 5.208 -26.029 661 HA ASP 71 HA ASP 71 26.793 4.292 -23.852 662 HB2 ASP 71 HB2 ASP 71 26.442 6.866 -25.271 663 HB3 ASP 71 HB3 ASP 71 25.521 6.204 -23.915 664 H THR 72 H THR 72 24.628 3.825 -23.660 665 HA THR 72 HA THR 72 23.103 3.222 -26.189 666 HB THR 72 HB THR 72 22.176 1.311 -25.291 667 HG1 THR 72 HG1 THR 72 23.204 0.704 -23.093 668 HG21 THR 72 HG21 THR 72 25.140 1.077 -24.606 669 HG22 THR 72 HG22 THR 72 24.115 -0.178 -24.936 670 HG23 THR 72 HG23 THR 72 24.556 1.197 -26.187 671 HA PRO 73 HA PRO 73 19.618 5.575 -24.106 672 HB2 PRO 73 HB2 PRO 73 17.779 3.241 -24.765 673 HB3 PRO 73 HB3 PRO 73 17.652 5.003 -25.164 674 HG2 PRO 73 HG2 PRO 73 18.484 2.891 -26.917 675 HG3 PRO 73 HG3 PRO 73 18.737 4.655 -27.089 676 HD2 PRO 73 HD2 PRO 73 20.556 2.384 -26.325 677 HD3 PRO 73 HD3 PRO 73 20.923 3.930 -27.072 678 H ALA 74 H ALA 74 20.188 2.130 -23.130 679 HA ALA 74 HA ALA 74 19.146 2.329 -20.403 680 HB1 ALA 74 HB1 ALA 74 20.663 0.368 -19.994 681 HB2 ALA 74 HB2 ALA 74 19.815 0.132 -21.552 682 HB3 ALA 74 HB3 ALA 74 21.529 0.640 -21.428 683 H GLN 75 H GLN 75 22.465 2.792 -21.778 684 HA GLN 75 HA GLN 75 23.718 3.348 -19.320 685 HB2 GLN 75 HB2 GLN 75 24.907 2.649 -21.387 686 HB3 GLN 75 HB3 GLN 75 24.500 4.303 -22.144 687 HG2 GLN 75 HG2 GLN 75 26.708 4.321 -21.492 688 HG3 GLN 75 HG3 GLN 75 25.926 5.373 -20.453 689 HE21 GLN 75 HE22 GLN 75 26.534 5.194 -18.352 690 HE22 GLN 75 HE21 GLN 75 27.193 3.649 -17.741 691 H LEU 76 H LEU 76 22.458 5.649 -21.679 692 HA LEU 76 HA LEU 76 23.074 7.773 -19.879 693 HB2 LEU 76 HB2 LEU 76 21.450 7.747 -22.453 694 HB3 LEU 76 HB3 LEU 76 22.100 9.265 -21.531 695 HG LEU 76 HG LEU 76 23.713 7.141 -23.023 696 HD11 LEU 76 HD11 LEU 76 24.330 8.930 -24.500 697 HD12 LEU 76 HD12 LEU 76 22.506 8.957 -24.442 698 HD13 LEU 76 HD13 LEU 76 23.348 10.080 -23.431 699 HD21 LEU 76 HD21 LEU 76 24.827 8.039 -20.936 700 HD22 LEU 76 HD22 LEU 76 25.734 8.308 -22.304 701 HD23 LEU 76 HD23 LEU 76 24.729 9.703 -21.652 702 H GLU 77 H GLU 77 20.541 5.658 -19.455 703 HA GLU 77 HA GLU 77 18.516 5.579 -18.751 704 HB2 GLU 77 HB2 GLU 77 19.533 7.806 -17.105 705 HB3 GLU 77 HB3 GLU 77 18.058 6.997 -16.768 706 HG2 GLU 77 HG2 GLU 77 20.698 5.433 -16.827 707 HG3 GLU 77 HG3 GLU 77 20.034 6.130 -15.382 708 H MET 78 H MET 78 18.034 6.305 -21.094 709 HA MET 78 HA MET 78 16.796 8.956 -21.256 710 HB2 MET 78 HB2 MET 78 16.919 7.052 -23.599 711 HB3 MET 78 HB3 MET 78 16.935 8.853 -23.497 712 HG2 MET 78 HG2 MET 78 19.235 8.687 -22.471 713 HG3 MET 78 HG3 MET 78 19.176 6.950 -22.903 714 HE1 MET 78 HE1 MET 78 18.632 10.369 -24.526 715 HE2 MET 78 HE2 MET 78 20.421 10.320 -24.254 716 HE3 MET 78 HE3 MET 78 19.838 10.417 -25.877 717 H GLU 79 H GLU 79 14.717 9.402 -21.222 718 HA GLU 79 HA GLU 79 12.535 7.481 -21.646 719 HB2 GLU 79 HB2 GLU 79 12.596 10.492 -21.089 720 HB3 GLU 79 HB3 GLU 79 11.178 9.521 -21.243 721 HG2 GLU 79 HG2 GLU 79 13.194 9.547 -18.962 722 HG3 GLU 79 HG3 GLU 79 11.512 9.969 -19.098 723 H ASP 80 H ASP 80 11.136 7.569 -23.147 724 HA ASP 80 HA ASP 80 12.161 7.686 -25.690 725 HB2 ASP 80 HB2 ASP 80 10.417 6.418 -24.942 726 HB3 ASP 80 HB3 ASP 80 9.353 7.809 -24.922 727 H GLU 81 H GLU 81 11.600 8.890 -27.663 728 HA GLU 81 HA GLU 81 11.547 10.637 -29.042 729 HB2 GLU 81 HB2 GLU 81 9.482 11.999 -27.170 730 HB3 GLU 81 HB3 GLU 81 9.748 12.233 -28.729 731 HG2 GLU 81 HG2 GLU 81 8.982 9.694 -29.194 732 HG3 GLU 81 HG3 GLU 81 8.767 9.706 -27.437 733 H ASP 82 H ASP 82 13.477 10.994 -26.538 734 HA ASP 82 HA ASP 82 13.767 13.859 -26.674 735 HB2 ASP 82 HB2 ASP 82 14.570 11.920 -24.984 736 HB3 ASP 82 HB3 ASP 82 16.110 12.477 -25.656 737 H THR 83 H THR 83 15.984 14.850 -26.841 738 HA THR 83 HA THR 83 17.070 14.341 -29.579 739 HB THR 83 HB THR 83 16.620 16.901 -28.170 740 HG1 THR 83 HG1 THR 83 14.815 16.673 -29.323 741 HG21 THR 83 HG21 THR 83 18.006 16.613 -30.810 742 HG22 THR 83 HG22 THR 83 17.567 18.216 -30.010 743 HG23 THR 83 HG23 THR 83 18.745 17.268 -29.318 744 H ILE 84 H ILE 84 19.193 13.911 -29.873 745 HA ILE 84 HA ILE 84 21.201 14.642 -27.897 746 HB ILE 84 HB ILE 84 21.529 12.934 -30.385 747 HG12 ILE 84 HG12 ILE 84 21.960 12.088 -27.549 748 HG13 ILE 84 HG13 ILE 84 20.317 12.014 -28.233 749 HG21 ILE 84 HG21 ILE 84 23.554 13.704 -28.389 750 HG22 ILE 84 HG22 ILE 84 23.818 12.589 -29.753 751 HG23 ILE 84 HG23 ILE 84 23.509 14.315 -30.053 752 HD11 ILE 84 HD11 ILE 84 21.517 9.831 -28.480 753 HD12 ILE 84 HD12 ILE 84 20.786 10.576 -29.889 754 HD13 ILE 84 HD13 ILE 84 22.558 10.672 -29.606 755 H ASP 85 H ASP 85 22.681 16.273 -28.203 756 HA ASP 85 HA ASP 85 22.125 18.013 -30.543 757 HB2 ASP 85 HB2 ASP 85 23.795 18.723 -28.132 758 HB3 ASP 85 HB3 ASP 85 23.083 19.743 -29.440 759 H VAL 86 H VAL 86 23.576 18.399 -31.896 760 HA VAL 86 HA VAL 86 26.323 17.500 -31.678 761 HB VAL 86 HB VAL 86 25.089 18.603 -34.245 762 HG11 VAL 86 HG11 VAL 86 26.643 16.962 -35.358 763 HG12 VAL 86 HG12 VAL 86 27.437 18.071 -34.356 764 HG13 VAL 86 HG13 VAL 86 27.193 16.436 -33.672 765 HG21 VAL 86 HG21 VAL 86 24.682 15.693 -33.089 766 HG22 VAL 86 HG22 VAL 86 23.469 16.858 -33.725 767 HG23 VAL 86 HG23 VAL 86 24.745 16.240 -34.771 768 H PHE 87 H PHE 87 28.052 18.891 -32.149 769 HA PHE 87 HA PHE 87 27.735 21.805 -32.720 770 HB2 PHE 87 HB2 PHE 87 29.192 20.858 -30.329 771 HB3 PHE 87 HB3 PHE 87 28.906 22.561 -30.877 772 HD1 PHE 87 HD2 PHE 87 26.910 23.931 -30.396 773 HD2 PHE 87 HD1 PHE 87 27.327 19.803 -29.134 774 HE1 PHE 87 HE2 PHE 87 25.034 24.156 -29.101 775 HE2 PHE 87 HE1 PHE 87 25.341 20.200 -27.530 776 HZ PHE 87 HZ PHE 87 24.130 22.227 -27.621 777 H GLN 88 H GLN 88 29.228 22.947 -33.431 778 HA GLN 88 HA GLN 88 31.441 21.665 -34.892 779 HB2 GLN 88 HB2 GLN 88 30.124 24.365 -34.843 780 HB3 GLN 88 HB3 GLN 88 31.663 24.254 -35.596 781 HG2 GLN 88 HG2 GLN 88 30.888 22.547 -37.123 782 HG3 GLN 88 HG3 GLN 88 29.259 22.769 -36.302 783 HE21 GLN 88 HE22 GLN 88 28.490 23.418 -38.600 784 HE22 GLN 88 HE21 GLN 88 28.690 25.116 -38.969 785 H GLN 89 H GLN 89 33.519 23.281 -34.891 786 HA GLN 89 HA GLN 89 34.496 24.086 -32.305 787 HB2 GLN 89 HB2 GLN 89 35.700 21.815 -33.860 788 HB3 GLN 89 HB3 GLN 89 36.512 22.655 -32.531 789 HG2 GLN 89 HG2 GLN 89 33.867 21.013 -32.142 790 HG3 GLN 89 HG3 GLN 89 35.346 20.209 -32.013 791 HE21 GLN 89 HE22 GLN 89 33.074 22.278 -30.566 792 HE22 GLN 89 HE21 GLN 89 33.788 22.585 -29.012 793 H GLN 90 H GLN 90 36.469 25.266 -32.357 794 HA GLN 90 HA GLN 90 37.139 26.317 -35.076 795 HB2 GLN 90 HB2 GLN 90 35.107 27.314 -33.995 796 HB3 GLN 90 HB3 GLN 90 36.162 28.061 -32.763 797 HG2 GLN 90 HG2 GLN 90 35.877 29.758 -34.148 798 HG3 GLN 90 HG3 GLN 90 37.410 29.154 -34.568 799 HE21 GLN 90 HE22 GLN 90 36.721 30.632 -36.487 800 HE22 GLN 90 HE21 GLN 90 35.919 29.773 -37.818 801 H THR 91 H THR 91 39.174 24.966 -34.181 802 HA THR 91 HA THR 91 41.055 26.558 -32.494 803 HB THR 91 HB THR 91 42.580 24.610 -32.829 804 HG1 THR 91 HG1 THR 91 41.812 23.470 -34.435 805 HG21 THR 91 HG21 THR 91 39.781 24.154 -31.547 806 HG22 THR 91 HG22 THR 91 41.166 23.110 -31.199 807 HG23 THR 91 HG23 THR 91 41.297 24.858 -30.772 808 H GLY 92 H GLY 92 43.189 26.856 -33.234 809 HA2 GLY 92 HA2 GLY 92 44.824 27.442 -34.769 810 HA3 GLY 92 HA3 GLY 92 43.667 27.022 -36.153 811 H GLY 93 H GLY 93 43.982 28.818 -37.291 812 HA2 GLY 93 HA2 GLY 93 43.354 31.035 -38.011 813 HA3 GLY 93 HA3 GLY 93 42.360 31.089 -36.600 814 H VAL 94 H VAL 94 43.488 33.354 -37.323 815 HA VAL 94 HA VAL 94 46.037 34.118 -36.217 816 HB VAL 94 HB VAL 94 43.771 35.958 -37.273 817 HG11 VAL 94 HG11 VAL 94 44.952 37.130 -35.438 818 HG12 VAL 94 HG12 VAL 94 46.440 36.507 -35.915 819 HG13 VAL 94 HG13 VAL 94 45.587 37.823 -36.923 820 HG21 VAL 94 HG21 VAL 94 46.650 35.191 -38.214 821 HG22 VAL 94 HG22 VAL 94 45.190 34.586 -38.885 822 HG23 VAL 94 HG23 VAL 94 45.251 36.240 -38.930 823 H TYR 95 H TYR 95 46.511 34.480 -33.996 824 HA TYR 95 HA TYR 95 44.434 35.308 -31.977 825 HB2 TYR 95 HB2 TYR 95 47.236 34.082 -32.015 826 HB3 TYR 95 HB3 TYR 95 46.526 34.972 -30.617 827 HD1 TYR 95 HD2 TYR 95 45.739 32.283 -33.168 828 HD2 TYR 95 HD1 TYR 95 45.559 33.468 -28.997 829 HE1 TYR 95 HE2 TYR 95 44.304 30.292 -32.663 830 HE2 TYR 95 HE1 TYR 95 44.576 31.343 -28.437 831 HH TYR 95 HH TYR 95 43.129 29.575 -29.392 Start of MODEL 2 1 H1 ACE 36 HH32 ACE 36 9.174 15.027 -45.448 2 H2 ACE 36 HH33 ACE 36 9.437 14.189 -43.920 3 H3 ACE 36 HH31 ACE 36 10.787 14.429 -44.830 4 H GLU 37 H GLU 37 10.502 13.534 -47.166 5 HA GLU 37 HA GLU 37 9.154 10.920 -47.637 6 HB2 GLU 37 HB2 GLU 37 10.006 12.857 -49.339 7 HB3 GLU 37 HB3 GLU 37 11.530 12.312 -49.018 8 HG2 GLU 37 HG2 GLU 37 10.733 11.364 -51.181 9 HG3 GLU 37 HG3 GLU 37 11.031 10.129 -50.057 10 H ASP 38 H ASP 38 12.267 11.680 -46.257 11 HA ASP 38 HA ASP 38 12.871 8.890 -45.830 12 HB2 ASP 38 HB2 ASP 38 13.771 9.605 -48.314 13 HB3 ASP 38 HB3 ASP 38 15.047 10.393 -47.360 14 H ALA 39 H ALA 39 12.477 11.307 -44.333 15 HA ALA 39 HA ALA 39 14.981 12.039 -43.026 16 HB1 ALA 39 HB1 ALA 39 12.033 12.801 -42.305 17 HB2 ALA 39 HB2 ALA 39 13.455 13.645 -41.761 18 HB3 ALA 39 HB3 ALA 39 12.930 13.599 -43.538 19 H PHE 40 H PHE 40 14.715 9.408 -42.902 20 HA PHE 40 HA PHE 40 14.397 8.742 -40.011 21 HB2 PHE 40 HB2 PHE 40 12.349 8.286 -41.724 22 HB3 PHE 40 HB3 PHE 40 13.155 6.817 -41.926 23 HD1 PHE 40 HD1 PHE 40 11.742 9.179 -39.229 24 HD2 PHE 40 HD2 PHE 40 12.719 5.114 -40.444 25 HE1 PHE 40 HE1 PHE 40 10.166 8.257 -37.644 26 HE2 PHE 40 HE2 PHE 40 11.199 4.262 -38.582 27 HZ PHE 40 HZ PHE 40 9.885 5.901 -37.192 28 H ILE 41 H ILE 41 15.734 7.074 -39.376 29 HA ILE 41 HA ILE 41 17.059 5.221 -41.214 30 HB ILE 41 HB ILE 41 18.700 6.728 -39.133 31 HG12 ILE 41 HG12 ILE 41 18.515 7.082 -42.086 32 HG13 ILE 41 HG13 ILE 41 17.896 8.152 -40.861 33 HG21 ILE 41 HG21 ILE 41 19.752 5.150 -41.462 34 HG22 ILE 41 HG22 ILE 41 20.593 5.757 -40.023 35 HG23 ILE 41 HG23 ILE 41 19.397 4.470 -39.837 36 HD11 ILE 41 HD11 ILE 41 19.659 9.173 -41.724 37 HD12 ILE 41 HD12 ILE 41 20.184 8.564 -40.036 38 HD13 ILE 41 HD13 ILE 41 20.757 7.756 -41.490 39 H VAL 42 H VAL 42 15.902 3.512 -40.284 40 HA VAL 42 HA VAL 42 15.662 3.044 -37.415 41 HB VAL 42 HB VAL 42 14.810 1.074 -39.523 42 HG11 VAL 42 HG11 VAL 42 13.322 0.272 -37.943 43 HG12 VAL 42 HG12 VAL 42 14.743 0.667 -36.856 44 HG13 VAL 42 HG13 VAL 42 13.409 1.766 -37.029 45 HG21 VAL 42 HG21 VAL 42 13.727 3.767 -38.523 46 HG22 VAL 42 HG22 VAL 42 13.851 3.185 -40.226 47 HG23 VAL 42 HG23 VAL 42 12.605 2.456 -39.173 48 H ILE 43 H ILE 43 17.179 2.012 -36.088 49 HA ILE 43 HA ILE 43 19.038 0.085 -37.441 50 HB ILE 43 HB ILE 43 20.175 1.783 -35.339 51 HG12 ILE 43 HG12 ILE 43 20.034 2.749 -38.170 52 HG13 ILE 43 HG13 ILE 43 19.069 3.413 -36.743 53 HG21 ILE 43 HG21 ILE 43 21.382 0.677 -37.939 54 HG22 ILE 43 HG22 ILE 43 22.156 1.568 -36.632 55 HG23 ILE 43 HG23 ILE 43 21.628 -0.058 -36.272 56 HD11 ILE 43 HD11 ILE 43 21.152 4.811 -37.384 57 HD12 ILE 43 HD12 ILE 43 21.094 4.189 -35.680 58 HD13 ILE 43 HD13 ILE 43 22.099 3.424 -37.021 59 H SEP 44 H SEP 44 19.923 -1.521 -36.325 60 HA SEP 44 HA SEP 44 19.523 -1.466 -33.389 61 HB2 SEP 44 HB2 SEP 44 18.625 -3.635 -33.045 62 HB3 SEP 44 HB3 SEP 44 17.648 -2.594 -34.192 63 H ASP 45 H ASP 45 20.583 -4.134 -32.861 64 HA ASP 45 HA ASP 45 23.332 -4.010 -34.028 65 HB2 ASP 45 HB2 ASP 45 22.931 -2.394 -32.112 66 HB3 ASP 45 HB3 ASP 45 23.075 -3.703 -31.001 67 H SEP 46 H SEP 46 21.101 -5.917 -32.436 68 HA SEP 46 HA SEP 46 22.851 -8.195 -32.129 69 HB2 SEP 46 HB2 SEP 46 20.961 -9.614 -31.738 70 HB3 SEP 46 HB3 SEP 46 20.958 -8.206 -30.637 71 H ASP 47 H ASP 47 23.821 -9.151 -33.916 72 HA ASP 47 HA ASP 47 22.193 -9.822 -36.137 73 HB2 ASP 47 HB2 ASP 47 23.108 -7.651 -36.762 74 HB3 ASP 47 HB3 ASP 47 24.758 -8.292 -36.816 75 H GLY 48 H GLY 48 23.800 -11.312 -37.904 76 HA2 GLY 48 HA2 GLY 48 25.812 -12.999 -36.597 77 HA3 GLY 48 HA3 GLY 48 24.086 -13.578 -36.752 78 H GLU 49 H GLU 49 26.519 -14.731 -37.686 79 HA GLU 49 HA GLU 49 25.704 -15.200 -40.580 80 HB2 GLU 49 HB2 GLU 49 27.306 -13.498 -40.761 81 HB3 GLU 49 HB3 GLU 49 28.364 -14.288 -39.584 82 HG2 GLU 49 HG2 GLU 49 29.226 -14.820 -41.896 83 HG3 GLU 49 HG3 GLU 49 28.475 -16.287 -41.277 84 HN1 NH2 50 HN1 NH2 50 27.638 -16.520 -37.499 85 HN2 NH2 50 HN2 NH2 50 27.830 -18.055 -38.335 86 H1 MET 1 H1 MET 1 -8.362 -27.268 -48.682 87 H2 MET 1 H2 MET 1 -7.930 -25.953 -47.918 88 H3 MET 1 H3 MET 1 -9.520 -26.371 -48.041 89 HA MET 1 HA MET 1 -9.483 -28.098 -46.667 90 HB2 MET 1 HB2 MET 1 -6.452 -28.092 -47.020 91 HB3 MET 1 HB3 MET 1 -7.211 -29.225 -45.884 92 HG2 MET 1 HG2 MET 1 -8.549 -30.105 -47.899 93 HG3 MET 1 HG3 MET 1 -7.592 -28.970 -48.864 94 HE1 MET 1 HE1 MET 1 -7.341 -31.562 -45.815 95 HE2 MET 1 HE2 MET 1 -7.913 -32.472 -47.115 96 HE3 MET 1 HE3 MET 1 -6.272 -32.784 -46.615 97 H ALA 2 H ALA 2 -8.814 -28.348 -44.159 98 HA ALA 2 HA ALA 2 -9.323 -25.560 -43.183 99 HB1 ALA 2 HB1 ALA 2 -9.291 -28.150 -41.588 100 HB2 ALA 2 HB2 ALA 2 -9.998 -26.728 -41.159 101 HB3 ALA 2 HB3 ALA 2 -10.837 -27.574 -42.402 102 H ASP 3 H ASP 3 -8.304 -24.694 -41.354 103 HA ASP 3 HA ASP 3 -5.542 -25.430 -40.929 104 HB2 ASP 3 HB2 ASP 3 -6.267 -23.706 -43.038 105 HB3 ASP 3 HB3 ASP 3 -5.909 -22.618 -41.632 106 H GLU 4 H GLU 4 -7.987 -24.899 -39.168 107 HA GLU 4 HA GLU 4 -6.932 -22.933 -37.254 108 HB2 GLU 4 HB2 GLU 4 -9.273 -23.245 -37.587 109 HB3 GLU 4 HB3 GLU 4 -9.312 -24.895 -36.960 110 HG2 GLU 4 HG2 GLU 4 -10.219 -23.448 -35.261 111 HG3 GLU 4 HG3 GLU 4 -8.683 -24.170 -34.763 112 H LYS 5 H LYS 5 -5.316 -23.140 -36.061 113 HA LYS 5 HA LYS 5 -4.536 -25.757 -34.672 114 HB2 LYS 5 HB2 LYS 5 -3.391 -25.301 -36.804 115 HB3 LYS 5 HB3 LYS 5 -2.723 -23.844 -36.172 116 HG2 LYS 5 HG2 LYS 5 -1.618 -24.820 -34.344 117 HG3 LYS 5 HG3 LYS 5 -2.251 -26.486 -34.662 118 HD2 LYS 5 HD2 LYS 5 -0.519 -26.760 -36.295 119 HD3 LYS 5 HD3 LYS 5 -0.787 -25.121 -36.882 120 HE2 LYS 5 HE2 LYS 5 0.472 -24.219 -34.901 121 HE3 LYS 5 HE3 LYS 5 0.634 -25.802 -34.297 122 HZ1 LYS 5 HZ1 LYS 5 1.602 -25.022 -37.007 123 HZ2 LYS 5 HZ2 LYS 5 2.509 -24.917 -35.627 124 HZ3 LYS 5 HZ3 LYS 5 2.211 -26.290 -36.205 125 HA PRO 6 HA PRO 6 -4.278 -22.837 -31.230 126 HB2 PRO 6 HB2 PRO 6 -3.145 -24.541 -29.413 127 HB3 PRO 6 HB3 PRO 6 -4.938 -24.400 -29.790 128 HG2 PRO 6 HG2 PRO 6 -3.008 -26.461 -30.520 129 HG3 PRO 6 HG3 PRO 6 -4.827 -26.559 -30.251 130 HD2 PRO 6 HD2 PRO 6 -3.514 -26.577 -32.759 131 HD3 PRO 6 HD3 PRO 6 -5.268 -26.251 -32.487 132 H LYS 7 H LYS 7 -2.536 -21.942 -29.926 133 HA LYS 7 HA LYS 7 0.162 -22.272 -31.253 134 HB2 LYS 7 HB2 LYS 7 -1.408 -20.294 -31.787 135 HB3 LYS 7 HB3 LYS 7 -0.980 -19.723 -30.177 136 HG2 LYS 7 HG2 LYS 7 1.330 -19.532 -30.622 137 HG3 LYS 7 HG3 LYS 7 1.146 -20.505 -32.160 138 HD2 LYS 7 HD2 LYS 7 -0.435 -18.491 -32.898 139 HD3 LYS 7 HD3 LYS 7 0.290 -17.758 -31.437 140 HE2 LYS 7 HE2 LYS 7 2.461 -17.941 -32.264 141 HE3 LYS 7 HE3 LYS 7 2.032 -18.614 -33.890 142 HZ1 LYS 7 HZ1 LYS 7 0.433 -16.633 -34.034 143 HZ2 LYS 7 HZ2 LYS 7 1.306 -16.032 -32.880 144 HZ3 LYS 7 HZ3 LYS 7 2.058 -16.329 -34.234 145 H GLU 8 H GLU 8 2.020 -21.684 -30.149 146 HA GLU 8 HA GLU 8 2.120 -22.192 -27.342 147 HB2 GLU 8 HB2 GLU 8 3.949 -22.969 -28.829 148 HB3 GLU 8 HB3 GLU 8 4.193 -21.343 -29.361 149 HG2 GLU 8 HG2 GLU 8 5.049 -20.627 -27.132 150 HG3 GLU 8 HG3 GLU 8 4.570 -22.197 -26.471 151 H GLY 9 H GLY 9 2.235 -20.863 -25.794 152 HA2 GLY 9 HA2 GLY 9 1.424 -18.004 -25.925 153 HA3 GLY 9 HA3 GLY 9 1.817 -18.894 -24.493 154 H VAL 10 H VAL 10 4.079 -18.147 -27.222 155 HA VAL 10 HA VAL 10 5.592 -16.713 -25.270 156 HB VAL 10 HB VAL 10 6.894 -18.976 -26.801 157 HG11 VAL 10 HG11 VAL 10 8.098 -16.692 -25.287 158 HG12 VAL 10 HG12 VAL 10 8.874 -18.292 -25.018 159 HG13 VAL 10 HG13 VAL 10 8.599 -17.496 -26.677 160 HG21 VAL 10 HG21 VAL 10 7.366 -20.169 -24.742 161 HG22 VAL 10 HG22 VAL 10 6.778 -18.881 -23.775 162 HG23 VAL 10 HG23 VAL 10 5.592 -19.663 -24.795 163 H LYS 11 H LYS 11 6.857 -15.047 -26.138 164 HA LYS 11 HA LYS 11 7.835 -15.260 -28.816 165 HB2 LYS 11 HB2 LYS 11 5.587 -14.365 -29.301 166 HB3 LYS 11 HB3 LYS 11 5.802 -12.948 -28.342 167 HG2 LYS 11 HG2 LYS 11 7.813 -12.297 -29.786 168 HG3 LYS 11 HG3 LYS 11 7.571 -13.892 -30.604 169 HD2 LYS 11 HD2 LYS 11 5.486 -13.131 -31.577 170 HD3 LYS 11 HD3 LYS 11 5.474 -11.654 -30.565 171 HE2 LYS 11 HE2 LYS 11 7.722 -11.054 -31.624 172 HE3 LYS 11 HE3 LYS 11 7.616 -12.404 -32.702 173 HZ1 LYS 11 HZ1 LYS 11 5.588 -11.415 -33.643 174 HZ2 LYS 11 HZ2 LYS 11 5.645 -10.213 -32.584 175 HZ3 LYS 11 HZ3 LYS 11 6.742 -10.382 -33.757 176 H THR 12 H THR 12 9.614 -15.260 -27.871 177 HA THR 12 HA THR 12 10.417 -12.792 -26.356 178 HB THR 12 HB THR 12 12.510 -14.190 -25.753 179 HG1 THR 12 HG1 THR 12 12.377 -15.851 -27.269 180 HG21 THR 12 HG21 THR 12 10.045 -14.250 -24.403 181 HG22 THR 12 HG22 THR 12 10.294 -15.913 -24.899 182 HG23 THR 12 HG23 THR 12 11.476 -15.077 -23.848 183 H GLU 13 H GLU 13 10.204 -13.377 -29.432 184 HA GLU 13 HA GLU 13 12.699 -12.277 -30.299 185 HB2 GLU 13 HB2 GLU 13 10.053 -12.313 -31.873 186 HB3 GLU 13 HB3 GLU 13 11.658 -12.048 -32.438 187 HG2 GLU 13 HG2 GLU 13 10.321 -14.672 -31.495 188 HG3 GLU 13 HG3 GLU 13 11.012 -14.311 -33.086 189 H ASN 14 H ASN 14 10.129 -11.147 -28.555 190 HA ASN 14 HA ASN 14 9.605 -8.390 -29.702 191 HB2 ASN 14 HB2 ASN 14 8.981 -9.783 -27.155 192 HB3 ASN 14 HB3 ASN 14 8.546 -8.153 -27.410 193 HD21 ASN 14 HD22 ASN 14 6.733 -9.916 -26.810 194 HD22 ASN 14 HD21 ASN 14 5.523 -10.062 -28.100 195 H ASN 15 H ASN 15 10.463 -6.462 -29.175 196 HA ASN 15 HA ASN 15 11.836 -6.248 -26.578 197 HB2 ASN 15 HB2 ASN 15 13.543 -6.909 -28.140 198 HB3 ASN 15 HB3 ASN 15 13.413 -5.332 -28.855 199 HD21 ASN 15 HD22 ASN 15 15.494 -6.353 -27.602 200 HD22 ASN 15 HD21 ASN 15 15.907 -5.793 -26.046 201 H ASP 16 H ASP 16 11.792 -3.906 -25.850 202 HA ASP 16 HA ASP 16 9.829 -2.068 -27.127 203 HB2 ASP 16 HB2 ASP 16 11.779 -1.951 -24.739 204 HB3 ASP 16 HB3 ASP 16 10.821 -0.512 -25.247 205 H HIS 17 H HIS 17 10.307 0.111 -27.828 206 HA HIS 17 HA HIS 17 13.080 0.629 -28.934 207 HB2 HIS 17 HB2 HIS 17 10.492 1.071 -30.501 208 HB3 HIS 17 HB3 HIS 17 12.046 1.351 -31.150 209 HD2 HIS 17 HD2 HIS 17 13.607 -1.169 -30.779 210 HE1 HIS 17 HE1 HIS 17 10.630 -2.729 -33.416 211 HE2 HIS 17 HE2 HIS 17 12.951 -2.989 -32.552 212 H ILE 18 H ILE 18 13.732 2.642 -29.280 213 HA ILE 18 HA ILE 18 11.962 4.855 -28.183 214 HB ILE 18 HB ILE 18 13.632 3.997 -26.578 215 HG12 ILE 18 HG12 ILE 18 14.287 6.781 -27.264 216 HG13 ILE 18 HG13 ILE 18 12.751 6.227 -26.398 217 HG21 ILE 18 HG21 ILE 18 15.437 3.365 -28.317 218 HG22 ILE 18 HG22 ILE 18 15.917 5.059 -28.296 219 HG23 ILE 18 HG23 ILE 18 15.939 4.131 -26.757 220 HD11 ILE 18 HD11 ILE 18 14.633 7.000 -24.892 221 HD12 ILE 18 HD12 ILE 18 13.919 5.352 -24.542 222 HD13 ILE 18 HD13 ILE 18 15.469 5.583 -25.287 223 H ASN 19 H ASN 19 12.072 6.982 -29.044 224 HA ASN 19 HA ASN 19 13.333 7.007 -31.642 225 HB2 ASN 19 HB2 ASN 19 11.081 8.573 -30.487 226 HB3 ASN 19 HB3 ASN 19 11.589 8.604 -32.205 227 HD21 ASN 19 HD22 ASN 19 10.179 6.803 -29.431 228 HD22 ASN 19 HD21 ASN 19 9.391 5.554 -30.464 229 H LEU 20 H LEU 20 15.287 7.940 -31.420 230 HA LEU 20 HA LEU 20 15.421 10.496 -29.945 231 HB2 LEU 20 HB2 LEU 20 17.818 9.031 -30.784 232 HB3 LEU 20 HB3 LEU 20 17.718 10.291 -29.571 233 HG LEU 20 HG LEU 20 16.477 7.488 -29.153 234 HD11 LEU 20 HD11 LEU 20 19.024 8.726 -28.114 235 HD12 LEU 20 HD12 LEU 20 18.524 7.099 -27.744 236 HD13 LEU 20 HD13 LEU 20 19.050 7.527 -29.405 237 HD21 LEU 20 HD21 LEU 20 16.680 8.014 -26.792 238 HD22 LEU 20 HD22 LEU 20 16.893 9.813 -27.342 239 HD23 LEU 20 HD23 LEU 20 15.454 8.899 -27.533 240 H LYS 21 H LYS 21 15.968 12.501 -30.809 241 HA LYS 21 HA LYS 21 16.209 12.614 -33.727 242 HB2 LYS 21 HB2 LYS 21 16.173 14.701 -31.488 243 HB3 LYS 21 HB3 LYS 21 16.383 15.117 -33.238 244 HG2 LYS 21 HG2 LYS 21 13.906 13.850 -31.952 245 HG3 LYS 21 HG3 LYS 21 14.048 15.507 -32.399 246 HD2 LYS 21 HD2 LYS 21 14.445 14.752 -34.804 247 HD3 LYS 21 HD3 LYS 21 14.020 13.059 -34.269 248 HE2 LYS 21 HE2 LYS 21 12.313 15.573 -33.929 249 HE3 LYS 21 HE3 LYS 21 12.336 14.563 -35.376 250 HZ1 LYS 21 HZ1 LYS 21 11.618 13.155 -32.836 251 HZ2 LYS 21 HZ2 LYS 21 10.547 14.115 -33.607 252 HZ3 LYS 21 HZ3 LYS 21 11.313 12.896 -34.414 253 H VAL 22 H VAL 22 18.317 13.273 -34.546 254 HA VAL 22 HA VAL 22 20.310 14.329 -32.601 255 HB VAL 22 HB VAL 22 20.827 12.807 -35.194 256 HG11 VAL 22 HG11 VAL 22 22.810 14.145 -33.379 257 HG12 VAL 22 HG12 VAL 22 23.154 13.243 -34.943 258 HG13 VAL 22 HG13 VAL 22 22.250 14.664 -35.050 259 HG21 VAL 22 HG21 VAL 22 22.147 11.297 -33.656 260 HG22 VAL 22 HG22 VAL 22 21.734 12.220 -32.220 261 HG23 VAL 22 HG23 VAL 22 20.507 11.291 -33.143 262 H ALA 23 H ALA 23 20.734 16.290 -32.724 263 HA ALA 23 HA ALA 23 19.810 17.751 -35.219 264 HB1 ALA 23 HB1 ALA 23 18.776 19.488 -33.873 265 HB2 ALA 23 HB2 ALA 23 18.266 17.855 -33.367 266 HB3 ALA 23 HB3 ALA 23 19.507 18.731 -32.429 267 H GLY 24 H GLY 24 20.948 19.401 -36.179 268 HA2 GLY 24 HA2 GLY 24 23.501 20.263 -34.943 269 HA3 GLY 24 HA3 GLY 24 22.869 20.623 -36.623 270 H GLN 25 H GLN 25 23.965 22.726 -34.890 271 HA GLN 25 HA GLN 25 21.631 24.052 -33.683 272 HB2 GLN 25 HB2 GLN 25 24.394 24.965 -34.043 273 HB3 GLN 25 HB3 GLN 25 23.108 25.757 -33.016 274 HG2 GLN 25 HG2 GLN 25 24.729 23.284 -32.469 275 HG3 GLN 25 HG3 GLN 25 24.690 24.753 -31.573 276 HE21 GLN 25 HE22 GLN 25 23.862 21.654 -31.468 277 HE22 GLN 25 HE21 GLN 25 22.354 21.689 -30.592 278 H ASP 26 H ASP 26 23.107 23.693 -36.818 279 HA ASP 26 HA ASP 26 21.838 26.056 -37.987 280 HB2 ASP 26 HB2 ASP 26 22.800 25.374 -39.856 281 HB3 ASP 26 HB3 ASP 26 23.851 24.819 -38.599 282 H GLY 27 H GLY 27 20.330 23.384 -36.534 283 HA2 GLY 27 HA2 GLY 27 18.082 22.911 -36.624 284 HA3 GLY 27 HA3 GLY 27 18.008 23.992 -38.071 285 H SER 28 H SER 28 20.255 21.698 -38.710 286 HA SER 28 HA SER 28 18.677 19.895 -40.414 287 HB2 SER 28 HB2 SER 28 20.894 19.355 -41.226 288 HB3 SER 28 HB3 SER 28 21.020 20.883 -40.968 289 HG SER 28 HG SER 28 22.219 20.601 -39.202 290 H VAL 29 H VAL 29 18.002 17.907 -39.946 291 HA VAL 29 HA VAL 29 18.754 16.534 -37.374 292 HB VAL 29 HB VAL 29 16.554 16.163 -36.794 293 HG11 VAL 29 HG11 VAL 29 16.059 18.606 -36.129 294 HG12 VAL 29 HG12 VAL 29 17.861 18.239 -36.149 295 HG13 VAL 29 HG13 VAL 29 17.017 19.122 -37.408 296 HG21 VAL 29 HG21 VAL 29 15.466 16.277 -39.108 297 HG22 VAL 29 HG22 VAL 29 14.621 17.270 -37.853 298 HG23 VAL 29 HG23 VAL 29 15.563 18.016 -39.109 299 H VAL 30 H VAL 30 18.049 14.435 -37.017 300 HA VAL 30 HA VAL 30 16.788 12.973 -39.105 301 HB VAL 30 HB VAL 30 19.437 11.817 -38.116 302 HG11 VAL 30 HG11 VAL 30 17.021 10.723 -39.402 303 HG12 VAL 30 HG12 VAL 30 18.588 10.020 -39.898 304 HG13 VAL 30 HG13 VAL 30 18.207 9.926 -38.192 305 HG21 VAL 30 HG21 VAL 30 19.737 13.377 -40.218 306 HG22 VAL 30 HG22 VAL 30 19.878 11.719 -40.701 307 HG23 VAL 30 HG23 VAL 30 18.304 12.527 -40.875 308 H GLN 31 H GLN 31 15.526 11.040 -38.338 309 HA GLN 31 HA GLN 31 15.124 10.927 -35.402 310 HB2 GLN 31 HB2 GLN 31 13.231 11.768 -36.703 311 HB3 GLN 31 HB3 GLN 31 13.220 10.410 -37.783 312 HG2 GLN 31 HG2 GLN 31 11.729 9.497 -36.521 313 HG3 GLN 31 HG3 GLN 31 13.057 8.769 -35.711 314 HE21 GLN 31 HE22 GLN 31 10.161 9.524 -34.883 315 HE22 GLN 31 HE21 GLN 31 10.461 10.395 -33.420 316 H PHE 32 H PHE 32 15.710 9.204 -34.655 317 HA PHE 32 HA PHE 32 16.451 6.732 -36.120 318 HB2 PHE 32 HB2 PHE 32 17.639 7.961 -33.726 319 HB3 PHE 32 HB3 PHE 32 18.241 6.385 -34.370 320 HD1 PHE 32 HD2 PHE 32 19.053 6.179 -36.727 321 HD2 PHE 32 HD1 PHE 32 18.521 9.980 -34.620 322 HE1 PHE 32 HE2 PHE 32 20.420 7.402 -38.335 323 HE2 PHE 32 HE1 PHE 32 20.296 11.036 -36.141 324 HZ PHE 32 HZ PHE 32 21.217 9.744 -37.942 325 H LYS 33 H LYS 33 14.609 5.570 -35.726 326 HA LYS 33 HA LYS 33 14.020 4.855 -33.007 327 HB2 LYS 33 HB2 LYS 33 12.145 5.041 -34.790 328 HB3 LYS 33 HB3 LYS 33 12.952 3.763 -35.694 329 HG2 LYS 33 HG2 LYS 33 12.635 2.170 -33.879 330 HG3 LYS 33 HG3 LYS 33 11.604 3.356 -32.965 331 HD2 LYS 33 HD2 LYS 33 10.053 3.386 -35.025 332 HD3 LYS 33 HD3 LYS 33 11.035 2.109 -35.745 333 HE2 LYS 33 HE2 LYS 33 10.671 0.763 -33.710 334 HE3 LYS 33 HE3 LYS 33 9.465 2.058 -33.199 335 HZ1 LYS 33 HZ1 LYS 33 8.226 1.291 -35.296 336 HZ2 LYS 33 HZ2 LYS 33 9.471 0.297 -35.472 337 HZ3 LYS 33 HZ3 LYS 33 8.494 0.070 -34.187 338 H ILE 34 H ILE 34 14.934 3.406 -31.770 339 HA ILE 34 HA ILE 34 16.601 1.222 -32.966 340 HB ILE 34 HB ILE 34 18.471 1.871 -31.453 341 HG12 ILE 34 HG12 ILE 34 16.890 4.445 -30.725 342 HG13 ILE 34 HG13 ILE 34 17.194 2.988 -29.729 343 HG21 ILE 34 HG21 ILE 34 17.730 4.231 -33.257 344 HG22 ILE 34 HG22 ILE 34 19.299 3.375 -32.895 345 HG23 ILE 34 HG23 ILE 34 18.024 2.588 -33.865 346 HD11 ILE 34 HD11 ILE 34 18.533 4.735 -29.272 347 HD12 ILE 34 HD12 ILE 34 19.427 3.300 -29.549 348 HD13 ILE 34 HD13 ILE 34 19.396 4.629 -30.773 349 H LYS 35 H LYS 35 17.609 -0.409 -31.428 350 HA LYS 35 HA LYS 35 15.677 -0.857 -29.182 351 HB2 LYS 35 HB2 LYS 35 17.972 -2.646 -30.284 352 HB3 LYS 35 HB3 LYS 35 17.039 -3.003 -28.977 353 HG2 LYS 35 HG2 LYS 35 14.964 -3.019 -30.168 354 HG3 LYS 35 HG3 LYS 35 15.819 -2.590 -31.640 355 HD2 LYS 35 HD2 LYS 35 17.005 -4.449 -31.910 356 HD3 LYS 35 HD3 LYS 35 16.868 -4.953 -30.094 357 HE2 LYS 35 HE2 LYS 35 14.768 -5.512 -30.363 358 HE3 LYS 35 HE3 LYS 35 14.531 -4.837 -32.024 359 HZ1 LYS 35 HZ1 LYS 35 16.191 -7.091 -31.075 360 HZ2 LYS 35 HZ2 LYS 35 14.773 -7.244 -31.837 361 HZ3 LYS 35 HZ3 LYS 35 16.114 -6.670 -32.676 362 H ARG 36 H ARG 36 16.494 -1.359 -27.137 363 HA ARG 36 HA ARG 36 17.539 1.201 -26.378 364 HB2 ARG 36 HB2 ARG 36 16.668 -1.160 -24.775 365 HB3 ARG 36 HB3 ARG 36 17.128 0.413 -24.099 366 HG2 ARG 36 HG2 ARG 36 15.324 1.450 -25.656 367 HG3 ARG 36 HG3 ARG 36 14.685 -0.237 -25.704 368 HD2 ARG 36 HD2 ARG 36 15.306 1.547 -23.330 369 HD3 ARG 36 HD3 ARG 36 13.696 1.002 -23.735 370 HE ARG 36 HE ARG 36 14.839 -1.399 -23.252 371 HH11 ARG 36 HH11 ARG 36 15.247 1.552 -21.731 372 HH12 ARG 36 HH12 ARG 36 15.491 0.928 -20.076 373 HH21 ARG 36 HH21 ARG 36 14.665 -2.270 -21.172 374 HH22 ARG 36 HH22 ARG 36 14.947 -1.160 -19.788 375 H HIS 37 H HIS 37 19.294 -1.938 -26.797 376 HA HIS 37 HA HIS 37 21.664 -0.990 -25.353 377 HB2 HIS 37 HB2 HIS 37 22.121 -3.253 -25.283 378 HB3 HIS 37 HB3 HIS 37 20.566 -3.140 -24.621 379 HD2 HIS 37 HD2 HIS 37 22.028 -5.451 -26.923 380 HE1 HIS 37 HE1 HIS 37 17.886 -5.290 -27.939 381 HE2 HIS 37 HE2 HIS 37 20.221 -6.595 -28.337 382 H THR 38 H THR 38 20.527 -0.460 -28.256 383 HA THR 38 HA THR 38 22.641 -1.130 -30.079 384 HB THR 38 HB THR 38 20.510 0.978 -29.960 385 HG1 THR 38 HG1 THR 38 20.206 -1.588 -30.363 386 HG21 THR 38 HG21 THR 38 21.914 1.781 -31.547 387 HG22 THR 38 HG22 THR 38 22.093 0.126 -32.304 388 HG23 THR 38 HG23 THR 38 20.593 0.970 -32.572 389 HA PRO 39 HA PRO 39 25.481 2.019 -28.443 390 HB2 PRO 39 HB2 PRO 39 26.774 1.484 -31.103 391 HB3 PRO 39 HB3 PRO 39 27.662 1.451 -29.471 392 HG2 PRO 39 HG2 PRO 39 27.143 -0.706 -30.790 393 HG3 PRO 39 HG3 PRO 39 27.085 -0.735 -29.021 394 HD2 PRO 39 HD2 PRO 39 24.935 -0.836 -31.072 395 HD3 PRO 39 HD3 PRO 39 24.885 -1.460 -29.404 396 H LEU 40 H LEU 40 25.489 4.073 -28.522 397 HA LEU 40 HA LEU 40 23.646 5.283 -30.261 398 HB2 LEU 40 HB2 LEU 40 25.361 6.528 -28.130 399 HB3 LEU 40 HB3 LEU 40 24.295 7.553 -29.032 400 HG LEU 40 HG LEU 40 23.123 5.033 -27.672 401 HD11 LEU 40 HD11 LEU 40 23.454 7.907 -26.471 402 HD12 LEU 40 HD12 LEU 40 22.880 6.529 -25.599 403 HD13 LEU 40 HD13 LEU 40 24.559 6.536 -25.973 404 HD21 LEU 40 HD21 LEU 40 21.159 6.682 -27.311 405 HD22 LEU 40 HD22 LEU 40 21.968 7.820 -28.428 406 HD23 LEU 40 HD23 LEU 40 21.374 6.299 -28.985 407 H SER 41 H SER 41 27.071 4.994 -30.481 408 HA SER 41 HA SER 41 27.839 7.111 -32.093 409 HB2 SER 41 HB2 SER 41 29.523 5.110 -32.902 410 HB3 SER 41 HB3 SER 41 29.520 5.679 -31.214 411 HG SER 41 HG SER 41 28.807 3.788 -30.577 412 H LYS 42 H LYS 42 26.096 4.126 -32.784 413 HA LYS 42 HA LYS 42 26.240 4.247 -35.533 414 HB2 LYS 42 HB2 LYS 42 23.862 2.962 -33.999 415 HB3 LYS 42 HB3 LYS 42 24.270 2.771 -35.685 416 HG2 LYS 42 HG2 LYS 42 26.517 1.791 -35.107 417 HG3 LYS 42 HG3 LYS 42 26.089 2.126 -33.397 418 HD2 LYS 42 HD2 LYS 42 25.721 -0.181 -33.691 419 HD3 LYS 42 HD3 LYS 42 24.149 0.589 -33.708 420 HE2 LYS 42 HE2 LYS 42 23.991 0.485 -36.126 421 HE3 LYS 42 HE3 LYS 42 25.748 0.018 -36.278 422 HZ1 LYS 42 HZ1 LYS 42 24.202 -1.742 -36.661 423 HZ2 LYS 42 HZ2 LYS 42 25.267 -1.984 -35.363 424 HZ3 LYS 42 HZ3 LYS 42 23.657 -1.664 -35.133 425 H LEU 43 H LEU 43 24.328 6.265 -33.505 426 HA LEU 43 HA LEU 43 22.544 7.393 -35.590 427 HB2 LEU 43 HB2 LEU 43 22.939 7.949 -32.690 428 HB3 LEU 43 HB3 LEU 43 21.923 8.921 -33.695 429 HG LEU 43 HG LEU 43 20.543 6.888 -34.173 430 HD11 LEU 43 HD11 LEU 43 21.870 5.549 -31.647 431 HD12 LEU 43 HD12 LEU 43 20.467 5.117 -32.475 432 HD13 LEU 43 HD13 LEU 43 22.030 5.039 -33.356 433 HD21 LEU 43 HD21 LEU 43 20.916 8.115 -31.419 434 HD22 LEU 43 HD22 LEU 43 19.881 8.556 -32.675 435 HD23 LEU 43 HD23 LEU 43 19.430 7.115 -31.832 436 H MET 44 H MET 44 25.109 8.365 -33.318 437 HA MET 44 HA MET 44 25.584 10.713 -34.416 438 HB2 MET 44 HB2 MET 44 27.909 9.148 -33.124 439 HB3 MET 44 HB3 MET 44 27.763 10.863 -33.194 440 HG2 MET 44 HG2 MET 44 26.350 11.130 -31.448 441 HG3 MET 44 HG3 MET 44 25.428 9.764 -31.674 442 HE1 MET 44 HE1 MET 44 29.358 8.415 -31.102 443 HE2 MET 44 HE2 MET 44 29.210 10.226 -30.929 444 HE3 MET 44 HE3 MET 44 29.458 9.058 -29.549 445 H LYS 45 H LYS 45 27.165 7.914 -35.771 446 HA LYS 45 HA LYS 45 28.725 9.226 -37.774 447 HB2 LYS 45 HB2 LYS 45 27.616 6.430 -37.425 448 HB3 LYS 45 HB3 LYS 45 28.642 6.919 -38.728 449 HG2 LYS 45 HG2 LYS 45 30.555 7.346 -37.190 450 HG3 LYS 45 HG3 LYS 45 29.369 7.259 -35.803 451 HD2 LYS 45 HD2 LYS 45 29.000 4.887 -36.158 452 HD3 LYS 45 HD3 LYS 45 30.055 4.920 -37.611 453 HE2 LYS 45 HE2 LYS 45 31.925 5.704 -36.017 454 HE3 LYS 45 HE3 LYS 45 30.881 5.525 -34.662 455 HZ1 LYS 45 HZ1 LYS 45 30.623 3.205 -35.252 456 HZ2 LYS 45 HZ2 LYS 45 31.598 3.432 -36.516 457 HZ3 LYS 45 HZ3 LYS 45 32.132 3.638 -34.894 458 H ALA 46 H ALA 46 25.473 7.695 -37.602 459 HA ALA 46 HA ALA 46 24.880 7.712 -40.407 460 HB1 ALA 46 HB1 ALA 46 23.072 7.668 -37.997 461 HB2 ALA 46 HB2 ALA 46 22.407 7.774 -39.613 462 HB3 ALA 46 HB3 ALA 46 23.443 6.399 -39.224 463 H TYR 47 H TYR 47 23.938 10.238 -38.017 464 HA TYR 47 HA TYR 47 22.752 11.961 -39.939 465 HB2 TYR 47 HB2 TYR 47 22.023 12.090 -37.574 466 HB3 TYR 47 HB3 TYR 47 23.664 12.031 -37.035 467 HD1 TYR 47 HD1 TYR 47 21.001 14.149 -38.299 468 HD2 TYR 47 HD2 TYR 47 25.150 14.016 -37.210 469 HE1 TYR 47 HE1 TYR 47 21.261 16.747 -38.626 470 HE2 TYR 47 HE2 TYR 47 25.354 16.398 -37.376 471 HH TYR 47 HH TYR 47 22.454 18.445 -38.164 472 H CYS 48 H CYS 48 25.837 11.887 -38.472 473 HA CYS 48 HA CYS 48 27.088 14.204 -39.568 474 HB2 CYS 48 HB2 CYS 48 28.148 13.013 -37.886 475 HB3 CYS 48 HB3 CYS 48 28.307 11.547 -38.882 476 HG CYS 48 HG CYS 48 30.315 12.656 -40.404 477 H GLU 49 H GLU 49 27.078 10.969 -41.017 478 HA GLU 49 HA GLU 49 28.452 11.596 -43.456 479 HB2 GLU 49 HB2 GLU 49 26.672 9.300 -42.613 480 HB3 GLU 49 HB3 GLU 49 27.489 9.512 -44.269 481 HG2 GLU 49 HG2 GLU 49 29.649 9.727 -43.259 482 HG3 GLU 49 HG3 GLU 49 28.930 9.395 -41.663 483 H ARG 50 H ARG 50 24.932 11.655 -42.514 484 HA ARG 50 HA ARG 50 24.191 12.371 -45.219 485 HB2 ARG 50 HB2 ARG 50 22.668 12.504 -42.618 486 HB3 ARG 50 HB3 ARG 50 22.108 13.165 -44.072 487 HG2 ARG 50 HG2 ARG 50 22.451 10.786 -45.182 488 HG3 ARG 50 HG3 ARG 50 22.591 10.195 -43.545 489 HD2 ARG 50 HD2 ARG 50 20.294 11.115 -43.066 490 HD3 ARG 50 HD3 ARG 50 20.261 11.766 -44.756 491 HE ARG 50 HE ARG 50 20.891 9.052 -44.597 492 HH11 ARG 50 HH11 ARG 50 18.229 11.110 -44.269 493 HH12 ARG 50 HH12 ARG 50 16.936 10.140 -44.778 494 HH21 ARG 50 HH21 ARG 50 19.278 7.400 -45.123 495 HH22 ARG 50 HH22 ARG 50 17.684 8.003 -45.435 496 H GLN 51 H GLN 51 25.257 14.449 -42.516 497 HA GLN 51 HA GLN 51 24.621 16.807 -44.139 498 HB2 GLN 51 HB2 GLN 51 26.351 16.855 -41.613 499 HB3 GLN 51 HB3 GLN 51 25.642 18.165 -42.340 500 HG2 GLN 51 HG2 GLN 51 24.491 16.055 -40.632 501 HG3 GLN 51 HG3 GLN 51 24.204 17.728 -40.529 502 HE21 GLN 51 HE22 GLN 51 22.679 14.697 -41.201 503 HE22 GLN 51 HE21 GLN 51 21.517 15.351 -42.315 504 H GLY 52 H GLY 52 27.231 14.612 -44.001 505 HA2 GLY 52 HA2 GLY 52 28.834 14.222 -45.419 506 HA3 GLY 52 HA3 GLY 52 28.692 15.807 -46.196 507 H LEU 53 H LEU 53 29.076 15.764 -42.892 508 HA LEU 53 HA LEU 53 31.694 17.114 -42.807 509 HB2 LEU 53 HB2 LEU 53 29.991 15.812 -40.710 510 HB3 LEU 53 HB3 LEU 53 31.203 17.059 -40.436 511 HG LEU 53 HG LEU 53 28.518 17.391 -41.749 512 HD11 LEU 53 HD11 LEU 53 28.513 17.022 -39.281 513 HD12 LEU 53 HD12 LEU 53 29.568 18.525 -39.151 514 HD13 LEU 53 HD13 LEU 53 27.980 18.698 -39.779 515 HD21 LEU 53 HD21 LEU 53 30.268 18.872 -42.736 516 HD22 LEU 53 HD22 LEU 53 28.917 19.679 -41.834 517 HD23 LEU 53 HD23 LEU 53 30.484 19.628 -41.102 518 H SER 54 H SER 54 33.454 16.553 -41.537 519 HA SER 54 HA SER 54 34.132 13.694 -41.420 520 HB2 SER 54 HB2 SER 54 35.807 15.439 -42.289 521 HB3 SER 54 HB3 SER 54 36.037 15.838 -40.498 522 HG SER 54 HG SER 54 37.501 14.367 -41.152 523 H MET 55 H MET 55 33.370 12.769 -39.661 524 HA MET 55 HA MET 55 32.141 13.847 -37.417 525 HB2 MET 55 HB2 MET 55 31.917 11.557 -38.275 526 HB3 MET 55 HB3 MET 55 33.395 11.015 -37.662 527 HG2 MET 55 HG2 MET 55 32.553 11.545 -35.341 528 HG3 MET 55 HG3 MET 55 31.119 12.404 -35.945 529 HE1 MET 55 HE1 MET 55 31.784 10.094 -33.972 530 HE2 MET 55 HE2 MET 55 30.044 10.228 -33.852 531 HE3 MET 55 HE3 MET 55 30.750 8.640 -34.172 532 H ARG 56 H ARG 56 35.683 13.450 -37.876 533 HA ARG 56 HA ARG 56 36.320 13.626 -35.016 534 HB2 ARG 56 HB2 ARG 56 37.566 12.294 -36.224 535 HB3 ARG 56 HB3 ARG 56 37.844 13.604 -37.474 536 HG2 ARG 56 HG2 ARG 56 39.073 14.736 -35.744 537 HG3 ARG 56 HG3 ARG 56 38.787 13.454 -34.668 538 HD2 ARG 56 HD2 ARG 56 40.285 13.198 -37.221 539 HD3 ARG 56 HD3 ARG 56 41.207 13.509 -35.751 540 HE ARG 56 HE ARG 56 39.541 11.066 -35.547 541 HH11 ARG 56 HH11 ARG 56 42.363 12.163 -37.361 542 HH12 ARG 56 HH12 ARG 56 42.781 10.522 -37.739 543 HH21 ARG 56 HH21 ARG 56 40.305 9.158 -35.546 544 HH22 ARG 56 HH22 ARG 56 41.580 8.666 -36.559 545 H GLN 57 H GLN 57 35.352 16.086 -37.193 546 HA GLN 57 HA GLN 57 36.618 18.169 -35.588 547 HB2 GLN 57 HB2 GLN 57 36.365 19.437 -37.632 548 HB3 GLN 57 HB3 GLN 57 36.494 17.928 -38.238 549 HG2 GLN 57 HG2 GLN 57 33.695 18.109 -38.057 550 HG3 GLN 57 HG3 GLN 57 34.150 19.805 -38.415 551 HE21 GLN 57 HE22 GLN 57 36.279 19.430 -40.248 552 HE22 GLN 57 HE21 GLN 57 35.515 18.978 -41.684 553 H ILE 58 H ILE 58 33.845 16.617 -35.137 554 HA ILE 58 HA ILE 58 32.459 18.921 -33.889 555 HB ILE 58 HB ILE 58 30.327 18.016 -34.529 556 HG12 ILE 58 HG12 ILE 58 31.866 15.839 -36.122 557 HG13 ILE 58 HG13 ILE 58 30.806 15.655 -34.764 558 HG21 ILE 58 HG21 ILE 58 31.831 18.482 -37.001 559 HG22 ILE 58 HG22 ILE 58 30.214 18.945 -36.673 560 HG23 ILE 58 HG23 ILE 58 31.553 19.714 -35.774 561 HD11 ILE 58 HD11 ILE 58 28.840 16.368 -35.868 562 HD12 ILE 58 HD12 ILE 58 29.574 16.402 -37.427 563 HD13 ILE 58 HD13 ILE 58 29.528 14.870 -36.563 564 H ARG 59 H ARG 59 30.940 18.494 -32.167 565 HA ARG 59 HA ARG 59 31.386 16.065 -30.425 566 HB2 ARG 59 HB2 ARG 59 31.108 18.845 -29.228 567 HB3 ARG 59 HB3 ARG 59 31.392 17.416 -28.420 568 HG2 ARG 59 HG2 ARG 59 33.477 18.677 -30.246 569 HG3 ARG 59 HG3 ARG 59 33.418 18.756 -28.599 570 HD2 ARG 59 HD2 ARG 59 33.592 16.130 -28.498 571 HD3 ARG 59 HD3 ARG 59 33.628 16.068 -30.206 572 HE ARG 59 HE ARG 59 35.761 17.225 -28.609 573 HH11 ARG 59 HH11 ARG 59 34.715 15.727 -31.774 574 HH12 ARG 59 HH12 ARG 59 36.411 15.703 -32.346 575 HH21 ARG 59 HH21 ARG 59 37.740 17.448 -29.703 576 HH22 ARG 59 HH22 ARG 59 38.060 16.572 -31.179 577 H PHE 60 H PHE 60 29.801 15.365 -28.992 578 HA PHE 60 HA PHE 60 26.871 15.697 -29.821 579 HB2 PHE 60 HB2 PHE 60 28.395 13.126 -29.152 580 HB3 PHE 60 HB3 PHE 60 26.710 13.381 -29.755 581 HD1 PHE 60 HD2 PHE 60 26.398 14.069 -32.123 582 HD2 PHE 60 HD1 PHE 60 30.032 12.979 -30.515 583 HE1 PHE 60 HE2 PHE 60 27.191 13.784 -34.413 584 HE2 PHE 60 HE1 PHE 60 31.156 12.868 -32.886 585 HZ PHE 60 HZ PHE 60 29.610 13.324 -34.829 586 H ARG 61 H ARG 61 25.568 16.223 -28.336 587 HA ARG 61 HA ARG 61 26.450 15.324 -25.692 588 HB2 ARG 61 HB2 ARG 61 25.707 18.109 -26.366 589 HB3 ARG 61 HB3 ARG 61 25.689 17.599 -24.635 590 HG2 ARG 61 HG2 ARG 61 28.282 17.184 -25.080 591 HG3 ARG 61 HG3 ARG 61 28.076 17.935 -26.642 592 HD2 ARG 61 HD2 ARG 61 27.131 19.927 -25.398 593 HD3 ARG 61 HD3 ARG 61 27.511 19.063 -23.906 594 HE ARG 61 HE ARG 61 29.882 19.181 -24.589 595 HH11 ARG 61 HH11 ARG 61 27.867 21.588 -25.820 596 HH12 ARG 61 HH12 ARG 61 29.132 22.402 -26.792 597 HH21 ARG 61 HH21 ARG 61 31.420 20.152 -25.675 598 HH22 ARG 61 HH22 ARG 61 31.283 21.754 -26.478 599 H PHE 62 H PHE 62 24.999 14.973 -24.102 600 HA PHE 62 HA PHE 62 22.056 15.427 -24.549 601 HB2 PHE 62 HB2 PHE 62 22.433 13.257 -25.593 602 HB3 PHE 62 HB3 PHE 62 23.440 12.741 -24.203 603 HD1 PHE 62 HD2 PHE 62 19.812 13.557 -25.246 604 HD2 PHE 62 HD1 PHE 62 22.500 11.772 -22.422 605 HE1 PHE 62 HE2 PHE 62 17.866 12.926 -23.910 606 HE2 PHE 62 HE1 PHE 62 20.469 10.862 -21.137 607 HZ PHE 62 HZ PHE 62 18.178 11.561 -21.896 608 H ASP 63 H ASP 63 20.843 15.679 -22.615 609 HA ASP 63 HA ASP 63 20.587 16.589 -20.573 610 HB2 ASP 63 HB2 ASP 63 21.150 14.068 -20.203 611 HB3 ASP 63 HB3 ASP 63 22.610 14.622 -19.586 612 H GLY 64 H GLY 64 22.861 17.593 -22.211 613 HA2 GLY 64 HA2 GLY 64 24.395 19.522 -22.043 614 HA3 GLY 64 HA3 GLY 64 24.123 19.551 -20.279 615 H GLN 65 H GLN 65 25.068 16.440 -21.539 616 HA GLN 65 HA GLN 65 27.915 16.953 -20.864 617 HB2 GLN 65 HB2 GLN 65 25.869 14.802 -20.171 618 HB3 GLN 65 HB3 GLN 65 27.655 14.552 -19.864 619 HG2 GLN 65 HG2 GLN 65 27.813 16.417 -18.479 620 HG3 GLN 65 HG3 GLN 65 25.951 16.594 -18.486 621 HE21 GLN 65 HE22 GLN 65 25.768 16.399 -16.355 622 HE22 GLN 65 HE21 GLN 65 26.130 14.986 -15.312 623 HA PRO 66 HA PRO 66 29.155 14.880 -24.381 624 HB2 PRO 66 HB2 PRO 66 31.596 13.595 -23.710 625 HB3 PRO 66 HB3 PRO 66 31.231 15.399 -23.483 626 HG2 PRO 66 HG2 PRO 66 30.782 13.281 -21.408 627 HG3 PRO 66 HG3 PRO 66 31.994 14.631 -21.297 628 HD2 PRO 66 HD2 PRO 66 29.653 15.142 -20.296 629 HD3 PRO 66 HD3 PRO 66 30.292 16.202 -21.580 630 H ILE 67 H ILE 67 29.987 12.744 -25.430 631 HA ILE 67 HA ILE 67 28.408 10.280 -24.355 632 HB ILE 67 HB ILE 67 28.245 11.670 -27.065 633 HG12 ILE 67 HG12 ILE 67 26.063 11.571 -24.896 634 HG13 ILE 67 HG13 ILE 67 26.939 13.010 -25.354 635 HG21 ILE 67 HG21 ILE 67 26.570 9.434 -25.898 636 HG22 ILE 67 HG22 ILE 67 26.579 9.997 -27.584 637 HG23 ILE 67 HG23 ILE 67 27.907 9.081 -27.037 638 HD11 ILE 67 HD11 ILE 67 24.985 13.243 -26.642 639 HD12 ILE 67 HD12 ILE 67 26.050 12.542 -27.909 640 HD13 ILE 67 HD13 ILE 67 24.868 11.588 -27.160 641 H ASN 68 H ASN 68 29.448 8.484 -24.571 642 HA ASN 68 HA ASN 68 32.015 8.393 -26.101 643 HB2 ASN 68 HB2 ASN 68 30.899 6.343 -24.230 644 HB3 ASN 68 HB3 ASN 68 32.521 6.559 -24.917 645 HD21 ASN 68 HD22 ASN 68 30.238 8.125 -22.710 646 HD22 ASN 68 HD21 ASN 68 31.629 8.786 -21.776 647 H GLU 69 H GLU 69 32.456 6.657 -27.651 648 HA GLU 69 HA GLU 69 30.462 6.098 -29.472 649 HB2 GLU 69 HB2 GLU 69 32.708 6.044 -29.871 650 HB3 GLU 69 HB3 GLU 69 33.074 4.642 -28.826 651 HG2 GLU 69 HG2 GLU 69 31.718 3.150 -30.190 652 HG3 GLU 69 HG3 GLU 69 31.193 4.599 -31.091 653 H THR 70 H THR 70 31.214 4.171 -26.551 654 HA THR 70 HA THR 70 29.401 1.915 -27.315 655 HB THR 70 HB THR 70 30.281 1.120 -25.062 656 HG1 THR 70 HG1 THR 70 31.100 2.779 -24.196 657 HG21 THR 70 HG21 THR 70 32.584 0.692 -26.132 658 HG22 THR 70 HG22 THR 70 31.291 0.097 -27.046 659 HG23 THR 70 HG23 THR 70 32.132 1.814 -27.283 660 H ASP 71 H ASP 71 28.765 4.961 -25.696 661 HA ASP 71 HA ASP 71 27.085 3.914 -23.700 662 HB2 ASP 71 HB2 ASP 71 26.899 6.627 -25.031 663 HB3 ASP 71 HB3 ASP 71 26.203 6.099 -23.541 664 H THR 72 H THR 72 24.635 4.406 -23.595 665 HA THR 72 HA THR 72 23.153 3.368 -25.862 666 HB THR 72 HB THR 72 22.350 1.296 -24.993 667 HG1 THR 72 HG1 THR 72 24.305 0.513 -23.489 668 HG21 THR 72 HG21 THR 72 25.376 1.147 -25.297 669 HG22 THR 72 HG22 THR 72 24.164 -0.084 -25.726 670 HG23 THR 72 HG23 THR 72 24.324 1.427 -26.677 671 HA PRO 73 HA PRO 73 19.712 5.382 -23.634 672 HB2 PRO 73 HB2 PRO 73 18.037 3.167 -24.694 673 HB3 PRO 73 HB3 PRO 73 17.751 4.842 -24.744 674 HG2 PRO 73 HG2 PRO 73 18.661 3.727 -26.993 675 HG3 PRO 73 HG3 PRO 73 19.339 5.316 -26.629 676 HD2 PRO 73 HD2 PRO 73 20.544 2.628 -26.220 677 HD3 PRO 73 HD3 PRO 73 21.195 4.270 -26.689 678 H ALA 74 H ALA 74 19.918 1.684 -23.457 679 HA ALA 74 HA ALA 74 18.760 1.123 -21.066 680 HB1 ALA 74 HB1 ALA 74 20.410 -0.669 -20.992 681 HB2 ALA 74 HB2 ALA 74 19.549 -0.531 -22.473 682 HB3 ALA 74 HB3 ALA 74 21.325 0.037 -22.332 683 H GLN 75 H GLN 75 22.209 2.276 -21.643 684 HA GLN 75 HA GLN 75 22.532 2.027 -18.807 685 HB2 GLN 75 HB2 GLN 75 24.498 1.248 -20.147 686 HB3 GLN 75 HB3 GLN 75 24.389 2.516 -21.286 687 HG2 GLN 75 HG2 GLN 75 26.385 2.721 -19.648 688 HG3 GLN 75 HG3 GLN 75 25.310 4.117 -19.616 689 HE21 GLN 75 HE22 GLN 75 26.087 4.708 -17.680 690 HE22 GLN 75 HE21 GLN 75 25.789 3.813 -16.238 691 H LEU 76 H LEU 76 22.337 4.831 -21.104 692 HA LEU 76 HA LEU 76 22.954 6.844 -19.157 693 HB2 LEU 76 HB2 LEU 76 21.575 7.129 -21.842 694 HB3 LEU 76 HB3 LEU 76 22.319 8.376 -20.813 695 HG LEU 76 HG LEU 76 23.840 6.159 -22.297 696 HD11 LEU 76 HD11 LEU 76 24.511 7.968 -23.545 697 HD12 LEU 76 HD12 LEU 76 22.751 7.842 -23.697 698 HD13 LEU 76 HD13 LEU 76 23.390 9.200 -22.750 699 HD21 LEU 76 HD21 LEU 76 25.046 6.714 -20.244 700 HD22 LEU 76 HD22 LEU 76 25.793 7.306 -21.486 701 HD23 LEU 76 HD23 LEU 76 24.927 8.444 -20.432 702 H GLU 77 H GLU 77 19.978 5.102 -20.293 703 HA GLU 77 HA GLU 77 17.974 4.833 -19.232 704 HB2 GLU 77 HB2 GLU 77 18.791 6.288 -16.796 705 HB3 GLU 77 HB3 GLU 77 17.229 5.527 -17.220 706 HG2 GLU 77 HG2 GLU 77 19.677 3.816 -17.342 707 HG3 GLU 77 HG3 GLU 77 19.051 4.289 -15.788 708 H MET 78 H MET 78 18.188 6.342 -21.370 709 HA MET 78 HA MET 78 17.177 9.032 -21.157 710 HB2 MET 78 HB2 MET 78 17.402 7.191 -23.487 711 HB3 MET 78 HB3 MET 78 17.265 8.884 -23.693 712 HG2 MET 78 HG2 MET 78 19.416 9.232 -22.613 713 HG3 MET 78 HG3 MET 78 19.736 7.444 -22.541 714 HE1 MET 78 HE1 MET 78 19.894 10.670 -24.783 715 HE2 MET 78 HE2 MET 78 19.691 10.068 -26.495 716 HE3 MET 78 HE3 MET 78 18.295 10.184 -25.487 717 H GLU 79 H GLU 79 15.275 9.667 -22.279 718 HA GLU 79 HA GLU 79 13.003 7.851 -21.908 719 HB2 GLU 79 HB2 GLU 79 13.180 10.913 -21.217 720 HB3 GLU 79 HB3 GLU 79 11.622 9.984 -21.335 721 HG2 GLU 79 HG2 GLU 79 13.915 9.462 -19.462 722 HG3 GLU 79 HG3 GLU 79 12.414 10.328 -19.051 723 H ASP 80 H ASP 80 11.071 8.551 -23.306 724 HA ASP 80 HA ASP 80 12.419 8.339 -25.947 725 HB2 ASP 80 HB2 ASP 80 10.565 6.751 -24.990 726 HB3 ASP 80 HB3 ASP 80 9.456 7.933 -25.001 727 H GLU 81 H GLU 81 11.226 9.335 -27.818 728 HA GLU 81 HA GLU 81 11.505 11.341 -29.031 729 HB2 GLU 81 HB2 GLU 81 9.239 12.067 -27.201 730 HB3 GLU 81 HB3 GLU 81 9.643 12.929 -28.761 731 HG2 GLU 81 HG2 GLU 81 9.436 10.890 -29.964 732 HG3 GLU 81 HG3 GLU 81 8.866 10.019 -28.462 733 H ASP 82 H ASP 82 13.618 11.492 -27.549 734 HA ASP 82 HA ASP 82 13.858 14.387 -26.716 735 HB2 ASP 82 HB2 ASP 82 14.314 12.376 -24.854 736 HB3 ASP 82 HB3 ASP 82 15.929 12.556 -25.526 737 H THR 83 H THR 83 16.109 15.301 -26.915 738 HA THR 83 HA THR 83 17.277 14.339 -29.514 739 HB THR 83 HB THR 83 16.800 17.204 -28.410 740 HG1 THR 83 HG1 THR 83 14.936 16.199 -29.158 741 HG21 THR 83 HG21 THR 83 18.026 16.239 -30.968 742 HG22 THR 83 HG22 THR 83 17.307 17.901 -30.783 743 HG23 THR 83 HG23 THR 83 18.603 17.502 -29.754 744 H ILE 84 H ILE 84 19.248 14.203 -29.877 745 HA ILE 84 HA ILE 84 21.375 14.816 -27.839 746 HB ILE 84 HB ILE 84 21.327 13.429 -30.477 747 HG12 ILE 84 HG12 ILE 84 22.273 11.894 -28.038 748 HG13 ILE 84 HG13 ILE 84 20.600 12.281 -27.956 749 HG21 ILE 84 HG21 ILE 84 23.697 14.079 -28.816 750 HG22 ILE 84 HG22 ILE 84 23.798 12.646 -29.954 751 HG23 ILE 84 HG23 ILE 84 23.540 14.154 -30.612 752 HD11 ILE 84 HD11 ILE 84 22.093 10.848 -30.205 753 HD12 ILE 84 HD12 ILE 84 20.990 10.078 -28.944 754 HD13 ILE 84 HD13 ILE 84 20.432 11.018 -30.373 755 H ASP 85 H ASP 85 22.364 16.907 -28.158 756 HA ASP 85 HA ASP 85 22.012 18.305 -30.663 757 HB2 ASP 85 HB2 ASP 85 23.528 19.089 -28.037 758 HB3 ASP 85 HB3 ASP 85 23.579 19.985 -29.496 759 H VAL 86 H VAL 86 23.563 18.936 -31.927 760 HA VAL 86 HA VAL 86 26.302 17.770 -31.784 761 HB VAL 86 HB VAL 86 24.750 18.509 -34.205 762 HG11 VAL 86 HG11 VAL 86 26.571 17.458 -35.477 763 HG12 VAL 86 HG12 VAL 86 27.269 18.715 -34.341 764 HG13 VAL 86 HG13 VAL 86 27.445 17.096 -34.014 765 HG21 VAL 86 HG21 VAL 86 25.292 15.870 -32.868 766 HG22 VAL 86 HG22 VAL 86 23.665 16.584 -33.223 767 HG23 VAL 86 HG23 VAL 86 24.527 15.980 -34.511 768 H PHE 87 H PHE 87 28.005 18.989 -31.875 769 HA PHE 87 HA PHE 87 27.645 21.914 -32.354 770 HB2 PHE 87 HB2 PHE 87 29.422 20.565 -30.168 771 HB3 PHE 87 HB3 PHE 87 29.390 22.321 -30.479 772 HD1 PHE 87 HD2 PHE 87 27.090 23.413 -30.573 773 HD2 PHE 87 HD1 PHE 87 27.655 19.562 -28.703 774 HE1 PHE 87 HE2 PHE 87 24.936 23.679 -29.181 775 HE2 PHE 87 HE1 PHE 87 25.520 19.830 -27.486 776 HZ PHE 87 HZ PHE 87 24.264 21.845 -27.665 777 H GLN 88 H GLN 88 28.997 22.884 -33.656 778 HA GLN 88 HA GLN 88 31.368 21.696 -34.869 779 HB2 GLN 88 HB2 GLN 88 30.313 24.516 -34.883 780 HB3 GLN 88 HB3 GLN 88 31.748 23.960 -35.814 781 HG2 GLN 88 HG2 GLN 88 28.999 22.521 -36.227 782 HG3 GLN 88 HG3 GLN 88 29.607 23.976 -37.171 783 HE21 GLN 88 HE22 GLN 88 28.933 21.945 -38.436 784 HE22 GLN 88 HE21 GLN 88 30.378 21.611 -39.402 785 H GLN 89 H GLN 89 33.305 23.427 -34.679 786 HA GLN 89 HA GLN 89 34.123 24.066 -31.885 787 HB2 GLN 89 HB2 GLN 89 35.614 22.071 -33.594 788 HB3 GLN 89 HB3 GLN 89 36.154 22.712 -32.036 789 HG2 GLN 89 HG2 GLN 89 33.741 20.884 -32.493 790 HG3 GLN 89 HG3 GLN 89 35.379 20.369 -31.947 791 HE21 GLN 89 HE22 GLN 89 32.590 22.398 -30.884 792 HE22 GLN 89 HE21 GLN 89 33.188 22.222 -29.205 793 H GLN 90 H GLN 90 36.169 25.112 -31.608 794 HA GLN 90 HA GLN 90 37.154 26.861 -33.985 795 HB2 GLN 90 HB2 GLN 90 34.979 27.574 -32.925 796 HB3 GLN 90 HB3 GLN 90 35.884 28.021 -31.510 797 HG2 GLN 90 HG2 GLN 90 37.247 29.634 -32.610 798 HG3 GLN 90 HG3 GLN 90 36.853 29.081 -34.161 799 HE21 GLN 90 HE22 GLN 90 36.566 31.697 -33.510 800 HE22 GLN 90 HE21 GLN 90 34.927 32.123 -33.711 801 H THR 91 H THR 91 38.520 24.715 -32.373 802 HA THR 91 HA THR 91 39.487 25.850 -29.972 803 HB THR 91 HB THR 91 40.863 23.853 -29.759 804 HG1 THR 91 HG1 THR 91 41.180 23.176 -31.864 805 HG21 THR 91 HG21 THR 91 38.002 23.104 -30.374 806 HG22 THR 91 HG22 THR 91 39.144 22.240 -29.471 807 HG23 THR 91 HG23 THR 91 38.477 23.787 -28.834 808 H GLY 92 H GLY 92 41.510 26.476 -29.288 809 HA2 GLY 92 HA2 GLY 92 43.621 27.628 -29.574 810 HA3 GLY 92 HA3 GLY 92 43.453 27.164 -31.331 811 H GLY 93 H GLY 93 43.943 29.370 -31.981 812 HA2 GLY 93 HA2 GLY 93 41.853 31.148 -32.202 813 HA3 GLY 93 HA3 GLY 93 42.527 31.587 -30.696 814 H VAL 94 H VAL 94 42.633 33.450 -32.031 815 HA VAL 94 HA VAL 94 45.522 34.127 -32.440 816 HB VAL 94 HB VAL 94 43.327 34.932 -34.392 817 HG11 VAL 94 HG11 VAL 94 44.689 37.093 -33.946 818 HG12 VAL 94 HG12 VAL 94 46.156 36.140 -34.198 819 HG13 VAL 94 HG13 VAL 94 45.071 36.385 -35.539 820 HG21 VAL 94 HG21 VAL 94 46.109 33.696 -34.816 821 HG22 VAL 94 HG22 VAL 94 44.684 32.832 -34.790 822 HG23 VAL 94 HG23 VAL 94 45.054 34.180 -36.001 823 H TYR 95 H TYR 95 46.030 35.984 -31.644 824 HA TYR 95 HA TYR 95 44.100 37.831 -30.423 825 HB2 TYR 95 HB2 TYR 95 46.085 36.671 -28.466 826 HB3 TYR 95 HB3 TYR 95 44.667 37.663 -28.169 827 HD1 TYR 95 HD2 TYR 95 46.061 34.068 -29.338 828 HD2 TYR 95 HD1 TYR 95 42.831 36.313 -27.341 829 HE1 TYR 95 HE2 TYR 95 44.983 32.055 -28.820 830 HE2 TYR 95 HE1 TYR 95 41.751 34.231 -26.780 831 HH TYR 95 HH TYR 95 42.086 32.010 -26.726 Start of MODEL 3 1 H1 ACE 36 HH32 ACE 36 13.071 17.324 -46.068 2 H2 ACE 36 HH33 ACE 36 11.678 18.325 -45.625 3 H3 ACE 36 HH31 ACE 36 12.318 17.206 -44.483 4 H GLU 37 H GLU 37 12.565 15.900 -47.538 5 HA GLU 37 HA GLU 37 10.129 14.218 -47.782 6 HB2 GLU 37 HB2 GLU 37 11.652 14.854 -49.707 7 HB3 GLU 37 HB3 GLU 37 12.928 13.832 -48.997 8 HG2 GLU 37 HG2 GLU 37 11.687 12.883 -50.891 9 HG3 GLU 37 HG3 GLU 37 11.616 11.777 -49.439 10 H ASP 38 H ASP 38 12.994 13.759 -45.883 11 HA ASP 38 HA ASP 38 12.208 10.962 -45.275 12 HB2 ASP 38 HB2 ASP 38 13.342 10.878 -47.332 13 HB3 ASP 38 HB3 ASP 38 14.897 11.414 -46.580 14 H ALA 39 H ALA 39 11.935 12.638 -43.469 15 HA ALA 39 HA ALA 39 14.322 13.018 -42.066 16 HB1 ALA 39 HB1 ALA 39 11.458 13.684 -41.236 17 HB2 ALA 39 HB2 ALA 39 12.774 14.094 -40.182 18 HB3 ALA 39 HB3 ALA 39 12.722 14.867 -41.714 19 H PHE 40 H PHE 40 14.038 10.538 -42.398 20 HA PHE 40 HA PHE 40 13.984 9.395 -39.649 21 HB2 PHE 40 HB2 PHE 40 11.880 9.030 -41.690 22 HB3 PHE 40 HB3 PHE 40 12.591 7.539 -41.672 23 HD1 PHE 40 HD1 PHE 40 11.597 9.707 -38.815 24 HD2 PHE 40 HD2 PHE 40 12.050 5.789 -40.448 25 HE1 PHE 40 HE1 PHE 40 10.338 8.744 -36.896 26 HE2 PHE 40 HE2 PHE 40 10.841 4.796 -38.458 27 HZ PHE 40 HZ PHE 40 9.894 6.357 -36.748 28 H ILE 41 H ILE 41 15.474 7.505 -39.247 29 HA ILE 41 HA ILE 41 16.348 5.755 -41.345 30 HB ILE 41 HB ILE 41 18.271 7.040 -39.421 31 HG12 ILE 41 HG12 ILE 41 17.962 8.049 -42.346 32 HG13 ILE 41 HG13 ILE 41 17.607 8.929 -40.881 33 HG21 ILE 41 HG21 ILE 41 19.301 5.716 -41.938 34 HG22 ILE 41 HG22 ILE 41 20.109 6.201 -40.460 35 HG23 ILE 41 HG23 ILE 41 18.884 4.885 -40.571 36 HD11 ILE 41 HD11 ILE 41 19.873 9.764 -41.661 37 HD12 ILE 41 HD12 ILE 41 20.071 8.773 -40.215 38 HD13 ILE 41 HD13 ILE 41 20.266 8.066 -41.820 39 H VAL 42 H VAL 42 16.420 3.758 -40.695 40 HA VAL 42 HA VAL 42 15.721 3.519 -37.814 41 HB VAL 42 HB VAL 42 14.865 1.631 -40.018 42 HG11 VAL 42 HG11 VAL 42 12.991 1.193 -38.317 43 HG12 VAL 42 HG12 VAL 42 14.574 0.865 -37.574 44 HG13 VAL 42 HG13 VAL 42 13.719 2.451 -37.291 45 HG21 VAL 42 HG21 VAL 42 13.332 4.082 -39.007 46 HG22 VAL 42 HG22 VAL 42 14.045 3.853 -40.595 47 HG23 VAL 42 HG23 VAL 42 12.732 2.776 -40.068 48 H ILE 43 H ILE 43 17.012 2.326 -36.593 49 HA ILE 43 HA ILE 43 19.076 0.579 -37.722 50 HB ILE 43 HB ILE 43 19.698 2.711 -35.578 51 HG12 ILE 43 HG12 ILE 43 19.764 3.046 -38.588 52 HG13 ILE 43 HG13 ILE 43 18.866 4.162 -37.497 53 HG21 ILE 43 HG21 ILE 43 21.411 1.163 -37.449 54 HG22 ILE 43 HG22 ILE 43 22.053 2.607 -36.490 55 HG23 ILE 43 HG23 ILE 43 21.459 1.171 -35.750 56 HD11 ILE 43 HD11 ILE 43 20.732 5.504 -38.236 57 HD12 ILE 43 HD12 ILE 43 21.380 4.865 -36.783 58 HD13 ILE 43 HD13 ILE 43 21.752 4.088 -38.309 59 H SEP 44 H SEP 44 20.107 -0.922 -36.537 60 HA SEP 44 HA SEP 44 19.843 -0.975 -33.640 61 HB2 SEP 44 HB2 SEP 44 18.868 -3.289 -33.540 62 HB3 SEP 44 HB3 SEP 44 17.855 -2.102 -34.374 63 H ASP 45 H ASP 45 20.961 -3.301 -33.029 64 HA ASP 45 HA ASP 45 23.606 -3.288 -34.509 65 HB2 ASP 45 HB2 ASP 45 23.609 -1.667 -32.792 66 HB3 ASP 45 HB3 ASP 45 23.269 -2.965 -31.596 67 H SEP 46 H SEP 46 21.605 -5.438 -34.734 68 HA SEP 46 HA SEP 46 23.548 -7.723 -33.953 69 HB2 SEP 46 HB2 SEP 46 21.718 -9.246 -33.572 70 HB3 SEP 46 HB3 SEP 46 21.888 -7.871 -32.387 71 H ASP 47 H ASP 47 24.347 -8.407 -35.792 72 HA ASP 47 HA ASP 47 22.337 -8.770 -37.996 73 HB2 ASP 47 HB2 ASP 47 23.690 -6.740 -38.203 74 HB3 ASP 47 HB3 ASP 47 25.130 -7.730 -38.167 75 H GLY 48 H GLY 48 23.194 -10.114 -39.948 76 HA2 GLY 48 HA2 GLY 48 25.447 -11.684 -39.717 77 HA3 GLY 48 HA3 GLY 48 24.144 -12.718 -39.022 78 H GLU 49 H GLU 49 25.229 -13.828 -40.778 79 HA GLU 49 HA GLU 49 23.974 -13.615 -43.539 80 HB2 GLU 49 HB2 GLU 49 25.882 -12.257 -43.617 81 HB3 GLU 49 HB3 GLU 49 26.882 -13.418 -42.792 82 HG2 GLU 49 HG2 GLU 49 27.308 -13.183 -45.112 83 HG3 GLU 49 HG3 GLU 49 26.970 -14.839 -44.660 84 HN1 NH2 50 HN1 NH2 50 26.236 -15.830 -41.705 85 HN2 NH2 50 HN2 NH2 50 25.893 -17.144 -42.849 86 H1 MET 1 H1 MET 1 -8.042 -31.160 -46.811 87 H2 MET 1 H2 MET 1 -6.424 -30.514 -46.762 88 H3 MET 1 H3 MET 1 -7.652 -29.753 -47.453 89 HA MET 1 HA MET 1 -8.702 -29.964 -45.097 90 HB2 MET 1 HB2 MET 1 -5.731 -30.398 -44.440 91 HB3 MET 1 HB3 MET 1 -7.015 -29.905 -43.367 92 HG2 MET 1 HG2 MET 1 -6.568 -32.168 -43.102 93 HG3 MET 1 HG3 MET 1 -8.235 -31.926 -43.671 94 HE1 MET 1 HE1 MET 1 -8.941 -34.447 -44.568 95 HE2 MET 1 HE2 MET 1 -7.641 -35.433 -45.200 96 HE3 MET 1 HE3 MET 1 -7.424 -34.867 -43.556 97 H ALA 2 H ALA 2 -8.870 -27.797 -44.151 98 HA ALA 2 HA ALA 2 -8.269 -25.643 -45.605 99 HB1 ALA 2 HB1 ALA 2 -8.837 -25.665 -42.608 100 HB2 ALA 2 HB2 ALA 2 -9.158 -24.375 -43.791 101 HB3 ALA 2 HB3 ALA 2 -9.952 -26.048 -43.830 102 H ASP 3 H ASP 3 -7.160 -23.666 -44.651 103 HA ASP 3 HA ASP 3 -4.315 -23.995 -44.454 104 HB2 ASP 3 HB2 ASP 3 -5.639 -22.001 -45.537 105 HB3 ASP 3 HB3 ASP 3 -5.753 -21.333 -43.906 106 H GLU 4 H GLU 4 -6.931 -23.630 -42.039 107 HA GLU 4 HA GLU 4 -5.570 -22.460 -39.902 108 HB2 GLU 4 HB2 GLU 4 -7.893 -22.921 -39.929 109 HB3 GLU 4 HB3 GLU 4 -7.734 -24.673 -39.983 110 HG2 GLU 4 HG2 GLU 4 -8.599 -23.859 -37.866 111 HG3 GLU 4 HG3 GLU 4 -6.958 -24.777 -37.872 112 H LYS 5 H LYS 5 -4.397 -22.951 -38.197 113 HA LYS 5 HA LYS 5 -3.675 -25.598 -37.487 114 HB2 LYS 5 HB2 LYS 5 -2.330 -24.955 -39.766 115 HB3 LYS 5 HB3 LYS 5 -1.351 -23.918 -38.714 116 HG2 LYS 5 HG2 LYS 5 -0.375 -25.659 -37.505 117 HG3 LYS 5 HG3 LYS 5 -1.502 -26.871 -38.168 118 HD2 LYS 5 HD2 LYS 5 -0.349 -26.839 -40.286 119 HD3 LYS 5 HD3 LYS 5 0.686 -25.369 -39.720 120 HE2 LYS 5 HE2 LYS 5 1.617 -26.700 -38.136 121 HE3 LYS 5 HE3 LYS 5 0.759 -28.162 -38.609 122 HZ1 LYS 5 HZ1 LYS 5 2.867 -26.689 -40.182 123 HZ2 LYS 5 HZ2 LYS 5 2.774 -28.268 -39.616 124 HZ3 LYS 5 HZ3 LYS 5 1.923 -27.700 -40.895 125 HA PRO 6 HA PRO 6 -2.577 -23.432 -33.906 126 HB2 PRO 6 HB2 PRO 6 -1.183 -25.239 -32.319 127 HB3 PRO 6 HB3 PRO 6 -2.937 -25.487 -32.623 128 HG2 PRO 6 HG2 PRO 6 -0.667 -26.904 -34.125 129 HG3 PRO 6 HG3 PRO 6 -2.118 -27.527 -33.455 130 HD2 PRO 6 HD2 PRO 6 -1.734 -26.708 -36.068 131 HD3 PRO 6 HD3 PRO 6 -3.411 -26.730 -35.363 132 H LYS 7 H LYS 7 -0.934 -22.125 -32.842 133 HA LYS 7 HA LYS 7 1.711 -22.508 -33.823 134 HB2 LYS 7 HB2 LYS 7 1.326 -21.285 -35.493 135 HB3 LYS 7 HB3 LYS 7 0.057 -20.131 -34.687 136 HG2 LYS 7 HG2 LYS 7 2.107 -18.957 -33.929 137 HG3 LYS 7 HG3 LYS 7 3.132 -20.003 -34.928 138 HD2 LYS 7 HD2 LYS 7 1.943 -19.198 -36.905 139 HD3 LYS 7 HD3 LYS 7 1.020 -17.999 -35.878 140 HE2 LYS 7 HE2 LYS 7 3.091 -17.153 -35.039 141 HE3 LYS 7 HE3 LYS 7 4.164 -18.044 -36.104 142 HZ1 LYS 7 HZ1 LYS 7 3.437 -16.996 -37.879 143 HZ2 LYS 7 HZ2 LYS 7 2.166 -16.238 -37.105 144 HZ3 LYS 7 HZ3 LYS 7 3.729 -15.775 -36.822 145 H GLU 8 H GLU 8 3.117 -21.854 -32.405 146 HA GLU 8 HA GLU 8 2.476 -20.921 -29.849 147 HB2 GLU 8 HB2 GLU 8 4.384 -22.153 -30.296 148 HB3 GLU 8 HB3 GLU 8 5.130 -20.863 -31.234 149 HG2 GLU 8 HG2 GLU 8 5.590 -19.666 -29.004 150 HG3 GLU 8 HG3 GLU 8 4.435 -20.615 -28.152 151 H GLY 9 H GLY 9 2.550 -18.955 -28.823 152 HA2 GLY 9 HA2 GLY 9 2.506 -16.609 -30.399 153 HA3 GLY 9 HA3 GLY 9 2.190 -16.710 -28.606 154 H VAL 10 H VAL 10 5.204 -17.888 -28.738 155 HA VAL 10 HA VAL 10 6.337 -15.430 -27.940 156 HB VAL 10 HB VAL 10 7.274 -18.341 -28.281 157 HG11 VAL 10 HG11 VAL 10 8.941 -15.879 -27.300 158 HG12 VAL 10 HG12 VAL 10 9.296 -17.649 -26.944 159 HG13 VAL 10 HG13 VAL 10 9.443 -16.984 -28.478 160 HG21 VAL 10 HG21 VAL 10 6.711 -16.890 -25.691 161 HG22 VAL 10 HG22 VAL 10 5.812 -18.281 -26.459 162 HG23 VAL 10 HG23 VAL 10 7.463 -18.400 -25.895 163 H LYS 11 H LYS 11 7.529 -14.145 -28.978 164 HA LYS 11 HA LYS 11 9.049 -14.713 -31.558 165 HB2 LYS 11 HB2 LYS 11 6.829 -13.457 -31.998 166 HB3 LYS 11 HB3 LYS 11 7.508 -12.180 -30.883 167 HG2 LYS 11 HG2 LYS 11 9.005 -11.453 -32.530 168 HG3 LYS 11 HG3 LYS 11 8.985 -13.043 -33.371 169 HD2 LYS 11 HD2 LYS 11 6.811 -12.367 -34.350 170 HD3 LYS 11 HD3 LYS 11 6.624 -11.063 -33.154 171 HE2 LYS 11 HE2 LYS 11 8.411 -9.836 -34.406 172 HE3 LYS 11 HE3 LYS 11 8.516 -11.153 -35.528 173 HZ1 LYS 11 HZ1 LYS 11 6.523 -10.445 -36.452 174 HZ2 LYS 11 HZ2 LYS 11 5.948 -9.859 -34.963 175 HZ3 LYS 11 HZ3 LYS 11 7.030 -9.022 -35.788 176 H THR 12 H THR 12 10.867 -14.953 -30.528 177 HA THR 12 HA THR 12 12.138 -12.996 -28.927 178 HB THR 12 HB THR 12 14.123 -14.033 -29.528 179 HG1 THR 12 HG1 THR 12 13.920 -14.699 -31.702 180 HG21 THR 12 HG21 THR 12 12.920 -15.098 -27.830 181 HG22 THR 12 HG22 THR 12 11.888 -15.975 -28.853 182 HG23 THR 12 HG23 THR 12 13.698 -16.302 -28.892 183 H GLU 13 H GLU 13 11.335 -12.722 -32.267 184 HA GLU 13 HA GLU 13 13.230 -10.603 -32.678 185 HB2 GLU 13 HB2 GLU 13 10.596 -10.910 -34.211 186 HB3 GLU 13 HB3 GLU 13 11.973 -9.984 -34.597 187 HG2 GLU 13 HG2 GLU 13 11.937 -12.994 -34.557 188 HG3 GLU 13 HG3 GLU 13 11.763 -12.013 -35.949 189 H ASN 14 H ASN 14 10.939 -10.591 -30.415 190 HA ASN 14 HA ASN 14 10.075 -7.840 -30.949 191 HB2 ASN 14 HB2 ASN 14 9.220 -9.881 -28.938 192 HB3 ASN 14 HB3 ASN 14 8.629 -8.147 -28.970 193 HD21 ASN 14 HD22 ASN 14 6.906 -10.272 -28.922 194 HD22 ASN 14 HD21 ASN 14 6.101 -10.252 -30.519 195 H ASN 15 H ASN 15 10.790 -6.088 -29.961 196 HA ASN 15 HA ASN 15 11.927 -6.075 -27.245 197 HB2 ASN 15 HB2 ASN 15 13.916 -6.578 -28.966 198 HB3 ASN 15 HB3 ASN 15 13.569 -5.097 -29.735 199 HD21 ASN 15 HD22 ASN 15 15.783 -6.079 -28.358 200 HD22 ASN 15 HD21 ASN 15 16.092 -5.295 -26.809 201 H ASP 16 H ASP 16 11.151 -4.270 -26.193 202 HA ASP 16 HA ASP 16 9.483 -2.285 -27.755 203 HB2 ASP 16 HB2 ASP 16 10.441 -2.217 -24.827 204 HB3 ASP 16 HB3 ASP 16 9.421 -0.991 -25.750 205 H HIS 17 H HIS 17 10.231 -0.760 -28.964 206 HA HIS 17 HA HIS 17 12.840 0.327 -29.014 207 HB2 HIS 17 HB2 HIS 17 10.277 0.994 -30.559 208 HB3 HIS 17 HB3 HIS 17 11.988 1.495 -30.878 209 HD2 HIS 17 HD2 HIS 17 13.659 -0.920 -31.374 210 HE1 HIS 17 HE1 HIS 17 10.452 -2.898 -33.285 211 HE2 HIS 17 HE2 HIS 17 12.946 -2.882 -32.797 212 H ILE 18 H ILE 18 13.559 2.457 -28.848 213 HA ILE 18 HA ILE 18 11.794 4.505 -27.607 214 HB ILE 18 HB ILE 18 13.585 3.762 -26.108 215 HG12 ILE 18 HG12 ILE 18 14.235 6.555 -27.069 216 HG13 ILE 18 HG13 ILE 18 12.883 5.909 -26.067 217 HG21 ILE 18 HG21 ILE 18 15.356 2.866 -27.799 218 HG22 ILE 18 HG22 ILE 18 15.590 4.529 -28.378 219 HG23 ILE 18 HG23 ILE 18 16.093 4.202 -26.824 220 HD11 ILE 18 HD11 ILE 18 14.486 6.789 -24.692 221 HD12 ILE 18 HD12 ILE 18 14.669 5.046 -24.430 222 HD13 ILE 18 HD13 ILE 18 15.897 6.064 -25.291 223 H ASN 19 H ASN 19 11.873 6.468 -28.498 224 HA ASN 19 HA ASN 19 12.747 6.629 -31.324 225 HB2 ASN 19 HB2 ASN 19 10.741 8.382 -29.667 226 HB3 ASN 19 HB3 ASN 19 11.114 8.546 -31.384 227 HD21 ASN 19 HD22 ASN 19 9.503 6.642 -28.762 228 HD22 ASN 19 HD21 ASN 19 8.423 5.772 -29.881 229 H LEU 20 H LEU 20 14.438 7.981 -31.664 230 HA LEU 20 HA LEU 20 14.918 10.292 -29.864 231 HB2 LEU 20 HB2 LEU 20 17.044 8.304 -30.860 232 HB3 LEU 20 HB3 LEU 20 17.475 9.888 -30.500 233 HG LEU 20 HG LEU 20 15.989 8.086 -28.507 234 HD11 LEU 20 HD11 LEU 20 19.020 8.696 -28.722 235 HD12 LEU 20 HD12 LEU 20 18.300 7.967 -27.339 236 HD13 LEU 20 HD13 LEU 20 18.275 7.144 -28.922 237 HD21 LEU 20 HD21 LEU 20 16.869 9.666 -26.841 238 HD22 LEU 20 HD22 LEU 20 17.668 10.735 -28.035 239 HD23 LEU 20 HD23 LEU 20 15.958 10.686 -27.965 240 H LYS 21 H LYS 21 16.472 11.997 -30.865 241 HA LYS 21 HA LYS 21 16.770 11.878 -33.807 242 HB2 LYS 21 HB2 LYS 21 16.074 14.444 -32.060 243 HB3 LYS 21 HB3 LYS 21 16.398 14.410 -33.798 244 HG2 LYS 21 HG2 LYS 21 14.337 13.013 -34.174 245 HG3 LYS 21 HG3 LYS 21 14.066 12.906 -32.476 246 HD2 LYS 21 HD2 LYS 21 13.516 15.196 -32.286 247 HD3 LYS 21 HD3 LYS 21 14.188 15.726 -33.814 248 HE2 LYS 21 HE2 LYS 21 12.449 14.304 -34.934 249 HE3 LYS 21 HE3 LYS 21 11.799 14.019 -33.293 250 HZ1 LYS 21 HZ1 LYS 21 11.260 16.350 -33.025 251 HZ2 LYS 21 HZ2 LYS 21 12.154 16.718 -34.425 252 HZ3 LYS 21 HZ3 LYS 21 10.767 15.944 -34.490 253 H VAL 22 H VAL 22 18.292 13.505 -34.509 254 HA VAL 22 HA VAL 22 20.508 13.996 -32.574 255 HB VAL 22 HB VAL 22 20.797 12.703 -35.251 256 HG11 VAL 22 HG11 VAL 22 23.108 13.578 -33.455 257 HG12 VAL 22 HG12 VAL 22 23.166 13.000 -35.041 258 HG13 VAL 22 HG13 VAL 22 22.497 14.620 -34.849 259 HG21 VAL 22 HG21 VAL 22 22.104 11.078 -34.013 260 HG22 VAL 22 HG22 VAL 22 21.448 11.809 -32.421 261 HG23 VAL 22 HG23 VAL 22 20.451 11.008 -33.522 262 H ALA 23 H ALA 23 20.717 16.399 -32.902 263 HA ALA 23 HA ALA 23 19.661 17.603 -35.414 264 HB1 ALA 23 HB1 ALA 23 18.546 19.316 -33.717 265 HB2 ALA 23 HB2 ALA 23 17.653 17.850 -33.911 266 HB3 ALA 23 HB3 ALA 23 18.720 18.035 -32.532 267 H GLY 24 H GLY 24 20.959 19.107 -36.048 268 HA2 GLY 24 HA2 GLY 24 23.336 19.995 -34.438 269 HA3 GLY 24 HA3 GLY 24 22.932 20.296 -36.222 270 H GLN 25 H GLN 25 23.885 22.009 -33.847 271 HA GLN 25 HA GLN 25 21.975 23.940 -33.198 272 HB2 GLN 25 HB2 GLN 25 24.823 24.286 -33.581 273 HB3 GLN 25 HB3 GLN 25 23.751 25.534 -32.977 274 HG2 GLN 25 HG2 GLN 25 24.804 23.052 -31.686 275 HG3 GLN 25 HG3 GLN 25 24.491 24.601 -30.864 276 HE21 GLN 25 HE22 GLN 25 23.636 21.350 -30.787 277 HE22 GLN 25 HE21 GLN 25 21.860 21.621 -30.490 278 H ASP 26 H ASP 26 23.677 23.412 -36.332 279 HA ASP 26 HA ASP 26 22.916 25.838 -37.714 280 HB2 ASP 26 HB2 ASP 26 24.062 24.697 -39.415 281 HB3 ASP 26 HB3 ASP 26 24.968 24.376 -37.987 282 H GLY 27 H GLY 27 21.032 23.533 -36.687 283 HA2 GLY 27 HA2 GLY 27 18.796 23.019 -36.900 284 HA3 GLY 27 HA3 GLY 27 18.643 24.083 -38.238 285 H SER 28 H SER 28 20.873 21.508 -38.354 286 HA SER 28 HA SER 28 19.270 19.826 -40.361 287 HB2 SER 28 HB2 SER 28 21.371 18.491 -40.480 288 HB3 SER 28 HB3 SER 28 21.574 20.195 -40.936 289 HG SER 28 HG SER 28 22.505 20.362 -38.856 290 H VAL 29 H VAL 29 18.543 17.985 -40.047 291 HA VAL 29 HA VAL 29 18.323 16.698 -37.264 292 HB VAL 29 HB VAL 29 15.726 16.854 -37.951 293 HG11 VAL 29 HG11 VAL 29 16.366 17.659 -35.800 294 HG12 VAL 29 HG12 VAL 29 17.373 18.860 -36.469 295 HG13 VAL 29 HG13 VAL 29 15.598 19.024 -36.578 296 HG21 VAL 29 HG21 VAL 29 15.897 17.791 -40.078 297 HG22 VAL 29 HG22 VAL 29 15.248 19.012 -38.968 298 HG23 VAL 29 HG23 VAL 29 16.834 19.173 -39.463 299 H VAL 30 H VAL 30 18.109 14.594 -37.225 300 HA VAL 30 HA VAL 30 16.173 13.453 -39.124 301 HB VAL 30 HB VAL 30 17.968 11.246 -38.591 302 HG11 VAL 30 HG11 VAL 30 17.038 12.724 -41.044 303 HG12 VAL 30 HG12 VAL 30 18.005 11.286 -41.247 304 HG13 VAL 30 HG13 VAL 30 16.450 11.145 -40.440 305 HG21 VAL 30 HG21 VAL 30 19.703 12.799 -38.344 306 HG22 VAL 30 HG22 VAL 30 19.871 11.863 -39.839 307 HG23 VAL 30 HG23 VAL 30 19.472 13.572 -39.964 308 H GLN 31 H GLN 31 14.853 11.850 -38.328 309 HA GLN 31 HA GLN 31 15.089 11.250 -35.527 310 HB2 GLN 31 HB2 GLN 31 12.899 12.182 -36.426 311 HB3 GLN 31 HB3 GLN 31 12.705 10.566 -37.220 312 HG2 GLN 31 HG2 GLN 31 12.500 9.380 -35.268 313 HG3 GLN 31 HG3 GLN 31 13.170 10.702 -34.293 314 HE21 GLN 31 HE22 GLN 31 10.253 9.213 -34.757 315 HE22 GLN 31 HE21 GLN 31 9.204 10.620 -34.524 316 H PHE 32 H PHE 32 15.029 9.156 -34.478 317 HA PHE 32 HA PHE 32 15.695 6.617 -36.036 318 HB2 PHE 32 HB2 PHE 32 17.282 7.734 -33.881 319 HB3 PHE 32 HB3 PHE 32 17.661 6.396 -34.836 320 HD1 PHE 32 HD1 PHE 32 17.673 10.106 -34.902 321 HD2 PHE 32 HD2 PHE 32 18.751 6.461 -36.925 322 HE1 PHE 32 HE1 PHE 32 19.757 11.271 -36.051 323 HE2 PHE 32 HE2 PHE 32 20.222 7.824 -38.478 324 HZ PHE 32 HZ PHE 32 20.926 10.043 -37.886 325 H LYS 33 H LYS 33 13.867 5.595 -35.647 326 HA LYS 33 HA LYS 33 13.219 4.873 -32.800 327 HB2 LYS 33 HB2 LYS 33 11.620 4.763 -34.667 328 HB3 LYS 33 HB3 LYS 33 12.448 3.606 -35.502 329 HG2 LYS 33 HG2 LYS 33 12.274 2.018 -33.420 330 HG3 LYS 33 HG3 LYS 33 11.375 3.271 -32.588 331 HD2 LYS 33 HD2 LYS 33 10.409 1.579 -34.879 332 HD3 LYS 33 HD3 LYS 33 9.808 1.718 -33.201 333 HE2 LYS 33 HE2 LYS 33 8.834 3.929 -33.641 334 HE3 LYS 33 HE3 LYS 33 9.430 3.798 -35.343 335 HZ1 LYS 33 HZ1 LYS 33 8.157 1.886 -35.617 336 HZ2 LYS 33 HZ2 LYS 33 7.729 1.992 -34.003 337 HZ3 LYS 33 HZ3 LYS 33 7.087 3.032 -35.127 338 H ILE 34 H ILE 34 14.623 3.666 -31.750 339 HA ILE 34 HA ILE 34 16.419 1.617 -33.036 340 HB ILE 34 HB ILE 34 18.292 2.382 -31.823 341 HG12 ILE 34 HG12 ILE 34 16.545 4.641 -30.805 342 HG13 ILE 34 HG13 ILE 34 17.215 3.424 -29.801 343 HG21 ILE 34 HG21 ILE 34 17.197 4.660 -33.471 344 HG22 ILE 34 HG22 ILE 34 18.801 4.112 -33.156 345 HG23 ILE 34 HG23 ILE 34 17.708 3.023 -34.050 346 HD11 ILE 34 HD11 ILE 34 18.954 5.410 -31.155 347 HD12 ILE 34 HD12 ILE 34 18.727 5.098 -29.392 348 HD13 ILE 34 HD13 ILE 34 19.569 3.921 -30.486 349 H LYS 35 H LYS 35 17.224 0.002 -31.456 350 HA LYS 35 HA LYS 35 15.505 -0.809 -29.218 351 HB2 LYS 35 HB2 LYS 35 18.051 -2.061 -30.327 352 HB3 LYS 35 HB3 LYS 35 17.038 -2.398 -28.863 353 HG2 LYS 35 HG2 LYS 35 15.177 -2.904 -29.997 354 HG3 LYS 35 HG3 LYS 35 15.795 -2.375 -31.644 355 HD2 LYS 35 HD2 LYS 35 17.423 -3.925 -31.783 356 HD3 LYS 35 HD3 LYS 35 16.938 -4.741 -30.287 357 HE2 LYS 35 HE2 LYS 35 14.609 -5.052 -31.564 358 HE3 LYS 35 HE3 LYS 35 15.562 -4.290 -32.869 359 HZ1 LYS 35 HZ1 LYS 35 16.650 -6.724 -31.594 360 HZ2 LYS 35 HZ2 LYS 35 15.395 -6.872 -32.591 361 HZ3 LYS 35 HZ3 LYS 35 16.788 -6.208 -33.143 362 H ARG 36 H ARG 36 15.965 -0.328 -27.037 363 HA ARG 36 HA ARG 36 17.435 2.051 -26.405 364 HB2 ARG 36 HB2 ARG 36 16.734 -0.173 -24.636 365 HB3 ARG 36 HB3 ARG 36 17.260 1.304 -23.997 366 HG2 ARG 36 HG2 ARG 36 15.182 2.398 -25.102 367 HG3 ARG 36 HG3 ARG 36 14.761 0.799 -25.705 368 HD2 ARG 36 HD2 ARG 36 14.975 1.880 -22.768 369 HD3 ARG 36 HD3 ARG 36 13.433 1.335 -23.495 370 HE ARG 36 HE ARG 36 14.336 -1.060 -23.290 371 HH11 ARG 36 HH11 ARG 36 15.771 1.331 -21.163 372 HH12 ARG 36 HH12 ARG 36 16.533 0.016 -20.352 373 HH21 ARG 36 HH21 ARG 36 15.346 -2.421 -21.963 374 HH22 ARG 36 HH22 ARG 36 16.544 -1.828 -20.840 375 H HIS 37 H HIS 37 18.754 -1.044 -26.788 376 HA HIS 37 HA HIS 37 21.405 -0.285 -25.525 377 HB2 HIS 37 HB2 HIS 37 21.890 -2.405 -25.321 378 HB3 HIS 37 HB3 HIS 37 20.147 -2.297 -24.950 379 HD2 HIS 37 HD2 HIS 37 22.324 -4.377 -26.954 380 HE1 HIS 37 HE1 HIS 37 18.484 -4.649 -28.965 381 HE2 HIS 37 HE2 HIS 37 20.932 -5.604 -28.837 382 H THR 38 H THR 38 20.057 0.155 -28.648 383 HA THR 38 HA THR 38 22.328 -0.589 -30.172 384 HB THR 38 HB THR 38 20.462 1.678 -30.748 385 HG1 THR 38 HG1 THR 38 20.484 -1.094 -30.987 386 HG21 THR 38 HG21 THR 38 22.617 1.800 -32.160 387 HG22 THR 38 HG22 THR 38 22.236 0.083 -32.672 388 HG23 THR 38 HG23 THR 38 21.170 1.478 -33.124 389 HA PRO 39 HA PRO 39 25.252 2.403 -28.390 390 HB2 PRO 39 HB2 PRO 39 27.011 1.898 -30.621 391 HB3 PRO 39 HB3 PRO 39 27.051 1.685 -28.765 392 HG2 PRO 39 HG2 PRO 39 26.918 -0.302 -30.686 393 HG3 PRO 39 HG3 PRO 39 26.477 -0.515 -28.993 394 HD2 PRO 39 HD2 PRO 39 24.483 -0.215 -31.202 395 HD3 PRO 39 HD3 PRO 39 24.270 -0.881 -29.686 396 H LEU 40 H LEU 40 25.329 4.642 -28.553 397 HA LEU 40 HA LEU 40 23.876 5.919 -30.590 398 HB2 LEU 40 HB2 LEU 40 25.638 6.981 -28.337 399 HB3 LEU 40 HB3 LEU 40 24.786 8.132 -29.355 400 HG LEU 40 HG LEU 40 23.728 5.839 -27.597 401 HD11 LEU 40 HD11 LEU 40 24.083 8.788 -27.155 402 HD12 LEU 40 HD12 LEU 40 22.599 8.129 -26.499 403 HD13 LEU 40 HD13 LEU 40 24.112 7.497 -25.965 404 HD21 LEU 40 HD21 LEU 40 21.413 6.937 -28.085 405 HD22 LEU 40 HD22 LEU 40 22.327 7.892 -29.308 406 HD23 LEU 40 HD23 LEU 40 22.199 6.127 -29.474 407 H SER 41 H SER 41 27.195 5.022 -30.477 408 HA SER 41 HA SER 41 28.507 6.612 -32.366 409 HB2 SER 41 HB2 SER 41 29.674 4.384 -32.946 410 HB3 SER 41 HB3 SER 41 29.473 4.549 -31.184 411 HG SER 41 HG SER 41 28.867 2.508 -32.398 412 H LYS 42 H LYS 42 25.972 4.140 -32.870 413 HA LYS 42 HA LYS 42 26.307 4.193 -35.696 414 HB2 LYS 42 HB2 LYS 42 23.829 3.189 -34.253 415 HB3 LYS 42 HB3 LYS 42 24.232 2.951 -35.889 416 HG2 LYS 42 HG2 LYS 42 26.385 1.950 -35.250 417 HG3 LYS 42 HG3 LYS 42 26.073 1.995 -33.491 418 HD2 LYS 42 HD2 LYS 42 25.722 -0.249 -34.140 419 HD3 LYS 42 HD3 LYS 42 24.061 0.359 -34.313 420 HE2 LYS 42 HE2 LYS 42 24.451 0.591 -36.750 421 HE3 LYS 42 HE3 LYS 42 26.062 0.044 -36.574 422 HZ1 LYS 42 HZ1 LYS 42 24.877 -1.799 -37.211 423 HZ2 LYS 42 HZ2 LYS 42 25.223 -2.112 -35.699 424 HZ3 LYS 42 HZ3 LYS 42 23.764 -1.725 -36.019 425 H LEU 43 H LEU 43 23.947 5.935 -33.744 426 HA LEU 43 HA LEU 43 22.734 7.329 -35.910 427 HB2 LEU 43 HB2 LEU 43 23.030 7.760 -32.908 428 HB3 LEU 43 HB3 LEU 43 22.185 8.905 -34.047 429 HG LEU 43 HG LEU 43 20.498 7.098 -34.470 430 HD11 LEU 43 HD11 LEU 43 22.154 5.723 -32.333 431 HD12 LEU 43 HD12 LEU 43 20.573 5.313 -32.439 432 HD13 LEU 43 HD13 LEU 43 21.554 5.071 -33.882 433 HD21 LEU 43 HD21 LEU 43 21.032 7.877 -31.533 434 HD22 LEU 43 HD22 LEU 43 20.018 8.863 -32.642 435 HD23 LEU 43 HD23 LEU 43 19.418 7.352 -32.126 436 H MET 44 H MET 44 25.666 7.989 -33.746 437 HA MET 44 HA MET 44 26.145 10.587 -34.703 438 HB2 MET 44 HB2 MET 44 28.069 8.496 -33.776 439 HB3 MET 44 HB3 MET 44 28.537 10.205 -33.924 440 HG2 MET 44 HG2 MET 44 27.567 10.968 -32.139 441 HG3 MET 44 HG3 MET 44 26.404 9.744 -31.990 442 HE1 MET 44 HE1 MET 44 30.784 8.606 -30.612 443 HE2 MET 44 HE2 MET 44 30.260 8.463 -32.275 444 HE3 MET 44 HE3 MET 44 30.575 10.097 -31.637 445 H LYS 45 H LYS 45 27.430 7.591 -35.929 446 HA LYS 45 HA LYS 45 28.699 8.501 -38.290 447 HB2 LYS 45 HB2 LYS 45 27.568 5.896 -37.312 448 HB3 LYS 45 HB3 LYS 45 28.451 5.998 -38.919 449 HG2 LYS 45 HG2 LYS 45 30.363 6.956 -37.952 450 HG3 LYS 45 HG3 LYS 45 29.714 6.873 -36.342 451 HD2 LYS 45 HD2 LYS 45 29.407 4.189 -37.304 452 HD3 LYS 45 HD3 LYS 45 30.988 4.800 -37.993 453 HE2 LYS 45 HE2 LYS 45 31.950 5.278 -35.858 454 HE3 LYS 45 HE3 LYS 45 30.368 4.857 -35.102 455 HZ1 LYS 45 HZ1 LYS 45 31.870 3.012 -36.709 456 HZ2 LYS 45 HZ2 LYS 45 32.082 3.029 -35.118 457 HZ3 LYS 45 HZ3 LYS 45 30.628 2.565 -35.825 458 H ALA 46 H ALA 46 25.302 7.406 -37.974 459 HA ALA 46 HA ALA 46 24.662 7.400 -40.762 460 HB1 ALA 46 HB1 ALA 46 22.865 7.717 -38.133 461 HB2 ALA 46 HB2 ALA 46 22.312 7.778 -39.636 462 HB3 ALA 46 HB3 ALA 46 23.213 6.310 -39.040 463 H TYR 47 H TYR 47 23.907 9.916 -38.289 464 HA TYR 47 HA TYR 47 23.301 12.073 -39.800 465 HB2 TYR 47 HB2 TYR 47 23.172 12.065 -37.382 466 HB3 TYR 47 HB3 TYR 47 24.930 11.866 -37.236 467 HD1 TYR 47 HD1 TYR 47 22.254 14.163 -37.921 468 HD2 TYR 47 HD2 TYR 47 26.402 13.671 -37.290 469 HE1 TYR 47 HE1 TYR 47 22.354 16.602 -37.690 470 HE2 TYR 47 HE2 TYR 47 26.660 16.209 -37.601 471 HH TYR 47 HH TYR 47 24.010 18.336 -38.267 472 H CYS 48 H CYS 48 26.696 11.157 -39.038 473 HA CYS 48 HA CYS 48 27.683 13.484 -40.223 474 HB2 CYS 48 HB2 CYS 48 28.667 11.946 -38.462 475 HB3 CYS 48 HB3 CYS 48 28.875 10.781 -39.638 476 HG CYS 48 HG CYS 48 30.593 12.479 -41.070 477 H GLU 49 H GLU 49 26.961 10.418 -41.730 478 HA GLU 49 HA GLU 49 28.252 11.236 -44.268 479 HB2 GLU 49 HB2 GLU 49 26.255 9.063 -43.562 480 HB3 GLU 49 HB3 GLU 49 26.737 9.324 -45.240 481 HG2 GLU 49 HG2 GLU 49 29.042 8.612 -44.617 482 HG3 GLU 49 HG3 GLU 49 28.858 8.948 -43.021 483 H ARG 50 H ARG 50 24.910 11.402 -43.126 484 HA ARG 50 HA ARG 50 23.712 12.490 -45.602 485 HB2 ARG 50 HB2 ARG 50 22.619 12.670 -42.763 486 HB3 ARG 50 HB3 ARG 50 21.774 13.269 -44.145 487 HG2 ARG 50 HG2 ARG 50 22.163 10.799 -45.123 488 HG3 ARG 50 HG3 ARG 50 22.188 10.450 -43.325 489 HD2 ARG 50 HD2 ARG 50 20.124 11.739 -43.154 490 HD3 ARG 50 HD3 ARG 50 20.035 11.866 -44.908 491 HE ARG 50 HE ARG 50 20.156 9.128 -44.379 492 HH11 ARG 50 HH11 ARG 50 17.959 11.813 -44.039 493 HH12 ARG 50 HH12 ARG 50 16.498 10.995 -44.445 494 HH21 ARG 50 HH21 ARG 50 18.432 7.940 -44.982 495 HH22 ARG 50 HH22 ARG 50 16.923 8.750 -44.985 496 H GLN 51 H GLN 51 25.670 13.942 -43.146 497 HA GLN 51 HA GLN 51 24.980 16.623 -44.128 498 HB2 GLN 51 HB2 GLN 51 26.618 15.839 -41.707 499 HB3 GLN 51 HB3 GLN 51 26.249 17.471 -42.171 500 HG2 GLN 51 HG2 GLN 51 24.427 15.309 -41.020 501 HG3 GLN 51 HG3 GLN 51 24.767 16.898 -40.457 502 HE21 GLN 51 HE22 GLN 51 22.163 15.854 -40.579 503 HE22 GLN 51 HE21 GLN 51 21.338 16.946 -41.675 504 H GLY 52 H GLY 52 27.333 14.394 -45.106 505 HA2 GLY 52 HA2 GLY 52 29.562 14.476 -46.024 506 HA3 GLY 52 HA3 GLY 52 29.080 16.095 -46.431 507 H LEU 53 H LEU 53 29.713 14.798 -43.166 508 HA LEU 53 HA LEU 53 31.512 17.027 -42.818 509 HB2 LEU 53 HB2 LEU 53 30.254 15.513 -40.506 510 HB3 LEU 53 HB3 LEU 53 31.295 16.906 -40.430 511 HG LEU 53 HG LEU 53 28.581 16.773 -41.934 512 HD11 LEU 53 HD11 LEU 53 28.358 16.247 -39.504 513 HD12 LEU 53 HD12 LEU 53 28.727 18.107 -39.314 514 HD13 LEU 53 HD13 LEU 53 27.391 17.516 -40.184 515 HD21 LEU 53 HD21 LEU 53 29.728 18.434 -42.850 516 HD22 LEU 53 HD22 LEU 53 28.439 19.072 -41.857 517 HD23 LEU 53 HD23 LEU 53 30.153 19.083 -41.201 518 H SER 54 H SER 54 33.594 16.752 -41.738 519 HA SER 54 HA SER 54 34.622 13.992 -41.276 520 HB2 SER 54 HB2 SER 54 36.396 15.472 -41.595 521 HB3 SER 54 HB3 SER 54 35.650 16.758 -40.746 522 HG SER 54 HG SER 54 37.363 14.759 -39.689 523 H MET 55 H MET 55 34.136 12.858 -39.340 524 HA MET 55 HA MET 55 32.341 14.091 -37.488 525 HB2 MET 55 HB2 MET 55 32.371 11.574 -38.124 526 HB3 MET 55 HB3 MET 55 33.955 11.348 -37.245 527 HG2 MET 55 HG2 MET 55 32.933 11.349 -35.108 528 HG3 MET 55 HG3 MET 55 31.544 12.293 -35.773 529 HE1 MET 55 HE1 MET 55 32.349 7.745 -35.755 530 HE2 MET 55 HE2 MET 55 33.374 8.855 -36.555 531 HE3 MET 55 HE3 MET 55 33.103 8.871 -34.773 532 H ARG 56 H ARG 56 35.679 13.887 -37.566 533 HA ARG 56 HA ARG 56 36.297 14.002 -34.949 534 HB2 ARG 56 HB2 ARG 56 37.712 13.569 -37.031 535 HB3 ARG 56 HB3 ARG 56 37.953 15.303 -37.050 536 HG2 ARG 56 HG2 ARG 56 38.888 15.296 -34.752 537 HG3 ARG 56 HG3 ARG 56 38.677 13.635 -34.501 538 HD2 ARG 56 HD2 ARG 56 40.717 14.774 -36.430 539 HD3 ARG 56 HD3 ARG 56 40.950 14.158 -34.825 540 HE ARG 56 HE ARG 56 40.034 11.984 -35.706 541 HH11 ARG 56 HH11 ARG 56 41.386 14.234 -38.029 542 HH12 ARG 56 HH12 ARG 56 41.455 13.122 -39.361 543 HH21 ARG 56 HH21 ARG 56 40.005 10.608 -37.280 544 HH22 ARG 56 HH22 ARG 56 40.330 11.068 -38.940 545 H GLN 57 H GLN 57 35.212 16.834 -37.077 546 HA GLN 57 HA GLN 57 36.221 18.698 -35.124 547 HB2 GLN 57 HB2 GLN 57 35.360 20.332 -36.646 548 HB3 GLN 57 HB3 GLN 57 36.366 19.202 -37.582 549 HG2 GLN 57 HG2 GLN 57 34.186 18.003 -38.251 550 HG3 GLN 57 HG3 GLN 57 33.309 19.306 -37.500 551 HE21 GLN 57 HE22 GLN 57 33.023 21.312 -38.482 552 HE22 GLN 57 HE21 GLN 57 33.619 21.519 -40.071 553 H ILE 58 H ILE 58 33.683 16.920 -34.727 554 HA ILE 58 HA ILE 58 31.846 19.028 -33.669 555 HB ILE 58 HB ILE 58 29.992 17.425 -34.156 556 HG12 ILE 58 HG12 ILE 58 31.956 16.053 -36.025 557 HG13 ILE 58 HG13 ILE 58 31.132 15.415 -34.630 558 HG21 ILE 58 HG21 ILE 58 30.282 19.547 -35.562 559 HG22 ILE 58 HG22 ILE 58 31.436 18.666 -36.589 560 HG23 ILE 58 HG23 ILE 58 29.687 18.349 -36.589 561 HD11 ILE 58 HD11 ILE 58 28.940 15.746 -36.075 562 HD12 ILE 58 HD12 ILE 58 30.060 16.036 -37.426 563 HD13 ILE 58 HD13 ILE 58 30.183 14.535 -36.618 564 H ARG 59 H ARG 59 30.541 18.352 -31.922 565 HA ARG 59 HA ARG 59 31.529 16.112 -30.279 566 HB2 ARG 59 HB2 ARG 59 30.960 18.933 -29.373 567 HB3 ARG 59 HB3 ARG 59 31.372 17.599 -28.352 568 HG2 ARG 59 HG2 ARG 59 33.321 18.610 -30.302 569 HG3 ARG 59 HG3 ARG 59 33.300 18.980 -28.606 570 HD2 ARG 59 HD2 ARG 59 33.633 16.633 -28.087 571 HD3 ARG 59 HD3 ARG 59 33.535 16.198 -29.854 572 HE ARG 59 HE ARG 59 35.796 17.324 -28.354 573 HH11 ARG 59 HH11 ARG 59 34.527 16.293 -31.469 574 HH12 ARG 59 HH12 ARG 59 36.141 16.229 -32.143 575 HH21 ARG 59 HH21 ARG 59 37.860 17.092 -29.278 576 HH22 ARG 59 HH22 ARG 59 37.842 16.604 -30.996 577 H PHE 60 H PHE 60 29.843 14.750 -29.819 578 HA PHE 60 HA PHE 60 26.925 15.630 -30.225 579 HB2 PHE 60 HB2 PHE 60 28.098 12.942 -29.764 580 HB3 PHE 60 HB3 PHE 60 26.447 13.355 -30.093 581 HD1 PHE 60 HD1 PHE 60 29.795 13.437 -31.719 582 HD2 PHE 60 HD2 PHE 60 25.498 13.632 -32.133 583 HE1 PHE 60 HE1 PHE 60 30.107 13.093 -34.100 584 HE2 PHE 60 HE2 PHE 60 25.753 13.020 -34.665 585 HZ PHE 60 HZ PHE 60 28.174 13.004 -35.615 586 H ARG 61 H ARG 61 25.944 16.261 -28.323 587 HA ARG 61 HA ARG 61 26.728 15.253 -25.622 588 HB2 ARG 61 HB2 ARG 61 25.227 17.837 -26.262 589 HB3 ARG 61 HB3 ARG 61 25.844 17.227 -24.638 590 HG2 ARG 61 HG2 ARG 61 28.056 17.144 -25.266 591 HG3 ARG 61 HG3 ARG 61 27.815 17.908 -26.787 592 HD2 ARG 61 HD2 ARG 61 26.575 19.789 -25.853 593 HD3 ARG 61 HD3 ARG 61 27.114 19.246 -24.211 594 HE ARG 61 HE ARG 61 29.431 19.490 -25.721 595 HH11 ARG 61 HH11 ARG 61 26.603 21.746 -25.245 596 HH12 ARG 61 HH12 ARG 61 27.625 23.085 -25.744 597 HH21 ARG 61 HH21 ARG 61 30.457 21.413 -26.242 598 HH22 ARG 61 HH22 ARG 61 29.536 22.938 -26.146 599 H PHE 62 H PHE 62 25.234 14.932 -24.185 600 HA PHE 62 HA PHE 62 22.405 15.157 -24.778 601 HB2 PHE 62 HB2 PHE 62 22.764 12.710 -25.414 602 HB3 PHE 62 HB3 PHE 62 23.628 12.602 -23.893 603 HD1 PHE 62 HD2 PHE 62 20.297 13.411 -25.401 604 HD2 PHE 62 HD1 PHE 62 22.458 12.055 -21.936 605 HE1 PHE 62 HE2 PHE 62 18.164 13.210 -24.112 606 HE2 PHE 62 HE1 PHE 62 20.266 11.629 -20.772 607 HZ PHE 62 HZ PHE 62 18.118 12.259 -21.939 608 H ASP 63 H ASP 63 21.243 15.927 -23.266 609 HA ASP 63 HA ASP 63 20.793 17.089 -21.237 610 HB2 ASP 63 HB2 ASP 63 20.781 14.461 -20.935 611 HB3 ASP 63 HB3 ASP 63 22.070 14.726 -19.846 612 H GLY 64 H GLY 64 23.053 18.084 -22.419 613 HA2 GLY 64 HA2 GLY 64 24.805 19.490 -21.897 614 HA3 GLY 64 HA3 GLY 64 24.172 19.520 -20.266 615 H GLN 65 H GLN 65 24.946 16.333 -21.311 616 HA GLN 65 HA GLN 65 27.821 16.509 -20.369 617 HB2 GLN 65 HB2 GLN 65 25.820 14.247 -20.013 618 HB3 GLN 65 HB3 GLN 65 27.532 14.069 -19.833 619 HG2 GLN 65 HG2 GLN 65 27.716 15.723 -18.053 620 HG3 GLN 65 HG3 GLN 65 26.053 16.098 -18.261 621 HE21 GLN 65 HE22 GLN 65 27.419 15.248 -16.027 622 HE22 GLN 65 HE21 GLN 65 26.787 13.740 -15.446 623 HA PRO 66 HA PRO 66 28.990 15.041 -24.439 624 HB2 PRO 66 HB2 PRO 66 31.054 13.366 -23.994 625 HB3 PRO 66 HB3 PRO 66 31.152 15.217 -23.874 626 HG2 PRO 66 HG2 PRO 66 30.650 13.180 -21.636 627 HG3 PRO 66 HG3 PRO 66 31.949 14.426 -21.657 628 HD2 PRO 66 HD2 PRO 66 29.521 14.547 -20.432 629 HD3 PRO 66 HD3 PRO 66 30.222 16.067 -21.094 630 H ILE 67 H ILE 67 29.016 13.140 -25.558 631 HA ILE 67 HA ILE 67 27.741 10.644 -24.444 632 HB ILE 67 HB ILE 67 27.975 11.579 -27.277 633 HG12 ILE 67 HG12 ILE 67 25.636 10.301 -25.785 634 HG13 ILE 67 HG13 ILE 67 25.993 12.018 -25.446 635 HG21 ILE 67 HG21 ILE 67 28.549 9.421 -27.688 636 HG22 ILE 67 HG22 ILE 67 27.619 8.753 -26.401 637 HG23 ILE 67 HG23 ILE 67 26.954 9.451 -27.991 638 HD11 ILE 67 HD11 ILE 67 24.205 11.615 -27.208 639 HD12 ILE 67 HD12 ILE 67 25.517 12.668 -27.776 640 HD13 ILE 67 HD13 ILE 67 25.383 11.000 -28.340 641 H ASN 68 H ASN 68 29.186 8.872 -24.144 642 HA ASN 68 HA ASN 68 31.882 8.803 -25.378 643 HB2 ASN 68 HB2 ASN 68 30.399 6.782 -23.692 644 HB3 ASN 68 HB3 ASN 68 32.157 6.799 -24.082 645 HD21 ASN 68 HD22 ASN 68 29.608 7.990 -22.043 646 HD22 ASN 68 HD21 ASN 68 30.734 8.816 -20.977 647 H GLU 69 H GLU 69 32.449 7.272 -26.845 648 HA GLU 69 HA GLU 69 30.573 6.342 -28.828 649 HB2 GLU 69 HB2 GLU 69 32.809 6.832 -29.232 650 HB3 GLU 69 HB3 GLU 69 33.461 5.458 -28.385 651 HG2 GLU 69 HG2 GLU 69 32.399 3.942 -30.073 652 HG3 GLU 69 HG3 GLU 69 31.586 5.311 -30.756 653 H THR 70 H THR 70 31.472 4.741 -25.887 654 HA THR 70 HA THR 70 29.929 2.334 -26.633 655 HB THR 70 HB THR 70 30.533 1.394 -24.398 656 HG1 THR 70 HG1 THR 70 30.919 3.249 -23.388 657 HG21 THR 70 HG21 THR 70 33.143 2.118 -25.794 658 HG22 THR 70 HG22 THR 70 32.509 0.653 -24.965 659 HG23 THR 70 HG23 THR 70 31.884 1.139 -26.582 660 H ASP 71 H ASP 71 28.760 5.342 -25.577 661 HA ASP 71 HA ASP 71 26.906 4.391 -23.689 662 HB2 ASP 71 HB2 ASP 71 27.124 6.874 -25.264 663 HB3 ASP 71 HB3 ASP 71 25.858 6.661 -24.035 664 H THR 72 H THR 72 25.110 3.480 -23.820 665 HA THR 72 HA THR 72 23.539 3.443 -26.261 666 HB THR 72 HB THR 72 22.531 1.425 -25.438 667 HG1 THR 72 HG1 THR 72 23.293 0.679 -23.320 668 HG21 THR 72 HG21 THR 72 25.444 0.920 -25.124 669 HG22 THR 72 HG22 THR 72 24.236 -0.199 -25.271 670 HG23 THR 72 HG23 THR 72 24.547 0.947 -26.691 671 HA PRO 73 HA PRO 73 20.213 5.784 -24.262 672 HB2 PRO 73 HB2 PRO 73 18.436 3.537 -25.055 673 HB3 PRO 73 HB3 PRO 73 18.216 5.316 -25.243 674 HG2 PRO 73 HG2 PRO 73 18.949 3.858 -27.426 675 HG3 PRO 73 HG3 PRO 73 19.446 5.445 -27.129 676 HD2 PRO 73 HD2 PRO 73 20.885 2.842 -26.735 677 HD3 PRO 73 HD3 PRO 73 21.669 4.297 -27.277 678 H ALA 74 H ALA 74 20.604 2.313 -23.581 679 HA ALA 74 HA ALA 74 19.116 2.421 -21.057 680 HB1 ALA 74 HB1 ALA 74 20.807 0.268 -22.351 681 HB2 ALA 74 HB2 ALA 74 19.712 -0.065 -21.009 682 HB3 ALA 74 HB3 ALA 74 19.018 0.381 -22.516 683 H GLN 75 H GLN 75 22.617 2.534 -22.086 684 HA GLN 75 HA GLN 75 23.711 2.326 -19.517 685 HB2 GLN 75 HB2 GLN 75 25.111 2.082 -21.484 686 HB3 GLN 75 HB3 GLN 75 24.624 3.636 -22.114 687 HG2 GLN 75 HG2 GLN 75 26.877 4.129 -21.248 688 HG3 GLN 75 HG3 GLN 75 25.819 4.714 -20.086 689 HE21 GLN 75 HE22 GLN 75 28.222 4.313 -19.497 690 HE22 GLN 75 HE21 GLN 75 28.470 2.779 -18.695 691 H LEU 76 H LEU 76 22.417 4.909 -21.395 692 HA LEU 76 HA LEU 76 22.892 7.097 -19.351 693 HB2 LEU 76 HB2 LEU 76 21.357 7.139 -21.986 694 HB3 LEU 76 HB3 LEU 76 21.846 8.482 -21.098 695 HG LEU 76 HG LEU 76 23.803 6.570 -22.433 696 HD11 LEU 76 HD11 LEU 76 24.305 8.492 -24.029 697 HD12 LEU 76 HD12 LEU 76 22.590 7.964 -24.068 698 HD13 LEU 76 HD13 LEU 76 23.017 9.408 -23.225 699 HD21 LEU 76 HD21 LEU 76 24.832 7.322 -20.384 700 HD22 LEU 76 HD22 LEU 76 25.579 7.887 -21.826 701 HD23 LEU 76 HD23 LEU 76 24.571 9.055 -21.089 702 H GLU 77 H GLU 77 20.515 4.652 -19.788 703 HA GLU 77 HA GLU 77 18.286 4.284 -19.089 704 HB2 GLU 77 HB2 GLU 77 19.015 6.029 -16.790 705 HB3 GLU 77 HB3 GLU 77 17.595 5.048 -16.950 706 HG2 GLU 77 HG2 GLU 77 20.334 3.732 -16.958 707 HG3 GLU 77 HG3 GLU 77 19.534 4.243 -15.556 708 H MET 78 H MET 78 18.394 5.919 -21.117 709 HA MET 78 HA MET 78 17.061 8.518 -20.968 710 HB2 MET 78 HB2 MET 78 17.398 6.626 -23.264 711 HB3 MET 78 HB3 MET 78 16.386 7.922 -23.452 712 HG2 MET 78 HG2 MET 78 18.429 9.513 -22.856 713 HG3 MET 78 HG3 MET 78 19.233 8.077 -22.353 714 HE1 MET 78 HE1 MET 78 20.221 10.456 -24.446 715 HE2 MET 78 HE2 MET 78 19.977 9.997 -26.220 716 HE3 MET 78 HE3 MET 78 18.652 10.544 -25.236 717 H GLU 79 H GLU 79 15.141 9.164 -20.843 718 HA GLU 79 HA GLU 79 12.711 7.534 -21.000 719 HB2 GLU 79 HB2 GLU 79 12.986 10.615 -20.976 720 HB3 GLU 79 HB3 GLU 79 11.672 9.680 -20.415 721 HG2 GLU 79 HG2 GLU 79 14.386 9.909 -18.990 722 HG3 GLU 79 HG3 GLU 79 12.916 10.641 -18.461 723 H ASP 80 H ASP 80 11.205 7.630 -22.670 724 HA ASP 80 HA ASP 80 12.296 7.843 -25.226 725 HB2 ASP 80 HB2 ASP 80 10.478 6.295 -24.344 726 HB3 ASP 80 HB3 ASP 80 9.382 7.541 -24.401 727 H GLU 81 H GLU 81 11.458 8.970 -26.985 728 HA GLU 81 HA GLU 81 11.111 10.771 -28.343 729 HB2 GLU 81 HB2 GLU 81 9.107 11.583 -26.262 730 HB3 GLU 81 HB3 GLU 81 9.339 12.291 -27.982 731 HG2 GLU 81 HG2 GLU 81 8.822 10.053 -28.831 732 HG3 GLU 81 HG3 GLU 81 8.742 9.520 -27.154 733 H ASP 82 H ASP 82 13.328 11.184 -26.537 734 HA ASP 82 HA ASP 82 13.649 14.059 -26.044 735 HB2 ASP 82 HB2 ASP 82 14.661 11.741 -24.952 736 HB3 ASP 82 HB3 ASP 82 15.898 12.376 -25.906 737 H THR 83 H THR 83 15.996 14.707 -26.821 738 HA THR 83 HA THR 83 16.863 14.091 -29.629 739 HB THR 83 HB THR 83 16.370 16.729 -28.344 740 HG1 THR 83 HG1 THR 83 14.758 15.436 -29.617 741 HG21 THR 83 HG21 THR 83 17.243 17.771 -30.259 742 HG22 THR 83 HG22 THR 83 18.638 16.767 -29.753 743 HG23 THR 83 HG23 THR 83 17.720 16.263 -31.041 744 H ILE 84 H ILE 84 18.823 13.804 -29.891 745 HA ILE 84 HA ILE 84 20.947 14.315 -27.928 746 HB ILE 84 HB ILE 84 21.029 12.969 -30.647 747 HG12 ILE 84 HG12 ILE 84 21.382 11.839 -27.809 748 HG13 ILE 84 HG13 ILE 84 20.025 11.528 -28.836 749 HG21 ILE 84 HG21 ILE 84 23.143 13.505 -28.500 750 HG22 ILE 84 HG22 ILE 84 23.478 12.433 -29.863 751 HG23 ILE 84 HG23 ILE 84 23.253 14.192 -30.045 752 HD11 ILE 84 HD11 ILE 84 22.805 10.434 -29.260 753 HD12 ILE 84 HD12 ILE 84 21.464 9.629 -28.556 754 HD13 ILE 84 HD13 ILE 84 21.405 10.109 -30.318 755 H ASP 85 H ASP 85 22.372 16.089 -28.065 756 HA ASP 85 HA ASP 85 21.662 18.278 -30.040 757 HB2 ASP 85 HB2 ASP 85 23.242 18.513 -27.449 758 HB3 ASP 85 HB3 ASP 85 23.003 19.754 -28.624 759 H VAL 86 H VAL 86 23.135 18.901 -31.644 760 HA VAL 86 HA VAL 86 25.953 17.688 -31.492 761 HB VAL 86 HB VAL 86 24.738 18.478 -34.079 762 HG11 VAL 86 HG11 VAL 86 26.679 16.807 -34.723 763 HG12 VAL 86 HG12 VAL 86 27.308 18.268 -33.921 764 HG13 VAL 86 HG13 VAL 86 27.051 16.719 -33.031 765 HG21 VAL 86 HG21 VAL 86 23.170 16.761 -33.056 766 HG22 VAL 86 HG22 VAL 86 23.973 16.293 -34.482 767 HG23 VAL 86 HG23 VAL 86 24.570 15.655 -32.935 768 H PHE 87 H PHE 87 27.466 19.213 -31.020 769 HA PHE 87 HA PHE 87 27.333 21.956 -32.080 770 HB2 PHE 87 HB2 PHE 87 29.062 20.696 -29.969 771 HB3 PHE 87 HB3 PHE 87 28.911 22.367 -30.339 772 HD1 PHE 87 HD1 PHE 87 27.100 19.564 -28.824 773 HD2 PHE 87 HD2 PHE 87 27.187 23.809 -29.321 774 HE1 PHE 87 HE1 PHE 87 24.987 19.869 -27.412 775 HE2 PHE 87 HE2 PHE 87 25.169 24.086 -28.213 776 HZ PHE 87 HZ PHE 87 23.850 22.053 -27.331 777 H GLN 88 H GLN 88 28.841 22.804 -33.328 778 HA GLN 88 HA GLN 88 31.251 21.296 -34.263 779 HB2 GLN 88 HB2 GLN 88 30.013 23.994 -34.808 780 HB3 GLN 88 HB3 GLN 88 31.601 23.619 -35.490 781 HG2 GLN 88 HG2 GLN 88 29.073 21.819 -36.037 782 HG3 GLN 88 HG3 GLN 88 29.425 23.356 -36.859 783 HE21 GLN 88 HE22 GLN 88 29.393 21.489 -38.729 784 HE22 GLN 88 HE21 GLN 88 30.976 20.865 -39.093 785 H GLN 89 H GLN 89 33.411 21.718 -33.780 786 HA GLN 89 HA GLN 89 33.774 23.513 -31.476 787 HB2 GLN 89 HB2 GLN 89 35.605 21.342 -32.843 788 HB3 GLN 89 HB3 GLN 89 35.997 22.286 -31.491 789 HG2 GLN 89 HG2 GLN 89 33.716 20.315 -31.442 790 HG3 GLN 89 HG3 GLN 89 35.338 20.009 -30.746 791 HE21 GLN 89 HE22 GLN 89 32.446 22.289 -30.390 792 HE22 GLN 89 HE21 GLN 89 32.738 22.563 -28.701 793 H GLN 90 H GLN 90 35.487 24.927 -31.460 794 HA GLN 90 HA GLN 90 36.366 25.861 -34.043 795 HB2 GLN 90 HB2 GLN 90 34.350 27.069 -33.352 796 HB3 GLN 90 HB3 GLN 90 35.293 27.600 -31.904 797 HG2 GLN 90 HG2 GLN 90 36.919 28.456 -33.731 798 HG3 GLN 90 HG3 GLN 90 35.580 28.277 -34.840 799 HE21 GLN 90 HE22 GLN 90 36.701 30.782 -34.466 800 HE22 GLN 90 HE21 GLN 90 35.803 31.727 -33.295 801 H THR 91 H THR 91 38.021 24.269 -32.646 802 HA THR 91 HA THR 91 39.850 25.721 -30.869 803 HB THR 91 HB THR 91 41.280 23.781 -30.913 804 HG1 THR 91 HG1 THR 91 41.243 23.121 -32.916 805 HG21 THR 91 HG21 THR 91 38.377 22.878 -30.838 806 HG22 THR 91 HG22 THR 91 39.737 22.089 -30.029 807 HG23 THR 91 HG23 THR 91 39.237 23.607 -29.459 808 H GLY 92 H GLY 92 41.967 26.070 -31.055 809 HA2 GLY 92 HA2 GLY 92 43.898 26.701 -32.078 810 HA3 GLY 92 HA3 GLY 92 43.264 26.712 -33.747 811 H GLY 93 H GLY 93 43.886 29.030 -34.291 812 HA2 GLY 93 HA2 GLY 93 42.340 30.819 -34.866 813 HA3 GLY 93 HA3 GLY 93 41.669 30.700 -33.223 814 H VAL 94 H VAL 94 42.848 33.053 -34.494 815 HA VAL 94 HA VAL 94 45.480 33.224 -33.188 816 HB VAL 94 HB VAL 94 44.179 35.372 -34.998 817 HG11 VAL 94 HG11 VAL 94 45.789 36.471 -33.441 818 HG12 VAL 94 HG12 VAL 94 47.036 35.354 -34.082 819 HG13 VAL 94 HG13 VAL 94 46.307 36.640 -35.068 820 HG21 VAL 94 HG21 VAL 94 44.925 33.320 -36.338 821 HG22 VAL 94 HG22 VAL 94 46.022 34.543 -36.652 822 HG23 VAL 94 HG23 VAL 94 46.452 33.246 -35.557 823 H TYR 95 H TYR 95 45.782 33.778 -31.006 824 HA TYR 95 HA TYR 95 43.973 35.822 -29.841 825 HB2 TYR 95 HB2 TYR 95 45.186 33.366 -28.455 826 HB3 TYR 95 HB3 TYR 95 44.710 34.709 -27.653 827 HD1 TYR 95 HD2 TYR 95 43.200 32.238 -30.190 828 HD2 TYR 95 HD1 TYR 95 42.603 34.976 -26.933 829 HE1 TYR 95 HE2 TYR 95 40.854 31.612 -30.190 830 HE2 TYR 95 HE1 TYR 95 40.085 34.400 -26.953 831 HH TYR 95 HH TYR 95 38.514 33.009 -27.902 Start of MODEL 4 1 H1 ACE 36 HH32 ACE 36 15.155 15.590 -44.229 2 H2 ACE 36 HH33 ACE 36 14.884 16.997 -45.146 3 H3 ACE 36 HH31 ACE 36 13.831 16.820 -43.732 4 H GLU 37 H GLU 37 14.753 15.126 -46.691 5 HA GLU 37 HA GLU 37 12.094 14.320 -47.487 6 HB2 GLU 37 HB2 GLU 37 13.889 15.220 -48.936 7 HB3 GLU 37 HB3 GLU 37 14.817 13.751 -48.695 8 HG2 GLU 37 HG2 GLU 37 13.669 13.586 -50.784 9 HG3 GLU 37 HG3 GLU 37 13.068 12.314 -49.809 10 H ASP 38 H ASP 38 14.648 12.809 -45.874 11 HA ASP 38 HA ASP 38 13.320 10.129 -45.905 12 HB2 ASP 38 HB2 ASP 38 15.202 10.470 -47.684 13 HB3 ASP 38 HB3 ASP 38 16.263 10.601 -46.357 14 H ALA 39 H ALA 39 12.822 11.638 -43.683 15 HA ALA 39 HA ALA 39 15.313 11.932 -42.109 16 HB1 ALA 39 HB1 ALA 39 12.546 12.833 -41.487 17 HB2 ALA 39 HB2 ALA 39 13.965 13.293 -40.526 18 HB3 ALA 39 HB3 ALA 39 13.942 13.907 -42.154 19 H PHE 40 H PHE 40 14.962 9.350 -42.276 20 HA PHE 40 HA PHE 40 14.041 8.579 -39.631 21 HB2 PHE 40 HB2 PHE 40 12.259 8.429 -41.719 22 HB3 PHE 40 HB3 PHE 40 13.094 6.790 -41.832 23 HD1 PHE 40 HD1 PHE 40 11.165 8.957 -39.364 24 HD2 PHE 40 HD2 PHE 40 12.234 4.976 -40.706 25 HE1 PHE 40 HE1 PHE 40 9.947 8.001 -37.482 26 HE2 PHE 40 HE2 PHE 40 10.792 4.093 -38.794 27 HZ PHE 40 HZ PHE 40 9.757 5.551 -37.185 28 H ILE 41 H ILE 41 15.464 6.724 -38.904 29 HA ILE 41 HA ILE 41 16.670 4.914 -40.810 30 HB ILE 41 HB ILE 41 18.535 6.229 -38.860 31 HG12 ILE 41 HG12 ILE 41 17.895 7.443 -41.575 32 HG13 ILE 41 HG13 ILE 41 18.013 8.153 -39.987 33 HG21 ILE 41 HG21 ILE 41 18.906 4.604 -41.304 34 HG22 ILE 41 HG22 ILE 41 20.215 5.327 -40.348 35 HG23 ILE 41 HG23 ILE 41 19.088 4.076 -39.701 36 HD11 ILE 41 HD11 ILE 41 20.456 7.508 -40.122 37 HD12 ILE 41 HD12 ILE 41 20.214 7.223 -41.930 38 HD13 ILE 41 HD13 ILE 41 20.131 8.776 -41.151 39 H VAL 42 H VAL 42 16.829 2.829 -39.864 40 HA VAL 42 HA VAL 42 15.442 2.842 -37.282 41 HB VAL 42 HB VAL 42 14.877 1.097 -39.662 42 HG11 VAL 42 HG11 VAL 42 13.596 1.110 -36.859 43 HG12 VAL 42 HG12 VAL 42 12.535 0.914 -38.194 44 HG13 VAL 42 HG13 VAL 42 13.749 -0.300 -37.903 45 HG21 VAL 42 HG21 VAL 42 13.233 3.200 -38.388 46 HG22 VAL 42 HG22 VAL 42 14.141 3.495 -39.888 47 HG23 VAL 42 HG23 VAL 42 12.760 2.481 -39.978 48 H ILE 43 H ILE 43 17.769 2.706 -36.870 49 HA ILE 43 HA ILE 43 19.428 0.301 -37.282 50 HB ILE 43 HB ILE 43 19.863 2.566 -35.251 51 HG12 ILE 43 HG12 ILE 43 20.233 2.712 -38.199 52 HG13 ILE 43 HG13 ILE 43 19.564 3.849 -37.038 53 HG21 ILE 43 HG21 ILE 43 21.948 0.904 -36.495 54 HG22 ILE 43 HG22 ILE 43 21.994 2.116 -35.240 55 HG23 ILE 43 HG23 ILE 43 21.230 0.468 -34.964 56 HD11 ILE 43 HD11 ILE 43 21.799 4.574 -37.923 57 HD12 ILE 43 HD12 ILE 43 21.800 4.362 -36.173 58 HD13 ILE 43 HD13 ILE 43 22.455 3.032 -37.266 59 H SEP 44 H SEP 44 20.137 -1.451 -36.065 60 HA SEP 44 HA SEP 44 19.508 -1.364 -33.231 61 HB2 SEP 44 HB2 SEP 44 18.216 -3.310 -33.041 62 HB3 SEP 44 HB3 SEP 44 17.658 -2.646 -34.460 63 H ASP 45 H ASP 45 20.538 -4.165 -32.511 64 HA ASP 45 HA ASP 45 23.161 -4.165 -33.718 65 HB2 ASP 45 HB2 ASP 45 22.963 -2.384 -31.769 66 HB3 ASP 45 HB3 ASP 45 22.775 -3.766 -30.722 67 H SEP 46 H SEP 46 20.771 -6.015 -32.221 68 HA SEP 46 HA SEP 46 22.606 -8.274 -31.857 69 HB2 SEP 46 HB2 SEP 46 20.809 -9.449 -30.825 70 HB3 SEP 46 HB3 SEP 46 21.048 -7.834 -30.191 71 H ASP 47 H ASP 47 23.161 -9.911 -33.191 72 HA ASP 47 HA ASP 47 21.568 -11.017 -35.111 73 HB2 ASP 47 HB2 ASP 47 22.564 -8.690 -36.057 74 HB3 ASP 47 HB3 ASP 47 24.078 -9.478 -36.109 75 H GLY 48 H GLY 48 23.071 -12.382 -36.529 76 HA2 GLY 48 HA2 GLY 48 25.561 -13.563 -35.635 77 HA3 GLY 48 HA3 GLY 48 24.205 -14.531 -35.060 78 H GLU 49 H GLU 49 25.837 -15.814 -36.476 79 HA GLU 49 HA GLU 49 24.674 -15.986 -39.232 80 HB2 GLU 49 HB2 GLU 49 27.144 -15.193 -38.694 81 HB3 GLU 49 HB3 GLU 49 27.359 -16.870 -38.221 82 HG2 GLU 49 HG2 GLU 49 28.012 -16.690 -40.509 83 HG3 GLU 49 HG3 GLU 49 26.538 -17.722 -40.377 84 HN1 NH2 50 HN1 NH2 50 25.248 -18.135 -36.341 85 HN2 NH2 50 HN2 NH2 50 24.842 -19.539 -37.265 86 H1 MET 1 H1 MET 1 -7.701 -36.295 -41.021 87 H2 MET 1 H2 MET 1 -6.556 -35.109 -41.304 88 H3 MET 1 H3 MET 1 -8.104 -34.766 -41.550 89 HA MET 1 HA MET 1 -8.530 -34.412 -39.290 90 HB2 MET 1 HB2 MET 1 -5.908 -35.731 -38.806 91 HB3 MET 1 HB3 MET 1 -6.972 -35.053 -37.555 92 HG2 MET 1 HG2 MET 1 -8.752 -36.624 -38.153 93 HG3 MET 1 HG3 MET 1 -7.702 -37.411 -39.314 94 HE1 MET 1 HE1 MET 1 -4.863 -37.217 -37.463 95 HE2 MET 1 HE2 MET 1 -4.900 -38.938 -37.369 96 HE3 MET 1 HE3 MET 1 -5.262 -38.123 -38.944 97 H ALA 2 H ALA 2 -8.136 -32.638 -38.489 98 HA ALA 2 HA ALA 2 -6.976 -30.661 -40.042 99 HB1 ALA 2 HB1 ALA 2 -7.768 -30.365 -37.172 100 HB2 ALA 2 HB2 ALA 2 -7.549 -28.959 -38.200 101 HB3 ALA 2 HB3 ALA 2 -8.882 -30.073 -38.501 102 H ASP 3 H ASP 3 -5.265 -29.434 -40.262 103 HA ASP 3 HA ASP 3 -2.666 -30.189 -39.357 104 HB2 ASP 3 HB2 ASP 3 -3.484 -29.031 -41.434 105 HB3 ASP 3 HB3 ASP 3 -3.446 -27.524 -40.522 106 H GLU 4 H GLU 4 -4.847 -28.764 -37.497 107 HA GLU 4 HA GLU 4 -4.180 -26.475 -36.184 108 HB2 GLU 4 HB2 GLU 4 -6.350 -27.432 -35.695 109 HB3 GLU 4 HB3 GLU 4 -5.608 -28.964 -35.262 110 HG2 GLU 4 HG2 GLU 4 -6.601 -27.299 -33.425 111 HG3 GLU 4 HG3 GLU 4 -5.206 -28.219 -33.098 112 H LYS 5 H LYS 5 -2.358 -25.813 -34.986 113 HA LYS 5 HA LYS 5 -0.928 -27.833 -33.487 114 HB2 LYS 5 HB2 LYS 5 0.124 -27.807 -35.686 115 HB3 LYS 5 HB3 LYS 5 0.626 -26.083 -35.354 116 HG2 LYS 5 HG2 LYS 5 2.079 -26.760 -33.649 117 HG3 LYS 5 HG3 LYS 5 1.250 -28.306 -33.569 118 HD2 LYS 5 HD2 LYS 5 2.230 -28.990 -35.639 119 HD3 LYS 5 HD3 LYS 5 2.714 -27.291 -36.079 120 HE2 LYS 5 HE2 LYS 5 4.265 -27.657 -33.886 121 HE3 LYS 5 HE3 LYS 5 4.215 -29.367 -34.468 122 HZ1 LYS 5 HZ1 LYS 5 5.969 -28.364 -35.286 123 HZ2 LYS 5 HZ2 LYS 5 4.999 -28.711 -36.525 124 HZ3 LYS 5 HZ3 LYS 5 5.073 -27.137 -36.029 125 HA PRO 6 HA PRO 6 -0.748 -24.120 -30.881 126 HB2 PRO 6 HB2 PRO 6 1.663 -25.209 -29.424 127 HB3 PRO 6 HB3 PRO 6 0.071 -24.864 -28.740 128 HG2 PRO 6 HG2 PRO 6 0.904 -27.381 -29.068 129 HG3 PRO 6 HG3 PRO 6 -0.793 -26.972 -29.324 130 HD2 PRO 6 HD2 PRO 6 1.309 -27.356 -31.353 131 HD3 PRO 6 HD3 PRO 6 -0.267 -27.969 -31.618 132 H LYS 7 H LYS 7 0.182 -22.284 -30.500 133 HA LYS 7 HA LYS 7 3.050 -21.881 -31.443 134 HB2 LYS 7 HB2 LYS 7 0.997 -21.148 -33.127 135 HB3 LYS 7 HB3 LYS 7 0.853 -19.970 -31.862 136 HG2 LYS 7 HG2 LYS 7 3.274 -19.367 -32.365 137 HG3 LYS 7 HG3 LYS 7 3.204 -20.419 -33.740 138 HD2 LYS 7 HD2 LYS 7 1.305 -19.041 -34.602 139 HD3 LYS 7 HD3 LYS 7 1.311 -18.142 -33.042 140 HE2 LYS 7 HE2 LYS 7 3.461 -17.288 -33.647 141 HE3 LYS 7 HE3 LYS 7 3.472 -18.316 -35.214 142 HZ1 LYS 7 HZ1 LYS 7 3.005 -16.046 -35.620 143 HZ2 LYS 7 HZ2 LYS 7 1.569 -16.962 -35.820 144 HZ3 LYS 7 HZ3 LYS 7 1.807 -15.891 -34.580 145 H GLU 8 H GLU 8 4.315 -20.911 -29.728 146 HA GLU 8 HA GLU 8 3.379 -20.654 -27.415 147 HB2 GLU 8 HB2 GLU 8 5.584 -21.150 -27.925 148 HB3 GLU 8 HB3 GLU 8 5.825 -19.606 -28.502 149 HG2 GLU 8 HG2 GLU 8 5.745 -18.574 -26.235 150 HG3 GLU 8 HG3 GLU 8 5.274 -20.271 -25.634 151 H GLY 9 H GLY 9 2.816 -18.739 -25.921 152 HA2 GLY 9 HA2 GLY 9 1.559 -16.437 -26.633 153 HA3 GLY 9 HA3 GLY 9 2.181 -16.797 -25.136 154 H VAL 10 H VAL 10 4.923 -16.745 -26.598 155 HA VAL 10 HA VAL 10 5.524 -13.940 -25.861 156 HB VAL 10 HB VAL 10 6.903 -16.465 -24.769 157 HG11 VAL 10 HG11 VAL 10 8.031 -13.743 -24.726 158 HG12 VAL 10 HG12 VAL 10 8.650 -15.055 -23.787 159 HG13 VAL 10 HG13 VAL 10 8.835 -15.252 -25.482 160 HG21 VAL 10 HG21 VAL 10 5.552 -13.999 -23.562 161 HG22 VAL 10 HG22 VAL 10 5.145 -15.704 -23.565 162 HG23 VAL 10 HG23 VAL 10 6.573 -15.045 -22.603 163 H LYS 11 H LYS 11 6.996 -12.915 -27.078 164 HA LYS 11 HA LYS 11 8.708 -14.542 -28.748 165 HB2 LYS 11 HB2 LYS 11 6.612 -13.957 -29.970 166 HB3 LYS 11 