NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
22671 | 2jq6 | 15279 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 GLY 1 HT1 GLY 1 -50.376 32.260 28.319 2 H2 GLY 1 HT2 GLY 1 -51.340 33.379 27.490 3 H3 GLY 1 HT3 GLY 1 -49.648 33.413 27.314 4 HA2 GLY 1 HA1 GLY 1 -49.668 31.267 26.240 5 HA3 GLY 1 HA2 GLY 1 -51.410 31.189 26.453 6 HA PRO 2 HA PRO 2 -50.834 32.989 22.334 7 HB2 PRO 2 HB2 PRO 2 -52.821 31.458 21.176 8 HB3 PRO 2 HB1 PRO 2 -51.126 30.996 21.295 9 HG2 PRO 2 HG2 PRO 2 -53.387 29.835 22.633 10 HG3 PRO 2 HG1 PRO 2 -51.693 29.330 22.699 11 HD2 PRO 2 HD2 PRO 2 -53.252 30.905 24.625 12 HD3 PRO 2 HD1 PRO 2 -51.723 30.035 24.853 13 H LEU 3 HN LEU 3 -53.139 33.408 24.584 14 HA LEU 3 HA LEU 3 -54.867 34.997 22.811 15 HG LEU 3 HG LEU 3 -57.834 34.347 24.945 16 HB2 LEU 3 HB2 LEU 3 -55.831 33.213 24.409 17 HB3 LEU 3 HB1 LEU 3 -55.436 34.328 25.697 18 HD11 LEU 3 HD11 LEU 3 -58.078 36.764 24.991 19 HD12 LEU 3 HD12 LEU 3 -56.357 36.959 24.655 20 HD13 LEU 3 HD13 LEU 3 -56.884 36.227 26.171 21 HD21 LEU 3 HD21 LEU 3 -56.673 35.648 22.488 22 HD22 LEU 3 HD22 LEU 3 -58.388 35.514 22.880 23 HD23 LEU 3 HD23 LEU 3 -57.439 34.062 22.559 24 H GLY 4 HN GLY 4 -54.609 37.143 22.834 25 HA2 GLY 4 HA2 GLY 4 -54.202 39.261 23.764 26 HA3 GLY 4 HA1 GLY 4 -53.631 38.487 25.239 27 H SER 5 HN SER 5 -52.224 36.870 22.828 28 HA SER 5 HA SER 5 -50.204 38.663 21.936 29 HG SER 5 HG SER 5 -47.959 38.402 22.333 30 HB2 SER 5 HB2 SER 5 -49.410 38.207 24.273 31 HB3 SER 5 HB1 SER 5 -49.355 36.491 23.878 32 H GLU 6 HN GLU 6 -49.416 37.893 20.047 33 HA GLU 6 HA GLU 6 -50.564 35.449 19.083 34 HB2 GLU 6 HB2 GLU 6 -49.293 35.999 16.970 35 HB3 GLU 6 HB1 GLU 6 -50.481 37.186 17.484 36 HG2 GLU 6 HG2 GLU 6 -47.550 37.449 18.102 37 HG3 GLU 6 HG1 GLU 6 -48.274 38.066 16.620 38 H SER 7 HN SER 7 -49.772 33.545 19.411 39 HA SER 7 HA SER 7 -46.998 33.166 20.125 40 HG SER 7 HG SER 7 -46.736 30.960 21.190 41 HB2 SER 7 HB2 SER 7 -48.812 31.913 21.292 42 HB3 SER 7 HB1 SER 7 -49.199 31.110 19.771 43 H LEU 8 HN LEU 8 -45.719 33.453 18.405 44 HA LEU 8 HA LEU 8 -46.461 32.335 15.831 45 HG LEU 8 HG LEU 8 -42.989 33.228 16.897 46 HB2 LEU 8 HB2 LEU 8 -44.571 33.509 14.916 47 HB3 LEU 8 HB1 LEU 8 -45.489 34.604 15.923 48 HD11 LEU 8 HD11 LEU 8 -41.791 35.295 16.379 49 HD12 LEU 8 HD12 LEU 8 -43.235 35.934 15.595 50 HD13 LEU 8 HD13 LEU 8 -42.418 34.524 14.921 51 HD21 LEU 8 HD21 LEU 8 -44.459 34.133 18.628 52 HD22 LEU 8 HD22 LEU 8 -44.433 35.707 17.831 53 HD23 LEU 8 HD23 LEU 8 -42.953 35.044 18.524 54 H MET 9 HN MET 9 -45.464 30.654 14.841 55 HA MET 9 HA MET 9 -43.977 28.812 16.432 56 HB2 MET 9 HB2 MET 9 -44.400 28.834 13.430 57 HB3 MET 9 HB1 MET 9 -43.867 27.460 14.391 58 HG2 MET 9 HG2 MET 9 -46.552 28.808 14.593 59 HG3 MET 9 HG1 MET 9 -46.222 27.292 13.758 60 HE1 MET 9 HE1 MET 9 -44.219 25.799 15.615 61 HE2 MET 9 HE2 MET 9 -45.659 25.000 14.982 62 HE3 MET 9 HE3 MET 9 -45.278 24.899 16.701 63 HA PRO 10 HA PRO 10 -39.819 30.256 16.014 64 HB2 PRO 10 HB2 PRO 10 -38.666 27.773 15.318 65 HB3 PRO 10 HB1 PRO 10 -38.829 28.442 16.943 66 HG2 PRO 10 HG2 PRO 10 -40.540 26.463 15.527 67 HG3 PRO 10 HG1 PRO 10 -40.140 26.580 17.250 68 HD2 PRO 10 HD2 PRO 10 -42.544 27.310 16.342 69 HD3 PRO 10 HD1 PRO 10 -41.741 28.225 17.638 70 H SER 11 HN SER 11 -40.724 27.846 13.551 71 HA SER 11 HA SER 11 -39.493 29.587 11.535 72 HG SER 11 HG SER 11 -38.908 28.550 9.636 73 HB2 SER 11 HB2 SER 11 -38.616 27.240 11.682 74 HB3 SER 11 HB1 SER 11 -40.228 26.659 11.260 75 H GLN 12 HN GLN 12 -40.946 30.854 10.589 76 HA GLN 12 HA GLN 12 -43.743 30.178 10.683 77 HB2 GLN 12 HB2 GLN 12 -42.936 32.499 11.031 78 HB3 GLN 12 HB1 GLN 12 -42.377 32.532 9.363 79 HG2 GLN 12 HG2 GLN 12 -44.491 33.678 9.567 80 HG3 GLN 12 HG1 GLN 12 -44.670 32.225 8.587 81 HE21 GLN 12 HE21 GLN 12 -44.409 32.173 12.069 82 HE22 GLN 12 HE22 GLN 12 -46.030 31.656 12.368 83 H VAL 13 HN VAL 13 -44.163 28.473 9.359 84 HA VAL 13 HA VAL 13 -43.535 28.826 6.504 85 HB VAL 13 HB VAL 13 -43.859 26.388 6.254 86 HG11 VAL 13 HG11 VAL 13 -41.831 27.150 8.354 87 HG12 VAL 13 HG12 VAL 13 -41.615 27.270 6.608 88 HG13 VAL 13 HG13 VAL 13 -41.793 25.689 7.370 89 HG21 VAL 13 HG21 VAL 13 -43.941 24.964 8.251 90 HG22 VAL 13 HG22 VAL 13 -45.370 25.989 8.106 91 HG23 VAL 13 HG23 VAL 13 -44.100 26.406 9.256 92 H VAL 14 HN VAL 14 -45.131 28.671 4.989 93 HA VAL 14 HA VAL 14 -47.856 28.805 6.076 94 HB VAL 14 HB VAL 14 -47.279 30.865 5.002 95 HG11 VAL 14 HG11 VAL 14 -45.427 30.124 3.629 96 HG12 VAL 14 HG12 VAL 14 -46.596 31.018 2.657 97 HG13 VAL 14 HG13 VAL 14 -46.534 29.258 2.564 98 HG21 VAL 14 HG21 VAL 14 -48.982 30.990 3.229 99 HG22 VAL 14 HG22 VAL 14 -49.554 30.128 4.657 100 HG23 VAL 14 HG23 VAL 14 -49.079 29.228 3.217 101 H LYS 15 HN LYS 15 -48.986 27.012 5.826 102 HA LYS 15 HA LYS 15 -48.521 25.346 3.459 103 HB2 LYS 15 HB2 LYS 15 -49.916 24.735 6.071 104 HB3 LYS 15 HB1 LYS 15 -49.858 23.630 4.704 105 HG2 LYS 15 HG2 LYS 15 -47.436 23.538 4.855 106 HG3 LYS 15 HG1 LYS 15 -47.464 24.694 6.184 107 HD2 LYS 15 HD2 LYS 15 -48.627 23.130 7.595 108 HD3 LYS 15 HD1 LYS 15 -48.806 21.994 6.255 109 HE2 LYS 15 HE2 LYS 15 -46.412 21.670 6.159 110 HE3 LYS 15 HE1 LYS 15 -46.161 22.901 7.393 111 HZ1 LYS 15 HZ1 LYS 15 -47.679 20.383 7.859 112 HZ2 LYS 15 HZ2 LYS 15 -47.181 21.523 9.017 113 HZ3 LYS 15 HZ3 LYS 15 -46.031 20.582 8.206 114 H GLY 16 HN GLY 16 -49.632 26.590 1.971 115 HA2 GLY 16 HA2 GLY 16 -52.256 27.606 2.436 116 HA3 GLY 16 HA1 GLY 16 -51.407 27.584 0.901 117 H GLY 17 HN GLY 17 -53.977 26.360 2.624 118 HA2 GLY 17 HA2 GLY 17 -55.702 25.037 1.806 119 HA3 GLY 17 HA1 GLY 17 -54.696 24.627 0.424 120 H ALA 18 HN ALA 18 -52.858 24.144 3.111 121 HA ALA 18 HA ALA 18 -53.429 21.264 3.011 122 HB1 ALA 18 HB1 ALA 18 -50.915 22.675 3.888 123 HB2 ALA 18 HB2 ALA 18 -51.183 21.957 2.298 124 HB3 ALA 18 HB3 ALA 18 -51.145 20.934 3.734 125 H PHE 19 HN PHE 19 -54.965 21.017 4.590 126 HA PHE 19 HA PHE 19 -54.538 22.025 7.250 127 HD1 PHE 19 HD1 PHE 19 -57.241 21.706 4.433 128 HD2 PHE 19 HD2 PHE 19 -56.615 18.149 6.692 129 HE1 PHE 19 HE1 PHE 19 -58.214 20.376 2.607 130 HE2 PHE 19 HE2 PHE 19 -57.578 16.818 4.863 131 HZ PHE 19 HZ PHE 19 -58.380 17.931 2.819 132 HB2 PHE 19 HB2 PHE 19 -56.466 20.319 7.734 133 HB3 PHE 19 HB1 PHE 19 -56.812 21.789 6.835 134 H ASP 20 HN ASP 20 -52.918 21.267 8.389 135 HA ASP 20 HA ASP 20 -51.790 18.665 7.735 136 HB2 ASP 20 HB2 ASP 20 -50.409 20.768 7.885 137 HB3 ASP 20 HB1 ASP 20 -50.693 20.753 9.623 138 H GLY 21 HN GLY 21 -52.096 16.918 8.906 139 HA2 GLY 21 HA2 GLY 21 -52.778 17.245 11.756 140 HA3 GLY 21 HA1 GLY 21 -53.525 16.017 10.740 141 H THR 22 HN THR 22 -50.283 17.148 11.670 142 HA THR 22 HA THR 22 -49.057 14.624 11.265 143 HB THR 22 HB THR 22 -48.116 16.986 12.911 144 HG1 THR 22 HG1 THR 22 -48.394 17.430 10.639 145 HG21 THR 22 HG21 THR 22 -45.881 16.009 12.705 146 HG22 THR 22 HG22 THR 22 -46.558 14.617 11.860 147 HG23 THR 22 HG23 THR 22 -46.972 14.909 13.549 148 H MET 23 HN MET 23 -49.571 12.885 12.415 149 HA MET 23 HA MET 23 -50.470 13.021 15.133 150 HB2 MET 23 HB2 MET 23 -49.627 10.650 13.451 151 HB3 MET 23 HB1 MET 23 -50.369 10.545 15.040 152 HG2 MET 23 HG2 MET 23 -52.388 11.579 14.201 153 HG3 MET 23 HG1 MET 23 -51.648 11.781 12.615 154 HE1 MET 23 HE1 MET 23 -50.937 9.756 11.063 155 HE2 MET 23 HE2 MET 23 -51.267 8.063 11.428 156 HE3 MET 23 HE3 MET 23 -50.059 8.946 12.362 157 H ASN 24 HN ASN 24 -49.026 13.714 16.574 158 HA ASN 24 HA ASN 24 -46.220 13.118 16.295 159 HB2 ASN 24 HB2 ASN 24 -47.768 14.676 18.369 160 HB3 ASN 24 HB1 ASN 24 -46.030 14.431 18.450 161 HD21 ASN 24 HD21 ASN 24 -48.625 16.040 16.788 162 HD22 ASN 24 HD22 ASN 24 -47.635 17.134 15.894 163 H GLY 25 HN GLY 25 -44.940 12.169 17.980 164 HA2 GLY 25 HA2 GLY 25 -44.976 11.022 20.172 165 HA3 GLY 25 HA1 GLY 25 -46.415 10.201 19.602 166 HA PRO 26 HA PRO 26 -43.472 7.360 17.599 167 HB2 PRO 26 HB2 PRO 26 -43.876 7.757 14.792 168 HB3 PRO 26 HB1 PRO 26 -44.563 6.497 15.820 169 HG2 PRO 26 HG2 PRO 26 -46.024 8.503 14.621 170 HG3 PRO 26 HG1 PRO 26 -46.534 7.614 16.065 171 HD2 PRO 26 HD2 PRO 26 -45.270 10.318 15.856 172 HD3 PRO 26 HD1 PRO 26 -46.576 9.764 16.928 173 H PHE 27 HN PHE 27 -41.314 7.403 17.337 174 HA PHE 27 HA PHE 27 -40.157 9.598 15.746 175 HD1 PHE 27 HD1 PHE 27 -39.048 11.775 16.475 176 HD2 PHE 27 HD2 PHE 27 -36.702 8.646 18.155 177 HE1 PHE 27 HE1 PHE 27 -36.997 13.025 15.930 178 HE2 PHE 27 HE2 PHE 27 -34.650 9.888 17.611 179 HZ PHE 27 HZ PHE 27 -34.791 12.081 16.497 180 HB2 PHE 27 HB2 PHE 27 -39.948 10.042 18.191 181 HB3 PHE 27 HB1 PHE 27 -39.011 8.561 18.345 182 H GLY 28 HN GLY 28 -38.712 9.001 14.272 183 HA2 GLY 28 HA2 GLY 28 -36.801 6.977 14.531 184 HA3 GLY 28 HA1 GLY 28 -38.193 6.286 13.710 185 H HIS 29 HN HIS 29 -35.607 6.562 12.557 186 HA HIS 29 HA HIS 29 -36.334 7.858 10.122 187 HD1 HIS 29 HD1 HIS 29 -36.366 10.996 9.493 188 HD2 HIS 29 HD2 HIS 29 -32.576 9.297 9.155 189 HE1 HIS 29 HE1 HIS 29 -35.362 11.970 7.392 190 HE2 HIS 29 HE2 HIS 29 -33.032 11.018 7.269 191 HB2 HIS 29 HB2 HIS 29 -35.572 9.781 11.612 192 HB3 HIS 29 HB1 HIS 29 -33.973 9.052 11.590 193 H GLY 30 HN GLY 30 -35.496 6.602 8.585 194 HA2 GLY 30 HA2 GLY 30 -32.757 5.634 8.823 195 HA3 GLY 30 HA1 GLY 30 -34.006 4.401 8.774 196 H TYR 31 HN TYR 31 -31.864 6.085 6.951 197 HA TYR 31 HA TYR 31 -33.512 6.087 4.534 198 HD1 TYR 31 HD2 TYR 31 -29.402 6.014 3.699 199 HD2 TYR 31 HD1 TYR 31 -30.889 8.549 6.778 200 HE1 TYR 31 HE2 TYR 31 -27.153 6.124 4.687 201 HE2 TYR 31 HE1 TYR 31 -28.643 8.661 7.777 202 HH TYR 31 HH TYR 31 -26.582 7.419 7.819 203 HB2 TYR 31 HB2 TYR 31 -31.565 7.220 3.478 204 HB3 TYR 31 HB1 TYR 31 -32.225 8.104 4.846 205 H GLY 32 HN GLY 32 -32.306 5.306 2.489 206 HA2 GLY 32 HA2 GLY 32 -31.656 2.537 2.930 207 HA3 GLY 32 HA1 GLY 32 -31.710 3.364 1.377 208 H GLU 33 HN GLU 33 -29.760 2.440 4.066 209 HA GLU 33 HA GLU 33 -27.416 3.874 3.250 210 HB2 GLU 33 HB2 GLU 33 -26.300 2.543 5.043 211 HB3 GLU 33 HB1 GLU 33 -27.700 3.446 5.603 212 HG2 GLU 33 HG2 GLU 33 -29.034 1.353 5.429 213 HG3 GLU 33 HG1 GLU 33 -27.552 0.496 5.017 214 H GLY 34 HN GLY 34 -25.798 3.211 1.963 215 HA2 GLY 34 HA2 GLY 34 -26.143 0.771 0.460 216 HA3 GLY 34 HA1 GLY 34 -24.856 1.953 0.254 217 H ALA 35 HN ALA 35 -25.810 -0.994 1.697 218 HA ALA 35 HA ALA 35 -23.632 -1.197 3.544 219 HB1 ALA 35 HB1 ALA 35 -25.743 -2.332 3.969 220 HB2 ALA 35 HB2 ALA 35 -24.414 -3.490 3.880 221 HB3 ALA 35 HB3 ALA 35 -25.521 -3.313 2.518 222 H GLY 36 HN GLY 36 -21.607 -1.582 2.999 223 HA2 GLY 36 HA2 GLY 36 -21.069 -3.086 0.526 224 HA3 GLY 36 HA1 GLY 36 -19.943 -1.977 1.300 225 H GLU 37 HN GLU 37 -21.032 -5.198 1.073 226 HA GLU 37 HA GLU 37 -19.782 -6.055 3.533 227 HB2 GLU 37 HB2 GLU 37 -20.526 -8.308 2.786 228 HB3 GLU 37 HB1 GLU 37 -21.833 -7.146 2.916 229 HG2 GLU 37 HG2 GLU 37 -21.758 -6.814 0.489 230 HG3 GLU 37 HG1 GLU 37 -20.476 -8.018 0.372 231 H GLY 38 HN GLY 38 -18.519 -8.341 3.054 232 HA2 GLY 38 HA2 GLY 38 -16.130 -7.446 1.696 233 HA3 GLY 38 HA1 GLY 38 -16.309 -8.947 2.590 234 H ILE 39 HN ILE 39 -17.469 -7.368 -0.340 235 HA ILE 39 HA ILE 39 -17.798 -9.745 -1.844 236 HB ILE 39 HB ILE 39 -17.660 -8.210 -3.823 237 HG12 ILE 39 HG12 ILE 39 -17.014 -6.221 -1.644 238 HG13 ILE 39 HG11 ILE 39 -16.096 -6.570 -3.101 239 HG21 ILE 39 HG21 ILE 39 -19.785 -8.643 -2.739 240 HG22 ILE 39 HG22 ILE 39 -19.715 -6.968 -3.287 241 HG23 ILE 39 HG23 ILE 39 -19.485 -7.348 -1.578 242 HD11 ILE 39 HD11 ILE 39 -17.181 -4.448 -3.328 243 HD12 ILE 39 HD12 ILE 39 -18.745 -5.164 -2.944 244 HD13 ILE 39 HD13 ILE 39 -17.920 -5.598 -4.442 245 H ASP 40 HN ASP 40 -16.330 -10.499 -3.576 246 HA ASP 40 HA ASP 40 -13.675 -10.611 -2.492 247 HB2 ASP 40 HB2 ASP 40 -14.954 -11.881 -4.908 248 HB3 ASP 40 HB1 ASP 40 -13.238 -12.064 -4.551 249 H ASP 41 HN ASP 41 -13.420 -8.273 -2.697 250 HA ASP 41 HA ASP 41 -12.088 -7.687 -5.264 251 HB2 ASP 41 HB2 ASP 41 -13.875 -5.890 -3.639 252 HB3 ASP 41 HB1 ASP 41 -12.625 -5.213 -4.674 253 H VAL 42 HN VAL 42 -10.053 -8.187 -4.577 254 HA VAL 42 HA VAL 42 -9.040 -6.538 -2.365 255 HB VAL 42 HB VAL 42 -8.795 -8.841 -1.778 256 HG11 VAL 42 HG11 VAL 42 -8.967 -9.841 -3.995 257 HG12 VAL 42 HG12 VAL 42 -7.580 -10.472 -3.110 258 HG13 VAL 42 HG13 VAL 42 -7.341 -9.275 -4.382 259 HG21 VAL 42 HG21 VAL 42 -6.947 -7.372 -1.173 260 HG22 VAL 42 HG22 VAL 42 -6.128 -7.759 -2.686 261 HG23 VAL 42 HG23 VAL 42 -6.377 -9.016 -1.472 262 H GLU 43 HN GLU 43 -8.519 -4.737 -3.487 263 HA GLU 43 HA GLU 43 -6.203 -4.963 -5.233 264 HB2 GLU 43 HB2 GLU 43 -8.080 -4.864 -6.777 265 HB3 GLU 43 HB1 GLU 43 -8.699 -3.424 -5.976 266 HG2 GLU 43 HG2 GLU 43 -6.687 -2.198 -6.651 267 HG3 GLU 43 HG1 GLU 43 -6.083 -3.651 -7.447 268 H TRP 44 HN TRP 44 -4.835 -4.010 -3.846 269 HA TRP 44 HA TRP 44 -5.428 -1.552 -2.518 270 HD1 TRP 44 HD1 TRP 44 -3.697 0.471 -1.914 271 HE1 TRP 44 HE1 TRP 44 -1.466 1.593 -1.289 272 HE3 TRP 44 HE3 TRP 44 -0.751 -3.619 -1.802 273 HZ2 TRP 44 HZ2 TRP 44 1.242 0.779 -0.837 274 HZ3 TRP 44 HZ3 TRP 44 1.634 -3.407 -1.313 275 HH2 TRP 44 HH2 TRP 44 2.611 -1.240 -0.810 276 HB2 TRP 44 HB2 TRP 44 -3.825 -2.897 -1.419 277 HB3 TRP 44 HB1 TRP 44 -2.919 -3.171 -2.904 278 H VAL 45 HN VAL 45 -4.839 0.424 -3.032 279 HA VAL 45 HA VAL 45 -5.102 1.309 -5.607 280 HB VAL 45 HB VAL 45 -3.710 2.803 -3.391 281 HG11 VAL 45 HG11 VAL 45 -3.669 3.937 -5.544 282 HG12 VAL 45 HG12 VAL 45 -4.720 4.783 -4.408 283 HG13 VAL 45 HG13 VAL 45 -5.422 3.776 -5.675 284 HG21 VAL 45 HG21 VAL 45 -5.680 1.948 -2.373 285 HG22 VAL 45 HG22 VAL 45 -6.648 2.283 -3.808 286 HG23 VAL 45 HG23 VAL 45 -6.043 3.616 -2.825 287 H VAL 46 HN VAL 46 -2.229 -0.008 -4.265 288 HA VAL 46 HA VAL 46 -0.456 1.538 -5.927 289 HB VAL 46 HB VAL 46 -0.074 -0.592 -3.862 290 HG11 VAL 46 HG11 VAL 46 1.137 -1.586 -5.724 291 HG12 VAL 46 HG12 VAL 46 2.262 -0.941 -4.526 292 HG13 VAL 46 HG13 VAL 46 1.962 -0.059 -6.024 293 HG21 VAL 46 HG21 VAL 46 1.373 1.948 -4.607 294 HG22 VAL 46 HG22 VAL 46 1.685 0.970 -3.174 295 HG23 VAL 46 HG23 VAL 46 0.133 1.786 -3.367 296 H GLY 47 HN GLY 47 -2.257 -1.384 -6.317 297 HA2 GLY 47 HA2 GLY 47 -0.681 -2.639 -8.281 298 HA3 GLY 47 HA1 GLY 47 -2.432 -2.806 -8.125 299 H LYS 48 HN LYS 48 -2.325 0.319 -8.430 300 HA LYS 48 HA LYS 48 -2.377 0.245 -11.350 301 HB2 LYS 48 HB2 LYS 48 -3.887 2.278 -10.979 302 HB3 LYS 48 HB1 LYS 48 -4.530 0.678 -10.659 303 HG2 LYS 48 HG2 LYS 48 -3.804 1.189 -8.224 304 HG3 LYS 48 HG1 LYS 48 -3.811 2.865 -8.778 305 HD2 LYS 48 HD2 LYS 48 -5.964 2.299 -7.808 306 HD3 LYS 48 HD1 LYS 48 -6.132 2.588 -9.541 307 HE2 LYS 48 HE2 LYS 48 -6.027 0.139 -9.914 308 HE3 LYS 48 HE1 LYS 48 -5.990 -0.097 -8.170 309 HZ1 LYS 48 HZ1 LYS 48 -8.212 -0.396 -8.894 310 HZ2 LYS 48 HZ2 LYS 48 -8.199 1.054 -9.781 311 HZ3 LYS 48 HZ3 LYS 48 -8.156 1.097 -8.086 312 H ASP 49 HN ASP 49 -0.450 1.362 -8.909 313 HA ASP 49 HA ASP 49 0.589 3.489 -10.666 314 HB2 ASP 49 HB2 ASP 49 -0.737 4.396 -8.678 315 HB3 ASP 49 HB1 ASP 49 0.558 3.779 -7.659 316 H LYS 50 HN LYS 50 1.155 0.622 -9.295 317 HA LYS 50 HA LYS 50 3.675 0.681 -8.177 318 HB2 LYS 50 HB2 LYS 50 2.172 -1.321 -8.299 319 HB3 LYS 50 HB1 LYS 50 2.633 -1.495 -9.991 320 HG2 LYS 50 HG2 LYS 50 4.974 -1.771 -9.316 321 HG3 LYS 50 HG1 LYS 50 4.492 -1.630 -7.622 322 HD2 LYS 50 HD2 LYS 50 3.027 -3.603 -7.927 323 HD3 LYS 50 HD1 LYS 50 3.651 -3.773 -9.568 324 HE2 LYS 50 HE2 LYS 50 5.353 -3.817 -7.085 325 HE3 LYS 50 HE1 LYS 50 4.732 -5.256 -7.884 326 HZ1 LYS 50 HZ1 LYS 50 5.926 -4.516 -9.910 327 HZ2 LYS 50 HZ2 LYS 50 6.946 -4.895 -8.611 328 HZ3 LYS 50 HZ3 LYS 50 6.639 -3.277 -8.997 329 HA PRO 51 HA PRO 51 5.251 0.165 -12.974 330 HB2 PRO 51 HB2 PRO 51 3.289 2.313 -13.703 331 HB3 PRO 51 HB1 PRO 51 4.057 1.093 -14.732 332 HG2 PRO 51 HG2 PRO 51 1.571 0.751 -13.871 333 HG3 PRO 51 HG1 PRO 51 2.698 -0.616 -13.935 334 HD2 PRO 51 HD2 PRO 51 1.670 0.883 -11.590 335 HD3 PRO 51 HD1 PRO 51 2.224 -0.808 -11.705 336 H THR 52 HN THR 52 4.129 3.039 -11.230 337 HA THR 52 HA THR 52 6.134 4.777 -12.313 338 HB THR 52 HB THR 52 4.495 5.140 -9.787 339 HG1 THR 52 HG1 THR 52 2.833 5.543 -11.046 340 HG21 THR 52 HG21 THR 52 4.818 7.549 -10.270 341 HG22 THR 52 HG22 THR 52 5.880 7.112 -11.609 342 HG23 THR 52 HG23 THR 52 6.335 6.708 -9.954 343 H TYR 53 HN TYR 53 5.649 3.065 -9.260 344 HA TYR 53 HA TYR 53 8.060 4.079 -8.059 345 HD1 TYR 53 HD2 TYR 53 6.350 5.321 -6.752 346 HD2 TYR 53 HD1 TYR 53 4.415 1.539 -6.569 347 HE1 TYR 53 HE2 TYR 53 4.244 6.427 -6.141 348 HE2 TYR 53 HE1 TYR 53 2.310 2.639 -5.975 349 HH TYR 53 HH TYR 53 1.657 5.716 -6.444 350 HB2 TYR 53 HB2 TYR 53 6.586 1.619 -7.241 351 HB3 TYR 53 HB1 TYR 53 7.489 2.719 -6.219 352 H ASP 54 HN ASP 54 7.113 1.423 -9.991 353 HA ASP 54 HA ASP 54 9.320 -0.311 -9.279 354 HB2 ASP 54 HB2 ASP 54 7.080 -1.174 -9.900 355 HB3 ASP 54 HB1 ASP 54 7.247 -0.471 -11.502 356 H GLU 55 HN GLU 55 8.441 1.922 -11.867 357 HA GLU 55 HA GLU 55 10.670 1.295 -13.515 358 HB2 GLU 55 HB2 GLU 55 10.141 3.277 -14.772 359 HB3 GLU 55 HB1 GLU 55 8.644 2.461 -14.366 360 HG2 GLU 55 HG2 GLU 55 7.922 4.446 -13.738 361 HG3 GLU 55 HG1 GLU 55 8.919 4.222 -12.291 362 H ILE 56 HN ILE 56 10.106 3.661 -10.920 363 HA ILE 56 HA ILE 56 12.705 4.802 -11.097 364 HB ILE 56 HB ILE 56 10.907 4.662 -8.664 365 HG12 ILE 56 HG12 ILE 56 11.155 6.903 -10.678 366 HG13 ILE 56 HG11 ILE 56 9.894 5.670 -10.755 367 HG21 ILE 56 HG21 ILE 56 13.174 6.527 -9.360 368 HG22 ILE 56 HG22 ILE 56 13.209 5.258 -8.135 369 HG23 ILE 56 HG23 ILE 56 12.143 6.646 -7.934 370 HD11 ILE 56 HD11 ILE 56 9.092 7.716 -9.723 371 HD12 ILE 56 HD12 ILE 56 10.336 7.590 -8.479 372 HD13 ILE 56 HD13 ILE 56 9.064 6.371 -8.584 373 H PHE 57 HN PHE 57 11.322 2.044 -9.502 374 HA PHE 57 HA PHE 57 13.348 1.242 -7.797 375 HD1 PHE 57 HD2 PHE 57 12.945 -0.834 -6.120 376 HD2 PHE 57 HD1 PHE 57 12.069 -2.436 -9.960 377 HE1 PHE 57 HE2 PHE 57 13.816 -3.018 -5.407 378 HE2 PHE 57 HE1 PHE 57 12.927 -4.630 -9.250 379 HZ PHE 57 HZ PHE 57 13.804 -4.924 -6.971 380 HB2 PHE 57 HB2 PHE 57 11.208 0.167 -7.764 381 HB3 PHE 57 HB1 PHE 57 11.359 -0.319 -9.443 382 H TYR 58 HN TYR 58 12.877 0.260 -11.218 383 HA TYR 58 HA TYR 58 15.461 -0.970 -11.335 384 HD1 TYR 58 HD1 TYR 58 11.722 -1.514 -12.272 385 HD2 TYR 58 HD2 TYR 58 15.423 -3.331 -13.308 386 HE1 TYR 58 HE1 TYR 58 10.751 -3.726 -11.838 387 HE2 TYR 58 HE2 TYR 58 14.461 -5.554 -12.875 388 HH TYR 58 HH TYR 58 11.068 -6.014 -12.330 389 HB2 TYR 58 HB2 TYR 58 13.442 -0.266 -13.460 390 HB3 TYR 58 HB1 TYR 58 14.996 -1.008 -13.841 391 H THR 59 HN THR 59 14.265 2.219 -11.799 392 HA THR 59 HA THR 59 16.382 3.246 -13.381 393 HB THR 59 HB THR 59 14.275 4.531 -11.648 394 HG1 THR 59 HG1 THR 59 13.253 4.495 -13.490 395 HG21 THR 59 HG21 THR 59 14.970 6.706 -12.536 396 HG22 THR 59 HG22 THR 59 16.381 5.947 -13.271 397 HG23 THR 59 HG23 THR 59 16.217 5.991 -11.515 398 H LEU 60 HN LEU 60 15.903 2.841 -9.915 399 HA LEU 60 HA LEU 60 18.361 4.222 -9.259 400 HG LEU 60 HG LEU 60 15.430 4.640 -8.149 401 HB2 LEU 60 HB2 LEU 60 16.484 2.534 -7.590 402 HB3 LEU 60 HB1 LEU 60 17.890 3.375 -6.947 403 HD11 LEU 60 HD11 LEU 60 15.265 3.737 -5.839 404 HD12 LEU 60 HD12 LEU 60 15.040 5.481 -5.951 405 HD13 LEU 60 HD13 LEU 60 16.571 4.826 -5.372 406 HD21 LEU 60 HD21 LEU 60 17.943 5.945 -7.106 407 HD22 LEU 60 HD22 LEU 60 16.472 6.779 -7.602 408 HD23 LEU 60 HD23 LEU 60 17.425 5.894 -8.792 409 H SER 61 HN SER 61 17.554 1.241 -10.470 410 HA SER 61 HA SER 61 18.768 -0.569 -11.046 411 HG SER 61 HG SER 61 21.734 -1.257 -9.956 412 HB2 SER 61 HB2 SER 61 20.692 0.925 -11.381 413 HB3 SER 61 HB1 SER 61 21.100 0.789 -9.671 414 HA PRO 62 HA PRO 62 18.116 -2.542 -7.052 415 HB2 PRO 62 HB2 PRO 62 16.585 -4.553 -7.993 416 HB3 PRO 62 HB1 PRO 62 15.936 -2.943 -7.666 417 HG2 PRO 62 HG2 PRO 62 16.571 -4.240 -10.253 418 HG3 PRO 62 HG1 PRO 62 15.346 -3.020 -9.870 419 HD2 PRO 62 HD2 PRO 62 17.848 -2.565 -11.082 420 HD3 PRO 62 HD1 PRO 62 16.739 -1.337 -10.437 421 H VAL 63 HN VAL 63 18.459 -4.855 -6.388 422 HA VAL 63 HA VAL 63 20.351 -6.297 -8.105 423 HB VAL 63 HB VAL 63 20.777 -5.665 -5.170 424 HG11 VAL 63 HG11 VAL 63 22.461 -7.372 -7.007 425 HG12 VAL 63 HG12 VAL 63 21.430 -7.964 -5.701 426 HG13 VAL 63 HG13 VAL 63 22.833 -6.960 -5.333 427 HG21 VAL 63 HG21 VAL 63 22.821 -4.550 -5.921 428 HG22 VAL 63 HG22 VAL 63 21.384 -3.816 -6.632 429 HG23 VAL 63 HG23 VAL 63 22.395 -4.891 -7.599 430 H ASN 64 HN ASN 64 19.380 -8.185 -8.449 431 HA ASN 64 HA ASN 64 18.578 -10.264 -8.048 432 HB2 ASN 64 HB2 ASN 64 18.974 -9.625 -5.113 433 HB3 ASN 64 HB1 ASN 64 18.666 -11.226 -5.791 434 HD21 ASN 64 HD21 ASN 64 20.376 -10.328 -8.149 435 HD22 ASN 64 HD22 ASN 64 21.999 -10.595 -7.606 436 H GLY 65 HN GLY 65 16.913 -7.757 -7.965 437 HA2 GLY 65 HA2 GLY 65 14.600 -7.807 -8.425 438 HA3 GLY 65 HA1 GLY 65 14.459 -9.248 -7.432 439 H LYS 66 HN LYS 66 16.231 -6.556 -6.224 440 HA LYS 66 HA LYS 66 14.084 -5.103 -5.096 441 HB2 LYS 66 HB2 LYS 66 14.296 -5.619 -2.764 442 HB3 LYS 66 HB1 LYS 66 14.043 -7.132 -3.608 443 HG2 LYS 66 HG2 LYS 66 16.697 -6.113 -2.622 444 HG3 LYS 66 HG1 LYS 66 15.698 -7.311 -1.810 445 HD2 LYS 66 HD2 LYS 66 16.515 -7.774 -4.629 446 HD3 LYS 66 HD1 LYS 66 17.696 -8.024 -3.351 447 HE2 LYS 66 HE2 LYS 66 16.652 -10.127 -3.841 448 HE3 LYS 66 HE1 LYS 66 16.120 -9.585 -2.263 449 HZ1 LYS 66 HZ1 LYS 66 14.554 -9.357 -4.775 450 HZ2 LYS 66 HZ2 LYS 66 14.036 -8.852 -3.252 451 HZ3 LYS 66 HZ3 LYS 66 14.290 -10.494 -3.552 452 H ILE 67 HN ILE 67 14.866 -3.211 -3.937 453 HA ILE 67 HA ILE 67 17.573 -2.556 -4.786 454 HB ILE 67 HB ILE 67 17.073 -0.285 -3.728 455 HG12 ILE 67 HG12 ILE 67 14.338 -1.588 -3.537 456 HG13 ILE 67 HG11 ILE 67 15.272 -0.819 -2.258 457 HG21 ILE 67 HG21 ILE 67 16.997 -0.682 -6.135 458 HG22 ILE 67 HG22 ILE 67 15.684 0.397 -5.667 459 HG23 ILE 67 HG23 ILE 67 15.348 -1.298 -6.023 460 HD11 ILE 67 HD11 ILE 67 13.958 0.550 -4.597 461 HD12 ILE 67 HD12 ILE 67 14.972 1.348 -3.393 462 HD13 ILE 67 HD13 ILE 67 13.447 0.606 -2.908 463 H THR 68 HN THR 68 19.283 -2.416 -3.513 464 HA THR 68 HA THR 68 19.324 -3.264 -0.851 465 HB THR 68 HB THR 68 21.534 -2.006 -0.769 466 HG1 THR 68 HG1 THR 68 22.268 -1.216 -2.829 467 HG21 THR 68 HG21 THR 68 21.485 -4.347 -1.370 468 HG22 THR 68 HG22 THR 68 22.645 -3.507 -2.400 469 HG23 THR 68 HG23 THR 68 21.059 -3.944 -3.033 470 H GLY 69 HN GLY 69 18.872 -2.167 1.012 471 HA2 GLY 69 HA2 GLY 69 17.070 -0.105 0.919 472 HA3 GLY 69 HA1 GLY 69 18.003 -0.523 2.335 473 H ALA 70 HN ALA 70 20.552 0.172 0.945 474 HA ALA 70 HA ALA 70 21.008 2.784 1.635 475 HB1 ALA 70 HB1 ALA 70 22.869 2.774 0.079 476 HB2 ALA 70 HB2 ALA 70 22.195 1.372 -0.751 477 HB3 ALA 70 HB3 ALA 70 22.758 1.224 0.914 478 H ASN 71 HN ASN 71 20.006 1.684 -1.636 479 HA ASN 71 HA ASN 71 19.890 4.379 -2.587 480 HB2 ASN 71 HB2 ASN 71 19.279 3.500 -4.701 481 HB3 ASN 71 HB1 ASN 71 20.381 2.328 -4.015 482 HD21 ASN 71 HD21 ASN 71 19.804 0.313 -3.821 483 HD22 ASN 71 HD22 ASN 71 18.224 -0.287 -4.166 484 H ALA 72 HN ALA 72 17.655 2.165 -1.155 485 HA ALA 72 HA ALA 72 15.244 3.507 -1.877 486 HB1 ALA 72 HB1 ALA 72 14.271 2.244 0.010 487 HB2 ALA 72 HB2 ALA 72 15.891 1.702 0.451 488 HB3 ALA 72 HB3 ALA 72 15.189 1.221 -1.095 489 H LYS 73 HN LYS 73 17.550 3.728 0.741 490 HA LYS 73 HA LYS 73 16.127 5.632 2.284 491 HB2 LYS 73 HB2 LYS 73 19.101 5.064 2.204 492 HB3 LYS 73 HB1 LYS 73 18.295 6.055 3.407 493 HG2 LYS 73 HG2 LYS 73 17.926 3.107 2.956 494 HG3 LYS 73 HG1 LYS 73 18.690 3.894 4.339 495 HD2 LYS 73 HD2 LYS 73 15.834 4.397 3.563 496 HD3 LYS 73 HD1 LYS 73 16.304 3.090 4.649 497 HE2 LYS 73 HE2 LYS 73 16.920 6.020 5.077 498 HE3 LYS 73 HE1 LYS 73 15.590 5.140 5.843 499 HZ1 LYS 73 HZ1 LYS 73 17.671 5.400 7.202 500 HZ2 LYS 73 HZ2 LYS 73 18.433 4.328 6.134 501 HZ3 LYS 73 HZ3 LYS 73 17.103 3.810 7.048 502 H LYS 74 HN LYS 74 18.534 5.865 -0.274 503 HA LYS 74 HA LYS 74 18.950 8.622 -0.303 504 HB2 LYS 74 HB2 LYS 74 18.610 7.009 -2.790 505 HB3 LYS 74 HB1 LYS 74 19.627 8.398 -2.557 506 HG2 LYS 74 HG2 LYS 74 20.051 5.585 -1.638 507 HG3 LYS 74 HG1 LYS 74 21.077 6.566 -2.678 508 HD2 LYS 74 HD2 LYS 74 20.577 7.238 0.211 509 HD3 LYS 74 HD1 LYS 74 21.878 6.170 -0.298 510 HE2 LYS 74 HE2 LYS 74 21.500 9.060 -1.029 511 HE3 LYS 74 HE1 LYS 74 22.742 8.366 0.011 512 HZ1 LYS 74 HZ1 LYS 74 22.443 7.889 -2.907 513 HZ2 LYS 74 HZ2 LYS 74 23.608 7.155 -1.919 514 HZ3 LYS 74 HZ3 LYS 74 23.639 8.833 -2.166 515 H GLU 75 HN GLU 75 16.605 6.674 -1.980 516 HA GLU 75 HA GLU 75 15.184 8.631 -3.345 517 HB2 GLU 75 HB2 GLU 75 15.108 5.958 -3.232 518 HB3 GLU 75 HB1 GLU 75 13.702 6.299 -2.241 519 HG2 GLU 75 HG2 GLU 75 13.597 5.956 -4.876 520 HG3 GLU 75 HG1 GLU 75 12.456 6.960 -3.995 521 H MET 76 HN MET 76 14.381 7.223 -0.163 522 HA MET 76 HA MET 76 12.221 9.048 0.222 523 HB2 MET 76 HB2 MET 76 12.286 8.135 2.609 524 HB3 MET 76 HB1 MET 76 11.914 7.015 1.308 525 HG2 MET 76 HG2 MET 76 14.137 6.133 1.359 526 HG3 MET 76 HG1 MET 76 14.635 7.338 2.541 527 HE1 MET 76 HE1 MET 76 11.251 5.300 2.380 528 HE2 MET 76 HE2 MET 76 11.652 3.911 3.394 529 HE3 MET 76 HE3 MET 76 12.471 4.146 1.850 530 H VAL 77 HN VAL 77 15.613 9.200 0.887 531 HA VAL 77 HA VAL 77 15.495 11.344 2.778 532 HB VAL 77 HB VAL 77 17.662 10.150 1.098 533 HG11 VAL 77 HG11 VAL 77 18.024 12.551 0.795 534 HG12 VAL 77 HG12 VAL 77 19.271 11.840 1.821 535 HG13 VAL 77 HG13 VAL 77 17.969 12.784 2.545 536 HG21 VAL 77 HG21 VAL 77 17.177 9.196 3.268 537 HG22 VAL 77 HG22 VAL 77 17.379 10.772 4.032 538 HG23 VAL 77 HG23 VAL 77 18.763 9.968 3.290 539 H LYS 78 HN LYS 78 15.916 11.203 -0.759 540 HA LYS 78 HA LYS 78 16.121 14.030 -1.061 541 HB2 LYS 78 HB2 LYS 78 15.978 13.624 -3.428 542 HB3 LYS 78 HB1 LYS 78 16.984 12.371 -2.712 543 HG2 LYS 78 HG2 LYS 78 15.008 10.876 -2.690 544 HG3 LYS 78 HG1 LYS 78 14.115 12.121 -3.562 545 HD2 LYS 78 HD2 LYS 78 14.886 10.571 -5.164 546 HD3 LYS 78 HD1 LYS 78 15.892 12.011 -5.315 547 HE2 LYS 78 HE2 LYS 78 17.726 10.982 -4.307 548 HE3 LYS 78 HE1 LYS 78 16.736 9.705 -3.598 549 HZ1 LYS 78 HZ1 LYS 78 16.373 8.783 -5.780 550 HZ2 LYS 78 HZ2 LYS 78 18.042 8.923 -5.492 551 HZ3 LYS 78 HZ3 LYS 78 17.260 10.041 -6.501 552 H SER 79 HN SER 79 13.538 11.876 -0.583 553 HA SER 79 HA SER 79 11.384 13.369 -1.589 554 HG SER 79 HG SER 79 12.011 10.672 -1.364 555 HB2 SER 79 HB2 SER 79 11.527 11.533 0.815 556 HB3 SER 79 HB1 SER 79 10.026 12.120 0.082 557 H LYS 80 HN LYS 80 13.607 14.287 0.715 558 HA LYS 80 HA LYS 80 13.862 16.258 1.794 559 HB2 LYS 80 HB2 LYS 80 11.097 16.920 0.769 560 HB3 LYS 80 HB1 LYS 80 12.183 18.052 1.577 561 HG2 LYS 80 HG2 LYS 80 13.826 17.646 -0.261 562 HG3 LYS 80 HG1 LYS 80 12.570 16.721 -1.089 563 HD2 LYS 80 HD2 LYS 80 11.121 18.702 -1.081 564 HD3 LYS 80 HD1 LYS 80 12.391 19.625 -0.272 565 HE2 LYS 80 HE2 LYS 80 12.552 18.372 -3.014 566 HE3 LYS 80 HE1 LYS 80 12.378 20.090 -2.659 567 HZ1 LYS 80 HZ1 LYS 80 14.708 18.383 -1.955 568 HZ2 LYS 80 HZ2 LYS 80 14.551 20.019 -1.551 569 HZ3 LYS 80 HZ3 LYS 80 14.664 19.555 -3.177 570 H LEU 81 HN LEU 81 13.782 14.727 3.605 571 HA LEU 81 HA LEU 81 11.663 15.496 5.470 572 HG LEU 81 HG LEU 81 10.914 13.578 3.266 573 HB2 LEU 81 HB2 LEU 81 12.525 12.647 5.034 574 HB3 LEU 81 HB1 LEU 81 11.365 13.217 6.209 575 HD11 LEU 81 HD11 LEU 81 10.031 11.291 5.018 576 HD12 LEU 81 HD12 LEU 81 11.214 11.193 3.716 577 HD13 LEU 81 HD13 LEU 81 9.530 11.569 3.348 578 HD21 LEU 81 HD21 LEU 81 8.596 13.812 3.997 579 HD22 LEU 81 HD22 LEU 81 9.634 14.983 4.810 580 HD23 LEU 81 HD23 LEU 81 9.090 13.542 5.669 581 HA PRO 82 HA PRO 82 15.009 14.989 8.474 582 HB2 PRO 82 HB2 PRO 82 13.558 14.852 10.716 583 HB3 PRO 82 HB1 PRO 82 13.667 16.373 9.805 584 HG2 PRO 82 HG2 PRO 82 11.476 14.324 9.816 585 HG3 PRO 82 HG1 PRO 82 11.355 16.086 9.878 586 HD2 PRO 82 HD2 PRO 82 11.032 14.609 7.609 587 HD3 PRO 82 HD1 PRO 82 11.569 16.306 7.619 588 H ASN 83 HN ASN 83 15.609 13.343 10.162 589 HA ASN 83 HA ASN 83 15.260 10.716 9.168 590 HB2 ASN 83 HB2 ASN 83 16.453 11.836 11.682 591 HB3 ASN 83 HB1 ASN 83 16.302 10.096 11.459 592 HD21 ASN 83 HD21 ASN 83 16.826 12.075 8.658 593 HD22 ASN 83 HD22 ASN 83 18.496 11.681 8.441 594 H THR 84 HN THR 84 13.379 12.583 11.313 595 HA THR 84 HA THR 84 12.098 10.581 12.808 596 HB THR 84 HB THR 84 10.676 13.077 11.919 597 HG1 THR 84 HG1 THR 84 12.609 13.045 14.020 598 HG21 THR 84 HG21 THR 84 10.856 11.612 14.560 599 HG22 THR 84 HG22 THR 84 9.514 11.526 13.421 600 HG23 THR 84 HG23 THR 84 9.874 13.044 14.241 601 H VAL 85 HN VAL 85 10.692 12.415 10.096 602 HA VAL 85 HA VAL 85 8.560 10.657 9.588 603 HB VAL 85 HB VAL 85 9.864 12.535 7.607 604 HG11 VAL 85 HG11 VAL 85 8.300 10.931 6.625 605 HG12 VAL 85 HG12 VAL 85 7.657 12.572 6.568 606 HG13 VAL 85 HG13 VAL 85 7.061 11.432 7.775 607 HG21 VAL 85 HG21 VAL 85 8.186 14.181 8.359 608 HG22 VAL 85 HG22 VAL 85 9.315 13.746 9.644 609 HG23 VAL 85 HG23 VAL 85 7.689 13.068 9.634 610 H LEU 86 HN LEU 86 11.739 10.979 8.112 611 HA LEU 86 HA LEU 86 11.568 9.113 6.081 612 HG LEU 86 HG LEU 86 14.240 7.803 6.314 613 HB2 LEU 86 HB2 LEU 86 13.401 10.674 6.396 614 HB3 LEU 86 HB1 LEU 86 13.908 9.820 7.855 615 HD11 LEU 86 HD11 LEU 86 14.109 10.022 4.290 616 HD12 LEU 86 HD12 LEU 86 13.023 8.637 4.408 617 HD13 LEU 86 HD13 LEU 86 14.719 8.398 3.985 618 HD21 LEU 86 HD21 LEU 86 16.468 8.590 5.683 619 HD22 LEU 86 HD22 LEU 86 16.050 9.051 7.336 620 HD23 LEU 86 HD23 LEU 86 15.972 10.244 6.042 621 H GLY 87 HN GLY 87 12.704 8.650 9.420 622 HA2 GLY 87 HA2 GLY 87 13.324 5.932 9.209 623 HA3 GLY 87 HA1 GLY 87 12.938 6.771 10.707 624 H LYS 88 HN LYS 88 10.286 7.531 10.157 625 HA LYS 88 HA LYS 88 9.112 4.957 10.618 626 HB2 LYS 88 HB2 LYS 88 7.098 6.057 11.267 627 HB3 LYS 88 HB1 LYS 88 8.454 6.889 11.997 628 HG2 LYS 88 HG2 LYS 88 8.234 8.728 10.524 629 HG3 LYS 88 HG1 LYS 88 7.097 7.842 9.501 630 HD2 LYS 88 HD2 LYS 88 5.474 7.794 11.311 631 HD3 LYS 88 HD1 LYS 88 6.615 8.604 12.381 632 HE2 LYS 88 HE2 LYS 88 6.528 10.604 11.041 633 HE3 LYS 88 HE1 LYS 88 5.528 9.797 9.831 634 HZ1 LYS 88 HZ1 LYS 88 3.717 9.693 11.313 635 HZ2 LYS 88 HZ2 LYS 88 4.315 11.271 11.463 636 HZ3 LYS 88 HZ3 LYS 88 4.667 10.113 12.653 637 H ILE 89 HN ILE 89 9.465 6.981 7.868 638 HA ILE 89 HA ILE 89 7.295 5.820 6.404 639 HB ILE 89 HB ILE 89 9.808 7.216 5.491 640 HG12 ILE 89 HG12 ILE 89 6.880 7.940 5.519 641 HG13 ILE 89 HG11 ILE 89 8.186 8.712 6.410 642 HG21 ILE 89 HG21 ILE 89 7.611 6.129 3.739 643 HG22 ILE 89 HG22 ILE 89 9.263 5.517 3.832 644 HG23 ILE 89 HG23 ILE 89 8.959 7.138 3.211 645 HD11 ILE 89 HD11 ILE 89 7.481 10.079 4.543 646 HD12 ILE 89 HD12 ILE 89 7.823 8.758 3.424 647 HD13 ILE 89 HD13 ILE 89 9.139 9.519 4.318 648 H TRP 90 HN TRP 90 10.774 5.182 6.660 649 HA TRP 90 HA TRP 90 10.915 2.933 5.026 650 HD1 TRP 90 HD1 TRP 90 13.161 1.080 8.351 651 HE1 TRP 90 HE1 TRP 90 14.463 -0.851 7.233 652 HE3 TRP 90 HE3 TRP 90 13.239 2.831 3.539 653 HZ2 TRP 90 HZ2 TRP 90 15.402 -1.522 4.663 654 HZ3 TRP 90 HZ3 TRP 90 14.371 1.484 1.826 655 HH2 TRP 90 HH2 TRP 90 15.423 -0.646 2.368 656 HB2 TRP 90 HB2 TRP 90 12.904 3.987 5.994 657 HB3 TRP 90 HB1 TRP 90 12.419 3.452 7.591 658 H LYS 91 HN LYS 91 10.286 3.040 8.534 659 HA LYS 91 HA LYS 91 10.013 0.211 8.720 660 HB2 LYS 91 HB2 LYS 91 9.477 0.572 11.034 661 HB3 LYS 91 HB1 LYS 91 10.813 1.611 10.572 662 HG2 LYS 91 HG2 LYS 91 9.263 3.503 10.379 663 HG3 LYS 91 HG1 LYS 91 7.948 2.456 10.911 664 HD2 LYS 91 HD2 LYS 91 8.600 3.568 12.859 665 HD3 LYS 91 HD1 LYS 91 9.407 2.004 12.973 666 HE2 LYS 91 HE2 LYS 91 10.774 4.424 11.828 667 HE3 LYS 91 HE1 LYS 91 10.780 4.083 13.555 668 HZ1 LYS 91 HZ1 LYS 91 12.768 3.247 12.483 669 HZ2 LYS 91 HZ2 LYS 91 11.847 2.297 11.429 670 HZ3 LYS 91 HZ3 LYS 91 11.848 1.958 13.087 671 H LEU 92 HN LEU 92 7.822 2.668 7.787 672 HA LEU 92 HA LEU 92 5.517 0.994 8.410 673 HG LEU 92 HG LEU 92 3.304 2.232 7.133 674 HB2 LEU 92 HB2 LEU 92 5.593 3.560 8.592 675 HB3 LEU 92 HB1 LEU 92 5.436 3.552 6.835 676 HD11 LEU 92 HD11 LEU 92 3.636 3.049 10.013 677 HD12 LEU 92 HD12 LEU 92 3.817 1.402 9.397 678 HD13 LEU 92 HD13 LEU 92 2.253 2.218 9.304 679 HD21 LEU 92 HD21 LEU 92 3.433 4.962 8.414 680 HD22 LEU 92 HD22 LEU 92 1.968 4.176 7.826 681 HD23 LEU 92 HD23 LEU 92 3.244 4.628 6.693 682 H ALA 93 HN ALA 93 7.644 1.733 5.772 683 HA ALA 93 HA ALA 93 5.823 0.690 3.755 684 HB1 ALA 93 HB1 ALA 93 7.257 2.611 3.226 685 HB2 ALA 93 HB2 ALA 93 7.588 1.239 2.169 686 HB3 ALA 93 HB3 ALA 93 8.686 1.612 3.497 687 H ASP 94 HN ASP 94 8.885 -0.230 5.306 688 HA ASP 94 HA ASP 94 8.845 -2.783 3.882 689 HB2 ASP 94 HB2 ASP 94 10.992 -1.495 4.168 690 HB3 ASP 94 HB1 ASP 94 10.892 -1.820 5.891 691 H VAL 95 HN VAL 95 7.492 -4.191 4.707 692 HA VAL 95 HA VAL 95 6.679 -4.148 7.428 693 HB VAL 95 HB VAL 95 6.166 -6.323 5.406 694 HG11 VAL 95 HG11 VAL 95 5.615 -7.002 7.656 695 HG12 VAL 95 HG12 VAL 95 4.129 -6.719 6.749 696 HG13 VAL 95 HG13 VAL 95 4.695 -5.519 7.912 697 HG21 VAL 95 HG21 VAL 95 4.077 -5.135 4.889 698 HG22 VAL 95 HG22 VAL 95 5.501 -4.178 4.478 699 HG23 VAL 95 HG23 VAL 95 4.585 -3.810 5.939 700 H ASP 96 HN ASP 96 9.080 -5.867 5.650 701 HA ASP 96 HA ASP 96 9.468 -7.834 7.760 702 HB2 ASP 96 HB2 ASP 96 11.519 -7.465 5.687 703 HB3 ASP 96 HB1 ASP 96 10.775 -8.965 6.265 704 H LYS 97 HN LYS 97 10.704 -4.816 6.645 705 HA LYS 97 HA LYS 97 12.290 -3.375 7.341 706 HB2 LYS 97 HB2 LYS 97 12.183 -4.931 9.937 707 HB3 LYS 97 HB1 LYS 97 12.786 -3.287 9.720 708 HG2 LYS 97 HG2 LYS 97 10.562 -2.557 9.049 709 HG3 LYS 97 HG1 LYS 97 9.953 -4.192 9.242 710 HD2 LYS 97 HD2 LYS 97 10.635 -4.056 11.657 711 HD3 LYS 97 HD1 LYS 97 10.970 -2.341 11.388 712 HE2 LYS 97 HE2 LYS 97 8.657 -2.000 10.666 713 HE3 LYS 97 HE1 LYS 97 8.320 -3.711 10.927 714 HZ1 LYS 97 HZ1 LYS 97 9.080 -3.222 13.321 715 HZ2 LYS 97 HZ2 LYS 97 7.542 -2.708 12.840 716 HZ3 LYS 97 HZ3 LYS 97 8.815 -1.594 12.923 717 H ASP 98 HN ASP 98 13.344 -4.785 5.685 718 HA ASP 98 HA ASP 98 15.216 -6.796 6.592 719 HB2 ASP 98 HB2 ASP 98 14.895 -5.704 3.792 720 HB3 ASP 98 HB1 ASP 98 15.606 -7.244 4.269 721 H GLY 99 HN GLY 99 15.287 -3.495 5.498 722 HA2 GLY 99 HA2 GLY 99 17.209 -2.090 5.422 723 HA3 GLY 99 HA1 GLY 99 18.225 -3.531 5.460 724 H LEU 100 HN LEU 100 15.546 -3.789 3.458 725 HA LEU 100 HA LEU 100 16.662 -2.557 1.109 726 HG LEU 100 HG LEU 100 16.108 -5.976 2.411 727 HB2 LEU 100 HB2 LEU 100 16.552 -4.644 -0.238 728 HB3 LEU 100 HB1 LEU 100 17.819 -4.654 0.968 729 HD11 LEU 100 HD11 LEU 100 14.165 -5.684 1.014 730 HD12 LEU 100 HD12 LEU 100 14.613 -7.391 1.042 731 HD13 LEU 100 HD13 LEU 100 15.005 -6.394 -0.364 732 HD21 LEU 100 HD21 LEU 100 17.448 -7.190 0.002 733 HD22 LEU 100 HD22 LEU 100 16.922 -8.064 1.441 734 HD23 LEU 100 HD23 LEU 100 18.205 -6.861 1.561 735 H LEU 101 HN LEU 101 14.968 -3.339 -0.826 736 HA LEU 101 HA LEU 101 12.278 -3.447 0.188 737 HG LEU 101 HG LEU 101 13.355 -0.770 1.308 738 HB2 LEU 101 HB2 LEU 101 13.364 -0.956 -1.136 739 HB3 LEU 101 HB1 LEU 101 11.653 -1.351 -1.127 740 HD11 LEU 101 HD11 LEU 101 12.799 1.178 -0.125 741 HD12 LEU 101 HD12 LEU 101 12.052 1.253 1.471 742 HD13 LEU 101 HD13 LEU 101 11.089 0.790 0.066 743 HD21 LEU 101 HD21 LEU 101 10.425 -1.417 1.047 744 HD22 LEU 101 HD22 LEU 101 11.201 -0.807 2.503 745 HD23 LEU 101 HD23 LEU 101 11.651 -2.389 1.861 746 H ASP 102 HN ASP 102 11.333 -4.780 -1.276 747 HA ASP 102 HA ASP 102 12.651 -5.120 -3.813 748 HB2 ASP 102 HB2 ASP 102 11.182 -6.951 -4.189 749 HB3 ASP 102 HB1 ASP 102 11.807 -7.058 -2.557 750 H ASP 103 HN ASP 103 10.678 -5.558 -5.654 751 HA ASP 103 HA ASP 103 10.287 -2.926 -6.550 752 HB2 ASP 103 HB2 ASP 103 8.782 -3.980 -8.273 753 HB3 ASP 103 HB1 ASP 103 10.415 -4.665 -8.170 754 H GLU 104 HN GLU 104 8.195 -5.029 -4.674 755 HA GLU 104 HA GLU 104 5.931 -3.212 -4.971 756 HB2 GLU 104 HB2 GLU 104 5.784 -5.776 -4.769 757 HB3 GLU 104 HB1 GLU 104 6.090 -5.519 -3.054 758 HG2 GLU 104 HG2 GLU 104 3.812 -5.535 -3.097 759 HG3 GLU 104 HG1 GLU 104 4.152 -3.804 -3.249 760 H GLU 105 HN GLU 105 8.493 -3.964 -2.744 761 HA GLU 105 HA GLU 105 7.356 -2.514 -0.559 762 HB2 GLU 105 HB2 GLU 105 9.674 -4.149 -1.002 763 HB3 GLU 105 HB1 GLU 105 10.145 -2.651 -0.217 764 HG2 GLU 105 HG2 GLU 105 8.937 -3.076 1.670 765 HG3 GLU 105 HG1 GLU 105 7.738 -4.040 0.815 766 H PHE 106 HN PHE 106 9.434 -1.716 -3.258 767 HA PHE 106 HA PHE 106 9.868 0.994 -2.429 768 HD1 PHE 106 HD2 PHE 106 9.164 2.846 -4.223 769 HD2 PHE 106 HD1 PHE 106 12.658 0.989 -5.739 770 HE1 PHE 106 HE2 PHE 106 9.992 5.021 -5.014 771 HE2 PHE 106 HE1 PHE 106 13.481 3.142 -6.525 772 HZ PHE 106 HZ PHE 106 12.153 5.172 -6.149 773 HB2 PHE 106 HB2 PHE 106 11.245 -0.203 -4.191 774 HB3 PHE 106 HB1 PHE 106 9.860 -0.100 -5.262 775 H ALA 107 HN ALA 107 7.438 -0.814 -4.221 776 HA ALA 107 HA ALA 107 5.942 1.311 -5.235 777 HB1 ALA 107 HB1 ALA 107 5.570 -1.038 -5.821 778 HB2 ALA 107 HB2 ALA 107 4.081 -0.244 -5.309 779 HB3 ALA 107 HB3 ALA 107 4.929 -1.331 -4.205 780 H LEU 108 HN LEU 108 5.727 -0.336 -2.102 781 HA LEU 108 HA LEU 108 3.700 1.373 -1.069 782 HG LEU 108 HG LEU 108 2.677 0.238 0.857 783 HB2 LEU 108 HB2 LEU 108 4.502 -0.990 -0.301 784 HB3 LEU 108 HB1 LEU 108 5.674 -0.086 0.652 785 HD11 LEU 108 HD11 LEU 108 3.372 -1.945 1.597 786 HD12 LEU 108 HD12 LEU 108 2.905 -0.941 2.970 787 HD13 LEU 108 