HB3 LYS 11 7.064 -12.218 -29.934 167 HG2 LYS 11 HG2 LYS 11 9.147 -12.980 -31.081 168 HG3 LYS 11 HG3 LYS 11 8.628 -14.660 -31.119 169 HD2 LYS 11 HD2 LYS 11 6.778 -14.121 -32.522 170 HD3 LYS 11 HD3 LYS 11 7.214 -12.387 -32.513 171 HE2 LYS 11 HE2 LYS 11 9.560 -13.444 -33.467 172 HE3 LYS 11 HE3 LYS 11 8.707 -14.838 -33.605 173 HZ1 LYS 11 HZ1 LYS 11 7.085 -13.646 -34.955 174 HZ2 LYS 11 HZ2 LYS 11 8.054 -12.309 -34.970 175 HZ3 LYS 11 HZ3 LYS 11 8.494 -13.855 -35.626 176 H THR 12 H THR 12 10.865 -13.609 -28.744 177 HA THR 12 HA THR 12 11.223 -11.303 -27.284 178 HB THR 12 HB THR 12 13.448 -10.949 -28.454 179 HG1 THR 12 HG1 THR 12 13.513 -11.651 -30.250 180 HG21 THR 12 HG21 THR 12 13.698 -12.539 -26.579 181 HG22 THR 12 HG22 THR 12 12.887 -13.755 -27.636 182 HG23 THR 12 HG23 THR 12 14.407 -13.344 -28.055 183 H GLU 13 H GLU 13 10.131 -11.473 -30.394 184 HA GLU 13 HA GLU 13 10.605 -8.676 -31.335 185 HB2 GLU 13 HB2 GLU 13 8.521 -10.512 -32.422 186 HB3 GLU 13 HB3 GLU 13 9.161 -9.154 -33.288 187 HG2 GLU 13 HG2 GLU 13 10.372 -11.856 -32.487 188 HG3 GLU 13 HG3 GLU 13 10.023 -11.375 -34.100 189 H ASN 14 H ASN 14 8.206 -9.949 -29.044 190 HA ASN 14 HA ASN 14 6.570 -7.570 -29.461 191 HB2 ASN 14 HB2 ASN 14 6.730 -9.585 -27.063 192 HB3 ASN 14 HB3 ASN 14 5.565 -8.275 -27.097 193 HD21 ASN 14 HD22 ASN 14 5.478 -11.260 -27.076 194 HD22 ASN 14 HD21 ASN 14 4.590 -11.833 -28.460 195 H ASN 15 H ASN 15 9.656 -7.461 -28.537 196 HA ASN 15 HA ASN 15 9.818 -5.793 -26.126 197 HB2 ASN 15 HB2 ASN 15 11.503 -7.519 -27.012 198 HB3 ASN 15 HB3 ASN 15 11.781 -6.274 -28.277 199 HD21 ASN 15 HD22 ASN 15 14.111 -6.179 -27.427 200 HD22 ASN 15 HD21 ASN 15 14.403 -5.262 -26.002 201 H ASP 16 H ASP 16 9.505 -3.748 -25.921 202 HA ASP 16 HA ASP 16 8.903 -1.961 -27.949 203 HB2 ASP 16 HB2 ASP 16 9.693 -1.356 -25.003 204 HB3 ASP 16 HB3 ASP 16 8.913 -0.234 -26.093 205 H HIS 17 H HIS 17 9.708 -0.601 -29.138 206 HA HIS 17 HA HIS 17 12.577 0.004 -29.277 207 HB2 HIS 17 HB2 HIS 17 10.203 1.249 -30.758 208 HB3 HIS 17 HB3 HIS 17 11.884 1.413 -31.241 209 HD2 HIS 17 HD2 HIS 17 13.238 -0.835 -31.983 210 HE1 HIS 17 HE1 HIS 17 10.005 -2.596 -33.836 211 HE2 HIS 17 HE2 HIS 17 12.491 -2.741 -33.459 212 H ILE 18 H ILE 18 13.269 2.270 -29.755 213 HA ILE 18 HA ILE 18 11.978 4.419 -28.202 214 HB ILE 18 HB ILE 18 13.388 3.333 -26.631 215 HG12 ILE 18 HG12 ILE 18 14.790 5.934 -27.136 216 HG13 ILE 18 HG13 ILE 18 13.021 5.903 -26.790 217 HG21 ILE 18 HG21 ILE 18 15.067 2.291 -27.940 218 HG22 ILE 18 HG22 ILE 18 15.799 3.955 -28.309 219 HG23 ILE 18 HG23 ILE 18 15.838 3.342 -26.746 220 HD11 ILE 18 HD11 ILE 18 15.450 5.790 -25.101 221 HD12 ILE 18 HD12 ILE 18 13.723 6.106 -24.691 222 HD13 ILE 18 HD13 ILE 18 14.461 4.449 -24.789 223 H ASN 19 H ASN 19 12.324 6.545 -28.795 224 HA ASN 19 HA ASN 19 13.164 6.806 -31.610 225 HB2 ASN 19 HB2 ASN 19 10.887 8.123 -30.135 226 HB3 ASN 19 HB3 ASN 19 11.260 8.302 -31.813 227 HD21 ASN 19 HD22 ASN 19 9.982 5.967 -29.677 228 HD22 ASN 19 HD21 ASN 19 9.293 5.006 -30.995 229 H LEU 20 H LEU 20 15.025 8.021 -31.678 230 HA LEU 20 HA LEU 20 14.856 10.527 -30.221 231 HB2 LEU 20 HB2 LEU 20 17.629 9.356 -30.628 232 HB3 LEU 20 HB3 LEU 20 17.239 10.703 -29.582 233 HG LEU 20 HG LEU 20 15.960 8.065 -28.990 234 HD11 LEU 20 HD11 LEU 20 18.828 8.561 -28.293 235 HD12 LEU 20 HD12 LEU 20 17.836 7.132 -27.879 236 HD13 LEU 20 HD13 LEU 20 18.195 7.477 -29.552 237 HD21 LEU 20 HD21 LEU 20 17.137 10.174 -27.287 238 HD22 LEU 20 HD22 LEU 20 15.364 9.723 -27.563 239 HD23 LEU 20 HD23 LEU 20 16.408 8.716 -26.634 240 H LYS 21 H LYS 21 15.759 12.420 -30.982 241 HA LYS 21 HA LYS 21 16.171 12.676 -33.958 242 HB2 LYS 21 HB2 LYS 21 15.529 14.724 -31.794 243 HB3 LYS 21 HB3 LYS 21 16.230 15.041 -33.401 244 HG2 LYS 21 HG2 LYS 21 14.197 14.188 -34.482 245 HG3 LYS 21 HG3 LYS 21 13.620 13.515 -32.899 246 HD2 LYS 21 HD2 LYS 21 13.539 15.639 -31.956 247 HD3 LYS 21 HD3 LYS 21 14.321 16.431 -33.348 248 HE2 LYS 21 HE2 LYS 21 12.337 15.351 -34.831 249 HE3 LYS 21 HE3 LYS 21 11.571 15.027 -33.344 250 HZ1 LYS 21 HZ1 LYS 21 12.210 17.768 -34.494 251 HZ2 LYS 21 HZ2 LYS 21 10.804 16.950 -34.464 252 HZ3 LYS 21 HZ3 LYS 21 11.545 17.550 -33.069 253 H VAL 22 H VAL 22 18.251 13.067 -34.591 254 HA VAL 22 HA VAL 22 20.262 14.002 -32.652 255 HB VAL 22 HB VAL 22 20.612 12.392 -35.145 256 HG11 VAL 22 HG11 VAL 22 22.768 13.697 -33.467 257 HG12 VAL 22 HG12 VAL 22 23.205 12.412 -34.426 258 HG13 VAL 22 HG13 VAL 22 22.460 13.948 -35.128 259 HG21 VAL 22 HG21 VAL 22 21.785 10.632 -33.642 260 HG22 VAL 22 HG22 VAL 22 21.564 11.704 -32.264 261 HG23 VAL 22 HG23 VAL 22 20.149 11.021 -33.111 262 H ALA 23 H ALA 23 20.535 16.072 -32.779 263 HA ALA 23 HA ALA 23 20.141 17.374 -35.452 264 HB1 ALA 23 HB1 ALA 23 18.626 19.004 -34.171 265 HB2 ALA 23 HB2 ALA 23 18.076 17.262 -34.140 266 HB3 ALA 23 HB3 ALA 23 18.897 17.960 -32.777 267 H GLY 24 H GLY 24 21.099 19.460 -35.769 268 HA2 GLY 24 HA2 GLY 24 23.234 20.159 -33.818 269 HA3 GLY 24 HA3 GLY 24 23.258 20.354 -35.613 270 H GLN 25 H GLN 25 23.573 22.413 -33.641 271 HA GLN 25 HA GLN 25 21.134 23.800 -33.055 272 HB2 GLN 25 HB2 GLN 25 23.976 24.966 -33.102 273 HB3 GLN 25 HB3 GLN 25 22.575 25.489 -32.159 274 HG2 GLN 25 HG2 GLN 25 24.557 23.294 -31.687 275 HG3 GLN 25 HG3 GLN 25 24.056 24.567 -30.600 276 HE21 GLN 25 HE22 GLN 25 23.910 21.437 -31.026 277 HE22 GLN 25 HE21 GLN 25 22.449 21.126 -29.954 278 H ASP 26 H ASP 26 22.903 23.705 -35.904 279 HA ASP 26 HA ASP 26 21.897 26.168 -36.968 280 HB2 ASP 26 HB2 ASP 26 23.056 25.463 -39.105 281 HB3 ASP 26 HB3 ASP 26 24.046 25.421 -37.602 282 H GLY 27 H GLY 27 20.411 23.073 -36.426 283 HA2 GLY 27 HA2 GLY 27 17.968 23.225 -36.698 284 HA3 GLY 27 HA3 GLY 27 18.091 24.102 -38.029 285 H SER 28 H SER 28 20.629 21.715 -38.164 286 HA SER 28 HA SER 28 19.136 19.981 -40.048 287 HB2 SER 28 HB2 SER 28 21.219 18.956 -40.524 288 HB3 SER 28 HB3 SER 28 21.229 20.629 -40.835 289 HG SER 28 HG SER 28 22.413 21.037 -38.860 290 H VAL 29 H VAL 29 18.533 17.868 -39.906 291 HA VAL 29 HA VAL 29 19.055 16.490 -37.289 292 HB VAL 29 HB VAL 29 16.682 16.317 -36.730 293 HG11 VAL 29 HG11 VAL 29 17.634 18.537 -36.268 294 HG12 VAL 29 HG12 VAL 29 16.808 19.063 -37.810 295 HG13 VAL 29 HG13 VAL 29 15.880 18.526 -36.523 296 HG21 VAL 29 HG21 VAL 29 14.981 17.071 -38.010 297 HG22 VAL 29 HG22 VAL 29 16.030 17.331 -39.480 298 HG23 VAL 29 HG23 VAL 29 15.645 15.741 -38.850 299 H VAL 30 H VAL 30 18.661 14.261 -37.236 300 HA VAL 30 HA VAL 30 16.945 12.971 -39.234 301 HB VAL 30 HB VAL 30 19.410 11.531 -38.409 302 HG11 VAL 30 HG11 VAL 30 17.535 9.949 -38.907 303 HG12 VAL 30 HG12 VAL 30 16.976 11.014 -40.186 304 HG13 VAL 30 HG13 VAL 30 18.519 10.222 -40.393 305 HG21 VAL 30 HG21 VAL 30 20.160 13.063 -40.107 306 HG22 VAL 30 HG22 VAL 30 20.229 11.402 -40.593 307 HG23 VAL 30 HG23 VAL 30 18.904 12.452 -41.194 308 H GLN 31 H GLN 31 15.759 11.540 -38.232 309 HA GLN 31 HA GLN 31 15.733 11.145 -35.262 310 HB2 GLN 31 HB2 GLN 31 13.829 12.274 -35.490 311 HB3 GLN 31 HB3 GLN 31 13.331 11.348 -37.065 312 HG2 GLN 31 HG2 GLN 31 12.919 9.401 -35.697 313 HG3 GLN 31 HG3 GLN 31 13.563 10.315 -34.324 314 HE21 GLN 31 HE22 GLN 31 10.735 9.144 -34.535 315 HE22 GLN 31 HE21 GLN 31 9.923 10.574 -33.877 316 H PHE 32 H PHE 32 15.999 9.217 -34.565 317 HA PHE 32 HA PHE 32 16.192 6.778 -36.253 318 HB2 PHE 32 HB2 PHE 32 17.641 7.910 -33.859 319 HB3 PHE 32 HB3 PHE 32 17.784 6.275 -34.577 320 HD1 PHE 32 HD2 PHE 32 18.945 5.924 -36.572 321 HD2 PHE 32 HD1 PHE 32 18.754 9.842 -34.858 322 HE1 PHE 32 HE2 PHE 32 20.631 6.776 -38.324 323 HE2 PHE 32 HE1 PHE 32 20.606 10.562 -36.384 324 HZ PHE 32 HZ PHE 32 21.297 9.127 -38.228 325 H LYS 33 H LYS 33 14.701 5.291 -35.813 326 HA LYS 33 HA LYS 33 13.785 4.758 -33.032 327 HB2 LYS 33 HB2 LYS 33 12.190 5.000 -34.936 328 HB3 LYS 33 HB3 LYS 33 12.935 3.611 -35.778 329 HG2 LYS 33 HG2 LYS 33 12.594 2.160 -33.741 330 HG3 LYS 33 HG3 LYS 33 11.549 3.478 -33.088 331 HD2 LYS 33 HD2 LYS 33 10.251 3.423 -35.194 332 HD3 LYS 33 HD3 LYS 33 11.297 2.124 -35.863 333 HE2 LYS 33 HE2 LYS 33 10.323 0.648 -33.982 334 HE3 LYS 33 HE3 LYS 33 9.283 1.937 -33.542 335 HZ1 LYS 33 HZ1 LYS 33 8.401 1.808 -35.826 336 HZ2 LYS 33 HZ2 LYS 33 9.266 0.595 -36.259 337 HZ3 LYS 33 HZ3 LYS 33 8.156 0.432 -35.011 338 H ILE 34 H ILE 34 14.847 3.488 -31.808 339 HA ILE 34 HA ILE 34 16.447 1.364 -33.064 340 HB ILE 34 HB ILE 34 18.186 1.978 -31.519 341 HG12 ILE 34 HG12 ILE 34 16.809 4.653 -30.943 342 HG13 ILE 34 HG13 ILE 34 17.050 3.197 -29.854 343 HG21 ILE 34 HG21 ILE 34 17.910 4.449 -33.158 344 HG22 ILE 34 HG22 ILE 34 19.335 3.540 -32.800 345 HG23 ILE 34 HG23 ILE 34 18.085 2.923 -33.928 346 HD11 ILE 34 HD11 ILE 34 18.664 5.049 -29.323 347 HD12 ILE 34 HD12 ILE 34 19.442 3.543 -30.028 348 HD13 ILE 34 HD13 ILE 34 19.135 5.028 -30.933 349 H LYS 35 H LYS 35 17.477 0.130 -30.983 350 HA LYS 35 HA LYS 35 15.269 -0.534 -29.078 351 HB2 LYS 35 HB2 LYS 35 17.623 -2.060 -30.064 352 HB3 LYS 35 HB3 LYS 35 16.846 -2.452 -28.500 353 HG2 LYS 35 HG2 LYS 35 14.668 -2.592 -29.461 354 HG3 LYS 35 HG3 LYS 35 15.395 -2.322 -31.154 355 HD2 LYS 35 HD2 LYS 35 16.849 -4.217 -30.673 356 HD3 LYS 35 HD3 LYS 35 15.796 -4.629 -29.235 357 HE2 LYS 35 HE2 LYS 35 13.928 -4.985 -30.493 358 HE3 LYS 35 HE3 LYS 35 14.588 -4.125 -31.850 359 HZ1 LYS 35 HZ1 LYS 35 15.719 -6.859 -31.119 360 HZ2 LYS 35 HZ2 LYS 35 14.618 -6.627 -32.174 361 HZ3 LYS 35 HZ3 LYS 35 16.144 -5.988 -32.383 362 H ARG 36 H ARG 36 15.940 -0.896 -26.834 363 HA ARG 36 HA ARG 36 17.261 1.485 -25.932 364 HB2 ARG 36 HB2 ARG 36 16.472 -1.013 -24.492 365 HB3 ARG 36 HB3 ARG 36 17.080 0.293 -23.648 366 HG2 ARG 36 HG2 ARG 36 15.163 1.747 -24.847 367 HG3 ARG 36 HG3 ARG 36 14.528 0.133 -25.220 368 HD2 ARG 36 HD2 ARG 36 14.946 1.326 -22.369 369 HD3 ARG 36 HD3 ARG 36 13.558 1.375 -23.114 370 HE ARG 36 HE ARG 36 13.661 -1.237 -22.721 371 HH11 ARG 36 HH11 ARG 36 15.909 0.653 -21.180 372 HH12 ARG 36 HH12 ARG 36 16.705 -0.673 -20.267 373 HH21 ARG 36 HH21 ARG 36 14.385 -2.881 -21.534 374 HH22 ARG 36 HH22 ARG 36 15.969 -2.766 -20.716 375 H HIS 37 H HIS 37 18.587 -1.540 -26.382 376 HA HIS 37 HA HIS 37 21.322 -0.924 -25.356 377 HB2 HIS 37 HB2 HIS 37 21.731 -3.106 -25.612 378 HB3 HIS 37 HB3 HIS 37 20.381 -2.739 -24.576 379 HD2 HIS 37 HD2 HIS 37 21.435 -5.194 -26.879 380 HE1 HIS 37 HE1 HIS 37 17.325 -5.142 -27.904 381 HE2 HIS 37 HE2 HIS 37 19.431 -6.284 -28.217 382 H THR 38 H THR 38 19.810 -0.049 -28.379 383 HA THR 38 HA THR 38 22.041 -0.840 -30.086 384 HB THR 38 HB THR 38 19.958 1.306 -30.466 385 HG1 THR 38 HG1 THR 38 19.622 -1.274 -30.349 386 HG21 THR 38 HG21 THR 38 21.889 1.654 -31.921 387 HG22 THR 38 HG22 THR 38 21.716 0.025 -32.560 388 HG23 THR 38 HG23 THR 38 20.451 1.223 -32.786 389 HA PRO 39 HA PRO 39 24.550 2.458 -28.157 390 HB2 PRO 39 HB2 PRO 39 26.501 2.220 -30.307 391 HB3 PRO 39 HB3 PRO 39 26.638 1.777 -28.590 392 HG2 PRO 39 HG2 PRO 39 26.644 -0.049 -30.458 393 HG3 PRO 39 HG3 PRO 39 25.891 -0.327 -28.833 394 HD2 PRO 39 HD2 PRO 39 24.513 0.178 -31.365 395 HD3 PRO 39 HD3 PRO 39 24.069 -0.949 -30.021 396 H LEU 40 H LEU 40 24.706 4.683 -28.411 397 HA LEU 40 HA LEU 40 23.645 5.851 -30.708 398 HB2 LEU 40 HB2 LEU 40 25.356 7.012 -28.577 399 HB3 LEU 40 HB3 LEU 40 24.159 7.989 -29.517 400 HG LEU 40 HG LEU 40 23.453 6.129 -27.283 401 HD11 LEU 40 HD11 LEU 40 22.775 9.056 -27.856 402 HD12 LEU 40 HD12 LEU 40 22.516 8.056 -26.438 403 HD13 LEU 40 HD13 LEU 40 24.158 8.465 -26.824 404 HD21 LEU 40 HD21 LEU 40 21.571 7.291 -29.293 405 HD22 LEU 40 HD22 LEU 40 21.817 5.516 -28.874 406 HD23 LEU 40 HD23 LEU 40 21.039 6.662 -27.806 407 H SER 41 H SER 41 26.908 5.116 -30.124 408 HA SER 41 HA SER 41 28.224 6.960 -31.848 409 HB2 SER 41 HB2 SER 41 30.208 5.353 -31.750 410 HB3 SER 41 HB3 SER 41 29.387 5.524 -30.197 411 HG SER 41 HG SER 41 29.433 3.506 -30.258 412 H LYS 42 H LYS 42 26.155 4.216 -32.712 413 HA LYS 42 HA LYS 42 27.051 4.120 -35.515 414 HB2 LYS 42 HB2 LYS 42 24.431 3.273 -34.138 415 HB3 LYS 42 HB3 LYS 42 24.798 3.091 -35.830 416 HG2 LYS 42 HG2 LYS 42 26.743 1.844 -35.489 417 HG3 LYS 42 HG3 LYS 42 26.576 1.725 -33.752 418 HD2 LYS 42 HD2 LYS 42 24.365 0.871 -33.915 419 HD3 LYS 42 HD3 LYS 42 24.482 0.709 -35.679 420 HE2 LYS 42 HE2 LYS 42 26.657 -0.508 -35.108 421 HE3 LYS 42 HE3 LYS 42 25.955 -0.676 -33.467 422 HZ1 LYS 42 HZ1 LYS 42 24.089 -1.930 -34.488 423 HZ2 LYS 42 HZ2 LYS 42 24.683 -1.599 -35.965 424 HZ3 LYS 42 HZ3 LYS 42 25.456 -2.606 -34.873 425 H LEU 43 H LEU 43 24.653 5.918 -33.611 426 HA LEU 43 HA LEU 43 23.242 7.032 -35.813 427 HB2 LEU 43 HB2 LEU 43 23.341 7.473 -32.825 428 HB3 LEU 43 HB3 LEU 43 22.526 8.700 -33.942 429 HG LEU 43 HG LEU 43 21.103 6.922 -34.597 430 HD11 LEU 43 HD11 LEU 43 22.008 4.850 -34.224 431 HD12 LEU 43 HD12 LEU 43 22.780 5.232 -32.558 432 HD13 LEU 43 HD13 LEU 43 21.092 5.051 -32.739 433 HD21 LEU 43 HD21 LEU 43 21.241 7.450 -31.691 434 HD22 LEU 43 HD22 LEU 43 20.470 8.382 -32.894 435 HD23 LEU 43 HD23 LEU 43 19.747 6.749 -32.530 436 H MET 44 H MET 44 25.652 8.201 -33.701 437 HA MET 44 HA MET 44 26.672 10.755 -34.589 438 HB2 MET 44 HB2 MET 44 28.439 8.369 -34.021 439 HB3 MET 44 HB3 MET 44 28.867 10.091 -34.366 440 HG2 MET 44 HG2 MET 44 27.707 10.690 -32.273 441 HG3 MET 44 HG3 MET 44 27.019 9.128 -32.157 442 HE1 MET 44 HE1 MET 44 31.366 10.370 -30.977 443 HE2 MET 44 HE2 MET 44 31.152 10.304 -32.722 444 HE3 MET 44 HE3 MET 44 30.142 11.395 -31.697 445 H LYS 45 H LYS 45 27.695 7.666 -36.055 446 HA LYS 45 HA LYS 45 28.905 9.023 -38.198 447 HB2 LYS 45 HB2 LYS 45 28.134 6.169 -37.715 448 HB3 LYS 45 HB3 LYS 45 29.039 6.607 -39.084 449 HG2 LYS 45 HG2 LYS 45 30.853 7.620 -37.856 450 HG3 LYS 45 HG3 LYS 45 30.191 7.216 -36.284 451 HD2 LYS 45 HD2 LYS 45 30.280 4.848 -36.722 452 HD3 LYS 45 HD3 LYS 45 30.779 5.195 -38.456 453 HE2 LYS 45 HE2 LYS 45 32.784 6.377 -37.520 454 HE3 LYS 45 HE3 LYS 45 32.281 5.936 -35.920 455 HZ1 LYS 45 HZ1 LYS 45 33.188 4.313 -38.096 456 HZ2 LYS 45 HZ2 LYS 45 33.823 4.408 -36.593 457 HZ3 LYS 45 HZ3 LYS 45 32.411 3.582 -36.826 458 H ALA 46 H ALA 46 25.561 7.201 -38.059 459 HA ALA 46 HA ALA 46 25.163 7.545 -40.873 460 HB1 ALA 46 HB1 ALA 46 23.168 7.287 -38.564 461 HB2 ALA 46 HB2 ALA 46 22.927 6.967 -40.291 462 HB3 ALA 46 HB3 ALA 46 24.196 5.980 -39.451 463 H TYR 47 H TYR 47 24.934 9.803 -38.209 464 HA TYR 47 HA TYR 47 23.240 11.821 -39.671 465 HB2 TYR 47 HB2 TYR 47 22.904 11.856 -37.376 466 HB3 TYR 47 HB3 TYR 47 24.667 11.741 -36.958 467 HD1 TYR 47 HD2 TYR 47 26.099 13.677 -37.430 468 HD2 TYR 47 HD1 TYR 47 21.838 13.986 -37.789 469 HE1 TYR 47 HE2 TYR 47 26.268 16.037 -36.989 470 HE2 TYR 47 HE1 TYR 47 22.005 16.410 -37.333 471 HH TYR 47 HH TYR 47 23.474 18.294 -37.175 472 H CYS 48 H CYS 48 26.548 11.460 -38.707 473 HA CYS 48 HA CYS 48 27.583 13.697 -39.937 474 HB2 CYS 48 HB2 CYS 48 28.559 12.269 -38.138 475 HB3 CYS 48 HB3 CYS 48 28.926 11.078 -39.347 476 HG CYS 48 HG CYS 48 30.771 12.293 -40.638 477 H GLU 49 H GLU 49 27.360 10.470 -41.278 478 HA GLU 49 HA GLU 49 28.489 10.748 -43.830 479 HB2 GLU 49 HB2 GLU 49 26.161 8.957 -42.847 480 HB3 GLU 49 HB3 GLU 49 26.678 8.975 -44.517 481 HG2 GLU 49 HG2 GLU 49 28.831 8.033 -43.936 482 HG3 GLU 49 HG3 GLU 49 28.676 8.558 -42.323 483 H ARG 50 H ARG 50 24.951 11.063 -43.073 484 HA ARG 50 HA ARG 50 24.058 12.197 -45.604 485 HB2 ARG 50 HB2 ARG 50 22.930 12.455 -42.762 486 HB3 ARG 50 HB3 ARG 50 22.127 13.087 -44.223 487 HG2 ARG 50 HG2 ARG 50 22.340 10.789 -45.154 488 HG3 ARG 50 HG3 ARG 50 22.891 10.182 -43.612 489 HD2 ARG 50 HD2 ARG 50 20.904 10.438 -42.605 490 HD3 ARG 50 HD3 ARG 50 20.162 11.575 -43.809 491 HE ARG 50 HE ARG 50 20.900 8.723 -44.443 492 HH11 ARG 50 HH11 ARG 50 18.409 11.020 -44.387 493 HH12 ARG 50 HH12 ARG 50 17.174 9.775 -44.454 494 HH21 ARG 50 HH21 ARG 50 19.340 7.163 -44.786 495 HH22 ARG 50 HH22 ARG 50 17.841 7.943 -45.380 496 H GLN 51 H GLN 51 25.285 13.859 -42.662 497 HA GLN 51 HA GLN 51 25.130 16.556 -43.870 498 HB2 GLN 51 HB2 GLN 51 26.897 15.711 -41.622 499 HB3 GLN 51 HB3 GLN 51 26.383 17.285 -42.027 500 HG2 GLN 51 HG2 GLN 51 24.528 15.407 -40.651 501 HG3 GLN 51 HG3 GLN 51 25.306 16.766 -40.078 502 HE21 GLN 51 HE22 GLN 51 22.264 15.952 -40.978 503 HE22 GLN 51 HE21 GLN 51 21.774 17.421 -41.762 504 H GLY 52 H GLY 52 27.547 14.061 -44.295 505 HA2 GLY 52 HA2 GLY 52 29.462 14.188 -45.907 506 HA3 GLY 52 HA3 GLY 52 28.854 15.905 -45.975 507 H LEU 53 H LEU 53 29.541 15.215 -42.862 508 HA LEU 53 HA LEU 53 31.376 17.534 -43.029 509 HB2 LEU 53 HB2 LEU 53 29.609 16.320 -41.025 510 HB3 LEU 53 HB3 LEU 53 30.872 17.235 -40.393 511 HG LEU 53 HG LEU 53 28.437 18.088 -42.167 512 HD11 LEU 53 HD11 LEU 53 27.931 17.664 -39.857 513 HD12 LEU 53 HD12 LEU 53 29.087 18.809 -39.307 514 HD13 LEU 53 HD13 LEU 53 27.778 19.368 -40.393 515 HD21 LEU 53 HD21 LEU 53 30.501 19.531 -42.817 516 HD22 LEU 53 HD22 LEU 53 29.298 20.446 -41.919 517 HD23 LEU 53 HD23 LEU 53 30.877 19.741 -41.169 518 H SER 54 H SER 54 33.368 17.420 -41.490 519 HA SER 54 HA SER 54 34.227 14.674 -41.178 520 HB2 SER 54 HB2 SER 54 35.963 16.551 -41.501 521 HB3 SER 54 HB3 SER 54 35.430 17.278 -40.015 522 HG SER 54 HG SER 54 36.669 14.751 -40.421 523 H MET 55 H MET 55 33.541 13.340 -39.367 524 HA MET 55 HA MET 55 32.085 14.342 -37.264 525 HB2 MET 55 HB2 MET 55 32.658 11.809 -38.415 526 HB3 MET 55 HB3 MET 55 33.762 11.811 -36.916 527 HG2 MET 55 HG2 MET 55 32.016 12.194 -35.465 528 HG3 MET 55 HG3 MET 55 30.812 12.604 -36.738 529 HE1 MET 55 HE1 MET 55 32.472 8.312 -35.972 530 HE2 MET 55 HE2 MET 55 33.347 9.801 -36.528 531 HE3 MET 55 HE3 MET 55 32.720 9.701 -34.871 532 H ARG 56 H ARG 56 35.421 14.564 -37.537 533 HA ARG 56 HA ARG 56 36.310 15.014 -34.770 534 HB2 ARG 56 HB2 ARG 56 37.458 14.568 -37.286 535 HB3 ARG 56 HB3 ARG 56 37.516 16.262 -37.182 536 HG2 ARG 56 HG2 ARG 56 38.708 15.962 -34.924 537 HG3 ARG 56 HG3 ARG 56 38.591 14.336 -34.964 538 HD2 ARG 56 HD2 ARG 56 40.228 15.950 -36.919 539 HD3 ARG 56 HD3 ARG 56 40.715 15.359 -35.394 540 HE ARG 56 HE ARG 56 39.571 13.355 -37.427 541 HH11 ARG 56 HH11 ARG 56 42.598 14.166 -35.608 542 HH12 ARG 56 HH12 ARG 56 43.224 12.704 -36.274 543 HH21 ARG 56 HH21 ARG 56 40.490 11.522 -37.871 544 HH22 ARG 56 HH22 ARG 56 42.154 11.385 -37.637 545 H GLN 57 H GLN 57 34.468 16.852 -36.871 546 HA GLN 57 HA GLN 57 35.492 19.337 -35.546 547 HB2 GLN 57 HB2 GLN 57 34.824 20.663 -37.071 548 HB3 GLN 57 HB3 GLN 57 35.299 19.382 -38.155 549 HG2 GLN 57 HG2 GLN 57 32.703 18.819 -38.311 550 HG3 GLN 57 HG3 GLN 57 32.623 20.559 -37.785 551 HE21 GLN 57 HE22 GLN 57 32.384 21.887 -39.601 552 HE22 GLN 57 HE21 GLN 57 32.866 21.219 -41.170 553 H ILE 58 H ILE 58 33.052 17.160 -34.806 554 HA ILE 58 HA ILE 58 31.252 19.282 -33.703 555 HB ILE 58 HB ILE 58 29.424 17.461 -34.313 556 HG12 ILE 58 HG12 ILE 58 31.208 16.859 -36.744 557 HG13 ILE 58 HG13 ILE 58 31.145 15.795 -35.247 558 HG21 ILE 58 HG21 ILE 58 28.678 19.026 -36.140 559 HG22 ILE 58 HG22 ILE 58 29.624 20.028 -35.083 560 HG23 ILE 58 HG23 ILE 58 30.411 19.345 -36.504 561 HD11 ILE 58 HD11 ILE 58 29.007 16.252 -37.225 562 HD12 ILE 58 HD12 ILE 58 29.920 14.735 -36.710 563 HD13 ILE 58 HD13 ILE 58 28.742 15.558 -35.664 564 H ARG 59 H ARG 59 30.189 18.891 -31.858 565 HA ARG 59 HA ARG 59 31.184 16.604 -30.244 566 HB2 ARG 59 HB2 ARG 59 30.349 19.351 -29.264 567 HB3 ARG 59 HB3 ARG 59 30.704 18.053 -28.157 568 HG2 ARG 59 HG2 ARG 59 32.526 19.165 -30.344 569 HG3 ARG 59 HG3 ARG 59 32.709 19.569 -28.646 570 HD2 ARG 59 HD2 ARG 59 33.434 17.229 -28.289 571 HD3 ARG 59 HD3 ARG 59 33.249 16.776 -29.995 572 HE ARG 59 HE ARG 59 35.329 18.638 -29.034 573 HH11 ARG 59 HH11 ARG 59 34.043 16.806 -31.851 574 HH12 ARG 59 HH12 ARG 59 35.407 17.381 -32.707 575 HH21 ARG 59 HH21 ARG 59 36.680 19.403 -30.189 576 HH22 ARG 59 HH22 ARG 59 36.681 19.089 -31.900 577 H PHE 60 H PHE 60 29.744 15.062 -30.363 578 HA PHE 60 HA PHE 60 26.816 15.497 -30.458 579 HB2 PHE 60 HB2 PHE 60 28.415 13.041 -30.053 580 HB3 PHE 60 HB3 PHE 60 26.732 13.146 -30.165 581 HD1 PHE 60 HD1 PHE 60 29.720 13.468 -32.227 582 HD2 PHE 60 HD2 PHE 60 25.472 13.372 -32.330 583 HE1 PHE 60 HE1 PHE 60 29.813 13.294 -34.665 584 HE2 PHE 60 HE2 PHE 60 25.491 13.309 -34.821 585 HZ PHE 60 HZ PHE 60 27.630 12.987 -36.008 586 H ARG 61 H ARG 61 25.529 15.738 -28.460 587 HA ARG 61 HA ARG 61 26.763 14.729 -26.008 588 HB2 ARG 61 HB2 ARG 61 25.479 17.430 -26.369 589 HB3 ARG 61 HB3 ARG 61 26.059 16.786 -24.835 590 HG2 ARG 61 HG2 ARG 61 28.432 16.797 -26.126 591 HG3 ARG 61 HG3 ARG 61 27.539 18.033 -27.122 592 HD2 ARG 61 HD2 ARG 61 26.833 19.214 -25.158 593 HD3 ARG 61 HD3 ARG 61 28.017 18.360 -24.206 594 HE ARG 61 HE ARG 61 29.721 19.225 -25.798 595 HH11 ARG 61 HH11 ARG 61 27.018 21.078 -24.848 596 HH12 ARG 61 HH12 ARG 61 27.668 22.617 -25.415 597 HH21 ARG 61 HH21 ARG 61 30.548 21.209 -26.529 598 HH22 ARG 61 HH22 ARG 61 29.580 22.578 -26.542 599 H PHE 62 H PHE 62 25.345 14.918 -24.045 600 HA PHE 62 HA PHE 62 22.551 15.053 -24.172 601 HB2 PHE 62 HB2 PHE 62 22.607 12.745 -25.077 602 HB3 PHE 62 HB3 PHE 62 23.748 12.225 -23.829 603 HD1 PHE 62 HD1 PHE 62 22.994 12.007 -21.498 604 HD2 PHE 62 HD2 PHE 62 20.317 13.248 -24.721 605 HE1 PHE 62 HE1 PHE 62 21.153 11.376 -20.117 606 HE2 PHE 62 HE2 PHE 62 18.384 12.678 -23.294 607 HZ PHE 62 HZ PHE 62 18.722 11.561 -21.051 608 H ASP 63 H ASP 63 21.621 15.466 -22.180 609 HA ASP 63 HA ASP 63 21.626 16.328 -20.283 610 HB2 ASP 63 HB2 ASP 63 22.445 14.041 -19.336 611 HB3 ASP 63 HB3 ASP 63 24.037 14.781 -19.156 612 H GLY 64 H GLY 64 23.455 17.570 -22.251 613 HA2 GLY 64 HA2 GLY 64 25.111 19.411 -22.375 614 HA3 GLY 64 HA3 GLY 64 25.206 19.439 -20.644 615 H GLN 65 H GLN 65 25.739 16.370 -21.047 616 HA GLN 65 HA GLN 65 28.626 16.793 -21.054 617 HB2 GLN 65 HB2 GLN 65 27.368 14.292 -20.238 618 HB3 GLN 65 HB3 GLN 65 29.085 14.797 -20.167 619 HG2 GLN 65 HG2 GLN 65 27.791 16.912 -18.858 620 HG3 GLN 65 HG3 GLN 65 26.639 15.733 -18.583 621 HE21 GLN 65 HE22 GLN 65 28.059 17.115 -16.724 622 HE22 GLN 65 HE21 GLN 65 28.908 15.959 -15.663 623 HA PRO 66 HA PRO 66 29.259 14.788 -25.240 624 HB2 PRO 66 HB2 PRO 66 31.771 13.779 -24.961 625 HB3 PRO 66 HB3 PRO 66 31.319 15.449 -25.126 626 HG2 PRO 66 HG2 PRO 66 31.774 14.151 -22.447 627 HG3 PRO 66 HG3 PRO 66 32.553 15.690 -23.079 628 HD2 PRO 66 HD2 PRO 66 30.576 15.629 -21.427 629 HD3 PRO 66 HD3 PRO 66 30.545 16.802 -22.732 630 H ILE 67 H ILE 67 28.981 12.968 -26.289 631 HA ILE 67 HA ILE 67 28.407 10.499 -24.810 632 HB ILE 67 HB ILE 67 28.027 11.498 -27.632 633 HG12 ILE 67 HG12 ILE 67 26.131 10.115 -25.639 634 HG13 ILE 67 HG13 ILE 67 26.588 11.834 -25.538 635 HG21 ILE 67 HG21 ILE 67 28.966 9.100 -27.809 636 HG22 ILE 67 HG22 ILE 67 27.525 8.626 -26.820 637 HG23 ILE 67 HG23 ILE 67 27.298 9.354 -28.358 638 HD11 ILE 67 HD11 ILE 67 25.073 10.258 -27.689 639 HD12 ILE 67 HD12 ILE 67 24.318 11.524 -26.700 640 HD13 ILE 67 HD13 ILE 67 25.644 11.845 -27.951 641 H ASN 68 H ASN 68 29.310 8.703 -25.005 642 HA ASN 68 HA ASN 68 32.066 8.384 -26.164 643 HB2 ASN 68 HB2 ASN 68 30.542 6.689 -24.142 644 HB3 ASN 68 HB3 ASN 68 32.134 6.356 -24.663 645 HD21 ASN 68 HD22 ASN 68 29.898 8.397 -22.783 646 HD22 ASN 68 HD21 ASN 68 31.029 9.368 -21.953 647 H GLU 69 H GLU 69 32.766 6.548 -27.248 648 HA GLU 69 HA GLU 69 31.106 5.516 -29.138 649 HB2 GLU 69 HB2 GLU 69 33.616 4.205 -28.094 650 HB3 GLU 69 HB3 GLU 69 32.819 3.819 -29.605 651 HG2 GLU 69 HG2 GLU 69 32.982 6.134 -30.190 652 HG3 GLU 69 HG3 GLU 69 33.951 6.525 -28.721 653 H THR 70 H THR 70 31.439 4.199 -25.961 654 HA THR 70 HA THR 70 29.877 1.777 -26.588 655 HB THR 70 HB THR 70 30.410 1.498 -23.981 656 HG1 THR 70 HG1 THR 70 30.655 3.354 -23.387 657 HG21 THR 70 HG21 THR 70 32.642 0.909 -24.230 658 HG22 THR 70 HG22 THR 70 31.873 0.575 -25.891 659 HG23 THR 70 HG23 THR 70 32.915 1.889 -25.673 660 H ASP 71 H ASP 71 28.958 4.817 -25.751 661 HA ASP 71 HA ASP 71 26.816 4.377 -23.688 662 HB2 ASP 71 HB2 ASP 71 27.206 6.713 -25.601 663 HB3 ASP 71 HB3 ASP 71 25.959 6.540 -24.345 664 H THR 72 H THR 72 24.996 3.869 -23.783 665 HA THR 72 HA THR 72 23.177 3.427 -26.099 666 HB THR 72 HB THR 72 22.163 1.650 -24.997 667 HG1 THR 72 HG1 THR 72 23.052 0.561 -23.184 668 HG21 THR 72 HG21 THR 72 25.171 0.949 -25.092 669 HG22 THR 72 HG22 THR 72 23.778 -0.202 -25.439 670 HG23 THR 72 HG23 THR 72 24.202 1.176 -26.476 671 HA PRO 73 HA PRO 73 20.179 5.757 -23.851 672 HB2 PRO 73 HB2 PRO 73 18.456 3.491 -24.448 673 HB3 PRO 73 HB3 PRO 73 17.927 5.189 -24.814 674 HG2 PRO 73 HG2 PRO 73 18.548 3.577 -26.892 675 HG3 PRO 73 HG3 PRO 73 19.252 5.181 -26.806 676 HD2 PRO 73 HD2 PRO 73 20.881 2.618 -26.245 677 HD3 PRO 73 HD3 PRO 73 21.208 4.193 -26.881 678 H ALA 74 H ALA 74 19.972 2.214 -23.270 679 HA ALA 74 HA ALA 74 19.173 2.182 -20.626 680 HB1 ALA 74 HB1 ALA 74 21.368 0.534 -21.762 681 HB2 ALA 74 HB2 ALA 74 20.662 0.316 -20.130 682 HB3 ALA 74 HB3 ALA 74 19.696 0.182 -21.680 683 H GLN 75 H GLN 75 22.693 2.515 -21.475 684 HA GLN 75 HA GLN 75 23.762 3.153 -18.936 685 HB2 GLN 75 HB2 GLN 75 24.969 2.403 -21.145 686 HB3 GLN 75 HB3 GLN 75 24.892 4.141 -21.511 687 HG2 GLN 75 HG2 GLN 75 27.048 3.700 -20.539 688 HG3 GLN 75 HG3 GLN 75 26.068 4.657 -19.368 689 HE21 GLN 75 HE22 GLN 75 28.204 3.637 -18.310 690 HE22 GLN 75 HE21 GLN 75 27.905 2.021 -17.647 691 H LEU 76 H LEU 76 22.418 5.381 -21.301 692 HA LEU 76 HA LEU 76 22.908 7.753 -19.515 693 HB2 LEU 76 HB2 LEU 76 21.787 7.311 -22.363 694 HB3 LEU 76 HB3 LEU 76 22.168 8.850 -21.716 695 HG LEU 76 HG LEU 76 24.133 6.647 -22.614 696 HD11 LEU 76 HD11 LEU 76 25.119 8.454 -23.813 697 HD12 LEU 76 HD12 LEU 76 23.378 8.486 -24.134 698 HD13 LEU 76 HD13 LEU 76 24.059 9.626 -23.007 699 HD21 LEU 76 HD21 LEU 76 24.921 7.328 -20.201 700 HD22 LEU 76 HD22 LEU 76 26.016 7.768 -21.557 701 HD23 LEU 76 HD23 LEU 76 24.930 8.963 -20.704 702 H GLU 77 H GLU 77 20.742 5.356 -19.303 703 HA GLU 77 HA GLU 77 18.579 5.120 -18.656 704 HB2 GLU 77 HB2 GLU 77 19.046 7.537 -17.031 705 HB3 GLU 77 HB3 GLU 77 17.862 6.365 -16.653 706 HG2 GLU 77 HG2 GLU 77 20.771 5.942 -16.881 707 HG3 GLU 77 HG3 GLU 77 19.873 6.271 -15.349 708 H MET 78 H MET 78 18.854 6.729 -21.221 709 HA MET 78 HA MET 78 17.160 8.925 -21.254 710 HB2 MET 78 HB2 MET 78 17.966 6.759 -23.278 711 HB3 MET 78 HB3 MET 78 16.868 8.088 -23.681 712 HG2 MET 78 HG2 MET 78 18.523 9.727 -23.387 713 HG3 MET 78 HG3 MET 78 19.593 8.697 -22.544 714 HE1 MET 78 HE1 MET 78 21.292 9.931 -24.483 715 HE2 MET 78 HE2 MET 78 20.946 9.933 -26.215 716 HE3 MET 78 HE3 MET 78 19.819 10.788 -25.242 717 H GLU 79 H GLU 79 15.258 9.404 -21.967 718 HA GLU 79 HA GLU 79 12.957 7.547 -21.567 719 HB2 GLU 79 HB2 GLU 79 13.247 10.630 -21.807 720 HB3 GLU 79 HB3 GLU 79 11.693 9.807 -21.798 721 HG2 GLU 79 HG2 GLU 79 13.705 9.778 -19.494 722 HG3 GLU 79 HG3 GLU 79 12.316 10.882 -19.792 723 H ASP 80 H ASP 80 11.282 7.608 -23.228 724 HA ASP 80 HA ASP 80 12.263 7.613 -25.899 725 HB2 ASP 80 HB2 ASP 80 10.402 6.341 -24.759 726 HB3 ASP 80 HB3 ASP 80 9.270 7.539 -25.069 727 H GLU 81 H GLU 81 11.455 8.822 -27.753 728 HA GLU 81 HA GLU 81 11.045 10.582 -28.997 729 HB2 GLU 81 HB2 GLU 81 9.080 11.433 -26.833 730 HB3 GLU 81 HB3 GLU 81 8.926 11.666 -28.448 731 HG2 GLU 81 HG2 GLU 81 8.726 9.191 -28.808 732 HG3 GLU 81 HG3 GLU 81 8.838 8.911 -27.099 733 H ASP 82 H ASP 82 13.163 11.191 -27.906 734 HA ASP 82 HA ASP 82 13.202 14.031 -26.944 735 HB2 ASP 82 HB2 ASP 82 13.542 12.116 -25.224 736 HB3 ASP 82 HB3 ASP 82 15.181 12.009 -25.976 737 H THR 83 H THR 83 15.603 14.770 -26.965 738 HA THR 83 HA THR 83 16.754 14.379 -29.734 739 HB THR 83 HB THR 83 16.730 16.901 -28.139 740 HG1 THR 83 HG1 THR 83 14.778 16.678 -28.851 741 HG21 THR 83 HG21 THR 83 17.110 18.034 -30.072 742 HG22 THR 83 HG22 THR 83 18.548 16.963 -29.638 743 HG23 THR 83 HG23 THR 83 17.564 16.660 -31.016 744 H ILE 84 H ILE 84 18.707 13.976 -29.939 745 HA ILE 84 HA ILE 84 20.959 14.557 -27.980 746 HB ILE 84 HB ILE 84 20.762 13.025 -30.443 747 HG12 ILE 84 HG12 ILE 84 21.390 11.841 -27.809 748 HG13 ILE 84 HG13 ILE 84 19.726 11.935 -28.410 749 HG21 ILE 84 HG21 ILE 84 23.201 13.392 -28.638 750 HG22 ILE 84 HG22 ILE 84 23.096 12.431 -30.166 751 HG23 ILE 84 HG23 ILE 84 22.907 14.177 -30.257 752 HD11 ILE 84 HD11 ILE 84 20.376 10.576 -30.478 753 HD12 ILE 84 HD12 ILE 84 21.917 10.488 -29.703 754 HD13 ILE 84 HD13 ILE 84 20.615 9.683 -28.924 755 H ASP 85 H ASP 85 22.193 16.349 -28.100 756 HA ASP 85 HA ASP 85 21.805 18.216 -30.332 757 HB2 ASP 85 HB2 ASP 85 22.937 18.439 -27.513 758 HB3 ASP 85 HB3 ASP 85 23.180 19.606 -28.716 759 H VAL 86 H VAL 86 23.400 18.760 -31.751 760 HA VAL 86 HA VAL 86 26.135 17.807 -31.386 761 HB VAL 86 HB VAL 86 24.706 18.429 -34.008 762 HG11 VAL 86 HG11 VAL 86 26.550 16.721 -34.804 763 HG12 VAL 86 HG12 VAL 86 27.214 18.313 -34.366 764 HG13 VAL 86 HG13 VAL 86 27.290 16.862 -33.295 765 HG21 VAL 86 HG21 VAL 86 23.627 16.544 -32.864 766 HG22 VAL 86 HG22 VAL 86 24.473 15.935 -34.306 767 HG23 VAL 86 HG23 VAL 86 25.157 15.747 -32.649 768 H PHE 87 H PHE 87 27.745 19.454 -31.734 769 HA PHE 87 HA PHE 87 26.926 22.339 -32.154 770 HB2 PHE 87 HB2 PHE 87 28.814 21.026 -30.189 771 HB3 PHE 87 HB3 PHE 87 28.653 22.784 -30.349 772 HD1 PHE 87 HD1 PHE 87 26.915 19.769 -29.090 773 HD2 PHE 87 HD2 PHE 87 26.636 24.063 -29.253 774 HE1 PHE 87 HE1 PHE 87 25.049 19.705 -27.540 775 HE2 PHE 87 HE2 PHE 87 24.778 23.921 -27.611 776 HZ PHE 87 HZ PHE 87 23.897 21.739 -26.898 777 H GLN 88 H GLN 88 28.250 23.412 -33.840 778 HA GLN 88 HA GLN 88 30.512 22.044 -34.934 779 HB2 GLN 88 HB2 GLN 88 29.095 24.607 -35.294 780 HB3 GLN 88 HB3 GLN 88 30.556 24.371 -36.170 781 HG2 GLN 88 HG2 GLN 88 28.289 22.348 -36.326 782 HG3 GLN 88 HG3 GLN 88 28.246 23.891 -37.271 783 HE21 GLN 88 HE22 GLN 88 27.938 21.371 -38.518 784 HE22 GLN 88 HE21 GLN 88 29.363 21.212 -39.516 785 H GLN 89 H GLN 89 32.860 22.777 -34.901 786 HA GLN 89 HA GLN 89 33.433 24.116 -32.407 787 HB2 GLN 89 HB2 GLN 89 34.707 21.860 -33.947 788 HB3 GLN 89 HB3 GLN 89 35.586 22.709 -32.660 789 HG2 GLN 89 HG2 GLN 89 33.168 20.819 -32.432 790 HG3 GLN 89 HG3 GLN 89 34.730 20.582 -31.803 791 HE21 GLN 89 HE22 GLN 89 31.881 22.923 -31.549 792 HE22 GLN 89 HE21 GLN 89 31.997 22.839 -29.799 793 H GLN 90 H GLN 90 33.615 26.226 -33.237 794 HA GLN 90 HA GLN 90 35.359 26.562 -35.533 795 HB2 GLN 90 HB2 GLN 90 34.245 28.794 -33.890 796 HB3 GLN 90 HB3 GLN 90 34.698 29.026 -35.486 797 HG2 GLN 90 HG2 GLN 90 32.471 28.415 -36.120 798 HG3 GLN 90 HG3 GLN 90 32.982 26.796 -35.788 799 HE21 GLN 90 HE22 GLN 90 30.238 27.834 -35.323 800 HE22 GLN 90 HE21 GLN 90 30.034 27.300 -33.628 801 H THR 91 H THR 91 37.089 25.420 -33.895 802 HA THR 91 HA THR 91 38.544 27.007 -32.016 803 HB THR 91 HB THR 91 40.237 25.331 -32.060 804 HG1 THR 91 HG1 THR 91 40.682 24.954 -34.207 805 HG21 THR 91 HG21 THR 91 38.806 23.312 -31.624 806 HG22 THR 91 HG22 THR 91 38.393 24.700 -30.742 807 HG23 THR 91 HG23 THR 91 37.458 24.200 -32.181 808 H GLY 92 H GLY 92 40.305 28.026 -31.821 809 HA2 GLY 92 HA2 GLY 92 42.020 29.382 -32.406 810 HA3 GLY 92 HA3 GLY 92 41.890 28.891 -34.148 811 H GLY 93 H GLY 93 42.364 31.311 -33.879 812 HA2 GLY 93 HA2 GLY 93 40.039 32.401 -35.293 813 HA3 GLY 93 HA3 GLY 93 40.717 33.426 -33.995 814 H VAL 94 H VAL 94 40.451 34.723 -36.232 815 HA VAL 94 HA VAL 94 42.864 35.283 -37.492 816 HB VAL 94 HB VAL 94 40.445 37.030 -36.929 817 HG11 VAL 94 HG11 VAL 94 42.769 38.101 -37.655 818 HG12 VAL 94 HG12 VAL 94 42.491 37.166 -39.194 819 HG13 VAL 94 HG13 VAL 94 41.421 38.454 -38.672 820 HG21 VAL 94 HG21 VAL 94 39.831 35.104 -38.506 821 HG22 VAL 94 HG22 VAL 94 39.834 36.642 -39.205 822 HG23 VAL 94 HG23 VAL 94 41.199 35.544 -39.533 823 H TYR 95 H TYR 95 44.283 35.011 -35.662 824 HA TYR 95 HA TYR 95 44.352 37.136 -33.496 825 HB2 TYR 95 HB2 TYR 95 44.741 34.210 -33.001 826 HB3 TYR 95 HB3 TYR 95 44.915 35.412 -31.820 827 HD1 TYR 95 HD1 TYR 95 42.224 37.064 -32.721 828 HD2 TYR 95 HD2 TYR 95 43.105 32.817 -31.920 829 HE1 TYR 95 HE1 TYR 95 39.887 36.468 -32.232 830 HE2 TYR 95 HE2 TYR 95 40.900 32.592 -30.951 831 HH TYR 95 HH TYR 95 38.476 35.066 -31.259 Start of MODEL 5 1 H1 ACE 36 HH32 ACE 36 13.357 18.913 -43.776 2 H2 ACE 36 HH33 ACE 36 14.438 17.649 -44.251 3 H3 ACE 36 HH31 ACE 36 13.672 18.516 -45.545 4 H GLU 37 H GLU 37 13.241 16.189 -46.095 5 HA GLU 37 HA GLU 37 10.601 15.377 -44.992 6 HB2 GLU 37 HB2 GLU 37 10.543 16.156 -47.367 7 HB3 GLU 37 HB3 GLU 37 11.648 14.773 -47.740 8 HG2 GLU 37 HG2 GLU 37 9.578 13.830 -48.317 9 HG3 GLU 37 HG3 GLU 37 9.819 13.310 -46.683 10 H ASP 38 H ASP 38 13.706 14.183 -45.902 11 HA ASP 38 HA ASP 38 12.916 11.500 -45.239 12 HB2 ASP 38 HB2 ASP 38 14.271 11.893 -47.261 13 HB3 ASP 38 HB3 ASP 38 15.649 12.481 -46.264 14 H ALA 39 H ALA 39 12.709 13.112 -43.044 15 HA ALA 39 HA ALA 39 15.218 13.044 -41.531 16 HB1 ALA 39 HB1 ALA 39 12.368 13.871 -40.912 17 HB2 ALA 39 HB2 ALA 39 13.620 14.139 -39.768 18 HB3 ALA 39 HB3 ALA 39 13.671 15.058 -41.287 19 H PHE 40 H PHE 40 14.734 10.524 -41.978 20 HA PHE 40 HA PHE 40 13.916 9.240 -39.348 21 HB2 PHE 40 HB2 PHE 40 11.920 9.316 -41.219 22 HB3 PHE 40 HB3 PHE 40 12.797 7.945 -41.766 23 HD1 PHE 40 HD1 PHE 40 11.190 9.572 -38.898 24 HD2 PHE 40 HD2 PHE 40 12.873 5.963 -40.334 25 HE1 PHE 40 HE1 PHE 40 9.797 8.305 -37.301 26 HE2 PHE 40 HE2 PHE 40 11.628 4.637 -38.692 27 HZ PHE 40 HZ PHE 40 10.085 5.846 -37.101 28 H ILE 41 H ILE 41 15.427 7.663 -38.744 29 HA ILE 41 HA ILE 41 16.618 5.915 -40.699 30 HB ILE 41 HB ILE 41 18.208 7.429 -38.621 31 HG12 ILE 41 HG12 ILE 41 18.721 7.933 -41.615 32 HG13 ILE 41 HG13 ILE 41 17.613 8.882 -40.582 33 HG21 ILE 41 HG21 ILE 41 18.939 5.761 -40.968 34 HG22 ILE 41 HG22 ILE 41 20.278 6.367 -39.961 35 HG23 ILE 41 HG23 ILE 41 19.165 5.091 -39.375 36 HD11 ILE 41 HD11 ILE 41 19.646 9.990 -41.066 37 HD12 ILE 41 HD12 ILE 41 19.293 9.704 -39.373 38 HD13 ILE 41 HD13 ILE 41 20.632 8.851 -40.209 39 H VAL 42 H VAL 42 16.986 4.033 -39.970 40 HA VAL 42 HA VAL 42 15.781 3.129 -37.320 41 HB VAL 42 HB VAL 42 15.513 1.781 -39.967 42 HG11 VAL 42 HG11 VAL 42 13.461 0.877 -39.175 43 HG12 VAL 42 HG12 VAL 42 14.749 0.531 -37.983 44 HG13 VAL 42 HG13 VAL 42 13.624 1.762 -37.546 45 HG21 VAL 42 HG21 VAL 42 13.793 4.027 -38.760 46 HG22 VAL 42 HG22 VAL 42 14.488 3.950 -40.363 47 HG23 VAL 42 HG23 VAL 42 13.095 2.974 -39.901 48 H ILE 43 H ILE 43 17.438 2.104 -36.239 49 HA ILE 43 HA ILE 43 19.554 0.623 -37.790 50 HB ILE 43 HB ILE 43 20.157 2.634 -35.684 51 HG12 ILE 43 HG12 ILE 43 20.653 3.169 -38.578 52 HG13 ILE 43 HG13 ILE 43 19.388 3.962 -37.563 53 HG21 ILE 43 HG21 ILE 43 21.928 1.134 -37.642 54 HG22 ILE 43 HG22 ILE 43 22.500 2.262 -36.508 55 HG23 ILE 43 HG23 ILE 43 21.855 0.801 -35.804 56 HD11 ILE 43 HD11 ILE 43 21.176 4.720 -36.103 57 HD12 ILE 43 HD12 ILE 43 22.359 4.191 -37.434 58 HD13 ILE 43 HD13 ILE 43 21.134 5.377 -37.816 59 H SEP 44 H SEP 44 20.516 -1.261 -36.585 60 HA SEP 44 HA SEP 44 20.404 -0.993 -33.793 61 HB2 SEP 44 HB2 SEP 44 19.228 -3.175 -33.132 62 HB3 SEP 44 HB3 SEP 44 18.252 -2.315 -34.284 63 H ASP 45 H ASP 45 21.466 -3.371 -32.821 64 HA ASP 45 HA ASP 45 24.126 -2.758 -33.773 65 HB2 ASP 45 HB2 ASP 45 23.331 -2.401 -31.556 66 HB3 ASP 45 HB3 ASP 45 23.471 -4.160 -31.226 67 H SEP 46 H SEP 46 22.044 -5.771 -33.636 68 HA SEP 46 HA SEP 46 24.431 -7.526 -33.973 69 HB2 SEP 46 HB2 SEP 46 23.221 -9.218 -32.915 70 HB3 SEP 46 HB3 SEP 46 23.067 -7.736 -31.890 71 H ASP 47 H ASP 47 24.511 -9.103 -35.217 72 HA ASP 47 HA ASP 47 22.334 -9.811 -37.047 73 HB2 ASP 47 HB2 ASP 47 23.774 -7.988 -38.127 74 HB3 ASP 47 HB3 ASP 47 25.089 -9.170 -38.177 75 H GLY 48 H GLY 48 22.381 -11.985 -37.416 76 HA2 GLY 48 HA2 GLY 48 24.668 -13.520 -36.215 77 HA3 GLY 48 HA3 GLY 48 22.952 -14.060 -36.497 78 H GLU 49 H GLU 49 25.235 -15.648 -36.997 79 HA GLU 49 HA GLU 49 25.459 -15.870 -39.991 80 HB2 GLU 49 HB2 GLU 49 27.479 -15.179 -39.043 81 HB3 GLU 49 HB3 GLU 49 27.479 -16.613 -37.969 82 HG2 GLU 49 HG2 GLU 49 29.104 -17.025 -39.750 83 HG3 GLU 49 HG3 GLU 49 27.917 -18.180 -39.944 84 HN1 NH2 50 HN1 NH2 50 24.596 -17.705 -40.851 85 HN2 NH2 50 HN2 NH2 50 24.162 -19.103 -39.885 86 H1 MET 1 H1 MET 1 -5.831 -37.416 -39.414 87 H2 MET 1 H2 MET 1 -4.763 -36.583 -40.260 88 H3 MET 1 H3 MET 1 -6.115 -35.861 -39.598 89 HA MET 1 HA MET 1 -5.148 -35.868 -37.497 90 HB2 MET 1 HB2 MET 1 -3.139 -37.669 -38.800 91 HB3 MET 1 HB3 MET 1 -2.570 -36.665 -37.529 92 HG2 MET 1 HG2 MET 1 -4.958 -37.684 -36.500 93 HG3 MET 1 HG3 MET 1 -4.649 -38.877 -37.774 94 HE1 MET 1 HE1 MET 1 -4.926 -40.366 -35.187 95 HE2 MET 1 HE2 MET 1 -3.827 -40.165 -33.900 96 HE3 MET 1 HE3 MET 1 -4.866 -38.841 -34.320 97 H ALA 2 H ALA 2 -5.463 -33.820 -37.919 98 HA ALA 2 HA ALA 2 -4.198 -32.286 -40.138 99 HB1 ALA 2 HB1 ALA 2 -5.615 -30.456 -39.242 100 HB2 ALA 2 HB2 ALA 2 -6.570 -31.874 -39.128 101 HB3 ALA 2 HB3 ALA 2 -5.616 -31.271 -37.710 102 H ASP 3 H ASP 3 -2.816 -30.589 -40.064 103 HA ASP 3 HA ASP 3 -0.510 -30.911 -38.414 104 HB2 ASP 3 HB2 ASP 3 -0.616 -30.197 -40.723 105 HB3 ASP 3 HB3 ASP 3 -1.200 -28.558 -40.288 106 H GLU 4 H GLU 4 0.049 -30.146 -36.511 107 HA GLU 4 HA GLU 4 -0.785 -27.630 -35.467 108 HB2 GLU 4 HB2 GLU 4 -3.093 -28.931 -35.384 109 HB3 GLU 4 HB3 GLU 4 -2.384 -30.007 -34.305 110 HG2 GLU 4 HG2 GLU 4 -3.795 -28.461 -33.219 111 HG3 GLU 4 HG3 GLU 4 -2.234 -28.628 -32.521 112 H LYS 5 H LYS 5 0.088 -27.229 -33.410 113 HA LYS 5 HA LYS 5 1.589 -29.109 -31.636 114 HB2 LYS 5 HB2 LYS 5 3.103 -28.885 -33.734 115 HB3 LYS 5 HB3 LYS 5 3.519 -27.231 -33.190 116 HG2 LYS 5 HG2 LYS 5 4.299 -27.918 -31.229 117 HG3 LYS 5 HG3 LYS 5 3.752 -29.548 -31.326 118 HD2 LYS 5 HD2 LYS 5 5.130 -29.667 -33.541 119 HD3 LYS 5 HD3 LYS 5 5.998 -28.230 -32.959 120 HE2 LYS 5 HE2 LYS 5 6.334 -31.033 -31.823 121 HE3 LYS 5 HE3 LYS 5 7.405 -29.855 -32.512 122 HZ1 LYS 5 HZ1 LYS 5 7.349 -28.548 -30.573 123 HZ2 LYS 5 HZ2 LYS 5 6.325 -29.364 -29.844 124 HZ3 LYS 5 HZ3 LYS 5 7.796 -30.010 -30.210 125 HA PRO 6 HA PRO 6 0.709 -25.743 -29.161 126 HB2 PRO 6 HB2 PRO 6 3.236 -26.536 -27.682 127 HB3 PRO 6 HB3 PRO 6 1.860 -25.827 -26.903 128 HG2 PRO 6 HG2 PRO 6 2.032 -28.538 -26.865 129 HG3 PRO 6 HG3 PRO 6 0.500 -27.889 -27.488 130 HD2 PRO 6 HD2 PRO 6 3.109 -28.365 -29.084 131 HD3 PRO 6 HD3 PRO 6 1.572 -29.263 -29.411 132 H LYS 7 H LYS 7 1.681 -23.530 -28.232 133 HA LYS 7 HA LYS 7 4.022 -22.530 -29.955 134 HB2 LYS 7 HB2 LYS 7 1.844 -21.936 -30.789 135 HB3 LYS 7 HB3 LYS 7 1.556 -21.214 -29.207 136 HG2 LYS 7 HG2 LYS 7 3.460 -19.724 -29.511 137 HG3 LYS 7 HG3 LYS 7 3.936 -20.482 -30.986 138 HD2 LYS 7 HD2 LYS 7 1.912 -19.608 -32.200 139 HD3 LYS 7 HD3 LYS 7 1.425 -18.705 -30.770 140 HE2 LYS 7 HE2 LYS 7 3.571 -17.568 -30.804 141 HE3 LYS 7 HE3 LYS 7 3.957 -18.467 -32.323 142 HZ1 LYS 7 HZ1 LYS 7 1.782 -16.524 -31.936 143 HZ2 LYS 7 HZ2 LYS 7 2.884 -16.310 -33.017 144 HZ3 LYS 7 HZ3 LYS 7 1.816 -17.512 -33.232 145 H GLU 8 H GLU 8 5.440 -21.345 -28.559 146 HA GLU 8 HA GLU 8 4.630 -20.545 -25.837 147 HB2 GLU 8 HB2 GLU 8 6.865 -21.441 -25.699 148 HB3 GLU 8 HB3 GLU 8 7.287 -20.373 -27.110 149 HG2 GLU 8 HG2 GLU 8 7.119 -18.363 -25.818 150 HG3 GLU 8 HG3 GLU 8 6.548 -19.248 -24.404 151 H GLY 9 H GLY 9 3.700 -18.380 -25.692 152 HA2 GLY 9 HA2 GLY 9 3.092 -16.943 -27.989 153 HA3 GLY 9 HA3 GLY 9 2.678 -16.529 -26.422 154 H VAL 10 H VAL 10 5.204 -16.385 -25.216 155 HA VAL 10 HA VAL 10 5.997 -13.613 -25.522 156 HB VAL 10 HB VAL 10 7.212 -16.056 -24.135 157 HG11 VAL 10 HG11 VAL 10 9.233 -14.852 -24.448 158 HG12 VAL 10 HG12 VAL 10 8.358 -13.344 -24.478 159 HG13 VAL 10 HG13 VAL 10 8.558 -14.206 -22.941 160 HG21 VAL 10 HG21 VAL 10 6.519 -14.645 -22.171 161 HG22 VAL 10 HG22 VAL 10 6.344 -13.301 -23.220 162 HG23 VAL 10 HG23 VAL 10 5.109 -14.642 -23.217 163 H LYS 11 H LYS 11 7.682 -12.769 -26.933 164 HA LYS 11 HA LYS 11 9.672 -14.794 -28.136 165 HB2 LYS 11 HB2 LYS 11 7.397 -14.427 -29.417 166 HB3 LYS 11 HB3 LYS 11 8.081 -12.858 -29.856 167 HG2 LYS 11 HG2 LYS 11 10.043 -14.080 -30.839 168 HG3 LYS 11 HG3 LYS 11 9.280 -15.589 -30.385 169 HD2 LYS 11 HD2 LYS 11 7.566 -15.310 -31.991 170 HD3 LYS 11 HD3 LYS 11 8.022 -13.800 -32.561 171 HE2 LYS 11 HE2 LYS 11 10.292 -14.767 -33.325 172 HE3 LYS 11 HE3 LYS 11 9.717 -16.326 -32.676 173 HZ1 LYS 11 HZ1 LYS 11 7.908 -16.209 -34.306 174 HZ2 LYS 11 HZ2 LYS 11 8.413 -14.736 -34.875 175 HZ3 LYS 11 HZ3 LYS 11 9.317 -16.045 -35.122 176 H THR 12 H THR 12 11.552 -13.872 -28.865 177 HA THR 12 HA THR 12 12.676 -11.498 -27.991 178 HB THR 12 HB THR 12 14.462 -11.855 -29.616 179 HG1 THR 12 HG1 THR 12 13.885 -12.572 -31.553 180 HG21 THR 12 HG21 THR 12 14.496 -13.375 -27.821 181 HG22 THR 12 HG22 THR 12 13.347 -14.491 -28.584 182 HG23 THR 12 HG23 THR 12 15.041 -14.253 -29.245 183 H GLU 13 H GLU 13 10.599 -12.024 -30.777 184 HA GLU 13 HA GLU 13 11.327 -9.399 -32.058 185 HB2 GLU 13 HB2 GLU 13 9.292 -11.333 -33.131 186 HB3 GLU 13 HB3 GLU 13 10.362 -10.040 -33.877 187 HG2 GLU 13 HG2 GLU 13 11.166 -12.848 -32.993 188 HG3 GLU 13 HG3 GLU 13 10.980 -12.325 -34.554 189 H ASN 14 H ASN 14 9.469 -9.794 -29.462 190 HA ASN 14 HA ASN 14 7.205 -8.091 -30.140 191 HB2 ASN 14 HB2 ASN 14 8.328 -9.474 -27.729 192 HB3 ASN 14 HB3 ASN 14 7.036 -8.342 -27.546 193 HD21 ASN 14 HD22 ASN 14 5.823 -9.410 -30.309 194 HD22 ASN 14 HD21 ASN 14 4.941 -10.857 -29.644 195 H ASN 15 H ASN 15 10.586 -7.395 -29.658 196 HA ASN 15 HA ASN 15 10.530 -5.623 -27.398 197 HB2 ASN 15 HB2 ASN 15 12.264 -7.077 -28.298 198 HB3 ASN 15 HB3 ASN 15 12.411 -5.999 -29.705 199 HD21 ASN 15 HD22 ASN 15 14.592 -6.314 -28.369 200 HD22 ASN 15 HD21 ASN 15 14.993 -4.989 -27.251 201 H ASP 16 H ASP 16 10.264 -3.341 -27.284 202 HA ASP 16 HA ASP 16 9.445 -1.945 -29.826 203 HB2 ASP 16 HB2 ASP 16 8.731 -1.288 -26.943 204 HB3 ASP 16 HB3 ASP 16 8.451 -0.228 -28.453 205 H HIS 17 H HIS 17 10.526 -0.569 -30.689 206 HA HIS 17 HA HIS 17 13.156 0.376 -29.915 207 HB2 HIS 17 HB2 HIS 17 11.204 1.643 -31.882 208 HB3 HIS 17 HB3 HIS 17 12.854 1.965 -31.902 209 HD2 HIS 17 HD2 HIS 17 14.467 0.033 -33.206 210 HE1 HIS 17 HE1 HIS 17 11.347 -2.617 -34.305 211 HE2 HIS 17 HE2 HIS 17 13.767 -1.999 -34.557 212 H ILE 18 H ILE 18 13.831 2.138 -29.174 213 HA ILE 18 HA ILE 18 12.121 4.265 -27.992 214 HB ILE 18 HB ILE 18 13.702 3.300 -26.491 215 HG12 ILE 18 HG12 ILE 18 14.340 6.252 -27.206 216 HG13 ILE 18 HG13 ILE 18 13.150 5.573 -26.145 217 HG21 ILE 18 HG21 ILE 18 15.364 2.705 -28.109 218 HG22 ILE 18 HG22 ILE 18 15.999 4.453 -27.955 219 HG23 ILE 18 HG23 ILE 18 15.889 3.334 -26.536 220 HD11 ILE 18 HD11 ILE 18 15.109 4.678 -24.706 221 HD12 ILE 18 HD12 ILE 18 16.254 5.541 -25.749 222 HD13 ILE 18 HD13 ILE 18 15.122 6.457 -24.859 223 H ASN 19 H ASN 19 12.074 6.437 -28.889 224 HA ASN 19 HA ASN 19 13.542 6.618 -31.505 225 HB2 ASN 19 HB2 ASN 19 10.998 8.123 -30.616 226 HB3 ASN 19 HB3 ASN 19 11.620 7.767 -32.237 227 HD21 ASN 19 HD22 ASN 19 10.305 5.986 -29.406 228 HD22 ASN 19 HD21 ASN 19 9.439 4.819 -30.389 229 H LEU 20 H LEU 20 15.009 8.059 -31.700 230 HA LEU 20 HA LEU 20 15.419 10.107 -29.585 231 HB2 LEU 20 HB2 LEU 20 17.690 8.266 -30.633 232 HB3 LEU 20 HB3 LEU 20 17.709 9.564 -29.454 233 HG LEU 20 HG LEU 20 16.127 6.922 -28.977 234 HD11 LEU 20 HD11 LEU 20 18.814 7.782 -27.788 235 HD12 LEU 20 HD12 LEU 20 17.975 6.157 -27.904 236 HD13 LEU 20 HD13 LEU 20 18.712 7.068 -29.314 237 HD21 LEU 20 HD21 LEU 20 17.063 9.438 -27.404 238 HD22 LEU 20 HD22 LEU 20 15.412 8.955 -27.699 239 HD23 LEU 20 HD23 LEU 20 16.468 7.995 -26.595 240 H LYS 21 H LYS 21 15.185 11.976 -30.624 241 HA LYS 21 HA LYS 21 15.938 12.520 -33.399 242 HB2 LYS 21 HB2 LYS 21 14.965 14.023 -30.983 243 HB3 LYS 21 HB3 LYS 21 15.632 14.821 -32.482 244 HG2 LYS 21 HG2 LYS 21 14.132 13.793 -33.861 245 HG3 LYS 21 HG3 LYS 21 13.404 12.866 -32.561 246 HD2 LYS 21 HD2 LYS 21 12.985 15.322 -31.507 247 HD3 LYS 21 HD3 LYS 21 13.590 15.872 -33.077 248 HE2 LYS 21 HE2 LYS 21 11.076 14.502 -32.273 249 HE3 LYS 21 HE3 LYS 21 11.232 16.113 -33.041 250 HZ1 LYS 21 HZ1 LYS 21 11.393 13.698 -34.466 251 HZ2 LYS 21 HZ2 LYS 21 10.550 15.061 -34.854 252 HZ3 LYS 21 HZ3 LYS 21 12.178 15.004 -35.001 253 H VAL 22 H VAL 22 17.575 13.469 -33.949 254 HA VAL 22 HA VAL 22 19.911 14.552 -32.369 255 HB VAL 22 HB VAL 22 20.211 12.916 -34.911 256 HG11 VAL 22 HG11 VAL 22 22.286 14.434 -33.135 257 HG12 VAL 22 HG12 VAL 22 22.708 13.312 -34.394 258 HG13 VAL 22 HG13 VAL 22 21.970 14.794 -34.840 259 HG21 VAL 22 HG21 VAL 22 21.478 11.411 -33.429 260 HG22 VAL 22 HG22 VAL 22 21.096 12.435 -32.071 261 HG23 VAL 22 HG23 VAL 22 19.764 11.666 -32.890 262 H ALA 23 H ALA 23 20.156 16.662 -32.539 263 HA ALA 23 HA ALA 23 19.308 17.902 -35.126 264 HB1 ALA 23 HB1 ALA 23 18.439 19.642 -33.650 265 HB2 ALA 23 HB2 ALA 23 17.664 17.966 -33.531 266 HB3 ALA 23 HB3 ALA 23 18.664 18.670 -32.220 267 H GLY 24 H GLY 24 21.051 19.035 -36.004 268 HA2 GLY 24 HA2 GLY 24 23.311 20.218 -34.610 269 HA3 GLY 24 HA3 GLY 24 22.802 20.420 -36.311 270 H GLN 25 H GLN 25 23.822 22.460 -34.597 271 HA GLN 25 HA GLN 25 21.569 24.095 -33.915 272 HB2 GLN 25 HB2 GLN 25 24.339 25.112 -34.360 273 HB3 GLN 25 HB3 GLN 25 23.135 25.748 -33.320 274 HG2 GLN 25 HG2 GLN 25 24.911 23.284 -32.987 275 HG3 GLN 25 HG3 GLN 25 24.924 24.724 -32.051 276 HE21 GLN 25 HE22 GLN 25 24.143 21.759 -31.481 277 HE22 GLN 25 HE21 GLN 25 22.652 21.854 -30.530 278 H ASP 26 H ASP 26 22.787 23.393 -36.824 279 HA ASP 26 HA ASP 26 22.407 25.827 -38.439 280 HB2 ASP 26 HB2 ASP 26 23.076 23.983 -40.322 281 HB3 ASP 26 HB3 ASP 26 24.287 24.305 -39.065 282 H GLY 27 H GLY 27 20.380 23.282 -37.297 283 HA2 GLY 27 HA2 GLY 27 18.070 23.278 -37.676 284 HA3 GLY 27 HA3 GLY 27 18.165 24.037 -39.204 285 H SER 28 H SER 28 20.541 21.611 -39.042 286 HA SER 28 HA SER 28 19.094 19.561 -40.576 287 HB2 SER 28 HB2 SER 28 21.098 18.196 -40.067 288 HB3 SER 28 HB3 SER 28 21.564 19.781 -40.647 289 HG SER 28 HG SER 28 22.119 20.391 -38.614 290 H VAL 29 H VAL 29 18.031 17.845 -39.794 291 HA VAL 29 HA VAL 29 17.893 17.038 -37.003 292 HB VAL 29 HB VAL 29 15.145 17.470 -38.192 293 HG11 VAL 29 HG11 VAL 29 16.032 16.211 -35.937 294 HG12 VAL 29 HG12 VAL 29 16.041 17.852 -35.364 295 HG13 VAL 29 HG13 VAL 29 14.482 17.227 -35.948 296 HG21 VAL 29 HG21 VAL 29 14.756 19.544 -37.285 297 HG22 VAL 29 HG22 VAL 29 16.387 19.829 -36.746 298 HG23 VAL 29 HG23 VAL 29 15.808 19.820 -38.464 299 H VAL 30 H VAL 30 17.870 14.803 -36.963 300 HA VAL 30 HA VAL 30 15.977 13.359 -38.634 301 HB VAL 30 HB VAL 30 17.420 11.780 -39.057 302 HG11 VAL 30 HG11 VAL 30 17.935 13.688 -40.539 303 HG12 VAL 30 HG12 VAL 30 19.314 14.164 -39.485 304 HG13 VAL 30 HG13 VAL 30 19.271 12.544 -40.358 305 HG21 VAL 30 HG21 VAL 30 18.595 11.522 -36.821 306 HG22 VAL 30 HG22 VAL 30 19.779 11.598 -37.948 307 HG23 VAL 30 HG23 VAL 30 19.142 13.181 -37.132 308 H GLN 31 H GLN 31 15.095 11.573 -37.731 309 HA GLN 31 HA GLN 31 15.276 11.450 -34.816 310 HB2 GLN 31 HB2 GLN 31 13.159 12.264 -35.585 311 HB3 GLN 31 HB3 GLN 31 13.048 10.999 -36.811 312 HG2 GLN 31 HG2 GLN 31 12.573 9.266 -34.905 313 HG3 GLN 31 HG3 GLN 31 13.232 10.396 -33.727 314 HE21 GLN 31 HE22 GLN 31 10.319 8.985 -33.940 315 HE22 GLN 31 HE21 GLN 31 9.637 10.515 -33.285 316 H PHE 32 H PHE 32 16.313 9.450 -34.150 317 HA PHE 32 HA PHE 32 16.498 7.094 -35.969 318 HB2 PHE 32 HB2 PHE 32 17.932 7.964 -33.335 319 HB3 PHE 32 HB3 PHE 32 18.076 6.366 -34.164 320 HD1 PHE 32 HD2 PHE 32 18.951 6.407 -36.544 321 HD2 PHE 32 HD1 PHE 32 19.142 9.863 -34.004 322 HE1 PHE 32 HE2 PHE 32 20.467 7.481 -38.141 323 HE2 PHE 32 HE1 PHE 32 20.665 10.915 -35.592 324 HZ PHE 32 HZ PHE 32 21.379 9.760 -37.692 325 H LYS 33 H LYS 33 15.177 5.328 -35.921 326 HA LYS 33 HA LYS 33 13.822 4.753 -33.405 327 HB2 LYS 33 HB2 LYS 33 12.281 5.161 -35.054 328 HB3 LYS 33 HB3 LYS 33 13.229 4.254 -36.212 329 HG2 LYS 33 HG2 LYS 33 12.851 2.131 -34.991 330 HG3 LYS 33 HG3 LYS 33 11.936 3.067 -33.774 331 HD2 LYS 33 HD2 LYS 33 10.187 3.647 -35.798 332 HD3 LYS 33 HD3 LYS 33 11.204 2.582 -36.822 333 HE2 LYS 33 HE2 LYS 33 10.816 0.722 -35.159 334 HE3 LYS 33 HE3 LYS 33 9.829 1.923 -34.256 335 HZ1 LYS 33 HZ1 LYS 33 8.354 1.715 -36.371 336 HZ2 LYS 33 HZ2 LYS 33 9.424 0.491 -36.846 337 HZ3 LYS 33 HZ3 LYS 33 8.489 0.400 -35.546 338 H ILE 34 H ILE 34 15.205 3.821 -32.254 339 HA ILE 34 HA ILE 34 16.801 1.380 -33.174 340 HB ILE 34 HB ILE 34 18.688 1.961 -31.833 341 HG12 ILE 34 HG12 ILE 34 17.639 4.734 -31.294 342 HG13 ILE 34 HG13 ILE 34 16.902 3.608 -30.321 343 HG21 ILE 34 HG21 ILE 34 18.313 4.363 -33.440 344 HG22 ILE 34 HG22 ILE 34 19.622 3.037 -33.390 345 HG23 ILE 34 HG23 ILE 34 18.190 2.809 -34.282 346 HD11 ILE 34 HD11 ILE 34 19.060 3.126 -29.195 347 HD12 ILE 34 HD12 ILE 34 20.068 3.533 -30.546 348 HD13 ILE 34 HD13 ILE 34 19.380 4.828 -29.651 349 H LYS 35 H LYS 35 17.720 0.259 -30.822 350 HA LYS 35 HA LYS 35 15.249 -0.322 -29.375 351 HB2 LYS 35 HB2 LYS 35 17.549 -1.923 -30.521 352 HB3 LYS 35 HB3 LYS 35 16.854 -2.550 -28.947 353 HG2 LYS 35 HG2 LYS 35 14.705 -2.785 -30.284 354 HG3 LYS 35 HG3 LYS 35 15.523 -1.985 -31.601 355 HD2 LYS 35 HD2 LYS 35 16.971 -4.099 -31.743 356 HD3 LYS 35 HD3 LYS 35 16.097 -4.693 -30.299 357 HE2 LYS 35 HE2 LYS 35 14.081 -4.302 -31.714 358 HE3 LYS 35 HE3 LYS 35 15.314 -3.778 -33.024 359 HZ1 LYS 35 HZ1 LYS 35 14.659 -6.298 -32.989 360 HZ2 LYS 35 HZ2 LYS 35 16.133 -5.653 -33.404 361 HZ3 LYS 35 HZ3 LYS 35 15.877 -6.280 -31.936 362 H ARG 36 H ARG 36 15.712 -0.711 -27.150 363 HA ARG 36 HA ARG 36 16.951 1.525 -26.057 364 HB2 ARG 36 HB2 ARG 36 15.155 0.307 -25.171 365 HB3 ARG 36 HB3 ARG 36 16.215 -0.854 -24.345 366 HG2 ARG 36 HG2 ARG 36 17.322 1.249 -23.274 367 HG3 ARG 36 HG3 ARG 36 15.990 2.144 -24.001 368 HD2 ARG 36 HD2 ARG 36 15.313 1.894 -21.901 369 HD3 ARG 36 HD3 ARG 36 14.397 0.634 -22.798 370 HE ARG 36 HE ARG 36 15.726 -1.080 -21.618 371 HH11 ARG 36 HH11 ARG 36 16.826 1.997 -20.525 372 HH12 ARG 36 HH12 ARG 36 17.637 1.227 -19.132 373 HH21 ARG 36 HH21 ARG 36 16.262 -1.830 -19.810 374 HH22 ARG 36 HH22 ARG 36 17.265 -0.971 -18.679 375 H HIS 37 H HIS 37 18.576 -1.350 -26.797 376 HA HIS 37 HA HIS 37 21.059 -0.888 -25.255 377 HB2 HIS 37 HB2 HIS 37 21.607 -3.059 -25.367 378 HB3 HIS 37 HB3 HIS 37 19.859 -3.157 -25.005 379 HD2 HIS 37 HD2 HIS 37 22.331 -4.891 -27.282 380 HE1 HIS 37 HE1 HIS 37 18.735 -5.511 -29.286 381 HE2 HIS 37 HE2 HIS 37 21.133 -6.111 -29.104 382 H THR 38 H THR 38 19.909 -0.225 -28.274 383 HA THR 38 HA THR 38 22.179 -0.942 -30.033 384 HB THR 38 HB THR 38 20.196 1.315 -30.310 385 HG1 THR 38 HG1 THR 38 20.024 -1.351 -31.077 386 HG21 THR 38 HG21 THR 38 21.648 1.698 -32.066 387 HG22 THR 38 HG22 THR 38 21.990 0.116 -32.412 388 HG23 THR 38 HG23 THR 38 20.303 0.760 -32.811 389 HA PRO 39 HA PRO 39 24.532 2.383 -28.083 390 HB2 PRO 39 HB2 PRO 39 26.994 2.204 -29.449 391 HB3 PRO 39 HB3 PRO 39 26.285 0.948 -28.401 392 HG2 PRO 39 HG2 PRO 39 26.269 1.022 -31.355 393 HG3 PRO 39 HG3 PRO 39 26.656 -0.216 -30.287 394 HD2 PRO 39 HD2 PRO 39 24.046 0.023 -31.343 395 HD3 PRO 39 HD3 PRO 39 24.403 -0.856 -29.874 396 H LEU 40 H LEU 40 25.299 4.575 -28.401 397 HA LEU 40 HA LEU 40 23.829 5.989 -30.498 398 HB2 LEU 40 HB2 LEU 40 25.223 7.045 -27.992 399 HB3 LEU 40 HB3 LEU 40 24.261 7.951 -29.187 400 HG LEU 40 HG LEU 40 23.225 5.532 -27.573 401 HD11 LEU 40 HD11 LEU 40 22.747 8.503 -26.958 402 HD12 LEU 40 HD12 LEU 40 22.338 7.050 -25.913 403 HD13 LEU 40 HD13 LEU 40 23.993 7.671 -26.127 404 HD21 LEU 40 HD21 LEU 40 21.745 7.525 -29.167 405 HD22 LEU 40 HD22 LEU 40 21.778 5.756 -29.294 406 HD23 LEU 40 HD23 LEU 40 20.943 6.408 -28.001 407 H SER 41 H SER 41 27.290 5.373 -30.105 408 HA SER 41 HA SER 41 28.689 6.814 -31.931 409 HB2 SER 41 HB2 SER 41 29.618 4.671 -32.619 410 HB3 SER 41 HB3 SER 41 29.601 5.071 -30.876 411 HG SER 41 HG SER 41 28.863 2.854 -31.355 412 H LYS 42 H LYS 42 26.303 4.297 -32.615 413 HA LYS 42 HA LYS 42 26.655 4.334 -35.433 414 HB2 LYS 42 HB2 LYS 42 24.341 3.025 -33.778 415 HB3 LYS 42 HB3 LYS 42 24.479 3.030 -35.552 416 HG2 LYS 42 HG2 LYS 42 26.540 1.911 -35.467 417 HG3 LYS 42 HG3 LYS 42 26.428 1.821 -33.633 418 HD2 LYS 42 HD2 LYS 42 24.377 0.660 -33.881 419 HD3 LYS 42 HD3 LYS 42 24.624 0.482 -35.650 420 HE2 LYS 42 HE2 LYS 42 26.613 -0.669 -33.575 421 HE3 LYS 42 HE3 LYS 42 25.312 -1.547 -34.271 422 HZ1 LYS 42 HZ1 LYS 42 26.576 -0.735 -36.375 423 HZ2 LYS 42 HZ2 LYS 42 27.911 -0.622 -35.415 424 HZ3 LYS 42 HZ3 LYS 42 27.152 -2.054 -35.604 425 H LEU 43 H LEU 43 24.340 5.997 -33.445 426 HA LEU 43 HA LEU 43 22.734 7.227 -35.520 427 HB2 LEU 43 HB2 LEU 43 23.173 7.632 -32.481 428 HB3 LEU 43 HB3 LEU 43 22.119 8.672 -33.409 429 HG LEU 43 HG LEU 43 20.681 6.579 -33.905 430 HD11 LEU 43 HD11 LEU 43 22.774 5.163 -32.120 431 HD12 LEU 43 HD12 LEU 43 21.091 4.566 -32.512 432 HD13 LEU 43 HD13 LEU 43 22.317 4.666 -33.742 433 HD21 LEU 43 HD21 LEU 43 21.092 7.147 -31.009 434 HD22 LEU 43 HD22 LEU 43 20.206 8.195 -32.087 435 HD23 LEU 43 HD23 LEU 43 19.585 6.597 -31.724 436 H MET 44 H MET 44 25.335 8.315 -33.325 437 HA MET 44 HA MET 44 25.608 10.904 -34.198 438 HB2 MET 44 HB2 MET 44 27.807 9.123 -33.110 439 HB3 MET 44 HB3 MET 44 27.961 10.772 -33.350 440 HG2 MET 44 HG2 MET 44 26.474 11.435 -31.580 441 HG3 MET 44 HG3 MET 44 25.522 9.945 -31.845 442 HE1 MET 44 HE1 MET 44 29.537 9.583 -29.514 443 HE2 MET 44 HE2 MET 44 29.430 9.333 -31.232 444 HE3 MET 44 HE3 MET 44 29.235 10.861 -30.784 445 H LYS 45 H LYS 45 27.685 8.010 -35.264 446 HA LYS 45 HA LYS 45 28.934 9.219 -37.502 447 HB2 LYS 45 HB2 LYS 45 28.347 6.260 -37.124 448 HB3 LYS 45 HB3 LYS 45 29.362 6.916 -38.364 449 HG2 LYS 45 HG2 LYS 45 31.039 7.770 -36.809 450 HG3 LYS 45 HG3 LYS 45 29.941 7.583 -35.489 451 HD2 LYS 45 HD2 LYS 45 30.091 4.982 -35.932 452 HD3 LYS 45 HD3 LYS 45 31.225 5.321 -37.173 453 HE2 LYS 45 HE2 LYS 45 32.701 6.178 -35.099 454 HE3 LYS 45 HE3 LYS 45 31.397 5.517 -34.126 455 HZ1 LYS 45 HZ1 LYS 45 32.586 3.791 -36.182 456 HZ2 LYS 45 HZ2 LYS 45 33.063 3.932 -34.537 457 HZ3 LYS 45 HZ3 LYS 45 31.619 3.429 -34.878 458 H ALA 46 H ALA 46 25.691 7.615 -37.379 459 HA ALA 46 HA ALA 46 25.265 7.576 -40.220 460 HB1 ALA 46 HB1 ALA 46 23.288 7.185 -37.975 461 HB2 ALA 46 HB2 ALA 46 22.885 7.145 -39.662 462 HB3 ALA 46 HB3 ALA 46 24.080 6.029 -39.038 463 H TYR 47 H TYR 47 24.331 9.941 -37.798 464 HA TYR 47 HA TYR 47 23.132 11.862 -39.579 465 HB2 TYR 47 HB2 TYR 47 23.094 12.078 -37.120 466 HB3 TYR 47 HB3 TYR 47 24.844 12.167 -37.195 467 HD1 TYR 47 HD1 TYR 47 21.831 14.121 -38.134 468 HD2 TYR 47 HD2 TYR 47 26.059 14.194 -37.332 469 HE1 TYR 47 HE1 TYR 47 21.731 16.487 -38.012 470 HE2 TYR 47 HE2 TYR 47 26.003 16.646 -37.391 471 HH TYR 47 HH TYR 47 23.210 18.685 -38.065 472 H CYS 48 H CYS 48 26.390 11.526 -38.562 473 HA CYS 48 HA CYS 48 27.452 13.816 -39.933 474 HB2 CYS 48 HB2 CYS 48 28.295 12.647 -37.782 475 HB3 CYS 48 HB3 CYS 48 28.623 11.200 -38.771 476 HG CYS 48 HG CYS 48 30.484 11.924 -40.099 477 H GLU 49 H GLU 49 27.351 10.294 -40.890 478 HA GLU 49 HA GLU 49 28.777 10.657 -43.270 479 HB2 GLU 49 HB2 GLU 49 26.569 8.788 -42.413 480 HB3 GLU 49 HB3 GLU 49 27.263 8.685 -43.995 481 HG2 GLU 49 HG2 GLU 49 29.417 8.203 -43.249 482 HG3 GLU 49 HG3 GLU 49 29.020 8.467 -41.563 483 H ARG 50 H ARG 50 25.222 10.905 -42.581 484 HA ARG 50 HA ARG 50 24.351 11.459 -45.275 485 HB2 ARG 50 HB2 ARG 50 23.003 12.072 -42.671 486 HB3 ARG 50 HB3 ARG 50 22.448 12.569 -44.267 487 HG2 ARG 50 HG2 ARG 50 22.635 10.018 -44.849 488 HG3 ARG 50 HG3 ARG 50 22.766 9.888 -43.015 489 HD2 ARG 50 HD2 ARG 50 20.638 11.115 -42.820 490 HD3 ARG 50 HD3 ARG 50 20.567 11.154 -44.563 491 HE ARG 50 HE ARG 50 20.813 8.462 -43.491 492 HH11 ARG 50 HH11 ARG 50 18.386 10.938 -44.366 493 HH12 ARG 50 HH12 ARG 50 17.311 9.741 -44.924 494 HH21 ARG 50 HH21 ARG 50 19.271 7.077 -44.013 495 HH22 ARG 50 HH22 ARG 50 17.642 7.714 -44.395 496 H GLN 51 H GLN 51 25.533 13.654 -42.831 497 HA GLN 51 HA GLN 51 24.964 15.923 -44.553 498 HB2 GLN 51 HB2 GLN 51 26.159 16.007 -41.806 499 HB3 GLN 51 HB3 GLN 51 25.741 17.298 -42.714 500 HG2 GLN 51 HG2 GLN 51 23.651 15.092 -41.980 501 HG3 GLN 51 HG3 GLN 51 24.167 16.225 -40.898 502 HE21 GLN 51 HE22 GLN 51 21.466 15.909 -42.402 503 HE22 GLN 51 HE21 GLN 51 21.051 17.507 -43.002 504 H GLY 52 H GLY 52 27.305 13.876 -44.611 505 HA2 GLY 52 HA2 GLY 52 29.492 13.754 -45.417 506 HA3 GLY 52 HA3 GLY 52 29.179 15.337 -46.310 507 H LEU 53 H LEU 53 29.461 14.573 -42.746 508 HA LEU 53 HA LEU 53 31.401 16.915 -42.517 509 HB2 LEU 53 HB2 LEU 53 29.847 15.472 -40.445 510 HB3 LEU 53 HB3 LEU 53 30.795 16.905 -40.128 511 HG LEU 53 HG LEU 53 28.387 16.791 -41.994 512 HD11 LEU 53 HD11 LEU 53 27.886 16.287 -39.735 513 HD12 LEU 53 HD12 LEU 53 28.657 17.792 -39.194 514 HD13 LEU 53 HD13 LEU 53 27.110 17.839 -40.148 515 HD21 LEU 53 HD21 LEU 53 29.636 18.863 -42.524 516 HD22 LEU 53 HD22 LEU 53 28.386 19.381 -41.470 517 HD23 LEU 53 HD23 LEU 53 30.078 19.257 -40.969 518 H SER 54 H SER 54 33.302 16.736 -41.552 519 HA SER 54 HA SER 54 34.352 13.925 -41.212 520 HB2 SER 54 HB2 SER 54 36.040 15.687 -41.974 521 HB3 SER 54 HB3 SER 54 35.614 16.652 -40.615 522 HG SER 54 HG SER 54 37.393 15.697 -40.123 523 H MET 55 H MET 55 34.200 12.872 -39.385 524 HA MET 55 HA MET 55 32.586 14.040 -37.523 525 HB2 MET 55 HB2 MET 55 33.057 11.560 -38.016 526 HB3 MET 55 HB3 MET 55 34.303 11.664 -36.876 527 HG2 MET 55 HG2 MET 55 32.469 12.718 -35.174 528 HG3 MET 55 HG3 MET 55 31.440 11.956 -36.486 529 HE1 MET 55 HE1 MET 55 33.997 9.511 -33.629 530 HE2 MET 55 HE2 MET 55 34.795 10.698 -34.768 531 HE3 MET 55 HE3 MET 55 33.885 11.258 -33.365 532 H ARG 56 H ARG 56 36.117 13.798 -37.408 533 HA ARG 56 HA ARG 56 36.760 14.630 -34.834 534 HB2 ARG 56 HB2 ARG 56 38.100 14.062 -36.765 535 HB3 ARG 56 HB3 ARG 56 38.201 15.710 -37.327 536 HG2 ARG 56 HG2 ARG 56 39.345 16.258 -35.227 537 HG3 ARG 56 HG3 ARG 56 39.029 14.794 -34.436 538 HD2 ARG 56 HD2 ARG 56 40.480 15.111 -37.201 539 HD3 ARG 56 HD3 ARG 56 41.380 14.982 -35.668 540 HE ARG 56 HE ARG 56 39.978 12.795 -35.572 541 HH11 ARG 56 HH11 ARG 56 42.345 14.141 -37.868 542 HH12 ARG 56 HH12 ARG 56 42.893 12.549 -38.268 543 HH21 ARG 56 HH21 ARG 56 40.661 10.710 -36.526 544 HH22 ARG 56 HH22 ARG 56 42.167 10.840 -37.461 545 H GLN 57 H GLN 57 35.129 16.606 -37.272 546 HA GLN 57 HA GLN 57 35.972 19.265 -35.920 547 HB2 GLN 57 HB2 GLN 57 35.538 20.323 -37.851 548 HB3 GLN 57 HB3 GLN 57 35.933 18.803 -38.504 549 HG2 GLN 57 HG2 GLN 57 33.364 18.289 -38.209 550 HG3 GLN 57 HG3 GLN 57 33.157 20.024 -38.531 551 HE21 GLN 57 HE22 GLN 57 35.782 19.730 -40.546 552 HE22 GLN 57 HE21 GLN 57 34.954 19.333 -41.968 553 H ILE 58 H ILE 58 33.166 17.110 -35.578 554 HA ILE 58 HA ILE 58 31.783 19.236 -34.049 555 HB ILE 58 HB ILE 58 29.797 17.582 -34.316 556 HG12 ILE 58 HG12 ILE 58 31.369 16.456 -36.700 557 HG13 ILE 58 HG13 ILE 58 31.151 15.612 -35.134 558 HG21 ILE 58 HG21 ILE 58 29.087 18.629 -36.409 559 HG22 ILE 58 HG22 ILE 58 30.057 19.733 -35.274 560 HG23 ILE 58 HG23 ILE 58 30.696 19.172 -36.775 561 HD11 ILE 58 HD11 ILE 58 28.970 16.247 -37.162 562 HD12 ILE 58 HD12 ILE 58 29.431 14.677 -36.534 563 HD13 ILE 58 HD13 ILE 58 28.640 15.893 -35.523 564 H ARG 59 H ARG 59 30.417 18.193 -32.468 565 HA ARG 59 HA ARG 59 31.420 15.977 -30.752 566 HB2 ARG 59 HB2 ARG 59 31.003 18.773 -29.693 567 HB3 ARG 59 HB3 ARG 59 31.427 17.314 -28.680 568 HG2 ARG 59 HG2 ARG 59 33.170 18.766 -30.517 569 HG3 ARG 59 HG3 ARG 59 33.234 18.667 -28.761 570 HD2 ARG 59 HD2 ARG 59 33.813 16.311 -28.821 571 HD3 ARG 59 HD3 ARG 59 33.723 16.284 -30.572 572 HE ARG 59 HE ARG 59 35.808 17.258 -28.827 573 HH11 ARG 59 HH11 ARG 59 34.880 17.221 -32.262 574 HH12 ARG 59 HH12 ARG 59 36.370 17.885 -32.684 575 HH21 ARG 59 HH21 ARG 59 37.726 18.236 -29.656 576 HH22 ARG 59 HH22 ARG 59 37.774 18.480 -31.376 577 H PHE 60 H PHE 60 29.960 15.319 -29.496 578 HA PHE 60 HA PHE 60 27.150 16.123 -30.154 579 HB2 PHE 60 HB2 PHE 60 28.368 13.395 -29.603 580 HB3 PHE 60 HB3 PHE 60 26.643 13.635 -29.838 581 HD1 PHE 60 HD1 PHE 60 29.843 13.754 -31.542 582 HD2 PHE 60 HD2 PHE 60 25.699 14.028 -31.834 583 HE1 PHE 60 HE1 PHE 60 30.059 13.354 -34.029 584 HE2 PHE 60 HE2 PHE 60 25.769 13.713 -34.383 585 HZ PHE 60 HZ PHE 60 28.005 13.241 -35.371 586 H ARG 61 H ARG 61 25.752 16.464 -28.389 587 HA ARG 61 HA ARG 61 26.757 15.825 -25.562 588 HB2 ARG 61 HB2 ARG 61 25.187 18.310 -26.202 589 HB3 ARG 61 HB3 ARG 61 25.910 17.843 -24.634 590 HG2 ARG 61 HG2 ARG 61 28.299 18.011 -25.809 591 HG3 ARG 61 HG3 ARG 61 27.432 18.885 -27.065 592 HD2 ARG 61 HD2 ARG 61 26.525 20.439 -25.367 593 HD3 ARG 61 HD3 ARG 61 27.629 19.627 -24.214 594 HE ARG 61 HE ARG 61 29.241 20.333 -26.237 595 HH11 ARG 61 HH11 ARG 61 26.631 22.249 -25.158 596 HH12 ARG 61 HH12 ARG 61 27.374 23.775 -25.700 597 HH21 ARG 61 HH21 ARG 61 30.290 22.216 -26.738 598 HH22 ARG 61 HH22 ARG 61 29.528 23.645 -26.433 599 H PHE 62 H PHE 62 25.413 15.229 -24.198 600 HA PHE 62 HA PHE 62 22.704 15.755 -24.640 601 HB2 PHE 62 HB2 PHE 62 22.698 13.504 -25.536 602 HB3 PHE 62 HB3 PHE 62 23.553 12.790 -24.168 603 HD1 PHE 62 HD2 PHE 62 20.469 14.211 -25.531 604 HD2 PHE 62 HD1 PHE 62 22.241 12.179 -22.110 605 HE1 PHE 62 HE2 PHE 62 18.247 13.924 -24.624 606 HE2 PHE 62 HE1 PHE 62 20.048 11.936 -21.123 607 HZ PHE 62 HZ PHE 62 18.014 12.942 -22.263 608 H ASP 63 H ASP 63 21.432 16.038 -22.490 609 HA ASP 63 HA ASP 63 21.236 16.884 -20.454 610 HB2 ASP 63 HB2 ASP 63 21.479 14.371 -20.031 611 HB3 ASP 63 HB3 ASP 63 23.134 14.756 -19.584 612 H GLY 64 H GLY 64 23.585 17.945 -22.093 613 HA2 GLY 64 HA2 GLY 64 24.951 19.775 -21.809 614 HA3 GLY 64 HA3 GLY 64 25.026 19.515 -20.059 615 H GLN 65 H GLN 65 25.514 16.422 -21.192 616 HA GLN 65 HA GLN 65 28.422 16.667 -20.850 617 HB2 GLN 65 HB2 GLN 65 26.505 14.364 -20.092 618 HB3 GLN 65 HB3 GLN 65 28.247 14.436 -19.823 619 HG2 GLN 65 HG2 GLN 65 26.227 16.355 -18.810 620 HG3 GLN 65 HG3 GLN 65 26.835 14.998 -17.844 621 HE21 GLN 65 HE22 GLN 65 27.201 18.317 -18.308 622 HE22 GLN 65 HE21 GLN 65 28.801 18.437 -17.692 623 HA PRO 66 HA PRO 66 29.313 14.875 -24.759 624 HB2 PRO 66 HB2 PRO 66 31.672 13.763 -24.559 625 HB3 PRO 66 HB3 PRO 66 31.400 15.491 -24.396 626 HG2 PRO 66 HG2 PRO 66 31.611 13.308 -22.207 627 HG3 PRO 66 HG3 PRO 66 32.467 14.901 -22.252 628 HD2 PRO 66 HD2 PRO 66 30.288 14.702 -20.787 629 HD3 PRO 66 HD3 PRO 66 30.622 16.150 -21.758 630 H ILE 67 H ILE 67 29.371 13.013 -26.091 631 HA ILE 67 HA ILE 67 28.283 10.476 -24.721 632 HB ILE 67 HB ILE 67 28.007 11.172 -27.644 633 HG12 ILE 67 HG12 ILE 67 26.032 11.564 -25.376 634 HG13 ILE 67 HG13 ILE 67 26.724 12.787 -26.413 635 HG21 ILE 67 HG21 ILE 67 28.077 8.854 -27.171 636 HG22 ILE 67 HG22 ILE 67 26.853 8.791 -25.980 637 HG23 ILE 67 HG23 ILE 67 26.417 9.198 -27.649 638 HD11 ILE 67 HD11 ILE 67 24.577 10.738 -27.377 639 HD12 ILE 67 HD12 ILE 67 24.589 12.498 -27.450 640 HD13 ILE 67 HD13 ILE 67 25.704 11.460 -28.421 641 H ASN 68 H ASN 68 29.227 8.630 -24.794 642 HA ASN 68 HA ASN 68 31.918 8.413 -25.878 643 HB2 ASN 68 HB2 ASN 68 30.475 6.346 -24.281 644 HB3 ASN 68 HB3 ASN 68 32.229 6.529 -24.710 645 HD21 ASN 68 HD22 ASN 68 30.096 6.675 -22.174 646 HD22 ASN 68 HD21 ASN 68 31.173 7.618 -21.132 647 H GLU 69 H GLU 69 32.576 6.618 -27.210 648 HA GLU 69 HA GLU 69 30.837 5.672 -29.340 649 HB2 GLU 69 HB2 GLU 69 33.698 4.737 -28.460 650 HB3 GLU 69 HB3 GLU 69 32.865 4.487 -29.981 651 HG2 GLU 69 HG2 GLU 69 33.057 7.176 -30.109 652 HG3 GLU 69 HG3 GLU 69 33.974 6.971 -28.674 653 H THR 70 H THR 70 30.887 4.749 -26.217 654 HA THR 70 HA THR 70 29.780 2.005 -26.990 655 HB THR 70 HB THR 70 30.219 1.328 -24.585 656 HG1 THR 70 HG1 THR 70 30.485 2.952 -23.386 657 HG21 THR 70 HG21 THR 70 32.571 1.033 -24.739 658 HG22 THR 70 HG22 THR 70 31.457 0.649 -26.207 659 HG23 THR 70 HG23 THR 70 32.669 2.087 -26.012 660 H ASP 71 H ASP 71 28.578 5.036 -25.996 661 HA ASP 71 HA ASP 71 26.913 4.152 -23.836 662 HB2 ASP 71 HB2 ASP 71 26.833 6.496 -25.579 663 HB3 ASP 71 HB3 ASP 71 25.798 6.351 -24.253 664 H THR 72 H THR 72 25.207 2.992 -23.768 665 HA THR 72 HA THR 72 23.421 2.717 -26.005 666 HB THR 72 HB THR 72 22.206 1.191 -25.048 667 HG1 THR 72 HG1 THR 72 23.023 0.114 -23.118 668 HG21 THR 72 HG21 THR 72 25.284 0.613 -25.132 669 HG22 THR 72 HG22 THR 72 24.089 -0.637 -25.217 670 HG23 THR 72 HG23 THR 72 24.060 0.569 -26.432 671 HA PRO 73 HA PRO 73 20.396 5.454 -24.101 672 HB2 PRO 73 HB2 PRO 73 18.258 3.526 -24.919 673 HB3 PRO 73 HB3 PRO 73 18.352 5.297 -25.267 674 HG2 PRO 73 HG2 PRO 73 18.831 3.242 -27.021 675 HG3 PRO 73 HG3 PRO 73 19.622 4.823 -27.176 676 HD2 PRO 73 HD2 PRO 73 20.686 2.308 -26.325 677 HD3 PRO 73 HD3 PRO 73 21.549 3.703 -26.939 678 H ALA 74 H ALA 74 20.126 1.944 -23.358 679 HA ALA 74 HA ALA 74 19.016 2.087 -20.706 680 HB1 ALA 74 HB1 ALA 74 21.297 0.235 -21.540 681 HB2 ALA 74 HB2 ALA 74 20.052 -0.056 -20.313 682 HB3 ALA 74 HB3 ALA 74 19.648 0.002 -22.027 683 H GLN 75 H GLN 75 22.446 2.364 -21.552 684 HA GLN 75 HA GLN 75 23.329 2.619 -18.933 685 HB2 GLN 75 HB2 GLN 75 24.464 1.887 -20.866 686 HB3 GLN 75 HB3 GLN 75 24.552 3.519 -21.536 687 HG2 GLN 75 HG2 GLN 75 26.855 2.640 -20.564 688 HG3 GLN 75 HG3 GLN 75 26.268 4.172 -19.906 689 HE21 GLN 75 HE22 GLN 75 26.838 4.006 -17.695 690 HE22 GLN 75 HE21 GLN 75 26.533 2.591 -16.681 691 H LEU 76 H LEU 76 22.554 5.267 -21.235 692 HA LEU 76 HA LEU 76 23.059 7.457 -19.378 693 HB2 LEU 76 HB2 LEU 76 22.064 7.262 -22.204 694 HB3 LEU 76 HB3 LEU 76 21.923 8.827 -21.282 695 HG LEU 76 HG LEU 76 24.455 7.210 -21.937 696 HD11 LEU 76 HD11 LEU 76 24.889 9.073 -23.465 697 HD12 LEU 76 HD12 LEU 76 23.348 8.370 -23.976 698 HD13 LEU 76 HD13 LEU 76 23.346 9.836 -23.133 699 HD21 LEU 76 HD21 LEU 76 24.518 8.567 -19.741 700 HD22 LEU 76 HD22 LEU 76 25.500 9.175 -21.028 701 HD23 LEU 76 HD23 LEU 76 23.952 9.958 -20.768 702 H GLU 77 H GLU 77 20.690 5.300 -19.500 703 HA GLU 77 HA GLU 77 18.440 4.987 -19.018 704 HB2 GLU 77 HB2 GLU 77 19.320 7.281 -17.065 705 HB3 GLU 77 HB3 GLU 77 17.820 6.407 -16.785 706 HG2 GLU 77 HG2 GLU 77 20.503 5.103 -16.798 707 HG3 GLU 77 HG3 GLU 77 19.796 5.945 -15.406 708 H MET 78 H MET 78 18.746 6.500 -21.216 709 HA MET 78 HA MET 78 17.120 8.865 -21.430 710 HB2 MET 78 HB2 MET 78 17.796 6.529 -23.388 711 HB3 MET 78 HB3 MET 78 17.256 8.131 -23.893 712 HG2 MET 78 HG2 MET 78 19.320 9.021 -22.623 713 HG3 MET 78 HG3 MET 78 19.867 7.329 -22.767 714 HE1 MET 78 HE1 MET 78 19.589 10.845 -24.604 715 HE2 MET 78 HE2 MET 78 19.308 10.312 -26.264 716 HE3 MET 78 HE3 MET 78 18.152 9.938 -24.950 717 H GLU 79 H GLU 79 15.031 9.162 -21.945 718 HA GLU 79 HA GLU 79 13.186 6.715 -22.006 719 HB2 GLU 79 HB2 GLU 79 12.400 9.607 -21.428 720 HB3 GLU 79 HB3 GLU 79 11.346 8.204 -21.472 721 HG2 GLU 79 HG2 GLU 79 13.684 8.426 -19.599 722 HG3 GLU 79 HG3 GLU 79 12.153 9.032 -19.175 723 H ASP 80 H ASP 80 11.342 7.002 -23.480 724 HA ASP 80 HA ASP 80 12.189 7.635 -26.136 725 HB2 ASP 80 HB2 ASP 80 10.362 5.965 -25.009 726 HB3 ASP 80 HB3 ASP 80 9.330 7.152 -25.020 727 H GLU 81 H GLU 81 11.453 9.085 -27.571 728 HA GLU 81 HA GLU 81 11.144 11.250 -28.284 729 HB2 GLU 81 HB2 GLU 81 9.489 12.177 -26.009 730 HB3 GLU 81 HB3 GLU 81 9.667 12.686 -27.721 731 HG2 GLU 81 HG2 GLU 81 8.833 10.104 -28.024 732 HG3 GLU 81 HG3 GLU 81 7.877 10.534 -26.552 733 H ASP 82 H ASP 82 13.160 10.784 -25.807 734 HA ASP 82 HA ASP 82 14.089 13.496 -24.945 735 HB2 ASP 82 HB2 ASP 82 15.291 10.852 -24.819 736 HB3 ASP 82 HB3 ASP 82 16.075 12.337 -24.249 737 H THR 83 H THR 83 15.936 14.464 -25.772 738 HA THR 83 HA THR 83 16.545 13.926 -28.673 739 HB THR 83 HB THR 83 16.005 16.657 -27.387 740 HG1 THR 83 HG1 THR 83 14.330 14.949 -27.416 741 HG21 THR 83 HG21 THR 83 15.381 16.993 -29.927 742 HG22 THR 83 HG22 THR 83 16.998 17.344 -29.289 743 HG23 THR 83 HG23 THR 83 16.663 15.739 -30.042 744 H ILE 84 H ILE 84 18.569 14.085 -29.369 745 HA ILE 84 HA ILE 84 20.861 14.778 -27.723 746 HB ILE 84 HB ILE 84 20.299 12.956 -30.151 747 HG12 ILE 84 HG12 ILE 84 21.434 12.130 -27.475 748 HG13 ILE 84 HG13 ILE 84 19.661 12.218 -27.858 749 HG21 ILE 84 HG21 ILE 84 22.974 13.691 -29.126 750 HG22 ILE 84 HG22 ILE 84 22.702 12.215 -30.054 751 HG23 ILE 84 HG23 ILE 84 22.444 13.808 -30.805 752 HD11 ILE 84 HD11 ILE 84 20.794 10.033 -27.909 753 HD12 ILE 84 HD12 ILE 84 19.813 10.399 -29.350 754 HD13 ILE 84 HD13 ILE 84 21.557 10.527 -29.469 755 H ASP 85 H ASP 85 22.513 16.057 -28.421 756 HA ASP 85 HA ASP 85 21.673 17.817 -30.779 757 HB2 ASP 85 HB2 ASP 85 23.104 18.533 -28.203 758 HB3 ASP 85 HB3 ASP 85 22.768 19.682 -29.526 759 H VAL 86 H VAL 86 23.281 19.017 -31.918 760 HA VAL 86 HA VAL 86 25.951 17.664 -31.953 761 HB VAL 86 HB VAL 86 24.575 18.410 -34.505 762 HG11 VAL 86 HG11 VAL 86 27.018 18.304 -34.714 763 HG12 VAL 86 HG12 VAL 86 27.181 16.909 -33.651 764 HG13 VAL 86 HG13 VAL 86 26.419 16.686 -35.197 765 HG21 VAL 86 HG21 VAL 86 23.327 16.531 -33.536 766 HG22 VAL 86 HG22 VAL 86 24.250 15.842 -34.770 767 HG23 VAL 86 HG23 VAL 86 24.845 15.646 -33.135 768 H PHE 87 H PHE 87 27.797 19.003 -32.255 769 HA PHE 87 HA PHE 87 27.381 21.910 -32.531 770 HB2 PHE 87 HB2 PHE 87 28.466 20.382 -30.060 771 HB3 PHE 87 HB3 PHE 87 28.991 21.999 -30.385 772 HD1 PHE 87 HD1 PHE 87 25.900 19.938 -29.634 773 HD2 PHE 87 HD2 PHE 87 27.762 23.827 -29.440 774 HE1 PHE 87 HE1 PHE 87 24.070 20.875 -28.162 775 HE2 PHE 87 HE2 PHE 87 25.908 24.701 -28.157 776 HZ PHE 87 HZ PHE 87 24.151 23.153 -27.352 777 H GLN 88 H GLN 88 28.718 22.872 -33.583 778 HA GLN 88 HA GLN 88 31.059 21.662 -34.707 779 HB2 GLN 88 HB2 GLN 88 29.817 24.459 -34.900 780 HB3 GLN 88 HB3 GLN 88 31.254 24.000 -35.816 781 HG2 GLN 88 HG2 GLN 88 28.591 22.707 -35.986 782 HG3 GLN 88 HG3 GLN 88 29.126 23.906 -37.124 783 HE21 GLN 88 HE22 GLN 88 28.742 22.298 -38.840 784 HE22 GLN 88 HE21 GLN 88 29.995 21.177 -39.274 785 H GLN 89 H GLN 89 33.161 22.752 -34.735 786 HA GLN 89 HA GLN 89 33.912 24.150 -32.113 787 HB2 GLN 89 HB2 GLN 89 35.165 21.707 -33.454 788 HB3 GLN 89 HB3 GLN 89 35.823 22.501 -32.015 789 HG2 GLN 89 HG2 GLN 89 32.994 21.214 -32.141 790 HG3 GLN 89 HG3 GLN 89 34.451 20.352 -31.791 791 HE21 GLN 89 HE22 GLN 89 31.821 22.304 -30.456 792 HE22 GLN 89 HE21 GLN 89 32.639 22.604 -28.955 793 H GLN 90 H GLN 90 34.878 25.758 -32.102 794 HA GLN 90 HA GLN 90 35.818 26.993 -34.646 795 HB2 GLN 90 HB2 GLN 90 35.218 28.107 -31.893 796 HB3 GLN 90 HB3 GLN 90 35.668 28.966 -33.328 797 HG2 GLN 90 HG2 GLN 90 33.414 29.090 -33.281 798 HG3 GLN 90 HG3 GLN 90 33.756 28.107 -34.575 799 HE21 GLN 90 HE22 GLN 90 31.628 27.007 -34.834 800 HE22 GLN 90 HE21 GLN 90 30.825 26.449 -33.444 801 H THR 91 H THR 91 37.662 25.115 -33.995 802 HA THR 91 HA THR 91 40.154 26.028 -32.813 803 HB THR 91 HB THR 91 41.007 24.031 -34.323 804 HG1 THR 91 HG1 THR 91 39.563 23.993 -35.965 805 HG21 THR 91 HG21 THR 91 40.058 22.468 -33.066 806 HG22 THR 91 HG22 THR 91 40.174 23.922 -31.958 807 HG23 THR 91 HG23 THR 91 38.594 23.479 -32.671 808 H GLY 92 H GLY 92 41.798 26.821 -33.913 809 HA2 GLY 92 HA2 GLY 92 42.947 28.252 -35.550 810 HA3 GLY 92 HA3 GLY 92 41.750 27.754 -36.690 811 H GLY 93 H GLY 93 42.689 29.814 -36.955 812 HA2 GLY 93 HA2 GLY 93 40.554 31.556 -37.478 813 HA3 GLY 93 HA3 GLY 93 41.158 32.070 -35.922 814 H VAL 94 H VAL 94 41.648 34.148 -37.112 815 HA VAL 94 HA VAL 94 44.216 34.133 -38.610 816 HB VAL 94 HB VAL 94 41.978 36.076 -38.421 817 HG11 VAL 94 HG11 VAL 94 44.941 36.449 -39.561 818 HG12 VAL 94 HG12 VAL 94 43.673 37.290 -40.243 819 HG13 VAL 94 HG13 VAL 94 44.074 37.554 -38.530 820 HG21 VAL 94 HG21 VAL 94 41.251 34.633 -40.040 821 HG22 VAL 94 HG22 VAL 94 41.866 35.972 -40.831 822 HG23 VAL 94 HG23 VAL 94 42.747 34.344 -40.610 823 H TYR 95 H TYR 95 45.669 33.684 -36.930 824 HA TYR 95 HA TYR 95 45.651 35.708 -34.755 825 HB2 TYR 95 HB2 TYR 95 46.261 32.709 -34.576 826 HB3 TYR 95 HB3 TYR 95 46.194 33.756 -33.181 827 HD1 TYR 95 HD1 TYR 95 43.820 35.508 -33.370 828 HD2 TYR 95 HD2 TYR 95 44.358 31.197 -33.982 829 HE1 TYR 95 HE1 TYR 95 41.712 35.066 -32.450 830 HE2 TYR 95 HE2 TYR 95 42.068 30.863 -33.193 831 HH TYR 95 HH TYR 95 40.124 33.378 -31.791 Start of MODEL 6 1 H1 ACE 36 HH32 ACE 36 14.834 16.963 -42.801 2 H2 ACE 36 HH33 ACE 36 14.239 18.372 -43.621 3 H3 ACE 36 HH31 ACE 36 13.953 18.279 -41.872 4 H GLU 37 H GLU 37 13.014 17.515 -44.988 5 HA GLU 37 HA GLU 37 10.422 16.206 -44.481 6 HB2 GLU 37 HB2 GLU 37 11.440 17.400 -46.661 7 HB3 GLU 37 HB3 GLU 37 12.060 15.837 -47.022 8 HG2 GLU 37 HG2 GLU 37 9.699 15.938 -48.028 9 HG3 GLU 37 HG3 GLU 37 9.493 14.986 -46.574 10 H ASP 38 H ASP 38 13.648 15.129 -44.755 11 HA ASP 38 HA ASP 38 12.790 12.336 -45.070 12 HB2 ASP 38 HB2 ASP 38 14.672 13.307 -46.430 13 HB3 ASP 38 HB3 ASP 38 15.642 13.361 -44.953 14 H ALA 39 H ALA 39 11.823 13.058 -42.750 15 HA ALA 39 HA ALA 39 13.673 12.977 -40.513 16 HB1 ALA 39 HB1 ALA 39 10.665 13.267 -41.085 17 HB2 ALA 39 HB2 ALA 39 11.122 13.038 -39.403 18 HB3 ALA 39 HB3 ALA 39 11.636 14.462 -40.281 19 H PHE 40 H PHE 40 14.249 10.717 -41.442 20 HA PHE 40 HA PHE 40 13.425 8.984 -39.260 21 HB2 PHE 40 HB2 PHE 40 11.496 8.700 -41.175 22 HB3 PHE 40 HB3 PHE 40 12.686 7.562 -41.796 23 HD1 PHE 40 HD1 PHE 40 10.550 8.666 -38.935 24 HD2 PHE 40 HD2 PHE 40 12.271 5.126 -40.838 25 HE1 PHE 40 HE1 PHE 40 9.485 7.169 -37.321 26 HE2 PHE 40 HE2 PHE 40 11.442 3.818 -39.190 27 HZ PHE 40 HZ PHE 40 9.957 4.754 -37.366 28 H ILE 41 H ILE 41 15.014 7.480 -38.734 29 HA ILE 41 HA ILE 41 16.657 6.035 -40.688 30 HB ILE 41 HB ILE 41 17.930 7.511 -38.266 31 HG12 ILE 41 HG12 ILE 41 19.415 8.393 -40.295 32 HG13 ILE 41 HG13 ILE 41 17.970 8.159 -41.207 33 HG21 ILE 41 HG21 ILE 41 18.997 5.561 -40.423 34 HG22 ILE 41 HG22 ILE 41 19.999 6.536 -39.296 35 HG23 ILE 41 HG23 ILE 41 18.831 5.300 -38.683 36 HD11 ILE 41 HD11 ILE 41 18.016 10.486 -40.385 37 HD12 ILE 41 HD12 ILE 41 16.738 9.827 -39.484 38 HD13 ILE 41 HD13 ILE 41 18.389 9.777 -38.712 39 H VAL 42 H VAL 42 17.248 3.939 -39.861 40 HA VAL 42 HA VAL 42 15.877 2.923 -37.363 41 HB VAL 42 HB VAL 42 15.317 1.817 -40.147 42 HG11 VAL 42 HG11 VAL 42 15.144 0.300 -38.099 43 HG12 VAL 42 HG12 VAL 42 14.249 1.524 -37.265 44 HG13 VAL 42 HG13 VAL 42 13.424 0.813 -38.621 45 HG21 VAL 42 HG21 VAL 42 13.697 3.867 -38.555 46 HG22 VAL 42 HG22 VAL 42 14.364 3.884 -40.258 47 HG23 VAL 42 HG23 VAL 42 13.115 2.736 -39.774 48 H ILE 43 H ILE 43 17.415 1.882 -36.337 49 HA ILE 43 HA ILE 43 19.519 0.222 -37.672 50 HB ILE 43 HB ILE 43 20.074 2.156 -35.387 51 HG12 ILE 43 HG12 ILE 43 21.517 2.564 -37.987 52 HG13 ILE 43 HG13 ILE 43 19.797 3.139 -37.767 53 HG21 ILE 43 HG21 ILE 43 21.736 0.221 -36.957 54 HG22 ILE 43 HG22 ILE 43 22.421 1.468 -35.856 55 HG23 ILE 43 HG23 ILE 43 21.380 0.193 -35.206 56 HD11 ILE 43 HD11 ILE 43 20.436 4.494 -36.002 57 HD12 ILE 43 HD12 ILE 43 22.090 3.726 -35.868 58 HD13 ILE 43 HD13 ILE 43 21.615 4.741 -37.282 59 H SEP 44 H SEP 44 19.989 -1.607 -36.681 60 HA SEP 44 HA SEP 44 19.631 -1.551 -33.875 61 HB2 SEP 44 HB2 SEP 44 18.525 -3.672 -33.548 62 HB3 SEP 44 HB3 SEP 44 17.690 -2.769 -34.737 63 H ASP 45 H ASP 45 21.055 -3.331 -32.751 64 HA ASP 45 HA ASP 45 23.671 -2.791 -34.055 65 HB2 ASP 45 HB2 ASP 45 23.089 -2.565 -31.668 66 HB3 ASP 45 HB3 ASP 45 22.912 -4.251 -31.591 67 H SEP 46 H SEP 46 21.981 -5.744 -33.171 68 HA SEP 46 HA SEP 46 24.296 -7.267 -34.131 69 HB2 SEP 46 HB2 SEP 46 23.293 -9.084 -32.743 70 HB3 SEP 46 HB3 SEP 46 23.151 -7.610 -31.865 71 H ASP 47 H ASP 47 24.449 -9.008 -35.346 72 HA ASP 47 HA ASP 47 22.557 -9.596 -37.473 73 HB2 ASP 47 HB2 ASP 47 23.430 -7.178 -37.941 74 HB3 ASP 47 HB3 ASP 47 24.992 -7.894 -38.310 75 H GLY 48 H GLY 48 23.553 -11.424 -38.838 76 HA2 GLY 48 HA2 GLY 48 25.959 -12.451 -39.123 77 HA3 GLY 48 HA3 GLY 48 25.615 -12.791 -37.413 78 H GLU 49 H GLU 49 25.949 -15.016 -38.247 79 HA GLU 49 HA GLU 49 24.869 -16.659 -40.102 80 HB2 GLU 49 HB2 GLU 49 26.605 -17.116 -38.926 81 HB3 GLU 49 HB3 GLU 49 25.870 -17.045 -37.471 82 HG2 GLU 49 HG2 GLU 49 26.324 -19.352 -38.187 83 HG3 GLU 49 HG3 GLU 49 24.575 -18.946 -37.731 84 HN1 NH2 50 HN1 NH2 50 22.711 -16.305 -40.811 85 HN2 NH2 50 HN2 NH2 50 21.413 -16.788 -39.752 86 H1 MET 1 H1 MET 1 -3.666 -37.603 -39.389 87 H2 MET 1 H2 MET 1 -2.301 -37.145 -40.170 88 H3 MET 1 H3 MET 1 -3.757 -36.575 -40.634 89 HA MET 1 HA MET 1 -4.043 -35.412 -38.498 90 HB2 MET 1 HB2 MET 1 -1.250 -36.435 -38.010 91 HB3 MET 1 HB3 MET 1 -1.842 -35.172 -37.031 92 HG2 MET 1 HG2 MET 1 -2.247 -37.146 -35.717 93 HG3 MET 1 HG3 MET 1 -3.708 -36.503 -36.318 94 HE1 MET 1 HE1 MET 1 -1.478 -40.458 -37.281 95 HE2 MET 1 HE2 MET 1 -0.910 -38.848 -37.712 96 HE3 MET 1 HE3 MET 1 -1.190 -39.380 -35.979 97 H ALA 2 H ALA 2 -4.151 -33.529 -39.304 98 HA ALA 2 HA ALA 2 -2.178 -31.986 -40.723 99 HB1 ALA 2 HB1 ALA 2 -3.694 -30.060 -39.702 100 HB2 ALA 2 HB2 ALA 2 -4.433 -31.171 -40.800 101 HB3 ALA 2 HB3 ALA 2 -4.704 -31.495 -39.102 102 H ASP 3 H ASP 3 -1.021 -30.398 -40.122 103 HA ASP 3 HA ASP 3 0.840 -30.699 -37.894 104 HB2 ASP 3 HB2 ASP 3 1.456 -29.749 -40.055 105 HB3 ASP 3 HB3 ASP 3 0.464 -28.351 -39.830 106 H GLU 4 H GLU 4 1.365 -29.421 -36.190 107 HA GLU 4 HA GLU 4 -0.539 -27.549 -35.078 108 HB2 GLU 4 HB2 GLU 4 -1.237 -29.972 -34.695 109 HB3 GLU 4 HB3 GLU 4 0.065 -30.049 -33.523 110 HG2 GLU 4 HG2 GLU 4 -1.798 -29.524 -32.327 111 HG3 GLU 4 HG3 GLU 4 -0.757 -28.038 -32.357 112 H LYS 5 H LYS 5 0.491 -26.034 -34.279 113 HA LYS 5 HA LYS 5 2.598 -26.419 -32.302 114 HB2 LYS 5 HB2 LYS 5 3.710 -26.090 -34.462 115 HB3 LYS 5 HB3 LYS 5 3.106 -24.510 -34.605 116 HG2 LYS 5 HG2 LYS 5 3.835 -23.886 -32.303 117 HG3 LYS 5 HG3 LYS 5 4.705 -25.398 -32.126 118 HD2 LYS 5 HD2 LYS 5 6.106 -24.983 -34.093 119 HD3 LYS 5 HD3 LYS 5 5.195 -23.463 -34.465 120 HE2 LYS 5 HE2 LYS 5 6.775 -24.082 -31.875 121 HE3 LYS 5 HE3 LYS 5 7.445 -23.353 -33.362 122 HZ1 LYS 5 HZ1 LYS 5 5.357 -22.090 -31.559 123 HZ2 LYS 5 HZ2 LYS 5 6.898 -21.701 -31.843 124 HZ3 LYS 5 HZ3 LYS 5 5.746 -21.484 -32.946 125 HA PRO 6 HA PRO 6 0.133 -23.063 -30.379 126 HB2 PRO 6 HB2 PRO 6 0.892 -23.420 -27.807 127 HB3 PRO 6 HB3 PRO 6 -0.202 -24.517 -28.547 128 HG2 PRO 6 HG2 PRO 6 2.864 -24.817 -28.220 129 HG3 PRO 6 HG3 PRO 6 1.540 -25.983 -27.901 130 HD2 PRO 6 HD2 PRO 6 3.015 -25.878 -30.306 131 HD3 PRO 6 HD3 PRO 6 1.318 -26.461 -30.137 132 H LYS 7 H LYS 7 0.591 -20.946 -29.228 133 HA LYS 7 HA LYS 7 3.036 -19.669 -30.323 134 HB2 LYS 7 HB2 LYS 7 0.906 -18.706 -30.592 135 HB3 LYS 7 HB3 LYS 7 0.745 -18.388 -28.867 136 HG2 LYS 7 HG2 LYS 7 2.910 -17.018 -29.170 137 HG3 LYS 7 HG3 LYS 7 2.839 -17.268 -30.914 138 HD2 LYS 7 HD2 LYS 7 0.688 -15.914 -31.134 139 HD3 LYS 7 HD3 LYS 7 0.705 -15.856 -29.327 140 HE2 LYS 7 HE2 LYS 7 2.803 -14.736 -29.483 141 HE3 LYS 7 HE3 LYS 7 2.879 -15.111 -31.249 142 HZ1 LYS 7 HZ1 LYS 7 1.100 -13.125 -29.922 143 HZ2 LYS 7 HZ2 LYS 7 1.979 -12.826 -31.152 144 HZ3 LYS 7 HZ3 LYS 7 0.609 -13.830 -31.331 145 H GLU 8 H GLU 8 4.578 -18.995 -29.533 146 HA GLU 8 HA GLU 8 5.721 -19.969 -27.065 147 HB2 GLU 8 HB2 GLU 8 6.992 -20.109 -29.092 148 HB3 GLU 8 HB3 GLU 8 6.927 -18.336 -29.403 149 HG2 GLU 8 HG2 GLU 8 8.234 -17.792 -27.743 150 HG3 GLU 8 HG3 GLU 8 8.174 -19.318 -26.830 151 H GLY 9 H GLY 9 7.074 -18.878 -25.505 152 HA2 GLY 9 HA2 GLY 9 5.141 -17.580 -23.909 153 HA3 GLY 9 HA3 GLY 9 6.929 -17.839 -23.512 154 H VAL 10 H VAL 10 8.387 -16.464 -24.991 155 HA VAL 10 HA VAL 10 7.627 -13.604 -25.240 156 HB VAL 10 HB VAL 10 10.127 -14.712 -23.956 157 HG11 VAL 10 HG11 VAL 10 10.755 -12.609 -25.033 158 HG12 VAL 10 HG12 VAL 10 9.087 -11.973 -24.762 159 HG13 VAL 10 HG13 VAL 10 10.213 -12.028 -23.452 160 HG21 VAL 10 HG21 VAL 10 9.284 -13.534 -21.996 161 HG22 VAL 10 HG22 VAL 10 7.737 -13.415 -22.691 162 HG23 VAL 10 HG23 VAL 10 8.455 -15.063 -22.457 163 H LYS 11 H LYS 11 7.928 -13.066 -27.138 164 HA LYS 11 HA LYS 11 9.807 -14.224 -28.952 165 HB2 LYS 11 HB2 LYS 11 7.543 -13.002 -29.458 166 HB3 LYS 11 HB3 LYS 11 8.398 -11.469 -29.337 167 HG2 LYS 11 HG2 LYS 11 10.001 -12.327 -31.029 168 HG3 LYS 11 HG3 LYS 11 9.095 -13.752 -31.324 169 HD2 LYS 11 HD2 LYS 11 7.027 -12.260 -31.799 170 HD3 LYS 11 HD3 LYS 11 8.138 -10.812 -31.847 171 HE2 LYS 11 HE2 LYS 11 9.589 -11.923 -33.386 172 HE3 LYS 11 HE3 LYS 11 8.745 -13.492 -33.207 173 HZ1 LYS 11 HZ1 LYS 11 6.769 -12.644 -34.305 174 HZ2 LYS 11 HZ2 LYS 11 7.503 -11.327 -34.522 175 HZ3 LYS 11 HZ3 LYS 11 8.042 -12.620 -35.333 176 H THR 12 H THR 12 11.818 -13.488 -29.812 177 HA THR 12 HA THR 12 13.743 -11.904 -28.292 178 HB THR 12 HB THR 12 15.007 -11.828 -30.328 179 HG1 THR 12 HG1 THR 12 13.620 -11.674 -31.892 180 HG21 THR 12 HG21 THR 12 15.754 -13.679 -29.492 181 HG22 THR 12 HG22 THR 12 14.263 -14.159 -28.774 182 HG23 THR 12 HG23 THR 12 14.701 -14.633 -30.434 183 H GLU 13 H GLU 13 11.156 -10.779 -30.367 184 HA GLU 13 HA GLU 13 12.242 -8.123 -30.314 185 HB2 GLU 13 HB2 GLU 13 9.419 -8.841 -31.259 186 HB3 GLU 13 HB3 GLU 13 10.563 -7.686 -31.919 187 HG2 GLU 13 HG2 GLU 13 10.833 -10.611 -32.202 188 HG3 GLU 13 HG3 GLU 13 10.214 -9.459 -33.406 189 H ASN 14 H ASN 14 10.552 -9.673 -27.961 190 HA ASN 14 HA ASN 14 8.435 -7.887 -27.330 191 HB2 ASN 14 HB2 ASN 14 9.642 -10.369 -25.999 192 HB3 ASN 14 HB3 ASN 14 8.649 -9.233 -25.061 193 HD21 ASN 14 HD22 ASN 14 7.282 -9.078 -28.215 194 HD22 ASN 14 HD21 ASN 14 6.144 -10.255 -27.876 195 H ASN 15 H ASN 15 11.659 -7.716 -26.355 196 HA ASN 15 HA ASN 15 11.770 -5.257 -24.736 197 HB2 ASN 15 HB2 ASN 15 13.286 -6.864 -24.497 198 HB3 ASN 15 HB3 ASN 15 13.691 -6.933 -26.237 199 HD21 ASN 15 HD22 ASN 15 15.969 -6.584 -25.169 200 HD22 ASN 15 HD21 ASN 15 16.448 -4.878 -25.102 201 H ASP 16 H ASP 16 10.316 -3.691 -25.778 202 HA ASP 16 HA ASP 16 10.438 -3.342 -28.611 203 HB2 ASP 16 HB2 ASP 16 9.049 -1.714 -26.411 204 HB3 ASP 16 HB3 ASP 16 8.720 -1.356 -28.095 205 H HIS 17 H HIS 17 10.537 -1.293 -29.871 206 HA HIS 17 HA HIS 17 13.054 -0.032 -29.574 207 HB2 HIS 17 HB2 HIS 17 10.788 0.929 -31.235 208 HB3 HIS 17 HB3 HIS 17 12.445 1.342 -31.450 209 HD2 HIS 17 HD2 HIS 17 14.201 -0.294 -32.581 210 HE1 HIS 17 HE1 HIS 17 11.643 -3.593 -33.218 211 HE2 HIS 17 HE2 HIS 17 13.762 -2.431 -33.974 212 H ILE 18 H ILE 18 13.646 2.086 -29.632 213 HA ILE 18 HA ILE 18 11.981 4.083 -28.253 214 HB ILE 18 HB ILE 18 13.562 3.180 -26.710 215 HG12 ILE 18 HG12 ILE 18 14.717 5.820 -27.546 216 HG13 ILE 18 HG13 ILE 18 13.065 5.603 -26.826 217 HG21 ILE 18 HG21 ILE 18 16.127 3.420 -27.266 218 HG22 ILE 18 HG22 ILE 18 15.292 2.491 -28.547 219 HG23 ILE 18 HG23 ILE 18 15.687 4.162 -28.823 220 HD11 ILE 18 HD11 ILE 18 14.202 4.599 -24.824 221 HD12 ILE 18 HD12 ILE 18 15.799 4.966 -25.468 222 HD13 ILE 18 HD13 ILE 18 14.660 6.283 -25.176 223 H ASN 19 H ASN 19 12.039 6.169 -28.795 224 HA ASN 19 HA ASN 19 12.709 6.411 -31.629 225 HB2 ASN 19 HB2 ASN 19 10.242 7.315 -30.211 226 HB3 ASN 19 HB3 ASN 19 10.537 7.584 -31.799 227 HD21 ASN 19 HD22 ASN 19 9.818 5.167 -29.303 228 HD22 ASN 19 HD21 ASN 19 9.427 3.812 -30.290 229 H LEU 20 H LEU 20 14.682 7.476 -31.252 230 HA LEU 20 HA LEU 20 14.864 9.979 -29.460 231 HB2 LEU 20 HB2 LEU 20 17.007 8.287 -30.642 232 HB3 LEU 20 HB3 LEU 20 17.163 9.780 -29.500 233 HG LEU 20 HG LEU 20 16.383 6.896 -28.953 234 HD11 LEU 20 HD11 LEU 20 18.496 8.922 -28.179 235 HD12 LEU 20 HD12 LEU 20 18.211 7.306 -27.296 236 HD13 LEU 20 HD13 LEU 20 18.643 7.390 -29.044 237 HD21 LEU 20 HD21 LEU 20 16.255 9.203 -26.990 238 HD22 LEU 20 HD22 LEU 20 14.794 8.339 -27.819 239 HD23 LEU 20 HD23 LEU 20 15.885 7.506 -26.774 240 H LYS 21 H LYS 21 16.390 11.715 -30.376 241 HA LYS 21 HA LYS 21 16.071 12.182 -33.306 242 HB2 LYS 21 HB2 LYS 21 15.093 13.915 -31.018 243 HB3 LYS 21 HB3 LYS 21 15.660 14.582 -32.410 244 HG2 LYS 21 HG2 LYS 21 14.046 13.228 -33.957 245 HG3 LYS 21 HG3 LYS 21 13.442 12.442 -32.496 246 HD2 LYS 21 HD2 LYS 21 12.995 15.029 -31.689 247 HD3 LYS 21 HD3 LYS 21 13.038 15.418 -33.301 248 HE2 LYS 21 HE2 LYS 21 11.353 14.060 -33.971 249 HE3 LYS 21 HE3 LYS 21 11.273 13.077 -32.460 250 HZ1 LYS 21 HZ1 LYS 21 10.466 15.847 -32.773 251 HZ2 LYS 21 HZ2 LYS 21 9.489 14.604 -32.456 252 HZ3 LYS 21 HZ3 LYS 21 10.608 14.963 -31.315 253 H VAL 22 H VAL 22 17.580 13.451 -34.060 254 HA VAL 22 HA VAL 22 19.889 14.149 -32.356 255 HB VAL 22 HB VAL 22 20.242 12.985 -35.081 256 HG11 VAL 22 HG11 VAL 22 22.250 13.833 -33.031 257 HG12 VAL 22 HG12 VAL 22 22.658 12.809 -34.367 258 HG13 VAL 22 HG13 VAL 22 22.076 14.422 -34.757 259 HG21 VAL 22 HG21 VAL 22 21.072 10.895 -33.957 260 HG22 VAL 22 HG22 VAL 22 20.665 11.876 -32.446 261 HG23 VAL 22 HG23 VAL 22 19.412 11.158 -33.502 262 H ALA 23 H ALA 23 20.257 16.201 -32.503 263 HA ALA 23 HA ALA 23 19.549 17.815 -34.912 264 HB1 ALA 23 HB1 ALA 23 18.524 19.431 -33.212 265 HB2 ALA 23 HB2 ALA 23 17.861 17.799 -33.233 266 HB3 ALA 23 HB3 ALA 23 18.959 18.308 -31.951 267 H GLY 24 H GLY 24 20.500 19.776 -35.388 268 HA2 GLY 24 HA2 GLY 24 22.765 20.935 -33.730 269 HA3 GLY 24 HA3 GLY 24 23.106 20.392 -35.217 270 H GLN 25 H GLN 25 24.061 22.645 -34.998 271 HA GLN 25 HA GLN 25 22.218 24.632 -34.443 272 HB2 GLN 25 HB2 GLN 25 25.188 24.998 -34.815 273 HB3 GLN 25 HB3 GLN 25 24.036 26.218 -34.284 274 HG2 GLN 25 HG2 GLN 25 24.968 23.395 -33.085 275 HG3 GLN 25 HG3 GLN 25 25.320 25.043 -32.402 276 HE21 GLN 25 HE22 GLN 25 24.046 22.502 -31.473 277 HE22 GLN 25 HE21 GLN 25 22.545 23.060 -30.732 278 H ASP 26 H ASP 26 23.149 23.519 -37.414 279 HA ASP 26 HA ASP 26 22.592 26.033 -38.956 280 HB2 ASP 26 HB2 ASP 26 22.857 24.390 -40.892 281 HB3 ASP 26 HB3 ASP 26 24.224 24.335 -39.740 282 H GLY 27 H GLY 27 20.704 23.643 -37.332 283 HA2 GLY 27 HA2 GLY 27 18.414 24.107 -37.053 284 HA3 GLY 27 HA3 GLY 27 18.340 24.800 -38.744 285 H SER 28 H SER 28 20.322 22.032 -38.821 286 HA SER 28 HA SER 28 18.288 20.444 -39.985 287 HB2 SER 28 HB2 SER 28 19.963 18.722 -39.994 288 HB3 SER 28 HB3 SER 28 20.810 20.328 -40.530 289 HG SER 28 HG SER 28 21.660 20.537 -38.618 290 H VAL 29 H VAL 29 17.523 18.252 -38.979 291 HA VAL 29 HA VAL 29 17.962 17.395 -36.383 292 HB VAL 29 HB VAL 29 15.150 18.167 -37.130 293 HG11 VAL 29 HG11 VAL 29 14.876 16.402 -35.407 294 HG12 VAL 29 HG12 VAL 29 16.424 16.787 -34.733 295 HG13 VAL 29 HG13 VAL 29 14.950 17.808 -34.435 296 HG21 VAL 29 HG21 VAL 29 15.207 19.968 -35.426 297 HG22 VAL 29 HG22 VAL 29 16.966 19.718 -35.202 298 HG23 VAL 29 HG23 VAL 29 16.357 20.299 -36.786 299 H VAL 30 H VAL 30 17.322 15.109 -36.295 300 HA VAL 30 HA VAL 30 15.407 13.933 -38.299 301 HB VAL 30 HB VAL 30 16.685 12.143 -38.936 302 HG11 VAL 30 HG11 VAL 30 16.517 14.169 -40.353 303 HG12 VAL 30 HG12 VAL 30 18.308 14.374 -40.005 304 HG13 VAL 30 HG13 VAL 30 17.728 13.017 -40.736 305 HG21 VAL 30 HG21 VAL 30 18.465 12.154 -37.041 306 HG22 VAL 30 HG22 VAL 30 19.306 12.342 -38.549 307 HG23 VAL 30 HG23 VAL 30 18.888 13.754 -37.467 308 H GLN 31 H GLN 31 14.356 12.132 -37.621 309 HA GLN 31 HA GLN 31 14.824 11.217 -34.896 310 HB2 GLN 31 HB2 GLN 31 12.707 11.877 -35.685 311 HB3 GLN 31 HB3 GLN 31 12.697 10.618 -36.957 312 HG2 GLN 31 HG2 GLN 31 12.455 8.989 -35.040 313 HG3 GLN 31 HG3 GLN 31 12.597 10.381 -33.909 314 HE21 GLN 31 HE22 GLN 31 10.259 8.447 -35.033 315 HE22 GLN 31 HE21 GLN 31 8.889 9.587 -35.122 316 H PHE 32 H PHE 32 15.535 9.236 -34.216 317 HA PHE 32 HA PHE 32 16.166 7.070 -36.150 318 HB2 PHE 32 HB2 PHE 32 17.794 7.583 -33.634 319 HB3 PHE 32 HB3 PHE 32 17.958 6.226 -34.771 320 HD1 PHE 32 HD1 PHE 32 18.149 9.873 -34.797 321 HD2 PHE 32 HD2 PHE 32 19.497 6.154 -36.397 322 HE1 PHE 32 HE1 PHE 32 19.945 11.059 -36.070 323 HE2 PHE 32 HE2 PHE 32 21.137 7.315 -37.822 324 HZ PHE 32 HZ PHE 32 21.553 9.750 -37.430 325 H LYS 33 H LYS 33 15.407 5.019 -35.761 326 HA LYS 33 HA LYS 33 13.924 4.305 -33.237 327 HB2 LYS 33 HB2 LYS 33 12.494 4.520 -35.192 328 HB3 LYS 33 HB3 LYS 33 13.429 3.309 -35.946 329 HG2 LYS 33 HG2 LYS 33 13.045 1.738 -33.905 330 HG3 LYS 33 HG3 LYS 33 11.819 2.899 -33.355 331 HD2 LYS 33 HD2 LYS 33 10.824 2.928 -35.465 332 HD3 LYS 33 HD3 LYS 33 11.817 1.581 -36.076 333 HE2 LYS 33 HE2 LYS 33 11.050 0.094 -34.425 334 HE3 LYS 33 HE3 LYS 33 10.070 1.383 -33.635 335 HZ1 LYS 33 HZ1 LYS 33 9.759 -0.207 -36.005 336 HZ2 LYS 33 HZ2 LYS 33 8.612 0.163 -34.880 337 HZ3 LYS 33 HZ3 LYS 33 8.869 1.214 -36.010 338 H ILE 34 H ILE 34 15.110 3.056 -31.924 339 HA ILE 34 HA ILE 34 16.929 0.998 -32.831 340 HB ILE 34 HB ILE 34 18.694 1.893 -31.394 341 HG12 ILE 34 HG12 ILE 34 17.004 4.463 -31.415 342 HG13 ILE 34 HG13 ILE 34 17.286 3.372 -30.004 343 HG21 ILE 34 HG21 ILE 34 18.389 2.286 -33.830 344 HG22 ILE 34 HG22 ILE 34 17.978 3.926 -33.542 345 HG23 ILE 34 HG23 ILE 34 19.636 3.432 -33.013 346 HD11 ILE 34 HD11 ILE 34 19.832 3.970 -30.502 347 HD12 ILE 34 HD12 ILE 34 19.069 5.363 -31.334 348 HD13 ILE 34 HD13 ILE 34 18.796 4.954 -29.563 349 H LYS 35 H LYS 35 17.848 -0.022 -30.654 350 HA LYS 35 HA LYS 35 15.563 -0.757 -28.968 351 HB2 LYS 35 HB2 LYS 35 17.935 -2.328 -29.874 352 HB3 LYS 35 HB3 LYS 35 16.864 -2.868 -28.590 353 HG2 LYS 35 HG2 LYS 35 15.055 -2.669 -30.368 354 HG3 LYS 35 HG3 LYS 35 16.116 -2.436 -31.656 355 HD2 LYS 35 HD2 LYS 35 17.441 -4.413 -31.012 356 HD3 LYS 35 HD3 LYS 35 16.115 -4.949 -29.986 357 HE2 LYS 35 HE2 LYS 35 14.600 -4.930 -31.977 358 HE3 LYS 35 HE3 LYS 35 16.016 -4.543 -32.918 359 HZ1 LYS 35 HZ1 LYS 35 15.413 -7.063 -32.666 360 HZ2 LYS 35 HZ2 LYS 35 16.967 -6.582 -32.667 361 HZ3 LYS 35 HZ3 LYS 35 16.305 -6.917 -31.254 362 H ARG 36 H ARG 36 16.188 -1.011 -26.657 363 HA ARG 36 HA ARG 36 17.537 1.158 -25.384 364 HB2 ARG 36 HB2 ARG 36 16.499 -1.489 -24.635 365 HB3 ARG 36 HB3 ARG 36 17.897 -1.006 -23.668 366 HG2 ARG 36 HG2 ARG 36 16.694 1.225 -23.188 367 HG3 ARG 36 HG3 ARG 36 15.333 0.653 -24.059 368 HD2 ARG 36 HD2 ARG 36 14.610 0.231 -21.964 369 HD3 ARG 36 HD3 ARG 36 15.026 -1.353 -22.607 370 HE ARG 36 HE ARG 36 16.506 -1.606 -20.879 371 HH11 ARG 36 HH11 ARG 36 15.844 1.975 -20.897 372 HH12 ARG 36 HH12 ARG 36 16.491 1.939 -19.274 373 HH21 ARG 36 HH21 ARG 36 17.169 -1.323 -19.017 374 HH22 ARG 36 HH22 ARG 36 17.287 0.370 -18.354 375 H HIS 37 H HIS 37 19.062 -1.855 -26.719 376 HA HIS 37 HA HIS 37 21.596 -1.119 -25.359 377 HB2 HIS 37 HB2 HIS 37 22.029 -3.419 -25.648 378 HB3 HIS 37 HB3 HIS 37 20.409 -3.312 -24.986 379 HD2 HIS 37 HD2 HIS 37 22.477 -4.837 -27.872 380 HE1 HIS 37 HE1 HIS 37 18.379 -5.352 -29.044 381 HE2 HIS 37 HE2 HIS 37 20.780 -6.203 -29.229 382 H THR 38 H THR 38 20.439 -0.188 -28.166 383 HA THR 38 HA THR 38 22.698 -0.842 -29.953 384 HB THR 38 HB THR 38 20.527 1.249 -30.136 385 HG1 THR 38 HG1 THR 38 20.449 -1.366 -30.628 386 HG21 THR 38 HG21 THR 38 22.228 1.612 -31.721 387 HG22 THR 38 HG22 THR 38 22.342 -0.095 -32.141 388 HG23 THR 38 HG23 THR 38 20.866 0.845 -32.526 389 HA PRO 39 HA PRO 39 24.906 2.653 -27.935 390 HB2 PRO 39 HB2 PRO 39 27.311 2.463 -28.926 391 HB3 PRO 39 HB3 PRO 39 26.583 1.158 -27.943 392 HG2 PRO 39 HG2 PRO 39 26.857 1.068 -30.981 393 HG3 PRO 39 HG3 PRO 39 27.210 -0.094 -29.805 394 HD2 PRO 39 HD2 PRO 39 24.835 0.040 -31.144 395 HD3 PRO 39 HD3 PRO 39 25.026 -0.699 -29.517 396 H LEU 40 H LEU 40 25.541 4.649 -28.252 397 HA LEU 40 HA LEU 40 23.882 5.868 -30.198 398 HB2 LEU 40 HB2 LEU 40 25.919 7.003 -28.237 399 HB3 LEU 40 HB3 LEU 40 24.702 7.914 -29.128 400 HG LEU 40 HG LEU 40 23.968 5.803 -27.139 401 HD11 LEU 40 HD11 LEU 40 24.215 8.783 -26.839 402 HD12 LEU 40 HD12 LEU 40 23.237 7.602 -25.797 403 HD13 LEU 40 HD13 LEU 40 25.019 7.607 -25.927 404 HD21 LEU 40 HD21 LEU 40 22.341 7.968 -28.328 405 HD22 LEU 40 HD22 LEU 40 22.312 6.222 -28.971 406 HD23 LEU 40 HD23 LEU 40 21.805 6.713 -27.353 407 H SER 41 H SER 41 27.366 5.200 -30.027 408 HA SER 41 HA SER 41 28.522 6.653 -31.996 409 HB2 SER 41 HB2 SER 41 29.952 4.657 -32.430 410 HB3 SER 41 HB3 SER 41 29.848 5.013 -30.841 411 HG SER 41 HG SER 41 29.367 2.598 -31.515 412 H LYS 42 H LYS 42 26.411 3.965 -32.677 413 HA LYS 42 HA LYS 42 26.562 4.150 -35.612 414 HB2 LYS 42 HB2 LYS 42 24.370 3.012 -33.760 415 HB3 LYS 42 HB3 LYS 42 24.134 2.972 -35.459 416 HG2 LYS 42 HG2 LYS 42 26.336 1.718 -35.691 417 HG3 LYS 42 HG3 LYS 42 26.586 1.760 -33.999 418 HD2 LYS 42 HD2 LYS 42 24.572 0.336 -33.582 419 HD3 LYS 42 HD3 LYS 42 24.127 0.441 -35.270 420 HE2 LYS 42 HE2 LYS 42 26.881 -0.603 -34.309 421 HE3 LYS 42 HE3 LYS 42 25.522 -1.673 -34.331 422 HZ1 LYS 42 HZ1 LYS 42 26.782 -0.358 -36.768 423 HZ2 LYS 42 HZ2 LYS 42 26.599 -1.823 -36.528 424 HZ3 LYS 42 HZ3 LYS 42 25.297 -1.018 -36.840 425 H LEU 43 H LEU 43 24.831 6.015 -33.244 426 HA LEU 43 HA LEU 43 23.069 7.209 -35.249 427 HB2 LEU 43 HB2 LEU 43 23.365 7.447 -32.246 428 HB3 LEU 43 HB3 LEU 43 22.867 8.881 -33.084 429 HG LEU 43 HG LEU 43 20.995 7.776 -33.991 430 HD11 LEU 43 HD11 LEU 43 21.685 5.545 -34.359 431 HD12 LEU 43 HD12 LEU 43 22.161 5.232 -32.743 432 HD13 LEU 43 HD13 LEU 43 20.446 5.536 -33.122 433 HD21 LEU 43 HD21 LEU 43 21.064 7.031 -31.019 434 HD22 LEU 43 HD22 LEU 43 20.790 8.630 -31.554 435 HD23 LEU 43 HD23 LEU 43 19.564 7.484 -31.882 436 H MET 44 H MET 44 25.918 8.108 -33.290 437 HA MET 44 HA MET 44 26.309 10.721 -34.277 438 HB2 MET 44 HB2 MET 44 28.521 8.820 -33.322 439 HB3 MET 44 HB3 MET 44 28.777 10.474 -33.602 440 HG2 MET 44 HG2 MET 44 27.082 10.904 -31.768 441 HG3 MET 44 HG3 MET 44 27.167 9.183 -31.460 442 HE1 MET 44 HE1 MET 44 30.425 8.947 -32.315 443 HE2 MET 44 HE2 MET 44 31.149 9.021 -30.659 444 HE3 MET 44 HE3 MET 44 29.810 8.004 -30.961 445 H LYS 45 H LYS 45 27.505 7.525 -35.518 446 HA LYS 45 HA LYS 45 29.078 8.548 -37.659 447 HB2 LYS 45 HB2 LYS 45 27.721 5.973 -37.145 448 HB3 LYS 45 HB3 LYS 45 28.611 6.176 -38.729 449 HG2 LYS 45 HG2 LYS 45 30.683 6.703 -37.406 450 HG3 LYS 45 HG3 LYS 45 29.868 6.670 -35.874 451 HD2 LYS 45 HD2 LYS 45 29.087 4.369 -36.237 452 HD3 LYS 45 HD3 LYS 45 30.382 4.322 -37.623 453 HE2 LYS 45 HE2 LYS 45 31.984 5.097 -36.213 454 HE3 LYS 45 HE3 LYS 45 30.861 4.993 -34.774 455 HZ1 LYS 45 HZ1 LYS 45 31.647 2.775 -36.512 456 HZ2 LYS 45 HZ2 LYS 45 32.261 3.000 -34.912 457 HZ3 LYS 45 HZ3 LYS 45 30.678 2.656 -35.293 458 H ALA 46 H ALA 46 25.943 7.162 -37.941 459 HA ALA 46 HA ALA 46 25.555 7.785 -40.460 460 HB1 ALA 46 HB1 ALA 46 23.313 7.656 -38.446 461 HB2 ALA 46 HB2 ALA 46 23.222 7.474 -40.191 462 HB3 ALA 46 HB3 ALA 46 24.081 6.249 -39.222 463 H TYR 47 H TYR 47 24.938 9.965 -37.915 464 HA TYR 47 HA TYR 47 23.447 12.104 -39.202 465 HB2 TYR 47 HB2 TYR 47 23.390 12.036 -36.827 466 HB3 TYR 47 HB3 TYR 47 25.130 12.147 -36.618 467 HD1 TYR 47 HD1 TYR 47 21.958 13.661 -37.361 468 HD2 TYR 47 HD2 TYR 47 26.093 14.497 -37.095 469 HE1 TYR 47 HE1 TYR 47 21.411 16.206 -37.160 470 HE2 TYR 47 HE2 TYR 47 25.683 16.922 -37.235 471 HH TYR 47 HH TYR 47 22.506 18.300 -37.774 472 H CYS 48 H CYS 48 27.079 11.289 -38.894 473 HA CYS 48 HA CYS 48 27.696 13.921 -39.849 474 HB2 CYS 48 HB2 CYS 48 28.926 12.397 -38.046 475 HB3 CYS 48 HB3 CYS 48 29.689 11.702 -39.414 476 HG CYS 48 HG CYS 48 30.663 13.627 -40.600 477 H GLU 49 H GLU 49 27.701 10.639 -41.233 478 HA GLU 49 HA GLU 49 28.326 11.319 -43.889 479 HB2 GLU 49 HB2 GLU 49 26.343 9.378 -42.678 480 HB3 GLU 49 HB3 GLU 49 26.793 9.358 -44.376 481 HG2 GLU 49 HG2 GLU 49 29.037 8.801 -43.970 482 HG3 GLU 49 HG3 GLU 49 28.652 8.910 -42.194 483 H ARG 50 H ARG 50 24.915 11.262 -42.380 484 HA ARG 50 HA ARG 50 23.561 12.163 -44.584 485 HB2 ARG 50 HB2 ARG 50 23.261 12.444 -41.642 486 HB3 ARG 50 HB3 ARG 50 22.245 13.481 -42.587 487 HG2 ARG 50 HG2 ARG 50 21.500 11.250 -43.821 488 HG3 ARG 50 HG3 ARG 50 22.261 10.339 -42.536 489 HD2 ARG 50 HD2 ARG 50 21.023 11.101 -40.851 490 HD3 ARG 50 HD3 ARG 50 20.188 12.323 -41.698 491 HE ARG 50 HE ARG 50 19.707 9.496 -42.291 492 HH11 ARG 50 HH11 ARG 50 19.013 12.813 -43.309 493 HH12 ARG 50 HH12 ARG 50 17.883 12.219 -44.529 494 HH21 ARG 50 HH21 ARG 50 18.237 8.876 -43.519 495 HH22 ARG 50 HH22 ARG 50 17.376 10.039 -44.527 496 H GLN 51 H GLN 51 25.301 14.248 -42.104 497 HA GLN 51 HA GLN 51 24.577 16.723 -43.479 498 HB2 GLN 51 HB2 GLN 51 26.423 16.018 -41.133 499 HB3 GLN 51 HB3 GLN 51 26.153 17.606 -41.800 500 HG2 GLN 51 HG2 GLN 51 23.512 16.627 -41.578 501 HG3 GLN 51 HG3 GLN 51 24.311 16.104 -40.027 502 HE21 GLN 51 HE22 GLN 51 22.463 18.341 -41.224 503 HE22 GLN 51 HE21 GLN 51 23.206 19.839 -40.554 504 H GLY 52 H GLY 52 27.108 14.403 -44.270 505 HA2 GLY 52 HA2 GLY 52 28.448 14.571 -46.167 506 HA3 GLY 52 HA3 GLY 52 28.127 16.301 -46.205 507 H LEU 53 H LEU 53 29.596 14.819 -43.277 508 HA LEU 53 HA LEU 53 31.706 16.871 -43.523 509 HB2 LEU 53 HB2 LEU 53 30.001 16.238 -41.097 510 HB3 LEU 53 HB3 LEU 53 31.272 17.519 -41.305 511 HG LEU 53 HG LEU 53 28.577 17.318 -42.740 512 HD11 LEU 53 HD11 LEU 53 28.717 17.870 -40.159 513 HD12 LEU 53 HD12 LEU 53 29.574 19.337 -40.627 514 HD13 LEU 53 HD13 LEU 53 27.953 19.081 -41.342 515 HD21 LEU 53 HD21 LEU 53 30.281 18.428 -44.108 516 HD22 LEU 53 HD22 LEU 53 29.100 19.621 -43.582 517 HD23 LEU 53 HD23 LEU 53 30.630 19.564 -42.782 518 H SER 54 H SER 54 33.633 16.460 -41.925 519 HA SER 54 HA SER 54 34.267 13.679 -41.416 520 HB2 SER 54 HB2 SER 54 35.979 15.594 -42.104 521 HB3 SER 54 HB3 SER 54 35.505 16.244 -40.522 522 HG SER 54 HG SER 54 37.315 14.365 -41.272 523 H MET 55 H MET 55 34.078 12.795 -39.432 524 HA MET 55 HA MET 55 32.311 13.586 -37.395 525 HB2 MET 55 HB2 MET 55 33.186 11.329 -37.866 526 HB3 MET 55 HB3 MET 55 34.645 11.723 -36.979 527 HG2 MET 55 HG2 MET 55 33.113 12.191 -35.059 528 HG3 MET 55 HG3 MET 55 31.756 11.653 -36.126 529 HE1 MET 55 HE1 MET 55 31.976 9.265 -37.152 530 HE2 MET 55 HE2 MET 55 31.784 8.002 -35.853 531 HE3 MET 55 HE3 MET 55 30.793 9.517 -35.970 532 H ARG 56 H ARG 56 35.789 14.077 -37.669 533 HA ARG 56 HA ARG 56 36.732 14.667 -35.056 534 HB2 ARG 56 HB2 ARG 56 38.038 13.934 -36.959 535 HB3 ARG 56 HB3 ARG 56 37.635 15.459 -37.819 536 HG2 ARG 56 HG2 ARG 56 38.838 16.496 -35.670 537 HG3 ARG 56 HG3 ARG 56 39.420 14.795 -35.427 538 HD2 ARG 56 HD2 ARG 56 39.779 16.391 -37.964 539 HD3 ARG 56 HD3 ARG 56 41.046 16.298 -36.698 540 HE ARG 56 HE ARG 56 40.586 13.749 -36.814 541 HH11 ARG 56 HH11 ARG 56 40.868 15.531 -39.785 542 HH12 ARG 56 HH12 ARG 56 40.504 13.989 -40.685 543 HH21 ARG 56 HH21 ARG 56 40.642 11.914 -38.226 544 HH22 ARG 56 HH22 ARG 56 40.628 12.303 -39.940 545 H GLN 57 H GLN 57 35.083 16.776 -37.530 546 HA GLN 57 HA GLN 57 35.908 19.170 -36.054 547 HB2 GLN 57 HB2 GLN 57 35.196 20.291 -38.084 548 HB3 GLN 57 HB3 GLN 57 35.571 18.674 -38.699 549 HG2 GLN 57 HG2 GLN 57 33.036 18.066 -38.449 550 HG3 GLN 57 HG3 GLN 57 32.794 19.716 -38.202 551 HE21 GLN 57 HE22 GLN 57 31.823 20.459 -40.130 552 HE22 GLN 57 HE21 GLN 57 32.692 20.217 -41.652 553 H ILE 58 H ILE 58 33.327 17.185 -35.511 554 HA ILE 58 HA ILE 58 31.928 19.296 -34.092 555 HB ILE 58 HB ILE 58 29.793 18.065 -34.233 556 HG12 ILE 58 HG12 ILE 58 31.209 16.405 -36.204 557 HG13 ILE 58 HG13 ILE 58 30.369 16.023 -34.834 558 HG21 ILE 58 HG21 ILE 58 30.492 20.203 -35.386 559 HG22 ILE 58 HG22 ILE 58 30.653 19.154 -36.816 560 HG23 ILE 58 HG23 ILE 58 29.033 19.463 -35.966 561 HD11 ILE 58 HD11 ILE 58 28.184 16.952 -36.272 562 HD12 ILE 58 HD12 ILE 58 29.370 16.704 -37.586 563 HD13 ILE 58 HD13 ILE 58 28.966 15.376 -36.391 564 H ARG 59 H ARG 59 30.448 18.506 -32.305 565 HA ARG 59 HA ARG 59 31.414 16.108 -30.851 566 HB2 ARG 59 HB2 ARG 59 31.136 18.882 -29.834 567 HB3 ARG 59 HB3 ARG 59 31.468 17.635 -28.729 568 HG2 ARG 59 HG2 ARG 59 33.335 18.681 -30.875 569 HG3 ARG 59 HG3 ARG 59 33.591 18.884 -29.218 570 HD2 ARG 59 HD2 ARG 59 33.754 16.363 -28.846 571 HD3 ARG 59 HD3 ARG 59 33.519 16.080 -30.516 572 HE ARG 59 HE ARG 59 35.920 17.127 -29.164 573 HH11 ARG 59 HH11 ARG 59 34.695 16.234 -32.290 574 HH12 ARG 59 HH12 ARG 59 36.144 16.764 -33.133 575 HH21 ARG 59 HH21 ARG 59 37.471 18.265 -30.457 576 HH22 ARG 59 HH22 ARG 59 37.718 17.396 -31.992 577 H PHE 60 H PHE 60 29.783 14.895 -30.396 578 HA PHE 60 HA PHE 60 26.956 15.784 -30.313 579 HB2 PHE 60 HB2 PHE 60 28.305 13.079 -30.119 580 HB3 PHE 60 HB3 PHE 60 26.570 13.315 -30.195 581 HD1 PHE 60 HD2 PHE 60 25.406 13.776 -32.227 582 HD2 PHE 60 HD1 PHE 60 29.638 13.280 -32.088 583 HE1 PHE 60 HE2 PHE 60 25.508 13.505 -34.768 584 HE2 PHE 60 HE1 PHE 60 29.746 12.813 -34.554 585 HZ PHE 60 HZ PHE 60 27.664 13.156 -35.886 586 H ARG 61 H ARG 61 25.820 16.032 -28.526 587 HA ARG 61 HA ARG 61 26.901 15.114 -26.037 588 HB2 ARG 61 HB2 ARG 61 25.793 17.943 -26.500 589 HB3 ARG 61 HB3 ARG 61 26.072 17.100 -24.979 590 HG2 ARG 61 HG2 ARG 61 28.364 16.898 -25.285 591 HG3 ARG 61 HG3 ARG 61 28.332 17.347 -26.902 592 HD2 ARG 61 HD2 ARG 61 27.374 19.753 -26.039 593 HD3 ARG 61 HD3 ARG 61 27.859 19.332 -24.501 594 HE ARG 61 HE ARG 61 30.113 18.767 -25.972 595 HH11 ARG 61 HH11 ARG 61 28.183 21.648 -25.320 596 HH12 ARG 61 HH12 ARG 61 29.252 22.675 -26.203 597 HH21 ARG 61 HH21 ARG 61 31.695 20.164 -26.782 598 HH22 ARG 61 HH22 ARG 61 31.257 21.815 -27.030 599 H PHE 62 H PHE 62 25.615 14.555 -24.474 600 HA PHE 62 HA PHE 62 22.707 15.223 -24.402 601 HB2 PHE 62 HB2 PHE 62 22.755 13.048 -25.435 602 HB3 PHE 62 HB3 PHE 62 23.743 12.475 -24.033 603 HD1 PHE 62 HD2 PHE 62 20.531 14.418 -24.512 604 HD2 PHE 62 HD1 PHE 62 22.410 10.937 -22.776 605 HE1 PHE 62 HE2 PHE 62 18.440 13.851 -23.641 606 HE2 PHE 62 HE1 PHE 62 20.259 10.367 -21.634 607 HZ PHE 62 HZ PHE 62 18.304 11.991 -21.864 608 H ASP 63 H ASP 63 21.746 15.140 -22.364 609 HA ASP 63 HA ASP 63 21.738 15.819 -20.176 610 HB2 ASP 63 HB2 ASP 63 22.052 13.296 -20.198 611 HB3 ASP 63 HB3 ASP 63 23.662 13.611 -19.614 612 H GLY 64 H GLY 64 23.956 17.080 -21.768 613 HA2 GLY 64 HA2 GLY 64 25.321 18.991 -21.283 614 HA3 GLY 64 HA3 GLY 64 25.385 18.528 -19.561 615 H GLN 65 H GLN 65 25.938 15.901 -21.551 616 HA GLN 65 HA GLN 65 28.792 16.195 -20.967 617 HB2 GLN 65 HB2 GLN 65 26.602 14.283 -20.383 618 HB3 GLN 65 HB3 GLN 65 28.293 13.699 -20.387 619 HG2 GLN 65 HG2 GLN 65 26.885 15.898 -18.907 620 HG3 GLN 65 HG3 GLN 65 27.263 14.279 -18.235 621 HE21 GLN 65 HE22 GLN 65 28.203 15.531 -16.170 622 HE22 GLN 65 HE21 GLN 65 29.876 15.909 -16.414 623 HA PRO 66 HA PRO 66 29.492 14.374 -25.088 624 HB2 PRO 66 HB2 PRO 66 31.863 12.986 -24.392 625 HB3 PRO 66 HB3 PRO 66 31.845 14.687 -24.987 626 HG2 PRO 66 HG2 PRO 66 31.891 13.469 -22.167 627 HG3 PRO 66 HG3 PRO 66 32.821 14.824 -22.686 628 HD2 PRO 66 HD2 PRO 66 30.583 15.095 -21.288 629 HD3 PRO 66 HD3 PRO 66 31.101 16.231 -22.639 630 H ILE 67 H ILE 67 29.187 12.508 -26.192 631 HA ILE 67 HA ILE 67 27.993 10.220 -24.829 632 HB ILE 67 HB ILE 67 28.471 10.931 -27.736 633 HG12 ILE 67 HG12 ILE 67 25.990 10.746 -26.006 634 HG13 ILE 67 HG13 ILE 67 26.774 12.133 -26.417 635 HG21 ILE 67 HG21 ILE 67 28.675 8.342 -27.501 636 HG22 ILE 67 HG22 ILE 67 27.389 8.333 -26.394 637 HG23 ILE 67 HG23 ILE 67 27.033 8.845 -28.131 638 HD11 ILE 67 HD11 ILE 67 25.260 10.340 -28.264 639 HD12 ILE 67 HD12 ILE 67 25.232 12.136 -28.222 640 HD13 ILE 67 HD13 ILE 67 26.484 11.310 -29.010 641 H ASN 68 H ASN 68 29.382 8.217 -24.480 642 HA ASN 68 HA ASN 68 32.076 8.103 -25.763 643 HB2 ASN 68 HB2 ASN 68 31.131 6.214 -23.479 644 HB3 ASN 68 HB3 ASN 68 32.770 6.680 -23.930 645 HD21 ASN 68 HD22 ASN 68 30.030 7.691 -22.070 646 HD22 ASN 68 HD21 ASN 68 31.162 8.584 -21.110 647 H GLU 69 H GLU 69 32.637 6.326 -27.194 648 HA GLU 69 HA GLU 69 30.435 5.281 -28.579 649 HB2 GLU 69 HB2 GLU 69 33.309 4.314 -28.406 650 HB3 GLU 69 HB3 GLU 69 32.202 3.434 -29.441 651 HG2 GLU 69 HG2 GLU 69 31.858 5.820 -30.587 652 HG3 GLU 69 HG3 GLU 69 33.007 6.439 -29.549 653 H THR 70 H THR 70 31.416 3.905 -25.624 654 HA THR 70 HA THR 70 29.728 1.487 -26.076 655 HB THR 70 HB THR 70 30.210 0.941 -23.728 656 HG1 THR 70 HG1 THR 70 30.446 2.709 -22.777 657 HG21 THR 70 HG21 THR 70 32.592 0.462 -24.001 658 HG22 THR 70 HG22 THR 70 31.741 0.131 -25.545 659 HG23 THR 70 HG23 THR 70 32.663 1.636 -25.361 660 H ASP 71 H ASP 71 28.850 4.676 -25.218 661 HA ASP 71 HA ASP 71 26.870 4.092 -23.210 662 HB2 ASP 71 HB2 ASP 71 27.343 6.496 -24.930 663 HB3 ASP 71 HB3 ASP 71 25.946 6.332 -24.002 664 H THR 72 H THR 72 24.671 3.604 -23.566 665 HA THR 72 HA THR 72 23.157 3.426 -26.249 666 HB THR 72 HB THR 72 22.292 1.286 -25.681 667 HG1 THR 72 HG1 THR 72 22.447 0.514 -23.657 668 HG21 THR 72 HG21 THR 72 24.729 1.235 -26.201 669 HG22 THR 72 HG22 THR 72 25.023 1.096 -24.472 670 HG23 THR 72 HG23 THR 72 24.151 -0.182 -25.234 671 HA PRO 73 HA PRO 73 19.872 5.776 -24.715 672 HB2 PRO 73 HB2 PRO 73 18.037 3.385 -25.387 673 HB3 PRO 73 HB3 PRO 73 17.973 5.043 -25.990 674 HG2 PRO 73 HG2 PRO 73 18.821 3.091 -27.496 675 HG3 PRO 73 HG3 PRO 73 19.366 4.843 -27.484 676 HD2 PRO 73 HD2 PRO 73 20.905 2.390 -26.386 677 HD3 PRO 73 HD3 PRO 73 21.472 3.959 -27.132 678 H ALA 74 H ALA 74 20.006 2.326 -23.690 679 HA ALA 74 HA ALA 74 18.493 2.580 -21.223 680 HB1 ALA 74 HB1 ALA 74 19.187 0.386 -20.830 681 HB2 ALA 74 HB2 ALA 74 19.160 0.352 -22.676 682 HB3 ALA 74 HB3 ALA 74 20.630 0.510 -21.943 683 H GLN 75 H GLN 75 22.063 2.974 -22.028 684 HA GLN 75 HA GLN 75 22.622 2.855 -19.362 685 HB2 GLN 75 HB2 GLN 75 24.544 2.117 -20.516 686 HB3 GLN 75 HB3 GLN 75 24.347 3.417 -21.779 687 HG2 GLN 75 HG2 GLN 75 26.471 3.753 -20.620 688 HG3 GLN 75 HG3 GLN 75 25.287 5.038 -20.423 689 HE21 GLN 75 HE22 GLN 75 26.433 5.740 -18.458 690 HE22 GLN 75 HE21 GLN 75 26.308 4.754 -16.972 691 H LEU 76 H LEU 76 21.448 5.445 -21.437 692 HA LEU 76 HA LEU 76 22.002 7.509 -19.194 693 HB2 LEU 76 HB2 LEU 76 21.637 7.975 -22.094 694 HB3 LEU 76 HB3 LEU 76 22.243 9.105 -20.954 695 HG LEU 76 HG LEU 76 23.857 6.906 -22.090 696 HD11 LEU 76 HD11 LEU 76 25.119 8.533 -23.204 697 HD12 LEU 76 HD12 LEU 76 23.468 8.934 -23.580 698 HD13 LEU 76 HD13 LEU 76 24.420 9.851 -22.338 699 HD21 LEU 76 HD21 LEU 76 24.505 9.164 -20.009 700 HD22 LEU 76 HD22 LEU 76 24.437 7.415 -19.676 701 HD23 LEU 76 HD23 LEU 76 25.714 7.920 -20.692 702 H GLU 77 H GLU 77 19.599 5.610 -19.693 703 HA GLU 77 HA GLU 77 17.447 5.680 -19.095 704 HB2 GLU 77 HB2 GLU 77 17.869 8.303 -17.924 705 HB3 GLU 77 HB3 GLU 77 16.806 7.058 -17.367 706 HG2 GLU 77 HG2 GLU 77 19.816 6.970 -17.188 707 HG3 GLU 77 HG3 GLU 77 18.547 7.151 -15.988 708 H MET 78 H MET 78 17.563 6.376 -21.791 709 HA MET 78 HA MET 78 16.261 8.880 -22.120 710 HB2 MET 78 HB2 MET 78 17.359 6.805 -24.093 711 HB3 MET 78 HB3 MET 78 16.700 8.458 -24.415 712 HG2 MET 78 HG2 MET 78 18.651 9.389 -23.123 713 HG3 MET 78 HG3 MET 78 19.195 7.791 -22.673 714 HE1 MET 78 HE1 MET 78 20.182 10.212 -26.538 715 HE2 MET 78 HE2 MET 78 18.589 10.353 -25.822 716 HE3 MET 78 HE3 MET 78 19.934 10.802 -24.843 717 H GLU 79 H GLU 79 14.388 9.221 -23.419 718 HA GLU 79 HA GLU 79 12.345 6.991 -23.670 719 HB2 GLU 79 HB2 GLU 79 12.131 9.956 -23.086 720 HB3 GLU 79 HB3 GLU 79 10.777 8.813 -23.378 721 HG2 GLU 79 HG2 GLU 79 12.623 8.797 -21.031 722 HG3 GLU 79 HG3 GLU 79 10.836 9.014 -21.005 723 H ASP 80 H ASP 80 10.607 7.963 -25.101 724 HA ASP 80 HA ASP 80 11.573 8.513 -27.790 725 HB2 ASP 80 HB2 ASP 80 8.815 8.443 -26.629 726 HB3 ASP 80 HB3 ASP 80 9.089 8.769 -28.341 727 H GLU 81 H GLU 81 11.413 10.300 -28.913 728 HA GLU 81 HA GLU 81 11.540 12.377 -29.380 729 HB2 GLU 81 HB2 GLU 81 9.333 12.720 -27.351 730 HB3 GLU 81 HB3 GLU 81 9.871 14.105 -27.862 731 HG2 GLU 81 HG2 GLU 81 9.628 13.265 -30.337 732 HG3 GLU 81 HG3 GLU 81 8.829 11.953 -29.647 733 H ASP 82 H ASP 82 13.203 11.207 -26.932 734 HA ASP 82 HA ASP 82 14.221 13.718 -25.835 735 HB2 ASP 82 HB2 ASP 82 15.337 10.917 -25.439 736 HB3 ASP 82 HB3 ASP 82 16.167 12.335 -25.040 737 H THR 83 H THR 83 16.317 14.710 -26.374 738 HA THR 83 HA THR 83 17.005 14.327 -29.347 739 HB THR 83 HB THR 83 16.218 16.757 -27.670 740 HG1 THR 83 HG1 THR 83 14.528 15.270 -28.410 741 HG21 THR 83 HG21 THR 83 16.530 18.106 -29.554 742 HG22 THR 83 HG22 THR 83 17.988 17.176 -29.594 743 HG23 THR 83 HG23 THR 83 16.734 16.652 -30.636 744 H ILE 84 H ILE 84 19.016 13.838 -29.369 745 HA ILE 84 HA ILE 84 21.080 14.716 -27.560 746 HB ILE 84 HB ILE 84 20.957 13.501 -30.426 747 HG12 ILE 84 HG12 ILE 84 22.011 11.956 -27.887 748 HG13 ILE 84 HG13 ILE 84 20.272 12.213 -28.095 749 HG21 ILE 84 HG21 ILE 84 23.408 13.607 -28.758 750 HG22 ILE 84 HG22 ILE 84 23.375 12.724 -30.294 751 HG23 ILE 84 HG23 ILE 84 23.173 14.518 -30.259 752 HD11 ILE 84 HD11 ILE 84 21.358 10.055 -28.991 753 HD12 ILE 84 HD12 ILE 84 20.039 10.937 -29.784 754 HD13 ILE 84 HD13 ILE 84 21.673 11.169 -30.451 755 H ASP 85 H ASP 85 22.521 16.405 -27.963 756 HA ASP 85 HA ASP 85 21.825 18.258 -30.156 757 HB2 ASP 85 HB2 ASP 85 23.026 19.012 -27.538 758 HB3 ASP 85 HB3 ASP 85 22.892 20.074 -28.938 759 H VAL 86 H VAL 86 23.242 18.306 -31.767 760 HA VAL 86 HA VAL 86 26.090 17.872 -31.428 761 HB VAL 86 HB VAL 86 24.565 18.843 -33.852 762 HG11 VAL 86 HG11 VAL 86 26.829 19.515 -34.359 763 HG12 VAL 86 HG12 VAL 86 27.472 18.058 -33.598 764 HG13 VAL 86 HG13 VAL 86 26.659 17.930 -35.075 765 HG21 VAL 86 HG21 VAL 86 23.840 16.656 -33.429 766 HG22 VAL 86 HG22 VAL 86 25.264 16.389 -34.510 767 HG23 VAL 86 HG23 VAL 86 25.335 16.140 -32.727 768 H PHE 87 H PHE 87 27.392 19.281 -30.836 769 HA PHE 87 HA PHE 87 27.210 22.260 -31.430 770 HB2 PHE 87 HB2 PHE 87 28.787 20.695 -29.333 771 HB3 PHE 87 HB3 PHE 87 28.927 22.365 -29.584 772 HD1 PHE 87 HD1 PHE 87 26.578 19.716 -28.400 773 HD2 PHE 87 HD2 PHE 87 27.189 23.977 -28.995 774 HE1 PHE 87 HE1 PHE 87 24.597 20.366 -26.855 775 HE2 PHE 87 HE2 PHE 87 25.342 24.515 -27.472 776 HZ PHE 87 HZ PHE 87 24.044 22.616 -26.468 777 H GLN 88 H GLN 88 28.809 23.451 -32.146 778 HA GLN 88 HA GLN 88 30.683 22.183 -34.005 779 HB2 GLN 88 HB2 GLN 88 30.209 25.102 -33.662 780 HB3 GLN 88 HB3 GLN 88 31.206 24.285 -34.762 781 HG2 GLN 88 HG2 GLN 88 29.102 22.870 -35.470 782 HG3 GLN 88 HG3 GLN 88 28.146 24.194 -34.769 783 HE21 GLN 88 HE22 GLN 88 29.689 22.958 -37.353 784 HE22 GLN 88 HE21 GLN 88 29.421 24.225 -38.519 785 H GLN 89 H GLN 89 32.867 23.032 -34.132 786 HA GLN 89 HA GLN 89 34.152 23.756 -31.570 787 HB2 GLN 89 HB2 GLN 89 35.302 21.551 -33.279 788 HB3 GLN 89 HB3 GLN 89 36.201 22.384 -32.093 789 HG2 GLN 89 HG2 GLN 89 33.560 20.879 -31.482 790 HG3 GLN 89 HG3 GLN 89 35.125 20.129 -31.402 791 HE21 GLN 89 HE22 GLN 89 33.325 22.852 -29.798 792 HE22 GLN 89 HE21 GLN 89 34.294 22.687 -28.375 793 H GLN 90 H GLN 90 35.724 25.038 -31.769 794 HA GLN 90 HA GLN 90 35.535 26.671 -34.258 795 HB2 GLN 90 HB2 GLN 90 36.118 27.379 -31.240 796 HB3 GLN 90 HB3 GLN 90 35.960 28.521 -32.549 797 HG2 GLN 90 HG2 GLN 90 33.885 28.661 -31.443 798 HG3 GLN 90 HG3 GLN 90 33.606 27.677 -32.857 799 HE21 GLN 90 HE22 GLN 90 31.646 26.973 -31.309 800 HE22 GLN 90 HE21 GLN 90 32.071 25.704 -30.104 801 H THR 91 H THR 91 37.719 24.755 -34.033 802 HA THR 91 HA THR 91 40.103 25.958 -33.306 803 HB THR 91 HB THR 91 41.212 24.456 -35.139 804 HG1 THR 91 HG1 THR 91 39.622 24.136 -36.592 805 HG21 THR 91 HG21 THR 91 39.337 23.352 -33.076 806 HG22 THR 91 HG22 THR 91 40.487 22.291 -33.911 807 HG23 THR 91 HG23 THR 91 41.036 23.682 -32.814 808 H GLY 92 H GLY 92 41.682 27.019 -34.347 809 HA2 GLY 92 HA2 GLY 92 42.763 28.063 -36.143 810 HA3 GLY 92 HA3 GLY 92 41.250 28.420 -36.990 811 H GLY 93 H GLY 93 41.884 30.492 -37.026 812 HA2 GLY 93 HA2 GLY 93 40.505 32.561 -35.762 813 HA3 GLY 93 HA3 GLY 93 41.887 32.241 -34.658 814 H VAL 94 H VAL 94 41.108 34.664 -36.026 815 HA VAL 94 HA VAL 94 42.986 35.140 -38.166 816 HB VAL 94 HB VAL 94 41.211 36.915 -36.570 817 HG11 VAL 94 HG11 VAL 94 42.390 37.444 -39.206 818 HG12 VAL 94 HG12 VAL 94 41.190 38.550 -38.292 819 HG13 VAL 94 HG13 VAL 94 42.822 38.337 -37.860 820 HG21 VAL 94 HG21 VAL 94 39.659 36.752 -38.432 821 HG22 VAL 94 HG22 VAL 94 40.709 35.648 -39.375 822 HG23 VAL 94 HG23 VAL 94 39.820 35.156 -37.882 823 H TYR 95 H TYR 95 45.035 35.129 -37.930 824 HA TYR 95 HA TYR 95 46.120 36.712 -35.743 825 HB2 TYR 95 HB2 TYR 95 46.525 33.733 -36.069 826 HB3 TYR 95 HB3 TYR 95 47.501 34.630 -34.995 827 HD1 TYR 95 HD1 TYR 95 46.121 36.142 -33.053 828 HD2 TYR 95 HD2 TYR 95 44.904 32.269 -34.757 829 HE1 TYR 95 HE1 TYR 95 44.968 35.521 -31.088 830 HE2 TYR 95 HE2 TYR 95 43.617 31.787 -32.864 831 HH TYR 95 HH TYR 95 43.005 34.296 -30.393 Start of MODEL 7 1 H1 ACE 36 HH32 ACE 36 15.009 15.216 -48.595 2 H2 ACE 36 HH33 ACE 36 14.061 16.705 -48.402 3 H3 ACE 36 HH31 ACE 36 15.481 16.429 -47.484 4 H GLU 37 H GLU 37 12.539 15.084 -48.384 5 HA GLU 37 HA GLU 37 10.836 14.710 -46.148 6 HB2 GLU 37 HB2 GLU 37 10.130 14.452 -48.475 7 HB3 GLU 37 HB3 GLU 37 11.142 13.049 -48.696 8 HG2 GLU 37 HG2 GLU 37 8.574 12.604 -48.403 9 HG3 GLU 37 HG3 GLU 37 9.461 11.733 -47.297 10 H ASP 38 H ASP 38 13.871 13.135 -46.455 11 HA ASP 38 HA ASP 38 13.138 10.362 -45.842 12 HB2 ASP 38 HB2 ASP 38 14.725 10.817 -47.578 13 HB3 ASP 38 HB3 ASP 38 15.904 11.583 -46.490 14 H ALA 39 H ALA 39 12.490 12.003 -43.730 15 HA ALA 39 HA ALA 39 14.570 12.234 -41.806 16 HB1 ALA 39 HB1 ALA 39 11.677 12.713 -41.476 17 HB2 ALA 39 HB2 ALA 39 13.075 13.233 -40.473 18 HB3 ALA 39 HB3 ALA 39 12.836 13.967 -42.047 19 H PHE 40 H PHE 40 14.828 9.710 -42.040 20 HA PHE 40 HA PHE 40 13.744 8.428 -39.599 21 HB2 PHE 40 HB2 PHE 40 12.062 8.410 -41.723 22 HB3 PHE 40 HB3 PHE 40 13.083 7.064 -42.041 23 HD1 PHE 40 HD1 PHE 40 11.031 8.460 -39.263 24 HD2 PHE 40 HD2 PHE 40 12.650 4.814 -40.923 25 HE1 PHE 40 HE1 PHE 40 9.645 7.096 -37.699 26 HE2 PHE 40 HE2 PHE 40 11.263 3.441 -39.347 27 HZ PHE 40 HZ PHE 40 9.926 4.649 -37.634 28 H ILE 41 H ILE 41 15.210 6.956 -39.001 29 HA ILE 41 HA ILE 41 17.214 5.672 -40.836 30 HB ILE 41 HB ILE 41 17.979 7.035 -38.220 31 HG12 ILE 41 HG12 ILE 41 19.599 8.433 -39.750 32 HG13 ILE 41 HG13 ILE 41 18.378 8.085 -41.067 33 HG21 ILE 41 HG21 ILE 41 19.573 5.518 -40.249 34 HG22 ILE 41 HG22 ILE 41 20.235 6.546 -38.911 35 HG23 ILE 41 HG23 ILE 41 19.158 5.165 -38.644 36 HD11 ILE 41 HD11 ILE 41 17.936 9.493 -38.383 37 HD12 ILE 41 HD12 ILE 41 18.130 10.251 -40.058 38 HD13 ILE 41 HD13 ILE 41 16.728 9.225 -39.694 39 H VAL 42 H VAL 42 17.381 3.720 -40.230 40 HA VAL 42 HA VAL 42 16.212 2.781 -37.644 41 HB VAL 42 HB VAL 42 15.706 1.074 -40.090 42 HG11 VAL 42 HG11 VAL 42 13.902 0.355 -38.754 43 HG12 VAL 42 HG12 VAL 42 15.293 0.490 -37.683 44 HG13 VAL 42 HG13 VAL 42 14.109 1.764 -37.638 45 HG21 VAL 42 HG21 VAL 42 14.080 3.499 -39.088 46 HG22 VAL 42 HG22 VAL 42 14.908 3.434 -40.710 47 HG23 VAL 42 HG23 VAL 42 13.676 2.314 -40.379 48 H ILE 43 H ILE 43 17.504 1.796 -36.417 49 HA ILE 43 HA ILE 43 19.794 0.131 -37.528 50 HB ILE 43 HB ILE 43 20.106 2.339 -35.495 51 HG12 ILE 43 HG12 ILE 43 20.543 2.134 -38.428 52 HG13 ILE 43 HG13 ILE 43 19.646 3.476 -37.594 53 HG21 ILE 43 HG21 ILE 43 22.134 0.543 -36.829 54 HG22 ILE 43 HG22 ILE 43 22.527 1.862 -35.761 55 HG23 ILE 43 HG23 ILE 43 21.648 0.476 -35.165 56 HD11 ILE 43 HD11 ILE 43 21.752 4.338 -36.733 57 HD12 ILE 43 HD12 ILE 43 22.692 3.034 -37.564 58 HD13 ILE 43 HD13 ILE 43 21.835 4.251 -38.466 59 H SEP 44 H SEP 44 20.213 -1.653 -36.266 60 HA SEP 44 HA SEP 44 19.407 -1.579 -33.341 61 HB2 SEP 44 HB2 SEP 44 18.237 -3.591 -33.073 62 HB3 SEP 44 HB3 SEP 44 17.461 -2.816 -34.307 63 H ASP 45 H ASP 45 20.712 -3.933 -32.247 64 HA ASP 45 HA ASP 45 23.423 -3.456 -33.120 65 HB2 ASP 45 HB2 ASP 45 22.578 -2.883 -30.827 66 HB3 ASP 45 HB3 ASP 45 22.359 -4.646 -30.472 67 H SEP 46 H SEP 46 21.214 -6.177 -32.269 68 HA SEP 46 HA SEP 46 23.364 -8.124 -32.282 69 HB2 SEP 46 HB2 SEP 46 21.999 -9.611 -31.302 70 HB3 SEP 46 HB3 SEP 46 21.699 -7.961 -30.669 71 H ASP 47 H ASP 47 23.707 -9.904 -33.756 72 HA ASP 47 HA ASP 47 22.106 -10.400 -36.139 73 HB2 ASP 47 HB2 ASP 47 23.525 -8.402 -36.579 74 HB3 ASP 47 HB3 ASP 47 24.952 -9.371 -36.159 75 H GLY 48 H GLY 48 22.494 -12.369 -37.023 76 HA2 GLY 48 HA2 GLY 48 24.158 -14.293 -36.905 77 HA3 GLY 48 HA3 GLY 48 23.679 -14.335 -35.226 78 H GLU 49 H GLU 49 22.752 -16.595 -35.316 79 HA GLU 49 HA GLU 49 21.050 -17.558 -37.378 80 HB2 GLU 49 HB2 GLU 49 22.286 -18.826 -35.936 81 HB3 GLU 49 HB3 GLU 49 21.608 -18.159 -34.444 82 HG2 GLU 49 HG2 GLU 49 20.894 -20.481 -34.922 83 HG3 GLU 49 HG3 GLU 49 19.461 -19.356 -34.941 84 HN1 NH2 50 HN1 NH2 50 18.959 -17.490 -37.900 85 HN2 NH2 50 HN2 NH2 50 17.771 -16.478 -37.089 86 H1 MET 1 H1 MET 1 -8.982 -33.609 -39.310 87 H2 MET 1 H2 MET 1 -8.613 -33.970 -37.843 88 H3 MET 1 H3 MET 1 -7.362 -33.408 -38.765 89 HA MET 1 HA MET 1 -9.784 -31.849 -38.140 90 HB2 MET 1 HB2 MET 1 -7.788 -32.720 -36.297 91 HB3 MET 1 HB3 MET 1 -7.711 -30.906 -36.369 92 HG2 MET 1 HG2 MET 1 -9.149 -31.934 -34.648 93 HG3 MET 1 HG3 MET 1 -10.167 -31.007 -35.816 94 HE1 MET 1 HE1 MET 1 -11.209 -33.826 -33.838 95 HE2 MET 1 HE2 MET 1 -12.057 -32.376 -34.518 96 HE3 MET 1 HE3 MET 1 -12.450 -34.115 -34.892 97 H ALA 2 H ALA 2 -9.669 -29.943 -39.413 98 HA ALA 2 HA ALA 2 -7.430 -29.361 -41.225 99 HB1 ALA 2 HB1 ALA 2 -8.936 -27.469 -41.574 100 HB2 ALA 2 HB2 ALA 2 -9.413 -29.072 -42.043 101 HB3 ALA 2 HB3 ALA 2 -10.120 -28.337 -40.545 102 H ASP 3 H ASP 3 -6.506 -27.257 -41.280 103 HA ASP 3 HA ASP 3 -5.199 -26.850 -38.870 104 HB2 ASP 3 HB2 ASP 3 -4.026 -26.953 -40.941 105 HB3 ASP 3 HB3 ASP 3 -5.046 -25.593 -41.617 106 H GLU 4 H GLU 4 -5.863 -25.722 -37.244 107 HA GLU 4 HA GLU 4 -6.396 -22.813 -37.395 108 HB2 GLU 4 HB2 GLU 4 -8.496 -23.806 -37.300 109 HB3 GLU 4 HB3 GLU 4 -8.116 -24.891 -35.880 110 HG2 GLU 4 HG2 GLU 4 -9.573 -22.989 -35.517 111 HG3 GLU 4 HG3 GLU 4 -8.221 -22.979 -34.473 112 H LYS 5 H LYS 5 -3.872 -23.810 -37.113 113 HA LYS 5 HA LYS 5 -3.020 -24.720 -34.650 114 HB2 LYS 5 HB2 LYS 5 -1.543 -24.605 -36.710 115 HB3 LYS 5 HB3 LYS 5 -1.477 -22.876 -36.613 116 HG2 LYS 5 HG2 LYS 5 -0.442 -23.102 -34.340 117 HG3 LYS 5 HG3 LYS 5 -0.306 -24.800 -34.620 118 HD2 LYS 5 HD2 LYS 5 1.107 -24.673 -36.345 119 HD3 LYS 5 HD3 LYS 5 0.971 -22.845 -36.464 120 HE2 LYS 5 HE2 LYS 5 1.927 -24.257 -33.926 121 HE3 LYS 5 HE3 LYS 5 3.128 -23.676 -35.177 122 HZ1 LYS 5 HZ1 LYS 5 1.181 -22.072 -33.693 123 HZ2 LYS 5 HZ2 LYS 5 2.766 -22.333 -33.441 124 HZ3 LYS 5 HZ3 LYS 5 2.345 -21.586 -34.844 125 HA PRO 6 HA PRO 6 -3.384 -21.239 -31.863 126 HB2 PRO 6 HB2 PRO 6 -1.219 -22.478 -30.247 127 HB3 PRO 6 HB3 PRO 6 -2.881 -22.091 -29.752 128 HG2 PRO 6 HG2 PRO 6 -2.110 -24.752 -30.226 129 HG3 PRO 6 HG3 PRO 6 -3.687 -24.028 -30.394 130 HD2 PRO 6 HD2 PRO 6 -1.773 -24.643 -32.698 131 HD3 PRO 6 HD3 PRO 6 -3.624 -24.671 -32.589 132 H LYS 7 H LYS 7 -2.355 -19.300 -31.708 133 HA LYS 7 HA LYS 7 0.063 -18.635 -33.175 134 HB2 LYS 7 HB2 LYS 7 -1.919 -17.065 -32.610 135 HB3 LYS 7 HB3 LYS 7 -1.365 -16.927 -30.974 136 HG2 LYS 7 HG2 LYS 7 0.848 -15.889 -31.881 137 HG3 LYS 7 HG3 LYS 7 0.118 -16.114 -33.548 138 HD2 LYS 7 HD2 LYS 7 -1.888 -14.729 -32.717 139 HD3 LYS 7 HD3 LYS 7 -1.020 -14.352 -31.324 140 HE2 LYS 7 HE2 LYS 7 0.846 -13.507 -32.914 141 HE3 LYS 7 HE3 LYS 7 -0.420 -13.497 -34.125 142 HZ1 LYS 7 HZ1 LYS 7 -0.664 -12.103 -31.476 143 HZ2 LYS 7 HZ2 LYS 7 -0.289 -11.388 -32.873 144 HZ3 LYS 7 HZ3 LYS 7 -1.693 -12.001 -32.772 145 H GLU 8 H GLU 8 2.250 -17.931 -32.272 146 HA GLU 8 HA GLU 8 3.120 -19.690 -30.162 147 HB2 GLU 8 HB2 GLU 8 4.728 -18.988 -31.821 148 HB3 GLU 8 HB3 GLU 8 4.504 -17.377 -31.303 149 HG2 GLU 8 HG2 GLU 8 6.585 -18.265 -30.357 150 HG3 GLU 8 HG3 GLU 8 5.434 -17.878 -29.117 151 H GLY 9 H GLY 9 3.520 -19.353 -27.897 152 HA2 GLY 9 HA2 GLY 9 2.203 -17.051 -26.634 153 HA3 GLY 9 HA3 GLY 9 3.000 -18.422 -25.872 154 H VAL 10 H VAL 10 5.553 -18.488 -26.038 155 HA VAL 10 HA VAL 10 6.480 -15.736 -25.762 156 HB VAL 10 HB VAL 10 7.441 -18.413 -24.726 157 HG11 VAL 10 HG11 VAL 10 9.436 -17.207 -25.302 158 HG12 VAL 10 HG12 VAL 10 8.952 -15.759 -24.440 159 HG13 VAL 10 HG13 VAL 10 9.338 -17.342 -23.569 160 HG21 VAL 10 HG21 VAL 10 7.039 -17.455 -22.491 161 HG22 VAL 10 HG22 VAL 10 6.697 -15.907 -23.151 162 HG23 VAL 10 HG23 VAL 10 5.570 -17.236 -23.466 163 H LYS 11 H LYS 11 8.357 -15.034 -27.023 164 HA LYS 11 HA LYS 11 9.202 -16.855 -29.243 165 HB2 LYS 11 HB2 LYS 11 7.095 -15.420 -29.603 166 HB3 LYS 11 HB3 LYS 11 8.196 -14.147 -29.624 167 HG2 LYS 11 HG2 LYS 11 9.250 -15.001 -31.678 168 HG3 LYS 11 HG3 LYS 11 8.217 -16.393 -31.637 169 HD2 LYS 11 HD2 LYS 11 6.240 -14.754 -31.508 170 HD3 LYS 11 HD3 LYS 11 7.315 -13.452 -31.928 171 HE2 LYS 11 HE2 LYS 11 8.020 -14.585 -33.987 172 HE3 LYS 11 HE3 LYS 11 6.807 -15.882 -33.682 173 HZ1 LYS 11 HZ1 LYS 11 6.149 -14.214 -35.236 174 HZ2 LYS 11 HZ2 LYS 11 5.157 -14.044 -33.892 175 HZ3 LYS 11 HZ3 LYS 11 6.219 -12.988 -34.254 176 H THR 12 H THR 12 10.581 -14.858 -30.754 177 HA THR 12 HA THR 12 12.693 -13.486 -28.984 178 HB THR 12 HB THR 12 14.177 -13.823 -30.883 179 HG1 THR 12 HG1 THR 12 12.756 -14.080 -32.513 180 HG21 THR 12 HG21 THR 12 14.252 -15.573 -29.102 181 HG22 THR 12 HG22 THR 12 12.935 -16.418 -29.995 182 HG23 THR 12 HG23 THR 12 14.544 -16.148 -30.659 183 H GLU 13 H GLU 13 9.900 -12.317 -30.583 184 HA GLU 13 HA GLU 13 11.272 -9.885 -31.732 185 HB2 GLU 13 HB2 GLU 13 8.506 -10.719 -32.407 186 HB3 GLU 13 HB3 GLU 13 9.671 -9.814 -33.259 187 HG2 GLU 13 HG2 GLU 13 9.667 -12.813 -33.047 188 HG3 GLU 13 HG3 GLU 13 9.511 -11.918 -34.504 189 H ASN 14 H ASN 14 10.465 -10.302 -28.755 190 HA ASN 14 HA ASN 14 8.340 -8.394 -28.462 191 HB2 ASN 14 HB2 ASN 14 9.769 -9.926 -26.199 192 HB3 ASN 14 HB3 ASN 14 8.211 -9.201 -26.040 193 HD21 ASN 14 HD22 ASN 14 6.697 -10.030 -28.349 194 HD22 ASN 14 HD21 ASN 14 6.771 -11.746 -28.357 195 H ASN 15 H ASN 15 11.509 -7.624 -28.755 196 HA ASN 15 HA ASN 15 11.588 -5.550 -26.713 197 HB2 ASN 15 HB2 ASN 15 13.349 -6.777 -28.283 198 HB3 ASN 15 HB3 ASN 15 13.049 -5.476 -29.432 199 HD21 ASN 15 HD22 ASN 15 14.662 -6.629 -26.714 200 HD22 ASN 15 HD21 ASN 15 14.861 -5.074 -25.859 201 H ASP 16 H ASP 16 10.792 -3.594 -26.886 202 HA ASP 16 HA ASP 16 9.441 -2.609 -29.314 203 HB2 ASP 16 HB2 ASP 16 8.712 -1.550 -26.591 204 HB3 ASP 16 HB3 ASP 16 7.931 -1.287 -27.980 205 H HIS 17 H HIS 17 10.197 -0.910 -30.512 206 HA HIS 17 HA HIS 17 12.590 -0.066 -29.840 207 HB2 HIS 17 HB2 HIS 17 10.481 1.039 -31.698 208 HB3 HIS 17 HB3 HIS 17 12.235 1.452 -31.934 209 HD2 HIS 17 HD2 HIS 17 13.789 -0.217 -33.048 210 HE1 HIS 17 HE1 HIS 17 10.988 -3.218 -34.001 211 HE2 HIS 17 HE2 HIS 17 13.326 -2.574 -34.187 212 H ILE 18 H ILE 18 13.637 1.655 -29.229 213 HA ILE 18 HA ILE 18 12.114 4.001 -28.002 214 HB ILE 18 HB ILE 18 13.647 2.614 -26.728 215 HG12 ILE 18 HG12 ILE 18 14.033 5.534 -26.922 216 HG13 ILE 18 HG13 ILE 18 12.800 4.685 -25.973 217 HG21 ILE 18 HG21 ILE 18 15.594 2.408 -28.433 218 HG22 ILE 18 HG22 ILE 18 15.636 4.149 -28.467 219 HG23 ILE 18 HG23 ILE 18 16.239 3.255 -27.113 220 HD11 ILE 18 HD11 ILE 18 14.528 3.638 -24.548 221 HD12 ILE 18 HD12 ILE 18 15.795 4.582 -25.407 222 HD13 ILE 18 HD13 ILE 18 14.592 5.396 -24.422 223 H ASN 19 H ASN 19 12.171 5.801 -28.801 224 HA ASN 19 HA ASN 19 13.473 6.363 -31.533 225 HB2 ASN 19 HB2 ASN 19 10.780 7.016 -30.321 226 HB3 ASN 19 HB3 ASN 19 11.216 7.521 -31.979 227 HD21 ASN 19 HD22 ASN 19 10.108 4.806 -29.918 228 HD22 ASN 19 HD21 ASN 19 9.774 3.870 -31.363 229 H LEU 20 H LEU 20 15.059 7.396 -31.183 230 HA LEU 20 HA LEU 20 14.939 9.782 -29.401 231 HB2 LEU 20 HB2 LEU 20 17.484 8.320 -30.509 232 HB3 LEU 20 HB3 LEU 20 17.531 9.660 -29.403 233 HG LEU 20 HG LEU 20 16.471 6.904 -28.773 234 HD11 LEU 20 HD11 LEU 20 18.570 8.528 -27.530 235 HD12 LEU 20 HD12 LEU 20 18.307 6.738 -27.282 236 HD13 LEU 20 HD13 LEU 20 18.969 7.325 -28.852 237 HD21 LEU 20 HD21 LEU 20 16.299 9.242 -26.924 238 HD22 LEU 20 HD22 LEU 20 14.993 8.209 -27.585 239 HD23 LEU 20 HD23 LEU 20 16.155 7.562 -26.497 240 H LYS 21 H LYS 21 16.413 11.560 -30.116 241 HA LYS 21 HA LYS 21 15.921 12.055 -33.058 242 HB2 LYS 21 HB2 LYS 21 15.365 13.910 -30.687 243 HB3 LYS 21 HB3 LYS 21 15.339 14.390 -32.385 244 HG2 LYS 21 HG2 LYS 21 13.538 13.095 -32.928 245 HG3 LYS 21 HG3 LYS 21 13.479 12.399 -31.278 246 HD2 LYS 21 HD2 LYS 21 13.084 14.661 -30.344 247 HD3 LYS 21 HD3 LYS 21 12.993 15.287 -32.011 248 HE2 LYS 21 HE2 LYS 21 11.122 13.638 -32.325 249 HE3 LYS 21 HE3 LYS 21 11.316 13.157 -30.583 250 HZ1 LYS 21 HZ1 LYS 21 9.506 14.817 -30.657 251 HZ2 LYS 21 HZ2 LYS 21 10.902 15.463 -30.041 252 HZ3 LYS 21 HZ3 LYS 21 10.257 15.729 -31.567 253 H VAL 22 H VAL 22 17.348 13.675 -33.952 254 HA VAL 22 HA VAL 22 19.746 14.221 -32.339 255 HB VAL 22 HB VAL 22 19.825 13.152 -35.158 256 HG11 VAL 22 HG11 VAL 22 21.994 14.062 -33.162 257 HG12 VAL 22 HG12 VAL 22 22.352 13.093 -34.490 258 HG13 VAL 22 HG13 VAL 22 21.708 14.673 -34.810 259 HG21 VAL 22 HG21 VAL 22 21.043 11.288 -33.948 260 HG22 VAL 22 HG22 VAL 22 20.312 11.943 -32.476 261 HG23 VAL 22 HG23 VAL 22 19.241 11.496 -33.747 262 H ALA 23 H ALA 23 20.561 16.386 -32.851 263 HA ALA 23 HA ALA 23 18.922 18.053 -34.776 264 HB1 ALA 23 HB1 ALA 23 18.394 19.490 -32.892 265 HB2 ALA 23 HB2 ALA 23 17.904 17.844 -32.421 266 HB3 ALA 23 HB3 ALA 23 19.397 18.542 -31.738 267 H GLY 24 H GLY 24 20.255 19.561 -35.886 268 HA2 GLY 24 HA2 GLY 24 22.950 19.975 -35.019 269 HA3 GLY 24 HA3 GLY 24 22.253 20.856 -36.253 270 H GLN 25 H GLN 25 23.732 22.400 -35.058 271 HA GLN 25 HA GLN 25 22.305 24.258 -33.314 272 HB2 GLN 25 HB2 GLN 25 25.098 24.316 -34.611 273 HB3 GLN 25 HB3 GLN 25 24.414 25.537 -33.650 274 HG2 GLN 25 HG2 GLN 25 25.554 22.951 -32.797 275 HG3 GLN 25 HG3 GLN 25 25.539 24.445 -31.857 276 HE21 GLN 25 HE22 GLN 25 24.326 21.365 -32.023 277 HE22 GLN 25 HE21 GLN 25 23.067 21.640 -30.838 278 H ASP 26 H ASP 26 22.573 23.643 -36.862 279 HA ASP 26 HA ASP 26 21.684 26.236 -37.450 280 HB2 ASP 26 HB2 ASP 26 20.993 25.479 -39.625 281 HB3 ASP 26 HB3 ASP 26 22.595 25.043 -39.207 282 H GLY 27 H GLY 27 19.883 23.350 -36.541 283 HA2 GLY 27 HA2 GLY 27 17.760 23.568 -35.246 284 HA3 GLY 27 HA3 GLY 27 17.228 24.732 -36.381 285 H SER 28 H SER 28 19.044 22.123 -37.872 286 HA SER 28 HA SER 28 16.538 20.894 -39.085 287 HB2 SER 28 HB2 SER 28 18.015 19.609 -40.429 288 HB3 SER 28 HB3 SER 28 18.444 21.310 -40.460 289 HG SER 28 HG SER 28 20.128 21.018 -39.179 290 H VAL 29 H VAL 29 15.699 18.812 -38.403 291 HA VAL 29 HA VAL 29 17.313 17.322 -36.357 292 HB VAL 29 HB VAL 29 14.424 18.192 -36.071 293 HG11 VAL 29 HG11 VAL 29 15.877 16.887 -33.718 294 HG12 VAL 29 HG12 VAL 29 14.282 16.864 -34.017 295 HG13 VAL 29 HG13 VAL 29 15.236 15.888 -35.072 296 HG21 VAL 29 HG21 VAL 29 15.237 19.242 -34.080 297 HG22 VAL 29 HG22 VAL 29 16.925 18.968 -34.617 298 HG23 VAL 29 HG23 VAL 29 15.801 20.051 -35.564 299 H VAL 30 H VAL 30 17.200 15.045 -36.630 300 HA VAL 30 HA VAL 30 14.881 13.966 -38.133 301 HB VAL 30 HB VAL 30 16.244 11.989 -38.761 302 HG11 VAL 30 HG11 VAL 30 16.008 13.929 -40.359 303 HG12 VAL 30 HG12 VAL 30 17.581 14.459 -39.871 304 HG13 VAL 30 HG13 VAL 30 17.388 12.867 -40.582 305 HG21 VAL 30 HG21 VAL 30 18.558 13.679 -37.684 306 HG22 VAL 30 HG22 VAL 30 17.953 12.147 -36.996 307 HG23 VAL 30 HG23 VAL 30 18.713 12.297 -38.666 308 H GLN 31 H GLN 31 14.427 11.843 -37.641 309 HA GLN 31 HA GLN 31 14.595 11.199 -34.788 310 HB2 GLN 31 HB2 GLN 31 12.469 11.780 -35.411 311 HB3 GLN 31 HB3 GLN 31 12.305 10.758 -36.899 312 HG2 GLN 31 HG2 GLN 31 12.222 8.778 -35.632 313 HG3 GLN 31 HG3 GLN 31 12.556 9.802 -34.110 314 HE21 GLN 31 HE22 GLN 31 10.487 7.997 -34.568 315 HE22 GLN 31 HE21 GLN 31 8.934 8.796 -34.500 316 H PHE 32 H PHE 32 15.058 9.191 -34.186 317 HA PHE 32 HA PHE 32 16.097 7.207 -36.064 318 HB2 PHE 32 HB2 PHE 32 17.171 8.348 -33.515 319 HB3 PHE 32 HB3 PHE 32 17.674 6.728 -33.851 320 HD1 PHE 32 HD1 PHE 32 17.847 10.219 -35.344 321 HD2 PHE 32 HD2 PHE 32 19.222 6.178 -35.375 322 HE1 PHE 32 HE1 PHE 32 19.772 10.878 -36.568 323 HE2 PHE 32 HE2 PHE 32 21.146 6.810 -36.791 324 HZ PHE 32 HZ PHE 32 21.481 9.116 -37.324 325 H LYS 33 H LYS 33 14.874 5.562 -36.173 326 HA LYS 33 HA LYS 33 13.540 4.460 -33.726 327 HB2 LYS 33 HB2 LYS 33 12.353 4.420 -35.897 328 HB3 LYS 33 HB3 LYS 33 13.549 3.376 -36.551 329 HG2 LYS 33 HG2 LYS 33 12.995 1.694 -34.886 330 HG3 LYS 33 HG3 LYS 33 11.836 2.890 -34.145 331 HD2 LYS 33 HD2 LYS 33 10.676 2.922 -36.317 332 HD3 LYS 33 HD3 LYS 33 11.582 1.323 -36.720 333 HE2 LYS 33 HE2 LYS 33 10.602 0.615 -34.482 334 HE3 LYS 33 HE3 LYS 33 9.645 2.112 -34.505 335 HZ1 LYS 33 HZ1 LYS 33 9.306 -0.061 -36.474 336 HZ2 LYS 33 HZ2 LYS 33 8.170 0.491 -35.450 337 HZ3 LYS 33 HZ3 LYS 33 8.712 1.482 -36.531 338 H ILE 34 H ILE 34 14.827 3.279 -32.303 339 HA ILE 34 HA ILE 34 16.823 1.403 -33.142 340 HB ILE 34 HB ILE 34 18.451 2.144 -31.620 341 HG12 ILE 34 HG12 ILE 34 17.015 4.985 -31.507 342 HG13 ILE 34 HG13 ILE 34 16.448 3.716 -30.521 343 HG21 ILE 34 HG21 ILE 34 18.869 2.872 -33.807 344 HG22 ILE 34 HG22 ILE 34 17.938 4.427 -33.465 345 HG23 ILE 34 HG23 ILE 34 19.423 4.122 -32.642 346 HD11 ILE 34 HD11 ILE 34 18.466 3.431 -29.312 347 HD12 ILE 34 HD12 ILE 34 19.327 4.485 -30.448 348 HD13 ILE 34 HD13 ILE 34 18.104 5.260 -29.348 349 H LYS 35 H LYS 35 17.762 0.539 -30.603 350 HA LYS 35 HA LYS 35 15.310 -0.031 -29.071 351 HB2 LYS 35 HB2 LYS 35 17.403 -2.111 -29.872 352 HB3 LYS 35 HB3 LYS 35 16.291 -2.371 -28.705 353 HG2 LYS 35 HG2 LYS 35 14.351 -2.224 -30.411 354 HG3 LYS 35 HG3 LYS 35 15.672 -1.896 -31.647 355 HD2 LYS 35 HD2 LYS 35 16.602 -4.094 -30.932 356 HD3 LYS 35 HD3 LYS 35 15.163 -4.392 -29.956 357 HE2 LYS 35 HE2 LYS 35 13.595 -4.480 -31.722 358 HE3 LYS 35 HE3 LYS 35 14.757 -3.545 -32.793 359 HZ1 LYS 35 HZ1 LYS 35 14.241 -5.953 -33.266 360 HZ2 LYS 35 HZ2 LYS 35 15.840 -5.630 -33.211 361 HZ3 LYS 35 HZ3 LYS 35 15.302 -6.305 -31.933 362 H ARG 36 H ARG 36 15.747 -0.394 -26.798 363 HA ARG 36 HA ARG 36 17.102 1.639 -25.679 364 HB2 ARG 36 HB2 ARG 36 15.485 0.682 -24.600 365 HB3 ARG 36 HB3 ARG 36 16.089 -0.871 -24.317 366 HG2 ARG 36 HG2 ARG 36 17.885 0.198 -22.792 367 HG3 ARG 36 HG3 ARG 36 17.139 1.760 -23.184 368 HD2 ARG 36 HD2 ARG 36 15.232 1.228 -21.890 369 HD3 ARG 36 HD3 ARG 36 15.451 -0.514 -21.971 370 HE ARG 36 HE ARG 36 16.986 -0.319 -20.223 371 HH11 ARG 36 HH11 ARG 36 15.589 2.911 -20.432 372 HH12 ARG 36 HH12 ARG 36 16.378 3.287 -18.905 373 HH21 ARG 36 HH21 ARG 36 17.926 0.388 -18.592 374 HH22 ARG 36 HH22 ARG 36 17.719 2.069 -18.082 375 H HIS 37 H HIS 37 18.541 -1.600 -26.295 376 HA HIS 37 HA HIS 37 21.234 -0.763 -25.505 377 HB2 HIS 37 HB2 HIS 37 21.555 -3.131 -25.414 378 HB3 HIS 37 HB3 HIS 37 20.000 -2.761 -24.717 379 HD2 HIS 37 HD2 HIS 37 21.613 -5.212 -26.723 380 HE1 HIS 37 HE1 HIS 37 17.731 -5.143 -28.373 381 HE2 HIS 37 HE2 HIS 37 19.866 -6.441 -28.298 382 H THR 38 H THR 38 19.867 -0.031 -28.458 383 HA THR 38 HA THR 38 22.105 -0.817 -30.059 384 HB THR 38 HB THR 38 20.393 1.701 -30.315 385 HG1 THR 38 HG1 THR 38 19.841 -0.989 -30.641 386 HG21 THR 38 HG21 THR 38 20.557 0.999 -32.867 387 HG22 THR 38 HG22 THR 38 22.119 1.709 -32.179 388 HG23 THR 38 HG23 THR 38 21.845 -0.092 -32.422 389 HA PRO 39 HA PRO 39 25.366 1.923 -28.321 390 HB2 PRO 39 HB2 PRO 39 27.268 1.762 -30.021 391 HB3 PRO 39 HB3 PRO 39 26.967 0.576 -28.688 392 HG2 PRO 39 HG2 PRO 39 26.246 0.186 -31.578 393 HG3 PRO 39 HG3 PRO 39 26.900 -0.967 -30.370 394 HD2 PRO 39 HD2 PRO 39 24.279 -0.819 -31.101 395 HD3 PRO 39 HD3 PRO 39 24.667 -1.310 -29.469 396 H LEU 40 H LEU 40 25.562 4.116 -28.605 397 HA LEU 40 HA LEU 40 24.271 5.436 -30.826 398 HB2 LEU 40 HB2 LEU 40 26.027 6.155 -28.420 399 HB3 LEU 40 HB3 LEU 40 25.298 7.469 -29.406 400 HG LEU 40 HG LEU 40 23.639 5.500 -27.768 401 HD11 LEU 40 HD11 LEU 40 24.214 8.577 -27.308 402 HD12 LEU 40 HD12 LEU 40 23.072 7.570 -26.410 403 HD13 LEU 40 HD13 LEU 40 24.824 7.283 -26.431 404 HD21 LEU 40 HD21 LEU 40 23.026 7.951 -29.636 405 HD22 LEU 40 HD22 LEU 40 22.505 6.302 -29.796 406 HD23 LEU 40 HD23 LEU 40 21.896 7.221 -28.466 407 H SER 41 H SER 41 27.429 4.126 -30.631 408 HA SER 41 HA SER 41 28.815 5.988 -32.333 409 HB2 SER 41 HB2 SER 41 30.298 4.179 -32.966 410 HB3 SER 41 HB3 SER 41 29.892 4.134 -31.186 411 HG SER 41 HG SER 41 29.537 2.196 -31.638 412 H LYS 42 H LYS 42 26.756 3.301 -33.314 413 HA LYS 42 HA LYS 42 26.869 3.557 -36.038 414 HB2 LYS 42 HB2 LYS 42 24.554 2.887 -34.444 415 HB3 LYS 42 HB3 LYS 42 24.888 2.277 -36.047 416 HG2 LYS 42 HG2 LYS 42 26.805 0.986 -35.416 417 HG3 LYS 42 HG3 LYS 42 26.758 1.422 -33.747 418 HD2 LYS 42 HD2 LYS 42 24.494 0.526 -33.531 419 HD3 LYS 42 HD3 LYS 42 24.404 0.039 -35.174 420 HE2 LYS 42 HE2 LYS 42 26.603 -0.858 -33.338 421 HE3 LYS 42 HE3 LYS 42 25.145 -1.799 -33.562 422 HZ1 LYS 42 HZ1 LYS 42 26.517 -2.749 -35.140 423 HZ2 LYS 42 HZ2 LYS 42 25.787 -1.678 -36.084 424 HZ3 LYS 42 HZ3 LYS 42 27.333 -1.408 -35.528 425 H LEU 43 H LEU 43 24.986 5.542 -33.728 426 HA LEU 43 HA LEU 43 23.277 6.897 -35.633 427 HB2 LEU 43 HB2 LEU 43 23.537 7.287 -32.612 428 HB3 LEU 43 HB3 LEU 43 22.584 8.296 -33.648 429 HG LEU 43 HG LEU 43 21.427 6.038 -34.372 430 HD11 LEU 43 HD11 LEU 43 22.070 4.967 -31.684 431 HD12 LEU 43 HD12 LEU 43 21.692 4.129 -33.176 432 HD13 LEU 43 HD13 LEU 43 23.302 4.632 -33.049 433 HD21 LEU 43 HD21 LEU 43 21.080 7.056 -31.478 434 HD22 LEU 43 HD22 LEU 43 20.525 7.817 -32.962 435 HD23 LEU 43 HD23 LEU 43 19.956 6.318 -32.620 436 H MET 44 H MET 44 26.072 7.694 -33.488 437 HA MET 44 HA MET 44 26.670 10.288 -34.539 438 HB2 MET 44 HB2 MET 44 28.585 8.014 -33.532 439 HB3 MET 44 HB3 MET 44 28.964 9.727 -34.014 440 HG2 MET 44 HG2 MET 44 27.452 10.563 -32.470 441 HG3 MET 44 HG3 MET 44 27.071 8.899 -31.730 442 HE1 MET 44 HE1 MET 44 29.791 7.476 -31.114 443 HE2 MET 44 HE2 MET 44 29.893 8.146 -29.432 444 HE3 MET 44 HE3 MET 44 28.363 7.684 -30.059 445 H LYS 45 H LYS 45 28.135 7.239 -35.718 446 HA LYS 45 HA LYS 45 29.226 8.166 -38.036 447 HB2 LYS 45 HB2 LYS 45 27.984 5.530 -37.388 448 HB3 LYS 45 HB3 LYS 45 28.789 5.612 -38.864 449 HG2 LYS 45 HG2 LYS 45 30.920 6.230 -37.798 450 HG3 LYS 45 HG3 LYS 45 30.220 6.376 -36.192 451 HD2 LYS 45 HD2 LYS 45 29.781 3.864 -36.503 452 HD3 LYS 45 HD3 LYS 45 30.967 4.063 -37.822 453 HE2 LYS 45 HE2 LYS 45 32.436 5.090 -36.061 454 HE3 LYS 45 HE3 LYS 45 31.263 4.919 -34.826 455 HZ1 LYS 45 HZ1 LYS 45 32.387 2.597 -36.358 456 HZ2 LYS 45 HZ2 LYS 45 32.854 3.148 -34.878 457 HZ3 LYS 45 HZ3 LYS 45 31.445 2.506 -34.999 458 H ALA 46 H ALA 46 25.878 6.962 -37.676 459 HA ALA 46 HA ALA 46 25.124 7.463 -40.311 460 HB1 ALA 46 HB1 ALA 46 23.098 7.664 -38.076 461 HB2 ALA 46 HB2 ALA 46 22.832 7.134 -39.707 462 HB3 ALA 46 HB3 ALA 46 23.876 6.157 -38.627 463 H TYR 47 H TYR 47 24.731 9.912 -37.575 464 HA TYR 47 HA TYR 47 23.441 11.756 -39.474 465 HB2 TYR 47 HB2 TYR 47 23.097 11.529 -37.035 466 HB3 TYR 47 HB3 TYR 47 24.628 12.421 -36.792 467 HD1 TYR 47 HD1 TYR 47 21.296 13.156 -38.486 468 HD2 TYR 47 HD2 TYR 47 25.024 14.729 -36.834 469 HE1 TYR 47 HE1 TYR 47 20.400 15.422 -38.414 470 HE2 TYR 47 HE2 TYR 47 24.019 16.971 -36.843 471 HH TYR 47 HH TYR 47 20.705 17.455 -38.107 472 H CYS 48 H CYS 48 26.872 11.250 -38.404 473 HA CYS 48 HA CYS 48 27.701 13.819 -39.291 474 HB2 CYS 48 HB2 CYS 48 28.931 12.251 -37.584 475 HB3 CYS 48 HB3 CYS 48 29.268 11.220 -38.996 476 HG CYS 48 HG CYS 48 30.771 12.605 -40.304 477 H GLU 49 H GLU 49 27.233 10.607 -40.900 478 HA GLU 49 HA GLU 49 28.461 11.234 -43.369 479 HB2 GLU 49 HB2 GLU 49 26.715 9.085 -42.358 480 HB3 GLU 49 HB3 GLU 49 26.997 9.322 -44.121 481 HG2 GLU 49 HG2 GLU 49 29.355 9.117 -43.914 482 HG3 GLU 49 HG3 GLU 49 29.294 8.968 -42.190 483 H ARG 50 H ARG 50 25.286 11.860 -42.069 484 HA ARG 50 HA ARG 50 24.133 12.496 -44.638 485 HB2 ARG 50 HB2 ARG 50 23.080 12.809 -41.801 486 HB3 ARG 50 HB3 ARG 50 22.214 13.650 -43.053 487 HG2 ARG 50 HG2 ARG 50 21.898 11.484 -44.266 488 HG3 ARG 50 HG3 ARG 50 22.811 10.652 -42.885 489 HD2 ARG 50 HD2 ARG 50 21.030 11.156 -41.409 490 HD3 ARG 50 HD3 ARG 50 20.405 12.351 -42.354 491 HE ARG 50 HE ARG 50 20.223 9.414 -43.250 492 HH11 ARG 50 HH11 ARG 50 18.404 12.479 -43.065 493 HH12 ARG 50 HH12 ARG 50 16.933 11.493 -43.221 494 HH21 ARG 50 HH21 ARG 50 18.560 8.554 -43.339 495 HH22 ARG 50 HH22 ARG 50 17.071 9.464 -43.750 496 H GLN 51 H GLN 51 26.112 14.148 -42.257 497 HA GLN 51 HA GLN 51 25.789 16.783 -43.629 498 HB2 GLN 51 HB2 GLN 51 27.475 15.732 -41.325 499 HB3 GLN 51 HB3 GLN 51 27.640 17.336 -41.895 500 HG2 GLN 51 HG2 GLN 51 24.961 16.173 -40.699 501 HG3 GLN 51 HG3 GLN 51 26.036 17.323 -39.919 502 HE21 GLN 51 HE22 GLN 51 23.119 17.457 -41.480 503 HE22 GLN 51 HE21 GLN 51 23.308 19.123 -41.942 504 H GLY 52 H GLY 52 27.878 14.077 -43.521 505 HA2 GLY 52 HA2 GLY 52 29.545 13.431 -44.999 506 HA3 GLY 52 HA3 GLY 52 29.295 14.893 -45.985 507 H LEU 53 H LEU 53 30.224 14.309 -42.719 508 HA LEU 53 HA LEU 53 32.550 16.118 -42.999 509 HB2 LEU 53 HB2 LEU 53 30.797 15.714 -40.554 510 HB3 LEU 53 HB3 LEU 53 32.227 16.721 -40.543 511 HG LEU 53 HG LEU 53 29.807 17.256 -42.280 512 HD11 LEU 53 HD11 LEU 53 29.208 17.859 -39.984 513 HD12 LEU 53 HD12 LEU 53 30.819 18.338 -39.595 514 HD13 LEU 53 HD13 LEU 53 29.683 19.269 -40.631 515 HD21 LEU 53 HD21 LEU 53 31.866 18.001 -43.432 516 HD22 LEU 53 HD22 LEU 53 30.978 19.387 -42.770 517 HD23 LEU 53 HD23 LEU 53 32.423 18.806 -41.970 518 H SER 54 H SER 54 34.350 15.636 -41.311 519 HA SER 54 HA SER 54 34.769 12.749 -40.788 520 HB2 SER 54 HB2 SER 54 36.764 13.828 -41.482 521 HB3 SER 54 HB3 SER 54 36.424 15.247 -40.440 522 HG SER 54 HG SER 54 37.913 14.144 -39.489 523 H MET 55 H MET 55 34.667 12.033 -38.566 524 HA MET 55 HA MET 55 32.775 13.404 -36.835 525 HB2 MET 55 HB2 MET 55 32.974 11.089 -37.215 526 HB3 MET 55 HB3 MET 55 34.285 10.870 -36.109 527 HG2 MET 55 HG2 MET 55 32.827 11.884 -34.283 528 HG3 MET 55 HG3 MET 55 31.494 11.948 -35.481 529 HE1 MET 55 HE1 MET 55 32.741 9.042 -36.781 530 HE2 MET 55 HE2 MET 55 31.737 7.741 -36.046 531 HE3 MET 55 HE3 MET 55 30.979 9.041 -36.671 532 H ARG 56 H ARG 56 36.240 13.641 -37.197 533 HA ARG 56 HA ARG 56 37.056 14.553 -34.574 534 HB2 ARG 56 HB2 ARG 56 38.283 13.990 -36.798 535 HB3 ARG 56 HB3 ARG 56 38.025 15.600 -37.206 536 HG2 ARG 56 HG2 ARG 56 39.340 16.305 -35.088 537 HG3 ARG 56 HG3 ARG 56 39.556 14.531 -34.755 538 HD2 ARG 56 HD2 ARG 56 40.541 14.403 -37.134 539 HD3 ARG 56 HD3 ARG 56 40.670 16.088 -37.059 540 HE ARG 56 HE ARG 56 41.714 15.061 -34.594 541 HH11 ARG 56 HH11 ARG 56 42.661 15.765 -37.909 542 HH12 ARG 56 HH12 ARG 56 44.314 15.533 -37.563 543 HH21 ARG 56 HH21 ARG 56 43.520 15.042 -34.197 544 HH22 ARG 56 HH22 ARG 56 44.924 15.043 -35.302 545 H GLN 57 H GLN 57 35.397 16.202 -37.149 546 HA GLN 57 HA GLN 57 36.069 18.803 -35.906 547 HB2 GLN 57 HB2 GLN 57 35.693 19.670 -37.864 548 HB3 GLN 57 HB3 GLN 57 36.180 18.004 -38.430 549 HG2 GLN 57 HG2 GLN 57 33.717 17.612 -38.680 550 HG3 GLN 57 HG3 GLN 57 33.442 19.300 -38.386 551 HE21 GLN 57 HE22 GLN 57 33.886 20.573 -40.397 552 HE22 GLN 57 HE21 GLN 57 34.543 19.875 -41.919 553 H ILE 58 H ILE 58 33.701 16.679 -35.097 554 HA ILE 58 HA ILE 58 31.787 18.780 -34.362 555 HB ILE 58 HB ILE 58 29.755 17.114 -34.932 556 HG12 ILE 58 HG12 ILE 58 31.970 15.505 -36.083 557 HG13 ILE 58 HG13 ILE 58 31.139 15.120 -34.714 558 HG21 ILE 58 HG21 ILE 58 30.680 19.029 -36.806 559 HG22 ILE 58 HG22 ILE 58 31.352 17.787 -37.536 560 HG23 ILE 58 HG23 ILE 58 29.675 17.537 -37.233 561 HD11 ILE 58 HD11 ILE 58 28.932 15.310 -36.094 562 HD12 ILE 58 HD12 ILE 58 29.975 15.167 -37.460 563 HD13 ILE 58 HD13 ILE 58 29.970 13.838 -36.285 564 H ARG 59 H ARG 59 30.129 17.881 -32.747 565 HA ARG 59 HA ARG 59 30.925 15.514 -31.115 566 HB2 ARG 59 HB2 ARG 59 30.444 18.166 -29.829 567 HB3 ARG 59 HB3 ARG 59 30.425 16.661 -29.033 568 HG2 ARG 59 HG2 ARG 59 32.930 17.625 -30.533 569 HG3 ARG 59 HG3 ARG 59 32.671 17.786 -28.795 570 HD2 ARG 59 HD2 ARG 59 32.824 15.495 -28.348 571 HD3 ARG 59 HD3 ARG 59 33.118 15.048 -30.033 572 HE ARG 59 HE ARG 59 35.107 16.242 -28.251 573 HH11 ARG 59 HH11 ARG 59 34.336 16.005 -31.720 574 HH12 ARG 59 HH12 ARG 59 35.973 16.111 -32.068 575 HH21 ARG 59 HH21 ARG 59 36.993 16.160 -28.698 576 HH22 ARG 59 HH22 ARG 59 37.497 16.259 -30.380 577 H PHE 60 H PHE 60 29.317 14.542 -30.016 578 HA PHE 60 HA PHE 60 26.544 15.496 -30.398 579 HB2 PHE 60 HB2 PHE 60 27.783 12.739 -30.131 580 HB3 PHE 60 HB3 PHE 60 26.078 13.055 -30.107 581 HD1 PHE 60 HD1 PHE 60 29.144 13.092 -32.190 582 HD2 PHE 60 HD2 PHE 60 24.862 13.145 -32.180 583 HE1 PHE 60 HE1 PHE 60 29.152 12.807 -34.649 584 HE2 PHE 60 HE2 PHE 60 24.893 12.859 -34.614 585 HZ PHE 60 HZ PHE 60 26.987 12.689 -35.878 586 H ARG 61 H ARG 61 25.599 16.175 -28.617 587 HA ARG 61 HA ARG 61 26.674 15.441 -25.946 588 HB2 ARG 61 HB2 ARG 61 25.467 18.187 -26.888 589 HB3 ARG 61 HB3 ARG 61 25.984 17.973 -25.323 590 HG2 ARG 61 HG2 ARG 61 28.275 17.556 -25.946 591 HG3 ARG 61 HG3 ARG 61 27.964 17.936 -27.712 592 HD2 ARG 61 HD2 ARG 61 27.117 20.199 -26.917 593 HD3 ARG 61 HD3 ARG 61 27.544 19.637 -25.289 594 HE ARG 61 HE ARG 61 29.946 19.196 -26.477 595 HH11 ARG 61 HH11 ARG 61 27.893 21.889 -27.096 596 HH12 ARG 61 HH12 ARG 61 29.199 23.016 -27.133 597 HH21 ARG 61 HH21 ARG 61 31.640 20.579 -26.769 598 HH22 ARG 61 HH22 ARG 61 31.336 22.189 -27.138 599 H PHE 62 H PHE 62 25.330 15.256 -24.261 600 HA PHE 62 HA PHE 62 22.596 16.250 -24.496 601 HB2 PHE 62 HB2 PHE 62 22.336 13.905 -25.417 602 HB3 PHE 62 HB3 PHE 62 23.107 13.183 -24.023 603 HD1 PHE 62 HD2 PHE 62 20.192 15.462 -25.040 604 HD2 PHE 62 HD1 PHE 62 21.526 12.125 -22.519 605 HE1 PHE 62 HE2 PHE 62 17.864 15.006 -24.073 606 HE2 PHE 62 HE1 PHE 62 19.321 11.930 -21.529 607 HZ PHE 62 HZ PHE 62 17.479 13.346 -22.443 608 H ASP 63 H ASP 63 22.012 17.221 -22.784 609 HA ASP 63 HA ASP 63 21.788 17.888 -20.742 610 HB2 ASP 63 HB2 ASP 63 21.414 15.445 -19.997 611 HB3 ASP 63 HB3 ASP 63 23.032 15.436 -19.503 612 H GLY 64 H GLY 64 23.783 18.568 -22.283 613 HA2 GLY 64 HA2 GLY 64 25.881 19.831 -22.372 614 HA3 GLY 64 HA3 GLY 64 25.914 19.737 -20.709 615 H GLN 65 H GLN 65 25.650 16.505 -20.964 616 HA GLN 65 HA GLN 65 28.494 16.068 -20.671 617 HB2 GLN 65 HB2 GLN 65 26.236 14.005 -20.987 618 HB3 GLN 65 HB3 GLN 65 27.777 13.721 -20.351 619 HG2 GLN 65 HG2 GLN 65 25.444 15.277 -19.136 620 HG3 GLN 65 HG3 GLN 65 25.991 13.848 -18.497 621 HE21 GLN 65 HE22 GLN 65 26.135 17.156 -18.486 622 HE22 GLN 65 HE21 GLN 65 27.488 17.436 -17.373 623 HA PRO 66 HA PRO 66 28.681 15.250 -25.168 624 HB2 PRO 66 HB2 PRO 66 31.391 14.268 -24.510 625 HB3 PRO 66 HB3 PRO 66 30.835 15.189 -25.898 626 HG2 PRO 66 HG2 PRO 66 31.860 16.594 -23.953 627 HG3 PRO 66 HG3 PRO 66 30.228 17.081 -24.555 628 HD2 PRO 66 HD2 PRO 66 30.880 15.762 -22.010 629 HD3 PRO 66 HD3 PRO 66 29.795 17.094 -22.310 630 H ILE 67 H ILE 67 28.465 13.351 -26.285 631 HA ILE 67 HA ILE 67 28.068 10.904 -24.860 632 HB ILE 67 HB ILE 67 27.501 11.538 -27.754 633 HG12 ILE 67 HG12 ILE 67 26.063 11.333 -25.133 634 HG13 ILE 67 HG13 ILE 67 26.306 12.860 -26.012 635 HG21 ILE 67 HG21 ILE 67 27.810 9.394 -27.921 636 HG22 ILE 67 HG22 ILE 67 26.974 9.125 -26.268 637 HG23 ILE 67 HG23 ILE 67 26.086 9.573 -27.782 638 HD11 ILE 67 HD11 ILE 67 24.645 11.806 -27.839 639 HD12 ILE 67 HD12 ILE 67 24.262 10.656 -26.434 640 HD13 ILE 67 HD13 ILE 67 24.068 12.382 -26.300 641 H ASN 68 H ASN 68 29.314 8.890 -24.941 642 HA ASN 68 HA ASN 68 31.928 8.816 -26.342 643 HB2 ASN 68 HB2 ASN 68 30.680 7.172 -24.102 644 HB3 ASN 68 HB3 ASN 68 32.336 7.026 -24.609 645 HD21 ASN 68 HD22 ASN 68 30.353 8.292 -22.366 646 HD22 ASN 68 HD21 ASN 68 31.387 9.664 -21.763 647 H GLU 69 H GLU 69 32.455 6.791 -27.362 648 HA GLU 69 HA GLU 69 30.239 6.041 -29.182 649 HB2 GLU 69 HB2 GLU 69 32.871 4.473 -28.814 650 HB3 GLU 69 HB3 GLU 69 31.573 4.425 -30.081 651 HG2 GLU 69 HG2 GLU 69 32.057 6.818 -30.688 652 HG3 GLU 69 HG3 GLU 69 33.467 6.882 -29.667 653 H THR 70 H THR 70 31.724 4.573 -26.297 654 HA THR 70 HA THR 70 30.257 2.111 -26.088 655 HB THR 70 HB THR 70 31.227 2.207 -23.547 656 HG1 THR 70 HG1 THR 70 31.051 4.463 -23.502 657 HG21 THR 70 HG21 THR 70 33.490 1.940 -24.024 658 HG22 THR 70 HG22 THR 70 32.631 1.214 -25.313 659 HG23 THR 70 HG23 THR 70 33.376 2.785 -25.615 660 H ASP 71 H ASP 71 29.043 5.380 -25.685 661 HA ASP 71 HA ASP 71 27.090 4.520 -23.525 662 HB2 ASP 71 HB2 ASP 71 27.358 6.894 -25.416 663 HB3 ASP 71 HB3 ASP 71 26.047 6.711 -24.254 664 H THR 72 H THR 72 24.865 4.283 -23.719 665 HA THR 72 HA THR 72 23.615 3.713 -26.352 666 HB THR 72 HB THR 72 22.262 1.736 -25.349 667 HG1 THR 72 HG1 THR 72 24.206 1.832 -23.309 668 HG21 THR 72 HG21 THR 72 25.364 1.366 -25.475 669 HG22 THR 72 HG22 THR 72 24.149 0.089 -25.254 670 HG23 THR 72 HG23 THR 72 24.069 1.039 -26.700 671 HA PRO 73 HA PRO 73 20.170 5.842 -24.379 672 HB2 PRO 73 HB2 PRO 73 18.322 3.620 -24.980 673 HB3 PRO 73 HB3 PRO 73 18.140 5.183 -25.536 674 HG2 PRO 73 HG2 PRO 73 18.985 3.129 -27.073 675 HG3 PRO 73 HG3 PRO 73 19.467 4.848 -27.486 676 HD2 PRO 73 HD2 PRO 73 20.892 2.562 -26.348 677 HD3 PRO 73 HD3 PRO 73 21.564 3.812 -27.220 678 H ALA 74 H ALA 74 20.702 2.361 -23.582 679 HA ALA 74 HA ALA 74 19.367 2.268 -20.978 680 HB1 ALA 74 HB1 ALA 74 20.630 0.380 -20.736 681 HB2 ALA 74 HB2 ALA 74 20.267 0.332 -22.514 682 HB3 ALA 74 HB3 ALA 74 21.861 0.790 -21.857 683 H GLN 75 H GLN 75 22.772 2.977 -21.806 684 HA GLN 75 HA GLN 75 23.598 3.514 -19.134 685 HB2 GLN 75 HB2 GLN 75 25.047 2.966 -20.978 686 HB3 GLN 75 HB3 GLN 75 24.512 4.471 -21.762 687 HG2 GLN 75 HG2 GLN 75 26.734 4.832 -21.037 688 HG3 GLN 75 HG3 GLN 75 25.757 5.939 -20.055 689 HE21 GLN 75 HE22 GLN 75 28.455 5.269 -19.034 690 HE22 GLN 75 HE21 GLN 75 28.216 3.848 -17.946 691 H LEU 76 H LEU 76 22.456 5.775 -21.622 692 HA LEU 76 HA LEU 76 22.774 8.163 -19.899 693 HB2 LEU 76 HB2 LEU 76 21.457 7.907 -22.628 694 HB3 LEU 76 HB3 LEU 76 21.679 9.301 -21.651 695 HG LEU 76 HG LEU 76 23.849 7.500 -22.800 696 HD11 LEU 76 HD11 LEU 76 24.473 9.267 -24.233 697 HD12 LEU 76 HD12 LEU 76 22.816 8.760 -24.459 698 HD13 LEU 76 HD13 LEU 76 23.163 10.266 -23.607 699 HD21 LEU 76 HD21 LEU 76 24.337 9.922 -21.194 700 HD22 LEU 76 HD22 LEU 76 24.867 8.346 -20.704 701 HD23 LEU 76 HD23 LEU 76 25.718 8.949 -22.051 702 H GLU 77 H GLU 77 20.315 5.811 -19.923 703 HA GLU 77 HA GLU 77 18.149 5.776 -19.576 704 HB2 GLU 77 HB2 GLU 77 18.800 7.791 -17.257 705 HB3 GLU 77 HB3 GLU 77 17.292 6.844 -17.507 706 HG2 GLU 77 HG2 GLU 77 19.906 5.553 -16.931 707 HG3 GLU 77 HG3 GLU 77 18.625 5.869 -15.773 708 H MET 78 H MET 78 18.440 6.876 -21.672 709 HA MET 78 HA MET 78 16.912 9.438 -22.255 710 HB2 MET 78 HB2 MET 78 18.226 7.400 -23.965 711 HB3 MET 78 HB3 MET 78 17.085 8.672 -24.621 712 HG2 MET 78 HG2 MET 78 18.686 10.293 -23.297 713 HG3 MET 78 HG3 MET 78 19.611 9.053 -22.943 714 HE1 MET 78 HE1 MET 78 19.089 11.905 -24.989 715 HE2 MET 78 HE2 MET 78 19.637 11.615 -26.604 716 HE3 MET 78 HE3 MET 78 18.128 10.978 -26.211 717 H GLU 79 H GLU 79 14.761 9.306 -23.565 718 HA GLU 79 HA GLU 79 13.329 6.671 -23.453 719 HB2 GLU 79 HB2 GLU 79 12.372 9.174 -22.053 720 HB3 GLU 79 HB3 GLU 79 11.299 7.996 -22.650 721 HG2 GLU 79 HG2 GLU 79 13.460 7.500 -20.666 722 HG3 GLU 79 HG3 GLU 79 11.691 7.844 -20.409 723 H ASP 80 H ASP 80 10.961 7.322 -24.856 724 HA ASP 80 HA ASP 80 11.775 8.171 -27.517 725 HB2 ASP 80 HB2 ASP 80 9.139 8.007 -26.080 726 HB3 ASP 80 HB3 ASP 80 9.185 8.305 -27.725 727 H GLU 81 H GLU 81 11.740 9.903 -28.389 728 HA GLU 81 HA GLU 81 11.735 12.129 -28.916 729 HB2 GLU 81 HB2 GLU 81 9.796 12.804 -26.690 730 HB3 GLU 81 HB3 GLU 81 10.067 13.714 -28.094 731 HG2 GLU 81 HG2 GLU 81 9.323 11.642 -29.477 732 HG3 GLU 81 HG3 GLU 81 8.668 11.123 -27.882 733 H ASP 82 H ASP 82 13.387 11.063 -26.259 734 HA ASP 82 HA ASP 82 14.604 13.635 -25.566 735 HB2 ASP 82 HB2 ASP 82 15.767 10.900 -25.376 736 HB3 ASP 82 HB3 ASP 82 16.373 12.460 -24.855 737 H THR 83 H THR 83 16.323 14.606 -26.508 738 HA THR 83 HA THR 83 17.041 14.066 -29.368 739 HB THR 83 HB THR 83 16.630 16.613 -27.945 740 HG1 THR 83 HG1 THR 83 14.843 15.345 -28.379 741 HG21 THR 83 HG21 THR 83 17.341 16.097 -30.953 742 HG22 THR 83 HG22 THR 83 16.794 17.634 -30.275 743 HG23 THR 83 HG23 THR 83 18.369 16.853 -29.781 744 H ILE 84 H ILE 84 19.071 13.617 -29.759 745 HA ILE 84 HA ILE 84 21.308 14.433 -28.113 746 HB ILE 84 HB ILE 84 21.161 12.764 -30.704 747 HG12 ILE 84 HG12 ILE 84 21.669 12.004 -27.750 748 HG13 ILE 84 HG13 ILE 84 20.170 11.717 -28.575 749 HG21 ILE 84 HG21 ILE 84 23.559 13.525 -28.924 750 HG22 ILE 84 HG22 ILE 84 23.495 12.342 -30.276 751 HG23 ILE 84 HG23 ILE 84 23.249 13.971 -30.635 752 HD11 ILE 84 HD11 ILE 84 22.696 10.120 -29.130 753 HD12 ILE 84 HD12 ILE 84 21.160 9.664 -28.510 754 HD13 ILE 84 HD13 ILE 84 21.330 10.299 -30.171 755 H ASP 85 H ASP 85 22.314 16.256 -28.250 756 HA ASP 85 HA ASP 85 21.734 18.233 -30.396 757 HB2 ASP 85 HB2 ASP 85 23.161 18.442 -27.763 758 HB3 ASP 85 HB3 ASP 85 22.998 19.690 -29.068 759 H VAL 86 H VAL 86 23.173 18.664 -32.020 760 HA VAL 86 HA VAL 86 25.957 17.511 -31.840 761 HB VAL 86 HB VAL 86 24.368 17.811 -34.410 762 HG11 VAL 86 HG11 VAL 86 26.745 18.158 -34.741 763 HG12 VAL 86 HG12 VAL 86 27.115 16.630 -33.978 764 HG13 VAL 86 HG13 VAL 86 26.012 16.678 -35.381 765 HG21 VAL 86 HG21 VAL 86 23.162 16.361 -33.199 766 HG22 VAL 86 HG22 VAL 86 24.074 15.408 -34.258 767 HG23 VAL 86 HG23 VAL 86 24.483 15.566 -32.421 768 H PHE 87 H PHE 87 27.681 18.916 -31.944 769 HA PHE 87 HA PHE 87 27.267 21.742 -32.758 770 HB2 PHE 87 HB2 PHE 87 28.849 20.296 -30.695 771 HB3 PHE 87 HB3 PHE 87 29.341 21.865 -31.177 772 HD1 PHE 87 HD1 PHE 87 26.421 20.017 -29.568 773 HD2 PHE 87 HD2 PHE 87 28.376 23.823 -30.319 774 HE1 PHE 87 HE1 PHE 87 24.866 21.253 -27.894 775 HE2 PHE 87 HE2 PHE 87 27.168 24.877 -28.517 776 HZ PHE 87 HZ PHE 87 25.343 23.574 -27.305 777 H GLN 88 H GLN 88 28.930 22.711 -33.852 778 HA GLN 88 HA GLN 88 30.952 21.147 -35.355 779 HB2 GLN 88 HB2 GLN 88 30.642 24.182 -35.102 780 HB3 GLN 88 HB3 GLN 88 31.827 23.271 -36.021 781 HG2 GLN 88 HG2 GLN 88 29.962 22.416 -37.440 782 HG3 GLN 88 HG3 GLN 88 28.811 23.032 -36.257 783 HE21 GLN 88 HE22 GLN 88 27.709 24.385 -37.948 784 HE22 GLN 88 HE21 GLN 88 28.554 25.827 -38.535 785 H GLN 89 H GLN 89 33.190 21.439 -35.068 786 HA GLN 89 HA GLN 89 34.172 22.527 -32.474 787 HB2 GLN 89 HB2 GLN 89 35.193 20.189 -34.091 788 HB3 GLN 89 HB3 GLN 89 36.014 20.811 -32.636 789 HG2 GLN 89 HG2 GLN 89 33.347 19.410 -32.802 790 HG3 GLN 89 HG3 GLN 89 34.842 18.681 -32.183 791 HE21 GLN 89 HE22 GLN 89 32.591 21.561 -31.085 792 HE22 GLN 89 HE21 GLN 89 33.286 21.382 -29.528 793 H GLN 90 H GLN 90 36.084 23.551 -32.470 794 HA GLN 90 HA GLN 90 37.260 24.205 -35.074 795 HB2 GLN 90 HB2 GLN 90 36.678 26.340 -32.857 796 HB3 GLN 90 HB3 GLN 90 37.240 26.661 -34.422 797 HG2 GLN 90 HG2 GLN 90 35.164 27.167 -34.823 798 HG3 GLN 90 HG3 GLN 90 35.060 25.482 -35.227 799 HE21 GLN 90 HE22 GLN 90 34.252 28.126 -33.019 800 HE22 GLN 90 HE21 GLN 90 32.872 27.284 -32.214 801 H THR 91 H THR 91 39.452 24.279 -35.311 802 HA THR 91 HA THR 91 41.054 23.704 -32.890 803 HB THR 91 HB THR 91 42.180 21.965 -34.468 804 HG1 THR 91 HG1 THR 91 39.626 21.774 -35.663 805 HG21 THR 91 HG21 THR 91 40.319 20.307 -33.635 806 HG22 THR 91 HG22 THR 91 40.834 21.477 -32.342 807 HG23 THR 91 HG23 THR 91 39.385 21.798 -33.176 808 H GLY 92 H GLY 92 42.959 24.765 -32.902 809 HA2 GLY 92 HA2 GLY 92 44.622 26.286 -33.609 810 HA3 GLY 92 HA3 GLY 92 44.479 25.598 -35.208 811 H GLY 93 H GLY 93 45.051 27.850 -35.895 812 HA2 GLY 93 HA2 GLY 93 42.830 29.393 -36.848 813 HA3 GLY 93 HA3 GLY 93 43.423 30.135 -35.387 814 H VAL 94 H VAL 94 43.885 31.906 -36.859 815 HA VAL 94 HA VAL 94 46.181 31.715 -38.833 816 HB VAL 94 HB VAL 94 44.498 33.923 -37.748 817 HG11 VAL 94 HG11 VAL 94 46.738 34.187 -39.888 818 HG12 VAL 94 HG12 VAL 94 45.461 35.344 -39.603 819 HG13 VAL 94 HG13 VAL 94 46.712 34.983 -38.267 820 HG21 VAL 94 HG21 VAL 94 43.808 33.993 -40.006 821 HG22 VAL 94 HG22 VAL 94 44.774 32.505 -40.345 822 HG23 VAL 94 HG23 VAL 94 43.321 32.481 -39.266 823 H TYR 95 H TYR 95 48.296 31.959 -38.249 824 HA TYR 95 HA TYR 95 49.251 32.948 -35.597 825 HB2 TYR 95 HB2 TYR 95 50.014 30.616 -37.452 826 HB3 TYR 95 HB3 TYR 95 51.087 31.105 -36.223 827 HD1 TYR 95 HD1 TYR 95 50.146 31.517 -33.804 828 HD2 TYR 95 HD2 TYR 95 48.512 28.886 -36.789 829 HE1 TYR 95 HE1 TYR 95 48.807 30.135 -32.006 830 HE2 TYR 95 HE2 TYR 95 47.240 27.648 -35.036 831 HH TYR 95 HH TYR 95 46.931 28.528 -31.910 Start of MODEL 8 1 H1 ACE 36 HH32 ACE 36 13.087 15.961 -46.460 2 H2 ACE 36 HH33 ACE 36 11.774 15.537 -47.629 3 H3 ACE 36 HH31 ACE 36 11.391 16.596 -46.276 4 H GLU 37 H GLU 37 10.773 13.878 -47.499 5 HA GLU 37 HA GLU 37 10.058 12.484 -45.144 6 HB2 GLU 37 HB2 GLU 37 9.080 12.134 -47.548 7 HB3 GLU 37 HB3 GLU 37 10.531 11.348 -47.876 8 HG2 GLU 37 HG2 GLU 37 8.607 9.807 -47.400 9 HG3 GLU 37 HG3 GLU 37 9.770 9.628 -46.266 10 H ASP 38 H ASP 38 13.202 12.757 -46.339 11 HA ASP 38 HA ASP 38 14.325 10.196 -45.486 12 HB2 ASP 38 HB2 ASP 38 14.986 11.337 -47.584 13 HB3 ASP 38 HB3 ASP 38 15.843 12.612 -46.550 14 H ALA 39 H ALA 39 13.092 12.336 -43.635 15 HA ALA 39 HA ALA 39 15.353 12.645 -41.866 16 HB1 ALA 39 HB1 ALA 39 12.411 13.353 -41.526 17 HB2 ALA 39 HB2 ALA 39 13.721 13.981 -40.546 18 HB3 ALA 39 HB3 ALA 39 13.690 14.436 -42.212 19 H PHE 40 H PHE 40 14.825 10.015 -42.465 20 HA PHE 40 HA PHE 40 14.122 8.822 -39.825 21 HB2 PHE 40 HB2 PHE 40 12.370 8.795 -41.887 22 HB3 PHE 40 HB3 PHE 40 13.235 7.425 -42.363 23 HD1 PHE 40 HD1 PHE 40 11.211 9.004 -39.789 24 HD2 PHE 40 HD2 PHE 40 13.235 5.322 -40.835 25 HE1 PHE 40 HE1 PHE 40 9.884 7.837 -38.174 26 HE2 PHE 40 HE2 PHE 40 11.894 4.163 -39.075 27 HZ PHE 40 HZ PHE 40 10.296 5.494 -37.606 28 H ILE 41 H ILE 41 15.764 7.777 -39.078 29 HA ILE 41 HA ILE 41 17.227 5.914 -40.844 30 HB ILE 41 HB ILE 41 18.524 7.438 -38.543 31 HG12 ILE 41 HG12 ILE 41 19.864 8.608 -40.457 32 HG13 ILE 41 HG13 ILE 41 18.533 8.161 -41.539 33 HG21 ILE 41 HG21 ILE 41 19.668 5.719 -40.757 34 HG22 ILE 41 HG22 ILE 41 20.518 6.745 -39.678 35 HG23 ILE 41 HG23 ILE 41 19.617 5.461 -38.963 36 HD11 ILE 41 HD11 ILE 41 18.487 9.863 -38.887 37 HD12 ILE 41 HD12 ILE 41 18.736 10.440 -40.515 38 HD13 ILE 41 HD13 ILE 41 17.165 9.805 -40.085 39 H VAL 42 H VAL 42 17.803 3.795 -39.712 40 HA VAL 42 HA VAL 42 16.318 3.238 -37.117 41 HB VAL 42 HB VAL 42 16.171 1.861 -39.736 42 HG11 VAL 42 HG11 VAL 42 14.267 1.576 -37.292 43 HG12 VAL 42 HG12 VAL 42 14.217 0.581 -38.685 44 HG13 VAL 42 HG13 VAL 42 15.642 0.413 -37.638 45 HG21 VAL 42 HG21 VAL 42 13.954 3.517 -38.551 46 HG22 VAL 42 HG22 VAL 42 14.783 3.817 -40.054 47 HG23 VAL 42 HG23 VAL 42 13.762 2.300 -39.925 48 H ILE 43 H ILE 43 17.836 2.411 -35.808 49 HA ILE 43 HA ILE 43 19.835 0.519 -36.918 50 HB ILE 43 HB ILE 43 20.256 3.057 -35.177 51 HG12 ILE 43 HG12 ILE 43 21.324 2.235 -37.858 52 HG13 ILE 43 HG13 ILE 43 19.962 3.347 -37.595 53 HG21 ILE 43 HG21 ILE 43 22.052 0.750 -35.808 54 HG22 ILE 43 HG22 ILE 43 22.535 2.382 -35.124 55 HG23 ILE 43 HG23 ILE 43 21.476 1.355 -34.228 56 HD11 ILE 43 HD11 ILE 43 21.555 4.891 -36.251 57 HD12 ILE 43 HD12 ILE 43 22.880 3.989 -36.592 58 HD13 ILE 43 HD13 ILE 43 22.052 4.683 -37.994 59 H SEP 44 H SEP 44 20.340 -1.215 -36.148 60 HA SEP 44 HA SEP 44 20.345 -1.895 -33.252 61 HB2 SEP 44 HB2 SEP 44 19.111 -3.901 -33.342 62 HB3 SEP 44 HB3 SEP 44 18.189 -2.749 -34.384 63 H ASP 45 H ASP 45 21.719 -3.407 -32.542 64 HA ASP 45 HA ASP 45 24.324 -3.368 -34.082 65 HB2 ASP 45 HB2 ASP 45 24.000 -2.471 -31.849 66 HB3 ASP 45 HB3 ASP 45 23.335 -3.995 -31.190 67 H SEP 46 H SEP 46 21.915 -5.839 -33.139 68 HA SEP 46 HA SEP 46 23.956 -7.797 -33.012 69 HB2 SEP 46 HB2 SEP 46 22.528 -9.262 -32.360 70 HB3 SEP 46 HB3 SEP 46 22.035 -7.860 -31.428 71 H ASP 47 H ASP 47 24.434 -9.517 -34.380 72 HA ASP 47 HA ASP 47 22.556 -10.100 -36.513 73 HB2 ASP 47 HB2 ASP 47 24.240 -8.618 -37.522 74 HB3 ASP 47 HB3 ASP 47 25.588 -9.921 -37.118 75 H GLY 48 H GLY 48 22.387 -12.381 -36.980 76 HA2 GLY 48 HA2 GLY 48 23.893 -14.485 -35.950 77 HA3 GLY 48 HA3 GLY 48 23.135 -13.846 -34.530 78 H GLU 49 H GLU 49 21.521 -15.900 -34.336 79 HA GLU 49 HA GLU 49 19.610 -16.519 -36.564 80 HB2 GLU 49 HB2 GLU 49 20.346 -18.324 -34.869 81 HB3 GLU 49 HB3 GLU 49 19.825 -17.247 -33.530 82 HG2 GLU 49 HG2 GLU 49 18.519 -19.287 -34.063 83 HG3 GLU 49 HG3 GLU 49 17.546 -17.786 -34.034 84 HN1 NH2 50 HN1 NH2 50 17.180 -16.354 -36.018 85 HN2 NH2 50 HN2 NH2 50 16.708 -14.775 -35.494 86 H1 MET 1 H1 MET 1 -14.597 -30.906 -35.389 87 H2 MET 1 H2 MET 1 -14.472 -32.009 -34.112 88 H3 MET 1 H3 MET 1 -13.755 -32.329 -35.540 89 HA MET 1 HA MET 1 -12.834 -30.394 -33.647 90 HB2 MET 1 HB2 MET 1 -11.424 -32.890 -35.030 91 HB3 MET 1 HB3 MET 1 -10.808 -31.821 -33.717 92 HG2 MET 1 HG2 MET 1 -13.093 -33.720 -33.419 93 HG3 MET 1 HG3 MET 1 -11.403 -33.864 -32.777 94 HE1 MET 1 HE1 MET 1 -11.872 -34.246 -30.237 95 HE2 MET 1 HE2 MET 1 -13.396 -33.414 -29.578 96 HE3 MET 1 HE3 MET 1 -13.473 -34.556 -30.843 97 H ALA 2 H ALA 2 -12.729 -28.736 -34.449 98 HA ALA 2 HA ALA 2 -11.902 -28.009 -37.187 99 HB1 ALA 2 HB1 ALA 2 -12.185 -25.708 -36.285 100 HB2 ALA 2 HB2 ALA 2 -13.585 -26.735 -36.071 101 HB3 ALA 2 HB3 ALA 2 -12.504 -26.461 -34.708 102 H ASP 3 H ASP 3 -10.063 -26.589 -37.497 103 HA ASP 3 HA ASP 3 -7.559 -27.222 -35.958 104 HB2 ASP 3 HB2 ASP 3 -7.455 -27.088 -38.323 105 HB3 ASP 3 HB3 ASP 3 -8.038 -25.323 -38.200 106 H GLU 4 H GLU 4 -6.542 -25.905 -34.553 107 HA GLU 4 HA GLU 4 -7.741 -23.299 -34.254 108 HB2 GLU 4 HB2 GLU 4 -9.252 -24.255 -32.880 109 HB3 GLU 4 HB3 GLU 4 -8.282 -25.447 -32.250 110 HG2 GLU 4 HG2 GLU 4 -8.706 -24.002 -30.563 111 HG3 GLU 4 HG3 GLU 4 -6.993 -23.770 -30.988 112 H LYS 5 H LYS 5 -6.134 -21.948 -33.678 113 HA LYS 5 HA LYS 5 -3.982 -22.700 -32.004 114 HB2 LYS 5 HB2 LYS 5 -2.751 -22.747 -34.074 115 HB3 LYS 5 HB3 LYS 5 -3.280 -21.040 -34.388 116 HG2 LYS 5 HG2 LYS 5 -1.902 -20.339 -32.669 117 HG3 LYS 5 HG3 LYS 5 -1.457 -22.017 -32.264 118 HD2 LYS 5 HD2 LYS 5 -0.648 -22.033 -34.793 119 HD3 LYS 5 HD3 LYS 5 -0.767 -20.291 -34.716 120 HE2 LYS 5 HE2 LYS 5 0.883 -22.243 -33.019 121 HE3 LYS 5 HE3 LYS 5 1.533 -21.476 -34.457 122 HZ1 LYS 5 HZ1 LYS 5 0.507 -20.249 -31.940 123 HZ2 LYS 5 HZ2 LYS 5 2.067 -20.405 -32.503 124 HZ3 LYS 5 HZ3 LYS 5 1.053 -19.361 -33.255 125 HA PRO 6 HA PRO 6 -5.197 -18.772 -29.851 126 HB2 PRO 6 HB2 PRO 6 -3.856 -18.864 -27.760 127 HB3 PRO 6 HB3 PRO 6 -5.217 -20.067 -28.046 128 HG2 PRO 6 HG2 PRO 6 -2.303 -20.619 -28.619 129 HG3 PRO 6 HG3 PRO 6 -3.493 -21.612 -27.595 130 HD2 PRO 6 HD2 PRO 6 -2.968 -22.192 -30.166 131 HD3 PRO 6 HD3 PRO 6 -4.607 -22.495 -29.550 132 H LYS 7 H LYS 7 -4.097 -16.807 -29.691 133 HA LYS 7 HA LYS 7 -2.187 -16.037 -31.465 134 HB2 LYS 7 HB2 LYS 7 -3.579 -14.477 -30.186 135 HB3 LYS 7 HB3 LYS 7 -2.474 -14.588 -28.813 136 HG2 LYS 7 HG2 LYS 7 -0.628 -13.911 -30.456 137 HG3 LYS 7 HG3 LYS 7 -2.030 -13.748 -31.687 138 HD2 LYS 7 HD2 LYS 7 -2.984 -12.054 -30.557 139 HD3 LYS 7 HD3 LYS 7 -2.101 -12.303 -29.058 140 HE2 LYS 7 HE2 LYS 7 0.017 -11.489 -30.027 141 HE3 LYS 7 HE3 LYS 7 -0.870 -11.262 -31.598 142 HZ1 LYS 7 HZ1 LYS 7 -1.616 -9.801 -29.187 143 HZ2 LYS 7 HZ2 LYS 7 -0.500 -9.280 -30.243 144 HZ3 LYS 7 HZ3 LYS 7 -2.123 -9.526 -30.617 145 H GLU 8 H GLU 8 -0.056 -15.679 -31.554 146 HA GLU 8 HA GLU 8 1.787 -17.390 -30.131 147 HB2 GLU 8 HB2 GLU 8 2.640 -16.756 -32.313 148 HB3 GLU 8 HB3 GLU 8 2.548 -15.068 -31.908 149 HG2 GLU 8 HG2 GLU 8 4.737 -16.059 -31.829 150 HG3 GLU 8 HG3 GLU 8 4.368 -15.351 -30.345 151 H GLY 9 H GLY 9 2.770 -17.012 -28.263 152 HA2 GLY 9 HA2 GLY 9 2.228 -14.522 -26.572 153 HA3 GLY 9 HA3 GLY 9 2.600 -16.040 -25.881 154 H VAL 10 H VAL 10 5.038 -16.379 -27.890 155 HA VAL 10 HA VAL 10 6.707 -14.188 -26.770 156 HB VAL 10 HB VAL 10 7.355 -17.140 -26.320 157 HG11 VAL 10 HG11 VAL 10 9.435 -15.568 -26.315 158 HG12 VAL 10 HG12 VAL 10 8.543 -14.618 -25.041 159 HG13 VAL 10 HG13 VAL 10 9.013 -16.278 -24.712 160 HG21 VAL 10 HG21 VAL 10 7.020 -16.816 -23.887 161 HG22 VAL 10 HG22 VAL 10 6.373 -15.263 -24.174 162 HG23 VAL 10 HG23 VAL 10 5.607 -16.763 -24.914 163 H LYS 11 H LYS 11 7.876 -13.266 -28.346 164 HA LYS 11 HA LYS 11 9.689 -15.048 -29.715 165 HB2 LYS 11 HB2 LYS 11 7.934 -15.193 -31.227 166 HB3 LYS 11 HB3 LYS 11 7.651 -13.422 -31.274 167 HG2 LYS 11 HG2 LYS 11 9.959 -13.146 -32.276 168 HG3 LYS 11 HG3 LYS 11 10.083 -14.870 -32.240 169 HD2 LYS 11 HD2 LYS 11 7.824 -15.043 -33.583 170 HD3 LYS 11 HD3 LYS 11 7.880 -13.369 -33.895 171 HE2 LYS 11 HE2 LYS 11 10.181 -13.721 -34.929 172 HE3 LYS 11 HE3 LYS 11 9.955 -15.459 -34.573 173 HZ1 LYS 11 HZ1 LYS 11 9.391 -14.845 -36.829 174 HZ2 LYS 11 HZ2 LYS 11 8.098 -15.568 -35.992 175 HZ3 LYS 11 HZ3 LYS 11 8.081 -14.026 -36.309 176 H THR 12 H THR 12 11.780 -14.026 -30.137 177 HA THR 12 HA THR 12 12.809 -11.732 -29.046 178 HB THR 12 HB THR 12 14.245 -11.510 -31.133 179 HG1 THR 12 HG1 THR 12 13.276 -12.430 -32.696 180 HG21 THR 12 HG21 THR 12 14.698 -13.004 -29.142 181 HG22 THR 12 HG22 THR 12 14.022 -14.316 -30.069 182 HG23 THR 12 HG23 THR 12 15.479 -13.349 -30.637 183 H GLU 13 H GLU 13 11.009 -11.415 -32.050 184 HA GLU 13 HA GLU 13 11.424 -8.602 -32.147 185 HB2 GLU 13 HB2 GLU 13 9.208 -10.064 -33.451 186 HB3 GLU 13 HB3 GLU 13 10.018 -8.597 -33.996 187 HG2 GLU 13 HG2 GLU 13 11.043 -11.466 -33.919 188 HG3 GLU 13 HG3 GLU 13 10.824 -10.547 -35.395 189 H ASN 14 H ASN 14 9.284 -10.082 -29.856 190 HA ASN 14 HA ASN 14 7.207 -7.904 -29.724 191 HB2 ASN 14 HB2 ASN 14 8.161 -9.975 -27.786 192 HB3 ASN 14 HB3 ASN 14 6.683 -8.979 -27.649 193 HD21 ASN 14 HD22 ASN 14 5.557 -9.576 -30.293 194 HD22 ASN 14 HD21 ASN 14 5.039 -11.206 -29.998 195 H ASN 15 H ASN 15 10.416 -7.750 -29.295 196 HA ASN 15 HA ASN 15 10.420 -6.224 -26.740 197 HB2 ASN 15 HB2 ASN 15 12.567 -7.553 -27.397 198 HB3 ASN 15 HB3 ASN 15 12.573 -6.718 -28.863 199 HD21 ASN 15 HD22 ASN 15 13.359 -4.721 -28.977 200 HD22 ASN 15 HD21 ASN 15 14.201 -3.943 -27.564 201 H ASP 16 H ASP 16 10.475 -3.982 -26.333 202 HA ASP 16 HA ASP 16 9.268 -2.477 -28.423 203 HB2 ASP 16 HB2 ASP 16 9.990 -1.334 -25.754 204 HB3 ASP 16 HB3 ASP 16 8.982 -0.606 -26.886 205 H HIS 17 H HIS 17 9.908 -0.856 -29.579 206 HA HIS 17 HA HIS 17 12.752 -0.085 -29.797 207 HB2 HIS 17 HB2 HIS 17 10.474 0.780 -31.489 208 HB3 HIS 17 HB3 HIS 17 12.075 1.421 -31.495 209 HD2 HIS 17 HD2 HIS 17 13.954 -0.802 -31.769 210 HE1 HIS 17 HE1 HIS 17 11.345 -2.578 -34.624 211 HE2 HIS 17 HE2 HIS 17 13.758 -2.531 -33.853 212 H ILE 18 H ILE 18 13.651 1.984 -29.271 213 HA ILE 18 HA ILE 18 11.697 3.932 -28.174 214 HB ILE 18 HB ILE 18 13.414 3.291 -26.594 215 HG12 ILE 18 HG12 ILE 18 14.499 5.855 -27.778 216 HG13 ILE 18 HG13 ILE 18 13.020 5.763 -26.871 217 HG21 ILE 18 HG21 ILE 18 15.060 2.167 -28.147 218 HG22 ILE 18 HG22 ILE 18 15.243 3.790 -28.949 219 HG23 ILE 18 HG23 ILE 18 15.930 3.370 -27.356 220 HD11 ILE 18 HD11 ILE 18 14.469 6.173 -25.186 221 HD12 ILE 18 HD12 ILE 18 14.512 4.373 -25.156 222 HD13 ILE 18 HD13 ILE 18 15.866 5.257 -25.776 223 H ASN 19 H ASN 19 11.566 5.944 -29.162 224 HA ASN 19 HA ASN 19 13.219 6.509 -31.631 225 HB2 ASN 19 HB2 ASN 19 10.590 7.745 -30.852 226 HB3 ASN 19 HB3 ASN 19 11.466 7.780 -32.409 227 HD21 ASN 19 HD22 ASN 19 8.999 7.052 -32.876 228 HD22 ASN 19 HD21 ASN 19 8.843 5.372 -33.076 229 H LEU 20 H LEU 20 14.654 8.002 -31.575 230 HA LEU 20 HA LEU 20 14.722 10.082 -29.513 231 HB2 LEU 20 HB2 LEU 20 16.934 8.266 -30.565 232 HB3 LEU 20 HB3 LEU 20 17.310 9.792 -29.629 233 HG LEU 20 HG LEU 20 15.878 7.288 -28.808 234 HD11 LEU 20 HD11 LEU 20 18.165 8.273 -27.239 235 HD12 LEU 20 HD12 LEU 20 17.742 6.604 -27.771 236 HD13 LEU 20 HD13 LEU 20 18.632 7.770 -28.802 237 HD21 LEU 20 HD21 LEU 20 16.252 9.986 -27.389 238 HD22 LEU 20 HD22 LEU 20 14.766 9.119 -27.615 239 HD23 LEU 20 HD23 LEU 20 15.955 8.494 -26.481 240 H LYS 21 H LYS 21 15.936 12.007 -30.258 241 HA LYS 21 HA LYS 21 16.102 12.417 -33.267 242 HB2 LYS 21 HB2 LYS 21 15.201 14.347 -31.097 243 HB3 LYS 21 HB3 LYS 21 15.479 14.854 -32.725 244 HG2 LYS 21 HG2 LYS 21 13.916 12.823 -33.378 245 HG3 LYS 21 HG3 LYS 21 13.411 12.986 -31.679 246 HD2 LYS 21 HD2 LYS 21 12.873 15.382 -32.238 247 HD3 LYS 21 HD3 LYS 21 13.144 15.161 -33.924 248 HE2 LYS 21 HE2 LYS 21 10.845 15.177 -33.543 249 HE3 LYS 21 HE3 LYS 21 11.248 13.755 -34.344 250 HZ1 LYS 21 HZ1 LYS 21 11.010 13.998 -31.321 251 HZ2 LYS 21 HZ2 LYS 21 9.726 13.434 -32.288 252 HZ3 LYS 21 HZ3 LYS 21 11.036 12.587 -32.140 253 H VAL 22 H VAL 22 17.451 14.048 -33.908 254 HA VAL 22 HA VAL 22 19.828 14.725 -32.272 255 HB VAL 22 HB VAL 22 19.736 13.183 -34.767 256 HG11 VAL 22 HG11 VAL 22 21.995 15.134 -33.934 257 HG12 VAL 22 HG12 VAL 22 22.179 13.867 -35.227 258 HG13 VAL 22 HG13 VAL 22 21.095 15.187 -35.438 259 HG21 VAL 22 HG21 VAL 22 21.696 13.098 -32.479 260 HG22 VAL 22 HG22 VAL 22 20.156 12.183 -32.469 261 HG23 VAL 22 HG23 VAL 22 21.470 11.811 -33.683 262 H ALA 23 H ALA 23 20.222 16.957 -32.498 263 HA ALA 23 HA ALA 23 18.924 18.350 -34.780 264 HB1 ALA 23 HB1 ALA 23 18.401 20.127 -33.000 265 HB2 ALA 23 HB2 ALA 23 17.683 18.608 -32.618 266 HB3 ALA 23 HB3 ALA 23 19.220 19.073 -31.812 267 H GLY 24 H GLY 24 19.846 19.920 -35.827 268 HA2 GLY 24 HA2 GLY 24 22.825 20.563 -35.700 269 HA3 GLY 24 HA3 GLY 24 21.601 20.968 -36.955 270 H GLN 25 H GLN 25 23.313 22.763 -36.092 271 HA GLN 25 HA GLN 25 22.039 24.762 -34.386 272 HB2 GLN 25 HB2 GLN 25 24.858 24.827 -35.678 273 HB3 GLN 25 HB3 GLN 25 24.194 26.041 -34.604 274 HG2 GLN 25 HG2 GLN 25 24.623 23.143 -33.881 275 HG3 GLN 25 HG3 GLN 25 25.786 24.457 -33.618 276 HE21 GLN 25 HE22 GLN 25 24.942 23.068 -31.360 277 HE22 GLN 25 HE21 GLN 25 23.868 24.140 -30.420 278 H ASP 26 H ASP 26 21.907 23.893 -37.602 279 HA ASP 26 HA ASP 26 21.057 26.495 -38.548 280 HB2 ASP 26 HB2 ASP 26 20.583 25.357 -40.568 281 HB3 ASP 26 HB3 ASP 26 22.218 25.165 -39.951 282 H GLY 27 H GLY 27 19.858 24.318 -36.323 283 HA2 GLY 27 HA2 GLY 27 17.788 24.326 -35.306 284 HA3 GLY 27 HA3 GLY 27 17.154 25.278 -36.717 285 H SER 28 H SER 28 18.616 23.004 -38.349 286 HA SER 28 HA SER 28 16.296 21.359 -38.931 287 HB2 SER 28 HB2 SER 28 17.640 20.235 -40.519 288 HB3 SER 28 HB3 SER 28 18.036 21.936 -40.522 289 HG SER 28 HG SER 28 19.950 21.496 -39.354 290 H VAL 29 H VAL 29 16.113 19.067 -38.899 291 HA VAL 29 HA VAL 29 17.415 17.823 -36.512 292 HB VAL 29 HB VAL 29 14.412 17.960 -36.862 293 HG11 VAL 29 HG11 VAL 29 15.814 17.416 -34.196 294 HG12 VAL 29 HG12 VAL 29 14.064 17.419 -34.855 295 HG13 VAL 29 HG13 VAL 29 15.214 16.202 -35.367 296 HG21 VAL 29 HG21 VAL 29 14.134 19.527 -35.297 297 HG22 VAL 29 HG22 VAL 29 15.925 19.949 -35.123 298 HG23 VAL 29 HG23 VAL 29 14.929 20.251 -36.520 299 H VAL 30 H VAL 30 17.271 15.307 -36.423 300 HA VAL 30 HA VAL 30 15.365 13.981 -38.176 301 HB VAL 30 HB VAL 30 17.007 12.219 -38.794 302 HG11 VAL 30 HG11 VAL 30 16.750 13.889 -40.630 303 HG12 VAL 30 HG12 VAL 30 18.122 14.806 -39.907 304 HG13 VAL 30 HG13 VAL 30 18.341 13.194 -40.621 305 HG21 VAL 30 HG21 VAL 30 19.445 13.770 -37.763 306 HG22 VAL 30 HG22 VAL 30 18.446 12.632 -36.825 307 HG23 VAL 30 HG23 VAL 30 19.370 12.240 -38.356 308 H GLN 31 H GLN 31 15.101 11.822 -37.712 309 HA GLN 31 HA GLN 31 14.722 11.256 -34.874 310 HB2 GLN 31 HB2 GLN 31 12.754 12.020 -36.144 311 HB3 GLN 31 HB3 GLN 31 12.901 10.454 -37.033 312 HG2 GLN 31 HG2 GLN 31 12.542 9.261 -34.918 313 HG3 GLN 31 HG3 GLN 31 12.643 10.830 -34.063 314 HE21 GLN 31 HE22 GLN 31 10.440 8.695 -35.327 315 HE22 GLN 31 HE21 GLN 31 8.995 9.598 -34.987 316 H PHE 32 H PHE 32 15.673 9.449 -34.217 317 HA PHE 32 HA PHE 32 16.148 7.266 -36.128 318 HB2 PHE 32 HB2 PHE 32 17.683 7.621 -33.535 319 HB3 PHE 32 HB3 PHE 32 17.837 6.256 -34.677 320 HD1 PHE 32 HD1 PHE 32 18.496 10.032 -34.334 321 HD2 PHE 32 HD2 PHE 32 19.261 6.278 -36.299 322 HE1 PHE 32 HE1 PHE 32 20.334 11.053 -35.639 323 HE2 PHE 32 HE2 PHE 32 21.069 7.222 -37.533 324 HZ PHE 32 HZ PHE 32 21.696 9.651 -37.251 325 H LYS 33 H LYS 33 15.422 5.317 -35.821 326 HA LYS 33 HA LYS 33 13.790 4.587 -33.455 327 HB2 LYS 33 HB2 LYS 33 12.443 4.619 -35.598 328 HB3 LYS 33 HB3 LYS 33 13.652 3.746 -36.407 329 HG2 LYS 33 HG2 LYS 33 13.177 1.665 -35.008 330 HG3 LYS 33 HG3 LYS 33 12.133 2.543 -34.073 331 HD2 LYS 33 HD2 LYS 33 10.594 3.099 -35.962 332 HD3 LYS 33 HD3 LYS 33 11.618 2.084 -37.083 333 HE2 LYS 33 HE2 LYS 33 11.397 0.231 -35.278 334 HE3 LYS 33 HE3 LYS 33 10.270 1.211 -34.441 335 HZ1 LYS 33 HZ1 LYS 33 9.001 1.188 -36.899 336 HZ2 LYS 33 HZ2 LYS 33 9.941 -0.092 -37.123 337 HZ3 LYS 33 HZ3 LYS 33 9.059 -0.176 -35.881 338 H ILE 34 H ILE 34 14.878 3.261 -32.136 339 HA ILE 34 HA ILE 34 16.943 1.357 -33.054 340 HB ILE 34 HB ILE 34 18.602 2.298 -31.460 341 HG12 ILE 34 HG12 ILE 34 16.697 4.611 -31.201 342 HG13 ILE 34 HG13 ILE 34 16.865 3.301 -30.048 343 HG21 ILE 34 HG21 ILE 34 18.144 2.874 -34.004 344 HG22 ILE 34 HG22 ILE 34 17.740 4.472 -33.322 345 HG23 ILE 34 HG23 ILE 34 19.387 3.862 -33.054 346 HD11 ILE 34 HD11 ILE 34 18.366 4.856 -29.098 347 HD12 ILE 34 HD12 ILE 34 19.520 4.076 -30.127 348 HD13 ILE 34 HD13 ILE 34 18.736 5.518 -30.761 349 H LYS 35 H LYS 35 17.812 0.005 -31.700 350 HA LYS 35 HA LYS 35 15.938 -0.869 -29.470 351 HB2 LYS 35 HB2 LYS 35 18.220 -2.041 -31.003 352 HB3 LYS 35 HB3 LYS 35 18.016 -2.739 -29.429 353 HG2 LYS 35 HG2 LYS 35 15.434 -3.096 -30.155 354 HG3 LYS 35 HG3 LYS 35 15.915 -2.548 -31.698 355 HD2 LYS 35 HD2 LYS 35 17.542 -4.323 -31.985 356 HD3 LYS 35 HD3 LYS 35 17.528 -4.873 -30.346 357 HE2 LYS 35 HE2 LYS 35 15.322 -5.866 -30.734 358 HE3 LYS 35 HE3 LYS 35 15.255 -5.337 -32.324 359 HZ1 LYS 35 HZ1 LYS 35 17.120 -6.532 -32.919 360 HZ2 LYS 35 HZ2 LYS 35 17.578 -7.051 -31.455 361 HZ3 LYS 35 HZ3 LYS 35 16.191 -7.584 -32.195 362 H ARG 36 H ARG 36 16.337 -0.862 -27.374 363 HA ARG 36 HA ARG 36 17.367 1.591 -26.491 364 HB2 ARG 36 HB2 ARG 36 15.289 0.402 -25.642 365 HB3 ARG 36 HB3 ARG 36 16.358 -0.624 -24.656 366 HG2 ARG 36 HG2 ARG 36 17.211 1.522 -23.449 367 HG3 ARG 36 HG3 ARG 36 16.167 2.393 -24.494 368 HD2 ARG 36 HD2 ARG 36 15.064 2.238 -22.423 369 HD3 ARG 36 HD3 ARG 36 14.155 1.194 -23.414 370 HE ARG 36 HE ARG 36 15.060 -0.676 -22.459 371 HH11 ARG 36 HH11 ARG 36 16.055 2.225 -20.530 372 HH12 ARG 36 HH12 ARG 36 16.620 1.127 -19.301 373 HH21 ARG 36 HH21 ARG 36 16.049 -1.799 -20.810 374 HH22 ARG 36 HH22 ARG 36 16.953 -0.877 -19.605 375 H HIS 37 H HIS 37 18.851 -1.499 -26.358 376 HA HIS 37 HA HIS 37 21.277 -0.485 -24.998 377 HB2 HIS 37 HB2 HIS 37 21.916 -2.920 -24.932 378 HB3 HIS 37 HB3 HIS 37 20.398 -2.671 -24.213 379 HD2 HIS 37 HD2 HIS 37 21.759 -5.224 -25.818 380 HE1 HIS 37 HE1 HIS 37 18.069 -5.023 -27.851 381 HE2 HIS 37 HE2 HIS 37 20.218 -6.411 -27.571 382 H THR 38 H THR 38 20.473 -0.371 -28.164 383 HA THR 38 HA THR 38 22.883 -1.126 -29.562 384 HB THR 38 HB THR 38 20.804 1.076 -29.932 385 HG1 THR 38 HG1 THR 38 20.910 -1.401 -30.304 386 HG21 THR 38 HG21 THR 38 21.549 1.289 -32.224 387 HG22 THR 38 HG22 THR 38 22.597 2.049 -31.135 388 HG23 THR 38 HG23 THR 38 23.098 0.412 -31.876 389 HA PRO 39 HA PRO 39 25.514 2.225 -27.744 390 HB2 PRO 39 HB2 PRO 39 27.659 2.084 -29.513 391 HB3 PRO 39 HB3 PRO 39 27.343 1.091 -28.084 392 HG2 PRO 39 HG2 PRO 39 26.737 0.490 -31.091 393 HG3 PRO 39 HG3 PRO 39 27.398 -0.638 -29.884 394 HD2 PRO 39 HD2 PRO 39 24.805 -0.696 -30.586 395 HD3 PRO 39 HD3 PRO 39 25.343 -1.025 -28.837 396 H LEU 40 H LEU 40 25.501 4.370 -28.093 397 HA LEU 40 HA LEU 40 24.178 5.584 -30.290 398 HB2 LEU 40 HB2 LEU 40 25.946 6.889 -28.220 399 HB3 LEU 40 HB3 LEU 40 24.948 7.730 -29.379 400 HG LEU 40 HG LEU 40 23.694 5.676 -27.529 401 HD11 LEU 40 HD11 LEU 40 24.123 8.729 -27.072 402 HD12 LEU 40 HD12 LEU 40 23.067 7.613 -26.090 403 HD13 LEU 40 HD13 LEU 40 24.868 7.577 -26.077 404 HD21 LEU 40 HD21 LEU 40 22.641 8.035 -29.130 405 HD22 LEU 40 HD22 LEU 40 22.078 6.371 -29.229 406 HD23 LEU 40 HD23 LEU 40 21.780 7.404 -27.747 407 H SER 41 H SER 41 27.397 4.298 -30.568 408 HA SER 41 HA SER 41 28.913 6.178 -31.871 409 HB2 SER 41 HB2 SER 41 30.101 4.164 -32.721 410 HB3 SER 41 HB3 SER 41 29.863 4.198 -30.977 411 HG SER 41 HG SER 41 29.401 2.317 -31.650 412 H LYS 42 H LYS 42 26.825 3.467 -32.970 413 HA LYS 42 HA LYS 42 26.705 3.544 -35.830 414 HB2 LYS 42 HB2 LYS 42 24.554 2.858 -33.982 415 HB3 LYS 42 HB3 LYS 42 24.486 2.542 -35.705 416 HG2 LYS 42 HG2 LYS 42 26.566 1.262 -35.626 417 HG3 LYS 42 HG3 LYS 42 26.828 1.664 -33.876 418 HD2 LYS 42 HD2 LYS 42 24.810 0.416 -33.315 419 HD3 LYS 42 HD3 LYS 42 24.641 -0.183 -35.005 420 HE2 LYS 42 HE2 LYS 42 27.211 -0.657 -33.355 421 HE3 LYS 42 HE3 LYS 42 26.011 -1.904 -33.545 422 HZ1 LYS 42 HZ1 LYS 42 27.649 -2.298 -35.004 423 HZ2 LYS 42 HZ2 LYS 42 26.241 -2.186 -35.751 424 HZ3 LYS 42 HZ3 LYS 42 27.317 -1.009 -35.932 425 H LEU 43 H LEU 43 24.790 5.429 -33.548 426 HA LEU 43 HA LEU 43 23.205 6.770 -35.661 427 HB2 LEU 43 HB2 LEU 43 23.547 7.333 -32.617 428 HB3 LEU 43 HB3 LEU 43 22.666 8.421 -33.800 429 HG LEU 43 HG LEU 43 21.141 6.434 -34.130 430 HD11 LEU 43 HD11 LEU 43 23.031 5.280 -32.122 431 HD12 LEU 43 HD12 LEU 43 21.329 4.714 -32.133 432 HD13 LEU 43 HD13 LEU 43 22.323 4.570 -33.553 433 HD21 LEU 43 HD21 LEU 43 20.853 7.119 -31.272 434 HD22 LEU 43 HD22 LEU 43 20.578 8.315 -32.555 435 HD23 LEU 43 HD23 LEU 43 19.720 6.762 -32.509 436 H MET 44 H MET 44 26.021 7.712 -33.609 437 HA MET 44 HA MET 44 26.073 10.303 -34.400 438 HB2 MET 44 HB2 MET 44 27.851 8.354 -33.086 439 HB3 MET 44 HB3 MET 44 28.631 9.874 -33.529 440 HG2 MET 44 HG2 MET 44 26.822 11.074 -32.411 441 HG3 MET 44 HG3 MET 44 26.198 9.586 -31.749 442 HE1 MET 44 HE1 MET 44 29.474 8.304 -31.160 443 HE2 MET 44 HE2 MET 44 29.480 8.590 -29.432 444 HE3 MET 44 HE3 MET 44 28.016 7.918 -30.209 445 H LYS 45 H LYS 45 27.510 7.470 -35.726 446 HA LYS 45 HA LYS 45 29.100 8.803 -37.806 447 HB2 LYS 45 HB2 LYS 45 27.999 5.960 -37.440 448 HB3 LYS 45 HB3 LYS 45 29.077 6.381 -38.808 449 HG2 LYS 45 HG2 LYS 45 31.002 6.578 -37.382 450 HG3 LYS 45 HG3 LYS 45 29.906 6.515 -35.915 451 HD2 LYS 45 HD2 LYS 45 29.388 4.275 -36.419 452 HD3 LYS 45 HD3 LYS 45 30.358 4.241 -37.992 453 HE2 LYS 45 HE2 LYS 45 32.398 4.852 -36.522 454 HE3 LYS 45 HE3 LYS 45 31.324 4.725 -35.153 455 HZ1 LYS 45 HZ1 LYS 45 30.998 2.249 -35.848 456 HZ2 LYS 45 HZ2 LYS 45 32.154 2.514 -36.938 457 HZ3 LYS 45 HZ3 LYS 45 32.578 2.687 -35.484 458 H ALA 46 H ALA 46 25.958 7.028 -37.882 459 HA ALA 46 HA ALA 46 25.547 7.157 -40.677 460 HB1 ALA 46 HB1 ALA 46 23.739 7.113 -38.304 461 HB2 ALA 46 HB2 ALA 46 23.169 6.765 -39.993 462 HB3 ALA 46 HB3 ALA 46 24.460 5.804 -39.085 463 H TYR 47 H TYR 47 24.695 9.414 -38.230 464 HA TYR 47 HA TYR 47 23.721 11.620 -39.929 465 HB2 TYR 47 HB2 TYR 47 23.230 11.494 -37.445 466 HB3 TYR 47 HB3 TYR 47 24.923 11.721 -37.158 467 HD1 TYR 47 HD2 TYR 47 25.780 14.058 -37.634 468 HD2 TYR 47 HD1 TYR 47 21.587 13.248 -38.278 469 HE1 TYR 47 HE2 TYR 47 25.176 16.534 -37.293 470 HE2 TYR 47 HE1 TYR 47 21.096 15.666 -38.090 471 HH TYR 47 HH TYR 47 21.980 17.669 -37.959 472 H CYS 48 H CYS 48 26.945 11.016 -38.664 473 HA CYS 48 HA CYS 48 28.099 13.392 -39.819 474 HB2 CYS 48 HB2 CYS 48 28.881 11.908 -37.977 475 HB3 CYS 48 HB3 CYS 48 29.734 10.849 -39.161 476 HG CYS 48 HG CYS 48 31.088 12.974 -40.347 477 H GLU 49 H GLU 49 28.241 10.075 -41.056 478 HA GLU 49 HA GLU 49 29.051 10.437 -43.712 479 HB2 GLU 49 HB2 GLU 49 27.113 8.524 -42.375 480 HB3 GLU 49 HB3 GLU 49 27.376 8.426 -44.124 481 HG2 GLU 49 HG2 GLU 49 29.714 8.217 -43.729 482 HG3 GLU 49 HG3 GLU 49 29.528 8.170 -42.027 483 H ARG 50 H ARG 50 25.493 10.798 -42.556 484 HA ARG 50 HA ARG 50 24.561 11.576 -45.077 485 HB2 ARG 50 HB2 ARG 50 23.819 12.162 -42.281 486 HB3 ARG 50 HB3 ARG 50 22.985 13.099 -43.497 487 HG2 ARG 50 HG2 ARG 50 22.027 11.519 -44.420 488 HG3 ARG 50 HG3 ARG 50 22.998 10.128 -43.805 489 HD2 ARG 50 HD2 ARG 50 22.019 10.219 -41.579 490 HD3 ARG 50 HD3 ARG 50 21.125 11.647 -41.968 491 HE ARG 50 HE ARG 50 20.712 8.927 -42.962 492 HH11 ARG 50 HH11 ARG 50 19.320 12.228 -42.855 493 HH12 ARG 50 HH12 ARG 50 17.961 11.650 -43.739 494 HH21 ARG 50 HH21 ARG 50 19.042 8.395 -44.180 495 HH22 ARG 50 HH22 ARG 50 17.717 9.483 -44.406 496 H GLN 51 H GLN 51 25.815 13.686 -42.440 497 HA GLN 51 HA GLN 51 25.507 16.072 -44.030 498 HB2 GLN 51 HB2 GLN 51 26.898 15.422 -41.459 499 HB3 GLN 51 HB3 GLN 51 26.786 17.127 -42.109 500 HG2 GLN 51 HG2 GLN 51 24.226 15.588 -41.610 501 HG3 GLN 51 HG3 GLN 51 24.953 16.246 -40.250 502 HE21 GLN 51 HE22 GLN 51 23.863 17.576 -43.614 503 HE22 GLN 51 HE21 GLN 51 23.307 18.989 -42.819 504 H GLY 52 H GLY 52 27.913 13.624 -44.008 505 HA2 GLY 52 HA2 GLY 52 29.725 13.412 -45.243 506 HA3 GLY 52 HA3 GLY 52 29.255 15.034 -46.059 507 H LEU 53 H LEU 53 29.569 15.294 -42.770 508 HA LEU 53 HA LEU 53 31.880 17.062 -42.684 509 HB2 LEU 53 HB2 LEU 53 30.034 15.966 -40.508 510 HB3 LEU 53 HB3 LEU 53 31.323 17.153 -40.351 511 HG LEU 53 HG LEU 53 28.698 17.485 -42.062 512 HD11 LEU 53 HD11 LEU 53 28.200 17.365 -39.638 513 HD12 LEU 53 HD12 LEU 53 29.295 18.642 -39.301 514 HD13 LEU 53 HD13 LEU 53 27.824 18.867 -40.390 515 HD21 LEU 53 HD21 LEU 53 30.370 18.732 -42.990 516 HD22 LEU 53 HD22 LEU 53 29.421 19.820 -41.986 517 HD23 LEU 53 HD23 LEU 53 30.894 19.389 -41.240 518 H SER 54 H SER 54 33.747 16.510 -41.288 519 HA SER 54 HA SER 54 34.536 13.701 -40.909 520 HB2 SER 54 HB2 SER 54 36.172 15.417 -41.472 521 HB3 SER 54 HB3 SER 54 35.892 16.309 -39.938 522 HG SER 54 HG SER 54 37.662 14.546 -40.077 523 H MET 55 H MET 55 34.306 12.613 -38.718 524 HA MET 55 HA MET 55 32.925 13.845 -36.478 525 HB2 MET 55 HB2 MET 55 34.747 11.470 -36.902 526 HB3 MET 55 HB3 MET 55 34.144 11.933 -35.252 527 HG2 MET 55 HG2 MET 55 31.869 11.865 -36.188 528 HG3 MET 55 HG3 MET 55 32.518 11.250 -37.696 529 HE1 MET 55 HE1 MET 55 30.673 10.255 -34.511 530 HE2 MET 55 HE2 MET 55 30.329 10.243 -36.274 531 HE3 MET 55 HE3 MET 55 30.449 8.737 -35.266 532 H ARG 56 H ARG 56 36.242 14.155 -37.595 533 HA ARG 56 HA ARG 56 37.383 15.225 -35.101 534 HB2 ARG 56 HB2 ARG 56 38.507 14.442 -37.376 535 HB3 ARG 56 HB3 ARG 56 38.034 16.103 -37.932 536 HG2 ARG 56 HG2 ARG 56 39.342 16.935 -35.936 537 HG3 ARG 56 HG3 ARG 56 39.951 15.287 -35.773 538 HD2 ARG 56 HD2 ARG 56 40.882 15.346 -38.092 539 HD3 ARG 56 HD3 ARG 56 40.234 16.962 -38.366 540 HE ARG 56 HE ARG 56 42.492 16.281 -36.535 541 HH11 ARG 56 HH11 ARG 56 40.127 18.665 -37.201 542 HH12 ARG 56 HH12 ARG 56 41.184 19.967 -36.675 543 HH21 ARG 56 HH21 ARG 56 43.705 17.865 -35.778 544 HH22 ARG 56 HH22 ARG 56 43.345 19.527 -36.154 545 H GLN 57 H GLN 57 34.980 16.535 -37.365 546 HA GLN 57 HA GLN 57 35.666 19.194 -36.483 547 HB2 GLN 57 HB2 GLN 57 35.227 18.740 -38.849 548 HB3 GLN 57 HB3 GLN 57 33.582 18.118 -38.403 549 HG2 GLN 57 HG2 GLN 57 32.819 20.120 -38.026 550 HG3 GLN 57 HG3 GLN 57 34.358 21.008 -38.225 551 HE21 GLN 57 HE22 GLN 57 32.555 21.967 -39.875 552 HE22 GLN 57 HE21 GLN 57 32.766 21.318 -41.480 553 H ILE 58 H ILE 58 33.593 16.769 -35.561 554 HA ILE 58 HA ILE 58 31.775 18.776 -34.161 555 HB ILE 58 HB ILE 58 29.887 17.265 -34.681 556 HG12 ILE 58 HG12 ILE 58 31.645 16.029 -36.647 557 HG13 ILE 58 HG13 ILE 58 31.149 15.053 -35.208 558 HG21 ILE 58 HG21 ILE 58 30.550 19.357 -35.950 559 HG22 ILE 58 HG22 ILE 58 31.320 18.340 -37.079 560 HG23 ILE 58 HG23 ILE 58 29.501 18.338 -36.885 561 HD11 ILE 58 HD11 ILE 58 28.781 15.435 -35.835 562 HD12 ILE 58 HD12 ILE 58 29.328 16.034 -37.372 563 HD13 ILE 58 HD13 ILE 58 29.635 14.341 -36.874 564 H ARG 59 H ARG 59 30.399 17.806 -32.504 565 HA ARG 59 HA ARG 59 31.171 15.236 -31.396 566 HB2 ARG 59 HB2 ARG 59 31.235 17.855 -29.768 567 HB3 ARG 59 HB3 ARG 59 30.885 16.384 -28.967 568 HG2 ARG 59 HG2 ARG 59 33.522 17.061 -30.332 569 HG3 ARG 59 HG3 ARG 59 33.491 17.130 -28.669 570 HD2 ARG 59 HD2 ARG 59 32.921 14.596 -28.600 571 HD3 ARG 59 HD3 ARG 59 33.023 14.618 -30.358 572 HE ARG 59 HE ARG 59 35.273 14.877 -28.493 573 HH11 ARG 59 HH11 ARG 59 34.563 15.460 -31.944 574 HH12 ARG 59 HH12 ARG 59 36.103 14.827 -32.298 575 HH21 ARG 59 HH21 ARG 59 37.214 14.582 -29.107 576 HH22 ARG 59 HH22 ARG 59 37.617 14.617 -30.869 577 H PHE 60 H PHE 60 29.424 14.373 -30.020 578 HA PHE 60 HA PHE 60 26.754 15.649 -30.564 579 HB2 PHE 60 HB2 PHE 60 27.282 12.830 -30.012 580 HB3 PHE 60 HB3 PHE 60 25.729 13.695 -30.145 581 HD1 PHE 60 HD1 PHE 60 29.016 13.154 -32.129 582 HD2 PHE 60 HD2 PHE 60 24.753 13.846 -32.248 583 HE1 PHE 60 HE1 PHE 60 29.039 12.883 -34.520 584 HE2 PHE 60 HE2 PHE 60 24.830 13.309 -34.712 585 HZ PHE 60 HZ PHE 60 26.951 13.053 -35.923 586 H ARG 61 H ARG 61 25.374 15.633 -28.616 587 HA ARG 61 HA ARG 61 26.597 15.225 -25.932 588 HB2 ARG 61 HB2 ARG 61 27.092 17.699 -27.290 589 HB3 ARG 61 HB3 ARG 61 25.541 17.957 -26.776 590 HG2 ARG 61 HG2 ARG 61 26.012 17.454 -24.385 591 HG3 ARG 61 HG3 ARG 61 27.701 17.298 -24.565 592 HD2 ARG 61 HD2 ARG 61 25.973 19.702 -25.074 593 HD3 ARG 61 HD3 ARG 61 27.171 19.502 -23.810 594 HE ARG 61 HE ARG 61 28.700 19.018 -25.945 595 HH11 ARG 61 HH11 ARG 61 26.676 21.727 -25.148 596 HH12 ARG 61 HH12 ARG 61 27.754 22.931 -25.944 597 HH21 ARG 61 HH21 ARG 61 30.272 20.609 -26.601 598 HH22 ARG 61 HH22 ARG 61 29.707 22.274 -26.858 599 H PHE 62 H PHE 62 25.378 14.846 -24.340 600 HA PHE 62 HA PHE 62 22.599 15.546 -24.264 601 HB2 PHE 62 HB2 PHE 62 22.440 13.386 -25.374 602 HB3 PHE 62 HB3 PHE 62 23.342 12.681 -24.007 603 HD1 PHE 62 HD2 PHE 62 20.225 14.456 -25.055 604 HD2 PHE 62 HD1 PHE 62 22.104 12.160 -21.827 605 HE1 PHE 62 HE2 PHE 62 18.076 14.214 -23.986 606 HE2 PHE 62 HE1 PHE 62 19.973 11.835 -20.736 607 HZ PHE 62 HZ PHE 62 17.832 12.680 -21.922 608 H ASP 63 H ASP 63 21.884 15.982 -22.339 609 HA ASP 63 HA ASP 63 21.966 16.483 -20.237 610 HB2 ASP 63 HB2 ASP 63 22.005 13.993 -19.978 611 HB3 ASP 63 HB3 ASP 63 23.775 14.170 -19.545 612 H GLY 64 H GLY 64 23.780 17.771 -21.866 613 HA2 GLY 64 HA2 GLY 64 25.499 19.232 -21.754 614 HA3 GLY 64 HA3 GLY 64 25.671 18.882 -19.974 615 H GLN 65 H GLN 65 26.030 15.943 -21.058 616 HA GLN 65 HA GLN 65 28.977 16.219 -21.029 617 HB2 GLN 65 HB2 GLN 65 27.254 13.739 -20.930 618 HB3 GLN 65 HB3 GLN 65 28.944 13.764 -20.644 619 HG2 GLN 65 HG2 GLN 65 27.093 15.404 -18.714 620 HG3 GLN 65 HG3 GLN 65 27.606 13.697 -18.483 621 HE21 GLN 65 HE22 GLN 65 28.098 15.596 -16.623 622 HE22 GLN 65 HE21 GLN 65 29.842 15.783 -16.505 623 HA PRO 66 HA PRO 66 29.339 14.996 -25.387 624 HB2 PRO 66 HB2 PRO 66 31.867 13.486 -24.867 625 HB3 PRO 66 HB3 PRO 66 31.636 14.859 -25.969 626 HG2 PRO 66 HG2 PRO 66 32.736 14.910 -23.236 627 HG3 PRO 66 HG3 PRO 66 32.194 16.362 -24.305 628 HD2 PRO 66 HD2 PRO 66 31.118 15.348 -21.850 629 HD3 PRO 66 HD3 PRO 66 30.627 16.824 -22.816 630 H ILE 67 H ILE 67 28.953 13.021 -26.501 631 HA ILE 67 HA ILE 67 28.264 10.568 -24.951 632 HB ILE 67 HB ILE 67 27.421 11.479 -27.672 633 HG12 ILE 67 HG12 ILE 67 25.650 10.443 -25.397 634 HG13 ILE 67 HG13 ILE 67 26.172 12.107 -25.437 635 HG21 ILE 67 HG21 ILE 67 27.901 9.259 -28.021 636 HG22 ILE 67 HG22 ILE 67 26.999 8.716 -26.560 637 HG23 ILE 67 HG23 ILE 67 26.160 9.377 -27.922 638 HD11 ILE 67 HD11 ILE 67 23.861 11.458 -26.682 639 HD12 ILE 67 HD12 ILE 67 24.808 12.741 -27.283 640 HD13 ILE 67 HD13 ILE 67 25.015 11.151 -28.045 641 H ASN 68 H ASN 68 29.267 8.896 -24.889 642 HA ASN 68 HA ASN 68 31.754 8.568 -26.362 643 HB2 ASN 68 HB2 ASN 68 30.723 6.821 -24.131 644 HB3 ASN 68 HB3 ASN 68 32.393 7.035 -24.739 645 HD21 ASN 68 HD22 ASN 68 30.010 8.044 -22.613 646 HD22 ASN 68 HD21 ASN 68 30.756 9.328 -21.765 647 H GLU 69 H GLU 69 32.333 6.345 -27.327 648 HA GLU 69 HA GLU 69 30.270 5.482 -29.054 649 HB2 GLU 69 HB2 GLU 69 32.944 4.283 -28.406 650 HB3 GLU 69 HB3 GLU 69 31.961 3.733 -29.812 651 HG2 GLU 69 HG2 GLU 69 32.147 6.361 -30.405 652 HG3 GLU 69 HG3 GLU 69 33.570 6.318 -29.300 653 H THR 70 H THR 70 31.565 4.103 -26.159 654 HA THR 70 HA THR 70 29.863 1.852 -26.026 655 HB THR 70 HB THR 70 30.493 1.558 -23.586 656 HG1 THR 70 HG1 THR 70 31.301 3.649 -23.166 657 HG21 THR 70 HG21 THR 70 32.821 0.736 -24.481 658 HG22 THR 70 HG22 THR 70 31.362 0.029 -25.086 659 HG23 THR 70 HG23 THR 70 32.300 1.343 -25.945 660 H ASP 71 H ASP 71 28.796 5.115 -25.261 661 HA ASP 71 HA ASP 71 26.990 4.460 -23.066 662 HB2 ASP 71 HB2 ASP 71 27.119 6.595 -25.161 663 HB3 ASP 71 HB3 ASP 71 25.972 6.675 -23.815 664 H THR 72 H THR 72 24.957 3.597 -23.368 665 HA THR 72 HA THR 72 23.505 3.566 -26.017 666 HB THR 72 HB THR 72 22.334 1.577 -25.422 667 HG1 THR 72 HG1 THR 72 23.268 0.774 -23.232 668 HG21 THR 72 HG21 THR 72 23.982 -0.155 -24.962 669 HG22 THR 72 HG22 THR 72 24.500 0.979 -26.225 670 HG23 THR 72 HG23 THR 72 25.213 0.939 -24.536 671 HA PRO 73 HA PRO 73 20.204 5.884 -23.920 672 HB2 PRO 73 HB2 PRO 73 18.366 3.897 -24.945 673 HB3 PRO 73 HB3 PRO 73 18.258 5.749 -25.085 674 HG2 PRO 73 HG2 PRO 73 18.912 4.026 -27.125 675 HG3 PRO 73 HG3 PRO 73 19.707 5.690 -26.900 676 HD2 PRO 73 HD2 PRO 73 20.561 2.911 -26.360 677 HD3 PRO 73 HD3 PRO 73 21.492 4.359 -27.009 678 H ALA 74 H ALA 74 20.006 2.347 -23.660 679 HA ALA 74 HA ALA 74 18.784 2.099 -21.004 680 HB1 ALA 74 HB1 ALA 74 19.259 -0.034 -20.926 681 HB2 ALA 74 HB2 ALA 74 18.859 0.275 -22.601 682 HB3 ALA 74 HB3 ALA 74 20.541 -0.052 -22.099 683 H GLN 75 H GLN 75 22.248 2.844 -22.010 684 HA GLN 75 HA GLN 75 23.163 2.884 -19.330 685 HB2 GLN 75 HB2 GLN 75 24.645 2.554 -21.458 686 HB3 GLN 75 HB3 GLN 75 24.561 4.295 -21.591 687 HG2 GLN 75 HG2 GLN 75 26.519 3.776 -20.513 688 HG3 GLN 75 HG3 GLN 75 25.519 4.708 -19.441 689 HE21 GLN 75 HE22 GLN 75 26.781 4.136 -17.698 690 HE22 GLN 75 HE21 GLN 75 26.501 2.616 -16.874 691 H LEU 76 H LEU 76 21.858 5.386 -21.478 692 HA LEU 76 HA LEU 76 22.257 7.457 -19.322 693 HB2 LEU 76 HB2 LEU 76 21.559 7.561 -22.250 694 HB3 LEU 76 HB3 LEU 76 21.841 9.002 -21.175 695 HG LEU 76 HG LEU 76 23.810 7.006 -22.321 696 HD11 LEU 76 HD11 LEU 76 25.046 9.259 -22.855 697 HD12 LEU 76 HD12 LEU 76 23.574 8.740 -23.765 698 HD13 LEU 76 HD13 LEU 76 23.463 9.944 -22.496 699 HD21 LEU 76 HD21 LEU 76 24.518 9.046 -20.185 700 HD22 LEU 76 HD22 LEU 76 24.512 7.373 -19.832 701 HD23 LEU 76 HD23 LEU 76 25.632 8.045 -21.112 702 H GLU 77 H GLU 77 19.845 5.357 -19.686 703 HA GLU 77 HA GLU 77 17.691 5.310 -18.842 704 HB2 GLU 77 HB2 GLU 77 18.550 7.596 -17.003 705 HB3 GLU 77 HB3 GLU 77 17.253 6.448 -16.709 706 HG2 GLU 77 HG2 GLU 77 20.187 5.486 -16.816 707 HG3 GLU 77 HG3 GLU 77 19.317 6.081 -15.429 708 H MET 78 H MET 78 18.184 6.835 -21.045 709 HA MET 78 HA MET 78 16.580 9.123 -21.200 710 HB2 MET 78 HB2 MET 78 17.606 7.141 -23.416 711 HB3 MET 78 HB3 MET 78 16.845 8.693 -23.741 712 HG2 MET 78 HG2 MET 78 18.878 9.813 -22.613 713 HG3 MET 78 HG3 MET 78 19.437 8.150 -22.255 714 HE1 MET 78 HE1 MET 78 17.916 10.083 -25.397 715 HE2 MET 78 HE2 MET 78 19.196 11.047 -24.606 716 HE3 MET 78 HE3 MET 78 19.459 10.353 -26.252 717 H GLU 79 H GLU 79 14.742 9.516 -22.614 718 HA GLU 79 HA GLU 79 12.587 7.320 -22.645 719 HB2 GLU 79 HB2 GLU 79 12.604 10.385 -21.991 720 HB3 GLU 79 HB3 GLU 79 11.229 9.619 -22.508 721 HG2 GLU 79 HG2 GLU 79 12.636 8.893 -19.989 722 HG3 GLU 79 HG3 GLU 79 11.129 9.711 -20.188 723 H ASP 80 H ASP 80 10.937 7.809 -24.311 724 HA ASP 80 HA ASP 80 11.983 8.324 -26.954 725 HB2 ASP 80 HB2 ASP 80 8.929 8.401 -26.176 726 HB3 ASP 80 HB3 ASP 80 9.808 8.022 -27.675 727 H GLU 81 H GLU 81 11.300 9.977 -28.337 728 HA GLU 81 HA GLU 81 11.623 12.166 -28.970 729 HB2 GLU 81 HB2 GLU 81 9.738 12.851 -26.654 730 HB3 GLU 81 HB3 GLU 81 9.993 13.774 -28.104 731 HG2 GLU 81 HG2 GLU 81 9.264 11.715 -29.407 732 HG3 GLU 81 HG3 GLU 81 8.729 11.017 -27.852 733 H ASP 82 H ASP 82 13.386 11.294 -26.212 734 HA ASP 82 HA ASP 82 14.498 13.827 -25.625 735 HB2 ASP 82 HB2 ASP 82 15.803 11.162 -25.387 736 HB3 ASP 82 HB3 ASP 82 16.404 12.859 -24.890 737 H THR 83 H THR 83 16.370 15.045 -26.425 738 HA THR 83 HA THR 83 16.973 14.416 -29.224 739 HB THR 83 HB THR 83 16.227 17.147 -27.949 740 HG1 THR 83 HG1 THR 83 14.660 15.778 -28.532 741 HG21 THR 83 HG21 THR 83 17.257 16.879 -30.858 742 HG22 THR 83 HG22 THR 83 16.531 18.285 -30.041 743 HG23 THR 83 HG23 THR 83 18.058 17.678 -29.437 744 H ILE 84 H ILE 84 18.928 13.939 -29.420 745 HA ILE 84 HA ILE 84 21.143 14.778 -27.715 746 HB ILE 84 HB ILE 84 20.916 13.323 -30.462 747 HG12 ILE 84 HG12 ILE 84 22.012 11.894 -27.999 748 HG13 ILE 84 HG13 ILE 84 20.372 12.283 -27.929 749 HG21 ILE 84 HG21 ILE 84 23.276 14.105 -28.856 750 HG22 ILE 84 HG22 ILE 84 23.292 12.708 -30.057 751 HG23 ILE 84 HG23 ILE 84 22.997 14.369 -30.511 752 HD11 ILE 84 HD11 ILE 84 21.826 10.868 -30.309 753 HD12 ILE 84 HD12 ILE 84 20.768 10.026 -29.253 754 HD13 ILE 84 HD13 ILE 84 20.095 11.294 -30.340 755 H ASP 85 H ASP 85 22.194 16.469 -27.898 756 HA ASP 85 HA ASP 85 21.715 18.394 -30.019 757 HB2 ASP 85 HB2 ASP 85 23.701 18.612 -27.750 758 HB3 ASP 85 HB3 ASP 85 23.003 19.874 -28.698 759 H VAL 86 H VAL 86 23.529 19.538 -31.025 760 HA VAL 86 HA VAL 86 26.033 18.008 -31.398 761 HB VAL 86 HB VAL 86 24.496 18.739 -33.841 762 HG11 VAL 86 HG11 VAL 86 27.419 17.662 -33.535 763 HG12 VAL 86 HG12 VAL 86 26.431 17.401 -34.957 764 HG13 VAL 86 HG13 VAL 86 26.747 18.990 -34.406 765 HG21 VAL 86 HG21 VAL 86 24.750 16.228 -34.255 766 HG22 VAL 86 HG22 VAL 86 25.195 16.092 -32.670 767 HG23 VAL 86 HG23 VAL 86 23.532 16.805 -33.002 768 H PHE 87 H PHE 87 27.839 19.210 -31.567 769 HA PHE 87 HA PHE 87 27.752 21.996 -32.497 770 HB2 PHE 87 HB2 PHE 87 29.179 21.119 -29.902 771 HB3 PHE 87 HB3 PHE 87 29.290 22.641 -30.623 772 HD1 PHE 87 HD1 PHE 87 27.042 20.296 -28.891 773 HD2 PHE 87 HD2 PHE 87 27.767 24.296 -30.095 774 HE1 PHE 87 HE1 PHE 87 25.035 21.047 -27.515 775 HE2 PHE 87 HE2 PHE 87 26.023 25.118 -28.416 776 HZ PHE 87 HZ PHE 87 24.700 23.492 -27.129 777 H GLN 88 H GLN 88 29.872 22.770 -32.930 778 HA GLN 88 HA GLN 88 31.716 20.893 -34.309 779 HB2 GLN 88 HB2 GLN 88 31.617 23.868 -34.333 780 HB3 GLN 88 HB3 GLN 88 32.846 22.877 -35.153 781 HG2 GLN 88 HG2 GLN 88 30.949 21.578 -36.377 782 HG3 GLN 88 HG3 GLN 88 29.921 22.904 -35.919 783 HE21 GLN 88 HE22 GLN 88 30.808 25.086 -36.742 784 HE22 GLN 88 HE21 GLN 88 31.509 24.906 -38.428 785 H GLN 89 H GLN 89 34.056 21.445 -34.167 786 HA GLN 89 HA GLN 89 35.063 22.326 -31.555 787 HB2 GLN 89 HB2 GLN 89 35.520 19.571 -32.839 788 HB3 GLN 89 HB3 GLN 89 36.818 20.226 -31.931 789 HG2 GLN 89 HG2 GLN 89 34.132 20.242 -30.711 790 HG3 GLN 89 HG3 GLN 89 35.298 18.803 -30.676 791 HE21 GLN 89 HE22 GLN 89 34.220 20.982 -28.698 792 HE22 GLN 89 HE21 GLN 89 35.638 21.494 -27.823 793 H GLN 90 H GLN 90 37.112 23.395 -31.643 794 HA GLN 90 HA GLN 90 38.464 23.572 -34.301 795 HB2 GLN 90 HB2 GLN 90 38.311 25.790 -32.245 796 HB3 GLN 90 HB3 GLN 90 38.979 25.835 -33.834 797 HG2 GLN 90 HG2 GLN 90 37.128 26.884 -34.315 798 HG3 GLN 90 HG3 GLN 90 36.651 25.179 -34.685 799 HE21 GLN 90 HE22 GLN 90 34.343 25.194 -33.904 800 HE22 GLN 90 HE21 GLN 90 33.962 25.550 -32.221 801 H THR 91 H THR 91 40.602 23.815 -34.061 802 HA THR 91 HA THR 91 41.970 23.448 -31.443 803 HB THR 91 HB THR 91 43.704 22.029 -32.599 804 HG1 THR 91 HG1 THR 91 43.175 22.449 -34.805 805 HG21 THR 91 HG21 THR 91 42.347 19.999 -32.498 806 HG22 THR 91 HG22 THR 91 41.829 21.129 -31.206 807 HG23 THR 91 HG23 THR 91 40.911 21.027 -32.618 808 H GLY 92 H GLY 92 43.688 24.854 -31.193 809 HA2 GLY 92 HA2 GLY 92 44.509 26.934 -31.226 810 HA3 GLY 92 HA3 GLY 92 45.157 26.543 -32.821 811 H GLY 93 H GLY 93 44.821 28.596 -33.732 812 HA2 GLY 93 HA2 GLY 93 42.045 29.335 -34.641 813 HA3 GLY 93 HA3 GLY 93 42.881 30.145 -33.291 814 H VAL 94 H VAL 94 42.481 32.021 -35.106 815 HA VAL 94 HA VAL 94 44.900 32.063 -36.777 816 HB VAL 94 HB VAL 94 42.253 33.323 -37.071 817 HG11 VAL 94 HG11 VAL 94 44.636 34.019 -38.972 818 HG12 VAL 94 HG12 VAL 94 42.950 34.586 -38.804 819 HG13 VAL 94 HG13 VAL 94 44.183 34.998 -37.592 820 HG21 VAL 94 HG21 VAL 94 42.549 32.287 -39.277 821 HG22 VAL 94 HG22 VAL 94 44.039 31.569 -38.724 822 HG23 VAL 94 HG23 VAL 94 42.549 31.120 -37.891 823 H TYR 95 H TYR 95 46.452 32.795 -35.097 824 HA TYR 95 HA TYR 95 45.781 35.082 -33.329 825 HB2 TYR 95 HB2 TYR 95 48.256 33.305 -33.253 826 HB3 TYR 95 HB3 TYR 95 47.769 34.434 -32.059 827 HD1 TYR 95 HD1 TYR 95 45.446 33.593 -30.434 828 HD2 TYR 95 HD2 TYR 95 47.815 31.060 -33.256 829 HE1 TYR 95 HE1 TYR 95 44.222 31.826 -29.836 830 HE2 TYR 95 HE2 TYR 95 46.644 29.140 -32.228 