HD13 LEU 108 4.611 -1.225 2.623 788 HD21 LEU 108 HD21 LEU 108 3.189 1.430 2.931 789 HD22 LEU 108 HD22 LEU 108 3.863 2.244 1.520 790 HD23 LEU 108 HD23 LEU 108 4.911 1.298 2.577 791 H ALA 109 HN ALA 109 7.232 1.228 -0.616 792 HA ALA 109 HA ALA 109 7.678 3.249 1.172 793 HB1 ALA 109 HB1 ALA 109 9.846 3.585 0.115 794 HB2 ALA 109 HB2 ALA 109 9.298 2.693 -1.305 795 HB3 ALA 109 HB3 ALA 109 9.454 1.871 0.247 796 H ASN 110 HN ASN 110 7.526 3.660 -2.357 797 HA ASN 110 HA ASN 110 7.700 6.497 -2.215 798 HB2 ASN 110 HB2 ASN 110 8.462 5.023 -4.137 799 HB3 ASN 110 HB1 ASN 110 6.767 4.914 -4.600 800 HD21 ASN 110 HD21 ASN 110 9.557 6.949 -4.395 801 HD22 ASN 110 HD22 ASN 110 8.925 8.263 -5.319 802 H HIS 111 HN HIS 111 5.101 4.177 -2.085 803 HA HIS 111 HA HIS 111 3.063 5.942 -3.044 804 HD1 HIS 111 HD1 HIS 111 1.000 4.747 -4.382 805 HD2 HIS 111 HD2 HIS 111 0.089 4.044 -0.385 806 HE1 HIS 111 HE1 HIS 111 -1.495 5.007 -4.201 807 HE2 HIS 111 HE2 HIS 111 -1.994 4.808 -1.735 808 HB2 HIS 111 HB2 HIS 111 2.863 3.417 -2.910 809 HB3 HIS 111 HB1 HIS 111 2.670 3.609 -1.167 810 H LEU 112 HN LEU 112 4.321 5.062 0.140 811 HA LEU 112 HA LEU 112 2.542 6.801 1.549 812 HG LEU 112 HG LEU 112 3.073 3.887 2.260 813 HB2 LEU 112 HB2 LEU 112 5.049 5.324 2.325 814 HB3 LEU 112 HB1 LEU 112 4.241 6.429 3.434 815 HD11 LEU 112 HD11 LEU 112 3.073 3.138 4.576 816 HD12 LEU 112 HD12 LEU 112 3.812 4.658 5.081 817 HD13 LEU 112 HD13 LEU 112 4.704 3.547 4.043 818 HD21 LEU 112 HD21 LEU 112 1.809 5.896 4.127 819 HD22 LEU 112 HD22 LEU 112 1.117 4.352 3.627 820 HD23 LEU 112 HD23 LEU 112 1.365 5.631 2.439 821 H ILE 113 HN ILE 113 5.707 7.129 0.089 822 HA ILE 113 HA ILE 113 6.413 9.628 1.115 823 HB ILE 113 HB ILE 113 6.961 8.385 -1.574 824 HG12 ILE 113 HG12 ILE 113 8.700 8.829 0.866 825 HG13 ILE 113 HG11 ILE 113 7.955 7.304 0.404 826 HG21 ILE 113 HG21 ILE 113 8.142 10.924 -0.438 827 HG22 ILE 113 HG22 ILE 113 7.059 10.814 -1.829 828 HG23 ILE 113 HG23 ILE 113 8.672 10.106 -1.908 829 HD11 ILE 113 HD11 ILE 113 9.311 7.234 -1.606 830 HD12 ILE 113 HD12 ILE 113 10.326 7.394 -0.177 831 HD13 ILE 113 HD13 ILE 113 10.022 8.795 -1.204 832 H LYS 114 HN LYS 114 4.440 8.839 -1.780 833 HA LYS 114 HA LYS 114 3.805 11.613 -2.138 834 HB2 LYS 114 HB2 LYS 114 2.079 10.833 -3.771 835 HB3 LYS 114 HB1 LYS 114 3.719 10.320 -4.118 836 HG2 LYS 114 HG2 LYS 114 3.237 8.097 -3.326 837 HG3 LYS 114 HG1 LYS 114 1.619 8.596 -2.826 838 HD2 LYS 114 HD2 LYS 114 1.588 7.411 -4.981 839 HD3 LYS 114 HD1 LYS 114 1.025 9.074 -5.139 840 HE2 LYS 114 HE2 LYS 114 3.298 9.713 -5.922 841 HE3 LYS 114 HE1 LYS 114 3.754 8.012 -5.871 842 HZ1 LYS 114 HZ1 LYS 114 2.015 7.539 -7.507 843 HZ2 LYS 114 HZ2 LYS 114 3.128 8.665 -8.103 844 HZ3 LYS 114 HZ3 LYS 114 1.610 9.185 -7.572 845 H VAL 115 HN VAL 115 2.479 9.115 -0.168 846 HA VAL 115 HA VAL 115 -0.040 10.340 0.361 847 HB VAL 115 HB VAL 115 1.599 8.353 1.935 848 HG11 VAL 115 HG11 VAL 115 0.334 9.719 3.530 849 HG12 VAL 115 HG12 VAL 115 -0.301 8.077 3.441 850 HG13 VAL 115 HG13 VAL 115 -1.149 9.394 2.630 851 HG21 VAL 115 HG21 VAL 115 0.570 7.472 -0.067 852 HG22 VAL 115 HG22 VAL 115 -0.990 8.151 0.397 853 HG23 VAL 115 HG23 VAL 115 -0.277 6.847 1.346 854 H LYS 116 HN LYS 116 3.136 10.568 1.990 855 HA LYS 116 HA LYS 116 2.221 12.505 3.872 856 HB2 LYS 116 HB2 LYS 116 4.536 12.943 4.373 857 HB3 LYS 116 HB1 LYS 116 4.333 11.206 4.174 858 HG2 LYS 116 HG2 LYS 116 5.399 11.190 2.117 859 HG3 LYS 116 HG1 LYS 116 5.200 12.925 1.895 860 HD2 LYS 116 HD2 LYS 116 6.752 13.244 3.833 861 HD3 LYS 116 HD1 LYS 116 7.088 11.507 3.762 862 HE2 LYS 116 HE2 LYS 116 8.780 12.532 2.463 863 HE3 LYS 116 HE1 LYS 116 7.622 11.879 1.302 864 HZ1 LYS 116 HZ1 LYS 116 8.340 14.157 0.761 865 HZ2 LYS 116 HZ2 LYS 116 7.675 14.709 2.219 866 HZ3 LYS 116 HZ3 LYS 116 6.672 14.060 1.025 867 H LEU 117 HN LEU 117 3.276 12.588 0.587 868 HA LEU 117 HA LEU 117 3.870 15.360 0.405 869 HG LEU 117 HG LEU 117 4.465 16.094 -1.819 870 HB2 LEU 117 HB2 LEU 117 4.632 13.521 -1.143 871 HB3 LEU 117 HB1 LEU 117 2.999 13.494 -1.802 872 HD11 LEU 117 HD11 LEU 117 5.574 15.505 -3.913 873 HD12 LEU 117 HD12 LEU 117 5.008 13.843 -3.754 874 HD13 LEU 117 HD13 LEU 117 6.153 14.501 -2.584 875 HD21 LEU 117 HD21 LEU 117 2.631 14.712 -3.780 876 HD22 LEU 117 HD22 LEU 117 3.253 16.356 -3.922 877 HD23 LEU 117 HD23 LEU 117 2.151 15.939 -2.609 878 H GLU 118 HN GLU 118 0.981 13.483 0.315 879 HA GLU 118 HA GLU 118 -0.817 15.230 -0.904 880 HB2 GLU 118 HB2 GLU 118 -1.181 13.257 1.348 881 HB3 GLU 118 HB1 GLU 118 -2.517 14.108 0.587 882 HG2 GLU 118 HG2 GLU 118 -0.622 12.550 -1.104 883 HG3 GLU 118 HG1 GLU 118 -1.866 11.704 -0.172 884 H GLY 119 HN GLY 119 0.948 15.648 1.957 885 HA2 GLY 119 HA2 GLY 119 0.987 17.846 2.937 886 HA3 GLY 119 HA1 GLY 119 -0.743 17.957 2.649 887 H HIS 120 HN HIS 120 0.097 14.899 3.706 888 HA HIS 120 HA HIS 120 -0.189 15.607 6.527 889 HD1 HIS 120 HD1 HIS 120 -2.111 11.966 7.375 890 HD2 HIS 120 HD2 HIS 120 -1.889 12.760 3.291 891 HE1 HIS 120 HE1 HIS 120 -2.374 9.748 6.237 892 HE2 HIS 120 HE2 HIS 120 -2.522 10.297 3.775 893 HB2 HIS 120 HB2 HIS 120 -2.096 14.391 6.908 894 HB3 HIS 120 HB1 HIS 120 -2.416 14.905 5.259 895 H GLU 121 HN GLU 121 1.007 14.385 7.852 896 HA GLU 121 HA GLU 121 2.995 12.682 6.736 897 HB2 GLU 121 HB2 GLU 121 3.720 12.366 9.077 898 HB3 GLU 121 HB1 GLU 121 3.518 14.061 8.656 899 HG2 GLU 121 HG2 GLU 121 1.467 14.191 9.849 900 HG3 GLU 121 HG1 GLU 121 1.427 12.442 10.081 901 H LEU 122 HN LEU 122 3.453 10.494 7.601 902 HA LEU 122 HA LEU 122 1.173 8.802 7.298 903 HG LEU 122 HG LEU 122 4.223 9.170 6.093 904 HB2 LEU 122 HB2 LEU 122 3.930 8.010 8.214 905 HB3 LEU 122 HB1 LEU 122 2.702 6.968 7.495 906 HD11 LEU 122 HD11 LEU 122 4.268 6.172 5.806 907 HD12 LEU 122 HD12 LEU 122 5.546 7.179 6.487 908 HD13 LEU 122 HD13 LEU 122 5.134 7.313 4.778 909 HD21 LEU 122 HD21 LEU 122 3.055 8.420 4.075 910 HD22 LEU 122 HD22 LEU 122 1.930 9.050 5.278 911 HD23 LEU 122 HD23 LEU 122 2.089 7.309 5.047 912 HA PRO 123 HA PRO 123 0.178 8.717 11.571 913 HB2 PRO 123 HB2 PRO 123 -1.958 7.112 11.433 914 HB3 PRO 123 HB1 PRO 123 -1.944 8.699 10.658 915 HG2 PRO 123 HG2 PRO 123 -1.706 6.000 9.445 916 HG3 PRO 123 HG1 PRO 123 -2.399 7.481 8.768 917 HD2 PRO 123 HD2 PRO 123 0.188 6.415 8.294 918 HD3 PRO 123 HD1 PRO 123 -0.433 7.988 7.756 919 H ALA 124 HN ALA 124 1.971 6.400 10.327 920 HA ALA 124 HA ALA 124 3.075 4.592 11.135 921 HB1 ALA 124 HB1 ALA 124 1.904 5.443 13.788 922 HB2 ALA 124 HB2 ALA 124 3.450 5.964 13.116 923 HB3 ALA 124 HB3 ALA 124 3.210 4.278 13.567 924 H ASP 125 HN ASP 125 0.167 4.469 10.303 925 HA ASP 125 HA ASP 125 -0.476 1.866 11.523 926 HB2 ASP 125 HB2 ASP 125 -2.245 3.605 11.783 927 HB3 ASP 125 HB1 ASP 125 -2.328 3.731 10.025 928 H LEU 126 HN LEU 126 -0.745 0.126 10.197 929 HA LEU 126 HA LEU 126 -0.280 0.568 7.324 930 HG LEU 126 HG LEU 126 2.248 -0.078 6.943 931 HB2 LEU 126 HB2 LEU 126 1.404 -0.747 9.072 932 HB3 LEU 126 HB1 LEU 126 0.480 -2.061 8.365 933 HD11 LEU 126 HD11 LEU 126 3.489 -2.047 6.277 934 HD12 LEU 126 HD12 LEU 126 2.329 -3.086 7.105 935 HD13 LEU 126 HD13 LEU 126 3.346 -1.984 8.034 936 HD21 LEU 126 HD21 LEU 126 1.599 -1.177 4.852 937 HD22 LEU 126 HD22 LEU 126 0.223 -0.386 5.626 938 HD23 LEU 126 HD23 LEU 126 0.406 -2.137 5.731 939 HA PRO 127 HA PRO 127 -4.301 -1.434 7.549 940 HB2 PRO 127 HB2 PRO 127 -4.865 -0.410 4.935 941 HB3 PRO 127 HB1 PRO 127 -5.463 0.182 6.487 942 HG2 PRO 127 HG2 PRO 127 -3.753 1.559 4.826 943 HG3 PRO 127 HG1 PRO 127 -3.919 1.849 6.570 944 HD2 PRO 127 HD2 PRO 127 -1.843 0.287 5.094 945 HD3 PRO 127 HD1 PRO 127 -1.660 1.362 6.493 946 HA PRO 128 HA PRO 128 -3.549 -5.135 5.229 947 HB2 PRO 128 HB2 PRO 128 -6.146 -6.001 4.973 948 HB3 PRO 128 HB1 PRO 128 -5.165 -6.202 6.436 949 HG2 PRO 128 HG2 PRO 128 -7.238 -4.138 5.811 950 HG3 PRO 128 HG1 PRO 128 -6.944 -5.009 7.325 951 HD2 PRO 128 HD2 PRO 128 -6.127 -2.472 6.951 952 HD3 PRO 128 HD1 PRO 128 -5.189 -3.623 7.923 953 H HIS 129 HN HIS 129 -5.472 -2.538 4.040 954 HA HIS 129 HA HIS 129 -5.522 -3.707 1.355 955 HD1 HIS 129 HD1 HIS 129 -7.904 -1.466 4.294 956 HD2 HIS 129 HD2 HIS 129 -6.065 0.832 1.346 957 HE1 HIS 129 HE1 HIS 129 -7.826 0.881 5.201 958 HE2 HIS 129 HE2 HIS 129 -6.995 2.275 3.276 959 HB2 HIS 129 HB2 HIS 129 -6.911 -1.766 0.713 960 HB3 HIS 129 HB1 HIS 129 -7.622 -2.674 2.028 961 H LEU 130 HN LEU 130 -3.097 -2.710 2.837 962 HA LEU 130 HA LEU 130 -2.012 -1.268 0.549 963 HG LEU 130 HG LEU 130 -1.001 0.741 0.532 964 HB2 LEU 130 HB2 LEU 130 -2.850 0.228 2.538 965 HB3 LEU 130 HB1 LEU 130 -1.311 -0.226 3.237 966 HD11 LEU 130 HD11 LEU 130 -1.547 3.068 0.974 967 HD12 LEU 130 HD12 LEU 130 -2.200 2.628 2.552 968 HD13 LEU 130 HD13 LEU 130 -2.988 2.055 1.080 969 HD21 LEU 130 HD21 LEU 130 0.049 1.697 3.187 970 HD22 LEU 130 HD22 LEU 130 0.664 2.162 1.600 971 HD23 LEU 130 HD23 LEU 130 0.809 0.492 2.148 972 H VAL 131 HN VAL 131 -1.823 -3.850 2.310 973 HA VAL 131 HA VAL 131 1.045 -3.808 2.810 974 HB VAL 131 HB VAL 131 0.734 -6.131 3.675 975 HG11 VAL 131 HG11 VAL 131 0.726 -4.250 5.198 976 HG12 VAL 131 HG12 VAL 131 -0.428 -5.469 5.738 977 HG13 VAL 131 HG13 VAL 131 -1.000 -4.007 4.934 978 HG21 VAL 131 HG21 VAL 131 -1.519 -6.962 4.111 979 HG22 VAL 131 HG22 VAL 131 -1.243 -6.752 2.382 980 HG23 VAL 131 HG23 VAL 131 -2.206 -5.573 3.271 981 HA PRO 132 HA PRO 132 1.968 -5.285 -1.263 982 HB2 PRO 132 HB2 PRO 132 4.300 -6.507 0.141 983 HB3 PRO 132 HB1 PRO 132 4.270 -5.453 -1.276 984 HG2 PRO 132 HG2 PRO 132 5.023 -4.542 1.119 985 HG3 PRO 132 HG1 PRO 132 4.105 -3.529 -0.011 986 HD2 PRO 132 HD2 PRO 132 3.200 -4.928 2.461 987 HD3 PRO 132 HD1 PRO 132 2.659 -3.378 1.769 988 HA PRO 133 HA PRO 133 0.210 -9.344 -1.578 989 HB2 PRO 133 HB2 PRO 133 2.686 -9.935 -3.162 990 HB3 PRO 133 HB1 PRO 133 1.000 -10.334 -3.522 991 HG2 PRO 133 HG2 PRO 133 2.206 -8.242 -4.681 992 HG3 PRO 133 HG1 PRO 133 0.493 -8.180 -4.208 993 HD2 PRO 133 HD2 PRO 133 2.832 -6.821 -3.018 994 HD3 PRO 133 HD1 PRO 133 1.113 -6.392 -2.945 995 H SER 134 HN SER 134 3.744 -9.446 -1.122 996 HA SER 134 HA SER 134 3.925 -12.050 -0.133 997 HG SER 134 HG SER 134 6.400 -12.352 0.685 998 HB2 SER 134 HB2 SER 134 5.871 -10.877 -0.920 999 HB3 SER 134 HB1 SER 134 5.675 -9.630 0.307 1000 H LYS 135 HN LYS 135 2.758 -9.223 1.458 1001 HA LYS 135 HA LYS 135 3.003 -10.580 4.050 1002 HB2 LYS 135 HB2 LYS 135 2.963 -8.080 4.924 1003 HB3 LYS 135 HB1 LYS 135 4.454 -8.906 4.509 1004 HG2 LYS 135 HG2 LYS 135 3.033 -7.234 2.473 1005 HG3 LYS 135 HG1 LYS 135 4.065 -6.490 3.700 1006 HD2 LYS 135 HD2 LYS 135 4.901 -8.600 1.706 1007 HD3 LYS 135 HD1 LYS 135 5.318 -6.887 1.650 1008 HE2 LYS 135 HE2 LYS 135 6.511 -7.112 3.776 1009 HE3 LYS 135 HE1 LYS 135 6.105 -8.826 3.824 1010 HZ1 LYS 135 HZ1 LYS 135 7.355 -9.063 1.702 1011 HZ2 LYS 135 HZ2 LYS 135 8.317 -8.592 3.013 1012 HZ3 LYS 135 HZ3 LYS 135 7.853 -7.445 1.848 1013 H ARG 136 HN ARG 136 0.836 -10.692 2.208 1014 HA ARG 136 HA ARG 136 -1.348 -9.130 3.113 1015 HE ARG 136 HE ARG 136 -0.630 -12.588 -1.543 1016 HB2 ARG 136 HB2 ARG 136 -2.681 -10.821 1.890 1017 HB3 ARG 136 HB1 ARG 136 -1.336 -10.218 0.939 1018 HG2 ARG 136 HG2 ARG 136 -0.050 -12.232 1.526 1019 HG3 ARG 136 HG1 ARG 136 -1.458 -12.848 2.389 1020 HD2 ARG 136 HD2 ARG 136 -2.203 -13.716 0.489 1021 HD3 ARG 136 HD1 ARG 136 -2.338 -12.081 -0.161 1022 HH11 ARG 136 HH11 ARG 136 -0.212 -14.556 1.368 1023 HH12 ARG 136 HH12 ARG 136 1.247 -15.304 0.776 1024 HH21 ARG 136 HH21 ARG 136 1.256 -13.598 -2.283 1025 HH22 ARG 136 HH22 ARG 136 2.055 -14.774 -1.290 1026 H ARG 137 HN ARG 137 -1.064 -9.291 5.450 1027 HA ARG 137 HA ARG 137 -2.475 -11.491 6.647 1028 HE ARG 137 HE ARG 137 2.206 -12.741 8.296 1029 HB2 ARG 137 HB2 ARG 137 -0.425 -12.029 8.132 1030 HB3 ARG 137 HB1 ARG 137 -0.494 -12.712 6.514 1031 HG2 ARG 137 HG2 ARG 137 0.812 -10.432 5.975 1032 HG3 ARG 137 HG1 ARG 137 1.334 -10.691 7.640 1033 HD2 ARG 137 HD2 ARG 137 1.438 -12.868 5.585 1034 HD3 ARG 137 HD1 ARG 137 2.756 -11.714 5.765 1035 HH11 ARG 137 HH11 ARG 137 3.311 -13.914 5.192 1036 HH12 ARG 137 HH12 ARG 137 4.251 -15.209 5.861 1037 HH21 ARG 137 HH21 ARG 137 3.443 -14.415 9.198 1038 HH22 ARG 137 HH22 ARG 137 4.338 -15.487 8.164 1039 H HIS 138 HN HIS 138 -3.430 -10.862 8.481 1040 HA HIS 138 HA HIS 138 -2.475 -8.396 9.776 1041 HD1 HIS 138 HD1 HIS 138 -5.781 -9.171 12.452 1042 HD2 HIS 138 HD2 HIS 138 -4.124 -5.945 10.402 1043 HE1 HIS 138 HE1 HIS 138 -5.993 -7.195 13.995 1044 HE2 HIS 138 HE2 HIS 138 -4.893 -5.273 12.783 1045 HB2 HIS 138 HB2 HIS 138 -4.847 -8.388 8.992 1046 HB3 HIS 138 HB1 HIS 138 -5.175 -9.738 10.075 1047 H GLU 139 HN GLU 139 -1.087 -8.909 11.339 1048 HA GLU 139 HA GLU 139 -1.795 -11.101 13.164 1049 HB2 GLU 139 HB2 GLU 139 0.942 -10.185 12.252 1050 HB3 GLU 139 HB1 GLU 139 0.665 -11.360 13.532 1051 HG2 GLU 139 HG2 GLU 139 -0.304 -12.911 12.016 1052 HG3 GLU 139 HG1 GLU 139 -0.343 -11.715 10.722 Start of MODEL 2 1 H1 GLY 1 HT1 GLY 1 -25.804 33.727 18.091 2 H2 GLY 1 HT2 GLY 1 -27.310 33.961 18.834 3 H3 GLY 1 HT3 GLY 1 -27.155 34.136 17.163 4 HA2 GLY 1 HA1 GLY 1 -26.754 31.605 18.647 5 HA3 GLY 1 HA2 GLY 1 -28.220 32.034 17.785 6 HA PRO 2 HA PRO 2 -26.857 30.289 14.022 7 HB2 PRO 2 HB2 PRO 2 -27.131 32.873 12.584 8 HB3 PRO 2 HB1 PRO 2 -27.921 31.322 12.279 9 HG2 PRO 2 HG2 PRO 2 -29.272 33.338 13.371 10 HG3 PRO 2 HG1 PRO 2 -29.529 31.666 13.912 11 HD2 PRO 2 HD2 PRO 2 -27.945 33.858 15.205 12 HD3 PRO 2 HD1 PRO 2 -29.025 32.661 15.949 13 H LEU 3 HN LEU 3 -25.498 33.602 14.132 14 HA LEU 3 HA LEU 3 -23.271 32.953 12.529 15 HG LEU 3 HG LEU 3 -24.915 35.158 14.944 16 HB2 LEU 3 HB2 LEU 3 -22.322 35.122 13.440 17 HB3 LEU 3 HB1 LEU 3 -23.839 35.216 12.575 18 HD11 LEU 3 HD11 LEU 3 -22.132 36.109 15.592 19 HD12 LEU 3 HD12 LEU 3 -22.894 34.634 16.186 20 HD13 LEU 3 HD13 LEU 3 -23.531 36.208 16.661 21 HD21 LEU 3 HD21 LEU 3 -25.031 37.029 13.406 22 HD22 LEU 3 HD22 LEU 3 -23.419 37.551 13.892 23 HD23 LEU 3 HD23 LEU 3 -24.749 37.602 15.049 24 H GLY 4 HN GLY 4 -21.134 32.588 13.047 25 HA2 GLY 4 HA2 GLY 4 -19.419 32.095 14.708 26 HA3 GLY 4 HA1 GLY 4 -20.712 31.578 15.791 27 H SER 5 HN SER 5 -22.162 30.279 13.625 28 HA SER 5 HA SER 5 -20.687 27.775 13.557 29 HG SER 5 HG SER 5 -23.471 28.798 14.716 30 HB2 SER 5 HB2 SER 5 -23.483 28.373 12.535 31 HB3 SER 5 HB1 SER 5 -22.786 26.784 12.851 32 H GLU 6 HN GLU 6 -19.367 27.383 11.890 33 HA GLU 6 HA GLU 6 -19.685 28.906 9.444 34 HB2 GLU 6 HB2 GLU 6 -17.487 27.121 10.464 35 HB3 GLU 6 HB1 GLU 6 -17.467 27.840 8.858 36 HG2 GLU 6 HG2 GLU 6 -17.576 29.344 11.462 37 HG3 GLU 6 HG1 GLU 6 -16.155 29.147 10.438 38 H SER 7 HN SER 7 -20.477 28.149 7.608 39 HA SER 7 HA SER 7 -21.235 25.346 7.418 40 HG SER 7 HG SER 7 -23.515 25.788 5.257 41 HB2 SER 7 HB2 SER 7 -22.811 27.130 6.694 42 HB3 SER 7 HB1 SER 7 -21.655 27.628 5.462 43 H LEU 8 HN LEU 8 -19.734 23.963 6.761 44 HA LEU 8 HA LEU 8 -17.567 24.913 5.035 45 HG LEU 8 HG LEU 8 -16.195 22.144 4.771 46 HB2 LEU 8 HB2 LEU 8 -16.972 23.821 7.160 47 HB3 LEU 8 HB1 LEU 8 -17.815 22.375 6.647 48 HD11 LEU 8 HD11 LEU 8 -14.123 23.434 4.852 49 HD12 LEU 8 HD12 LEU 8 -14.778 24.399 6.177 50 HD13 LEU 8 HD13 LEU 8 -15.520 24.475 4.580 51 HD21 LEU 8 HD21 LEU 8 -14.969 22.259 7.524 52 HD22 LEU 8 HD22 LEU 8 -14.359 21.335 6.151 53 HD23 LEU 8 HD23 LEU 8 -15.913 20.919 6.874 54 H MET 9 HN MET 9 -18.069 24.713 2.952 55 HA MET 9 HA MET 9 -19.420 22.305 1.988 56 HB2 MET 9 HB2 MET 9 -18.706 24.899 0.613 57 HB3 MET 9 HB1 MET 9 -19.399 23.519 -0.224 58 HG2 MET 9 HG2 MET 9 -20.689 25.009 2.049 59 HG3 MET 9 HG1 MET 9 -21.073 25.209 0.342 60 HE1 MET 9 HE1 MET 9 -23.657 24.746 0.827 61 HE2 MET 9 HE2 MET 9 -23.254 24.618 2.540 62 HE3 MET 9 HE3 MET 9 -24.230 23.368 1.769 63 HA PRO 10 HA PRO 10 -15.382 20.560 1.273 64 HB2 PRO 10 HB2 PRO 10 -16.943 18.532 -0.202 65 HB3 PRO 10 HB1 PRO 10 -15.837 18.329 1.159 66 HG2 PRO 10 HG2 PRO 10 -18.480 18.089 1.475 67 HG3 PRO 10 HG1 PRO 10 -17.463 18.826 2.729 68 HD2 PRO 10 HD2 PRO 10 -19.244 20.139 0.709 69 HD3 PRO 10 HD1 PRO 10 -18.981 20.548 2.418 70 H SER 11 HN SER 11 -17.803 21.030 -1.248 71 HA SER 11 HA SER 11 -15.629 21.141 -3.224 72 HG SER 11 HG SER 11 -16.402 19.374 -5.289 73 HB2 SER 11 HB2 SER 11 -17.349 19.241 -3.418 74 HB3 SER 11 HB1 SER 11 -18.495 20.490 -3.899 75 H GLN 12 HN GLN 12 -15.235 23.301 -3.139 76 HA GLN 12 HA GLN 12 -17.289 24.987 -4.366 77 HB2 GLN 12 HB2 GLN 12 -17.405 25.453 -1.956 78 HB3 GLN 12 HB1 GLN 12 -15.672 25.744 -1.917 79 HG2 GLN 12 HG2 GLN 12 -15.967 27.682 -3.379 80 HG3 GLN 12 HG1 GLN 12 -17.707 27.393 -3.408 81 HE21 GLN 12 HE21 GLN 12 -14.995 28.366 -1.436 82 HE22 GLN 12 HE22 GLN 12 -15.921 29.117 -0.180 83 H VAL 13 HN VAL 13 -16.207 25.023 -6.303 84 HA VAL 13 HA VAL 13 -13.326 25.486 -6.325 85 HB VAL 13 HB VAL 13 -15.197 24.983 -8.648 86 HG11 VAL 13 HG11 VAL 13 -13.154 24.447 -9.892 87 HG12 VAL 13 HG12 VAL 13 -12.185 24.886 -8.488 88 HG13 VAL 13 HG13 VAL 13 -13.141 26.114 -9.318 89 HG21 VAL 13 HG21 VAL 13 -13.406 23.072 -7.157 90 HG22 VAL 13 HG22 VAL 13 -14.342 22.693 -8.603 91 HG23 VAL 13 HG23 VAL 13 -15.168 23.103 -7.100 92 H VAL 14 HN VAL 14 -12.775 27.553 -6.072 93 HA VAL 14 HA VAL 14 -14.328 29.588 -7.536 94 HB VAL 14 HB VAL 14 -12.656 29.979 -5.051 95 HG11 VAL 14 HG11 VAL 14 -14.441 31.872 -6.575 96 HG12 VAL 14 HG12 VAL 14 -12.687 31.974 -6.409 97 HG13 VAL 14 HG13 VAL 14 -13.722 32.211 -5.000 98 HG21 VAL 14 HG21 VAL 14 -14.835 30.377 -3.942 99 HG22 VAL 14 HG22 VAL 14 -14.633 28.720 -4.507 100 HG23 VAL 14 HG23 VAL 14 -15.644 29.843 -5.415 101 H LYS 15 HN LYS 15 -13.293 30.012 -9.372 102 HA LYS 15 HA LYS 15 -10.539 30.998 -9.125 103 HB2 LYS 15 HB2 LYS 15 -11.734 29.536 -11.498 104 HB3 LYS 15 HB1 LYS 15 -10.179 30.354 -11.514 105 HG2 LYS 15 HG2 LYS 15 -9.599 28.796 -9.535 106 HG3 LYS 15 HG1 LYS 15 -10.979 27.850 -10.093 107 HD2 LYS 15 HD2 LYS 15 -8.597 28.629 -11.777 108 HD3 LYS 15 HD1 LYS 15 -8.856 27.048 -11.042 109 HE2 LYS 15 HE2 LYS 15 -10.850 26.719 -12.379 110 HE3 LYS 15 HE1 LYS 15 -10.689 28.340 -13.058 111 HZ1 LYS 15 HZ1 LYS 15 -8.704 26.151 -13.384 112 HZ2 LYS 15 HZ2 LYS 15 -8.622 27.687 -14.092 113 HZ3 LYS 15 HZ3 LYS 15 -9.842 26.607 -14.549 114 H GLY 16 HN GLY 16 -10.570 33.131 -9.326 115 HA2 GLY 16 HA2 GLY 16 -12.890 34.399 -10.576 116 HA3 GLY 16 HA1 GLY 16 -11.701 35.179 -9.544 117 H GLY 17 HN GLY 17 -12.690 34.547 -12.718 118 HA2 GLY 17 HA2 GLY 17 -12.031 35.611 -14.660 119 HA3 GLY 17 HA1 GLY 17 -10.750 36.401 -13.750 120 H ALA 18 HN ALA 18 -10.650 33.105 -13.220 121 HA ALA 18 HA ALA 18 -8.236 32.918 -14.815 