831 HH TYR 95 HH TYR 95 44.011 29.386 -29.799 Start of MODEL 9 1 H1 ACE 36 HH32 ACE 36 10.990 15.666 -45.366 2 H2 ACE 36 HH33 ACE 36 9.207 15.341 -45.149 3 H3 ACE 36 HH31 ACE 36 10.289 15.732 -43.736 4 H GLU 37 H GLU 37 10.445 13.430 -46.514 5 HA GLU 37 HA GLU 37 9.749 11.367 -44.650 6 HB2 GLU 37 HB2 GLU 37 8.886 12.093 -47.081 7 HB3 GLU 37 HB3 GLU 37 10.124 11.022 -47.666 8 HG2 GLU 37 HG2 GLU 37 8.275 9.576 -47.602 9 HG3 GLU 37 HG3 GLU 37 9.382 9.108 -46.368 10 H ASP 38 H ASP 38 12.664 12.487 -46.100 11 HA ASP 38 HA ASP 38 14.168 10.193 -45.348 12 HB2 ASP 38 HB2 ASP 38 14.805 11.688 -47.329 13 HB3 ASP 38 HB3 ASP 38 15.536 12.705 -46.333 14 H ALA 39 H ALA 39 12.958 12.540 -43.528 15 HA ALA 39 HA ALA 39 14.853 12.887 -41.557 16 HB1 ALA 39 HB1 ALA 39 11.789 12.843 -41.284 17 HB2 ALA 39 HB2 ALA 39 13.050 13.568 -40.174 18 HB3 ALA 39 HB3 ALA 39 12.719 14.147 -41.834 19 H PHE 40 H PHE 40 14.792 10.220 -42.109 20 HA PHE 40 HA PHE 40 14.393 8.811 -39.462 21 HB2 PHE 40 HB2 PHE 40 12.389 8.993 -41.348 22 HB3 PHE 40 HB3 PHE 40 13.310 7.697 -41.971 23 HD1 PHE 40 HD2 PHE 40 13.489 5.549 -40.512 24 HD2 PHE 40 HD1 PHE 40 10.944 8.828 -39.442 25 HE1 PHE 40 HE2 PHE 40 12.195 4.027 -38.947 26 HE2 PHE 40 HE1 PHE 40 9.682 7.445 -37.895 27 HZ PHE 40 HZ PHE 40 10.447 5.015 -37.474 28 H ILE 41 H ILE 41 15.555 7.065 -39.021 29 HA ILE 41 HA ILE 41 17.406 5.676 -40.917 30 HB ILE 41 HB ILE 41 18.459 7.152 -38.498 31 HG12 ILE 41 HG12 ILE 41 20.074 8.273 -40.085 32 HG13 ILE 41 HG13 ILE 41 18.885 7.911 -41.291 33 HG21 ILE 41 HG21 ILE 41 19.593 5.337 -40.709 34 HG22 ILE 41 HG22 ILE 41 20.626 6.215 -39.607 35 HG23 ILE 41 HG23 ILE 41 19.646 5.076 -38.913 36 HD11 ILE 41 HD11 ILE 41 18.904 10.280 -40.261 37 HD12 ILE 41 HD12 ILE 41 17.336 9.502 -39.995 38 HD13 ILE 41 HD13 ILE 41 18.552 9.446 -38.663 39 H VAL 42 H VAL 42 17.570 3.454 -40.279 40 HA VAL 42 HA VAL 42 16.187 2.893 -37.607 41 HB VAL 42 HB VAL 42 15.563 1.324 -40.174 42 HG11 VAL 42 HG11 VAL 42 13.683 0.661 -38.645 43 HG12 VAL 42 HG12 VAL 42 15.261 0.109 -37.979 44 HG13 VAL 42 HG13 VAL 42 14.330 1.435 -37.295 45 HG21 VAL 42 HG21 VAL 42 14.291 3.626 -38.768 46 HG22 VAL 42 HG22 VAL 42 14.772 3.590 -40.441 47 HG23 VAL 42 HG23 VAL 42 13.428 2.512 -39.913 48 H ILE 43 H ILE 43 17.413 1.296 -36.344 49 HA ILE 43 HA ILE 43 19.700 -0.056 -37.513 50 HB ILE 43 HB ILE 43 20.001 2.277 -35.662 51 HG12 ILE 43 HG12 ILE 43 21.508 1.786 -38.280 52 HG13 ILE 43 HG13 ILE 43 20.065 2.721 -38.112 53 HG21 ILE 43 HG21 ILE 43 21.962 0.029 -36.545 54 HG22 ILE 43 HG22 ILE 43 22.649 1.392 -35.890 55 HG23 ILE 43 HG23 ILE 43 21.656 0.570 -34.806 56 HD11 ILE 43 HD11 ILE 43 21.178 4.330 -36.506 57 HD12 ILE 43 HD12 ILE 43 22.694 3.604 -36.755 58 HD13 ILE 43 HD13 ILE 43 21.979 4.149 -38.163 59 H SEP 44 H SEP 44 20.800 -1.584 -36.176 60 HA SEP 44 HA SEP 44 19.855 -2.183 -33.529 61 HB2 SEP 44 HB2 SEP 44 19.171 -4.481 -33.855 62 HB3 SEP 44 HB3 SEP 44 18.207 -3.462 -34.864 63 H ASP 45 H ASP 45 21.113 -4.471 -32.850 64 HA ASP 45 HA ASP 45 23.708 -4.546 -34.073 65 HB2 ASP 45 HB2 ASP 45 24.193 -2.652 -32.499 66 HB3 ASP 45 HB3 ASP 45 23.533 -3.568 -31.217 67 H SEP 46 H SEP 46 22.190 -6.448 -34.254 68 HA SEP 46 HA SEP 46 23.205 -8.592 -32.483 69 HB2 SEP 46 HB2 SEP 46 21.358 -9.687 -31.998 70 HB3 SEP 46 HB3 SEP 46 20.888 -8.028 -31.373 71 H ASP 47 H ASP 47 23.341 -10.569 -33.389 72 HA ASP 47 HA ASP 47 22.509 -11.081 -36.104 73 HB2 ASP 47 HB2 ASP 47 24.508 -9.745 -36.315 74 HB3 ASP 47 HB3 ASP 47 25.435 -10.795 -35.386 75 H GLY 48 H GLY 48 23.410 -13.382 -36.706 76 HA2 GLY 48 HA2 GLY 48 23.412 -15.681 -36.109 77 HA3 GLY 48 HA3 GLY 48 23.256 -15.335 -34.426 78 H GLU 49 H GLU 49 21.822 -17.081 -36.260 79 HA GLU 49 HA GLU 49 19.183 -16.117 -36.459 80 HB2 GLU 49 HB2 GLU 49 20.165 -18.064 -37.700 81 HB3 GLU 49 HB3 GLU 49 20.305 -18.960 -36.260 82 HG2 GLU 49 HG2 GLU 49 18.388 -19.593 -37.921 83 HG3 GLU 49 HG3 GLU 49 17.879 -19.395 -36.312 84 HN1 NH2 50 HN1 NH2 50 17.322 -16.731 -35.189 85 HN2 NH2 50 HN2 NH2 50 17.541 -16.969 -33.431 86 H1 MET 1 H1 MET 1 -13.464 -26.100 -39.998 87 H2 MET 1 H2 MET 1 -13.557 -27.472 -38.956 88 H3 MET 1 H3 MET 1 -12.510 -27.338 -40.166 89 HA MET 1 HA MET 1 -12.650 -25.437 -37.924 90 HB2 MET 1 HB2 MET 1 -10.847 -27.732 -38.389 91 HB3 MET 1 HB3 MET 1 -10.667 -26.504 -36.938 92 HG2 MET 1 HG2 MET 1 -12.617 -28.761 -37.091 93 HG3 MET 1 HG3 MET 1 -11.337 -28.282 -35.936 94 HE1 MET 1 HE1 MET 1 -14.781 -28.982 -35.687 95 HE2 MET 1 HE2 MET 1 -13.536 -29.083 -34.403 96 HE3 MET 1 HE3 MET 1 -14.929 -27.990 -34.210 97 H ALA 2 H ALA 2 -11.272 -23.961 -37.920 98 HA ALA 2 HA ALA 2 -9.822 -22.920 -40.150 99 HB1 ALA 2 HB1 ALA 2 -8.985 -21.399 -38.518 100 HB2 ALA 2 HB2 ALA 2 -10.770 -21.603 -38.340 101 HB3 ALA 2 HB3 ALA 2 -9.626 -22.276 -37.180 102 H ASP 3 H ASP 3 -7.600 -22.907 -40.585 103 HA ASP 3 HA ASP 3 -5.806 -24.766 -39.059 104 HB2 ASP 3 HB2 ASP 3 -5.435 -24.561 -41.368 105 HB3 ASP 3 HB3 ASP 3 -5.477 -22.790 -41.419 106 H GLU 4 H GLU 4 -4.973 -24.111 -37.113 107 HA GLU 4 HA GLU 4 -4.873 -21.170 -36.479 108 HB2 GLU 4 HB2 GLU 4 -7.225 -21.736 -35.950 109 HB3 GLU 4 HB3 GLU 4 -6.783 -23.228 -35.220 110 HG2 GLU 4 HG2 GLU 4 -6.937 -21.933 -33.352 111 HG3 GLU 4 HG3 GLU 4 -5.256 -21.495 -33.608 112 H LYS 5 H LYS 5 -3.054 -20.723 -35.119 113 HA LYS 5 HA LYS 5 -2.508 -22.450 -32.976 114 HB2 LYS 5 HB2 LYS 5 -1.032 -23.414 -34.753 115 HB3 LYS 5 HB3 LYS 5 -0.309 -21.895 -35.145 116 HG2 LYS 5 HG2 LYS 5 0.712 -21.758 -32.930 117 HG3 LYS 5 HG3 LYS 5 -0.152 -23.301 -32.442 118 HD2 LYS 5 HD2 LYS 5 0.851 -24.596 -33.905 119 HD3 LYS 5 HD3 LYS 5 1.855 -23.315 -34.668 120 HE2 LYS 5 HE2 LYS 5 2.444 -24.180 -31.770 121 HE3 LYS 5 HE3 LYS 5 3.054 -24.992 -33.161 122 HZ1 LYS 5 HZ1 LYS 5 3.522 -22.375 -32.243 123 HZ2 LYS 5 HZ2 LYS 5 4.603 -23.307 -33.005 124 HZ3 LYS 5 HZ3 LYS 5 3.481 -22.474 -33.823 125 HA PRO 6 HA PRO 6 -2.868 -18.127 -32.239 126 HB2 PRO 6 HB2 PRO 6 -2.506 -18.812 -29.354 127 HB3 PRO 6 HB3 PRO 6 -3.692 -17.733 -30.053 128 HG2 PRO 6 HG2 PRO 6 -4.454 -20.437 -29.623 129 HG3 PRO 6 HG3 PRO 6 -4.967 -19.730 -31.081 130 HD2 PRO 6 HD2 PRO 6 -2.689 -21.485 -30.496 131 HD3 PRO 6 HD3 PRO 6 -3.806 -21.491 -31.834 132 H LYS 7 H LYS 7 -1.857 -16.021 -31.336 133 HA LYS 7 HA LYS 7 1.066 -16.158 -31.434 134 HB2 LYS 7 HB2 LYS 7 -0.542 -14.353 -32.599 135 HB3 LYS 7 HB3 LYS 7 -0.730 -13.749 -30.914 136 HG2 LYS 7 HG2 LYS 7 1.608 -13.218 -30.878 137 HG3 LYS 7 HG3 LYS 7 2.010 -14.135 -32.268 138 HD2 LYS 7 HD2 LYS 7 0.858 -12.573 -33.736 139 HD3 LYS 7 HD3 LYS 7 0.422 -11.571 -32.313 140 HE2 LYS 7 HE2 LYS 7 2.764 -11.265 -31.921 141 HE3 LYS 7 HE3 LYS 7 3.301 -12.459 -33.103 142 HZ1 LYS 7 HZ1 LYS 7 1.933 -11.059 -34.759 143 HZ2 LYS 7 HZ2 LYS 7 2.001 -9.825 -33.722 144 HZ3 LYS 7 HZ3 LYS 7 3.409 -10.459 -34.322 145 H GLU 8 H GLU 8 2.294 -16.135 -29.549 146 HA GLU 8 HA GLU 8 0.850 -15.807 -26.979 147 HB2 GLU 8 HB2 GLU 8 2.756 -16.615 -25.903 148 HB3 GLU 8 HB3 GLU 8 2.277 -17.750 -27.243 149 HG2 GLU 8 HG2 GLU 8 4.017 -16.573 -28.625 150 HG3 GLU 8 HG3 GLU 8 4.599 -15.673 -27.334 151 H GLY 9 H GLY 9 1.434 -14.174 -25.433 152 HA2 GLY 9 HA2 GLY 9 1.793 -11.724 -26.590 153 HA3 GLY 9 HA3 GLY 9 1.853 -12.050 -24.913 154 H VAL 10 H VAL 10 4.521 -13.579 -26.558 155 HA VAL 10 HA VAL 10 6.605 -11.460 -26.091 156 HB VAL 10 HB VAL 10 6.630 -14.238 -25.056 157 HG11 VAL 10 HG11 VAL 10 8.947 -13.825 -25.624 158 HG12 VAL 10 HG12 VAL 10 8.690 -12.120 -25.456 159 HG13 VAL 10 HG13 VAL 10 8.987 -13.297 -24.036 160 HG21 VAL 10 HG21 VAL 10 7.077 -13.036 -22.805 161 HG22 VAL 10 HG22 VAL 10 6.650 -11.484 -23.678 162 HG23 VAL 10 HG23 VAL 10 5.433 -12.700 -23.532 163 H LYS 11 H LYS 11 7.173 -11.102 -27.947 164 HA LYS 11 HA LYS 11 8.961 -12.992 -29.238 165 HB2 LYS 11 HB2 LYS 11 6.875 -13.283 -30.578 166 HB3 LYS 11 HB3 LYS 11 6.768 -11.552 -30.654 167 HG2 LYS 11 HG2 LYS 11 8.686 -11.495 -32.234 168 HG3 LYS 11 HG3 LYS 11 8.801 -13.308 -31.961 169 HD2 LYS 11 HD2 LYS 11 6.570 -13.660 -33.001 170 HD3 LYS 11 HD3 LYS 11 6.592 -11.993 -33.424 171 HE2 LYS 11 HE2 LYS 11 7.546 -12.784 -35.324 172 HE3 LYS 11 HE3 LYS 11 9.014 -12.488 -34.286 173 HZ1 LYS 11 HZ1 LYS 11 8.761 -14.902 -33.702 174 HZ2 LYS 11 HZ2 LYS 11 7.663 -15.155 -34.720 175 HZ3 LYS 11 HZ3 LYS 11 9.185 -14.735 -35.255 176 H THR 12 H THR 12 10.866 -11.965 -30.138 177 HA THR 12 HA THR 12 11.684 -9.459 -29.100 178 HB THR 12 HB THR 12 13.447 -9.530 -30.761 179 HG1 THR 12 HG1 THR 12 12.864 -10.786 -32.324 180 HG21 THR 12 HG21 THR 12 13.148 -11.876 -28.904 181 HG22 THR 12 HG22 THR 12 14.723 -11.327 -29.677 182 HG23 THR 12 HG23 THR 12 14.020 -10.272 -28.595 183 H GLU 13 H GLU 13 10.317 -10.225 -32.182 184 HA GLU 13 HA GLU 13 11.105 -7.945 -33.664 185 HB2 GLU 13 HB2 GLU 13 8.655 -9.546 -34.236 186 HB3 GLU 13 HB3 GLU 13 9.739 -8.643 -35.343 187 HG2 GLU 13 HG2 GLU 13 10.488 -11.123 -33.831 188 HG3 GLU 13 HG3 GLU 13 9.959 -11.095 -35.541 189 H ASN 14 H ASN 14 8.181 -8.511 -31.713 190 HA ASN 14 HA ASN 14 6.839 -6.240 -32.896 191 HB2 ASN 14 HB2 ASN 14 5.542 -8.066 -30.891 192 HB3 ASN 14 HB3 ASN 14 4.782 -7.048 -32.208 193 HD21 ASN 14 HD22 ASN 14 5.198 -7.637 -34.409 194 HD22 ASN 14 HD21 ASN 14 5.155 -9.454 -34.606 195 H ASN 15 H ASN 15 8.764 -6.634 -30.364 196 HA ASN 15 HA ASN 15 7.906 -5.097 -28.142 197 HB2 ASN 15 HB2 ASN 15 9.802 -6.530 -28.113 198 HB3 ASN 15 HB3 ASN 15 10.668 -5.617 -29.374 199 HD21 ASN 15 HD22 ASN 15 12.462 -4.787 -28.097 200 HD22 ASN 15 HD21 ASN 15 12.396 -4.504 -26.351 201 H ASP 16 H ASP 16 8.176 -2.890 -27.692 202 HA ASP 16 HA ASP 16 8.211 -0.944 -29.766 203 HB2 ASP 16 HB2 ASP 16 8.528 -0.506 -26.729 204 HB3 ASP 16 HB3 ASP 16 8.167 0.708 -28.024 205 H HIS 17 H HIS 17 10.015 -0.305 -31.058 206 HA HIS 17 HA HIS 17 12.611 -0.048 -30.028 207 HB2 HIS 17 HB2 HIS 17 11.219 1.691 -32.018 208 HB3 HIS 17 HB3 HIS 17 12.924 1.622 -31.861 209 HD2 HIS 17 HD2 HIS 17 14.224 -0.106 -33.393 210 HE1 HIS 17 HE1 HIS 17 10.938 -2.599 -34.582 211 HE2 HIS 17 HE2 HIS 17 13.410 -1.884 -35.065 212 H ILE 18 H ILE 18 13.769 2.095 -29.538 213 HA ILE 18 HA ILE 18 12.278 4.171 -28.064 214 HB ILE 18 HB ILE 18 14.046 3.138 -26.601 215 HG12 ILE 18 HG12 ILE 18 14.534 6.038 -27.319 216 HG13 ILE 18 HG13 ILE 18 13.276 5.344 -26.311 217 HG21 ILE 18 HG21 ILE 18 15.691 2.603 -28.501 218 HG22 ILE 18 HG22 ILE 18 16.039 4.380 -28.567 219 HG23 ILE 18 HG23 ILE 18 16.254 3.440 -27.048 220 HD11 ILE 18 HD11 ILE 18 15.261 4.404 -24.980 221 HD12 ILE 18 HD12 ILE 18 16.338 5.419 -25.872 222 HD13 ILE 18 HD13 ILE 18 15.046 6.181 -24.863 223 H ASN 19 H ASN 19 11.838 5.849 -29.255 224 HA ASN 19 HA ASN 19 13.531 6.652 -31.621 225 HB2 ASN 19 HB2 ASN 19 10.843 7.660 -30.644 226 HB3 ASN 19 HB3 ASN 19 11.627 8.212 -32.126 227 HD21 ASN 19 HD22 ASN 19 9.352 5.944 -30.897 228 HD22 ASN 19 HD21 ASN 19 9.485 4.707 -32.233 229 H LEU 20 H LEU 20 14.890 7.916 -31.590 230 HA LEU 20 HA LEU 20 15.194 10.131 -29.590 231 HB2 LEU 20 HB2 LEU 20 17.202 8.272 -30.592 232 HB3 LEU 20 HB3 LEU 20 17.624 9.602 -29.575 233 HG LEU 20 HG LEU 20 16.002 7.194 -28.490 234 HD11 LEU 20 HD11 LEU 20 18.551 8.465 -27.625 235 HD12 LEU 20 HD12 LEU 20 17.634 7.126 -26.818 236 HD13 LEU 20 HD13 LEU 20 18.378 6.810 -28.318 237 HD21 LEU 20 HD21 LEU 20 16.329 9.963 -27.063 238 HD22 LEU 20 HD22 LEU 20 14.867 8.859 -27.321 239 HD23 LEU 20 HD23 LEU 20 16.077 8.493 -26.233 240 H LYS 21 H LYS 21 15.769 12.104 -30.433 241 HA LYS 21 HA LYS 21 16.293 12.328 -33.437 242 HB2 LYS 21 HB2 LYS 21 15.500 14.440 -31.360 243 HB3 LYS 21 HB3 LYS 21 15.657 14.838 -33.054 244 HG2 LYS 21 HG2 LYS 21 13.874 13.366 -33.676 245 HG3 LYS 21 HG3 LYS 21 13.508 12.956 -32.030 246 HD2 LYS 21 HD2 LYS 21 13.046 15.444 -31.648 247 HD3 LYS 21 HD3 LYS 21 13.369 15.796 -33.367 248 HE2 LYS 21 HE2 LYS 21 11.014 15.716 -32.973 249 HE3 LYS 21 HE3 LYS 21 11.552 14.465 -34.123 250 HZ1 LYS 21 HZ1 LYS 21 11.018 13.803 -31.244 251 HZ2 LYS 21 HZ2 LYS 21 9.919 13.729 -32.417 252 HZ3 LYS 21 HZ3 LYS 21 11.258 12.804 -32.533 253 H VAL 22 H VAL 22 17.748 13.793 -34.175 254 HA VAL 22 HA VAL 22 20.009 14.579 -32.345 255 HB VAL 22 HB VAL 22 20.559 13.085 -34.890 256 HG11 VAL 22 HG11 VAL 22 22.120 14.602 -34.334 257 HG12 VAL 22 HG12 VAL 22 22.331 14.025 -32.688 258 HG13 VAL 22 HG13 VAL 22 22.815 12.934 -34.036 259 HG21 VAL 22 HG21 VAL 22 21.130 11.132 -33.646 260 HG22 VAL 22 HG22 VAL 22 20.997 11.857 -32.126 261 HG23 VAL 22 HG23 VAL 22 19.515 11.597 -33.080 262 H ALA 23 H ALA 23 20.679 16.645 -32.816 263 HA ALA 23 HA ALA 23 19.177 17.991 -34.944 264 HB1 ALA 23 HB1 ALA 23 18.635 19.575 -33.041 265 HB2 ALA 23 HB2 ALA 23 17.862 18.020 -32.914 266 HB3 ALA 23 HB3 ALA 23 19.374 18.301 -31.992 267 H GLY 24 H GLY 24 20.482 19.465 -35.964 268 HA2 GLY 24 HA2 GLY 24 23.105 20.427 -35.028 269 HA3 GLY 24 HA3 GLY 24 22.271 20.614 -36.671 270 H GLN 25 H GLN 25 23.389 22.833 -35.280 271 HA GLN 25 HA GLN 25 21.392 24.152 -33.583 272 HB2 GLN 25 HB2 GLN 25 24.162 25.186 -34.434 273 HB3 GLN 25 HB3 GLN 25 23.101 25.714 -33.119 274 HG2 GLN 25 HG2 GLN 25 24.584 23.079 -33.496 275 HG3 GLN 25 HG3 GLN 25 24.945 24.409 -32.421 276 HE21 GLN 25 HE22 GLN 25 23.811 21.513 -31.882 277 HE22 GLN 25 HE21 GLN 25 22.555 21.953 -30.678 278 H ASP 26 H ASP 26 21.572 24.096 -36.789 279 HA ASP 26 HA ASP 26 20.129 26.658 -37.077 280 HB2 ASP 26 HB2 ASP 26 19.995 26.250 -39.255 281 HB3 ASP 26 HB3 ASP 26 21.572 25.572 -38.913 282 H GLY 27 H GLY 27 19.195 23.801 -35.665 283 HA2 GLY 27 HA2 GLY 27 17.354 22.704 -35.236 284 HA3 GLY 27 HA3 GLY 27 16.329 24.048 -35.769 285 H SER 28 H SER 28 18.544 22.570 -37.971 286 HA SER 28 HA SER 28 16.476 20.789 -39.271 287 HB2 SER 28 HB2 SER 28 18.017 20.226 -40.974 288 HB3 SER 28 HB3 SER 28 18.125 21.988 -40.700 289 HG SER 28 HG SER 28 19.987 21.755 -39.621 290 H VAL 29 H VAL 29 16.210 18.713 -38.930 291 HA VAL 29 HA VAL 29 17.920 17.341 -36.903 292 HB VAL 29 HB VAL 29 15.036 18.048 -36.267 293 HG11 VAL 29 HG11 VAL 29 17.289 16.871 -34.691 294 HG12 VAL 29 HG12 VAL 29 15.513 17.163 -34.171 295 HG13 VAL 29 HG13 VAL 29 16.007 15.875 -35.236 296 HG21 VAL 29 HG21 VAL 29 16.108 19.349 -34.356 297 HG22 VAL 29 HG22 VAL 29 17.570 19.251 -35.178 298 HG23 VAL 29 HG23 VAL 29 16.156 20.073 -35.930 299 H VAL 30 H VAL 30 17.924 15.293 -36.958 300 HA VAL 30 HA VAL 30 16.058 13.912 -38.816 301 HB VAL 30 HB VAL 30 17.576 12.018 -38.849 302 HG11 VAL 30 HG11 VAL 30 17.283 13.475 -40.621 303 HG12 VAL 30 HG12 VAL 30 18.419 14.581 -40.195 304 HG13 VAL 30 HG13 VAL 30 18.988 12.853 -40.669 305 HG21 VAL 30 HG21 VAL 30 19.800 13.899 -37.795 306 HG22 VAL 30 HG22 VAL 30 19.018 12.442 -37.152 307 HG23 VAL 30 HG23 VAL 30 19.997 12.155 -38.474 308 H GLN 31 H GLN 31 15.671 11.560 -38.235 309 HA GLN 31 HA GLN 31 15.661 11.313 -35.282 310 HB2 GLN 31 HB2 GLN 31 13.465 12.097 -35.926 311 HB3 GLN 31 HB3 GLN 31 13.190 10.660 -36.909 312 HG2 GLN 31 HG2 GLN 31 13.223 9.165 -35.034 313 HG3 GLN 31 HG3 GLN 31 13.675 10.489 -33.933 314 HE21 GLN 31 HE22 GLN 31 10.909 9.174 -35.748 315 HE22 GLN 31 HE21 GLN 31 9.815 10.162 -34.721 316 H PHE 32 H PHE 32 16.045 9.335 -34.448 317 HA PHE 32 HA PHE 32 16.755 7.140 -36.183 318 HB2 PHE 32 HB2 PHE 32 18.190 8.088 -33.654 319 HB3 PHE 32 HB3 PHE 32 18.381 6.471 -34.305 320 HD1 PHE 32 HD1 PHE 32 19.158 10.106 -34.919 321 HD2 PHE 32 HD2 PHE 32 19.595 6.005 -36.026 322 HE1 PHE 32 HE1 PHE 32 21.179 10.669 -36.286 323 HE2 PHE 32 HE2 PHE 32 21.588 6.559 -37.424 324 HZ PHE 32 HZ PHE 32 22.306 8.969 -37.687 325 H LYS 33 H LYS 33 15.800 5.289 -35.741 326 HA LYS 33 HA LYS 33 14.199 4.774 -33.229 327 HB2 LYS 33 HB2 LYS 33 12.820 5.024 -35.352 328 HB3 LYS 33 HB3 LYS 33 13.841 3.810 -36.063 329 HG2 LYS 33 HG2 LYS 33 13.080 2.067 -34.535 330 HG3 LYS 33 HG3 LYS 33 12.212 3.185 -33.489 331 HD2 LYS 33 HD2 LYS 33 10.710 3.666 -34.919 332 HD3 LYS 33 HD3 LYS 33 11.585 3.050 -36.344 333 HE2 LYS 33 HE2 LYS 33 11.276 0.693 -35.296 334 HE3 LYS 33 HE3 LYS 33 10.354 1.368 -34.048 335 HZ1 LYS 33 HZ1 LYS 33 8.793 0.611 -35.777 336 HZ2 LYS 33 HZ2 LYS 33 8.764 2.230 -35.645 337 HZ3 LYS 33 HZ3 LYS 33 9.537 1.582 -36.918 338 H ILE 34 H ILE 34 15.192 3.403 -31.956 339 HA ILE 34 HA ILE 34 16.707 1.047 -33.064 340 HB ILE 34 HB ILE 34 18.491 1.907 -31.616 341 HG12 ILE 34 HG12 ILE 34 17.258 4.647 -31.459 342 HG13 ILE 34 HG13 ILE 34 17.032 3.301 -30.301 343 HG21 ILE 34 HG21 ILE 34 18.485 2.197 -34.088 344 HG22 ILE 34 HG22 ILE 34 18.027 3.906 -33.983 345 HG23 ILE 34 HG23 ILE 34 19.508 3.390 -33.206 346 HD11 ILE 34 HD11 ILE 34 18.779 4.972 -29.547 347 HD12 ILE 34 HD12 ILE 34 19.384 3.294 -29.830 348 HD13 ILE 34 HD13 ILE 34 19.630 4.668 -30.994 349 H LYS 35 H LYS 35 17.725 -0.282 -31.305 350 HA LYS 35 HA LYS 35 15.595 -1.028 -29.341 351 HB2 LYS 35 HB2 LYS 35 18.046 -2.471 -30.291 352 HB3 LYS 35 HB3 LYS 35 17.188 -2.970 -28.817 353 HG2 LYS 35 HG2 LYS 35 15.190 -3.355 -30.242 354 HG3 LYS 35 HG3 LYS 35 15.837 -2.615 -31.588 355 HD2 LYS 35 HD2 LYS 35 17.654 -4.518 -31.421 356 HD3 LYS 35 HD3 LYS 35 16.395 -5.358 -30.457 357 HE2 LYS 35 HE2 LYS 35 14.711 -5.107 -32.192 358 HE3 LYS 35 HE3 LYS 35 15.718 -4.160 -33.140 359 HZ1 LYS 35 HZ1 LYS 35 16.638 -6.830 -32.579 360 HZ2 LYS 35 HZ2 LYS 35 15.683 -6.482 -33.906 361 HZ3 LYS 35 HZ3 LYS 35 17.129 -5.916 -33.824 362 H ARG 36 H ARG 36 15.859 -0.630 -27.147 363 HA ARG 36 HA ARG 36 17.414 1.645 -26.504 364 HB2 ARG 36 HB2 ARG 36 15.484 0.353 -25.023 365 HB3 ARG 36 HB3 ARG 36 16.895 -0.375 -24.224 366 HG2 ARG 36 HG2 ARG 36 17.696 1.974 -23.816 367 HG3 ARG 36 HG3 ARG 36 16.184 2.518 -24.609 368 HD2 ARG 36 HD2 ARG 36 15.485 2.687 -22.383 369 HD3 ARG 36 HD3 ARG 36 14.899 1.123 -22.920 370 HE ARG 36 HE ARG 36 16.421 -0.068 -21.643 371 HH11 ARG 36 HH11 ARG 36 16.617 3.370 -21.077 372 HH12 ARG 36 HH12 ARG 36 17.319 3.068 -19.435 373 HH21 ARG 36 HH21 ARG 36 17.680 -0.223 -19.737 374 HH22 ARG 36 HH22 ARG 36 18.013 1.339 -18.946 375 H HIS 37 H HIS 37 18.799 -1.629 -26.389 376 HA HIS 37 HA HIS 37 21.262 -0.571 -25.058 377 HB2 HIS 37 HB2 HIS 37 21.900 -2.678 -25.047 378 HB3 HIS 37 HB3 HIS 37 20.239 -2.677 -24.474 379 HD2 HIS 37 HD2 HIS 37 22.267 -5.017 -26.100 380 HE1 HIS 37 HE1 HIS 37 18.691 -5.362 -28.434 381 HE2 HIS 37 HE2 HIS 37 20.823 -6.497 -27.780 382 H THR 38 H THR 38 20.133 -0.238 -28.106 383 HA THR 38 HA THR 38 22.381 -1.006 -29.696 384 HB THR 38 HB THR 38 20.190 1.124 -30.055 385 HG1 THR 38 HG1 THR 38 20.134 -1.426 -30.373 386 HG21 THR 38 HG21 THR 38 22.299 0.598 -31.990 387 HG22 THR 38 HG22 THR 38 20.646 1.339 -32.295 388 HG23 THR 38 HG23 THR 38 21.730 2.215 -31.302 389 HA PRO 39 HA PRO 39 25.106 1.937 -27.976 390 HB2 PRO 39 HB2 PRO 39 27.460 1.714 -29.391 391 HB3 PRO 39 HB3 PRO 39 26.958 0.488 -28.223 392 HG2 PRO 39 HG2 PRO 39 26.403 0.677 -31.205 393 HG3 PRO 39 HG3 PRO 39 27.218 -0.669 -30.350 394 HD2 PRO 39 HD2 PRO 39 24.494 -0.638 -30.980 395 HD3 PRO 39 HD3 PRO 39 24.990 -1.206 -29.349 396 H LEU 40 H LEU 40 25.722 4.038 -28.242 397 HA LEU 40 HA LEU 40 24.488 5.563 -30.386 398 HB2 LEU 40 HB2 LEU 40 26.093 6.705 -28.140 399 HB3 LEU 40 HB3 LEU 40 25.250 7.651 -29.312 400 HG LEU 40 HG LEU 40 23.905 5.494 -27.525 401 HD11 LEU 40 HD11 LEU 40 23.881 8.530 -27.420 402 HD12 LEU 40 HD12 LEU 40 22.992 7.371 -26.317 403 HD13 LEU 40 HD13 LEU 40 24.754 7.444 -26.327 404 HD21 LEU 40 HD21 LEU 40 21.795 6.394 -28.217 405 HD22 LEU 40 HD22 LEU 40 22.576 7.641 -29.191 406 HD23 LEU 40 HD23 LEU 40 22.708 5.902 -29.652 407 H SER 41 H SER 41 27.591 4.211 -30.328 408 HA SER 41 HA SER 41 29.041 5.816 -32.186 409 HB2 SER 41 HB2 SER 41 30.227 3.622 -32.615 410 HB3 SER 41 HB3 SER 41 29.895 3.782 -30.890 411 HG SER 41 HG SER 41 29.226 1.714 -31.550 412 H LYS 42 H LYS 42 26.639 3.112 -32.848 413 HA LYS 42 HA LYS 42 26.937 3.517 -35.641 414 HB2 LYS 42 HB2 LYS 42 24.340 2.661 -34.342 415 HB3 LYS 42 HB3 LYS 42 24.773 2.394 -36.011 416 HG2 LYS 42 HG2 LYS 42 26.861 1.138 -34.907 417 HG3 LYS 42 HG3 LYS 42 25.981 1.288 -33.357 418 HD2 LYS 42 HD2 LYS 42 24.134 0.106 -34.004 419 HD3 LYS 42 HD3 LYS 42 24.675 -0.198 -35.641 420 HE2 LYS 42 HE2 LYS 42 25.821 -1.234 -33.020 421 HE3 LYS 42 HE3 LYS 42 25.070 -2.145 -34.309 422 HZ1 LYS 42 HZ1 LYS 42 27.382 -2.513 -34.650 423 HZ2 LYS 42 HZ2 LYS 42 26.863 -1.572 -35.791 424 HZ3 LYS 42 HZ3 LYS 42 27.779 -0.975 -34.615 425 H LEU 43 H LEU 43 25.074 5.454 -33.365 426 HA LEU 43 HA LEU 43 23.505 6.530 -35.454 427 HB2 LEU 43 HB2 LEU 43 23.787 7.386 -32.452 428 HB3 LEU 43 HB3 LEU 43 22.919 8.300 -33.622 429 HG LEU 43 HG LEU 43 21.435 6.227 -34.113 430 HD11 LEU 43 HD11 LEU 43 22.664 4.323 -33.464 431 HD12 LEU 43 HD12 LEU 43 23.066 5.045 -31.877 432 HD13 LEU 43 HD13 LEU 43 21.367 4.541 -32.305 433 HD21 LEU 43 HD21 LEU 43 20.764 8.113 -32.543 434 HD22 LEU 43 HD22 LEU 43 20.167 6.523 -32.078 435 HD23 LEU 43 HD23 LEU 43 21.628 7.272 -31.316 436 H MET 44 H MET 44 26.139 7.846 -33.382 437 HA MET 44 HA MET 44 26.530 10.415 -34.673 438 HB2 MET 44 HB2 MET 44 28.770 8.650 -33.543 439 HB3 MET 44 HB3 MET 44 28.736 10.390 -33.968 440 HG2 MET 44 HG2 MET 44 26.881 10.640 -32.133 441 HG3 MET 44 HG3 MET 44 27.081 8.883 -31.843 442 HE1 MET 44 HE1 MET 44 28.096 7.981 -29.882 443 HE2 MET 44 HE2 MET 44 29.433 7.859 -31.144 444 HE3 MET 44 HE3 MET 44 29.727 8.310 -29.466 445 H LYS 45 H LYS 45 28.156 7.363 -35.728 446 HA LYS 45 HA LYS 45 29.228 8.363 -38.054 447 HB2 LYS 45 HB2 LYS 45 28.087 5.683 -37.419 448 HB3 LYS 45 HB3 LYS 45 28.898 5.990 -38.968 449 HG2 LYS 45 HG2 LYS 45 31.030 6.660 -37.609 450 HG3 LYS 45 HG3 LYS 45 30.106 6.435 -36.128 451 HD2 LYS 45 HD2 LYS 45 30.209 4.019 -37.823 452 HD3 LYS 45 HD3 LYS 45 31.802 4.647 -37.161 453 HE2 LYS 45 HE2 LYS 45 30.660 4.619 -34.933 454 HE3 LYS 45 HE3 LYS 45 29.307 3.854 -35.689 455 HZ1 LYS 45 HZ1 LYS 45 30.576 1.888 -36.061 456 HZ2 LYS 45 HZ2 LYS 45 31.960 2.613 -35.722 457 HZ3 LYS 45 HZ3 LYS 45 30.972 2.336 -34.598 458 H ALA 46 H ALA 46 25.947 6.900 -38.013 459 HA ALA 46 HA ALA 46 25.405 7.631 -40.654 460 HB1 ALA 46 HB1 ALA 46 23.360 7.024 -38.381 461 HB2 ALA 46 HB2 ALA 46 22.937 7.135 -40.163 462 HB3 ALA 46 HB3 ALA 46 24.010 5.919 -39.592 463 H TYR 47 H TYR 47 24.885 9.588 -37.837 464 HA TYR 47 HA TYR 47 23.366 11.641 -39.265 465 HB2 TYR 47 HB2 TYR 47 23.397 11.521 -36.801 466 HB3 TYR 47 HB3 TYR 47 25.083 11.771 -36.684 467 HD1 TYR 47 HD2 TYR 47 25.960 14.170 -37.626 468 HD2 TYR 47 HD1 TYR 47 21.848 13.152 -36.928 469 HE1 TYR 47 HE2 TYR 47 25.431 16.620 -37.290 470 HE2 TYR 47 HE1 TYR 47 21.235 15.700 -36.969 471 HH TYR 47 HH TYR 47 22.178 17.911 -37.416 472 H CYS 48 H CYS 48 26.903 11.376 -38.232 473 HA CYS 48 HA CYS 48 27.937 13.525 -39.665 474 HB2 CYS 48 HB2 CYS 48 28.959 11.849 -37.881 475 HB3 CYS 48 HB3 CYS 48 29.403 10.828 -39.191 476 HG CYS 48 HG CYS 48 30.968 12.452 -40.327 477 H GLU 49 H GLU 49 27.301 10.378 -41.006 478 HA GLU 49 HA GLU 49 28.608 10.789 -43.432 479 HB2 GLU 49 HB2 GLU 49 26.426 8.877 -42.548 480 HB3 GLU 49 HB3 GLU 49 27.009 8.745 -44.069 481 HG2 GLU 49 HG2 GLU 49 29.422 8.330 -43.286 482 HG3 GLU 49 HG3 GLU 49 29.025 8.562 -41.713 483 H ARG 50 H ARG 50 25.197 11.275 -42.442 484 HA ARG 50 HA ARG 50 24.291 12.180 -44.969 485 HB2 ARG 50 HB2 ARG 50 23.374 12.174 -41.986 486 HB3 ARG 50 HB3 ARG 50 22.448 13.111 -43.017 487 HG2 ARG 50 HG2 ARG 50 21.593 11.427 -44.412 488 HG3 ARG 50 HG3 ARG 50 22.736 10.274 -44.017 489 HD2 ARG 50 HD2 ARG 50 21.848 9.956 -41.829 490 HD3 ARG 50 HD3 ARG 50 20.736 11.355 -41.972 491 HE ARG 50 HE ARG 50 20.335 8.581 -42.914 492 HH11 ARG 50 HH11 ARG 50 19.521 12.008 -43.737 493 HH12 ARG 50 HH12 ARG 50 18.495 11.528 -45.054 494 HH21 ARG 50 HH21 ARG 50 18.323 8.247 -44.071 495 HH22 ARG 50 HH22 ARG 50 17.855 9.512 -45.180 496 H GLN 51 H GLN 51 25.642 13.754 -42.234 497 HA GLN 51 HA GLN 51 25.620 16.545 -43.257 498 HB2 GLN 51 HB2 GLN 51 27.600 15.495 -41.334 499 HB3 GLN 51 HB3 GLN 51 27.061 17.197 -41.710 500 HG2 GLN 51 HG2 GLN 51 25.526 15.172 -40.195 501 HG3 GLN 51 HG3 GLN 51 26.191 16.681 -39.768 502 HE21 GLN 51 HE22 GLN 51 23.399 15.396 -40.191 503 HE22 GLN 51 HE21 GLN 51 22.421 16.801 -40.697 504 H GLY 52 H GLY 52 27.901 13.769 -43.524 505 HA2 GLY 52 HA2 GLY 52 29.258 13.261 -45.301 506 HA3 GLY 52 HA3 GLY 52 29.104 14.940 -45.995 507 H LEU 53 H LEU 53 29.824 14.469 -42.655 508 HA LEU 53 HA LEU 53 32.522 15.878 -42.875 509 HB2 LEU 53 HB2 LEU 53 30.556 15.691 -40.669 510 HB3 LEU 53 HB3 LEU 53 32.035 16.632 -40.722 511 HG LEU 53 HG LEU 53 29.517 17.296 -42.311 512 HD11 LEU 53 HD11 LEU 53 29.590 17.695 -39.939 513 HD12 LEU 53 HD12 LEU 53 31.093 18.589 -40.202 514 HD13 LEU 53 HD13 LEU 53 29.430 19.092 -40.946 515 HD21 LEU 53 HD21 LEU 53 30.845 19.338 -42.955 516 HD22 LEU 53 HD22 LEU 53 32.362 18.474 -42.340 517 HD23 LEU 53 HD23 LEU 53 31.413 17.893 -43.755 518 H SER 54 H SER 54 34.017 15.330 -41.026 519 HA SER 54 HA SER 54 33.749 12.470 -40.058 520 HB2 SER 54 HB2 SER 54 35.934 12.616 -40.833 521 HB3 SER 54 HB3 SER 54 36.242 14.227 -40.210 522 HG SER 54 HG SER 54 37.157 12.261 -39.187 523 H MET 55 H MET 55 33.687 11.834 -38.158 524 HA MET 55 HA MET 55 32.359 13.379 -36.141 525 HB2 MET 55 HB2 MET 55 33.551 10.635 -36.356 526 HB3 MET 55 HB3 MET 55 33.156 11.345 -34.748 527 HG2 MET 55 HG2 MET 55 30.749 11.349 -35.218 528 HG3 MET 55 HG3 MET 55 31.083 10.926 -36.889 529 HE1 MET 55 HE1 MET 55 32.942 9.250 -33.616 530 HE2 MET 55 HE2 MET 55 31.328 9.936 -33.236 531 HE3 MET 55 HE3 MET 55 31.780 8.146 -33.289 532 H ARG 56 H ARG 56 35.740 13.588 -36.915 533 HA ARG 56 HA ARG 56 36.681 14.696 -34.420 534 HB2 ARG 56 HB2 ARG 56 38.126 13.558 -36.021 535 HB3 ARG 56 HB3 ARG 56 37.862 14.739 -37.226 536 HG2 ARG 56 HG2 ARG 56 39.179 15.751 -34.617 537 HG3 ARG 56 HG3 ARG 56 39.966 15.113 -36.095 538 HD2 ARG 56 HD2 ARG 56 38.999 16.946 -37.359 539 HD3 ARG 56 HD3 ARG 56 38.378 17.614 -35.777 540 HE ARG 56 HE ARG 56 40.992 17.192 -35.354 541 HH11 ARG 56 HH11 ARG 56 39.420 19.025 -37.956 542 HH12 ARG 56 HH12 ARG 56 40.648 20.171 -37.902 543 HH21 ARG 56 HH21 ARG 56 42.852 18.310 -36.096 544 HH22 ARG 56 HH22 ARG 56 42.512 19.683 -37.062 545 H GLN 57 H GLN 57 35.202 16.114 -37.514 546 HA GLN 57 HA GLN 57 35.598 18.889 -36.778 547 HB2 GLN 57 HB2 GLN 57 35.503 18.054 -38.877 548 HB3 GLN 57 HB3 GLN 57 33.845 17.403 -38.748 549 HG2 GLN 57 HG2 GLN 57 32.690 19.356 -38.681 550 HG3 GLN 57 HG3 GLN 57 34.086 20.405 -38.488 551 HE21 GLN 57 HE22 GLN 57 32.641 21.400 -40.441 552 HE22 GLN 57 HE21 GLN 57 33.390 20.940 -41.958 553 H ILE 58 H ILE 58 33.260 16.558 -35.678 554 HA ILE 58 HA ILE 58 31.480 18.698 -34.499 555 HB ILE 58 HB ILE 58 29.540 17.399 -35.338 556 HG12 ILE 58 HG12 ILE 58 31.221 15.275 -36.630 557 HG13 ILE 58 HG13 ILE 58 30.210 15.241 -35.060 558 HG21 ILE 58 HG21 ILE 58 30.832 19.022 -36.926 559 HG22 ILE 58 HG22 ILE 58 31.299 17.636 -37.808 560 HG23 ILE 58 HG23 ILE 58 29.575 17.906 -37.603 561 HD11 ILE 58 HD11 ILE 58 28.332 15.693 -36.241 562 HD12 ILE 58 HD12 ILE 58 29.070 15.495 -37.850 563 HD13 ILE 58 HD13 ILE 58 29.150 14.120 -36.759 564 H ARG 59 H ARG 59 30.200 18.081 -32.887 565 HA ARG 59 HA ARG 59 30.764 15.478 -31.487 566 HB2 ARG 59 HB2 ARG 59 31.038 18.136 -30.060 567 HB3 ARG 59 HB3 ARG 59 30.960 16.600 -29.318 568 HG2 ARG 59 HG2 ARG 59 33.108 17.479 -31.308 569 HG3 ARG 59 HG3 ARG 59 33.151 17.639 -29.584 570 HD2 ARG 59 HD2 ARG 59 33.053 15.138 -29.299 571 HD3 ARG 59 HD3 ARG 59 32.920 14.849 -30.936 572 HE ARG 59 HE ARG 59 35.358 15.334 -29.460 573 HH11 ARG 59 HH11 ARG 59 34.130 15.859 -32.774 574 HH12 ARG 59 HH12 ARG 59 35.708 16.498 -33.230 575 HH21 ARG 59 HH21 ARG 59 37.202 16.375 -30.237 576 HH22 ARG 59 HH22 ARG 59 37.362 16.500 -31.972 577 H PHE 60 H PHE 60 29.287 14.787 -30.054 578 HA PHE 60 HA PHE 60 26.555 15.708 -30.487 579 HB2 PHE 60 HB2 PHE 60 27.616 12.830 -30.006 580 HB3 PHE 60 HB3 PHE 60 25.972 13.128 -30.016 581 HD1 PHE 60 HD1 PHE 60 29.001 13.140 -32.040 582 HD2 PHE 60 HD2 PHE 60 24.732 13.481 -32.196 583 HE1 PHE 60 HE1 PHE 60 29.102 12.919 -34.424 584 HE2 PHE 60 HE2 PHE 60 24.927 13.469 -34.750 585 HZ PHE 60 HZ PHE 60 26.993 13.287 -35.856 586 H ARG 61 H ARG 61 25.370 16.098 -28.699 587 HA ARG 61 HA ARG 61 26.480 15.600 -25.975 588 HB2 ARG 61 HB2 ARG 61 27.170 17.760 -27.103 589 HB3 ARG 61 HB3 ARG 61 25.377 18.235 -26.908 590 HG2 ARG 61 HG2 ARG 61 25.620 17.682 -24.509 591 HG3 ARG 61 HG3 ARG 61 27.371 17.591 -24.767 592 HD2 ARG 61 HD2 ARG 61 25.696 20.014 -25.244 593 HD3 ARG 61 HD3 ARG 61 26.681 19.808 -23.832 594 HE ARG 61 HE ARG 61 28.487 19.325 -25.834 595 HH11 ARG 61 HH11 ARG 61 26.427 22.158 -25.400 596 HH12 ARG 61 HH12 ARG 61 27.583 23.098 -26.329 597 HH21 ARG 61 HH21 ARG 61 29.762 20.562 -26.882 598 HH22 ARG 61 HH22 ARG 61 29.484 22.298 -27.042 599 H PHE 62 H PHE 62 24.926 15.525 -24.302 600 HA PHE 62 HA PHE 62 22.039 15.712 -24.535 601 HB2 PHE 62 HB2 PHE 62 22.475 13.519 -25.363 602 HB3 PHE 62 HB3 PHE 62 23.480 13.126 -24.064 603 HD1 PHE 62 HD2 PHE 62 19.921 14.006 -24.583 604 HD2 PHE 62 HD1 PHE 62 22.797 12.138 -22.019 605 HE1 PHE 62 HE2 PHE 62 18.073 12.931 -23.141 606 HE2 PHE 62 HE1 PHE 62 21.206 11.038 -20.745 607 HZ PHE 62 HZ PHE 62 18.725 11.418 -21.397 608 H ASP 63 H ASP 63 21.195 16.327 -22.858 609 HA ASP 63 HA ASP 63 20.850 17.173 -20.830 610 HB2 ASP 63 HB2 ASP 63 20.833 14.589 -20.608 611 HB3 ASP 63 HB3 ASP 63 22.317 14.704 -19.731 612 H GLY 64 H GLY 64 23.277 18.139 -22.291 613 HA2 GLY 64 HA2 GLY 64 24.997 19.614 -21.944 614 HA3 GLY 64 HA3 GLY 64 24.574 19.660 -20.160 615 H GLN 65 H GLN 65 25.388 16.535 -21.385 616 HA GLN 65 HA GLN 65 28.255 16.824 -20.761 617 HB2 GLN 65 HB2 GLN 65 26.350 14.689 -19.950 618 HB3 GLN 65 HB3 GLN 65 28.003 14.295 -20.384 619 HG2 GLN 65 HG2 GLN 65 27.191 16.659 -18.488 620 HG3 GLN 65 HG3 GLN 65 27.238 15.093 -17.885 621 HE21 GLN 65 HE22 GLN 65 29.627 14.094 -17.920 622 HE22 GLN 65 HE21 GLN 65 30.968 15.229 -18.078 623 HA PRO 66 HA PRO 66 29.161 15.138 -25.007 624 HB2 PRO 66 HB2 PRO 66 31.687 14.067 -24.522 625 HB3 PRO 66 HB3 PRO 66 31.345 15.841 -24.803 626 HG2 PRO 66 HG2 PRO 66 32.047 14.441 -22.295 627 HG3 PRO 66 HG3 PRO 66 32.273 16.118 -22.837 628 HD2 PRO 66 HD2 PRO 66 30.183 15.066 -21.106 629 HD3 PRO 66 HD3 PRO 66 30.196 16.732 -21.739 630 H ILE 67 H ILE 67 28.378 13.466 -25.953 631 HA ILE 67 HA ILE 67 28.011 10.847 -24.634 632 HB ILE 67 HB ILE 67 27.617 11.738 -27.539 633 HG12 ILE 67 HG12 ILE 67 25.679 11.175 -25.255 634 HG13 ILE 67 HG13 ILE 67 25.889 12.766 -25.903 635 HG21 ILE 67 HG21 ILE 67 28.064 9.370 -27.524 636 HG22 ILE 67 HG22 ILE 67 26.528 9.179 -26.424 637 HG23 ILE 67 HG23 ILE 67 26.494 9.749 -28.071 638 HD11 ILE 67 HD11 ILE 67 24.576 10.488 -27.434 639 HD12 ILE 67 HD12 ILE 67 23.776 11.929 -26.793 640 HD13 ILE 67 HD13 ILE 67 24.882 12.142 -28.084 641 H ASN 68 H ASN 68 29.203 9.156 -24.858 642 HA ASN 68 HA ASN 68 31.780 9.182 -26.445 643 HB2 ASN 68 HB2 ASN 68 30.729 7.194 -24.258 644 HB3 ASN 68 HB3 ASN 68 32.433 7.361 -24.678 645 HD21 ASN 68 HD22 ASN 68 30.162 7.999 -22.494 646 HD22 ASN 68 HD21 ASN 68 31.120 9.118 -21.502 647 H GLU 69 H GLU 69 32.426 7.172 -27.451 648 HA GLU 69 HA GLU 69 30.333 6.089 -29.030 649 HB2 GLU 69 HB2 GLU 69 33.355 5.647 -29.093 650 HB3 GLU 69 HB3 GLU 69 32.198 4.776 -30.083 651 HG2 GLU 69 HG2 GLU 69 31.539 6.968 -31.133 652 HG3 GLU 69 HG3 GLU 69 32.263 7.806 -29.740 653 H THR 70 H THR 70 31.751 4.900 -25.918 654 HA THR 70 HA THR 70 30.723 2.154 -26.105 655 HB THR 70 HB THR 70 31.368 2.103 -23.690 656 HG1 THR 70 HG1 THR 70 31.241 4.070 -23.038 657 HG21 THR 70 HG21 THR 70 33.664 3.295 -25.357 658 HG22 THR 70 HG22 THR 70 33.804 1.896 -24.220 659 HG23 THR 70 HG23 THR 70 32.981 1.727 -25.737 660 H ASP 71 H ASP 71 29.310 5.217 -25.489 661 HA ASP 71 HA ASP 71 27.454 4.388 -23.355 662 HB2 ASP 71 HB2 ASP 71 27.107 6.805 -25.145 663 HB3 ASP 71 HB3 ASP 71 26.270 6.398 -23.674 664 H THR 72 H THR 72 25.290 3.575 -23.563 665 HA THR 72 HA THR 72 24.277 3.400 -26.341 666 HB THR 72 HB THR 72 23.065 1.301 -25.714 667 HG1 THR 72 HG1 THR 72 23.522 0.534 -23.413 668 HG21 THR 72 HG21 THR 72 25.725 1.118 -24.400 669 HG22 THR 72 HG22 THR 72 24.866 -0.094 -25.378 670 HG23 THR 72 HG23 THR 72 25.691 1.428 -26.130 671 HA PRO 73 HA PRO 73 20.916 5.856 -24.383 672 HB2 PRO 73 HB2 PRO 73 18.797 3.871 -25.091 673 HB3 PRO 73 HB3 PRO 73 18.805 5.587 -25.499 674 HG2 PRO 73 HG2 PRO 73 19.399 3.553 -27.438 675 HG3 PRO 73 HG3 PRO 73 20.090 5.275 -27.387 676 HD2 PRO 73 HD2 PRO 73 21.283 2.622 -26.450 677 HD3 PRO 73 HD3 PRO 73 22.165 3.892 -27.279 678 H ALA 74 H ALA 74 20.745 2.450 -24.095 679 HA ALA 74 HA ALA 74 19.309 2.263 -21.494 680 HB1 ALA 74 HB1 ALA 74 20.124 -0.015 -21.379 681 HB2 ALA 74 HB2 ALA 74 19.714 0.296 -23.007 682 HB3 ALA 74 HB3 ALA 74 21.444 0.370 -22.514 683 H GLN 75 H GLN 75 22.676 2.537 -22.132 684 HA GLN 75 HA GLN 75 23.678 2.461 -19.380 685 HB2 GLN 75 HB2 GLN 75 25.038 2.001 -21.375 686 HB3 GLN 75 HB3 GLN 75 24.697 3.705 -21.956 687 HG2 GLN 75 HG2 GLN 75 27.029 3.632 -21.162 688 HG3 GLN 75 HG3 GLN 75 26.003 4.627 -20.324 689 HE21 GLN 75 HE22 GLN 75 26.846 4.497 -18.110 690 HE22 GLN 75 HE21 GLN 75 27.425 3.053 -17.372 691 H LEU 76 H LEU 76 23.047 5.288 -21.637 692 HA LEU 76 HA LEU 76 23.197 7.097 -19.408 693 HB2 LEU 76 HB2 LEU 76 22.179 7.551 -22.310 694 HB3 LEU 76 HB3 LEU 76 22.440 8.822 -21.255 695 HG LEU 76 HG LEU 76 24.466 6.861 -22.341 696 HD11 LEU 76 HD11 LEU 76 25.387 8.754 -23.514 697 HD12 LEU 76 HD12 LEU 76 23.813 8.248 -23.922 698 HD13 LEU 76 HD13 LEU 76 23.932 9.786 -22.986 699 HD21 LEU 76 HD21 LEU 76 24.913 9.185 -20.486 700 HD22 LEU 76 HD22 LEU 76 25.185 7.465 -20.189 701 HD23 LEU 76 HD23 LEU 76 26.270 8.211 -21.309 702 H GLU 77 H GLU 77 20.613 5.117 -20.168 703 HA GLU 77 HA GLU 77 18.486 4.979 -19.519 704 HB2 GLU 77 HB2 GLU 77 19.063 7.051 -17.397 705 HB3 GLU 77 HB3 GLU 77 17.797 5.886 -17.436 706 HG2 GLU 77 HG2 GLU 77 20.608 4.866 -17.365 707 HG3 GLU 77 HG3 GLU 77 19.617 5.308 -15.909 708 H MET 78 H MET 78 19.048 6.979 -21.646 709 HA MET 78 HA MET 78 17.450 9.302 -21.411 710 HB2 MET 78 HB2 MET 78 17.945 7.594 -23.934 711 HB3 MET 78 HB3 MET 78 17.600 9.408 -23.850 712 HG2 MET 78 HG2 MET 78 19.783 9.652 -22.753 713 HG3 MET 78 HG3 MET 78 20.065 7.910 -22.870 714 HE1 MET 78 HE1 MET 78 19.272 11.155 -24.824 715 HE2 MET 78 HE2 MET 78 19.679 10.697 -26.536 716 HE3 MET 78 HE3 MET 78 18.230 10.036 -25.810 717 H GLU 79 H GLU 79 15.421 9.855 -21.986 718 HA GLU 79 HA GLU 79 13.506 7.528 -21.989 719 HB2 GLU 79 HB2 GLU 79 13.071 10.588 -21.479 720 HB3 GLU 79 HB3 GLU 79 11.773 9.397 -21.698 721 HG2 GLU 79 HG2 GLU 79 14.005 9.099 -19.687 722 HG3 GLU 79 HG3 GLU 79 12.499 10.014 -19.330 723 H ASP 80 H ASP 80 11.724 7.534 -23.342 724 HA ASP 80 HA ASP 80 12.497 7.875 -26.175 725 HB2 ASP 80 HB2 ASP 80 9.774 8.008 -25.087 726 HB3 ASP 80 HB3 ASP 80 10.257 7.414 -26.646 727 H GLU 81 H GLU 81 12.237 9.525 -27.560 728 HA GLU 81 HA GLU 81 11.856 11.589 -28.524 729 HB2 GLU 81 HB2 GLU 81 9.890 12.151 -26.403 730 HB3 GLU 81 HB3 GLU 81 10.255 12.999 -27.993 731 HG2 GLU 81 HG2 GLU 81 9.700 10.779 -29.065 732 HG3 GLU 81 HG3 GLU 81 8.993 10.401 -27.452 733 H ASP 82 H ASP 82 13.765 11.035 -26.187 734 HA ASP 82 HA ASP 82 14.602 13.682 -25.389 735 HB2 ASP 82 HB2 ASP 82 15.992 11.135 -25.175 736 HB3 ASP 82 HB3 ASP 82 16.732 12.561 -24.638 737 H THR 83 H THR 83 16.415 14.917 -26.315 738 HA THR 83 HA THR 83 17.175 14.301 -29.223 739 HB THR 83 HB THR 83 16.556 17.038 -28.162 740 HG1 THR 83 HG1 THR 83 14.681 15.533 -28.597 741 HG21 THR 83 HG21 THR 83 17.234 16.189 -30.951 742 HG22 THR 83 HG22 THR 83 16.312 17.617 -30.575 743 HG23 THR 83 HG23 THR 83 18.005 17.431 -29.933 744 H ILE 84 H ILE 84 19.081 14.388 -29.780 745 HA ILE 84 HA ILE 84 21.337 15.061 -27.986 746 HB ILE 84 HB ILE 84 21.337 13.412 -30.554 747 HG12 ILE 84 HG12 ILE 84 21.386 12.376 -27.742 748 HG13 ILE 84 HG13 ILE 84 20.008 12.257 -28.813 749 HG21 ILE 84 HG21 ILE 84 23.418 13.819 -28.467 750 HG22 ILE 84 HG22 ILE 84 23.531 12.733 -29.869 751 HG23 ILE 84 HG23 ILE 84 23.602 14.452 -30.118 752 HD11 ILE 84 HD11 ILE 84 22.624 10.884 -29.164 753 HD12 ILE 84 HD12 ILE 84 21.065 10.253 -28.605 754 HD13 ILE 84 HD13 ILE 84 21.215 10.787 -30.284 755 H ASP 85 H ASP 85 22.272 16.992 -28.250 756 HA ASP 85 HA ASP 85 21.853 18.727 -30.719 757 HB2 ASP 85 HB2 ASP 85 23.189 18.917 -28.021 758 HB3 ASP 85 HB3 ASP 85 23.531 20.038 -29.334 759 H VAL 86 H VAL 86 23.531 19.364 -32.082 760 HA VAL 86 HA VAL 86 26.106 17.955 -31.727 761 HB VAL 86 HB VAL 86 24.725 18.461 -34.404 762 HG11 VAL 86 HG11 VAL 86 26.910 16.582 -33.798 763 HG12 VAL 86 HG12 VAL 86 26.362 16.988 -35.458 764 HG13 VAL 86 HG13 VAL 86 27.234 18.162 -34.593 765 HG21 VAL 86 HG21 VAL 86 24.295 15.930 -34.598 766 HG22 VAL 86 HG22 VAL 86 24.925 15.721 -32.957 767 HG23 VAL 86 HG23 VAL 86 23.442 16.634 -33.167 768 H PHE 87 H PHE 87 27.911 19.071 -32.015 769 HA PHE 87 HA PHE 87 27.658 21.838 -32.780 770 HB2 PHE 87 HB2 PHE 87 29.165 20.528 -30.564 771 HB3 PHE 87 HB3 PHE 87 29.295 22.221 -31.046 772 HD1 PHE 87 HD2 PHE 87 27.067 23.702 -30.897 773 HD2 PHE 87 HD1 PHE 87 27.572 19.740 -29.144 774 HE1 PHE 87 HE2 PHE 87 25.121 24.076 -29.651 775 HE2 PHE 87 HE1 PHE 87 25.640 20.154 -27.667 776 HZ PHE 87 HZ PHE 87 24.402 22.354 -27.826 777 H GLN 88 H GLN 88 29.337 22.785 -33.882 778 HA GLN 88 HA GLN 88 31.296 20.992 -35.169 779 HB2 GLN 88 HB2 GLN 88 30.613 23.940 -35.350 780 HB3 GLN 88 HB3 GLN 88 31.966 23.231 -36.317 781 HG2 GLN 88 HG2 GLN 88 29.269 21.752 -36.464 782 HG3 GLN 88 HG3 GLN 88 29.155 23.295 -36.926 783 HE21 GLN 88 HE22 GLN 88 28.621 22.298 -38.992 784 HE22 GLN 88 HE21 GLN 88 29.962 22.217 -40.200 785 H GLN 89 H GLN 89 33.662 21.234 -35.008 786 HA GLN 89 HA GLN 89 34.531 22.258 -32.417 787 HB2 GLN 89 HB2 GLN 89 36.301 20.624 -34.170 788 HB3 GLN 89 HB3 GLN 89 36.666 21.061 -32.491 789 HG2 GLN 89 HG2 GLN 89 34.451 19.158 -33.248 790 HG3 GLN 89 HG3 GLN 89 35.950 18.734 -32.695 791 HE21 GLN 89 HE22 GLN 89 32.956 20.254 -31.860 792 HE22 GLN 89 HE21 GLN 89 33.243 20.775 -30.223 793 H GLN 90 H GLN 90 36.683 23.621 -32.463 794 HA GLN 90 HA GLN 90 37.599 24.634 -34.905 795 HB2 GLN 90 HB2 GLN 90 36.893 27.028 -33.143 796 HB3 GLN 90 HB3 GLN 90 37.634 26.975 -34.688 797 HG2 GLN 90 HG2 GLN 90 35.477 27.774 -35.015 798 HG3 GLN 90 HG3 GLN 90 35.582 26.119 -35.688 799 HE21 GLN 90 HE22 GLN 90 33.180 26.344 -35.367 800 HE22 GLN 90 HE21 GLN 90 32.534 25.877 -33.796 801 H THR 91 H THR 91 39.866 25.484 -34.802 802 HA THR 91 HA THR 91 40.930 26.143 -32.324 803 HB THR 91 HB THR 91 43.040 24.676 -32.747 804 HG1 THR 91 HG1 THR 91 42.302 23.934 -34.908 805 HG21 THR 91 HG21 THR 91 42.294 22.695 -31.559 806 HG22 THR 91 HG22 THR 91 41.292 24.054 -30.936 807 HG23 THR 91 HG23 THR 91 40.546 22.935 -31.951 808 H GLY 92 H GLY 92 42.813 27.290 -32.564 809 HA2 GLY 92 HA2 GLY 92 44.417 28.592 -33.695 810 HA3 GLY 92 HA3 GLY 92 43.589 28.188 -35.214 811 H GLY 93 H GLY 93 44.294 30.736 -33.422 812 HA2 GLY 93 HA2 GLY 93 42.791 32.110 -35.186 813 HA3 GLY 93 HA3 GLY 93 42.212 32.597 -33.525 814 H VAL 94 H VAL 94 43.242 34.797 -34.743 815 HA VAL 94 HA VAL 94 46.123 35.088 -34.323 816 HB VAL 94 HB VAL 94 43.877 37.059 -35.069 817 HG11 VAL 94 HG11 VAL 94 46.956 37.503 -35.303 818 HG12 VAL 94 HG12 VAL 94 45.713 38.581 -35.770 819 HG13 VAL 94 HG13 VAL 94 46.023 38.209 -33.986 820 HG21 VAL 94 HG21 VAL 94 44.879 36.923 -37.344 821 HG22 VAL 94 HG22 VAL 94 46.164 35.944 -36.674 822 HG23 VAL 94 HG23 VAL 94 44.387 35.365 -36.697 823 H TYR 95 H TYR 95 47.105 36.115 -32.582 824 HA TYR 95 HA TYR 95 45.500 37.551 -30.487 825 HB2 TYR 95 HB2 TYR 95 47.569 35.439 -29.879 826 HB3 TYR 95 HB3 TYR 95 46.821 36.358 -28.709 827 HD1 TYR 95 HD2 TYR 95 46.731 33.454 -30.837 828 HD2 TYR 95 HD1 TYR 95 44.544 35.857 -28.075 829 HE1 TYR 95 HE2 TYR 95 45.150 31.655 -30.639 830 HE2 TYR 95 HE1 TYR 95 42.735 34.067 -27.962 831 HH TYR 95 HH TYR 95 42.087 31.990 -28.779 Start of MODEL 10 1 H1 ACE 36 HH32 ACE 36 9.821 14.738 -43.651 2 H2 ACE 36 HH33 ACE 36 10.760 14.636 -45.191 3 H3 ACE 36 HH31 ACE 36 9.116 14.219 -45.242 4 H GLU 37 H GLU 37 9.765 12.284 -46.134 5 HA GLU 37 HA GLU 37 9.535 10.176 -44.370 6 HB2 GLU 37 HB2 GLU 37 8.690 10.310 -46.645 7 HB3 GLU 37 HB3 GLU 37 10.381 10.265 -47.252 8 HG2 GLU 37 HG2 GLU 37 9.372 8.119 -47.828 9 HG3 GLU 37 HG3 GLU 37 10.736 7.937 -46.703 10 H ASP 38 H ASP 38 12.200 11.644 -45.801 11 HA ASP 38 HA ASP 38 14.200 9.620 -44.866 12 HB2 ASP 38 HB2 ASP 38 14.367 11.013 -47.039 13 HB3 ASP 38 HB3 ASP 38 14.862 12.374 -45.981 14 H ALA 39 H ALA 39 12.541 11.938 -43.067 15 HA ALA 39 HA ALA 39 14.820 12.793 -41.264 16 HB1 ALA 39 HB1 ALA 39 11.879 12.983 -40.821 17 HB2 ALA 39 HB2 ALA 39 13.077 14.074 -40.204 18 HB3 ALA 39 HB3 ALA 39 12.683 14.174 -41.951 19 H PHE 40 H PHE 40 14.638 10.065 -41.561 20 HA PHE 40 HA PHE 40 13.618 8.665 -39.069 21 HB2 PHE 40 HB2 PHE 40 11.811 9.167 -41.051 22 HB3 PHE 40 HB3 PHE 40 12.546 7.567 -41.619 23 HD1 PHE 40 HD1 PHE 40 10.527 9.197 -38.886 24 HD2 PHE 40 HD2 PHE 40 12.450 5.683 -40.345 25 HE1 PHE 40 HE1 PHE 40 9.414 7.936 -37.134 26 HE2 PHE 40 HE2 PHE 40 11.028 4.313 -38.748 27 HZ PHE 40 HZ PHE 40 9.608 5.578 -37.011 28 H ILE 41 H ILE 41 15.297 7.644 -38.563 29 HA ILE 41 HA ILE 41 16.951 6.107 -40.581 30 HB ILE 41 HB ILE 41 18.045 7.434 -38.036 31 HG12 ILE 41 HG12 ILE 41 19.591 8.502 -39.640 32 HG13 ILE 41 HG13 ILE 41 18.488 8.189 -40.907 33 HG21 ILE 41 HG21 ILE 41 19.142 5.913 -40.329 34 HG22 ILE 41 HG22 ILE 41 20.165 6.560 -39.049 35 HG23 ILE 41 HG23 ILE 41 19.000 5.163 -38.745 36 HD11 ILE 41 HD11 ILE 41 17.514 9.833 -38.461 37 HD12 ILE 41 HD12 ILE 41 18.090 10.594 -39.904 38 HD13 ILE 41 HD13 ILE 41 16.783 9.534 -40.079 39 H VAL 42 H VAL 42 17.017 3.847 -40.090 40 HA VAL 42 HA VAL 42 15.957 2.999 -37.490 41 HB VAL 42 HB VAL 42 14.837 1.826 -40.193 42 HG11 VAL 42 HG11 VAL 42 14.455 0.322 -38.230 43 HG12 VAL 42 HG12 VAL 42 14.101 1.641 -37.231 44 HG13 VAL 42 HG13 VAL 42 12.955 1.183 -38.670 45 HG21 VAL 42 HG21 VAL 42 13.546 3.821 -38.380 46 HG22 VAL 42 HG22 VAL 42 14.123 4.152 -40.020 47 HG23 VAL 42 HG23 VAL 42 12.835 2.970 -39.822 48 H ILE 43 H ILE 43 17.216 1.650 -36.594 49 HA ILE 43 HA ILE 43 19.196 -0.041 -38.038 50 HB ILE 43 HB ILE 43 19.829 1.953 -35.925 51 HG12 ILE 43 HG12 ILE 43 20.867 1.878 -38.822 52 HG13 ILE 43 HG13 ILE 43 19.627 2.978 -38.214 53 HG21 ILE 43 HG21 ILE 43 22.212 1.438 -36.059 54 HG22 ILE 43 HG22 ILE 43 21.322 0.052 -35.608 55 HG23 ILE 43 HG23 ILE 43 21.964 0.246 -37.275 56 HD11 ILE 43 HD11 ILE 43 22.475 3.385 -37.364 57 HD12 ILE 43 HD12 ILE 43 21.360 4.388 -38.320 58 HD13 ILE 43 HD13 ILE 43 20.993 4.130 -36.647 59 H SEP 44 H SEP 44 19.791 -1.732 -36.912 60 HA SEP 44 HA SEP 44 19.505 -2.290 -34.007 61 HB2 SEP 44 HB2 SEP 44 18.311 -4.251 -34.145 62 HB3 SEP 44 HB3 SEP 44 17.364 -3.316 -35.290 63 H ASP 45 H ASP 45 20.573 -4.359 -33.410 64 HA ASP 45 HA ASP 45 23.067 -4.484 -35.003 65 HB2 ASP 45 HB2 ASP 45 23.075 -2.510 -33.376 66 HB3 ASP 45 HB3 ASP 45 22.913 -3.704 -32.080 67 H SEP 46 H SEP 46 21.021 -6.691 -34.198 68 HA SEP 46 HA SEP 46 23.272 -8.651 -33.588 69 HB2 SEP 46 HB2 SEP 46 21.973 -10.220 -32.434 70 HB3 SEP 46 HB3 SEP 46 21.886 -8.549 -31.863 71 H ASP 47 H ASP 47 23.154 -10.732 -34.423 72 HA ASP 47 HA ASP 47 21.992 -11.048 -37.119 73 HB2 ASP 47 HB2 ASP 47 24.252 -10.234 -37.549 74 HB3 ASP 47 HB3 ASP 47 24.918 -11.329 -36.288 75 H GLY 48 H GLY 48 20.927 -13.047 -37.372 76 HA2 GLY 48 HA2 GLY 48 21.704 -15.498 -36.050 77 HA3 GLY 48 HA3 GLY 48 20.424 -14.542 -35.151 78 H GLU 49 H GLU 49 19.962 -17.088 -36.132 79 HA GLU 49 HA GLU 49 17.382 -16.351 -36.864 80 HB2 GLU 49 HB2 GLU 49 18.107 -16.963 -38.983 81 HB3 GLU 49 HB3 GLU 49 19.092 -18.295 -38.460 82 HG2 GLU 49 HG2 GLU 49 17.153 -19.294 -39.573 83 HG3 GLU 49 HG3 GLU 49 17.084 -19.627 -37.847 84 HN1 NH2 50 HN1 NH2 50 16.082 -18.185 -36.187 85 HN2 NH2 50 HN2 NH2 50 16.434 -18.963 -34.679 86 H1 MET 1 H1 MET 1 -11.041 -27.906 -38.267 87 H2 MET 1 H2 MET 1 -11.209 -28.419 -36.746 88 H3 MET 1 H3 MET 1 -9.710 -28.344 -37.325 89 HA MET 1 HA MET 1 -11.226 -25.956 -37.045 90 HB2 MET 1 HB2 MET 1 -8.806 -26.611 -35.357 91 HB3 MET 1 HB3 MET 1 -9.983 -25.308 -35.150 92 HG2 MET 1 HG2 MET 1 -10.230 -28.198 -34.764 93 HG3 MET 1 HG3 MET 1 -10.212 -26.842 -33.479 94 HE1 MET 1 HE1 MET 1 -13.588 -26.851 -32.609 95 HE2 MET 1 HE2 MET 1 -12.475 -28.252 -32.455 96 HE3 MET 1 HE3 MET 1 -11.941 -26.488 -32.289 97 H ALA 2 H ALA 2 -10.119 -24.079 -37.800 98 HA ALA 2 HA ALA 2 -7.990 -24.440 -39.730 99 HB1 ALA 2 HB1 ALA 2 -8.062 -21.782 -39.346 100 HB2 ALA 2 HB2 ALA 2 -9.591 -22.612 -39.953 101 HB3 ALA 2 HB3 ALA 2 -9.316 -22.140 -38.252 102 H ASP 3 H ASP 3 -5.618 -23.746 -39.536 103 HA ASP 3 HA ASP 3 -4.144 -24.270 -37.428 104 HB2 ASP 3 HB2 ASP 3 -3.683 -24.178 -39.868 105 HB3 ASP 3 HB3 ASP 3 -3.566 -22.432 -39.774 106 H GLU 4 H GLU 4 -6.169 -22.249 -36.462 107 HA GLU 4 HA GLU 4 -5.090 -19.653 -36.205 108 HB2 GLU 4 HB2 GLU 4 -7.608 -20.374 -36.254 109 HB3 GLU 4 HB3 GLU 4 -7.251 -21.106 -34.657 110 HG2 GLU 4 HG2 GLU 4 -8.486 -19.021 -34.669 111 HG3 GLU 4 HG3 GLU 4 -7.061 -18.983 -33.636 112 H LYS 5 H LYS 5 -4.205 -18.612 -34.507 113 HA LYS 5 HA LYS 5 -4.043 -19.826 -31.879 114 HB2 LYS 5 HB2 LYS 5 -2.203 -20.891 -32.890 115 HB3 LYS 5 HB3 LYS 5 -1.491 -19.396 -33.342 116 HG2 LYS 5 HG2 LYS 5 -0.982 -19.024 -30.776 117 HG3 LYS 5 HG3 LYS 5 -1.973 -20.512 -30.626 118 HD2 LYS 5 HD2 LYS 5 -0.149 -21.653 -31.994 119 HD3 LYS 5 HD3 LYS 5 0.621 -20.054 -32.029 120 HE2 LYS 5 HE2 LYS 5 0.699 -20.244 -29.481 121 HE3 LYS 5 HE3 LYS 5 0.311 -21.945 -29.627 122 HZ1 LYS 5 HZ1 LYS 5 2.765 -20.705 -30.773 123 HZ2 LYS 5 HZ2 LYS 5 2.703 -21.742 -29.547 124 HZ3 LYS 5 HZ3 LYS 5 2.324 -22.284 -31.020 125 HA PRO 6 HA PRO 6 -4.164 -15.699 -30.450 126 HB2 PRO 6 HB2 PRO 6 -3.391 -15.709 -27.933 127 HB3 PRO 6 HB3 PRO 6 -4.959 -16.460 -28.485 128 HG2 PRO 6 HG2 PRO 6 -2.464 -18.066 -28.182 129 HG3 PRO 6 HG3 PRO 6 -4.046 -18.356 -27.330 130 HD2 PRO 6 HD2 PRO 6 -3.380 -19.514 -29.549 131 HD3 PRO 6 HD3 PRO 6 -4.984 -18.722 -29.574 132 H LYS 7 H LYS 7 -2.623 -13.972 -30.653 133 HA LYS 7 HA LYS 7 0.244 -14.247 -30.264 134 HB2 LYS 7 HB2 LYS 7 -0.882 -13.667 -32.563 135 HB3 LYS 7 HB3 LYS 7 -1.073 -12.025 -31.919 136 HG2 LYS 7 HG2 LYS 7 1.286 -12.053 -31.222 137 HG3 LYS 7 HG3 LYS 7 1.514 -13.527 -32.171 138 HD2 LYS 7 HD2 LYS 7 0.414 -11.999 -34.103 139 HD3 LYS 7 HD3 LYS 7 0.894 -10.724 -33.088 140 HE2 LYS 7 HE2 LYS 7 3.264 -11.258 -33.254 141 HE3 LYS 7 HE3 LYS 7 2.921 -12.690 -34.040 142 HZ1 LYS 7 HZ1 LYS 7 1.879 -11.329 -35.959 143 HZ2 LYS 7 HZ2 LYS 7 2.349 -9.978 -35.158 144 HZ3 LYS 7 HZ3 LYS 7 3.392 -11.080 -35.730 145 H GLU 8 H GLU 8 1.247 -13.003 -29.023 146 HA GLU 8 HA GLU 8 -0.011 -10.555 -27.651 147 HB2 GLU 8 HB2 GLU 8 0.930 -11.371 -25.446 148 HB3 GLU 8 HB3 GLU 8 -0.457 -12.216 -26.109 149 HG2 GLU 8 HG2 GLU 8 1.294 -13.905 -27.069 150 HG3 GLU 8 HG3 GLU 8 2.452 -13.242 -25.932 151 H GLY 9 H GLY 9 1.420 -8.833 -26.810 152 HA2 GLY 9 HA2 GLY 9 3.844 -8.510 -28.168 153 HA3 GLY 9 HA3 GLY 9 3.358 -7.646 -26.748 154 H VAL 10 H VAL 10 3.545 -10.718 -25.888 155 HA VAL 10 HA VAL 10 6.220 -10.629 -24.865 156 HB VAL 10 HB VAL 10 4.327 -13.143 -24.887 157 HG11 VAL 10 HG11 VAL 10 6.463 -13.989 -24.100 158 HG12 VAL 10 HG12 VAL 10 6.595 -12.514 -23.116 159 HG13 VAL 10 HG13 VAL 10 5.384 -13.710 -22.717 160 HG21 VAL 10 HG21 VAL 10 3.367 -12.713 -22.914 161 HG22 VAL 10 HG22 VAL 10 4.388 -11.294 -22.592 162 HG23 VAL 10 HG23 VAL 10 3.163 -11.307 -23.934 163 H LYS 11 H LYS 11 6.740 -10.191 -27.459 164 HA LYS 11 HA LYS 11 8.410 -12.595 -27.939 165 HB2 LYS 11 HB2 LYS 11 6.104 -12.539 -29.272 166 HB3 LYS 11 HB3 LYS 11 6.888 -11.234 -30.106 167 HG2 LYS 11 HG2 LYS 11 8.584 -12.479 -30.961 168 HG3 LYS 11 HG3 LYS 11 8.129 -13.970 -30.066 169 HD2 LYS 11 HD2 LYS 11 5.826 -13.635 -31.529 170 HD3 LYS 11 HD3 LYS 11 6.702 -12.345 -32.196 171 HE2 LYS 11 HE2 LYS 11 6.914 -14.276 -33.666 172 HE3 LYS 11 HE3 LYS 11 8.428 -13.746 -33.169 173 HZ1 LYS 11 HZ1 LYS 11 8.631 -15.435 -31.542 174 HZ2 LYS 11 HZ2 LYS 11 7.049 -15.927 -31.780 175 HZ3 LYS 11 HZ3 LYS 11 8.294 -16.143 -32.915 176 H THR 12 H THR 12 10.244 -12.317 -28.817 177 HA THR 12 HA THR 12 11.624 -9.830 -28.964 178 HB THR 12 HB THR 12 13.123 -10.942 -30.723 179 HG1 THR 12 HG1 THR 12 12.149 -12.368 -31.750 180 HG21 THR 12 HG21 THR 12 13.487 -11.092 -28.134 181 HG22 THR 12 HG22 THR 12 12.568 -12.522 -28.107 182 HG23 THR 12 HG23 THR 12 14.051 -12.309 -29.084 183 H GLU 13 H GLU 13 10.201 -11.390 -31.793 184 HA GLU 13 HA GLU 13 10.436 -9.196 -33.574 185 HB2 GLU 13 HB2 GLU 13 8.531 -11.527 -33.929 186 HB3 GLU 13 HB3 GLU 13 9.211 -10.419 -35.140 187 HG2 GLU 13 HG2 GLU 13 10.212 -12.757 -33.617 188 HG3 GLU 13 HG3 GLU 13 10.389 -12.270 -35.322 189 H ASN 14 H ASN 14 8.512 -9.067 -31.008 190 HA ASN 14 HA ASN 14 7.041 -6.728 -32.151 191 HB2 ASN 14 HB2 ASN 14 5.898 -8.669 -30.095 192 HB3 ASN 14 HB3 ASN 14 5.139 -7.224 -30.838 193 HD21 ASN 14 HD22 ASN 14 4.586 -7.476 -33.130 194 HD22 ASN 14 HD21 ASN 14 4.525 -8.947 -33.917 195 H ASN 15 H ASN 15 9.610 -7.132 -30.115 196 HA ASN 15 HA ASN 15 8.742 -5.671 -27.831 197 HB2 ASN 15 HB2 ASN 15 10.573 -7.493 -27.791 198 HB3 ASN 15 HB3 ASN 15 11.488 -6.538 -28.961 199 HD21 ASN 15 HD22 ASN 15 13.079 -5.454 -28.180 200 HD22 ASN 15 HD21 ASN 15 13.205 -4.859 -26.525 201 H ASP 16 H ASP 16 9.519 -3.761 -27.049 202 HA ASP 16 HA ASP 16 9.019 -1.487 -28.883 203 HB2 ASP 16 HB2 ASP 16 10.075 -1.242 -26.077 204 HB3 ASP 16 HB3 ASP 16 9.328 -0.086 -27.054 205 H HIS 17 H HIS 17 10.457 -0.642 -30.261 206 HA HIS 17 HA HIS 17 13.326 0.042 -29.688 207 HB2 HIS 17 HB2 HIS 17 11.070 0.863 -31.550 208 HB3 HIS 17 HB3 HIS 17 12.729 1.453 -31.661 209 HD2 HIS 17 HD2 HIS 17 14.445 -1.100 -32.049 210 HE1 HIS 17 HE1 HIS 17 11.450 -3.176 -34.271 211 HE2 HIS 17 HE2 HIS 17 13.871 -3.159 -33.597 212 H ILE 18 H ILE 18 14.109 2.102 -29.603 213 HA ILE 18 HA ILE 18 12.427 4.015 -27.880 214 HB ILE 18 HB ILE 18 14.328 3.409 -26.703 215 HG12 ILE 18 HG12 ILE 18 14.715 6.255 -27.572 216 HG13 ILE 18 HG13 ILE 18 13.304 5.861 -26.508 217 HG21 ILE 18 HG21 ILE 18 15.818 2.871 -28.543 218 HG22 ILE 18 HG22 ILE 18 15.985 4.466 -29.039 219 HG23 ILE 18 HG23 ILE 18 16.664 3.915 -27.364 220 HD11 ILE 18 HD11 ILE 18 16.120 5.252 -25.864 221 HD12 ILE 18 HD12 ILE 18 15.149 6.699 -25.471 222 HD13 ILE 18 HD13 ILE 18 14.614 4.977 -24.954 223 H ASN 19 H ASN 19 12.110 6.112 -28.536 224 HA ASN 19 HA ASN 19 12.754 6.684 -31.358 225 HB2 ASN 19 HB2 ASN 19 10.489 7.636 -29.587 226 HB3 ASN 19 HB3 ASN 19 10.536 7.882 -31.376 227 HD21 ASN 19 HD22 ASN 19 10.094 5.436 -28.695 228 HD22 ASN 19 HD21 ASN 19 9.294 4.382 -29.796 229 H LEU 20 H LEU 20 14.614 7.724 -31.109 230 HA LEU 20 HA LEU 20 14.821 10.355 -29.522 231 HB2 LEU 20 HB2 LEU 20 16.830 8.356 -30.780 232 HB3 LEU 20 HB3 LEU 20 17.219 9.958 -30.198 233 HG LEU 20 HG LEU 20 15.874 7.909 -28.421 234 HD11 LEU 20 HD11 LEU 20 18.990 8.477 -28.497 235 HD12 LEU 20 HD12 LEU 20 18.212 7.579 -27.309 236 HD13 LEU 20 HD13 LEU 20 18.056 6.945 -28.948 237 HD21 LEU 20 HD21 LEU 20 17.700 10.242 -27.670 238 HD22 LEU 20 HD22 LEU 20 15.898 10.260 -27.775 239 HD23 LEU 20 HD23 LEU 20 16.802 9.258 -26.535 240 H LYS 21 H LYS 21 15.594 12.305 -30.441 241 HA LYS 21 HA LYS 21 15.969 12.294 -33.364 242 HB2 LYS 21 HB2 LYS 21 14.982 14.394 -31.383 243 HB3 LYS 21 HB3 LYS 21 15.221 14.715 -33.055 244 HG2 LYS 21 HG2 LYS 21 13.602 12.834 -33.632 245 HG3 LYS 21 HG3 LYS 21 13.227 12.827 -31.915 246 HD2 LYS 21 HD2 LYS 21 12.884 15.307 -32.172 247 HD3 LYS 21 HD3 LYS 21 12.842 15.176 -33.878 248 HE2 LYS 21 HE2 LYS 21 10.531 15.268 -33.310 249 HE3 LYS 21 HE3 LYS 21 10.979 13.699 -33.928 250 HZ1 LYS 21 HZ1 LYS 21 11.090 14.109 -31.036 251 HZ2 LYS 21 HZ2 LYS 21 9.557 13.882 -31.720 252 HZ3 LYS 21 HZ3 LYS 21 10.647 12.744 -31.773 253 H VAL 22 H VAL 22 17.352 13.910 -34.271 254 HA VAL 22 HA VAL 22 19.688 14.768 -32.580 255 HB VAL 22 HB VAL 22 19.946 13.454 -35.336 256 HG11 VAL 22 HG11 VAL 22 21.835 14.853 -35.266 257 HG12 VAL 22 HG12 VAL 22 22.133 14.507 -33.529 258 HG13 VAL 22 HG13 VAL 22 22.325 13.234 -34.656 259 HG21 VAL 22 HG21 VAL 22 21.190 11.658 -33.866 260 HG22 VAL 22 HG22 VAL 22 20.556 12.386 -32.479 261 HG23 VAL 22 HG23 VAL 22 19.366 11.766 -33.609 262 H ALA 23 H ALA 23 19.337 16.725 -32.331 263 HA ALA 23 HA ALA 23 18.968 18.559 -34.691 264 HB1 ALA 23 HB1 ALA 23 16.995 18.359 -33.423 265 HB2 ALA 23 HB2 ALA 23 17.923 18.783 -31.905 266 HB3 ALA 23 HB3 ALA 23 17.740 20.004 -33.116 267 H GLY 24 H GLY 24 19.481 20.775 -34.569 268 HA2 GLY 24 HA2 GLY 24 22.213 21.207 -33.265 269 HA3 GLY 24 HA3 GLY 24 21.990 21.141 -35.027 270 H GLN 25 H GLN 25 23.264 23.133 -34.301 271 HA GLN 25 HA GLN 25 21.603 25.290 -33.122 272 HB2 GLN 25 HB2 GLN 25 24.388 25.265 -34.253 273 HB3 GLN 25 HB3 GLN 25 23.793 26.581 -33.172 274 HG2 GLN 25 HG2 GLN 25 25.105 24.079 -32.492 275 HG3 GLN 25 HG3 GLN 25 25.120 25.700 -31.776 276 HE21 GLN 25 HE22 GLN 25 24.132 22.720 -31.388 277 HE22 GLN 25 HE21 GLN 25 22.763 22.869 -30.198 278 H ASP 26 H ASP 26 22.252 24.014 -36.162 279 HA ASP 26 HA ASP 26 21.678 26.353 -37.808 280 HB2 ASP 26 HB2 ASP 26 21.904 24.894 -39.652 281 HB3 ASP 26 HB3 ASP 26 23.173 24.699 -38.611 282 H GLY 27 H GLY 27 19.793 24.517 -35.792 283 HA2 GLY 27 HA2 GLY 27 17.446 24.218 -35.649 284 HA3 GLY 27 HA3 GLY 27 17.267 25.063 -37.212 285 H SER 28 H SER 28 19.359 22.365 -37.442 286 HA SER 28 HA SER 28 17.384 21.046 -39.104 287 HB2 SER 28 HB2 SER 28 19.194 19.281 -39.445 288 HB3 SER 28 HB3 SER 28 19.876 20.873 -39.730 289 HG SER 28 HG SER 28 21.003 20.740 -38.114 290 H VAL 29 H VAL 29 16.518 18.922 -38.942 291 HA VAL 29 HA VAL 29 16.665 17.504 -36.369 292 HB VAL 29 HB VAL 29 13.871 18.315 -37.425 293 HG11 VAL 29 HG11 VAL 29 14.767 16.452 -35.142 294 HG12 VAL 29 HG12 VAL 29 13.025 17.143 -35.490 295 HG13 VAL 29 HG13 VAL 29 13.819 16.025 -36.538 296 HG21 VAL 29 HG21 VAL 29 13.571 19.423 -35.185 297 HG22 VAL 29 HG22 VAL 29 15.200 19.156 -34.719 298 HG23 VAL 29 HG23 VAL 29 14.934 20.244 -36.096 299 H VAL 30 H VAL 30 16.575 15.463 -36.399 300 HA VAL 30 HA VAL 30 15.287 14.009 -38.675 301 HB VAL 30 HB VAL 30 16.949 12.216 -38.416 302 HG11 VAL 30 HG11 VAL 30 16.643 13.786 -40.426 303 HG12 VAL 30 HG12 VAL 30 18.050 14.673 -39.753 304 HG13 VAL 30 HG13 VAL 30 18.296 13.115 -40.454 305 HG21 VAL 30 HG21 VAL 30 19.120 14.132 -37.697 306 HG22 VAL 30 HG22 VAL 30 18.194 13.042 -36.575 307 HG23 VAL 30 HG23 VAL 30 19.149 12.400 -37.936 308 H GLN 31 H GLN 31 14.043 12.079 -37.831 309 HA GLN 31 HA GLN 31 14.677 11.333 -35.084 310 HB2 GLN 31 HB2 GLN 31 12.357 12.036 -35.807 311 HB3 GLN 31 HB3 GLN 31 12.216 10.488 -36.683 312 HG2 GLN 31 HG2 GLN 31 12.387 9.258 -34.482 313 HG3 GLN 31 HG3 GLN 31 12.643 10.685 -33.738 314 HE21 GLN 31 HE22 GLN 31 10.401 8.530 -34.749 315 HE22 GLN 31 HE21 GLN 31 8.908 9.281 -34.330 316 H PHE 32 H PHE 32 14.793 9.246 -34.310 317 HA PHE 32 HA PHE 32 15.848 7.223 -36.087 318 HB2 PHE 32 HB2 PHE 32 16.774 8.256 -33.496 319 HB3 PHE 32 HB3 PHE 32 17.353 6.611 -33.940 320 HD1 PHE 32 HD1 PHE 32 17.556 10.139 -34.895 321 HD2 PHE 32 HD2 PHE 32 19.231 6.195 -35.621 322 HE1 PHE 32 HE1 PHE 32 19.428 11.174 -36.164 323 HE2 PHE 32 HE2 PHE 32 21.113 7.307 -36.703 324 HZ PHE 32 HZ PHE 32 21.311 9.629 -37.021 325 H LYS 33 H LYS 33 15.594 5.149 -35.365 326 HA LYS 33 HA LYS 33 13.942 4.421 -33.003 327 HB2 LYS 33 HB2 LYS 33 12.278 4.768 -35.087 328 HB3 LYS 33 HB3 LYS 33 13.228 3.537 -35.934 329 HG2 LYS 33 HG2 LYS 33 12.637 2.154 -33.712 330 HG3 LYS 33 HG3 LYS 33 11.329 3.373 -33.508 331 HD2 LYS 33 HD2 LYS 33 10.527 2.816 -35.881 332 HD3 LYS 33 HD3 LYS 33 11.790 1.546 -35.931 333 HE2 LYS 33 HE2 LYS 33 10.733 0.620 -33.854 334 HE3 LYS 33 HE3 LYS 33 9.516 1.858 -33.930 335 HZ1 LYS 33 HZ1 LYS 33 8.875 -0.349 -34.963 336 HZ2 LYS 33 HZ2 LYS 33 8.875 0.825 -36.143 337 HZ3 LYS 33 HZ3 LYS 33 10.007 -0.227 -36.121 338 H ILE 34 H ILE 34 14.962 3.249 -32.041 339 HA ILE 34 HA ILE 34 16.529 1.042 -33.308 340 HB ILE 34 HB ILE 34 18.697 1.758 -32.196 341 HG12 ILE 34 HG12 ILE 34 17.117 4.102 -31.211 342 HG13 ILE 34 HG13 ILE 34 17.193 2.709 -30.213 343 HG21 ILE 34 HG21 ILE 34 18.171 2.590 -34.300 344 HG22 ILE 34 HG22 ILE 34 17.557 4.176 -33.658 345 HG23 ILE 34 HG23 ILE 34 19.187 3.707 -33.537 346 HD11 ILE 34 HD11 ILE 34 19.566 4.410 -31.146 347 HD12 ILE 34 HD12 ILE 34 18.824 4.413 -29.590 348 HD13 ILE 34 HD13 ILE 34 19.565 2.876 -30.010 349 H LYS 35 H LYS 35 17.771 -0.347 -31.673 350 HA LYS 35 HA LYS 35 16.008 -1.471 -29.669 351 HB2 LYS 35 HB2 LYS 35 18.804 -2.332 -30.662 352 HB3 LYS 35 HB3 LYS 35 18.075 -2.958 -29.194 353 HG2 LYS 35 HG2 LYS 35 16.022 -3.696 -30.649 354 HG3 LYS 35 HG3 LYS 35 16.896 -2.957 -31.997 355 HD2 LYS 35 HD2 LYS 35 18.583 -4.789 -31.799 356 HD3 LYS 35 HD3 LYS 35 18.009 -5.230 -30.205 357 HE2 LYS 35 HE2 LYS 35 16.136 -6.421 -31.268 358 HE3 LYS 35 HE3 LYS 35 16.199 -5.427 -32.716 359 HZ1 LYS 35 HZ1 LYS 35 18.345 -7.339 -31.801 360 HZ2 LYS 35 HZ2 LYS 35 17.198 -7.902 -32.715 361 HZ3 LYS 35 HZ3 LYS 35 18.181 -6.721 -33.356 362 H ARG 36 H ARG 36 16.352 -0.843 -27.433 363 HA ARG 36 HA ARG 36 17.596 1.639 -26.806 364 HB2 ARG 36 HB2 ARG 36 15.716 0.158 -25.661 365 HB3 ARG 36 HB3 ARG 36 17.046 -0.604 -24.875 366 HG2 ARG 36 HG2 ARG 36 17.633 1.687 -23.795 367 HG3 ARG 36 HG3 ARG 36 16.295 2.347 -24.700 368 HD2 ARG 36 HD2 ARG 36 15.566 1.934 -22.522 369 HD3 ARG 36 HD3 ARG 36 14.998 0.435 -23.325 370 HE ARG 36 HE ARG 36 17.048 -0.698 -22.425 371 HH11 ARG 36 HH11 ARG 36 16.761 2.462 -21.089 372 HH12 ARG 36 HH12 ARG 36 16.916 1.945 -19.453 373 HH21 ARG 36 HH21 ARG 36 17.467 -1.275 -20.529 374 HH22 ARG 36 HH22 ARG 36 17.609 -0.225 -19.104 375 H HIS 37 H HIS 37 19.170 -1.551 -26.814 376 HA HIS 37 HA HIS 37 21.553 -0.295 -25.552 377 HB2 HIS 37 HB2 HIS 37 22.142 -2.703 -24.931 378 HB3 HIS 37 HB3 HIS 37 20.492 -2.418 -24.500 379 HD2 HIS 37 HD2 HIS 37 22.795 -4.702 -26.387 380 HE1 HIS 37 HE1 HIS 37 19.090 -5.444 -28.336 381 HE2 HIS 37 HE2 HIS 37 21.527 -6.174 -28.014 382 H THR 38 H THR 38 20.772 -0.238 -28.474 383 HA THR 38 HA THR 38 23.130 -1.108 -29.869 384 HB THR 38 HB THR 38 21.005 0.964 -30.458 385 HG1 THR 38 HG1 THR 38 21.179 -1.651 -30.557 386 HG21 THR 38 HG21 THR 38 22.843 -0.183 -32.660 387 HG22 THR 38 HG22 THR 38 21.742 1.097 -32.675 388 HG23 THR 38 HG23 THR 38 23.151 1.411 -31.821 389 HA PRO 39 HA PRO 39 25.738 2.317 -28.167 390 HB2 PRO 39 HB2 PRO 39 27.977 2.051 -29.902 391 HB3 PRO 39 HB3 PRO 39 27.656 1.102 -28.457 392 HG2 PRO 39 HG2 PRO 39 26.951 0.700 -31.319 393 HG3 PRO 39 HG3 PRO 39 27.711 -0.597 -30.383 394 HD2 PRO 39 HD2 PRO 39 25.051 -0.785 -30.710 395 HD3 PRO 39 HD3 PRO 39 25.813 -0.945 -29.135 396 H LEU 40 H LEU 40 26.106 4.313 -28.326 397 HA LEU 40 HA LEU 40 24.641 5.682 -30.345 398 HB2 LEU 40 HB2 LEU 40 26.374 6.774 -28.045 399 HB3 LEU 40 HB3 LEU 40 25.420 7.760 -29.153 400 HG LEU 40 HG LEU 40 24.362 5.524 -27.332 401 HD11 LEU 40 HD11 LEU 40 24.936 7.398 -25.909 402 HD12 LEU 40 HD12 LEU 40 23.881 8.440 -26.968 403 HD13 LEU 40 HD13 LEU 40 23.214 7.086 -25.994 404 HD21 LEU 40 HD21 LEU 40 22.932 7.373 -29.287 405 HD22 LEU 40 HD22 LEU 40 22.789 5.575 -29.061 406 HD23 LEU 40 HD23 LEU 40 22.143 6.819 -27.914 407 H SER 41 H SER 41 27.937 4.577 -30.341 408 HA SER 41 HA SER 41 29.110 6.133 -32.188 409 HB2 SER 41 HB2 SER 41 30.514 4.278 -32.651 410 HB3 SER 41 HB3 SER 41 30.065 4.382 -31.005 411 HG SER 41 HG SER 41 29.780 2.198 -32.001 412 H LYS 42 H LYS 42 26.734 3.582 -32.896 413 HA LYS 42 HA LYS 42 26.923 3.880 -35.661 414 HB2 LYS 42 HB2 LYS 42 24.823 2.580 -33.813 415 HB3 LYS 42 HB3 LYS 42 24.606 2.455 -35.457 416 HG2 LYS 42 HG2 LYS 42 26.790 1.408 -35.922 417 HG3 LYS 42 HG3 LYS 42 27.149 1.453 -34.147 418 HD2 LYS 42 HD2 LYS 42 25.209 -0.223 -33.862 419 HD3 LYS 42 HD3 LYS 42 24.832 -0.055 -35.584 420 HE2 LYS 42 HE2 LYS 42 27.583 -1.138 -34.611 421 HE3 LYS 42 HE3 LYS 42 26.138 -2.051 -34.659 422 HZ1 LYS 42 HZ1 LYS 42 27.533 -2.289 -36.590 423 HZ2 LYS 42 HZ2 LYS 42 25.911 -2.222 -36.758 424 HZ3 LYS 42 HZ3 LYS 42 26.820 -0.890 -37.122 425 H LEU 43 H LEU 43 25.054 5.478 -33.282 426 HA LEU 43 HA LEU 43 23.323 6.989 -35.281 427 HB2 LEU 43 HB2 LEU 43 23.652 7.507 -32.306 428 HB3 LEU 43 HB3 LEU 43 22.543 8.394 -33.399 429 HG LEU 43 HG LEU 43 21.390 6.350 -33.996 430 HD11 LEU 43 HD11 LEU 43 22.846 4.500 -33.105 431 HD12 LEU 43 HD12 LEU 43 22.612 5.110 -31.552 432 HD13 LEU 43 HD13 LEU 43 21.155 4.565 -32.521 433 HD21 LEU 43 HD21 LEU 43 21.355 7.307 -31.107 434 HD22 LEU 43 HD22 LEU 43 20.450 8.110 -32.401 435 HD23 LEU 43 HD23 LEU 43 19.950 6.530 -31.790 436 H MET 44 H MET 44 26.057 7.874 -33.265 437 HA MET 44 HA MET 44 26.411 10.368 -34.482 438 HB2 MET 44 HB2 MET 44 28.536 8.633 -33.171 439 HB3 MET 44 HB3 MET 44 28.734 10.265 -33.867 440 HG2 MET 44 HG2 MET 44 26.808 10.894 -32.135 441 HG3 MET 44 HG3 MET 44 26.936 9.252 -31.574 442 HE1 MET 44 HE1 MET 44 28.463 8.182 -29.937 443 HE2 MET 44 HE2 MET 44 29.901 8.175 -30.807 444 HE3 MET 44 HE3 MET 44 29.939 8.997 -29.219 445 H LYS 45 H LYS 45 27.660 7.141 -35.732 446 HA LYS 45 HA LYS 45 29.064 8.215 -38.051 447 HB2 LYS 45 HB2 LYS 45 27.857 5.464 -37.479 448 HB3 LYS 45 HB3 LYS 45 28.815 5.910 -38.834 449 HG2 LYS 45 HG2 LYS 45 30.779 6.343 -37.794 450 HG3 LYS 45 HG3 LYS 45 30.110 6.090 -36.148 451 HD2 LYS 45 HD2 LYS 45 30.090 4.130 -38.462 452 HD3 LYS 45 HD3 LYS 45 31.485 4.407 -37.445 453 HE2 LYS 45 HE2 LYS 45 29.618 3.925 -35.565 454 HE3 LYS 45 HE3 LYS 45 29.002 2.885 -36.723 455 HZ1 LYS 45 HZ1 LYS 45 31.446 1.965 -36.875 456 HZ2 LYS 45 HZ2 LYS 45 31.756 2.915 -35.579 457 HZ3 LYS 45 HZ3 LYS 45 30.635 1.705 -35.426 458 H ALA 46 H ALA 46 25.617 7.017 -37.649 459 HA ALA 46 HA ALA 46 25.164 7.516 -40.510 460 HB1 ALA 46 HB1 ALA 46 23.053 7.553 -38.301 461 HB2 ALA 46 HB2 ALA 46 22.791 7.098 -40.028 462 HB3 ALA 46 HB3 ALA 46 23.789 6.091 -38.969 463 H TYR 47 H TYR 47 24.748 9.609 -37.744 464 HA TYR 47 HA TYR 47 23.590 11.658 -39.230 465 HB2 TYR 47 HB2 TYR 47 23.620 11.673 -36.807 466 HB3 TYR 47 HB3 TYR 47 25.383 11.833 -36.882 467 HD1 TYR 47 HD2 TYR 47 26.502 13.986 -37.563 468 HD2 TYR 47 HD1 TYR 47 22.193 13.779 -37.376 469 HE1 TYR 47 HE2 TYR 47 26.372 16.401 -37.787 470 HE2 TYR 47 HE1 TYR 47 22.061 16.229 -37.539 471 HH TYR 47 HH TYR 47 23.216 18.091 -37.863 472 H CYS 48 H CYS 48 27.053 11.065 -38.540 473 HA CYS 48 HA CYS 48 28.114 13.334 -39.808 474 HB2 CYS 48 HB2 CYS 48 29.068 11.784 -37.953 475 HB3 CYS 48 HB3 CYS 48 29.524 10.678 -39.216 476 HG CYS 48 HG CYS 48 30.930 12.049 -40.480 477 H GLU 49 H GLU 49 27.533 10.022 -41.012 478 HA GLU 49 HA GLU 49 28.602 10.591 -43.665 479 HB2 GLU 49 HB2 GLU 49 26.690 8.469 -42.851 480 HB3 GLU 49 HB3 GLU 49 27.465 8.494 -44.428 481 HG2 GLU 49 HG2 GLU 49 29.678 8.128 -43.248 482 HG3 GLU 49 HG3 GLU 49 28.826 8.121 -41.707 483 H ARG 50 H ARG 50 25.318 10.759 -42.400 484 HA ARG 50 HA ARG 50 24.129 11.638 -45.021 485 HB2 ARG 50 HB2 ARG 50 23.335 11.938 -42.094 486 HB3 ARG 50 HB3 ARG 50 22.313 12.540 -43.464 487 HG2 ARG 50 HG2 ARG 50 22.190 10.247 -44.398 488 HG3 ARG 50 HG3 ARG 50 23.089 9.712 -42.909 489 HD2 ARG 50 HD2 ARG 50 21.447 10.084 -41.517 490 HD3 ARG 50 HD3 ARG 50 20.605 11.180 -42.652 491 HE ARG 50 HE ARG 50 20.798 8.168 -43.098 492 HH11 ARG 50 HH11 ARG 50 19.182 11.109 -43.674 493 HH12 ARG 50 HH12 ARG 50 17.637 10.404 -44.097 494 HH21 ARG 50 HH21 ARG 50 18.637 7.144 -43.669 495 HH22 ARG 50 HH22 ARG 50 17.384 8.290 -44.098 496 H GLN 51 H GLN 51 25.901 13.430 -42.447 497 HA GLN 51 HA GLN 51 25.667 15.942 -43.911 498 HB2 GLN 51 HB2 GLN 51 27.203 14.928 -41.494 499 HB3 GLN 51 HB3 GLN 51 27.429 16.618 -42.229 500 HG2 GLN 51 HG2 GLN 51 24.692 15.726 -41.630 501 HG3 GLN 51 HG3 GLN 51 25.572 15.968 -40.311 502 HE21 GLN 51 HE22 GLN 51 23.565 17.907 -40.552 503 HE22 GLN 51 HE21 GLN 51 24.277 19.375 -40.847 504 H GLY 52 H GLY 52 27.995 13.222 -43.951 505 HA2 GLY 52 HA2 GLY 52 29.672 12.636 -45.283 506 HA3 GLY 52 HA3 GLY 52 29.446 14.137 -46.286 507 H LEU 53 H LEU 53 30.335 13.566 -42.955 508 HA LEU 53 HA LEU 53 32.589 15.496 -43.255 509 HB2 LEU 53 HB2 LEU 53 30.436 15.363 -41.004 510 HB3 LEU 53 HB3 LEU 53 31.902 16.357 -41.016 511 HG LEU 53 HG LEU 53 29.557 16.665 -42.819 512 HD11 LEU 53 HD11 LEU 53 29.190 17.090 -40.467 513 HD12 LEU 53 HD12 LEU 53 30.500 18.285 -40.514 514 HD13 LEU 53 HD13 LEU 53 29.148 18.632 -41.430 515 HD21 LEU 53 HD21 LEU 53 30.671 18.727 -43.278 516 HD22 LEU 53 HD22 LEU 53 32.098 18.352 -42.189 517 HD23 LEU 53 HD23 LEU 53 31.795 17.409 -43.657 518 H SER 54 H SER 54 33.600 15.278 -40.599 519 HA SER 54 HA SER 54 33.752 12.289 -39.988 520 HB2 SER 54 HB2 SER 54 35.957 13.296 -40.876 521 HB3 SER 54 HB3 SER 54 35.950 14.430 -39.459 522 HG SER 54 HG SER 54 36.069 11.626 -39.598 523 H MET 55 H MET 55 33.314 11.748 -37.981 524 HA MET 55 HA MET 55 32.338 13.483 -35.964 525 HB2 MET 55 HB2 MET 55 33.854 10.864 -35.735 526 HB3 MET 55 HB3 MET 55 32.933 11.612 -34.320 527 HG2 MET 55 HG2 MET 55 30.997 11.275 -35.309 528 HG3 MET 55 HG3 MET 55 31.798 10.633 -36.854 529 HE1 MET 55 HE1 MET 55 32.830 9.454 -33.149 530 HE2 MET 55 HE2 MET 55 31.252 10.059 -33.094 531 HE3 MET 55 HE3 MET 55 31.331 8.376 -32.923 532 H ARG 56 H ARG 56 35.655 12.882 -36.786 533 HA ARG 56 HA ARG 56 37.095 13.708 -34.445 534 HB2 ARG 56 HB2 ARG 56 37.908 12.602 -36.598 535 HB3 ARG 56 HB3 ARG 56 37.901 14.226 -37.329 536 HG2 ARG 56 HG2 ARG 56 39.498 15.069 -35.582 537 HG3 ARG 56 HG3 ARG 56 39.480 13.392 -34.924 538 HD2 ARG 56 HD2 ARG 56 40.286 12.625 -37.105 539 HD3 ARG 56 HD3 ARG 56 40.203 14.374 -37.480 540 HE ARG 56 HE ARG 56 42.065 13.424 -35.253 541 HH11 ARG 56 HH11 ARG 56 41.749 15.416 -38.207 542 HH12 ARG 56 HH12 ARG 56 43.137 16.206 -37.923 543 HH21 ARG 56 HH21 ARG 56 43.696 14.466 -34.991 544 HH22 ARG 56 HH22 ARG 56 44.479 15.495 -36.248 545 H GLN 57 H GLN 57 35.630 15.760 -37.023 546 HA GLN 57 HA GLN 57 36.634 18.320 -35.900 547 HB2 GLN 57 HB2 GLN 57 36.354 18.013 -38.198 548 HB3 GLN 57 HB3 GLN 57 34.757 17.349 -38.054 549 HG2 GLN 57 HG2 GLN 57 34.177 19.806 -37.332 550 HG3 GLN 57 HG3 GLN 57 35.757 20.170 -37.803 551 HE21 GLN 57 HE22 GLN 57 34.313 21.513 -39.292 552 HE22 GLN 57 HE21 GLN 57 33.980 20.778 -40.895 553 H ILE 58 H ILE 58 33.519 16.490 -36.139 554 HA ILE 58 HA ILE 58 32.230 18.664 -34.711 555 HB ILE 58 HB ILE 58 30.091 17.633 -35.361 556 HG12 ILE 58 HG12 ILE 58 31.814 15.505 -36.621 557 HG13 ILE 58 HG13 ILE 58 30.583 15.296 -35.228 558 HG21 ILE 58 HG21 ILE 58 31.224 19.114 -36.860 559 HG22 ILE 58 HG22 ILE 58 32.006 17.752 -37.732 560 HG23 ILE 58 HG23 ILE 58 30.180 18.035 -37.733 561 HD11 ILE 58 HD11 ILE 58 28.997 16.228 -37.051 562 HD12 ILE 58 HD12 ILE 58 30.107 15.517 -38.169 563 HD13 ILE 58 HD13 ILE 58 29.353 14.488 -36.920 564 H ARG 59 H ARG 59 30.425 18.097 -33.349 565 HA ARG 59 HA ARG 59 31.290 16.128 -31.249 566 HB2 ARG 59 HB2 ARG 59 30.735 19.059 -30.531 567 HB3 ARG 59 HB3 ARG 59 31.013 17.708 -29.460 568 HG2 ARG 59 HG2 ARG 59 33.213 18.412 -31.472 569 HG3 ARG 59 HG3 ARG 59 32.998 19.265 -29.928 570 HD2 ARG 59 HD2 ARG 59 33.177 17.075 -28.747 571 HD3 ARG 59 HD3 ARG 59 33.364 16.326 -30.312 572 HE ARG 59 HE ARG 59 35.456 17.703 -28.944 573 HH11 ARG 59 HH11 ARG 59 34.437 16.321 -32.091 574 HH12 ARG 59 HH12 ARG 59 36.008 16.010 -32.640 575 HH21 ARG 59 HH21 ARG 59 37.484 17.150 -29.730 576 HH22 ARG 59 HH22 ARG 59 37.789 16.776 -31.341 577 H PHE 60 H PHE 60 29.589 15.291 -29.734 578 HA PHE 60 HA PHE 60 26.813 15.991 -30.576 579 HB2 PHE 60 HB2 PHE 60 28.072 13.323 -30.229 580 HB3 PHE 60 HB3 PHE 60 26.281 13.678 -30.462 581 HD1 PHE 60 HD2 PHE 60 25.552 14.370 -32.544 582 HD2 PHE 60 HD1 PHE 60 29.503 13.039 -31.864 583 HE1 PHE 60 HE2 PHE 60 25.691 13.961 -34.955 584 HE2 PHE 60 HE1 PHE 60 29.592 12.310 -34.313 585 HZ PHE 60 HZ PHE 60 27.814 12.846 -35.842 586 H ARG 61 H ARG 61 25.460 16.000 -28.921 587 HA ARG 61 HA ARG 61 26.332 15.529 -26.047 588 HB2 ARG 61 HB2 ARG 61 25.025 18.198 -26.765 589 HB3 ARG 61 HB3 ARG 61 25.441 17.573 -25.216 590 HG2 ARG 61 HG2 ARG 61 27.810 17.460 -26.080 591 HG3 ARG 61 HG3 ARG 61 27.218 18.280 -27.621 592 HD2 ARG 61 HD2 ARG 61 26.618 20.144 -26.199 593 HD3 ARG 61 HD3 ARG 61 27.381 19.368 -24.784 594 HE ARG 61 HE ARG 61 29.456 19.497 -26.583 595 HH11 ARG 61 HH11 ARG 61 27.304 22.168 -25.709 596 HH12 ARG 61 HH12 ARG 61 28.394 23.305 -26.402 597 HH21 ARG 61 HH21 ARG 61 30.598 20.790 -27.437 598 HH22 ARG 61 HH22 ARG 61 30.157 22.518 -27.627 599 H PHE 62 H PHE 62 24.940 15.579 -24.440 600 HA PHE 62 HA PHE 62 22.107 15.948 -24.558 601 HB2 PHE 62 HB2 PHE 62 22.232 13.717 -25.308 602 HB3 PHE 62 HB3 PHE 62 23.075 13.068 -23.956 603 HD1 PHE 62 HD2 PHE 62 19.970 14.771 -25.075 604 HD2 PHE 62 HD1 PHE 62 21.907 12.541 -21.908 605 HE1 PHE 62 HE2 PHE 62 17.773 14.193 -23.995 606 HE2 PHE 62 HE1 PHE 62 19.870 12.049 -20.790 607 HZ PHE 62 HZ PHE 62 17.646 12.800 -22.098 608 H ASP 63 H ASP 63 21.273 16.688 -22.848 609 HA ASP 63 HA ASP 63 21.189 17.774 -20.857 610 HB2 ASP 63 HB2 ASP 63 21.190 15.095 -20.474 611 HB3 ASP 63 HB3 ASP 63 22.644 15.455 -19.528 612 H GLY 64 H GLY 64 23.686 18.442 -22.312 613 HA2 GLY 64 HA2 GLY 64 25.199 20.196 -21.791 614 HA3 GLY 64 HA3 GLY 64 24.968 19.779 -20.081 615 H GLN 65 H GLN 65 25.584 16.795 -21.544 616 HA GLN 65 HA GLN 65 28.329 16.935 -20.960 617 HB2 GLN 65 HB2 GLN 65 26.210 14.767 -21.000 618 HB3 GLN 65 HB3 GLN 65 27.848 14.272 -20.546 619 HG2 GLN 65 HG2 GLN 65 25.797 16.008 -18.976 620 HG3 GLN 65 HG3 GLN 65 26.538 14.496 -18.501 621 HE21 GLN 65 HE22 GLN 65 26.667 17.032 -16.946 622 HE22 GLN 65 HE21 GLN 65 28.333 17.470 -16.879 623 HA PRO 66 HA PRO 66 29.232 15.364 -25.153 624 HB2 PRO 66 HB2 PRO 66 31.560 13.910 -24.459 625 HB3 PRO 66 HB3 PRO 66 31.389 15.608 -25.070 626 HG2 PRO 66 HG2 PRO 66 32.122 14.617 -22.377 627 HG3 PRO 66 HG3 PRO 66 32.353 16.193 -23.042 628 HD2 PRO 66 HD2 PRO 66 30.122 15.310 -21.289 629 HD3 PRO 66 HD3 PRO 66 30.408 16.967 -21.895 630 H ILE 67 H ILE 67 28.690 13.663 -26.345 631 HA ILE 67 HA ILE 67 27.950 11.156 -25.009 632 HB ILE 67 HB ILE 67 27.390 11.978 -27.887 633 HG12 ILE 67 HG12 ILE 67 25.511 11.494 -25.586 634 HG13 ILE 67 HG13 ILE 67 26.160 13.085 -25.800 635 HG21 ILE 67 HG21 ILE 67 27.701 9.629 -27.755 636 HG22 ILE 67 HG22 ILE 67 26.663 9.539 -26.305 637 HG23 ILE 67 HG23 ILE 67 26.049 9.982 -28.015 638 HD11 ILE 67 HD11 ILE 67 25.299 13.239 -28.156 639 HD12 ILE 67 HD12 ILE 67 24.553 11.646 -27.930 640 HD13 ILE 67 HD13 ILE 67 23.968 13.039 -27.022 641 H ASN 68 H ASN 68 28.834 9.149 -25.421 642 HA ASN 68 HA ASN 68 31.606 9.057 -26.552 643 HB2 ASN 68 HB2 ASN 68 30.580 7.116 -24.514 644 HB3 ASN 68 HB3 ASN 68 32.208 7.346 -25.141 645 HD21 ASN 68 HD22 ASN 68 29.916 8.386 -22.833 646 HD22 ASN 68 HD21 ASN 68 30.799 9.719 -22.206 647 H GLU 69 H GLU 69 32.149 7.324 -27.742 648 HA GLU 69 HA GLU 69 30.381 5.822 -29.527 649 HB2 GLU 69 HB2 GLU 69 33.142 4.937 -29.046 650 HB3 GLU 69 HB3 GLU 69 32.047 4.583 -30.381 651 HG2 GLU 69 HG2 GLU 69 32.050 6.985 -30.993 652 HG3 GLU 69 HG3 GLU 69 33.237 7.310 -29.814 653 H THR 70 H THR 70 31.629 5.101 -26.313 654 HA THR 70 HA THR 70 30.629 2.313 -26.374 655 HB THR 70 HB THR 70 31.335 2.534 -23.808 656 HG1 THR 70 HG1 THR 70 31.419 4.636 -23.464 657 HG21 THR 70 HG21 THR 70 33.661 2.516 -24.096 658 HG22 THR 70 HG22 THR 70 32.734 1.330 -25.160 659 HG23 THR 70 HG23 THR 70 33.504 2.799 -25.835 660 H ASP 71 H ASP 71 29.088 5.254 -25.869 661 HA ASP 71 HA ASP 71 27.486 4.492 -23.485 662 HB2 ASP 71 HB2 ASP 71 27.038 6.600 -25.420 663 HB3 ASP 71 HB3 ASP 71 26.145 6.358 -23.851 664 H THR 72 H THR 72 25.325 4.322 -23.631 665 HA THR 72 HA THR 72 24.180 3.597 -26.137 666 HB THR 72 HB THR 72 23.133 1.473 -25.450 667 HG1 THR 72 HG1 THR 72 23.739 0.490 -23.418 668 HG21 THR 72 HG21 THR 72 25.257 1.112 -26.441 669 HG22 THR 72 HG22 THR 72 26.104 1.353 -24.940 670 HG23 THR 72 HG23 THR 72 25.055 -0.091 -25.134 671 HA PRO 73 HA PRO 73 20.856 5.705 -24.545 672 HB2 PRO 73 HB2 PRO 73 18.693 4.000 -25.553 673 HB3 PRO 73 HB3 PRO 73 19.241 5.726 -26.028 674 HG2 PRO 73 HG2 PRO 73 19.533 3.208 -27.350 675 HG3 PRO 73 HG3 PRO 73 20.257 4.782 -27.824 676 HD2 PRO 73 HD2 PRO 73 21.765 2.551 -26.616 677 HD3 PRO 73 HD3 PRO 73 22.276 4.133 -27.253 678 H ALA 74 H ALA 74 20.822 2.156 -23.776 679 HA ALA 74 HA ALA 74 19.422 2.542 -21.374 680 HB1 ALA 74 HB1 ALA 74 20.531 0.323 -20.928 681 HB2 ALA 74 HB2 ALA 74 19.461 0.402 -22.327 682 HB3 ALA 74 HB3 ALA 74 21.197 0.484 -22.662 683 H GLN 75 H GLN 75 23.063 2.771 -21.970 684 HA GLN 75 HA GLN 75 23.740 2.865 -19.102 685 HB2 GLN 75 HB2 GLN 75 25.279 2.453 -20.873 686 HB3 GLN 75 HB3 GLN 75 25.249 4.165 -21.408 687 HG2 GLN 75 HG2 GLN 75 27.142 4.008 -20.034 688 HG3 GLN 75 HG3 GLN 75 25.907 5.031 -19.237 689 HE21 GLN 75 HE22 GLN 75 24.908 4.161 -17.188 690 HE22 GLN 75 HE21 GLN 75 25.784 2.973 -16.292 691 H LEU 76 H LEU 76 22.756 5.320 -21.463 692 HA LEU 76 HA LEU 76 22.583 7.421 -19.404 693 HB2 LEU 76 HB2 LEU 76 21.752 7.524 -22.347 694 HB3 LEU 76 HB3 LEU 76 21.868 8.847 -21.193 695 HG LEU 76 HG LEU 76 24.156 7.085 -22.167 696 HD11 LEU 76 HD11 LEU 76 24.808 8.807 -23.432 697 HD12 LEU 76 HD12 LEU 76 23.109 8.684 -23.864 698 HD13 LEU 76 HD13 LEU 76 23.654 9.981 -22.753 699 HD21 LEU 76 HD21 LEU 76 24.260 9.584 -20.263 700 HD22 LEU 76 HD22 LEU 76 24.638 8.043 -19.782 701 HD23 LEU 76 HD23 LEU 76 25.740 8.707 -20.962 702 H GLU 77 H GLU 77 20.624 4.899 -19.901 703 HA GLU 77 HA GLU 77 18.182 4.411 -19.678 704 HB2 GLU 77 HB2 GLU 77 18.828 6.370 -17.401 705 HB3 GLU 77 HB3 GLU 77 17.405 5.470 -17.620 706 HG2 GLU 77 HG2 GLU 77 20.165 4.182 -17.385 707 HG3 GLU 77 HG3 GLU 77 19.080 4.672 -16.063 708 H MET 78 H MET 78 18.779 6.258 -21.731 709 HA MET 78 HA MET 78 17.110 8.423 -21.723 710 HB2 MET 78 HB2 MET 78 17.818 6.577 -24.158 711 HB3 MET 78 HB3 MET 78 17.231 8.117 -24.392 712 HG2 MET 78 HG2 MET 78 19.092 8.955 -22.735 713 HG3 MET 78 HG3 MET 78 19.952 7.457 -23.173 714 HE1 MET 78 HE1 MET 78 19.217 10.952 -23.881 715 HE2 MET 78 HE2 MET 78 19.658 11.306 -25.657 716 HE3 MET 78 HE3 MET 78 18.114 10.572 -25.205 717 H GLU 79 H GLU 79 15.262 9.141 -22.912 718 HA GLU 79 HA GLU 79 13.220 7.076 -23.059 719 HB2 GLU 79 HB2 GLU 79 12.998 9.709 -21.662 720 HB3 GLU 79 HB3 GLU 79 11.480 9.068 -22.380 721 HG2 GLU 79 HG2 GLU 79 13.211 7.959 -20.226 722 HG3 GLU 79 HG3 GLU 79 11.718 8.602 -20.008 723 H ASP 80 H ASP 80 11.140 7.633 -24.137 724 HA ASP 80 HA ASP 80 11.998 8.159 -26.765 725 HB2 ASP 80 HB2 ASP 80 9.165 8.143 -25.888 726 HB3 ASP 80 HB3 ASP 80 9.820 8.074 -27.529 727 H GLU 81 H GLU 81 11.398 10.244 -28.133 728 HA GLU 81 HA GLU 81 11.181 12.356 -28.437 729 HB2 GLU 81 HB2 GLU 81 9.391 12.696 -26.043 730 HB3 GLU 81 HB3 GLU 81 9.456 13.646 -27.446 731 HG2 GLU 81 HG2 GLU 81 8.524 10.729 -27.461 732 HG3 GLU 81 HG3 GLU 81 7.478 12.066 -27.445 733 H ASP 82 H ASP 82 13.287 11.354 -26.559 734 HA ASP 82 HA ASP 82 14.329 13.976 -25.560 735 HB2 ASP 82 HB2 ASP 82 15.648 11.165 -25.501 736 HB3 ASP 82 HB3 ASP 82 16.390 12.633 -24.908 737 H THR 83 H THR 83 16.091 14.936 -26.270 738 HA THR 83 HA THR 83 16.804 14.249 -29.158 739 HB THR 83 HB THR 83 16.250 16.945 -27.702 740 HG1 THR 83 HG1 THR 83 14.501 17.079 -29.275 741 HG21 THR 83 HG21 THR 83 17.937 17.249 -29.127 742 HG22 THR 83 HG22 THR 83 17.225 16.656 -30.488 743 HG23 THR 83 HG23 THR 83 16.548 18.121 -29.748 744 H ILE 84 H ILE 84 18.757 14.099 -29.782 745 HA ILE 84 HA ILE 84 20.975 15.011 -28.089 746 HB ILE 84 HB ILE 84 20.788 13.531 -30.794 747 HG12 ILE 84 HG12 ILE 84 21.962 11.743 -28.946 748 HG13 ILE 84 HG13 ILE 84 20.905 12.564 -27.953 749 HG21 ILE 84 HG21 ILE 84 23.050 14.276 -29.202 750 HG22 ILE 84 HG22 ILE 84 23.154 12.948 -30.471 751 HG23 ILE 84 HG23 ILE 84 22.837 14.658 -30.907 752 HD11 ILE 84 HD11 ILE 84 18.953 11.941 -29.142 753 HD12 ILE 84 HD12 ILE 84 19.953 11.145 -30.483 754 HD13 ILE 84 HD13 ILE 84 19.830 10.505 -28.884 755 H ASP 85 H ASP 85 22.472 16.392 -28.571 756 HA ASP 85 HA ASP 85 21.835 18.571 -30.467 757 HB2 ASP 85 HB2 ASP 85 23.735 18.773 -28.171 758 HB3 ASP 85 HB3 ASP 85 23.181 19.983 -29.192 759 H VAL 86 H VAL 86 23.187 19.195 -31.897 760 HA VAL 86 HA VAL 86 25.968 18.102 -32.275 761 HB VAL 86 HB VAL 86 24.217 19.255 -34.349 762 HG11 VAL 86 HG11 VAL 86 26.737 17.559 -34.520 763 HG12 VAL 86 HG12 VAL 86 25.808 18.077 -36.005 764 HG13 VAL 86 HG13 VAL 86 26.590 19.241 -34.899 765 HG21 VAL 86 HG21 VAL 86 23.736 16.646 -34.931 766 HG22 VAL 86 HG22 VAL 86 24.847 16.345 -33.519 767 HG23 VAL 86 HG23 VAL 86 23.203 17.004 -33.451 768 H PHE 87 H PHE 87 27.648 19.274 -32.325 769 HA PHE 87 HA PHE 87 27.689 22.192 -32.632 770 HB2 PHE 87 HB2 PHE 87 29.058 20.405 -30.507 771 HB3 PHE 87 HB3 PHE 87 29.385 22.093 -30.804 772 HD1 PHE 87 HD2 PHE 87 27.939 23.866 -30.286 773 HD2 PHE 87 HD1 PHE 87 26.831 19.807 -29.273 774 HE1 PHE 87 HE2 PHE 87 26.074 24.705 -28.900 775 HE2 PHE 87 HE1 PHE 87 24.944 20.732 -27.967 776 HZ PHE 87 HZ PHE 87 24.736 23.221 -27.622 777 H GLN 88 H GLN 88 29.969 22.925 -33.522 778 HA GLN 88 HA GLN 88 31.792 20.751 -34.217 779 HB2 GLN 88 HB2 GLN 88 31.727 23.562 -35.156 780 HB3 GLN 88 HB3 GLN 88 32.676 22.183 -35.680 781 HG2 GLN 88 HG2 GLN 88 30.034 21.184 -36.109 782 HG3 GLN 88 HG3 GLN 88 29.836 22.898 -36.408 783 HE21 GLN 88 HE22 GLN 88 29.263 21.529 -38.438 784 HE22 GLN 88 HE21 GLN 88 30.438 21.362 -39.652 785 H GLN 89 H GLN 89 34.071 20.977 -34.000 786 HA GLN 89 HA GLN 89 35.087 23.308 -32.439 787 HB2 GLN 89 HB2 GLN 89 35.728 20.354 -32.047 788 HB3 GLN 89 HB3 GLN 89 36.857 21.510 -31.769 789 HG2 GLN 89 HG2 GLN 89 35.171 22.594 -30.233 790 HG3 GLN 89 HG3 GLN 89 34.143 21.103 -30.381 791 HE21 GLN 89 HE22 GLN 89 34.739 21.494 -27.764 792 HE22 GLN 89 HE21 GLN 89 35.886 20.243 -27.320 793 H GLN 90 H GLN 90 37.189 24.107 -33.141 794 HA GLN 90 HA GLN 90 37.705 23.247 -35.887 795 HB2 GLN 90 HB2 GLN 90 38.190 25.940 -34.475 796 HB3 GLN 90 HB3 GLN 90 39.203 25.516 -35.729 797 HG2 GLN 90 HG2 GLN 90 37.308 26.912 -36.615 798 HG3 GLN 90 HG3 GLN 90 37.473 25.342 -37.336 799 HE21 GLN 90 HE22 GLN 90 35.549 24.589 -37.955 800 HE22 GLN 90 HE21 GLN 90 34.092 24.823 -36.997 801 H THR 91 H THR 91 40.136 23.536 -36.589 802 HA THR 91 HA THR 91 42.092 22.545 -34.544 803 HB THR 91 HB THR 91 43.529 22.095 -36.356 804 HG1 THR 91 HG1 THR 91 42.264 21.873 -38.448 805 HG21 THR 91 HG21 THR 91 40.887 20.724 -36.835 806 HG22 THR 91 HG22 THR 91 42.570 20.212 -37.335 807 HG23 THR 91 HG23 THR 91 41.935 20.076 -35.644 808 H GLY 92 H GLY 92 41.283 25.341 -36.640 809 HA2 GLY 92 HA2 GLY 92 41.475 27.212 -35.794 810 HA3 GLY 92 HA3 GLY 92 43.008 26.900 -34.779 811 H GLY 93 H GLY 93 43.479 29.298 -35.688 812 HA2 GLY 93 HA2 GLY 93 44.469 29.119 -38.471 813 HA3 GLY 93 HA3 GLY 93 43.240 30.304 -37.870 814 H VAL 94 H VAL 94 44.523 32.460 -37.659 815 HA VAL 94 HA VAL 94 47.271 32.290 -36.920 816 HB VAL 94 HB VAL 94 45.333 34.628 -36.928 817 HG11 VAL 94 HG11 VAL 94 48.342 34.830 -37.066 818 HG12 VAL 94 HG12 VAL 94 47.086 36.105 -36.798 819 HG13 VAL 94 HG13 VAL 94 47.430 34.960 -35.575 820 HG21 VAL 94 HG21 VAL 94 46.842 35.104 -39.018 821 HG22 VAL 94 HG22 VAL 94 47.129 33.406 -38.987 822 HG23 VAL 94 HG23 VAL 94 45.431 34.070 -39.191 823 H TYR 95 H TYR 95 48.352 32.419 -35.084 824 HA TYR 95 HA TYR 95 46.903 32.742 -32.419 825 HB2 TYR 95 HB2 TYR 95 49.510 31.403 -33.240 826 HB3 TYR 95 HB3 TYR 95 48.967 31.624 -31.566 827 HD1 TYR 95 HD1 TYR 95 46.908 30.398 -30.447 828 HD2 TYR 95 HD2 TYR 95 48.351 29.643 -34.467 829 HE1 TYR 95 HE1 TYR 95 45.544 28.329 -30.611 830 HE2 TYR 95 HE2 TYR 95 46.704 27.730 -34.673 831 HH TYR 95 HH TYR 95 45.609 25.971 -32.276 Start of MODEL 11 1 H1 ACE 36 HH32 ACE 36 11.168 14.333 -43.829 2 H2 ACE 36 HH33 ACE 36 10.886 14.412 -45.508 3 H3 ACE 36 HH31 ACE 36 9.530 14.351 -44.484 4 H GLU 37 H GLU 37 10.139 12.469 -46.725 5 HA GLU 37 HA GLU 37 9.825 10.009 -45.523 6 HB2 GLU 37 HB2 GLU 37 9.131 10.790 -47.851 7 HB3 GLU 37 HB3 GLU 37 10.785 10.454 -48.314 8 HG2 GLU 37 HG2 GLU 37 9.274 8.337 -48.780 9 HG3 GLU 37 HG3 GLU 37 10.649 8.170 -47.816 10 H ASP 38 H ASP 38 12.856 11.489 -46.174 11 HA ASP 38 HA ASP 38 14.185 9.053 -45.491 12 HB2 ASP 38 HB2 ASP 38 14.526 9.643 -47.791 13 HB3 ASP 38 HB3 ASP 38 15.069 11.258 -47.376 14 H ALA 39 H ALA 39 13.100 11.374 -43.784 15 HA ALA 39 HA ALA 39 15.504 12.311 -42.504 16 HB1 ALA 39 HB1 ALA 39 12.611 12.650 -41.525 17 HB2 ALA 39 HB2 ALA 39 13.894 13.850 -41.289 18 HB3 ALA 39 HB3 ALA 39 13.145 13.611 -42.935 19 H PHE 40 H PHE 40 15.026 9.679 -42.588 20 HA PHE 40 HA PHE 40 14.423 8.838 -39.682 21 HB2 PHE 40 HB2 PHE 40 12.431 9.157 -41.512 22 HB3 PHE 40 HB3 PHE 40 13.156 7.758 -42.145 23 HD1 PHE 40 HD2 PHE 40 13.146 5.488 -40.380 24 HD2 PHE 40 HD1 PHE 40 11.131 9.218 -39.687 25 HE1 PHE 40 HE2 PHE 40 11.893 4.391 -38.569 26 HE2 PHE 40 HE1 PHE 40 9.641 8.014 -38.000 27 HZ PHE 40 HZ PHE 40 10.276 5.842 -37.239 28 H ILE 41 H ILE 41 16.140 7.882 -39.019 29 HA ILE 41 HA ILE 41 17.603 6.116 -40.831 30 HB ILE 41 HB ILE 41 18.687 7.673 -38.424 31 HG12 ILE 41 HG12 ILE 41 20.297 8.774 -40.261 32 HG13 ILE 41 HG13 ILE 41 19.226 8.142 -41.368 33 HG21 ILE 41 HG21 ILE 41 20.396 6.144 -40.466 34 HG22 ILE 41 HG22 ILE 41 20.784 6.894 -38.996 35 HG23 ILE 41 HG23 ILE 41 19.818 5.430 -38.837 36 HD11 ILE 41 HD11 ILE 41 18.729 10.618 -40.645 37 HD12 ILE 41 HD12 ILE 41 17.349 9.605 -40.668 38 HD13 ILE 41 HD13 ILE 41 18.063 9.869 -39.109 39 H VAL 42 H VAL 42 17.824 3.918 -40.236 40 HA VAL 42 HA VAL 42 16.422 3.171 -37.698 41 HB VAL 42 HB VAL 42 15.862 1.980 -40.377 42 HG11 VAL 42 HG11 VAL 42 15.286 0.390 -38.639 43 HG12 VAL 42 HG12 VAL 42 14.541 1.683 -37.684 44 HG13 VAL 42 HG13 VAL 42 13.824 1.150 -39.256 45 HG21 VAL 42 HG21 VAL 42 14.441 4.107 -38.748 46 HG22 VAL 42 HG22 VAL 42 15.021 4.246 -40.414 47 HG23 VAL 42 HG23 VAL 42 13.579 3.204 -40.055 48 H ILE 43 H ILE 43 17.693 2.122 -36.325 49 HA ILE 43 HA ILE 43 19.866 0.356 -37.472 50 HB ILE 43 HB ILE 43 20.010 2.776 -35.759 51 HG12 ILE 43 HG12 ILE 43 21.336 2.251 -38.369 52 HG13 ILE 43 HG13 ILE 43 19.957 3.352 -38.009 53 HG21 ILE 43 HG21 ILE 43 22.441 1.181 -36.566 54 HG22 ILE 43 HG22 ILE 43 22.393 2.472 -35.273 55 HG23 ILE 43 HG23 ILE 43 21.693 0.816 -35.028 56 HD11 ILE 43 HD11 ILE 43 22.056 4.816 -38.117 57 HD12 ILE 43 HD12 ILE 43 21.170 4.844 -36.570 58 HD13 ILE 43 HD13 ILE 43 22.699 4.008 -36.808 59 H SEP 44 H SEP 44 20.567 -1.434 -36.300 60 HA SEP 44 HA SEP 44 19.769 -1.339 -33.462 61 HB2 SEP 44 HB2 SEP 44 18.525 -3.334 -33.379 62 HB3 SEP 44 HB3 SEP 44 18.098 -2.563 -34.917 63 H ASP 45 H ASP 45 20.717 -3.852 -32.452 64 HA ASP 45 HA ASP 45 23.548 -4.006 -33.306 65 HB2 ASP 45 HB2 ASP 45 22.971 -2.820 -30.841 66 HB3 ASP 45 HB3 ASP 45 22.777 -4.533 -30.437 67 H SEP 46 H SEP 46 20.795 -6.179 -32.080 68 HA SEP 46 HA SEP 46 22.805 -8.131 -31.599 69 HB2 SEP 46 HB2 SEP 46 20.928 -9.615 -30.819 70 HB3 SEP 46 HB3 SEP 46 20.944 -8.082 -29.980 71 H ASP 47 H ASP 47 23.800 -9.235 -32.997 72 HA ASP 47 HA ASP 47 22.294 -10.555 -35.290 73 HB2 ASP 47 HB2 ASP 47 23.606 -9.111 -36.095 74 HB3 ASP 47 HB3 ASP 47 25.018 -9.438 -35.153 75 H GLY 48 H GLY 48 22.197 -12.875 -35.033 76 HA2 GLY 48 HA2 GLY 48 24.305 -14.589 -35.005 77 HA3 GLY 48 HA3 GLY 48 24.015 -14.364 -33.296 78 H GLU 49 H GLU 49 23.688 -16.493 -33.369 79 HA GLU 49 HA GLU 49 20.963 -17.435 -33.808 80 HB2 GLU 49 HB2 GLU 49 22.362 -17.705 -35.915 81 HB3 GLU 49 HB3 GLU 49 23.382 -18.752 -35.004 82 HG2 GLU 49 HG2 GLU 49 21.904 -20.122 -36.230 83 HG3 GLU 49 HG3 GLU 49 21.267 -20.274 -34.638 84 HN1 NH2 50 HN1 NH2 50 20.390 -18.551 -32.050 85 HN2 NH2 50 HN2 NH2 50 21.528 -19.235 -30.917 86 H1 MET 1 H1 MET 1 -9.751 -29.167 -40.143 87 H2 MET 1 H2 MET 1 -11.158 -29.269 -39.347 88 H3 MET 1 H3 MET 1 -9.616 -29.479 -38.636 89 HA MET 1 HA MET 1 -10.744 -26.926 -39.514 90 HB2 MET 1 HB2 MET 1 -9.311 -27.622 -36.914 91 HB3 MET 1 HB3 MET 1 -9.967 -26.177 -37.106 92 HG2 MET 1 HG2 MET 1 -11.272 -28.982 -36.881 93 HG3 MET 1 HG3 MET 1 -11.143 -27.944 -35.575 94 HE1 MET 1 HE1 MET 1 -14.191 -25.402 -36.561 95 HE2 MET 1 HE2 MET 1 -13.129 -25.979 -35.250 96 HE3 MET 1 HE3 MET 1 -12.478 -24.924 -36.526 97 H ALA 2 H ALA 2 -9.403 -25.095 -39.367 98 HA ALA 2 HA ALA 2 -6.799 -25.532 -40.656 99 HB1 ALA 2 HB1 ALA 2 -8.112 -23.396 -41.068 100 HB2 ALA 2 HB2 ALA 2 -7.884 -22.921 -39.409 101 HB3 ALA 2 HB3 ALA 2 -6.441 -23.174 -40.288 102 H ASP 3 H ASP 3 -4.987 -24.656 -39.906 103 HA ASP 3 HA ASP 3 -4.149 -25.174 -37.183 104 HB2 ASP 3 HB2 ASP 3 -2.447 -25.587 -39.114 105 HB3 ASP 3 HB3 ASP 3 -2.533 -23.883 -39.412 106 H GLU 4 H GLU 4 -4.252 -23.660 -35.587 107 HA GLU 4 HA GLU 4 -4.188 -20.717 -35.993 108 HB2 GLU 4 HB2 GLU 4 -6.505 -21.745 -36.357 109 HB3 GLU 4 HB3 GLU 4 -6.459 -22.084 -34.613 110 HG2 GLU 4 HG2 GLU 4 -7.817 -20.009 -35.265 111 HG3 GLU 4 HG3 GLU 4 -6.503 -19.810 -34.043 112 H LYS 5 H LYS 5 -3.821 -19.705 -34.181 113 HA LYS 5 HA LYS 5 -3.250 -20.813 -31.483 114 HB2 LYS 5 HB2 LYS 5 -1.315 -20.334 -33.122 115 HB3 LYS 5 HB3 LYS 5 -1.538 -18.609 -32.712 116 HG2 LYS 5 HG2 LYS 5 -1.277 -19.387 -30.202 117 HG3 LYS 5 HG3 LYS 5 -0.819 -20.926 -30.761 118 HD2 LYS 5 HD2 LYS 5 0.998 -19.580 -32.148 119 HD3 LYS 5 HD3 LYS 5 0.507 -18.316 -31.202 120 HE2 LYS 5 HE2 LYS 5 0.981 -19.506 -29.107 121 HE3 LYS 5 HE3 LYS 5 1.500 -20.949 -30.121 122 HZ1 LYS 5 HZ1 LYS 5 2.685 -18.244 -30.317 123 HZ2 LYS 5 HZ2 LYS 5 3.351 -19.282 -29.311 124 HZ3 LYS 5 HZ3 LYS 5 3.346 -19.699 -30.833 125 HA PRO 6 HA PRO 6 -5.517 -17.152 -30.056 126 HB2 PRO 6 HB2 PRO 6 -3.817 -17.243 -27.655 127 HB3 PRO 6 HB3 PRO 6 -5.654 -17.189 -27.802 128 HG2 PRO 6 HG2 PRO 6 -4.554 -19.497 -27.118 129 HG3 PRO 6 HG3 PRO 6 -5.821 -19.366 -28.342 130 HD2 PRO 6 HD2 PRO 6 -2.900 -19.753 -28.828 131 HD3 PRO 6 HD3 PRO 6 -4.299 -20.571 -29.473 132 H LYS 7 H LYS 7 -4.927 -14.894 -30.372 133 HA LYS 7 HA LYS 7 -2.240 -14.134 -31.380 134 HB2 LYS 7 HB2 LYS 7 -4.458 -13.504 -32.547 135 HB3 LYS 7 HB3 LYS 7 -4.635 -12.310 -31.241 136 HG2 LYS 7 HG2 LYS 7 -2.438 -11.405 -31.792 137 HG3 LYS 7 HG3 LYS 7 -2.256 -12.394 -33.200 138 HD2 LYS 7 HD2 LYS 7 -4.427 -11.617 -34.176 139 HD3 LYS 7 HD3 LYS 7 -4.680 -10.519 -32.873 140 HE2 LYS 7 HE2 LYS 7 -2.962 -9.094 -33.549 141 HE3 LYS 7 HE3 LYS 7 -2.014 -10.460 -34.286 142 HZ1 LYS 7 HZ1 LYS 7 -3.675 -10.372 -36.104 143 HZ2 LYS 7 HZ2 LYS 7 -4.418 -9.140 -35.255 144 HZ3 LYS 7 HZ3 LYS 7 -2.936 -9.006 -35.984 145 H GLU 8 H GLU 8 -0.672 -13.548 -29.988 146 HA GLU 8 HA GLU 8 -1.249 -11.168 -28.427 147 HB2 GLU 8 HB2 GLU 8 -0.548 -12.131 -26.171 148 HB3 GLU 8 HB3 GLU 8 -2.023 -12.834 -26.831 149 HG2 GLU 8 HG2 GLU 8 -0.307 -14.723 -27.698 150 HG3 GLU 8 HG3 GLU 8 0.910 -13.840 -26.601 151 H GLY 9 H GLY 9 0.352 -9.863 -28.046 152 HA2 GLY 9 HA2 GLY 9 2.599 -10.357 -29.566 153 HA3 GLY 9 HA3 GLY 9 2.308 -8.991 -28.429 154 H VAL 10 H VAL 10 2.559 -12.053 -26.955 155 HA VAL 10 HA VAL 10 4.351 -10.877 -25.009 156 HB VAL 10 HB VAL 10 3.038 -13.592 -25.208 157 HG11 VAL 10 HG11 VAL 10 5.085 -13.817 -23.665 158 HG12 VAL 10 HG12 VAL 10 4.544 -12.341 -22.826 159 HG13 VAL 10 HG13 VAL 10 3.624 -13.818 -22.780 160 HG21 VAL 10 HG21 VAL 10 1.749 -12.770 -23.350 161 HG22 VAL 10 HG22 VAL 10 2.623 -11.190 -23.434 162 HG23 VAL 10 HG23 VAL 10 1.586 -11.716 -24.803 163 H LYS 11 H LYS 11 5.998 -10.613 -26.795 164 HA LYS 11 HA LYS 11 8.119 -12.699 -26.727 165 HB2 LYS 11 HB2 LYS 11 6.430 -13.249 -28.549 166 HB3 LYS 11 HB3 LYS 11 6.968 -11.900 -29.434 167 HG2 LYS 11 HG2 LYS 11 9.361 -12.848 -29.238 168 HG3 LYS 11 HG3 LYS 11 8.742 -14.256 -28.366 169 HD2 LYS 11 HD2 LYS 11 7.163 -14.679 -30.361 170 HD3 LYS 11 HD3 LYS 11 8.083 -13.330 -31.035 171 HE2 LYS 11 HE2 LYS 11 10.142 -14.712 -30.682 172 HE3 LYS 11 HE3 LYS 11 9.071 -16.094 -30.205 173 HZ1 LYS 11 HZ1 LYS 11 8.248 -16.256 -32.315 174 HZ2 LYS 11 HZ2 LYS 11 8.949 -14.848 -32.868 175 HZ3 LYS 11 HZ3 LYS 11 9.836 -16.163 -32.630 176 H THR 12 H THR 12 10.227 -11.773 -27.160 177 HA THR 12 HA THR 12 10.669 -9.020 -26.804 178 HB THR 12 HB THR 12 13.216 -9.737 -27.666 179 HG1 THR 12 HG1 THR 12 12.616 -11.375 -28.983 180 HG21 THR 12 HG21 THR 12 13.747 -10.942 -25.591 181 HG22 THR 12 HG22 THR 12 12.612 -9.781 -25.103 182 HG23 THR 12 HG23 THR 12 12.031 -11.444 -25.324 183 H GLU 13 H GLU 13 10.416 -10.760 -29.754 184 HA GLU 13 HA GLU 13 11.288 -8.992 -31.718 185 HB2 GLU 13 HB2 GLU 13 9.194 -11.031 -31.795 186 HB3 GLU 13 HB3 GLU 13 10.047 -10.354 -33.225 187 HG2 GLU 13 HG2 GLU 13 10.894 -12.395 -31.248 188 HG3 GLU 13 HG3 GLU 13 11.274 -12.296 -32.951 189 H ASN 14 H ASN 14 8.459 -8.770 -29.688 190 HA ASN 14 HA ASN 14 7.024 -6.831 -31.570 191 HB2 ASN 14 HB2 ASN 14 6.150 -8.395 -29.096 192 HB3 ASN 14 HB3 ASN 14 5.159 -7.270 -30.181 193 HD21 ASN 14 HD22 ASN 14 4.342 -8.017 -32.086 194 HD22 ASN 14 HD21 ASN 14 4.440 -9.752 -32.260 195 H ASN 15 H ASN 15 9.173 -6.704 -28.531 196 HA ASN 15 HA ASN 15 7.750 -4.729 -27.361 197 HB2 ASN 15 HB2 ASN 15 9.417 -6.186 -26.210 198 HB3 ASN 15 HB3 ASN 15 10.609 -5.534 -27.338 199 HD21 ASN 15 HD22 ASN 15 11.812 -5.143 -25.498 200 HD22 ASN 15 HD21 ASN 15 11.403 -3.737 -24.474 201 H ASP 16 H ASP 16 8.357 -2.396 -27.016 202 HA ASP 16 HA ASP 16 8.346 -1.087 -29.489 203 HB2 ASP 16 HB2 ASP 16 9.075 0.269 -26.979 204 HB3 ASP 16 HB3 ASP 16 8.041 0.896 -28.238 205 H HIS 17 H HIS 17 9.954 -0.332 -30.628 206 HA HIS 17 HA HIS 17 12.751 -0.172 -29.785 207 HB2 HIS 17 HB2 HIS 17 11.479 1.429 -32.014 208 HB3 HIS 17 HB3 HIS 17 13.178 1.301 -31.819 209 HD2 HIS 17 HD2 HIS 17 14.496 -0.755 -32.740 210 HE1 HIS 17 HE1 HIS 17 11.354 -3.455 -33.477 211 HE2 HIS 17 HE2 HIS 17 13.898 -2.937 -33.841 212 H ILE 18 H ILE 18 13.762 2.040 -29.685 213 HA ILE 18 HA ILE 18 12.203 4.031 -27.941 214 HB ILE 18 HB ILE 18 13.968 2.961 -26.648 215 HG12 ILE 18 HG12 ILE 18 14.731 5.777 -27.228 216 HG13 ILE 18 HG13 ILE 18 13.252 5.424 -26.318 217 HG21 ILE 18 HG21 ILE 18 15.456 2.455 -28.380 218 HG22 ILE 18 HG22 ILE 18 15.857 4.251 -28.498 219 HG23 ILE 18 HG23 ILE 18 16.318 3.460 -27.124 220 HD11 ILE 18 HD11 ILE 18 15.389 6.126 -24.906 221 HD12 ILE 18 HD12 ILE 18 14.348 4.684 -24.520 222 HD13 ILE 18 HD13 ILE 18 15.986 4.644 -25.330 223 H ASN 19 H ASN 19 11.794 5.928 -28.418 224 HA ASN 19 HA ASN 19 12.526 6.709 -31.110 225 HB2 ASN 19 HB2 ASN 19 10.613 7.914 -29.152 226 HB3 ASN 19 HB3 ASN 19 10.778 8.430 -30.862 227 HD21 ASN 19 HD22 ASN 19 10.018 5.355 -28.858 228 HD22 ASN 19 HD21 ASN 19 8.973 4.672 -30.035 229 H LEU 20 H LEU 20 14.682 7.559 -31.007 230 HA LEU 20 HA LEU 20 15.060 10.198 -29.588 231 HB2 LEU 20 HB2 LEU 20 17.174 8.345 -30.903 232 HB3 LEU 20 HB3 LEU 20 17.369 9.885 -29.963 233 HG LEU 20 HG LEU 20 16.562 7.235 -28.886 234 HD11 LEU 20 HD11 LEU 20 18.891 9.022 -28.328 235 HD12 LEU 20 HD12 LEU 20 18.443 7.557 -27.412 236 HD13 LEU 20 HD13 LEU 20 19.061 7.557 -29.096 237 HD21 LEU 20 HD21 LEU 20 16.350 9.968 -27.540 238 HD22 LEU 20 HD22 LEU 20 15.153 8.744 -27.828 239 HD23 LEU 20 HD23 LEU 20 16.481 8.434 -26.692 240 H LYS 21 H LYS 21 15.925 12.129 -30.620 241 HA LYS 21 HA LYS 21 16.203 11.896 -33.586 242 HB2 LYS 21 HB2 LYS 21 15.172 14.293 -32.015 243 HB3 LYS 21 HB3 LYS 21 15.494 14.275 -33.715 244 HG2 LYS 21 HG2 LYS 21 13.759 12.538 -33.997 245 HG3 LYS 21 HG3 LYS 21 13.468 12.553 -32.166 246 HD2 LYS 21 HD2 LYS 21 13.042 15.198 -32.999 247 HD3 LYS 21 HD3 LYS 21 12.643 14.267 -34.470 248 HE2 LYS 21 HE2 LYS 21 10.569 14.412 -33.534 249 HE3 LYS 21 HE3 LYS 21 11.025 12.850 -32.933 250 HZ1 LYS 21 HZ1 LYS 21 11.930 13.940 -31.000 251 HZ2 LYS 21 HZ2 LYS 21 11.281 15.411 -31.476 252 HZ3 LYS 21 HZ3 LYS 21 10.297 14.147 -31.040 253 H VAL 22 H VAL 22 17.529 13.512 -34.377 254 HA VAL 22 HA VAL 22 19.885 14.442 -32.541 255 HB VAL 22 HB VAL 22 20.183 13.247 -35.322 256 HG11 VAL 22 HG11 VAL 22 21.744 15.118 -35.025 257 HG12 VAL 22 HG12 VAL 22 22.351 14.284 -33.597 258 HG13 VAL 22 HG13 VAL 22 22.574 13.585 -35.174 259 HG21 VAL 22 HG21 VAL 22 21.605 11.612 -34.345 260 HG22 VAL 22 HG22 VAL 22 21.376 12.245 -32.729 261 HG23 VAL 22 HG23 VAL 22 19.954 11.525 -33.561 262 H ALA 23 H ALA 23 20.283 16.590 -32.763 263 HA ALA 23 HA ALA 23 19.285 17.961 -35.258 264 HB1 ALA 23 HB1 ALA 23 17.516 18.043 -33.792 265 HB2 ALA 23 HB2 ALA 23 18.379 18.675 -32.418 266 HB3 ALA 23 HB3 ALA 23 18.171 19.614 -33.965 267 H GLY 24 H GLY 24 20.542 19.581 -36.016 268 HA2 GLY 24 HA2 GLY 24 22.985 20.457 -34.657 269 HA3 GLY 24 HA3 GLY 24 22.545 20.764 -36.246 270 H GLN 25 H GLN 25 23.596 22.782 -34.745 271 HA GLN 25 HA GLN 25 21.675 24.419 -33.267 272 HB2 GLN 25 HB2 GLN 25 24.397 25.205 -34.567 273 HB3 GLN 25 HB3 GLN 25 23.317 26.139 -33.400 274 HG2 GLN 25 HG2 GLN 25 25.175 23.806 -33.051 275 HG3 GLN 25 HG3 GLN 25 25.137 25.255 -32.216 276 HE21 GLN 25 HE22 GLN 25 24.485 22.103 -31.994 277 HE22 GLN 25 HE21 GLN 25 23.203 21.997 -30.815 278 H ASP 26 H ASP 26 22.208 23.891 -36.646 279 HA ASP 26 HA ASP 26 21.308 26.366 -37.598 280 HB2 ASP 26 HB2 ASP 26 20.943 25.036 -39.713 281 HB3 ASP 26 HB3 ASP 26 22.569 25.280 -39.215 282 H GLY 27 H GLY 27 19.752 23.752 -36.200 283 HA2 GLY 27 HA2 GLY 27 17.653 23.649 -35.479 284 HA3 GLY 27 HA3 GLY 27 17.043 24.737 -36.731 285 H SER 28 H SER 28 19.013 22.109 -37.898 286 HA SER 28 HA SER 28 16.768 20.979 -39.401 287 HB2 SER 28 HB2 SER 28 18.556 19.637 -40.445 288 HB3 SER 28 HB3 SER 28 19.029 21.187 -40.484 289 HG SER 28 HG SER 28 20.443 20.988 -38.919 290 H VAL 29 H VAL 29 15.977 18.758 -39.225 291 HA VAL 29 HA VAL 29 16.649 17.489 -36.663 292 HB VAL 29 HB VAL 29 13.850 18.373 -37.587 293 HG11 VAL 29 HG11 VAL 29 14.889 16.812 -35.062 294 HG12 VAL 29 HG12 VAL 29 13.162 17.415 -35.308 295 HG13 VAL 29 HG13 VAL 29 13.815 16.198 -36.377 296 HG21 VAL 29 HG21 VAL 29 13.736 19.621 -35.664 297 HG22 VAL 29 HG22 VAL 29 15.425 19.167 -35.147 298 HG23 VAL 29 HG23 VAL 29 15.123 20.204 -36.595 299 H VAL 30 H VAL 30 16.482 15.199 -36.761 300 HA VAL 30 HA VAL 30 14.869 13.744 -38.676 301 HB VAL 30 HB VAL 30 16.554 12.148 -39.141 302 HG11 VAL 30 HG11 VAL 30 16.096 13.832 -40.859 303 HG12 VAL 30 HG12 VAL 30 17.664 14.628 -40.540 304 HG13 VAL 30 HG13 VAL 30 17.585 12.898 -40.950 305 HG21 VAL 30 HG21 VAL 30 18.784 14.060 -38.653 306 HG22 VAL 30 HG22 VAL 30 18.143 13.143 -37.244 307 HG23 VAL 30 HG23 VAL 30 18.878 12.312 -38.657 308 H GLN 31 H GLN 31 14.463 11.770 -38.275 309 HA GLN 31 HA GLN 31 14.566 11.005 -35.351 310 HB2 GLN 31 HB2 GLN 31 12.323 11.457 -36.783 311 HB3 GLN 31 HB3 GLN 31 12.573 9.713 -37.163 312 HG2 GLN 31 HG2 GLN 31 12.656 9.235 -34.666 313 HG3 GLN 31 HG3 GLN 31 12.119 10.850 -34.397 314 HE21 GLN 31 HE22 GLN 31 10.934 8.111 -34.066 315 HE22 GLN 31 HE21 GLN 31 9.294 8.420 -34.582 316 H PHE 32 H PHE 32 15.198 9.252 -34.461 317 HA PHE 32 HA PHE 32 16.674 7.361 -36.274 318 HB2 PHE 32 HB2 PHE 32 17.608 8.560 -33.672 319 HB3 PHE 32 HB3 PHE 32 18.105 7.039 -34.116 320 HD1 PHE 32 HD1 PHE 32 18.109 10.526 -35.263 321 HD2 PHE 32 HD2 PHE 32 19.757 6.646 -35.863 322 HE1 PHE 32 HE1 PHE 32 19.874 11.469 -36.697 323 HE2 PHE 32 HE2 PHE 32 21.523 7.545 -37.147 324 HZ PHE 32 HZ PHE 32 21.813 9.887 -37.379 325 H LYS 33 H LYS 33 15.828 5.256 -36.075 326 HA LYS 33 HA LYS 33 14.114 4.657 -33.665 327 HB2 LYS 33 HB2 LYS 33 12.855 4.634 -35.583 328 HB3 LYS 33 HB3 LYS 33 13.988 3.563 -36.489 329 HG2 LYS 33 HG2 LYS 33 13.449 1.690 -34.878 330 HG3 LYS 33 HG3 LYS 33 12.563 2.848 -33.885 331 HD2 LYS 33 HD2 LYS 33 10.893 3.052 -35.623 332 HD3 LYS 33 HD3 LYS 33 11.848 2.252 -36.842 333 HE2 LYS 33 HE2 LYS 33 11.903 0.207 -35.286 334 HE3 LYS 33 HE3 LYS 33 10.685 1.046 -34.349 335 HZ1 LYS 33 HZ1 LYS 33 9.286 1.153 -36.149 336 HZ2 LYS 33 HZ2 LYS 33 10.277 0.449 -37.222 337 HZ3 LYS 33 HZ3 LYS 33 9.642 -0.437 -36.014 338 H ILE 34 H ILE 34 15.152 3.463 -32.216 339 HA ILE 34 HA ILE 34 17.174 1.432 -32.966 340 HB ILE 34 HB ILE 34 18.814 2.382 -31.444 341 HG12 ILE 34 HG12 ILE 34 16.493 4.155 -30.628 342 HG13 ILE 34 HG13 ILE 34 17.447 3.171 -29.600 343 HG21 ILE 34 HG21 ILE 34 18.541 3.555 -33.789 344 HG22 ILE 34 HG22 ILE 34 17.773 4.899 -32.910 345 HG23 ILE 34 HG23 ILE 34 19.436 4.441 -32.521 346 HD11 ILE 34 HD11 ILE 34 19.473 4.348 -29.911 347 HD12 ILE 34 HD12 ILE 34 18.693 5.755 -30.685 348 HD13 ILE 34 HD13 ILE 34 18.116 5.205 -29.082 349 H LYS 35 H LYS 35 17.973 0.297 -30.878 350 HA LYS 35 HA LYS 35 15.591 -0.132 -29.045 351 HB2 LYS 35 HB2 LYS 35 17.844 -2.043 -29.494 352 HB3 LYS 35 HB3 LYS 35 16.337 -2.238 -28.584 353 HG2 LYS 35 HG2 LYS 35 15.044 -2.144 -30.687 354 HG3 LYS 35 HG3 LYS 35 16.656 -2.113 -31.530 355 HD2 LYS 35 HD2 LYS 35 16.970 -4.426 -30.315 356 HD3 LYS 35 HD3 LYS 35 15.323 -4.397 -29.781 357 HE2 LYS 35 HE2 LYS 35 14.564 -4.105 -32.179 358 HE3 LYS 35 HE3 LYS 35 16.243 -4.174 -32.657 359 HZ1 LYS 35 HZ1 LYS 35 15.073 -6.347 -32.736 360 HZ2 LYS 35 HZ2 LYS 35 16.344 -6.465 -31.792 361 HZ3 LYS 35 HZ3 LYS 35 14.935 -6.283 -31.040 362 H ARG 36 H ARG 36 16.451 -0.929 -26.845 363 HA ARG 36 HA ARG 36 17.580 1.475 -25.628 364 HB2 ARG 36 HB2 ARG 36 16.784 -1.345 -24.590 365 HB3 ARG 36 HB3 ARG 36 17.422 -0.073 -23.540 366 HG2 ARG 36 HG2 ARG 36 15.834 1.455 -24.002 367 HG3 ARG 36 HG3 ARG 36 14.921 0.399 -25.183 368 HD2 ARG 36 HD2 ARG 36 13.746 0.433 -23.125 369 HD3 ARG 36 HD3 ARG 36 14.393 -1.121 -23.263 370 HE ARG 36 HE ARG 36 16.139 -0.650 -21.720 371 HH11 ARG 36 HH11 ARG 36 13.945 1.981 -21.765 372 HH12 ARG 36 HH12 ARG 36 14.812 2.860 -20.560 373 HH21 ARG 36 HH21 ARG 36 17.069 0.080 -20.315 374 HH22 ARG 36 HH22 ARG 36 16.729 1.662 -19.645 375 H HIS 37 H HIS 37 18.959 -1.445 -26.465 376 HA HIS 37 HA HIS 37 21.529 -1.063 -25.026 377 HB2 HIS 37 HB2 HIS 37 22.088 -3.479 -25.660 378 HB3 HIS 37 HB3 HIS 37 20.877 -3.237 -24.593 379 HD2 HIS 37 HD2 HIS 37 21.426 -5.385 -27.374 380 HE1 HIS 37 HE1 HIS 37 17.180 -4.866 -27.307 381 HE2 HIS 37 HE2 HIS 37 18.998 -6.243 -28.253 382 H THR 38 H THR 38 20.320 0.073 -27.931 383 HA THR 38 HA THR 38 22.187 -0.891 -29.747 384 HB THR 38 HB THR 38 20.459 1.449 -29.894 385 HG1 THR 38 HG1 THR 38 20.152 -1.187 -30.478 386 HG21 THR 38 HG21 THR 38 22.236 0.550 -32.228 387 HG22 THR 38 HG22 THR 38 20.805 1.452 -32.474 388 HG23 THR 38 HG23 THR 38 22.138 1.988 -31.423 389 HA PRO 39 HA PRO 39 25.529 1.574 -28.195 390 HB2 PRO 39 HB2 PRO 39 27.629 0.995 -29.878 391 HB3 PRO 39 HB3 PRO 39 27.050 0.030 -28.521 392 HG2 PRO 39 HG2 PRO 39 26.452 -0.379 -31.481 393 HG3 PRO 39 HG3 PRO 39 26.551 -1.705 -30.242 394 HD2 PRO 39 HD2 PRO 39 24.156 -0.891 -31.086 395 HD3 PRO 39 HD3 PRO 39 24.528 -1.560 -29.447 396 H LEU 40 H LEU 40 25.665 3.738 -28.415 397 HA LEU 40 HA LEU 40 24.396 5.011 -30.559 398 HB2 LEU 40 HB2 LEU 40 25.968 6.059 -28.230 399 HB3 LEU 40 HB3 LEU 40 25.131 7.137 -29.443 400 HG LEU 40 HG LEU 40 23.688 4.978 -27.830 401 HD11 LEU 40 HD11 LEU 40 24.150 6.652 -26.293 402 HD12 LEU 40 HD12 LEU 40 23.712 7.933 -27.388 403 HD13 LEU 40 HD13 LEU 40 22.480 6.902 -26.632 404 HD21 LEU 40 HD21 LEU 40 22.718 7.368 -29.552 405 HD22 LEU 40 HD22 LEU 40 22.621 5.639 -29.946 406 HD23 LEU 40 HD23 LEU 40 21.675 6.115 -28.654 407 H SER 41 H SER 41 27.698 4.024 -30.549 408 HA SER 41 HA SER 41 28.894 5.930 -32.347 409 HB2 SER 41 HB2 SER 41 30.406 4.034 -32.852 410 HB3 SER 41 HB3 SER 41 30.065 4.383 -31.075 411 HG SER 41 HG SER 41 29.854 2.035 -32.023 412 H LYS 42 H LYS 42 26.674 3.301 -32.849 413 HA LYS 42 HA LYS 42 26.971 3.112 -35.686 414 HB2 LYS 42 HB2 LYS 42 24.459 2.422 -33.893 415 HB3 LYS 42 HB3 LYS 42 24.664 2.086 -35.583 416 HG2 LYS 42 HG2 LYS 42 26.749 0.792 -35.020 417 HG3 LYS 42 HG3 LYS 42 26.123 0.748 -33.317 418 HD2 LYS 42 HD2 LYS 42 23.888 -0.041 -34.307 419 HD3 LYS 42 HD3 LYS 42 24.711 -0.407 -35.780 420 HE2 LYS 42 HE2 LYS 42 25.400 -1.493 -33.063 421 HE3 LYS 42 HE3 LYS 42 24.437 -2.405 -34.162 422 HZ1 LYS 42 HZ1 LYS 42 26.560 -3.203 -34.788 423 HZ2 LYS 42 HZ2 LYS 42 26.524 -1.796 -35.735 424 HZ3 LYS 42 HZ3 LYS 42 27.280 -1.757 -34.469 425 H LEU 43 H LEU 43 25.295 5.307 -33.584 426 HA LEU 43 HA LEU 43 23.674 6.480 -35.751 427 HB2 LEU 43 HB2 LEU 43 24.022 7.166 -32.933 428 HB3 LEU 43 HB3 LEU 43 23.089 8.147 -34.011 429 HG LEU 43 HG LEU 43 21.630 5.934 -34.555 430 HD11 LEU 43 HD11 LEU 43 23.015 4.194 -33.320 431 HD12 LEU 43 HD12 LEU 43 22.712 5.141 -31.879 432 HD13 LEU 43 HD13 LEU 43 21.387 4.359 -32.659 433 HD21 LEU 43 HD21 LEU 43 21.316 6.919 -31.749 434 HD22 LEU 43 HD22 LEU 43 20.986 8.024 -33.036 435 HD23 LEU 43 HD23 LEU 43 20.065 6.539 -32.996 436 H MET 44 H MET 44 26.469 7.384 -33.675 437 HA MET 44 HA MET 44 26.771 9.951 -34.740 438 HB2 MET 44 HB2 MET 44 28.687 8.050 -33.503 439 HB3 MET 44 HB3 MET 44 29.008 9.878 -33.827 440 HG2 MET 44 HG2 MET 44 27.265 10.485 -32.579 441 HG3 MET 44 HG3 MET 44 26.771 8.880 -32.022 442 HE1 MET 44 HE1 MET 44 29.923 7.670 -30.914 443 HE2 MET 44 HE2 MET 44 29.974 8.517 -29.366 444 HE3 MET 44 HE3 MET 44 28.529 7.674 -29.866 445 H LYS 45 H LYS 45 28.541 7.083 -35.840 446 HA LYS 45 HA LYS 45 29.812 8.259 -38.224 447 HB2 LYS 45 HB2 LYS 45 29.008 5.444 -37.478 448 HB3 LYS 45 HB3 LYS 45 30.107 5.850 -38.769 449 HG2 LYS 45 HG2 LYS 45 31.746 6.675 -37.060 450 HG3 LYS 45 HG3 LYS 45 30.612 6.247 -35.801 451 HD2 LYS 45 HD2 LYS 45 32.156 4.492 -37.760 452 HD3 LYS 45 HD3 LYS 45 32.306 4.498 -36.136 453 HE2 LYS 45 HE2 LYS 45 30.005 3.237 -35.940 454 HE3 LYS 45 HE3 LYS 45 29.760 3.575 -37.635 455 HZ1 LYS 45 HZ1 LYS 45 31.599 1.953 -38.066 456 HZ2 LYS 45 HZ2 LYS 45 31.901 1.766 -36.515 457 HZ3 LYS 45 HZ3 LYS 45 30.488 1.342 -37.041 458 H ALA 46 H ALA 46 26.412 7.511 -37.696 459 HA ALA 46 HA ALA 46 26.178 7.103 -40.538 460 HB1 ALA 46 HB1 ALA 46 23.902 7.175 -38.465 461 HB2 ALA 46 HB2 ALA 46 23.815 6.709 -40.175 462 HB3 ALA 46 HB3 ALA 46 24.669 5.631 -39.126 463 H TYR 47 H TYR 47 25.402 9.403 -37.993 464 HA TYR 47 HA TYR 47 24.317 11.332 -39.817 465 HB2 TYR 47 HB2 TYR 47 24.054 11.198 -37.205 466 HB3 TYR 47 HB3 TYR 47 25.707 11.904 -37.196 467 HD1 TYR 47 HD1 TYR 47 22.250 12.339 -38.252 468 HD2 TYR 47 HD2 TYR 47 25.953 14.125 -37.341 469 HE1 TYR 47 HE1 TYR 47 21.052 14.648 -37.879 470 HE2 TYR 47 HE2 TYR 47 24.862 16.397 -37.239 471 HH TYR 47 HH TYR 47 21.299 16.739 -37.472 472 H CYS 48 H CYS 48 27.585 10.731 -38.948 473 HA CYS 48 HA CYS 48 28.975 12.804 -40.400 474 HB2 CYS 48 HB2 CYS 48 30.097 11.060 -39.041 475 HB3 CYS 48 HB3 CYS 48 29.534 9.935 -40.422 476 HG CYS 48 HG CYS 48 31.752 10.324 -41.614 477 H GLU 49 H GLU 49 27.795 9.833 -41.919 478 HA GLU 49 HA GLU 49 28.464 10.706 -44.576 479 HB2 GLU 49 HB2 GLU 49 26.511 8.451 -43.842 480 HB3 GLU 49 HB3 GLU 49 27.257 8.905 -45.450 481 HG2 GLU 49 HG2 GLU 49 28.530 8.132 -42.841 482 HG3 GLU 49 HG3 GLU 49 28.392 7.001 -44.120 483 H ARG 50 H ARG 50 25.533 11.062 -42.653 484 HA ARG 50 HA ARG 50 23.990 12.184 -44.928 485 HB2 ARG 50 HB2 ARG 50 23.417 12.124 -41.992 486 HB3 ARG 50 HB3 ARG 50 22.503 13.065 -43.073 487 HG2 ARG 50 HG2 ARG 50 22.219 10.892 -44.574 488 HG3 ARG 50 HG3 ARG 50 22.894 9.982 -43.328 489 HD2 ARG 50 HD2 ARG 50 21.200 10.514 -41.746 490 HD3 ARG 50 HD3 ARG 50 20.384 11.623 -42.857 491 HE ARG 50 HE ARG 50 20.441 8.619 -43.011 492 HH11 ARG 50 HH11 ARG 50 19.695 11.499 -44.678 493 HH12 ARG 50 HH12 ARG 50 18.435 10.763 -45.713 494 HH21 ARG 50 HH21 ARG 50 18.948 7.603 -44.183 495 HH22 ARG 50 HH22 ARG 50 17.946 8.544 -45.278 496 H GLN 51 H GLN 51 26.126 13.629 -42.425 497 HA GLN 51 HA GLN 51 25.434 16.454 -43.014 498 HB2 GLN 51 HB2 GLN 51 27.885 15.212 -41.892 499 HB3 GLN 51 HB3 GLN 51 27.386 16.982 -41.787 500 HG2 GLN 51 HG2 GLN 51 25.567 15.313 -40.330 501 HG3 GLN 51 HG3 GLN 51 27.099 15.239 -39.605 502 HE21 GLN 51 HE22 GLN 51 24.377 17.413 -40.411 503 HE22 GLN 51 HE21 GLN 51 25.041 18.707 -39.387 504 H GLY 52 H GLY 52 28.107 14.261 -44.011 505 HA2 GLY 52 HA2 GLY 52 29.662 14.470 -45.675 506 HA3 GLY 52 HA3 GLY 52 28.872 16.088 -46.142 507 H LEU 53 H LEU 53 29.196 16.188 -42.909 508 HA LEU 53 HA LEU 53 31.931 17.390 -42.695 509 HB2 LEU 53 HB2 LEU 53 29.570 17.360 -40.875 510 HB3 LEU 53 HB3 LEU 53 31.181 17.961 -40.387 511 HG LEU 53 HG LEU 53 29.211 18.935 -42.506 512 HD11 LEU 53 HD11 LEU 53 28.879 20.764 -41.057 513 HD12 LEU 53 HD12 LEU 53 28.669 19.234 -40.146 514 HD13 LEU 53 HD13 LEU 53 30.159 20.151 -39.939 515 HD21 LEU 53 HD21 LEU 53 30.545 20.986 -42.641 516 HD22 LEU 53 HD22 LEU 53 31.918 20.251 -41.721 517 HD23 LEU 53 HD23 LEU 53 31.484 19.710 -43.354 518 H SER 54 H SER 54 33.404 16.961 -40.945 519 HA SER 54 HA SER 54 33.892 14.168 -40.804 520 HB2 SER 54 HB2 SER 54 35.454 15.668 -41.554 521 HB3 SER 54 HB3 SER 54 35.348 16.804 -40.340 522 HG SER 54 HG SER 54 36.532 14.236 -40.487 523 H MET 55 H MET 55 33.868 12.845 -38.753 524 HA MET 55 HA MET 55 32.714 13.800 -36.334 525 HB2 MET 55 HB2 MET 55 34.126 11.363 -37.380 526 HB3 MET 55 HB3 MET 55 33.889 11.658 -35.599 527 HG2 MET 55 HG2 MET 55 31.649 12.107 -35.662 528 HG3 MET 55 HG3 MET 55 31.527 11.986 -37.467 529 HE1 MET 55 HE1 MET 55 31.890 8.131 -34.814 530 HE2 MET 55 HE2 MET 55 33.021 9.483 -34.579 531 HE3 MET 55 HE3 MET 55 31.495 9.714 -34.002 532 H ARG 56 H ARG 56 36.007 13.803 -37.558 533 HA ARG 56 HA ARG 56 37.380 14.276 -35.047 534 HB2 ARG 56 HB2 ARG 56 38.202 13.844 -37.507 535 HB3 ARG 56 HB3 ARG 56 38.239 15.626 -37.540 536 HG2 ARG 56 HG2 ARG 56 39.666 15.670 -35.418 537 HG3 ARG 56 HG3 ARG 56 39.793 13.916 -35.522 538 HD2 ARG 56 HD2 ARG 56 40.846 13.956 -37.622 539 HD3 ARG 56 HD3 ARG 56 40.488 15.545 -37.990 540 HE ARG 56 HE ARG 56 42.228 15.531 -35.557 541 HH11 ARG 56 HH11 ARG 56 42.109 15.828 -38.850 542 HH12 ARG 56 HH12 ARG 56 43.765 15.820 -39.228 543 HH21 ARG 56 HH21 ARG 56 44.547 15.333 -35.825 544 HH22 ARG 56 HH22 ARG 56 45.241 15.583 -37.393 545 H GLN 57 H GLN 57 35.162 16.320 -36.617 546 HA GLN 57 HA GLN 57 35.879 18.941 -35.417 547 HB2 GLN 57 HB2 GLN 57 35.916 18.919 -37.989 548 HB3 GLN 57 HB3 GLN 57 34.320 18.314 -38.060 549 HG2 GLN 57 HG2 GLN 57 33.610 20.524 -36.937 550 HG3 GLN 57 HG3 GLN 57 35.353 20.959 -37.255 551 HE21 GLN 57 HE22 GLN 57 32.343 21.398 -38.490 552 HE22 GLN 57 HE21 GLN 57 32.811 21.403 -40.221 553 H ILE 58 H ILE 58 32.996 16.823 -36.317 554 HA ILE 58 HA ILE 58 31.369 18.558 -34.724 555 HB ILE 58 HB ILE 58 29.412 17.486 -35.302 556 HG12 ILE 58 HG12 ILE 58 30.967 15.273 -36.744 557 HG13 ILE 58 HG13 ILE 58 30.349 15.050 -35.193 558 HG21 ILE 58 HG21 ILE 58 30.924 18.807 -37.145 559 HG22 ILE 58 HG22 ILE 58 30.828 17.338 -37.961 560 HG23 ILE 58 HG23 ILE 58 29.350 18.180 -37.305 561 HD11 ILE 58 HD11 ILE 58 27.964 15.647 -36.118 562 HD12 ILE 58 HD12 ILE 58 28.726 16.003 -37.680 563 HD13 ILE 58 HD13 ILE 58 28.712 14.442 -37.239 564 H ARG 59 H ARG 59 30.122 17.884 -32.685 565 HA ARG 59 HA ARG 59 31.169 15.671 -31.005 566 HB2 ARG 59 HB2 ARG 59 30.943 18.560 -30.054 567 HB3 ARG 59 HB3 ARG 59 31.122 17.107 -29.168 568 HG2 ARG 59 HG2 ARG 59 33.095 18.114 -31.348 569 HG3 ARG 59 HG3 ARG 59 33.077 18.661 -29.670 570 HD2 ARG 59 HD2 ARG 59 33.702 16.483 -28.845 571 HD3 ARG 59 HD3 ARG 59 33.419 15.679 -30.503 572 HE ARG 59 HE ARG 59 35.750 17.235 -29.722 573 HH11 ARG 59 HH11 ARG 59 34.077 16.120 -32.627 574 HH12 ARG 59 HH12 ARG 59 35.707 15.808 -33.312 575 HH21 ARG 59 HH21 ARG 59 37.240 17.703 -31.052 576 HH22 ARG 59 HH22 ARG 59 37.304 16.924 -32.667 577 H PHE 60 H PHE 60 29.656 14.753 -29.898 578 HA PHE 60 HA PHE 60 26.832 15.712 -30.194 579 HB2 PHE 60 HB2 PHE 60 27.863 12.808 -30.052 580 HB3 PHE 60 HB3 PHE 60 26.171 13.285 -29.956 581 HD1 PHE 60 HD1 PHE 60 29.171 13.196 -31.979 582 HD2 PHE 60 HD2 PHE 60 24.927 13.462 -31.868 583 HE1 PHE 60 HE1 PHE 60 29.165 12.892 -34.493 584 HE2 PHE 60 HE2 PHE 60 24.852 13.385 -34.463 585 HZ PHE 60 HZ PHE 60 26.862 13.129 -35.654 586 H ARG 61 H ARG 61 25.702 16.091 -28.301 587 HA ARG 61 HA ARG 61 26.793 14.867 -25.898 588 HB2 ARG 61 HB2 ARG 61 25.711 17.678 -26.170 589 HB3 ARG 61 HB3 ARG 61 26.446 17.026 -24.606 590 HG2 ARG 61 HG2 ARG 61 28.590 16.803 -25.639 591 HG3 ARG 61 HG3 ARG 61 28.087 17.658 -27.122 592 HD2 ARG 61 HD2 ARG 61 27.501 19.590 -26.222 593 HD3 ARG 61 HD3 ARG 61 27.780 19.013 -24.536 594 HE ARG 61 HE ARG 61 30.115 18.690 -25.275 595 HH11 ARG 61 HH11 ARG 61 28.276 21.343 -26.616 596 HH12 ARG 61 HH12 ARG 61 29.591 22.020 -27.431 597 HH21 ARG 61 HH21 ARG 61 31.846 19.562 -26.780 598 HH22 ARG 61 HH22 ARG 61 31.673 21.242 -26.987 599 H PHE 62 H PHE 62 25.141 15.080 -23.904 600 HA PHE 62 HA PHE 62 22.385 15.636 -24.567 601 HB2 PHE 62 HB2 PHE 62 22.299 13.396 -25.386 602 HB3 PHE 62 HB3 PHE 62 23.299 12.869 -24.024 603 HD1 PHE 62 HD2 PHE 62 20.112 14.760 -24.530 604 HD2 PHE 62 HD1 PHE 62 22.176 11.662 -22.609 605 HE1 PHE 62 HE2 PHE 62 18.156 14.427 -22.914 606 HE2 PHE 62 HE1 PHE 62 20.307 11.376 -20.882 607 HZ PHE 62 HZ PHE 62 18.161 12.695 -21.303 608 H ASP 63 H ASP 63 21.181 16.202 -22.644 609 HA ASP 63 HA ASP 63 20.981 16.885 -20.594 610 HB2 ASP 63 HB2 ASP 63 21.110 14.316 -20.354 611 HB3 ASP 63 HB3 ASP 63 22.577 14.601 -19.477 612 H GLY 64 H GLY 64 23.189 18.227 -21.917 613 HA2 GLY 64 HA2 GLY 64 25.071 19.533 -21.573 614 HA3 GLY 64 HA3 GLY 64 24.884 19.099 -19.842 615 H GLN 65 H GLN 65 25.243 16.185 -20.991 616 HA GLN 65 HA GLN 65 28.098 16.137 -20.530 617 HB2 GLN 65 HB2 GLN 65 26.459 13.646 -20.820 618 HB3 GLN 65 HB3 GLN 65 27.976 13.880 -19.947 619 HG2 GLN 65 HG2 GLN 65 25.469 15.175 -18.910 620 HG3 GLN 65 HG3 GLN 65 26.095 13.604 -18.581 621 HE21 GLN 65 HE22 GLN 65 25.835 15.823 -16.616 622 HE22 GLN 65 HE21 GLN 65 27.438 16.141 -16.019 623 HA PRO 66 HA PRO 66 29.133 15.003 -24.832 624 HB2 PRO 66 HB2 PRO 66 31.767 14.091 -24.238 625 HB3 PRO 66 HB3 PRO 66 31.114 15.819 -24.442 626 HG2 PRO 66 HG2 PRO 66 31.814 14.209 -21.924 627 HG3 PRO 66 HG3 PRO 66 32.039 15.896 -22.228 628 HD2 PRO 66 HD2 PRO 66 29.933 14.935 -20.909 629 HD3 PRO 66 HD3 PRO 66 29.971 16.477 -21.529 630 H ILE 67 H ILE 67 29.075 12.967 -25.947 631 HA ILE 67 HA ILE 67 28.286 10.667 -24.346 632 HB ILE 67 HB ILE 67 27.783 11.533 -27.192 633 HG12 ILE 67 HG12 ILE 67 26.003 10.943 -24.883 634 HG13 ILE 67 HG13 ILE 67 26.393 12.603 -25.207 635 HG21 ILE 67 HG21 ILE 67 27.843 9.227 -27.508 636 HG22 ILE 67 HG22 ILE 67 26.723 8.925 -26.098 637 HG23 ILE 67 HG23 ILE 67 26.226 9.652 -27.591 638 HD11 ILE 67 HD11 ILE 67 24.252 12.311 -25.948 639 HD12 ILE 67 HD12 ILE 67 25.074 12.327 -27.526 640 HD13 ILE 67 HD13 ILE 67 24.481 10.815 -26.716 641 H ASN 68 H ASN 68 29.240 8.617 -24.789 642 HA ASN 68 HA ASN 68 31.899 8.816 -26.071 643 HB2 ASN 68 HB2 ASN 68 30.679 6.691 -24.202 644 HB3 ASN 68 HB3 ASN 68 32.374 6.699 -24.759 645 HD21 ASN 68 HD22 ASN 68 30.218 8.085 -22.395 646 HD22 ASN 68 HD21 ASN 68 31.606 8.853 -21.587 647 H GLU 69 H GLU 69 32.442 6.919 -27.439 648 HA GLU 69 HA GLU 69 30.385 5.914 -29.321 649 HB2 GLU 69 HB2 GLU 69 33.267 5.053 -28.729 650 HB3 GLU 69 HB3 GLU 69 32.252 4.520 -30.194 651 HG2 GLU 69 HG2 GLU 69 32.080 6.952 -30.926 652 HG3 GLU 69 HG3 GLU 69 32.881 7.329 -29.678 653 H THR 70 H THR 70 31.439 4.598 -26.319 654 HA THR 70 HA THR 70 30.289 1.915 -26.832 655 HB THR 70 HB THR 70 30.980 1.436 -24.486 656 HG1 THR 70 HG1 THR 70 31.190 3.356 -23.494 657 HG21 THR 70 HG21 THR 70 32.548 0.878 -26.365 658 HG22 THR 70 HG22 THR 70 33.193 2.454 -26.490 659 HG23 THR 70 HG23 THR 70 33.640 1.577 -25.120 660 H ASP 71 H ASP 71 29.218 4.959 -25.658 661 HA ASP 71 HA ASP 71 27.391 4.286 -23.563 662 HB2 ASP 71 HB2 ASP 71 27.492 6.659 -25.301 663 HB3 ASP 71 HB3 ASP 71 26.266 6.252 -24.049 664 H THR 72 H THR 72 24.967 4.255 -23.705 665 HA THR 72 HA THR 72 23.754 3.491 -26.250 666 HB THR 72 HB THR 72 22.617 1.579 -25.192 667 HG1 THR 72 HG1 THR 72 23.145 0.801 -23.281 668 HG21 THR 72 HG21 THR 72 24.572 0.905 -26.403 669 HG22 THR 72 HG22 THR 72 25.566 0.972 -24.864 670 HG23 THR 72 HG23 THR 72 24.380 -0.182 -24.936 671 HA PRO 73 HA PRO 73 20.537 5.678 -24.308 672 HB2 PRO 73 HB2 PRO 73 18.453 3.496 -24.634 673 HB3 PRO 73 HB3 PRO 73 18.353 5.253 -24.947 674 HG2 PRO 73 HG2 PRO 73 18.880 3.049 -26.810 675 HG3 PRO 73 HG3 PRO 73 19.367 4.760 -27.098 676 HD2 PRO 73 HD2 PRO 73 20.899 2.278 -26.277 677 HD3 PRO 73 HD3 PRO 73 21.457 3.658 -27.177 678 H ALA 74 H ALA 74 20.653 2.329 -23.324 679 HA ALA 74 HA ALA 74 19.405 2.687 -20.775 680 HB1 ALA 74 HB1 ALA 74 20.574 0.368 -20.492 681 HB2 ALA 74 HB2 ALA 74 19.653 0.472 -21.945 682 HB3 ALA 74 HB3 ALA 74 21.352 0.598 -22.103 683 H GLN 75 H GLN 75 22.830 2.730 -21.500 684 HA GLN 75 HA GLN 75 23.769 3.412 -18.911 685 HB2 GLN 75 HB2 GLN 75 25.241 2.821 -20.592 686 HB3 GLN 75 HB3 GLN 75 24.725 4.131 -21.717 687 HG2 GLN 75 HG2 GLN 75 27.000 4.120 -20.516 688 HG3 GLN 75 HG3 GLN 75 26.059 5.644 -20.592 689 HE21 GLN 75 HE22 GLN 75 26.970 6.534 -18.835 690 HE22 GLN 75 HE21 GLN 75 26.832 5.888 -17.154 691 H LEU 76 H LEU 76 21.982 5.570 -21.220 692 HA LEU 76 HA LEU 76 23.086 7.850 -19.629 693 HB2 LEU 76 HB2 LEU 76 21.794 7.974 -22.219 694 HB3 LEU 76 HB3 LEU 76 22.706 9.303 -21.271 695 HG LEU 76 HG LEU 76 23.916 7.034 -22.761 696 HD11 LEU 76 HD11 LEU 76 24.798 8.758 -24.110 697 HD12 LEU 76 HD12 LEU 76 23.000 9.142 -24.180 698 HD13 LEU 76 HD13 LEU 76 24.083 10.038 -23.145 699 HD21 LEU 76 HD21 LEU 76 25.196 7.851 -20.597 700 HD22 LEU 76 HD22 LEU 76 25.986 8.205 -22.080 701 HD23 LEU 76 HD23 LEU 76 25.018 9.431 -21.294 702 H GLU 77 H GLU 77 20.327 6.044 -19.288 703 HA GLU 77 HA GLU 77 18.214 6.616 -18.380 704 HB2 GLU 77 HB2 GLU 77 19.818 8.907 -17.115 705 HB3 GLU 77 HB3 GLU 77 18.283 8.220 -16.593 706 HG2 GLU 77 HG2 GLU 77 20.938 6.826 -16.930 707 HG3 GLU 77 HG3 GLU 77 20.404 7.552 -15.426 708 H MET 78 H MET 78 18.449 7.177 -21.051 709 HA MET 78 HA MET 78 16.824 9.449 -21.818 710 HB2 MET 78 HB2 MET 78 17.667 7.046 -23.418 711 HB3 MET 78 HB3 MET 78 17.166 8.515 -24.031 712 HG2 MET 78 HG2 MET 78 19.106 9.609 -22.585 713 HG3 MET 78 HG3 MET 78 19.716 7.939 -22.605 714 HE1 MET 78 HE1 MET 78 19.281 10.783 -26.322 715 HE2 MET 78 HE2 MET 78 18.106 10.419 -25.033 716 HE3 MET 78 HE3 MET 78 19.646 11.321 -24.608 717 H GLU 79 H GLU 79 14.669 9.488 -22.634 718 HA GLU 79 HA GLU 79 13.254 6.916 -22.921 719 HB2 GLU 79 HB2 GLU 79 12.407 9.313 -21.377 720 HB3 GLU 79 HB3 GLU 79 11.240 8.965 -22.552 721 HG2 GLU 79 HG2 GLU 79 12.314 7.093 -20.387 722 HG3 GLU 79 HG3 GLU 79 10.804 8.018 -20.308 723 H ASP 80 H ASP 80 11.082 7.523 -24.231 724 HA ASP 80 HA ASP 80 11.783 8.257 -27.037 725 HB2 ASP 80 HB2 ASP 80 9.100 8.136 -25.438 726 HB3 ASP 80 HB3 ASP 80 9.305 8.578 -27.022 727 H GLU 81 H GLU 81 11.487 9.977 -27.961 728 HA GLU 81 HA GLU 81 11.782 12.146 -28.485 729 HB2 GLU 81 HB2 GLU 81 9.877 12.882 -26.233 730 HB3 GLU 81 HB3 GLU 81 10.184 13.787 -27.650 731 HG2 GLU 81 HG2 GLU 81 8.651 11.214 -27.537 732 HG3 GLU 81 HG3 GLU 81 7.979 12.730 -27.807 733 H ASP 82 H ASP 82 13.475 11.140 -26.034 734 HA ASP 82 HA ASP 82 14.677 13.711 -25.620 735 HB2 ASP 82 HB2 ASP 82 15.657 10.872 -25.354 736 HB3 ASP 82 HB3 ASP 82 16.761 12.149 -25.062 737 H THR 83 H THR 83 16.506 14.565 -26.363 738 HA THR 83 HA THR 83 17.008 13.911 -29.265 739 HB THR 83 HB THR 83 16.504 16.774 -28.257 740 HG1 THR 83 HG1 THR 83 14.622 16.039 -28.291 741 HG21 THR 83 HG21 THR 83 18.094 16.315 -30.441 742 HG22 THR 83 HG22 THR 83 16.428 16.125 -31.139 743 HG23 THR 83 HG23 THR 83 16.720 17.535 -30.228 744 H ILE 84 H ILE 84 18.957 13.530 -29.670 745 HA ILE 84 HA ILE 84 21.128 14.415 -27.901 746 HB ILE 84 HB ILE 84 21.181 12.565 -30.316 747 HG12 ILE 84 HG12 ILE 84 21.966 11.994 -27.487 748 HG13 ILE 84 HG13 ILE 84 20.317 11.646 -28.105 749 HG21 ILE 84 HG21 ILE 84 23.422 13.783 -28.675 750 HG22 ILE 84 HG22 ILE 84 23.607 12.291 -29.620 751 HG23 ILE 84 HG23 ILE 84 23.243 13.815 -30.458 752 HD11 ILE 84 HD11 ILE 84 21.386 9.624 -28.241 753 HD12 ILE 84 HD12 ILE 84 21.281 10.223 -29.889 754 HD13 ILE 84 HD13 ILE 84 22.825 10.393 -29.070 755 H ASP 85 H ASP 85 22.452 15.887 -28.235 756 HA ASP 85 HA ASP 85 21.752 18.034 -30.145 757 HB2 ASP 85 HB2 ASP 85 23.125 18.151 -27.492 758 HB3 ASP 85 HB3 ASP 85 22.895 19.401 -28.770 759 H VAL 86 H VAL 86 23.087 18.578 -31.793 760 HA VAL 86 HA VAL 86 25.932 17.531 -31.926 761 HB VAL 86 HB VAL 86 24.293 18.516 -34.338 762 HG11 VAL 86 HG11 VAL 86 26.608 18.735 -34.651 763 HG12 VAL 86 HG12 VAL 86 26.978 17.198 -33.972 764 HG13 VAL 86 HG13 VAL 86 26.098 17.231 -35.557 765 HG21 VAL 86 HG21 VAL 86 23.886 16.152 -34.954 766 HG22 VAL 86 HG22 VAL 86 24.869 15.627 -33.658 767 HG23 VAL 86 HG23 VAL 86 23.291 16.449 -33.348 768 H PHE 87 H PHE 87 27.409 18.841 -31.639 769 HA PHE 87 HA PHE 87 27.303 21.745 -32.097 770 HB2 PHE 87 HB2 PHE 87 28.968 20.181 -30.033 771 HB3 PHE 87 HB3 PHE 87 28.875 21.966 -30.282 772 HD1 PHE 87 HD1 PHE 87 26.924 19.188 -28.867 773 HD2 PHE 87 HD2 PHE 87 27.280 23.440 -29.384 774 HE1 PHE 87 HE1 PHE 87 24.886 19.518 -27.520 775 HE2 PHE 87 HE2 PHE 87 25.172 23.794 -27.959 776 HZ PHE 87 HZ PHE 87 23.876 21.735 -27.245 777 H GLN 88 H GLN 88 29.810 22.319 -32.367 778 HA GLN 88 HA GLN 88 31.511 20.132 -33.414 779 HB2 GLN 88 HB2 GLN 88 31.226 22.979 -34.291 780 HB3 GLN 88 HB3 GLN 88 32.263 21.853 -35.068 781 HG2 GLN 88 HG2 GLN 88 29.886 20.461 -35.487 782 HG3 GLN 88 HG3 GLN 88 29.127 21.918 -35.146 783 HE21 GLN 88 HE22 GLN 88 28.461 21.183 -37.524 784 HE22 GLN 88 HE21 GLN 88 29.357 22.056 -38.746 785 H GLN 89 H GLN 89 34.003 20.693 -33.369 786 HA GLN 89 HA GLN 89 34.634 22.930 -31.529 787 HB2 GLN 89 HB2 GLN 89 35.710 20.095 -31.476 788 HB3 GLN 89 HB3 GLN 89 36.748 21.463 -30.918 789 HG2 GLN 89 HG2 GLN 89 35.135 21.980 -29.226 790 HG3 GLN 89 HG3 GLN 89 34.033 20.686 -29.814 791 HE21 GLN 89 HE22 GLN 89 34.898 20.731 -27.205 792 HE22 GLN 89 HE21 GLN 89 35.913 19.273 -27.086 793 H GLN 90 H GLN 90 36.057 24.149 -32.181 794 HA GLN 90 HA GLN 90 37.215 23.910 -34.885 795 HB2 GLN 90 HB2 GLN 90 36.741 26.272 -32.985 796 HB3 GLN 90 HB3 GLN 90 37.801 26.423 -34.384 797 HG2 GLN 90 HG2 GLN 90 36.062 27.168 -35.416 798 HG3 GLN 90 HG3 GLN 90 35.835 25.504 -35.815 799 HE21 GLN 90 HE22 GLN 90 33.852 25.445 -36.377 800 HE22 GLN 90 HE21 GLN 90 32.587 25.374 -35.117 801 H THR 91 H THR 91 39.565 24.473 -35.186 802 HA THR 91 HA THR 91 41.097 23.381 -32.918 803 HB THR 91 HB THR 91 42.945 22.990 -34.610 804 HG1 THR 91 HG1 THR 91 42.228 23.580 -36.854 805 HG21 THR 91 HG21 THR 91 40.228 22.057 -35.426 806 HG22 THR 91 HG22 THR 91 41.778 21.456 -36.167 807 HG23 THR 91 HG23 THR 91 41.467 21.168 -34.443 808 H GLY 92 H GLY 92 40.187 26.461 -33.281 809 HA2 GLY 92 HA2 GLY 92 41.114 28.099 -31.896 810 HA3 GLY 92 HA3 GLY 92 42.748 27.420 -32.073 811 H GLY 93 H GLY 93 43.236 29.740 -32.476 812 HA2 GLY 93 HA2 GLY 93 41.907 31.025 -34.762 813 HA3 GLY 93 HA3 GLY 93 42.642 31.806 -33.395 814 H VAL 94 H VAL 94 43.249 32.641 -35.918 815 HA VAL 94 HA VAL 94 45.872 31.656 -36.714 816 HB VAL 94 HB VAL 94 44.734 34.296 -37.670 817 HG11 VAL 94 HG11 VAL 94 46.692 32.489 -39.134 818 HG12 VAL 94 HG12 VAL 94 46.207 34.075 -39.650 819 HG13 VAL 94 HG13 VAL 94 47.237 33.936 -38.247 820 HG21 VAL 94 HG21 VAL 94 43.997 32.934 -39.624 821 HG22 VAL 94 HG22 VAL 94 44.381 31.431 -38.715 822 HG23 VAL 94 HG23 VAL 94 43.129 32.513 -38.216 823 H TYR 95 H TYR 95 47.410 32.039 -35.372 824 HA TYR 95 HA TYR 95 47.716 34.425 -33.627 825 HB2 TYR 95 HB2 TYR 95 49.432 31.916 -33.622 826 HB3 TYR 95 HB3 TYR 95 49.258 33.030 -32.378 827 HD1 TYR 95 HD1 TYR 95 46.119 33.074 -32.085 828 HD2 TYR 95 HD2 TYR 95 48.761 29.753 -32.839 829 HE1 TYR 95 HE1 TYR 95 44.472 31.483 -31.245 830 HE2 TYR 95 HE2 TYR 95 47.032 28.199 -31.863 831 HH TYR 95 HH TYR 95 44.843 27.865 -31.144 Start of MODEL 12 1 H1 ACE 36 HH32 ACE 36 9.140 13.647 -43.643 2 H2 ACE 36 HH33 ACE 36 10.764 13.201 -43.239 3 H3 ACE 36 HH31 ACE 36 10.530 14.700 -44.129 4 H GLU 37 H GLU 37 11.253 14.515 -46.099 5 HA GLU 37 HA GLU 37 10.365 12.377 -47.989 6 HB2 GLU 37 HB2 GLU 37 10.780 14.551 -48.940 7 HB3 GLU 37 HB3 GLU 37 12.520 14.402 -48.369 8 HG2 GLU 37 HG2 GLU 37 12.114 14.093 -50.829 9 HG3 GLU 37 HG3 GLU 37 12.988 12.836 -49.990 10 H ASP 38 H ASP 38 13.211 13.160 -46.235 11 HA ASP 38 HA ASP 38 14.307 10.380 -46.213 12 HB2 ASP 38 HB2 ASP 38 15.285 11.429 -48.214 13 HB3 ASP 38 HB3 ASP 38 15.966 12.748 -47.152 14 H ALA 39 H ALA 39 13.397 10.584 -44.037 15 HA ALA 39 HA ALA 39 15.566 11.385 -42.195 16 HB1 ALA 39 HB1 ALA 39 12.894 12.908 -42.253 17 HB2 ALA 39 HB2 ALA 39 14.073 12.912 -40.893 18 HB3 ALA 39 HB3 ALA 39 14.523 13.500 -42.475 19 H PHE 40 H PHE 40 14.779 8.920 -42.648 20 HA PHE 40 HA PHE 40 14.248 8.146 -39.876 21 HB2 PHE 40 HB2 PHE 40 12.045 7.986 -41.619 22 HB3 PHE 40 HB3 PHE 40 12.772 6.334 -41.722 23 HD1 PHE 40 HD1 PHE 40 11.925 8.825 -39.091 24 HD2 PHE 40 HD2 PHE 40 11.901 4.593 -40.232 25 HE1 PHE 40 HE1 PHE 40 11.022 8.167 -36.899 26 HE2 PHE 40 HE2 PHE 40 11.141 4.015 -37.953 27 HZ PHE 40 HZ PHE 40 10.718 5.750 -36.333 28 H ILE 41 H ILE 41 15.600 6.606 -39.059 29 HA ILE 41 HA ILE 41 17.101 4.949 -40.884 30 HB ILE 41 HB ILE 41 18.169 6.735 -38.716 31 HG12 ILE 41 HG12 ILE 41 19.766 7.558 -40.845 32 HG13 ILE 41 HG13 ILE 41 18.326 7.079 -41.708 33 HG21 ILE 41 HG21 ILE 41 19.792 5.014 -40.835 34 HG22 ILE 41 HG22 ILE 41 20.399 5.604 -39.361 35 HG23 ILE 41 HG23 ILE 41 19.207 4.323 -39.303 36 HD11 ILE 41 HD11 ILE 41 17.937 9.451 -41.163 37 HD12 ILE 41 HD12 ILE 41 17.215 8.873 -39.674 38 HD13 ILE 41 HD13 ILE 41 18.887 9.189 -39.630 39 H VAL 42 H VAL 42 16.248 3.030 -40.362 40 HA VAL 42 HA VAL 42 15.570 2.370 -37.496 41 HB VAL 42 HB VAL 42 14.885 0.717 -39.841 42 HG11 VAL 42 HG11 VAL 42 14.541 -0.133 -37.512 43 HG12 VAL 42 HG12 VAL 42 13.442 1.279 -37.247 44 HG13 VAL 42 HG13 VAL 42 13.047 0.111 -38.502 45 HG21 VAL 42 HG21 VAL 42 13.644 3.282 -38.824 46 HG22 VAL 42 HG22 VAL 42 13.970 2.804 -40.467 47 HG23 VAL 42 HG23 VAL 42 12.559 2.141 -39.536 48 H ILE 43 H ILE 43 17.077 1.484 -36.223 49 HA ILE 43 HA ILE 43 18.945 -0.428 -37.409 50 HB ILE 43 HB ILE 43 19.532 1.734 -35.466 51 HG12 ILE 43 HG12 ILE 43 20.608 1.703 -38.320 52 HG13 ILE 43 HG13 ILE 43 19.276 2.751 -37.767 53 HG21 ILE 43 HG21 ILE 43 21.945 0.785 -35.970 54 HG22 ILE 43 HG22 ILE 43 20.822 0.205 -34.845 55 HG23 ILE 43 HG23 ILE 43 20.963 -0.674 -36.449 56 HD11 ILE 43 HD11 ILE 43 22.097 2.938 -36.759 57 HD12 ILE 43 HD12 ILE 43 21.218 3.845 -38.001 58 HD13 ILE 43 HD13 ILE 43 20.739 4.007 -36.310 59 H SEP 44 H SEP 44 19.249 -2.419 -36.231 60 HA SEP 44 HA SEP 44 19.110 -2.549 -33.226 61 HB2 SEP 44 HB2 SEP 44 17.931 -4.471 -33.307 62 HB3 SEP 44 HB3 SEP 44 16.911 -3.164 -33.889 63 H ASP 45 H ASP 45 20.421 -3.914 -32.225 64 HA ASP 45 HA ASP 45 22.909 -3.917 -33.739 65 HB2 ASP 45 HB2 ASP 45 22.522 -3.108 -31.388 66 HB3 ASP 45 HB3 ASP 45 22.323 -4.785 -30.847 67 H SEP 46 H SEP 46 20.573 -6.258 -33.594 68 HA SEP 46 HA SEP 46 22.516 -8.517 -33.563 69 HB2 SEP 46 HB2 SEP 46 20.733 -9.937 -32.714 70 HB3 SEP 46 HB3 SEP 46 21.406 -8.821 -31.552 71 H ASP 47 H ASP 47 22.249 -10.013 -35.190 72 HA ASP 47 HA ASP 47 19.998 -9.762 -37.088 73 HB2 ASP 47 HB2 ASP 47 22.151 -8.975 -37.801 74 HB3 ASP 47 HB3 ASP 47 22.799 -10.609 -37.574 75 H GLY 48 H GLY 48 19.634 -11.897 -38.326 76 HA2 GLY 48 HA2 GLY 48 19.366 -14.158 -38.376 77 HA3 GLY 48 HA3 GLY 48 20.515 -14.383 -36.956 78 H GLU 49 H GLU 49 18.971 -16.176 -36.656 79 HA GLU 49 HA GLU 49 16.521 -15.337 -35.387 80 HB2 GLU 49 HB2 GLU 49 16.568 -17.389 -36.896 81 HB3 GLU 49 HB3 GLU 49 17.892 -18.092 -35.951 82 HG2 GLU 49 HG2 GLU 49 15.815 -19.136 -35.305 83 HG3 GLU 49 HG3 GLU 49 16.568 -18.475 -33.932 84 HN1 NH2 50 HN1 NH2 50 16.020 -15.736 -33.214 85 HN2 NH2 50 HN2 NH2 50 17.210 -16.061 -31.982 86 H1 MET 1 H1 MET 1 -12.040 -26.693 -36.345 87 H2 MET 1 H2 MET 1 -12.941 -27.040 -35.168 88 H3 MET 1 H3 MET 1 -11.361 -27.581 -35.115 89 HA MET 1 HA MET 1 -12.268 -24.790 -35.060 90 HB2 MET 1 HB2 MET 1 -11.064 -26.324 -32.672 91 HB3 MET 1 HB3 MET 1 -11.612 -24.676 -32.696 92 HG2 MET 1 HG2 MET 1 -13.632 -26.940 -32.961 93 HG3 MET 1 HG3 MET 1 -13.240 -25.822 -31.579 94 HE1 MET 1 HE1 MET 1 -15.302 -24.786 -31.029 95 HE2 MET 1 HE2 MET 1 -16.595 -24.116 -32.109 96 HE3 MET 1 HE3 MET 1 -16.296 -25.804 -31.997 97 H ALA 2 H ALA 2 -10.465 -23.132 -34.906 98 HA ALA 2 HA ALA 2 -8.392 -24.162 -36.643 99 HB1 ALA 2 HB1 ALA 2 -8.867 -22.069 -37.211 100 HB2 ALA 2 HB2 ALA 2 -9.414 -21.615 -35.661 101 HB3 ALA 2 HB3 ALA 2 -7.653 -21.588 -35.919 102 H ASP 3 H ASP 3 -6.228 -24.168 -36.563 103 HA ASP 3 HA ASP 3 -4.755 -24.475 -33.990 104 HB2 ASP 3 HB2 ASP 3 -4.188 -25.854 -36.085 105 HB3 ASP 3 HB3 ASP 3 -4.085 -24.324 -36.872 106 H GLU 4 H GLU 4 -5.908 -22.308 -33.401 107 HA GLU 4 HA GLU 4 -3.791 -20.373 -33.790 108 HB2 GLU 4 HB2 GLU 4 -5.679 -19.671 -35.354 109 HB3 GLU 4 HB3 GLU 4 -6.780 -19.960 -33.928 110 HG2 GLU 4 HG2 GLU 4 -6.543 -17.503 -34.313 111 HG3 GLU 4 HG3 GLU 4 -5.586 -17.925 -32.866 112 H LYS 5 H LYS 5 -2.925 -20.100 -31.873 113 HA LYS 5 HA LYS 5 -4.267 -20.471 -29.454 114 HB2 LYS 5 HB2 LYS 5 -1.882 -21.197 -29.670 115 HB3 LYS 5 HB3 LYS 5 -1.393 -19.466 -29.859 116 HG2 LYS 5 HG2 LYS 5 -2.153 -19.047 -27.548 117 HG3 LYS 5 HG3 LYS 5 -2.823 -20.640 -27.417 118 HD2 LYS 5 HD2 LYS 5 -0.539 -21.674 -27.862 119 HD3 LYS 5 HD3 LYS 5 -0.015 -19.993 -28.050 120 HE2 LYS 5 HE2 LYS 5 -0.489 -19.239 -25.871 121 HE3 LYS 5 HE3 LYS 5 -1.375 -20.790 -25.658 122 HZ1 LYS 5 HZ1 LYS 5 0.479 -22.068 -25.471 123 HZ2 LYS 5 HZ2 LYS 5 1.516 -20.882 -25.794 124 HZ3 LYS 5 HZ3 LYS 5 0.759 -20.950 -24.381 125 HA PRO 6 HA PRO 6 -5.767 -16.494 -29.263 126 HB2 PRO 6 HB2 PRO 6 -6.192 -16.998 -26.267 127 HB3 PRO 6 HB3 PRO 6 -7.406 -16.268 -27.354 128 HG2 PRO 6 HG2 PRO 6 -7.625 -18.892 -26.913 129 HG3 PRO 6 HG3 PRO 6 -7.653 -18.210 -28.617 130 HD2 PRO 6 HD2 PRO 6 -5.336 -19.511 -27.156 131 HD3 PRO 6 HD3 PRO 6 -6.084 -19.952 -28.829 132 H LYS 7 H LYS 7 -5.214 -14.314 -28.421 133 HA LYS 7 HA LYS 7 -2.561 -14.143 -28.344 134 HB2 LYS 7 HB2 LYS 7 -4.218 -12.578 -29.431 135 HB3 LYS 7 HB3 LYS 7 -4.501 -11.773 -27.881 136 HG2 LYS 7 HG2 LYS 7 -2.179 -11.103 -27.657 137 HG3 LYS 7 HG3 LYS 7 -1.677 -12.276 -28.800 138 HD2 LYS 7 HD2 LYS 7 -3.036 -10.808 -30.597 139 HD3 LYS 7 HD3 LYS 7 -3.201 -9.616 -29.268 140 HE2 LYS 7 HE2 LYS 7 -0.765 -9.665 -29.067 141 HE3 LYS 7 HE3 LYS 7 -0.700 -10.847 -30.330 142 HZ1 LYS 7 HZ1 LYS 7 -1.744 -9.031 -31.815 143 HZ2 LYS 7 HZ2 LYS 7 -1.266 -7.975 -30.668 144 HZ3 LYS 7 HZ3 LYS 7 -0.209 -8.958 -31.373 145 H GLU 8 H GLU 8 -1.275 -13.721 -26.862 146 HA GLU 8 HA GLU 8 -1.595 -12.685 -24.113 147 HB2 GLU 8 HB2 GLU 8 -0.290 -14.336 -22.989 148 HB3 GLU 8 HB3 GLU 8 -1.877 -14.805 -23.436 149 HG2 GLU 8 HG2 GLU 8 -1.111 -16.166 -25.197 150 HG3 GLU 8 HG3 GLU 8 0.547 -15.616 -24.961 151 H GLY 9 H GLY 9 0.358 -11.331 -23.505 152 HA2 GLY 9 HA2 GLY 9 1.856 -10.696 -25.830 153 HA3 GLY 9 HA3 GLY 9 1.923 -10.056 -24.257 154 H VAL 10 H VAL 10 2.538 -13.580 -24.293 155 HA VAL 10 HA VAL 10 5.024 -12.846 -22.942 156 HB VAL 10 HB VAL 10 4.001 -15.631 -23.478 157 HG11 VAL 10 HG11 VAL 10 6.124 -15.748 -22.401 158 HG12 VAL 10 HG12 VAL 10 5.885 -14.328 -21.430 159 HG13 VAL 10 HG13 VAL 10 5.042 -15.805 -20.948 160 HG21 VAL 10 HG21 VAL 10 2.927 -13.657 -21.399 161 HG22 VAL 10 HG22 VAL 10 2.154 -14.692 -22.575 162 HG23 VAL 10 HG23 VAL 10 2.836 -15.401 -21.159 163 H LYS 11 H LYS 11 6.138 -11.859 -24.773 164 HA LYS 11 HA LYS 11 8.110 -13.771 -25.407 165 HB2 LYS 11 HB2 LYS 11 7.044 -12.048 -27.602 166 HB3 LYS 11 HB3 LYS 11 8.367 -13.211 -27.763 167 HG2 LYS 11 HG2 LYS 11 6.624 -15.160 -27.607 168 HG3 LYS 11 HG3 LYS 11 5.414 -13.900 -27.453 169 HD2 LYS 11 HD2 LYS 11 6.109 -12.870 -29.627 170 HD3 LYS 11 HD3 LYS 11 7.402 -14.243 -29.767 171 HE2 LYS 11 HE2 LYS 11 5.783 -15.926 -29.672 172 HE3 LYS 11 HE3 LYS 11 4.514 -14.727 -29.512 173 HZ1 LYS 11 HZ1 LYS 11 6.330 -14.880 -31.848 174 HZ2 LYS 11 HZ2 LYS 11 4.853 -15.674 -31.676 175 HZ3 LYS 11 HZ3 LYS 11 5.021 -13.951 -31.670 176 H THR 12 H THR 12 10.119 -12.773 -25.843 177 HA THR 12 HA THR 12 10.567 -10.185 -24.825 178 HB THR 12 HB THR 12 13.001 -10.829 -25.085 179 HG1 THR 12 HG1 THR 12 13.461 -12.495 -26.394 180 HG21 THR 12 HG21 THR 12 13.089 -12.506 -23.446 181 HG22 THR 12 HG22 THR 12 11.653 -11.509 -23.151 182 HG23 THR 12 HG23 THR 12 11.486 -13.177 -23.814 183 H GLU 13 H GLU 13 10.414 -11.496 -28.044 184 HA GLU 13 HA GLU 13 11.425 -9.271 -29.636 185 HB2 GLU 13 HB2 GLU 13 9.075 -11.088 -30.052 186 HB3 GLU 13 HB3 GLU 13 9.699 -10.026 -31.212 187 HG2 GLU 13 HG2 GLU 13 10.869 -12.615 -30.104 188 HG3 GLU 13 HG3 GLU 13 10.440 -12.200 -31.674 189 H ASN 14 H ASN 14 8.426 -9.667 -27.796 190 HA ASN 14 HA ASN 14 7.024 -7.482 -29.100 191 HB2 ASN 14 HB2 ASN 14 6.648 -9.030 -26.594 192 HB3 ASN 14 HB3 ASN 14 5.494 -7.812 -27.317 193 HD21 ASN 14 HD22 ASN 14 4.817 -10.455 -26.734 194 HD22 ASN 14 HD21 ASN 14 4.370 -11.243 -28.200 195 H ASN 15 H ASN 15 9.538 -6.992 -27.068 196 HA ASN 15 HA ASN 15 8.574 -5.081 -25.088 197 HB2 ASN 15 HB2 ASN 15 10.601 -6.665 -24.955 198 HB3 ASN 15 HB3 ASN 15 11.305 -5.696 -26.148 199 HD21 ASN 15 HD22 ASN 15 13.066 -5.100 -24.314 200 HD22 ASN 15 HD21 ASN 15 12.467 -3.918 -23.153 201 H ASP 16 H ASP 16 8.229 -2.775 -25.622 202 HA ASP 16 HA ASP 16 8.192 -1.746 -28.251 203 HB2 ASP 16 HB2 ASP 16 8.568 0.115 -25.954 204 HB3 ASP 16 HB3 ASP 16 7.901 0.509 -27.518 205 H HIS 17 H HIS 17 9.565 -0.586 -29.622 206 HA HIS 17 HA HIS 17 12.402 -0.242 -29.261 207 HB2 HIS 17 HB2 HIS 17 10.244 1.187 -30.908 208 HB3 HIS 17 HB3 HIS 17 12.044 1.195 -31.160 209 HD2 HIS 17 HD2 HIS 17 13.255 -0.903 -31.945 210 HE1 HIS 17 HE1 HIS 17 9.867 -2.893 -33.471 211 HE2 HIS 17 HE2 HIS 17 12.381 -2.840 -33.419 212 H ILE 18 H ILE 18 13.457 1.748 -29.102 213 HA ILE 18 HA ILE 18 12.144 4.023 -27.738 214 HB ILE 18 HB ILE 18 13.960 3.070 -26.526 215 HG12 ILE 18 HG12 ILE 18 15.042 5.736 -27.393 216 HG13 ILE 18 HG13 ILE 18 13.423 5.602 -26.667 217 HG21 ILE 18 HG21 ILE 18 15.513 2.185 -28.313 218 HG22 ILE 18 HG22 ILE 18 15.744 3.849 -28.903 219 HG23 ILE 18 HG23 ILE 18 16.366 3.231 -27.307 220 HD11 ILE 18 HD11 ILE 18 15.095 6.096 -24.962 221 HD12 ILE 18 HD12 ILE 18 14.396 4.453 -24.663 222 HD13 ILE 18 HD13 ILE 18 15.996 4.665 -25.512 223 H ASN 19 H ASN 19 12.515 6.229 -28.495 224 HA ASN 19 HA ASN 19 13.063 6.476 -31.402 225 HB2 ASN 19 HB2 ASN 19 10.808 7.850 -29.686 226 HB3 ASN 19 HB3 ASN 19 11.001 8.056 -31.451 227 HD21 ASN 19 HD22 ASN 19 9.729 5.897 -28.940 228 HD22 ASN 19 HD21 ASN 19 9.465 4.511 -30.047 229 H LEU 20 H LEU 20 14.898 7.810 -31.612 230 HA LEU 20 HA LEU 20 15.168 10.135 -29.803 231 HB2 LEU 20 HB2 LEU 20 17.260 8.198 -30.878 232 HB3 LEU 20 HB3 LEU 20 17.634 9.560 -29.805 233 HG LEU 20 HG LEU 20 15.833 7.095 -29.133 234 HD11 LEU 20 HD11 LEU 20 18.585 7.856 -28.209 235 HD12 LEU 20 HD12 LEU 20 17.794 6.359 -27.696 236 HD13 LEU 20 HD13 LEU 20 18.319 6.615 -29.429 237 HD21 LEU 20 HD21 LEU 20 16.391 9.600 -27.697 238 HD22 LEU 20 HD22 LEU 20 15.091 8.445 -27.761 239 HD23 LEU 20 HD23 LEU 20 16.611 8.137 -26.745 240 H LYS 21 H LYS 21 15.904 11.941 -30.724 241 HA LYS 21 HA LYS 21 16.265 12.206 -33.633 242 HB2 LYS 21 HB2 LYS 21 15.417 14.010 -31.337 243 HB3 LYS 21 HB3 LYS 21 15.708 14.768 -32.882 244 HG2 LYS 21 HG2 LYS 21 14.307 13.407 -34.174 245 HG3 LYS 21 HG3 LYS 21 13.862 12.458 -32.733 246 HD2 LYS 21 HD2 LYS 21 12.958 14.495 -31.595 247 HD3 LYS 21 HD3 LYS 21 13.208 15.438 -33.026 248 HE2 LYS 21 HE2 LYS 21 10.879 15.112 -33.193 249 HE3 LYS 21 HE3 LYS 21 11.575 14.033 -34.340 250 HZ1 LYS 21 HZ1 LYS 21 11.295 12.234 -32.546 251 HZ2 LYS 21 HZ2 LYS 21 10.622 13.343 -31.614 252 HZ3 LYS 21 HZ3 LYS 21 9.887 12.961 -32.977 253 H VAL 22 H VAL 22 17.895 13.518 -34.408 254 HA VAL 22 HA VAL 22 20.003 14.500 -32.553 255 HB VAL 22 HB VAL 22 20.663 13.294 -35.323 256 HG11 VAL 22 HG11 VAL 22 22.145 15.097 -34.745 257 HG12 VAL 22 HG12 VAL 22 22.213 14.486 -33.136 258 HG13 VAL 22 HG13 VAL 22 23.010 13.510 -34.446 259 HG21 VAL 22 HG21 VAL 22 22.054 11.539 -33.654 260 HG22 VAL 22 HG22 VAL 22 20.865 12.042 -32.490 261 HG23 VAL 22 HG23 VAL 22 20.259 11.328 -33.829 262 H ALA 23 H ALA 23 20.701 16.586 -32.961 263 HA ALA 23 HA ALA 23 19.226 17.905 -35.137 264 HB1 ALA 23 HB1 ALA 23 17.894 19.272 -33.618 265 HB2 ALA 23 HB2 ALA 23 17.419 17.706 -33.636 266 HB3 ALA 23 HB3 ALA 23 18.309 18.192 -32.252 267 H GLY 24 H GLY 24 19.956 19.599 -35.927 268 HA2 GLY 24 HA2 GLY 24 22.639 20.479 -34.775 269 HA3 GLY 24 HA3 GLY 24 22.258 20.306 -36.431 270 H GLN 25 H GLN 25 23.458 22.579 -35.436 271 HA GLN 25 HA GLN 25 21.868 24.627 -34.512 272 HB2 GLN 25 HB2 GLN 25 24.462 25.183 -35.951 273 HB3 GLN 25 HB3 GLN 25 23.582 26.120 -34.822 274 HG2 GLN 25 HG2 GLN 25 24.977 23.481 -34.179 275 HG3 GLN 25 HG3 GLN 25 25.335 25.136 -33.686 276 HE21 GLN 25 HE22 GLN 25 24.410 22.489 -32.000 277 HE22 GLN 25 HE21 GLN 25 23.258 23.254 -30.951 278 H ASP 26 H ASP 26 22.345 23.688 -37.741 279 HA ASP 26 HA ASP 26 21.363 26.053 -39.200 280 HB2 ASP 26 HB2 ASP 26 21.221 24.385 -41.081 281 HB3 ASP 26 HB3 ASP 26 22.741 24.354 -40.341 282 H GLY 27 H GLY 27 19.664 23.802 -37.266 283 HA2 GLY 27 HA2 GLY 27 17.478 24.115 -36.582 284 HA3 GLY 27 HA3 GLY 27 17.010 24.798 -38.126 285 H SER 28 H SER 28 18.936 21.801 -38.247 286 HA SER 28 HA SER 28 16.446 20.564 -39.353 287 HB2 SER 28 HB2 SER 28 18.003 19.012 -40.522 288 HB3 SER 28 HB3 SER 28 18.339 20.745 -40.873 289 HG SER 28 HG SER 28 19.964 20.668 -39.469 290 H VAL 29 H VAL 29 16.097 18.340 -39.119 291 HA VAL 29 HA VAL 29 17.069 16.901 -36.716 292 HB VAL 29 HB VAL 29 14.157 16.705 -37.023 293 HG11 VAL 29 HG11 VAL 29 16.071 16.458 -34.762 294 HG12 VAL 29 HG12 VAL 29 14.283 16.155 -34.727 295 HG13 VAL 29 HG13 VAL 29 15.272 15.162 -35.735 296 HG21 VAL 29 HG21 VAL 29 13.826 18.453 -35.351 297 HG22 VAL 29 HG22 VAL 29 15.538 18.789 -35.231 298 HG23 VAL 29 HG23 VAL 29 14.604 19.275 -36.725 299 H VAL 30 H VAL 30 17.417 14.931 -37.112 300 HA VAL 30 HA VAL 30 15.489 13.269 -38.809 301 HB VAL 30 HB VAL 30 16.896 11.549 -39.469 302 HG11 VAL 30 HG11 VAL 30 17.191 13.395 -40.998 303 HG12 VAL 30 HG12 VAL 30 18.811 13.710 -40.193 304 HG13 VAL 30 HG13 VAL 30 18.408 12.247 -40.970 305 HG21 VAL 30 HG21 VAL 30 19.036 12.700 -37.703 306 HG22 VAL 30 HG22 VAL 30 18.274 11.141 -37.498 307 HG23 VAL 30 HG23 VAL 30 19.312 11.349 -38.882 308 H GLN 31 H GLN 31 15.172 10.966 -38.061 309 HA GLN 31 HA GLN 31 15.405 10.825 -35.177 310 HB2 GLN 31 HB2 GLN 31 13.251 11.752 -35.592 311 HB3 GLN 31 HB3 GLN 31 12.836 10.386 -36.721 312 HG2 GLN 31 HG2 GLN 31 12.858 8.791 -35.094 313 HG3 GLN 31 HG3 GLN 31 13.449 9.849 -33.800 314 HE21 GLN 31 HE22 GLN 31 11.181 8.388 -33.481 315 HE22 GLN 31 HE21 GLN 31 9.792 9.411 -33.396 316 H PHE 32 H PHE 32 15.685 8.823 -34.364 317 HA PHE 32 HA PHE 32 15.946 6.418 -36.230 318 HB2 PHE 32 HB2 PHE 32 17.565 6.907 -33.649 319 HB3 PHE 32 HB3 PHE 32 17.685 5.577 -34.701 320 HD1 PHE 32 HD1 PHE 32 17.959 9.287 -34.610 321 HD2 PHE 32 HD2 PHE 32 19.470 5.681 -36.393 322 HE1 PHE 32 HE1 PHE 32 19.697 10.654 -35.879 323 HE2 PHE 32 HE2 PHE 32 21.107 7.022 -37.593 324 HZ PHE 32 HZ PHE 32 21.150 9.526 -37.400 325 H LYS 33 H LYS 33 15.170 4.493 -35.591 326 HA LYS 33 HA LYS 33 13.515 4.302 -33.019 327 HB2 LYS 33 HB2 LYS 33 12.064 4.398 -35.150 328 HB3 LYS 33 HB3 LYS 33 13.024 3.002 -35.697 329 HG2 LYS 33 HG2 LYS 33 12.363 1.686 -33.819 330 HG3 LYS 33 HG3 LYS 33 11.260 3.046 -33.333 331 HD2 LYS 33 HD2 LYS 33 9.789 2.763 -35.051 332 HD3 LYS 33 HD3 LYS 33 10.846 1.638 -36.001 333 HE2 LYS 33 HE2 LYS 33 10.972 0.091 -34.068 334 HE3 LYS 33 HE3 LYS 33 9.640 0.969 -33.346 335 HZ1 LYS 33 HZ1 LYS 33 9.149 -1.010 -34.935 336 HZ2 LYS 33 HZ2 LYS 33 8.242 0.276 -35.314 337 HZ3 LYS 33 HZ3 LYS 33 9.677 0.025 -36.153 338 H ILE 34 H ILE 34 14.745 2.992 -31.766 339 HA ILE 34 HA ILE 34 16.254 0.688 -32.800 340 HB ILE 34 HB ILE 34 18.176 1.266 -31.816 341 HG12 ILE 34 HG12 ILE 34 17.073 3.925 -30.866 342 HG13 ILE 34 HG13 ILE 34 17.489 2.547 -29.847 343 HG21 ILE 34 HG21 ILE 34 17.585 2.229 -34.098 344 HG22 ILE 34 HG22 ILE 34 17.570 3.868 -33.298 345 HG23 ILE 34 HG23 ILE 34 19.047 2.892 -33.418 346 HD11 ILE 34 HD11 ILE 34 19.944 3.024 -30.763 347 HD12 ILE 34 HD12 ILE 34 19.270 4.528 -31.489 348 HD13 ILE 34 HD13 ILE 34 19.172 4.351 -29.783 349 H LYS 35 H LYS 35 17.336 -0.026 -30.735 350 HA LYS 35 HA LYS 35 15.338 -0.960 -28.686 351 HB2 LYS 35 HB2 LYS 35 17.843 -2.178 -29.996 352 HB3 LYS 35 HB3 LYS 35 17.034 -2.785 -28.516 353 HG2 LYS 35 HG2 LYS 35 14.962 -3.091 -29.866 354 HG3 LYS 35 HG3 LYS 35 15.777 -2.582 -31.293 355 HD2 LYS 35 HD2 LYS 35 17.300 -4.479 -31.192 356 HD3 LYS 35 HD3 LYS 35 16.304 -5.113 -29.821 357 HE2 LYS 35 HE2 LYS 35 14.339 -4.994 -31.437 358 HE3 LYS 35 HE3 LYS 35 15.478 -4.583 -32.688 359 HZ1 LYS 35 HZ1 LYS 35 16.115 -6.757 -32.725 360 HZ2 LYS 35 HZ2 LYS 35 16.464 -6.822 -31.197 361 HZ3 LYS 35 HZ3 LYS 35 14.928 -7.205 -31.835 362 H ARG 36 H ARG 36 16.278 -1.466 -26.477 363 HA ARG 36 HA ARG 36 17.403 0.878 -25.577 364 HB2 ARG 36 HB2 ARG 36 17.054 -1.829 -24.117 365 HB3 ARG 36 HB3 ARG 36 17.689 -0.426 -23.354 366 HG2 ARG 36 HG2 ARG 36 15.611 0.765 -23.915 367 HG3 ARG 36 HG3 ARG 36 14.889 -0.581 -24.704 368 HD2 ARG 36 HD2 ARG 36 14.034 -0.293 -22.515 369 HD3 ARG 36 HD3 ARG 36 14.773 -1.825 -22.609 370 HE ARG 36 HE ARG 36 16.271 -1.285 -20.948 371 HH11 ARG 36 HH11 ARG 36 15.143 1.848 -22.240 372 HH12 ARG 36 HH12 ARG 36 16.137 2.721 -21.186 373 HH21 ARG 36 HH21 ARG 36 17.381 0.145 -19.401 374 HH22 ARG 36 HH22 ARG 36 16.884 1.786 -19.392 375 H HIS 37 H HIS 37 19.128 -1.830 -26.271 376 HA HIS 37 HA HIS 37 21.697 -0.935 -24.969 377 HB2 HIS 37 HB2 HIS 37 22.402 -3.345 -25.270 378 HB3 HIS 37 HB3 HIS 37 20.971 -3.129 -24.217 379 HD2 HIS 37 HD2 HIS 37 22.074 -5.623 -26.045 380 HE1 HIS 37 HE1 HIS 37 18.065 -5.592 -27.249 381 HE2 HIS 37 HE2 HIS 37 20.140 -6.838 -27.254 382 H THR 38 H THR 38 20.490 -0.468 -27.901 383 HA THR 38 HA THR 38 22.535 -1.139 -29.775 384 HB THR 38 HB THR 38 20.372 1.052 -29.706 385 HG1 THR 38 HG1 THR 38 20.016 -1.536 -29.930 386 HG21 THR 38 HG21 THR 38 21.967 0.017 -32.147 387 HG22 THR 38 HG22 THR 38 20.438 0.959 -32.051 388 HG23 THR 38 HG23 THR 38 21.926 1.676 -31.422 389 HA PRO 39 HA PRO 39 25.768 1.524 -28.451 390 HB2 PRO 39 HB2 PRO 39 27.588 0.870 -30.444 391 HB3 PRO 39 HB3 PRO 39 26.984 -0.180 -29.148 392 HG2 PRO 39 HG2 PRO 39 26.275 -0.335 -32.065 393 HG3 PRO 39 HG3 PRO 39 26.531 -1.637 -30.886 394 HD2 PRO 39 HD2 PRO 39 23.961 -0.873 -31.298 395 HD3 PRO 39 HD3 PRO 39 24.665 -1.669 -29.832 396 H LEU 40 H LEU 40 25.389 3.592 -28.550 397 HA LEU 40 HA LEU 40 24.220 5.066 -30.596 398 HB2 LEU 40 HB2 LEU 40 26.107 5.999 -28.469 399 HB3 LEU 40 HB3 LEU 40 25.255 7.123 -29.561 400 HG LEU 40 HG LEU 40 23.865 4.966 -27.947 401 HD11 LEU 40 HD11 LEU 40 24.983 6.537 -26.324 402 HD12 LEU 40 HD12 LEU 40 24.509 7.940 -27.203 403 HD13 LEU 40 HD13 LEU 40 23.269 6.896 -26.421 404 HD21 LEU 40 HD21 LEU 40 22.578 6.200 -29.977 405 HD22 LEU 40 HD22 LEU 40 21.951 6.672 -28.342 406 HD23 LEU 40 HD23 LEU 40 23.104 7.654 -29.124 407 H SER 41 H SER 41 27.585 3.936 -30.686 408 HA SER 41 HA SER 41 28.483 6.102 -32.218 409 HB2 SER 41 HB2 SER 41 30.207 4.423 -33.038 410 HB3 SER 41 HB3 SER 41 30.184 4.606 -31.237 411 HG SER 41 HG SER 41 30.110 2.346 -32.023 412 H LYS 42 H LYS 42 26.753 3.252 -33.099 413 HA LYS 42 HA LYS 42 26.880 3.375 -35.884 414 HB2 LYS 42 HB2 LYS 42 24.816 2.466 -33.913 415 HB3 LYS 42 HB3 LYS 42 24.587 2.222 -35.689 416 HG2 LYS 42 HG2 LYS 42 26.800 1.019 -35.680 417 HG3 LYS 42 HG3 LYS 42 26.875 1.170 -33.937 418 HD2 LYS 42 HD2 LYS 42 25.079 -0.363 -33.621 419 HD3 LYS 42 HD3 LYS 42 24.550 -0.049 -35.337 420 HE2 LYS 42 HE2 LYS 42 26.503 -1.251 -36.142 421 HE3 LYS 42 HE3 LYS 42 27.189 -1.451 -34.499 422 HZ1 LYS 42 HZ1 LYS 42 25.393 -2.959 -34.030 423 HZ2 LYS 42 HZ2 LYS 42 24.569 -2.560 -35.324 424 HZ3 LYS 42 HZ3 LYS 42 26.044 -3.386 -35.440 425 H LEU 43 H LEU 43 24.867 5.181 -33.781 426 HA LEU 43 HA LEU 43 23.252 6.425 -35.779 427 HB2 LEU 43 HB2 LEU 43 23.513 7.019 -32.913 428 HB3 LEU 43 HB3 LEU 43 22.515 8.052 -33.983 429 HG LEU 43 HG LEU 43 21.404 5.715 -34.719 430 HD11 LEU 43 HD11 LEU 43 21.519 4.105 -32.601 431 HD12 LEU 43 HD12 LEU 43 22.772 3.924 -33.790 432 HD13 LEU 43 HD13 LEU 43 23.081 4.772 -32.264 433 HD21 LEU 43 HD21 LEU 43 20.923 6.641 -31.905 434 HD22 LEU 43 HD22 LEU 43 20.328 7.506 -33.285 435 HD23 LEU 43 HD23 LEU 43 19.862 5.825 -32.992 436 H MET 44 H MET 44 25.961 7.581 -33.713 437 HA MET 44 HA MET 44 26.058 10.205 -34.613 438 HB2 MET 44 HB2 MET 44 28.351 8.564 -33.398 439 HB3 MET 44 HB3 MET 44 28.347 10.205 -33.748 440 HG2 MET 44 HG2 MET 44 26.083 10.343 -32.372 441 HG3 MET 44 HG3 MET 44 26.281 8.674 -31.946 442 HE1 MET 44 HE1 MET 44 28.379 7.851 -29.908 443 HE2 MET 44 HE2 MET 44 29.309 8.275 -31.392 444 HE3 MET 44 HE3 MET 44 29.683 8.963 -29.832 445 H LYS 45 H LYS 45 28.208 7.564 -35.729 446 HA LYS 45 HA LYS 45 29.353 8.835 -37.891 447 HB2 LYS 45 HB2 LYS 45 28.444 5.971 -37.575 448 HB3 LYS 45 HB3 LYS 45 29.146 6.330 -39.018 449 HG2 LYS 45 HG2 LYS 45 31.339 7.167 -37.704 450 HG3 LYS 45 HG3 LYS 45 30.404 6.856 -36.238 451 HD2 LYS 45 HD2 LYS 45 31.838 4.933 -36.584 452 HD3 LYS 45 HD3 LYS 45 30.231 4.462 -37.127 453 HE2 LYS 45 HE2 LYS 45 30.739 4.674 -39.360 454 HE3 LYS 45 HE3 LYS 45 32.396 5.281 -39.017 455 HZ1 LYS 45 HZ1 LYS 45 31.562 2.545 -38.392 456 HZ2 LYS 45 HZ2 LYS 45 32.449 2.921 -39.595 457 HZ3 LYS 45 HZ3 LYS 45 33.004 3.141 -38.040 458 H ALA 46 H ALA 46 26.202 7.141 -37.966 459 HA ALA 46 HA ALA 46 25.641 7.642 -40.616 460 HB1 ALA 46 HB1 ALA 46 23.903 7.117 -38.256 461 HB2 ALA 46 HB2 ALA 46 23.193 7.520 -39.897 462 HB3 ALA 46 HB3 ALA 46 24.257 6.101 -39.632 463 H TYR 47 H TYR 47 25.335 9.885 -37.894 464 HA TYR 47 HA TYR 47 23.762 11.878 -39.417 465 HB2 TYR 47 HB2 TYR 47 23.400 11.140 -36.960 466 HB3 TYR 47 HB3 TYR 47 24.990 11.911 -36.711 467 HD1 TYR 47 HD1 TYR 47 21.646 12.228 -38.031 468 HD2 TYR 47 HD2 TYR 47 25.129 14.355 -36.742 469 HE1 TYR 47 HE1 TYR 47 20.370 14.424 -38.272 470 HE2 TYR 47 HE2 TYR 47 23.847 16.552 -37.004 471 HH TYR 47 HH TYR 47 22.072 17.577 -37.911 472 H CYS 48 H CYS 48 27.066 11.264 -38.350 473 HA CYS 48 HA CYS 48 28.147 13.908 -39.027 474 HB2 CYS 48 HB2 CYS 48 29.370 12.062 -37.777 475 HB3 CYS 48 HB3 CYS 48 29.608 11.171 -39.267 476 HG CYS 48 HG CYS 48 30.825 13.242 -40.598 477 H GLU 49 H GLU 49 27.675 11.015 -41.176 478 HA GLU 49 HA GLU 49 28.747 12.483 -43.488 479 HB2 GLU 49 HB2 GLU 49 26.979 10.025 -43.193 480 HB3 GLU 49 HB3 GLU 49 27.666 10.486 -44.769 481 HG2 GLU 49 HG2 GLU 49 29.245 9.458 -42.221 482 HG3 GLU 49 HG3 GLU 49 28.745 8.495 -43.436 483 H ARG 50 H ARG 50 25.734 12.441 -41.984 484 HA ARG 50 HA ARG 50 24.350 13.653 -44.203 485 HB2 ARG 50 HB2 ARG 50 23.649 13.038 -41.299 486 HB3 ARG 50 HB3 ARG 50 22.588 14.111 -42.135 487 HG2 ARG 50 HG2 ARG 50 22.106 12.526 -43.802 488 HG3 ARG 50 HG3 ARG 50 23.217 11.312 -43.205 489 HD2 ARG 50 HD2 ARG 50 21.743 11.234 -41.207 490 HD3 ARG 50 HD3 ARG 50 20.672 12.450 -41.948 491 HE ARG 50 HE ARG 50 21.111 9.632 -42.870 492 HH11 ARG 50 HH11 ARG 50 19.366 12.617 -43.526 493 HH12 ARG 50 HH12 ARG 50 18.013 11.699 -44.156 494 HH21 ARG 50 HH21 ARG 50 19.553 8.775 -44.325 495 HH22 ARG 50 HH22 ARG 50 18.273 9.792 -44.923 496 H GLN 51 H GLN 51 26.315 15.042 -41.883 497 HA GLN 51 HA GLN 51 25.683 17.916 -42.468 498 HB2 GLN 51 HB2 GLN 51 27.331 16.691 -40.274 499 HB3 GLN 51 HB3 GLN 51 27.672 18.215 -40.799 500 HG2 GLN 51 HG2 GLN 51 25.061 18.753 -40.600 501 HG3 GLN 51 HG3 GLN 51 24.917 17.245 -39.776 502 HE21 GLN 51 HE22 GLN 51 24.195 19.352 -38.345 503 HE22 GLN 51 HE21 GLN 51 25.399 19.884 -37.131 504 H GLY 52 H GLY 52 27.705 15.258 -43.490 505 HA2 GLY 52 HA2 GLY 52 29.347 14.999 -44.955 506 HA3 GLY 52 HA3 GLY 52 29.117 16.632 -45.629 507 H LEU 53 H LEU 53 29.658 16.492 -42.320 508 HA LEU 53 HA LEU 53 32.489 17.390 -42.479 509 HB2 LEU 53 HB2 LEU 53 30.637 17.644 -40.135 510 HB3 LEU 53 HB3 LEU 53 32.304 18.270 -40.158 511 HG LEU 53 HG LEU 53 30.174 19.219 -42.126 512 HD11 LEU 53 HD11 LEU 53 29.530 19.644 -39.674 513 HD12 LEU 53 HD12 LEU 53 31.106 20.393 -39.517 514 HD13 LEU 53 HD13 LEU 53 29.838 21.076 -40.662 515 HD21 LEU 53 HD21 LEU 53 31.959 21.292 -41.884 516 HD22 LEU 53 HD22 LEU 53 33.001 20.108 -41.179 517 HD23 LEU 53 HD23 LEU 53 32.363 19.785 -42.844 518 H SER 54 H SER 54 33.695 16.771 -40.463 519 HA SER 54 HA SER 54 33.808 13.870 -40.513 520 HB2 SER 54 HB2 SER 54 35.654 15.052 -41.365 521 HB3 SER 54 HB3 SER 54 35.772 16.204 -39.992 522 HG SER 54 HG SER 54 36.764 13.791 -40.230 523 H MET 55 H MET 55 33.716 12.695 -38.245 524 HA MET 55 HA MET 55 32.882 14.110 -35.953 525 HB2 MET 55 HB2 MET 55 34.137 11.411 -36.355 526 HB3 MET 55 HB3 MET 55 33.580 11.974 -34.724 527 HG2 MET 55 HG2 MET 55 31.233 12.357 -35.905 528 HG3 MET 55 HG3 MET 55 31.935 11.472 -37.191 529 HE1 MET 55 HE1 MET 55 32.128 10.419 -33.209 530 HE2 MET 55 HE2 MET 55 30.477 11.106 -33.364 531 HE3 MET 55 HE3 MET 55 30.819 9.356 -33.332 532 H ARG 56 H ARG 56 35.956 14.109 -37.368 533 HA ARG 56 HA ARG 56 37.606 14.567 -35.099 534 HB2 ARG 56 HB2 ARG 56 38.288 14.068 -37.435 535 HB3 ARG 56 HB3 ARG 56 37.981 15.826 -37.833 536 HG2 ARG 56 HG2 ARG 56 39.592 16.440 -35.987 537 HG3 ARG 56 HG3 ARG 56 40.129 14.778 -35.854 538 HD2 ARG 56 HD2 ARG 56 40.732 14.992 -38.402 539 HD3 ARG 56 HD3 ARG 56 40.376 16.730 -38.214 540 HE ARG 56 HE ARG 56 42.545 15.054 -37.030 541 HH11 ARG 56 HH11 ARG 56 41.330 18.137 -37.669 542 HH12 ARG 56 HH12 ARG 56 42.862 18.917 -37.493 543 HH21 ARG 56 HH21 ARG 56 44.497 16.121 -36.228 544 HH22 ARG 56 HH22 ARG 56 44.517 17.820 -36.598 545 H GLN 57 H GLN 57 35.462 16.772 -36.760 546 HA GLN 57 HA GLN 57 36.272 19.041 -35.128 547 HB2 GLN 57 HB2 GLN 57 36.803 19.540 -37.208 548 HB3 GLN 57 HB3 GLN 57 35.264 18.946 -37.923 549 HG2 GLN 57 HG2 GLN 57 34.060 20.880 -37.022 550 HG3 GLN 57 HG3 GLN 57 35.366 21.312 -35.974 551 HE21 GLN 57 HE22 GLN 57 34.029 23.116 -37.894 552 HE22 GLN 57 HE21 GLN 57 35.236 23.582 -39.057 553 H ILE 58 H ILE 58 33.477 17.220 -36.257 554 HA ILE 58 HA ILE 58 31.898 18.940 -34.374 555 HB ILE 58 HB ILE 58 29.784 17.662 -35.199 556 HG12 ILE 58 HG12 ILE 58 31.544 16.446 -37.280 557 HG13 ILE 58 HG13 ILE 58 31.337 15.605 -35.665 558 HG21 ILE 58 HG21 ILE 58 30.385 19.728 -36.327 559 HG22 ILE 58 HG22 ILE 58 31.407 18.922 -37.470 560 HG23 ILE 58 HG23 ILE 58 29.612 18.595 -37.269 561 HD11 ILE 58 HD11 ILE 58 28.793 15.805 -36.167 562 HD12 ILE 58 HD12 ILE 58 29.470 15.967 -37.800 563 HD13 ILE 58 HD13 ILE 58 29.862 14.584 -36.899 564 H ARG 59 H ARG 59 30.352 17.975 -32.902 565 HA ARG 59 HA ARG 59 31.431 15.801 -31.107 566 HB2 ARG 59 HB2 ARG 59 30.675 18.598 -30.295 567 HB3 ARG 59 HB3 ARG 59 30.904 17.250 -29.186 568 HG2 ARG 59 HG2 ARG 59 33.041 18.430 -31.121 569 HG3 ARG 59 HG3 ARG 59 32.824 18.846 -29.385 570 HD2 ARG 59 HD2 ARG 59 33.332 16.394 -28.838 571 HD3 ARG 59 HD3 ARG 59 33.432 16.134 -30.562 572 HE ARG 59 HE ARG 59 35.181 17.861 -28.858 573 HH11 ARG 59 HH11 ARG 59 34.731 16.465 -32.224 574 HH12 ARG 59 HH12 ARG 59 36.383 16.775 -32.538 575 HH21 ARG 59 HH21 ARG 59 37.243 18.211 -29.626 576 HH22 ARG 59 HH22 ARG 59 37.713 17.758 -31.274 577 H PHE 60 H PHE 60 29.735 14.800 -29.875 578 HA PHE 60 HA PHE 60 26.866 15.645 -30.326 579 HB2 PHE 60 HB2 PHE 60 28.216 13.025 -30.317 580 HB3 PHE 60 HB3 PHE 60 26.454 13.176 -30.049 581 HD1 PHE 60 HD1 PHE 60 29.314 13.946 -32.274 582 HD2 PHE 60 HD2 PHE 60 25.147 13.028 -32.184 583 HE1 PHE 60 HE1 PHE 60 29.217 13.625 -34.807 584 HE2 PHE 60 HE2 PHE 60 25.002 13.039 -34.532 585 HZ PHE 60 HZ PHE 60 26.977 13.331 -35.917 586 H ARG 61 H ARG 61 25.661 15.678 -28.560 587 HA ARG 61 HA ARG 61 26.437 14.671 -25.831 588 HB2 ARG 61 HB2 ARG 61 25.776 17.619 -26.220 589 HB3 ARG 61 HB3 ARG 61 26.459 16.799 -24.838 590 HG2 ARG 61 HG2 ARG 61 28.499 16.563 -25.649 591 HG3 ARG 61 HG3 ARG 61 28.125 17.084 -27.346 592 HD2 ARG 61 HD2 ARG 61 27.558 19.389 -26.523 593 HD3 ARG 61 HD3 ARG 61 27.919 18.941 -24.896 594 HE ARG 61 HE ARG 61 30.343 18.389 -26.007 595 HH11 ARG 61 HH11 ARG 61 28.100 21.074 -26.370 596 HH12 ARG 61 HH12 ARG 61 29.334 22.151 -27.160 597 HH21 ARG 61 HH21 ARG 61 31.730 19.680 -26.975 598 HH22 ARG 61 HH22 ARG 61 31.406 21.322 -27.522 599 H PHE 62 H PHE 62 24.923 14.495 -24.341 600 HA PHE 62 HA PHE 62 22.113 15.439 -24.871 601 HB2 PHE 62 HB2 PHE 62 21.840 13.279 -25.805 602 HB3 PHE 62 HB3 PHE 62 22.917 12.679 -24.647 603 HD1 PHE 62 HD2 PHE 62 19.591 14.472 -24.586 604 HD2 PHE 62 HD1 PHE 62 22.108 11.433 -23.030 605 HE1 PHE 62 HE2 PHE 62 17.725 13.721 -23.165 606 HE2 PHE 62 HE1 PHE 62 20.312 10.697 -21.476 607 HZ PHE 62 HZ PHE 62 18.125 11.976 -21.388 608 H ASP 63 H ASP 63 21.354 16.426 -23.170 609 HA ASP 63 HA ASP 63 21.317 17.599 -21.377 610 HB2 ASP 63 HB2 ASP 63 20.806 15.223 -20.445 611 HB3 ASP 63 HB3 ASP 63 22.435 15.197 -19.844 612 H GLY 64 H GLY 64 23.394 17.908 -23.115 613 HA2 GLY 64 HA2 GLY 64 25.442 18.873 -23.375 614 HA3 GLY 64 HA3 GLY 64 25.384 19.271 -21.613 615 H GLN 65 H GLN 65 25.284 15.982 -21.642 616 HA GLN 65 HA GLN 65 28.096 15.739 -20.835 617 HB2 GLN 65 HB2 GLN 65 26.027 13.492 -21.196 618 HB3 GLN 65 HB3 GLN 65 27.623 13.393 -20.444 619 HG2 GLN 65 HG2 GLN 65 25.166 15.000 -19.518 620 HG3 GLN 65 HG3 GLN 65 25.614 13.450 -18.916 621 HE21 GLN 65 HE22 GLN 65 25.159 15.071 -17.191 622 HE22 GLN 65 HE21 GLN 65 26.409 16.010 -16.475 623 HA PRO 66 HA PRO 66 29.370 14.507 -24.855 624 HB2 PRO 66 HB2 PRO 66 32.000 13.370 -24.262 625 HB3 PRO 66 HB3 PRO 66 31.663 15.084 -24.159 626 HG2 PRO 66 HG2 PRO 66 31.864 13.156 -22.076 627 HG3 PRO 66 HG3 PRO 66 32.168 14.907 -22.027 628 HD2 PRO 66 HD2 PRO 66 29.803 13.856 -20.930 629 HD3 PRO 66 HD3 PRO 66 30.248 15.498 -21.288 630 H ILE 67 H ILE 67 29.061 12.753 -26.120 631 HA ILE 67 HA ILE 67 28.283 10.425 -24.841 632 HB ILE 67 HB ILE 67 27.771 11.402 -27.679 633 HG12 ILE 67 HG12 ILE 67 26.185 11.349 -25.113 634 HG13 ILE 67 HG13 ILE 67 26.475 12.628 -26.259 635 HG21 ILE 67 HG21 ILE 67 28.017 9.060 -27.848 636 HG22 ILE 67 HG22 ILE 67 26.789 8.806 -26.533 637 HG23 ILE 67 HG23 ILE 67 26.390 9.644 -28.125 638 HD11 ILE 67 HD11 ILE 67 24.773 11.511 -27.903 639 HD12 ILE 67 HD12 ILE 67 24.679 10.212 -26.632 640 HD13 ILE 67 HD13 ILE 67 24.054 11.829 -26.301 641 H ASN 68 H ASN 68 29.203 8.490 -25.018 642 HA ASN 68 HA ASN 68 31.912 8.308 -26.033 643 HB2 ASN 68 HB2 ASN 68 30.323 6.316 -24.216 644 HB3 ASN 68 HB3 ASN 68 32.007 6.229 -24.585 645 HD21 ASN 68 HD22 ASN 68 29.690 7.512 -22.565 646 HD22 ASN 68 HD21 ASN 68 30.743 8.585 -21.612 647 H GLU 69 H GLU 69 32.453 6.213 -27.396 648 HA GLU 69 HA GLU 69 30.530 5.758 -29.300 649 HB2 GLU 69 HB2 GLU 69 33.076 4.186 -28.699 650 HB3 GLU 69 HB3 GLU 69 31.902 3.761 -29.907 651 HG2 GLU 69 HG2 GLU 69 32.113 6.303 -30.753 652 HG3 GLU 69 HG3 GLU 69 33.442 6.452 -29.667 653 H THR 70 H THR 70 31.339 3.992 -26.266 654 HA THR 70 HA THR 70 29.795 1.629 -26.544 655 HB THR 70 HB THR 70 30.911 1.270 -24.301 656 HG1 THR 70 HG1 THR 70 31.058 3.520 -23.738 657 HG21 THR 70 HG21 THR 70 32.116 0.953 -26.662 658 HG22 THR 70 HG22 THR 70 33.035 2.346 -26.096 659 HG23 THR 70 HG23 THR 70 32.953 0.898 -25.087 660 H ASP 71 H ASP 71 28.668 4.631 -25.906 661 HA ASP 71 HA ASP 71 27.070 4.022 -23.566 662 HB2 ASP 71 HB2 ASP 71 27.071 6.379 -25.455 663 HB3 ASP 71 HB3 ASP 71 25.846 6.313 -24.262 664 H THR 72 H THR 72 24.844 3.606 -23.629 665 HA THR 72 HA THR 72 23.324 3.275 -26.177 666 HB THR 72 HB THR 72 22.237 1.282 -25.270 667 HG1 THR 72 HG1 THR 72 23.140 0.613 -23.115 668 HG21 THR 72 HG21 THR 72 24.030 0.671 -26.524 669 HG22 THR 72 HG22 THR 72 25.235 0.871 -25.106 670 HG23 THR 72 HG23 THR 72 23.926 -0.255 -24.988 671 HA PRO 73 HA PRO 73 20.067 5.596 -24.530 672 HB2 PRO 73 HB2 PRO 73 18.156 3.496 -24.749 673 HB3 PRO 73 HB3 PRO 73 18.094 5.090 -25.570 674 HG2 PRO 73 HG2 PRO 73 18.663 2.527 -26.689 675 HG3 PRO 73 HG3 PRO 73 18.854 4.132 -27.516 676 HD2 PRO 73 HD2 PRO 73 20.964 2.322 -26.576 677 HD3 PRO 73 HD3 PRO 73 21.289 3.928 -27.206 678 H ALA 74 H ALA 74 20.209 2.093 -23.341 679 HA ALA 74 HA ALA 74 19.136 2.565 -20.785 680 HB1 ALA 74 HB1 ALA 74 20.551 0.448 -20.308 681 HB2 ALA 74 HB2 ALA 74 19.789 0.279 -21.884 682 HB3 ALA 74 HB3 ALA 74 21.425 0.706 -21.804 683 H GLN 75 H GLN 75 22.553 2.572 -21.639 684 HA GLN 75 HA GLN 75 23.415 3.390 -19.080 685 HB2 GLN 75 HB2 GLN 75 24.910 2.366 -20.840 686 HB3 GLN 75 HB3 GLN 75 24.627 3.755 -21.863 687 HG2 GLN 75 HG2 GLN 75 26.826 3.937 -21.180 688 HG3 GLN 75 HG3 GLN 75 25.938 5.230 -20.439 689 HE21 GLN 75 HE22 GLN 75 27.968 5.168 -18.904 690 HE22 GLN 75 HE21 GLN 75 28.015 3.964 -17.618 691 H LEU 76 H LEU 76 22.018 5.305 -21.614 692 HA LEU 76 HA LEU 76 22.979 7.787 -20.292 693 HB2 LEU 76 HB2 LEU 76 21.351 7.349 -22.828 694 HB3 LEU 76 HB3 LEU 76 21.846 8.911 -22.187 695 HG LEU 76 HG LEU 76 23.679 6.761 -23.377 696 HD11 LEU 76 HD11 LEU 76 24.415 8.771 -24.864 697 HD12 LEU 76 HD12 LEU 76 22.806 8.537 -25.067 698 HD13 LEU 76 HD13 LEU 76 23.240 9.813 -24.016 699 HD21 LEU 76 HD21 LEU 76 25.100 7.417 -21.712 700 HD22 LEU 76 HD22 LEU 76 25.569 8.418 -22.955 701 HD23 LEU 76 HD23 LEU 76 24.450 9.070 -21.690 702 H GLU 77 H GLU 77 20.372 5.733 -19.959 703 HA GLU 77 HA GLU 77 18.207 5.900 -19.190 704 HB2 GLU 77 HB2 GLU 77 19.179 8.268 -17.762 705 HB3 GLU 77 HB3 GLU 77 17.707 7.383 -17.376 706 HG2 GLU 77 HG2 GLU 77 20.352 6.054 -16.900 707 HG3 GLU 77 HG3 GLU 77 19.176 6.609 -15.705 708 H MET 78 H MET 78 18.808 7.064 -21.824 709 HA MET 78 HA MET 78 17.138 9.296 -22.124 710 HB2 MET 78 HB2 MET 78 18.067 7.134 -24.148 711 HB3 MET 78 HB3 MET 78 17.194 8.497 -24.629 712 HG2 MET 78 HG2 MET 78 18.862 10.025 -23.804 713 HG3 MET 78 HG3 MET 78 19.718 8.680 -23.117 714 HE1 MET 78 HE1 MET 78 19.731 10.113 -27.430 715 HE2 MET 78 HE2 MET 78 18.373 10.246 -26.208 716 HE3 MET 78 HE3 MET 78 19.804 11.148 -25.875 717 H GLU 79 H GLU 79 15.208 9.252 -23.488 718 HA GLU 79 HA GLU 79 13.318 6.929 -23.453 719 HB2 GLU 79 HB2 GLU 79 12.798 9.686 -22.231 720 HB3 GLU 79 HB3 GLU 79 11.534 8.626 -22.666 721 HG2 GLU 79 HG2 GLU 79 13.484 7.358 -20.792 722 HG3 GLU 79 HG3 GLU 79 12.634 8.716 -20.219 723 H ASP 80 H ASP 80 11.187 7.648 -24.724 724 HA ASP 80 HA ASP 80 11.943 8.528 -27.240 725 HB2 ASP 80 HB2 ASP 80 9.126 8.844 -25.971 726 HB3 ASP 80 HB3 ASP 80 9.642 8.779 -27.616 727 H GLU 81 H GLU 81 11.858 10.614 -28.276 728 HA GLU 81 HA GLU 81 11.913 12.837 -28.569 729 HB2 GLU 81 HB2 GLU 81 10.044 13.228 -26.112 730 HB3 GLU 81 HB3 GLU 81 10.444 14.406 -27.148 731 HG2 GLU 81 HG2 GLU 81 8.849 11.886 -27.550 732 HG3 GLU 81 HG3 GLU 81 8.328 13.446 -27.600 733 H ASP 82 H ASP 82 13.665 11.393 -26.138 734 HA ASP 82 HA ASP 82 15.117 13.813 -25.233 735 HB2 ASP 82 HB2 ASP 82 15.835 10.887 -25.337 736 HB3 ASP 82 HB3 ASP 82 16.925 12.171 -24.777 737 H THR 83 H THR 83 16.746 14.896 -26.396 738 HA THR 83 HA THR 83 17.285 13.853 -29.121 739 HB THR 83 HB THR 83 16.433 16.501 -28.121 740 HG1 THR 83 HG1 THR 83 14.629 16.034 -29.525 741 HG21 THR 83 HG21 THR 83 16.259 16.883 -30.606 742 HG22 THR 83 HG22 THR 83 17.894 17.129 -29.816 743 HG23 THR 83 HG23 THR 83 17.429 15.694 -30.897 744 H ILE 84 H ILE 84 19.259 13.747 -29.755 745 HA ILE 84 HA ILE 84 21.381 14.619 -27.944 746 HB ILE 84 HB ILE 84 21.374 13.082 -30.649 747 HG12 ILE 84 HG12 ILE 84 22.063 12.008 -27.883 748 HG13 ILE 84 HG13 ILE 84 20.464 11.795 -28.864 749 HG21 ILE 84 HG21 ILE 84 23.647 13.602 -28.751 750 HG22 ILE 84 HG22 ILE 84 23.754 12.568 -30.230 751 HG23 ILE 84 HG23 ILE 84 23.392 14.242 -30.440 752 HD11 ILE 84 HD11 ILE 84 23.079 10.642 -29.422 753 HD12 ILE 84 HD12 ILE 84 21.655 9.689 -29.185 754 HD13 ILE 84 HD13 ILE 84 21.655 10.620 -30.628 755 H ASP 85 H ASP 85 22.859 16.252 -28.344 756 HA ASP 85 HA ASP 85 21.970 18.091 -30.615 757 HB2 ASP 85 HB2 ASP 85 23.515 18.841 -28.105 758 HB3 ASP 85 HB3 ASP 85 23.068 19.861 -29.400 759 H VAL 86 H VAL 86 23.517 19.091 -31.884 760 HA VAL 86 HA VAL 86 26.137 17.721 -31.828 761 HB VAL 86 HB VAL 86 24.604 18.683 -34.331 762 HG11 VAL 86 HG11 VAL 86 26.970 19.271 -34.803 763 HG12 VAL 86 HG12 VAL 86 27.501 17.686 -34.298 764 HG13 VAL 86 HG13 VAL 86 26.699 17.802 -35.697 765 HG21 VAL 86 HG21 VAL 86 25.008 16.394 -34.993 766 HG22 VAL 86 HG22 VAL 86 25.833 15.974 -33.521 767 HG23 VAL 86 HG23 VAL 86 24.109 16.504 -33.379 768 H PHE 87 H PHE 87 27.979 19.125 -31.776 769 HA PHE 87 HA PHE 87 27.606 21.930 -32.643 770 HB2 PHE 87 HB2 PHE 87 29.216 21.164 -30.210 771 HB3 PHE 87 HB3 PHE 87 28.859 22.731 -30.801 772 HD1 PHE 87 HD1 PHE 87 27.538 19.684 -28.946 773 HD2 PHE 87 HD2 PHE 87 26.513 23.670 -30.286 774 HE1 PHE 87 HE1 PHE 87 25.553 19.741 -27.448 775 HE2 PHE 87 HE2 PHE 87 24.795 23.784 -28.528 776 HZ PHE 87 HZ PHE 87 24.429 21.849 -27.048 777 H GLN 88 H GLN 88 30.057 22.872 -32.437 778 HA GLN 88 HA GLN 88 32.041 20.889 -33.554 779 HB2 GLN 88 HB2 GLN 88 31.673 23.834 -34.164 780 HB3 GLN 88 HB3 GLN 88 33.037 22.735 -34.369 781 HG2 GLN 88 HG2 GLN 88 31.656 21.376 -35.928 782 HG3 GLN 88 HG3 GLN 88 30.199 22.346 -35.482 783 HE21 GLN 88 HE22 GLN 88 30.026 22.102 -38.018 784 HE22 GLN 88 HE21 GLN 88 31.028 23.164 -38.929 785 H GLN 89 H GLN 89 34.134 21.124 -32.934 786 HA GLN 89 HA GLN 89 34.994 23.148 -31.002 787 HB2 GLN 89 HB2 GLN 89 35.538 20.162 -30.518 788 HB3 GLN 89 HB3 GLN 89 36.689 21.527 -30.040 789 HG2 GLN 89 HG2 GLN 89 34.770 22.548 -28.884 790 HG3 GLN 89 HG3 GLN 89 33.727 21.280 -29.466 791 HE21 GLN 89 HE22 GLN 89 34.788 22.269 -26.567 792 HE22 GLN 89 HE21 GLN 89 35.276 20.839 -25.829 793 H GLN 90 H GLN 90 36.877 23.885 -31.399 794 HA GLN 90 HA GLN 90 38.383 22.803 -33.701 795 HB2 GLN 90 HB2 GLN 90 37.910 25.770 -32.804 796 HB3 GLN 90 HB3 GLN 90 39.359 25.294 -33.727 797 HG2 GLN 90 HG2 GLN 90 37.973 26.056 -35.207 798 HG3 GLN 90 HG3 GLN 90 38.124 24.373 -35.593 799 HE21 GLN 90 HE22 GLN 90 36.007 24.727 -36.841 800 HE22 GLN 90 HE21 GLN 90 34.510 24.519 -35.840 801 H THR 91 H THR 91 40.672 23.343 -33.624 802 HA THR 91 HA THR 91 41.955 22.284 -31.312 803 HB THR 91 HB THR 91 44.139 22.811 -32.439 804 HG1 THR 91 HG1 THR 91 44.135 24.253 -33.729 805 HG21 THR 91 HG21 THR 91 42.244 21.583 -34.448 806 HG22 THR 91 HG22 THR 91 43.899 21.077 -33.946 807 HG23 THR 91 HG23 THR 91 42.597 20.914 -32.784 808 H GLY 92 H GLY 92 42.035 25.634 -32.669 809 HA2 GLY 92 HA2 GLY 92 42.105 27.176 -30.196 810 HA3 GLY 92 HA3 GLY 92 43.666 26.577 -30.440 811 H GLY 93 H GLY 93 43.923 29.073 -30.451 812 HA2 GLY 93 HA2 GLY 93 43.144 30.706 -32.790 813 HA3 GLY 93 HA3 GLY 93 44.428 31.220 -31.620 814 H VAL 94 H VAL 94 44.504 31.923 -34.225 815 HA VAL 94 HA VAL 94 45.719 29.894 -35.975 816 HB VAL 94 HB VAL 94 45.701 32.816 -36.650 817 HG11 VAL 94 HG11 VAL 94 45.512 30.327 -38.500 818 HG12 VAL 94 HG12 VAL 94 45.442 31.923 -39.079 819 HG13 VAL 94 HG13 VAL 94 46.958 31.357 -38.333 820 HG21 VAL 94 HG21 VAL 94 43.556 30.960 -37.408 821 HG22 VAL 94 HG22 VAL 94 43.480 31.981 -35.916 822 HG23 VAL 94 HG23 VAL 94 43.439 32.684 -37.602 823 H TYR 95 H TYR 95 47.908 29.395 -35.904 824 HA TYR 95 HA TYR 95 49.581 31.027 -34.167 825 HB2 TYR 95 HB2 TYR 95 50.167 28.511 -35.660 826 HB3 TYR 95 HB3 TYR 95 51.190 29.387 -34.434 827 HD1 TYR 95 HD1 TYR 95 48.620 30.057 -32.519 828 HD2 TYR 95 HD2 TYR 95 49.818 26.421 -34.557 829 HE1 TYR 95 HE1 TYR 95 47.399 28.810 -31.017 830 HE2 TYR 95 HE2 TYR 95 48.667 25.167 -33.027 831 HH TYR 95 HH TYR 95 47.233 25.105 -31.121 Start of MODEL 13 1 H1 ACE 36 HH32 ACE 36 10.726 15.924 -43.832 2 H2 ACE 36 HH33 ACE 36 9.249 15.526 -42.931 3 H3 ACE 36 HH31 ACE 36 10.776 15.153 -42.214 4 H GLU 37 H GLU 37 10.083 14.767 -45.754 5 HA GLU 37 HA GLU 37 9.092 12.170 -45.949 6 HB2 GLU 37 HB2 GLU 37 8.848 13.926 -47.550 7 HB3 GLU 37 HB3 GLU 37 10.512 13.639 -48.060 8 HG2 GLU 37 HG2 GLU 37 9.228 12.627 -49.698 9 HG3 GLU 37 HG3 GLU 37 9.879 11.274 -48.720 10 H ASP 38 H ASP 38 12.403 13.178 -45.578 11 HA ASP 38 HA ASP 38 13.365 10.405 -45.936 12 HB2 ASP 38 HB2 ASP 38 14.183 11.896 -47.710 13 HB3 ASP 38 HB3 ASP 38 14.622 13.127 -46.594 14 H ALA 39 H ALA 39 12.496 12.436 -43.490 15 HA ALA 39 HA ALA 39 14.975 12.556 -41.997 16 HB1 ALA 39 HB1 ALA 39 12.200 13.117 -40.913 17 HB2 ALA 39 HB2 ALA 39 13.637 13.729 -40.292 18 HB3 ALA 39 HB3 ALA 39 13.153 14.233 -41.984 19 H PHE 40 H PHE 40 14.543 9.732 -42.440 20 HA PHE 40 HA PHE 40 14.278 8.895 -39.727 21 HB2 PHE 40 HB2 PHE 40 12.125 8.794 -41.254 22 HB3 PHE 40 HB3 PHE 40 12.794 7.424 -41.986 23 HD1 PHE 40 HD1 PHE 40 11.358 8.948 -39.123 24 HD2 PHE 40 HD2 PHE 40 13.152 5.339 -40.524 25 HE1 PHE 40 HE1 PHE 40 10.118 7.587 -37.158 26 HE2 PHE 40 HE2 PHE 40 11.884 3.917 -38.681 27 HZ PHE 40 HZ PHE 40 10.218 5.060 -37.375 28 H ILE 41 H ILE 41 15.418 7.056 -39.234 29 HA ILE 41 HA ILE 41 17.010 5.462 -41.015 30 HB ILE 41 HB ILE 41 18.127 7.139 -38.653 31 HG12 ILE 41 HG12 ILE 41 19.804 7.930 -40.482 32 HG13 ILE 41 HG13 ILE 41 18.468 7.667 -41.587 33 HG21 ILE 41 HG21 ILE 41 19.414 5.102 -40.596 34 HG22 ILE 41 HG22 ILE 41 20.416 5.978 -39.504 35 HG23 ILE 41 HG23 ILE 41 19.212 4.923 -38.858 36 HD11 ILE 41 HD11 ILE 41 18.787 10.046 -40.814 37 HD12 ILE 41 HD12 ILE 41 17.157 9.505 -40.438 38 HD13 ILE 41 HD13 ILE 41 18.430 9.600 -39.147 39 H VAL 42 H VAL 42 17.347 3.585 -40.125 40 HA VAL 42 HA VAL 42 16.241 2.969 -37.402 41 HB VAL 42 HB VAL 42 16.024 1.012 -39.640 42 HG11 VAL 42 HG11 VAL 42 15.470 0.586 -37.010 43 HG12 VAL 42 HG12 VAL 42 13.955 1.363 -37.602 44 HG13 VAL 42 HG13 VAL 42 14.578 -0.150 -38.305 45 HG21 VAL 42 HG21 VAL 42 14.313 3.506 -39.303 46 HG22 VAL 42 HG22 VAL 42 14.838 2.724 -40.853 47 HG23 VAL 42 HG23 VAL 42 13.569 2.060 -39.834 48 H ILE 43 H ILE 43 17.764 1.681 -36.136 49 HA ILE 43 HA ILE 43 19.595 -0.163 -37.574 50 HB ILE 43 HB ILE 43 20.491 1.720 -35.262 51 HG12 ILE 43 HG12 ILE 43 21.481 1.578 -38.125 52 HG13 ILE 43 HG13 ILE 43 20.361 2.789 -37.518 53 HG21 ILE 43 HG21 ILE 43 22.620 0.882 -35.195 54 HG22 ILE 43 HG22 ILE 43 21.396 -0.374 -34.913 55 HG23 ILE 43 HG23 ILE 43 22.365 -0.337 -36.441 56 HD11 ILE 43 HD11 ILE 43 23.306 2.508 -37.004 57 HD12 ILE 43 HD12 ILE 43 22.349 3.958 -37.464 58 HD13 ILE 43 HD13 ILE 43 22.269 3.291 -35.813 59 H SEP 44 H SEP 44 19.814 -2.120 -36.719 60 HA SEP 44 HA SEP 44 19.324 -2.425 -33.895 61 HB2 SEP 44 HB2 SEP 44 18.347 -4.500 -33.755 62 HB3 SEP 44 HB3 SEP 44 17.306 -3.598 -34.925 63 H ASP 45 H ASP 45 20.655 -4.005 -32.770 64 HA ASP 45 HA ASP 45 23.293 -3.707 -34.140 65 HB2 ASP 45 HB2 ASP 45 22.495 -2.765 -31.868 66 HB3 ASP 45 HB3 ASP 45 22.680 -4.339 -31.218 67 H SEP 46 H SEP 46 21.130 -6.051 -34.255 68 HA SEP 46 HA SEP 46 23.017 -8.333 -33.956 69 HB2 SEP 46 HB2 SEP 46 21.117 -9.661 -33.229 70 HB3 SEP 46 HB3 SEP 46 21.659 -8.537 -32.021 71 H ASP 47 H ASP 47 23.479 -9.506 -35.479 72 HA ASP 47 HA ASP 47 21.397 -9.912 -37.609 73 HB2 ASP 47 HB2 ASP 47 23.248 -8.601 -38.475 74 HB3 ASP 47 HB3 ASP 47 24.404 -9.745 -37.690 75 H GLY 48 H GLY 48 21.387 -12.060 -38.417 76 HA2 GLY 48 HA2 GLY 48 21.997 -14.398 -38.642 77 HA3 GLY 48 HA3 GLY 48 23.196 -14.103 -37.362 78 H GLU 49 H GLU 49 22.579 -15.901 -36.269 79 HA GLU 49 HA GLU 49 19.983 -16.755 -35.355 80 HB2 GLU 49 HB2 GLU 49 22.043 -18.191 -35.370 81 HB3 GLU 49 HB3 GLU 49 22.742 -17.163 -34.163 82 HG2 GLU 49 HG2 GLU 49 22.110 -19.330 -33.370 83 HG3 GLU 49 HG3 GLU 49 21.260 -18.129 -32.420 84 HN1 NH2 50 HN1 NH2 50 18.638 -15.990 -33.943 85 HN2 NH2 50 HN2 NH2 50 19.045 -15.300 -32.454 86 H1 MET 1 H1 MET 1 -11.192 -29.916 -40.490 87 H2 MET 1 H2 MET 1 -10.313 -30.455 -39.138 88 H3 MET 1 H3 MET 1 -9.683 -30.342 -40.659 89 HA MET 1 HA MET 1 -10.123 -27.949 -40.644 90 HB2 MET 1 HB2 MET 1 -11.087 -28.546 -37.916 91 HB3 MET 1 HB3 MET 1 -10.700 -26.912 -38.524 92 HG2 MET 1 HG2 MET 1 -12.518 -27.157 -40.135 93 HG3 MET 1 HG3 MET 1 -12.731 -28.852 -39.820 94 HE1 MET 1 HE1 MET 1 -12.585 -25.548 -38.114 95 HE2 MET 1 HE2 MET 1 -13.934 -25.109 -39.145 96 HE3 MET 1 HE3 MET 1 -14.221 -25.199 -37.417 97 H ALA 2 H ALA 2 -8.389 -26.524 -39.953 98 HA ALA 2 HA ALA 2 -5.773 -27.741 -39.467 99 HB1 ALA 2 HB1 ALA 2 -6.282 -25.688 -40.797 100 HB2 ALA 2 HB2 ALA 2 -6.741 -24.849 -39.273 101 HB3 ALA 2 HB3 ALA 2 -5.070 -25.459 -39.453 102 H ASP 3 H ASP 3 -4.638 -27.783 -37.762 103 HA ASP 3 HA ASP 3 -5.769 -27.365 -35.013 104 HB2 ASP 3 HB2 ASP 3 -4.622 -29.453 -35.980 105 HB3 ASP 3 HB3 ASP 3 -3.155 -28.463 -36.045 106 H GLU 4 H GLU 4 -5.615 -24.954 -36.083 107 HA GLU 4 HA GLU 4 -2.885 -23.838 -36.027 108 HB2 GLU 4 HB2 GLU 4 -4.560 -23.020 -37.528 109 HB3 GLU 4 HB3 GLU 4 -5.656 -22.571 -36.325 110 HG2 GLU 4 HG2 GLU 4 -4.349 -20.790 -35.521 111 HG3 GLU 4 HG3 GLU 4 -2.889 -21.307 -36.413 112 H LYS 5 H LYS 5 -1.728 -23.052 -34.495 113 HA LYS 5 HA LYS 5 -2.927 -22.623 -31.876 114 HB2 LYS 5 HB2 LYS 5 -0.453 -23.309 -32.186 115 HB3 LYS 5 HB3 LYS 5 -0.137 -21.741 -32.902 116 HG2 LYS 5 HG2 LYS 5 -0.917 -20.651 -30.784 117 HG3 LYS 5 HG3 LYS 5 -1.200 -22.211 -30.117 118 HD2 LYS 5 HD2 LYS 5 1.119 -22.769 -30.190 119 HD3 LYS 5 HD3 LYS 5 1.597 -21.196 -31.059 120 HE2 LYS 5 HE2 LYS 5 0.094 -21.112 -28.430 121 HE3 LYS 5 HE3 LYS 5 1.859 -21.052 -28.533 122 HZ1 LYS 5 HZ1 LYS 5 0.072 -19.118 -29.875 123 HZ2 LYS 5 HZ2 LYS 5 0.968 -18.796 -28.559 124 HZ3 LYS 5 HZ3 LYS 5 1.696 -19.133 -29.986 125 HA PRO 6 HA PRO 6 -4.159 -18.399 -32.663 126 HB2 PRO 6 HB2 PRO 6 -4.145 -17.978 -29.698 127 HB3 PRO 6 HB3 PRO 6 -5.529 -17.725 -30.836 128 HG2 PRO 6 HG2 PRO 6 -5.057 -19.935 -29.099 129 HG3 PRO 6 HG3 PRO 6 -6.226 -19.955 -30.455 130 HD2 PRO 6 HD2 PRO 6 -3.443 -21.136 -30.025 131 HD3 PRO 6 HD3 PRO 6 -4.793 -21.678 -31.072 132 H LYS 7 H LYS 7 -2.870 -16.716 -32.976 133 HA LYS 7 HA LYS 7 -0.195 -16.370 -31.863 134 HB2 LYS 7 HB2 LYS 7 -0.583 -15.797 -34.274 135 HB3 LYS 7 HB3 LYS 7 -1.967 -14.733 -33.699 136 HG2 LYS 7 HG2 LYS 7 -0.387 -13.137 -32.748 137 HG3 LYS 7 HG3 LYS 7 0.919 -14.223 -33.057 138 HD2 LYS 7 HD2 LYS 7 0.719 -13.834 -35.469 139 HD3 LYS 7 HD3 LYS 7 -0.859 -12.960 -35.233 140 HE2 LYS 7 HE2 LYS 7 0.166 -11.358 -33.982 141 HE3 LYS 7 HE3 LYS 7 1.847 -11.921 -34.139 142 HZ1 LYS 7 HZ1 LYS 7 1.361 -11.576 -36.613 143 HZ2 LYS 7 HZ2 LYS 7 -0.048 -10.776 -36.135 144 HZ3 LYS 7 HZ3 LYS 7 1.390 -10.247 -35.758 145 H GLU 8 H GLU 8 0.468 -15.386 -30.457 146 HA GLU 8 HA GLU 8 -0.870 -13.096 -29.238 147 HB2 GLU 8 HB2 GLU 8 -0.305 -14.088 -26.914 148 HB3 GLU 8 HB3 GLU 8 -1.305 -15.089 -27.895 149 HG2 GLU 8 HG2 GLU 8 0.622 -16.469 -28.745 150 HG3 GLU 8 HG3 GLU 8 1.689 -15.545 -27.735 151 H GLY 9 H GLY 9 0.526 -11.715 -28.022 152 HA2 GLY 9 HA2 GLY 9 2.804 -10.763 -29.432 153 HA3 GLY 9 HA3 GLY 9 2.142 -10.137 -27.967 154 H VAL 10 H VAL 10 2.857 -13.327 -27.263 155 HA VAL 10 HA VAL 10 4.903 -12.288 -25.482 156 HB VAL 10 HB VAL 10 3.971 -15.139 -25.470 157 HG11 VAL 10 HG11 VAL 10 5.966 -14.402 -24.060 158 HG12 VAL 10 HG12 VAL 10 5.041 -13.105 -23.344 159 HG13 VAL 10 HG13 VAL 10 4.568 -14.805 -23.132 160 HG21 VAL 10 HG21 VAL 10 2.646 -12.791 -24.070 161 HG22 VAL 10 HG22 VAL 10 1.865 -13.927 -25.224 162 HG23 VAL 10 HG23 VAL 10 2.434 -14.531 -23.707 163 H LYS 11 H LYS 11 6.073 -11.854 -27.573 164 HA LYS 11 HA LYS 11 8.303 -13.713 -28.094 165 HB2 LYS 11 HB2 LYS 11 6.525 -12.910 -30.442 166 HB3 LYS 11 HB3 LYS 11 8.177 -13.333 -30.598 167 HG2 LYS 11 HG2 LYS 11 7.758 -15.532 -29.630 168 HG3 LYS 11 HG3 LYS 11 6.074 -15.225 -29.325 169 HD2 LYS 11 HD2 LYS 11 5.716 -14.908 -31.939 170 HD3 LYS 11 HD3 LYS 11 7.460 -15.137 -32.106 171 HE2 LYS 11 HE2 LYS 11 7.397 -17.373 -31.178 172 HE3 LYS 11 HE3 LYS 11 5.667 -17.169 -30.764 173 HZ1 LYS 11 HZ1 LYS 11 6.704 -17.638 -33.528 174 HZ2 LYS 11 HZ2 LYS 11 5.752 -18.454 -32.656 175 HZ3 LYS 11 HZ3 LYS 11 5.216 -16.991 -33.159 176 H THR 12 H THR 12 10.145 -12.695 -27.734 177 HA THR 12 HA THR 12 10.361 -10.165 -27.032 178 HB THR 12 HB THR 12 12.902 -10.333 -27.823 179 HG1 THR 12 HG1 THR 12 13.248 -11.637 -29.237 180 HG21 THR 12 HG21 THR 12 12.671 -10.712 -25.577 181 HG22 THR 12 HG22 THR 12 11.344 -11.906 -25.780 182 HG23 THR 12 HG23 THR 12 13.107 -12.348 -26.006 183 H GLU 13 H GLU 13 10.352 -10.859 -30.708 184 HA GLU 13 HA GLU 13 11.352 -8.284 -31.243 185 HB2 GLU 13 HB2 GLU 13 9.371 -10.057 -32.663 186 HB3 GLU 13 HB3 GLU 13 10.163 -8.601 -33.497 187 HG2 GLU 13 HG2 GLU 13 11.794 -10.891 -32.340 188 HG3 GLU 13 HG3 GLU 13 11.229 -10.775 -33.926 189 H ASN 14 H ASN 14 8.534 -8.784 -29.449 190 HA ASN 14 HA ASN 14 7.070 -6.440 -30.569 191 HB2 ASN 14 HB2 ASN 14 6.204 -8.789 -28.759 192 HB3 ASN 14 HB3 ASN 14 5.091 -7.461 -29.242 193 HD21 ASN 14 HD22 ASN 14 6.014 -10.715 -29.781 194 HD22 ASN 14 HD21 ASN 14 5.271 -10.834 -31.366 195 H ASN 15 H ASN 15 9.380 -6.685 -28.531 196 HA ASN 15 HA ASN 15 8.435 -4.895 -26.347 197 HB2 ASN 15 HB2 ASN 15 10.307 -6.626 -26.247 198 HB3 ASN 15 HB3 ASN 15 11.331 -5.602 -27.160 199 HD21 ASN 15 HD22 ASN 15 12.793 -4.603 -26.043 200 HD22 ASN 15 HD21 ASN 15 12.407 -3.884 -24.425 201 H ASP 16 H ASP 16 8.971 -2.616 -26.245 202 HA ASP 16 HA ASP 16 8.316 -1.559 -28.813 203 HB2 ASP 16 HB2 ASP 16 8.771 -0.107 -26.182 204 HB3 ASP 16 HB3 ASP 16 7.961 0.581 -27.478 205 H HIS 17 H HIS 17 9.618 -0.452 -30.136 206 HA HIS 17 HA HIS 17 12.513 -0.095 -29.634 207 HB2 HIS 17 HB2 HIS 17 10.864 1.107 -31.774 208 HB3 HIS 17 HB3 HIS 17 12.654 1.288 -31.560 209 HD2 HIS 17 HD2 HIS 17 14.038 -0.284 -33.043 210 HE1 HIS 17 HE1 HIS 17 11.132 -3.232 -33.706 211 HE2 HIS 17 HE2 HIS 17 13.642 -2.568 -34.063 212 H ILE 18 H ILE 18 13.571 1.869 -28.990 213 HA ILE 18 HA ILE 18 11.907 4.008 -28.012 214 HB ILE 18 HB ILE 18 13.227 3.262 -26.355 215 HG12 ILE 18 HG12 ILE 18 14.740 5.744 -27.062 216 HG13 ILE 18 HG13 ILE 18 13.028 5.840 -26.775 217 HG21 ILE 18 HG21 ILE 18 15.130 2.156 -27.520 218 HG22 ILE 18 HG22 ILE 18 15.592 3.705 -28.384 219 HG23 ILE 18 HG23 ILE 18 15.809 3.341 -26.583 220 HD11 ILE 18 HD11 ILE 18 15.369 5.291 -24.954 221 HD12 ILE 18 HD12 ILE 18 14.211 6.445 -24.718 222 HD13 ILE 18 HD13 ILE 18 13.708 4.747 -24.499 223 H ASN 19 H ASN 19 11.722 5.838 -28.913 224 HA ASN 19 HA ASN 19 13.063 6.258 -31.598 225 HB2 ASN 19 HB2 ASN 19 10.540 7.573 -30.516 226 HB3 ASN 19 HB3 ASN 19 11.120 7.847 -32.104 227 HD21 ASN 19 HD22 ASN 19 8.583 6.624 -30.962 228 HD22 ASN 19 HD21 ASN 19 8.661 4.930 -31.418 229 H LEU 20 H LEU 20 14.598 7.727 -31.908 230 HA LEU 20 HA LEU 20 14.889 9.954 -29.939 231 HB2 LEU 20 HB2 LEU 20 17.167 8.131 -30.813 232 HB3 LEU 20 HB3 LEU 20 17.262 9.606 -29.781 233 HG LEU 20 HG LEU 20 15.492 7.221 -29.030 234 HD11 LEU 20 HD11 LEU 20 18.297 7.663 -28.049 235 HD12 LEU 20 HD12 LEU 20 17.323 6.204 -27.832 236 HD13 LEU 20 HD13 LEU 20 17.808 6.465 -29.424 237 HD21 LEU 20 HD21 LEU 20 16.506 9.614 -27.507 238 HD22 LEU 20 HD22 LEU 20 14.848 9.139 -27.880 239 HD23 LEU 20 HD23 LEU 20 15.888 8.169 -26.736 240 H LYS 21 H LYS 21 15.910 11.609 -30.530 241 HA LYS 21 HA LYS 21 16.561 12.007 -33.459 242 HB2 LYS 21 HB2 LYS 21 15.628 14.187 -31.695 243 HB3 LYS 21 HB3 LYS 21 15.907 14.324 -33.408 244 HG2 LYS 21 HG2 LYS 21 14.038 12.794 -34.112 245 HG3 LYS 21 HG3 LYS 21 13.618 12.551 -32.409 246 HD2 LYS 21 HD2 LYS 21 13.512 15.215 -32.283 247 HD3 LYS 21 HD3 LYS 21 13.557 15.214 -34.036 248 HE2 LYS 21 HE2 LYS 21 11.262 15.480 -33.386 249 HE3 LYS 21 HE3 LYS 21 11.629 13.962 -34.260 250 HZ1 LYS 21 HZ1 LYS 21 11.454 12.781 -32.173 251 HZ2 LYS 21 HZ2 LYS 21 11.493 14.060 -31.328 252 HZ3 LYS 21 HZ3 LYS 21 10.086 13.768 -32.119 253 H VAL 22 H VAL 22 18.104 13.231 -34.175 254 HA VAL 22 HA VAL 22 20.132 14.271 -32.330 255 HB VAL 22 HB VAL 22 20.755 13.017 -35.066 256 HG11 VAL 22 HG11 VAL 22 21.814 15.231 -34.768 257 HG12 VAL 22 HG12 VAL 22 22.603 14.744 -33.257 258 HG13 VAL 22 HG13 VAL 22 22.979 13.892 -34.732 259 HG21 VAL 22 HG21 VAL 22 20.554 11.546 -33.032 260 HG22 VAL 22 HG22 VAL 22 22.085 11.598 -33.782 261 HG23 VAL 22 HG23 VAL 22 21.922 12.484 -32.288 262 H ALA 23 H ALA 23 20.481 16.404 -32.577 263 HA ALA 23 HA ALA 23 19.226 17.812 -34.844 264 HB1 ALA 23 HB1 ALA 23 18.678 19.644 -33.144 265 HB2 ALA 23 HB2 ALA 23 17.627 18.198 -32.957 266 HB3 ALA 23 HB3 ALA 23 19.019 18.607 -31.796 267 H GLY 24 H GLY 24 20.071 19.733 -35.239 268 HA2 GLY 24 HA2 GLY 24 22.957 20.331 -34.440 269 HA3 GLY 24 HA3 GLY 24 22.213 20.777 -35.950 270 H GLN 25 H GLN 25 23.410 22.776 -34.473 271 HA GLN 25 HA GLN 25 21.338 24.202 -33.042 272 HB2 GLN 25 HB2 GLN 25 23.982 25.488 -33.778 273 HB3 GLN 25 HB3 GLN 25 22.873 25.882 -32.462 274 HG2 GLN 25 HG2 GLN 25 24.870 23.489 -32.365 275 HG3 GLN 25 HG3 GLN 25 24.730 24.883 -31.456 276 HE21 GLN 25 HE22 GLN 25 23.880 21.686 -31.824 277 HE22 GLN 25 HE21 GLN 25 22.387 21.759 -30.765 278 H ASP 26 H ASP 26 22.539 24.305 -36.388 279 HA ASP 26 HA ASP 26 21.206 26.675 -37.220 280 HB2 ASP 26 HB2 ASP 26 21.746 25.994 -39.224 281 HB3 ASP 26 HB3 ASP 26 23.109 25.528 -38.215 282 H GLY 27 H GLY 27 19.956 23.552 -36.472 283 HA2 GLY 27 HA2 GLY 27 17.720 23.361 -35.610 284 HA3 GLY 27 HA3 GLY 27 17.111 24.339 -36.987 285 H SER 28 H SER 28 19.348 22.461 -38.433 286 HA SER 28 HA SER 28 17.759 20.520 -39.713 287 HB2 SER 28 HB2 SER 28 19.815 19.365 -40.219 288 HB3 SER 28 HB3 SER 28 19.878 21.118 -40.590 289 HG SER 28 HG SER 28 20.832 21.432 -38.676 290 H VAL 29 H VAL 29 17.122 18.334 -39.213 291 HA VAL 29 HA VAL 29 18.006 17.140 -36.702 292 HB VAL 29 HB VAL 29 14.995 17.870 -37.113 293 HG11 VAL 29 HG11 VAL 29 16.412 16.421 -34.910 294 HG12 VAL 29 HG12 VAL 29 14.808 16.826 -35.005 295 HG13 VAL 29 HG13 VAL 29 15.359 15.622 -36.193 296 HG21 VAL 29 HG21 VAL 29 16.892 18.848 -34.944 297 HG22 VAL 29 HG22 VAL 29 16.117 19.811 -36.261 298 HG23 VAL 29 HG23 VAL 29 15.038 18.941 -35.157 299 H VAL 30 H VAL 30 17.685 14.849 -36.624 300 HA VAL 30 HA VAL 30 16.175 13.694 -38.814 301 HB VAL 30 HB VAL 30 17.682 11.972 -39.174 302 HG11 VAL 30 HG11 VAL 30 17.871 13.792 -40.699 303 HG12 VAL 30 HG12 VAL 30 19.322 14.452 -39.895 304 HG13 VAL 30 HG13 VAL 30 19.306 12.842 -40.690 305 HG21 VAL 30 HG21 VAL 30 18.977 12.017 -37.044 306 HG22 VAL 30 HG22 VAL 30 20.094 11.836 -38.386 307 HG23 VAL 30 HG23 VAL 30 19.885 13.462 -37.693 308 H GLN 31 H GLN 31 15.103 11.976 -38.233 309 HA GLN 31 HA GLN 31 15.434 11.154 -35.430 310 HB2 GLN 31 HB2 GLN 31 13.186 12.083 -36.150 311 HB3 GLN 31 HB3 GLN 31 13.053 10.705 -37.173 312 HG2 GLN 31 HG2 GLN 31 13.068 9.151 -35.429 313 HG3 GLN 31 HG3 GLN 31 13.412 10.401 -34.149 314 HE21 GLN 31 HE22 GLN 31 10.693 8.551 -34.845 315 HE22 GLN 31 HE21 GLN 31 9.606 9.852 -34.445 316 H PHE 32 H PHE 32 15.347 9.317 -34.781 317 HA PHE 32 HA PHE 32 16.507 6.974 -36.289 318 HB2 PHE 32 HB2 PHE 32 17.612 8.089 -33.702 319 HB3 PHE 32 HB3 PHE 32 18.004 6.604 -34.336 320 HD1 PHE 32 HD2 PHE 32 19.173 6.379 -36.663 321 HD2 PHE 32 HD1 PHE 32 18.689 10.076 -34.418 322 HE1 PHE 32 HE2 PHE 32 21.048 7.430 -37.879 323 HE2 PHE 32 HE1 PHE 32 20.782 10.990 -35.485 324 HZ PHE 32 HZ PHE 32 21.848 9.630 -37.268 325 H LYS 33 H LYS 33 15.911 4.704 -35.559 326 HA LYS 33 HA LYS 33 14.056 4.467 -33.264 327 HB2 LYS 33 HB2 LYS 33 12.690 4.622 -35.255 328 HB3 LYS 33 HB3 LYS 33 13.745 3.350 -36.038 329 HG2 LYS 33 HG2 LYS 33 13.276 1.736 -34.542 330 HG3 LYS 33 HG3 LYS 33 12.290 2.710 -33.445 331 HD2 LYS 33 HD2 LYS 33 10.664 3.050 -35.112 332 HD3 LYS 33 HD3 LYS 33 11.674 2.207 -36.386 333 HE2 LYS 33 HE2 LYS 33 11.351 0.107 -35.078 334 HE3 LYS 33 HE3 LYS 33 10.332 0.954 -33.949 335 HZ1 LYS 33 HZ1 LYS 33 8.973 -0.141 -35.646 336 HZ2 LYS 33 HZ2 LYS 33 8.604 1.293 -35.590 337 HZ3 LYS 33 HZ3 LYS 33 9.663 0.850 -36.840 338 H ILE 34 H ILE 34 15.220 3.135 -31.858 339 HA ILE 34 HA ILE 34 16.978 1.087 -32.909 340 HB ILE 34 HB ILE 34 18.882 1.739 -31.394 341 HG12 ILE 34 HG12 ILE 34 17.557 4.330 -30.689 342 HG13 ILE 34 HG13 ILE 34 17.972 2.916 -29.738 343 HG21 ILE 34 HG21 ILE 34 18.691 2.283 -33.879 344 HG22 ILE 34 HG22 ILE 34 18.298 3.923 -33.295 345 HG23 ILE 34 HG23 ILE 34 19.855 3.167 -32.803 346 HD11 ILE 34 HD11 ILE 34 20.305 3.254 -29.923 347 HD12 ILE 34 HD12 ILE 34 20.071 4.670 -31.015 348 HD13 ILE 34 HD13 ILE 34 19.610 4.798 -29.451 349 H LYS 35 H LYS 35 17.896 -0.296 -30.994 350 HA LYS 35 HA LYS 35 15.639 -0.726 -29.046 351 HB2 LYS 35 HB2 LYS 35 17.997 -2.609 -29.781 352 HB3 LYS 35 HB3 LYS 35 16.703 -2.822 -28.618 353 HG2 LYS 35 HG2 LYS 35 15.104 -2.619 -30.524 354 HG3 LYS 35 HG3 LYS 35 16.477 -2.594 -31.685 355 HD2 LYS 35 HD2 LYS 35 17.317 -4.546 -30.898 356 HD3 LYS 35 HD3 LYS 35 15.865 -4.905 -29.873 357 HE2 LYS 35 HE2 LYS 35 14.417 -4.624 -31.885 358 HE3 LYS 35 HE3 LYS 35 15.856 -4.334 -32.835 359 HZ1 LYS 35 HZ1 LYS 35 14.989 -6.787 -31.687 360 HZ2 LYS 35 HZ2 LYS 35 15.653 -6.533 -33.253 361 HZ3 LYS 35 HZ3 LYS 35 16.566 -6.719 -31.885 362 H ARG 36 H ARG 36 16.209 -0.930 -26.766 363 HA ARG 36 HA ARG 36 17.614 1.396 -25.926 364 HB2 ARG 36 HB2 ARG 36 16.806 -1.061 -24.302 365 HB3 ARG 36 HB3 ARG 36 17.029 0.478 -23.568 366 HG2 ARG 36 HG2 ARG 36 15.422 1.551 -24.931 367 HG3 ARG 36 HG3 ARG 36 14.906 0.075 -25.725 368 HD2 ARG 36 HD2 ARG 36 13.421 0.472 -23.920 369 HD3 ARG 36 HD3 ARG 36 14.290 -0.991 -23.664 370 HE ARG 36 HE ARG 36 15.396 0.011 -21.785 371 HH11 ARG 36 HH11 ARG 36 13.378 2.694 -23.147 372 HH12 ARG 36 HH12 ARG 36 13.570 3.482 -21.620 373 HH21 ARG 36 HH21 ARG 36 15.769 1.646 -20.105 374 HH22 ARG 36 HH22 ARG 36 14.824 3.057 -20.095 375 H HIS 37 H HIS 37 18.924 -1.788 -26.340 376 HA HIS 37 HA HIS 37 21.393 -1.163 -24.898 377 HB2 HIS 37 HB2 HIS 37 22.023 -3.291 -25.446 378 HB3 HIS 37 HB3 HIS 37 20.414 -3.339 -24.693 379 HD2 HIS 37 HD2 HIS 37 22.099 -5.357 -26.848 380 HE1 HIS 37 HE1 HIS 37 18.231 -5.463 -28.500 381 HE2 HIS 37 HE2 HIS 37 20.413 -6.675 -28.309 382 H THR 38 H THR 38 20.288 -0.286 -28.030 383 HA THR 38 HA THR 38 22.676 -1.072 -29.519 384 HB THR 38 HB THR 38 20.935 1.167 -30.161 385 HG1 THR 38 HG1 THR 38 20.427 -1.589 -30.063 386 HG21 THR 38 HG21 THR 38 22.316 -0.796 -32.120 387 HG22 THR 38 HG22 THR 38 21.391 0.648 -32.592 388 HG23 THR 38 HG23 THR 38 22.824 0.823 -31.696 389 HA PRO 39 HA PRO 39 25.692 2.015 -28.074 390 HB2 PRO 39 HB2 PRO 39 27.756 1.145 -29.480 391 HB3 PRO 39 HB3 PRO 39 26.952 0.081 -28.198 392 HG2 PRO 39 HG2 PRO 39 26.612 -0.045 -31.168 393 HG3 PRO 39 HG3 PRO 39 26.997 -1.313 -29.851 394 HD2 PRO 39 HD2 PRO 39 24.432 -0.855 -30.864 395 HD3 PRO 39 HD3 PRO 39 24.721 -1.341 -29.330 396 H LEU 40 H LEU 40 25.749 3.926 -28.469 397 HA LEU 40 HA LEU 40 24.509 4.865 -30.803 398 HB2 LEU 40 HB2 LEU 40 25.928 6.460 -28.511 399 HB3 LEU 40 HB3 LEU 40 24.839 7.190 -29.576 400 HG LEU 40 HG LEU 40 23.920 4.885 -27.910 401 HD11 LEU 40 HD11 LEU 40 24.812 6.403 -26.409 402 HD12 LEU 40 HD12 LEU 40 24.036 7.876 -27.224 403 HD13 LEU 40 HD13 LEU 40 23.113 6.673 -26.317 404 HD21 LEU 40 HD21 LEU 40 22.297 5.489 -29.663 405 HD22 LEU 40 HD22 LEU 40 21.671 6.043 -28.154 406 HD23 LEU 40 HD23 LEU 40 22.300 7.218 -29.195 407 H SER 41 H SER 41 27.803 4.163 -30.684 408 HA SER 41 HA SER 41 29.063 6.141 -32.101 409 HB2 SER 41 HB2 SER 41 30.691 4.323 -32.702 410 HB3 SER 41 HB3 SER 41 30.154 3.982 -31.057 411 HG SER 41 HG SER 41 30.043 2.168 -32.264 412 H LYS 42 H LYS 42 26.924 3.303 -33.204 413 HA LYS 42 HA LYS 42 27.174 3.804 -36.045 414 HB2 LYS 42 HB2 LYS 42 25.207 2.323 -34.313 415 HB3 LYS 42 HB3 LYS 42 25.196 2.265 -36.074 416 HG2 LYS 42 HG2 LYS 42 27.501 1.389 -36.230 417 HG3 LYS 42 HG3 LYS 42 27.719 1.457 -34.532 418 HD2 LYS 42 HD2 LYS 42 25.647 -0.184 -34.373 419 HD3 LYS 42 HD3 LYS 42 25.856 -0.348 -36.090 420 HE2 LYS 42 HE2 LYS 42 28.182 -1.088 -35.700 421 HE3 LYS 42 HE3 LYS 42 27.858 -0.959 -33.951 422 HZ1 LYS 42 HZ1 LYS 42 26.242 -2.748 -34.158 423 HZ2 LYS 42 HZ2 LYS 42 26.423 -2.796 -35.845 424 HZ3 LYS 42 HZ3 LYS 42 27.603 -3.248 -34.949 425 H LEU 43 H LEU 43 25.040 5.349 -33.560 426 HA LEU 43 HA LEU 43 23.243 6.519 -35.446 427 HB2 LEU 43 HB2 LEU 43 23.375 6.282 -32.643 428 HB3 LEU 43 HB3 LEU 43 23.456 7.984 -32.852 429 HG LEU 43 HG LEU 43 21.281 7.739 -34.218 430 HD11 LEU 43 HD11 LEU 43 21.546 5.005 -32.930 431 HD12 LEU 43 HD12 LEU 43 20.101 5.550 -33.400 432 HD13 LEU 43 HD13 LEU 43 21.319 5.337 -34.701 433 HD21 LEU 43 HD21 LEU 43 21.413 7.058 -31.206 434 HD22 LEU 43 HD22 LEU 43 21.560 8.593 -31.999 435 HD23 LEU 43 HD23 LEU 43 20.029 7.764 -32.045 436 H MET 44 H MET 44 26.158 7.371 -33.781 437 HA MET 44 HA MET 44 26.493 10.127 -34.430 438 HB2 MET 44 HB2 MET 44 28.121 8.033 -33.177 439 HB3 MET 44 HB3 MET 44 28.859 9.548 -33.555 440 HG2 MET 44 HG2 MET 44 27.029 10.718 -32.451 441 HG3 MET 44 HG3 MET 44 26.386 9.175 -31.886 442 HE1 MET 44 HE1 MET 44 27.857 7.842 -29.811 443 HE2 MET 44 HE2 MET 44 29.315 7.723 -30.780 444 HE3 MET 44 HE3 MET 44 29.411 8.549 -29.219 445 H LYS 45 H LYS 45 27.877 7.074 -35.769 446 HA LYS 45 HA LYS 45 29.432 8.297 -37.888 447 HB2 LYS 45 HB2 LYS 45 28.629 5.377 -37.501 448 HB3 LYS 45 HB3 LYS 45 29.347 6.171 -38.943 449 HG2 LYS 45 HG2 LYS 45 31.397 6.642 -37.828 450 HG3 LYS 45 HG3 LYS 45 30.690 6.264 -36.278 451 HD2 LYS 45 HD2 LYS 45 31.927 4.411 -36.674 452 HD3 LYS 45 HD3 LYS 45 30.368 3.861 -37.341 453 HE2 LYS 45 HE2 LYS 45 31.136 4.602 -39.645 454 HE3 LYS 45 HE3 LYS 45 32.794 4.814 -39.067 455 HZ1 LYS 45 HZ1 LYS 45 31.237 2.293 -38.848 456 HZ2 LYS 45 HZ2 LYS 45 32.490 2.620 -39.894 457 HZ3 LYS 45 HZ3 LYS 45 32.774 2.529 -38.359 458 H ALA 46 H ALA 46 26.080 6.745 -37.890 459 HA ALA 46 HA ALA 46 25.507 7.219 -40.692 460 HB1 ALA 46 HB1 ALA 46 23.844 6.791 -38.065 461 HB2 ALA 46 HB2 ALA 46 23.199 6.907 -39.759 462 HB3 ALA 46 HB3 ALA 46 24.248 5.618 -39.305 463 H TYR 47 H TYR 47 25.033 9.326 -37.755 464 HA TYR 47 HA TYR 47 23.709 11.390 -39.134 465 HB2 TYR 47 HB2 TYR 47 23.792 11.360 -36.783 466 HB3 TYR 47 HB3 TYR 47 25.502 11.547 -36.855 467 HD1 TYR 47 HD1 TYR 47 22.144 13.043 -37.752 468 HD2 TYR 47 HD2 TYR 47 26.375 13.930 -37.296 469 HE1 TYR 47 HE1 TYR 47 21.659 15.508 -37.806 470 HE2 TYR 47 HE2 TYR 47 25.911 16.345 -37.151 471 HH TYR 47 HH TYR 47 22.719 17.681 -37.478 472 H CYS 48 H CYS 48 27.238 10.666 -38.751 473 HA CYS 48 HA CYS 48 28.087 13.191 -40.049 474 HB2 CYS 48 HB2 CYS 48 29.597 12.148 -38.439 475 HB3 CYS 48 HB3 CYS 48 29.505 10.673 -39.320 476 HG CYS 48 HG CYS 48 31.020 13.412 -40.407 477 H GLU 49 H GLU 49 27.299 9.971 -41.292 478 HA GLU 49 HA GLU 49 28.146 10.487 -43.980 479 HB2 GLU 49 HB2 GLU 49 25.845 8.845 -43.075 480 HB3 GLU 49 HB3 GLU 49 26.471 9.149 -44.779 481 HG2 GLU 49 HG2 GLU 49 28.045 8.004 -42.339 482 HG3 GLU 49 HG3 GLU 49 27.258 6.952 -43.579 483 H ARG 50 H ARG 50 24.832 11.113 -42.612 484 HA ARG 50 HA ARG 50 23.788 12.322 -44.959 485 HB2 ARG 50 HB2 ARG 50 23.283 12.541 -41.924 486 HB3 ARG 50 HB3 ARG 50 22.233 13.387 -43.137 487 HG2 ARG 50 HG2 ARG 50 21.982 11.087 -44.188 488 HG3 ARG 50 HG3 ARG 50 22.579 10.361 -42.693 489 HD2 ARG 50 HD2 ARG 50 20.602 11.393 -41.468 490 HD3 ARG 50 HD3 ARG 50 20.200 12.331 -42.869 491 HE ARG 50 HE ARG 50 20.083 9.457 -43.012 492 HH11 ARG 50 HH11 ARG 50 18.617 12.375 -44.090 493 HH12 ARG 50 HH12 ARG 50 17.424 11.526 -44.993 494 HH21 ARG 50 HH21 ARG 50 18.112 8.581 -43.469 495 HH22 ARG 50 HH22 ARG 50 17.027 9.482 -44.472 496 H GLN 51 H GLN 51 25.530 13.731 -42.176 497 HA GLN 51 HA GLN 51 25.186 16.477 -43.175 498 HB2 GLN 51 HB2 GLN 51 27.076 15.483 -41.039 499 HB3 GLN 51 HB3 GLN 51 27.312 16.988 -41.624 500 HG2 GLN 51 HG2 GLN 51 24.448 16.293 -41.031 501 HG3 GLN 51 HG3 GLN 51 25.505 16.631 -39.612 502 HE21 GLN 51 HE22 GLN 51 24.502 18.613 -38.991 503 HE22 GLN 51 HE21 GLN 51 24.380 19.980 -40.134 504 H GLY 52 H GLY 52 27.926 14.219 -43.820 505 HA2 GLY 52 HA2 GLY 52 29.673 14.447 -45.276 506 HA3 GLY 52 HA3 GLY 52 29.075 15.959 -45.717 507 H LEU 53 H LEU 53 29.242 16.975 -42.750 508 HA LEU 53 HA LEU 53 31.904 17.762 -42.575 509 HB2 LEU 53 HB2 LEU 53 29.937 17.618 -40.237 510 HB3 LEU 53 HB3 LEU 53 31.440 18.572 -40.409 511 HG LEU 53 HG LEU 53 28.956 18.933 -42.290 512 HD11 LEU 53 HD11 LEU 53 28.818 19.754 -39.758 513 HD12 LEU 53 HD12 LEU 53 29.813 21.101 -40.430 514 HD13 LEU 53 HD13 LEU 53 28.202 20.643 -41.112 515 HD21 LEU 53 HD21 LEU 53 30.176 21.190 -42.755 516 HD22 LEU 53 HD22 LEU 53 31.540 20.449 -42.212 517 HD23 LEU 53 HD23 LEU 53 30.621 19.676 -43.586 518 H SER 54 H SER 54 33.529 17.015 -41.169 519 HA SER 54 HA SER 54 33.644 14.177 -40.802 520 HB2 SER 54 HB2 SER 54 35.508 16.032 -41.279 521 HB3 SER 54 HB3 SER 54 35.536 16.294 -39.545 522 HG SER 54 HG SER 54 36.258 14.047 -40.875 523 H MET 55 H MET 55 33.853 12.865 -38.912 524 HA MET 55 HA MET 55 32.512 13.855 -36.582 525 HB2 MET 55 HB2 MET 55 34.443 11.444 -36.861 526 HB3 MET 55 HB3 MET 55 33.439 11.780 -35.563 527 HG2 MET 55 HG2 MET 55 31.465 11.765 -37.405 528 HG3 MET 55 HG3 MET 55 32.782 10.994 -38.362 529 HE1 MET 55 HE1 MET 55 30.522 10.383 -35.211 530 HE2 MET 55 HE2 MET 55 30.532 8.637 -34.993 531 HE3 MET 55 HE3 MET 55 31.926 9.650 -34.441 532 H ARG 56 H ARG 56 35.826 14.047 -37.540 533 HA ARG 56 HA ARG 56 36.984 15.061 -35.044 534 HB2 ARG 56 HB2 ARG 56 38.190 14.355 -36.995 535 HB3 ARG 56 HB3 ARG 56 37.719 15.712 -37.899 536 HG2 ARG 56 HG2 ARG 56 38.764 17.246 -36.186 537 HG3 ARG 56 HG3 ARG 56 39.455 15.837 -35.372 538 HD2 ARG 56 HD2 ARG 56 40.819 15.276 -37.158 539 HD3 ARG 56 HD3 ARG 56 39.952 16.296 -38.324 540 HE ARG 56 HE ARG 56 42.099 17.238 -36.646 541 HH11 ARG 56 HH11 ARG 56 39.260 18.244 -38.395 542 HH12 ARG 56 HH12 ARG 56 39.818 19.905 -38.328 543 HH21 ARG 56 HH21 ARG 56 42.594 19.188 -36.367 544 HH22 ARG 56 HH22 ARG 56 41.758 20.500 -37.026 545 H GLN 57 H GLN 57 35.002 16.864 -37.500 546 HA GLN 57 HA GLN 57 35.647 19.469 -36.175 547 HB2 GLN 57 HB2 GLN 57 35.003 19.096 -38.853 548 HB3 GLN 57 HB3 GLN 57 33.419 18.944 -38.161 549 HG2 GLN 57 HG2 GLN 57 33.776 21.374 -37.275 550 HG3 GLN 57 HG3 GLN 57 35.185 21.368 -38.215 551 HE21 GLN 57 HE22 GLN 57 32.834 23.133 -38.783 552 HE22 GLN 57 HE21 GLN 57 32.699 22.894 -40.499 553 H ILE 58 H ILE 58 32.841 17.126 -36.337 554 HA ILE 58 HA ILE 58 31.235 19.028 -34.628 555 HB ILE 58 HB ILE 58 29.434 17.995 -35.211 556 HG12 ILE 58 HG12 ILE 58 31.064 15.735 -36.463 557 HG13 ILE 58 HG13 ILE 58 30.107 15.683 -34.986 558 HG21 ILE 58 HG21 ILE 58 30.521 19.352 -37.110 559 HG22 ILE 58 HG22 ILE 58 31.171 17.826 -37.693 560 HG23 ILE 58 HG23 ILE 58 29.373 18.109 -37.742 561 HD11 ILE 58 HD11 ILE 58 28.070 16.296 -36.240 562 HD12 ILE 58 HD12 ILE 58 28.883 15.886 -37.746 563 HD13 ILE 58 HD13 ILE 58 28.746 14.687 -36.413 564 H ARG 59 H ARG 59 30.250 18.589 -32.835 565 HA ARG 59 HA ARG 59 31.189 16.233 -31.385 566 HB2 ARG 59 HB2 ARG 59 30.780 19.121 -30.383 567 HB3 ARG 59 HB3 ARG 59 31.112 17.720 -29.361 568 HG2 ARG 59 HG2 ARG 59 32.966 18.448 -31.633 569 HG3 ARG 59 HG3 ARG 59 33.150 19.161 -30.022 570 HD2 ARG 59 HD2 ARG 59 33.413 16.872 -29.105 571 HD3 ARG 59 HD3 ARG 59 33.133 16.214 -30.660 572 HE ARG 59 HE ARG 59 35.669 17.426 -29.753 573 HH11 ARG 59 HH11 ARG 59 34.043 16.347 -32.643 574 HH12 ARG 59 HH12 ARG 59 35.609 16.358 -33.472 575 HH21 ARG 59 HH21 ARG 59 37.353 17.788 -31.170 576 HH22 ARG 59 HH22 ARG 59 37.307 16.763 -32.566 577 H PHE 60 H PHE 60 29.743 14.931 -30.326 578 HA PHE 60 HA PHE 60 26.881 15.687 -30.232 579 HB2 PHE 60 HB2 PHE 60 28.373 13.067 -30.074 580 HB3 PHE 60 HB3 PHE 60 26.603 13.275 -29.945 581 HD1 PHE 60 HD2 PHE 60 25.201 13.521 -31.975 582 HD2 PHE 60 HD1 PHE 60 29.614 13.240 -32.161 583 HE1 PHE 60 HE2 PHE 60 25.166 13.188 -34.431 584 HE2 PHE 60 HE1 PHE 60 29.324 12.417 -34.475 585 HZ PHE 60 HZ PHE 60 27.199 12.699 -35.623 586 H ARG 61 H ARG 61 25.638 16.027 -28.309 587 HA ARG 61 HA ARG 61 26.687 14.955 -25.927 588 HB2 ARG 61 HB2 ARG 61 25.825 17.881 -26.495 589 HB3 ARG 61 HB3 ARG 61 26.105 17.381 -24.923 590 HG2 ARG 61 HG2 ARG 61 28.560 16.847 -25.521 591 HG3 ARG 61 HG3 ARG 61 28.219 17.311 -27.264 592 HD2 ARG 61 HD2 ARG 61 27.431 19.541 -26.224 593 HD3 ARG 61 HD3 ARG 61 28.323 19.125 -24.811 594 HE ARG 61 HE ARG 61 30.332 18.560 -26.321 595 HH11 ARG 61 HH11 ARG 61 28.383 21.282 -26.522 596 HH12 ARG 61 HH12 ARG 61 29.723 22.268 -27.242 597 HH21 ARG 61 HH21 ARG 61 31.970 19.724 -27.472 598 HH22 ARG 61 HH22 ARG 61 31.596 21.383 -27.888 599 H PHE 62 H PHE 62 25.308 14.868 -24.182 600 HA PHE 62 HA PHE 62 22.457 15.412 -24.587 601 HB2 PHE 62 HB2 PHE 62 22.841 12.873 -24.986 602 HB3 PHE 62 HB3 PHE 62 23.562 12.795 -23.369 603 HD1 PHE 62 HD2 PHE 62 20.500 13.952 -25.204 604 HD2 PHE 62 HD1 PHE 62 22.105 12.324 -21.523 605 HE1 PHE 62 HE2 PHE 62 18.331 13.414 -24.627 606 HE2 PHE 62 HE1 PHE 62 19.804 11.923 -20.757 607 HZ PHE 62 HZ PHE 62 17.897 12.149 -22.279 608 H ASP 63 H ASP 63 21.552 16.165 -22.649 609 HA ASP 63 HA ASP 63 21.777 17.566 -20.832 610 HB2 ASP 63 HB2 ASP 63 21.282 15.326 -20.060 611 HB3 ASP 63 HB3 ASP 63 22.959 15.233 -19.531 612 H GLY 64 H GLY 64 23.673 18.352 -22.470 613 HA2 GLY 64 HA2 GLY 64 25.568 19.684 -22.474 614 HA3 GLY 64 HA3 GLY 64 25.766 19.437 -20.688 615 H GLN 65 H GLN 65 26.156 16.506 -20.868 616 HA GLN 65 HA GLN 65 28.890 16.798 -21.410 617 HB2 GLN 65 HB2 GLN 65 27.283 14.312 -20.746 618 HB3 GLN 65 HB3 GLN 65 29.020 14.420 -20.548 619 HG2 GLN 65 HG2 GLN 65 26.692 15.599 -18.879 620 HG3 GLN 65 HG3 GLN 65 28.194 14.766 -18.371 621 HE21 GLN 65 HE22 GLN 65 26.876 17.607 -17.851 622 HE22 GLN 65 HE21 GLN 65 28.046 18.789 -18.296 623 HA PRO 66 HA PRO 66 29.614 14.598 -25.493 624 HB2 PRO 66 HB2 PRO 66 31.867 13.319 -25.027 625 HB3 PRO 66 HB3 PRO 66 31.920 15.084 -25.118 626 HG2 PRO 66 HG2 PRO 66 31.625 13.446 -22.575 627 HG3 PRO 66 HG3 PRO 66 32.803 14.710 -22.956 628 HD2 PRO 66 HD2 PRO 66 30.565 15.407 -21.635 629 HD3 PRO 66 HD3 PRO 66 31.080 16.468 -22.989 630 H ILE 67 H ILE 67 29.361 12.656 -26.511 631 HA ILE 67 HA ILE 67 28.408 10.432 -24.636 632 HB ILE 67 HB ILE 67 27.914 11.135 -27.541 633 HG12 ILE 67 HG12 ILE 67 25.978 11.281 -25.218 634 HG13 ILE 67 HG13 ILE 67 26.678 12.687 -26.017 635 HG21 ILE 67 HG21 ILE 67 27.692 8.606 -27.194 636 HG22 ILE 67 HG22 ILE 67 26.467 8.908 -26.003 637 HG23 ILE 67 HG23 ILE 67 26.189 9.321 -27.734 638 HD11 ILE 67 HD11 ILE 67 25.451 11.504 -28.121 639 HD12 ILE 67 HD12 ILE 67 24.357 11.038 -26.642 640 HD13 ILE 67 HD13 ILE 67 24.608 12.563 -27.089 641 H ASN 68 H ASN 68 29.494 8.554 -24.583 642 HA ASN 68 HA ASN 68 31.793 8.400 -26.336 643 HB2 ASN 68 HB2 ASN 68 31.057 7.063 -23.801 644 HB3 ASN 68 HB3 ASN 68 32.331 6.358 -24.733 645 HD21 ASN 68 HD22 ASN 68 31.998 8.252 -22.205 646 HD22 ASN 68 HD21 ASN 68 33.273 9.495 -22.427 647 H GLU 69 H GLU 69 32.382 6.304 -27.567 648 HA GLU 69 HA GLU 69 30.086 5.437 -29.111 649 HB2 GLU 69 HB2 GLU 69 32.947 4.542 -28.620 650 HB3 GLU 69 HB3 GLU 69 31.941 3.880 -29.906 651 HG2 GLU 69 HG2 GLU 69 31.709 6.243 -30.809 652 HG3 GLU 69 HG3 GLU 69 32.994 6.723 -29.684 653 H THR 70 H THR 70 30.926 4.722 -25.964 654 HA THR 70 HA THR 70 29.733 1.963 -26.327 655 HB THR 70 HB THR 70 30.933 1.350 -24.245 656 HG1 THR 70 HG1 THR 70 31.398 3.318 -23.352 657 HG21 THR 70 HG21 THR 70 32.849 2.154 -26.591 658 HG22 THR 70 HG22 THR 70 33.189 1.196 -25.076 659 HG23 THR 70 HG23 THR 70 32.082 0.645 -26.320 660 H ASP 71 H ASP 71 28.846 4.867 -25.568 661 HA ASP 71 HA ASP 71 27.003 4.123 -23.421 662 HB2 ASP 71 HB2 ASP 71 27.303 6.706 -25.212 663 HB3 ASP 71 HB3 ASP 71 26.000 6.393 -24.013 664 H THR 72 H THR 72 24.883 4.200 -23.502 665 HA THR 72 HA THR 72 23.646 3.305 -26.134 666 HB THR 72 HB THR 72 22.726 1.324 -25.446 667 HG1 