122 HB1 ALA 18 HB1 ALA 18 -8.272 32.179 -12.459 123 HB2 ALA 18 HB2 ALA 18 -7.778 30.903 -13.571 124 HB3 ALA 18 HB3 ALA 18 -9.410 30.906 -12.900 125 H PHE 19 HN PHE 19 -8.585 32.482 -16.896 126 HA PHE 19 HA PHE 19 -10.703 30.724 -17.768 127 HD1 PHE 19 HD2 PHE 19 -12.113 31.734 -19.936 128 HD2 PHE 19 HD1 PHE 19 -9.033 34.379 -18.655 129 HE1 PHE 19 HE2 PHE 19 -13.677 33.629 -20.093 130 HE2 PHE 19 HE1 PHE 19 -10.593 36.274 -18.808 131 HZ PHE 19 HZ PHE 19 -12.917 35.899 -19.532 132 HB2 PHE 19 HB2 PHE 19 -8.507 32.163 -19.260 133 HB3 PHE 19 HB1 PHE 19 -9.691 31.123 -20.049 134 H ASP 20 HN ASP 20 -10.493 28.683 -18.637 135 HA ASP 20 HA ASP 20 -7.863 27.404 -18.239 136 HB2 ASP 20 HB2 ASP 20 -9.909 26.877 -16.638 137 HB3 ASP 20 HB1 ASP 20 -10.398 25.835 -17.970 138 H GLY 21 HN GLY 21 -7.349 25.675 -19.675 139 HA2 GLY 21 HA2 GLY 21 -8.569 26.145 -22.300 140 HA3 GLY 21 HA1 GLY 21 -6.987 25.435 -22.012 141 H THR 22 HN THR 22 -10.063 24.795 -22.983 142 HA THR 22 HA THR 22 -10.224 22.102 -21.900 143 HB THR 22 HB THR 22 -12.307 22.093 -23.493 144 HG1 THR 22 HG1 THR 22 -12.617 23.918 -24.501 145 HG21 THR 22 HG21 THR 22 -13.658 23.135 -21.742 146 HG22 THR 22 HG22 THR 22 -12.209 23.863 -21.044 147 HG23 THR 22 HG23 THR 22 -12.409 22.111 -21.037 148 H MET 23 HN MET 23 -9.064 20.550 -22.830 149 HA MET 23 HA MET 23 -7.850 20.808 -25.371 150 HB2 MET 23 HB2 MET 23 -8.194 18.448 -23.540 151 HB3 MET 23 HB1 MET 23 -7.305 18.354 -25.056 152 HG2 MET 23 HG2 MET 23 -5.860 20.208 -24.224 153 HG3 MET 23 HG1 MET 23 -6.670 20.062 -22.668 154 HE1 MET 23 HE1 MET 23 -3.029 18.546 -22.307 155 HE2 MET 23 HE2 MET 23 -4.166 19.643 -21.533 156 HE3 MET 23 HE3 MET 23 -3.620 19.949 -23.183 157 H ASN 24 HN ASN 24 -8.525 20.302 -27.345 158 HA ASN 24 HA ASN 24 -10.846 18.515 -27.613 159 HB2 ASN 24 HB2 ASN 24 -11.419 19.692 -29.697 160 HB3 ASN 24 HB1 ASN 24 -11.401 20.803 -28.330 161 HD21 ASN 24 HD21 ASN 24 -9.954 19.935 -31.328 162 HD22 ASN 24 HD22 ASN 24 -8.893 21.290 -31.455 163 H GLY 25 HN GLY 25 -10.701 16.840 -29.052 164 HA2 GLY 25 HA2 GLY 25 -9.545 15.932 -31.059 165 HA3 GLY 25 HA1 GLY 25 -8.053 16.496 -30.333 166 HA PRO 26 HA PRO 26 -8.109 12.635 -27.825 167 HB2 PRO 26 HB2 PRO 26 -9.271 13.671 -25.326 168 HB3 PRO 26 HB1 PRO 26 -7.687 12.940 -25.602 169 HG2 PRO 26 HG2 PRO 26 -7.956 15.557 -25.092 170 HG3 PRO 26 HG1 PRO 26 -6.719 14.952 -26.211 171 HD2 PRO 26 HD2 PRO 26 -9.378 16.198 -26.816 172 HD3 PRO 26 HD1 PRO 26 -7.803 16.467 -27.595 173 H PHE 27 HN PHE 27 -9.542 11.092 -28.275 174 HA PHE 27 HA PHE 27 -12.394 11.619 -27.865 175 HD1 PHE 27 HD1 PHE 27 -13.510 12.084 -30.079 176 HD2 PHE 27 HD2 PHE 27 -9.857 10.198 -31.184 177 HE1 PHE 27 HE1 PHE 27 -13.347 13.559 -32.045 178 HE2 PHE 27 HE2 PHE 27 -9.693 11.671 -33.150 179 HZ PHE 27 HZ PHE 27 -11.435 13.355 -33.583 180 HB2 PHE 27 HB2 PHE 27 -11.039 9.378 -29.382 181 HB3 PHE 27 HB1 PHE 27 -12.771 9.673 -29.310 182 H GLY 28 HN GLY 28 -13.140 11.013 -25.947 183 HA2 GLY 28 HA2 GLY 28 -11.812 8.997 -24.382 184 HA3 GLY 28 HA1 GLY 28 -13.264 9.881 -23.934 185 H HIS 29 HN HIS 29 -12.732 7.058 -23.628 186 HA HIS 29 HA HIS 29 -14.409 5.729 -25.579 187 HD1 HIS 29 HD1 HIS 29 -10.736 4.601 -23.232 188 HD2 HIS 29 HD2 HIS 29 -12.681 3.946 -26.856 189 HE1 HIS 29 HE1 HIS 29 -8.914 4.167 -24.917 190 HE2 HIS 29 HE2 HIS 29 -10.109 3.893 -27.121 191 HB2 HIS 29 HB2 HIS 29 -13.196 4.704 -22.995 192 HB3 HIS 29 HB1 HIS 29 -14.058 3.717 -24.168 193 H GLY 30 HN GLY 30 -16.547 5.500 -25.437 194 HA2 GLY 30 HA2 GLY 30 -17.834 5.677 -22.823 195 HA3 GLY 30 HA1 GLY 30 -18.216 6.952 -23.965 196 H TYR 31 HN TYR 31 -19.276 4.145 -22.746 197 HA TYR 31 HA TYR 31 -21.028 3.734 -25.058 198 HD1 TYR 31 HD1 TYR 31 -21.507 0.571 -22.268 199 HD2 TYR 31 HD2 TYR 31 -17.633 1.858 -23.464 200 HE1 TYR 31 HE1 TYR 31 -20.555 -0.420 -20.226 201 HE2 TYR 31 HE2 TYR 31 -16.673 0.870 -21.431 202 HH TYR 31 HH TYR 31 -17.447 0.272 -19.140 203 HB2 TYR 31 HB2 TYR 31 -21.091 1.302 -24.547 204 HB3 TYR 31 HB1 TYR 31 -19.493 1.840 -25.048 205 H GLY 32 HN GLY 32 -23.083 2.592 -24.361 206 HA2 GLY 32 HA2 GLY 32 -24.298 3.969 -22.218 207 HA3 GLY 32 HA1 GLY 32 -24.976 2.579 -23.059 208 H GLU 33 HN GLU 33 -23.233 3.696 -20.310 209 HA GLU 33 HA GLU 33 -22.785 0.990 -19.335 210 HB2 GLU 33 HB2 GLU 33 -21.641 2.303 -17.420 211 HB3 GLU 33 HB1 GLU 33 -20.853 2.234 -18.987 212 HG2 GLU 33 HG2 GLU 33 -20.643 4.449 -18.202 213 HG3 GLU 33 HG1 GLU 33 -21.846 4.478 -19.487 214 H GLY 34 HN GLY 34 -23.305 0.471 -17.098 215 HA2 GLY 34 HA2 GLY 34 -25.706 1.890 -16.143 216 HA3 GLY 34 HA1 GLY 34 -25.406 0.177 -15.874 217 H ALA 35 HN ALA 35 -24.998 3.315 -14.688 218 HA ALA 35 HA ALA 35 -22.716 3.501 -13.289 219 HB1 ALA 35 HB1 ALA 35 -24.440 5.207 -13.239 220 HB2 ALA 35 HB2 ALA 35 -23.908 4.813 -11.604 221 HB3 ALA 35 HB3 ALA 35 -25.441 4.186 -12.207 222 H GLY 36 HN GLY 36 -21.624 2.240 -11.994 223 HA2 GLY 36 HA2 GLY 36 -23.031 0.157 -10.489 224 HA3 GLY 36 HA1 GLY 36 -21.306 0.203 -10.836 225 H GLU 37 HN GLU 37 -22.996 0.004 -8.321 226 HA GLU 37 HA GLU 37 -22.057 2.354 -6.889 227 HB2 GLU 37 HB2 GLU 37 -24.428 1.252 -6.761 228 HB3 GLU 37 HB1 GLU 37 -23.647 0.161 -5.624 229 HG2 GLU 37 HG2 GLU 37 -23.213 1.881 -4.101 230 HG3 GLU 37 HG1 GLU 37 -23.484 3.138 -5.304 231 H GLY 38 HN GLY 38 -21.617 1.374 -4.342 232 HA2 GLY 38 HA2 GLY 38 -18.912 0.541 -4.777 233 HA3 GLY 38 HA1 GLY 38 -19.632 0.928 -3.229 234 H ILE 39 HN ILE 39 -19.770 -1.530 -5.747 235 HA ILE 39 HA ILE 39 -20.418 -3.694 -4.144 236 HB ILE 39 HB ILE 39 -19.053 -5.036 -5.860 237 HG12 ILE 39 HG12 ILE 39 -18.800 -2.245 -7.000 238 HG13 ILE 39 HG11 ILE 39 -17.508 -3.380 -6.647 239 HG21 ILE 39 HG21 ILE 39 -21.454 -4.832 -5.981 240 HG22 ILE 39 HG22 ILE 39 -20.762 -4.715 -7.599 241 HG23 ILE 39 HG23 ILE 39 -21.309 -3.259 -6.766 242 HD11 ILE 39 HD11 ILE 39 -18.219 -4.797 -8.472 243 HD12 ILE 39 HD12 ILE 39 -17.955 -3.147 -9.044 244 HD13 ILE 39 HD13 ILE 39 -19.596 -3.740 -8.787 245 H ASP 40 HN ASP 40 -19.104 -5.234 -3.029 246 HA ASP 40 HA ASP 40 -17.011 -3.891 -1.609 247 HB2 ASP 40 HB2 ASP 40 -18.562 -6.359 -1.251 248 HB3 ASP 40 HB1 ASP 40 -16.901 -6.449 -0.676 249 H ASP 41 HN ASP 41 -15.612 -3.602 -3.458 250 HA ASP 41 HA ASP 41 -13.795 -5.933 -3.649 251 HB2 ASP 41 HB2 ASP 41 -14.852 -5.293 -5.840 252 HB3 ASP 41 HB1 ASP 41 -14.048 -3.733 -5.717 253 H VAL 42 HN VAL 42 -12.227 -5.592 -2.244 254 HA VAL 42 HA VAL 42 -11.344 -2.943 -1.567 255 HB VAL 42 HB VAL 42 -11.339 -4.582 0.197 256 HG11 VAL 42 HG11 VAL 42 -9.419 -6.176 -1.490 257 HG12 VAL 42 HG12 VAL 42 -11.082 -6.608 -1.089 258 HG13 VAL 42 HG13 VAL 42 -9.858 -6.536 0.179 259 HG21 VAL 42 HG21 VAL 42 -9.609 -2.884 0.340 260 HG22 VAL 42 HG22 VAL 42 -8.509 -3.896 -0.596 261 HG23 VAL 42 HG23 VAL 42 -9.028 -4.410 1.010 262 H GLU 43 HN GLU 43 -9.538 -1.911 -2.226 263 HA GLU 43 HA GLU 43 -7.729 -3.167 -4.106 264 HB2 GLU 43 HB2 GLU 43 -9.555 -2.390 -5.534 265 HB3 GLU 43 HB1 GLU 43 -9.473 -0.794 -4.803 266 HG2 GLU 43 HG2 GLU 43 -7.031 -0.789 -5.641 267 HG3 GLU 43 HG1 GLU 43 -7.563 -2.103 -6.687 268 H TRP 44 HN TRP 44 -5.779 -2.516 -3.574 269 HA TRP 44 HA TRP 44 -5.420 -0.070 -2.059 270 HD1 TRP 44 HD1 TRP 44 -3.561 1.298 -1.488 271 HE1 TRP 44 HE1 TRP 44 -1.204 1.960 -0.713 272 HE3 TRP 44 HE3 TRP 44 -1.313 -3.233 -1.800 273 HZ2 TRP 44 HZ2 TRP 44 1.288 0.699 -0.284 274 HZ3 TRP 44 HZ3 TRP 44 1.055 -3.445 -1.226 275 HH2 TRP 44 HH2 TRP 44 2.337 -1.521 -0.464 276 HB2 TRP 44 HB2 TRP 44 -4.225 -2.084 -1.347 277 HB3 TRP 44 HB1 TRP 44 -3.471 -2.190 -2.930 278 H VAL 45 HN VAL 45 -4.415 1.678 -2.770 279 HA VAL 45 HA VAL 45 -4.784 2.389 -5.453 280 HB VAL 45 HB VAL 45 -3.107 3.830 -3.408 281 HG11 VAL 45 HG11 VAL 45 -2.930 4.774 -5.629 282 HG12 VAL 45 HG12 VAL 45 -3.859 5.858 -4.592 283 HG13 VAL 45 HG13 VAL 45 -4.686 4.840 -5.773 284 HG21 VAL 45 HG21 VAL 45 -5.216 5.022 -2.797 285 HG22 VAL 45 HG22 VAL 45 -5.188 3.323 -2.325 286 HG23 VAL 45 HG23 VAL 45 -6.105 3.831 -3.745 287 H VAL 46 HN VAL 46 -2.199 0.695 -4.063 288 HA VAL 46 HA VAL 46 -0.226 1.812 -5.880 289 HB VAL 46 HB VAL 46 0.053 -0.356 -3.743 290 HG11 VAL 46 HG11 VAL 46 2.487 -0.060 -4.066 291 HG12 VAL 46 HG12 VAL 46 2.169 0.952 -5.475 292 HG13 VAL 46 HG13 VAL 46 1.709 -0.755 -5.492 293 HG21 VAL 46 HG21 VAL 46 1.023 2.493 -3.892 294 HG22 VAL 46 HG22 VAL 46 1.350 1.349 -2.589 295 HG23 VAL 46 HG23 VAL 46 -0.302 1.896 -2.892 296 H GLY 47 HN GLY 47 -2.513 -0.684 -5.950 297 HA2 GLY 47 HA2 GLY 47 -1.074 -2.461 -7.667 298 HA3 GLY 47 HA1 GLY 47 -2.827 -2.408 -7.465 299 H LYS 48 HN LYS 48 -2.342 0.622 -8.139 300 HA LYS 48 HA LYS 48 -2.564 0.229 -11.030 301 HB2 LYS 48 HB2 LYS 48 -3.772 2.473 -10.865 302 HB3 LYS 48 HB1 LYS 48 -4.611 1.043 -10.285 303 HG2 LYS 48 HG2 LYS 48 -3.897 1.679 -7.986 304 HG3 LYS 48 HG1 LYS 48 -3.261 3.177 -8.662 305 HD2 LYS 48 HD2 LYS 48 -5.552 3.380 -7.681 306 HD3 LYS 48 HD1 LYS 48 -5.440 3.862 -9.374 307 HE2 LYS 48 HE2 LYS 48 -6.403 1.795 -10.097 308 HE3 LYS 48 HE1 LYS 48 -6.333 1.133 -8.464 309 HZ1 LYS 48 HZ1 LYS 48 -8.038 2.533 -7.749 310 HZ2 LYS 48 HZ2 LYS 48 -8.555 1.995 -9.269 311 HZ3 LYS 48 HZ3 LYS 48 -7.912 3.554 -9.100 312 H ASP 49 HN ASP 49 -0.895 2.017 -8.540 313 HA ASP 49 HA ASP 49 0.380 3.661 -10.619 314 HB2 ASP 49 HB2 ASP 49 -0.857 4.770 -8.671 315 HB3 ASP 49 HB1 ASP 49 0.454 4.192 -7.650 316 H LYS 50 HN LYS 50 0.870 0.863 -9.264 317 HA LYS 50 HA LYS 50 3.320 0.835 -8.005 318 HB2 LYS 50 HB2 LYS 50 1.640 -1.061 -8.287 319 HB3 LYS 50 HB1 LYS 50 2.396 -1.347 -9.852 320 HG2 LYS 50 HG2 LYS 50 4.588 -1.525 -8.623 321 HG3 LYS 50 HG1 LYS 50 3.642 -1.551 -7.133 322 HD2 LYS 50 HD2 LYS 50 2.403 -3.501 -8.022 323 HD3 LYS 50 HD1 LYS 50 3.494 -3.509 -9.412 324 HE2 LYS 50 HE2 LYS 50 5.339 -3.519 -7.546 325 HE3 LYS 50 HE1 LYS 50 4.038 -4.183 -6.564 326 HZ1 LYS 50 HZ1 LYS 50 5.474 -5.847 -7.686 327 HZ2 LYS 50 HZ2 LYS 50 4.860 -5.316 -9.173 328 HZ3 LYS 50 HZ3 LYS 50 3.821 -6.013 -8.026 329 HA PRO 51 HA PRO 51 5.206 -0.014 -12.542 330 HB2 PRO 51 HB2 PRO 51 4.008 1.881 -14.243 331 HB3 PRO 51 HB1 PRO 51 3.816 0.123 -14.310 332 HG2 PRO 51 HG2 PRO 51 2.051 2.181 -13.078 333 HG3 PRO 51 HG1 PRO 51 1.620 0.669 -13.897 334 HD2 PRO 51 HD2 PRO 51 1.501 0.868 -11.237 335 HD3 PRO 51 HD1 PRO 51 2.080 -0.626 -12.018 336 H THR 52 HN THR 52 4.015 3.003 -11.205 337 HA THR 52 HA THR 52 6.109 4.650 -12.240 338 HB THR 52 HB THR 52 4.428 5.181 -9.782 339 HG1 THR 52 HG1 THR 52 2.746 5.578 -11.040 340 HG21 THR 52 HG21 THR 52 6.303 6.734 -10.237 341 HG22 THR 52 HG22 THR 52 4.727 7.516 -10.366 342 HG23 THR 52 HG23 THR 52 5.610 7.070 -11.826 343 H TYR 53 HN TYR 53 5.493 2.928 -9.245 344 HA TYR 53 HA TYR 53 7.867 3.924 -7.943 345 HD1 TYR 53 HD2 TYR 53 6.284 5.305 -6.798 346 HD2 TYR 53 HD1 TYR 53 4.007 1.732 -6.430 347 HE1 TYR 53 HE2 TYR 53 4.281 6.635 -6.291 348 HE2 TYR 53 HE1 TYR 53 1.999 3.056 -5.930 349 HH TYR 53 HH TYR 53 1.675 6.193 -6.597 350 HB2 TYR 53 HB2 TYR 53 6.191 1.571 -7.107 351 HB3 TYR 53 HB1 TYR 53 7.163 2.617 -6.085 352 H ASP 54 HN ASP 54 6.909 1.229 -9.882 353 HA ASP 54 HA ASP 54 9.212 -0.420 -9.243 354 HB2 ASP 54 HB2 ASP 54 7.157 -1.512 -9.893 355 HB3 ASP 54 HB1 ASP 54 7.057 -0.575 -11.379 356 H GLU 55 HN GLU 55 8.288 1.876 -11.802 357 HA GLU 55 HA GLU 55 10.525 1.350 -13.468 358 HB2 GLU 55 HB2 GLU 55 10.020 3.433 -14.579 359 HB3 GLU 55 HB1 GLU 55 8.526 2.570 -14.254 360 HG2 GLU 55 HG2 GLU 55 8.152 4.008 -12.289 361 HG3 GLU 55 HG1 GLU 55 9.604 4.926 -12.731 362 H ILE 56 HN ILE 56 10.011 3.638 -10.792 363 HA ILE 56 HA ILE 56 12.653 4.683 -10.944 364 HB ILE 56 HB ILE 56 10.887 4.548 -8.493 365 HG12 ILE 56 HG12 ILE 56 11.108 6.781 -10.526 366 HG13 ILE 56 HG11 ILE 56 9.813 5.577 -10.530 367 HG21 ILE 56 HG21 ILE 56 12.167 6.511 -7.773 368 HG22 ILE 56 HG22 ILE 56 13.157 6.399 -9.230 369 HG23 ILE 56 HG23 ILE 56 13.215 5.114 -8.022 370 HD11 ILE 56 HD11 ILE 56 9.105 7.655 -9.490 371 HD12 ILE 56 HD12 ILE 56 10.406 7.515 -8.308 372 HD13 ILE 56 HD13 ILE 56 9.106 6.324 -8.331 373 H PHE 57 HN PHE 57 11.204 1.878 -9.520 374 HA PHE 57 HA PHE 57 13.170 1.062 -7.725 375 HD1 PHE 57 HD2 PHE 57 12.746 -0.877 -6.026 376 HD2 PHE 57 HD1 PHE 57 11.895 -2.692 -9.774 377 HE1 PHE 57 HE2 PHE 57 13.593 -3.025 -5.181 378 HE2 PHE 57 HE1 PHE 57 12.737 -4.843 -8.936 379 HZ PHE 57 HZ PHE 57 13.585 -5.011 -6.628 380 HB2 PHE 57 HB2 PHE 57 11.003 0.019 -7.750 381 HB3 PHE 57 HB1 PHE 57 11.228 -0.527 -9.406 382 H TYR 58 HN TYR 58 12.734 -0.081 -11.096 383 HA TYR 58 HA TYR 58 15.223 -1.450 -11.161 384 HD1 TYR 58 HD1 TYR 58 11.711 -1.705 -11.796 385 HD2 TYR 58 HD2 TYR 58 14.918 -3.683 -13.759 386 HE1 TYR 58 HE1 TYR 58 10.564 -3.850 -11.496 387 HE2 TYR 58 HE2 TYR 58 13.772 -5.838 -13.475 388 HH TYR 58 HH TYR 58 10.501 -6.014 -12.167 389 HB2 TYR 58 HB2 TYR 58 13.370 -0.510 -13.351 390 HB3 TYR 58 HB1 TYR 58 14.884 -1.351 -13.702 391 H THR 59 HN THR 59 14.352 1.834 -11.618 392 HA THR 59 HA THR 59 16.627 2.664 -13.098 393 HB THR 59 HB THR 59 14.630 4.150 -11.391 394 HG1 THR 59 HG1 THR 59 13.648 3.550 -13.233 395 HG21 THR 59 HG21 THR 59 16.788 5.316 -13.149 396 HG22 THR 59 HG22 THR 59 16.678 5.460 -11.393 397 HG23 THR 59 HG23 THR 59 15.460 6.216 -12.422 398 H LEU 60 HN LEU 60 16.026 2.059 -9.706 399 HA LEU 60 HA LEU 60 18.440 3.441 -8.877 400 HG LEU 60 HG LEU 60 15.462 3.897 -7.861 401 HB2 LEU 60 HB2 LEU 60 16.458 1.769 -7.337 402 HB3 LEU 60 HB1 LEU 60 17.855 2.552 -6.612 403 HD11 LEU 60 HD11 LEU 60 15.094 4.724 -5.617 404 HD12 LEU 60 HD12 LEU 60 16.561 3.920 -5.053 405 HD13 LEU 60 HD13 LEU 60 15.184 2.962 -5.595 406 HD21 LEU 60 HD21 LEU 60 17.535 5.093 -8.409 407 HD22 LEU 60 HD22 LEU 60 17.946 5.143 -6.694 408 HD23 LEU 60 HD23 LEU 60 16.521 5.998 -7.284 409 H SER 61 HN SER 61 18.015 0.664 -10.419 410 HA SER 61 HA SER 61 19.293 -1.153 -10.821 411 HG SER 61 HG SER 61 21.393 -2.025 -10.769 412 HB2 SER 61 HB2 SER 61 21.178 0.466 -10.704 413 HB3 SER 61 HB1 SER 61 21.326 0.132 -8.980 414 HA PRO 62 HA PRO 62 17.993 -3.137 -6.892 415 HB2 PRO 62 HB2 PRO 62 16.191 -4.821 -7.961 416 HB3 PRO 62 HB1 PRO 62 15.798 -3.135 -7.599 417 HG2 PRO 62 HG2 PRO 62 16.438 -4.418 -10.214 418 HG3 PRO 62 HG1 PRO 62 15.267 -3.144 -9.845 419 HD2 PRO 62 HD2 PRO 62 17.776 -2.729 -10.937 420 HD3 PRO 62 HD1 PRO 62 16.812 -1.500 -10.085 421 H VAL 63 HN VAL 63 18.521 -5.152 -6.089 422 HA VAL 63 HA VAL 63 19.822 -7.019 -7.939 423 HB VAL 63 HB VAL 63 21.198 -7.747 -5.974 424 HG11 VAL 63 HG11 VAL 63 21.543 -4.885 -6.847 425 HG12 VAL 63 HG12 VAL 63 22.140 -6.308 -7.699 426 HG13 VAL 63 HG13 VAL 63 22.790 -5.892 -6.113 427 HG21 VAL 63 HG21 VAL 63 20.151 -5.207 -4.745 428 HG22 VAL 63 HG22 VAL 63 21.458 -6.201 -4.095 429 HG23 VAL 63 HG23 VAL 63 19.819 -6.846 -4.185 430 H ASN 64 HN ASN 64 18.955 -8.947 -8.054 431 HA ASN 64 HA ASN 64 17.703 -10.786 -7.647 432 HB2 ASN 64 HB2 ASN 64 18.161 -10.053 -4.747 433 HB3 ASN 64 HB1 ASN 64 17.503 -11.590 -5.307 434 HD21 ASN 64 HD21 ASN 64 20.301 -9.776 -4.686 435 HD22 ASN 64 HD22 ASN 64 21.460 -10.923 -5.255 436 H GLY 65 HN GLY 65 16.441 -8.051 -7.768 437 HA2 GLY 65 HA2 GLY 65 14.164 -7.621 -8.119 438 HA3 GLY 65 HA1 GLY 65 13.774 -9.023 -7.134 439 H LYS 66 HN LYS 66 16.045 -6.708 -5.918 440 HA LYS 66 HA LYS 66 14.088 -4.962 -4.761 441 HB2 LYS 66 HB2 LYS 66 14.777 -5.318 -2.398 442 HB3 LYS 66 HB1 LYS 66 13.908 -6.685 -3.077 443 HG2 LYS 66 HG2 LYS 66 16.907 -6.611 -2.980 444 HG3 LYS 66 HG1 LYS 66 15.934 -7.177 -1.614 445 HD2 LYS 66 HD2 LYS 66 15.684 -8.224 -4.402 446 HD3 LYS 66 HD1 LYS 66 16.706 -8.982 -3.176 447 HE2 LYS 66 HE2 LYS 66 14.946 -9.918 -2.144 448 HE3 LYS 66 HE1 LYS 66 13.993 -8.441 -2.270 449 HZ1 LYS 66 HZ1 LYS 66 13.450 -9.027 -4.549 450 HZ2 LYS 66 HZ2 LYS 66 12.969 -10.252 -3.489 451 HZ3 LYS 66 HZ3 LYS 66 14.362 -10.449 -4.433 452 H ILE 67 HN ILE 67 14.983 -3.089 -3.915 453 HA ILE 67 HA ILE 67 17.679 -2.579 -4.879 454 HB ILE 67 HB ILE 67 17.165 -0.200 -3.999 455 HG12 ILE 67 HG12 ILE 67 14.415 -1.477 -3.850 456 HG13 ILE 67 HG11 ILE 67 15.329 -0.774 -2.523 457 HG21 ILE 67 HG21 ILE 67 17.147 -0.774 -6.366 458 HG22 ILE 67 HG22 ILE 67 15.795 0.299 -5.998 459 HG23 ILE 67 HG23 ILE 67 15.513 -1.427 -6.227 460 HD11 ILE 67 HD11 ILE 67 13.590 0.718 -3.217 461 HD12 ILE 67 HD12 ILE 67 14.177 0.688 -4.879 462 HD13 ILE 67 HD13 ILE 67 15.162 1.418 -3.609 463 H THR 68 HN THR 68 19.438 -2.499 -3.638 464 HA THR 68 HA THR 68 19.456 -3.230 -0.932 465 HB THR 68 HB THR 68 21.788 -2.035 -1.042 466 HG1 THR 68 HG1 THR 68 21.893 -0.897 -2.847 467 HG21 THR 68 HG21 THR 68 21.461 -4.466 -1.103 468 HG22 THR 68 HG22 THR 68 22.744 -3.967 -2.204 469 HG23 THR 68 HG23 THR 68 21.150 -4.381 -2.835 470 H GLY 69 HN GLY 69 18.777 -2.112 0.760 471 HA2 GLY 69 HA2 GLY 69 17.076 -0.057 0.418 472 HA3 GLY 69 HA1 GLY 69 17.799 -0.436 1.972 473 H ALA 70 HN ALA 70 20.496 0.447 0.966 474 HA ALA 70 HA ALA 70 20.561 3.075 1.757 475 HB1 ALA 70 HB1 ALA 70 22.684 3.267 0.607 476 HB2 ALA 70 HB2 ALA 70 22.319 1.828 -0.346 477 HB3 ALA 70 HB3 ALA 70 22.552 1.696 1.398 478 H ASN 71 HN ASN 71 19.623 1.840 -1.396 479 HA ASN 71 HA ASN 71 19.724 4.425 -2.683 480 HB2 ASN 71 HB2 ASN 71 18.564 3.168 -4.572 481 HB3 ASN 71 HB1 ASN 71 20.177 2.619 -4.138 482 HD21 ASN 71 HD21 ASN 71 19.889 0.617 -4.971 483 HD22 ASN 71 HD22 ASN 71 18.874 -0.563 -4.242 484 H ALA 72 HN ALA 72 17.220 2.306 -1.375 485 HA ALA 72 HA ALA 72 15.024 3.942 -2.147 486 HB1 ALA 72 HB1 ALA 72 14.708 1.610 -1.564 487 HB2 ALA 72 HB2 ALA 72 13.770 2.638 -0.483 488 HB3 ALA 72 HB3 ALA 72 15.279 1.917 0.077 489 H LYS 73 HN LYS 73 17.157 3.759 0.591 490 HA LYS 73 HA LYS 73 15.892 5.698 2.219 491 HB2 LYS 73 HB2 LYS 73 18.821 4.961 2.030 492 HB3 LYS 73 HB1 LYS 73 18.119 5.958 3.295 493 HG2 LYS 73 HG2 LYS 73 17.570 3.051 2.756 494 HG3 LYS 73 HG1 LYS 73 18.420 3.746 4.138 495 HD2 LYS 73 HD2 LYS 73 15.585 4.469 3.501 496 HD3 LYS 73 HD1 LYS 73 15.978 3.047 4.462 497 HE2 LYS 73 HE2 LYS 73 16.821 5.864 5.119 498 HE3 LYS 73 HE1 LYS 73 15.441 5.027 5.843 499 HZ1 LYS 73 HZ1 LYS 73 17.221 3.259 6.436 500 HZ2 LYS 73 HZ2 LYS 73 17.091 4.659 7.378 501 HZ3 LYS 73 HZ3 LYS 73 18.326 4.529 6.226 502 H LYS 74 HN LYS 74 18.247 5.841 -0.360 503 HA LYS 74 HA LYS 74 18.947 8.534 -0.317 504 HB2 LYS 74 HB2 LYS 74 19.771 6.572 -1.826 505 HB3 LYS 74 HB1 LYS 74 18.442 7.040 -2.878 506 HG2 LYS 74 HG2 LYS 74 20.404 8.093 -3.684 507 HG3 LYS 74 HG1 LYS 74 19.403 9.343 -2.934 508 HD2 LYS 74 HD2 LYS 74 21.713 9.615 -2.285 509 HD3 LYS 74 HD1 LYS 74 20.747 9.161 -0.886 510 HE2 LYS 74 HE2 LYS 74 22.808 7.919 -0.846 511 HE3 LYS 74 HE1 LYS 74 21.482 