THR 72 HG1 THR 72 22.456 0.711 -23.226 668 HG21 THR 72 HG21 THR 72 24.041 -0.166 -24.285 669 HG22 THR 72 HG22 THR 72 24.882 0.736 -25.519 670 HG23 THR 72 HG23 THR 72 25.083 1.065 -23.726 671 HA PRO 73 HA PRO 73 20.136 5.657 -24.425 672 HB2 PRO 73 HB2 PRO 73 18.308 3.318 -25.139 673 HB3 PRO 73 HB3 PRO 73 18.071 5.007 -25.589 674 HG2 PRO 73 HG2 PRO 73 18.974 3.235 -27.395 675 HG3 PRO 73 HG3 PRO 73 19.512 4.948 -27.392 676 HD2 PRO 73 HD2 PRO 73 20.868 2.380 -26.464 677 HD3 PRO 73 HD3 PRO 73 21.623 3.898 -27.199 678 H ALA 74 H ALA 74 20.350 2.301 -23.497 679 HA ALA 74 HA ALA 74 18.762 2.566 -21.095 680 HB1 ALA 74 HB1 ALA 74 20.051 0.379 -20.586 681 HB2 ALA 74 HB2 ALA 74 19.106 0.367 -22.114 682 HB3 ALA 74 HB3 ALA 74 20.866 0.543 -22.093 683 H GLN 75 H GLN 75 22.285 2.910 -21.874 684 HA GLN 75 HA GLN 75 23.184 3.245 -19.155 685 HB2 GLN 75 HB2 GLN 75 24.615 2.527 -20.923 686 HB3 GLN 75 HB3 GLN 75 24.227 3.930 -21.874 687 HG2 GLN 75 HG2 GLN 75 26.419 3.940 -20.814 688 HG3 GLN 75 HG3 GLN 75 25.568 5.226 -20.142 689 HE21 GLN 75 HE22 GLN 75 27.539 4.786 -18.354 690 HE22 GLN 75 HE21 GLN 75 27.115 3.594 -17.116 691 H LEU 76 H LEU 76 22.370 5.651 -21.683 692 HA LEU 76 HA LEU 76 22.562 7.934 -19.810 693 HB2 LEU 76 HB2 LEU 76 21.322 7.684 -22.556 694 HB3 LEU 76 HB3 LEU 76 21.807 9.293 -21.812 695 HG LEU 76 HG LEU 76 23.720 7.012 -22.821 696 HD11 LEU 76 HD11 LEU 76 24.363 8.536 -24.610 697 HD12 LEU 76 HD12 LEU 76 22.660 8.283 -24.781 698 HD13 LEU 76 HD13 LEU 76 23.266 9.788 -24.062 699 HD21 LEU 76 HD21 LEU 76 24.437 8.717 -21.002 700 HD22 LEU 76 HD22 LEU 76 25.561 8.495 -22.434 701 HD23 LEU 76 HD23 LEU 76 24.430 9.899 -22.259 702 H GLU 77 H GLU 77 20.296 5.746 -19.947 703 HA GLU 77 HA GLU 77 18.100 5.622 -19.332 704 HB2 GLU 77 HB2 GLU 77 18.902 7.853 -17.323 705 HB3 GLU 77 HB3 GLU 77 17.534 6.792 -17.358 706 HG2 GLU 77 HG2 GLU 77 20.457 5.759 -17.081 707 HG3 GLU 77 HG3 GLU 77 19.459 6.176 -15.725 708 H MET 78 H MET 78 18.098 6.794 -21.615 709 HA MET 78 HA MET 78 16.891 9.406 -21.818 710 HB2 MET 78 HB2 MET 78 17.420 7.215 -23.764 711 HB3 MET 78 HB3 MET 78 16.480 8.479 -24.346 712 HG2 MET 78 HG2 MET 78 18.427 10.038 -23.684 713 HG3 MET 78 HG3 MET 78 19.259 8.599 -23.020 714 HE1 MET 78 HE1 MET 78 19.188 10.913 -26.048 715 HE2 MET 78 HE2 MET 78 20.488 10.550 -24.820 716 HE3 MET 78 HE3 MET 78 20.712 10.087 -26.520 717 H GLU 79 H GLU 79 14.570 9.776 -22.368 718 HA GLU 79 HA GLU 79 12.686 7.577 -22.436 719 HB2 GLU 79 HB2 GLU 79 12.180 10.593 -22.529 720 HB3 GLU 79 HB3 GLU 79 10.984 9.273 -22.356 721 HG2 GLU 79 HG2 GLU 79 13.144 10.463 -20.486 722 HG3 GLU 79 HG3 GLU 79 11.440 10.436 -20.201 723 H ASP 80 H ASP 80 11.025 7.619 -24.296 724 HA ASP 80 HA ASP 80 12.229 8.112 -27.018 725 HB2 ASP 80 HB2 ASP 80 9.214 7.865 -26.505 726 HB3 ASP 80 HB3 ASP 80 10.183 7.327 -27.865 727 H GLU 81 H GLU 81 11.810 9.832 -28.232 728 HA GLU 81 HA GLU 81 11.495 11.979 -28.940 729 HB2 GLU 81 HB2 GLU 81 9.451 12.916 -26.983 730 HB3 GLU 81 HB3 GLU 81 9.895 13.259 -28.618 731 HG2 GLU 81 HG2 GLU 81 8.766 10.644 -27.848 732 HG3 GLU 81 HG3 GLU 81 7.738 12.003 -28.331 733 H ASP 82 H ASP 82 13.360 11.140 -26.265 734 HA ASP 82 HA ASP 82 14.162 13.833 -25.879 735 HB2 ASP 82 HB2 ASP 82 15.796 11.329 -25.251 736 HB3 ASP 82 HB3 ASP 82 16.200 13.002 -24.915 737 H THR 83 H THR 83 16.512 14.786 -26.476 738 HA THR 83 HA THR 83 17.255 13.928 -29.188 739 HB THR 83 HB THR 83 16.737 16.792 -28.239 740 HG1 THR 83 HG1 THR 83 14.674 15.845 -28.607 741 HG21 THR 83 HG21 THR 83 16.771 17.034 -30.783 742 HG22 THR 83 HG22 THR 83 18.264 16.957 -29.860 743 HG23 THR 83 HG23 THR 83 17.703 15.495 -30.771 744 H ILE 84 H ILE 84 19.186 13.862 -29.638 745 HA ILE 84 HA ILE 84 21.599 14.635 -27.942 746 HB ILE 84 HB ILE 84 21.031 13.148 -30.493 747 HG12 ILE 84 HG12 ILE 84 22.482 12.121 -28.023 748 HG13 ILE 84 HG13 ILE 84 20.771 11.777 -28.332 749 HG21 ILE 84 HG21 ILE 84 23.616 14.141 -29.048 750 HG22 ILE 84 HG22 ILE 84 23.668 12.769 -30.287 751 HG23 ILE 84 HG23 ILE 84 23.309 14.422 -30.672 752 HD11 ILE 84 HD11 ILE 84 22.828 10.846 -30.310 753 HD12 ILE 84 HD12 ILE 84 22.334 9.967 -28.865 754 HD13 ILE 84 HD13 ILE 84 21.126 10.422 -30.148 755 H ASP 85 H ASP 85 22.572 16.415 -28.079 756 HA ASP 85 HA ASP 85 21.950 18.447 -30.205 757 HB2 ASP 85 HB2 ASP 85 23.660 18.610 -27.714 758 HB3 ASP 85 HB3 ASP 85 23.434 19.897 -28.822 759 H VAL 86 H VAL 86 23.396 19.206 -31.486 760 HA VAL 86 HA VAL 86 26.034 17.916 -31.396 761 HB VAL 86 HB VAL 86 24.775 18.565 -34.127 762 HG11 VAL 86 HG11 VAL 86 27.115 18.663 -34.119 763 HG12 VAL 86 HG12 VAL 86 27.177 17.018 -33.350 764 HG13 VAL 86 HG13 VAL 86 26.568 17.362 -35.059 765 HG21 VAL 86 HG21 VAL 86 23.401 16.914 -33.001 766 HG22 VAL 86 HG22 VAL 86 24.346 16.306 -34.318 767 HG23 VAL 86 HG23 VAL 86 24.883 15.884 -32.675 768 H PHE 87 H PHE 87 27.795 19.296 -31.265 769 HA PHE 87 HA PHE 87 27.557 22.166 -32.063 770 HB2 PHE 87 HB2 PHE 87 29.040 20.738 -29.782 771 HB3 PHE 87 HB3 PHE 87 29.246 22.387 -30.193 772 HD1 PHE 87 HD1 PHE 87 26.762 20.229 -28.583 773 HD2 PHE 87 HD2 PHE 87 27.828 24.179 -29.771 774 HE1 PHE 87 HE1 PHE 87 24.627 21.001 -27.605 775 HE2 PHE 87 HE2 PHE 87 25.614 24.990 -28.695 776 HZ PHE 87 HZ PHE 87 23.993 23.362 -27.731 777 H GLN 88 H GLN 88 29.935 23.133 -32.270 778 HA GLN 88 HA GLN 88 31.599 21.138 -33.680 779 HB2 GLN 88 HB2 GLN 88 31.090 23.943 -34.574 780 HB3 GLN 88 HB3 GLN 88 32.525 22.921 -35.025 781 HG2 GLN 88 HG2 GLN 88 30.843 21.291 -35.763 782 HG3 GLN 88 HG3 GLN 88 29.483 22.300 -35.285 783 HE21 GLN 88 HE22 GLN 88 28.740 22.135 -37.368 784 HE22 GLN 88 HE21 GLN 88 29.625 22.956 -38.704 785 H GLN 89 H GLN 89 33.855 21.347 -33.720 786 HA GLN 89 HA GLN 89 35.065 23.092 -31.544 787 HB2 GLN 89 HB2 GLN 89 35.413 21.016 -30.819 788 HB3 GLN 89 HB3 GLN 89 35.876 20.354 -32.418 789 HG2 GLN 89 HG2 GLN 89 37.883 21.226 -32.412 790 HG3 GLN 89 HG3 GLN 89 37.621 22.483 -31.121 791 HE21 GLN 89 HE22 GLN 89 37.831 21.953 -29.002 792 HE22 GLN 89 HE21 GLN 89 38.410 20.344 -28.478 793 H GLN 90 H GLN 90 36.080 24.602 -31.996 794 HA GLN 90 HA GLN 90 36.838 25.082 -34.842 795 HB2 GLN 90 HB2 GLN 90 35.267 26.727 -32.850 796 HB3 GLN 90 HB3 GLN 90 36.719 27.518 -33.472 797 HG2 GLN 90 HG2 GLN 90 34.841 27.920 -35.072 798 HG3 GLN 90 HG3 GLN 90 35.626 26.590 -35.822 799 HE21 GLN 90 HE22 GLN 90 34.409 25.114 -36.743 800 HE22 GLN 90 HE21 GLN 90 33.018 24.431 -36.115 801 H THR 91 H THR 91 38.855 25.956 -35.399 802 HA THR 91 HA THR 91 41.041 25.470 -33.835 803 HB THR 91 HB THR 91 42.271 27.065 -35.453 804 HG1 THR 91 HG1 THR 91 40.971 27.763 -37.084 805 HG21 THR 91 HG21 THR 91 42.048 24.720 -35.827 806 HG22 THR 91 HG22 THR 91 40.510 25.087 -36.669 807 HG23 THR 91 HG23 THR 91 41.989 25.834 -37.337 808 H GLY 92 H GLY 92 39.065 28.341 -33.398 809 HA2 GLY 92 HA2 GLY 92 39.377 30.244 -32.194 810 HA3 GLY 92 HA3 GLY 92 40.720 29.508 -31.332 811 H GLY 93 H GLY 93 41.589 31.865 -31.633 812 HA2 GLY 93 HA2 GLY 93 41.631 33.051 -34.266 813 HA3 GLY 93 HA3 GLY 93 42.113 33.763 -32.828 814 H VAL 94 H VAL 94 43.338 33.741 -35.461 815 HA VAL 94 HA VAL 94 46.005 32.552 -35.312 816 HB VAL 94 HB VAL 94 44.630 34.856 -36.838 817 HG11 VAL 94 HG11 VAL 94 47.395 33.788 -37.255 818 HG12 VAL 94 HG12 VAL 94 46.534 34.874 -38.430 819 HG13 VAL 94 HG13 VAL 94 47.029 35.360 -36.761 820 HG21 VAL 94 HG21 VAL 94 45.222 32.010 -37.796 821 HG22 VAL 94 HG22 VAL 94 43.579 32.896 -37.583 822 HG23 VAL 94 HG23 VAL 94 44.822 33.343 -38.735 823 H TYR 95 H TYR 95 47.659 33.423 -34.429 824 HA TYR 95 HA TYR 95 47.397 35.328 -32.282 825 HB2 TYR 95 HB2 TYR 95 49.568 33.537 -33.236 826 HB3 TYR 95 HB3 TYR 95 49.926 34.605 -31.857 827 HD1 TYR 95 HD1 TYR 95 48.745 34.449 -29.917 828 HD2 TYR 95 HD2 TYR 95 48.196 31.565 -32.959 829 HE1 TYR 95 HE1 TYR 95 47.632 32.990 -28.219 830 HE2 TYR 95 HE2 TYR 95 47.103 29.992 -31.323 831 HH TYR 95 HH TYR 95 46.262 30.952 -28.000 Start of MODEL 14 1 H1 ACE 36 HH32 ACE 36 9.852 15.294 -41.195 2 H2 ACE 36 HH33 ACE 36 9.989 16.343 -42.519 3 H3 ACE 36 HH31 ACE 36 8.405 15.589 -42.320 4 H GLU 37 H GLU 37 10.206 15.582 -44.682 5 HA GLU 37 HA GLU 37 8.997 13.175 -45.459 6 HB2 GLU 37 HB2 GLU 37 8.877 15.356 -46.551 7 HB3 GLU 37 HB3 GLU 37 10.605 15.186 -46.910 8 HG2 GLU 37 HG2 GLU 37 9.154 14.845 -48.850 9 HG3 GLU 37 HG3 GLU 37 10.159 13.465 -48.454 10 H ASP 38 H ASP 38 12.232 13.812 -44.754 11 HA ASP 38 HA ASP 38 13.063 11.008 -45.300 12 HB2 ASP 38 HB2 ASP 38 13.725 12.240 -47.209 13 HB3 ASP 38 HB3 ASP 38 14.542 13.452 -46.187 14 H ALA 39 H ALA 39 12.407 12.720 -42.806 15 HA ALA 39 HA ALA 39 14.894 13.047 -41.411 16 HB1 ALA 39 HB1 ALA 39 11.934 13.586 -40.636 17 HB2 ALA 39 HB2 ALA 39 13.359 14.136 -39.694 18 HB3 ALA 39 HB3 ALA 39 12.982 14.800 -41.217 19 H PHE 40 H PHE 40 14.904 10.511 -41.931 20 HA PHE 40 HA PHE 40 14.122 9.090 -39.410 21 HB2 PHE 40 HB2 PHE 40 12.294 9.249 -41.241 22 HB3 PHE 40 HB3 PHE 40 13.100 7.871 -41.854 23 HD1 PHE 40 HD2 PHE 40 13.283 5.748 -40.605 24 HD2 PHE 40 HD1 PHE 40 11.216 9.184 -39.070 25 HE1 PHE 40 HE2 PHE 40 12.078 4.384 -39.008 26 HE2 PHE 40 HE1 PHE 40 9.790 7.745 -37.504 27 HZ PHE 40 HZ PHE 40 10.280 5.278 -37.601 28 H ILE 41 H ILE 41 15.728 7.864 -38.845 29 HA ILE 41 HA ILE 41 17.303 6.373 -40.839 30 HB ILE 41 HB ILE 41 18.591 7.478 -38.382 31 HG12 ILE 41 HG12 ILE 41 20.003 8.721 -40.187 32 HG13 ILE 41 HG13 ILE 41 18.626 8.639 -41.219 33 HG21 ILE 41 HG21 ILE 41 19.513 5.831 -40.746 34 HG22 ILE 41 HG22 ILE 41 20.668 6.706 -39.857 35 HG23 ILE 41 HG23 ILE 41 19.778 5.597 -38.954 36 HD11 ILE 41 HD11 ILE 41 18.798 10.897 -39.823 37 HD12 ILE 41 HD12 ILE 41 17.320 10.001 -39.729 38 HD13 ILE 41 HD13 ILE 41 18.430 9.756 -38.454 39 H VAL 42 H VAL 42 17.704 4.356 -40.152 40 HA VAL 42 HA VAL 42 16.539 3.208 -37.603 41 HB VAL 42 HB VAL 42 16.251 2.099 -40.387 42 HG11 VAL 42 HG11 VAL 42 15.534 1.290 -37.605 43 HG12 VAL 42 HG12 VAL 42 14.067 1.631 -38.496 44 HG13 VAL 42 HG13 VAL 42 15.264 0.459 -39.042 45 HG21 VAL 42 HG21 VAL 42 14.226 3.940 -39.229 46 HG22 VAL 42 HG22 VAL 42 15.301 4.210 -40.618 47 HG23 VAL 42 HG23 VAL 42 14.098 2.940 -40.699 48 H ILE 43 H ILE 43 17.849 1.704 -36.534 49 HA ILE 43 HA ILE 43 20.043 0.248 -37.905 50 HB ILE 43 HB ILE 43 20.518 2.252 -35.736 51 HG12 ILE 43 HG12 ILE 43 22.024 1.951 -38.207 52 HG13 ILE 43 HG13 ILE 43 20.612 3.012 -38.125 53 HG21 ILE 43 HG21 ILE 43 22.823 1.283 -35.488 54 HG22 ILE 43 HG22 ILE 43 21.585 0.127 -35.022 55 HG23 ILE 43 HG23 ILE 43 22.272 -0.044 -36.567 56 HD11 ILE 43 HD11 ILE 43 23.359 3.566 -37.274 57 HD12 ILE 43 HD12 ILE 43 22.082 4.704 -37.492 58 HD13 ILE 43 HD13 ILE 43 22.105 3.816 -35.983 59 H SEP 44 H SEP 44 20.295 -1.860 -36.978 60 HA SEP 44 HA SEP 44 19.748 -2.059 -34.100 61 HB2 SEP 44 HB2 SEP 44 19.074 -4.566 -34.356 62 HB3 SEP 44 HB3 SEP 44 17.845 -3.317 -34.900 63 H ASP 45 H ASP 45 20.957 -3.470 -32.950 64 HA ASP 45 HA ASP 45 23.702 -3.456 -34.133 65 HB2 ASP 45 HB2 ASP 45 23.153 -2.590 -31.755 66 HB3 ASP 45 HB3 ASP 45 22.806 -4.325 -31.406 67 H SEP 46 H SEP 46 21.379 -5.868 -34.100 68 HA SEP 46 HA SEP 46 23.417 -8.001 -33.616 69 HB2 SEP 46 HB2 SEP 46 21.856 -9.374 -32.336 70 HB3 SEP 46 HB3 SEP 46 21.621 -7.749 -31.680 71 H ASP 47 H ASP 47 23.358 -9.749 -34.964 72 HA ASP 47 HA ASP 47 21.872 -9.145 -37.531 73 HB2 ASP 47 HB2 ASP 47 23.990 -7.918 -37.474 74 HB3 ASP 47 HB3 ASP 47 24.928 -9.362 -37.331 75 H GLY 48 H GLY 48 21.173 -11.055 -38.626 76 HA2 GLY 48 HA2 GLY 48 20.904 -13.133 -39.297 77 HA3 GLY 48 HA3 GLY 48 22.649 -13.409 -39.049 78 H GLU 49 H GLU 49 23.108 -14.963 -37.581 79 HA GLU 49 HA GLU 49 21.136 -16.383 -36.194 80 HB2 GLU 49 HB2 GLU 49 22.956 -17.416 -37.222 81 HB3 GLU 49 HB3 GLU 49 24.209 -16.653 -36.365 82 HG2 GLU 49 HG2 GLU 49 23.713 -19.006 -35.529 83 HG3 GLU 49 HG3 GLU 49 23.583 -17.834 -34.180 84 HN1 NH2 50 HN1 NH2 50 20.533 -16.288 -33.973 85 HN2 NH2 50 HN2 NH2 50 21.286 -15.098 -32.938 86 H1 MET 1 H1 MET 1 -9.612 -34.958 -38.738 87 H2 MET 1 H2 MET 1 -9.611 -34.146 -40.133 88 H3 MET 1 H3 MET 1 -10.861 -35.132 -39.815 89 HA MET 1 HA MET 1 -11.053 -32.617 -39.410 90 HB2 MET 1 HB2 MET 1 -12.888 -34.139 -38.521 91 HB3 MET 1 HB3 MET 1 -11.744 -34.630 -37.336 92 HG2 MET 1 HG2 MET 1 -13.487 -32.940 -36.568 93 HG3 MET 1 HG3 MET 1 -11.899 -32.473 -36.127 94 HE1 MET 1 HE1 MET 1 -12.330 -29.905 -35.926 95 HE2 MET 1 HE2 MET 1 -13.314 -28.847 -36.974 96 HE3 MET 1 HE3 MET 1 -14.123 -30.143 -36.145 97 H ALA 2 H ALA 2 -10.443 -30.850 -38.157 98 HA ALA 2 HA ALA 2 -7.614 -30.913 -37.666 99 HB1 ALA 2 HB1 ALA 2 -9.656 -28.726 -37.803 100 HB2 ALA 2 HB2 ALA 2 -7.898 -28.452 -38.068 101 HB3 ALA 2 HB3 ALA 2 -8.831 -29.415 -39.224 102 H ASP 3 H ASP 3 -6.613 -29.361 -36.058 103 HA ASP 3 HA ASP 3 -8.013 -28.266 -33.873 104 HB2 ASP 3 HB2 ASP 3 -7.999 -30.787 -33.250 105 HB3 ASP 3 HB3 ASP 3 -6.193 -30.828 -33.286 106 H GLU 4 H GLU 4 -6.560 -26.834 -35.362 107 HA GLU 4 HA GLU 4 -3.749 -26.948 -35.170 108 HB2 GLU 4 HB2 GLU 4 -4.877 -25.844 -37.148 109 HB3 GLU 4 HB3 GLU 4 -5.719 -24.802 -36.008 110 HG2 GLU 4 HG2 GLU 4 -3.859 -23.291 -35.813 111 HG3 GLU 4 HG3 GLU 4 -2.753 -24.620 -36.278 112 H LYS 5 H LYS 5 -2.409 -25.659 -33.988 113 HA LYS 5 HA LYS 5 -3.339 -24.920 -31.251 114 HB2 LYS 5 HB2 LYS 5 -1.229 -26.027 -31.474 115 HB3 LYS 5 HB3 LYS 5 -0.597 -24.979 -32.684 116 HG2 LYS 5 HG2 LYS 5 -1.294 -23.883 -29.960 117 HG3 LYS 5 HG3 LYS 5 0.265 -24.768 -30.258 118 HD2 LYS 5 HD2 LYS 5 0.896 -23.161 -31.895 119 HD3 LYS 5 HD3 LYS 5 -0.616 -22.246 -31.579 120 HE2 LYS 5 HE2 LYS 5 1.471 -22.702 -29.511 121 HE3 LYS 5 HE3 LYS 5 1.311 -21.246 -30.504 122 HZ1 LYS 5 HZ1 LYS 5 0.111 -21.018 -28.458 123 HZ2 LYS 5 HZ2 LYS 5 -1.033 -21.102 -29.562 124 HZ3 LYS 5 HZ3 LYS 5 -0.668 -22.457 -28.625 125 HA PRO 6 HA PRO 6 -4.313 -20.848 -32.957 126 HB2 PRO 6 HB2 PRO 6 -5.452 -19.677 -30.665 127 HB3 PRO 6 HB3 PRO 6 -6.216 -20.781 -31.779 128 HG2 PRO 6 HG2 PRO 6 -4.956 -21.262 -29.158 129 HG3 PRO 6 HG3 PRO 6 -6.407 -21.897 -29.764 130 HD2 PRO 6 HD2 PRO 6 -3.998 -23.337 -29.748 131 HD3 PRO 6 HD3 PRO 6 -5.246 -23.608 -31.017 132 H LYS 7 H LYS 7 -3.426 -19.065 -33.242 133 HA LYS 7 HA LYS 7 -0.853 -18.358 -32.396 134 HB2 LYS 7 HB2 LYS 7 -1.634 -17.451 -34.516 135 HB3 LYS 7 HB3 LYS 7 -3.022 -16.794 -33.726 136 HG2 LYS 7 HG2 LYS 7 -1.864 -15.069 -32.707 137 HG3 LYS 7 HG3 LYS 7 -0.248 -15.756 -33.171 138 HD2 LYS 7 HD2 LYS 7 -0.973 -15.586 -35.464 139 HD3 LYS 7 HD3 LYS 7 -2.446 -14.695 -34.897 140 HE2 LYS 7 HE2 LYS 7 -0.755 -12.818 -34.119 141 HE3 LYS 7 HE3 LYS 7 0.534 -14.054 -34.575 142 HZ1 LYS 7 HZ1 LYS 7 -0.286 -13.822 -36.775 143 HZ2 LYS 7 HZ2 LYS 7 -1.360 -12.691 -36.214 144 HZ3 LYS 7 HZ3 LYS 7 0.261 -12.473 -36.157 145 H GLU 8 H GLU 8 0.096 -17.597 -30.624 146 HA GLU 8 HA GLU 8 -1.302 -15.379 -29.208 147 HB2 GLU 8 HB2 GLU 8 0.242 -15.471 -27.468 148 HB3 GLU 8 HB3 GLU 8 -0.691 -16.920 -27.522 149 HG2 GLU 8 HG2 GLU 8 2.218 -16.819 -28.311 150 HG3 GLU 8 HG3 GLU 8 1.601 -17.436 -26.788 151 H GLY 9 H GLY 9 -0.219 -13.462 -28.796 152 HA2 GLY 9 HA2 GLY 9 1.690 -12.641 -30.931 153 HA3 GLY 9 HA3 GLY 9 0.305 -11.774 -30.344 154 H VAL 10 H VAL 10 1.339 -13.108 -27.731 155 HA VAL 10 HA VAL 10 3.481 -11.072 -27.161 156 HB VAL 10 HB VAL 10 2.452 -13.562 -25.490 157 HG11 VAL 10 HG11 VAL 10 4.562 -12.951 -24.739 158 HG12 VAL 10 HG12 VAL 10 4.338 -11.256 -24.569 159 HG13 VAL 10 HG13 VAL 10 3.471 -12.375 -23.486 160 HG21 VAL 10 HG21 VAL 10 1.519 -10.708 -25.627 161 HG22 VAL 10 HG22 VAL 10 0.602 -12.240 -25.612 162 HG23 VAL 10 HG23 VAL 10 1.367 -11.707 -24.094 163 H LYS 11 H LYS 11 5.766 -11.512 -27.279 164 HA LYS 11 HA LYS 11 6.762 -14.016 -27.909 165 HB2 LYS 11 HB2 LYS 11 5.350 -13.533 -29.986 166 HB3 LYS 11 HB3 LYS 11 6.138 -11.983 -30.214 167 HG2 LYS 11 HG2 LYS 11 8.267 -13.439 -30.788 168 HG3 LYS 11 HG3 LYS 11 7.179 -14.848 -30.461 169 HD2 LYS 11 HD2 LYS 11 5.737 -14.041 -32.399 170 HD3 LYS 11 HD3 LYS 11 6.923 -12.720 -32.681 171 HE2 LYS 11 HE2 LYS 11 8.524 -14.375 -33.448 172 HE3 LYS 11 HE3 LYS 11 7.632 -15.630 -32.538 173 HZ1 LYS 11 HZ1 LYS 11 6.779 -14.467 -35.120 174 HZ2 LYS 11 HZ2 LYS 11 7.294 -15.938 -34.772 175 HZ3 LYS 11 HZ3 LYS 11 5.909 -15.573 -34.121 176 H THR 12 H THR 12 9.310 -13.679 -28.111 177 HA THR 12 HA THR 12 10.095 -11.216 -26.966 178 HB THR 12 HB THR 12 12.392 -11.937 -27.557 179 HG1 THR 12 HG1 THR 12 12.474 -13.593 -29.039 180 HG21 THR 12 HG21 THR 12 10.572 -13.696 -25.912 181 HG22 THR 12 HG22 THR 12 12.394 -13.933 -25.862 182 HG23 THR 12 HG23 THR 12 11.627 -12.431 -25.442 183 H GLU 13 H GLU 13 10.182 -12.169 -30.369 184 HA GLU 13 HA GLU 13 11.544 -9.948 -31.355 185 HB2 GLU 13 HB2 GLU 13 9.443 -11.844 -32.616 186 HB3 GLU 13 HB3 GLU 13 10.532 -10.637 -33.409 187 HG2 GLU 13 HG2 GLU 13 11.521 -13.053 -31.859 188 HG3 GLU 13 HG3 GLU 13 11.327 -12.992 -33.649 189 H ASN 14 H ASN 14 8.215 -10.127 -30.211 190 HA ASN 14 HA ASN 14 7.388 -7.642 -31.509 191 HB2 ASN 14 HB2 ASN 14 5.916 -9.274 -29.547 192 HB3 ASN 14 HB3 ASN 14 5.202 -7.862 -30.353 193 HD21 ASN 14 HD22 ASN 14 4.212 -10.693 -30.573 194 HD22 ASN 14 HD21 ASN 14 4.160 -10.777 -32.380 195 H ASN 15 H ASN 15 9.459 -7.884 -29.219 196 HA ASN 15 HA ASN 15 8.651 -5.955 -27.307 197 HB2 ASN 15 HB2 ASN 15 10.436 -7.731 -27.211 198 HB3 ASN 15 HB3 ASN 15 11.451 -6.674 -28.204 199 HD21 ASN 15 HD22 ASN 15 12.930 -6.053 -26.397 200 HD22 ASN 15 HD21 ASN 15 12.309 -5.071 -25.142 201 H ASP 16 H ASP 16 9.608 -3.897 -27.169 202 HA ASP 16 HA ASP 16 8.824 -2.387 -29.600 203 HB2 ASP 16 HB2 ASP 16 8.815 -2.060 -26.667 204 HB3 ASP 16 HB3 ASP 16 8.653 -0.577 -27.643 205 H HIS 17 H HIS 17 10.005 -0.701 -30.371 206 HA HIS 17 HA HIS 17 12.811 -0.492 -29.780 207 HB2 HIS 17 HB2 HIS 17 11.095 0.946 -31.854 208 HB3 HIS 17 HB3 HIS 17 12.850 1.077 -31.793 209 HD2 HIS 17 HD2 HIS 17 14.200 -1.160 -32.686 210 HE1 HIS 17 HE1 HIS 17 10.895 -3.682 -33.539 211 HE2 HIS 17 HE2 HIS 17 13.424 -3.315 -33.808 212 H ILE 18 H ILE 18 13.939 1.539 -29.518 213 HA ILE 18 HA ILE 18 12.364 3.575 -28.178 214 HB ILE 18 HB ILE 18 14.155 2.814 -26.882 215 HG12 ILE 18 HG12 ILE 18 14.576 5.609 -27.884 216 HG13 ILE 18 HG13 ILE 18 13.191 5.157 -26.859 217 HG21 ILE 18 HG21 ILE 18 16.059 4.056 -28.924 218 HG22 ILE 18 HG22 ILE 18 16.539 3.331 -27.383 219 HG23 ILE 18 HG23 ILE 18 15.923 2.332 -28.619 220 HD11 ILE 18 HD11 ILE 18 15.370 6.361 -25.811 221 HD12 ILE 18 HD12 ILE 18 14.191 5.467 -24.974 222 HD13 ILE 18 HD13 ILE 18 15.723 4.654 -25.519 223 H ASN 19 H ASN 19 12.437 5.665 -28.898 224 HA ASN 19 HA ASN 19 13.572 6.250 -31.575 225 HB2 ASN 19 HB2 ASN 19 10.790 7.006 -30.686 226 HB3 ASN 19 HB3 ASN 19 11.605 7.331 -32.311 227 HD21 ASN 19 HD22 ASN 19 10.255 5.000 -30.128 228 HD22 ASN 19 HD21 ASN 19 9.757 3.833 -31.339 229 H LEU 20 H LEU 20 15.034 7.751 -31.569 230 HA LEU 20 HA LEU 20 15.056 9.910 -29.467 231 HB2 LEU 20 HB2 LEU 20 17.407 8.161 -30.608 232 HB3 LEU 20 HB3 LEU 20 17.538 9.582 -29.697 233 HG LEU 20 HG LEU 20 16.106 7.145 -28.717 234 HD11 LEU 20 HD11 LEU 20 18.796 8.375 -27.813 235 HD12 LEU 20 HD12 LEU 20 18.084 6.908 -27.328 236 HD13 LEU 20 HD13 LEU 20 18.660 7.012 -28.961 237 HD21 LEU 20 HD21 LEU 20 16.459 9.894 -27.545 238 HD22 LEU 20 HD22 LEU 20 15.008 8.828 -27.668 239 HD23 LEU 20 HD23 LEU 20 16.275 8.547 -26.445 240 H LYS 21 H LYS 21 15.968 11.753 -30.087 241 HA LYS 21 HA LYS 21 15.821 12.587 -33.028 242 HB2 LYS 21 HB2 LYS 21 14.911 13.765 -30.404 243 HB3 LYS 21 HB3 LYS 21 15.101 14.752 -31.988 244 HG2 LYS 21 HG2 LYS 21 13.616 13.539 -33.052 245 HG3 LYS 21 HG3 LYS 21 13.348 12.314 -31.712 246 HD2 LYS 21 HD2 LYS 21 12.125 13.642 -30.536 247 HD3 LYS 21 HD3 LYS 21 12.712 15.167 -31.338 248 HE2 LYS 21 HE2 LYS 21 11.532 14.450 -33.429 249 HE3 LYS 21 HE3 LYS 21 10.931 12.991 -32.749 250 HZ1 LYS 21 HZ1 LYS 21 9.209 14.573 -32.737 251 HZ2 LYS 21 HZ2 LYS 21 9.507 14.473 -31.201 252 HZ3 LYS 21 HZ3 LYS 21 10.137 15.723 -32.054 253 H VAL 22 H VAL 22 17.341 13.936 -33.779 254 HA VAL 22 HA VAL 22 19.525 14.950 -32.088 255 HB VAL 22 HB VAL 22 19.957 13.532 -34.794 256 HG11 VAL 22 HG11 VAL 22 21.531 15.180 -34.604 257 HG12 VAL 22 HG12 VAL 22 21.718 15.011 -32.786 258 HG13 VAL 22 HG13 VAL 22 22.397 13.931 -33.873 259 HG21 VAL 22 HG21 VAL 22 19.508 11.753 -33.201 260 HG22 VAL 22 HG22 VAL 22 21.285 11.874 -33.515 261 HG23 VAL 22 HG23 VAL 22 20.496 12.478 -32.011 262 H ALA 23 H ALA 23 20.039 16.915 -32.624 263 HA ALA 23 HA ALA 23 19.498 17.983 -35.298 264 HB1 ALA 23 HB1 ALA 23 18.599 20.103 -34.323 265 HB2 ALA 23 HB2 ALA 23 17.626 18.669 -34.156 266 HB3 ALA 23 HB3 ALA 23 18.594 19.276 -32.704 267 H GLY 24 H GLY 24 21.332 19.131 -36.049 268 HA2 GLY 24 HA2 GLY 24 23.514 19.937 -34.240 269 HA3 GLY 24 HA3 GLY 24 23.629 20.166 -35.951 270 H GLN 25 H GLN 25 24.394 22.312 -35.456 271 HA GLN 25 HA GLN 25 22.487 24.103 -34.030 272 HB2 GLN 25 HB2 GLN 25 24.999 24.724 -35.398 273 HB3 GLN 25 HB3 GLN 25 24.102 25.853 -34.423 274 HG2 GLN 25 HG2 GLN 25 25.646 23.515 -33.370 275 HG3 GLN 25 HG3 GLN 25 25.806 25.192 -32.970 276 HE21 GLN 25 HE22 GLN 25 24.279 22.248 -31.792 277 HE22 GLN 25 HE21 GLN 25 23.338 23.283 -30.675 278 H ASP 26 H ASP 26 22.445 23.185 -37.164 279 HA ASP 26 HA ASP 26 21.088 25.556 -38.289 280 HB2 ASP 26 HB2 ASP 26 20.370 23.750 -39.872 281 HB3 ASP 26 HB3 ASP 26 22.037 24.068 -39.804 282 H GLY 27 H GLY 27 20.090 23.418 -35.681 283 HA2 GLY 27 HA2 GLY 27 18.072 23.208 -34.669 284 HA3 GLY 27 HA3 GLY 27 17.504 24.551 -35.575 285 H SER 28 H SER 28 18.010 22.348 -38.085 286 HA SER 28 HA SER 28 15.370 21.045 -38.024 287 HB2 SER 28 HB2 SER 28 16.071 20.208 -40.080 288 HB3 SER 28 HB3 SER 28 16.815 21.715 -40.073 289 HG SER 28 HG SER 28 18.866 20.533 -39.502 290 H VAL 29 H VAL 29 14.947 19.046 -37.815 291 HA VAL 29 HA VAL 29 16.630 17.429 -35.909 292 HB VAL 29 HB VAL 29 13.604 17.327 -36.178 293 HG11 VAL 29 HG11 VAL 29 15.263 16.348 -33.923 294 HG12 VAL 29 HG12 VAL 29 13.500 16.319 -34.061 295 HG13 VAL 29 HG13 VAL 29 14.403 15.250 -35.027 296 HG21 VAL 29 HG21 VAL 29 14.747 19.669 -35.025 297 HG22 VAL 29 HG22 VAL 29 13.814 18.749 -33.910 298 HG23 VAL 29 HG23 VAL 29 15.537 18.509 -34.010 299 H VAL 30 H VAL 30 16.840 15.164 -36.118 300 HA VAL 30 HA VAL 30 15.201 13.803 -38.227 301 HB VAL 30 HB VAL 30 16.902 12.292 -38.772 302 HG11 VAL 30 HG11 VAL 30 16.596 13.947 -40.249 303 HG12 VAL 30 HG12 VAL 30 17.624 15.149 -39.330 304 HG13 VAL 30 HG13 VAL 30 18.261 13.676 -40.223 305 HG21 VAL 30 HG21 VAL 30 18.389 12.684 -36.551 306 HG22 VAL 30 HG22 VAL 30 19.338 12.574 -38.136 307 HG23 VAL 30 HG23 VAL 30 19.074 14.029 -37.367 308 H GLN 31 H GLN 31 14.443 11.864 -37.531 309 HA GLN 31 HA GLN 31 14.910 11.086 -34.705 310 HB2 GLN 31 HB2 GLN 31 12.532 10.386 -36.514 311 HB3 GLN 31 HB3 GLN 31 12.892 9.488 -35.058 312 HG2 GLN 31 HG2 GLN 31 12.310 11.432 -33.668 313 HG3 GLN 31 HG3 GLN 31 12.489 12.485 -35.152 314 HE21 GLN 31 HE22 GLN 31 10.632 9.275 -34.850 315 HE22 GLN 31 HE21 GLN 31 9.142 10.084 -35.123 316 H PHE 32 H PHE 32 15.917 9.259 -34.240 317 HA PHE 32 HA PHE 32 16.702 7.151 -36.203 318 HB2 PHE 32 HB2 PHE 32 17.653 7.977 -33.446 319 HB3 PHE 32 HB3 PHE 32 18.026 6.440 -34.173 320 HD1 PHE 32 HD1 PHE 32 18.485 10.130 -34.743 321 HD2 PHE 32 HD2 PHE 32 19.906 6.111 -35.769 322 HE1 PHE 32 HE1 PHE 32 20.157 11.090 -36.230 323 HE2 PHE 32 HE2 PHE 32 21.546 7.061 -37.218 324 HZ PHE 32 HZ PHE 32 21.762 9.411 -37.540 325 H LYS 33 H LYS 33 15.993 5.346 -35.884 326 HA LYS 33 HA LYS 33 14.502 4.521 -33.458 327 HB2 LYS 33 HB2 LYS 33 13.124 4.352 -35.659 328 HB3 LYS 33 HB3 LYS 33 14.216 3.045 -36.228 329 HG2 LYS 33 HG2 LYS 33 13.621 1.748 -34.174 330 HG3 LYS 33 HG3 LYS 33 12.275 2.861 -34.004 331 HD2 LYS 33 HD2 LYS 33 11.387 2.364 -36.163 332 HD3 LYS 33 HD3 LYS 33 12.762 1.156 -36.444 333 HE2 LYS 33 HE2 LYS 33 11.994 -0.240 -34.762 334 HE3 LYS 33 HE3 LYS 33 10.743 0.769 -34.204 335 HZ1 LYS 33 HZ1 LYS 33 11.124 -0.900 -36.725 336 HZ2 LYS 33 HZ2 LYS 33 10.011 -1.145 -35.634 337 HZ3 LYS 33 HZ3 LYS 33 9.825 0.123 -36.614 338 H ILE 34 H ILE 34 15.179 2.949 -32.388 339 HA ILE 34 HA ILE 34 17.113 1.034 -33.339 340 HB ILE 34 HB ILE 34 19.010 1.487 -31.750 341 HG12 ILE 34 HG12 ILE 34 17.564 4.080 -31.402 342 HG13 ILE 34 HG13 ILE 34 17.771 2.790 -30.102 343 HG21 ILE 34 HG21 ILE 34 18.888 2.226 -34.100 344 HG22 ILE 34 HG22 ILE 34 18.616 3.858 -33.611 345 HG23 ILE 34 HG23 ILE 34 20.116 2.981 -33.129 346 HD11 ILE 34 HD11 ILE 34 20.156 3.247 -30.033 347 HD12 ILE 34 HD12 ILE 34 20.058 4.411 -31.450 348 HD13 ILE 34 HD13 ILE 34 19.324 4.820 -29.943 349 H LYS 35 H LYS 35 18.140 -0.231 -31.303 350 HA LYS 35 HA LYS 35 15.866 -0.884 -29.502 351 HB2 LYS 35 HB2 LYS 35 18.378 -2.336 -30.307 352 HB3 LYS 35 HB3 LYS 35 17.369 -2.761 -28.815 353 HG2 LYS 35 HG2 LYS 35 15.601 -3.378 -30.065 354 HG3 LYS 35 HG3 LYS 35 16.214 -2.455 -31.509 355 HD2 LYS 35 HD2 LYS 35 17.657 -4.098 -32.062 356 HD3 LYS 35 HD3 LYS 35 17.648 -4.940 -30.523 357 HE2 LYS 35 HE2 LYS 35 15.287 -5.672 -31.177 358 HE3 LYS 35 HE3 LYS 35 15.500 -4.748 -32.647 359 HZ1 LYS 35 HZ1 LYS 35 15.978 -7.252 -32.857 360 HZ2 LYS 35 HZ2 LYS 35 17.023 -6.465 -33.538 361 HZ3 LYS 35 HZ3 LYS 35 17.296 -7.198 -32.123 362 H ARG 36 H ARG 36 16.051 -1.050 -27.368 363 HA ARG 36 HA ARG 36 17.342 1.199 -26.243 364 HB2 ARG 36 HB2 ARG 36 16.395 -1.419 -24.872 365 HB3 ARG 36 HB3 ARG 36 16.985 -0.054 -23.881 366 HG2 ARG 36 HG2 ARG 36 15.173 1.403 -24.842 367 HG3 ARG 36 HG3 ARG 36 14.667 -0.110 -25.843 368 HD2 ARG 36 HD2 ARG 36 13.333 0.075 -23.831 369 HD3 ARG 36 HD3 ARG 36 14.314 -1.299 -23.672 370 HE ARG 36 HE ARG 36 15.516 -0.423 -21.960 371 HH11 ARG 36 HH11 ARG 36 13.657 2.316 -23.259 372 HH12 ARG 36 HH12 ARG 36 14.291 3.264 -21.899 373 HH21 ARG 36 HH21 ARG 36 15.737 0.851 -20.104 374 HH22 ARG 36 HH22 ARG 36 14.833 2.342 -20.124 375 H HIS 37 H HIS 37 18.834 -1.934 -26.436 376 HA HIS 37 HA HIS 37 21.258 -0.750 -25.280 377 HB2 HIS 37 HB2 HIS 37 22.141 -3.035 -25.255 378 HB3 HIS 37 HB3 HIS 37 20.504 -3.101 -24.719 379 HD2 HIS 37 HD2 HIS 37 22.694 -4.893 -26.878 380 HE1 HIS 37 HE1 HIS 37 18.769 -5.744 -28.387 381 HE2 HIS 37 HE2 HIS 37 21.154 -6.650 -28.345 382 H THR 38 H THR 38 20.388 -0.288 -28.399 383 HA THR 38 HA THR 38 22.756 -1.183 -29.713 384 HB THR 38 HB THR 38 20.762 1.022 -30.386 385 HG1 THR 38 HG1 THR 38 20.551 -1.623 -30.634 386 HG21 THR 38 HG21 THR 38 21.431 1.051 -32.793 387 HG22 THR 38 HG22 THR 38 22.770 1.280 -31.705 388 HG23 THR 38 HG23 THR 38 22.622 -0.239 -32.475 389 HA PRO 39 HA PRO 39 25.645 1.889 -28.090 390 HB2 PRO 39 HB2 PRO 39 27.567 1.645 -29.929 391 HB3 PRO 39 HB3 PRO 39 27.093 0.367 -28.701 392 HG2 PRO 39 HG2 PRO 39 26.189 0.529 -31.685 393 HG3 PRO 39 HG3 PRO 39 27.217 -0.692 -30.939 394 HD2 PRO 39 HD2 PRO 39 24.428 -0.876 -30.997 395 HD3 PRO 39 HD3 PRO 39 25.379 -1.382 -29.586 396 H LEU 40 H LEU 40 25.716 3.837 -28.324 397 HA LEU 40 HA LEU 40 24.350 5.240 -30.478 398 HB2 LEU 40 HB2 LEU 40 25.885 6.250 -27.902 399 HB3 LEU 40 HB3 LEU 40 25.263 7.357 -29.021 400 HG LEU 40 HG LEU 40 23.552 5.268 -27.646 401 HD11 LEU 40 HD11 LEU 40 24.199 7.257 -26.066 402 HD12 LEU 40 HD12 LEU 40 23.025 8.179 -26.950 403 HD13 LEU 40 HD13 LEU 40 22.567 6.672 -26.162 404 HD21 LEU 40 HD21 LEU 40 22.449 5.544 -29.558 405 HD22 LEU 40 HD22 LEU 40 21.741 6.764 -28.590 406 HD23 LEU 40 HD23 LEU 40 22.888 7.246 -29.858 407 H SER 41 H SER 41 27.490 4.143 -30.133 408 HA SER 41 HA SER 41 29.025 5.968 -31.584 409 HB2 SER 41 HB2 SER 41 30.316 3.946 -32.271 410 HB3 SER 41 HB3 SER 41 29.913 3.861 -30.623 411 HG SER 41 HG SER 41 29.429 1.823 -31.584 412 H LYS 42 H LYS 42 26.699 3.496 -32.746 413 HA LYS 42 HA LYS 42 26.988 3.871 -35.576 414 HB2 LYS 42 HB2 LYS 42 24.927 2.407 -33.915 415 HB3 LYS 42 HB3 LYS 42 24.896 2.605 -35.672 416 HG2 LYS 42 HG2 LYS 42 26.960 1.445 -35.941 417 HG3 LYS 42 HG3 LYS 42 27.418 1.719 -34.195 418 HD2 LYS 42 HD2 LYS 42 25.556 0.016 -33.695 419 HD3 LYS 42 HD3 LYS 42 25.176 -0.118 -35.303 420 HE2 LYS 42 HE2 LYS 42 27.599 -0.932 -35.726 421 HE3 LYS 42 HE3 LYS 42 27.875 -0.923 -34.057 422 HZ1 LYS 42 HZ1 LYS 42 26.291 -2.848 -33.971 423 HZ2 LYS 42 HZ2 LYS 42 25.488 -2.269 -35.279 424 HZ3 LYS 42 HZ3 LYS 42 26.948 -3.047 -35.344 425 H LEU 43 H LEU 43 24.767 5.201 -33.210 426 HA LEU 43 HA LEU 43 23.268 6.712 -35.199 427 HB2 LEU 43 HB2 LEU 43 22.313 6.227 -32.926 428 HB3 LEU 43 HB3 LEU 43 23.531 6.949 -32.070 429 HG LEU 43 HG LEU 43 21.975 8.795 -33.943 430 HD11 LEU 43 HD11 LEU 43 21.131 8.147 -31.148 431 HD12 LEU 43 HD12 LEU 43 20.348 9.209 -32.272 432 HD13 LEU 43 HD13 LEU 43 20.261 7.453 -32.572 433 HD21 LEU 43 HD21 LEU 43 23.080 9.034 -31.138 434 HD22 LEU 43 HD22 LEU 43 23.996 9.588 -32.550 435 HD23 LEU 43 HD23 LEU 43 22.582 10.470 -32.194 436 H MET 44 H MET 44 26.242 7.424 -33.443 437 HA MET 44 HA MET 44 26.318 10.248 -34.311 438 HB2 MET 44 HB2 MET 44 28.535 8.564 -33.034 439 HB3 MET 44 HB3 MET 44 28.673 10.206 -33.483 440 HG2 MET 44 HG2 MET 44 26.594 10.843 -32.003 441 HG3 MET 44 HG3 MET 44 26.552 9.143 -31.671 442 HE1 MET 44 HE1 MET 44 29.239 8.466 -29.117 443 HE2 MET 44 HE2 MET 44 28.212 7.729 -30.267 444 HE3 MET 44 HE3 MET 44 29.865 8.116 -30.708 445 H LYS 45 H LYS 45 27.827 7.293 -35.308 446 HA LYS 45 HA LYS 45 29.166 8.216 -37.647 447 HB2 LYS 45 HB2 LYS 45 27.804 5.639 -36.598 448 HB3 LYS 45 HB3 LYS 45 28.374 5.730 -38.252 449 HG2 LYS 45 HG2 LYS 45 30.535 6.253 -37.555 450 HG3 LYS 45 HG3 LYS 45 30.107 6.334 -35.838 451 HD2 LYS 45 HD2 LYS 45 31.057 3.934 -36.350 452 HD3 LYS 45 HD3 LYS 45 29.468 4.021 -35.593 453 HE2 LYS 45 HE2 LYS 45 28.311 3.558 -37.475 454 HE3 LYS 45 HE3 LYS 45 29.739 3.799 -38.481 455 HZ1 LYS 45 HZ1 LYS 45 28.898 1.415 -37.653 456 HZ2 LYS 45 HZ2 LYS 45 30.455 1.814 -38.059 457 HZ3 LYS 45 HZ3 LYS 45 30.019 1.767 -36.489 458 H ALA 46 H ALA 46 25.784 7.017 -37.334 459 HA ALA 46 HA ALA 46 25.479 7.283 -40.147 460 HB1 ALA 46 HB1 ALA 46 23.652 6.733 -37.873 461 HB2 ALA 46 HB2 ALA 46 22.999 6.753 -39.472 462 HB3 ALA 46 HB3 ALA 46 24.300 5.621 -39.040 463 H TYR 47 H TYR 47 24.806 9.488 -37.440 464 HA TYR 47 HA TYR 47 23.193 11.387 -38.945 465 HB2 TYR 47 HB2 TYR 47 23.347 11.618 -36.419 466 HB3 TYR 47 HB3 TYR 47 25.096 11.791 -36.610 467 HD1 TYR 47 HD1 TYR 47 21.731 13.280 -37.489 468 HD2 TYR 47 HD2 TYR 47 25.865 14.221 -36.772 469 HE1 TYR 47 HE1 TYR 47 21.197 15.683 -37.624 470 HE2 TYR 47 HE2 TYR 47 25.356 16.586 -36.938 471 HH TYR 47 HH TYR 47 22.126 17.805 -37.679 472 H CYS 48 H CYS 48 26.783 10.973 -38.356 473 HA CYS 48 HA CYS 48 27.742 13.322 -39.793 474 HB2 CYS 48 HB2 CYS 48 28.913 11.855 -38.022 475 HB3 CYS 48 HB3 CYS 48 29.233 10.812 -39.363 476 HG CYS 48 HG CYS 48 30.851 11.833 -40.463 477 H GLU 49 H GLU 49 26.821 10.124 -41.170 478 HA GLU 49 HA GLU 49 27.745 10.735 -43.739 479 HB2 GLU 49 HB2 GLU 49 25.880 8.630 -42.528 480 HB3 GLU 49 HB3 GLU 49 26.144 8.652 -44.260 481 HG2 GLU 49 HG2 GLU 49 28.403 8.511 -42.301 482 HG3 GLU 49 HG3 GLU 49 27.617 7.024 -42.815 483 H ARG 50 H ARG 50 25.166 11.876 -42.085 484 HA ARG 50 HA ARG 50 23.632 12.838 -44.483 485 HB2 ARG 50 HB2 ARG 50 22.847 12.712 -41.540 486 HB3 ARG 50 HB3 ARG 50 22.080 13.828 -42.645 487 HG2 ARG 50 HG2 ARG 50 21.564 11.896 -44.197 488 HG3 ARG 50 HG3 ARG 50 22.384 10.810 -43.142 489 HD2 ARG 50 HD2 ARG 50 20.737 10.927 -41.430 490 HD3 ARG 50 HD3 ARG 50 19.948 12.363 -42.228 491 HE ARG 50 HE ARG 50 19.893 9.581 -43.191 492 HH11 ARG 50 HH11 ARG 50 18.860 12.817 -44.068 493 HH12 ARG 50 HH12 ARG 50 17.649 12.095 -45.078 494 HH21 ARG 50 HH21 ARG 50 18.222 8.898 -44.330 495 HH22 ARG 50 HH22 ARG 50 17.275 10.076 -45.243 496 H GLN 51 H GLN 51 25.961 13.913 -42.127 497 HA GLN 51 HA GLN 51 25.620 16.707 -43.167 498 HB2 GLN 51 HB2 GLN 51 27.453 15.967 -40.891 499 HB3 GLN 51 HB3 GLN 51 26.932 17.504 -41.353 500 HG2 GLN 51 HG2 GLN 51 25.285 15.356 -39.912 501 HG3 GLN 51 HG3 GLN 51 25.549 17.031 -39.357 502 HE21 GLN 51 HE22 GLN 51 24.852 18.524 -41.257 503 HE22 GLN 51 HE21 GLN 51 23.080 18.324 -41.408 504 H GLY 52 H GLY 52 27.840 14.154 -43.730 505 HA2 GLY 52 HA2 GLY 52 29.448 14.140 -45.496 506 HA3 GLY 52 HA3 GLY 52 28.900 15.793 -45.801 507 H LEU 53 H LEU 53 30.046 15.486 -42.542 508 HA LEU 53 HA LEU 53 32.563 17.096 -43.141 509 HB2 LEU 53 HB2 LEU 53 31.059 16.438 -40.719 510 HB3 LEU 53 HB3 LEU 53 32.552 17.398 -40.934 511 HG LEU 53 HG LEU 53 29.990 18.244 -42.403 512 HD11 LEU 53 HD11 LEU 53 30.558 18.583 -39.481 513 HD12 LEU 53 HD12 LEU 53 29.530 19.727 -40.308 514 HD13 LEU 53 HD13 LEU 53 28.944 18.138 -40.159 515 HD21 LEU 53 HD21 LEU 53 31.033 20.520 -42.008 516 HD22 LEU 53 HD22 LEU 53 32.480 19.641 -41.562 517 HD23 LEU 53 HD23 LEU 53 31.960 19.392 -43.060 518 H SER 54 H SER 54 34.477 16.543 -42.449 519 HA SER 54 HA SER 54 35.321 13.884 -41.853 520 HB2 SER 54 HB2 SER 54 36.933 15.573 -42.353 521 HB3 SER 54 HB3 SER 54 36.467 16.611 -40.976 522 HG SER 54 HG SER 54 38.388 15.404 -40.385 523 H MET 55 H MET 55 34.260 12.738 -40.263 524 HA MET 55 HA MET 55 32.764 13.732 -38.153 525 HB2 MET 55 HB2 MET 55 32.732 11.385 -39.023 526 HB3 MET 55 HB3 MET 55 34.261 11.050 -38.246 527 HG2 MET 55 HG2 MET 55 33.081 11.521 -36.053 528 HG3 MET 55 HG3 MET 55 31.579 11.893 -36.999 529 HE1 MET 55 HE1 MET 55 31.115 8.311 -35.168 530 HE2 MET 55 HE2 MET 55 32.422 9.505 -34.758 531 HE3 MET 55 HE3 MET 55 30.783 10.112 -34.960 532 H ARG 56 H ARG 56 36.284 13.479 -38.018 533 HA ARG 56 HA ARG 56 36.825 13.441 -35.431 534 HB2 ARG 56 HB2 ARG 56 38.152 13.657 -37.622 535 HB3 ARG 56 HB3 ARG 56 38.226 15.432 -37.357 536 HG2 ARG 56 HG2 ARG 56 39.236 15.309 -35.174 537 HG3 ARG 56 HG3 ARG 56 39.250 13.616 -35.181 538 HD2 ARG 56 HD2 ARG 56 40.742 13.378 -36.944 539 HD3 ARG 56 HD3 ARG 56 40.620 15.003 -37.481 540 HE ARG 56 HE ARG 56 41.834 13.988 -34.943 541 HH11 ARG 56 HH11 ARG 56 41.422 16.712 -37.204 542 HH12 ARG 56 HH12 ARG 56 42.279 17.792 -36.123 543 HH21 ARG 56 HH21 ARG 56 43.309 15.543 -33.877 544 HH22 ARG 56 HH22 ARG 56 43.466 17.100 -34.602 545 H GLN 57 H GLN 57 35.563 16.292 -37.439 546 HA GLN 57 HA GLN 57 36.306 18.465 -35.753 547 HB2 GLN 57 HB2 GLN 57 36.141 18.525 -38.182 548 HB3 GLN 57 HB3 GLN 57 34.410 18.172 -38.059 549 HG2 GLN 57 HG2 GLN 57 33.933 20.359 -37.078 550 HG3 GLN 57 HG3 GLN 57 35.589 20.782 -36.928 551 HE21 GLN 57 HE22 GLN 57 33.810 22.503 -38.470 552 HE22 GLN 57 HE21 GLN 57 34.335 22.423 -40.092 553 H ILE 58 H ILE 58 33.439 16.460 -35.715 554 HA ILE 58 HA ILE 58 31.828 18.540 -34.346 555 HB ILE 58 HB ILE 58 29.975 17.498 -35.001 556 HG12 ILE 58 HG12 ILE 58 31.232 14.974 -35.934 557 HG13 ILE 58 HG13 ILE 58 30.244 15.204 -34.462 558 HG21 ILE 58 HG21 ILE 58 31.368 18.630 -36.809 559 HG22 ILE 58 HG22 ILE 58 31.803 16.952 -37.329 560 HG23 ILE 58 HG23 ILE 58 30.085 17.558 -37.328 561 HD11 ILE 58 HD11 ILE 58 28.281 15.624 -35.671 562 HD12 ILE 58 HD12 ILE 58 29.109 15.548 -37.213 563 HD13 ILE 58 HD13 ILE 58 29.152 14.141 -36.151 564 H ARG 59 H ARG 59 30.284 17.820 -32.531 565 HA ARG 59 HA ARG 59 31.413 15.778 -30.719 566 HB2 ARG 59 HB2 ARG 59 31.287 18.649 -29.996 567 HB3 ARG 59 HB3 ARG 59 31.451 17.344 -28.809 568 HG2 ARG 59 HG2 ARG 59 33.439 17.865 -30.954 569 HG3 ARG 59 HG3 ARG 59 33.607 18.276 -29.305 570 HD2 ARG 59 HD2 ARG 59 33.590 15.819 -28.606 571 HD3 ARG 59 HD3 ARG 59 33.545 15.426 -30.348 572 HE ARG 59 HE ARG 59 35.902 16.328 -28.873 573 HH11 ARG 59 HH11 ARG 59 34.494 16.026 -32.023 574 HH12 ARG 59 HH12 ARG 59 35.993 16.583 -32.818 575 HH21 ARG 59 HH21 ARG 59 37.694 16.449 -29.866 576 HH22 ARG 59 HH22 ARG 59 37.987 16.760 -31.609 577 H PHE 60 H PHE 60 29.635 14.730 -30.317 578 HA PHE 60 HA PHE 60 26.903 15.859 -30.159 579 HB2 PHE 60 HB2 PHE 60 28.035 13.077 -29.661 580 HB3 PHE 60 HB3 PHE 60 26.353 13.438 -29.771 581 HD1 PHE 60 HD1 PHE 60 29.530 12.963 -31.899 582 HD2 PHE 60 HD2 PHE 60 25.245 13.806 -31.860 583 HE1 PHE 60 HE1 PHE 60 29.474 12.668 -34.292 584 HE2 PHE 60 HE2 PHE 60 25.164 13.155 -34.299 585 HZ PHE 60 HZ PHE 60 27.336 12.665 -35.481 586 H ARG 61 H ARG 61 25.789 16.340 -28.430 587 HA ARG 61 HA ARG 61 26.649 15.582 -25.703 588 HB2 ARG 61 HB2 ARG 61 26.070 18.372 -26.562 589 HB3 ARG 61 HB3 ARG 61 26.214 17.899 -24.924 590 HG2 ARG 61 HG2 ARG 61 28.655 17.194 -25.074 591 HG3 ARG 61 HG3 ARG 61 28.612 17.681 -26.725 592 HD2 ARG 61 HD2 ARG 61 27.961 20.014 -26.014 593 HD3 ARG 61 HD3 ARG 61 28.220 19.528 -24.380 594 HE ARG 61 HE ARG 61 30.555 18.636 -25.555 595 HH11 ARG 61 HH11 ARG 61 29.089 21.816 -25.333 596 HH12 ARG 61 HH12 ARG 61 30.591 22.607 -25.602 597 HH21 ARG 61 HH21 ARG 61 32.467 19.682 -25.984 598 HH22 ARG 61 HH22 ARG 61 32.438 21.439 -25.837 599 H PHE 62 H PHE 62 25.239 15.539 -24.197 600 HA PHE 62 HA PHE 62 22.299 16.149 -24.565 601 HB2 PHE 62 HB2 PHE 62 22.680 13.860 -25.401 602 HB3 PHE 62 HB3 PHE 62 23.551 13.570 -23.855 603 HD1 PHE 62 HD2 PHE 62 20.181 14.735 -25.126 604 HD2 PHE 62 HD1 PHE 62 22.192 12.509 -22.101 605 HE1 PHE 62 HE2 PHE 62 18.008 14.412 -23.936 606 HE2 PHE 62 HE1 PHE 62 20.078 12.115 -20.929 607 HZ PHE 62 HZ PHE 62 17.927 12.990 -22.074 608 H ASP 63 H ASP 63 21.562 17.268 -22.959 609 HA ASP 63 HA ASP 63 21.455 18.315 -21.034 610 HB2 ASP 63 HB2 ASP 63 21.111 16.018 -20.079 611 HB3 ASP 63 HB3 ASP 63 22.748 16.045 -19.620 612 H GLY 64 H GLY 64 23.789 18.827 -22.839 613 HA2 GLY 64 HA2 GLY 64 25.731 19.916 -22.896 614 HA3 GLY 64 HA3 GLY 64 25.584 20.204 -21.144 615 H GLN 65 H GLN 65 25.564 17.069 -21.869 616 HA GLN 65 HA GLN 65 28.376 16.738 -21.031 617 HB2 GLN 65 HB2 GLN 65 26.350 14.565 -20.630 618 HB3 GLN 65 HB3 GLN 65 27.877 14.736 -19.786 619 HG2 GLN 65 HG2 GLN 65 25.598 16.687 -19.514 620 HG3 GLN 65 HG3 GLN 65 26.034 15.443 -18.264 621 HE21 GLN 65 HE22 GLN 65 25.922 18.422 -18.135 622 HE22 GLN 65 HE21 GLN 65 27.481 18.931 -17.541 623 HA PRO 66 HA PRO 66 29.356 14.879 -24.820 624 HB2 PRO 66 HB2 PRO 66 31.695 13.488 -23.549 625 HB3 PRO 66 HB3 PRO 66 31.736 14.737 -24.813 626 HG2 PRO 66 HG2 PRO 66 32.436 15.390 -22.288 627 HG3 PRO 66 HG3 PRO 66 31.799 16.500 -23.493 628 HD2 PRO 66 HD2 PRO 66 30.498 15.269 -21.112 629 HD3 PRO 66 HD3 PRO 66 30.188 16.794 -21.867 630 H ILE 67 H ILE 67 29.093 13.090 -26.094 631 HA ILE 67 HA ILE 67 28.086 10.844 -24.655 632 HB ILE 67 HB ILE 67 27.742 11.707 -27.596 633 HG12 ILE 67 HG12 ILE 67 25.495 11.033 -25.598 634 HG13 ILE 67 HG13 ILE 67 26.375 12.433 -25.327 635 HG21 ILE 67 HG21 ILE 67 27.800 9.129 -27.609 636 HG22 ILE 67 HG22 ILE 67 26.471 9.169 -26.440 637 HG23 ILE 67 HG23 ILE 67 26.259 9.901 -28.035 638 HD11 ILE 67 HD11 ILE 67 24.620 13.144 -26.445 639 HD12 ILE 67 HD12 ILE 67 25.789 13.096 -27.691 640 HD13 ILE 67 HD13 ILE 67 24.563 11.735 -27.515 641 H ASN 68 H ASN 68 29.110 8.815 -24.642 642 HA ASN 68 HA ASN 68 31.693 8.374 -26.049 643 HB2 ASN 68 HB2 ASN 68 30.207 6.597 -23.950 644 HB3 ASN 68 HB3 ASN 68 31.796 6.344 -24.616 645 HD21 ASN 68 HD22 ASN 68 30.081 7.986 -22.146 646 HD22 ASN 68 HD21 ASN 68 31.477 8.785 -21.523 647 H GLU 69 H GLU 69 32.259 6.738 -27.315 648 HA GLU 69 HA GLU 69 30.265 5.443 -29.148 649 HB2 GLU 69 HB2 GLU 69 33.190 4.890 -28.498 650 HB3 GLU 69 HB3 GLU 69 32.290 3.692 -29.378 651 HG2 GLU 69 HG2 GLU 69 31.559 5.520 -31.025 652 HG3 GLU 69 HG3 GLU 69 32.415 6.630 -30.149 653 H THR 70 H THR 70 31.524 4.636 -25.965 654 HA THR 70 HA THR 70 30.307 2.004 -25.896 655 HB THR 70 HB THR 70 30.915 2.232 -23.443 656 HG1 THR 70 HG1 THR 70 30.954 4.116 -23.004 657 HG21 THR 70 HG21 THR 70 33.391 3.023 -25.085 658 HG22 THR 70 HG22 THR 70 33.230 1.633 -23.920 659 HG23 THR 70 HG23 THR 70 32.506 1.485 -25.493 660 H ASP 71 H ASP 71 28.868 5.141 -25.665 661 HA ASP 71 HA ASP 71 26.984 4.409 -23.475 662 HB2 ASP 71 HB2 ASP 71 27.259 6.862 -25.164 663 HB3 ASP 71 HB3 ASP 71 25.781 6.596 -24.267 664 H THR 72 H THR 72 24.655 4.329 -23.721 665 HA THR 72 HA THR 72 23.596 3.381 -26.384 666 HB THR 72 HB THR 72 22.467 1.609 -25.352 667 HG1 THR 72 HG1 THR 72 22.465 1.064 -23.327 668 HG21 THR 72 HG21 THR 72 24.089 0.007 -24.873 669 HG22 THR 72 HG22 THR 72 24.866 1.081 -25.823 670 HG23 THR 72 HG23 THR 72 25.251 1.309 -24.087 671 HA PRO 73 HA PRO 73 19.893 5.793 -24.855 672 HB2 PRO 73 HB2 PRO 73 18.455 3.265 -25.247 673 HB3 PRO 73 HB3 PRO 73 17.974 4.968 -25.731 674 HG2 PRO 73 HG2 PRO 73 18.851 3.065 -27.452 675 HG3 PRO 73 HG3 PRO 73 19.296 4.717 -27.793 676 HD2 PRO 73 HD2 PRO 73 20.962 2.521 -26.674 677 HD3 PRO 73 HD3 PRO 73 21.545 3.824 -27.620 678 H ALA 74 H ALA 74 20.166 2.347 -23.720 679 HA ALA 74 HA ALA 74 19.001 3.027 -21.172 680 HB1 ALA 74 HB1 ALA 74 19.137 0.621 -20.921 681 HB2 ALA 74 HB2 ALA 74 18.668 0.885 -22.562 682 HB3 ALA 74 HB3 ALA 74 20.424 0.608 -22.127 683 H GLN 75 H GLN 75 22.175 3.339 -22.107 684 HA GLN 75 HA GLN 75 23.299 3.433 -19.437 685 HB2 GLN 75 HB2 GLN 75 24.600 2.486 -21.238 686 HB3 GLN 75 HB3 GLN 75 24.328 4.110 -22.099 687 HG2 GLN 75 HG2 GLN 75 26.552 3.765 -21.323 688 HG3 GLN 75 HG3 GLN 75 25.756 5.193 -20.592 689 HE21 GLN 75 HE22 GLN 75 26.921 5.400 -18.745 690 HE22 GLN 75 HE21 GLN 75 26.935 4.213 -17.463 691 H LEU 76 H LEU 76 22.267 5.977 -21.711 692 HA LEU 76 HA LEU 76 22.765 7.999 -19.833 693 HB2 LEU 76 HB2 LEU 76 21.814 7.684 -22.612 694 HB3 LEU 76 HB3 LEU 76 21.789 9.250 -21.817 695 HG LEU 76 HG LEU 76 24.272 7.525 -22.400 696 HD11 LEU 76 HD11 LEU 76 24.825 9.033 -24.028 697 HD12 LEU 76 HD12 LEU 76 23.094 8.885 -24.226 698 HD13 LEU 76 HD13 LEU 76 23.632 10.340 -23.426 699 HD21 LEU 76 HD21 LEU 76 24.889 8.430 -20.505 700 HD22 LEU 76 HD22 LEU 76 25.551 9.596 -21.751 701 HD23 LEU 76 HD23 LEU 76 24.149 9.990 -20.773 702 H GLU 77 H GLU 77 20.276 5.796 -19.433 703 HA GLU 77 HA GLU 77 17.974 5.694 -18.960 704 HB2 GLU 77 HB2 GLU 77 18.594 8.338 -17.573 705 HB3 GLU 77 HB3 GLU 77 17.325 7.265 -17.268 706 HG2 GLU 77 HG2 GLU 77 20.270 6.760 -16.798 707 HG3 GLU 77 HG3 GLU 77 19.004 7.229 -15.568 708 H MET 78 H MET 78 18.361 6.576 -21.476 709 HA MET 78 HA MET 78 16.692 8.920 -22.016 710 HB2 MET 78 HB2 MET 78 17.404 7.007 -24.233 711 HB3 MET 78 HB3 MET 78 17.128 8.681 -24.368 712 HG2 MET 78 HG2 MET 78 19.072 9.144 -22.798 713 HG3 MET 78 HG3 MET 78 19.618 7.492 -23.170 714 HE1 MET 78 HE1 MET 78 20.034 11.130 -25.844 715 HE2 MET 78 HE2 MET 78 18.364 10.680 -25.685 716 HE3 MET 78 HE3 MET 78 19.198 11.221 -24.314 717 H GLU 79 H GLU 79 14.998 9.108 -23.170 718 HA GLU 79 HA GLU 79 12.882 7.042 -23.320 719 HB2 GLU 79 HB2 GLU 79 12.318 10.041 -22.370 720 HB3 GLU 79 HB3 GLU 79 11.287 8.625 -22.585 721 HG2 GLU 79 HG2 GLU 79 13.589 8.624 -20.516 722 HG3 GLU 79 HG3 GLU 79 11.799 9.061 -20.256 723 H ASP 80 H ASP 80 11.370 7.433 -24.907 724 HA ASP 80 HA ASP 80 12.552 8.344 -27.194 725 HB2 ASP 80 HB2 ASP 80 9.532 8.309 -26.814 726 HB3 ASP 80 HB3 ASP 80 10.496 8.078 -28.253 727 H GLU 81 H GLU 81 12.055 9.994 -28.609 728 HA GLU 81 HA GLU 81 12.194 12.030 -29.286 729 HB2 GLU 81 HB2 GLU 81 9.736 12.792 -27.523 730 HB3 GLU 81 HB3 GLU 81 10.486 13.844 -28.725 731 HG2 GLU 81 HG2 GLU 81 9.922 12.219 -30.443 732 HG3 GLU 81 HG3 GLU 81 9.225 11.162 -29.182 733 H ASP 82 H ASP 82 13.394 11.406 -26.397 734 HA ASP 82 HA ASP 82 14.447 13.927 -25.595 735 HB2 ASP 82 HB2 ASP 82 15.664 11.208 -25.462 736 HB3 ASP 82 HB3 ASP 82 16.489 12.490 -24.689 737 H THR 83 H THR 83 16.190 15.162 -26.276 738 HA THR 83 HA THR 83 16.958 14.640 -29.173 739 HB THR 83 HB THR 83 16.927 17.365 -27.806 740 HG1 THR 83 HG1 THR 83 14.748 16.685 -27.980 741 HG21 THR 83 HG21 THR 83 16.589 18.105 -30.230 742 HG22 THR 83 HG22 THR 83 18.209 17.337 -29.670 743 HG23 THR 83 HG23 THR 83 17.070 16.481 -30.667 744 H ILE 84 H ILE 84 19.155 14.118 -29.602 745 HA ILE 84 HA ILE 84 21.102 15.057 -27.710 746 HB ILE 84 HB ILE 84 21.213 13.305 -30.257 747 HG12 ILE 84 HG12 ILE 84 21.616 12.494 -27.460 748 HG13 ILE 84 HG13 ILE 84 20.034 12.314 -28.168 749 HG21 ILE 84 HG21 ILE 84 23.498 13.718 -28.314 750 HG22 ILE 84 HG22 ILE 84 23.455 12.723 -29.779 751 HG23 ILE 84 HG23 ILE 84 23.364 14.474 -29.927 752 HD11 ILE 84 HD11 ILE 84 22.316 10.911 -29.566 753 HD12 ILE 84 HD12 ILE 84 21.080 10.081 -28.483 754 HD13 ILE 84 HD13 ILE 84 20.545 10.897 -29.892 755 H ASP 85 H ASP 85 22.335 16.796 -28.057 756 HA ASP 85 HA ASP 85 22.094 18.463 -30.529 757 HB2 ASP 85 HB2 ASP 85 23.520 18.968 -27.808 758 HB3 ASP 85 HB3 ASP 85 23.116 20.162 -29.070 759 H VAL 86 H VAL 86 23.790 19.272 -31.803 760 HA VAL 86 HA VAL 86 26.405 17.885 -31.360 761 HB VAL 86 HB VAL 86 25.119 18.660 -33.948 762 HG11 VAL 86 HG11 VAL 86 27.680 16.919 -33.487 763 HG12 VAL 86 HG12 VAL 86 26.804 17.116 -34.930 764 HG13 VAL 86 HG13 VAL 86 27.592 18.472 -34.203 765 HG21 VAL 86 HG21 VAL 86 23.813 16.921 -33.107 766 HG22 VAL 86 HG22 VAL 86 25.068 16.070 -34.045 767 HG23 VAL 86 HG23 VAL 86 25.235 16.169 -32.229 768 H PHE 87 H PHE 87 28.071 19.309 -31.144 769 HA PHE 87 HA PHE 87 27.808 22.016 -32.234 770 HB2 PHE 87 HB2 PHE 87 29.357 20.908 -29.786 771 HB3 PHE 87 HB3 PHE 87 29.560 22.578 -30.501 772 HD1 PHE 87 HD1 PHE 87 27.261 20.126 -28.756 773 HD2 PHE 87 HD2 PHE 87 27.906 24.203 -30.064 774 HE1 PHE 87 HE1 PHE 87 25.157 20.850 -27.496 775 HE2 PHE 87 HE2 PHE 87 25.830 24.884 -28.697 776 HZ PHE 87 HZ PHE 87 24.656 23.280 -27.317 777 H GLN 88 H GLN 88 30.283 22.745 -32.726 778 HA GLN 88 HA GLN 88 31.864 20.432 -33.758 779 HB2 GLN 88 HB2 GLN 88 32.014 23.206 -34.644 780 HB3 GLN 88 HB3 GLN 88 33.172 22.063 -34.975 781 HG2 GLN 88 HG2 GLN 88 31.477 20.527 -36.061 782 HG3 GLN 88 HG3 GLN 88 30.185 21.567 -35.633 783 HE21 GLN 88 HE22 GLN 88 30.566 20.923 -38.158 784 HE22 GLN 88 HE21 GLN 88 31.303 22.332 -39.106 785 H GLN 89 H GLN 89 34.149 20.786 -33.405 786 HA GLN 89 HA GLN 89 35.192 22.133 -31.010 787 HB2 GLN 89 HB2 GLN 89 35.726 19.851 -31.494 788 HB3 GLN 89 HB3 GLN 89 36.634 20.281 -32.951 789 HG2 GLN 89 HG2 GLN 89 38.176 19.911 -30.965 790 HG3 GLN 89 HG3 GLN 89 38.149 21.601 -31.504 791 HE21 GLN 89 HE22 GLN 89 37.135 19.303 -28.703 792 HE22 GLN 89 HE21 GLN 89 36.890 20.771 -27.802 793 H GLN 90 H GLN 90 36.637 23.782 -31.143 794 HA GLN 90 HA GLN 90 37.504 24.864 -33.827 795 HB2 GLN 90 HB2 GLN 90 36.575 26.523 -31.494 796 HB3 GLN 90 HB3 GLN 90 37.576 27.168 -32.825 797 HG2 GLN 90 HG2 GLN 90 35.355 27.817 -33.097 798 HG3 GLN 90 HG3 GLN 90 35.522 26.572 -34.373 799 HE21 GLN 90 HE22 GLN 90 33.112 26.164 -34.525 800 HE22 GLN 90 HE21 GLN 90 32.597 25.058 -33.279 801 H THR 91 H THR 91 39.470 25.964 -33.877 802 HA THR 91 HA THR 91 41.508 24.912 -32.004 803 HB THR 91 HB THR 91 43.186 25.389 -33.876 804 HG1 THR 91 HG1 THR 91 42.189 26.054 -35.797 805 HG21 THR 91 HG21 THR 91 40.852 23.739 -34.924 806 HG22 THR 91 HG22 THR 91 42.567 23.795 -35.402 807 HG23 THR 91 HG23 THR 91 42.148 23.139 -33.890 808 H GLY 92 H GLY 92 40.257 27.833 -33.463 809 HA2 GLY 92 HA2 GLY 92 40.490 30.110 -32.191 810 HA3 GLY 92 HA3 GLY 92 42.030 29.613 -31.671 811 H GLY 93 H GLY 93 41.077 32.005 -33.250 812 HA2 GLY 93 HA2 GLY 93 42.247 32.098 -35.911 813 HA3 GLY 93 HA3 GLY 93 42.053 33.430 -34.813 814 H VAL 94 H VAL 94 44.075 31.854 -36.600 815 HA VAL 94 HA VAL 94 46.422 31.111 -35.501 816 HB VAL 94 HB VAL 94 46.426 32.688 -37.988 817 HG11 VAL 94 HG11 VAL 94 48.082 30.568 -36.745 818 HG12 VAL 94 HG12 VAL 94 48.233 30.778 -38.424 819 HG13 VAL 94 HG13 VAL 94 48.606 32.196 -37.305 820 HG21 VAL 94 HG21 VAL 94 45.288 29.969 -37.381 821 HG22 VAL 94 HG22 VAL 94 44.782 31.036 -38.592 822 HG23 VAL 94 HG23 VAL 94 46.261 30.315 -38.903 823 H TYR 95 H TYR 95 47.532 32.056 -33.854 824 HA TYR 95 HA TYR 95 48.642 34.634 -33.513 825 HB2 TYR 95 HB2 TYR 95 49.390 31.872 -32.946 826 HB3 TYR 95 HB3 TYR 95 50.389 33.290 -32.527 827 HD1 TYR 95 HD1 TYR 95 48.585 35.151 -31.226 828 HD2 TYR 95 HD2 TYR 95 48.516 30.801 -31.163 829 HE1 TYR 95 HE1 TYR 95 47.213 35.217 -29.181 830 HE2 TYR 95 HE2 TYR 95 47.182 30.946 -29.036 831 HH TYR 95 HH TYR 95 46.650 34.001 -27.349 Start of MODEL 15 1 H1 ACE 36 HH32 ACE 36 10.055 16.093 -43.990 2 H2 ACE 36 HH33 ACE 36 10.016 14.998 -42.630 3 H3 ACE 36 HH31 ACE 36 11.572 15.527 -43.351 4 H GLU 37 H GLU 37 11.383 15.506 -45.907 5 HA GLU 37 HA GLU 37 10.373 13.028 -47.025 6 HB2 GLU 37 HB2 GLU 37 10.626 15.230 -48.184 7 HB3 GLU 37 HB3 GLU 37 12.369 15.059 -48.046 8 HG2 GLU 37 HG2 GLU 37 11.216 14.462 -50.269 9 HG3 GLU 37 HG3 GLU 37 12.473 13.332 -49.555 10 H ASP 38 H ASP 38 13.228 13.913 -45.569 11 HA ASP 38 HA ASP 38 14.482 11.172 -45.643 12 HB2 ASP 38 HB2 ASP 38 15.312 12.409 -47.658 13 HB3 ASP 38 HB3 ASP 38 15.920 13.625 -46.482 14 H ALA 39 H ALA 39 13.424 12.305 -43.472 15 HA ALA 39 HA ALA 39 15.728 13.138 -41.801 16 HB1 ALA 39 HB1 ALA 39 12.732 13.677 -41.672 17 HB2 ALA 39 HB2 ALA 39 13.680 14.345 -40.451 18 HB3 ALA 39 HB3 ALA 39 14.002 14.902 -42.084 19 H PHE 40 H PHE 40 15.434 10.583 -42.220 20 HA PHE 40 HA PHE 40 14.879 9.510 -39.402 21 HB2 PHE 40 HB2 PHE 40 12.879 9.529 -41.208 22 HB3 PHE 40 HB3 PHE 40 13.594 8.101 -41.787 23 HD1 PHE 40 HD2 PHE 40 14.068 6.130 -39.920 24 HD2 PHE 40 HD1 PHE 40 11.493 9.633 -39.249 25 HE1 PHE 40 HE2 PHE 40 12.856 5.065 -37.855 26 HE2 PHE 40 HE1 PHE 40 10.474 8.545 -37.489 27 HZ PHE 40 HZ PHE 40 11.131 6.180 -36.875 28 H ILE 41 H ILE 41 15.776 7.537 -38.750 29 HA ILE 41 HA ILE 41 17.602 6.447 -40.564 30 HB ILE 41 HB ILE 41 18.768 7.536 -38.024 31 HG12 ILE 41 HG12 ILE 41 20.471 8.635 -39.629 32 HG13 ILE 41 HG13 ILE 41 19.252 8.340 -40.941 33 HG21 ILE 41 HG21 ILE 41 19.851 5.818 -40.249 34 HG22 ILE 41 HG22 ILE 41 20.961 6.682 -39.222 35 HG23 ILE 41 HG23 ILE 41 19.855 5.481 -38.508 36 HD11 ILE 41 HD11 ILE 41 18.084 10.206 -40.227 37 HD12 ILE 41 HD12 ILE 41 18.011 9.578 -38.706 38 HD13 ILE 41 HD13 ILE 41 19.605 10.460 -39.288 39 H VAL 42 H VAL 42 17.986 4.066 -39.792 40 HA VAL 42 HA VAL 42 16.242 3.298 -37.629 41 HB VAL 42 HB VAL 42 16.448 1.733 -40.244 42 HG11 VAL 42 HG11 VAL 42 15.675 0.479 -38.411 43 HG12 VAL 42 HG12 VAL 42 14.374 1.602 -38.066 44 HG13 VAL 42 HG13 VAL 42 14.481 0.840 -39.727 45 HG21 VAL 42 HG21 VAL 42 14.020 3.396 -39.431 46 HG22 VAL 42 HG22 VAL 42 15.141 4.097 -40.571 47 HG23 VAL 42 HG23 VAL 42 14.241 2.576 -40.901 48 H ILE 43 H ILE 43 17.496 1.994 -36.450 49 HA ILE 43 HA ILE 43 19.685 0.250 -37.444 50 HB ILE 43 HB ILE 43 20.390 2.185 -35.226 51 HG12 ILE 43 HG12 ILE 43 21.064 2.448 -38.120 52 HG13 ILE 43 HG13 ILE 43 20.113 3.648 -37.041 53 HG21 ILE 43 HG21 ILE 43 22.273 0.512 -36.929 54 HG22 ILE 43 HG22 ILE 43 22.748 1.414 -35.480 55 HG23 ILE 43 HG23 ILE 43 21.734 0.050 -35.200 56 HD11 ILE 43 HD11 ILE 43 23.050 2.877 -37.260 57 HD12 ILE 43 HD12 ILE 43 22.438 4.335 -37.890 58 HD13 ILE 43 HD13 ILE 43 22.412 4.118 -36.074 59 H SEP 44 H SEP 44 19.670 -1.661 -36.598 60 HA SEP 44 HA SEP 44 19.491 -1.899 -33.611 61 HB2 SEP 44 HB2 SEP 44 18.496 -4.155 -33.880 62 HB3 SEP 44 HB3 SEP 44 17.531 -2.769 -34.581 63 H ASP 45 H ASP 45 20.623 -3.670 -32.644 64 HA ASP 45 HA ASP 45 23.334 -3.790 -34.045 65 HB2 ASP 45 HB2 ASP 45 22.923 -2.762 -31.882 66 HB3 ASP 45 HB3 ASP 45 22.529 -4.343 -31.213 67 H SEP 46 H SEP 46 20.824 -6.014 -34.233 68 HA SEP 46 HA SEP 46 22.652 -8.338 -34.095 69 HB2 SEP 46 HB2 SEP 46 20.703 -9.797 -33.629 70 HB3 SEP 46 HB3 SEP 46 21.040 -8.780 -32.319 71 H ASP 47 H ASP 47 23.338 -8.086 -36.292 72 HA ASP 47 HA ASP 47 21.502 -8.258 -38.368 73 HB2 ASP 47 HB2 ASP 47 23.760 -7.730 -38.886 74 HB3 ASP 47 HB3 ASP 47 24.402 -9.311 -38.458 75 H GLY 48 H GLY 48 20.640 -10.321 -39.558 76 HA2 GLY 48 HA2 GLY 48 21.023 -12.545 -40.316 77 HA3 GLY 48 HA3 GLY 48 22.041 -12.913 -38.966 78 H GLU 49 H GLU 49 20.248 -14.661 -39.952 79 HA GLU 49 HA GLU 49 18.337 -15.519 -38.141 80 HB2 GLU 49 HB2 GLU 49 19.123 -16.525 -40.398 81 HB3 GLU 49 HB3 GLU 49 20.603 -17.081 -39.580 82 HG2 GLU 49 HG2 GLU 49 18.861 -18.689 -40.135 83 HG3 GLU 49 HG3 GLU 49 19.508 -18.688 -38.495 84 HN1 NH2 50 HN1 NH2 50 18.638 -17.194 -36.583 85 HN2 NH2 50 HN2 NH2 50 20.036 -17.243 -35.459 86 H1 MET 1 H1 MET 1 -11.973 -32.852 -36.752 87 H2 MET 1 H2 MET 1 -11.861 -32.507 -38.304 88 H3 MET 1 H3 MET 1 -13.358 -32.862 -37.739 89 HA MET 1 HA MET 1 -12.934 -30.513 -38.172 90 HB2 MET 1 HB2 MET 1 -14.374 -31.139 -36.250 91 HB3 MET 1 HB3 MET 1 -13.062 -31.084 -35.078 92 HG2 MET 1 HG2 MET 1 -14.237 -29.186 -34.654 93 HG3 MET 1 HG3 MET 1 -12.960 -28.612 -35.700 94 HE1 MET 1 HE1 MET 1 -13.877 -26.608 -36.810 95 HE2 MET 1 HE2 MET 1 -15.564 -26.274 -36.943 96 HE3 MET 1 HE3 MET 1 -14.807 -26.726 -35.333 97 H ALA 2 H ALA 2 -11.657 -28.630 -37.736 98 HA ALA 2 HA ALA 2 -8.794 -29.089 -37.657 99 HB1 ALA 2 HB1 ALA 2 -9.850 -27.782 -39.398 100 HB2 ALA 2 HB2 ALA 2 -10.461 -26.697 -38.260 101 HB3 ALA 2 HB3 ALA 2 -8.703 -26.830 -38.384 102 H ASP 3 H ASP 3 -7.319 -27.755 -36.607 103 HA ASP 3 HA ASP 3 -7.886 -25.908 -34.549 104 HB2 ASP 3 HB2 ASP 3 -8.294 -27.777 -33.175 105 HB3 ASP 3 HB3 ASP 3 -6.719 -28.536 -33.520 106 H GLU 4 H GLU 4 -6.157 -24.827 -33.569 107 HA GLU 4 HA GLU 4 -3.411 -25.150 -34.700 108 HB2 GLU 4 HB2 GLU 4 -4.558 -24.260 -36.485 109 HB3 GLU 4 HB3 GLU 4 -5.369 -22.999 -35.557 110 HG2 GLU 4 HG2 GLU 4 -3.329 -21.825 -35.310 111 HG3 GLU 4 HG3 GLU 4 -2.383 -23.207 -35.945 112 H LYS 5 H LYS 5 -1.880 -24.057 -33.610 113 HA LYS 5 HA LYS 5 -2.173 -23.685 -30.815 114 HB2 LYS 5 HB2 LYS 5 -0.139 -24.049 -32.150 115 HB3 LYS 5 HB3 LYS 5 -0.303 -22.395 -32.599 116 HG2 LYS 5 HG2 LYS 5 -0.169 -21.506 -30.340 117 HG3 LYS 5 HG3 LYS 5 0.443 -23.138 -29.748 118 HD2 LYS 5 HD2 LYS 5 2.193 -22.900 -31.584 119 HD3 LYS 5 HD3 LYS 5 1.596 -21.303 -31.818 120 HE2 LYS 5 HE2 LYS 5 3.011 -22.353 -29.319 121 HE3 LYS 5 HE3 LYS 5 3.622 -21.254 -30.395 122 HZ1 LYS 5 HZ1 LYS 5 2.846 -19.910 -28.724 123 HZ2 LYS 5 HZ2 LYS 5 1.659 -19.716 -29.746 124 HZ3 LYS 5 HZ3 LYS 5 1.404 -20.689 -28.461 125 HA PRO 6 HA PRO 6 -4.127 -19.927 -30.347 126 HB2 PRO 6 HB2 PRO 6 -3.893 -19.450 -27.623 127 HB3 PRO 6 HB3 PRO 6 -5.057 -20.631 -28.256 128 HG2 PRO 6 HG2 PRO 6 -2.139 -21.067 -27.546 129 HG3 PRO 6 HG3 PRO 6 -3.550 -21.997 -26.856 130 HD2 PRO 6 HD2 PRO 6 -1.842 -22.784 -28.782 131 HD3 PRO 6 HD3 PRO 6 -3.656 -23.026 -29.000 132 H LYS 7 H LYS 7 -3.690 -17.698 -30.341 133 HA LYS 7 HA LYS 7 -0.990 -17.038 -30.746 134 HB2 LYS 7 HB2 LYS 7 -2.917 -15.922 -31.840 135 HB3 LYS 7 HB3 LYS 7 -3.434 -15.287 -30.270 136 HG2 LYS 7 HG2 LYS 7 -1.379 -13.875 -30.173 137 HG3 LYS 7 HG3 LYS 7 -0.779 -14.551 -31.670 138 HD2 LYS 7 HD2 LYS 7 -2.600 -13.534 -32.989 139 HD3 LYS 7 HD3 LYS 7 -3.370 -13.005 -31.499 140 HE2 LYS 7 HE2 LYS 7 -1.228 -11.585 -31.099 141 HE3 LYS 7 HE3 LYS 7 -0.507 -12.457 -32.341 142 HZ1 LYS 7 HZ1 LYS 7 -1.493 -10.133 -33.019 143 HZ2 LYS 7 HZ2 LYS 7 -1.896 -11.257 -33.980 144 HZ3 LYS 7 HZ3 LYS 7 -2.874 -10.739 -32.677 145 H GLU 8 H GLU 8 0.434 -16.637 -29.506 146 HA GLU 8 HA GLU 8 0.149 -15.544 -26.789 147 HB2 GLU 8 HB2 GLU 8 2.185 -16.526 -26.179 148 HB3 GLU 8 HB3 GLU 8 1.469 -17.663 -27.364 149 HG2 GLU 8 HG2 GLU 8 2.953 -16.573 -29.082 150 HG3 GLU 8 HG3 GLU 8 3.790 -15.725 -27.834 151 H GLY 9 H GLY 9 1.149 -13.560 -26.276 152 HA2 GLY 9 HA2 GLY 9 2.309 -11.939 -28.369 153 HA3 GLY 9 HA3 GLY 9 1.419 -11.328 -26.889 154 H VAL 10 H VAL 10 3.077 -13.286 -25.405 155 HA VAL 10 HA VAL 10 5.341 -11.429 -24.814 156 HB VAL 10 HB VAL 10 4.372 -13.960 -23.353 157 HG11 VAL 10 HG11 VAL 10 6.674 -13.758 -22.826 158 HG12 VAL 10 HG12 VAL 10 6.637 -11.968 -22.831 159 HG13 VAL 10 HG13 VAL 10 5.913 -12.988 -21.478 160 HG21 VAL 10 HG21 VAL 10 4.016 -11.161 -22.351 161 HG22 VAL 10 HG22 VAL 10 2.803 -12.151 -23.168 162 HG23 VAL 10 HG23 VAL 10 3.456 -12.642 -21.588 163 H LYS 11 H LYS 11 6.739 -11.424 -26.425 164 HA LYS 11 HA LYS 11 8.546 -13.646 -26.199 165 HB2 LYS 11 HB2 LYS 11 6.895 -13.890 -28.441 166 HB3 LYS 11 HB3 LYS 11 7.981 -12.683 -29.053 167 HG2 LYS 11 HG2 LYS 11 10.005 -14.135 -28.722 168 HG3 LYS 11 HG3 LYS 11 8.946 -15.382 -28.168 169 HD2 LYS 11 HD2 LYS 11 7.735 -15.189 -30.374 170 HD3 LYS 11 HD3 LYS 11 8.845 -13.979 -30.865 171 HE2 LYS 11 HE2 LYS 11 10.756 -15.571 -30.637 172 HE3 LYS 11 HE3 LYS 11 9.675 -16.806 -30.110 173 HZ1 LYS 11 HZ1 LYS 11 9.408 -15.554 -32.728 174 HZ2 LYS 11 HZ2 LYS 11 10.061 -17.043 -32.581 175 HZ3 LYS 11 HZ3 LYS 11 8.474 -16.778 -32.169 176 H THR 12 H THR 12 10.691 -13.181 -26.694 177 HA THR 12 HA THR 12 11.685 -10.667 -26.030 178 HB THR 12 HB THR 12 13.886 -11.118 -26.925 179 HG1 THR 12 HG1 THR 12 13.768 -11.956 -28.775 180 HG21 THR 12 HG21 THR 12 13.388 -12.482 -24.891 181 HG22 THR 12 HG22 THR 12 12.539 -13.758 -25.760 182 HG23 THR 12 HG23 THR 12 14.307 -13.460 -26.010 183 H GLU 13 H GLU 13 10.851 -11.635 -29.417 184 HA GLU 13 HA GLU 13 11.901 -9.522 -30.760 185 HB2 GLU 13 HB2 GLU 13 9.483 -11.479 -31.220 186 HB3 GLU 13 HB3 GLU 13 10.200 -10.266 -32.424 187 HG2 GLU 13 HG2 GLU 13 11.510 -12.769 -31.265 188 HG3 GLU 13 HG3 GLU 13 10.922 -12.558 -32.908 189 H ASN 14 H ASN 14 9.088 -9.442 -28.715 190 HA ASN 14 HA ASN 14 7.658 -7.183 -30.133 191 HB2 ASN 14 HB2 ASN 14 7.112 -9.300 -27.893 192 HB3 ASN 14 HB3 ASN 14 5.993 -7.928 -28.422 193 HD21 ASN 14 HD22 ASN 14 5.051 -10.593 -28.618 194 HD22 ASN 14 HD21 ASN 14 5.241 -11.041 -30.285 195 H ASN 15 H ASN 15 10.244 -7.029 -28.310 196 HA ASN 15 HA ASN 15 9.426 -5.050 -26.349 197 HB2 ASN 15 HB2 ASN 15 11.590 -6.265 -26.041 198 HB3 ASN 15 HB3 ASN 15 12.066 -5.934 -27.667 199 HD21 ASN 15 HD22 ASN 15 10.822 -4.178 -24.895 200 HD22 ASN 15 HD21 ASN 15 12.197 -2.989 -24.920 201 H ASP 16 H ASP 16 8.950 -3.036 -26.986 202 HA ASP 16 HA ASP 16 8.892 -1.973 -29.437 203 HB2 ASP 16 HB2 ASP 16 8.811 -0.499 -26.719 204 HB3 ASP 16 HB3 ASP 16 8.147 0.119 -28.194 205 H HIS 17 H HIS 17 10.178 -0.272 -30.478 206 HA HIS 17 HA HIS 17 12.974 -0.080 -29.802 207 HB2 HIS 17 HB2 HIS 17 11.277 1.493 -31.730 208 HB3 HIS 17 HB3 HIS 17 13.094 1.529 -31.618 209 HD2 HIS 17 HD2 HIS 17 14.320 -0.549 -32.616 210 HE1 HIS 17 HE1 HIS 17 10.934 -2.256 -34.483 211 HE2 HIS 17 HE2 HIS 17 13.530 -2.281 -34.311 212 H ILE 18 H ILE 18 14.033 2.221 -29.585 213 HA ILE 18 HA ILE 18 12.393 4.152 -28.079 214 HB ILE 18 HB ILE 18 14.034 3.253 -26.618 215 HG12 ILE 18 HG12 ILE 18 14.804 6.027 -27.677 216 HG13 ILE 18 HG13 ILE 18 13.365 5.815 -26.745 217 HG21 ILE 18 HG21 ILE 18 16.143 3.812 -28.706 218 HG22 ILE 18 HG22 ILE 18 16.547 3.700 -26.897 219 HG23 ILE 18 HG23 ILE 18 15.844 2.373 -27.832 220 HD11 ILE 18 HD11 ILE 18 15.061 6.546 -25.238 221 HD12 ILE 18 HD12 ILE 18 14.933 4.917 -24.931 222 HD13 ILE 18 HD13 ILE 18 16.264 5.536 -26.087 223 H ASN 19 H ASN 19 11.883 5.905 -29.326 224 HA ASN 19 HA ASN 19 13.318 6.472 -31.819 225 HB2 ASN 19 HB2 ASN 19 10.674 7.357 -30.744 226 HB3 ASN 19 HB3 ASN 19 11.492 7.774 -32.246 227 HD21 ASN 19 HD22 ASN 19 10.251 4.892 -30.536 228 HD22 ASN 19 HD21 ASN 19 9.985 4.078 -32.133 229 H LEU 20 H LEU 20 15.336 7.539 -31.109 230 HA LEU 20 HA LEU 20 14.917 9.843 -29.501 231 HB2 LEU 20 HB2 LEU 20 17.313 8.658 -30.948 232 HB3 LEU 20 HB3 LEU 20 17.390 10.168 -30.077 233 HG LEU 20 HG LEU 20 17.116 7.428 -28.921 234 HD11 LEU 20 HD11 LEU 20 19.267 9.590 -28.516 235 HD12 LEU 20 HD12 LEU 20 19.303 7.856 -28.246 236 HD13 LEU 20 HD13 LEU 20 19.329 8.482 -29.910 237 HD21 LEU 20 HD21 LEU 20 17.230 10.027 -27.325 238 HD22 LEU 20 HD22 LEU 20 15.822 8.956 -27.442 239 HD23 LEU 20 HD23 LEU 20 17.318 8.450 -26.606 240 H LYS 21 H LYS 21 15.685 11.922 -30.172 241 HA LYS 21 HA LYS 21 15.569 12.528 -33.117 242 HB2 LYS 21 HB2 LYS 21 14.790 14.229 -30.795 243 HB3 LYS 21 HB3 LYS 21 15.023 14.851 -32.471 244 HG2 LYS 21 HG2 LYS 21 13.064 13.217 -33.179 245 HG3 LYS 21 HG3 LYS 21 12.982 12.815 -31.405 246 HD2 LYS 21 HD2 LYS 21 12.187 14.903 -30.776 247 HD3 LYS 21 HD3 LYS 21 12.580 15.591 -32.400 248 HE2 LYS 21 HE2 LYS 21 10.937 14.264 -33.517 249 HE3 LYS 21 HE3 LYS 21 10.550 13.353 -32.087 250 HZ1 LYS 21 HZ1 LYS 21 10.174 16.300 -32.405 251 HZ2 LYS 21 HZ2 LYS 21 9.003 15.196 -32.548 252 HZ3 LYS 21 HZ3 LYS 21 9.662 15.446 -31.089 253 H VAL 22 H VAL 22 17.203 14.125 -33.946 254 HA VAL 22 HA VAL 22 19.414 15.073 -32.079 255 HB VAL 22 HB VAL 22 19.850 13.820 -34.788 256 HG11 VAL 22 HG11 VAL 22 21.684 15.488 -33.864 257 HG12 VAL 22 HG12 VAL 22 22.127 14.157 -32.733 258 HG13 VAL 22 HG13 VAL 22 22.228 13.964 -34.405 259 HG21 VAL 22 HG21 VAL 22 19.347 11.852 -33.588 260 HG22 VAL 22 HG22 VAL 22 21.114 11.840 -33.877 261 HG23 VAL 22 HG23 VAL 22 20.453 12.214 -32.333 262 H ALA 23 H ALA 23 20.028 17.181 -32.490 263 HA ALA 23 HA ALA 23 19.829 18.099 -35.328 264 HB1 ALA 23 HB1 ALA 23 18.739 20.195 -34.368 265 HB2 ALA 23 HB2 ALA 23 17.760 18.747 -34.498 266 HB3 ALA 23 HB3 ALA 23 18.378 19.171 -32.901 267 H GLY 24 H GLY 24 20.894 19.932 -35.830 268 HA2 GLY 24 HA2 GLY 24 23.041 20.643 -33.915 269 HA3 GLY 24 HA3 GLY 24 23.157 20.770 -35.763 270 H GLN 25 H GLN 25 23.914 22.978 -34.751 271 HA GLN 25 HA GLN 25 21.799 24.570 -33.531 272 HB2 GLN 25 HB2 GLN 25 24.594 25.415 -34.609 273 HB3 GLN 25 HB3 GLN 25 23.604 26.333 -33.549 274 HG2 GLN 25 HG2 GLN 25 25.202 23.755 -33.043 275 HG3 GLN 25 HG3 GLN 25 25.306 25.240 -32.105 276 HE21 GLN 25 HE22 GLN 25 24.265 22.151 -31.408 277 HE22 GLN 25 HE21 GLN 25 22.997 22.766 -30.311 278 H ASP 26 H ASP 26 22.640 24.087 -36.984 279 HA ASP 26 HA ASP 26 21.252 26.349 -38.148 280 HB2 ASP 26 HB2 ASP 26 20.974 25.072 -40.034 281 HB3 ASP 26 HB3 ASP 26 22.574 24.726 -39.327 282 H GLY 27 H GLY 27 20.100 23.514 -36.380 283 HA2 GLY 27 HA2 GLY 27 18.152 23.842 -35.161 284 HA3 GLY 27 HA3 GLY 27 17.289 24.524 -36.432 285 H SER 28 H SER 28 18.417 22.451 -38.400 286 HA SER 28 HA SER 28 15.981 20.977 -38.489 287 HB2 SER 28 HB2 SER 28 16.837 19.604 -40.160 288 HB3 SER 28 HB3 SER 28 16.965 21.282 -40.590 289 HG SER 28 HG SER 28 19.113 21.314 -40.105 290 H VAL 29 H VAL 29 15.263 19.010 -37.944 291 HA VAL 29 HA VAL 29 16.914 17.320 -36.020 292 HB VAL 29 HB VAL 29 13.840 17.726 -36.127 293 HG11 VAL 29 HG11 VAL 29 15.616 16.342 -34.202 294 HG12 VAL 29 HG12 VAL 29 13.910 16.549 -33.972 295 HG13 VAL 29 HG13 VAL 29 14.424 15.631 -35.361 296 HG21 VAL 29 HG21 VAL 29 15.250 19.804 -35.141 297 HG22 VAL 29 HG22 VAL 29 14.044 19.187 -34.113 298 HG23 VAL 29 HG23 VAL 29 15.659 18.662 -33.790 299 H VAL 30 H VAL 30 17.322 15.305 -36.670 300 HA VAL 30 HA VAL 30 15.128 14.019 -38.254 301 HB VAL 30 HB VAL 30 16.584 12.190 -38.705 302 HG11 VAL 30 HG11 VAL 30 16.742 14.388 -40.164 303 HG12 VAL 30 HG12 VAL 30 18.325 14.516 -39.397 304 HG13 VAL 30 HG13 VAL 30 17.883 13.088 -40.405 305 HG21 VAL 30 HG21 VAL 30 18.019 12.259 -36.787 306 HG22 VAL 30 HG22 VAL 30 19.145 12.526 -38.116 307 HG23 VAL 30 HG23 VAL 30 18.602 13.953 -37.184 308 H GLN 31 H GLN 31 14.283 11.853 -37.781 309 HA GLN 31 HA GLN 31 14.708 11.285 -34.785 310 HB2 GLN 31 HB2 GLN 31 12.393 11.729 -35.139 311 HB3 GLN 31 HB3 GLN 31 12.361 10.752 -36.593 312 HG2 GLN 31 HG2 GLN 31 12.523 8.746 -35.349 313 HG3 GLN 31 HG3 GLN 31 13.020 9.569 -33.887 314 HE21 GLN 31 HE22 GLN 31 10.217 8.178 -34.946 315 HE22 GLN 31 HE21 GLN 31 8.962 9.330 -34.327 316 H PHE 32 H PHE 32 15.898 9.682 -34.254 317 HA PHE 32 HA PHE 32 16.739 7.485 -35.945 318 HB2 PHE 32 HB2 PHE 32 17.623 8.961 -33.465 319 HB3 PHE 32 HB3 PHE 32 17.971 7.291 -33.424 320 HD1 PHE 32 HD2 PHE 32 19.555 6.106 -35.128 321 HD2 PHE 32 HD1 PHE 32 18.757 10.330 -35.154 322 HE1 PHE 32 HE2 PHE 32 21.460 6.371 -36.429 323 HE2 PHE 32 HE1 PHE 32 20.746 10.662 -36.646 324 HZ PHE 32 HZ PHE 32 22.137 8.622 -37.353 325 H LYS 33 H LYS 33 15.198 5.731 -35.944 326 HA LYS 33 HA LYS 33 14.044 4.963 -33.253 327 HB2 LYS 33 HB2 LYS 33 12.479 5.008 -35.229 328 HB3 LYS 33 HB3 LYS 33 13.557 3.959 -36.055 329 HG2 LYS 33 HG2 LYS 33 13.078 2.295 -34.074 330 HG3 LYS 33 HG3 LYS 33 11.974 3.434 -33.507 331 HD2 LYS 33 HD2 LYS 33 10.972 3.503 -36.014 332 HD3 LYS 33 HD3 LYS 33 12.089 2.217 -36.332 333 HE2 LYS 33 HE2 LYS 33 10.771 0.670 -34.848 334 HE3 LYS 33 HE3 LYS 33 9.639 2.058 -34.498 335 HZ1 LYS 33 HZ1 LYS 33 9.990 0.797 -37.107 336 HZ2 LYS 33 HZ2 LYS 33 8.596 0.972 -36.182 337 HZ3 LYS 33 HZ3 LYS 33 9.301 2.254 -36.844 338 H ILE 34 H ILE 34 15.473 4.063 -32.054 339 HA ILE 34 HA ILE 34 17.043 1.834 -33.258 340 HB ILE 34 HB ILE 34 18.994 2.300 -31.996 341 HG12 ILE 34 HG12 ILE 34 17.195 4.627 -30.785 342 HG13 ILE 34 HG13 ILE 34 17.945 3.378 -29.827 343 HG21 ILE 34 HG21 ILE 34 18.500 3.439 -34.237 344 HG22 ILE 34 HG22 ILE 34 18.098 4.846 -33.504 345 HG23 ILE 34 HG23 ILE 34 19.792 4.130 -33.186 346 HD11 ILE 34 HD11 ILE 34 19.209 5.466 -29.653 347 HD12 ILE 34 HD12 ILE 34 20.138 4.565 -30.973 348 HD13 ILE 34 HD13 ILE 34 19.073 5.838 -31.362 349 H LYS 35 H LYS 35 17.734 0.119 -31.628 350 HA LYS 35 HA LYS 35 15.650 -0.435 -29.612 351 HB2 LYS 35 HB2 LYS 35 18.040 -2.026 -30.628 352 HB3 LYS 35 HB3 LYS 35 17.139 -2.360 -29.092 353 HG2 LYS 35 HG2 LYS 35 15.127 -2.628 -30.131 354 HG3 LYS 35 HG3 LYS 35 15.879 -2.114 -31.768 355 HD2 LYS 35 HD2 LYS 35 17.285 -4.060 -31.635 356 HD3 LYS 35 HD3 LYS 35 16.687 -4.475 -30.060 357 HE2 LYS 35 HE2 LYS 35 14.553 -5.004 -30.859 358 HE3 LYS 35 HE3 LYS 35 14.803 -4.392 -32.455 359 HZ1 LYS 35 HZ1 LYS 35 16.369 -6.139 -32.926 360 HZ2 LYS 35 HZ2 LYS 35 16.515 -6.648 -31.479 361 HZ3 LYS 35 HZ3 LYS 35 15.074 -6.869 -32.247 362 H ARG 36 H ARG 36 16.033 -0.547 -27.356 363 HA ARG 36 HA ARG 36 17.468 1.573 -26.315 364 HB2 ARG 36 HB2 ARG 36 16.249 -0.689 -24.943 365 HB3 ARG 36 HB3 ARG 36 17.090 0.667 -24.118 366 HG2 ARG 36 HG2 ARG 36 15.547 2.232 -25.303 367 HG3 ARG 36 HG3 ARG 36 14.692 0.960 -25.999 368 HD2 ARG 36 HD2 ARG 36 13.360 1.503 -23.969 369 HD3 ARG 36 HD3 ARG 36 14.062 0.028 -23.816 370 HE ARG 36 HE ARG 36 15.634 1.036 -22.293 371 HH11 ARG 36 HH11 ARG 36 13.185 3.463 -23.275 372 HH12 ARG 36 HH12 ARG 36 14.071 4.571 -22.184 373 HH21 ARG 36 HH21 ARG 36 16.281 2.715 -20.875 374 HH22 ARG 36 HH22 ARG 36 15.533 4.221 -21.060 375 H HIS 37 H HIS 37 18.664 -1.396 -27.181 376 HA HIS 37 HA HIS 37 21.097 -0.988 -25.481 377 HB2 HIS 37 HB2 HIS 37 21.571 -3.366 -25.526 378 HB3 HIS 37 HB3 HIS 37 20.121 -3.077 -24.611 379 HD2 HIS 37 HD2 HIS 37 21.590 -5.228 -27.191 380 HE1 HIS 37 HE1 HIS 37 17.398 -5.797 -27.585 381 HE2 HIS 37 HE2 HIS 37 19.600 -6.857 -28.003 382 H THR 38 H THR 38 20.599 -0.155 -28.531 383 HA THR 38 HA THR 38 22.859 -1.266 -29.853 384 HB THR 38 HB THR 38 20.944 0.807 -30.365 385 HG1 THR 38 HG1 THR 38 20.440 -1.524 -30.646 386 HG21 THR 38 HG21 THR 38 22.914 1.501 -31.723 387 HG22 THR 38 HG22 THR 38 22.969 -0.094 -32.407 388 HG23 THR 38 HG23 THR 38 21.593 0.871 -32.753 389 HA PRO 39 HA PRO 39 25.688 1.927 -28.231 390 HB2 PRO 39 HB2 PRO 39 26.903 1.634 -30.927 391 HB3 PRO 39 HB3 PRO 39 27.717 1.800 -29.348 392 HG2 PRO 39 HG2 PRO 39 27.314 -0.773 -30.504 393 HG3 PRO 39 HG3 PRO 39 27.087 -0.638 -28.754 394 HD2 PRO 39 HD2 PRO 39 25.050 -0.797 -30.953 395 HD3 PRO 39 HD3 PRO 39 25.043 -1.408 -29.316 396 H LEU 40 H LEU 40 25.560 3.906 -28.147 397 HA LEU 40 HA LEU 40 24.578 5.847 -30.286 398 HB2 LEU 40 HB2 LEU 40 26.190 6.537 -27.763 399 HB3 LEU 40 HB3 LEU 40 25.473 7.668 -28.917 400 HG LEU 40 HG LEU 40 23.953 5.831 -27.036 401 HD11 LEU 40 HD11 LEU 40 24.737 8.228 -26.445 402 HD12 LEU 40 HD12 LEU 40 23.340 8.781 -27.491 403 HD13 LEU 40 HD13 LEU 40 22.943 7.795 -26.253 404 HD21 LEU 40 HD21 LEU 40 22.273 5.571 -28.854 405 HD22 LEU 40 HD22 LEU 40 21.859 7.104 -28.085 406 HD23 LEU 40 HD23 LEU 40 22.797 7.011 -29.533 407 H SER 41 H SER 41 27.679 4.388 -29.874 408 HA SER 41 HA SER 41 29.263 5.852 -31.642 409 HB2 SER 41 HB2 SER 41 30.344 3.976 -32.374 410 HB3 SER 41 HB3 SER 41 30.201 3.823 -30.648 411 HG SER 41 HG SER 41 29.702 1.831 -31.496 412 H LYS 42 H LYS 42 26.813 3.412 -32.553 413 HA LYS 42 HA LYS 42 26.974 3.852 -35.260 414 HB2 LYS 42 HB2 LYS 42 24.648 2.679 -33.720 415 HB3 LYS 42 HB3 LYS 42 24.902 2.458 -35.449 416 HG2 LYS 42 HG2 LYS 42 27.237 1.478 -34.819 417 HG3 LYS 42 HG3 LYS 42 26.542 1.305 -33.145 418 HD2 LYS 42 HD2 LYS 42 24.822 -0.143 -34.127 419 HD3 LYS 42 HD3 LYS 42 25.498 0.138 -35.780 420 HE2 LYS 42 HE2 LYS 42 27.784 -0.640 -34.867 421 HE3 LYS 42 HE3 LYS 42 27.031 -0.910 -33.310 422 HZ1 LYS 42 HZ1 LYS 42 26.079 -2.772 -33.902 423 HZ2 LYS 42 HZ2 LYS 42 25.638 -2.374 -35.456 424 HZ3 LYS 42 HZ3 LYS 42 27.141 -2.816 -35.136 425 H LEU 43 H LEU 43 25.232 5.683 -32.941 426 HA LEU 43 HA LEU 43 23.450 6.812 -35.046 427 HB2 LEU 43 HB2 LEU 43 22.308 6.595 -33.065 428 HB3 LEU 43 HB3 LEU 43 23.547 6.934 -31.942 429 HG LEU 43 HG LEU 43 22.355 8.995 -33.762 430 HD11 LEU 43 HD11 LEU 43 21.314 8.334 -30.921 431 HD12 LEU 43 HD12 LEU 43 20.788 9.553 -32.034 432 HD13 LEU 43 HD13 LEU 43 20.519 7.878 -32.419 433 HD21 LEU 43 HD21 LEU 43 23.721 9.367 -30.991 434 HD22 LEU 43 HD22 LEU 43 24.273 9.896 -32.590 435 HD23 LEU 43 HD23 LEU 43 22.857 10.619 -31.813 436 H MET 44 H MET 44 26.407 7.851 -33.191 437 HA MET 44 HA MET 44 26.459 10.457 -34.560 438 HB2 MET 44 HB2 MET 44 28.651 8.785 -33.164 439 HB3 MET 44 HB3 MET 44 28.944 10.513 -33.290 440 HG2 MET 44 HG2 MET 44 26.832 11.049 -32.022 441 HG3 MET 44 HG3 MET 44 26.643 9.381 -31.750 442 HE1 MET 44 HE1 MET 44 30.135 8.751 -29.525 443 HE2 MET 44 HE2 MET 44 28.838 7.854 -30.383 444 HE3 MET 44 HE3 MET 44 30.109 8.616 -31.300 445 H LYS 45 H LYS 45 28.057 7.300 -35.459 446 HA LYS 45 HA LYS 45 29.385 8.640 -37.601 447 HB2 LYS 45 HB2 LYS 45 28.651 5.638 -37.242 448 HB3 LYS 45 HB3 LYS 45 29.837 6.312 -38.425 449 HG2 LYS 45 HG2 LYS 45 31.292 7.086 -36.707 450 HG3 LYS 45 HG3 LYS 45 30.147 6.916 -35.455 451 HD2 LYS 45 HD2 LYS 45 31.646 5.246 -35.164 452 HD3 LYS 45 HD3 LYS 45 30.163 4.417 -35.857 453 HE2 LYS 45 HE2 LYS 45 31.144 4.253 -37.978 454 HE3 LYS 45 HE3 LYS 45 32.574 5.206 -37.492 455 HZ1 LYS 45 HZ1 LYS 45 33.216 3.424 -36.106 456 HZ2 LYS 45 HZ2 LYS 45 31.781 2.594 -36.219 457 HZ3 LYS 45 HZ3 LYS 45 32.807 2.641 -37.464 458 H ALA 46 H ALA 46 26.112 7.147 -37.490 459 HA ALA 46 HA ALA 46 25.875 7.518 -40.399 460 HB1 ALA 46 HB1 ALA 46 23.759 7.058 -38.157 461 HB2 ALA 46 HB2 ALA 46 23.495 6.615 -39.827 462 HB3 ALA 46 HB3 ALA 46 24.881 5.873 -38.801 463 H TYR 47 H TYR 47 24.933 9.457 -37.578 464 HA TYR 47 HA TYR 47 23.675 11.521 -38.941 465 HB2 TYR 47 HB2 TYR 47 24.071 11.200 -36.367 466 HB3 TYR 47 HB3 TYR 47 25.614 11.909 -36.614 467 HD1 TYR 47 HD1 TYR 47 22.049 12.235 -36.682 468 HD2 TYR 47 HD2 TYR 47 25.722 14.468 -37.191 469 HE1 TYR 47 HE1 TYR 47 20.746 14.397 -36.804 470 HE2 TYR 47 HE2 TYR 47 24.463 16.525 -37.276 471 HH TYR 47 HH TYR 47 21.106 16.722 -37.330 472 H CYS 48 H CYS 48 27.143 11.114 -38.410 473 HA CYS 48 HA CYS 48 27.958 13.544 -39.770 474 HB2 CYS 48 HB2 CYS 48 29.019 12.196 -37.949 475 HB3 CYS 48 HB3 CYS 48 29.680 11.182 -39.275 476 HG CYS 48 HG CYS 48 30.940 12.899 -40.532 477 H GLU 49 H GLU 49 27.617 10.229 -41.107 478 HA GLU 49 HA GLU 49 28.699 11.085 -43.673 479 HB2 GLU 49 HB2 GLU 49 27.019 8.639 -43.120 480 HB3 GLU 49 HB3 GLU 49 27.969 8.870 -44.534 481 HG2 GLU 49 HG2 GLU 49 29.136 8.407 -41.812 482 HG3 GLU 49 HG3 GLU 49 29.179 7.284 -43.131 483 H ARG 50 H ARG 50 25.646 11.460 -42.100 484 HA ARG 50 HA ARG 50 24.214 12.162 -44.622 485 HB2 ARG 50 HB2 ARG 50 23.582 12.065 -41.679 486 HB3 ARG 50 HB3 ARG 50 22.652 13.087 -42.772 487 HG2 ARG 50 HG2 ARG 50 21.979 11.280 -44.180 488 HG3 ARG 50 HG3 ARG 50 22.922 10.102 -43.134 489 HD2 ARG 50 HD2 ARG 50 21.534 10.421 -41.392 490 HD3 ARG 50 HD3 ARG 50 20.755 11.875 -41.908 491 HE ARG 50 HE ARG 50 20.347 8.991 -42.587 492 HH11 ARG 50 HH11 ARG 50 19.521 12.109 -43.912 493 HH12 ARG 50 HH12 ARG 50 18.378 11.409 -45.110 494 HH21 ARG 50 HH21 ARG 50 18.676 8.262 -44.029 495 HH22 ARG 50 HH22 ARG 50 18.301 9.430 -45.287 496 H GLN 51 H GLN 51 26.003 13.894 -42.063 497 HA GLN 51 HA GLN 51 25.400 16.627 -43.302 498 HB2 GLN 51 HB2 GLN 51 27.639 15.828 -41.322 499 HB3 GLN 51 HB3 GLN 51 27.345 17.437 -41.970 500 HG2 GLN 51 HG2 GLN 51 25.589 15.692 -40.104 501 HG3 GLN 51 HG3 GLN 51 26.376 17.189 -39.777 502 HE21 GLN 51 HE22 GLN 51 25.404 19.118 -40.103 503 HE22 GLN 51 HE21 GLN 51 23.797 19.235 -40.806 504 H GLY 52 H GLY 52 27.639 14.050 -43.894 505 HA2 GLY 52 HA2 GLY 52 28.920 13.906 -45.991 506 HA3 GLY 52 HA3 GLY 52 28.729 15.653 -46.110 507 H LEU 53 H LEU 53 29.675 14.944 -43.073 508 HA LEU 53 HA LEU 53 32.423 15.842 -43.512 509 HB2 LEU 53 HB2 LEU 53 30.998 15.808 -40.854 510 HB3 LEU 53 HB3 LEU 53 32.529 16.623 -41.302 511 HG LEU 53 HG LEU 53 29.560 17.157 -42.016 512 HD11 LEU 53 HD11 LEU 53 31.488 18.459 -40.112 513 HD12 LEU 53 HD12 LEU 53 29.997 19.230 -40.702 514 HD13 LEU 53 HD13 LEU 53 29.991 17.630 -39.952 515 HD21 LEU 53 HD21 LEU 53 31.330 17.689 -43.918 516 HD22 LEU 53 HD22 LEU 53 30.319 19.067 -43.249 517 HD23 LEU 53 HD23 LEU 53 31.975 18.890 -42.753 518 H SER 54 H SER 54 34.274 15.052 -42.333 519 HA SER 54 HA SER 54 34.261 12.222 -41.256 520 HB2 SER 54 HB2 SER 54 36.444 13.107 -42.194 521 HB3 SER 54 HB3 SER 54 36.337 14.373 -41.011 522 HG SER 54 HG SER 54 36.318 11.598 -40.431 523 H MET 55 H MET 55 33.947 11.633 -39.054 524 HA MET 55 HA MET 55 32.379 13.542 -37.651 525 HB2 MET 55 HB2 MET 55 32.157 10.995 -37.567 526 HB3 MET 55 HB3 MET 55 33.662 10.971 -36.679 527 HG2 MET 55 HG2 MET 55 32.561 12.271 -34.889 528 HG3 MET 55 HG3 MET 55 31.269 12.680 -35.929 529 HE1 MET 55 HE1 MET 55 33.038 9.996 -33.994 530 HE2 MET 55 HE2 MET 55 31.875 8.578 -34.035 531 HE3 MET 55 HE3 MET 55 32.942 8.914 -35.403 532 H ARG 56 H ARG 56 35.900 13.058 -37.545 533 HA ARG 56 HA ARG 56 36.617 14.245 -35.169 534 HB2 ARG 56 HB2 ARG 56 38.335 13.240 -36.543 535 HB3 ARG 56 HB3 ARG 56 37.774 14.111 -38.019 536 HG2 ARG 56 HG2 ARG 56 38.794 16.151 -37.093 537 HG3 ARG 56 HG3 ARG 56 39.122 15.258 -35.518 538 HD2 ARG 56 HD2 ARG 56 40.449 13.677 -36.994 539 HD3 ARG 56 HD3 ARG 56 40.370 15.074 -38.199 540 HE ARG 56 HE ARG 56 41.192 16.195 -35.834 541 HH11 ARG 56 HH11 ARG 56 42.706 13.404 -37.639 542 HH12 ARG 56 HH12 ARG 56 44.250 13.982 -37.171 543 HH21 ARG 56 HH21 ARG 56 43.423 16.407 -35.144 544 HH22 ARG 56 HH22 ARG 56 44.628 15.338 -35.889 545 H GLN 57 H GLN 57 35.300 15.811 -37.867 546 HA GLN 57 HA GLN 57 36.007 18.493 -37.087 547 HB2 GLN 57 HB2 GLN 57 35.284 17.421 -39.548 548 HB3 GLN 57 HB3 GLN 57 33.696 17.878 -39.004 549 HG2 GLN 57 HG2 GLN 57 34.264 20.181 -38.630 550 HG3 GLN 57 HG3 GLN 57 35.994 19.722 -38.964 551 HE21 GLN 57 HE22 GLN 57 33.215 21.183 -40.284 552 HE22 GLN 57 HE21 GLN 57 33.771 21.085 -41.939 553 H ILE 58 H ILE 58 33.492 16.615 -35.836 554 HA ILE 58 HA ILE 58 32.030 19.082 -34.734 555 HB ILE 58 HB ILE 58 30.054 17.679 -34.946 556 HG12 ILE 58 HG12 ILE 58 31.255 16.127 -37.167 557 HG13 ILE 58 HG13 ILE 58 31.563 15.542 -35.512 558 HG21 ILE 58 HG21 ILE 58 30.947 18.362 -37.741 559 HG22 ILE 58 HG22 ILE 58 29.389 18.294 -36.991 560 HG23 ILE 58 HG23 ILE 58 30.630 19.546 -36.540 561 HD11 ILE 58 HD11 ILE 58 28.829 15.725 -35.379 562 HD12 ILE 58 HD12 ILE 58 28.887 15.734 -37.110 563 HD13 ILE 58 HD13 ILE 58 29.531 14.328 -36.269 564 H ARG 59 H ARG 59 30.582 18.505 -32.901 565 HA ARG 59 HA ARG 59 31.500 16.340 -31.077 566 HB2 ARG 59 HB2 ARG 59 30.986 19.139 -30.475 567 HB3 ARG 59 HB3 ARG 59 30.941 18.089 -29.117 568 HG2 ARG 59 HG2 ARG 59 33.243 18.540 -30.912 569 HG3 ARG 59 HG3 ARG 59 33.149 19.159 -29.238 570 HD2 ARG 59 HD2 ARG 59 33.130 17.044 -28.315 571 HD3 ARG 59 HD3 ARG 59 33.212 16.205 -29.871 572 HE ARG 59 HE ARG 59 35.467 17.496 -28.467 573 HH11 ARG 59 HH11 ARG 59 34.256 17.226 -31.744 574 HH12 ARG 59 HH12 ARG 59 35.937 17.140 -32.405 575 HH21 ARG 59 HH21 ARG 59 37.493 17.650 -29.531 576 HH22 ARG 59 HH22 ARG 59 37.590 17.236 -31.194 577 H PHE 60 H PHE 60 30.062 15.460 -29.893 578 HA PHE 60 HA PHE 60 27.222 16.039 -30.161 579 HB2 PHE 60 HB2 PHE 60 28.452 13.362 -29.840 580 HB3 PHE 60 HB3 PHE 60 26.693 13.641 -29.771 581 HD1 PHE 60 HD2 PHE 60 25.517 14.430 -31.801 582 HD2 PHE 60 HD1 PHE 60 29.620 13.133 -31.928 583 HE1 PHE 60 HE2 PHE 60 25.377 14.115 -34.163 584 HE2 PHE 60 HE1 PHE 60 29.484 12.725 -34.444 585 HZ PHE 60 HZ PHE 60 27.262 12.985 -35.505 586 H ARG 61 H ARG 61 25.869 16.295 -28.416 587 HA ARG 61 HA ARG 61 26.571 15.228 -25.644 588 HB2 ARG 61 HB2 ARG 61 25.546 18.037 -26.183 589 HB3 ARG 61 HB3 ARG 61 26.169 17.267 -24.735 590 HG2 ARG 61 HG2 ARG 61 28.200 16.794 -25.600 591 HG3 ARG 61 HG3 ARG 61 27.994 17.864 -26.950 592 HD2 ARG 61 HD2 ARG 61 27.625 19.755 -25.055 593 HD3 ARG 61 HD3 ARG 61 27.792 18.543 -23.829 594 HE ARG 61 HE ARG 61 30.171 18.753 -25.457 595 HH11 ARG 61 HH11 ARG 61 28.649 19.784 -22.364 596 HH12 ARG 61 HH12 ARG 61 30.294 20.257 -21.792 597 HH21 ARG 61 HH21 ARG 61 31.931 19.152 -24.431 598 HH22 ARG 61 HH22 ARG 61 32.099 19.924 -22.861 599 H PHE 62 H PHE 62 25.047 14.500 -24.456 600 HA PHE 62 HA PHE 62 22.233 15.227 -24.999 601 HB2 PHE 62 HB2 PHE 62 22.120 12.852 -25.588 602 HB3 PHE 62 HB3 PHE 62 23.257 12.454 -24.307 603 HD1 PHE 62 HD2 PHE 62 19.967 14.081 -24.866 604 HD2 PHE 62 HD1 PHE 62 22.338 11.550 -22.333 605 HE1 PHE 62 HE2 PHE 62 17.980 13.526 -23.540 606 HE2 PHE 62 HE1 PHE 62 20.251 10.925 -21.121 607 HZ PHE 62 HZ PHE 62 18.061 11.964 -21.626 608 H ASP 63 H ASP 63 21.035 15.938 -23.361 609 HA ASP 63 HA ASP 63 20.940 17.272 -21.536 610 HB2 ASP 63 HB2 ASP 63 20.364 14.782 -20.925 611 HB3 ASP 63 HB3 ASP 63 21.975 14.719 -20.210 612 H GLY 64 H GLY 64 23.119 17.892 -22.766 613 HA2 GLY 64 HA2 GLY 64 24.824 19.303 -22.536 614 HA3 GLY 64 HA3 GLY 64 24.380 19.320 -20.829 615 H GLN 65 H GLN 65 25.132 16.247 -21.296 616 HA GLN 65 HA GLN 65 27.958 16.452 -20.462 617 HB2 GLN 65 HB2 GLN 65 26.395 13.909 -20.562 618 HB3 GLN 65 HB3 GLN 65 27.760 14.196 -19.612 619 HG2 GLN 65 HG2 GLN 65 24.911 15.247 -19.155 620 HG3 GLN 65 HG3 GLN 65 25.845 14.278 -18.048 621 HE21 GLN 65 HE22 GLN 65 24.917 17.507 -18.428 622 HE22 GLN 65 HE21 GLN 65 26.293 18.181 -17.627 623 HA PRO 66 HA PRO 66 29.738 14.875 -24.434 624 HB2 PRO 66 HB2 PRO 66 31.350 13.424 -22.477 625 HB3 PRO 66 HB3 PRO 66 31.868 14.178 -23.978 626 HG2 PRO 66 HG2 PRO 66 32.154 15.524 -21.471 627 HG3 PRO 66 HG3 PRO 66 31.719 16.446 -22.958 628 HD2 PRO 66 HD2 PRO 66 30.118 15.304 -20.661 629 HD3 PRO 66 HD3 PRO 66 29.922 16.884 -21.510 630 H ILE 67 H ILE 67 28.998 13.486 -25.578 631 HA ILE 67 HA ILE 67 27.708 10.925 -24.622 632 HB ILE 67 HB ILE 67 27.849 11.890 -27.486 633 HG12 ILE 67 HG12 ILE 67 25.599 11.038 -25.552 634 HG13 ILE 67 HG13 ILE 67 26.068 12.696 -25.753 635 HG21 ILE 67 HG21 ILE 67 28.139 9.490 -27.663 636 HG22 ILE 67 HG22 ILE 67 26.877 9.144 -26.401 637 HG23 ILE 67 HG23 ILE 67 26.496 9.582 -28.056 638 HD11 ILE 67 HD11 ILE 67 24.339 12.643 -27.065 639 HD12 ILE 67 HD12 ILE 67 25.530 12.414 -28.327 640 HD13 ILE 67 HD13 ILE 67 24.612 11.043 -27.770 641 H ASN 68 H ASN 68 28.948 8.949 -24.495 642 HA ASN 68 HA ASN 68 31.751 8.877 -25.660 643 HB2 ASN 68 HB2 ASN 68 30.278 6.854 -23.918 644 HB3 ASN 68 HB3 ASN 68 31.917 6.841 -24.342 645 HD21 ASN 68 HD22 ASN 68 29.633 7.778 -22.139 646 HD22 ASN 68 HD21 ASN 68 30.715 8.797 -21.152 647 H GLU 69 H GLU 69 32.326 7.332 -27.307 648 HA GLU 69 HA GLU 69 30.337 6.337 -29.117 649 HB2 GLU 69 HB2 GLU 69 33.207 5.561 -28.436 650 HB3 GLU 69 HB3 GLU 69 32.340 4.510 -29.507 651 HG2 GLU 69 HG2 GLU 69 32.231 6.139 -31.269 652 HG3 GLU 69 HG3 GLU 69 32.177 7.437 -30.081 653 H THR 70 H THR 70 31.494 5.116 -26.189 654 HA THR 70 HA THR 70 30.355 2.504 -26.546 655 HB THR 70 HB THR 70 31.244 2.114 -24.216 656 HG1 THR 70 HG1 THR 70 31.282 3.947 -23.352 657 HG21 THR 70 HG21 THR 70 32.926 2.998 -26.488 658 HG22 THR 70 HG22 THR 70 33.742 2.748 -24.924 659 HG23 THR 70 HG23 THR 70 32.817 1.402 -25.675 660 H ASP 71 H ASP 71 28.747 5.333 -25.570 661 HA ASP 71 HA ASP 71 27.105 4.272 -23.431 662 HB2 ASP 71 HB2 ASP 71 26.922 6.645 -25.239 663 HB3 ASP 71 HB3 ASP 71 25.767 6.241 -23.974 664 H THR 72 H THR 72 24.842 4.061 -23.660 665 HA THR 72 HA THR 72 23.739 3.460 -26.293 666 HB THR 72 HB THR 72 22.665 1.434 -25.516 667 HG1 THR 72 HG1 THR 72 23.908 0.824 -23.311 668 HG21 THR 72 HG21 THR 72 25.079 1.302 -26.249 669 HG22 THR 72 HG22 THR 72 25.523 0.847 -24.505 670 HG23 THR 72 HG23 THR 72 24.427 -0.090 -25.517 671 HA PRO 73 HA PRO 73 20.208 5.757 -24.674 672 HB2 PRO 73 HB2 PRO 73 18.285 3.601 -25.393 673 HB3 PRO 73 HB3 PRO 73 18.228 5.275 -25.633 674 HG2 PRO 73 HG2 PRO 73 19.003 3.470 -27.646 675 HG3 PRO 73 HG3 PRO 73 19.782 5.061 -27.558 676 HD2 PRO 73 HD2 PRO 73 20.884 2.334 -26.529 677 HD3 PRO 73 HD3 PRO 73 21.714 3.817 -27.166 678 H ALA 74 H ALA 74 20.523 2.250 -23.752 679 HA ALA 74 HA ALA 74 19.086 2.391 -21.348 680 HB1 ALA 74 HB1 ALA 74 20.258 0.135 -20.999 681 HB2 ALA 74 HB2 ALA 74 19.333 0.252 -22.378 682 HB3 ALA 74 HB3 ALA 74 21.062 0.392 -22.624 683 H GLN 75 H GLN 75 22.641 2.750 -21.939 684 HA GLN 75 HA GLN 75 23.438 2.771 -19.225 685 HB2 GLN 75 HB2 GLN 75 24.951 2.167 -21.136 686 HB3 GLN 75 HB3 GLN 75 24.487 3.634 -21.984 687 HG2 GLN 75 HG2 GLN 75 26.726 3.951 -21.267 688 HG3 GLN 75 HG3 GLN 75 25.650 5.065 -20.512 689 HE21 GLN 75 HE22 GLN 75 27.734 5.224 -19.177 690 HE22 GLN 75 HE21 GLN 75 27.659 4.254 -17.713 691 H LEU 76 H LEU 76 22.384 5.274 -21.386 692 HA LEU 76 HA LEU 76 22.768 7.358 -19.278 693 HB2 LEU 76 HB2 LEU 76 22.018 7.387 -22.294 694 HB3 LEU 76 HB3 LEU 76 22.130 8.910 -21.294 695 HG LEU 76 HG LEU 76 24.200 6.918 -22.045 696 HD11 LEU 76 HD11 LEU 76 25.209 8.595 -23.360 697 HD12 LEU 76 HD12 LEU 76 23.563 8.336 -23.857 698 HD13 LEU 76 HD13 LEU 76 23.998 9.776 -23.026 699 HD21 LEU 76 HD21 LEU 76 24.656 7.874 -19.757 700 HD22 LEU 76 HD22 LEU 76 25.793 8.510 -20.927 701 HD23 LEU 76 HD23 LEU 76 24.485 9.514 -20.368 702 H GLU 77 H GLU 77 20.411 5.214 -19.667 703 HA GLU 77 HA GLU 77 18.439 4.937 -18.978 704 HB2 GLU 77 HB2 GLU 77 19.212 7.314 -17.214 705 HB3 GLU 77 HB3 GLU 77 17.866 6.385 -16.805 706 HG2 GLU 77 HG2 GLU 77 20.725 5.442 -17.003 707 HG3 GLU 77 HG3 GLU 77 19.913 5.723 -15.481 708 H MET 78 H MET 78 18.196 6.127 -21.339 709 HA MET 78 HA MET 78 16.835 8.623 -21.278 710 HB2 MET 78 HB2 MET 78 17.878 6.828 -23.634 711 HB3 MET 78 HB3 MET 78 17.257 8.386 -23.835 712 HG2 MET 78 HG2 MET 78 19.091 8.910 -22.074 713 HG3 MET 78 HG3 MET 78 19.758 7.331 -22.518 714 HE1 MET 78 HE1 MET 78 18.611 10.021 -25.812 715 HE2 MET 78 HE2 MET 78 18.574 10.594 -24.082 716 HE3 MET 78 HE3 MET 78 19.890 11.028 -25.171 717 H GLU 79 H GLU 79 14.953 9.132 -22.947 718 HA GLU 79 HA GLU 79 13.265 6.826 -23.451 719 HB2 GLU 79 HB2 GLU 79 12.498 9.549 -22.187 720 HB3 GLU 79 HB3 GLU 79 11.280 8.762 -23.020 721 HG2 GLU 79 HG2 GLU 79 12.749 7.433 -20.767 722 HG3 GLU 79 HG3 GLU 79 11.123 8.289 -20.690 723 H ASP 80 H ASP 80 11.602 7.029 -24.786 724 HA ASP 80 HA ASP 80 12.227 7.921 -27.367 725 HB2 ASP 80 HB2 ASP 80 9.598 7.472 -26.003 726 HB3 ASP 80 HB3 ASP 80 9.530 7.992 -27.658 727 H GLU 81 H GLU 81 11.932 9.708 -28.563 728 HA GLU 81 HA GLU 81 11.941 11.779 -29.073 729 HB2 GLU 81 HB2 GLU 81 9.634 12.193 -27.140 730 HB3 GLU 81 HB3 GLU 81 10.158 13.330 -28.357 731 HG2 GLU 81 HG2 GLU 81 9.563 12.182 -30.256 732 HG3 GLU 81 HG3 GLU 81 9.249 10.708 -29.340 733 H ASP 82 H ASP 82 13.731 10.876 -26.723 734 HA ASP 82 HA ASP 82 14.454 13.418 -25.613 735 HB2 ASP 82 HB2 ASP 82 15.838 10.718 -25.495 736 HB3 ASP 82 HB3 ASP 82 16.566 12.281 -25.079 737 H THR 83 H THR 83 15.982 14.807 -26.494 738 HA THR 83 HA THR 83 16.706 14.050 -29.320 739 HB THR 83 HB THR 83 16.538 16.888 -28.259 740 HG1 THR 83 HG1 THR 83 14.654 16.067 -28.041 741 HG21 THR 83 HG21 THR 83 15.883 17.085 -30.856 742 HG22 THR 83 HG22 THR 83 17.556 17.232 -30.256 743 HG23 THR 83 HG23 THR 83 17.021 15.731 -30.938 744 H ILE 84 H ILE 84 19.106 14.073 -29.836 745 HA ILE 84 HA ILE 84 21.235 15.064 -28.104 746 HB ILE 84 HB ILE 84 21.083 13.432 -30.547 747 HG12 ILE 84 HG12 ILE 84 22.027 12.889 -27.702 748 HG13 ILE 84 HG13 ILE 84 20.355 12.643 -28.225 749 HG21 ILE 84 HG21 ILE 84 23.608 14.175 -28.993 750 HG22 ILE 84 HG22 ILE 84 23.473 13.107 -30.421 751 HG23 ILE 84 HG23 ILE 84 23.187 14.782 -30.640 752 HD11 ILE 84 HD11 ILE 84 22.828 11.235 -29.276 753 HD12 ILE 84 HD12 ILE 84 21.631 10.511 -28.379 754 HD13 ILE 84 HD13 ILE 84 21.162 11.101 -29.949 755 H ASP 85 H ASP 85 22.563 16.450 -28.370 756 HA ASP 85 HA ASP 85 22.076 18.872 -30.077 757 HB2 ASP 85 HB2 ASP 85 23.636 18.737 -27.398 758 HB3 ASP 85 HB3 ASP 85 23.552 20.114 -28.549 759 H VAL 86 H VAL 86 23.505 19.541 -31.519 760 HA VAL 86 HA VAL 86 26.106 18.045 -31.705 761 HB VAL 86 HB VAL 86 24.409 18.802 -34.044 762 HG11 VAL 86 HG11 VAL 86 26.944 17.207 -33.828 763 HG12 VAL 86 HG12 VAL 86 25.971 17.298 -35.350 764 HG13 VAL 86 HG13 VAL 86 26.879 18.646 -34.684 765 HG21 VAL 86 HG21 VAL 86 23.220 17.191 -32.989 766 HG22 VAL 86 HG22 VAL 86 24.114 16.301 -34.190 767 HG23 VAL 86 HG23 VAL 86 24.720 16.246 -32.458 768 H PHE 87 H PHE 87 27.913 19.280 -32.314 769 HA PHE 87 HA PHE 87 27.751 22.180 -32.975 770 HB2 PHE 87 HB2 PHE 87 29.546 21.139 -30.744 771 HB3 PHE 87 HB3 PHE 87 29.458 22.713 -31.282 772 HD1 PHE 87 HD1 PHE 87 27.562 20.188 -29.297 773 HD2 PHE 87 HD2 PHE 87 27.542 24.334 -30.511 774 HE1 PHE 87 HE1 PHE 87 25.777 20.563 -27.770 775 HE2 PHE 87 HE2 PHE 87 25.618 24.636 -29.035 776 HZ PHE 87 HZ PHE 87 24.591 22.808 -27.747 777 H GLN 88 H GLN 88 29.609 23.057 -33.912 778 HA GLN 88 HA GLN 88 31.434 21.202 -35.304 779 HB2 GLN 88 HB2 GLN 88 30.931 24.152 -35.437 780 HB3 GLN 88 HB3 GLN 88 32.237 23.367 -36.324 781 HG2 GLN 88 HG2 GLN 88 29.438 22.336 -36.791 782 HG3 GLN 88 HG3 GLN 88 30.071 23.865 -37.493 783 HE21 GLN 88 HE22 GLN 88 29.118 22.225 -39.093 784 HE22 GLN 88 HE21 GLN 88 30.381 21.415 -39.984 785 H GLN 89 H GLN 89 33.763 21.314 -34.960 786 HA GLN 89 HA GLN 89 34.650 22.304 -32.286 787 HB2 GLN 89 HB2 GLN 89 34.795 19.747 -32.806 788 HB3 GLN 89 HB3 GLN 89 36.029 20.209 -34.019 789 HG2 GLN 89 HG2 GLN 89 37.224 19.630 -32.237 790 HG3 GLN 89 HG3 GLN 89 37.351 21.387 -32.274 791 HE21 GLN 89 HE22 GLN 89 38.242 20.683 -29.971 792 HE22 GLN 89 HE21 GLN 89 37.060 20.747 -28.722 793 H GLN 90 H GLN 90 36.288 23.785 -32.358 794 HA GLN 90 HA GLN 90 37.167 24.876 -35.000 795 HB2 GLN 90 HB2 GLN 90 36.387 26.204 -32.406 796 HB3 GLN 90 HB3 GLN 90 37.041 27.142 -33.713 797 HG2 GLN 90 HG2 GLN 90 35.011 27.504 -34.517 798 HG3 GLN 90 HG3 GLN 90 35.108 25.759 -35.029 799 HE21 GLN 90 HE22 GLN 90 32.700 26.192 -35.131 800 HE22 GLN 90 HE21 GLN 90 31.874 26.052 -33.631 801 H THR 91 H THR 91 39.338 24.347 -35.251 802 HA THR 91 HA THR 91 40.898 23.686 -33.171 803 HB THR 91 HB THR 91 42.917 24.125 -34.866 804 HG1 THR 91 HG1 THR 91 42.373 23.954 -36.878 805 HG21 THR 91 HG21 THR 91 42.359 22.074 -34.194 806 HG22 THR 91 HG22 THR 91 40.807 22.088 -35.059 807 HG23 THR 91 HG23 THR 91 42.204 21.915 -36.020 808 H GLY 92 H GLY 92 40.415 26.925 -34.239 809 HA2 GLY 92 HA2 GLY 92 40.984 28.760 -32.851 810 HA3 GLY 92 HA3 GLY 92 42.413 27.974 -32.226 811 H GLY 93 H GLY 93 42.777 30.441 -32.822 812 HA2 GLY 93 HA2 GLY 93 43.358 31.300 -35.494 813 HA3 GLY 93 HA3 GLY 93 43.929 32.009 -34.100 814 H VAL 94 H VAL 94 45.842 32.295 -35.259 815 HA VAL 94 HA VAL 94 47.668 30.017 -35.163 816 HB VAL 94 HB VAL 94 46.970 31.480 -37.680 817 HG11 VAL 94 HG11 VAL 94 49.371 29.637 -37.340 818 HG12 VAL 94 HG12 VAL 94 48.692 30.357 -38.799 819 HG13 VAL 94 HG13 VAL 94 49.381 31.319 -37.438 820 HG21 VAL 94 HG21 VAL 94 45.505 29.591 -37.436 821 HG22 VAL 94 HG22 VAL 94 46.726 29.093 -38.631 822 HG23 VAL 94 HG23 VAL 94 46.975 28.605 -37.000 823 H TYR 95 H TYR 95 49.910 30.680 -34.609 824 HA TYR 95 HA TYR 95 50.248 33.590 -34.133 825 HB2 TYR 95 HB2 TYR 95 51.520 31.068 -33.103 826 HB3 TYR 95 HB3 TYR 95 52.153 32.684 -32.678 827 HD1 TYR 95 HD1 TYR 95 50.375 34.487 -31.533 828 HD2 TYR 95 HD2 TYR 95 50.174 30.138 -31.487 829 HE1 TYR 95 HE1 TYR 95 49.212 34.604 -29.408 830 HE2 TYR 95 HE2 TYR 95 49.085 30.298 -29.280 831 HH TYR 95 HH TYR 95 48.655 33.245 -27.403 Start of MODEL 16 1 H1 ACE 36 HH32 ACE 36 9.364 16.132 -42.651 2 H2 ACE 36 HH33 ACE 36 10.974 15.643 -42.134 3 H3 ACE 36 HH31 ACE 36 10.795 16.356 -43.780 4 H GLU 37 H GLU 37 9.702 15.271 -45.406 5 HA GLU 37 HA GLU 37 8.795 12.611 -45.186 6 HB2 GLU 37 HB2 GLU 37 8.354 14.084 -47.140 7 HB3 GLU 37 HB3 GLU 37 10.096 13.995 -47.427 8 HG2 GLU 37 HG2 GLU 37 8.709 12.653 -48.950 9 HG3 GLU 37 HG3 GLU 37 9.925 11.639 -48.055 10 H ASP 38 H ASP 38 11.954 13.662 -45.435 11 HA ASP 38 HA ASP 38 13.087 10.937 -45.092 12 HB2 ASP 38 HB2 ASP 38 13.193 11.739 -47.334 13 HB3 ASP 38 HB3 ASP 38 14.449 12.988 -46.808 14 H ALA 39 H ALA 39 12.421 12.616 -42.968 15 HA ALA 39 HA ALA 39 15.146 13.326 -41.753 16 HB1 ALA 39 HB1 ALA 39 12.362 14.108 -40.899 17 HB2 ALA 39 HB2 ALA 39 13.947 14.589 -40.098 18 HB3 ALA 39 HB3 ALA 39 13.528 15.246 -41.601 19 H PHE 40 H PHE 40 14.748 10.851 -42.342 20 HA PHE 40 HA PHE 40 14.376 9.557 -39.638 21 HB2 PHE 40 HB2 PHE 40 12.292 9.635 -41.489 22 HB3 PHE 40 HB3 PHE 40 13.076 8.177 -41.980 23 HD1 PHE 40 HD1 PHE 40 11.400 9.875 -39.250 24 HD2 PHE 40 HD2 PHE 40 13.096 6.129 -40.534 25 HE1 PHE 40 HE1 PHE 40 10.483 8.917 -37.327 26 HE2 PHE 40 HE2 PHE 40 12.103 5.045 -38.456 27 HZ PHE 40 HZ PHE 40 10.796 6.264 -36.917 28 H ILE 41 H ILE 41 15.580 7.923 -39.027 29 HA ILE 41 HA ILE 41 17.030 6.198 -40.901 30 HB ILE 41 HB ILE 41 18.347 7.346 -38.456 31 HG12 ILE 41 HG12 ILE 41 19.839 8.757 -39.817 32 HG13 ILE 41 HG13 ILE 41 18.662 8.570 -41.163 33 HG21 ILE 41 HG21 ILE 41 20.347 6.436 -39.367 34 HG22 ILE 41 HG22 ILE 41 19.136 5.214 -39.443 35 HG23 ILE 41 HG23 ILE 41 19.595 6.031 -40.951 36 HD11 ILE 41 HD11 ILE 41 18.856 10.657 -39.474 37 HD12 ILE 41 HD12 ILE 41 17.251 10.328 -39.951 38 HD13 ILE 41 HD13 ILE 41 17.938 9.678 -38.408 39 H VAL 42 H VAL 42 17.043 4.156 -40.363 40 HA VAL 42 HA VAL 42 16.049 3.111 -37.742 41 HB VAL 42 HB VAL 42 15.256 1.841 -40.261 42 HG11 VAL 42 HG11 VAL 42 13.399 1.138 -39.016 43 HG12 VAL 42 HG12 VAL 42 14.906 0.809 -38.092 44 HG13 VAL 42 HG13 VAL 42 13.941 2.230 -37.625 45 HG21 VAL 42 HG21 VAL 42 13.514 3.921 -39.179 46 HG22 VAL 42 HG22 VAL 42 14.467 4.112 -40.749 47 HG23 VAL 42 HG23 VAL 42 13.128 2.999 -40.554 48 H ILE 43 H ILE 43 17.224 1.912 -36.836 49 HA ILE 43 HA ILE 43 19.423 0.136 -38.031 50 HB ILE 43 HB ILE 43 19.989 2.134 -35.854 51 HG12 ILE 43 HG12 ILE 43 20.820 2.644 -38.739 52 HG13 ILE 43 HG13 ILE 43 19.485 3.424 -38.091 53 HG21 ILE 43 HG21 ILE 43 22.147 1.610 -36.084 54 HG22 ILE 43 HG22 ILE 43 21.425 0.008 -36.448 55 HG23 ILE 43 HG23 ILE 43 22.045 1.039 -37.761 56 HD11 ILE 43 HD11 ILE 43 22.405 3.777 -37.029 57 HD12 ILE 43 HD12 ILE 43 21.303 4.832 -38.035 58 HD13 ILE 43 HD13 ILE 43 20.896 4.499 -36.342 59 H SEP 44 H SEP 44 19.759 -1.594 -36.799 60 HA SEP 44 HA SEP 44 19.222 -1.670 -33.913 61 HB2 SEP 44 HB2 SEP 44 18.554 -3.938 -34.031 62 HB3 SEP 44 HB3 SEP 44 17.459 -2.768 -34.829 63 H ASP 45 H ASP 45 20.655 -2.841 -32.725 64 HA ASP 45 HA ASP 45 23.263 -2.680 -34.086 65 HB2 ASP 45 HB2 ASP 45 23.009 -2.320 -31.572 66 HB3 ASP 45 HB3 ASP 45 22.644 -4.092 -31.410 67 H SEP 46 H SEP 46 21.280 -5.403 -33.362 68 HA SEP 46 HA SEP 46 23.192 -7.365 -34.182 69 HB2 SEP 46 HB2 SEP 46 21.733 -8.998 -33.543 70 HB3 SEP 46 HB3 SEP 46 21.641 -7.654 -32.342 71 H ASP 47 H ASP 47 23.737 -7.765 -36.158 72 HA ASP 47 HA ASP 47 21.859 -7.468 -38.343 73 HB2 ASP 47 HB2 ASP 47 24.069 -6.863 -38.974 74 HB3 ASP 47 HB3 ASP 47 24.738 -8.378 -38.393 75 H GLY 48 H GLY 48 20.334 -8.931 -39.034 76 HA2 GLY 48 HA2 GLY 48 19.717 -10.955 -39.944 77 HA3 GLY 48 HA3 GLY 48 21.363 -11.438 -39.783 78 H GLU 49 H GLU 49 20.368 -13.339 -39.318 79 HA GLU 49 HA GLU 49 18.385 -13.989 -37.306 80 HB2 GLU 49 HB2 GLU 49 19.368 -15.457 -39.278 81 HB3 GLU 49 HB3 GLU 49 20.487 -15.911 -37.889 82 HG2 GLU 49 HG2 GLU 49 18.687 -17.651 -38.189 83 HG3 GLU 49 HG3 GLU 49 18.806 -16.918 -36.629 84 HN1 NH2 50 HN1 NH2 50 18.341 -14.703 -35.269 85 HN2 NH2 50 HN2 NH2 50 19.798 -14.245 -34.330 86 H1 MET 1 H1 MET 1 -13.841 -29.953 -34.517 87 H2 MET 1 H2 MET 1 -14.544 -30.188 -35.937 88 H3 MET 1 H3 MET 1 -15.476 -29.948 -34.673 89 HA MET 1 HA MET 1 -14.959 -27.986 -36.297 90 HB2 MET 1 HB2 MET 1 -16.267 -27.750 -34.110 91 HB3 MET 1 HB3 MET 1 -14.714 -27.865 -33.342 92 HG2 MET 1 HG2 MET 1 -15.706 -25.505 -33.469 93 HG3 MET 1 HG3 MET 1 -14.123 -25.535 -33.934 94 HE1 MET 1 HE1 MET 1 -17.692 -26.448 -35.046 95 HE2 MET 1 HE2 MET 1 -17.952 -24.743 -35.128 96 HE3 MET 1 HE3 MET 1 -18.027 -25.808 -36.629 97 H ALA 2 H ALA 2 -13.663 -26.648 -36.887 98 HA ALA 2 HA ALA 2 -10.850 -26.792 -36.924 99 HB1 ALA 2 HB1 ALA 2 -12.454 -24.398 -37.603 100 HB2 ALA 2 HB2 ALA 2 -10.735 -24.787 -37.891 101 HB3 ALA 2 HB3 ALA 2 -11.987 -25.809 -38.659 102 H ASP 3 H ASP 3 -9.290 -26.156 -35.518 103 HA ASP 3 HA ASP 3 -9.872 -23.979 -33.592 104 HB2 ASP 3 HB2 ASP 3 -10.055 -26.442 -32.563 105 HB3 ASP 3 HB3 ASP 3 -8.322 -26.598 -32.859 106 H GLU 4 H GLU 4 -8.001 -23.090 -32.492 107 HA GLU 4 HA GLU 4 -5.428 -22.875 -34.018 108 HB2 GLU 4 HB2 GLU 4 -6.866 -21.423 -35.263 109 HB3 GLU 4 HB3 GLU 4 -7.272 -20.498 -33.761 110 HG2 GLU 4 HG2 GLU 4 -5.189 -19.545 -33.478 111 HG3 GLU 4 HG3 GLU 4 -4.428 -20.779 -34.643 112 H LYS 5 H LYS 5 -3.728 -22.399 -32.900 113 HA LYS 5 HA LYS 5 -3.826 -22.201 -29.987 114 HB2 LYS 5 HB2 LYS 5 -1.965 -23.366 -30.824 115 HB3 LYS 5 HB3 LYS 5 -1.645 -22.190 -32.148 116 HG2 LYS 5 HG2 LYS 5 -0.862 -20.567 -30.440 117 HG3 LYS 5 HG3 LYS 5 -1.255 -21.855 -29.202 118 HD2 LYS 5 HD2 LYS 5 0.519 -23.257 -29.975 119 HD3 LYS 5 HD3 LYS 5 0.969 -22.143 -31.263 120 HE2 LYS 5 HE2 LYS 5 1.033 -21.413 -28.324 121 HE3 LYS 5 HE3 LYS 5 2.457 -21.928 -29.290 122 HZ1 LYS 5 HZ1 LYS 5 2.511 -20.210 -30.620 123 HZ2 LYS 5 HZ2 LYS 5 1.046 -19.539 -30.168 124 HZ3 LYS 5 HZ3 LYS 5 2.348 -19.552 -29.196 125 HA PRO 6 HA PRO 6 -4.150 -17.688 -30.759 126 HB2 PRO 6 HB2 PRO 6 -4.155 -16.872 -28.199 127 HB3 PRO 6 HB3 PRO 6 -5.586 -17.560 -29.012 128 HG2 PRO 6 HG2 PRO 6 -3.869 -18.812 -26.947 129 HG3 PRO 6 HG3 PRO 6 -5.583 -19.206 -27.374 130 HD2 PRO 6 HD2 PRO 6 -3.266 -20.779 -28.274 131 HD3 PRO 6 HD3 PRO 6 -5.013 -20.818 -28.618 132 H LYS 7 H LYS 7 -2.836 -16.095 -30.675 133 HA LYS 7 HA LYS 7 -0.003 -16.065 -30.718 134 HB2 LYS 7 HB2 LYS 7 -1.615 -14.384 -31.792 135 HB3 LYS 7 HB3 LYS 7 -1.891 -13.810 -30.056 136 HG2 LYS 7 HG2 LYS 7 0.271 -12.975 -29.924 137 HG3 LYS 7 HG3 LYS 7 0.813 -13.818 -31.466 138 HD2 LYS 7 HD2 LYS 7 -0.819 -12.165 -32.697 139 HD3 LYS 7 HD3 LYS 7 -0.958 -11.300 -31.232 140 HE2 LYS 7 HE2 LYS 7 1.586 -10.932 -31.092 141 HE3 LYS 7 HE3 LYS 7 1.686 -11.888 -32.559 142 HZ1 LYS 7 HZ1 LYS 7 0.359 -9.346 -32.106 143 HZ2 LYS 7 HZ2 LYS 7 1.725 -9.537 -33.013 144 HZ3 LYS 7 HZ3 LYS 7 0.252 -10.163 -33.497 145 H GLU 8 H GLU 8 1.735 -15.224 -29.535 146 HA GLU 8 HA GLU 8 1.439 -14.506 -26.700 147 HB2 GLU 8 HB2 GLU 8 2.862 -16.375 -26.005 148 HB3 GLU 8 HB3 GLU 8 1.274 -16.903 -26.748 149 HG2 GLU 8 HG2 GLU 8 2.376 -17.620 -28.761 150 HG3 GLU 8 HG3 GLU 8 3.798 -16.761 -28.347 151 H GLY 9 H GLY 9 3.804 -14.270 -25.734 152 HA2 GLY 9 HA2 GLY 9 5.838 -13.286 -27.617 153 HA3 GLY 9 HA3 GLY 9 4.728 -11.979 -27.041 154 H VAL 10 H VAL 10 5.805 -14.572 -24.718 155 HA VAL 10 HA VAL 10 7.623 -12.490 -23.579 156 HB VAL 10 HB VAL 10 6.978 -15.344 -22.561 157 HG11 VAL 10 HG11 VAL 10 9.371 -14.711 -21.918 158 HG12 VAL 10 HG12 VAL 10 8.648 -13.211 -21.205 159 HG13 VAL 10 HG13 VAL 10 8.210 -14.846 -20.655 160 HG21 VAL 10 HG21 VAL 10 6.388 -12.485 -21.663 161 HG22 VAL 10 HG22 VAL 10 5.223 -13.876 -22.173 162 HG23 VAL 10 HG23 VAL 10 6.054 -14.021 -20.712 163 H LYS 11 H LYS 11 9.160 -12.136 -25.263 164 HA LYS 11 HA LYS 11 11.390 -13.913 -25.497 165 HB2 LYS 11 HB2 LYS 11 9.826 -15.076 -27.068 166 HB3 LYS 11 HB3 LYS 11 9.495 -13.487 -27.779 167 HG2 LYS 11 HG2 LYS 11 11.704 -13.448 -28.793 168 HG3 LYS 11 HG3 LYS 11 12.226 -14.702 -27.609 169 HD2 LYS 11 HD2 LYS 11 10.604 -16.264 -28.975 170 HD3 LYS 11 HD3 LYS 11 10.440 -14.984 -30.110 171 HE2 LYS 11 HE2 LYS 11 13.193 -14.826 -30.236 172 HE3 LYS 11 HE3 LYS 11 13.192 -16.216 -29.275 173 HZ1 LYS 11 HZ1 LYS 11 13.424 -16.643 -31.647 174 HZ2 LYS 11 HZ2 LYS 11 12.107 -17.459 -31.146 175 HZ3 LYS 11 HZ3 LYS 11 11.991 -16.026 -31.927 176 H THR 12 H THR 12 13.118 -12.263 -25.378 177 HA THR 12 HA THR 12 12.643 -9.701 -25.515 178 HB THR 12 HB THR 12 15.201 -9.539 -26.059 179 HG1 THR 12 HG1 THR 12 16.010 -11.860 -26.179 180 HG21 THR 12 HG21 THR 12 14.434 -10.109 -23.664 181 HG22 THR 12 HG22 THR 12 14.615 -11.799 -24.240 182 HG23 THR 12 HG23 THR 12 16.011 -10.548 -24.126 183 H GLU 13 H GLU 13 13.150 -11.633 -28.508 184 HA GLU 13 HA GLU 13 13.675 -9.474 -30.392 185 HB2 GLU 13 HB2 GLU 13 11.832 -11.927 -30.559 186 HB3 GLU 13 HB3 GLU 13 12.538 -10.854 -31.863 187 HG2 GLU 13 HG2 GLU 13 14.038 -12.911 -30.061 188 HG3 GLU 13 HG3 GLU 13 13.489 -13.166 -31.703 189 H ASN 14 H ASN 14 10.724 -10.077 -28.567 190 HA ASN 14 HA ASN 14 9.179 -8.445 -30.421 191 HB2 ASN 14 HB2 ASN 14 8.631 -9.671 -27.637 192 HB3 ASN 14 HB3 ASN 14 7.382 -8.836 -28.696 193 HD21 ASN 14 HD22 ASN 14 6.708 -11.127 -27.905 194 HD22 ASN 14 HD21 ASN 14 6.703 -12.235 -29.293 195 H ASN 15 H ASN 15 11.616 -7.269 -28.438 196 HA ASN 15 HA ASN 15 10.165 -5.388 -26.902 197 HB2 ASN 15 HB2 ASN 15 12.758 -6.408 -26.677 198 HB3 ASN 15 HB3 ASN 15 13.134 -5.301 -27.927 199 HD21 ASN 15 HD22 ASN 15 10.938 -4.928 -25.046 200 HD22 ASN 15 HD21 ASN 15 11.810 -3.551 -24.453 201 H ASP 16 H ASP 16 9.748 -3.644 -27.087 202 HA ASP 16 HA ASP 16 9.142 -1.938 -29.207 203 HB2 ASP 16 HB2 ASP 16 9.717 -1.132 -26.353 204 HB3 ASP 16 HB3 ASP 16 8.955 -0.190 -27.634 205 H HIS 17 H HIS 17 10.306 -0.387 -30.541 206 HA HIS 17 HA HIS 17 13.090 0.321 -30.273 207 HB2 HIS 17 HB2 HIS 17 10.871 1.464 -31.929 208 HB3 HIS 17 HB3 HIS 17 12.645 1.572 -32.217 209 HD2 HIS 17 HD2 HIS 17 13.937 -0.411 -33.170 210 HE1 HIS 17 HE1 HIS 17 10.571 -2.791 -34.088 211 HE2 HIS 17 HE2 HIS 17 13.099 -2.673 -34.360 212 H ILE 18 H ILE 18 13.960 2.116 -29.568 213 HA ILE 18 HA ILE 18 12.352 4.272 -28.282 214 HB ILE 18 HB ILE 18 13.876 3.318 -26.735 215 HG12 ILE 18 HG12 ILE 18 14.309 6.272 -27.628 216 HG13 ILE 18 HG13 ILE 18 13.197 5.684 -26.424 217 HG21 ILE 18 HG21 ILE 18 16.038 4.606 -28.500 218 HG22 ILE 18 HG22 ILE 18 16.380 3.525 -27.074 219 HG23 ILE 18 HG23 ILE 18 15.736 2.850 -28.591 220 HD11 ILE 18 HD11 ILE 18 15.231 4.824 -25.210 221 HD12 ILE 18 HD12 ILE 18 16.207 5.910 -26.169 222 HD13 ILE 18 HD13 ILE 18 14.851 6.536 -25.134 223 H ASN 19 H ASN 19 12.215 6.154 -29.046 224 HA ASN 19 HA ASN 19 12.938 6.858 -31.795 225 HB2 ASN 19 HB2 ASN 19 10.675 7.701 -29.993 226 HB3 ASN 19 HB3 ASN 19 10.963 8.227 -31.651 227 HD21 ASN 19 HD22 ASN 19 10.269 5.355 -29.632 228 HD22 ASN 19 HD21 ASN 19 9.498 4.485 -30.834 229 H LEU 20 H LEU 20 15.087 7.477 -30.927 230 HA LEU 20 HA LEU 20 15.141 9.996 -29.488 231 HB2 LEU 20 HB2 LEU 20 17.081 8.113 -30.657 232 HB3 LEU 20 HB3 LEU 20 17.642 9.779 -29.984 233 HG LEU 20 HG LEU 20 16.395 7.520 -28.642 234 HD11 LEU 20 HD11 LEU 20 19.100 8.686 -28.430 235 HD12 LEU 20 HD12 LEU 20 18.350 7.458 -27.315 236 HD13 LEU 20 HD13 LEU 20 18.667 7.073 -28.942 237 HD21 LEU 20 HD21 LEU 20 17.060 10.251 -27.450 238 HD22 LEU 20 HD22 LEU 20 15.434 9.483 -27.471 239 HD23 LEU 20 HD23 LEU 20 16.796 8.876 -26.503 240 H LYS 21 H LYS 21 15.110 12.093 -30.098 241 HA LYS 21 HA LYS 21 15.154 12.991 -32.845 242 HB2 LYS 21 HB2 LYS 21 14.776 14.327 -30.274 243 HB3 LYS 21 HB3 LYS 21 14.698 15.104 -31.775 244 HG2 LYS 21 HG2 LYS 21 12.965 13.684 -32.583 245 HG3 LYS 21 HG3 LYS 21 12.872 12.801 -30.961 246 HD2 LYS 21 HD2 LYS 21 12.182 15.059 -30.026 247 HD3 LYS 21 HD3 LYS 21 12.506 15.764 -31.565 248 HE2 LYS 21 HE2 LYS 21 10.746 14.440 -32.660 249 HE3 LYS 21 HE3 LYS 21 10.733 13.313 -31.182 250 HZ1 LYS 21 HZ1 LYS 21 9.075 14.714 -30.492 251 HZ2 LYS 21 HZ2 LYS 21 10.161 16.037 -30.671 252 HZ3 LYS 21 HZ3 LYS 21 9.141 15.512 -31.854 253 H VAL 22 H VAL 22 16.819 14.587 -33.541 254 HA VAL 22 HA VAL 22 19.233 14.884 -31.903 255 HB VAL 22 HB VAL 22 19.258 13.666 -34.698 256 HG11 VAL 22 HG11 VAL 22 21.303 15.061 -34.505 257 HG12 VAL 22 HG12 VAL 22 21.733 14.365 -33.046 258 HG13 VAL 22 HG13 VAL 22 21.735 13.345 -34.522 259 HG21 VAL 22 HG21 VAL 22 18.848 11.789 -32.906 260 HG22 VAL 22 HG22 VAL 22 20.261 11.824 -34.018 261 HG23 VAL 22 HG23 VAL 22 20.556 12.318 -32.410 262 H ALA 23 H ALA 23 19.773 16.859 -32.023 263 HA ALA 23 HA ALA 23 18.954 18.585 -34.433 264 HB1 ALA 23 HB1 ALA 23 18.271 20.305 -32.894 265 HB2 ALA 23 HB2 ALA 23 17.371 18.798 -32.613 266 HB3 ALA 23 HB3 ALA 23 18.695 19.232 -31.516 267 H GLY 24 H GLY 24 20.313 19.740 -35.230 268 HA2 GLY 24 HA2 GLY 24 23.012 20.481 -34.206 269 HA3 GLY 24 HA3 GLY 24 22.662 20.437 -35.852 270 H GLN 25 H GLN 25 23.722 22.538 -34.725 271 HA GLN 25 HA GLN 25 21.860 24.666 -33.920 272 HB2 GLN 25 HB2 GLN 25 24.914 24.671 -34.667 273 HB3 GLN 25 HB3 GLN 25 24.061 25.976 -34.032 274 HG2 GLN 25 HG2 GLN 25 25.071 23.574 -32.733 275 HG3 GLN 25 HG3 GLN 25 25.094 25.215 -32.234 276 HE21 GLN 25 HE22 GLN 25 23.784 22.109 -31.671 277 HE22 GLN 25 HE21 GLN 25 22.400 22.678 -30.656 278 H ASP 26 H ASP 26 22.819 23.399 -36.908 279 HA ASP 26 HA ASP 26 22.659 26.002 -38.211 280 HB2 ASP 26 HB2 ASP 26 23.095 24.773 -40.374 281 HB3 ASP 26 HB3 ASP 26 24.244 24.304 -39.142 282 H GLY 27 H GLY 27 20.244 24.585 -36.799 283 HA2 GLY 27 HA2 GLY 27 18.052 24.703 -37.023 284 HA3 GLY 27 HA3 GLY 27 18.132 25.129 -38.768 285 H SER 28 H SER 28 19.913 22.304 -38.602 286 HA SER 28 HA SER 28 17.990 20.850 -39.708 287 HB2 SER 28 HB2 SER 28 19.555 19.166 -40.004 288 HB3 SER 28 HB3 SER 28 20.313 20.682 -40.301 289 HG SER 28 HG SER 28 21.360 20.596 -38.458 290 H VAL 29 H VAL 29 16.883 18.969 -39.037 291 HA VAL 29 HA VAL 29 17.081 17.980 -36.250 292 HB VAL 29 HB VAL 29 14.474 18.788 -37.590 293 HG11 VAL 29 HG11 VAL 29 14.917 18.382 -34.640 294 HG12 VAL 29 HG12 VAL 29 13.362 18.334 -35.570 295 HG13 VAL 29 HG13 VAL 29 14.450 17.016 -35.698 296 HG21 VAL 29 HG21 VAL 29 14.396 20.748 -36.094 297 HG22 VAL 29 HG22 VAL 29 15.975 20.330 -35.437 298 HG23 VAL 29 HG23 VAL 29 15.683 20.832 -37.136 299 H VAL 30 H VAL 30 16.789 15.875 -36.215 300 HA VAL 30 HA VAL 30 15.079 14.369 -38.107 301 HB VAL 30 HB VAL 30 16.859 12.626 -38.537 302 HG11 VAL 30 HG11 VAL 30 18.034 15.052 -39.881 303 HG12 VAL 30 HG12 VAL 30 17.972 13.373 -40.356 304 HG13 VAL 30 HG13 VAL 30 16.464 14.356 -40.341 305 HG21 VAL 30 HG21 VAL 30 18.679 13.284 -36.826 306 HG22 VAL 30 HG22 VAL 30 19.377 13.124 -38.365 307 HG23 VAL 30 HG23 VAL 30 18.947 14.756 -37.745 308 H GLN 31 H GLN 31 14.992 12.054 -37.583 309 HA GLN 31 HA GLN 31 15.577 11.474 -34.746 310 HB2 GLN 31 HB2 GLN 31 13.402 11.699 -34.142 311 HB3 GLN 31 HB3 GLN 31 12.890 11.893 -35.877 312 HG2 GLN 31 HG2 GLN 31 12.772 9.300 -35.979 313 HG3 GLN 31 HG3 GLN 31 13.431 9.214 -34.373 314 HE21 GLN 31 HE22 GLN 31 11.262 7.881 -34.377 315 HE22 GLN 31 HE21 GLN 31 10.038 8.880 -33.590 316 H PHE 32 H PHE 32 15.911 9.518 -34.161 317 HA PHE 32 HA PHE 32 16.412 7.487 -36.285 318 HB2 PHE 32 HB2 PHE 32 17.820 7.942 -33.661 319 HB3 PHE 32 HB3 PHE 32 18.174 6.668 -34.728 320 HD1 PHE 32 HD1 PHE 32 18.294 10.420 -34.960 321 HD2 PHE 32 HD2 PHE 32 19.878 6.582 -36.138 322 HE1 PHE 32 HE1 PHE 32 20.114 11.425 -36.423 323 HE2 PHE 32 HE2 PHE 32 21.666 7.657 -37.376 324 HZ PHE 32 HZ PHE 32 21.616 10.123 -37.696 325 H LYS 33 H LYS 33 15.435 5.631 -36.115 326 HA LYS 33 HA LYS 33 14.104 4.818 -33.577 327 HB2 LYS 33 HB2 LYS 33 12.529 5.138 -35.358 328 HB3 LYS 33 HB3 LYS 33 13.211 4.100 -36.462 329 HG2 LYS 33 HG2 LYS 33 12.820 2.285 -34.397 330 HG3 LYS 33 HG3 LYS 33 11.842 3.478 -33.790 331 HD2 LYS 33 HD2 LYS 33 10.453 3.621 -35.896 332 HD3 LYS 33 HD3 LYS 33 11.608 2.304 -36.551 333 HE2 LYS 33 HE2 LYS 33 10.961 0.871 -34.698 334 HE3 LYS 33 HE3 LYS 33 9.665 2.067 -34.323 335 HZ1 LYS 33 HZ1 LYS 33 8.822 1.677 -36.606 336 HZ2 LYS 33 HZ2 LYS 33 9.830 0.431 -36.729 337 HZ3 LYS 33 HZ3 LYS 33 8.733 0.415 -35.587 338 H ILE 34 H ILE 34 15.169 3.653 -32.431 339 HA ILE 34 HA ILE 34 17.126 1.564 -33.485 340 HB ILE 34 HB ILE 34 19.007 2.399 -32.341 341 HG12 ILE 34 HG12 ILE 34 17.227 4.529 -31.061 342 HG13 ILE 34 HG13 ILE 34 18.025 3.156 -30.310 343 HG21 ILE 34 HG21 ILE 34 18.740 3.275 -34.569 344 HG22 ILE 34 HG22 ILE 34 17.967 4.723 -33.793 345 HG23 ILE 34 HG23 ILE 34 19.641 4.157 -33.506 346 HD11 ILE 34 HD11 ILE 34 19.423 5.475 -31.505 347 HD12 ILE 34 HD12 ILE 34 19.442 4.933 -29.816 348 HD13 ILE 34 HD13 ILE 34 20.162 3.878 -31.045 349 H LYS 35 H LYS 35 18.172 0.512 -31.345 350 HA LYS 35 HA LYS 35 15.878 -0.224 -29.519 351 HB2 LYS 35 HB2 LYS 35 18.290 -1.935 -29.973 352 HB3 LYS 35 HB3 LYS 35 16.981 -2.057 -28.815 353 HG2 LYS 35 HG2 LYS 35 15.261 -2.329 -30.598 354 HG3 LYS 35 HG3 LYS 35 16.536 -2.146 -31.804 355 HD2 LYS 35 HD2 LYS 35 17.659 -4.253 -30.853 356 HD3 LYS 35 HD3 LYS 35 16.121 -4.360 -29.874 357 HE2 LYS 35 HE2 LYS 35 14.926 -4.463 -32.018 358 HE3 LYS 35 HE3 LYS 35 16.517 -4.123 -32.846 359 HZ1 LYS 35 HZ1 LYS 35 15.652 -6.673 -31.505 360 HZ2 LYS 35 HZ2 LYS 35 15.969 -6.425 -33.125 361 HZ3 LYS 35 HZ3 LYS 35 17.144 -6.474 -32.071 362 H ARG 36 H ARG 36 16.391 -0.376 -27.237 363 HA ARG 36 HA ARG 36 17.767 2.015 -26.301 364 HB2 ARG 36 HB2 ARG 36 16.660 -0.588 -25.132 365 HB3 ARG 36 HB3 ARG 36 17.177 0.721 -24.108 366 HG2 ARG 36 HG2 ARG 36 15.345 2.210 -25.198 367 HG3 ARG 36 HG3 ARG 36 14.796 0.640 -25.934 368 HD2 ARG 36 HD2 ARG 36 13.620 1.413 -23.855 369 HD3 ARG 36 HD3 ARG 36 14.326 -0.168 -23.764 370 HE ARG 36 HE ARG 36 15.665 0.661 -22.009 371 HH11 ARG 36 HH11 ARG 36 13.831 3.217 -23.612 372 HH12 ARG 36 HH12 ARG 36 14.591 4.449 -22.556 373 HH21 ARG 36 HH21 ARG 36 16.502 2.356 -20.817 374 HH22 ARG 36 HH22 ARG 36 15.833 3.945 -20.815 375 H HIS 37 H HIS 37 18.928 -1.454 -26.776 376 HA HIS 37 HA HIS 37 21.429 -0.744 -25.626 377 HB2 HIS 37 HB2 HIS 37 21.841 -3.331 -26.065 378 HB3 HIS 37 HB3 HIS 37 20.563 -2.884 -24.995 379 HD2 HIS 37 HD2 HIS 37 21.418 -5.223 -27.472 380 HE1 HIS 37 HE1 HIS 37 17.334 -4.685 -28.278 381 HE2 HIS 37 HE2 HIS 37 19.269 -6.102 -28.777 382 H THR 38 H THR 38 20.291 0.364 -28.543 383 HA THR 38 HA THR 38 22.292 -0.831 -30.249 384 HB THR 38 HB THR 38 20.388 1.464 -30.733 385 HG1 THR 38 HG1 THR 38 20.364 -1.276 -30.832 386 HG21 THR 38 HG21 THR 38 22.382 1.879 -32.203 387 HG22 THR 38 HG22 THR 38 22.462 0.269 -32.723 388 HG23 THR 38 HG23 THR 38 21.057 1.227 -33.143 389 HA PRO 39 HA PRO 39 25.645 1.824 -28.881 390 HB2 PRO 39 HB2 PRO 39 26.552 1.687 -31.742 391 HB3 PRO 39 HB3 PRO 39 27.613 1.562 -30.323 392 HG2 PRO 39 HG2 PRO 39 26.746 -0.839 -31.481 393 HG3 PRO 39 HG3 PRO 39 26.692 -0.705 -29.703 394 HD2 PRO 39 HD2 PRO 39 24.565 -0.403 -31.751 395 HD3 PRO 39 HD3 PRO 39 24.476 -1.195 -30.227 396 H LEU 40 H LEU 40 25.798 3.916 -28.565 397 HA LEU 40 HA LEU 40 24.321 5.761 -30.099 398 HB2 LEU 40 HB2 LEU 40 26.371 6.077 -27.924 399 HB3 LEU 40 HB3 LEU 40 25.663 7.558 -28.561 400 HG LEU 40 HG LEU 40 24.150 5.238 -27.256 401 HD11 LEU 40 HD11 LEU 40 23.745 6.785 -25.441 402 HD12 LEU 40 HD12 LEU 40 25.511 6.923 -25.863 403 HD13 LEU 40 HD13 LEU 40 24.307 8.112 -26.376 404 HD21 LEU 40 HD21 LEU 40 22.185 6.702 -27.263 405 HD22 LEU 40 HD22 LEU 40 23.071 7.871 -28.347 406 HD23 LEU 40 HD23 LEU 40 22.558 6.288 -28.936 407 H SER 41 H SER 41 27.586 4.575 -30.162 408 HA SER 41 HA SER 41 28.741 6.459 -32.128 409 HB2 SER 41 HB2 SER 41 30.238 4.828 -32.598 410 HB3 SER 41 HB3 SER 41 30.115 4.934 -30.818 411 HG SER 41 HG SER 41 30.074 2.695 -31.809 412 H LYS 42 H LYS 42 26.975 3.443 -32.731 413 HA LYS 42 HA LYS 42 26.897 3.760 -35.615 414 HB2 LYS 42 HB2 LYS 42 24.916 2.114 -34.059 415 HB3 LYS 42 HB3 LYS 42 25.054 2.234 -35.773 416 HG2 LYS 42 HG2 LYS 42 27.268 1.336 -35.689 417 HG3 LYS 42 HG3 LYS 42 27.073 1.036 -33.938 418 HD2 LYS 42 HD2 LYS 42 25.113 -0.521 -34.668 419 HD3 LYS 42 HD3 LYS 42 25.285 -0.167 -36.374 420 HE2 LYS 42 HE2 LYS 42 27.113 -1.254 -36.697 421 HE3 LYS 42 HE3 LYS 42 27.789 -1.241 -35.065 422 HZ1 LYS 42 HZ1 LYS 42 26.203 -2.808 -34.352 423 HZ2 LYS 42 HZ2 LYS 42 25.338 -2.640 -35.826 424 HZ3 LYS 42 HZ3 LYS 42 26.747 -3.300 -35.827 425 H LEU 43 H LEU 43 24.220 4.849 -33.225 426 HA LEU 43 HA LEU 43 22.951 6.605 -35.096 427 HB2 LEU 43 HB2 LEU 43 22.365 6.316 -32.606 428 HB3 LEU 43 HB3 LEU 43 23.778 7.468 -32.413 429 HG LEU 43 HG LEU 43 21.859 8.493 -34.283 430 HD11 LEU 43 HD11 LEU 43 20.081 9.089 -32.907 431 HD12 LEU 43 HD12 LEU 43 20.107 7.402 -33.016 432 HD13 LEU 43 HD13 LEU 43 20.904 8.112 -31.580 433 HD21 LEU 43 HD21 LEU 43 23.053 9.450 -31.714 434 HD22 LEU 43 HD22 LEU 43 23.654 9.621 -33.389 435 HD23 LEU 43 HD23 LEU 43 22.196 10.478 -32.967 436 H MET 44 H MET 44 25.795 7.679 -33.177 437 HA MET 44 HA MET 44 26.124 10.195 -34.439 438 HB2 MET 44 HB2 MET 44 28.237 8.496 -33.139 439 HB3 MET 44 HB3 MET 44 28.413 10.175 -33.462 440 HG2 MET 44 HG2 MET 44 26.458 10.757 -32.059 441 HG3 MET 44 HG3 MET 44 26.351 9.126 -31.494 442 HE1 MET 44 HE1 MET 44 27.907 8.211 -29.505 443 HE2 MET 44 HE2 MET 44 29.163 7.984 -30.708 444 HE3 MET 44 HE3 MET 44 29.493 8.878 -29.180 445 H LYS 45 H LYS 45 27.939 7.163 -35.515 446 HA LYS 45 HA LYS 45 29.094 8.378 -37.836 447 HB2 LYS 45 HB2 LYS 45 28.379 5.391 -37.427 448 HB3 LYS 45 HB3 LYS 45 29.377 5.951 -38.748 449 HG2 LYS 45 HG2 LYS 45 31.144 6.610 -37.389 450 HG3 LYS 45 HG3 LYS 45 30.197 6.550 -35.887 451 HD2 LYS 45 HD2 LYS 45 31.503 4.745 -35.794 452 HD3 LYS 45 HD3 LYS 45 30.047 3.984 -36.208 453 HE2 LYS 45 HE2 LYS 45 31.057 3.821 -38.709 454 HE3 LYS 45 HE3 LYS 45 32.375 4.780 -37.991 455 HZ1 LYS 45 HZ1 LYS 45 32.791 2.309 -38.271 456 HZ2 LYS 45 HZ2 LYS 45 32.932 2.814 -36.837 457 HZ3 LYS 45 HZ3 LYS 45 31.519 2.076 -37.183 458 H ALA 46 H ALA 46 26.007 6.763 -37.456 459 HA ALA 46 HA ALA 46 25.308 7.224 -40.308 460 HB1 ALA 46 HB1 ALA 46 23.624 6.713 -37.729 461 HB2 ALA 46 HB2 ALA 46 22.887 6.964 -39.252 462 HB3 ALA 46 HB3 ALA 46 23.896 5.508 -39.069 463 H TYR 47 H TYR 47 24.650 9.358 -37.307 464 HA TYR 47 HA TYR 47 23.449 11.215 -39.130 465 HB2 TYR 47 HB2 TYR 47 23.266 11.111 -36.512 466 HB3 TYR 47 HB3 TYR 47 25.065 11.484 -36.502 467 HD1 TYR 47 HD1 TYR 47 21.716 12.918 -37.068 468 HD2 TYR 47 HD2 TYR 47 26.014 13.618 -37.114 469 HE1 TYR 47 HE1 TYR 47 21.273 15.290 -37.180 470 HE2 TYR 47 HE2 TYR 47 25.578 16.098 -37.072 471 HH TYR 47 HH TYR 47 22.443 17.527 -36.938 472 H CYS 48 H CYS 48 26.997 10.779 -38.180 473 HA CYS 48 HA CYS 48 27.690 13.274 -39.401 474 HB2 CYS 48 HB2 CYS 48 29.116 11.865 -37.749 475 HB3 CYS 48 HB3 CYS 48 29.193 10.648 -39.058 476 HG CYS 48 HG CYS 48 30.347 12.820 -40.638 477 H GLU 49 H GLU 49 27.725 9.997 -40.805 478 HA GLU 49 HA GLU 49 28.532 10.718 -43.469 479 HB2 GLU 49 HB2 GLU 49 26.904 8.352 -42.526 480 HB3 GLU 49 HB3 GLU 49 27.634 8.473 -44.101 481 HG2 GLU 49 HG2 GLU 49 29.270 8.454 -41.490 482 HG3 GLU 49 HG3 GLU 49 28.683 7.053 -42.401 483 H ARG 50 H ARG 50 25.241 10.742 -42.134 484 HA ARG 50 HA ARG 50 23.880 11.337 -44.637 485 HB2 ARG 50 HB2 ARG 50 22.953 10.443 -42.616 486 HB3 ARG 50 HB3 ARG 50 23.097 11.975 -41.757 487 HG2 ARG 50 HG2 ARG 50 21.343 12.925 -42.754 488 HG3 ARG 50 HG3 ARG 50 21.249 11.950 -44.189 489 HD2 ARG 50 HD2 ARG 50 20.898 10.284 -41.986 490 HD3 ARG 50 HD3 ARG 50 19.884 11.755 -41.712 491 HE ARG 50 HE ARG 50 19.467 9.520 -43.532 492 HH11 ARG 50 HH11 ARG 50 18.610 12.877 -42.876 493 HH12 ARG 50 HH12 ARG 50 16.977 12.620 -43.455 494 HH21 ARG 50 HH21 ARG 50 17.513 9.637 -44.818 495 HH22 ARG 50 HH22 ARG 50 16.447 10.957 -44.447 496 H GLN 51 H GLN 51 25.428 13.331 -42.319 497 HA GLN 51 HA GLN 51 24.710 15.936 -43.522 498 HB2 GLN 51 HB2 GLN 51 26.596 15.352 -41.092 499 HB3 GLN 51 HB3 GLN 51 26.139 16.915 -41.489 500 HG2 GLN 51 HG2 GLN 51 24.474 14.766 -40.191 501 HG3 GLN 51 HG3 GLN 51 24.562 16.479 -39.711 502 HE21 GLN 51 HE22 GLN 51 23.548 17.941 -41.527 503 HE22 GLN 51 HE21 GLN 51 22.172 17.286 -42.476 504 H GLY 52 H GLY 52 27.023 13.621 -44.021 505 HA2 GLY 52 HA2 GLY 52 28.452 13.469 -45.642 506 HA3 GLY 52 HA3 GLY 52 28.237 15.141 -46.085 507 H LEU 53 H LEU 53 29.288 14.275 -42.746 508 HA LEU 53 HA LEU 53 31.738 15.899 -43.322 509 HB2 LEU 53 HB2 LEU 53 30.127 15.669 -40.730 510 HB3 LEU 53 HB3 LEU 53 31.526 16.642 -40.834 511 HG LEU 53 HG LEU 53 28.922 17.212 -42.304 512 HD11 LEU 53 HD11 LEU 53 29.896 18.694 -39.882 513 HD12 LEU 53 HD12 LEU 53 28.431 18.979 -40.714 514 HD13 LEU 53 HD13 LEU 53 28.590 17.470 -39.911 515 HD21 LEU 53 HD21 LEU 53 31.010 18.309 -43.338 516 HD22 LEU 53 HD22 LEU 53 29.939 19.552 -42.575 517 HD23 LEU 53 HD23 LEU 53 31.391 18.991 -41.768 518 H SER 54 H SER 54 33.725 15.611 -41.880 519 HA SER 54 HA SER 54 34.150 12.818 -41.255 520 HB2 SER 54 HB2 SER 54 36.021 14.318 -42.111 521 HB3 SER 54 HB3 SER 54 35.982 15.244 -40.693 522 HG SER 54 HG SER 54 36.521 12.510 -40.949 523 H MET 55 H MET 55 33.860 12.009 -39.231 524 HA MET 55 HA MET 55 32.423 13.404 -37.405 525 HB2 MET 55 HB2 MET 55 32.217 11.056 -37.870 526 HB3 MET 55 HB3 MET 55 33.582 10.621 -36.877 527 HG2 MET 55 HG2 MET 55 32.543 11.604 -34.865 528 HG3 MET 55 HG3 MET 55 31.186 12.232 -35.896 529 HE1 MET 55 HE1 MET 55 32.448 9.448 -33.743 530 HE2 MET 55 HE2 MET 55 30.717 9.320 -33.268 531 HE3 MET 55 HE3 MET 55 31.513 8.078 -34.304 532 H ARG 56 H ARG 56 35.755 13.426 -37.704 533 HA ARG 56 HA ARG 56 36.640 14.401 -35.272 534 HB2 ARG 56 HB2 ARG 56 37.951 13.792 -37.241 535 HB3 ARG 56 HB3 ARG 56 37.701 15.313 -38.058 536 HG2 ARG 56 HG2 ARG 56 38.824 16.451 -36.165 537 HG3 ARG 56 HG3 ARG 56 38.909 14.924 -35.339 538 HD2 ARG 56 HD2 ARG 56 40.543 14.146 -36.808 539 HD3 ARG 56 HD3 ARG 56 40.134 15.378 -38.094 540 HE ARG 56 HE ARG 56 40.781 17.182 -36.358 541 HH11 ARG 56 HH11 ARG 56 42.365 14.076 -36.745 542 HH12 ARG 56 HH12 ARG 56 43.904 14.659 -36.178 543 HH21 ARG 56 HH21 ARG 56 42.690 17.906 -35.653 544 HH22 ARG 56 HH22 ARG 56 44.146 16.879 -35.663 545 H GLN 57 H GLN 57 34.682 16.084 -37.693 546 HA GLN 57 HA GLN 57 35.490 18.755 -36.735 547 HB2 GLN 57 HB2 GLN 57 35.249 18.557 -39.199 548 HB3 GLN 57 HB3 GLN 57 33.611 18.080 -39.038 549 HG2 GLN 57 HG2 GLN 57 32.809 20.142 -38.233 550 HG3 GLN 57 HG3 GLN 57 34.368 20.835 -38.016 551 HE21 GLN 57 HE22 GLN 57 32.843 22.242 -39.316 552 HE22 GLN 57 HE21 GLN 57 33.283 22.394 -41.063 553 H ILE 58 H ILE 58 33.178 16.640 -35.652 554 HA ILE 58 HA ILE 58 31.483 18.825 -34.443 555 HB ILE 58 HB ILE 58 29.636 17.349 -34.743 556 HG12 ILE 58 HG12 ILE 58 31.039 15.947 -36.990 557 HG13 ILE 58 HG13 ILE 58 31.132 15.355 -35.345 558 HG21 ILE 58 HG21 ILE 58 30.996 18.777 -37.013 559 HG22 ILE 58 HG22 ILE 58 29.419 18.001 -37.223 560 HG23 ILE 58 HG23 ILE 58 29.736 19.339 -36.033 561 HD11 ILE 58 HD11 ILE 58 28.473 15.595 -35.318 562 HD12 ILE 58 HD12 ILE 58 28.571 15.501 -37.039 563 HD13 ILE 58 HD13 ILE 58 29.319 14.230 -36.010 564 H ARG 59 H ARG 59 30.240 17.958 -32.510 565 HA ARG 59 HA ARG 59 31.274 15.747 -30.984 566 HB2 ARG 59 HB2 ARG 59 31.296 18.632 -30.000 567 HB3 ARG 59 HB3 ARG 59 31.374 17.359 -28.919 568 HG2 ARG 59 HG2 ARG 59 33.425 18.348 -30.864 569 HG3 ARG 59 HG3 ARG 59 33.607 18.149 -29.121 570 HD2 ARG 59 HD2 ARG 59 33.604 15.763 -29.173 571 HD3 ARG 59 HD3 ARG 59 33.386 15.798 -30.971 572 HE ARG 59 HE ARG 59 35.737 16.059 -29.298 573 HH11 ARG 59 HH11 ARG 59 34.535 16.640 -32.565 574 HH12 ARG 59 HH12 ARG 59 36.135 16.635 -33.198 575 HH21 ARG 59 HH21 ARG 59 37.685 15.973 -30.341 576 HH22 ARG 59 HH22 ARG 59 37.964 16.582 -31.977 577 H PHE 60 H PHE 60 29.712 14.857 -29.676 578 HA PHE 60 HA PHE 60 26.995 15.923 -30.051 579 HB2 PHE 60 HB2 PHE 60 27.893 13.126 -29.578 580 HB3 PHE 60 HB3 PHE 60 26.134 13.690 -29.775 581 HD1 PHE 60 HD1 PHE 60 29.291 13.530 -31.700 582 HD2 PHE 60 HD2 PHE 60 25.004 13.505 -31.965 583 HE1 PHE 60 HE1 PHE 60 29.424 12.639 -34.046 584 HE2 PHE 60 HE2 PHE 60 25.241 13.054 -34.395 585 HZ PHE 60 HZ PHE 60 27.353 12.620 -35.401 586 H ARG 61 H ARG 61 25.480 15.507 -28.338 587 HA ARG 61 HA ARG 61 26.427 15.306 -25.607 588 HB2 ARG 61 HB2 ARG 61 25.410 17.957 -26.629 589 HB3 ARG 61 HB3 ARG 61 25.547 17.583 -24.958 590 HG2 ARG 61 HG2 ARG 61 28.011 17.153 -25.320 591 HG3 ARG 61 HG3 ARG 61 27.834 17.879 -26.842 592 HD2 ARG 61 HD2 ARG 61 26.793 19.874 -25.798 593 HD3 ARG 61 HD3 ARG 61 27.028 19.137 -24.179 594 HE ARG 61 HE ARG 61 29.569 19.070 -25.582 595 HH11 ARG 61 HH11 ARG 61 27.679 21.517 -23.999 596 HH12 ARG 61 HH12 ARG 61 29.100 22.532 -23.924 597 HH21 ARG 61 HH21 ARG 61 31.177 20.370 -25.469 598 HH22 ARG 61 HH22 ARG 61 30.989 21.924 -24.648 599 H PHE 62 H PHE 62 24.878 15.360 -24.053 600 HA PHE 62 HA PHE 62 21.935 15.235 -24.663 601 HB2 PHE 62 HB2 PHE 62 22.439 13.045 -25.343 602 HB3 PHE 62 HB3 PHE 62 23.394 12.663 -23.978 603 HD1 PHE 62 HD2 PHE 62 19.969 14.243 -24.486 604 HD2 PHE 62 HD1 PHE 62 22.342 11.201 -22.404 605 HE1 PHE 62 HE2 PHE 62 18.006 13.637 -23.034 606 HE2 PHE 62 HE1 PHE 62 20.362 10.473 -21.168 607 HZ PHE 62 HZ PHE 62 18.206 11.674 -21.504 608 H ASP 63 H ASP 63 20.856 16.130 -22.691 609 HA ASP 63 HA ASP 63 20.736 17.096 -20.854 610 HB2 ASP 63 HB2 ASP 63 20.552 14.665 -20.233 611 HB3 ASP 63 HB3 ASP 63 22.161 14.865 -19.530 612 H GLY 64 H GLY 64 23.080 17.766 -22.287 613 HA2 GLY 64 HA2 GLY 64 24.655 19.382 -22.395 614 HA3 GLY 64 HA3 GLY 64 24.444 19.659 -20.603 615 H GLN 65 H GLN 65 25.051 16.421 -21.563 616 HA GLN 65 HA GLN 65 27.793 16.495 -20.503 617 HB2 GLN 65 HB2 GLN 65 25.835 14.225 -20.852 618 HB3 GLN 65 HB3 GLN 65 27.361 14.106 -20.007 619 HG2 GLN 65 HG2 GLN 65 24.727 15.458 -19.222 620 HG3 GLN 65 HG3 GLN 65 25.416 14.184 -18.354 621 HE21 GLN 65 HE22 GLN 65 24.789 17.351 -17.962 622 HE22 GLN 65 HE21 GLN 65 26.201 17.805 -16.977 623 HA PRO 66 HA PRO 66 29.167 15.199 -24.529 624 HB2 PRO 66 HB2 PRO 66 31.684 14.060 -23.863 625 HB3 PRO 66 HB3 PRO 66 31.491 15.833 -23.875 626 HG2 PRO 66 HG2 PRO 66 31.527 13.977 -21.697 627 HG3 PRO 66 HG3 PRO 66 32.111 15.619 -21.724 628 HD2 PRO 66 HD2 PRO 66 29.684 15.040 -20.397 629 HD3 PRO 66 HD3 PRO 66 29.996 16.588 -21.283 630 H ILE 67 H ILE 67 29.016 13.374 -25.730 631 HA ILE 67 HA ILE 67 28.163 10.909 -24.332 632 HB ILE 67 HB ILE 67 28.025 11.700 -27.356 633 HG12 ILE 67 HG12 ILE 67 25.908 11.672 -25.144 634 HG13 ILE 67 HG13 ILE 67 26.425 12.950 -26.135 635 HG21 ILE 67 HG21 ILE 67 28.323 9.201 -26.961 636 HG22 ILE 67 HG22 ILE 67 26.954 9.203 -25.845 637 HG23 ILE 67 HG23 ILE 67 26.743 9.581 -27.590 638 HD11 ILE 67 HD11 ILE 67 24.527 12.411 -27.299 639 HD12 ILE 67 HD12 ILE 67 25.508 11.307 -28.190 640 HD13 ILE 67 HD13 ILE 67 24.606 10.651 -26.795 641 H ASN 68 H ASN 68 29.169 9.169 -24.295 642 HA ASN 68 HA ASN 68 32.045 8.979 -25.372 643 HB2 ASN 68 HB2 ASN 68 30.625 7.189 -23.535 644 HB3 ASN 68 HB3 ASN 68 32.358 7.429 -23.685 645 HD21 ASN 68 HD22 ASN 68 30.154 7.568 -21.520 646 HD22 ASN 68 HD21 ASN 68 30.986 8.787 -20.532 647 H GLU 69 H GLU 69 32.567 7.539 -26.843 648 HA GLU 69 HA GLU 69 30.619 6.110 -28.447 649 HB2 GLU 69 HB2 GLU 69 33.599 5.719 -28.256 650 HB3 GLU 69 HB3 GLU 69 32.548 5.113 -29.535 651 HG2 GLU 69 HG2 GLU 69 31.920 7.364 -30.137 652 HG3 GLU 69 HG3 GLU 69 33.088 8.006 -28.994 653 H THR 70 H THR 70 31.832 4.958 -25.322 654 HA THR 70 HA THR 70 31.623 2.113 -25.707 655 HB THR 70 HB THR 70 31.402 2.199 -23.230 656 HG1 THR 70 HG1 THR 70 30.678 4.352 -23.023 657 HG21 THR 70 HG21 THR 70 33.734 3.702 -24.425 658 HG22 THR 70 HG22 THR 70 33.798 2.875 -22.900 659 HG23 THR 70 HG23 THR 70 33.543 1.908 -24.324 660 H ASP 71 H ASP 71 29.292 4.651 -25.752 661 HA ASP 71 HA ASP 71 27.471 3.313 -23.917 662 HB2 ASP 71 HB2 ASP 71 27.306 6.245 -24.667 663 HB3 ASP 71 HB3 ASP 71 26.420 5.321 -23.367 664 H THR 72 H THR 72 25.269 3.417 -23.926 665 HA THR 72 HA THR 72 23.838 3.131 -26.618 666 HB THR 72 HB THR 72 22.548 1.435 -25.795 667 HG1 THR 72 HG1 THR 72 23.705 0.498 -23.886 668 HG21 THR 72 HG21 THR 72 24.189 -0.359 -25.751 669 HG22 THR 72 HG22 THR 72 24.317 0.810 -27.113 670 HG23 THR 72 HG23 THR 72 25.480 0.839 -25.744 671 HA PRO 73 HA PRO 73 20.538 5.793 -24.558 672 HB2 PRO 73 HB2 PRO 73 18.698 3.687 -25.550 673 HB3 PRO 73 HB3 PRO 73 18.647 5.547 -25.710 674 HG2 PRO 73 HG2 PRO 73 19.367 4.006 -27.836 675 HG3 PRO 73 HG3 PRO 73 20.134 5.533 -27.469 676 HD2 PRO 73 HD2 PRO 73 20.957 2.780 -26.915 677 HD3 PRO 73 HD3 PRO 73 21.921 4.152 -27.536 678 H ALA 74 H ALA 74 20.726 2.267 -23.839 679 HA ALA 74 HA ALA 74 19.079 2.277 -21.474 680 HB1 ALA 74 HB1 ALA 74 19.806 -0.076 -21.289 681 HB2 ALA 74 HB2 ALA 74 19.457 0.315 -22.935 682 HB3 ALA 74 HB3 ALA 74 21.163 0.177 -22.279 683 H GLN 75 H GLN 75 22.656 2.420 -22.070 684 HA GLN 75 HA GLN 75 23.390 2.499 -19.458 685 HB2 GLN 75 HB2 GLN 75 25.035 1.993 -20.964 686 HB3 GLN 75 HB3 GLN 75 24.645 3.305 -22.109 687 HG2 GLN 75 HG2 GLN 75 26.741 3.745 -21.208 688 HG3 GLN 75 HG3 GLN 75 25.690 4.953 -20.628 689 HE21 GLN 75 HE22 GLN 75 27.148 5.401 -18.811 690 HE22 GLN 75 HE21 GLN 75 26.929 4.341 -17.421 691 H LEU 76 H LEU 76 22.178 5.325 -21.514 692 HA LEU 76 HA LEU 76 22.827 7.289 -19.340 693 HB2 LEU 76 HB2 LEU 76 21.912 7.515 -22.339 694 HB3 LEU 76 HB3 LEU 76 22.324 8.895 -21.340 695 HG LEU 76 HG LEU 76 24.075 6.751 -22.477 696 HD11 LEU 76 HD11 LEU 76 24.973 8.574 -23.759 697 HD12 LEU 76 HD12 LEU 76 23.281 8.915 -23.794 698 HD13 LEU 76 HD13 LEU 76 24.222 9.866 -22.638 699 HD21 LEU 76 HD21 LEU 76 24.701 8.989 -20.407 700 HD22 LEU 76 HD22 LEU 76 24.937 7.231 -20.348 701 HD23 LEU 76 HD23 LEU 76 25.997 8.262 -21.409 702 H GLU 77 H GLU 77 20.360 5.185 -19.919 703 HA GLU 77 HA GLU 77 18.232 5.164 -19.288 704 HB2 GLU 77 HB2 GLU 77 19.220 7.461 -17.603 705 HB3 GLU 77 HB3 GLU 77 17.746 6.615 -17.324 706 HG2 GLU 77 HG2 GLU 77 20.208 4.893 -17.586 707 HG3 GLU 77 HG3 GLU 77 20.064 5.924 -16.165 708 H MET 78 H MET 78 18.513 6.506 -21.725 709 HA MET 78 HA MET 78 16.934 8.903 -21.508 710 HB2 MET 78 HB2 MET 78 17.410 7.609 -24.238 711 HB3 MET 78 HB3 MET 78 17.589 9.304 -23.801 712 HG2 MET 78 HG2 MET 78 19.669 9.121 -22.785 713 HG3 MET 78 HG3 MET 78 19.656 7.369 -23.084 714 HE1 MET 78 HE1 MET 78 20.203 10.870 -24.562 715 HE2 MET 78 HE2 MET 78 20.283 10.512 -26.288 716 HE3 MET 78 HE3 MET 78 18.715 10.407 -25.469 717 H GLU 79 H GLU 79 15.080 9.091 -23.187 718 HA GLU 79 HA GLU 79 13.271 6.730 -23.226 719 HB2 GLU 79 HB2 GLU 79 12.784 9.518 -21.958 720 HB3 GLU 79 HB3 GLU 79 11.546 8.511 -22.624 721 HG2 GLU 79 HG2 GLU 79 13.254 7.432 -20.370 722 HG3 GLU 79 HG3 GLU 79 11.649 8.179 -20.196 723 H ASP 80 H ASP 80 11.346 7.303 -24.603 724 HA ASP 80 HA ASP 80 12.327 8.182 -27.133 725 HB2 ASP 80 HB2 ASP 80 9.344 7.940 -26.477 726 HB3 ASP 80 HB3 ASP 80 10.195 8.063 -28.016 727 H GLU 81 H GLU 81 11.876 9.810 -28.411 728 HA GLU 81 HA GLU 81 12.201 11.920 -29.001 729 HB2 GLU 81 HB2 GLU 81 9.882 12.615 -27.092 730 HB3 GLU 81 HB3 GLU 81 10.276 13.511 -28.531 731 HG2 GLU 81 HG2 GLU 81 9.691 11.680 -30.022 732 HG3 GLU 81 HG3 GLU 81 9.170 10.743 -28.545 733 H ASP 82 H ASP 82 13.226 11.154 -25.980 734 HA ASP 82 HA ASP 82 14.094 13.815 -25.236 735 HB2 ASP 82 HB2 ASP 82 15.461 11.184 -25.221 736 HB3 ASP 82 HB3 ASP 82 16.222 12.619 -24.538 737 H THR 83 H THR 83 16.088 14.934 -26.033 738 HA THR 83 HA THR 83 16.715 14.292 -28.878 739 HB THR 83 HB THR 83 16.451 17.050 -27.552 740 HG1 THR 83 HG1 THR 83 14.485 16.051 -27.993 741 HG21 THR 83 HG21 THR 83 16.701 18.075 -29.662 742 HG22 THR 83 HG22 THR 83 18.140 17.096 -29.291 743 HG23 THR 83 HG23 THR 83 16.797 16.622 -30.470 744 H ILE 84 H ILE 84 18.889 13.963 -29.436 745 HA ILE 84 HA ILE 84 21.027 14.617 -27.713 746 HB ILE 84 HB ILE 84 20.841 13.123 -30.423 747 HG12 ILE 84 HG12 ILE 84 21.782 12.338 -27.603 748 HG13 ILE 84 HG13 ILE 84 20.151 12.031 -28.016 749 HG21 ILE 84 HG21 ILE 84 23.400 13.556 -28.833 750 HG22 ILE 84 HG22 ILE 84 23.038 12.626 -30.318 751 HG23 ILE 84 HG23 ILE 84 22.965 14.348 -30.294 752 HD11 ILE 84 HD11 ILE 84 22.534 10.678 -29.423 753 HD12 ILE 84 HD12 ILE 84 21.280 9.938 -28.563 754 HD13 ILE 84 HD13 ILE 84 20.875 10.714 -30.078 755 H ASP 85 H ASP 85 22.004 16.416 -27.806 756 HA ASP 85 HA ASP 85 21.790 18.396 -29.989 757 HB2 ASP 85 HB2 ASP 85 23.348 18.276 -27.387 758 HB3 ASP 85 HB3 ASP 85 23.601 19.524 -28.594 759 H VAL 86 H VAL 86 23.301 19.008 -31.358 760 HA VAL 86 HA VAL 86 25.968 17.807 -31.429 761 HB VAL 86 HB VAL 86 24.285 18.331 -33.889 762 HG11 VAL 86 HG11 VAL 86 26.478 18.664 -34.330 763 HG12 VAL 86 HG12 VAL 86 27.012 17.112 -33.667 764 HG13 VAL 86 HG13 VAL 86 25.921 17.042 -35.061 765 HG21 VAL 86 HG21 VAL 86 24.867 15.737 -32.226 766 HG22 VAL 86 HG22 VAL 86 23.368 16.494 -32.730 767 HG23 VAL 86 HG23 VAL 86 24.290 15.669 -33.946 768 H PHE 87 H PHE 87 27.664 19.103 -31.967 769 HA PHE 87 HA PHE 87 27.244 21.904 -32.857 770 HB2 PHE 87 HB2 PHE 87 28.718 20.866 -30.390 771 HB3 PHE 87 HB3 PHE 87 28.897 22.455 -30.919 772 HD1 PHE 87 HD2 PHE 87 27.069 24.034 -30.873 773 HD2 PHE 87 HD1 PHE 87 26.795 20.368 -28.716 774 HE1 PHE 87 HE2 PHE 87 25.347 25.079 -29.339 775 HE2 PHE 87 HE1 PHE 87 25.148 21.223 -27.277 776 HZ PHE 87 HZ PHE 87 24.259 23.578 -27.524 777 H GLN 88 H GLN 88 29.531 22.996 -33.187 778 HA GLN 88 HA GLN 88 31.424 21.015 -34.703 779 HB2 GLN 88 HB2 GLN 88 31.057 24.008 -34.092 780 HB3 GLN 88 HB3 GLN 88 32.340 23.367 -35.218 781 HG2 GLN 88 HG2 GLN 88 29.356 23.017 -35.945 782 HG3 GLN 88 HG3 GLN 88 30.357 24.436 -36.418 783 HE21 GLN 88 HE22 GLN 88 29.109 21.728 -37.573 784 HE22 GLN 88 HE21 GLN 88 30.385 21.417 -38.765 785 H GLN 89 H GLN 89 33.417 20.938 -34.302 786 HA GLN 89 HA GLN 89 34.659 21.954 -31.765 787 HB2 GLN 89 HB2 GLN 89 34.749 19.606 -32.185 788 HB3 GLN 89 HB3 GLN 89 35.637 19.732 -33.565 789 HG2 GLN 89 HG2 GLN 89 37.220 19.311 -32.050 790 HG3 GLN 89 HG3 GLN 89 37.527 20.924 -32.173 791 HE21 GLN 89 HE22 GLN 89 38.391 19.914 -29.801 792 HE22 GLN 89 HE21 GLN 89 37.210 20.245 -28.538 793 H GLN 90 H GLN 90 35.381 24.099 -31.992 794 HA GLN 90 HA GLN 90 35.843 25.367 -34.485 795 HB2 GLN 90 HB2 GLN 90 36.342 26.064 -31.583 796 HB3 GLN 90 HB3 GLN 90 36.623 27.282 -32.922 797 HG2 GLN 90 HG2 GLN 90 34.643 27.761 -31.890 798 HG3 GLN 90 HG3 GLN 90 34.145 27.111 -33.463 799 HE21 GLN 90 HE22 GLN 90 32.052 26.504 -32.809 800 HE22 GLN 90 HE21 GLN 90 31.774 24.998 -31.913 801 H THR 91 H THR 91 37.791 25.833 -35.705 802 HA THR 91 HA THR 91 40.111 24.094 -34.885 803 HB THR 91 HB THR 91 41.071 24.830 -37.095 804 HG1 THR 91 HG1 THR 91 39.360 25.978 -38.429 805 HG21 THR 91 HG21 THR 91 38.272 23.820 -37.500 806 HG22 THR 91 HG22 THR 91 39.683 23.573 -38.544 807 HG23 THR 91 HG23 THR 91 39.704 22.900 -36.987 808 H GLY 92 H GLY 92 39.469 27.468 -34.361 809 HA2 GLY 92 HA2 GLY 92 40.800 28.892 -33.209 810 HA3 GLY 92 HA3 GLY 92 42.172 27.798 -33.204 811 H GLY 93 H GLY 93 43.430 29.622 -33.785 812 HA2 GLY 93 HA2 GLY 93 42.954 31.184 -36.257 813 HA3 GLY 93 HA3 GLY 93 44.108 31.424 -34.946 814 H VAL 94 H VAL 94 45.303 32.054 -37.068 815 HA VAL 94 HA VAL 94 47.053 29.729 -37.478 816 HB VAL 94 HB VAL 94 46.290 31.334 -39.956 817 HG11 VAL 94 HG11 VAL 94 48.382 29.220 -39.480 818 HG12 VAL 94 HG12 VAL 94 47.892 29.926 -41.055 819 HG13 VAL 94 HG13 VAL 94 48.730 30.954 -39.806 820 HG21 VAL 94 HG21 VAL 94 44.715 29.757 -39.592 821 HG22 VAL 94 HG22 VAL 94 45.822 29.130 -40.807 822 HG23 VAL 94 HG23 VAL 94 45.958 28.557 -39.122 823 H TYR 95 H TYR 95 48.651 30.312 -36.439 824 HA TYR 95 HA TYR 95 49.323 32.975 -35.560 825 HB2 TYR 95 HB2 TYR 95 50.876 30.353 -35.262 826 HB3 TYR 95 HB3 TYR 95 51.183 31.856 -34.322 827 HD1 TYR 95 HD1 TYR 95 49.316 32.666 -32.653 828 HD2 TYR 95 HD2 TYR 95 49.350 28.698 -34.456 829 HE1 TYR 95 HE1 TYR 95 47.886 31.842 -30.962 830 HE2 TYR 95 HE2 TYR 95 48.219 27.868 -32.483 831 HH TYR 95 HH TYR 95 46.974 28.429 -30.489 Start of MODEL 17 1 H1 ACE 36 HH32 ACE 36 10.750 15.758 -43.762 2 H2 ACE 36 HH33 ACE 36 9.316 16.009 -44.888 3 H3 ACE 36 HH31 ACE 36 9.236 15.270 -43.227 4 H GLU 37 H GLU 37 9.801 14.574 -46.499 5 HA GLU 37 HA GLU 37 9.430 11.707 -45.937 6 HB2 GLU 37 HB2 GLU 37 8.629 13.198 -47.986 7 HB3 GLU 37 HB3 GLU 37 10.324 12.932 -48.539 8 HG2 GLU 37 HG2 GLU 37 8.829 11.440 -49.686 9 HG3 GLU 37 HG3 GLU 37 10.155 10.673 -48.893 10 H ASP 38 H ASP 38 12.345 13.316 -45.554 11 HA ASP 38 HA ASP 38 13.494 10.546 -45.756 12 HB2 ASP 38 HB2 ASP 38 14.229 12.374 -47.410 13 HB3 ASP 38 HB3 ASP 38 15.030 13.115 -45.988 14 H ALA 39 H ALA 39 12.655 12.844 -43.538 15 HA ALA 39 HA ALA 39 14.888 13.226 -41.885 16 HB1 ALA 39 HB1 ALA 39 12.046 13.683 -41.000 17 HB2 ALA 39 HB2 ALA 39 13.540 14.527 -40.572 18 HB3 ALA 39 HB3 ALA 39 12.842 14.773 -42.144 19 H PHE 40 H PHE 40 14.759 10.426 -42.143 20 HA PHE 40 HA PHE 40 14.096 9.463 -39.481 21 HB2 PHE 40 HB2 PHE 40 12.217 9.483 -41.297 22 HB3 PHE 40 HB3 PHE 40 12.948 8.028 -41.994 23 HD1 PHE 40 HD1 PHE 40 11.175 9.398 -39.234 24 HD2 PHE 40 HD2 PHE 40 13.194 5.881 -40.503 25 HE1 PHE 40 HE1 PHE 40 9.667 8.049 -37.690 26 HE2 PHE 40 HE2 PHE 40 11.860 4.487 -38.788 27 HZ PHE 40 HZ PHE 40 10.142 5.662 -37.403 28 H ILE 41 H ILE 41 15.722 7.979 -38.855 29 HA ILE 41 HA ILE 41 17.479 6.626 -40.968 30 HB ILE 41 HB ILE 41 18.480 8.375 -38.531 31 HG12 ILE 41 HG12 ILE 41 19.678 9.631 -40.427 32 HG13 ILE 41 HG13 ILE 41 18.343 8.838 -41.443 33 HG21 ILE 41 HG21 ILE 41 20.571 7.666 -39.504 34 HG22 ILE 41 HG22 ILE 41 19.702 6.211 -39.094 35 HG23 ILE 41 HG23 ILE 41 19.743 6.801 -40.836 36 HD11 ILE 41 HD11 ILE 41 16.737 9.953 -40.149 37 HD12 ILE 41 HD12 ILE 41 17.938 10.578 -39.017 38 HD13 ILE 41 HD13 ILE 41 17.988 11.124 -40.748 39 H VAL 42 H VAL 42 17.611 4.324 -40.645 40 HA VAL 42 HA VAL 42 16.751 3.552 -37.945 41 HB VAL 42 HB VAL 42 15.826 2.065 -40.448 42 HG11 VAL 42 HG11 VAL 42 13.766 1.860 -38.895 43 HG12 VAL 42 HG12 VAL 42 15.145 1.059 -38.292 44 HG13 VAL 42 HG13 VAL 42 14.519 2.567 -37.603 45 HG21 VAL 42 HG21 VAL 42 14.380 4.332 -39.112 46 HG22 VAL 42 HG22 VAL 42 15.217 4.603 -40.714 47 HG23 VAL 42 HG23 VAL 42 13.820 3.580 -40.619 48 H ILE 43 H ILE 43 18.025 2.364 -36.854 49 HA ILE 43 HA ILE 43 20.024 0.466 -38.051 50 HB ILE 43 HB ILE 43 20.356 2.778 -36.193 51 HG12 ILE 43 HG12 ILE 43 21.684 2.335 -38.804 52 HG13 ILE 43 HG13 ILE 43 20.339 3.405 -38.601 53 HG21 ILE 43 HG21 ILE 43 22.786 2.301 -36.078 54 HG22 ILE 43 HG22 ILE 43 21.878 0.757 -35.462 55 HG23 ILE 43 HG23 ILE 43 22.605 0.913 -37.048 56 HD11 ILE 43 HD11 ILE 43 23.098 4.021 -37.738 57 HD12 ILE 43 HD12 ILE 43 21.887 4.932 -38.491 58 HD13 ILE 43 HD13 ILE 43 21.821 4.647 -36.756 59 H SEP 44 H SEP 44 20.701 -1.197 -36.730 60 HA SEP 44 HA SEP 44 20.172 -1.329 -33.897 61 HB2 SEP 44 HB2 SEP 44 19.178 -3.384 -33.618 62 HB3 SEP 44 HB3 SEP 44 18.249 -2.540 -34.786 63 H ASP 45 H ASP 45 21.796 -2.472 -32.910 64 HA ASP 45 HA ASP 45 24.330 -2.116 -34.025 65 HB2 ASP 45 HB2 ASP 45 23.738 -1.968 -31.683 66 HB3 ASP 45 HB3 ASP 45 23.372 -3.638 -31.632 67 H SEP 46 H SEP 46 22.285 -4.789 -34.430 68 HA SEP 46 HA SEP 46 24.557 -6.598 -35.198 69 HB2 SEP 46 HB2 SEP 46 23.428 -8.489 -34.060 70 HB3 SEP 46 HB3 SEP 46 24.272 -7.179 -33.104 71 H ASP 47 H ASP 47 23.859 -6.050 -37.519 72 HA ASP 47 HA ASP 47 21.603 -7.181 -38.727 73 HB2 ASP 47 HB2 ASP 47 23.230 -5.635 -39.607 74 HB3 ASP 47 HB3 ASP 47 24.404 -6.964 -39.764 75 H GLY 48 H GLY 48 21.593 -9.143 -40.021 76 HA2 GLY 48 HA2 GLY 48 21.874 -11.231 -40.595 77 HA3 GLY 48 HA3 GLY 48 23.385 -11.323 -39.566 78 H GLU 49 H GLU 49 22.531 -13.564 -39.288 79 HA GLU 49 HA GLU 49 20.611 -13.520 -37.027 80 HB2 GLU 49 HB2 GLU 49 19.252 -14.179 -38.947 81 HB3 GLU 49 HB3 GLU 49 20.441 -15.441 -39.345 82 HG2 GLU 49 HG2 GLU 49 18.292 -16.080 -38.320 83 HG3 GLU 49 HG3 GLU 49 19.781 -16.722 -37.496 84 HN1 NH2 50 HN1 NH2 50 21.536 -14.479 -35.303 85 HN2 NH2 50 HN2 NH2 50 22.719 -15.788 -35.277 86 H1 MET 1 H1 MET 1 -15.933 -26.832 -36.476 87 H2 MET 1 H2 MET 1 -17.198 -25.852 -36.011 88 H3 MET 1 H3 MET 1 -16.248 -26.639 -34.942 89 HA MET 1 HA MET 1 -15.333 -24.317 -36.382 90 HB2 MET 1 HB2 MET 1 -16.775 -24.133 -34.178 91 HB3 MET 1 HB3 MET 1 -15.483 -24.949 -33.342 92 HG2 MET 1 HG2 MET 1 -15.248 -22.453 -33.190 93 HG3 MET 1 HG3 MET 1 -13.856 -23.256 -33.964 94 HE1 MET 1 HE1 MET 1 -17.200 -21.010 -36.109 95 HE2 MET 1 HE2 MET 1 -17.282 -22.288 -34.940 96 HE3 MET 1 HE3 MET 1 -16.929 -20.634 -34.365 97 H ALA 2 H ALA 2 -13.352 -24.707 -37.203 98 HA ALA 2 HA ALA 2 -11.290 -26.592 -36.194 99 HB1 ALA 2 HB1 ALA 2 -10.095 -25.147 -37.983 100 HB2 ALA 2 HB2 ALA 2 -11.638 -25.883 -38.582 101 HB3 ALA 2 HB3 ALA 2 -11.518 -24.203 -38.147 102 H ASP 3 H ASP 3 -9.361 -25.989 -35.329 103 HA ASP 3 HA ASP 3 -9.455 -23.523 -33.701 104 HB2 ASP 3 HB2 ASP 3 -9.736 -25.944 -32.563 105 HB3 ASP 3 HB3 ASP 3 -8.037 -26.248 -33.098 106 H GLU 4 H GLU 4 -7.376 -22.682 -33.106 107 HA GLU 4 HA GLU 4 -5.025 -23.419 -34.705 108 HB2 GLU 4 HB2 GLU 4 -6.354 -21.804 -36.045 109 HB3 GLU 4 HB3 GLU 4 -5.853 -20.511 -34.881 110 HG2 GLU 4 HG2 GLU 4 -3.594 -20.685 -35.504 111 HG3 GLU 4 HG3 GLU 4 -3.991 -22.222 -36.426 112 H LYS 5 H LYS 5 -3.077 -23.330 -33.774 113 HA LYS 5 HA LYS 5 -2.689 -23.290 -31.072 114 HB2 LYS 5 HB2 LYS 5 -0.980 -23.791 -33.037 115 HB3 LYS 5 HB3 LYS 5 -0.614 -22.083 -32.898 116 HG2 LYS 5 HG2 LYS 5 0.161 -22.437 -30.637 117 HG3 LYS 5 HG3 LYS 5 -0.466 -24.066 -30.601 118 HD2 LYS 5 HD2 LYS 5 1.200 -24.818 -32.278 119 HD3 LYS 5 HD3 LYS 5 1.741 -23.204 -32.600 120 HE2 LYS 5 HE2 LYS 5 1.781 -24.109 -29.690 121 HE3 LYS 5 HE3 LYS 5 2.814 -24.923 -30.660 122 HZ1 LYS 5 HZ1 LYS 5 4.134 -23.065 -30.928 123 HZ2 LYS 5 HZ2 LYS 5 2.971 -21.933 -30.842 124 HZ3 LYS 5 HZ3 LYS 5 3.421 -22.613 -29.506 125 HA PRO 6 HA PRO 6 -3.288 -19.108 -29.891 126 HB2 PRO 6 HB2 PRO 6 -2.442 -19.809 -27.044 127 HB3 PRO 6 HB3 PRO 6 -4.149 -19.392 -27.659 128 HG2 PRO 6 HG2 PRO 6 -3.598 -21.794 -26.915 129 HG3 PRO 6 HG3 PRO 6 -4.594 -21.454 -28.453 130 HD2 PRO 6 HD2 PRO 6 -1.649 -22.129 -28.203 131 HD3 PRO 6 HD3 PRO 6 -2.933 -22.990 -29.100 132 H LYS 7 H LYS 7 -2.375 -17.367 -28.617 133 HA LYS 7 HA LYS 7 0.085 -16.499 -29.847 134 HB2 LYS 7 HB2 LYS 7 -2.035 -15.327 -29.065 135 HB3 LYS 7 HB3 LYS 7 -1.216 -15.293 -27.506 136 HG2 LYS 7 HG2 LYS 7 0.442 -13.817 -28.302 137 HG3 LYS 7 HG3 LYS 7 0.136 -14.116 -29.974 138 HD2 LYS 7 HD2 LYS 7 -1.748 -12.664 -29.774 139 HD3 LYS 7 HD3 LYS 7 -1.694 -12.521 -28.056 140 HE2 LYS 7 HE2 LYS 7 0.437 -11.389 -28.131 141 HE3 LYS 7 HE3 LYS 7 0.543 -11.503 -29.802 142 HZ1 LYS 7 HZ1 LYS 7 -1.499 -9.984 -28.230 143 HZ2 LYS 7 HZ2 LYS 7 -0.363 -9.325 -29.115 144 HZ3 LYS 7 HZ3 LYS 7 -1.622 -10.168 -29.832 145 H GLU 8 H GLU 8 2.093 -16.404 -29.316 146 HA GLU 8 HA GLU 8 3.017 -16.708 -26.459 147 HB2 GLU 8 HB2 GLU 8 4.665 -18.237 -26.757 148 HB3 GLU 8 HB3 GLU 8 3.092 -19.010 -27.076 149 HG2 GLU 8 HG2 GLU 8 3.573 -18.661 -29.589 150 HG3 GLU 8 HG3 GLU 8 5.160 -18.120 -29.243 151 H GLY 9 H GLY 9 5.344 -15.930 -26.232 152 HA2 GLY 9 HA2 GLY 9 7.088 -15.403 -28.095 153 HA3 GLY 9 HA3 GLY 9 6.145 -13.977 -28.406 154 H VAL 10 H VAL 10 7.004 -15.701 -25.288 155 HA VAL 10 HA VAL 10 8.420 -13.249 -24.224 156 HB VAL 10 HB VAL 10 8.526 -15.985 -23.161 157 HG11 VAL 10 HG11 VAL 10 9.357 -13.268 -22.066 158 HG12 VAL 10 HG12 VAL 10 9.155 -14.762 -21.145 159 HG13 VAL 10 HG13 VAL 10 10.311 -14.638 -22.449 160 HG21 VAL 10 HG21 VAL 10 6.541 -13.768 -22.568 161 HG22 VAL 10 HG22 VAL 10 6.383 -15.517 -23.104 162 HG23 VAL 10 HG23 VAL 10 6.884 -15.175 -21.484 163 H LYS 11 H LYS 11 9.760 -12.749 -25.911 164 HA LYS 11 HA LYS 11 12.390 -13.923 -25.510 165 HB2 LYS 11 HB2 LYS 11 11.281 -15.162 -27.455 166 HB3 LYS 11 HB3 LYS 11 11.153 -13.680 -28.269 167 HG2 LYS 11 HG2 LYS 11 13.585 -13.619 -28.563 168 HG3 LYS 11 HG3 LYS 11 13.790 -14.898 -27.236 169 HD2 LYS 11 HD2 LYS 11 12.562 -16.380 -28.809 170 HD3 LYS 11 HD3 LYS 11 12.492 -15.129 -30.009 171 HE2 LYS 11 HE2 LYS 11 15.007 -14.970 -29.964 172 HE3 LYS 11 HE3 LYS 11 15.024 -16.434 -28.884 173 HZ1 LYS 11 HZ1 LYS 11 15.370 -16.995 -31.201 174 HZ2 LYS 11 HZ2 LYS 11 13.947 -17.494 -30.890 175 HZ3 LYS 11 HZ3 LYS 11 13.978 -16.038 -31.608 176 H THR 12 H THR 12 13.970 -12.527 -25.384 177 HA THR 12 HA THR 12 13.960 -9.864 -25.186 178 HB THR 12 HB THR 12 16.368 -9.735 -25.825 179 HG1 THR 12 HG1 THR 12 17.237 -11.555 -26.563 180 HG21 THR 12 HG21 THR 12 15.662 -12.013 -24.081 181 HG22 THR 12 HG22 THR 12 17.182 -11.227 -24.038 182 HG23 THR 12 HG23 THR 12 15.757 -10.290 -23.485 183 H GLU 13 H GLU 13 14.542 -11.296 -28.342 184 HA GLU 13 HA GLU 13 14.854 -9.028 -29.788 185 HB2 GLU 13 HB2 GLU 13 13.650 -11.702 -30.616 186 HB3 GLU 13 HB3 GLU 13 14.162 -10.606 -31.845 187 HG2 GLU 13 HG2 GLU 13 16.178 -11.359 -29.640 188 HG3 GLU 13 HG3 GLU 13 15.794 -12.422 -30.981 189 H ASN 14 H ASN 14 11.803 -10.016 -28.525 190 HA ASN 14 HA ASN 14 9.971 -8.434 -30.293 191 HB2 ASN 14 HB2 ASN 14 9.462 -10.090 -27.779 192 HB3 ASN 14 HB3 ASN 14 8.303 -9.504 -28.964 193 HD21 ASN 14 HD22 ASN 14 8.283 -12.121 -28.242 194 HD22 ASN 14 HD21 ASN 14 8.722 -12.999 -29.715 195 H ASN 15 H ASN 15 11.752 -7.822 -27.472 196 HA ASN 15 HA ASN 15 10.195 -5.821 -26.177 197 HB2 ASN 15 HB2 ASN 15 12.601 -6.758 -25.700 198 HB3 ASN 15 HB3 ASN 15 13.158 -5.473 -26.677 199 HD21 ASN 15 HD22 ASN 15 10.999 -6.195 -23.804 200 HD22 ASN 15 HD21 ASN 15 11.151 -4.625 -23.107 201 H ASP 16 H ASP 16 10.441 -3.401 -26.311 202 HA ASP 16 HA ASP 16 9.855 -2.700 -29.037 203 HB2 ASP 16 HB2 ASP 16 9.508 -1.152 -26.468 204 HB3 ASP 16 HB3 ASP 16 8.944 -0.526 -27.947 205 H HIS 17 H HIS 17 10.430 -0.620 -29.959 206 HA HIS 17 HA HIS 17 13.331 0.009 -29.965 207 HB2 HIS 17 HB2 HIS 17 10.983 1.143 -31.425 208 HB3 HIS 17 HB3 HIS 17 12.619 1.340 -32.055 209 HD2 HIS 17 HD2 HIS 17 13.864 -1.137 -32.605 210 HE1 HIS 17 HE1 HIS 17 10.286 -3.023 -33.770 211 HE2 HIS 17 HE2 HIS 17 12.803 -3.031 -34.134 212 H ILE 18 H ILE 18 14.143 2.043 -29.929 213 HA ILE 18 HA ILE 18 12.610 4.137 -28.447 214 HB ILE 18 HB ILE 18 14.549 3.299 -27.243 215 HG12 ILE 18 HG12 ILE 18 14.361 6.240 -27.756 216 HG13 ILE 18 HG13 ILE 18 13.242 5.461 -26.756 217 HG21 ILE 18 HG21 ILE 18 16.057 5.059 -29.132 218 HG22 ILE 18 HG22 ILE 18 16.796 4.204 -27.898 219 HG23 ILE 18 HG23 ILE 18 16.005 3.293 -29.331 220 HD11 ILE 18 HD11 ILE 18 16.045 5.325 -26.050 221 HD12 ILE 18 HD12 ILE 18 14.836 6.547 -25.411 222 HD13 ILE 18 HD13 ILE 18 14.773 4.804 -25.055 223 H ASN 19 H ASN 19 12.202 6.110 -29.420 224 HA ASN 19 HA ASN 19 13.395 6.759 -32.027 225 HB2 ASN 19 HB2 ASN 19 10.710 7.572 -30.761 226 HB3 ASN 19 HB3 ASN 19 11.350 7.990 -32.276 227 HD21 ASN 19 HD22 ASN 19 10.429 5.244 -30.451 228 HD22 ASN 19 HD21 ASN 19 9.765 4.236 -31.737 229 H LEU 20 H LEU 20 14.982 8.129 -31.715 230 HA LEU 20 HA LEU 20 14.815 10.318 -29.592 231 HB2 LEU 20 HB2 LEU 20 17.099 8.828 -30.877 232 HB3 LEU 20 HB3 LEU 20 17.278 10.202 -29.721 233 HG LEU 20 HG LEU 20 15.954 7.566 -29.197 234 HD11 LEU 20 HD11 LEU 20 18.778 8.419 -28.527 235 HD12 LEU 20 HD12 LEU 20 18.008 7.009 -27.803 236 HD13 LEU 20 HD13 LEU 20 18.193 6.942 -29.472 237 HD21 LEU 20 HD21 LEU 20 16.588 9.656 -27.166 238 HD22 LEU 20 HD22 LEU 20 14.980 9.208 -27.847 239 HD23 LEU 20 HD23 LEU 20 15.877 8.012 -26.952 240 H LYS 21 H LYS 21 14.988 12.415 -30.223 241 HA LYS 21 HA LYS 21 15.234 13.080 -33.076 242 HB2 LYS 21 HB2 LYS 21 14.771 14.751 -30.527 243 HB3 LYS 21 HB3 LYS 21 15.210 15.566 -32.042 244 HG2 LYS 21 HG2 LYS 21 13.326 14.697 -33.195 245 HG3 LYS 21 HG3 LYS 21 12.892 13.675 -31.805 246 HD2 LYS 21 HD2 LYS 21 12.422 15.489 -30.379 247 HD3 LYS 21 HD3 LYS 21 13.056 16.678 -31.454 248 HE2 LYS 21 HE2 LYS 21 11.581 16.260 -33.248 249 HE3 LYS 21 HE3 LYS 21 10.823 14.954 -32.169 250 HZ1 LYS 21 HZ1 LYS 21 10.511 17.696 -31.306 251 HZ2 LYS 21 HZ2 LYS 21 9.375 16.785 -32.000 252 HZ3 LYS 21 HZ3 LYS 21 10.049 16.187 -30.701 253 H VAL 22 H VAL 22 16.997 14.182 -34.029 254 HA VAL 22 HA VAL 22 19.343 14.747 -32.247 255 HB VAL 22 HB VAL 22 19.343 13.906 -35.081 256 HG11 VAL 22 HG11 VAL 22 21.169 15.293 -34.887 257 HG12 VAL 22 HG12 VAL 22 21.679 14.750 -33.305 258 HG13 VAL 22 HG13 VAL 22 21.883 13.624 -34.541 259 HG21 VAL 22 HG21 VAL 22 18.872 12.041 -33.201 260 HG22 VAL 22 HG22 VAL 22 20.367 11.775 -34.233 261 HG23 VAL 22 HG23 VAL 22 20.637 12.313 -32.784 262 H ALA 23 H ALA 23 19.886 16.978 -32.183 263 HA ALA 23 HA ALA 23 18.682 18.732 -34.236 264 HB1 ALA 23 HB1 ALA 23 18.296 19.103 -31.331 265 HB2 ALA 23 HB2 ALA 23 17.590 20.063 -32.750 266 HB3 ALA 23 HB3 ALA 23 17.083 18.401 -32.495 267 H GLY 24 H GLY 24 20.500 19.636 -34.891 268 HA2 GLY 24 HA2 GLY 24 22.708 20.506 -33.178 269 HA3 GLY 24 HA3 GLY 24 22.709 20.692 -35.029 270 H GLN 25 H GLN 25 23.964 22.718 -33.353 271 HA GLN 25 HA GLN 25 21.986 24.527 -32.585 272 HB2 GLN 25 HB2 GLN 25 24.866 25.329 -33.062 273 HB3 GLN 25 HB3 GLN 25 23.681 26.033 -32.044 274 HG2 GLN 25 HG2 GLN 25 25.110 23.397 -31.811 275 HG3 GLN 25 HG3 GLN 25 25.211 24.809 -30.754 276 HE21 GLN 25 HE22 GLN 25 23.968 21.799 -30.714 277 HE22 GLN 25 HE21 GLN 25 22.471 22.026 -29.833 278 H ASP 26 H ASP 26 23.121 23.899 -35.934 279 HA ASP 26 HA ASP 26 22.489 26.552 -37.018 280 HB2 ASP 26 HB2 ASP 26 22.870 25.483 -39.224 281 HB3 ASP 26 HB3 ASP 26 24.255 25.176 -38.186 282 H GLY 27 H GLY 27 20.452 24.743 -35.466 283 HA2 GLY 27 HA2 GLY 27 18.048 24.241 -35.598 284 HA3 GLY 27 HA3 GLY 27 18.117 25.407 -36.883 285 H SER 28 H SER 28 20.212 22.697 -37.521 286 HA SER 28 HA SER 28 18.265 21.395 -39.189 287 HB2 SER 28 HB2 SER 28 19.889 19.689 -39.757 288 HB3 SER 28 HB3 SER 28 20.408 21.349 -40.028 289 HG SER 28 HG SER 28 21.632 21.208 -38.142 290 H VAL 29 H VAL 29 17.010 19.640 -38.748 291 HA VAL 29 HA VAL 29 17.515 18.126 -36.348 292 HB VAL 29 HB VAL 29 14.663 18.654 -37.079 293 HG11 VAL 29 HG11 VAL 29 16.244 17.983 -34.572 294 HG12 VAL 29 HG12 VAL 29 14.555 18.558 -34.583 295 HG13 VAL 29 HG13 VAL 29 14.970 17.009 -35.376 296 HG21 VAL 29 HG21 VAL 29 14.715 20.652 -35.484 297 HG22 VAL 29 HG22 VAL 29 16.481 20.632 -35.585 298 HG23 VAL 29 HG23 VAL 29 15.430 21.011 -36.959 299 H VAL 30 H VAL 30 17.036 15.825 -36.373 300 HA VAL 30 HA VAL 30 15.367 14.693 -38.451 301 HB VAL 30 HB VAL 30 17.121 12.628 -38.794 302 HG11 VAL 30 HG11 VAL 30 17.743 15.338 -40.001 303 HG12 VAL 30 HG12 VAL 30 18.509 13.932 -40.521 304 HG13 VAL 30 HG13 VAL 30 16.753 13.937 -40.716 305 HG21 VAL 30 HG21 VAL 30 18.412 13.179 -36.871 306 HG22 VAL 30 HG22 VAL 30 19.167 12.824 -38.452 307 HG23 VAL 30 HG23 VAL 30 19.088 14.469 -38.028 308 H GLN 31 H GLN 31 14.713 12.493 -38.010 309 HA GLN 31 HA GLN 31 14.726 11.657 -35.051 310 HB2 GLN 31 HB2 GLN 31 12.661 12.129 -36.186 311 HB3 GLN 31 HB3 GLN 31 12.885 10.661 -37.036 312 HG2 GLN 31 HG2 GLN 31 13.437 10.023 -34.238 313 HG3 GLN 31 HG3 GLN 31 12.132 11.197 -34.242 314 HE21 GLN 31 HE22 GLN 31 12.958 7.856 -35.022 315 HE22 GLN 31 HE21 GLN 31 11.312 7.322 -35.211 316 H PHE 32 H PHE 32 16.054 10.113 -34.419 317 HA PHE 32 HA PHE 32 16.776 7.988 -36.431 318 HB2 PHE 32 HB2 PHE 32 18.097 8.575 -33.705 319 HB3 PHE 32 HB3 PHE 32 17.986 6.977 -34.262 320 HD1 PHE 32 HD1 PHE 32 18.567 10.470 -35.823 321 HD2 PHE 32 HD2 PHE 32 19.716 6.339 -35.937 322 HE1 PHE 32 HE1 PHE 32 20.392 11.023 -37.352 323 HE2 PHE 32 HE2 PHE 32 21.713 6.990 -37.245 324 HZ PHE 32 HZ PHE 32 22.026 9.322 -37.911 325 H LYS 33 H LYS 33 15.950 5.859 -36.025 326 HA LYS 33 HA LYS 33 14.548 4.941 -33.488 327 HB2 LYS 33 HB2 LYS 33 12.788 5.309 -35.281 328 HB3 LYS 33 HB3 LYS 33 13.610 4.208 -36.335 329 HG2 LYS 33 HG2 LYS 33 13.388 2.363 -34.737 330 HG3 LYS 33 HG3 LYS 33 12.499 3.511 -33.632 331 HD2 LYS 33 HD2 LYS 33 10.799 3.851 -35.263 332 HD3 LYS 33 HD3 LYS 33 11.587 2.519 -36.216 333 HE2 LYS 33 HE2 LYS 33 11.203 0.900 -34.482 334 HE3 LYS 33 HE3 LYS 33 10.588 1.996 -33.380 335 HZ1 LYS 33 HZ1 LYS 33 8.943 0.662 -34.943 336 HZ2 LYS 33 HZ2 LYS 33 8.538 2.128 -34.511 337 HZ3 LYS 33 HZ3 LYS 33 9.204 1.876 -35.961 338 H ILE 34 H ILE 34 15.766 3.948 -32.490 339 HA ILE 34 HA ILE 34 17.174 1.751 -33.787 340 HB ILE 34 HB ILE 34 19.169 2.144 -32.307 341 HG12 ILE 34 HG12 ILE 34 17.618 4.539 -31.259 342 HG13 ILE 34 HG13 ILE 34 18.098 3.236 -30.371 343 HG21 ILE 34 HG21 ILE 34 18.830 3.257 -34.452 344 HG22 ILE 34 HG22 ILE 34 18.912 4.812 -33.674 345 HG23 ILE 34 HG23 ILE 34 20.309 3.826 -33.484 346 HD11 ILE 34 HD11 ILE 34 19.549 5.224 -30.052 347 HD12 ILE 34 HD12 ILE 34 20.542 3.814 -30.700 348 HD13 ILE 34 HD13 ILE 34 19.971 5.173 -31.703 349 H LYS 35 H LYS 35 18.408 0.468 -31.422 350 HA LYS 35 HA LYS 35 15.962 -0.100 -29.667 351 HB2 LYS 35 HB2 LYS 35 18.462 -1.879 -30.184 352 HB3 LYS 35 HB3 LYS 35 17.126 -2.108 -28.976 353 HG2 LYS 35 HG2 LYS 35 15.506 -2.102 -30.714 354 HG3 LYS 35 HG3 LYS 35 16.683 -1.884 -31.922 355 HD2 LYS 35 HD2 LYS 35 17.879 -4.032 -31.305 356 HD3 LYS 35 HD3 LYS 35 16.623 -4.362 -30.072 357 HE2 LYS 35 HE2 LYS 35 15.004 -4.643 -31.546 358 HE3 LYS 35 HE3 LYS 35 15.838 -3.981 -32.966 359 HZ1 LYS 35 HZ1 LYS 35 17.218 -5.873 -32.941 360 HZ2 LYS 35 HZ2 LYS 35 16.615 -6.477 -31.633 361 HZ3 LYS 35 HZ3 LYS 35 15.631 -6.494 -32.921 362 H ARG 36 H ARG 36 16.533 -0.412 -27.458 363 HA ARG 36 HA ARG 36 17.902 1.984 -26.350 364 HB2 ARG 36 HB2 ARG 36 16.493 -0.374 -24.883 365 HB3 ARG 36 HB3 ARG 36 17.255 0.997 -24.177 366 HG2 ARG 36 HG2 ARG 36 15.860 2.567 -25.348 367 HG3 ARG 36 HG3 ARG 36 15.191 1.295 -26.485 368 HD2 ARG 36 HD2 ARG 36 13.375 1.784 -25.295 369 HD3 ARG 36 HD3 ARG 36 14.036 0.340 -24.562 370 HE ARG 36 HE ARG 36 14.853 1.644 -22.621 371 HH11 ARG 36 HH11 ARG 36 12.179 3.303 -24.455 372 HH12 ARG 36 HH12 ARG 36 11.862 4.186 -22.994 373 HH21 ARG 36 HH21 ARG 36 14.190 2.822 -21.032 374 HH22 ARG 36 HH22 ARG 36 12.747 3.819 -21.220 375 H HIS 37 H HIS 37 18.687 -1.442 -26.652 376 HA HIS 37 HA HIS 37 21.317 -1.321 -25.380 377 HB2 HIS 37 HB2 HIS 37 21.611 -3.422 -25.763 378 HB3 HIS 37 HB3 HIS 37 19.876 -3.288 -25.427 379 HD2 HIS 37 HD2 HIS 37 22.139 -4.767 -27.778 380 HE1 HIS 37 HE1 HIS 37 18.185 -5.656 -29.162 381 HE2 HIS 37 HE2 HIS 37 20.646 -6.197 -29.508 382 H THR 38 H THR 38 20.576 0.123 -28.375 383 HA THR 38 HA THR 38 22.681 -1.014 -30.029 384 HB THR 38 HB THR 38 21.102 1.426 -30.476 385 HG1 THR 38 HG1 THR 38 20.747 -1.316 -31.060 386 HG21 THR 38 HG21 THR 38 22.873 1.642 -32.011 387 HG22 THR 38 HG22 THR 38 22.781 -0.136 -32.293 388 HG23 THR 38 HG23 THR 38 21.541 1.046 -32.857 389 HA PRO 39 HA PRO 39 25.478 2.055 -28.312 390 HB2 PRO 39 HB2 PRO 39 27.125 1.238 -30.738 391 HB3 PRO 39 HB3 PRO 39 27.691 1.728 -29.163 392 HG2 PRO 39 HG2 PRO 39 27.488 -0.916 -29.434 393 HG3 PRO 39 HG3 PRO 39 26.528 -0.219 -28.074 394 HD2 PRO 39 HD2 PRO 39 25.566 -0.615 -30.944 395 HD3 PRO 39 HD3 PRO 39 24.855 -1.385 -29.582 396 H LEU 40 H LEU 40 25.646 4.313 -28.359 397 HA LEU 40 HA LEU 40 24.399 5.813 -30.629 398 HB2 LEU 40 HB2 LEU 40 26.128 6.729 -28.244 399 HB3 LEU 40 HB3 LEU 40 25.132 7.761 -29.169 400 HG LEU 40 HG LEU 40 23.818 5.392 -27.691 401 HD11 LEU 40 HD11 LEU 40 23.380 6.746 -25.798 402 HD12 LEU 40 HD12 LEU 40 24.954 7.284 -26.243 403 HD13 LEU 40 HD13 LEU 40 23.725 8.256 -26.799 404 HD21 LEU 40 HD21 LEU 40 21.724 6.859 -28.195 405 HD22 LEU 40 HD22 LEU 40 22.749 7.940 -29.022 406 HD23 LEU 40 HD23 LEU 40 22.384 6.218 -29.599 407 H SER 41 H SER 41 27.539 4.570 -30.040 408 HA SER 41 HA SER 41 29.055 6.428 -31.656 409 HB2 SER 41 HB2 SER 41 30.824 4.632 -31.821 410 HB3 SER 41 HB3 SER 41 30.273 4.780 -30.206 411 HG SER 41 HG SER 41 30.023 2.587 -30.760 412 H LYS 42 H LYS 42 26.961 3.727 -32.401 413 HA LYS 42 HA LYS 42 27.455 3.857 -35.258 414 HB2 LYS 42 HB2 LYS 42 25.320 2.409 -33.611 415 HB3 LYS 42 HB3 LYS 42 25.389 2.468 -35.359 416 HG2 LYS 42 HG2 LYS 42 27.799 1.586 -35.173 417 HG3 LYS 42 HG3 LYS 42 27.477 1.381 -33.395 418 HD2 LYS 42 HD2 LYS 42 25.806 -0.258 -33.765 419 HD3 LYS 42 HD3 LYS 42 25.837 0.088 -35.558 420 HE2 LYS 42 HE2 LYS 42 28.059 -0.812 -35.724 421 HE3 LYS 42 HE3 LYS 42 28.250 -0.868 -34.019 422 HZ1 LYS 42 HZ1 LYS 42 26.618 -2.760 -34.107 423 HZ2 LYS 42 HZ2 LYS 42 26.014 -2.254 -35.505 424 HZ3 LYS 42 HZ3 LYS 42 27.519 -2.981 -35.374 425 H LEU 43 H LEU 43 25.007 5.303 -33.162 426 HA LEU 43 HA LEU 43 23.504 6.610 -35.157 427 HB2 LEU 43 HB2 LEU 43 22.647 6.458 -32.965 428 HB3 LEU 43 HB3 LEU 43 23.912 7.356 -32.144 429 HG LEU 43 HG LEU 43 22.218 8.695 -34.409 430 HD11 LEU 43 HD11 LEU 43 20.643 9.484 -32.914 431 HD12 LEU 43 HD12 LEU 43 20.606 7.716 -32.640 432 HD13 LEU 43 HD13 LEU 43 21.557 8.699 -31.491 433 HD21 LEU 43 HD21 LEU 43 23.793 9.814 -32.075 434 HD22 LEU 43 HD22 LEU 43 23.804 10.354 -33.746 435 HD23 LEU 43 HD23 LEU 43 22.464 10.698 -32.826 436 H MET 44 H MET 44 26.464 7.840 -33.271 437 HA MET 44 HA MET 44 26.274 10.342 -34.600 438 HB2 MET 44 HB2 MET 44 28.525 9.004 -33.283 439 HB3 MET 44 HB3 MET 44 28.594 10.685 -33.734 440 HG2 MET 44 HG2 MET 44 26.654 11.180 -32.210 441 HG3 MET 44 HG3 MET 44 26.727 9.426 -31.698 442 HE1 MET 44 HE1 MET 44 29.671 8.640 -31.415 443 HE2 MET 44 HE2 MET 44 30.091 9.097 -29.774 444 HE3 MET 44 HE3 MET 44 28.490 8.271 -30.070 445 H LYS 45 H LYS 45 28.279 7.443 -35.430 446 HA LYS 45 HA LYS 45 29.777 8.645 -37.644 447 HB2 LYS 45 HB2 LYS 45 29.100 5.755 -37.000 448 HB3 LYS 45 HB3 LYS 45 30.056 6.088 -38.455 449 HG2 LYS 45 HG2 LYS 45 31.639 7.464 -36.905 450 HG3 LYS 45 HG3 LYS 45 30.646 6.915 -35.596 451 HD2 LYS 45 HD2 LYS 45 32.016 5.055 -37.528 452 HD3 LYS 45 HD3 LYS 45 32.769 5.588 -35.993 453 HE2 LYS 45 HE2 LYS 45 30.851 4.537 -34.734 454 HE3 LYS 45 HE3 LYS 45 30.000 4.149 -36.122 455 HZ1 LYS 45 HZ1 LYS 45 31.277 2.290 -35.152 456 HZ2 LYS 45 HZ2 LYS 45 31.840 2.494 -36.656 457 HZ3 LYS 45 HZ3 LYS 45 32.696 2.973 -35.384 458 H ALA 46 H ALA 46 26.660 6.888 -37.502 459 HA ALA 46 HA ALA 46 25.984 6.968 -40.373 460 HB1 ALA 46 HB1 ALA 46 24.218 6.666 -37.977 461 HB2 ALA 46 HB2 ALA 46 23.901 6.451 -39.755 462 HB3 ALA 46 HB3 ALA 46 25.049 5.393 -38.785 463 H TYR 47 H TYR 47 24.683 9.172 -37.668 464 HA TYR 47 HA TYR 47 23.512 10.949 -39.470 465 HB2 TYR 47 HB2 TYR 47 23.557 11.183 -36.922 466 HB3 TYR 47 HB3 TYR 47 25.316 11.377 -37.029 467 HD1 TYR 47 HD2 TYR 47 26.294 13.532 -37.705 468 HD2 TYR 47 HD1 TYR 47 22.121 12.969 -37.407 469 HE1 TYR 47 HE2 TYR 47 26.073 15.884 -37.857 470 HE2 TYR 47 HE1 TYR 47 21.823 15.507 -37.323 471 HH TYR 47 HH TYR 47 22.848 17.581 -37.228 472 H CYS 48 H CYS 48 27.102 10.733 -38.760 473 HA CYS 48 HA CYS 48 27.602 13.258 -39.933 474 HB2 CYS 48 HB2 CYS 48 29.100 11.725 -38.397 475 HB3 CYS 48 HB3 CYS 48 29.594 11.203 -40.068 476 HG CYS 48 HG CYS 48 30.323 13.350 -40.970 477 H GLU 49 H GLU 49 27.711 9.901 -41.381 478 HA GLU 49 HA GLU 49 28.789 10.767 -43.922 479 HB2 GLU 49 HB2 GLU 49 27.360 8.285 -42.802 480 HB3 GLU 49 HB3 GLU 49 27.372 8.471 -44.532 481 HG2 GLU 49 HG2 GLU 49 29.890 8.583 -42.941 482 HG3 GLU 49 HG3 GLU 49 29.239 7.058 -43.653 483 H ARG 50 H ARG 50 25.471 10.661 -42.409 484 HA ARG 50 HA ARG 50 24.037 11.066 -44.901 485 HB2 ARG 50 HB2 ARG 50 23.315 10.013 -42.616 486 HB3 ARG 50 HB3 ARG 50 22.892 11.766 -42.361 487 HG2 ARG 50 HG2 ARG 50 21.406 11.611 -44.299 488 HG3 ARG 50 HG3 ARG 50 22.064 10.056 -44.783 489 HD2 ARG 50 HD2 ARG 50 21.200 9.192 -42.518 490 HD3 ARG 50 HD3 ARG 50 20.506 10.871 -42.311 491 HE ARG 50 HE ARG 50 19.761 8.492 -43.852 492 HH11 ARG 50 HH11 ARG 50 18.789 11.887 -43.434 493 HH12 ARG 50 HH12 ARG 50 17.188 11.577 -44.049 494 HH21 ARG 50 HH21 ARG 50 17.708 8.266 -44.747 495 HH22 ARG 50 HH22 ARG 50 16.802 9.632 -45.102 496 H GLN 51 H GLN 51 25.474 13.233 -42.512 497 HA GLN 51 HA GLN 51 24.681 15.742 -43.646 498 HB2 GLN 51 HB2 GLN 51 26.976 15.177 -41.608 499 HB3 GLN 51 HB3 GLN 51 26.491 16.790 -42.280 500 HG2 GLN 51 HG2 GLN 51 24.959 15.033 -40.419 501 HG3 GLN 51 HG3 GLN 51 25.546 16.735 -40.380 502 HE21 GLN 51 HE22 GLN 51 24.551 18.233 -42.089 503 HE22 GLN 51 HE21 GLN 51 22.964 17.886 -42.782 504 H GLY 52 H GLY 52 26.723 13.264 -44.590 505 HA2 GLY 52 HA2 GLY 52 28.407 12.963 -46.036 506 HA3 GLY 52 HA3 GLY 52 27.941 14.520 -46.710 507 H LEU 53 H LEU 53 29.064 14.287 -43.316 508 HA LEU 53 HA LEU 53 31.692 15.588 -44.063 509 HB2 LEU 53 HB2 LEU 53 30.531 15.903 -41.300 510 HB3 LEU 53 HB3 LEU 53 31.684 16.871 -42.292 511 HG LEU 53 HG LEU 53 28.699 16.683 -42.844 512 HD11 LEU 53 HD11 LEU 53 30.332 18.642 -41.175 513 HD12 LEU 53 HD12 LEU 53 28.771 19.047 -41.813 514 HD13 LEU 53 HD13 LEU 53 28.822 17.689 -40.764 515 HD21 LEU 53 HD21 LEU 53 30.305 17.418 -44.667 516 HD22 LEU 53 HD22 LEU 53 29.132 18.650 -44.300 517 HD23 LEU 53 HD23 LEU 53 30.817 18.767 -43.601 518 H SER 54 H SER 54 33.369 15.180 -42.188 519 HA SER 54 HA SER 54 33.458 12.173 -41.472 520 HB2 SER 54 HB2 SER 54 35.561 13.308 -42.488 521 HB3 SER 54 HB3 SER 54 35.469 14.450 -41.247 522 HG SER 54 HG SER 54 36.857 12.696 -40.743 523 H MET 55 H MET 55 33.154 11.524 -39.358 524 HA MET 55 HA MET 55 31.997 13.254 -37.452 525 HB2 MET 55 HB2 MET 55 31.694 10.908 -37.359 526 HB3 MET 55 HB3 MET 55 33.407 10.634 -36.895 527 HG2 MET 55 HG2 MET 55 32.934 11.435 -34.667 528 HG3 MET 55 HG3 MET 55 31.394 12.129 -35.238 529 HE1 MET 55 HE1 MET 55 33.137 9.216 -33.605 530 HE2 MET 55 HE2 MET 55 32.077 7.706 -34.054 531 HE3 MET 55 HE3 MET 55 33.179 8.560 -35.194 532 H ARG 56 H ARG 56 35.304 12.922 -37.964 533 HA ARG 56 HA ARG 56 36.289 14.051 -35.352 534 HB2 ARG 56 HB2 ARG 56 37.531 12.832 -37.460 535 HB3 ARG 56 HB3 ARG 56 37.623 14.514 -37.971 536 HG2 ARG 56 HG2 ARG 56 38.856 15.162 -36.057 537 HG3 ARG 56 HG3 ARG 56 38.638 13.400 -35.342 538 HD2 ARG 56 HD2 ARG 56 39.915 12.492 -36.954 539 HD3 ARG 56 HD3 ARG 56 39.983 13.924 -37.951 540 HE ARG 56 HE ARG 56 41.917 14.581 -36.576 541 HH11 ARG 56 HH11 ARG 56 40.533 11.628 -35.233 542 HH12 ARG 56 HH12 ARG 56 41.893 11.484 -34.254 543 HH21 ARG 56 HH21 ARG 56 43.489 14.378 -35.432 544 HH22 ARG 56 HH22 ARG 56 43.335 13.186 -34.095 545 H GLN 57 H GLN 57 34.718 15.497 -38.214 546 HA GLN 57 HA GLN 57 35.472 18.074 -37.335 547 HB2 GLN 57 HB2 GLN 57 34.998 17.748 -39.607 548 HB3 GLN 57 HB3 GLN 57 33.443 17.068 -39.419 549 HG2 GLN 57 HG2 GLN 57 32.472 19.233 -38.907 550 HG3 GLN 57 HG3 GLN 57 34.034 19.997 -38.675 551 HE21 GLN 57 HE22 GLN 57 31.984 20.887 -40.251 552 HE22 GLN 57 HE21 GLN 57 32.465 20.780 -41.986 553 H ILE 58 H ILE 58 32.874 16.033 -36.105 554 HA ILE 58 HA ILE 58 31.482 18.428 -34.826 555 HB ILE 58 HB ILE 58 29.510 17.363 -35.246 556 HG12 ILE 58 HG12 ILE 58 30.854 15.147 -36.605 557 HG13 ILE 58 HG13 ILE 58 30.113 15.222 -34.930 558 HG21 ILE 58 HG21 ILE 58 30.804 18.722 -37.145 559 HG22 ILE 58 HG22 ILE 58 30.907 17.210 -37.935 560 HG23 ILE 58 HG23 ILE 58 29.312 17.736 -37.527 561 HD11 ILE 58 HD11 ILE 58 27.887 15.418 -35.904 562 HD12 ILE 58 HD12 ILE 58 28.668 15.601 -37.544 563 HD13 ILE 58 HD13 ILE 58 28.678 14.096 -36.642 564 H ARG 59 H ARG 59 30.190 18.027 -32.958 565 HA ARG 59 HA ARG 59 30.992 15.654 -31.161 566 HB2 ARG 59 HB2 ARG 59 30.704 18.506 -30.417 567 HB3 ARG 59 HB3 ARG 59 30.927 17.095 -29.313 568 HG2 ARG 59 HG2 ARG 59 32.910 18.093 -31.386 569 HG3 ARG 59 HG3 ARG 59 33.072 18.299 -29.673 570 HD2 ARG 59 HD2 ARG 59 33.209 15.798 -29.352 571 HD3 ARG 59 HD3 ARG 59 33.166 15.455 -31.053 572 HE ARG 59 HE ARG 59 35.459 16.639 -29.660 573 HH11 ARG 59 HH11 ARG 59 34.139 16.502 -33.064 574 HH12 ARG 59 HH12 ARG 59 35.571 17.333 -33.563 575 HH21 ARG 59 HH21 ARG 59 37.183 17.425 -30.617 576 HH22 ARG 59 HH22 ARG 59 37.201 17.740 -32.346 577 H PHE 60 H PHE 60 29.432 15.049 -29.794 578 HA PHE 60 HA PHE 60 26.715 16.260 -30.036 579 HB2 PHE 60 HB2 PHE 60 27.508 13.315 -29.683 580 HB3 PHE 60 HB3 PHE 60 25.891 13.945 -29.653 581 HD1 PHE 60 HD1 PHE 60 28.937 13.470 -31.931 582 HD2 PHE 60 HD2 PHE 60 24.641 14.198 -31.643 583 HE1 PHE 60 HE1 PHE 60 28.665 13.096 -34.321 584 HE2 PHE 60 HE2 PHE 60 24.466 13.526 -34.030 585 HZ PHE 60 HZ PHE 60 26.433 13.288 -35.383 586 H ARG 61 H ARG 61 25.277 15.882 -28.007 587 HA ARG 61 HA ARG 61 26.511 15.249 -25.497 588 HB2 ARG 61 HB2 ARG 61 25.266 18.004 -26.189 589 HB3 ARG 61 HB3 ARG 61 25.688 17.469 -24.582 590 HG2 ARG 61 HG2 ARG 61 28.122 17.526 -25.346 591 HG3 ARG 61 HG3 ARG 61 27.532 18.211 -26.949 592 HD2 ARG 61 HD2 ARG 61 26.452 19.987 -25.617 593 HD3 ARG 61 HD3 ARG 61 27.221 19.331 -24.149 594 HE ARG 61 HE ARG 61 29.060 19.590 -26.318 595 HH11 ARG 61 HH11 ARG 61 27.158 21.834 -24.481 596 HH12 ARG 61 HH12 ARG 61 28.262 23.167 -24.914 597 HH21 ARG 61 HH21 ARG 61 30.201 21.359 -26.863 598 HH22 ARG 61 HH22 ARG 61 29.657 22.883 -26.293 599 H PHE 62 H PHE 62 24.900 15.030 -23.795 600 HA PHE 62 HA PHE 62 22.073 15.362 -24.324 601 HB2 PHE 62 HB2 PHE 62 22.198 13.243 -25.365 602 HB3 PHE 62 HB3 PHE 62 23.140 12.601 -23.930 603 HD1 PHE 62 HD1 PHE 62 21.915 12.071 -21.797 604 HD2 PHE 62 HD2 PHE 62 19.748 13.711 -25.247 605 HE1 PHE 62 HE1 PHE 62 19.788 11.358 -20.956 606 HE2 PHE 62 HE2 PHE 62 17.665 12.903 -24.287 607 HZ PHE 62 HZ PHE 62 17.743 11.637 -22.069 608 H ASP 63 H ASP 63 21.134 15.902 -22.391 609 HA ASP 63 HA ASP 63 20.976 16.643 -20.287 610 HB2 ASP 63 HB2 ASP 63 20.803 14.361 -19.804 611 HB3 ASP 63 HB3 ASP 63 22.523 14.298 -19.383 612 H GLY 64 H GLY 64 22.864 17.785 -21.921 613 HA2 GLY 64 HA2 GLY 64 24.565 19.191 -21.942 614 HA3 GLY 64 HA3 GLY 64 24.520 19.273 -20.146 615 H GLN 65 H GLN 65 25.247 16.013 -21.171 616 HA GLN 65 HA GLN 65 28.101 16.490 -20.580 617 HB2 GLN 65 HB2 GLN 65 26.697 13.855 -20.698 618 HB3 GLN 65 HB3 GLN 65 28.293 14.279 -20.034 619 HG2 GLN 65 HG2 GLN 65 25.474 14.803 -18.727 620 HG3 GLN 65 HG3 GLN 65 26.644 13.800 -18.206 621 HE21 GLN 65 HE22 GLN 65 25.176 16.781 -17.954 622 HE22 GLN 65 HE21 GLN 65 26.377 17.549 -16.989 623 HA PRO 66 HA PRO 66 28.771 15.446 -24.915 624 HB2 PRO 66 HB2 PRO 66 31.355 14.641 -25.080 625 HB3 PRO 66 HB3 PRO 66 30.902 16.339 -24.806 626 HG2 PRO 66 HG2 PRO 66 31.641 14.282 -22.673 627 HG3 PRO 66 HG3 PRO 66 32.327 15.887 -22.950 628 HD2 PRO 66 HD2 PRO 66 30.174 15.451 -21.147 629 HD3 PRO 66 HD3 PRO 66 30.391 17.004 -22.101 630 H ILE 67 H ILE 67 28.695 13.558 -26.068 631 HA ILE 67 HA ILE 67 27.977 11.035 -24.610 632 HB ILE 67 HB ILE 67 27.806 11.569 -27.588 633 HG12 ILE 67 HG12 ILE 67 25.577 11.275 -25.401 634 HG13 ILE 67 HG13 ILE 67 26.193 12.785 -25.897 635 HG21 ILE 67 HG21 ILE 67 28.122 9.087 -27.169 636 HG22 ILE 67 HG22 ILE 67 26.723 9.126 -26.051 637 HG23 ILE 67 HG23 ILE 67 26.571 9.376 -27.760 638 HD11 ILE 67 HD11 ILE 67 25.493 12.075 -28.265 639 HD12 ILE 67 HD12 ILE 67 24.666 10.712 -27.599 640 HD13 ILE 67 HD13 ILE 67 24.183 12.315 -27.124 641 H ASN 68 H ASN 68 28.957 9.352 -24.390 642 HA ASN 68 HA ASN 68 31.847 9.099 -25.197 643 HB2 ASN 68 HB2 ASN 68 30.457 7.113 -23.369 644 HB3 ASN 68 HB3 ASN 68 32.084 7.330 -23.721 645 HD21 ASN 68 HD22 ASN 68 29.871 7.635 -21.278 646 HD22 ASN 68 HD21 ASN 68 30.502 9.008 -20.410 647 H GLU 69 H GLU 69 32.631 7.447 -26.574 648 HA GLU 69 HA GLU 69 30.744 6.488 -28.363 649 HB2 GLU 69 HB2 GLU 69 33.574 5.503 -28.412 650 HB3 GLU 69 HB3 GLU 69 32.433 5.557 -29.696 651 HG2 GLU 69 HG2 GLU 69 32.206 8.050 -29.399 652 HG3 GLU 69 HG3 GLU 69 33.302 8.065 -28.162 653 H THR 70 H THR 70 31.628 5.161 -25.570 654 HA THR 70 HA THR 70 31.185 2.238 -26.045 655 HB THR 70 HB THR 70 31.486 2.148 -23.507 656 HG1 THR 70 HG1 THR 70 30.808 4.167 -22.994 657 HG21 THR 70 HG21 THR 70 33.740 3.275 -25.136 658 HG22 THR 70 HG22 THR 70 33.803 2.499 -23.490 659 HG23 THR 70 HG23 THR 70 33.110 1.639 -24.907 660 H ASP 71 H ASP 71 28.979 5.068 -25.473 661 HA ASP 71 HA ASP 71 27.344 3.250 -23.677 662 HB2 ASP 71 HB2 ASP 71 27.208 6.266 -23.869 663 HB3 ASP 71 HB3 ASP 71 26.299 5.427 -22.854 664 H THR 72 H THR 72 25.138 3.382 -23.639 665 HA THR 72 HA THR 72 23.850 3.382 -26.253 666 HB THR 72 HB THR 72 22.449 1.598 -25.315 667 HG1 THR 72 HG1 THR 72 24.286 1.323 -23.256 668 HG21 THR 72 HG21 THR 72 24.523 0.620 -26.486 669 HG22 THR 72 HG22 THR 72 25.313 0.769 -24.967 670 HG23 THR 72 HG23 THR 72 23.984 -0.339 -25.043 671 HA PRO 73 HA PRO 73 20.567 5.981 -24.515 672 HB2 PRO 73 HB2 PRO 73 18.534 4.057 -25.509 673 HB3 PRO 73 HB3 PRO 73 18.655 5.748 -25.892 674 HG2 PRO 73 HG2 PRO 73 19.454 3.933 -27.720 675 HG3 PRO 73 HG3 PRO 73 20.211 5.501 -27.521 676 HD2 PRO 73 HD2 PRO 73 21.140 2.736 -26.594 677 HD3 PRO 73 HD3 PRO 73 22.079 4.081 -27.239 678 H ALA 74 H ALA 74 20.564 2.455 -23.841 679 HA ALA 74 HA ALA 74 18.811 2.597 -21.607 680 HB1 ALA 74 HB1 ALA 74 19.458 0.454 -21.179 681 HB2 ALA 74 HB2 ALA 74 19.244 0.553 -22.956 682 HB3 ALA 74 HB3 ALA 74 20.898 0.452 -22.222 683 H GLN 75 H GLN 75 22.425 2.554 -21.853 684 HA GLN 75 HA GLN 75 23.027 2.691 -19.032 685 HB2 GLN 75 HB2 GLN 75 24.720 2.184 -20.461 686 HB3 GLN 75 HB3 GLN 75 24.390 3.472 -21.519 687 HG2 GLN 75 HG2 GLN 75 26.383 4.156 -20.487 688 HG3 GLN 75 HG3 GLN 75 25.279 5.088 -19.601 689 HE21 GLN 75 HE22 GLN 75 27.235 5.025 -18.039 690 HE22 GLN 75 HE21 GLN 75 26.872 3.876 -16.795 691 H LEU 76 H LEU 76 22.155 5.151 -21.329 692 HA LEU 76 HA LEU 76 22.655 7.535 -19.551 693 HB2 LEU 76 HB2 LEU 76 21.770 7.208 -22.415 694 HB3 LEU 76 HB3 LEU 76 21.888 8.769 -21.630 695 HG LEU 76 HG LEU 76 24.214 6.791 -22.358 696 HD11 LEU 76 HD11 LEU 76 23.780 9.741 -23.054 697 HD12 LEU 76 HD12 LEU 76 24.965 8.605 -23.750 698 HD13 LEU 76 HD13 LEU 76 23.154 8.401 -24.008 699 HD21 LEU 76 HD21 LEU 76 24.053 9.453 -20.737 700 HD22 LEU 76 HD22 LEU 76 24.603 7.884 -20.139 701 HD23 LEU 76 HD23 LEU 76 25.491 8.869 -21.302 702 H GLU 77 H GLU 77 19.988 5.459 -19.812 703 HA GLU 77 HA GLU 77 17.892 5.589 -19.037 704 HB2 GLU 77 HB2 GLU 77 18.564 8.218 -17.692 705 HB3 GLU 77 HB3 GLU 77 17.249 7.006 -17.319 706 HG2 GLU 77 HG2 GLU 77 19.991 5.879 -17.085 707 HG3 GLU 77 HG3 GLU 77 19.711 7.214 -16.029 708 H MET 78 H MET 78 18.165 6.490 -21.821 709 HA MET 78 HA MET 78 16.607 8.871 -22.081 710 HB2 MET 78 HB2 MET 78 17.692 6.679 -23.956 711 HB3 MET 78 HB3 MET 78 16.731 8.023 -24.581 712 HG2 MET 78 HG2 MET 78 18.186 9.742 -23.883 713 HG3 MET 78 HG3 MET 78 19.141 8.624 -23.002 714 HE1 MET 78 HE1 MET 78 21.040 9.995 -24.366 715 HE2 MET 78 HE2 MET 78 21.012 10.008 -26.097 716 HE3 MET 78 HE3 MET 78 19.667 10.788 -25.345 717 H GLU 79 H GLU 79 14.669 8.971 -22.852 718 HA GLU 79 HA GLU 79 12.917 6.527 -23.333 719 HB2 GLU 79 HB2 GLU 79 12.175 9.118 -22.231 720 HB3 GLU 79 HB3 GLU 79 11.007 8.044 -22.951 721 HG2 GLU 79 HG2 GLU 79 12.758 7.665 -20.402 722 HG3 GLU 79 HG3 GLU 79 11.012 7.719 -20.574 723 H ASP 80 H ASP 80 10.854 7.460 -24.799 724 HA ASP 80 HA ASP 80 11.875 8.013 -27.540 725 HB2 ASP 80 HB2 ASP 80 9.166 7.591 -26.408 726 HB3 ASP 80 HB3 ASP 80 9.526 7.847 -28.169 727 H GLU 81 H GLU 81 11.567 9.842 -28.686 728 HA GLU 81 HA GLU 81 11.188 12.241 -29.030 729 HB2 GLU 81 HB2 GLU 81 9.184 11.946 -26.838 730 HB3 GLU 81 HB3 GLU 81 9.363 13.232 -27.928 731 HG2 GLU 81 HG2 GLU 81 9.310 10.875 -29.568 732 HG3 GLU 81 HG3 GLU 81 8.383 10.311 -28.228 733 H ASP 82 H ASP 82 12.990 11.241 -26.696 734 HA ASP 82 HA ASP 82 13.544 13.835 -25.518 735 HB2 ASP 82 HB2 ASP 82 15.222 11.367 -25.763 736 HB3 ASP 82 HB3 ASP 82 15.818 12.845 -24.917 737 H THR 83 H THR 83 16.066 14.573 -26.141 738 HA THR 83 HA THR 83 16.494 14.559 -29.086 739 HB THR 83 HB THR 83 16.307 17.015 -27.381 740 HG1 THR 83 HG1 THR 83 14.268 16.289 -28.191 741 HG21 THR 83 HG21 THR 83 16.988 17.111 -30.405 742 HG22 THR 83 HG22 THR 83 16.718 18.414 -29.414 743 HG23 THR 83 HG23 THR 83 18.142 17.475 -29.016 744 H ILE 84 H ILE 84 18.538 14.240 -29.841 745 HA ILE 84 HA ILE 84 20.774 14.602 -27.943 746 HB ILE 84 HB ILE 84 20.672 13.462 -30.798 747 HG12 ILE 84 HG12 ILE 84 21.464 11.930 -28.205 748 HG13 ILE 84 HG13 ILE 84 19.784 12.349 -28.559 749 HG21 ILE 84 HG21 ILE 84 23.032 13.985 -29.108 750 HG22 ILE 84 HG22 ILE 84 22.910 12.912 -30.502 751 HG23 ILE 84 HG23 ILE 84 22.684 14.612 -30.690 752 HD11 ILE 84 HD11 ILE 84 20.126 11.357 -30.864 753 HD12 ILE 84 HD12 ILE 84 21.716 10.977 -30.542 754 HD13 ILE 84 HD13 ILE 84 20.455 10.140 -29.595 755 H ASP 85 H ASP 85 22.079 16.426 -27.896 756 HA ASP 85 HA ASP 85 21.700 18.582 -30.042 757 HB2 ASP 85 HB2 ASP 85 23.539 18.750 -27.546 758 HB3 ASP 85 HB3 ASP 85 23.149 19.990 -28.642 759 H VAL 86 H VAL 86 22.749 18.692 -31.833 760 HA VAL 86 HA VAL 86 25.554 17.516 -31.722 761 HB VAL 86 HB VAL 86 24.304 18.700 -34.256 762 HG11 VAL 86 HG11 VAL 86 26.630 18.183 -34.356 763 HG12 VAL 86 HG12 VAL 86 26.386 16.541 -33.803 764 HG13 VAL 86 HG13 VAL 86 25.678 17.059 -35.378 765 HG21 VAL 86 HG21 VAL 86 22.964 16.602 -33.100 766 HG22 VAL 86 HG22 VAL 86 22.968 17.168 -34.773 767 HG23 VAL 86 HG23 VAL 86 24.019 15.818 -34.251 768 H PHE 87 H PHE 87 27.204 18.837 -32.598 769 HA PHE 87 HA PHE 87 27.084 21.822 -32.643 770 HB2 PHE 87 HB2 PHE 87 29.040 20.313 -30.910 771 HB3 PHE 87 HB3 PHE 87 29.216 22.032 -31.190 772 HD1 PHE 87 HD1 PHE 87 27.242 19.434 -29.635 773 HD2 PHE 87 HD2 PHE 87 27.842 23.674 -29.914 774 HE1 PHE 87 HE1 PHE 87 25.556 19.751 -27.900 775 HE2 PHE 87 HE2 PHE 87 26.361 23.964 -27.927 776 HZ PHE 87 HZ PHE 87 25.141 22.035 -26.928 777 H GLN 88 H GLN 88 28.548 22.448 -34.214 778 HA GLN 88 HA GLN 88 30.526 20.575 -35.372 779 HB2 GLN 88 HB2 GLN 88 29.520 23.381 -36.117 780 HB3 GLN 88 HB3 GLN 88 30.820 22.588 -37.065 781 HG2 GLN 88 HG2 GLN 88 28.408 21.019 -36.438 782 HG3 GLN 88 HG3 GLN 88 28.083 22.493 -37.492 783 HE21 GLN 88 HE22 GLN 88 27.437 20.045 -38.549 784 HE22 GLN 88 HE21 GLN 88 28.735 19.521 -39.611 785 H GLN 89 H GLN 89 32.796 20.645 -34.927 786 HA GLN 89 HA GLN 89 33.574 22.455 -32.761 787 HB2 GLN 89 HB2 GLN 89 34.140 19.964 -33.034 788 HB3 GLN 89 HB3 GLN 89 35.251 20.396 -34.377 789 HG2 GLN 89 HG2 GLN 89 36.678 20.260 -32.310 790 HG3 GLN 89 HG3 GLN 89 36.619 21.806 -33.027 791 HE21 GLN 89 HE22 GLN 89 36.936 23.259 -31.346 792 HE22 GLN 89 HE21 GLN 89 36.099 23.116 -29.777 793 H GLN 90 H GLN 90 34.568 24.319 -32.928 794 HA GLN 90 HA GLN 90 35.515 25.407 -35.258 795 HB2 GLN 90 HB2 GLN 90 36.167 26.343 -32.410 796 HB3 GLN 90 HB3 GLN 90 36.302 27.275 -33.968 797 HG2 GLN 90 HG2 GLN 90 34.328 28.006 -32.656 798 HG3 GLN 90 HG3 GLN 90 33.922 27.227 -34.233 799 HE21 GLN 90 HE22 GLN 90 31.676 27.030 -33.217 800 HE22 GLN 90 HE21 GLN 90 31.471 25.733 -32.063 801 H THR 91 H THR 91 37.629 26.237 -35.639 802 HA THR 91 HA THR 91 39.912 24.277 -35.353 803 HB THR 91 HB THR 91 40.581 24.666 -37.763 804 HG1 THR 91 HG1 THR 91 38.080 25.783 -38.079 805 HG21 THR 91 HG21 THR 91 37.723 23.436 -37.587 806 HG22 THR 91 HG22 THR 91 39.113 23.232 -38.736 807 HG23 THR 91 HG23 THR 91 39.317 22.690 -37.169 808 H GLY 92 H GLY 92 38.963 27.687 -36.291 809 HA2 GLY 92 HA2 GLY 92 39.914 29.689 -35.278 810 HA3 GLY 92 HA3 GLY 92 40.843 28.532 -34.366 811 H GLY 93 H GLY 93 42.516 30.432 -34.717 812 HA2 GLY 93 HA2 GLY 93 43.455 30.860 -37.327 813 HA3 GLY 93 HA3 GLY 93 43.985 31.490 -35.782 814 H VAL 94 H VAL 94 45.974 31.473 -36.835 815 HA VAL 94 HA VAL 94 47.707 29.192 -36.547 816 HB VAL 94 HB VAL 94 47.539 30.409 -39.296 817 HG11 VAL 94 HG11 VAL 94 49.232 28.152 -38.123 818 HG12 VAL 94 HG12 VAL 94 49.124 28.816 -39.781 819 HG13 VAL 94 HG13 VAL 94 49.711 29.879 -38.572 820 HG21 VAL 94 HG21 VAL 94 45.596 28.734 -39.017 821 HG22 VAL 94 HG22 VAL 94 46.789 28.196 -40.138 822 HG23 VAL 94 HG23 VAL 94 46.786 27.491 -38.589 823 H TYR 95 H TYR 95 49.239 30.060 -35.432 824 HA TYR 95 HA TYR 95 49.897 32.829 -35.302 825 HB2 TYR 95 HB2 TYR 95 51.302 30.346 -34.069 826 HB3 TYR 95 HB3 TYR 95 51.613 31.833 -33.485 827 HD1 TYR 95 HD2 TYR 95 49.358 29.001 -33.675 828 HD2 TYR 95 HD1 TYR 95 49.716 33.011 -32.172 829 HE1 TYR 95 HE2 TYR 95 47.508 28.560 -31.974 830 HE2 TYR 95 HE1 TYR 95 47.983 32.555 -30.512 831 HH TYR 95 HH TYR 95 46.197 29.629 -30.021 Start of MODEL 18 1 H1 ACE 36 HH32 ACE 36 10.159 15.676 -45.099 2 H2 ACE 36 HH33 ACE 36 11.949 16.090 -44.918 3 H3 ACE 36 HH31 ACE 36 10.987 16.523 -46.293 4 H GLU 37 H GLU 37 12.759 15.289 -47.405 5 HA GLU 37 HA GLU 37 11.683 13.134 -48.681 6 HB2 GLU 37 HB2 GLU 37 13.324 14.892 -49.488 7 HB3 GLU 37 HB3 GLU 37 14.594 13.987 -48.603 8 HG2 GLU 37 HG2 GLU 37 14.476 13.628 -51.172 9 HG3 GLU 37 HG3 GLU 37 14.285 12.165 -50.077 10 H ASP 38 H ASP 38 14.004 13.096 -46.266 11 HA ASP 38 HA ASP 38 14.247 10.107 -46.161 12 HB2 ASP 38 HB2 ASP 38 16.094 11.385 -47.452 13 HB3 ASP 38 HB3 ASP 38 16.694 11.966 -45.908 14 H ALA 39 H ALA 39 13.093 12.229 -44.059 15 HA ALA 39 HA ALA 39 14.977 12.345 -41.902 16 HB1 ALA 39 HB1 ALA 39 12.104 13.309 -42.056 17 HB2 ALA 39 HB2 ALA 39 13.324 13.686 -40.870 18 HB3 ALA 39 HB3 ALA 39 13.482 14.253 -42.590 19 H PHE 40 H PHE 40 14.632 9.656 -42.194 20 HA PHE 40 HA PHE 40 13.665 8.799 -39.614 21 HB2 PHE 40 HB2 PHE 40 11.829 8.322 -41.572 22 HB3 PHE 40 HB3 PHE 40 12.811 6.914 -41.688 23 HD1 PHE 40 HD1 PHE 40 11.160 9.120 -39.248 24 HD2 PHE 40 HD2 PHE 40 12.639 5.259 -39.917 25 HE1 PHE 40 HE1 PHE 40 10.077 8.427 -37.187 26 HE2 PHE 40 HE2 PHE 40 11.750 4.555 -37.685 27 HZ PHE 40 HZ PHE 40 10.252 6.075 -36.358 28 H ILE 41 H ILE 41 15.190 7.469 -38.693 29 HA ILE 41 HA ILE 41 16.873 5.846 -40.478 30 HB ILE 41 HB ILE 41 18.267 7.230 -38.228 31 HG12 ILE 41 HG12 ILE 41 19.630 8.306 -39.893 32 HG13 ILE 41 HG13 ILE 41 18.184 8.196 -41.049 33 HG21 ILE 41 HG21 ILE 41 20.219 6.156 -39.419 34 HG22 ILE 41 HG22 ILE 41 18.848 5.073 -38.978 35 HG23 ILE 41 HG23 ILE 41 19.171 5.548 -40.655 36 HD11 ILE 41 HD11 ILE 41 16.846 9.438 -39.499 37 HD12 ILE 41 HD12 ILE 41 18.237 9.697 -38.428 38 HD13 ILE 41 HD13 ILE 41 18.215 10.379 -40.019 39 H VAL 42 H VAL 42 17.097 3.874 -39.716 40 HA VAL 42 HA VAL 42 16.015 3.229 -37.037 41 HB VAL 42 HB VAL 42 15.354 1.721 -39.538 42 HG11 VAL 42 HG11 VAL 42 13.740 0.594 -38.276 43 HG12 VAL 42 HG12 VAL 42 15.270 0.647 -37.386 44 HG13 VAL 42 HG13 VAL 42 13.909 1.838 -36.981 45 HG21 VAL 42 HG21 VAL 42 13.791 4.178 -38.480 46 HG22 VAL 42 HG22 VAL 42 14.159 3.834 -40.049 47 HG23 VAL 42 HG23 VAL 42 12.993 2.745 -39.243 48 H ILE 43 H ILE 43 17.613 2.102 -36.013 49 HA ILE 43 HA ILE 43 19.217 0.166 -37.444 50 HB ILE 43 HB ILE 43 20.276 2.530 -35.960 51 HG12 ILE 43 HG12 ILE 43 21.150 1.646 -38.714 52 HG13 ILE 43 HG13 ILE 43 19.797 2.725 -38.324 53 HG21 ILE 43 HG21 ILE 43 22.591 1.551 -36.215 54 HG22 ILE 43 HG22 ILE 43 21.515 0.473 -35.083 55 HG23 ILE 43 HG23 ILE 43 21.859 0.143 -36.790 56 HD11 ILE 43 HD11 ILE 43 21.829 3.873 -39.084 57 HD12 ILE 43 HD12 ILE 43 21.412 4.279 -37.312 58 HD13 ILE 43 HD13 ILE 43 22.666 3.137 -37.715 59 H SEP 44 H SEP 44 20.057 -1.516 -36.433 60 HA SEP 44 HA SEP 44 20.059 -1.611 -33.497 61 HB2 SEP 44 HB2 SEP 44 18.982 -3.675 -33.181 62 HB3 SEP 44 HB3 SEP 44 17.914 -2.666 -34.185 63 H ASP 45 H ASP 45 21.244 -4.107 -33.055 64 HA ASP 45 HA ASP 45 23.834 -3.529 -34.399 65 HB2 ASP 45 HB2 ASP 45 23.331 -3.212 -31.780 66 HB3 ASP 45 HB3 ASP 45 23.232 -4.962 -31.765 67 H SEP 46 H SEP 46 21.273 -5.911 -34.050 68 HA SEP 46 HA SEP 46 22.897 -8.197 -34.898 69 HB2 SEP 46 HB2 SEP 46 21.312 -9.806 -34.120 70 HB3 SEP 46 HB3 SEP 46 22.195 -8.934 -32.837 71 H ASP 47 H ASP 47 22.822 -7.145 -36.990 72 HA ASP 47 HA ASP 47 20.265 -7.509 -38.556 73 HB2 ASP 47 HB2 ASP 47 22.278 -6.172 -39.292 74 HB3 ASP 47 HB3 ASP 47 23.212 -7.659 -39.486 75 H GLY 48 H GLY 48 19.136 -9.116 -38.061 76 HA2 GLY 48 HA2 GLY 48 18.116 -10.862 -39.101 77 HA3 GLY 48 HA3 GLY 48 19.673 -11.405 -39.760 78 H GLU 49 H GLU 49 17.783 -13.101 -38.423 79 HA GLU 49 HA GLU 49 18.517 -13.991 -35.696 80 HB2 GLU 49 HB2 GLU 49 16.225 -14.544 -36.779 81 HB3 GLU 49 HB3 GLU 49 16.993 -15.171 -38.164 82 HG2 GLU 49 HG2 GLU 49 16.038 -16.841 -36.822 83 HG3 GLU 49 HG3 GLU 49 17.778 -17.062 -36.605 84 HN1 NH2 50 HN1 NH2 50 19.301 -14.745 -39.106 85 HN2 NH2 50 HN2 NH2 50 20.507 -15.953 -38.765 86 H1 MET 1 H1 MET 1 -14.050 -30.833 -39.865 87 H2 MET 1 H2 MET 1 -13.363 -30.468 -38.325 88 H3 MET 1 H3 MET 1 -12.441 -30.552 -39.676 89 HA MET 1 HA MET 1 -13.683 -28.738 -40.679 90 HB2 MET 1 HB2 MET 1 -15.657 -28.983 -39.293 91 HB3 MET 1 HB3 MET 1 -14.713 -28.468 -37.894 92 HG2 MET 1 HG2 MET 1 -16.240 -26.751 -38.798 93 HG3 MET 1 HG3 MET 1 -14.475 -26.318 -38.865 94 HE1 MET 1 HE1 MET 1 -16.628 -27.839 -42.785 95 HE2 MET 1 HE2 MET 1 -16.539 -28.591 -41.218 96 HE3 MET 1 HE3 MET 1 -17.709 -27.178 -41.554 97 H ALA 2 H ALA 2 -12.439 -26.761 -40.884 98 HA ALA 2 HA ALA 2 -9.855 -27.023 -39.849 99 HB1 ALA 2 HB1 ALA 2 -9.390 -24.969 -40.961 100 HB2 ALA 2 HB2 ALA 2 -10.691 -25.753 -41.856 101 HB3 ALA 2 HB3 ALA 2 -11.122 -24.423 -40.839 102 H ASP 3 H ASP 3 -8.628 -25.969 -38.232 103 HA ASP 3 HA ASP 3 -9.898 -24.012 -36.516 104 HB2 ASP 3 HB2 ASP 3 -10.095 -26.224 -35.466 105 HB3 ASP 3 HB3 ASP 3 -8.325 -26.422 -35.442 106 H GLU 4 H GLU 4 -8.045 -23.049 -35.234 107 HA GLU 4 HA GLU 4 -5.749 -22.393 -37.111 108 HB2 GLU 4 HB2 GLU 4 -7.427 -20.652 -36.698 109 HB3 GLU 4 HB3 GLU 4 -6.929 -20.599 -34.984 110 HG2 GLU 4 HG2 GLU 4 -4.634 -20.048 -35.757 111 HG3 GLU 4 HG3 GLU 4 -5.239 -20.209 -37.489 112 H LYS 5 H LYS 5 -3.462 -22.161 -36.219 113 HA LYS 5 HA LYS 5 -2.839 -23.478 -33.791 114 HB2 LYS 5 HB2 LYS 5 -1.382 -23.806 -35.556 115 HB3 LYS 5 HB3 LYS 5 -1.395 -22.110 -35.953 116 HG2 LYS 5 HG2 LYS 5 0.293 -21.661 -34.003 117 HG3 LYS 5 HG3 LYS 5 0.221 -23.355 -33.565 118 HD2 LYS 5 HD2 LYS 5 0.944 -23.942 -35.786 119 HD3 LYS 5 HD3 LYS 5 1.091 -22.147 -36.210 120 HE2 LYS 5 HE2 LYS 5 2.860 -23.770 -34.319 121 HE3 LYS 5 HE3 LYS 5 3.258 -22.715 -35.675 122 HZ1 LYS 5 HZ1 LYS 5 2.321 -20.962 -34.396 123 HZ2 LYS 5 HZ2 LYS 5 2.155 -21.975 -33.068 124 HZ3 LYS 5 HZ3 LYS 5 3.664 -21.664 -33.708 125 HA PRO 6 HA PRO 6 -3.697 -19.908 -31.293 126 HB2 PRO 6 HB2 PRO 6 -3.053 -20.699 -28.822 127 HB3 PRO 6 HB3 PRO 6 -4.338 -21.507 -29.604 128 HG2 PRO 6 HG2 PRO 6 -1.537 -22.677 -29.535 129 HG3 PRO 6 HG3 PRO 6 -3.066 -23.548 -29.243 130 HD2 PRO 6 HD2 PRO 6 -1.923 -23.680 -31.621 131 HD3 PRO 6 HD3 PRO 6 -3.767 -23.432 -31.486 132 H LYS 7 H LYS 7 -2.864 -18.111 -30.628 133 HA LYS 7 HA LYS 7 -0.212 -17.760 -31.618 134 HB2 LYS 7 HB2 LYS 7 -2.312 -16.436 -31.806 135 HB3 LYS 7 HB3 LYS 7 -2.051 -15.888 -30.176 136 HG2 LYS 7 HG2 LYS 7 0.147 -14.822 -30.912 137 HG3 LYS 7 HG3 LYS 7 -0.167 -15.287 -32.574 138 HD2 LYS 7 HD2 LYS 7 -2.450 -14.170 -32.518 139 HD3 LYS 7 HD3 LYS 7 -2.007 -13.521 -30.911 140 HE2 LYS 7 HE2 LYS 7 0.180 -12.548 -31.929 141 HE3 LYS 7 HE3 LYS 7 -0.394 -13.325 -33.528 142 HZ1 LYS 7 HZ1 LYS 7 -1.057 -10.907 -33.477 143 HZ2 LYS 7 HZ2 LYS 7 -2.319 -12.042 -33.396 144 HZ3 LYS 7 HZ3 LYS 7 -1.866 -11.229 -32.103 145 H GLU 8 H GLU 8 1.691 -17.305 -30.581 146 HA GLU 8 HA GLU 8 1.867 -17.573 -27.575 147 HB2 GLU 8 HB2 GLU 8 3.100 -19.539 -27.837 148 HB3 GLU 8 HB3 GLU 8 1.690 -19.654 -28.873 149 HG2 GLU 8 HG2 GLU 8 2.917 -20.588 -30.110 150 HG3 GLU 8 HG3 GLU 8 3.042 -18.996 -30.839 151 H GLY 9 H GLY 9 2.815 -15.338 -29.974 152 HA2 GLY 9 HA2 GLY 9 5.561 -15.272 -29.933 153 HA3 GLY 9 HA3 GLY 9 4.479 -14.001 -30.248 154 H VAL 10 H VAL 10 5.338 -15.551 -27.083 155 HA VAL 10 HA VAL 10 6.336 -13.049 -25.860 156 HB VAL 10 HB VAL 10 6.518 -15.917 -24.926 157 HG11 VAL 10 HG11 VAL 10 6.905 -13.425 -23.398 158 HG12 VAL 10 HG12 VAL 10 7.041 -14.995 -22.576 159 HG13 VAL 10 HG13 VAL 10 8.125 -14.461 -23.918 160 HG21 VAL 10 HG21 VAL 10 4.531 -13.936 -23.862 161 HG22 VAL 10 HG22 VAL 10 4.065 -15.328 -24.869 162 HG23 VAL 10 HG23 VAL 10 4.684 -15.711 -23.451 163 H LYS 11 H LYS 11 8.120 -12.238 -27.034 164 HA LYS 11 HA LYS 11 10.291 -14.086 -27.347 165 HB2 LYS 11 HB2 LYS 11 8.788 -14.753 -29.313 166 HB3 LYS 11 HB3 LYS 11 8.745 -13.067 -29.878 167 HG2 LYS 11 HG2 LYS 11 11.039 -12.953 -30.327 168 HG3 LYS 11 HG3 LYS 11 11.251 -14.669 -29.758 169 HD2 LYS 11 HD2 LYS 11 9.512 -15.389 -31.378 170 HD3 LYS 11 HD3 LYS 11 9.573 -13.811 -32.054 171 HE2 LYS 11 HE2 LYS 11 11.942 -14.185 -32.544 172 HE3 LYS 11 HE3 LYS 11 11.909 -15.708 -31.684 173 HZ1 LYS 11 HZ1 LYS 11 11.611 -15.879 -34.117 174 HZ2 LYS 11 HZ2 LYS 11 10.192 -16.422 -33.398 175 HZ3 LYS 11 HZ3 LYS 11 10.348 -15.006 -34.161 176 H THR 12 H THR 12 12.267 -12.853 -27.609 177 HA THR 12 HA THR 12 12.249 -10.159 -27.000 178 HB THR 12 HB THR 12 14.591 -10.083 -27.243 179 HG1 THR 12 HG1 THR 12 15.281 -10.980 -29.004 180 HG21 THR 12 HG21 THR 12 13.867 -12.905 -26.788 181 HG22 THR 12 HG22 THR 12 15.328 -12.213 -26.117 182 HG23 THR 12 HG23 THR 12 13.783 -11.736 -25.414 183 H GLU 13 H GLU 13 11.880 -11.573 -30.251 184 HA GLU 13 HA GLU 13 12.944 -9.236 -31.735 185 HB2 GLU 13 HB2 GLU 13 11.003 -11.419 -32.558 186 HB3 GLU 13 HB3 GLU 13 11.730 -10.286 -33.730 187 HG2 GLU 13 HG2 GLU 13 13.047 -12.367 -32.087 188 HG3 GLU 13 HG3 GLU 13 12.752 -12.525 -33.796 189 H ASN 14 H ASN 14 9.804 -10.131 -30.254 190 HA ASN 14 HA ASN 14 8.410 -7.837 -31.443 191 HB2 ASN 14 HB2 ASN 14 7.567 -9.678 -29.255 192 HB3 ASN 14 HB3 ASN 14 6.505 -8.532 -29.921 193 HD21 ASN 14 HD22 ASN 14 6.359 -11.683 -29.694 194 HD22 ASN 14 HD21 ASN 14 6.466 -12.047 -31.475 195 H ASN 15 H ASN 15 10.649 -7.594 -29.092 196 HA ASN 15 HA ASN 15 9.363 -5.946 -27.258 197 HB2 ASN 15 HB2 ASN 15 11.184 -7.101 -26.571 198 HB3 ASN 15 HB3 ASN 15 12.193 -6.408 -27.880 199 HD21 ASN 15 HD22 ASN 15 10.418 -5.475 -25.131 200 HD22 ASN 15 HD21 ASN 15 11.368 -4.226 -24.540 201 H ASP 16 H ASP 16 9.356 -3.590 -27.107 202 HA ASP 16 HA ASP 16 9.302 -2.343 -29.840 203 HB2 ASP 16 HB2 ASP 16 8.419 -1.680 -26.977 204 HB3 ASP 16 HB3 ASP 16 8.429 -0.498 -28.361 205 H HIS 17 H HIS 17 10.077 -0.419 -30.276 206 HA HIS 17 HA HIS 17 12.955 -0.107 -29.982 207 HB2 HIS 17 HB2 HIS 17 11.103 1.828 -31.592 208 HB3 HIS 17 HB3 HIS 17 12.765 1.719 -31.828 209 HD2 HIS 17 HD2 HIS 17 13.552 0.423 -33.564 210 HE1 HIS 17 HE1 HIS 17 10.527 -2.443 -34.015 211 HE2 HIS 17 HE2 HIS 17 12.776 -1.833 -34.914 212 H ILE 18 H ILE 18 14.013 2.213 -29.945 213 HA ILE 18 HA ILE 18 12.460 4.210 -28.268 214 HB ILE 18 HB ILE 18 14.094 3.273 -26.696 215 HG12 ILE 18 HG12 ILE 18 15.366 5.784 -27.721 216 HG13 ILE 18 HG13 ILE 18 13.848 5.777 -26.919 217 HG21 ILE 18 HG21 ILE 18 15.691 2.347 -28.633 218 HG22 ILE 18 HG22 ILE 18 16.448 3.880 -28.530 219 HG23 ILE 18 HG23 ILE 18 16.497 2.724 -27.164 220 HD11 ILE 18 HD11 ILE 18 16.335 4.778 -25.573 221 HD12 ILE 18 HD12 ILE 18 15.663 6.481 -25.377 222 HD13 ILE 18 HD13 ILE 18 14.756 5.049 -24.885 223 H ASN 19 H ASN 19 11.823 5.889 -29.511 224 HA ASN 19 HA ASN 19 13.489 6.648 -31.752 225 HB2 ASN 19 HB2 ASN 19 10.838 7.488 -30.602 226 HB3 ASN 19 HB3 ASN 19 11.527 8.222 -32.075 227 HD21 ASN 19 HD22 ASN 19 9.945 5.251 -30.881 228 HD22 ASN 19 HD21 ASN 19 9.860 4.705 -32.632 229 H LEU 20 H LEU 20 15.418 7.443 -30.694 230 HA LEU 20 HA LEU 20 15.324 9.991 -29.196 231 HB2 LEU 20 HB2 LEU 20 17.577 8.949 -30.815 232 HB3 LEU 20 HB3 LEU 20 17.666 10.255 -29.663 233 HG LEU 20 HG LEU 20 17.118 7.242 -29.350 234 HD11 LEU 20 HD11 LEU 20 19.470 8.719 -28.121 235 HD12 LEU 20 HD12 LEU 20 19.275 6.956 -28.310 236 HD13 LEU 20 HD13 LEU 20 19.508 7.906 -29.710 237 HD21 LEU 20 HD21 LEU 20 17.399 8.983 -26.943 238 HD22 LEU 20 HD22 LEU 20 15.809 8.373 -27.539 239 HD23 LEU 20 HD23 LEU 20 17.072 7.217 -26.992 240 H LYS 21 H LYS 21 16.504 12.018 -30.116 241 HA LYS 21 HA LYS 21 16.177 12.438 -33.008 242 HB2 LYS 21 HB2 LYS 21 15.431 14.371 -30.780 243 HB3 LYS 21 HB3 LYS 21 15.757 14.947 -32.471 244 HG2 LYS 21 HG2 LYS 21 14.136 13.282 -33.167 245 HG3 LYS 21 HG3 LYS 21 13.752 12.907 -31.479 246 HD2 LYS 21 HD2 LYS 21 13.243 15.464 -31.175 247 HD3 LYS 21 HD3 LYS 21 13.427 15.572 -32.917 248 HE2 LYS 21 HE2 LYS 21 11.653 14.067 -33.353 249 HE3 LYS 21 HE3 LYS 21 11.226 13.760 -31.676 250 HZ1 LYS 21 HZ1 LYS 21 10.797 16.355 -33.088 251 HZ2 LYS 21 HZ2 LYS 21 9.716 15.336 -32.466 252 HZ3 LYS 21 HZ3 LYS 21 10.714 16.055 -31.465 253 H VAL 22 H VAL 22 17.791 13.447 -34.072 254 HA VAL 22 HA VAL 22 20.045 14.565 -32.528 255 HB VAL 22 HB VAL 22 20.191 13.420 -35.324 256 HG11 VAL 22 HG11 VAL 22 21.859 15.286 -34.710 257 HG12 VAL 22 HG12 VAL 22 22.384 14.365 -33.289 258 HG13 VAL 22 HG13 VAL 22 22.720 13.825 -34.893 259 HG21 VAL 22 HG21 VAL 22 19.806 11.603 -33.986 260 HG22 VAL 22 HG22 VAL 22 21.518 11.723 -34.297 261 HG23 VAL 22 HG23 VAL 22 20.881 12.265 -32.644 262 H ALA 23 H ALA 23 20.536 16.725 -32.905 263 HA ALA 23 HA ALA 23 19.621 17.933 -35.385 264 HB1 ALA 23 HB1 ALA 23 19.271 19.124 -32.521 265 HB2 ALA 23 HB2 ALA 23 18.396 19.703 -34.022 266 HB3 ALA 23 HB3 ALA 23 17.969 18.202 -33.280 267 H GLY 24 H GLY 24 20.506 19.938 -36.065 268 HA2 GLY 24 HA2 GLY 24 23.088 20.667 -34.999 269 HA3 GLY 24 HA3 GLY 24 22.346 21.129 -36.490 270 H GLN 25 H GLN 25 23.534 22.917 -34.826 271 HA GLN 25 HA GLN 25 21.679 24.249 -32.986 272 HB2 GLN 25 HB2 GLN 25 24.168 25.303 -34.498 273 HB3 GLN 25 HB3 GLN 25 23.464 26.210 -33.279 274 HG2 GLN 25 HG2 GLN 25 24.708 23.370 -33.196 275 HG3 GLN 25 HG3 GLN 25 25.379 24.903 -32.487 276 HE21 GLN 25 HE22 GLN 25 24.835 22.054 -31.359 277 HE22 GLN 25 HE21 GLN 25 23.845 22.414 -30.054 278 H ASP 26 H ASP 26 22.218 24.348 -36.384 279 HA ASP 26 HA ASP 26 21.137 26.804 -37.161 280 HB2 ASP 26 HB2 ASP 26 21.084 25.836 -39.477 281 HB3 ASP 26 HB3 ASP 26 22.598 25.668 -38.533 282 H GLY 27 H GLY 27 19.288 24.122 -35.997 283 HA2 GLY 27 HA2 GLY 27 17.054 24.006 -35.647 284 HA3 GLY 27 HA3 GLY 27 16.803 25.198 -36.930 285 H SER 28 H SER 28 18.769 22.433 -37.688 286 HA SER 28 HA SER 28 16.462 21.168 -39.142 287 HB2 SER 28 HB2 SER 28 18.100 19.904 -40.570 288 HB3 SER 28 HB3 SER 28 18.031 21.681 -40.813 289 HG SER 28 HG SER 28 19.817 21.880 -39.657 290 H VAL 29 H VAL 29 16.087 18.999 -38.608 291 HA VAL 29 HA VAL 29 17.504 17.726 -36.377 292 HB VAL 29 HB VAL 29 14.491 17.864 -36.865 293 HG11 VAL 29 HG11 VAL 29 16.033 16.812 -34.619 294 HG12 VAL 29 HG12 VAL 29 14.255 17.120 -34.441 295 HG13 VAL 29 HG13 VAL 29 14.843 15.892 -35.559 296 HG21 VAL 29 HG21 VAL 29 14.389 19.753 -35.833 297 HG22 VAL 29 HG22 VAL 29 15.293 19.199 -34.362 298 HG23 VAL 29 HG23 VAL 29 16.172 19.933 -35.583 299 H VAL 30 H VAL 30 17.240 15.249 -36.407 300 HA VAL 30 HA VAL 30 15.340 14.205 -38.342 301 HB VAL 30 HB VAL 30 16.558 12.158 -38.593 302 HG11 VAL 30 HG11 VAL 30 17.351 12.648 -40.653 303 HG12 VAL 30 HG12 VAL 30 16.316 14.089 -40.337 304 HG13 VAL 30 HG13 VAL 30 18.049 14.265 -40.125 305 HG21 VAL 30 HG21 VAL 30 18.533 12.540 -37.027 306 HG22 VAL 30 HG22 VAL 30 19.155 12.351 -38.625 307 HG23 VAL 30 HG23 VAL 30 19.086 13.903 -37.869 308 H GLN 31 H GLN 31 14.177 12.457 -37.590 309 HA GLN 31 HA GLN 31 14.521 11.621 -34.814 310 HB2 GLN 31 HB2 GLN 31 12.387 11.747 -35.842 311 HB3 GLN 31 HB3 GLN 31 12.762 10.267 -36.825 312 HG2 GLN 31 HG2 GLN 31 12.808 8.929 -34.882 313 HG3 GLN 31 HG3 GLN 31 12.750 10.232 -33.778 314 HE21 GLN 31 HE22 GLN 31 10.574 8.118 -34.333 315 HE22 GLN 31 HE21 GLN 31 9.192 9.098 -34.886 316 H PHE 32 H PHE 32 15.391 9.639 -34.140 317 HA PHE 32 HA PHE 32 16.454 7.526 -36.021 318 HB2 PHE 32 HB2 PHE 32 17.617 8.785 -33.624 319 HB3 PHE 32 HB3 PHE 32 17.770 6.982 -33.999 320 HD1 PHE 32 HD2 PHE 32 19.150 6.312 -35.935 321 HD2 PHE 32 HD1 PHE 32 18.623 10.497 -35.138 322 HE1 PHE 32 HE2 PHE 32 21.085 6.761 -37.425 323 HE2 PHE 32 HE1 PHE 32 20.665 11.030 -36.509 324 HZ PHE 32 HZ PHE 32 21.731 9.199 -37.840 325 H LYS 33 H LYS 33 15.441 5.571 -35.785 326 HA LYS 33 HA LYS 33 13.883 4.978 -33.328 327 HB2 LYS 33 HB2 LYS 33 12.480 5.005 -35.448 328 HB3 LYS 33 HB3 LYS 33 13.626 3.910 -36.186 329 HG2 LYS 33 HG2 LYS 33 12.824 2.211 -34.540 330 HG3 LYS 33 HG3 LYS 33 11.945 3.489 -33.616 331 HD2 LYS 33 HD2 LYS 33 10.392 3.734 -35.608 332 HD3 LYS 33 HD3 LYS 33 11.294 2.297 -36.309 333 HE2 LYS 33 HE2 LYS 33 10.566 0.925 -34.377 334 HE3 LYS 33 HE3 LYS 33 9.543 2.257 -33.835 335 HZ1 LYS 33 HZ1 LYS 33 8.523 0.532 -35.376 336 HZ2 LYS 33 HZ2 LYS 33 8.305 2.122 -35.768 337 HZ3 LYS 33 HZ3 LYS 33 9.509 1.266 -36.525 338 H ILE 34 H ILE 34 15.914 4.409 -32.420 339 HA ILE 34 HA ILE 34 17.442 1.972 -33.277 340 HB ILE 34 HB ILE 34 19.079 2.546 -31.663 341 HG12 ILE 34 HG12 ILE 34 17.720 5.260 -31.319 342 HG13 ILE 34 HG13 ILE 34 17.807 3.838 -30.211 343 HG21 ILE 34 HG21 ILE 34 19.265 2.959 -34.005 344 HG22 ILE 34 HG22 ILE 34 18.505 4.538 -34.002 345 HG23 ILE 34 HG23 ILE 34 20.133 4.320 -33.266 346 HD11 ILE 34 HD11 ILE 34 19.522 5.105 -29.424 347 HD12 ILE 34 HD12 ILE 34 20.467 4.435 -30.629 348 HD13 ILE 34 HD13 ILE 34 19.798 5.968 -30.988 349 H LYS 35 H LYS 35 18.320 0.939 -30.929 350 HA LYS 35 HA LYS 35 15.920 0.445 -29.339 351 HB2 LYS 35 HB2 LYS 35 17.863 -1.736 -30.008 352 HB3 LYS 35 HB3 LYS 35 16.426 -1.910 -29.084 353 HG2 LYS 35 HG2 LYS 35 15.075 -1.177 -31.242 354 HG3 LYS 35 HG3 LYS 35 16.568 -1.148 -32.107 355 HD2 LYS 35 HD2 LYS 35 16.906 -3.592 -31.586 356 HD3 LYS 35 HD3 LYS 35 15.426 -3.682 -30.660 357 HE2 LYS 35 HE2 LYS 35 14.068 -2.878 -32.408 358 HE3 LYS 35 HE3 LYS 35 15.347 -2.941 -33.604 359 HZ1 LYS 35 HZ1 LYS 35 15.602 -5.232 -33.201 360 HZ2 LYS 35 HZ2 LYS 35 14.554 -5.206 -31.956 361 HZ3 LYS 35 HZ3 LYS 35 13.984 -4.983 -33.491 362 H ARG 36 H ARG 36 16.279 -0.319 -27.047 363 HA ARG 36 HA ARG 36 17.789 1.764 -25.951 364 HB2 ARG 36 HB2 ARG 36 16.407 -0.623 -24.609 365 HB3 ARG 36 HB3 ARG 36 17.065 0.768 -23.794 366 HG2 ARG 36 HG2 ARG 36 15.466 2.286 -25.232 367 HG3 ARG 36 HG3 ARG 36 14.888 0.900 -25.966 368 HD2 ARG 36 HD2 ARG 36 13.373 1.626 -24.166 369 HD3 ARG 36 HD3 ARG 36 13.970 0.094 -23.649 370 HE ARG 36 HE ARG 36 15.489 1.056 -22.145 371 HH11 ARG 36 HH11 ARG 36 13.443 3.559 -23.710 372 HH12 ARG 36 HH12 ARG 36 13.610 4.543 -22.260 373 HH21 ARG 36 HH21 ARG 36 15.996 2.819 -20.769 374 HH22 ARG 36 HH22 ARG 36 15.096 4.325 -20.957 375 H HIS 37 H HIS 37 18.745 -1.475 -26.605 376 HA HIS 37 HA HIS 37 21.323 -1.324 -25.166 377 HB2 HIS 37 HB2 HIS 37 21.647 -3.593 -26.061 378 HB3 HIS 37 HB3 HIS 37 20.349 -3.360 -24.909 379 HD2 HIS 37 HD2 HIS 37 19.473 -5.851 -25.928 380 HE1 HIS 37 HE1 HIS 37 17.790 -4.158 -29.462 381 HE2 HIS 37 HE2 HIS 37 17.922 -6.320 -27.920 382 H THR 38 H THR 38 20.219 -0.235 -28.198 383 HA THR 38 HA THR 38 22.477 -1.085 -29.987 384 HB THR 38 HB THR 38 20.534 1.165 -30.350 385 HG1 THR 38 HG1 THR 38 20.341 -1.519 -30.661 386 HG21 THR 38 HG21 THR 38 22.416 1.570 -31.896 387 HG22 THR 38 HG22 THR 38 22.221 -0.100 -32.478 388 HG23 THR 38 HG23 THR 38 20.993 1.100 -32.753 389 HA PRO 39 HA PRO 39 25.615 1.770 -28.537 390 HB2 PRO 39 HB2 PRO 39 27.364 1.638 -30.597 391 HB3 PRO 39 HB3 PRO 39 27.028 0.406 -29.230 392 HG2 PRO 39 HG2 PRO 39 26.151 0.439 -31.852 393 HG3 PRO 39 HG3 PRO 39 26.851 -1.059 -31.186 394 HD2 PRO 39 HD2 PRO 39 24.251 -0.314 -31.682 395 HD3 PRO 39 HD3 PRO 39 24.846 -1.441 -30.326 396 H LEU 40 H LEU 40 26.006 3.840 -28.568 397 HA LEU 40 HA LEU 40 24.372 5.391 -30.357 398 HB2 LEU 40 HB2 LEU 40 26.239 5.938 -27.961 399 HB3 LEU 40 HB3 LEU 40 25.634 7.271 -29.066 400 HG LEU 40 HG LEU 40 23.832 5.283 -27.852 401 HD11 LEU 40 HD11 LEU 40 23.209 6.611 -26.003 402 HD12 LEU 40 HD12 LEU 40 24.957 6.571 -25.913 403 HD13 LEU 40 HD13 LEU 40 24.122 7.952 -26.565 404 HD21 LEU 40 HD21 LEU 40 22.146 6.896 -28.185 405 HD22 LEU 40 HD22 LEU 40 23.285 8.094 -28.693 406 HD23 LEU 40 HD23 LEU 40 23.009 6.635 -29.790 407 H SER 41 H SER 41 27.558 4.118 -30.392 408 HA SER 41 HA SER 41 29.007 5.867 -32.024 409 HB2 SER 41 HB2 SER 41 30.351 3.946 -32.443 410 HB3 SER 41 HB3 SER 41 29.740 3.782 -30.899 411 HG SER 41 HG SER 41 29.587 1.873 -32.115 412 H LYS 42 H LYS 42 27.018 3.089 -32.888 413 HA LYS 42 HA LYS 42 26.893 3.517 -35.692 414 HB2 LYS 42 HB2 LYS 42 25.354 1.829 -33.535 415 HB3 LYS 42 HB3 LYS 42 24.784 1.907 -35.255 416 HG2 LYS 42 HG2 LYS 42 26.923 1.250 -36.097 417 HG3 LYS 42 HG3 LYS 42 27.655 1.065 -34.684 418 HD2 LYS 42 HD2 LYS 42 26.270 -0.692 -33.814 419 HD3 LYS 42 HD3 LYS 42 25.237 -0.572 -35.266 420 HE2 LYS 42 HE2 LYS 42 27.473 -1.190 -36.604 421 HE3 LYS 42 HE3 LYS 42 28.182 -1.378 -34.993 422 HZ1 LYS 42 HZ1 LYS 42 26.393 -3.107 -34.523 423 HZ2 LYS 42 HZ2 LYS 42 25.619 -2.836 -35.950 424 HZ3 LYS 42 HZ3 LYS 42 27.017 -3.620 -35.913 425 H LEU 43 H LEU 43 24.734 4.954 -33.262 426 HA LEU 43 HA LEU 43 23.142 6.393 -35.186 427 HB2 LEU 43 HB2 LEU 43 22.428 6.079 -32.930 428 HB3 LEU 43 HB3 LEU 43 23.938 6.885 -32.373 429 HG LEU 43 HG LEU 43 22.113 8.491 -34.157 430 HD11 LEU 43 HD11 LEU 43 20.725 9.085 -32.086 431 HD12 LEU 43 HD12 LEU 43 20.520 7.456 -32.625 432 HD13 LEU 43 HD13 LEU 43 21.636 7.819 -31.237 433 HD21 LEU 43 HD21 LEU 43 23.596 9.078 -31.537 434 HD22 LEU 43 HD22 LEU 43 24.075 9.681 -33.180 435 HD23 LEU 43 HD23 LEU 43 22.650 10.204 -32.304 436 H MET 44 H MET 44 26.192 7.333 -33.401 437 HA MET 44 HA MET 44 26.104 9.936 -34.443 438 HB2 MET 44 HB2 MET 44 28.178 8.281 -32.926 439 HB3 MET 44 HB3 MET 44 28.484 9.991 -33.356 440 HG2 MET 44 HG2 MET 44 26.394 10.670 -32.176 441 HG3 MET 44 HG3 MET 44 26.226 9.047 -31.690 442 HE1 MET 44 HE1 MET 44 27.262 7.926 -30.083 443 HE2 MET 44 HE2 MET 44 28.922 7.875 -30.784 444 HE3 MET 44 HE3 MET 44 28.677 8.378 -29.118 445 H LYS 45 H LYS 45 27.589 7.163 -35.713 446 HA LYS 45 HA LYS 45 29.042 8.560 -37.932 447 HB2 LYS 45 HB2 LYS 45 28.202 5.631 -37.532 448 HB3 LYS 45 HB3 LYS 45 29.259 6.158 -38.877 449 HG2 LYS 45 HG2 LYS 45 30.766 7.101 -37.351 450 HG3 LYS 45 HG3 LYS 45 30.022 6.507 -35.993 451 HD2 LYS 45 HD2 LYS 45 30.853 4.672 -38.313 452 HD3 LYS 45 HD3 LYS 45 31.876 4.934 -36.843 453 HE2 LYS 45 HE2 LYS 45 30.178 3.904 -35.510 454 HE3 LYS 45 HE3 LYS 45 28.879 3.869 -36.743 455 HZ1 LYS 45 HZ1 LYS 45 29.936 1.760 -36.421 456 HZ2 LYS 45 HZ2 LYS 45 30.131 2.330 -38.007 457 HZ3 LYS 45 HZ3 LYS 45 31.335 2.298 -36.917 458 H ALA 46 H ALA 46 25.932 6.910 -37.787 459 HA ALA 46 HA ALA 46 25.233 7.087 -40.524 460 HB1 ALA 46 HB1 ALA 46 23.325 6.886 -38.202 461 HB2 ALA 46 HB2 ALA 46 23.140 6.404 -39.937 462 HB3 ALA 46 HB3 ALA 46 24.317 5.582 -38.884 463 H TYR 47 H TYR 47 25.018 9.359 -37.685 464 HA TYR 47 HA TYR 47 23.511 11.326 -39.194 465 HB2 TYR 47 HB2 TYR 47 23.012 11.218 -36.955 466 HB3 TYR 47 HB3 TYR 47 24.669 11.671 -36.477 467 HD1 TYR 47 HD1 TYR 47 21.561 13.118 -38.232 468 HD2 TYR 47 HD2 TYR 47 25.480 13.898 -36.626 469 HE1 TYR 47 HE1 TYR 47 21.045 15.419 -38.110 470 HE2 TYR 47 HE2 TYR 47 24.975 16.317 -36.519 471 HH TYR 47 HH TYR 47 21.853 17.620 -37.606 472 H CYS 48 H CYS 48 26.916 10.916 -38.101 473 HA CYS 48 HA CYS 48 28.022 13.283 -39.231 474 HB2 CYS 48 HB2 CYS 48 29.134 11.754 -37.538 475 HB3 CYS 48 HB3 CYS 48 29.382 10.552 -38.810 476 HG CYS 48 HG CYS 48 30.712 12.005 -40.259 477 H GLU 49 H GLU 49 27.843 10.054 -41.076 478 HA GLU 49 HA GLU 49 28.586 11.124 -43.431 479 HB2 GLU 49 HB2 GLU 49 26.629 8.946 -42.562 480 HB3 GLU 49 HB3 GLU 49 27.116 9.199 -44.231 481 HG2 GLU 49 HG2 GLU 49 29.128 8.407 -42.097 482 HG3 GLU 49 HG3 GLU 49 28.255 7.360 -43.288 483 H ARG 50 H ARG 50 25.422 11.210 -42.008 484 HA ARG 50 HA ARG 50 23.929 12.165 -44.232 485 HB2 ARG 50 HB2 ARG 50 23.542 12.087 -41.225 486 HB3 ARG 50 HB3 ARG 50 22.471 13.183 -42.128 487 HG2 ARG 50 HG2 ARG 50 21.671 11.411 -43.597 488 HG3 ARG 50 HG3 ARG 50 22.861 10.301 -43.070 489 HD2 ARG 50 HD2 ARG 50 21.367 10.210 -40.850 490 HD3 ARG 50 HD3 ARG 50 20.416 11.557 -41.538 491 HE ARG 50 HE ARG 50 20.604 8.771 -42.644 492 HH11 ARG 50 HH11 ARG 50 19.052 11.863 -42.987 493 HH12 ARG 50 HH12 ARG 50 17.578 11.011 -43.587 494 HH21 ARG 50 HH21 ARG 50 18.782 7.992 -43.363 495 HH22 ARG 50 HH22 ARG 50 17.641 9.245 -44.112 496 H GLN 51 H GLN 51 25.416 14.071 -41.556 497 HA GLN 51 HA GLN 51 25.220 16.512 -43.021 498 HB2 GLN 51 HB2 GLN 51 27.272 15.652 -40.844 499 HB3 GLN 51 HB3 GLN 51 26.943 17.248 -41.474 500 HG2 GLN 51 HG2 GLN 51 25.080 15.653 -39.609 501 HG3 GLN 51 HG3 GLN 51 25.981 17.135 -39.291 502 HE21 GLN 51 HE22 GLN 51 25.258 19.157 -40.629 503 HE22 GLN 51 HE21 GLN 51 23.618 19.327 -40.619 504 H GLY 52 H GLY 52 27.018 13.910 -44.009 505 HA2 GLY 52 HA2 GLY 52 28.754 13.735 -45.635 506 HA3 GLY 52 HA3 GLY 52 28.613 15.444 -45.943 507 H LEU 53 H LEU 53 29.517 14.514 -42.697 508 HA LEU 53 HA LEU 53 32.265 15.656 -43.072 509 HB2 LEU 53 HB2 LEU 53 30.513 15.337 -40.691 510 HB3 LEU 53 HB3 LEU 53 32.120 16.023 -40.823 511 HG LEU 53 HG LEU 53 29.679 17.192 -42.266 512 HD11 LEU 53 HD11 LEU 53 31.219 18.321 -39.785 513 HD12 LEU 53 HD12 LEU 53 30.117 19.172 -40.665 514 HD13 LEU 53 HD13 LEU 53 29.570 17.595 -39.959 515 HD21 LEU 53 HD21 LEU 53 31.553 17.647 -43.666 516 HD22 LEU 53 HD22 LEU 53 31.466 19.069 -42.574 517 HD23 LEU 53 HD23 LEU 53 32.643 17.865 -42.210 518 H SER 54 H SER 54 33.928 14.971 -41.543 519 HA SER 54 HA SER 54 33.902 12.041 -40.795 520 HB2 SER 54 HB2 SER 54 36.001 12.504 -41.697 521 HB3 SER 54 HB3 SER 54 36.102 14.137 -40.911 522 HG SER 54 HG SER 54 36.322 11.672 -39.799 523 H MET 55 H MET 55 33.894 11.481 -38.480 524 HA MET 55 HA MET 55 32.314 13.052 -36.811 525 HB2 MET 55 HB2 MET 55 32.930 10.499 -36.752 526 HB3 MET 55 HB3 MET 55 34.451 11.016 -35.934 527 HG2 MET 55 HG2 MET 55 33.189 11.418 -33.978 528 HG3 MET 55 HG3 MET 55 31.709 11.808 -34.859 529 HE1 MET 55 HE1 MET 55 30.912 8.821 -32.374 530 HE2 MET 55 HE2 MET 55 32.301 9.862 -32.136 531 HE3 MET 55 HE3 MET 55 30.731 10.519 -32.840 532 H ARG 56 H ARG 56 35.764 12.989 -37.129 533 HA ARG 56 HA ARG 56 36.766 14.282 -34.895 534 HB2 ARG 56 HB2 ARG 56 37.932 13.060 -36.652 535 HB3 ARG 56 HB3 ARG 56 38.132 14.670 -37.497 536 HG2 ARG 56 HG2 ARG 56 39.180 15.360 -35.218 537 HG3 ARG 56 HG3 ARG 56 38.946 13.754 -34.631 538 HD2 ARG 56 HD2 ARG 56 40.597 12.785 -35.891 539 HD3 ARG 56 HD3 ARG 56 40.503 14.160 -37.084 540 HE ARG 56 HE ARG 56 41.668 15.573 -35.623 541 HH11 ARG 56 HH11 ARG 56 41.618 12.321 -34.098 542 HH12 ARG 56 HH12 ARG 56 42.539 12.946 -32.794 543 HH21 ARG 56 HH21 ARG 56 42.735 16.161 -33.708 544 HH22 ARG 56 HH22 ARG 56 43.284 14.900 -32.659 545 H GLN 57 H GLN 57 34.928 15.815 -37.527 546 HA GLN 57 HA GLN 57 35.963 18.487 -36.883 547 HB2 GLN 57 HB2 GLN 57 35.463 17.858 -39.196 548 HB3 GLN 57 HB3 GLN 57 33.833 17.577 -38.793 549 HG2 GLN 57 HG2 GLN 57 33.179 19.573 -38.415 550 HG3 GLN 57 HG3 GLN 57 34.813 20.346 -38.206 551 HE21 GLN 57 HE22 GLN 57 33.521 21.708 -39.788 552 HE22 GLN 57 HE21 GLN 57 33.696 21.380 -41.545 553 H ILE 58 H ILE 58 33.463 16.353 -35.497 554 HA ILE 58 HA ILE 58 31.798 18.611 -34.594 555 HB ILE 58 HB ILE 58 29.895 17.493 -35.186 556 HG12 ILE 58 HG12 ILE 58 31.478 15.245 -36.333 557 HG13 ILE 58 HG13 ILE 58 30.650 15.128 -34.763 558 HG21 ILE 58 HG21 ILE 58 31.074 18.943 -36.833 559 HG22 ILE 58 HG22 ILE 58 31.630 17.461 -37.665 560 HG23 ILE 58 HG23 ILE 58 29.938 17.919 -37.534 561 HD11 ILE 58 HD11 ILE 58 28.500 15.426 -35.900 562 HD12 ILE 58 HD12 ILE 58 29.262 15.677 -37.508 563 HD13 ILE 58 HD13 ILE 58 29.506 14.157 -36.748 564 H ARG 59 H ARG 59 30.533 18.089 -32.709 565 HA ARG 59 HA ARG 59 31.145 15.682 -31.123 566 HB2 ARG 59 HB2 ARG 59 31.118 18.586 -30.108 567 HB3 ARG 59 HB3 ARG 59 31.066 17.270 -29.079 568 HG2 ARG 59 HG2 ARG 59 33.358 17.808 -31.176 569 HG3 ARG 59 HG3 ARG 59 33.570 18.076 -29.477 570 HD2 ARG 59 HD2 ARG 59 33.212 15.439 -29.191 571 HD3 ARG 59 HD3 ARG 59 33.261 15.469 -30.880 572 HE ARG 59 HE ARG 59 35.453 15.796 -29.143 573 HH11 ARG 59 HH11 ARG 59 34.567 16.201 -32.610 574 HH12 ARG 59 HH12 ARG 59 36.167 16.519 -33.034 575 HH21 ARG 59 HH21 ARG 59 37.404 16.243 -29.864 576 HH22 ARG 59 HH22 ARG 59 37.798 16.605 -31.524 577 H PHE 60 H PHE 60 29.460 14.908 -29.864 578 HA PHE 60 HA PHE 60 26.811 16.155 -30.341 579 HB2 PHE 60 HB2 PHE 60 27.786 13.229 -29.727 580 HB3 PHE 60 HB3 PHE 60 26.111 13.613 -29.974 581 HD1 PHE 60 HD1 PHE 60 29.385 13.145 -31.730 582 HD2 PHE 60 HD2 PHE 60 25.109 13.780 -32.059 583 HE1 PHE 60 HE1 PHE 60 29.365 12.465 -34.090 584 HE2 PHE 60 HE2 PHE 60 25.087 13.132 -34.365 585 HZ PHE 60 HZ PHE 60 27.371 12.518 -35.408 586 H ARG 61 H ARG 61 25.667 16.812 -28.444 587 HA ARG 61 HA ARG 61 26.632 15.727 -25.932 588 HB2 ARG 61 HB2 ARG 61 25.562 18.636 -26.255 589 HB3 ARG 61 HB3 ARG 61 25.980 17.784 -24.788 590 HG2 ARG 61 HG2 ARG 61 28.287 17.448 -25.702 591 HG3 ARG 61 HG3 ARG 61 27.823 18.206 -27.232 592 HD2 ARG 61 HD2 ARG 61 27.026 20.153 -25.763 593 HD3 ARG 61 HD3 ARG 61 27.967 19.651 -24.479 594 HE ARG 61 HE ARG 61 29.892 19.658 -26.467 595 HH11 ARG 61 HH11 ARG 61 27.588 22.047 -24.978 596 HH12 ARG 61 HH12 ARG 61 28.784 23.265 -25.160 597 HH21 ARG 61 HH21 ARG 61 31.236 21.358 -26.559 598 HH22 ARG 61 HH22 ARG 61 30.645 22.915 -25.970 599 H PHE 62 H PHE 62 25.227 15.179 -24.363 600 HA PHE 62 HA PHE 62 22.162 15.618 -24.647 601 HB2 PHE 62 HB2 PHE 62 22.592 13.245 -25.323 602 HB3 PHE 62 HB3 PHE 62 23.635 13.050 -23.883 603 HD1 PHE 62 HD2 PHE 62 20.196 13.913 -24.818 604 HD2 PHE 62 HD1 PHE 62 22.753 11.958 -21.886 605 HE1 PHE 62 HE2 PHE 62 18.282 13.187 -23.539 606 HE2 PHE 62 HE1 PHE 62 20.829 11.138 -20.765 607 HZ PHE 62 HZ PHE 62 18.608 11.709 -21.411 608 H ASP 63 H ASP 63 21.190 16.480 -22.842 609 HA ASP 63 HA ASP 63 21.151 17.682 -21.186 610 HB2 ASP 63 HB2 ASP 63 20.927 15.176 -20.137 611 HB3 ASP 63 HB3 ASP 63 22.445 15.449 -19.445 612 H GLY 64 H GLY 64 23.055 18.450 -22.614 613 HA2 GLY 64 HA2 GLY 64 24.904 19.654 -22.789 614 HA3 GLY 64 HA3 GLY 64 25.184 19.671 -20.961 615 H GLN 65 H GLN 65 25.256 16.457 -21.785 616 HA GLN 65 HA GLN 65 28.143 16.640 -21.245 617 HB2 GLN 65 HB2 GLN 65 26.412 14.304 -20.408 618 HB3 GLN 65 HB3 GLN 65 28.109 14.501 -20.085 619 HG2 GLN 65 HG2 GLN 65 25.766 16.059 -19.179 620 HG3 GLN 65 HG3 GLN 65 26.798 15.147 -18.135 621 HE21 GLN 65 HE22 GLN 65 25.594 18.148 -19.052 622 HE22 GLN 65 HE21 GLN 65 26.977 19.096 -18.560 623 HA PRO 66 HA PRO 66 28.692 14.859 -25.416 624 HB2 PRO 66 HB2 PRO 66 31.475 14.166 -24.415 625 HB3 PRO 66 HB3 PRO 66 30.998 15.097 -25.925 626 HG2 PRO 66 HG2 PRO 66 32.102 16.478 -23.923 627 HG3 PRO 66 HG3 PRO 66 30.535 17.063 -24.555 628 HD2 PRO 66 HD2 PRO 66 30.636 15.325 -22.140 629 HD3 PRO 66 HD3 PRO 66 29.877 16.943 -22.375 630 H ILE 67 H ILE 67 27.871 13.060 -25.968 631 HA ILE 67 HA ILE 67 27.909 10.816 -24.282 632 HB ILE 67 HB ILE 67 27.254 11.034 -27.155 633 HG12 ILE 67 HG12 ILE 67 25.079 10.668 -25.093 634 HG13 ILE 67 HG13 ILE 67 25.662 12.274 -25.336 635 HG21 ILE 67 HG21 ILE 67 27.898 8.851 -26.751 636 HG22 ILE 67 HG22 ILE 67 26.553 8.544 -25.545 637 HG23 ILE 67 HG23 ILE 67 26.145 8.964 -27.189 638 HD11 ILE 67 HD11 ILE 67 24.468 10.636 -27.602 639 HD12 ILE 67 HD12 ILE 67 23.872 12.110 -26.667 640 HD13 ILE 67 HD13 ILE 67 25.214 12.184 -27.728 641 H ASN 68 H ASN 68 29.347 9.301 -24.161 642 HA ASN 68 HA ASN 68 31.741 9.123 -25.978 643 HB2 ASN 68 HB2 ASN 68 31.169 7.350 -23.450 644 HB3 ASN 68 HB3 ASN 68 32.686 7.479 -24.411 645 HD21 ASN 68 HD22 ASN 68 30.569 9.513 -22.328 646 HD22 ASN 68 HD21 ASN 68 31.822 10.722 -22.182 647 H GLU 69 H GLU 69 32.215 7.296 -27.380 648 HA GLU 69 HA GLU 69 30.141 5.823 -28.565 649 HB2 GLU 69 HB2 GLU 69 33.235 5.662 -28.806 650 HB3 GLU 69 HB3 GLU 69 32.014 4.891 -29.889 651 HG2 GLU 69 HG2 GLU 69 31.074 6.990 -30.322 652 HG3 GLU 69 HG3 GLU 69 32.346 7.805 -29.340 653 H THR 70 H THR 70 31.347 5.306 -25.637 654 HA THR 70 HA THR 70 31.402 2.332 -25.727 655 HB THR 70 HB THR 70 31.665 2.586 -23.362 656 HG1 THR 70 HG1 THR 70 31.112 4.791 -23.056 657 HG21 THR 70 HG21 THR 70 33.559 2.369 -25.112 658 HG22 THR 70 HG22 THR 70 33.793 4.046 -24.998 659 HG23 THR 70 HG23 THR 70 33.982 3.050 -23.501 660 H ASP 71 H ASP 71 29.044 4.834 -25.400 661 HA ASP 71 HA ASP 71 27.443 3.423 -23.374 662 HB2 ASP 71 HB2 ASP 71 27.309 6.244 -24.471 663 HB3 ASP 71 HB3 ASP 71 26.470 5.663 -23.118 664 H THR 72 H THR 72 25.178 3.287 -23.624 665 HA THR 72 HA THR 72 23.973 3.291 -26.428 666 HB THR 72 HB THR 72 22.722 1.211 -25.868 667 HG1 THR 72 HG1 THR 72 23.652 0.227 -23.903 668 HG21 THR 72 HG21 THR 72 24.884 0.948 -26.863 669 HG22 THR 72 HG22 THR 72 25.563 0.779 -25.193 670 HG23 THR 72 HG23 THR 72 24.415 -0.357 -25.690 671 HA PRO 73 HA PRO 73 20.597 5.638 -24.459 672 HB2 PRO 73 HB2 PRO 73 18.528 3.641 -25.185 673 HB3 PRO 73 HB3 PRO 73 18.577 5.396 -25.482 674 HG2 PRO 73 HG2 PRO 73 19.240 3.840 -27.585 675 HG3 PRO 73 HG3 PRO 73 20.187 5.360 -27.224 676 HD2 PRO 73 HD2 PRO 73 20.775 2.608 -26.850 677 HD3 PRO 73 HD3 PRO 73 21.960 3.947 -27.328 678 H ALA 74 H ALA 74 20.225 2.246 -23.812 679 HA ALA 74 HA ALA 74 18.917 2.251 -21.356 680 HB1 ALA 74 HB1 ALA 74 20.028 0.111 -20.875 681 HB2 ALA 74 HB2 ALA 74 19.510 0.134 -22.545 682 HB3 ALA 74 HB3 ALA 74 21.192 0.455 -22.259 683 H GLN 75 H GLN 75 22.492 2.742 -21.700 684 HA GLN 75 HA GLN 75 23.076 2.745 -18.850 685 HB2 GLN 75 HB2 GLN 75 24.687 2.032 -20.431 686 HB3 GLN 75 HB3 GLN 75 24.563 3.520 -21.358 687 HG2 GLN 75 HG2 GLN 75 26.598 3.466 -20.304 688 HG3 GLN 75 HG3 GLN 75 25.693 4.886 -19.872 689 HE21 GLN 75 HE22 GLN 75 27.302 5.036 -17.931 690 HE22 GLN 75 HE21 GLN 75 27.090 3.986 -16.593 691 H LEU 76 H LEU 76 22.296 5.161 -21.340 692 HA LEU 76 HA LEU 76 22.819 7.445 -19.467 693 HB2 LEU 76 HB2 LEU 76 21.851 7.363 -22.363 694 HB3 LEU 76 HB3 LEU 76 22.433 8.790 -21.423 695 HG LEU 76 HG LEU 76 24.401 6.528 -22.317 696 HD11 LEU 76 HD11 LEU 76 23.909 9.286 -23.489 697 HD12 LEU 76 HD12 LEU 76 25.076 8.071 -24.079 698 HD13 LEU 76 HD13 LEU 76 23.370 7.885 -24.306 699 HD21 LEU 76 HD21 LEU 76 24.591 9.249 -21.131 700 HD22 LEU 76 HD22 LEU 76 25.015 7.695 -20.302 701 HD23 LEU 76 HD23 LEU 76 25.999 8.307 -21.650 702 H GLU 77 H GLU 77 20.525 5.247 -19.642 703 HA GLU 77 HA GLU 77 18.363 5.098 -19.183 704 HB2 GLU 77 HB2 GLU 77 18.964 7.416 -17.356 705 HB3 GLU 77 HB3 GLU 77 17.473 6.367 -17.429 706 HG2 GLU 77 HG2 GLU 77 20.271 5.281 -17.198 707 HG3 GLU 77 HG3 GLU 77 19.422 5.684 -15.762 708 H MET 78 H MET 78 18.408 6.295 -21.607 709 HA MET 78 HA MET 78 16.830 8.777 -21.990 710 HB2 MET 78 HB2 MET 78 18.125 6.775 -23.778 711 HB3 MET 78 HB3 MET 78 17.270 8.115 -24.439 712 HG2 MET 78 HG2 MET 78 18.880 9.671 -23.466 713 HG3 MET 78 HG3 MET 78 19.728 8.268 -22.758 714 HE1 MET 78 HE1 MET 78 21.599 10.138 -25.791 715 HE2 MET 78 HE2 MET 78 20.062 10.702 -25.143 716 HE3 MET 78 HE3 MET 78 21.415 10.108 -24.093 717 H GLU 79 H GLU 79 15.178 8.629 -23.750 718 HA GLU 79 HA GLU 79 13.133 6.487 -23.646 719 HB2 GLU 79 HB2 GLU 79 12.604 9.369 -22.607 720 HB3 GLU 79 HB3 GLU 79 11.443 8.175 -22.815 721 HG2 GLU 79 HG2 GLU 79 13.694 8.375 -20.906 722 HG3 GLU 79 HG3 GLU 79 12.030 8.564 -20.517 723 H ASP 80 H ASP 80 11.173 7.497 -24.959 724 HA ASP 80 HA ASP 80 12.297 8.284 -27.610 725 HB2 ASP 80 HB2 ASP 80 9.344 8.022 -26.935 726 HB3 ASP 80 HB3 ASP 80 10.119 8.219 -28.539 727 H GLU 81 H GLU 81 12.260 10.257 -28.614 728 HA GLU 81 HA GLU 81 12.172 12.396 -28.873 729 HB2 GLU 81 HB2 GLU 81 9.956 12.707 -27.050 730 HB3 GLU 81 HB3 GLU 81 10.579 13.935 -28.125 731 HG2 GLU 81 HG2 GLU 81 10.115 12.541 -30.042 732 HG3 GLU 81 HG3 GLU 81 9.108 11.449 -29.010 733 H ASP 82 H ASP 82 13.855 11.216 -26.962 734 HA ASP 82 HA ASP 82 14.790 13.598 -25.514 735 HB2 ASP 82 HB2 ASP 82 16.105 10.794 -25.560 736 HB3 ASP 82 HB3 ASP 82 16.825 12.232 -25.048 737 H THR 83 H THR 83 16.269 15.021 -26.497 738 HA THR 83 HA THR 83 17.179 14.494 -29.298 739 HB THR 83 HB THR 83 16.852 17.187 -27.999 740 HG1 THR 83 HG1 THR 83 14.790 16.282 -28.380 741 HG21 THR 83 HG21 THR 83 17.719 16.168 -30.691 742 HG22 THR 83 HG22 THR 83 17.092 17.822 -30.450 743 HG23 THR 83 HG23 THR 83 18.567 17.338 -29.671 744 H ILE 84 H ILE 84 19.064 14.436 -29.613 745 HA ILE 84 HA ILE 84 21.493 15.116 -28.003 746 HB ILE 84 HB ILE 84 21.254 13.569 -30.589 747 HG12 ILE 84 HG12 ILE 84 21.380 12.500 -27.782 748 HG13 ILE 84 HG13 ILE 84 20.154 12.303 -28.999 749 HG21 ILE 84 HG21 ILE 84 23.668 13.512 -28.766 750 HG22 ILE 84 HG22 ILE 84 23.469 12.986 -30.465 751 HG23 ILE 84 HG23 ILE 84 23.445 14.723 -30.041 752 HD11 ILE 84 HD11 ILE 84 21.150 10.314 -28.979 753 HD12 ILE 84 HD12 ILE 84 21.429 11.170 -30.542 754 HD13 ILE 84 HD13 ILE 84 22.787 11.059 -29.315 755 H ASP 85 H ASP 85 22.082 17.126 -28.289 756 HA ASP 85 HA ASP 85 21.868 18.696 -30.713 757 HB2 ASP 85 HB2 ASP 85 22.819 19.435 -27.980 758 HB3 ASP 85 HB3 ASP 85 22.853 20.473 -29.410 759 H VAL 86 H VAL 86 23.573 19.142 -32.186 760 HA VAL 86 HA VAL 86 26.175 17.991 -31.470 761 HB VAL 86 HB VAL 86 24.965 18.355 -34.198 762 HG11 VAL 86 HG11 VAL 86 27.226 18.152 -34.600 763 HG12 VAL 86 HG12 VAL 86 27.460 16.730 -33.455 764 HG13 VAL 86 HG13 VAL 86 26.503 16.691 -34.987 765 HG21 VAL 86 HG21 VAL 86 25.032 16.012 -32.225 766 HG22 VAL 86 HG22 VAL 86 23.602 16.700 -32.948 767 HG23 VAL 86 HG23 VAL 86 24.765 15.672 -33.944 768 H PHE 87 H PHE 87 28.060 19.048 -32.056 769 HA PHE 87 HA PHE 87 27.806 21.884 -32.617 770 HB2 PHE 87 HB2 PHE 87 29.295 20.727 -30.236 771 HB3 PHE 87 HB3 PHE 87 29.440 22.329 -30.775 772 HD1 PHE 87 HD1 PHE 87 26.927 19.866 -29.613 773 HD2 PHE 87 HD2 PHE 87 28.224 23.913 -29.966 774 HE1 PHE 87 HE1 PHE 87 25.280 20.483 -27.805 775 HE2 PHE 87 HE2 PHE 87 26.578 24.609 -28.146 776 HZ PHE 87 HZ PHE 87 25.164 22.946 -27.100 777 H GLN 88 H GLN 88 29.619 22.955 -33.649 778 HA GLN 88 HA GLN 88 31.497 21.069 -35.056 779 HB2 GLN 88 HB2 GLN 88 31.115 24.069 -34.955 780 HB3 GLN 88 HB3 GLN 88 32.525 23.365 -35.734 781 HG2 GLN 88 HG2 GLN 88 29.642 22.554 -36.499 782 HG3 GLN 88 HG3 GLN 88 30.380 24.088 -37.040 783 HE21 GLN 88 HE22 GLN 88 29.619 22.128 -38.888 784 HE22 GLN 88 HE21 GLN 88 31.098 21.633 -39.756 785 H GLN 89 H GLN 89 33.456 20.717 -34.423 786 HA GLN 89 HA GLN 89 34.269 21.302 -31.685 787 HB2 GLN 89 HB2 GLN 89 34.738 19.238 -32.534 788 HB3 GLN 89 HB3 GLN 89 35.632 20.010 -33.918 789 HG2 GLN 89 HG2 GLN 89 37.161 18.910 -32.103 790 HG3 GLN 89 HG3 GLN 89 37.584 20.434 -32.788 791 HE21 GLN 89 HE22 GLN 89 38.107 21.950 -31.082 792 HE22 GLN 89 HE21 GLN 89 37.600 21.770 -29.422 793 H GLN 90 H GLN 90 35.338 23.075 -30.975 794 HA GLN 90 HA GLN 90 35.885 25.371 -32.536 795 HB2 GLN 90 HB2 GLN 90 37.060 24.635 -29.651 796 HB3 GLN 90 HB3 GLN 90 37.061 26.120 -30.338 797 HG2 GLN 90 HG2 GLN 90 35.014 26.486 -29.251 798 HG3 GLN 90 HG3 GLN 90 34.335 25.743 -30.655 799 HE21 GLN 90 HE22 GLN 90 33.706 25.727 -27.685 800 HE22 GLN 90 HE21 GLN 90 33.401 23.988 -27.381 801 H THR 91 H THR 91 38.037 26.380 -32.953 802 HA THR 91 HA THR 91 40.380 24.505 -33.330 803 HB THR 91 HB THR 91 41.173 26.049 -34.815 804 HG1 THR 91 HG1 THR 91 40.337 27.989 -34.172 805 HG21 THR 91 HG21 THR 91 38.308 25.144 -35.562 806 HG22 THR 91 HG22 THR 91 39.634 25.865 -36.710 807 HG23 THR 91 HG23 THR 91 39.729 24.347 -35.815 808 H GLY 92 H GLY 92 39.556 27.707 -31.936 809 HA2 GLY 92 HA2 GLY 92 40.642 29.003 -30.545 810 HA3 GLY 92 HA3 GLY 92 41.699 27.618 -30.003 811 H GLY 93 H GLY 93 43.716 28.577 -30.015 812 HA2 GLY 93 HA2 GLY 93 44.428 30.722 -31.703 813 HA3 GLY 93 HA3 GLY 93 45.442 29.805 -30.662 814 H VAL 94 H VAL 94 46.563 30.870 -32.653 815 HA VAL 94 HA VAL 94 47.619 28.527 -34.041 816 HB VAL 94 HB VAL 94 47.451 31.290 -35.301 817 HG11 VAL 94 HG11 VAL 94 48.540 28.616 -36.369 818 HG12 VAL 94 HG12 VAL 94 48.234 29.996 -37.389 819 HG13 VAL 94 HG13 VAL 94 49.369 30.278 -36.263 820 HG21 VAL 94 HG21 VAL 94 45.273 30.063 -35.260 821 HG22 VAL 94 HG22 VAL 94 46.034 30.091 -36.925 822 HG23 VAL 94 HG23 VAL 94 45.933 28.622 -35.895 823 H TYR 95 H TYR 95 49.880 28.709 -34.393 824 HA TYR 95 HA TYR 95 51.417 30.111 -32.230 825 HB2 TYR 95 HB2 TYR 95 51.301 27.021 -32.619 826 HB3 TYR 95 HB3 TYR 95 52.104 27.912 -31.358 827 HD1 TYR 95 HD1 TYR 95 50.793 29.446 -29.740 828 HD2 TYR 95 HD2 TYR 95 48.811 26.581 -32.387 829 HE1 TYR 95 HE1 TYR 95 48.937 29.080 -28.080 830 HE2 TYR 95 HE2 TYR 95 46.976 26.440 -30.804 831 HH TYR 95 HH TYR 95 46.352 26.746 -28.918 Start of MODEL 19 1 H1 ACE 36 HH32 ACE 36 11.082 17.095 -43.209 2 H2 ACE 36 HH33 ACE 36 11.176 15.736 -42.089 3 H3 ACE 36 HH31 ACE 36 12.651 16.401 -42.682 4 H GLU 37 H GLU 37 12.224 16.390 -45.377 5 HA GLU 37 HA GLU 37 10.585 14.529 -46.823 6 HB2 GLU 37 HB2 GLU 37 11.695 16.493 -47.797 7 HB3 GLU 37 HB3 GLU 37 13.249 15.771 -47.559 8 HG2 GLU 37 HG2 GLU 37 12.556 15.366 -49.953 9 HG3 GLU 37 HG3 GLU 37 12.581 13.849 -49.099 10 H ASP 38 H ASP 38 13.530 14.236 -45.225 11 HA ASP 38 HA ASP 38 13.920 11.291 -45.746 12 HB2 ASP 38 HB2 ASP 38 15.110 12.515 -47.521 13 HB3 ASP 38 HB3 ASP 38 15.795 13.509 -46.267 14 H ALA 39 H ALA 39 13.121 13.219 -43.331 15 HA ALA 39 HA ALA 39 15.395 13.004 -41.583 16 HB1 ALA 39 HB1 ALA 39 12.490 13.974 -41.071 17 HB2 ALA 39 HB2 ALA 39 13.845 13.894 -39.920 18 HB3 ALA 39 HB3 ALA 39 13.927 14.883 -41.401 19 H PHE 40 H PHE 40 15.126 10.420 -42.310 20 HA PHE 40 HA PHE 40 14.558 8.977 -39.776 21 HB2 PHE 40 HB2 PHE 40 12.474 9.070 -41.702 22 HB3 PHE 40 HB3 PHE 40 13.424 7.697 -42.150 23 HD1 PHE 40 HD1 PHE 40 11.601 9.336 -39.484 24 HD2 PHE 40 HD2 PHE 40 13.289 5.649 -40.827 25 HE1 PHE 40 HE1 PHE 40 10.421 8.177 -37.719 26 HE2 PHE 40 HE2 PHE 40 12.059 4.365 -39.057 27 HZ PHE 40 HZ PHE 40 10.527 5.626 -37.523 28 H ILE 41 H ILE 41 15.767 7.335 -39.278 29 HA ILE 41 HA ILE 41 17.792 6.075 -41.085 30 HB ILE 41 HB ILE 41 18.453 7.706 -38.542 31 HG12 ILE 41 HG12 ILE 41 20.069 8.644 -40.255 32 HG13 ILE 41 HG13 ILE 41 18.880 7.988 -41.386 33 HG21 ILE 41 HG21 ILE 41 20.764 6.993 -39.165 34 HG22 ILE 41 HG22 ILE 41 19.795 5.663 -38.584 35 HG23 ILE 41 HG23 ILE 41 20.032 5.805 -40.318 36 HD11 ILE 41 HD11 ILE 41 19.189 10.375 -39.764 37 HD12 ILE 41 HD12 ILE 41 17.928 10.146 -40.997 38 HD13 ILE 41 HD13 ILE 41 17.497 9.763 -39.317 39 H VAL 42 H VAL 42 18.134 3.795 -40.218 40 HA VAL 42 HA VAL 42 16.631 3.145 -37.770 41 HB VAL 42 HB VAL 42 16.069 1.629 -40.363 42 HG11 VAL 42 HG11 VAL 42 14.320 0.681 -38.975 43 HG12 VAL 42 HG12 VAL 42 15.764 0.672 -37.931 44 HG13 VAL 42 HG13 VAL 42 14.596 1.897 -37.669 45 HG21 VAL 42 HG21 VAL 42 14.369 3.787 -39.239 46 HG22 VAL 42 HG22 VAL 42 15.283 3.854 -40.831 47 HG23 VAL 42 HG23 VAL 42 13.926 2.758 -40.559 48 H ILE 43 H ILE 43 18.311 2.194 -36.656 49 HA ILE 43 HA ILE 43 20.363 0.262 -37.848 50 HB ILE 43 HB ILE 43 20.783 2.890 -36.332 51 HG12 ILE 43 HG12 ILE 43 22.381 1.662 -38.631 52 HG13 ILE 43 HG13 ILE 43 20.880 2.563 -38.887 53 HG21 ILE 43 HG21 ILE 43 23.182 2.322 -35.920 54 HG22 ILE 43 HG22 ILE 43 22.222 1.239 -34.994 55 HG23 ILE 43 HG23 ILE 43 22.892 0.630 -36.473 56 HD11 ILE 43 HD11 ILE 43 22.633 4.086 -39.237 57 HD12 ILE 43 HD12 ILE 43 21.618 4.523 -37.925 58 HD13 ILE 43 HD13 ILE 43 23.221 3.851 -37.548 59 H SEP 44 H SEP 44 21.071 -1.339 -36.576 60 HA SEP 44 HA SEP 44 20.281 -1.521 -33.900 61 HB2 SEP 44 HB2 SEP 44 19.232 -3.574 -33.788 62 HB3 SEP 44 HB3 SEP 44 18.341 -2.644 -34.874 63 H ASP 45 H ASP 45 21.244 -3.864 -33.024 64 HA ASP 45 HA ASP 45 24.117 -3.502 -33.944 65 HB2 ASP 45 HB2 ASP 45 23.536 -2.582 -31.702 66 HB3 ASP 45 HB3 ASP 45 23.044 -4.191 -31.266 67 H SEP 46 H SEP 46 21.633 -6.067 -33.182 68 HA SEP 46 HA SEP 46 23.630 -8.215 -33.393 69 HB2 SEP 46 HB2 SEP 46 21.794 -9.763 -32.848 70 HB3 SEP 46 HB3 SEP 46 21.917 -8.371 -31.744 71 H ASP 47 H ASP 47 24.093 -9.327 -35.066 72 HA ASP 47 HA ASP 47 22.588 -9.142 -37.601 73 HB2 ASP 47 HB2 ASP 47 24.972 -8.404 -37.604 74 HB3 ASP 47 HB3 ASP 47 25.428 -9.938 -36.908 75 H GLY 48 H GLY 48 21.049 -10.456 -37.374 76 HA2 GLY 48 HA2 GLY 48 20.003 -12.672 -37.991 77 HA3 GLY 48 HA3 GLY 48 21.711 -13.121 -38.196 78 H GLU 49 H GLU 49 20.675 -15.073 -37.235 79 HA GLU 49 HA GLU 49 20.640 -15.078 -34.226 80 HB2 GLU 49 HB2 GLU 49 18.262 -15.341 -35.078 81 HB3 GLU 49 HB3 GLU 49 18.961 -16.848 -35.853 82 HG2 GLU 49 HG2 GLU 49 17.818 -17.465 -33.843 83 HG3 GLU 49 HG3 GLU 49 19.530 -17.688 -33.639 84 HN1 NH2 50 HN1 NH2 50 20.698 -17.123 -37.138 85 HN2 NH2 50 HN2 NH2 50 21.852 -18.312 -36.572 86 H1 MET 1 H1 MET 1 -10.940 -27.583 -39.008 87 H2 MET 1 H2 MET 1 -12.514 -27.965 -39.038 88 H3 MET 1 H3 MET 1 -11.651 -28.273 -37.669 89 HA MET 1 HA MET 1 -11.961 -25.670 -38.978 90 HB2 MET 1 HB2 MET 1 -14.153 -26.577 -37.909 91 HB3 MET 1 HB3 MET 1 -13.217 -26.747 -36.369 92 HG2 MET 1 HG2 MET 1 -14.605 -24.873 -36.309 93 HG3 MET 1 HG3 MET 1 -12.972 -24.180 -36.459 94 HE1 MET 1 HE1 MET 1 -15.561 -22.805 -36.519 95 HE2 MET 1 HE2 MET 1 -15.052 -21.600 -37.568 96 HE3 MET 1 HE3 MET 1 -16.504 -22.668 -38.058 97 H ALA 2 H ALA 2 -10.753 -24.116 -38.583 98 HA ALA 2 HA ALA 2 -8.455 -24.480 -36.728 99 HB1 ALA 2 HB1 ALA 2 -7.639 -22.429 -37.889 100 HB2 ALA 2 HB2 ALA 2 -8.279 -23.731 -38.967 101 HB3 ALA 2 HB3 ALA 2 -9.253 -22.306 -38.646 102 H ASP 3 H ASP 3 -7.671 -23.176 -35.363 103 HA ASP 3 HA ASP 3 -9.635 -21.434 -33.843 104 HB2 ASP 3 HB2 ASP 3 -8.935 -23.521 -32.469 105 HB3 ASP 3 HB3 ASP 3 -7.271 -23.177 -32.648 106 H GLU 4 H GLU 4 -8.712 -19.412 -32.921 107 HA GLU 4 HA GLU 4 -6.772 -18.117 -34.777 108 HB2 GLU 4 HB2 GLU 4 -8.608 -16.885 -33.840 109 HB3 GLU 4 HB3 GLU 4 -8.146 -17.369 -32.186 110 HG2 GLU 4 HG2 GLU 4 -6.336 -15.776 -32.212 111 HG3 GLU 4 HG3 GLU 4 -6.636 -15.428 -33.932 112 H LYS 5 H LYS 5 -4.465 -17.981 -34.586 113 HA LYS 5 HA LYS 5 -3.270 -19.189 -32.236 114 HB2 LYS 5 HB2 LYS 5 -2.355 -19.544 -34.452 115 HB3 LYS 5 HB3 LYS 5 -2.043 -17.821 -34.750 116 HG2 LYS 5 HG2 LYS 5 -0.394 -17.824 -32.854 117 HG3 LYS 5 HG3 LYS 5 -0.715 -19.515 -32.436 118 HD2 LYS 5 HD2 LYS 5 0.003 -20.142 -34.751 119 HD3 LYS 5 HD3 LYS 5 0.385 -18.495 -35.108 120 HE2 LYS 5 HE2 LYS 5 1.383 -19.781 -32.545 121 HE3 LYS 5 HE3 LYS 5 2.262 -20.220 -33.986 122 HZ1 LYS 5 HZ1 LYS 5 3.393 -18.247 -32.933 123 HZ2 LYS 5 HZ2 LYS 5 2.635 -17.683 -34.186 124 HZ3 LYS 5 HZ3 LYS 5 1.943 -17.573 -32.671 125 HA PRO 6 HA PRO 6 -3.462 -15.343 -30.149 126 HB2 PRO 6 HB2 PRO 6 -2.248 -15.907 -27.761 127 HB3 PRO 6 HB3 PRO 6 -3.881 -16.599 -28.325 128 HG2 PRO 6 HG2 PRO 6 -1.198 -17.921 -28.423 129 HG3 PRO 6 HG3 PRO 6 -2.873 -18.566 -27.927 130 HD2 PRO 6 HD2 PRO 6 -1.797 -19.005 -30.365 131 HD3 PRO 6 HD3 PRO 6 -3.529 -18.865 -30.032 132 H LYS 7 H LYS 7 -2.234 -13.628 -29.832 133 HA LYS 7 HA LYS 7 0.671 -13.547 -30.444 134 HB2 LYS 7 HB2 LYS 7 -0.850 -12.088 -31.498 135 HB3 LYS 7 HB3 LYS 7 -1.264 -11.208 -30.035 136 HG2 LYS 7 HG2 LYS 7 1.165 -10.318 -29.972 137 HG3 LYS 7 HG3 LYS 7 1.530 -11.396 -31.229 138 HD2 LYS 7 HD2 LYS 7 0.028 -10.522 -32.749 139 HD3 LYS 7 HD3 LYS 7 -0.665 -9.276 -31.672 140 HE2 LYS 7 HE2 LYS 7 1.406 -7.938 -31.648 141 HE3 LYS 7 HE3 LYS 7 2.284 -9.264 -32.377 142 HZ1 LYS 7 HZ1 LYS 7 0.232 -7.635 -33.772 143 HZ2 LYS 7 HZ2 LYS 7 1.851 -7.591 -33.852 144 HZ3 LYS 7 HZ3 LYS 7 1.024 -8.888 -34.471 145 H GLU 8 H GLU 8 1.544 -14.609 -28.694 146 HA GLU 8 HA GLU 8 1.852 -12.883 -26.376 147 HB2 GLU 8 HB2 GLU 8 0.742 -14.467 -24.706 148 HB3 GLU 8 HB3 GLU 8 -0.398 -14.133 -25.942 149 HG2 GLU 8 HG2 GLU 8 -0.581 -16.548 -25.691 150 HG3 GLU 8 HG3 GLU 8 0.382 -16.355 -27.124 151 H GLY 9 H GLY 9 3.048 -15.631 -28.117 152 HA2 GLY 9 HA2 GLY 9 4.854 -16.769 -26.148 153 HA3 GLY 9 HA3 GLY 9 4.976 -17.006 -27.879 154 H VAL 10 H VAL 10 6.566 -15.858 -25.413 155 HA VAL 10 HA VAL 10 7.432 -13.168 -26.336 156 HB VAL 10 HB VAL 10 8.358 -14.869 -24.022 157 HG11 VAL 10 HG11 VAL 10 8.995 -11.920 -24.555 158 HG12 VAL 10 HG12 VAL 10 9.616 -12.737 -23.190 159 HG13 VAL 10 HG13 VAL 10 10.088 -13.115 -24.921 160 HG21 VAL 10 HG21 VAL 10 6.656 -12.383 -23.882 161 HG22 VAL 10 HG22 VAL 10 6.062 -14.061 -23.708 162 HG23 VAL 10 HG23 VAL 10 7.203 -13.400 -22.554 163 H LYS 11 H LYS 11 8.932 -12.719 -27.723 164 HA LYS 11 HA LYS 11 11.221 -14.393 -27.906 165 HB2 LYS 11 HB2 LYS 11 9.650 -14.922 -29.950 166 HB3 LYS 11 HB3 LYS 11 9.921 -13.335 -30.430 167 HG2 LYS 11 HG2 LYS 11 12.343 -13.689 -30.500 168 HG3 LYS 11 HG3 LYS 11 12.168 -15.387 -29.860 169 HD2 LYS 11 HD2 LYS 11 10.760 -16.151 -31.687 170 HD3 LYS 11 HD3 LYS 11 10.808 -14.635 -32.454 171 HE2 LYS 11 HE2 LYS 11 12.677 -15.881 -33.528 172 HE3 LYS 11 HE3 LYS 11 13.428 -14.720 -32.469 173 HZ1 LYS 11 HZ1 LYS 11 13.075 -17.076 -31.046 174 HZ2 LYS 11 HZ2 LYS 11 13.354 -17.553 -32.494 175 HZ3 LYS 11 HZ3 LYS 11 14.467 -16.649 -31.914 176 H THR 12 H THR 12 13.079 -12.787 -28.344 177 HA THR 12 HA THR 12 12.714 -10.005 -27.389 178 HB THR 12 HB THR 12 15.115 -9.829 -27.748 179 HG1 THR 12 HG1 THR 12 16.142 -11.773 -28.333 180 HG21 THR 12 HG21 THR 12 14.408 -10.513 -25.594 181 HG22 THR 12 HG22 THR 12 14.053 -12.135 -26.180 182 HG23 THR 12 HG23 THR 12 15.788 -11.546 -26.078 183 H GLU 13 H GLU 13 12.628 -11.494 -30.514 184 HA GLU 13 HA GLU 13 12.978 -9.053 -32.031 185 HB2 GLU 13 HB2 GLU 13 11.302 -11.656 -32.531 186 HB3 GLU 13 HB3 GLU 13 11.554 -10.404 -33.731 187 HG2 GLU 13 HG2 GLU 13 13.551 -12.329 -32.264 188 HG3 GLU 13 HG3 GLU 13 13.079 -12.458 -33.916 189 H ASN 14 H ASN 14 10.233 -10.128 -29.955 190 HA ASN 14 HA ASN 14 8.445 -8.544 -31.263 191 HB2 ASN 14 HB2 ASN 14 8.345 -9.776 -28.453 192 HB3 ASN 14 HB3 ASN 14 6.975 -9.153 -29.369 193 HD21 ASN 14 HD22 ASN 14 6.926 -11.664 -28.246 194 HD22 ASN 14 HD21 ASN 14 6.844 -12.742 -29.552 195 H ASN 15 H ASN 15 10.983 -7.411 -29.338 196 HA ASN 15 HA ASN 15 9.537 -5.762 -27.504 197 HB2 ASN 15 HB2 ASN 15 11.733 -7.119 -27.084 198 HB3 ASN 15 HB3 ASN 15 12.467 -5.607 -27.688 199 HD21 ASN 15 HD22 ASN 15 9.878 -6.707 -25.256 200 HD22 ASN 15 HD21 ASN 15 10.374 -5.332 -24.255 201 H ASP 16 H ASP 16 9.360 -3.430 -27.515 202 HA ASP 16 HA ASP 16 9.199 -2.117 -29.961 203 HB2 ASP 16 HB2 ASP 16 8.996 -1.345 -26.989 204 HB3 ASP 16 HB3 ASP 16 8.802 -0.134 -28.292 205 H HIS 17 H HIS 17 10.375 -0.782 -30.972 206 HA HIS 17 HA HIS 17 13.047 0.014 -30.340 207 HB2 HIS 17 HB2 HIS 17 11.064 1.437 -32.194 208 HB3 HIS 17 HB3 HIS 17 12.728 1.795 -32.052 209 HD2 HIS 17 HD2 HIS 17 14.448 -0.476 -32.899 210 HE1 HIS 17 HE1 HIS 17 11.511 -2.336 -35.207 211 HE2 HIS 17 HE2 HIS 17 13.870 -2.167 -34.674 212 H ILE 18 H ILE 18 13.935 2.176 -29.681 213 HA ILE 18 HA ILE 18 12.044 3.934 -28.335 214 HB ILE 18 HB ILE 18 13.757 3.172 -26.784 215 HG12 ILE 18 HG12 ILE 18 14.116 6.178 -27.601 216 HG13 ILE 18 HG13 ILE 18 13.118 5.670 -26.309 217 HG21 ILE 18 HG21 ILE 18 15.388 2.675 -28.578 218 HG22 ILE 18 HG22 ILE 18 15.932 4.338 -28.606 219 HG23 ILE 18 HG23 ILE 18 15.985 3.356 -27.097 220 HD11 ILE 18 HD11 ILE 18 16.109 5.603 -26.226 221 HD12 ILE 18 HD12 ILE 18 15.032 6.754 -25.477 222 HD13 ILE 18 HD13 ILE 18 14.975 5.048 -24.922 223 H ASN 19 H ASN 19 11.805 6.117 -29.003 224 HA ASN 19 HA ASN 19 13.122 6.776 -31.607 225 HB2 ASN 19 HB2 ASN 19 10.427 7.193 -30.626 226 HB3 ASN 19 HB3 ASN 19 11.287 8.213 -31.924 227 HD21 ASN 19 HD22 ASN 19 9.742 5.068 -31.384 228 HD22 ASN 19 HD21 ASN 19 10.052 4.714 -33.123 229 H LEU 20 H LEU 20 14.716 7.938 -31.302 230 HA LEU 20 HA LEU 20 14.723 10.234 -29.484 231 HB2 LEU 20 HB2 LEU 20 17.189 9.134 -31.057 232 HB3 LEU 20 HB3 LEU 20 17.247 10.268 -29.774 233 HG LEU 20 HG LEU 20 16.246 7.390 -29.368 234 HD11 LEU 20 HD11 LEU 20 18.879 8.559 -28.795 235 HD12 LEU 20 HD12 LEU 20 18.235 7.010 -28.280 236 HD13 LEU 20 HD13 LEU 20 18.543 7.465 -30.045 237 HD21 LEU 20 HD21 LEU 20 16.641 9.940 -27.499 238 HD22 LEU 20 HD22 LEU 20 15.295 8.838 -27.511 239 HD23 LEU 20 HD23 LEU 20 16.729 8.235 -26.844 240 H LYS 21 H LYS 21 15.409 12.203 -29.921 241 HA LYS 21 HA LYS 21 15.621 13.161 -32.843 242 HB2 LYS 21 HB2 LYS 21 15.263 14.735 -30.149 243 HB3 LYS 21 HB3 LYS 21 15.538 15.408 -31.650 244 HG2 LYS 21 HG2 LYS 21 13.382 14.508 -32.568 245 HG3 LYS 21 HG3 LYS 21 13.210 13.486 -31.111 246 HD2 LYS 21 HD2 LYS 21 12.830 15.471 -29.867 247 HD3 LYS 21 HD3 LYS 21 13.505 16.548 -31.266 248 HE2 LYS 21 HE2 LYS 21 11.553 15.988 -32.541 249 HE3 LYS 21 HE3 LYS 21 10.929 15.015 -31.188 250 HZ1 LYS 21 HZ1 LYS 21 11.593 17.970 -31.144 251 HZ2 LYS 21 HZ2 LYS 21 10.155 17.397 -31.354 252 HZ3 LYS 21 HZ3 LYS 21 10.830 17.185 -29.934 253 H VAL 22 H VAL 22 17.103 14.279 -33.790 254 HA VAL 22 HA VAL 22 19.501 14.883 -32.199 255 HB VAL 22 HB VAL 22 19.764 13.562 -34.943 256 HG11 VAL 22 HG11 VAL 22 21.711 14.638 -34.099 257 HG12 VAL 22 HG12 VAL 22 21.595 13.661 -32.538 258 HG13 VAL 22 HG13 VAL 22 21.950 12.925 -34.206 259 HG21 VAL 22 HG21 VAL 22 18.570 11.848 -33.939 260 HG22 VAL 22 HG22 VAL 22 20.225 11.255 -33.936 261 HG23 VAL 22 HG23 VAL 22 19.570 11.895 -32.498 262 H ALA 23 H ALA 23 20.233 16.613 -32.510 263 HA ALA 23 HA ALA 23 18.861 18.478 -34.390 264 HB1 ALA 23 HB1 ALA 23 19.503 18.449 -31.307 265 HB2 ALA 23 HB2 ALA 23 18.873 19.834 -32.202 266 HB3 ALA 23 HB3 ALA 23 17.977 18.248 -32.158 267 H GLY 24 H GLY 24 20.092 19.180 -35.638 268 HA2 GLY 24 HA2 GLY 24 22.779 20.301 -35.495 269 HA3 GLY 24 HA3 GLY 24 21.522 20.696 -36.634 270 H GLN 25 H GLN 25 23.423 22.494 -35.101 271 HA GLN 25 HA GLN 25 21.884 23.919 -33.151 272 HB2 GLN 25 HB2 GLN 25 23.905 25.453 -34.760 273 HB3 GLN 25 HB3 GLN 25 23.232 25.805 -33.179 274 HG2 GLN 25 HG2 GLN 25 24.802 23.161 -33.532 275 HG3 GLN 25 HG3 GLN 25 25.626 24.753 -33.236 276 HE21 GLN 25 HE22 GLN 25 25.052 22.137 -31.666 277 HE22 GLN 25 HE21 GLN 25 24.906 22.886 -30.144 278 H ASP 26 H ASP 26 21.694 24.130 -36.562 279 HA ASP 26 HA ASP 26 20.174 26.614 -36.620 280 HB2 ASP 26 HB2 ASP 26 19.769 26.310 -39.018 281 HB3 ASP 26 HB3 ASP 26 21.491 26.070 -38.473 282 H GLY 27 H GLY 27 19.030 23.752 -35.430 283 HA2 GLY 27 HA2 GLY 27 16.964 23.126 -34.899 284 HA3 GLY 27 HA3 GLY 27 16.131 24.374 -35.882 285 H SER 28 H SER 28 18.616 22.537 -37.340 286 HA SER 28 HA SER 28 16.640 20.911 -38.912 287 HB2 SER 28 HB2 SER 28 18.498 20.337 -40.303 288 HB3 SER 28 HB3 SER 28 18.662 22.104 -39.931 289 HG SER 28 HG SER 28 20.198 21.794 -38.883 290 H VAL 29 H VAL 29 16.027 19.049 -38.449 291 HA VAL 29 HA VAL 29 17.175 17.544 -36.115 292 HB VAL 29 HB VAL 29 14.264 18.414 -36.339 293 HG11 VAL 29 HG11 VAL 29 15.644 16.928 -34.257 294 HG12 VAL 29 HG12 VAL 29 13.999 17.615 -34.147 295 HG13 VAL 29 HG13 VAL 29 14.315 16.351 -35.354 296 HG21 VAL 29 HG21 VAL 29 14.588 19.792 -34.574 297 HG22 VAL 29 HG22 VAL 29 16.360 19.321 -34.368 298 HG23 VAL 29 HG23 VAL 29 15.896 20.330 -35.668 299 H VAL 30 H VAL 30 17.400 15.414 -36.650 300 HA VAL 30 HA VAL 30 15.326 14.264 -38.409 301 HB VAL 30 HB VAL 30 17.112 12.373 -38.850 302 HG11 VAL 30 HG11 VAL 30 17.667 13.221 -40.633 303 HG12 VAL 30 HG12 VAL 30 16.623 14.592 -40.279 304 HG13 VAL 30 HG13 VAL 30 18.432 14.627 -40.008 305 HG21 VAL 30 HG21 VAL 30 18.482 12.801 -36.931 306 HG22 VAL 30 HG22 VAL 30 19.428 12.966 -38.446 307 HG23 VAL 30 HG23 VAL 30 19.012 14.389 -37.653 308 H GLN 31 H GLN 31 14.482 11.950 -37.740 309 HA GLN 31 HA GLN 31 14.759 11.478 -34.862 310 HB2 GLN 31 HB2 GLN 31 12.420 11.621 -36.300 311 HB3 GLN 31 HB3 GLN 31 13.130 10.293 -37.232 312 HG2 GLN 31 HG2 GLN 31 13.002 8.853 -35.298 313 HG3 GLN 31 HG3 GLN 31 12.618 10.126 -34.144 314 HE21 GLN 31 HE22 GLN 31 10.934 7.758 -34.715 315 HE22 GLN 31 HE21 GLN 31 9.402 8.378 -35.384 316 H PHE 32 H PHE 32 15.203 9.502 -34.045 317 HA PHE 32 HA PHE 32 16.537 7.602 -35.969 318 HB2 PHE 32 HB2 PHE 32 17.595 8.777 -33.458 319 HB3 PHE 32 HB3 PHE 32 17.898 7.121 -33.590 320 HD1 PHE 32 HD1 PHE 32 18.355 10.227 -35.574 321 HD2 PHE 32 HD2 PHE 32 19.533 6.170 -34.870 322 HE1 PHE 32 HE1 PHE 32 20.087 10.442 -37.337 323 HE2 PHE 32 HE2 PHE 32 21.354 6.344 -36.434 324 HZ PHE 32 HZ PHE 32 21.797 8.725 -37.630 325 H LYS 33 H LYS 33 15.544 5.583 -35.858 326 HA LYS 33 HA LYS 33 13.756 4.759 -33.552 327 HB2 LYS 33 HB2 LYS 33 12.681 5.086 -35.744 328 HB3 LYS 33 HB3 LYS 33 13.879 4.009 -36.448 329 HG2 LYS 33 HG2 LYS 33 12.956 2.100 -35.080 330 HG3 LYS 33 HG3 LYS 33 11.772 3.284 -34.367 331 HD2 LYS 33 HD2 LYS 33 10.950 3.645 -36.638 332 HD3 LYS 33 HD3 LYS 33 11.999 2.336 -37.274 333 HE2 LYS 33 HE2 LYS 33 10.779 0.980 -35.348 334 HE3 LYS 33 HE3 LYS 33 9.728 2.303 -35.233 335 HZ1 LYS 33 HZ1 LYS 33 8.710 0.736 -36.544 336 HZ2 LYS 33 HZ2 LYS 33 8.893 2.087 -37.430 337 HZ3 LYS 33 HZ3 LYS 33 9.866 0.804 -37.740 338 H ILE 34 H ILE 34 15.348 3.855 -32.378 339 HA ILE 34 HA ILE 34 16.951 1.533 -33.429 340 HB ILE 34 HB ILE 34 18.706 2.294 -32.121 341 HG12 ILE 34 HG12 ILE 34 17.098 4.698 -31.200 342 HG13 ILE 34 HG13 ILE 34 17.740 3.513 -30.131 343 HG21 ILE 34 HG21 ILE 34 18.240 3.156 -34.435 344 HG22 ILE 34 HG22 ILE 34 17.878 4.714 -33.708 345 HG23 ILE 34 HG23 ILE 34 19.487 3.961 -33.492 346 HD11 ILE 34 HD11 ILE 34 19.432 5.351 -30.041 347 HD12 ILE 34 HD12 ILE 34 20.069 4.195 -31.243 348 HD13 ILE 34 HD13 ILE 34 19.151 5.544 -31.809 349 H LYS 35 H LYS 35 17.952 0.169 -31.481 350 HA LYS 35 HA LYS 35 15.737 -0.515 -29.770 351 HB2 LYS 35 HB2 LYS 35 18.134 -1.991 -30.741 352 HB3 LYS 35 HB3 LYS 35 17.480 -2.550 -29.233 353 HG2 LYS 35 HG2 LYS 35 15.367 -3.043 -30.298 354 HG3 LYS 35 HG3 LYS 35 15.783 -2.372 -31.847 355 HD2 LYS 35 HD2 LYS 35 17.548 -3.668 -32.332 356 HD3 LYS 35 HD3 LYS 35 17.593 -4.588 -30.923 357 HE2 LYS 35 HE2 LYS 35 15.127 -5.243 -31.222 358 HE3 LYS 35 HE3 LYS 35 15.100 -4.527 -32.801 359 HZ1 LYS 35 HZ1 LYS 35 16.867 -6.130 -33.293 360 HZ2 LYS 35 HZ2 LYS 35 16.748 -6.729 -31.751 361 HZ3 LYS 35 HZ3 LYS 35 15.473 -6.759 -32.858 362 H ARG 36 H ARG 36 16.197 -0.632 -27.476 363 HA ARG 36 HA ARG 36 17.658 1.749 -26.728 364 HB2 ARG 36 HB2 ARG 36 16.269 -0.501 -25.269 365 HB3 ARG 36 HB3 ARG 36 17.049 0.840 -24.288 366 HG2 ARG 36 HG2 ARG 36 15.486 2.452 -25.262 367 HG3 ARG 36 HG3 ARG 36 14.935 1.220 -26.452 368 HD2 ARG 36 HD2 ARG 36 13.293 1.644 -24.579 369 HD3 ARG 36 HD3 ARG 36 13.941 -0.042 -24.461 370 HE ARG 36 HE ARG 36 15.326 0.578 -22.549 371 HH11 ARG 36 HH11 ARG 36 13.533 3.416 -23.613 372 HH12 ARG 36 HH12 ARG 36 14.232 4.297 -22.299 373 HH21 ARG 36 HH21 ARG 36 15.501 1.592 -20.671 374 HH22 ARG 36 HH22 ARG 36 15.051 3.267 -20.585 375 H HIS 37 H HIS 37 18.872 -1.223 -27.172 376 HA HIS 37 HA HIS 37 21.309 -0.588 -25.613 377 HB2 HIS 37 HB2 HIS 37 21.784 -2.983 -25.676 378 HB3 HIS 37 HB3 HIS 37 20.235 -2.655 -24.984 379 HD2 HIS 37 HD2 HIS 37 18.275 -3.760 -25.352 380 HE1 HIS 37 HE1 HIS 37 18.955 -4.943 -29.418 381 HE2 HIS 37 HE2 HIS 37 17.276 -5.004 -27.515 382 H THR 38 H THR 38 20.371 0.086 -28.848 383 HA THR 38 HA THR 38 22.636 -0.920 -30.357 384 HB THR 38 HB THR 38 20.743 1.441 -30.746 385 HG1 THR 38 HG1 THR 38 20.492 -1.204 -31.565 386 HG21 THR 38 HG21 THR 38 22.865 1.446 -32.195 387 HG22 THR 38 HG22 THR 38 22.135 0.046 -33.020 388 HG23 THR 38 HG23 THR 38 21.240 1.469 -33.041 389 HA PRO 39 HA PRO 39 25.475 2.073 -28.652 390 HB2 PRO 39 HB2 PRO 39 26.812 2.004 -31.259 391 HB3 PRO 39 HB3 PRO 39 27.465 1.843 -29.616 392 HG2 PRO 39 HG2 PRO 39 27.196 -0.396 -31.107 393 HG3 PRO 39 HG3 PRO 39 26.601 -0.412 -29.458 394 HD2 PRO 39 HD2 PRO 39 24.845 -0.027 -31.855 395 HD3 PRO 39 HD3 PRO 39 24.727 -0.992 -30.303 396 H LEU 40 H LEU 40 25.534 4.275 -28.511 397 HA LEU 40 HA LEU 40 24.376 5.990 -30.511 398 HB2 LEU 40 HB2 LEU 40 26.076 6.719 -28.085 399 HB3 LEU 40 HB3 LEU 40 25.198 7.856 -29.076 400 HG LEU 40 HG LEU 40 23.903 5.399 -27.586 401 HD11 LEU 40 HD11 LEU 40 23.539 6.683 -25.683 402 HD12 LEU 40 HD12 LEU 40 25.249 7.070 -26.074 403 HD13 LEU 40 HD13 LEU 40 24.026 8.215 -26.505 404 HD21 LEU 40 HD21 LEU 40 23.002 8.050 -28.743 405 HD22 LEU 40 HD22 LEU 40 22.403 6.387 -29.259 406 HD23 LEU 40 HD23 LEU 40 21.932 7.016 -27.708 407 H SER 41 H SER 41 27.700 4.969 -29.925 408 HA SER 41 HA SER 41 29.190 6.614 -31.666 409 HB2 SER 41 HB2 SER 41 30.674 4.588 -32.109 410 HB3 SER 41 HB3 SER 41 30.043 4.688 -30.404 411 HG SER 41 HG SER 41 29.474 2.805 -30.936 412 H LYS 42 H LYS 42 27.165 3.823 -32.634 413 HA LYS 42 HA LYS 42 27.598 4.117 -35.418 414 HB2 LYS 42 HB2 LYS 42 25.630 2.410 -33.911 415 HB3 LYS 42 HB3 LYS 42 25.764 2.311 -35.718 416 HG2 LYS 42 HG2 LYS 42 28.170 1.770 -35.437 417 HG3 LYS 42 HG3 LYS 42 27.828 1.516 -33.648 418 HD2 LYS 42 HD2 LYS 42 26.142 -0.146 -33.986 419 HD3 LYS 42 HD3 LYS 42 26.243 -0.228 -35.655 420 HE2 LYS 42 HE2 LYS 42 28.761 -0.852 -35.462 421 HE3 LYS 42 HE3 LYS 42 28.732 -0.777 -33.804 422 HZ1 LYS 42 HZ1 LYS 42 27.063 -2.464 -33.535 423 HZ2 LYS 42 HZ2 LYS 42 26.940 -2.701 -35.164 424 HZ3 LYS 42 HZ3 LYS 42 28.321 -3.009 -34.334 425 H LEU 43 H LEU 43 25.083 5.327 -33.186 426 HA LEU 43 HA LEU 43 23.530 6.434 -35.274 427 HB2 LEU 43 HB2 LEU 43 22.451 6.020 -33.039 428 HB3 LEU 43 HB3 LEU 43 23.709 7.049 -32.283 429 HG LEU 43 HG LEU 43 22.013 8.414 -34.302 430 HD11 LEU 43 HD11 LEU 43 20.289 9.027 -32.780 431 HD12 LEU 43 HD12 LEU 43 20.191 7.285 -32.715 432 HD13 LEU 43 HD13 LEU 43 20.917 8.119 -31.358 433 HD21 LEU 43 HD21 LEU 43 21.972 10.323 -32.814 434 HD22 LEU 43 HD22 LEU 43 22.850 9.310 -31.520 435 HD23 LEU 43 HD23 LEU 43 23.663 9.846 -32.986 436 H MET 44 H MET 44 25.971 8.148 -33.220 437 HA MET 44 HA MET 44 26.214 10.620 -34.572 438 HB2 MET 44 HB2 MET 44 28.310 8.786 -33.157 439 HB3 MET 44 HB3 MET 44 28.314 10.597 -33.525 440 HG2 MET 44 HG2 MET 44 26.570 10.884 -32.058 441 HG3 MET 44 HG3 MET 44 26.604 9.276 -31.272 442 HE1 MET 44 HE1 MET 44 29.560 8.732 -30.981 443 HE2 MET 44 HE2 MET 44 29.991 9.437 -29.354 444 HE3 MET 44 HE3 MET 44 28.388 8.564 -29.688 445 H LYS 45 H LYS 45 28.091 7.631 -35.210 446 HA LYS 45 HA LYS 45 29.317 8.713 -37.505 447 HB2 LYS 45 HB2 LYS 45 28.773 5.973 -36.830 448 HB3 LYS 45 HB3 LYS 45 29.776 6.322 -38.276 449 HG2 LYS 45 HG2 LYS 45 31.369 7.572 -36.913 450 HG3 LYS 45 HG3 LYS 45 30.508 7.172 -35.431 451 HD2 LYS 45 HD2 LYS 45 31.935 5.330 -37.282 452 HD3 LYS 45 HD3 LYS 45 32.460 6.124 -35.741 453 HE2 LYS 45 HE2 LYS 45 30.716 4.788 -34.576 454 HE3 LYS 45 HE3 LYS 45 30.185 4.116 -36.129 455 HZ1 LYS 45 HZ1 LYS 45 32.219 2.874 -36.390 456 HZ2 LYS 45 HZ2 LYS 45 32.880 3.591 -35.060 457 HZ3 LYS 45 HZ3 LYS 45 31.669 2.632 -34.859 458 H ALA 46 H ALA 46 26.247 6.845 -37.542 459 HA ALA 46 HA ALA 46 25.915 6.900 -40.250 460 HB1 ALA 46 HB1 ALA 46 23.977 7.102 -37.983 461 HB2 ALA 46 HB2 ALA 46 23.438 6.522 -39.628 462 HB3 ALA 46 HB3 ALA 46 24.652 5.603 -38.796 463 H TYR 47 H TYR 47 24.707 9.319 -37.847 464 HA TYR 47 HA TYR 47 23.502 11.118 -39.665 465 HB2 TYR 47 HB2 TYR 47 23.214 11.004 -37.275 466 HB3 TYR 47 HB3 TYR 47 24.893 11.437 -36.905 467 HD1 TYR 47 HD2 TYR 47 25.838 13.701 -37.820 468 HD2 TYR 47 HD1 TYR 47 21.697 12.860 -37.250 469 HE1 TYR 47 HE2 TYR 47 25.337 16.095 -37.880 470 HE2 TYR 47 HE1 TYR 47 21.080 15.311 -37.336 471 HH TYR 47 HH TYR 47 22.258 17.702 -37.587 472 H CYS 48 H CYS 48 26.875 10.977 -38.449 473 HA CYS 48 HA CYS 48 27.979 13.328 -39.708 474 HB2 CYS 48 HB2 CYS 48 28.884 11.948 -37.828 475 HB3 CYS 48 HB3 CYS 48 29.132 10.636 -39.098 476 HG CYS 48 HG CYS 48 31.363 11.169 -39.266 477 H GLU 49 H GLU 49 27.868 9.905 -40.880 478 HA GLU 49 HA GLU 49 28.999 10.172 -43.475 479 HB2 GLU 49 HB2 GLU 49 26.830 8.405 -42.358 480 HB3 GLU 49 HB3 GLU 49 27.246 8.304 -44.043 481 HG2 GLU 49 HG2 GLU 49 29.076 7.644 -41.738 482 HG3 GLU 49 HG3 GLU 49 28.418 6.647 -43.032 483 H ARG 50 H ARG 50 25.596 10.637 -42.478 484 HA ARG 50 HA ARG 50 24.487 11.491 -45.062 485 HB2 ARG 50 HB2 ARG 50 23.710 11.408 -42.238 486 HB3 ARG 50 HB3 ARG 50 22.776 12.530 -43.206 487 HG2 ARG 50 HG2 ARG 50 22.152 10.754 -44.758 488 HG3 ARG 50 HG3 ARG 50 22.937 9.529 -43.770 489 HD2 ARG 50 HD2 ARG 50 21.680 10.027 -41.883 490 HD3 ARG 50 HD3 ARG 50 20.773 11.369 -42.709 491 HE ARG 50 HE ARG 50 20.563 8.433 -43.204 492 HH11 ARG 50 HH11 ARG 50 19.359 11.539 -43.889 493 HH12 ARG 50 HH12 ARG 50 17.921 10.943 -44.751 494 HH21 ARG 50 HH21 ARG 50 18.705 7.715 -44.129 495 HH22 ARG 50 HH22 ARG 50 17.556 8.865 -44.869 496 H GLN 51 H GLN 51 25.624 13.512 -42.344 497 HA GLN 51 HA GLN 51 25.478 16.006 -43.873 498 HB2 GLN 51 HB2 GLN 51 27.198 15.449 -41.456 499 HB3 GLN 51 HB3 GLN 51 26.866 17.009 -42.114 500 HG2 GLN 51 HG2 GLN 51 24.716 15.198 -40.755 501 HG3 GLN 51 HG3 GLN 51 25.297 16.851 -40.351 502 HE21 GLN 51 HE22 GLN 51 24.827 18.613 -42.225 503 HE22 GLN 51 HE21 GLN 51 23.405 18.253 -43.165 504 H GLY 52 H GLY 52 27.804 13.412 -44.209 505 HA2 GLY 52 HA2 GLY 52 29.253 13.116 -45.798 506 HA3 GLY 52 HA3 GLY 52 29.115 14.807 -46.316 507 H LEU 53 H LEU 53 30.170 13.567 -43.125 508 HA LEU 53 HA LEU 53 32.778 15.051 -43.391 509 HB2 LEU 53 HB2 LEU 53 31.056 14.995 -40.928 510 HB3 LEU 53 HB3 LEU 53 32.504 15.943 -41.178 511 HG LEU 53 HG LEU 53 29.748 16.165 -42.291 512 HD11 LEU 53 HD11 LEU 53 31.267 17.958 -40.376 513 HD12 LEU 53 HD12 LEU 53 29.648 18.292 -41.005 514 HD13 LEU 53 HD13 LEU 53 29.919 16.805 -40.095 515 HD21 LEU 53 HD21 LEU 53 31.493 16.948 -43.925 516 HD22 LEU 53 HD22 LEU 53 30.645 18.323 -43.497 517 HD23 LEU 53 HD23 LEU 53 32.193 18.064 -42.622 518 H SER 54 H SER 54 34.150 14.451 -41.442 519 HA SER 54 HA SER 54 33.986 11.652 -40.532 520 HB2 SER 54 HB2 SER 54 36.298 12.182 -41.341 521 HB3 SER 54 HB3 SER 54 36.423 13.558 -40.260 522 HG SER 54 HG SER 54 37.025 11.279 -39.455 523 H MET 55 H MET 55 33.640 11.168 -38.473 524 HA MET 55 HA MET 55 32.018 12.826 -36.951 525 HB2 MET 55 HB2 MET 55 32.288 10.144 -36.701 526 HB3 MET 55 HB3 MET 55 33.615 10.481 -35.692 527 HG2 MET 55 HG2 MET 55 32.045 11.964 -34.293 528 HG3 MET 55 HG3 MET 55 30.915 11.539 -35.598 529 HE1 MET 55 HE1 MET 55 33.231 9.515 -32.966 530 HE2 MET 55 HE2 MET 55 32.262 8.091 -32.875 531 HE3 MET 55 HE3 MET 55 33.007 8.365 -34.382 532 H ARG 56 H ARG 56 35.502 12.703 -36.769 533 HA ARG 56 HA ARG 56 35.799 14.320 -34.281 534 HB2 ARG 56 HB2 ARG 56 37.411 12.553 -35.280 535 HB3 ARG 56 HB3 ARG 56 37.704 13.536 -36.613 536 HG2 ARG 56 HG2 ARG 56 38.708 15.345 -35.150 537 HG3 ARG 56 HG3 ARG 56 38.466 14.340 -33.712 538 HD2 ARG 56 HD2 ARG 56 39.642 12.493 -34.802 539 HD3 ARG 56 HD3 ARG 56 39.937 13.522 -36.138 540 HE ARG 56 HE ARG 56 41.042 15.207 -34.715 541 HH11 ARG 56 HH11 ARG 56 41.382 11.786 -33.580 542 HH12 ARG 56 HH12 ARG 56 42.901 12.221 -32.990 543 HH21 ARG 56 HH21 ARG 56 43.136 15.389 -34.027 544 HH22 ARG 56 HH22 ARG 56 43.899 14.001 -33.432 545 H GLN 57 H GLN 57 34.859 15.277 -37.553 546 HA GLN 57 HA GLN 57 35.805 18.072 -36.913 547 HB2 GLN 57 HB2 GLN 57 35.676 17.227 -39.128 548 HB3 GLN 57 HB3 GLN 57 33.981 16.829 -38.982 549 HG2 GLN 57 HG2 GLN 57 33.478 19.411 -38.796 550 HG3 GLN 57 HG3 GLN 57 35.187 19.693 -38.841 551 HE21 GLN 57 HE22 GLN 57 33.148 20.703 -40.258 552 HE22 GLN 57 HE21 GLN 57 33.378 20.358 -42.000 553 H ILE 58 H ILE 58 33.123 16.150 -36.022 554 HA ILE 58 HA ILE 58 31.585 18.482 -34.904 555 HB ILE 58 HB ILE 58 29.535 17.011 -35.000 556 HG12 ILE 58 HG12 ILE 58 31.077 15.560 -37.033 557 HG13 ILE 58 HG13 ILE 58 30.410 15.018 -35.415 558 HG21 ILE 58 HG21 ILE 58 30.159 19.061 -36.446 559 HG22 ILE 58 HG22 ILE 58 30.020 17.808 -37.749 560 HG23 ILE 58 HG23 ILE 58 28.683 17.984 -36.557 561 HD11 ILE 58 HD11 ILE 58 28.103 15.307 -36.206 562 HD12 ILE 58 HD12 ILE 58 28.824 15.830 -37.774 563 HD13 ILE 58 HD13 ILE 58 28.896 14.160 -37.240 564 H ARG 59 H ARG 59 30.375 18.109 -32.964 565 HA ARG 59 HA ARG 59 31.367 15.909 -31.311 566 HB2 ARG 59 HB2 ARG 59 31.236 18.796 -30.486 567 HB3 ARG 59 HB3 ARG 59 31.209 17.484 -29.342 568 HG2 ARG 59 HG2 ARG 59 33.417 18.265 -31.197 569 HG3 ARG 59 HG3 ARG 59 33.207 18.527 -29.544 570 HD2 ARG 59 HD2 ARG 59 33.541 16.186 -28.837 571 HD3 ARG 59 HD3 ARG 59 33.440 15.611 -30.486 572 HE ARG 59 HE ARG 59 35.814 16.405 -29.227 573 HH11 ARG 59 HH11 ARG 59 34.370 16.441 -32.466 574 HH12 ARG 59 HH12 ARG 59 35.941 16.665 -33.102 575 HH21 ARG 59 HH21 ARG 59 37.601 16.676 -30.222 576 HH22 ARG 59 HH22 ARG 59 37.790 16.852 -31.914 577 H PHE 60 H PHE 60 29.809 15.416 -29.469 578 HA PHE 60 HA PHE 60 27.070 16.240 -30.097 579 HB2 PHE 60 HB2 PHE 60 27.850 13.260 -29.727 580 HB3 PHE 60 HB3 PHE 60 26.170 13.731 -29.949 581 HD1 PHE 60 HD1 PHE 60 29.461 13.308 -31.773 582 HD2 PHE 60 HD2 PHE 60 25.239 14.209 -32.089 583 HE1 PHE 60 HE1 PHE 60 29.581 13.081 -34.186 584 HE2 PHE 60 HE2 PHE 60 25.334 13.977 -34.475 585 HZ PHE 60 HZ PHE 60 27.434 13.203 -35.573 586 H ARG 61 H ARG 61 25.646 16.213 -28.437 587 HA ARG 61 HA ARG 61 26.467 15.356 -25.653 588 HB2 ARG 61 HB2 ARG 61 25.248 18.107 -26.115 589 HB3 ARG 61 HB3 ARG 61 25.742 17.383 -24.606 590 HG2 ARG 61 HG2 ARG 61 28.195 17.467 -25.357 591 HG3 ARG 61 HG3 ARG 61 27.486 18.316 -26.783 592 HD2 ARG 61 HD2 ARG 61 26.750 20.038 -25.036 593 HD3 ARG 61 HD3 ARG 61 27.385 19.057 -23.722 594 HE ARG 61 HE ARG 61 29.643 19.387 -25.256 595 HH11 ARG 61 HH11 ARG 61 27.326 21.706 -23.974 596 HH12 ARG 61 HH12 ARG 61 28.604 22.874 -23.746 597 HH21 ARG 61 HH21 ARG 61 31.139 20.851 -24.867 598 HH22 ARG 61 HH22 ARG 61 30.592 22.457 -24.528 599 H PHE 62 H PHE 62 24.955 14.945 -24.255 600 HA PHE 62 HA PHE 62 22.130 15.682 -24.627 601 HB2 PHE 62 HB2 PHE 62 22.231 13.417 -25.636 602 HB3 PHE 62 HB3 PHE 62 23.219 12.850 -24.368 603 HD1 PHE 62 HD2 PHE 62 19.794 14.345 -24.833 604 HD2 PHE 62 HD1 PHE 62 22.134 11.615 -22.557 605 HE1 PHE 62 HE2 PHE 62 17.830 13.836 -23.315 606 HE2 PHE 62 HE1 PHE 62 20.275 11.071 -21.226 607 HZ PHE 62 HZ PHE 62 17.988 12.218 -21.693 608 H ASP 63 H ASP 63 20.995 15.738 -22.426 609 HA ASP 63 HA ASP 63 21.084 16.513 -20.366 610 HB2 ASP 63 HB2 ASP 63 20.844 14.262 -19.879 611 HB3 ASP 63 HB3 ASP 63 22.570 14.004 -19.742 612 H GLY 64 H GLY 64 22.876 17.803 -22.053 613 HA2 GLY 64 HA2 GLY 64 24.476 19.455 -21.929 614 HA3 GLY 64 HA3 GLY 64 24.469 19.437 -20.171 615 H GLN 65 H GLN 65 25.124 16.382 -20.920 616 HA GLN 65 HA GLN 65 28.080 16.561 -20.728 617 HB2 GLN 65 HB2 GLN 65 26.271 14.143 -20.731 618 HB3 GLN 65 HB3 GLN 65 27.957 14.241 -20.370 619 HG2 GLN 65 HG2 GLN 65 25.620 14.765 -18.733 620 HG3 GLN 65 HG3 GLN 65 27.153 14.164 -18.301 621 HE21 GLN 65 HE22 GLN 65 29.065 16.096 -18.182 622 HE22 GLN 65 HE21 GLN 65 28.422 17.571 -17.633 623 HA PRO 66 HA PRO 66 29.011 15.652 -25.040 624 HB2 PRO 66 HB2 PRO 66 31.649 14.914 -23.898 625 HB3 PRO 66 HB3 PRO 66 31.246 15.903 -25.256 626 HG2 PRO 66 HG2 PRO 66 31.954 16.988 -23.114 627 HG3 PRO 66 HG3 PRO 66 30.626 17.807 -23.959 628 HD2 PRO 66 HD2 PRO 66 30.471 16.145 -21.485 629 HD3 PRO 66 HD3 PRO 66 29.498 17.562 -21.911 630 H ILE 67 H ILE 67 29.142 13.506 -26.265 631 HA ILE 67 HA ILE 67 28.334 11.241 -24.573 632 HB ILE 67 HB ILE 67 28.168 11.882 -27.535 633 HG12 ILE 67 HG12 ILE 67 26.205 11.544 -25.256 634 HG13 ILE 67 HG13 ILE 67 26.606 13.033 -26.140 635 HG21 ILE 67 HG21 ILE 67 28.738 9.431 -27.338 636 HG22 ILE 67 HG22 ILE 67 27.531 9.347 -26.065 637 HG23 ILE 67 HG23 ILE 67 26.929 9.576 -27.660 638 HD11 ILE 67 HD11 ILE 67 25.623 11.892 -28.112 639 HD12 ILE 67 HD12 ILE 67 25.011 10.513 -27.097 640 HD13 ILE 67 HD13 ILE 67 24.437 12.160 -26.822 641 H ASN 68 H ASN 68 29.813 9.351 -24.042 642 HA ASN 68 HA ASN 68 32.286 9.240 -25.545 643 HB2 ASN 68 HB2 ASN 68 30.920 7.846 -23.248 644 HB3 ASN 68 HB3 ASN 68 32.252 6.946 -24.118 645 HD21 ASN 68 HD22 ASN 68 31.413 9.860 -22.221 646 HD22 ASN 68 HD21 ASN 68 33.043 10.233 -21.862 647 H GLU 69 H GLU 69 32.799 7.809 -26.887 648 HA GLU 69 HA GLU 69 30.978 6.315 -28.574 649 HB2 GLU 69 HB2 GLU 69 34.002 6.057 -28.560 650 HB3 GLU 69 HB3 GLU 69 32.986 5.677 -29.944 651 HG2 GLU 69 HG2 GLU 69 32.353 7.854 -30.252 652 HG3 GLU 69 HG3 GLU 69 33.289 8.493 -28.999 653 H THR 70 H THR 70 31.201 5.620 -25.689 654 HA THR 70 HA THR 70 31.321 2.696 -26.070 655 HB THR 70 HB THR 70 31.617 2.609 -23.729 656 HG1 THR 70 HG1 THR 70 30.834 4.531 -22.968 657 HG21 THR 70 HG21 THR 70 33.458 2.788 -25.468 658 HG22 THR 70 HG22 THR 70 33.809 4.461 -24.834 659 HG23 THR 70 HG23 THR 70 33.876 3.021 -23.746 660 H ASP 71 H ASP 71 28.918 5.153 -25.559 661 HA ASP 71 HA ASP 71 27.439 3.299 -23.905 662 HB2 ASP 71 HB2 ASP 71 27.139 6.358 -24.159 663 HB3 ASP 71 HB3 ASP 71 26.335 5.224 -23.054 664 H THR 72 H THR 72 25.066 3.700 -23.887 665 HA THR 72 HA THR 72 23.851 3.324 -26.554 666 HB THR 72 HB THR 72 22.811 1.312 -25.848 667 HG1 THR 72 HG1 THR 72 23.305 0.503 -23.869 668 HG21 THR 72 HG21 THR 72 25.127 0.841 -26.606 669 HG22 THR 72 HG22 THR 72 25.711 1.244 -25.055 670 HG23 THR 72 HG23 THR 72 24.630 -0.220 -25.348 671 HA PRO 73 HA PRO 73 20.592 5.799 -24.689 672 HB2 PRO 73 HB2 PRO 73 18.559 3.883 -25.440 673 HB3 PRO 73 HB3 PRO 73 18.692 5.638 -25.816 674 HG2 PRO 73 HG2 PRO 73 19.263 3.664 -27.757 675 HG3 PRO 73 HG3 PRO 73 20.096 5.227 -27.601 676 HD2 PRO 73 HD2 PRO 73 20.771 2.546 -26.763 677 HD3 PRO 73 HD3 PRO 73 21.982 3.762 -27.378 678 H ALA 74 H ALA 74 19.918 2.334 -23.866 679 HA ALA 74 HA ALA 74 18.833 2.770 -21.293 680 HB1 ALA 74 HB1 ALA 74 19.907 0.510 -20.957 681 HB2 ALA 74 HB2 ALA 74 18.751 0.646 -22.446 682 HB3 ALA 74 HB3 ALA 74 20.481 0.591 -22.632 683 H GLN 75 H GLN 75 22.225 2.910 -22.328 684 HA GLN 75 HA GLN 75 23.078 2.957 -19.524 685 HB2 GLN 75 HB2 GLN 75 24.233 1.730 -21.095 686 HB3 GLN 75 HB3 GLN 75 24.518 3.237 -22.030 687 HG2 GLN 75 HG2 GLN 75 26.520 2.589 -21.072 688 HG3 GLN 75 HG3 GLN 75 26.071 3.947 -20.137 689 HE21 GLN 75 HE22 GLN 75 27.168 3.517 -18.120 690 HE22 GLN 75 HE21 GLN 75 26.512 2.304 -17.119 691 H LEU 76 H LEU 76 22.222 5.442 -21.745 692 HA LEU 76 HA LEU 76 22.960 7.469 -19.685 693 HB2 LEU 76 HB2 LEU 76 21.922 7.878 -22.408 694 HB3 LEU 76 HB3 LEU 76 22.499 9.240 -21.268 695 HG LEU 76 HG LEU 76 24.019 7.153 -22.838 696 HD11 LEU 76 HD11 LEU 76 24.355 10.191 -22.847 697 HD12 LEU 76 HD12 LEU 76 24.983 8.966 -24.031 698 HD13 LEU 76 HD13 LEU 76 23.324 9.205 -23.929 699 HD21 LEU 76 HD21 LEU 76 26.013 7.944 -21.802 700 HD22 LEU 76 HD22 LEU 76 25.078 9.002 -20.657 701 HD23 LEU 76 HD23 LEU 76 25.079 7.184 -20.728 702 H GLU 77 H GLU 77 20.482 5.505 -19.702 703 HA GLU 77 HA GLU 77 18.443 5.356 -19.024 704 HB2 GLU 77 HB2 GLU 77 19.136 7.969 -17.648 705 HB3 GLU 77 HB3 GLU 77 17.702 6.984 -17.252 706 HG2 GLU 77 HG2 GLU 77 20.638 6.035 -17.084 707 HG3 GLU 77 HG3 GLU 77 19.789 6.587 -15.747 708 H MET 78 H MET 78 18.658 6.343 -21.618 709 HA MET 78 HA MET 78 17.245 8.861 -21.970 710 HB2 MET 78 HB2 MET 78 18.075 6.752 -24.061 711 HB3 MET 78 HB3 MET 78 17.552 8.437 -24.336 712 HG2 MET 78 HG2 MET 78 19.473 9.270 -22.902 713 HG3 MET 78 HG3 MET 78 19.989 7.679 -22.759 714 HE1 MET 78 HE1 MET 78 19.883 10.219 -26.801 715 HE2 MET 78 HE2 MET 78 18.456 9.508 -26.022 716 HE3 MET 78 HE3 MET 78 19.278 10.840 -25.227 717 H GLU 79 H GLU 79 15.224 9.121 -23.136 718 HA GLU 79 HA GLU 79 13.014 7.107 -22.892 719 HB2 GLU 79 HB2 GLU 79 12.891 10.098 -22.020 720 HB3 GLU 79 HB3 GLU 79 11.545 8.981 -22.068 721 HG2 GLU 79 HG2 GLU 79 13.946 8.531 -20.148 722 HG3 GLU 79 HG3 GLU 79 12.530 9.296 -19.757 723 H ASP 80 H ASP 80 11.383 7.541 -24.598 724 HA ASP 80 HA ASP 80 12.420 8.549 -26.938 725 HB2 ASP 80 HB2 ASP 80 9.398 8.477 -26.393 726 HB3 ASP 80 HB3 ASP 80 10.282 8.047 -27.883 727 H GLU 81 H GLU 81 11.999 10.489 -28.230 728 HA GLU 81 HA GLU 81 12.144 12.859 -28.482 729 HB2 GLU 81 HB2 GLU 81 9.785 12.899 -26.627 730 HB3 GLU 81 HB3 GLU 81 10.315 14.189 -27.681 731 HG2 GLU 81 HG2 GLU 81 9.873 12.716 -29.632 732 HG3 GLU 81 HG3 GLU 81 9.156 11.470 -28.512 733 H ASP 82 H ASP 82 13.716 11.553 -26.102 734 HA ASP 82 HA ASP 82 14.833 14.034 -25.078 735 HB2 ASP 82 HB2 ASP 82 15.770 11.099 -25.361 736 HB3 ASP 82 HB3 ASP 82 16.882 12.320 -24.872 737 H THR 83 H THR 83 16.506 15.191 -25.977 738 HA THR 83 HA THR 83 17.087 14.536 -28.850 739 HB THR 83 HB THR 83 17.046 17.233 -27.586 740 HG1 THR 83 HG1 THR 83 15.154 16.477 -27.621 741 HG21 THR 83 HG21 THR 83 18.407 17.215 -29.709 742 HG22 THR 83 HG22 THR 83 17.000 16.476 -30.490 743 HG23 THR 83 HG23 THR 83 16.890 18.099 -29.963 744 H ILE 84 H ILE 84 19.136 13.928 -29.351 745 HA ILE 84 HA ILE 84 21.464 14.824 -27.862 746 HB ILE 84 HB ILE 84 21.204 13.196 -30.421 747 HG12 ILE 84 HG12 ILE 84 21.884 12.070 -27.660 748 HG13 ILE 84 HG13 ILE 84 20.294 11.993 -28.467 749 HG21 ILE 84 HG21 ILE 84 23.533 13.542 -28.474 750 HG22 ILE 84 HG22 ILE 84 23.582 12.504 -29.836 751 HG23 ILE 84 HG23 ILE 84 23.422 14.270 -30.178 752 HD11 ILE 84 HD11 ILE 84 21.356 9.889 -28.805 753 HD12 ILE 84 HD12 ILE 84 21.355 10.806 -30.401 754 HD13 ILE 84 HD13 ILE 84 22.789 10.551 -29.429 755 H ASP 85 H ASP 85 22.523 16.533 -28.096 756 HA ASP 85 HA ASP 85 21.981 18.578 -30.180 757 HB2 ASP 85 HB2 ASP 85 23.532 18.441 -27.690 758 HB3 ASP 85 HB3 ASP 85 23.573 19.728 -28.882 759 H VAL 86 H VAL 86 23.273 18.811 -31.975 760 HA VAL 86 HA VAL 86 26.045 17.720 -32.098 761 HB VAL 86 HB VAL 86 24.337 18.593 -34.399 762 HG11 VAL 86 HG11 VAL 86 26.730 18.352 -34.990 763 HG12 VAL 86 HG12 VAL 86 26.767 16.758 -34.291 764 HG13 VAL 86 HG13 VAL 86 25.742 17.181 -35.715 765 HG21 VAL 86 HG21 VAL 86 24.379 15.653 -33.341 766 HG22 VAL 86 HG22 VAL 86 22.961 16.631 -33.553 767 HG23 VAL 86 HG23 VAL 86 23.876 16.180 -34.930 768 H PHE 87 H PHE 87 27.594 18.876 -32.323 769 HA PHE 87 HA PHE 87 27.618 21.887 -32.723 770 HB2 PHE 87 HB2 PHE 87 29.237 19.984 -31.005 771 HB3 PHE 87 HB3 PHE 87 29.570 21.693 -31.181 772 HD1 PHE 87 HD2 PHE 87 28.014 23.330 -30.301 773 HD2 PHE 87 HD1 PHE 87 27.334 19.167 -29.427 774 HE1 PHE 87 HE2 PHE 87 26.274 23.876 -28.357 775 HE2 PHE 87 HE1 PHE 87 26.017 19.843 -27.397 776 HZ PHE 87 HZ PHE 87 25.601 22.148 -26.910 777 H GLN 88 H GLN 88 29.558 22.642 -33.837 778 HA GLN 88 HA GLN 88 31.019 20.636 -35.491 779 HB2 GLN 88 HB2 GLN 88 30.669 23.591 -35.858 780 HB3 GLN 88 HB3 GLN 88 31.930 22.634 -36.680 781 HG2 GLN 88 HG2 GLN 88 29.209 21.303 -36.756 782 HG3 GLN 88 HG3 GLN 88 29.270 22.833 -37.532 783 HE21 GLN 88 HE22 GLN 88 28.584 21.173 -39.274 784 HE22 GLN 88 HE21 GLN 88 29.918 21.071 -40.382 785 H GLN 89 H GLN 89 33.286 20.556 -35.109 786 HA GLN 89 HA GLN 89 34.303 21.613 -32.605 787 HB2 GLN 89 HB2 GLN 89 35.021 19.459 -33.596 788 HB3 GLN 89 HB3 GLN 89 36.127 20.219 -34.711 789 HG2 GLN 89 HG2 GLN 89 37.272 19.335 -33.011 790 HG3 GLN 89 HG3 GLN 89 37.581 21.079 -33.133 791 HE21 GLN 89 HE22 GLN 89 38.570 20.661 -31.147 792 HE22 GLN 89 HE21 GLN 89 37.711 20.138 -29.685 793 H GLN 90 H GLN 90 36.008 23.228 -32.126 794 HA GLN 90 HA GLN 90 36.140 25.493 -33.631 795 HB2 GLN 90 HB2 GLN 90 37.941 24.082 -31.630 796 HB3 GLN 90 HB3 GLN 90 38.393 25.598 -32.214 797 HG2 GLN 90 HG2 GLN 90 37.563 25.856 -30.056 798 HG3 GLN 90 HG3 GLN 90 36.557 26.750 -31.276 799 HE21 GLN 90 HE22 GLN 90 35.057 26.784 -29.659 800 HE22 GLN 90 HE21 GLN 90 33.831 25.481 -29.459 801 H THR 91 H THR 91 37.835 26.510 -34.671 802 HA THR 91 HA THR 91 39.177 24.830 -36.716 803 HB THR 91 HB THR 91 38.499 26.508 -38.368 804 HG1 THR 91 HG1 THR 91 38.054 28.301 -37.193 805 HG21 THR 91 HG21 THR 91 35.957 25.574 -36.870 806 HG22 THR 91 HG22 THR 91 36.267 25.633 -38.623 807 HG23 THR 91 HG23 THR 91 37.148 24.464 -37.615 808 H GLY 92 H GLY 92 40.397 25.941 -34.292 809 HA2 GLY 92 HA2 GLY 92 42.135 27.134 -33.493 810 HA3 GLY 92 HA3 GLY 92 42.863 27.066 -35.157 811 H GLY 93 H GLY 93 43.807 29.031 -34.747 812 HA2 GLY 93 HA2 GLY 93 42.226 31.475 -35.601 813 HA3 GLY 93 HA3 GLY 93 42.870 31.684 -34.001 814 H VAL 94 H VAL 94 44.309 33.130 -34.316 815 HA VAL 94 HA VAL 94 46.542 32.810 -36.306 816 HB VAL 94 HB VAL 94 44.788 35.304 -35.912 817 HG11 VAL 94 HG11 VAL 94 47.082 34.933 -37.966 818 HG12 VAL 94 HG12 VAL 94 46.087 36.341 -37.563 819 HG13 VAL 94 HG13 VAL 94 47.313 35.671 -36.390 820 HG21 VAL 94 HG21 VAL 94 43.690 33.515 -37.155 821 HG22 VAL 94 HG22 VAL 94 44.193 34.858 -38.166 822 HG23 VAL 94 HG23 VAL 94 45.124 33.388 -38.244 823 H TYR 95 H TYR 95 48.633 33.220 -35.268 824 HA TYR 95 HA TYR 95 49.121 34.926 -33.020 825 HB2 TYR 95 HB2 TYR 95 49.490 31.953 -32.834 826 HB3 TYR 95 HB3 TYR 95 49.854 33.049 -31.504 827 HD1 TYR 95 HD1 TYR 95 47.914 34.332 -30.408 828 HD2 TYR 95 HD2 TYR 95 47.309 30.876 -33.049 829 HE1 TYR 95 HE1 TYR 95 45.595 33.773 -29.240 830 HE2 TYR 95 HE2 TYR 95 45.121 30.418 -31.889 831 HH TYR 95 HH TYR 95 44.169 32.132 -29.057 Start of MODEL 20 1 H1 ACE 36 HH32 ACE 36 8.653 14.620 -44.069 2 H2 ACE 36 HH33 ACE 36 9.933 14.505 -42.895 3 H3 ACE 36 HH31 ACE 36 10.187 15.197 -44.572 4 H GLU 37 H GLU 37 9.786 13.671 -46.258 5 HA GLU 37 HA GLU 37 9.815 10.971 -46.212 6 HB2 GLU 37 HB2 GLU 37 9.257 12.346 -47.969 7 HB3 GLU 37 HB3 GLU 37 10.849 12.930 -48.268 8 HG2 GLU 37 HG2 GLU 37 10.464 11.341 -49.935 9 HG3 GLU 37 HG3 GLU 37 11.596 10.667 -48.723 10 H ASP 38 H ASP 38 12.706 12.905 -46.046 11 HA ASP 38 HA ASP 38 14.427 10.523 -45.519 12 HB2 ASP 38 HB2 ASP 38 14.917 11.807 -47.482 13 HB3 ASP 38 HB3 ASP 38 15.440 13.117 -46.502 14 H ALA 39 H ALA 39 12.679 12.657 -43.832 15 HA ALA 39 HA ALA 39 14.647 13.750 -41.871 16 HB1 ALA 39 HB1 ALA 39 11.704 13.729 -41.453 17 HB2 ALA 39 HB2 ALA 39 12.814 14.927 -40.966 18 HB3 ALA 39 HB3 ALA 39 12.467 14.781 -42.702 19 H PHE 40 H PHE 40 14.383 10.870 -42.224 20 HA PHE 40 HA PHE 40 14.081 9.921 -39.487 21 HB2 PHE 40 HB2 PHE 40 11.777 9.941 -40.888 22 HB3 PHE 40 HB3 PHE 40 12.330 8.538 -41.626 23 HD1 PHE 40 HD2 PHE 40 13.357 6.752 -39.467 24 HD2 PHE 40 HD1 PHE 40 10.784 10.140 -38.994 25 HE1 PHE 40 HE2 PHE 40 12.471 5.724 -37.444 26 HE2 PHE 40 HE1 PHE 40 9.667 9.128 -37.178 27 HZ PHE 40 HZ PHE 40 10.454 6.844 -36.390 28 H ILE 41 H ILE 41 15.215 8.073 -38.955 29 HA ILE 41 HA ILE 41 16.574 6.564 -40.993 30 HB ILE 41 HB ILE 41 18.186 7.819 -38.688 31 HG12 ILE 41 HG12 ILE 41 19.202 9.126 -40.500 32 HG13 ILE 41 HG13 ILE 41 17.639 9.073 -41.304 33 HG21 ILE 41 HG21 ILE 41 20.059 7.116 -39.911 34 HG22 ILE 41 HG22 ILE 41 19.117 5.776 -39.721 35 HG23 ILE 41 HG23 ILE 41 18.984 6.647 -41.357 36 HD11 ILE 41 HD11 ILE 41 18.282 11.101 -39.835 37 HD12 ILE 41 HD12 ILE 41 16.734 10.313 -39.221 38 HD13 ILE 41 HD13 ILE 41 18.246 10.063 -38.432 39 H VAL 42 H VAL 42 17.423 4.483 -40.023 40 HA VAL 42 HA VAL 42 16.100 3.696 -37.474 41 HB VAL 42 HB VAL 42 15.428 2.035 -39.817 42 HG11 VAL 42 HG11 VAL 42 13.776 2.406 -37.319 43 HG12 VAL 42 HG12 VAL 42 13.633 1.243 -38.474 44 HG13 VAL 42 HG13 VAL 42 15.159 1.220 -37.496 45 HG21 VAL 42 HG21 VAL 42 13.642 4.321 -39.116 46 HG22 VAL 42 HG22 VAL 42 14.641 4.062 -40.516 47 HG23 VAL 42 HG23 VAL 42 13.332 2.879 -40.092 48 H ILE 43 H ILE 43 17.444 2.305 -36.471 49 HA ILE 43 HA ILE 43 19.794 0.836 -37.856 50 HB ILE 43 HB ILE 43 20.011 3.067 -35.951 51 HG12 ILE 43 HG12 ILE 43 20.935 2.459 -38.676 52 HG13 ILE 43 HG13 ILE 43 20.132 3.925 -38.090 53 HG21 ILE 43 HG21 ILE 43 22.332 2.413 -35.558 54 HG22 ILE 43 HG22 ILE 43 21.291 1.281 -35.056 55 HG23 ILE 43 HG23 ILE 43 22.117 0.941 -36.667 56 HD11 ILE 43 HD11 ILE 43 22.254 4.408 -38.842 57 HD12 ILE 43 HD12 ILE 43 22.287 4.575 -37.051 58 HD13 ILE 43 HD13 ILE 43 23.079 3.286 -37.864 59 H SEP 44 H SEP 44 20.454 -0.994 -36.877 60 HA SEP 44 HA SEP 44 19.956 -1.435 -34.041 61 HB2 SEP 44 HB2 SEP 44 18.703 -3.282 -33.900 62 HB3 SEP 44 HB3 SEP 44 17.952 -2.459 -35.266 63 H ASP 45 H ASP 45 20.728 -4.040 -33.490 64 HA ASP 45 HA ASP 45 23.435 -4.010 -34.586 65 HB2 ASP 45 HB2 ASP 45 22.894 -2.909 -32.206 66 HB3 ASP 45 HB3 ASP 45 22.712 -4.525 -31.668 67 H SEP 46 H SEP 46 20.826 -6.087 -34.157 68 HA SEP 46 HA SEP 46 22.568 -8.610 -33.909 69 HB2 SEP 46 HB2 SEP 46 20.579 -9.890 -33.126 70 HB3 SEP 46 HB3 SEP 46 21.402 -8.798 -31.922 71 H ASP 47 H ASP 47 22.672 -7.617 -36.125 72 HA ASP 47 HA ASP 47 21.186 -9.147 -38.181 73 HB2 ASP 47 HB2 ASP 47 22.574 -7.305 -38.565 74 HB3 ASP 47 HB3 ASP 47 24.052 -8.281 -38.074 75 H GLY 48 H GLY 48 21.165 -11.470 -38.289 76 HA2 GLY 48 HA2 GLY 48 22.038 -13.642 -38.205 77 HA3 GLY 48 HA3 GLY 48 23.463 -12.912 -37.446 78 H GLU 49 H GLU 49 23.025 -14.995 -35.801 79 HA GLU 49 HA GLU 49 21.451 -13.883 -33.426 80 HB2 GLU 49 HB2 GLU 49 20.481 -15.895 -34.608 81 HB3 GLU 49 HB3 GLU 49 21.851 -16.806 -33.915 82 HG2 GLU 49 HG2 GLU 49 20.096 -17.098 -32.501 83 HG3 GLU 49 HG3 GLU 49 21.334 -15.932 -31.767 84 HN1 NH2 50 HN1 NH2 50 24.392 -14.458 -34.958 85 HN2 NH2 50 HN2 NH2 50 25.416 -14.269 -33.600 86 H1 MET 1 H1 MET 1 -5.106 -29.096 -34.683 87 H2 MET 1 H2 MET 1 -5.511 -28.043 -35.805 88 H3 MET 1 H3 MET 1 -6.469 -29.384 -35.448 89 HA MET 1 HA MET 1 -7.166 -26.957 -34.494 90 HB2 MET 1 HB2 MET 1 -8.135 -29.230 -33.724 91 HB3 MET 1 HB3 MET 1 -6.743 -29.355 -32.558 92 HG2 MET 1 HG2 MET 1 -8.527 -28.658 -31.150 93 HG3 MET 1 HG3 MET 1 -7.473 -27.260 -31.502 94 HE1 MET 1 HE1 MET 1 -11.700 -28.057 -33.080 95 HE2 MET 1 HE2 MET 1 -10.375 -28.954 -33.932 96 HE3 MET 1 HE3 MET 1 -10.599 -29.229 -32.315 97 H ALA 2 H ALA 2 -6.318 -25.251 -33.930 98 HA ALA 2 HA ALA 2 -3.808 -25.073 -32.526 99 HB1 ALA 2 HB1 ALA 2 -3.960 -22.895 -32.764 100 HB2 ALA 2 HB2 ALA 2 -4.457 -23.470 -34.248 101 HB3 ALA 2 HB3 ALA 2 -5.758 -22.903 -33.198 102 H ASP 3 H ASP 3 -3.577 -24.059 -30.236 103 HA ASP 3 HA ASP 3 -5.830 -24.181 -28.364 104 HB2 ASP 3 HB2 ASP 3 -4.346 -26.194 -28.306 105 HB3 ASP 3 HB3 ASP 3 -2.931 -25.193 -28.161 106 H GLU 4 H GLU 4 -6.031 -22.139 -27.276 107 HA GLU 4 HA GLU 4 -4.305 -20.032 -27.427 108 HB2 GLU 4 HB2 GLU 4 -6.643 -20.059 -26.610 109 HB3 GLU 4 HB3 GLU 4 -6.135 -20.733 -25.079 110 HG2 GLU 4 HG2 GLU 4 -4.911 -18.645 -24.523 111 HG3 GLU 4 HG3 GLU 4 -5.085 -18.106 -26.218 112 H LYS 5 H LYS 5 -2.295 -19.601 -26.569 113 HA LYS 5 HA LYS 5 -1.144 -21.335 -24.511 114 HB2 LYS 5 HB2 LYS 5 -0.249 -21.271 -27.038 115 HB3 LYS 5 HB3 LYS 5 0.299 -19.631 -26.575 116 HG2 LYS 5 HG2 LYS 5 1.593 -20.803 -24.777 117 HG3 LYS 5 HG3 LYS 5 1.014 -22.376 -25.414 118 HD2 LYS 5 HD2 LYS 5 2.147 -21.604 -27.697 119 HD3 LYS 5 HD3 LYS 5 2.716 -20.308 -26.798 120 HE2 LYS 5 HE2 LYS 5 3.158 -23.113 -25.735 121 HE3 LYS 5 HE3 LYS 5 4.168 -22.582 -27.072 122 HZ1 LYS 5 HZ1 LYS 5 5.343 -21.052 -25.757 123 HZ2 LYS 5 HZ2 LYS 5 4.247 -20.945 -24.611 124 HZ3 LYS 5 HZ3 LYS 5 5.129 -22.349 -24.800 125 HA PRO 6 HA PRO 6 -1.292 -17.502 -22.419 126 HB2 PRO 6 HB2 PRO 6 0.110 -18.757 -20.010 127 HB3 PRO 6 HB3 PRO 6 -1.384 -17.824 -20.177 128 HG2 PRO 6 HG2 PRO 6 -1.565 -20.560 -20.032 129 HG3 PRO 6 HG3 PRO 6 -2.602 -19.579 -21.194 130 HD2 PRO 6 HD2 PRO 6 -0.115 -21.082 -21.786 131 HD3 PRO 6 HD3 PRO 6 -1.701 -21.119 -22.628 132 H LYS 7 H LYS 7 0.060 -15.810 -21.795 133 HA LYS 7 HA LYS 7 2.762 -15.719 -22.770 134 HB2 LYS 7 HB2 LYS 7 1.387 -13.920 -23.278 135 HB3 LYS 7 HB3 LYS 7 0.739 -13.701 -21.655 136 HG2 LYS 7 HG2 LYS 7 3.005 -12.667 -21.085 137 HG3 LYS 7 HG3 LYS 7 3.640 -13.043 -22.708 138 HD2 LYS 7 HD2 LYS 7 2.043 -11.529 -23.742 139 HD3 LYS 7 HD3 LYS 7 1.303 -11.166 -22.120 140 HE2 LYS 7 HE2 LYS 7 3.733 -10.473 -21.454 141 HE3 LYS 7 HE3 LYS 7 4.281 -10.880 -23.044 142 HZ1 LYS 7 HZ1 LYS 7 3.794 -8.621 -23.125 143 HZ2 LYS 7 HZ2 LYS 7 2.694 -9.241 -23.992 144 HZ3 LYS 7 HZ3 LYS 7 2.233 -8.716 -22.560 145 H GLU 8 H GLU 8 4.159 -16.735 -21.251 146 HA GLU 8 HA GLU 8 4.194 -15.819 -18.520 147 HB2 GLU 8 HB2 GLU 8 3.979 -17.840 -17.404 148 HB3 GLU 8 HB3 GLU 8 2.459 -17.560 -18.352 149 HG2 GLU 8 HG2 GLU 8 2.575 -19.645 -19.212 150 HG3 GLU 8 HG3 GLU 8 4.046 -19.341 -19.918 151 H GLY 9 H GLY 9 6.070 -16.867 -21.088 152 HA2 GLY 9 HA2 GLY 9 8.511 -17.005 -19.399 153 HA3 GLY 9 HA3 GLY 9 8.231 -18.009 -20.906 154 H VAL 10 H VAL 10 10.264 -15.726 -19.968 155 HA VAL 10 HA VAL 10 9.545 -13.633 -21.906 156 HB VAL 10 HB VAL 10 11.064 -14.003 -19.368 157 HG11 VAL 10 HG11 VAL 10 11.472 -11.522 -21.331 158 HG12 VAL 10 HG12 VAL 10 11.817 -11.584 -19.610 159 HG13 VAL 10 HG13 VAL 10 12.800 -12.558 -20.560 160 HG21 VAL 10 HG21 VAL 10 9.217 -11.963 -20.463 161 HG22 VAL 10 HG22 VAL 10 8.837 -13.199 -19.209 162 HG23 VAL 10 HG23 VAL 10 9.843 -11.927 -18.820 163 H LYS 11 H LYS 11 10.637 -12.830 -23.567 164 HA LYS 11 HA LYS 11 13.291 -14.054 -24.260 165 HB2 LYS 11 HB2 LYS 11 11.294 -15.330 -25.357 166 HB3 LYS 11 HB3 LYS 11 11.085 -13.933 -26.344 167 HG2 LYS 11 HG2 LYS 11 13.504 -14.373 -27.203 168 HG3 LYS 11 HG3 LYS 11 13.491 -15.911 -26.319 169 HD2 LYS 11 HD2 LYS 11 11.663 -16.682 -27.618 170 HD3 LYS 11 HD3 LYS 11 11.492 -15.030 -28.295 171 HE2 LYS 11 HE2 LYS 11 12.575 -15.980 -29.996 172 HE3 LYS 11 HE3 LYS 11 13.877 -15.082 -29.175 173 HZ1 LYS 11 HZ1 LYS 11 13.364 -17.948 -28.984 174 HZ2 LYS 11 HZ2 LYS 11 14.677 -17.172 -29.693 175 HZ3 LYS 11 HZ3 LYS 11 14.612 -17.124 -28.201 176 H THR 12 H THR 12 14.643 -12.448 -25.039 177 HA THR 12 HA THR 12 14.264 -9.795 -24.861 178 HB THR 12 HB THR 12 16.377 -9.529 -25.966 179 HG1 THR 12 HG1 THR 12 16.300 -10.942 -27.606 180 HG21 THR 12 HG21 THR 12 16.630 -10.488 -23.649 181 HG22 THR 12 HG22 THR 12 16.804 -12.075 -24.387 182 HG23 THR 12 HG23 THR 12 17.884 -10.820 -24.907 183 H GLU 13 H GLU 13 13.027 -11.459 -27.471 184 HA GLU 13 HA GLU 13 13.292 -9.508 -29.549 185 HB2 GLU 13 HB2 GLU 13 11.184 -11.685 -29.166 186 HB3 GLU 13 HB3 GLU 13 11.443 -10.839 -30.680 187 HG2 GLU 13 HG2 GLU 13 13.604 -12.548 -29.313 188 HG3 GLU 13 HG3 GLU 13 12.575 -13.212 -30.439 189 H ASN 14 H ASN 14 10.804 -10.171 -27.093 190 HA ASN 14 HA ASN 14 8.727 -8.832 -28.579 191 HB2 ASN 14 HB2 ASN 14 8.876 -9.856 -25.765 192 HB3 ASN 14 HB3 ASN 14 7.314 -9.561 -26.609 193 HD21 ASN 14 HD22 ASN 14 8.977 -12.172 -25.623 194 HD22 ASN 14 HD21 ASN 14 8.431 -13.162 -26.989 195 H ASN 15 H ASN 15 11.117 -7.316 -26.919 196 HA ASN 15 HA ASN 15 9.702 -5.384 -25.368 197 HB2 ASN 15 HB2 ASN 15 11.878 -6.506 -24.682 198 HB3 ASN 15 HB3 ASN 15 12.703 -5.752 -25.999 199 HD21 ASN 15 HD22 ASN 15 10.578 -4.811 -23.205 200 HD22 ASN 15 HD21 ASN 15 11.262 -3.154 -23.080 201 H ASP 16 H ASP 16 10.019 -2.916 -25.416 202 HA ASP 16 HA ASP 16 9.068 -2.239 -28.071 203 HB2 ASP 16 HB2 ASP 16 9.831 -0.236 -25.972 204 HB3 ASP 16 HB3 ASP 16 8.570 -0.126 -27.240 205 H HIS 17 H HIS 17 10.083 -0.920 -29.567 206 HA HIS 17 HA HIS 17 12.935 -0.263 -29.428 207 HB2 HIS 17 HB2 HIS 17 11.018 0.898 -31.527 208 HB3 HIS 17 HB3 HIS 17 12.666 1.080 -31.366 209 HD2 HIS 17 HD2 HIS 17 14.125 -0.807 -32.549 210 HE1 HIS 17 HE1 HIS 17 10.933 -3.491 -33.557 211 HE2 HIS 17 HE2 HIS 17 13.363 -3.013 -33.942 212 H ILE 18 H ILE 18 13.659 1.884 -29.836 213 HA ILE 18 HA ILE 18 12.337 4.007 -28.092 214 HB ILE 18 HB ILE 18 13.860 2.911 -26.787 215 HG12 ILE 18 HG12 ILE 18 14.424 5.805 -27.438 216 HG13 ILE 18 HG13 ILE 18 13.388 5.130 -26.168 217 HG21 ILE 18 HG21 ILE 18 15.530 2.058 -28.248 218 HG22 ILE 18 HG22 ILE 18 16.243 3.779 -28.297 219 HG23 ILE 18 HG23 ILE 18 16.125 2.863 -26.853 220 HD11 ILE 18 HD11 ILE 18 15.446 4.278 -24.911 221 HD12 ILE 18 HD12 ILE 18 16.480 5.151 -26.098 222 HD13 ILE 18 HD13 ILE 18 15.374 5.964 -25.008 223 H ASN 19 H ASN 19 11.936 5.821 -29.298 224 HA ASN 19 HA ASN 19 13.417 6.399 -31.671 225 HB2 ASN 19 HB2 ASN 19 11.073 7.489 -30.212 226 HB3 ASN 19 HB3 ASN 19 11.891 8.534 -31.368 227 HD21 ASN 19 HD22 ASN 19 9.647 6.026 -31.177 228 HD22 ASN 19 HD21 ASN 19 9.384 5.705 -32.892 229 H LEU 20 H LEU 20 15.105 7.997 -31.780 230 HA LEU 20 HA LEU 20 15.400 9.956 -29.590 231 HB2 LEU 20 HB2 LEU 20 17.556 8.723 -31.313 232 HB3 LEU 20 HB3 LEU 20 17.810 10.090 -30.254 233 HG LEU 20 HG LEU 20 16.761 7.394 -29.245 234 HD11 LEU 20 HD11 LEU 20 19.531 8.662 -28.661 235 HD12 LEU 20 HD12 LEU 20 19.026 7.047 -28.234 236 HD13 LEU 20 HD13 LEU 20 19.273 7.271 -29.903 237 HD21 LEU 20 HD21 LEU 20 16.962 9.940 -27.889 238 HD22 LEU 20 HD22 LEU 20 16.007 8.427 -27.675 239 HD23 LEU 20 HD23 LEU 20 17.589 8.458 -27.016 240 H LYS 21 H LYS 21 16.288 12.056 -30.430 241 HA LYS 21 HA LYS 21 15.743 12.555 -33.301 242 HB2 LYS 21 HB2 LYS 21 14.837 14.235 -30.990 243 HB3 LYS 21 HB3 LYS 21 15.180 14.915 -32.580 244 HG2 LYS 21 HG2 LYS 21 13.575 13.405 -33.567 245 HG3 LYS 21 HG3 LYS 21 13.553 12.570 -31.932 246 HD2 LYS 21 HD2 LYS 21 12.511 14.631 -31.036 247 HD3 LYS 21 HD3 LYS 21 12.562 15.427 -32.594 248 HE2 LYS 21 HE2 LYS 21 11.143 13.690 -33.641 249 HE3 LYS 21 HE3 LYS 21 10.879 12.908 -32.156 250 HZ1 LYS 21 HZ1 LYS 21 9.238 14.674 -32.933 251 HZ2 LYS 21 HZ2 LYS 21 9.523 14.600 -31.387 252 HZ3 LYS 21 HZ3 LYS 21 10.265 15.782 -32.219 253 H VAL 22 H VAL 22 17.455 13.868 -34.210 254 HA VAL 22 HA VAL 22 19.538 14.950 -32.297 255 HB VAL 22 HB VAL 22 19.945 14.223 -35.273 256 HG11 VAL 22 HG11 VAL 22 21.327 16.015 -34.593 257 HG12 VAL 22 HG12 VAL 22 21.735 15.195 -33.040 258 HG13 VAL 22 HG13 VAL 22 22.450 14.675 -34.574 259 HG21 VAL 22 HG21 VAL 22 19.789 12.161 -33.951 260 HG22 VAL 22 HG22 VAL 22 21.516 12.529 -34.415 261 HG23 VAL 22 HG23 VAL 22 20.944 12.914 -32.758 262 H ALA 23 H ALA 23 19.597 17.124 -32.199 263 HA ALA 23 HA ALA 23 18.224 18.824 -34.271 264 HB1 ALA 23 HB1 ALA 23 18.962 19.387 -31.458 265 HB2 ALA 23 HB2 ALA 23 18.196 20.563 -32.539 266 HB3 ALA 23 HB3 ALA 23 17.323 19.116 -31.932 267 H GLY 24 H GLY 24 19.307 21.014 -34.415 268 HA2 GLY 24 HA2 GLY 24 22.159 20.746 -34.444 269 HA3 GLY 24 HA3 GLY 24 21.323 21.069 -35.966 270 H GLN 25 H GLN 25 23.133 22.918 -35.459 271 HA GLN 25 HA GLN 25 22.057 25.056 -33.904 272 HB2 GLN 25 HB2 GLN 25 24.688 25.015 -35.554 273 HB3 GLN 25 HB3 GLN 25 24.012 26.406 -34.751 274 HG2 GLN 25 HG2 GLN 25 23.977 24.948 -32.609 275 HG3 GLN 25 HG3 GLN 25 24.892 23.803 -33.529 276 HE21 GLN 25 HE22 GLN 25 25.897 24.762 -31.193 277 HE22 GLN 25 HE21 GLN 25 27.063 25.968 -31.340 278 H ASP 26 H ASP 26 22.190 24.248 -37.233 279 HA ASP 26 HA ASP 26 21.054 26.694 -38.518 280 HB2 ASP 26 HB2 ASP 26 20.824 25.350 -40.542 281 HB3 ASP 26 HB3 ASP 26 22.381 25.262 -39.680 282 H GLY 27 H GLY 27 19.780 24.369 -36.473 283 HA2 GLY 27 HA2 GLY 27 17.696 24.343 -35.473 284 HA3 GLY 27 HA3 GLY 27 17.045 25.335 -36.821 285 H SER 28 H SER 28 18.609 22.575 -38.144 286 HA SER 28 HA SER 28 16.063 21.270 -38.673 287 HB2 SER 28 HB2 SER 28 17.347 19.907 -40.208 288 HB3 SER 28 HB3 SER 28 17.720 21.616 -40.463 289 HG SER 28 HG SER 28 19.644 21.350 -39.349 290 H VAL 29 H VAL 29 15.431 19.171 -38.436 291 HA VAL 29 HA VAL 29 16.835 17.650 -36.375 292 HB VAL 29 HB VAL 29 13.986 18.560 -36.391 293 HG11 VAL 29 HG11 VAL 29 15.547 16.916 -34.306 294 HG12 VAL 29 HG12 VAL 29 13.879 17.374 -34.053 295 HG13 VAL 29 HG13 VAL 29 14.239 16.269 -35.407 296 HG21 VAL 29 HG21 VAL 29 14.342 19.518 -34.229 297 HG22 VAL 29 HG22 VAL 29 16.062 19.312 -34.228 298 HG23 VAL 29 HG23 VAL 29 15.329 20.374 -35.493 299 H VAL 30 H VAL 30 16.934 15.700 -36.519 300 HA VAL 30 HA VAL 30 15.109 14.158 -38.331 301 HB VAL 30 HB VAL 30 16.678 12.573 -38.779 302 HG11 VAL 30 HG11 VAL 30 16.257 14.310 -40.393 303 HG12 VAL 30 HG12 VAL 30 17.526 15.332 -39.896 304 HG13 VAL 30 HG13 VAL 30 17.917 13.691 -40.497 305 HG21 VAL 30 HG21 VAL 30 18.798 14.685 -38.071 306 HG22 VAL 30 HG22 VAL 30 18.387 13.302 -36.969 307 HG23 VAL 30 HG23 VAL 30 19.109 12.965 -38.485 308 H GLN 31 H GLN 31 14.488 12.140 -37.755 309 HA GLN 31 HA GLN 31 14.782 11.480 -34.883 310 HB2 GLN 31 HB2 GLN 31 12.527 12.150 -35.278 311 HB3 GLN 31 HB3 GLN 31 12.257 11.066 -36.604 312 HG2 GLN 31 HG2 GLN 31 12.251 9.117 -35.201 313 HG3 GLN 31 HG3 GLN 31 12.719 10.030 -33.873 314 HE21 GLN 31 HE22 GLN 31 10.317 8.498 -34.207 315 HE22 GLN 31 HE21 GLN 31 8.941 9.662 -34.105 316 H PHE 32 H PHE 32 15.074 9.377 -34.286 317 HA PHE 32 HA PHE 32 15.950 7.577 -36.380 318 HB2 PHE 32 HB2 PHE 32 17.277 8.239 -33.664 319 HB3 PHE 32 HB3 PHE 32 17.643 6.731 -34.561 320 HD1 PHE 32 HD1 PHE 32 18.151 10.319 -34.617 321 HD2 PHE 32 HD2 PHE 32 19.162 6.504 -36.213 322 HE1 PHE 32 HE1 PHE 32 19.803 11.437 -36.160 323 HE2 PHE 32 HE2 PHE 32 20.893 7.600 -37.646 324 HZ PHE 32 HZ PHE 32 21.167 10.132 -37.537 325 H LYS 33 H LYS 33 14.904 5.490 -36.128 326 HA LYS 33 HA LYS 33 13.854 4.811 -33.401 327 HB2 LYS 33 HB2 LYS 33 12.091 4.720 -35.086 328 HB3 LYS 33 HB3 LYS 33 13.131 3.890 -36.194 329 HG2 LYS 33 HG2 LYS 33 13.049 1.996 -34.390 330 HG3 LYS 33 HG3 LYS 33 11.896 2.987 -33.488 331 HD2 LYS 33 HD2 LYS 33 10.603 3.013 -35.564 332 HD3 LYS 33 HD3 LYS 33 11.677 1.736 -36.290 333 HE2 LYS 33 HE2 LYS 33 10.998 0.155 -34.595 334 HE3 LYS 33 HE3 LYS 33 10.030 1.299 -33.680 335 HZ1 LYS 33 HZ1 LYS 33 8.813 -0.231 -35.353 336 HZ2 LYS 33 HZ2 LYS 33 8.393 1.294 -35.428 337 HZ3 LYS 33 HZ3 LYS 33 9.486 0.617 -36.511 338 H ILE 34 H ILE 34 15.091 3.587 -32.169 339 HA ILE 34 HA ILE 34 16.892 1.607 -33.445 340 HB ILE 34 HB ILE 34 18.674 2.254 -32.128 341 HG12 ILE 34 HG12 ILE 34 17.247 4.790 -31.133 342 HG13 ILE 34 HG13 ILE 34 17.295 3.272 -30.273 343 HG21 ILE 34 HG21 ILE 34 18.371 3.231 -34.398 344 HG22 ILE 34 HG22 ILE 34 17.716 4.630 -33.720 345 HG23 ILE 34 HG23 ILE 34 19.323 4.412 -33.315 346 HD11 ILE 34 HD11 ILE 34 19.238 5.172 -29.802 347 HD12 ILE 34 HD12 ILE 34 19.805 3.467 -30.090 348 HD13 ILE 34 HD13 ILE 34 19.887 4.774 -31.298 349 H LYS 35 H LYS 35 17.895 0.392 -31.587 350 HA LYS 35 HA LYS 35 15.800 -0.418 -29.508 351 HB2 LYS 35 HB2 LYS 35 18.036 -2.216 -30.451 352 HB3 LYS 35 HB3 LYS 35 16.748 -2.427 -29.216 353 HG2 LYS 35 HG2 LYS 35 15.045 -2.310 -30.642 354 HG3 LYS 35 HG3 LYS 35 16.029 -2.014 -32.077 355 HD2 LYS 35 HD2 LYS 35 17.281 -4.023 -31.914 356 HD3 LYS 35 HD3 LYS 35 16.699 -4.347 -30.242 357 HE2 LYS 35 HE2 LYS 35 14.643 -5.104 -30.860 358 HE3 LYS 35 HE3 LYS 35 14.762 -4.450 -32.479 359 HZ1 LYS 35 HZ1 LYS 35 16.202 -6.021 -33.154 360 HZ2 LYS 35 HZ2 LYS 35 16.459 -6.579 -31.584 361 HZ3 LYS 35 HZ3 LYS 35 15.035 -6.806 -32.372 362 H ARG 36 H ARG 36 16.156 -0.431 -27.380 363 HA ARG 36 HA ARG 36 17.768 1.573 -26.428 364 HB2 ARG 36 HB2 ARG 36 16.473 -0.860 -25.158 365 HB3 ARG 36 HB3 ARG 36 17.510 0.139 -24.153 366 HG2 ARG 36 HG2 ARG 36 16.064 2.141 -24.824 367 HG3 ARG 36 HG3 ARG 36 14.999 0.902 -25.647 368 HD2 ARG 36 HD2 ARG 36 13.997 1.336 -23.702 369 HD3 ARG 36 HD3 ARG 36 14.732 -0.197 -23.426 370 HE ARG 36 HE ARG 36 16.280 0.835 -21.857 371 HH11 ARG 36 HH11 ARG 36 13.798 3.219 -23.070 372 HH12 ARG 36 HH12 ARG 36 14.697 4.512 -22.402 373 HH21 ARG 36 HH21 ARG 36 16.952 2.565 -20.574 374 HH22 ARG 36 HH22 ARG 36 16.247 4.166 -20.842 375 H HIS 37 H HIS 37 18.976 -1.505 -27.185 376 HA HIS 37 HA HIS 37 21.435 -1.108 -25.595 377 HB2 HIS 37 HB2 HIS 37 21.803 -3.556 -26.317 378 HB3 HIS 37 HB3 HIS 37 20.690 -3.212 -24.952 379 HD2 HIS 37 HD2 HIS 37 18.023 -3.670 -25.608 380 HE1 HIS 37 HE1 HIS 37 18.809 -5.744 -29.261 381 HE2 HIS 37 HE2 HIS 37 17.006 -5.326 -27.522 382 H THR 38 H THR 38 20.352 -0.391 -28.380 383 HA THR 38 HA THR 38 22.342 -1.327 -30.270 384 HB THR 38 HB THR 38 20.695 1.311 -30.503 385 HG1 THR 38 HG1 THR 38 20.274 -1.467 -30.990 386 HG21 THR 38 HG21 THR 38 22.382 1.619 -32.069 387 HG22 THR 38 HG22 THR 38 22.317 -0.001 -32.690 388 HG23 THR 38 HG23 THR 38 21.015 1.050 -32.957 389 HA PRO 39 HA PRO 39 25.627 1.438 -28.904 390 HB2 PRO 39 HB2 PRO 39 26.765 1.359 -31.533 391 HB3 PRO 39 HB3 PRO 39 27.387 0.830 -29.923 392 HG2 PRO 39 HG2 PRO 39 26.606 -0.999 -31.807 393 HG3 PRO 39 HG3 PRO 39 26.570 -1.266 -30.031 394 HD2 PRO 39 HD2 PRO 39 24.262 -0.751 -31.763 395 HD3 PRO 39 HD3 PRO 39 24.278 -1.597 -30.256 396 H LEU 40 H LEU 40 25.195 3.771 -28.824 397 HA LEU 40 HA LEU 40 24.016 5.477 -30.705 398 HB2 LEU 40 HB2 LEU 40 25.887 6.064 -28.270 399 HB3 LEU 40 HB3 LEU 40 25.177 7.163 -29.378 400 HG LEU 40 HG LEU 40 23.722 5.140 -27.589 401 HD11 LEU 40 HD11 LEU 40 22.914 6.916 -26.240 402 HD12 LEU 40 HD12 LEU 40 24.657 7.209 -26.447 403 HD13 LEU 40 HD13 LEU 40 23.460 8.092 -27.438 404 HD21 LEU 40 HD21 LEU 40 22.440 7.310 -29.487 405 HD22 LEU 40 HD22 LEU 40 22.332 5.598 -29.581 406 HD23 LEU 40 HD23 LEU 40 21.620 6.392 -28.186 407 H SER 41 H SER 41 27.223 4.135 -30.563 408 HA SER 41 HA SER 41 28.657 6.064 -32.226 409 HB2 SER 41 HB2 SER 41 30.160 4.037 -32.644 410 HB3 SER 41 HB3 SER 41 29.727 4.265 -30.944 411 HG SER 41 HG SER 41 29.370 2.163 -31.469 412 H LYS 42 H LYS 42 26.309 3.562 -33.135 413 HA LYS 42 HA LYS 42 26.720 4.014 -35.988 414 HB2 LYS 42 HB2 LYS 42 24.289 2.840 -34.601 415 HB3 LYS 42 HB3 LYS 42 24.581 2.740 -36.327 416 HG2 LYS 42 HG2 LYS 42 26.520 1.387 -36.052 417 HG3 LYS 42 HG3 LYS 42 26.421 1.494 -34.256 418 HD2 LYS 42 HD2 LYS 42 24.194 0.314 -34.379 419 HD3 LYS 42 HD3 LYS 42 24.323 0.306 -36.163 420 HE2 LYS 42 HE2 LYS 42 26.375 -1.114 -34.483 421 HE3 LYS 42 HE3 LYS 42 24.705 -1.777 -34.846 422 HZ1 LYS 42 HZ1 LYS 42 25.408 -2.407 -36.780 423 HZ2 LYS 42 HZ2 LYS 42 25.932 -0.822 -37.157 424 HZ3 LYS 42 HZ3 LYS 42 26.873 -1.888 -36.441 425 H LEU 43 H LEU 43 24.335 5.093 -33.755 426 HA LEU 43 HA LEU 43 23.001 6.946 -35.679 427 HB2 LEU 43 HB2 LEU 43 21.923 6.516 -33.581 428 HB3 LEU 43 HB3 LEU 43 23.294 7.017 -32.632 429 HG LEU 43 HG LEU 43 21.581 9.170 -34.223 430 HD11 LEU 43 HD11 LEU 43 20.208 9.353 -32.319 431 HD12 LEU 43 HD12 LEU 43 19.934 7.868 -33.035 432 HD13 LEU 43 HD13 LEU 43 21.045 7.886 -31.643 433 HD21 LEU 43 HD21 LEU 43 22.210 10.635 -32.640 434 HD22 LEU 43 HD22 LEU 43 22.958 9.362 -31.638 435 HD23 LEU 43 HD23 LEU 43 23.714 9.975 -33.236 436 H MET 44 H MET 44 25.712 7.630 -33.383 437 HA MET 44 HA MET 44 25.924 10.281 -34.429 438 HB2 MET 44 HB2 MET 44 28.068 8.383 -33.139 439 HB3 MET 44 HB3 MET 44 28.454 9.970 -33.563 440 HG2 MET 44 HG2 MET 44 26.593 10.831 -31.930 441 HG3 MET 44 HG3 MET 44 26.380 9.223 -31.404 442 HE1 MET 44 HE1 MET 44 27.789 8.089 -29.552 443 HE2 MET 44 HE2 MET 44 28.921 7.674 -30.684 444 HE3 MET 44 HE3 MET 44 29.443 8.492 -29.229 445 H LYS 45 H LYS 45 27.646 7.515 -35.593 446 HA LYS 45 HA LYS 45 28.958 8.853 -37.770 447 HB2 LYS 45 HB2 LYS 45 28.210 5.820 -37.659 448 HB3 LYS 45 HB3 LYS 45 29.126 6.519 -38.944 449 HG2 LYS 45 HG2 LYS 45 30.770 7.469 -37.535 450 HG3 LYS 45 HG3 LYS 45 30.069 6.794 -36.146 451 HD2 LYS 45 HD2 LYS 45 31.045 5.117 -38.534 452 HD3 LYS 45 HD3 LYS 45 32.047 5.379 -37.084 453 HE2 LYS 45 HE2 LYS 45 30.121 4.642 -35.756 454 HE3 LYS 45 HE3 LYS 45 29.424 3.820 -37.148 455 HZ1 LYS 45 HZ1 LYS 45 31.853 2.710 -37.294 456 HZ2 LYS 45 HZ2 LYS 45 32.087 3.568 -35.919 457 HZ3 LYS 45 HZ3 LYS 45 31.039 2.410 -35.787 458 H ALA 46 H ALA 46 25.803 7.363 -37.772 459 HA ALA 46 HA ALA 46 25.101 7.546 -40.586 460 HB1 ALA 46 HB1 ALA 46 23.126 7.940 -38.244 461 HB2 ALA 46 HB2 ALA 46 22.883 7.306 -39.846 462 HB3 ALA 46 HB3 ALA 46 23.734 6.265 -38.830 463 H TYR 47 H TYR 47 24.441 9.917 -38.016 464 HA TYR 47 HA TYR 47 23.404 12.031 -39.564 465 HB2 TYR 47 HB2 TYR 47 23.190 11.807 -37.108 466 HB3 TYR 47 HB3 TYR 47 24.918 11.946 -36.895 467 HD1 TYR 47 HD2 TYR 47 26.000 14.349 -37.338 468 HD2 TYR 47 HD1 TYR 47 21.771 13.425 -37.651 469 HE1 TYR 47 HE2 TYR 47 25.442 16.793 -37.310 470 HE2 TYR 47 HE1 TYR 47 21.270 15.926 -37.379 471 HH TYR 47 HH TYR 47 22.113 17.858 -37.337 472 H CYS 48 H CYS 48 26.780 11.145 -38.651 473 HA CYS 48 HA CYS 48 28.182 13.601 -39.459 474 HB2 CYS 48 HB2 CYS 48 28.759 11.553 -37.830 475 HB3 CYS 48 HB3 CYS 48 29.302 10.714 -39.224 476 HG CYS 48 HG CYS 48 31.301 12.296 -39.868 477 H GLU 49 H GLU 49 27.413 10.499 -41.080 478 HA GLU 49 HA GLU 49 28.906 11.039 -43.356 479 HB2 GLU 49 HB2 GLU 49 26.697 9.006 -42.890 480 HB3 GLU 49 HB3 GLU 49 27.549 9.212 -44.467 481 HG2 GLU 49 HG2 GLU 49 28.950 8.579 -41.812 482 HG3 GLU 49 HG3 GLU 49 28.231 7.385 -42.815 483 H ARG 50 H ARG 50 25.481 11.542 -42.586 484 HA ARG 50 HA ARG 50 24.466 12.604 -44.979 485 HB2 ARG 50 HB2 ARG 50 23.720 12.761 -42.039 486 HB3 ARG 50 HB3 ARG 50 22.878 13.751 -43.124 487 HG2 ARG 50 HG2 ARG 50 22.116 11.782 -44.465 488 HG3 ARG 50 HG3 ARG 50 23.313 10.775 -43.821 489 HD2 ARG 50 HD2 ARG 50 22.255 10.620 -41.662 490 HD3 ARG 50 HD3 ARG 50 21.052 11.800 -42.079 491 HE ARG 50 HE ARG 50 21.083 9.020 -43.157 492 HH11 ARG 50 HH11 ARG 50 19.113 12.139 -43.009 493 HH12 ARG 50 HH12 ARG 50 17.860 11.297 -43.821 494 HH21 ARG 50 HH21 ARG 50 19.357 8.389 -44.240 495 HH22 ARG 50 HH22 ARG 50 18.168 9.587 -44.686 496 H GLN 51 H GLN 51 26.008 14.170 -42.221 497 HA GLN 51 HA GLN 51 26.149 16.912 -43.284 498 HB2 GLN 51 HB2 GLN 51 27.641 15.384 -41.285 499 HB3 GLN 51 HB3 GLN 51 27.966 17.086 -41.469 500 HG2 GLN 51 HG2 GLN 51 25.502 15.956 -40.268 501 HG3 GLN 51 HG3 GLN 51 26.862 16.891 -39.623 502 HE21 GLN 51 HE22 GLN 51 23.734 17.793 -39.587 503 HE22 GLN 51 HE21 GLN 51 23.926 19.228 -40.540 504 H GLY 52 H GLY 52 27.999 13.964 -44.190 505 HA2 GLY 52 HA2 GLY 52 29.873 13.711 -45.566 506 HA3 GLY 52 HA3 GLY 52 29.674 15.293 -46.094 507 H LEU 53 H LEU 53 30.438 14.089 -42.678 508 HA LEU 53 HA LEU 53 33.020 15.389 -42.759 509 HB2 LEU 53 HB2 LEU 53 31.368 15.461 -40.192 510 HB3 LEU 53 HB3 LEU 53 32.840 16.214 -40.656 511 HG LEU 53 HG LEU 53 30.261 16.743 -42.054 512 HD11 LEU 53 HD11 LEU 53 31.529 17.950 -39.362 513 HD12 LEU 53 HD12 LEU 53 30.383 18.868 -40.303 514 HD13 LEU 53 HD13 LEU 53 29.949 17.281 -39.607 515 HD21 LEU 53 HD21 LEU 53 32.802 18.291 -41.818 516 HD22 LEU 53 HD22 LEU 53 32.165 17.483 -43.260 517 HD23 LEU 53 HD23 LEU 53 31.319 18.908 -42.627 518 H SER 54 H SER 54 34.571 14.839 -41.105 519 HA SER 54 HA SER 54 34.611 11.980 -40.336 520 HB2 SER 54 HB2 SER 54 36.720 13.052 -41.072 521 HB3 SER 54 HB3 SER 54 36.616 14.129 -39.628 522 HG SER 54 HG SER 54 36.607 11.324 -39.610 523 H MET 55 H MET 55 34.063 11.226 -38.189 524 HA MET 55 HA MET 55 32.513 12.817 -36.475 525 HB2 MET 55 HB2 MET 55 32.433 10.502 -36.490 526 HB3 MET 55 HB3 MET 55 34.036 10.239 -35.889 527 HG2 MET 55 HG2 MET 55 33.436 10.891 -33.564 528 HG3 MET 55 HG3 MET 55 32.129 11.902 -34.215 529 HE1 MET 55 HE1 MET 55 32.056 7.211 -33.952 530 HE2 MET 55 HE2 MET 55 32.781 8.008 -35.275 531 HE3 MET 55 HE3 MET 55 33.406 8.313 -33.535 532 H ARG 56 H ARG 56 35.995 12.337 -36.571 533 HA ARG 56 HA ARG 56 36.948 13.627 -34.323 534 HB2 ARG 56 HB2 ARG 56 38.066 12.440 -36.225 535 HB3 ARG 56 HB3 ARG 56 37.759 13.841 -37.248 536 HG2 ARG 56 HG2 ARG 56 39.960 13.990 -36.557 537 HG3 ARG 56 HG3 ARG 56 38.922 15.313 -35.949 538 HD2 ARG 56 HD2 ARG 56 38.949 14.386 -33.716 539 HD3 ARG 56 HD3 ARG 56 39.825 13.009 -34.289 540 HE ARG 56 HE ARG 56 41.107 15.688 -34.633 541 HH11 ARG 56 HH11 ARG 56 40.740 12.998 -32.596 542 HH12 ARG 56 HH12 ARG 56 42.299 13.066 -31.840 543 HH21 ARG 56 HH21 ARG 56 43.248 15.946 -33.784 544 HH22 ARG 56 HH22 ARG 56 43.505 15.026 -32.389 545 H GLN 57 H GLN 57 35.382 15.409 -37.063 546 HA GLN 57 HA GLN 57 36.296 17.953 -36.075 547 HB2 GLN 57 HB2 GLN 57 35.812 17.518 -38.281 548 HB3 GLN 57 HB3 GLN 57 34.152 17.068 -37.981 549 HG2 GLN 57 HG2 GLN 57 33.531 19.303 -37.409 550 HG3 GLN 57 HG3 GLN 57 35.250 19.871 -37.394 551 HE21 GLN 57 HE22 GLN 57 33.027 20.849 -39.029 552 HE22 GLN 57 HE21 GLN 57 33.603 20.919 -40.707 553 H ILE 58 H ILE 58 33.249 16.148 -35.730 554 HA ILE 58 HA ILE 58 32.046 18.362 -34.084 555 HB ILE 58 HB ILE 58 29.889 17.337 -34.523 556 HG12 ILE 58 HG12 ILE 58 31.513 15.209 -36.038 557 HG13 ILE 58 HG13 ILE 58 30.544 15.032 -34.656 558 HG21 ILE 58 HG21 ILE 58 29.715 17.952 -37.003 559 HG22 ILE 58 HG22 ILE 58 30.851 19.044 -36.129 560 HG23 ILE 58 HG23 ILE 58 31.472 17.746 -37.021 561 HD11 ILE 58 HD11 ILE 58 28.617 15.513 -35.755 562 HD12 ILE 58 HD12 ILE 58 29.515 15.923 -37.324 563 HD13 ILE 58 HD13 ILE 58 29.550 14.260 -36.754 564 H ARG 59 H ARG 59 30.511 17.795 -32.424 565 HA ARG 59 HA ARG 59 31.345 15.441 -30.777 566 HB2 ARG 59 HB2 ARG 59 30.785 18.377 -29.901 567 HB3 ARG 59 HB3 ARG 59 31.194 17.074 -28.781 568 HG2 ARG 59 HG2 ARG 59 33.072 18.214 -30.798 569 HG3 ARG 59 HG3 ARG 59 33.124 18.565 -29.048 570 HD2 ARG 59 HD2 ARG 59 33.499 16.017 -28.604 571 HD3 ARG 59 HD3 ARG 59 33.471 15.715 -30.321 572 HE ARG 59 HE ARG 59 35.503 16.771 -28.609 573 HH11 ARG 59 HH11 ARG 59 34.442 16.822 -31.818 574 HH12 ARG 59 HH12 ARG 59 35.994 16.748 -32.608 575 HH21 ARG 59 HH21 ARG 59 37.514 16.784 -29.523 576 HH22 ARG 59 HH22 ARG 59 37.747 17.027 -31.255 577 H PHE 60 H PHE 60 29.484 14.432 -29.804 578 HA PHE 60 HA PHE 60 26.728 15.533 -30.157 579 HB2 PHE 60 HB2 PHE 60 27.476 12.650 -29.907 580 HB3 PHE 60 HB3 PHE 60 25.934 13.396 -30.167 581 HD1 PHE 60 HD1 PHE 60 29.158 12.978 -31.852 582 HD2 PHE 60 HD2 PHE 60 24.951 13.662 -32.344 583 HE1 PHE 60 HE1 PHE 60 29.386 12.514 -34.270 584 HE2 PHE 60 HE2 PHE 60 25.173 13.504 -34.717 585 HZ PHE 60 HZ PHE 60 27.265 12.757 -35.744 586 H ARG 61 H ARG 61 25.289 15.288 -28.344 587 HA ARG 61 HA ARG 61 26.705 15.660 -25.716 588 HB2 ARG 61 HB2 ARG 61 25.302 17.821 -27.086 589 HB3 ARG 61 HB3 ARG 61 25.723 17.774 -25.402 590 HG2 ARG 61 HG2 ARG 61 28.134 17.071 -26.069 591 HG3 ARG 61 HG3 ARG 61 27.583 17.678 -27.738 592 HD2 ARG 61 HD2 ARG 61 26.824 19.683 -26.565 593 HD3 ARG 61 HD3 ARG 61 27.651 19.078 -25.133 594 HE ARG 61 HE ARG 61 29.637 19.156 -27.261 595 HH11 ARG 61 HH11 ARG 61 27.788 21.559 -25.502 596 HH12 ARG 61 HH12 ARG 61 29.007 22.733 -25.654 597 HH21 ARG 61 HH21 ARG 61 31.050 20.543 -27.438 598 HH22 ARG 61 HH22 ARG 61 31.062 22.004 -26.460 599 H PHE 62 H PHE 62 25.210 15.439 -24.072 600 HA PHE 62 HA PHE 62 22.332 15.557 -24.503 601 HB2 PHE 62 HB2 PHE 62 22.976 13.061 -24.975 602 HB3 PHE 62 HB3 PHE 62 23.837 13.072 -23.509 603 HD1 PHE 62 HD2 PHE 62 20.390 14.419 -24.269 604 HD2 PHE 62 HD1 PHE 62 22.672 11.425 -22.243 605 HE1 PHE 62 HE2 PHE 62 18.405 13.684 -23.063 606 HE2 PHE 62 HE1 PHE 62 20.561 10.678 -21.026 607 HZ PHE 62 HZ PHE 62 18.377 11.791 -21.517 608 H ASP 63 H ASP 63 21.280 16.382 -22.660 609 HA ASP 63 HA ASP 63 21.387 18.064 -21.341 610 HB2 ASP 63 HB2 ASP 63 20.686 16.253 -19.993 611 HB3 ASP 63 HB3 ASP 63 22.367 16.052 -19.366 612 H GLY 64 H GLY 64 23.449 18.709 -22.744 613 HA2 GLY 64 HA2 GLY 64 25.200 20.148 -22.845 614 HA3 GLY 64 HA3 GLY 64 25.197 20.250 -21.091 615 H GLN 65 H GLN 65 25.521 17.031 -21.232 616 HA GLN 65 HA GLN 65 28.466 17.265 -21.249 617 HB2 GLN 65 HB2 GLN 65 26.621 15.002 -20.337 618 HB3 GLN 65 HB3 GLN 65 28.363 14.893 -20.377 619 HG2 GLN 65 HG2 GLN 65 26.614 16.874 -18.954 620 HG3 GLN 65 HG3 GLN 65 27.209 15.421 -18.133 621 HE21 GLN 65 HE22 GLN 65 30.063 15.668 -18.163 622 HE22 GLN 65 HE21 GLN 65 30.473 17.357 -17.985 623 HA PRO 66 HA PRO 66 28.882 15.344 -25.143 624 HB2 PRO 66 HB2 PRO 66 31.503 14.472 -25.060 625 HB3 PRO 66 HB3 PRO 66 31.016 16.249 -25.095 626 HG2 PRO 66 HG2 PRO 66 32.034 14.616 -22.718 627 HG3 PRO 66 HG3 PRO 66 32.267 16.279 -23.001 628 HD2 PRO 66 HD2 PRO 66 30.242 15.104 -21.481 629 HD3 PRO 66 HD3 PRO 66 30.513 16.844 -21.948 630 H ILE 67 H ILE 67 28.877 13.414 -26.267 631 HA ILE 67 HA ILE 67 28.306 10.912 -24.684 632 HB ILE 67 HB ILE 67 27.882 11.501 -27.549 633 HG12 ILE 67 HG12 ILE 67 25.857 11.755 -25.227 634 HG13 ILE 67 HG13 ILE 67 26.321 12.969 -26.497 635 HG21 ILE 67 HG21 ILE 67 28.116 9.180 -27.339 636 HG22 ILE 67 HG22 ILE 67 27.037 9.159 -25.857 637 HG23 ILE 67 HG23 ILE 67 26.379 9.255 -27.480 638 HD11 ILE 67 HD11 ILE 67 25.080 11.738 -28.180 639 HD12 ILE 67 HD12 ILE 67 24.527 10.580 -26.967 640 HD13 ILE 67 HD13 ILE 67 24.123 12.284 -26.820 641 H ASN 68 H ASN 68 29.665 9.289 -24.585 642 HA ASN 68 HA ASN 68 31.791 9.147 -26.597 643 HB2 ASN 68 HB2 ASN 68 31.654 7.651 -23.841 644 HB3 ASN 68 HB3 ASN 68 32.950 7.653 -25.052 645 HD21 ASN 68 HD22 ASN 68 31.438 9.223 -22.369 646 HD22 ASN 68 HD21 ASN 68 32.412 10.712 -22.378 647 H GLU 69 H GLU 69 32.358 7.332 -27.679 648 HA GLU 69 HA GLU 69 30.083 5.853 -28.670 649 HB2 GLU 69 HB2 GLU 69 33.031 5.550 -28.945 650 HB3 GLU 69 HB3 GLU 69 31.828 4.538 -29.905 651 HG2 GLU 69 HG2 GLU 69 31.474 6.546 -31.251 652 HG3 GLU 69 HG3 GLU 69 32.214 7.556 -29.943 653 H THR 70 H THR 70 31.931 5.016 -25.870 654 HA THR 70 HA THR 70 31.282 2.122 -25.709 655 HB THR 70 HB THR 70 31.532 2.771 -23.084 656 HG1 THR 70 HG1 THR 70 30.914 4.851 -23.421 657 HG21 THR 70 HG21 THR 70 33.671 2.184 -24.857 658 HG22 THR 70 HG22 THR 70 33.869 3.836 -24.535 659 HG23 THR 70 HG23 THR 70 33.862 2.743 -23.149 660 H ASP 71 H ASP 71 29.098 4.769 -25.637 661 HA ASP 71 HA ASP 71 27.407 3.348 -23.649 662 HB2 ASP 71 HB2 ASP 71 27.054 6.138 -24.641 663 HB3 ASP 71 HB3 ASP 71 26.295 5.237 -23.394 664 H THR 72 H THR 72 25.147 3.346 -23.731 665 HA THR 72 HA THR 72 23.950 3.419 -26.338 666 HB THR 72 HB THR 72 22.562 1.404 -25.620 667 HG1 THR 72 HG1 THR 72 22.891 0.397 -23.621 668 HG21 THR 72 HG21 THR 72 24.080 -0.552 -25.787 669 HG22 THR 72 HG22 THR 72 24.868 0.739 -26.614 670 HG23 THR 72 HG23 THR 72 25.326 0.296 -24.888 671 HA PRO 73 HA PRO 73 20.577 5.509 -24.490 672 HB2 PRO 73 HB2 PRO 73 18.694 3.314 -25.310 673 HB3 PRO 73 HB3 PRO 73 18.594 5.174 -25.300 674 HG2 PRO 73 HG2 PRO 73 19.447 3.884 -27.691 675 HG3 PRO 73 HG3 PRO 73 20.129 5.382 -26.966 676 HD2 PRO 73 HD2 PRO 73 21.134 2.573 -26.773 677 HD3 PRO 73 HD3 PRO 73 21.959 4.002 -27.275 678 H ALA 74 H ALA 74 20.581 2.028 -23.635 679 HA ALA 74 HA ALA 74 19.284 2.508 -21.064 680 HB1 ALA 74 HB1 ALA 74 19.921 0.254 -20.372 681 HB2 ALA 74 HB2 ALA 74 19.260 0.318 -22.078 682 HB3 ALA 74 HB3 ALA 74 20.990 0.142 -21.639 683 H GLN 75 H GLN 75 22.707 2.731 -22.036 684 HA GLN 75 HA GLN 75 23.748 2.884 -19.280 685 HB2 GLN 75 HB2 GLN 75 25.281 2.394 -21.357 686 HB3 GLN 75 HB3 GLN 75 25.097 4.046 -21.703 687 HG2 GLN 75 HG2 GLN 75 27.168 4.013 -20.596 688 HG3 GLN 75 HG3 GLN 75 26.025 4.668 -19.427 689 HE21 GLN 75 HE22 GLN 75 28.613 2.534 -19.611 690 HE22 GLN 75 HE21 GLN 75 28.089 1.413 -18.405 691 H LEU 76 H LEU 76 22.321 5.363 -21.505 692 HA LEU 76 HA LEU 76 23.008 7.477 -19.524 693 HB2 LEU 76 HB2 LEU 76 22.414 7.300 -22.488 694 HB3 LEU 76 HB3 LEU 76 22.263 8.808 -21.738 695 HG LEU 76 HG LEU 76 24.931 7.056 -22.039 696 HD11 LEU 76 HD11 LEU 76 24.430 7.742 -24.086 697 HD12 LEU 76 HD12 LEU 76 23.789 9.373 -23.510 698 HD13 LEU 76 HD13 LEU 76 25.541 8.943 -23.502 699 HD21 LEU 76 HD21 LEU 76 26.158 9.202 -21.366 700 HD22 LEU 76 HD22 LEU 76 24.628 9.894 -20.785 701 HD23 LEU 76 HD23 LEU 76 25.476 8.570 -20.052 702 H GLU 77 H GLU 77 20.646 5.256 -19.712 703 HA GLU 77 HA GLU 77 18.388 5.228 -19.356 704 HB2 GLU 77 HB2 GLU 77 19.012 7.558 -17.517 705 HB3 GLU 77 HB3 GLU 77 17.625 6.429 -17.548 706 HG2 GLU 77 HG2 GLU 77 20.587 5.587 -17.278 707 HG3 GLU 77 HG3 GLU 77 19.823 6.258 -15.860 708 H MET 78 H MET 78 18.386 6.280 -21.800 709 HA MET 78 HA MET 78 17.143 8.903 -22.164 710 HB2 MET 78 HB2 MET 78 17.881 6.688 -24.025 711 HB3 MET 78 HB3 MET 78 17.146 8.291 -24.462 712 HG2 MET 78 HG2 MET 78 19.179 9.328 -23.317 713 HG3 MET 78 HG3 MET 78 19.715 7.581 -23.260 714 HE1 MET 78 HE1 MET 78 18.678 10.523 -25.387 715 HE2 MET 78 HE2 MET 78 20.249 10.963 -24.722 716 HE3 MET 78 HE3 MET 78 20.105 10.710 -26.516 717 H GLU 79 H GLU 79 14.942 9.139 -23.181 718 HA GLU 79 HA GLU 79 12.792 6.970 -22.616 719 HB2 GLU 79 HB2 GLU 79 12.876 9.909 -22.006 720 HB3 GLU 79 HB3 GLU 79 11.346 9.065 -22.185 721 HG2 GLU 79 HG2 GLU 79 13.789 8.108 -20.462 722 HG3 GLU 79 HG3 GLU 79 12.610 9.111 -19.707 723 H ASP 80 H ASP 80 10.610 8.223 -23.900 724 HA ASP 80 HA ASP 80 11.318 7.662 -26.718 725 HB2 ASP 80 HB2 ASP 80 8.587 8.291 -25.577 726 HB3 ASP 80 HB3 ASP 80 8.847 7.572 -27.068 727 H GLU 81 H GLU 81 12.115 9.077 -27.938 728 HA GLU 81 HA GLU 81 12.523 10.731 -29.351 729 HB2 GLU 81 HB2 GLU 81 9.951 12.211 -28.753 730 HB3 GLU 81 HB3 GLU 81 11.135 12.598 -29.952 731 HG2 GLU 81 HG2 GLU 81 10.415 10.547 -31.342 732 HG3 GLU 81 HG3 GLU 81 9.834 9.806 -29.948 733 H ASP 82 H ASP 82 13.861 10.710 -27.175 734 HA ASP 82 HA ASP 82 14.145 13.413 -26.011 735 HB2 ASP 82 HB2 ASP 82 15.746 10.930 -25.548 736 HB3 ASP 82 HB3 ASP 82 16.146 12.566 -24.946 737 H THR 83 H THR 83 15.650 14.942 -26.690 738 HA THR 83 HA THR 83 16.631 14.483 -29.384 739 HB THR 83 HB THR 83 16.119 17.144 -27.971 740 HG1 THR 83 HG1 THR 83 14.319 15.893 -28.456 741 HG21 THR 83 HG21 THR 83 17.811 17.457 -29.649 742 HG22 THR 83 HG22 THR 83 17.023 16.461 -30.744 743 HG23 THR 83 HG23 THR 83 16.272 18.050 -30.349 744 H ILE 84 H ILE 84 18.718 14.423 -29.777 745 HA ILE 84 HA ILE 84 20.852 15.216 -27.853 746 HB ILE 84 HB ILE 84 21.054 13.488 -30.327 747 HG12 ILE 84 HG12 ILE 84 21.738 12.597 -27.575 748 HG13 ILE 84 HG13 ILE 84 20.028 12.450 -28.147 749 HG21 ILE 84 HG21 ILE 84 23.068 14.332 -28.470 750 HG22 ILE 84 HG22 ILE 84 23.347 12.981 -29.723 751 HG23 ILE 84 HG23 ILE 84 23.057 14.677 -30.241 752 HD11 ILE 84 HD11 ILE 84 21.158 10.301 -28.692 753 HD12 ILE 84 HD12 ILE 84 20.757 11.313 -30.173 754 HD13 ILE 84 HD13 ILE 84 22.413 11.126 -29.416 755 H ASP 85 H ASP 85 22.626 16.681 -28.308 756 HA ASP 85 HA ASP 85 22.171 18.217 -30.887 757 HB2 ASP 85 HB2 ASP 85 23.581 18.829 -28.341 758 HB3 ASP 85 HB3 ASP 85 23.453 19.956 -29.717 759 H VAL 86 H VAL 86 23.522 18.780 -32.115 760 HA VAL 86 HA VAL 86 26.278 17.549 -31.850 761 HB VAL 86 HB VAL 86 25.327 18.704 -34.427 762 HG11 VAL 86 HG11 VAL 86 27.629 18.157 -34.256 763 HG12 VAL 86 HG12 VAL 86 27.251 16.373 -33.843 764 HG13 VAL 86 HG13 VAL 86 26.900 17.067 -35.431 765 HG21 VAL 86 HG21 VAL 86 24.297 16.129 -33.158 766 HG22 VAL 86 HG22 VAL 86 23.508 17.305 -34.149 767 HG23 VAL 86 HG23 VAL 86 24.534 16.094 -34.927 768 H PHE 87 H PHE 87 28.005 18.732 -31.498 769 HA PHE 87 HA PHE 87 28.007 21.680 -32.177 770 HB2 PHE 87 HB2 PHE 87 29.408 20.183 -30.026 771 HB3 PHE 87 HB3 PHE 87 29.863 21.801 -30.639 772 HD1 PHE 87 HD1 PHE 87 26.873 19.897 -29.243 773 HD2 PHE 87 HD2 PHE 87 28.697 23.608 -29.996 774 HE1 PHE 87 HE1 PHE 87 24.912 21.052 -28.133 775 HE2 PHE 87 HE2 PHE 87 26.801 24.885 -29.042 776 HZ PHE 87 HZ PHE 87 24.927 23.578 -28.031 777 H GLN 88 H GLN 88 29.463 22.487 -33.505 778 HA GLN 88 HA GLN 88 31.588 20.848 -34.811 779 HB2 GLN 88 HB2 GLN 88 30.750 23.746 -34.807 780 HB3 GLN 88 HB3 GLN 88 32.038 23.217 -35.873 781 HG2 GLN 88 HG2 GLN 88 29.161 22.192 -36.026 782 HG3 GLN 88 HG3 GLN 88 29.879 23.449 -37.060 783 HE21 GLN 88 HE22 GLN 88 28.808 21.166 -38.305 784 HE22 GLN 88 HE21 GLN 88 30.146 20.231 -38.936 785 H GLN 89 H GLN 89 33.701 20.592 -34.095 786 HA GLN 89 HA GLN 89 34.611 22.069 -31.769 787 HB2 GLN 89 HB2 GLN 89 35.258 19.766 -32.516 788 HB3 GLN 89 HB3 GLN 89 35.993 20.554 -33.938 789 HG2 GLN 89 HG2 GLN 89 37.738 19.994 -32.163 790 HG3 GLN 89 HG3 GLN 89 37.576 21.689 -32.550 791 HE21 GLN 89 HE22 GLN 89 38.365 22.449 -30.454 792 HE22 GLN 89 HE21 GLN 89 37.459 22.121 -28.991 793 H GLN 90 H GLN 90 36.082 23.429 -31.570 794 HA GLN 90 HA GLN 90 35.809 25.772 -33.324 795 HB2 GLN 90 HB2 GLN 90 37.430 25.092 -30.793 796 HB3 GLN 90 HB3 GLN 90 37.693 26.585 -31.663 797 HG2 GLN 90 HG2 GLN 90 36.367 27.211 -29.920 798 HG3 GLN 90 HG3 GLN 90 35.314 27.223 -31.405 799 HE21 GLN 90 HE22 GLN 90 33.553 27.273 -29.826 800 HE22 GLN 90 HE21 GLN 90 33.100 25.898 -28.788 801 H THR 91 H THR 91 37.413 26.969 -34.225 802 HA THR 91 HA THR 91 39.995 25.668 -35.006 803 HB THR 91 HB THR 91 39.750 27.029 -37.144 804 HG1 THR 91 HG1 THR 91 37.738 26.984 -37.896 805 HG21 THR 91 HG21 THR 91 38.764 25.048 -38.331 806 HG22 THR 91 HG22 THR 91 39.915 24.572 -37.020 807 HG23 THR 91 HG23 THR 91 38.266 24.388 -36.689 808 H GLY 92 H GLY 92 38.365 28.340 -33.717 809 HA2 GLY 92 HA2 GLY 92 39.302 29.917 -32.379 810 HA3 GLY 92 HA3 GLY 92 40.933 29.561 -33.104 811 H GLY 93 H GLY 93 40.155 32.234 -32.660 812 HA2 GLY 93 HA2 GLY 93 38.987 33.234 -35.073 813 HA3 GLY 93 HA3 GLY 93 39.310 34.178 -33.695 814 H VAL 94 H VAL 94 39.854 35.476 -35.849 815 HA VAL 94 HA VAL 94 42.580 35.215 -36.827 816 HB VAL 94 HB VAL 94 40.194 36.987 -37.430 817 HG11 VAL 94 HG11 VAL 94 42.815 37.010 -39.021 818 HG12 VAL 94 HG12 VAL 94 41.360 37.915 -39.216 819 HG13 VAL 94 HG13 VAL 94 42.429 38.250 -37.795 820 HG21 VAL 94 HG21 VAL 94 40.517 34.441 -38.369 821 HG22 VAL 94 HG22 VAL 94 39.760 35.656 -39.357 822 HG23 VAL 94 HG23 VAL 94 41.448 35.302 -39.611 823 H TYR 95 H TYR 95 44.216 36.115 -36.197 824 HA TYR 95 HA TYR 95 44.144 38.278 -34.152 825 HB2 TYR 95 HB2 TYR 95 46.115 36.058 -33.945 826 HB3 TYR 95 HB3 TYR 95 45.672 37.180 -32.792 827 HD1 TYR 95 HD1 TYR 95 43.235 37.210 -31.822 828 HD2 TYR 95 HD2 TYR 95 44.898 33.950 -33.895 829 HE1 TYR 95 HE1 TYR 95 41.910 35.715 -30.373 830 HE2 TYR 95 HE2 TYR 95 43.209 32.340 -32.762 831 HH TYR 95 HH TYR 95 41.214 33.440 -30.183
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