6.814 -1.204 512 HZ1 LYS 74 HZ1 LYS 74 22.096 7.065 -3.601 513 HZ2 LYS 74 HZ2 LYS 74 23.258 6.289 -2.654 514 HZ3 LYS 74 HZ3 LYS 74 23.481 7.908 -3.104 515 H GLU 75 HN GLU 75 16.326 6.878 -1.996 516 HA GLU 75 HA GLU 75 15.177 9.129 -3.205 517 HB2 GLU 75 HB2 GLU 75 13.862 6.533 -2.422 518 HB3 GLU 75 HB1 GLU 75 13.104 7.761 -3.425 519 HG2 GLU 75 HG2 GLU 75 15.357 5.911 -4.067 520 HG3 GLU 75 HG1 GLU 75 13.912 6.300 -4.992 521 H MET 76 HN MET 76 14.227 7.555 -0.155 522 HA MET 76 HA MET 76 12.186 9.467 0.350 523 HB2 MET 76 HB2 MET 76 12.283 8.484 2.722 524 HB3 MET 76 HB1 MET 76 11.820 7.420 1.403 525 HG2 MET 76 HG2 MET 76 14.057 6.502 1.331 526 HG3 MET 76 HG1 MET 76 14.554 7.595 2.617 527 HE1 MET 76 HE1 MET 76 11.155 5.495 2.251 528 HE2 MET 76 HE2 MET 76 11.655 4.028 3.091 529 HE3 MET 76 HE3 MET 76 12.461 4.504 1.597 530 H VAL 77 HN VAL 77 15.601 9.419 1.018 531 HA VAL 77 HA VAL 77 15.564 11.573 2.907 532 HB VAL 77 HB VAL 77 17.795 10.487 1.169 533 HG11 VAL 77 HG11 VAL 77 17.933 12.707 3.219 534 HG12 VAL 77 HG12 VAL 77 18.204 12.869 1.485 535 HG13 VAL 77 HG13 VAL 77 19.325 11.925 2.466 536 HG21 VAL 77 HG21 VAL 77 18.710 9.773 3.347 537 HG22 VAL 77 HG22 VAL 77 17.132 9.056 3.022 538 HG23 VAL 77 HG23 VAL 77 17.271 10.409 4.145 539 H LYS 78 HN LYS 78 16.174 11.384 -0.598 540 HA LYS 78 HA LYS 78 16.649 14.166 -0.923 541 HB2 LYS 78 HB2 LYS 78 16.789 13.739 -3.219 542 HB3 LYS 78 HB1 LYS 78 17.301 12.223 -2.492 543 HG2 LYS 78 HG2 LYS 78 14.644 11.796 -2.736 544 HG3 LYS 78 HG1 LYS 78 14.952 12.837 -4.126 545 HD2 LYS 78 HD2 LYS 78 16.480 10.335 -3.471 546 HD3 LYS 78 HD1 LYS 78 15.162 10.427 -4.637 547 HE2 LYS 78 HE2 LYS 78 16.571 12.212 -5.799 548 HE3 LYS 78 HE1 LYS 78 17.886 11.663 -4.755 549 HZ1 LYS 78 HZ1 LYS 78 17.357 9.355 -5.632 550 HZ2 LYS 78 HZ2 LYS 78 18.107 10.428 -6.719 551 HZ3 LYS 78 HZ3 LYS 78 16.445 10.128 -6.833 552 H SER 79 HN SER 79 13.825 12.363 -0.431 553 HA SER 79 HA SER 79 11.948 14.043 -1.718 554 HG SER 79 HG SER 79 9.971 13.182 -1.585 555 HB2 SER 79 HB2 SER 79 11.622 11.678 -0.688 556 HB3 SER 79 HB1 SER 79 11.335 12.555 0.821 557 H LYS 80 HN LYS 80 14.032 14.564 0.863 558 HA LYS 80 HA LYS 80 14.464 16.408 2.097 559 HB2 LYS 80 HB2 LYS 80 12.053 17.555 0.681 560 HB3 LYS 80 HB1 LYS 80 13.032 18.460 1.839 561 HG2 LYS 80 HG2 LYS 80 14.931 18.385 0.444 562 HG3 LYS 80 HG1 LYS 80 14.200 17.173 -0.611 563 HD2 LYS 80 HD2 LYS 80 12.929 19.862 -0.256 564 HD3 LYS 80 HD1 LYS 80 14.267 19.642 -1.384 565 HE2 LYS 80 HE2 LYS 80 12.204 19.429 -2.585 566 HE3 LYS 80 HE1 LYS 80 12.971 17.846 -2.495 567 HZ1 LYS 80 HZ1 LYS 80 10.584 17.743 -2.086 568 HZ2 LYS 80 HZ2 LYS 80 10.746 18.779 -0.752 569 HZ3 LYS 80 HZ3 LYS 80 11.458 17.239 -0.721 570 H LEU 81 HN LEU 81 13.945 14.853 3.767 571 HA LEU 81 HA LEU 81 11.640 15.716 5.382 572 HG LEU 81 HG LEU 81 11.319 13.750 2.983 573 HB2 LEU 81 HB2 LEU 81 12.480 12.838 5.048 574 HB3 LEU 81 HB1 LEU 81 11.118 13.444 5.968 575 HD11 LEU 81 HD11 LEU 81 9.929 11.605 4.579 576 HD12 LEU 81 HD12 LEU 81 11.374 11.374 3.595 577 HD13 LEU 81 HD13 LEU 81 9.846 11.818 2.831 578 HD21 LEU 81 HD21 LEU 81 9.803 15.268 4.218 579 HD22 LEU 81 HD22 LEU 81 8.981 13.856 4.883 580 HD23 LEU 81 HD23 LEU 81 8.945 14.162 3.146 581 HA PRO 82 HA PRO 82 14.572 15.081 8.782 582 HB2 PRO 82 HB2 PRO 82 12.866 14.687 10.828 583 HB3 PRO 82 HB1 PRO 82 13.073 16.285 10.080 584 HG2 PRO 82 HG2 PRO 82 10.904 14.269 9.677 585 HG3 PRO 82 HG1 PRO 82 10.781 16.028 9.831 586 HD2 PRO 82 HD2 PRO 82 10.725 14.670 7.453 587 HD3 PRO 82 HD1 PRO 82 11.242 16.365 7.620 588 H ASN 83 HN ASN 83 15.053 13.387 10.462 589 HA ASN 83 HA ASN 83 15.089 10.835 9.247 590 HB2 ASN 83 HB2 ASN 83 15.739 11.700 12.057 591 HB3 ASN 83 HB1 ASN 83 15.995 10.064 11.463 592 HD21 ASN 83 HD21 ASN 83 16.770 10.970 8.789 593 HD22 ASN 83 HD22 ASN 83 18.380 11.583 8.960 594 H THR 84 HN THR 84 12.903 12.306 11.486 595 HA THR 84 HA THR 84 11.772 10.004 12.623 596 HB THR 84 HB THR 84 9.762 11.544 12.958 597 HG1 THR 84 HG1 THR 84 10.276 13.780 12.553 598 HG21 THR 84 HG21 THR 84 10.927 12.898 14.633 599 HG22 THR 84 HG22 THR 84 12.472 12.457 13.906 600 HG23 THR 84 HG23 THR 84 11.470 11.219 14.665 601 H VAL 85 HN VAL 85 10.713 11.988 9.864 602 HA VAL 85 HA VAL 85 8.592 10.273 9.113 603 HB VAL 85 HB VAL 85 10.109 12.222 7.364 604 HG11 VAL 85 HG11 VAL 85 8.059 12.279 6.030 605 HG12 VAL 85 HG12 VAL 85 7.334 11.065 7.084 606 HG13 VAL 85 HG13 VAL 85 8.737 10.652 6.097 607 HG21 VAL 85 HG21 VAL 85 8.346 13.825 7.939 608 HG22 VAL 85 HG22 VAL 85 9.251 13.323 9.365 609 HG23 VAL 85 HG23 VAL 85 7.648 12.657 9.059 610 H LEU 86 HN LEU 86 11.928 10.621 7.949 611 HA LEU 86 HA LEU 86 12.125 8.649 6.055 612 HG LEU 86 HG LEU 86 15.475 10.133 6.300 613 HB2 LEU 86 HB2 LEU 86 13.933 9.787 8.079 614 HB3 LEU 86 HB1 LEU 86 14.402 8.204 7.472 615 HD11 LEU 86 HD11 LEU 86 15.194 9.208 4.082 616 HD12 LEU 86 HD12 LEU 86 13.733 8.367 4.601 617 HD13 LEU 86 HD13 LEU 86 15.301 7.924 5.283 618 HD21 LEU 86 HD21 LEU 86 12.709 10.573 5.203 619 HD22 LEU 86 HD22 LEU 86 14.182 11.401 4.688 620 HD23 LEU 86 HD23 LEU 86 13.549 11.646 6.319 621 H GLY 87 HN GLY 87 12.482 8.255 9.553 622 HA2 GLY 87 HA2 GLY 87 12.994 5.516 9.583 623 HA3 GLY 87 HA1 GLY 87 12.365 6.447 10.931 624 H LYS 88 HN LYS 88 9.871 7.229 9.907 625 HA LYS 88 HA LYS 88 8.603 4.674 10.290 626 HB2 LYS 88 HB2 LYS 88 6.527 5.840 10.632 627 HB3 LYS 88 HB1 LYS 88 7.798 6.573 11.591 628 HG2 LYS 88 HG2 LYS 88 7.933 8.436 10.101 629 HG3 LYS 88 HG1 LYS 88 6.836 7.647 8.961 630 HD2 LYS 88 HD2 LYS 88 5.018 7.776 10.511 631 HD3 LYS 88 HD1 LYS 88 6.081 8.329 11.800 632 HE2 LYS 88 HE2 LYS 88 6.513 10.389 10.448 633 HE3 LYS 88 HE1 LYS 88 5.275 9.839 9.321 634 HZ1 LYS 88 HZ1 LYS 88 3.633 9.932 11.049 635 HZ2 LYS 88 HZ2 LYS 88 4.434 11.424 11.009 636 HZ3 LYS 88 HZ3 LYS 88 4.806 10.302 12.218 637 H ILE 89 HN ILE 89 9.154 6.787 7.598 638 HA ILE 89 HA ILE 89 7.206 5.608 5.887 639 HB ILE 89 HB ILE 89 9.840 6.958 5.270 640 HG12 ILE 89 HG12 ILE 89 6.944 7.779 4.929 641 HG13 ILE 89 HG11 ILE 89 8.109 8.451 6.065 642 HG21 ILE 89 HG21 ILE 89 9.419 5.296 3.532 643 HG22 ILE 89 HG22 ILE 89 9.220 6.932 2.905 644 HG23 ILE 89 HG23 ILE 89 7.801 5.951 3.280 645 HD11 ILE 89 HD11 ILE 89 9.427 9.310 4.190 646 HD12 ILE 89 HD12 ILE 89 7.781 9.943 4.203 647 HD13 ILE 89 HD13 ILE 89 8.222 8.669 3.068 648 H TRP 90 HN TRP 90 10.609 4.919 6.602 649 HA TRP 90 HA TRP 90 10.859 2.670 4.934 650 HD1 TRP 90 HD1 TRP 90 13.037 0.767 8.161 651 HE1 TRP 90 HE1 TRP 90 14.452 -1.037 6.961 652 HE3 TRP 90 HE3 TRP 90 13.226 2.865 3.503 653 HZ2 TRP 90 HZ2 TRP 90 15.528 -1.478 4.376 654 HZ3 TRP 90 HZ3 TRP 90 14.476 1.702 1.728 655 HH2 TRP 90 HH2 TRP 90 15.592 -0.420 2.155 656 HB2 TRP 90 HB2 TRP 90 12.774 3.819 5.984 657 HB3 TRP 90 HB1 TRP 90 12.281 3.179 7.539 658 H LYS 91 HN LYS 91 10.140 2.822 8.428 659 HA LYS 91 HA LYS 91 9.947 -0.009 8.622 660 HB2 LYS 91 HB2 LYS 91 9.353 0.322 10.920 661 HB3 LYS 91 HB1 LYS 91 10.644 1.438 10.495 662 HG2 LYS 91 HG2 LYS 91 9.020 3.240 10.288 663 HG3 LYS 91 HG1 LYS 91 7.733 2.123 10.741 664 HD2 LYS 91 HD2 LYS 91 8.906 1.723 12.892 665 HD3 LYS 91 HD1 LYS 91 10.094 2.945 12.424 666 HE2 LYS 91 HE2 LYS 91 8.311 4.615 12.281 667 HE3 LYS 91 HE1 LYS 91 7.136 3.387 12.756 668 HZ1 LYS 91 HZ1 LYS 91 9.423 4.317 14.422 669 HZ2 LYS 91 HZ2 LYS 91 8.260 3.167 14.880 670 HZ3 LYS 91 HZ3 LYS 91 7.807 4.780 14.627 671 H LEU 92 HN LEU 92 7.747 2.317 7.514 672 HA LEU 92 HA LEU 92 5.455 0.590 8.035 673 HG LEU 92 HG LEU 92 3.266 1.582 6.745 674 HB2 LEU 92 HB2 LEU 92 5.508 3.222 7.963 675 HB3 LEU 92 HB1 LEU 92 5.357 2.967 6.215 676 HD11 LEU 92 HD11 LEU 92 3.684 1.226 9.112 677 HD12 LEU 92 HD12 LEU 92 2.158 2.076 8.861 678 HD13 LEU 92 HD13 LEU 92 3.581 2.964 9.408 679 HD21 LEU 92 HD21 LEU 92 3.240 4.528 7.418 680 HD22 LEU 92 HD22 LEU 92 1.848 3.557 6.937 681 HD23 LEU 92 HD23 LEU 92 3.166 3.837 5.797 682 H ALA 93 HN ALA 93 7.625 1.547 5.414 683 HA ALA 93 HA ALA 93 6.113 0.101 3.425 684 HB1 ALA 93 HB1 ALA 93 7.335 2.106 2.818 685 HB2 ALA 93 HB2 ALA 93 7.929 0.714 1.914 686 HB3 ALA 93 HB3 ALA 93 8.854 1.338 3.282 687 H ASP 94 HN ASP 94 9.191 -0.371 5.136 688 HA ASP 94 HA ASP 94 9.453 -3.031 3.947 689 HB2 ASP 94 HB2 ASP 94 11.453 -1.521 4.166 690 HB3 ASP 94 HB1 ASP 94 11.313 -1.664 5.906 691 H VAL 95 HN VAL 95 7.484 -3.688 4.983 692 HA VAL 95 HA VAL 95 7.172 -3.873 7.785 693 HB VAL 95 HB VAL 95 6.018 -5.783 5.749 694 HG11 VAL 95 HG11 VAL 95 4.133 -5.877 7.325 695 HG12 VAL 95 HG12 VAL 95 5.014 -4.814 8.423 696 HG13 VAL 95 HG13 VAL 95 5.645 -6.420 8.055 697 HG21 VAL 95 HG21 VAL 95 5.674 -3.503 4.968 698 HG22 VAL 95 HG22 VAL 95 4.989 -3.059 6.532 699 HG23 VAL 95 HG23 VAL 95 4.153 -4.219 5.500 700 H ASP 96 HN ASP 96 8.919 -5.678 5.471 701 HA ASP 96 HA ASP 96 9.281 -8.057 7.044 702 HB2 ASP 96 HB2 ASP 96 9.244 -8.148 4.617 703 HB3 ASP 96 HB1 ASP 96 10.578 -6.987 4.540 704 H LYS 97 HN LYS 97 10.892 -5.021 6.543 705 HA LYS 97 HA LYS 97 12.615 -3.975 7.545 706 HB2 LYS 97 HB2 LYS 97 12.036 -5.924 9.776 707 HB3 LYS 97 HB1 LYS 97 12.916 -4.403 9.930 708 HG2 LYS 97 HG2 LYS 97 10.958 -3.166 9.248 709 HG3 LYS 97 HG1 LYS 97 10.067 -4.656 9.005 710 HD2 LYS 97 HD2 LYS 97 10.425 -5.144 11.450 711 HD3 LYS 97 HD1 LYS 97 11.073 -3.506 11.601 712 HE2 LYS 97 HE2 LYS 97 8.951 -2.621 10.700 713 HE3 LYS 97 HE1 LYS 97 8.308 -4.263 10.654 714 HZ1 LYS 97 HZ1 LYS 97 7.544 -3.270 12.641 715 HZ2 LYS 97 HZ2 LYS 97 9.080 -2.684 13.040 716 HZ3 LYS 97 HZ3 LYS 97 8.764 -4.351 13.099 717 H ASP 98 HN ASP 98 13.976 -4.779 5.923 718 HA ASP 98 HA ASP 98 15.778 -6.944 6.769 719 HB2 ASP 98 HB2 ASP 98 15.890 -7.464 4.256 720 HB3 ASP 98 HB1 ASP 98 14.400 -7.904 5.101 721 H GLY 99 HN GLY 99 15.490 -3.778 5.350 722 HA2 GLY 99 HA2 GLY 99 17.365 -2.264 5.375 723 HA3 GLY 99 HA1 GLY 99 18.435 -3.655 5.259 724 H LEU 100 HN LEU 100 15.731 -3.857 3.258 725 HA LEU 100 HA LEU 100 16.812 -2.352 1.043 726 HG LEU 100 HG LEU 100 16.520 -5.856 2.124 727 HB2 LEU 100 HB2 LEU 100 16.650 -4.361 -0.477 728 HB3 LEU 100 HB1 LEU 100 18.003 -4.352 0.632 729 HD11 LEU 100 HD11 LEU 100 14.432 -5.536 0.891 730 HD12 LEU 100 HD12 LEU 100 14.909 -7.234 0.928 731 HD13 LEU 100 HD13 LEU 100 15.157 -6.280 -0.535 732 HD21 LEU 100 HD21 LEU 100 18.549 -6.598 1.018 733 HD22 LEU 100 HD22 LEU 100 17.655 -6.866 -0.479 734 HD23 LEU 100 HD23 LEU 100 17.305 -7.847 0.944 735 H LEU 101 HN LEU 101 15.125 -3.154 -0.965 736 HA LEU 101 HA LEU 101 12.445 -3.387 0.137 737 HG LEU 101 HG LEU 101 13.496 -0.572 1.057 738 HB2 LEU 101 HB2 LEU 101 13.324 -0.904 -1.347 739 HB3 LEU 101 HB1 LEU 101 11.644 -1.385 -1.190 740 HD11 LEU 101 HD11 LEU 101 12.016 1.313 1.301 741 HD12 LEU 101 HD12 LEU 101 10.990 0.711 -0.002 742 HD13 LEU 101 HD13 LEU 101 12.628 1.255 -0.352 743 HD21 LEU 101 HD21 LEU 101 11.965 -2.337 1.785 744 HD22 LEU 101 HD22 LEU 101 10.604 -1.397 1.172 745 HD23 LEU 101 HD23 LEU 101 11.564 -0.780 2.511 746 H ASP 102 HN ASP 102 11.467 -4.823 -1.176 747 HA ASP 102 HA ASP 102 12.529 -5.370 -3.787 748 HB2 ASP 102 HB2 ASP 102 11.010 -7.151 -3.911 749 HB3 ASP 102 HB1 ASP 102 11.392 -7.042 -2.197 750 H ASP 103 HN ASP 103 10.459 -5.710 -5.472 751 HA ASP 103 HA ASP 103 10.050 -3.097 -6.454 752 HB2 ASP 103 HB2 ASP 103 9.682 -4.309 -8.291 753 HB3 ASP 103 HB1 ASP 103 9.611 -5.785 -7.318 754 H GLU 104 HN GLU 104 8.008 -5.195 -4.474 755 HA GLU 104 HA GLU 104 5.777 -3.328 -4.532 756 HB2 GLU 104 HB2 GLU 104 6.277 -6.031 -3.522 757 HB3 GLU 104 HB1 GLU 104 5.326 -5.044 -2.421 758 HG2 GLU 104 HG2 GLU 104 3.516 -5.241 -3.666 759 HG3 GLU 104 HG1 GLU 104 4.393 -4.740 -5.126 760 H GLU 105 HN GLU 105 8.393 -4.206 -2.302 761 HA GLU 105 HA GLU 105 7.527 -2.631 -0.147 762 HB2 GLU 105 HB2 GLU 105 9.871 -4.139 -0.851 763 HB3 GLU 105 HB1 GLU 105 10.334 -2.613 -0.115 764 HG2 GLU 105 HG2 GLU 105 9.095 -3.068 1.846 765 HG3 GLU 105 HG1 GLU 105 8.277 -4.430 1.097 766 H PHE 106 HN PHE 106 9.530 -1.827 -2.951 767 HA PHE 106 HA PHE 106 9.948 0.901 -2.244 768 HD1 PHE 106 HD2 PHE 106 9.338 2.755 -3.971 769 HD2 PHE 106 HD1 PHE 106 12.584 0.645 -5.730 770 HE1 PHE 106 HE2 PHE 106 10.236 4.859 -4.881 771 HE2 PHE 106 HE1 PHE 106 13.462 2.735 -6.632 772 HZ PHE 106 HZ PHE 106 12.300 4.846 -6.205 773 HB2 PHE 106 HB2 PHE 106 11.223 -0.404 -4.009 774 HB3 PHE 106 HB1 PHE 106 9.811 -0.268 -5.041 775 H ALA 107 HN ALA 107 7.512 -0.882 -4.046 776 HA ALA 107 HA ALA 107 6.062 1.127 -5.199 777 HB1 ALA 107 HB1 ALA 107 4.134 -0.363 -5.107 778 HB2 ALA 107 HB2 ALA 107 4.965 -1.370 -3.915 779 HB3 ALA 107 HB3 ALA 107 5.602 -1.232 -5.555 780 H LEU 108 HN LEU 108 5.605 -0.121 -1.844 781 HA LEU 108 HA LEU 108 3.724 2.038 -1.425 782 HG LEU 108 HG LEU 108 5.819 -0.040 0.781 783 HB2 LEU 108 HB2 LEU 108 3.462 1.275 0.842 784 HB3 LEU 108 HB1 LEU 108 3.102 0.049 -0.358 785 HD11 LEU 108 HD11 LEU 108 4.440 0.655 2.687 786 HD12 LEU 108 HD12 LEU 108 4.997 -1.010 2.862 787 HD13 LEU 108 HD13 LEU 108 3.334 -0.681 2.368 788 HD21 LEU 108 HD21 LEU 108 5.233 -2.432 0.825 789 HD22 LEU 108 HD22 LEU 108 4.950 -1.718 -0.764 790 HD23 LEU 108 HD23 LEU 108 3.590 -2.024 0.319 791 H ALA 109 HN ALA 109 7.016 1.307 -0.442 792 HA ALA 109 HA ALA 109 7.628 3.397 1.225 793 HB1 ALA 109 HB1 ALA 109 9.850 3.483 0.201 794 HB2 ALA 109 HB2 ALA 109 9.255 2.551 -1.171 795 HB3 ALA 109 HB3 ALA 109 9.306 1.821 0.433 796 H ASN 110 HN ASN 110 7.506 3.629 -2.330 797 HA ASN 110 HA ASN 110 7.988 6.454 -2.337 798 HB2 ASN 110 HB2 ASN 110 8.651 4.807 -4.159 799 HB3 ASN 110 HB1 ASN 110 6.960 4.812 -4.644 800 HD21 ASN 110 HD21 ASN 110 8.727 7.593 -3.422 801 HD22 ASN 110 HD22 ASN 110 8.685 8.497 -4.893 802 H HIS 111 HN HIS 111 5.196 4.354 -2.575 803 HA HIS 111 HA HIS 111 3.336 6.333 -3.378 804 HD1 HIS 111 HD1 HIS 111 0.805 5.587 -4.435 805 HD2 HIS 111 HD2 HIS 111 0.556 4.067 -0.568 806 HE1 HIS 111 HE1 HIS 111 -1.597 5.886 -3.741 807 HE2 HIS 111 HE2 HIS 111 -1.675 5.171 -1.318 808 HB2 HIS 111 HB2 HIS 111 2.801 3.974 -3.624 809 HB3 HIS 111 HB1 HIS 111 2.898 3.737 -1.878 810 H LEU 112 HN LEU 112 4.549 5.254 -0.293 811 HA LEU 112 HA LEU 112 2.796 6.837 1.298 812 HG LEU 112 HG LEU 112 3.456 3.972 1.692 813 HB2 LEU 112 HB2 LEU 112 5.436 5.490 1.838 814 HB3 LEU 112 HB1 LEU 112 4.584 6.434 3.064 815 HD11 LEU 112 HD11 LEU 112 5.369 3.452 3.146 816 HD12 LEU 112 HD12 LEU 112 3.849 2.836 3.796 817 HD13 LEU 112 HD13 LEU 112 4.571 4.294 4.476 818 HD21 LEU 112 HD21 LEU 112 1.732 5.544 2.402 819 HD22 LEU 112 HD22 LEU 112 2.442 5.611 4.016 820 HD23 LEU 112 HD23 LEU 112 1.727 4.109 3.427 821 H ILE 113 HN ILE 113 5.928 7.316 -0.196 822 HA ILE 113 HA ILE 113 6.561 9.842 0.836 823 HB ILE 113 HB ILE 113 7.169 8.526 -1.800 824 HG12 ILE 113 HG12 ILE 113 8.940 9.303 0.519 825 HG13 ILE 113 HG11 ILE 113 8.219 7.709 0.327 826 HG21 ILE 113 HG21 ILE 113 8.171 11.200 -0.835 827 HG22 ILE 113 HG22 ILE 113 7.122 10.921 -2.227 828 HG23 ILE 113 HG23 ILE 113 8.783 10.325 -2.237 829 HD11 ILE 113 HD11 ILE 113 9.476 7.396 -1.741 830 HD12 ILE 113 HD12 ILE 113 10.546 7.756 -0.390 831 HD13 ILE 113 HD13 ILE 113 10.167 9.007 -1.570 832 H LYS 114 HN LYS 114 4.604 8.916 -1.985 833 HA LYS 114 HA LYS 114 3.887 11.585 -2.647 834 HB2 LYS 114 HB2 LYS 114 2.799 10.677 -4.391 835 HB3 LYS 114 HB1 LYS 114 3.581 9.190 -3.896 836 HG2 LYS 114 HG2 LYS 114 1.469 8.412 -4.077 837 HG3 LYS 114 HG1 LYS 114 1.373 8.992 -2.414 838 HD2 LYS 114 HD2 LYS 114 0.349 11.054 -3.143 839 HD3 LYS 114 HD1 LYS 114 0.546 10.600 -4.838 840 HE2 LYS 114 HE2 LYS 114 -0.927 8.639 -4.417 841 HE3 LYS 114 HE1 LYS 114 -1.180 9.232 -2.778 842 HZ1 LYS 114 HZ1 LYS 114 -2.973 9.840 -4.349 843 HZ2 LYS 114 HZ2 LYS 114 -1.868 10.771 -5.224 844 HZ3 LYS 114 HZ3 LYS 114 -2.242 11.184 -3.618 845 H VAL 115 HN VAL 115 2.500 9.207 -0.486 846 HA VAL 115 HA VAL 115 0.072 10.457 0.132 847 HB VAL 115 HB VAL 115 1.843 8.529 1.609 848 HG11 VAL 115 HG11 VAL 115 0.836 9.924 3.351 849 HG12 VAL 115 HG12 VAL 115 0.149 8.302 3.352 850 HG13 VAL 115 HG13 VAL 115 -0.761 9.642 2.657 851 HG21 VAL 115 HG21 VAL 115 0.496 7.730 -0.272 852 HG22 VAL 115 HG22 VAL 115 -0.961 8.323 0.524 853 HG23 VAL 115 HG23 VAL 115 -0.028 7.018 1.256 854 H LYS 116 HN LYS 116 3.235 10.764 1.790 855 HA LYS 116 HA LYS 116 2.326 12.743 3.617 856 HB2 LYS 116 HB2 LYS 116 4.703 13.172 4.043 857 HB3 LYS 116 HB1 LYS 116 4.352 11.446 4.046 858 HG2 LYS 116 HG2 LYS 116 5.298 11.142 1.932 859 HG3 LYS 116 HG1 LYS 116 5.337 12.875 1.614 860 HD2 LYS 116 HD2 LYS 116 7.005 13.132 3.403 861 HD3 LYS 116 HD1 LYS 116 7.006 11.374 3.620 862 HE2 LYS 116 HE2 LYS 116 8.848 12.029 2.193 863 HE3 LYS 116 HE1 LYS 116 7.658 11.106 1.274 864 HZ1 LYS 116 HZ1 LYS 116 6.820 13.131 0.323 865 HZ2 LYS 116 HZ2 LYS 116 8.498 13.073 0.085 866 HZ3 LYS 116 HZ3 LYS 116 7.849 14.076 1.285 867 H LEU 117 HN LEU 117 3.446 12.827 0.341 868 HA LEU 117 HA LEU 117 4.168 15.579 0.232 869 HG LEU 117 HG LEU 117 3.433 16.050 -2.727 870 HB2 LEU 117 HB2 LEU 117 5.020 13.885 -1.332 871 HB3 LEU 117 HB1 LEU 117 3.389 13.665 -1.968 872 HD11 LEU 117 HD11 LEU 117 5.133 16.886 -1.194 873 HD12 LEU 117 HD12 LEU 117 5.593 17.178 -2.872 874 HD13 LEU 117 HD13 LEU 117 6.345 15.864 -1.966 875 HD21 LEU 117 HD21 LEU 117 4.863 15.608 -4.657 876 HD22 LEU 117 HD22 LEU 117 3.880 14.201 -4.251 877 HD23 LEU 117 HD23 LEU 117 5.589 14.241 -3.811 878 H GLU 118 HN GLU 118 1.189 13.860 0.104 879 HA GLU 118 HA GLU 118 -0.343 15.824 -1.270 880 HB2 GLU 118 HB2 GLU 118 -1.275 13.693 0.666 881 HB3 GLU 118 HB1 GLU 118 -2.299 14.597 -0.443 882 HG2 GLU 118 HG2 GLU 118 -1.007 13.648 -2.330 883 HG3 GLU 118 HG1 GLU 118 -0.114 12.660 -1.167 884 H GLY 119 HN GLY 119 1.059 15.825 1.792 885 HA2 GLY 119 HA2 GLY 119 1.025 18.023 2.862 886 HA3 GLY 119 HA1 GLY 119 -0.697 18.089 2.521 887 H HIS 120 HN HIS 120 -0.076 14.981 3.428 888 HA HIS 120 HA HIS 120 -0.350 15.608 6.282 889 HD1 HIS 120 HD1 HIS 120 -2.070 11.847 6.941 890 HD2 HIS 120 HD2 HIS 120 -1.991 12.844 2.897 891 HE1 HIS 120 HE1 HIS 120 -2.236 9.672 5.706 892 HE2 HIS 120 HE2 HIS 120 -2.494 10.338 3.286 893 HB2 HIS 120 HB2 HIS 120 -2.217 14.294 6.583 894 HB3 HIS 120 HB1 HIS 120 -2.516 14.874 4.952 895 H GLU 121 HN GLU 121 0.884 14.398 7.623 896 HA GLU 121 HA GLU 121 2.925 12.794 6.452 897 HB2 GLU 121 HB2 GLU 121 3.710 12.460 8.759 898 HB3 GLU 121 HB1 GLU 121 3.415 14.156 8.401 899 HG2 GLU 121 HG2 GLU 121 1.585 14.272 9.784 900 HG3 GLU 121 HG1 GLU 121 1.273 12.538 9.690 901 H LEU 122 HN LEU 122 3.467 10.614 7.287 902 HA LEU 122 HA LEU 122 1.304 8.842 6.837 903 HG LEU 122 HG LEU 122 2.974 8.149 5.101 904 HB2 LEU 122 HB2 LEU 122 4.065 8.261 7.903 905 HB3 LEU 122 HB1 LEU 122 2.898 7.047 7.405 906 HD11 LEU 122 HD11 LEU 122 4.086 10.224 5.751 907 HD12 LEU 122 HD12 LEU 122 5.032 9.343 4.552 908 HD13 LEU 122 HD13 LEU 122 5.512 9.312 6.248 909 HD21 LEU 122 HD21 LEU 122 4.970 6.869 4.497 910 HD22 LEU 122 HD22 LEU 122 3.927 5.983 5.609 911 HD23 LEU 122 HD23 LEU 122 5.397 6.750 6.206 912 HA PRO 123 HA PRO 123 -0.115 8.530 10.971 913 HB2 PRO 123 HB2 PRO 123 -2.044 6.750 10.559 914 HB3 PRO 123 HB1 PRO 123 -2.090 8.325 9.756 915 HG2 PRO 123 HG2 PRO 123 -1.347 5.646 8.660 916 HG3 PRO 123 HG1 PRO 123 -2.190 6.995 7.864 917 HD2 PRO 123 HD2 PRO 123 0.546 6.359 7.662 918 HD3 PRO 123 HD1 PRO 123 -0.236 7.851 7.103 919 H ALA 124 HN ALA 124 1.606 6.064 9.482 920 HA ALA 124 HA ALA 124 2.622 4.165 10.158 921 HB1 ALA 124 HB1 ALA 124 3.551 5.557 11.926 922 HB2 ALA 124 HB2 ALA 124 3.218 3.933 12.529 923 HB3 ALA 124 HB3 ALA 124 2.125 5.260 12.921 924 H ASP 125 HN ASP 125 -0.165 4.090 9.605 925 HA ASP 125 HA ASP 125 -0.747 1.689 11.186 926 HB2 ASP 125 HB2 ASP 125 -2.997 1.907 10.805 927 HB3 ASP 125 HB1 ASP 125 -2.510 3.561 11.095 928 H LEU 126 HN LEU 126 -0.839 -0.193 10.237 929 HA LEU 126 HA LEU 126 -0.433 -0.301 7.326 930 HG LEU 126 HG LEU 126 0.238 -3.206 7.023 931 HB2 LEU 126 HB2 LEU 126 1.450 -1.090 8.801 932 HB3 LEU 126 HB1 LEU 126 0.399 -2.388 9.334 933 HD11 LEU 126 HD11 LEU 126 1.629 -2.266 5.283 934 HD12 LEU 126 HD12 LEU 126 2.270 -1.066 6.407 935 HD13 LEU 126 HD13 LEU 126 0.571 -1.014 5.944 936 HD21 LEU 126 HD21 LEU 126 1.950 -4.116 8.502 937 HD22 LEU 126 HD22 LEU 126 3.064 -2.839 8.013 938 HD23 LEU 126 HD23 LEU 126 2.527 -4.040 6.840 939 HA PRO 127 HA PRO 127 -4.388 -2.419 7.996 940 HB2 PRO 127 HB2 PRO 127 -5.809 -0.969 6.266 941 HB3 PRO 127 HB1 PRO 127 -5.304 -0.299 7.823 942 HG2 PRO 127 HG2 PRO 127 -4.305 0.270 5.105 943 HG3 PRO 127 HG1 PRO 127 -4.284 1.296 6.549 944 HD2 PRO 127 HD2 PRO 127 -2.161 -0.331 5.487 945 HD3 PRO 127 HD1 PRO 127 -2.134 0.710 6.927 946 HA PRO 128 HA PRO 128 -4.729 -5.345 4.682 947 HB2 PRO 128 HB2 PRO 128 -7.406 -5.013 3.929 948 HB3 PRO 128 HB1 PRO 128 -6.798 -6.101 5.187 949 HG2 PRO 128 HG2 PRO 128 -8.005 -3.385 5.449 950 HG3 PRO 128 HG1 PRO 128 -8.147 -4.791 6.519 951 HD2 PRO 128 HD2 PRO 128 -6.581 -2.709 7.140 952 HD3 PRO 128 HD1 PRO 128 -6.115 -4.376 7.541 953 H HIS 129 HN HIS 129 -5.951 -2.104 4.068 954 HA HIS 129 HA HIS 129 -5.879 -2.516 1.210 955 HD1 HIS 129 HD1 HIS 129 -8.191 -0.548 4.331 956 HD2 HIS 129 HD2 HIS 129 -5.181 1.807 2.683 957 HE1 HIS 129 HE1 HIS 129 -7.824 1.323 5.966 958 HE2 HIS 129 HE2 HIS 129 -5.853 2.610 5.059 959 HB2 HIS 129 HB2 HIS 129 -6.534 -0.097 1.063 960 HB3 HIS 129 HB1 HIS 129 -7.673 -1.119 1.912 961 H LEU 130 HN LEU 130 -3.371 -2.504 2.996 962 HA LEU 130 HA LEU 130 -1.782 -1.292 0.868 963 HG LEU 130 HG LEU 130 -1.125 0.866 1.020 964 HB2 LEU 130 HB2 LEU 130 -1.774 -0.354 3.636 965 HB3 LEU 130 HB1 LEU 130 -0.187 -0.672 2.989 966 HD11 LEU 130 HD11 LEU 130 -2.537 1.908 3.467 967 HD12 LEU 130 HD12 LEU 130 -3.316 1.201 2.050 968 HD13 LEU 130 HD13 LEU 130 -2.419 2.715 1.902 969 HD21 LEU 130 HD21 LEU 130 0.925 1.226 2.255 970 HD22 LEU 130 HD22 LEU 130 0.012 1.848 3.631 971 HD23 LEU 130 HD23 LEU 130 0.024 2.736 2.106 972 H VAL 131 HN VAL 131 -2.477 -4.035 2.096 973 HA VAL 131 HA VAL 131 -0.074 -4.948 3.337 974 HB VAL 131 HB VAL 131 -2.322 -6.543 2.102 975 HG11 VAL 131 HG11 VAL 131 -0.293 -7.870 2.146 976 HG12 VAL 131 HG12 VAL 131 -1.401 -8.431 3.398 977 HG13 VAL 131 HG13 VAL 131 -0.016 -7.433 3.832 978 HG21 VAL 131 HG21 VAL 131 -3.049 -6.878 4.394 979 HG22 VAL 131 HG22 VAL 131 -2.956 -5.152 4.037 980 HG23 VAL 131 HG23 VAL 131 -1.686 -5.927 4.983 981 HA PRO 132 HA PRO 132 2.191 -5.230 -0.542 982 HB2 PRO 132 HB2 PRO 132 4.333 -6.257 1.189 983 HB3 PRO 132 HB1 PRO 132 4.324 -4.839 0.134 984 HG2 PRO 132 HG2 PRO 132 4.274 -4.616 2.816 985 HG3 PRO 132 HG1 PRO 132 3.441 -3.467 1.753 986 HD2 PRO 132 HD2 PRO 132 2.315 -5.737 3.351 987 HD3 PRO 132 HD1 PRO 132 1.656 -4.105 3.066 988 HA PRO 133 HA PRO 133 1.399 -9.617 -1.036 989 HB2 PRO 133 HB2 PRO 133 2.309 -9.131 -3.786 990 HB3 PRO 133 HB1 PRO 133 0.733 -9.695 -3.204 991 HG2 PRO 133 HG2 PRO 133 1.082 -7.232 -4.243 992 HG3 PRO 133 HG1 PRO 133 -0.081 -7.550 -2.928 993 HD2 PRO 133 HD2 PRO 133 2.672 -6.362 -2.794 994 HD3 PRO 133 HD1 PRO 133 1.183 -5.876 -1.935 995 H SER 134 HN SER 134 4.291 -7.999 -0.969 996 HA SER 134 HA SER 134 5.886 -10.306 -1.780 997 HG SER 134 HG SER 134 7.391 -6.606 -0.989 998 HB2 SER 134 HB2 SER 134 7.807 -8.757 -1.408 999 HB3 SER 134 HB1 SER 134 6.649 -8.156 -2.593 1000 H LYS 135 HN LYS 135 4.859 -8.588 1.106 1001 HA LYS 135 HA LYS 135 6.828 -10.008 2.704 1002 HB2 LYS 135 HB2 LYS 135 5.930 -8.678 4.627 1003 HB3 LYS 135 HB1 LYS 135 6.643 -7.736 3.336 1004 HG2 LYS 135 HG2 LYS 135 4.722 -6.581 4.065 1005 HG3 LYS 135 HG1 LYS 135 4.334 -7.278 2.497 1006 HD2 LYS 135 HD2 LYS 135 2.425 -7.651 3.789 1007 HD3 LYS 135 HD1 LYS 135 3.267 -9.196 3.818 1008 HE2 LYS 135 HE2 LYS 135 3.697 -7.187 6.004 1009 HE3 LYS 135 HE1 LYS 135 2.282 -8.232 6.024 1010 HZ1 LYS 135 HZ1 LYS 135 5.126 -9.065 6.107 1011 HZ2 LYS 135 HZ2 LYS 135 3.845 -10.141 5.856 1012 HZ3 LYS 135 HZ3 LYS 135 3.950 -9.280 7.308 1013 H ARG 136 HN ARG 136 3.914 -10.812 1.514 1014 HA ARG 136 HA ARG 136 2.813 -12.166 3.770 1015 HE ARG 136 HE ARG 136 1.831 -15.055 -0.351 1016 HB2 ARG 136 HB2 ARG 136 1.791 -13.609 1.773 1017 HB3 ARG 136 HB1 ARG 136 1.169 -12.020 2.198 1018 HG2 ARG 136 HG2 ARG 136 1.879 -11.080 0.290 1019 HG3 ARG 136 HG1 ARG 136 3.367 -12.027 0.249 1020 HD2 ARG 136 HD2 ARG 136 0.636 -13.126 -0.420 1021 HD3 ARG 136 HD1 ARG 136 1.781 -12.513 -1.615 1022 HH11 ARG 136 HH11 ARG 136 3.898 -12.538 -1.658 1023 HH12 ARG 136 HH12 ARG 136 5.261 -13.597 -1.871 1024 HH21 ARG 136 HH21 ARG 136 3.606 -16.460 -0.684 1025 HH22 ARG 136 HH22 ARG 136 5.080 -15.825 -1.352 1026 H ARG 137 HN ARG 137 4.645 -13.136 4.679 1027 HA ARG 137 HA ARG 137 5.362 -15.687 3.475 1028 HE ARG 137 HE ARG 137 9.664 -14.675 3.362 1029 HB2 ARG 137 HB2 ARG 137 7.769 -15.284 3.723 1030 HB3 ARG 137 HB1 ARG 137 7.050 -14.123 2.617 1031 HG2 ARG 137 HG2 ARG 137 6.958 -12.496 4.526 1032 HG3 ARG 137 HG1 ARG 137 7.911 -13.648 5.456 1033 HD2 ARG 137 HD2 ARG 137 8.712 -12.329 2.880 1034 HD3 ARG 137 HD1 ARG 137 9.359 -11.976 4.475 1035 HH11 ARG 137 HH11 ARG 137 11.116 -11.649 4.426 1036 HH12 ARG 137 HH12 ARG 137 12.741 -12.273 4.341 1037 HH21 ARG 137 HH21 ARG 137 11.774 -15.478 3.278 1038 HH22 ARG 137 HH22 ARG 137 13.110 -14.454 3.696 1039 H HIS 138 HN HIS 138 5.534 -17.230 4.966 1040 HA HIS 138 HA HIS 138 6.053 -16.462 7.750 1041 HD1 HIS 138 HD1 HIS 138 4.128 -20.122 8.782 1042 HD2 HIS 138 HD2 HIS 138 4.119 -16.190 10.141 1043 HE1 HIS 138 HE1 HIS 138 3.937 -20.268 11.284 1044 HE2 HIS 138 HE2 HIS 138 3.893 -17.883 12.090 1045 HB2 HIS 138 HB2 HIS 138 3.584 -16.804 7.349 1046 HB3 HIS 138 HB1 HIS 138 3.948 -18.471 6.923 1047 H GLU 139 HN GLU 139 8.044 -17.344 7.963 1048 HA GLU 139 HA GLU 139 8.705 -19.833 6.641 1049 HB2 GLU 139 HB2 GLU 139 10.446 -18.195 8.496 1050 HB3 GLU 139 HB1 GLU 139 10.971 -19.428 7.360 1051 HG2 GLU 139 HG2 GLU 139 9.842 -16.717 6.705 1052 HG3 GLU 139 HG1 GLU 139 11.500 -17.266 6.483 Start of MODEL 3 1 H1 GLY 1 HT1 GLY 1 11.879 17.253 19.603 2 H2 GLY 1 HT2 GLY 1 11.540 16.340 20.989 3 H3 GLY 1 HT3 GLY 1 13.144 16.720 20.592 4 HA2 GLY 1 HA1 GLY 1 12.314 18.095 22.410 5 HA3 GLY 1 HA2 GLY 1 12.774 19.035 20.995 6 HA PRO 2 HA PRO 2 8.564 20.487 22.096 7 HB2 PRO 2 HB2 PRO 2 8.985 23.067 21.386 8 HB3 PRO 2 HB1 PRO 2 9.462 22.413 22.957 9 HG2 PRO 2 HG2 PRO 2 11.132 22.918 20.527 10 HG3 PRO 2 HG1 PRO 2 11.514 23.213 22.233 11 HD2 PRO 2 HD2 PRO 2 12.423 21.051 20.843 12 HD3 PRO 2 HD1 PRO 2 12.144 21.038 22.594 13 H LEU 3 HN LEU 3 10.403 20.590 19.156 14 HA LEU 3 HA LEU 3 7.937 21.087 17.621 15 HG LEU 3 HG LEU 3 9.177 20.864 14.825 16 HB2 LEU 3 HB2 LEU 3 9.883 22.604 17.189 17 HB3 LEU 3 HB1 LEU 3 10.798 21.209 16.648 18 HD11 LEU 3 HD11 LEU 3 7.199 21.815 15.839 19 HD12 LEU 3 HD12 LEU 3 7.548 22.631 14.314 20 HD13 LEU 3 HD13 LEU 3 7.940 23.415 15.846 21 HD21 LEU 3 HD21 LEU 3 11.185 22.170 14.421 22 HD22 LEU 3 HD22 LEU 3 10.351 23.635 14.945 23 HD23 LEU 3 HD23 LEU 3 9.829 22.796 13.482 24 H GLY 4 HN GLY 4 7.177 19.532 16.240 25 HA2 GLY 4 HA2 GLY 4 7.228 17.469 15.089 26 HA3 GLY 4 HA1 GLY 4 8.739 17.078 15.904 27 H SER 5 HN SER 5 5.942 18.343 17.521 28 HA SER 5 HA SER 5 5.971 16.137 19.363 29 HG SER 5 HG SER 5 4.245 19.781 19.669 30 HB2 SER 5 HB2 SER 5 4.095 17.533 20.432 31 HB3 SER 5 HB1 SER 5 5.707 18.250 20.376 32 H GLU 6 HN GLU 6 4.644 14.472 19.419 33 HA GLU 6 HA GLU 6 2.537 14.293 17.409 34 HB2 GLU 6 HB2 GLU 6 2.499 11.878 18.093 35 HB3 GLU 6 HB1 GLU 6 4.033 12.430 17.434 36 HG2 GLU 6 HG2 GLU 6 4.753 12.775 19.852 37 HG3 GLU 6 HG1 GLU 6 3.335 11.817 20.282 38 H SER 7 HN SER 7 0.433 14.324 17.880 39 HA SER 7 HA SER 7 -0.374 14.974 20.566 40 HG SER 7 HG SER 7 -2.665 16.265 20.262 41 HB2 SER 7 HB2 SER 7 -1.318 16.107 18.552 42 HB3 SER 7 HB1 SER 7 -2.064 14.582 18.088 43 H LEU 8 HN LEU 8 -0.256 13.232 21.875 44 HA LEU 8 HA LEU 8 -1.265 10.656 21.043 45 HG LEU 8 HG LEU 8 1.583 11.523 22.029 46 HB2 LEU 8 HB2 LEU 8 -0.209 11.602 23.710 47 HB3 LEU 8 HB1 LEU 8 -0.641 9.946 23.333 48 HD11 LEU 8 HD11 LEU 8 2.099 10.905 24.323 49 HD12 LEU 8 HD12 LEU 8 3.052 9.944 23.191 50 HD13 LEU 8 HD13 LEU 8 1.650 9.232 23.987 51 HD21 LEU 8 HD21 LEU 8 0.545 9.923 20.488 52 HD22 LEU 8 HD22 LEU 8 0.773 8.637 21.672 53 HD23 LEU 8 HD23 LEU 8 2.174 9.422 20.943 54 H MET 9 HN MET 9 -3.432 10.810 20.749 55 HA MET 9 HA MET 9 -5.127 12.054 22.725 56 HB2 MET 9 HB2 MET 9 -5.745 10.531 20.194 57 HB3 MET 9 HB1 MET 9 -6.978 11.226 21.237 58 HG2 MET 9 HG2 MET 9 -4.795 12.786 19.877 59 HG3 MET 9 HG1 MET 9 -6.444 12.622 19.280 60 HE1 MET 9 HE1 MET 9 -8.087 12.726 22.067 61 HE2 MET 9 HE2 MET 9 -8.568 13.519 20.568 62 HE3 MET 9 HE3 MET 9 -8.506 14.440 22.071 63 HA PRO 10 HA PRO 10 -5.712 8.425 25.235 64 HB2 PRO 10 HB2 PRO 10 -8.255 9.745 25.974 65 HB3 PRO 10 HB1 PRO 10 -6.919 9.227 27.008 66 HG2 PRO 10 HG2 PRO 10 -7.354 11.815 26.504 67 HG3 PRO 10 HG1 PRO 10 -5.710 11.163 26.635 68 HD2 PRO 10 HD2 PRO 10 -7.275 11.869 24.183 69 HD3 PRO 10 HD1 PRO 10 -5.555 12.138 24.538 70 H SER 11 HN SER 11 -8.103 9.746 23.064 71 HA SER 11 HA SER 11 -9.741 7.372 23.099 72 HG SER 11 HG SER 11 -9.854 10.445 20.644 73 HB2 SER 11 HB2 SER 11 -10.881 8.695 21.163 74 HB3 SER 11 HB1 SER 11 -11.024 9.297 22.812 75 H GLN 12 HN GLN 12 -8.357 5.767 22.395 76 HA GLN 12 HA GLN 12 -7.783 5.847 19.511 77 HB2 GLN 12 HB2 GLN 12 -6.104 4.791 21.770 78 HB3 GLN 12 HB1 GLN 12 -5.932 4.133 20.151 79 HG2 GLN 12 HG2 GLN 12 -5.288 6.267 19.281 80 HG3 GLN 12 HG1 GLN 12 -5.642 7.053 20.821 81 HE21 GLN 12 HE21 GLN 12 -4.186 6.927 22.473 82 HE22 GLN 12 HE22 GLN 12 -2.594 6.263 22.294 83 H VAL 13 HN VAL 13 -9.788 4.902 19.078 84 HA VAL 13 HA VAL 13 -10.472 2.410 20.403 85 HB VAL 13 HB VAL 13 -12.241 4.059 20.025 86 HG11 VAL 13 HG11 VAL 13 -11.463 5.066 17.965 87 HG12 VAL 13 HG12 VAL 13 -13.122 4.495 17.789 88 HG13 VAL 13 HG13 VAL 13 -11.792 3.573 17.089 89 HG21 VAL 13 HG21 VAL 13 -12.839 1.708 20.176 90 HG22 VAL 13 HG22 VAL 13 -12.645 1.533 18.431 91 HG23 VAL 13 HG23 VAL 13 -13.922 2.564 19.082 92 H VAL 14 HN VAL 14 -10.212 0.439 19.596 93 HA VAL 14 HA VAL 14 -9.426 0.176 16.774 94 HB VAL 14 HB VAL 14 -8.038 -1.774 17.422 95 HG11 VAL 14 HG11 VAL 14 -6.949 0.352 17.100 96 HG12 VAL 14 HG12 VAL 14 -6.194 -0.482 18.462 97 HG13 VAL 14 HG13 VAL 14 -7.329 0.839 18.749 98 HG21 VAL 14 HG21 VAL 14 -9.123 -2.404 19.498 99 HG22 VAL 14 HG22 VAL 14 -8.632 -0.882 20.246 100 HG23 VAL 14 HG23 VAL 14 -7.415 -2.075 19.795 101 H LYS 15 HN LYS 15 -10.502 -1.299 15.594 102 HA LYS 15 HA LYS 15 -12.411 -3.027 17.017 103 HB2 LYS 15 HB2 LYS 15 -12.649 -1.722 14.305 104 HB3 LYS 15 HB1 LYS 15 -13.740 -2.980 14.875 105 HG2 LYS 15 HG2 LYS 15 -14.383 -1.538 16.760 106 HG3 LYS 15 HG1 LYS 15 -13.336 -0.269 16.126 107 HD2 LYS 15 HD2 LYS 15 -14.653 -0.159 14.088 108 HD3 LYS 15 HD1 LYS 15 -15.661 -1.496 14.637 109 HE2 LYS 15 HE2 LYS 15 -16.417 -0.129 16.531 110 HE3 LYS 15 HE1 LYS 15 -15.426 1.209 15.947 111 HZ1 LYS 15 HZ1 LYS 15 -17.767 1.417 15.304 112 HZ2 LYS 15 HZ2 LYS 15 -17.668 -0.038 14.437 113 HZ3 LYS 15 HZ3 LYS 15 -16.752 1.308 13.949 114 H GLY 16 HN GLY 16 -10.898 -4.710 17.207 115 HA2 GLY 16 HA2 GLY 16 -9.620 -5.794 14.867 116 HA3 GLY 16 HA1 GLY 16 -9.601 -6.485 16.485 117 H GLY 17 HN GLY 17 -10.896 -6.696 13.364 118 HA2 GLY 17 HA2 GLY 17 -12.214 -8.335 12.421 119 HA3 GLY 17 HA1 GLY 17 -12.303 -9.113 13.996 120 H ALA 18 HN ALA 18 -13.181 -5.785 13.658 121 HA ALA 18 HA ALA 18 -16.036 -6.498 13.717 122 HB1 ALA 18 HB1 ALA 18 -16.429 -4.696 15.300 123 HB2 ALA 18 HB2 ALA 18 -14.708 -4.314 15.315 124 HB3 ALA 18 HB3 ALA 18 -15.277 -5.856 15.958 125 H PHE 19 HN PHE 19 -16.794 -5.864 11.808 126 HA PHE 19 HA PHE 19 -15.965 -3.214 10.812 127 HD1 PHE 19 HD1 PHE 19 -14.124 -3.205 8.462 128 HD2 PHE 19 HD2 PHE 19 -14.966 -7.073 10.022 129 HE1 PHE 19 HE1 PHE 19 -11.734 -3.777 8.326 130 HE2 PHE 19 HE2 PHE 19 -12.580 -7.651 9.889 131 HZ PHE 19 HZ PHE 19 -10.960 -5.998 9.040 132 HB2 PHE 19 HB2 PHE 19 -16.734 -5.667 9.213 133 HB3 PHE 19 HB1 PHE 19 -16.402 -4.082 8.526 134 H ASP 20 HN ASP 20 -17.596 -1.901 11.379 135 HA ASP 20 HA ASP 20 -20.344 -2.698 11.246 136 HB2 ASP 20 HB2 ASP 20 -19.044 0.013 11.603 137 HB3 ASP 20 HB1 ASP 20 -20.789 -0.235 11.605 138 H GLY 21 HN GLY 21 -20.694 -3.408 9.176 139 HA2 GLY 21 HA2 GLY 21 -20.202 -1.613 6.945 140 HA3 GLY 21 HA1 GLY 21 -20.835 -3.250 6.853 141 H THR 22 HN THR 22 -21.731 -0.031 8.038 142 HA THR 22 HA THR 22 -24.536 -0.585 7.799 143 HB THR 22 HB THR 22 -24.766 1.886 8.278 144 HG1 THR 22 HG1 THR 22 -22.803 2.632 7.485 145 HG21 THR 22 HG21 THR 22 -24.837 0.254 10.092 146 HG22 THR 22 HG22 THR 22 -23.985 1.708 10.614 147 HG23 THR 22 HG23 THR 22 -23.077 0.259 10.186 148 H MET 23 HN MET 23 -25.142 -0.992 5.734 149 HA MET 23 HA MET 23 -24.900 1.205 3.835 150 HB2 MET 23 HB2 MET 23 -23.028 -0.340 3.358 151 HB3 MET 23 HB1 MET 23 -24.180 -1.651 3.141 152 HG2 MET 23 HG2 MET 23 -23.425 -0.759 1.010 153 HG3 MET 23 HG1 MET 23 -25.156 -0.502 1.236 154 HE1 MET 23 HE1 MET 23 -24.141 2.676 -0.793 155 HE2 MET 23 HE2 MET 23 -25.254 1.313 -0.676 156 HE3 MET 23 HE3 MET 23 -23.543 1.028 -0.996 157 H ASN 24 HN ASN 24 -26.660 1.478 2.594 158 HA ASN 24 HA ASN 24 -28.849 -0.456 2.939 159 HB2 ASN 24 HB2 ASN 24 -29.279 1.804 3.864 160 HB3 ASN 24 HB1 ASN 24 -29.014 2.496 2.268 161 HD21 ASN 24 HD21 ASN 24 -31.133 0.548 4.237 162 HD22 ASN 24 HD22 ASN 24 -32.517 0.686 3.203 163 H GLY 25 HN GLY 25 -30.342 -0.594 1.042 164 HA2 GLY 25 HA2 GLY 25 -30.512 -0.207 -1.390 165 HA3 GLY 25 HA1 GLY 25 -28.775 -0.452 -1.455 166 HA PRO 26 HA PRO 26 -29.863 -4.921 -1.450 167 HB2 PRO 26 HB2 PRO 26 -28.898 -5.813 1.122 168 HB3 PRO 26 HB1 PRO 26 -28.168 -6.052 -0.467 169 HG2 PRO 26 HG2 PRO 26 -27.075 -4.484 1.485 170 HG3 PRO 26 HG1 PRO 26 -26.801 -4.231 -0.247 171 HD2 PRO 26 HD2 PRO 26 -28.690 -2.813 1.598 172 HD3 PRO 26 HD1 PRO 26 -27.651 -2.147 0.319 173 H PHE 27 HN PHE 27 -31.500 -2.915 0.240 174 HA PHE 27 HA PHE 27 -32.974 -4.729 1.968 175 HD1 PHE 27 HD2 PHE 27 -33.982 -4.018 4.326 176 HD2 PHE 27 HD1 PHE 27 -35.485 -1.169 1.545 177 HE1 PHE 27 HE2 PHE 27 -36.136 -4.007 5.508 178 HE2 PHE 27 HE1 PHE 27 -37.641 -1.148 2.728 179 HZ PHE 27 HZ PHE 27 -37.967 -2.571 4.714 180 HB2 PHE 27 HB2 PHE 27 -32.489 -2.528 2.870 181 HB3 PHE 27 HB1 PHE 27 -33.240 -1.750 1.482 182 H GLY 28 HN GLY 28 -34.478 -5.937 1.073 183 HA2 GLY 28 HA2 GLY 28 -36.708 -4.948 -0.275 184 HA3 GLY 28 HA1 GLY 28 -35.565 -5.505 -1.493 185 H HIS 29 HN HIS 29 -37.698 -6.890 -1.706 186 HA HIS 29 HA HIS 29 -37.500 -9.204 0.087 187 HD1 HIS 29 HD1 HIS 29 -39.871 -6.243 -1.781 188 HD2 HIS 29 HD2 HIS 29 -40.637 -10.020 -3.350 189 HE1 HIS 29 HE1 HIS 29 -41.041 -5.843 -3.966 190 HE2 HIS 29 HE2 HIS 29 -41.679 -8.139 -4.792 191 HB2 HIS 29 HB2 HIS 29 -39.705 -9.887 -0.784 192 HB3 HIS 29 HB1 HIS 29 -39.746 -8.289 -0.060 193 H GLY 30 HN GLY 30 -36.574 -10.999 -0.583 194 HA2 GLY 30 HA2 GLY 30 -36.594 -12.139 -3.103 195 HA3 GLY 30 HA1 GLY 30 -35.232 -11.025 -3.086 196 H TYR 31 HN TYR 31 -34.171 -13.251 -3.445 197 HA TYR 31 HA TYR 31 -33.982 -15.007 -1.192 198 HD1 TYR 31 HD1 TYR 31 -34.483 -17.339 -2.212 199 HD2 TYR 31 HD2 TYR 31 -33.354 -14.956 -5.552 200 HE1 TYR 31 HE1 TYR 31 -36.129 -18.520 -3.611 201 HE2 TYR 31 HE2 TYR 31 -34.990 -16.133 -6.954 202 HH TYR 31 HH TYR 31 -36.089 -18.445 -6.921 203 HB2 TYR 31 HB2 TYR 31 -32.155 -14.765 -3.592 204 HB3 TYR 31 HB1 TYR 31 -32.169 -16.098 -2.446 205 H GLY 32 HN GLY 32 -32.730 -14.824 0.549 206 HA2 GLY 32 HA2 GLY 32 -31.006 -12.566 0.902 207 HA3 GLY 32 HA1 GLY 32 -31.256 -13.875 2.050 208 H GLU 33 HN GLU 33 -28.767 -12.652 1.485 209 HA GLU 33 HA GLU 33 -27.256 -14.191 -0.368 210 HB2 GLU 33 HB2 GLU 33 -26.092 -12.714 1.984 211 HB3 GLU 33 HB1 GLU 33 -25.355 -13.041 0.425 212 HG2 GLU 33 HG2 GLU 33 -25.871 -10.885 0.053 213 HG3 GLU 33 HG1 GLU 33 -27.433 -11.571 -0.389 214 H GLY 34 HN GLY 34 -26.201 -16.052 -0.141 215 HA2 GLY 34 HA2 GLY 34 -26.470 -17.635 2.229 216 HA3 GLY 34 HA1 GLY 34 -25.537 -18.052 0.796 217 H ALA 35 HN ALA 35 -24.931 -18.160 3.766 218 HA ALA 35 HA ALA 35 -23.244 -16.191 4.671 219 HB1 ALA 35 HB1 ALA 35 -22.249 -17.843 6.139 220 HB2 ALA 35 HB2 ALA 35 -22.890 -19.147 5.140 221 HB3 ALA 35 HB3 ALA 35 -23.991 -18.089 6.026 222 H GLY 36 HN GLY 36 -21.301 -15.441 4.181 223 HA2 GLY 36 HA2 GLY 36 -19.648 -16.985 2.296 224 HA3 GLY 36 HA1 GLY 36 -19.751 -15.228 2.285 225 H GLU 37 HN GLU 37 -17.543 -17.251 2.724 226 HA GLU 37 HA GLU 37 -16.704 -16.689 5.429 227 HB2 GLU 37 HB2 GLU 37 -16.350 -18.900 4.439 228 HB3 GLU 37 HB1 GLU 37 -15.339 -18.185 3.194 229 HG2 GLU 37 HG2 GLU 37 -14.059 -19.303 4.975 230 HG3 GLU 37 HG1 GLU 37 -13.666 -17.594 4.799 231 H GLY 38 HN GLY 38 -14.685 -15.671 5.959 232 HA2 GLY 38 HA2 GLY 38 -14.277 -13.291 4.389 233 HA3 GLY 38 HA1 GLY 38 -13.439 -13.711 5.876 234 H ILE 39 HN ILE 39 -13.694 -14.735 2.524 235 HA ILE 39 HA ILE 39 -11.096 -15.751 2.259 236 HB ILE 39 HB ILE 39 -11.427 -15.220 -0.202 237 HG12 ILE 39 HG12 ILE 39 -14.002 -14.105 0.918 238 HG13 ILE 39 HG11 ILE 39 -12.854 -13.318 -0.155 239 HG21 ILE 39 HG21 ILE 39 -12.015 -17.375 0.808 240 HG22 ILE 39 HG22 ILE 39 -13.122 -16.944 -0.497 241 HG23 ILE 39 HG23 ILE 39 -13.623 -16.755 1.183 242 HD11 ILE 39 HD11 ILE 39 -13.504 -14.861 -1.940 243 HD12 ILE 39 HD12 ILE 39 -14.869 -13.924 -1.333 244 HD13 ILE 39 HD13 ILE 39 -14.671 -15.607 -0.847 245 H ASP 40 HN ASP 40 -9.251 -14.716 1.192 246 HA ASP 40 HA ASP 40 -8.818 -12.214 2.509 247 HB2 ASP 40 HB2 ASP 40 -6.484 -12.421 1.625 248 HB3 ASP 40 HB1 ASP 40 -7.025 -13.794 2.581 249 H ASP 41 HN ASP 41 -10.443 -11.045 1.352 250 HA ASP 41 HA ASP 41 -10.159 -10.292 -1.364 251 HB2 ASP 41 HB2 ASP 41 -12.223 -9.912 -0.085 252 HB3 ASP 41 HB1 ASP 41 -11.382 -8.752 0.937 253 H VAL 42 HN VAL 42 -8.324 -9.493 -2.119 254 HA VAL 42 HA VAL 42 -6.946 -7.421 -0.559 255 HB VAL 42 HB VAL 42 -5.595 -9.401 -0.581 256 HG11 VAL 42 HG11 VAL 42 -6.547 -10.563 -2.483 257 HG12 VAL 42 HG12 VAL 42 -4.795 -10.447 -2.653 258 HG13 VAL 42 HG13 VAL 42 -5.843 -9.377 -3.585 259 HG21 VAL 42 HG21 VAL 42 -3.554 -8.588 -1.662 260 HG22 VAL 42 HG22 VAL 42 -4.393 -7.284 -0.822 261 HG23 VAL 42 HG23 VAL 42 -4.502 -7.416 -2.577 262 H GLU 43 HN GLU 43 -7.339 -5.522 -1.430 263 HA GLU 43 HA GLU 43 -6.484 -5.106 -4.174 264 HB2 GLU 43 HB2 GLU 43 -8.913 -5.392 -4.388 265 HB3 GLU 43 HB1 GLU 43 -9.176 -4.135 -3.187 266 HG2 GLU 43 HG2 GLU 43 -8.117 -2.495 -4.662 267 HG3 GLU 43 HG1 GLU 43 -7.864 -3.751 -5.873 268 H TRP 44 HN TRP 44 -4.863 -3.775 -3.827 269 HA TRP 44 HA TRP 44 -5.317 -1.425 -2.121 270 HD1 TRP 44 HD1 TRP 44 -3.740 0.613 -1.678 271 HE1 TRP 44 HE1 TRP 44 -1.548 1.894 -1.218 272 HE3 TRP 44 HE3 TRP 44 -0.550 -3.277 -1.669 273 HZ2 TRP 44 HZ2 TRP 44 1.219 1.255 -0.893 274 HZ3 TRP 44 HZ3 TRP 44 1.841 -2.914 -1.322 275 HH2 TRP 44 HH2 TRP 44 2.709 -0.688 -0.920 276 HB2 TRP 44 HB2 TRP 44 -3.617 -2.756 -1.097 277 HB3 TRP 44 HB1 TRP 44 -2.794 -3.004 -2.634 278 H VAL 45 HN VAL 45 -4.833 0.493 -2.870 279 HA VAL 45 HA VAL 45 -5.222 1.103 -5.529 280 HB VAL 45 HB VAL 45 -3.812 2.839 -3.504 281 HG11 VAL 45 HG11 VAL 45 -3.757 3.766 -5.738 282 HG12 VAL 45 HG12 VAL 45 -4.858 4.694 -4.720 283 HG13 VAL 45 HG13 VAL 45 -5.501 3.546 -5.894 284 HG21 VAL 45 HG21 VAL 45 -6.098 3.670 -2.948 285 HG22 VAL 45 HG22 VAL 45 -5.795 2.009 -2.448 286 HG23 VAL 45 HG23 VAL 45 -6.758 2.333 -3.889 287 H VAL 46 HN VAL 46 -2.191 0.282 -3.957 288 HA VAL 46 HA VAL 46 -0.499 1.750 -5.675 289 HB VAL 46 HB VAL 46 -0.057 0.101 -3.424 290 HG11 VAL 46 HG11 VAL 46 1.528 -0.950 -5.750 291 HG12 VAL 46 HG12 VAL 46 0.289 -1.829 -4.854 292 HG13 VAL 46 HG13 VAL 46 1.778 -1.330 -4.047 293 HG21 VAL 46 HG21 VAL 46 1.930 1.510 -5.220 294 HG22 VAL 46 HG22 VAL 46 2.218 1.012 -3.552 295 HG23 VAL 46 HG23 VAL 46 1.010 2.247 -3.907 296 H GLY 47 HN GLY 47 -2.347 -0.997 -6.332 297 HA2 GLY 47 HA2 GLY 47 -0.717 -2.153 -8.360 298 HA3 GLY 47 HA1 GLY 47 -2.470 -2.327 -8.212 299 H LYS 48 HN LYS 48 -2.053 0.897 -8.202 300 HA LYS 48 HA LYS 48 -2.480 1.058 -11.104 301 HB2 LYS 48 HB2 LYS 48 -3.785 2.972 -10.720 302 HB3 LYS 48 HB1 LYS 48 -4.257 1.855 -9.464 303 HG2 LYS 48 HG2 LYS 48 -2.994 3.076 -7.843 304 HG3 LYS 48 HG1 LYS 48 -2.283 4.101 -9.093 305 HD2 LYS 48 HD2 LYS 48 -5.211 3.976 -8.366 306 HD3 LYS 48 HD1 LYS 48 -4.087 5.251 -7.892 307 HE2 LYS 48 HE2 LYS 48 -4.896 4.532 -10.711 308 HE3 LYS 48 HE1 LYS 48 -5.421 5.947 -9.797 309 HZ1 LYS 48 HZ1 LYS 48 -3.251 6.847 -9.848 310 HZ2 LYS 48 HZ2 LYS 48 -3.577 6.326 -11.432 311 HZ3 LYS 48 HZ3 LYS 48 -2.578 5.403 -10.425 312 H ASP 49 HN ASP 49 -0.431 2.194 -8.523 313 HA ASP 49 HA ASP 49 0.911 4.001 -10.412 314 HB2 ASP 49 HB2 ASP 49 1.727 5.222 -8.345 315 HB3 ASP 49 HB1 ASP 49 0.010 5.355 -8.691 316 H LYS 50 HN LYS 50 1.216 1.084 -9.119 317 HA LYS 50 HA LYS 50 3.782 0.801 -8.164 318 HB2 LYS 50 HB2 LYS 50 2.089 -0.972 -8.113 319 HB3 LYS 50 HB1 LYS 50 2.206 -1.139 -9.859 320 HG2 LYS 50 HG2 LYS 50 4.621 -1.726 -9.545 321 HG3 LYS 50 HG1 LYS 50 4.308 -1.769 -7.809 322 HD2 LYS 50 HD2 LYS 50 2.609 -3.495 -8.174 323 HD3 LYS 50 HD1 LYS 50 2.943 -3.452 -9.909 324 HE2 LYS 50 HE2 LYS 50 4.812 -4.288 -7.701 325 HE3 LYS 50 HE1 LYS 50 4.113 -5.306 -8.957 326 HZ1 LYS 50 HZ1 LYS 50 5.988 -3.061 -9.469 327 HZ2 LYS 50 HZ2 LYS 50 5.406 -4.170 -10.610 328 HZ3 LYS 50 HZ3 LYS 50 6.441 -4.686 -9.369 329 HA PRO 51 HA PRO 51 4.987 -0.114 -12.951 330 HB2 PRO 51 HB2 PRO 51 3.884 2.091 -14.350 331 HB3 PRO 51 HB1 PRO 51 3.466 0.382 -14.541 332 HG2 PRO 51 HG2 PRO 51 2.120 2.500 -12.942 333 HG3 PRO 51 HG1 PRO 51 1.415 1.118 -13.802 334 HD2 PRO 51 HD2 PRO 51 1.626 1.097 -11.147 335 HD3 PRO 51 HD1 PRO 51 1.965 -0.376 -12.091 336 H THR 52 HN THR 52 4.396 3.057 -11.504 337 HA THR 52 HA THR 52 6.685 4.286 -12.717 338 HB THR 52 HB THR 52 4.977 5.227 -10.401 339 HG1 THR 52 HG1 THR 52 4.780 5.504 -13.224 340 HG21 THR 52 HG21 THR 52 7.096 6.414 -10.477 341 HG22 THR 52 HG22 THR 52 5.802 7.472 -11.038 342 HG23 THR 52 HG23 THR 52 6.890 6.720 -12.203 343 H TYR 53 HN TYR 53 5.962 2.758 -9.630 344 HA TYR 53 HA TYR 53 8.452 3.633 -8.449 345 HD1 TYR 53 HD2 TYR 53 7.146 5.146 -7.689 346 HD2 TYR 53 HD1 TYR 53 4.574 2.060 -6.323 347 HE1 TYR 53 HE2 TYR 53 5.415 6.820 -7.227 348 HE2 TYR 53 HE1 TYR 53 2.829 3.720 -5.856 349 HH TYR 53 HH TYR 53 2.269 5.849 -5.890 350 HB2 TYR 53 HB2 TYR 53 6.565 1.512 -7.472 351 HB3 TYR 53 HB1 TYR 53 7.725 2.424 -6.519 352 H ASP 54 HN ASP 54 7.206 0.933 -10.172 353 HA ASP 54 HA ASP 54 9.362 -0.876 -9.600 354 HB2 ASP 54 HB2 ASP 54 7.300 -1.848 -10.311 355 HB3 ASP 54 HB1 ASP 54 7.142 -0.739 -11.662 356 H GLU 55 HN GLU 55 8.638 1.470 -12.172 357 HA GLU 55 HA GLU 55 10.905 0.817 -13.748 358 HB2 GLU 55 HB2 GLU 55 10.487 2.907 -14.946 359 HB3 GLU 55 HB1 GLU 55 9.017 1.975 -14.738 360 HG2 GLU 55 HG2 GLU 55 8.040 3.760 -13.932 361 HG3 GLU 55 HG1 GLU 55 9.130 3.704 -12.543 362 H ILE 56 HN ILE 56 10.372 3.208 -11.171 363 HA ILE 56 HA ILE 56 13.024 4.253 -11.352 364 HB ILE 56 HB ILE 56 11.190 4.268 -8.940 365 HG12 ILE 56 HG12 ILE 56 11.586 6.493 -10.933 366 HG13 ILE 56 HG11 ILE 56 10.309 5.289 -11.124 367 HG21 ILE 56 HG21 ILE 56 13.548 6.019 -9.645 368 HG22 ILE 56 HG22 ILE 56 13.530 4.769 -8.402 369 HG23 ILE 56 HG23 ILE 56 12.517 6.201 -8.226 370 HD11 ILE 56 HD11 ILE 56 10.637 7.106 -8.750 371 HD12 ILE 56 HD12 ILE 56 9.323 5.962 -9.035 372 HD13 ILE 56 HD13 ILE 56 9.519 7.358 -10.094 373 H PHE 57 HN PHE 57 11.527 1.542 -9.790 374 HA PHE 57 HA PHE 57 13.488 0.776 -7.977 375 HD1 PHE 57 HD2 PHE 57 13.119 -1.082 -6.253 376 HD2 PHE 57 HD1 PHE 57 12.191 -3.047 -9.909 377 HE1 PHE 57 HE2 PHE 57 13.982 -3.197 -5.336 378 HE2 PHE 57 HE1 PHE 57 13.044 -5.164 -8.999 379 HZ PHE 57 HZ PHE 57 13.939 -5.241 -6.706 380 HB2 PHE 57 HB2 PHE 57 11.327 -0.268 -7.998 381 HB3 PHE 57 HB1 PHE 57 11.571 -0.867 -9.631 382 H TYR 58 HN TYR 58 13.103 -0.337 -11.360 383 HA TYR 58 HA TYR 58 15.632 -1.672 -11.368 384 HD1 TYR 58 HD1 TYR 58 11.959 -1.908 -12.252 385 HD2 TYR 58 HD2 TYR 58 15.396 -4.077 -13.513 386 HE1 TYR 58 HE1 TYR 58 10.783 -4.017 -11.834 387 HE2 TYR 58 HE2 TYR 58 14.214 -6.195 -13.100 388 HH TYR 58 HH TYR 58 10.826 -6.305 -12.492 389 HB2 TYR 58 HB2 TYR 58 13.765 -0.841 -13.595 390 HB3 TYR 58 HB1 TYR 58 15.272 -1.720 -13.882 391 H THR 59 HN THR 59 14.602 1.555 -11.914 392 HA THR 59 HA THR 59 16.881 2.466 -13.350 393 HB THR 59 HB THR 59 14.694 3.841 -11.792 394 HG1 THR 59 HG1 THR 59 13.826 3.381 -13.671 395 HG21 THR 59 HG21 THR 59 15.491 5.964 -12.769 396 HG22 THR 59 HG22 THR 59 16.963 5.140 -13.288 397 HG23 THR 59 HG23 THR 59 16.592 5.296 -11.568 398 H LEU 60 HN LEU 60 16.102 2.047 -9.965 399 HA LEU 60 HA LEU 60 18.446 3.465 -9.046 400 HG LEU 60 HG LEU 60 15.403 3.915 -8.229 401 HB2 LEU 60 HB2 LEU 60 16.360 1.825 -7.612 402 HB3 LEU 60 HB1 LEU 60 17.697 2.613 -6.793 403 HD11 LEU 60 HD11 LEU 60 15.061 3.109 -5.910 404 HD12 LEU 60 HD12 LEU 60 14.908 4.857 -6.078 405 HD13 LEU 60 HD13 LEU 60 16.375 4.161 -5.387 406 HD21 LEU 60 HD21 LEU 60 16.457 6.062 -7.706 407 HD22 LEU 60 HD22 LEU 60 17.454 5.106 -8.801 408 HD23 LEU 60 HD23 LEU 60 17.876 5.217 -7.094 409 H SER 61 HN SER 61 18.048 0.614 -10.501 410 HA SER 61 HA SER 61 19.340 -1.207 -10.836 411 HG SER 61 HG SER 61 22.226 -1.779 -9.387 412 HB2 SER 61 HB2 SER 61 21.217 0.429 -10.748 413 HB3 SER 61 HB1 SER 61 21.354 0.134 -9.016 414 HA PRO 62 HA PRO 62 18.143 -3.206 -6.931 415 HB2 PRO 62 HB2 PRO 62 16.471 -5.020 -8.005 416 HB3 PRO 62 HB1 PRO 62 15.969 -3.363 -7.648 417 HG2 PRO 62 HG2 PRO 62 16.584 -4.638 -10.254 418 HG3 PRO 62 HG1 PRO 62 15.472 -3.310 -9.879 419 HD2 PRO 62 HD2 PRO 62 18.065 -3.077 -10.965 420 HD3 PRO 62 HD1 PRO 62 17.049 -1.764 -10.333 421 H VAL 63 HN VAL 63 18.553 -5.320 -6.129 422 HA VAL 63 HA VAL 63 19.941 -7.168 -7.904 423 HB VAL 63 HB VAL 63 21.744 -5.896 -6.962 424 HG11 VAL 63 HG11 VAL 63 20.602 -6.574 -4.259 425 HG12 VAL 63 HG12 VAL 63 20.693 -4.976 -4.998 426 HG13 VAL 63 HG13 VAL 63 22.172 -5.819 -4.538 427 HG21 VAL 63 HG21 VAL 63 23.024 -7.674 -5.877 428 HG22 VAL 63 HG22 VAL 63 22.117 -8.278 -7.263 429 HG23 VAL 63 HG23 VAL 63 21.535 -8.584 -5.626 430 H ASN 64 HN ASN 64 19.501 -9.224 -7.494 431 HA ASN 64 HA ASN 64 18.505 -11.073 -6.635 432 HB2 ASN 64 HB2 ASN 64 18.760 -9.627 -3.976 433 HB3 ASN 64 HB1 ASN 64 18.368 -11.340 -4.182 434 HD21 ASN 64 HD21 ASN 64 20.617 -9.946 -2.856 435 HD22 ASN 64 HD22 ASN 64 22.043 -10.632 -3.558 436 H GLY 65 HN GLY 65 17.093 -8.493 -7.328 437 HA2 GLY 65 HA2 GLY 65 14.815 -8.408 -7.929 438 HA3 GLY 65 HA1 GLY 65 14.456 -9.543 -6.640 439 H LYS 66 HN LYS 66 16.424 -7.279 -5.222 440 HA LYS 66 HA LYS 66 14.219 -5.400 -4.733 441 HB2 LYS 66 HB2 LYS 66 16.014 -6.026 -2.452 442 HB3 LYS 66 HB1 LYS 66 14.347 -5.478 -2.446 443 HG2 LYS 66 HG2 LYS 66 14.231 -7.638 -1.618 444 HG3 LYS 66 HG1 LYS 66 13.783 -7.825 -3.317 445 HD2 LYS 66 HD2 LYS 66 15.794 -8.794 -3.881 446 HD3 LYS 66 HD1 LYS 66 16.639 -8.068 -2.520 447 HE2 LYS 66 HE2 LYS 66 16.452 -10.374 -2.052 448 HE3 LYS 66 HE1 LYS 66 15.270 -9.570 -1.029 449 HZ1 LYS 66 HZ1 LYS 66 14.591 -10.804 -3.642 450 HZ2 LYS 66 HZ2 LYS 66 13.518 -10.227 -2.460 451 HZ3 LYS 66 HZ3 LYS 66 14.446 -11.613 -2.161 452 H ILE 67 HN ILE 67 14.952 -3.311 -3.825 453 HA ILE 67 HA ILE 67 17.661 -2.647 -4.699 454 HB ILE 67 HB ILE 67 16.982 -0.312 -3.727 455 HG12 ILE 67 HG12 ILE 67 14.295 -1.650 -4.086 456 HG13 ILE 67 HG11 ILE 67 14.957 -0.974 -2.600 457 HG21 ILE 67 HG21 ILE 67 17.387 -0.773 -6.079 458 HG22 ILE 67 HG22 ILE 67 15.988 0.284 -5.893 459 HG23 ILE 67 HG23 ILE 67 15.758 -1.427 -6.261 460 HD11 ILE 67 HD11 ILE 67 13.294 0.492 -3.559 461 HD12 ILE 67 HD12 ILE 67 14.195 0.563 -5.072 462 HD13 ILE 67 HD13 ILE 67 14.885 1.253 -3.601 463 H THR 68 HN THR 68 19.343 -2.393 -3.386 464 HA THR 68 HA THR 68 19.272 -3.030 -0.667 465 HB THR 68 HB THR 68 21.453 -1.513 -0.705 466 HG1 THR 68 HG1 THR 68 22.232 -1.176 -2.744 467 HG21 THR 68 HG21 THR 68 22.720 -3.443 -1.572 468 HG22 THR 68 HG22 THR 68 21.218 -4.144 -2.179 469 HG23 THR 68 HG23 THR 68 21.460 -3.941 -0.443 470 H GLY 69 HN GLY 69 18.744 -1.876 1.079 471 HA2 GLY 69 HA2 GLY 69 16.811 0.005 0.757 472 HA3 GLY 69 HA1 GLY 69 17.657 -0.272 2.266 473 H ALA 70 HN ALA 70 20.233 0.653 1.185 474 HA ALA 70 HA ALA 70 20.233 3.315 1.885 475 HB1 ALA 70 HB1 ALA 70 22.385 3.496 0.781 476 HB2 ALA 70 HB2 ALA 70 22.069 2.011 -0.120 477 HB3 ALA 70 HB3 ALA 70 22.252 1.957 1.633 478 H ASN 71 HN ASN 71 19.432 1.942 -1.252 479 HA ASN 71 HA ASN 71 19.613 4.451 -2.660 480 HB2 ASN 71 HB2 ASN 71 18.069 2.120 -3.734 481 HB3 ASN 71 HB1 ASN 71 19.094 3.268 -4.589 482 HD21 ASN 71 HD21 ASN 71 18.977 0.307 -4.478 483 HD22 ASN 71 HD22 ASN 71 20.571 -0.205 -4.063 484 H ALA 72 HN ALA 72 17.095 2.452 -1.251 485 HA ALA 72 HA ALA 72 14.920 4.035 -2.227 486 HB1 ALA 72 HB1 ALA 72 13.583 2.741 -0.614 487 HB2 ALA 72 HB2 ALA 72 15.070 2.030 0.018 488 HB3 ALA 72 HB3 ALA 72 14.577 1.713 -1.646 489 H LYS 73 HN LYS 73 16.930 3.918 0.613 490 HA LYS 73 HA LYS 73 15.569 5.868 2.162 491 HB2 LYS 73 HB2 LYS 73 18.508 5.123 2.124 492 HB3 LYS 73 HB1 LYS 73 17.754 6.149 3.336 493 HG2 LYS 73 HG2 LYS 73 17.168 3.243 2.821 494 HG3 LYS 73 HG1 LYS 73 18.019 3.923 4.209 495 HD2 LYS 73 HD2 LYS 73 15.199 4.689 3.515 496 HD3 LYS 73 HD1 LYS 73 15.577 3.300 4.536 497 HE2 LYS 73 HE2 LYS 73 16.575 6.088 5.109 498 HE3 LYS 73 HE1 LYS 73 15.047 5.465 5.745 499 HZ1 LYS 73 HZ1 LYS 73 17.004 5.280 7.261 500 HZ2 LYS 73 HZ2 LYS 73 17.661 4.130 6.198 501 HZ3 LYS 73 HZ3 LYS 73 16.192 3.823 6.980 502 H LYS 74 HN LYS 74 18.037 5.960 -0.307 503 HA LYS 74 HA LYS 74 18.719 8.653 -0.311 504 HB2 LYS 74 HB2 LYS 74 19.639 6.669 -1.705 505 HB3 LYS 74 HB1 LYS 74 18.354 7.063 -2.840 506 HG2 LYS 74 HG2 LYS 74 20.328 8.131 -3.587 507 HG3 LYS 74 HG1 LYS 74 19.262 9.381 -2.936 508 HD2 LYS 74 HD2 LYS 74 21.505 9.759 -2.168 509 HD3 LYS 74 HD1 LYS 74 20.499 9.287 -0.808 510 HE2 LYS 74 HE2 LYS 74 22.674 8.160 -0.728 511 HE3 LYS 74 HE1 LYS 74 21.356 7.006 -0.947 512 HZ1 LYS 74 HZ1 LYS 74 21.882 6.803 -3.249 513 HZ2 LYS 74 HZ2 LYS 74 23.318 6.593 -2.382 514 HZ3 LYS 74 HZ3 LYS 74 23.015 8.064 -3.177 515 H GLU 75 HN GLU 75 16.125 6.963 -1.983 516 HA GLU 75 HA GLU 75 15.010 9.201 -3.276 517 HB2 GLU 75 HB2 GLU 75 13.605 6.669 -2.412 518 HB3 GLU 75 HB1 GLU 75 12.975 7.835 -3.562 519 HG2 GLU 75 HG2 GLU 75 15.230 5.895 -3.892 520 HG3 GLU 75 HG1 GLU 75 13.806 6.141 -4.888 521 H MET 76 HN MET 76 13.964 7.643 -0.244 522 HA MET 76 HA MET 76 11.976 9.597 0.259 523 HB2 MET 76 HB2 MET 76 12.077 8.661 2.636 524 HB3 MET 76 HB1 MET 76 11.655 7.543 1.347 525 HG2 MET 76 HG2 MET 76 13.926 6.696 1.319 526 HG3 MET 76 HG1 MET 76 14.376 7.832 2.585 527 HE1 MET 76 HE1 MET 76 11.085 5.524 2.208 528 HE2 MET 76 HE2 MET 76 11.703 4.107 3.055 529 HE3 MET 76 HE3 MET 76 12.485 4.660 1.572 530 H VAL 77 HN VAL 77 15.387 9.545 0.787 531 HA VAL 77 HA VAL 77 15.548 11.730 2.588 532 HB VAL 77 HB VAL 77 17.492 10.487 0.663 533 HG11 VAL 77 HG11 VAL 77 17.986 13.003 2.255 534 HG12 VAL 77 HG12 VAL 77 17.929 12.875 0.497 535 HG13 VAL 77 HG13 VAL 77 19.217 12.073 1.398 536 HG21 VAL 77 HG21 VAL 77 17.498 10.912 3.653 537 HG22 VAL 77 HG22 VAL 77 18.762 10.094 2.735 538 HG23 VAL 77 HG23 VAL 77 17.140 9.403 2.812 539 H LYS 78 HN LYS 78 15.553 11.572 -1.013 540 HA LYS 78 HA LYS 78 16.040 14.362 -1.292 541 HB2 LYS 78 HB2 LYS 78 15.681 14.072 -3.601 542 HB3 LYS 78 HB1 LYS 78 16.538 12.644 -3.027 543 HG2 LYS 78 HG2 LYS 78 14.491 11.388 -2.993 544 HG3 LYS 78 HG1 LYS 78 13.580 12.825 -3.463 545 HD2 LYS 78 HD2 LYS 78 13.841 11.868 -5.464 546 HD3 LYS 78 HD1 LYS 78 15.297 12.849 -5.424 547 HE2 LYS 78 HE2 LYS 78 15.061 9.922 -4.797 548 HE3 LYS 78 HE1 LYS 78 15.789 10.647 -6.211 549 HZ1 LYS 78 HZ1 LYS 78 17.364 9.858 -4.500 550 HZ2 LYS 78 HZ2 LYS 78 16.815 11.098 -3.490 551 HZ3 LYS 78 HZ3 LYS 78 17.566 11.473 -4.964 552 H SER 79 HN SER 79 13.314 12.469 -0.584 553 HA SER 79 HA SER 79 11.232 14.121 -1.502 554 HG SER 79 HG SER 79 9.490 13.945 0.350 555 HB2 SER 79 HB2 SER 79 10.849 11.822 -0.780 556 HB3 SER 79 HB1 SER 79 11.311 12.241 0.874 557 H LYS 80 HN LYS 80 13.577 14.770 0.810 558 HA LYS 80 HA LYS 80 13.942 16.583 2.130 559 HB2 LYS 80 HB2 LYS 80 11.330 17.607 1.002 560 HB3 LYS 80 HB1 LYS 80 12.518 18.564 1.889 561 HG2 LYS 80 HG2 LYS 80 14.047 18.503 0.139 562 HG3 LYS 80 HG1 LYS 80 13.264 17.123 -0.629 563 HD2 LYS 80 HD2 LYS 80 11.310 18.566 -1.114 564 HD3 LYS 80 HD1 LYS 80 12.203 19.937 -0.453 565 HE2 LYS 80 HE2 LYS 80 13.878 19.756 -2.147 566 HE3 LYS 80 HE1 LYS 80 13.199 18.235 -2.728 567 HZ1 LYS 80 HZ1 LYS 80 12.576 20.074 -4.151 568 HZ2 LYS 80 HZ2 LYS 80 11.861 20.884 -2.843 569 HZ3 LYS 80 HZ3 LYS 80 11.209 19.418 -3.397 570 H LEU 81 HN LEU 81 13.477 14.819 3.709 571 HA LEU 81 HA LEU 81 11.186 15.554 5.410 572 HG LEU 81 HG LEU 81 11.205 13.463 2.955 573 HB2 LEU 81 HB2 LEU 81 12.270 12.758 5.117 574 HB3 LEU 81 HB1 LEU 81 10.810 13.258 5.940 575 HD11 LEU 81 HD11 LEU 81 9.753 11.347 4.533 576 HD12 LEU 81 HD12 LEU 81 11.286 11.136 3.688 577 HD13 LEU 81 HD13 LEU 81 9.816 11.478 2.775 578 HD21 LEU 81 HD21 LEU 81 8.742 13.692 4.683 579 HD22 LEU 81 HD22 LEU 81 8.766 13.719 2.921 580 HD23 LEU 81 HD23 LEU 81 9.549 15.010 3.833 581 HA PRO 82 HA PRO 82 14.199 15.359 8.745 582 HB2 PRO 82 HB2 PRO 82 12.530 14.771 10.803 583 HB3 PRO 82 HB1 PRO 82 12.658 16.395 10.108 584 HG2 PRO 82 HG2 PRO 82 10.583 14.295 9.658 585 HG3 PRO 82 HG1 PRO 82 10.396 16.047 9.808 586 HD2 PRO 82 HD2 PRO 82 10.383 14.707 7.438 587 HD3 PRO 82 HD1 PRO 82 10.869 16.410 7.610 588 H ASN 83 HN ASN 83 14.978 13.761 10.309 589 HA ASN 83 HA ASN 83 15.238 11.245 9.066 590 HB2 ASN 83 HB2 ASN 83 15.973 12.060 11.882 591 HB3 ASN 83 HB1 ASN 83 16.496 10.580 11.087 592 HD21 ASN 83 HD21 ASN 83 16.882 11.836 8.489 593 HD22 ASN 83 HD22 ASN 83 18.316 12.783 8.628 594 H THR 84 HN THR 84 13.054 12.390 11.510 595 HA THR 84 HA THR 84 12.235 9.884 12.536 596 HB THR 84 HB THR 84 10.189 11.191 13.261 597 HG1 THR 84 HG1 THR 84 10.126 13.360 12.817 598 HG21 THR 84 HG21 THR 84 11.432 12.567 14.874 599 HG22 THR 84 HG22 THR 84 12.902 12.334 13.927 600 HG23 THR 84 HG23 THR 84 12.131 10.957 14.711 601 H VAL 85 HN VAL 85 10.925 12.000 10.005 602 HA VAL 85 HA VAL 85 8.816 10.260 9.230 603 HB VAL 85 HB VAL 85 10.178 12.458 7.657 604 HG11 VAL 85 HG11 VAL 85 7.594 10.990 7.139 605 HG12 VAL 85 HG12 VAL 85 9.057 10.914 6.157 606 HG13 VAL 85 HG13 VAL 85 8.145 12.420 6.268 607 HG21 VAL 85 HG21 VAL 85 7.605 12.440 9.240 608 HG22 VAL 85 HG22 VAL 85 8.226 13.792 8.290 609 HG23 VAL 85 HG23 VAL 85 9.105 13.235 9.714 610 H LEU 86 HN LEU 86 12.098 10.800 7.972 611 HA LEU 86 HA LEU 86 12.281 8.932 5.966 612 HG LEU 86 HG LEU 86 15.666 10.275 6.102 613 HB2 LEU 86 HB2 LEU 86 14.070 10.178 7.864 614 HB3 LEU 86 HB1 LEU 86 14.583 8.533 7.501 615 HD11 LEU 86 HD11 LEU 86 13.941 8.321 4.602 616 HD12 LEU 86 HD12 LEU 86 15.500 7.968 5.350 617 HD13 LEU 86 HD13 LEU 86 15.407 9.096 3.999 618 HD21 LEU 86 HD21 LEU 86 13.806 11.821 5.874 619 HD22 LEU 86 HD22 LEU 86 12.908 10.618 4.947 620 HD23 LEU 86 HD23 LEU 86 14.395 11.306 4.292 621 H GLY 87 HN GLY 87 12.861 8.367 9.413 622 HA2 GLY 87 HA2 GLY 87 13.362 5.642 9.313 623 HA3 GLY 87 HA1 GLY 87 12.752 6.502 10.716 624 H LYS 88 HN LYS 88 10.223 7.236 10.028 625 HA LYS 88 HA LYS 88 9.068 4.614 10.219 626 HB2 LYS 88 HB2 LYS 88 6.949 5.711 10.758 627 HB3 LYS 88 HB1 LYS 88 8.264 6.206 11.805 628 HG2 LYS 88 HG2 LYS 88 8.333 8.346 10.901 629 HG3 LYS 88 HG1 LYS 88 7.476 7.848 9.435 630 HD2 LYS 88 HD2 LYS 88 5.418 7.813 10.485 631 HD3 LYS 88 HD1 LYS 88 6.118 7.562 12.080 632 HE2 LYS 88 HE2 LYS 88 5.088 9.793 11.757 633 HE3 LYS 88 HE1 LYS 88 6.789 9.856 12.218 634 HZ1 LYS 88 HZ1 LYS 88 5.741 10.163 9.461 635 HZ2 LYS 88 HZ2 LYS 88 7.359 10.295 9.930 636 HZ3 LYS 88 HZ3 LYS 88 6.225 11.439 10.465 637 H ILE 89 HN ILE 89 9.372 6.925 7.656 638 HA ILE 89 HA ILE 89 7.305 5.782 6.052 639 HB ILE 89 HB ILE 89 9.788 7.319 5.314 640 HG12 ILE 89 HG12 ILE 89 6.825 7.878 5.256 641 HG13 ILE 89 HG11 ILE 89 8.067 8.714 6.178 642 HG21 ILE 89 HG21 ILE 89 9.456 5.686 3.538 643 HG22 ILE 89 HG22 ILE 89 9.026 7.301 2.972 644 HG23 ILE 89 HG23 ILE 89 7.759 6.150 3.402 645 HD11 ILE 89 HD11 ILE 89 7.334 10.071 4.330 646 HD12 ILE 89 HD12 ILE 89 7.723 8.777 3.197 647 HD13 ILE 89 HD13 ILE 89 9.011 9.584 4.092 648 H TRP 90 HN TRP 90 10.808 5.254 6.308 649 HA TRP 90 HA TRP 90 11.065 3.096 4.592 650 HD1 TRP 90 HD1 TRP 90 13.088 1.250 8.107 651 HE1 TRP 90 HE1 TRP 90 14.374 -0.758 7.092 652 HE3 TRP 90 HE3 TRP 90 13.351 2.808 3.248 653 HZ2 TRP 90 HZ2 TRP 90 15.358 -1.568 4.565 654 HZ3 TRP 90 HZ3 TRP 90 14.465 1.360 1.600 655 HH2 TRP 90 HH2 TRP 90 15.444 -0.777 2.245 656 HB2 TRP 90 HB2 TRP 90 12.997 4.071 5.651 657 HB3 TRP 90 HB1 TRP 90 12.422 3.593 7.244 658 H LYS 91 HN LYS 91 10.363 3.001 8.059 659 HA LYS 91 HA LYS 91 10.251 0.209 8.285 660 HB2 LYS 91 HB2 LYS 91 9.170 2.405 9.968 661 HB3 LYS 91 HB1 LYS 91 9.116 0.722 10.461 662 HG2 LYS 91 HG2 LYS 91 11.525 0.638 10.336 663 HG3 LYS 91 HG1 LYS 91 11.572 2.325 9.829 664 HD2 LYS 91 HD2 LYS 91 10.454 2.967 11.928 665 HD3 LYS 91 HD1 LYS 91 10.513 1.287 12.457 666 HE2 LYS 91 HE2 LYS 91 12.931 1.330 12.428 667 HE3 LYS 91 HE1 LYS 91 12.925 2.962 11.763 668 HZ1 LYS 91 HZ1 LYS 91 13.349 2.990 14.132 669 HZ2 LYS 91 HZ2 LYS 91 11.888 2.182 14.440 670 HZ3 LYS 91 HZ3 LYS 91 11.869 3.749 13.794 671 H LEU 92 HN LEU 92 7.820 2.561 7.466 672 HA LEU 92 HA LEU 92 5.656 0.676 7.848 673 HG LEU 92 HG LEU 92 3.340 1.700 7.221 674 HB2 LEU 92 HB2 LEU 92 5.730 3.370 7.992 675 HB3 LEU 92 HB1 LEU 92 5.204 3.180 6.314 676 HD11 LEU 92 HD11 LEU 92 4.215 2.971 9.810 677 HD12 LEU 92 HD12 LEU 92 4.342 1.260 9.401 678 HD13 LEU 92 HD13 LEU 92 2.753 2.011 9.568 679 HD21 LEU 92 HD21 LEU 92 1.960 3.625 7.859 680 HD22 LEU 92 HD22 LEU 92 2.952 3.975 6.443 681 HD23 LEU 92 HD23 LEU 92 3.415 4.609 8.023 682 H ALA 93 HN ALA 93 7.937 1.401 5.461 683 HA ALA 93 HA ALA 93 6.196 0.376 3.321 684 HB1 ALA 93 HB1 ALA 93 7.930 1.135 1.780 685 HB2 ALA 93 HB2 ALA 93 8.909 1.672 3.148 686 HB3 ALA 93 HB3 ALA 93 7.356 2.443 2.814 687 H ASP 94 HN ASP 94 9.327 -0.213 4.865 688 HA ASP 94 HA ASP 94 9.736 -2.686 3.431 689 HB2 ASP 94 HB2 ASP 94 11.613 -1.199 4.251 690 HB3 ASP 94 HB1 ASP 94 11.202 -1.690 5.892 691 H VAL 95 HN VAL 95 8.224 -4.158 3.873 692 HA VAL 95 HA VAL 95 6.972 -4.331 6.423 693 HB VAL 95 HB VAL 95 6.808 -6.287 4.133 694 HG11 VAL 95 HG11 VAL 95 4.681 -6.958 5.135 695 HG12 VAL 95 HG12 VAL 95 4.950 -5.832 6.463 696 HG13 VAL 95 HG13 VAL 95 6.022 -7.217 6.253 697 HG21 VAL 95 HG21 VAL 95 4.745 -5.103 3.522 698 HG22 VAL 95 HG22 VAL 95 6.168 -4.068 3.392 699 HG23 VAL 95 HG23 VAL 95 5.078 -3.903 4.769 700 H ASP 96 HN ASP 96 9.596 -5.946 4.823 701 HA ASP 96 HA ASP 96 9.811 -8.041 6.802 702 HB2 ASP 96 HB2 ASP 96 12.216 -7.199 5.327 703 HB3 ASP 96 HB1 ASP 96 11.582 -8.827 5.578 704 H LYS 97 HN LYS 97 10.870 -4.780 6.384 705 HA LYS 97 HA LYS 97 12.273 -3.376 7.492 706 HB2 LYS 97 HB2 LYS 97 11.697 -5.246 9.805 707 HB3 LYS 97 HB1 LYS 97 12.394 -3.632 9.941 708 HG2 LYS 97 HG2 LYS 97 10.376 -2.682 8.965 709 HG3 LYS 97 HG1 LYS 97 9.675 -4.286 8.835 710 HD2 LYS 97 HD2 LYS 97 9.750 -4.532 11.265 711 HD3 LYS 97 HD1 LYS 97 10.476 -2.929 11.415 712 HE2 LYS 97 HE2 LYS 97 8.499 -1.885 10.554 713 HE3 LYS 97 HE1 LYS 97 7.798 -3.445 10.134 714 HZ1 LYS 97 HZ1 LYS 97 8.401 -2.561 12.907 715 HZ2 LYS 97 HZ2 LYS 97 7.626 -3.996 12.449 716 HZ3 LYS 97 HZ3 LYS 97 6.869 -2.505 12.184 717 H ASP 98 HN ASP 98 13.532 -4.996 5.895 718 HA ASP 98 HA ASP 98 15.547 -6.513 7.404 719 HB2 ASP 98 HB2 ASP 98 15.701 -7.999 5.492 720 HB3 ASP 98 HB1 ASP 98 14.023 -7.869 6.029 721 H GLY 99 HN GLY 99 15.250 -3.688 5.731 722 HA2 GLY 99 HA2 GLY 99 17.103 -2.221 5.479 723 HA3 GLY 99 HA1 GLY 99 18.166 -3.619 5.413 724 H LEU 100 HN LEU 100 15.484 -4.093 3.471 725 HA LEU 100 HA LEU 100 16.424 -2.581 1.204 726 HG LEU 100 HG LEU 100 16.347 -6.131 2.250 727 HB2 LEU 100 HB2 LEU 100 16.600 -4.544 -0.277 728 HB3 LEU 100 HB1 LEU 100 17.852 -4.471 0.946 729 HD11 LEU 100 HD11 LEU 100 15.022 -7.594 0.794 730 HD12 LEU 100 HD12 LEU 100 15.280 -6.471 -0.541 731 HD13 LEU 100 HD13 LEU 100 14.369 -5.958 0.881 732 HD21 LEU 100 HD21 LEU 100 18.528 -6.656 1.345 733 HD22 LEU 100 HD22 LEU 100 17.822 -6.934 -0.246 734 HD23 LEU 100 HD23 LEU 100 17.414 -8.000 1.099 735 H LEU 101 HN LEU 101 14.980 -2.651 -0.568 736 HA LEU 101 HA LEU 101 12.247 -3.410 0.217 737 HG LEU 101 HG LEU 101 13.260 -0.615 1.167 738 HB2 LEU 101 HB2 LEU 101 13.235 -0.959 -1.242 739 HB3 LEU 101 HB1 LEU 101 11.538 -1.424 -1.186 740 HD11 LEU 101 HD11 LEU 101 11.796 1.306 1.260 741 HD12 LEU 101 HD12 LEU 101 10.892 0.716 -0.136 742 HD13 LEU 101 HD13 LEU 101 12.573 1.214 -0.320 743 HD21 LEU 101 HD21 LEU 101 10.349 -1.359 1.073 744 HD22 LEU 101 HD22 LEU 101 11.245 -0.784 2.479 745 HD23 LEU 101 HD23 LEU 101 11.640 -2.344 1.760 746 H ASP 102 HN ASP 102 11.522 -4.974 -1.131 747 HA ASP 102 HA ASP 102 12.721 -5.426 -3.683 748 HB2 ASP 102 HB2 ASP 102 10.872 -7.078 -4.010 749 HB3 ASP 102 HB1 ASP 102 11.779 -7.316 -2.520 750 H ASP 103 HN ASP 103 10.851 -5.718 -5.575 751 HA ASP 103 HA ASP 103 10.403 -3.114 -6.517 752 HB2 ASP 103 HB2 ASP 103 10.398 -4.595 -8.250 753 HB3 ASP 103 HB1 ASP 103 9.616 -5.863 -7.309 754 H GLU 104 HN GLU 104 8.380 -5.231 -4.617 755 HA GLU 104 HA GLU 104 6.021 -3.597 -4.974 756 HB2 GLU 104 HB2 GLU 104 6.173 -6.167 -4.722 757 HB3 GLU 104 HB1 GLU 104 6.355 -5.843 -3.006 758 HG2 GLU 104 HG2 GLU 104 4.208 -4.826 -2.895 759 HG3 GLU 104 HG1 GLU 104 4.035 -4.894 -4.664 760 H GLU 105 HN GLU 105 8.530 -4.190 -2.628 761 HA GLU 105 HA GLU 105 7.381 -2.625 -0.551 762 HB2 GLU 105 HB2 GLU 105 9.738 -4.224 -0.921 763 HB3 GLU 105 HB1 GLU 105 10.169 -2.678 -0.196 764 HG2 GLU 105 HG2 GLU 105 8.631 -2.994 1.592 765 HG3 GLU 105 HG1 GLU 105 7.935 -4.409 0.819 766 H PHE 106 HN PHE 106 9.503 -1.893 -3.262 767 HA PHE 106 HA PHE 106 9.988 0.815 -2.519 768 HD1 PHE 106 HD2 PHE 106 9.185 2.608 -4.366 769 HD2 PHE 106 HD1 PHE 106 12.622 0.714 -5.996 770 HE1 PHE 106 HE2 PHE 106 9.931 4.753 -5.297 771 HE2 PHE 106 HE1 PHE 106 13.355 2.845 -6.934 772 HZ PHE 106 HZ PHE 106 12.032 4.879 -6.557 773 HB2 PHE 106 HB2 PHE 106 11.305 -0.386 -4.267 774 HB3 PHE 106 HB1 PHE 106 9.893 -0.389 -5.310 775 H ALA 107 HN ALA 107 7.559 -0.825 -4.503 776 HA ALA 107 HA ALA 107 5.996 1.256 -5.353 777 HB1 ALA 107 HB1 ALA 107 4.099 -0.294 -5.253 778 HB2 ALA 107 HB2 ALA 107 5.052 -1.385 -4.244 779 HB3 ALA 107 HB3 ALA 107 5.542 -1.068 -5.909 780 H LEU 108 HN LEU 108 5.881 -0.332 -2.169 781 HA LEU 108 HA LEU 108 3.857 1.378 -1.142 782 HG LEU 108 HG LEU 108 2.814 -0.074 0.644 783 HB2 LEU 108 HB2 LEU 108 4.849 -0.949 -0.301 784 HB3 LEU 108 HB1 LEU 108 5.817 0.125 0.703 785 HD11 LEU 108 HD11 LEU 108 3.867 -1.892 1.785 786 HD12 LEU 108 HD12 LEU 108 3.084 -0.817 2.945 787 HD13 LEU 108 HD13 LEU 108 4.835 -0.767 2.734 788 HD21 LEU 108 HD21 LEU 108 4.552 1.747 2.284 789 HD22 LEU 108 HD22 LEU 108 2.817 1.507 2.504 790 HD23 LEU 108 HD23 LEU 108 3.428 2.229 1.016 791 H ALA 109 HN ALA 109 7.399 1.343 -0.833 792 HA ALA 109 HA ALA 109 7.773 3.386 0.966 793 HB1 ALA 109 HB1 ALA 109 9.968 3.728 -0.053 794 HB2 ALA 109 HB2 ALA 109 9.453 2.826 -1.476 795 HB3 ALA 109 HB3 ALA 109 9.589 2.012 0.081 796 H ASN 110 HN ASN 110 7.552 3.731 -2.570 797 HA ASN 110 HA ASN 110 7.765 6.570 -2.492 798 HB2 ASN 110 HB2 ASN 110 8.330 4.899 -4.424 799 HB3 ASN 110 HB1 ASN 110 6.630 5.093 -4.837 800 HD21 ASN 110 HD21 ASN 110 6.503 7.882 -3.982 801 HD22 ASN 110 HD22 ASN 110 7.372 8.794 -5.173 802 H HIS 111 HN HIS 111 5.172 4.226 -2.257 803 HA HIS 111 HA HIS 111 3.057 6.008 -3.007 804 HD1 HIS 111 HD1 HIS 111 0.867 4.578 -4.316 805 HD2 HIS 111 HD2 HIS 111 0.310 4.112 -0.217 806 HE1 HIS 111 HE1 HIS 111 -1.595 4.838 -3.929 807 HE2 HIS 111 HE2 HIS 111 -1.863 4.842 -1.419 808 HB2 HIS 111 HB2 HIS 111 2.914 3.460 -2.948 809 HB3 HIS 111 HB1 HIS 111 2.808 3.596 -1.192 810 H LEU 112 HN LEU 112 4.594 5.086 0.044 811 HA LEU 112 HA LEU 112 2.874 6.613 1.716 812 HG LEU 112 HG LEU 112 3.874 3.827 2.203 813 HB2 LEU 112 HB2 LEU 112 5.643 5.501 2.081 814 HB3 LEU 112 HB1 LEU 112 4.843 6.454 3.332 815 HD11 LEU 112 HD11 LEU 112 5.098 4.585 4.842 816 HD12 LEU 112 HD12 LEU 112 5.782 3.521 3.613 817 HD13 LEU 112 HD13 LEU 112 4.337 3.033 4.500 818 HD21 LEU 112 HD21 LEU 112 2.720 5.578 4.374 819 HD22 LEU 112 HD22 LEU 112 2.176 3.949 3.972 820 HD23 LEU 112 HD23 LEU 112 2.001 5.252 2.797 821 H ILE 113 HN ILE 113 5.907 7.274 0.065 822 HA ILE 113 HA ILE 113 6.441 9.804 1.098 823 HB ILE 113 HB ILE 113 6.962 8.683 -1.656 824 HG12 ILE 113 HG12 ILE 113 8.806 9.139 0.700 825 HG13 ILE 113 HG11 ILE 113 8.046 7.600 0.317 826 HG21 ILE 113 HG21 ILE 113 8.557 10.506 -1.974 827 HG22 ILE 113 HG22 ILE 113 8.061 11.213 -0.436 828 HG23 ILE 113 HG23 ILE 113 6.916 11.125 -1.776 829 HD11 ILE 113 HD11 ILE 113 10.361 7.696 -0.442 830 HD12 ILE 113 HD12 ILE 113 9.972 9.086 -1.456 831 HD13 ILE 113 HD13 ILE 113 9.242 7.517 -1.793 832 H LYS 114 HN LYS 114 4.463 8.919 -1.752 833 HA LYS 114 HA LYS 114 3.649 11.624 -2.180 834 HB2 LYS 114 HB2 LYS 114 2.156 10.823 -3.843 835 HB3 LYS 114 HB1 LYS 114 3.595 9.819 -3.940 836 HG2 LYS 114 HG2 LYS 114 2.461 8.038 -2.753 837 HG3 LYS 114 HG1 LYS 114 1.026 9.050 -2.565 838 HD2 LYS 114 HD2 LYS 114 2.207 8.077 -5.168 839 HD3 LYS 114 HD1 LYS 114 0.735 7.482 -4.401 840 HE2 LYS 114 HE2 LYS 114 -0.314 9.648 -4.676 841 HE3 LYS 114 HE1 LYS 114 1.173 10.308 -5.354 842 HZ1 LYS 114 HZ1 LYS 114 -0.235 9.805 -7.154 843 HZ2 LYS 114 HZ2 LYS 114 -0.608 8.268 -6.551 844 HZ3 LYS 114 HZ3 LYS 114 0.948 8.588 -7.144 845 H VAL 115 HN VAL 115 2.440 9.024 -0.199 846 HA VAL 115 HA VAL 115 -0.100 10.077 0.429 847 HB VAL 115 HB VAL 115 1.759 8.194 1.850 848 HG11 VAL 115 HG11 VAL 115 -0.892 9.148 2.922 849 HG12 VAL 115 HG12 VAL 115 0.690 9.487 3.626 850 HG13 VAL 115 HG13 VAL 115 0.081 7.832 3.583 851 HG21 VAL 115 HG21 VAL 115 0.470 7.371 -0.052 852 HG22 VAL 115 HG22 VAL 115 -1.023 7.894 0.727 853 HG23 VAL 115 HG23 VAL 115 -0.056 6.608 1.446 854 H LYS 116 HN LYS 116 3.087 10.596 2.025 855 HA LYS 116 HA LYS 116 1.833 12.523 3.770 856 HB2 LYS 116 HB2 LYS 116 3.988 12.838 4.757 857 HB3 LYS 116 HB1 LYS 116 3.638 11.121 4.600 858 HG2 LYS 116 HG2 LYS 116 5.261 10.793 3.058 859 HG3 LYS 116 HG1 LYS 116 5.156 12.445 2.430 860 HD2 LYS 116 HD2 LYS 116 6.295 11.614 5.087 861 HD3 LYS 116 HD1 LYS 116 7.214 12.109 3.671 862 HE2 LYS 116 HE2 LYS 116 5.265 13.791 5.230 863 HE3 LYS 116 HE1 LYS 116 7.014 13.946 5.225 864 HZ1 LYS 116 HZ1 LYS 116 5.199 14.450 2.930 865 HZ2 LYS 116 HZ2 LYS 116 6.887 14.490 2.841 866 HZ3 LYS 116 HZ3 LYS 116 6.069 15.613 3.810 867 H LEU 117 HN LEU 117 2.863 12.576 0.627 868 HA LEU 117 HA LEU 117 3.581 15.376 0.580 869 HG LEU 117 HG LEU 117 2.693 15.935 -2.291 870 HB2 LEU 117 HB2 LEU 117 4.454 13.787 -1.100 871 HB3 LEU 117 HB1 LEU 117 2.807 13.511 -1.675 872 HD11 LEU 117 HD11 LEU 117 5.651 15.867 -1.722 873 HD12 LEU 117 HD12 LEU 117 4.445 16.731 -0.770 874 HD13 LEU 117 HD13 LEU 117 4.755 17.206 -2.440 875 HD21 LEU 117 HD21 LEU 117 4.901 14.340 -3.577 876 HD22 LEU 117 HD22 LEU 117 4.028 15.690 -4.306 877 HD23 LEU 117 HD23 LEU 117 3.180 14.190 -3.929 878 H GLU 118 HN GLU 118 0.725 13.425 0.454 879 HA GLU 118 HA GLU 118 -1.046 15.266 -0.747 880 HB2 GLU 118 HB2 GLU 118 -1.572 13.038 1.230 881 HB3 GLU 118 HB1 GLU 118 -2.830 13.928 0.383 882 HG2 GLU 118 HG2 GLU 118 -1.939 13.133 -1.758 883 HG3 GLU 118 HG1 GLU 118 -0.703 12.214 -0.888 884 H GLY 119 HN GLY 119 0.473 15.295 2.300 885 HA2 GLY 119 HA2 GLY 119 0.456 17.478 3.375 886 HA3 GLY 119 HA1 GLY 119 -1.272 17.547 3.060 887 H HIS 120 HN HIS 120 -0.389 14.452 3.976 888 HA HIS 120 HA HIS 120 -0.750 15.071 6.816 889 HD1 HIS 120 HD1 HIS 120 -2.246 11.181 7.461 890 HD2 HIS 120 HD2 HIS 120 -2.132 12.245 3.436 891 HE1 HIS 120 HE1 HIS 120 -2.287 9.019 6.192 892 HE2 HIS 120 HE2 HIS 120 -2.441 9.699 3.751 893 HB2 HIS 120 HB2 HIS 120 -2.504 13.614 7.134 894 HB3 HIS 120 HB1 HIS 120 -2.873 14.190 5.516 895 H GLU 121 HN GLU 121 0.414 13.848 8.185 896 HA GLU 121 HA GLU 121 2.604 12.350 7.098 897 HB2 GLU 121 HB2 GLU 121 3.388 12.165 9.371 898 HB3 GLU 121 HB1 GLU 121 2.831 13.809 9.091 899 HG2 GLU 121 HG2 GLU 121 0.830 13.427 10.303 900 HG3 GLU 121 HG1 GLU 121 1.147 11.694 10.401 901 H LEU 122 HN LEU 122 3.188 10.187 7.993 902 HA LEU 122 HA LEU 122 1.087 8.330 7.509 903 HG LEU 122 HG LEU 122 4.306 8.900 6.724 904 HB2 LEU 122 HB2 LEU 122 3.763 7.724 8.757 905 HB3 LEU 122 HB1 LEU 122 2.711 6.615 7.879 906 HD11 LEU 122 HD11 LEU 122 4.456 5.919 6.348 907 HD12 LEU 122 HD12 LEU 122 5.612 6.922 7.226 908 HD13 LEU 122 HD13 LEU 122 5.421 7.112 5.482 909 HD21 LEU 122 HD21 LEU 122 3.426 8.244 4.563 910 HD22 LEU 122 HD22 LEU 122 2.122 8.744 5.640 911 HD23 LEU 122 HD23 LEU 122 2.401 7.031 5.330 912 HA PRO 123 HA PRO 123 -0.225 7.981 11.723 913 HB2 PRO 123 HB2 PRO 123 -2.147 6.141 11.368 914 HB3 PRO 123 HB1 PRO 123 -2.292 7.775 10.711 915 HG2 PRO 123 HG2 PRO 123 -1.752 5.230 9.321 916 HG3 PRO 123 HG1 PRO 123 -2.471 6.720 8.698 917 HD2 PRO 123 HD2 PRO 123 0.233 5.820 8.415 918 HD3 PRO 123 HD1 PRO 123 -0.474 7.336 7.826 919 H ALA 124 HN ALA 124 1.867 5.959 10.473 920 HA ALA 124 HA ALA 124 3.070 4.165 11.154 921 HB1 ALA 124 HB1 ALA 124 3.265 5.470 13.217 922 HB2 ALA 124 HB2 ALA 124 3.247 3.734 13.532 923 HB3 ALA 124 HB3 ALA 124 1.804 4.701 13.836 924 H ASP 125 HN ASP 125 0.212 3.899 10.270 925 HA ASP 125 HA ASP 125 -0.342 1.215 11.344 926 HB2 ASP 125 HB2 ASP 125 -2.138 3.013 11.588 927 HB3 ASP 125 HB1 ASP 125 -2.275 2.985 9.833 928 H LEU 126 HN LEU 126 -0.454 -0.482 9.911 929 HA LEU 126 HA LEU 126 -0.066 0.165 7.065 930 HG LEU 126 HG LEU 126 2.340 -0.533 6.342 931 HB2 LEU 126 HB2 LEU 126 1.765 -1.113 8.594 932 HB3 LEU 126 HB1 LEU 126 0.815 -2.486 8.059 933 HD11 LEU 126 HD11 LEU 126 3.562 -2.511 5.633 934 HD12 LEU 126 HD12 LEU 126 2.573 -3.516 6.692 935 HD13 LEU 126 HD13 LEU 126 3.656 -2.309 7.384 936 HD21 LEU 126 HD21 LEU 126 0.183 -1.028 5.292 937 HD22 LEU 126 HD22 LEU 126 0.522 -2.754 5.427 938 HD23 LEU 126 HD23 LEU 126 1.531 -1.736 4.398 939 HA PRO 127 HA PRO 127 -4.104 -1.854 7.522 940 HB2 PRO 127 HB2 PRO 127 -4.746 -0.516 5.001 941 HB3 PRO 127 HB1 PRO 127 -5.475 -0.311 6.594 942 HG2 PRO 127 HG2 PRO 127 -3.965 1.587 5.441 943 HG3 PRO 127 HG1 PRO 127 -4.003 1.341 7.197 944 HD2 PRO 127 HD2 PRO 127 -1.971 0.418 5.198 945 HD3 PRO 127 HD1 PRO 127 -1.710 1.154 6.794 946 HA PRO 128 HA PRO 128 -3.578 -5.300 4.817 947 HB2 PRO 128 HB2 PRO 128 -6.464 -5.701 4.723 948 HB3 PRO 128 HB1 PRO 128 -5.221 -6.694 5.499 949 HG2 PRO 128 HG2 PRO 128 -7.030 -5.183 6.860 950 HG3 PRO 128 HG1 PRO 128 -5.439 -5.618 7.499 951 HD2 PRO 128 HD2 PRO 128 -6.417 -3.046 6.377 952 HD3 PRO 128 HD1 PRO 128 -5.221 -3.345 7.653 953 H HIS 129 HN HIS 129 -5.296 -2.561 3.930 954 HA HIS 129 HA HIS 129 -5.538 -3.495 1.160 955 HD1 HIS 129 HD1 HIS 129 -8.096 -1.499 4.222 956 HD2 HIS 129 HD2 HIS 129 -5.999 0.966 1.619 957 HE1 HIS 129 HE1 HIS 129 -7.997 0.747 5.345 958 HE2 HIS 129 HE2 HIS 129 -7.041 2.275 3.588 959 HB2 HIS 129 HB2 HIS 129 -6.983 -1.552 0.726 960 HB3 HIS 129 HB1 HIS 129 -7.645 -2.573 1.984 961 H LEU 130 HN LEU 130 -3.309 -2.288 2.997 962 HA LEU 130 HA LEU 130 -2.050 -0.976 0.663 963 HG LEU 130 HG LEU 130 -1.477 1.269 0.776 964 HB2 LEU 130 HB2 LEU 130 -2.351 0.021 3.335 965 HB3 LEU 130 HB1 LEU 130 -0.672 -0.027 2.874 966 HD11 LEU 130 HD11 LEU 130 -3.743 1.828 2.673 967 HD12 LEU 130 HD12 LEU 130 -3.854 1.014 1.113 968 HD13 LEU 130 HD13 LEU 130 -3.404 2.719 1.189 969 HD21 LEU 130 HD21 LEU 130 -1.188 3.395 1.949 970 HD22 LEU 130 HD22 LEU 130 -0.009 2.192 2.472 971 HD23 LEU 130 HD23 LEU 130 -1.399 2.564 3.493 972 H VAL 131 HN VAL 131 -2.037 -3.483 2.848 973 HA VAL 131 HA VAL 131 0.722 -3.954 3.126 974 HB VAL 131 HB VAL 131 -1.674 -5.791 3.205 975 HG11 VAL 131 HG11 VAL 131 0.220 -7.055 2.325 976 HG12 VAL 131 HG12 VAL 131 -0.200 -7.563 3.960 977 HG13 VAL 131 HG13 VAL 131 1.203 -6.527 3.693 978 HG21 VAL 131 HG21 VAL 131 -1.367 -4.301 5.110 979 HG22 VAL 131 HG22 VAL 131 0.285 -4.897 5.307 980 HG23 VAL 131 HG23 VAL 131 -1.080 -5.982 5.561 981 HA PRO 132 HA PRO 132 1.634 -4.830 -1.176 982 HB2 PRO 132 HB2 PRO 132 3.988 -6.091 0.144 983 HB3 PRO 132 HB1 PRO 132 3.933 -4.952 -1.202 984 HG2 PRO 132 HG2 PRO 132 4.668 -4.155 1.232 985 HG3 PRO 132 HG1 PRO 132 3.688 -3.117 0.179 986 HD2 PRO 132 HD2 PRO 132 2.860 -4.730 2.557 987 HD3 PRO 132 HD1 PRO 132 2.273 -3.142 2.001 988 HA PRO 133 HA PRO 133 -0.530 -8.677 -0.932 989 HB2 PRO 133 HB2 PRO 133 0.295 -9.490 -3.532 990 HB3 PRO 133 HB1 PRO 133 -1.237 -8.739 -3.068 991 HG2 PRO 133 HG2 PRO 133 1.155 -7.540 -4.303 992 HG3 PRO 133 HG1 PRO 133 -0.536 -6.979 -4.325 993 HD2 PRO 133 HD2 PRO 133 1.443 -5.773 -2.887 994 HD3 PRO 133 HD1 PRO 133 -0.265 -5.739 -2.405 995 H SER 134 HN SER 134 2.847 -8.601 -2.005 996 HA SER 134 HA SER 134 3.139 -11.465 -1.754 997 HG SER 134 HG SER 134 4.037 -9.055 -3.820 998 HB2 SER 134 HB2 SER 134 5.307 -9.380 -2.086 999 HB3 SER 134 HB1 SER 134 5.415 -11.103 -2.451 1000 H LYS 135 HN LYS 135 2.941 -9.059 0.528 1001 HA LYS 135 HA LYS 135 4.843 -10.396 2.329 1002 HB2 LYS 135 HB2 LYS 135 3.385 -7.984 3.249 1003 HB3 LYS 135 HB1 LYS 135 5.040 -8.472 3.545 1004 HG2 LYS 135 HG2 LYS 135 3.983 -7.241 1.010 1005 HG3 LYS 135 HG1 LYS 135 4.921 -6.418 2.250 1006 HD2 LYS 135 HD2 LYS 135 5.909 -8.747 0.612 1007 HD3 LYS 135 HD1 LYS 135 6.243 -7.057 0.254 1008 HE2 LYS 135 HE2 LYS 135 7.303 -6.835 2.483 1009 HE3 LYS 135 HE1 LYS 135 7.064 -8.564 2.730 1010 HZ1 LYS 135 HZ1 LYS 135 8.706 -7.340 0.566 1011 HZ2 LYS 135 HZ2 LYS 135 8.466 -8.999 0.816 1012 HZ3 LYS 135 HZ3 LYS 135 9.298 -8.086 1.973 1013 H ARG 136 HN ARG 136 1.774 -10.772 1.425 1014 HA ARG 136 HA ARG 136 0.521 -11.132 3.965 1015 HE ARG 136 HE ARG 136 -2.784 -10.905 4.239 1016 HB2 ARG 136 HB2 ARG 136 -0.217 -12.113 1.209 1017 HB3 ARG 136 HB1 ARG 136 -1.191 -12.428 2.635 1018 HG2 ARG 136 HG2 ARG 136 -0.637 -9.796 1.300 1019 HG3 ARG 136 HG1 ARG 136 -2.190 -10.597 1.561 1020 HD2 ARG 136 HD2 ARG 136 -0.421 -9.246 3.584 1021 HD3 ARG 136 HD1 ARG 136 -2.067 -8.825 3.124 1022 HH11 ARG 136 HH11 ARG 136 0.399 -9.651 4.992 1023 HH12 ARG 136 HH12 ARG 136 0.437 -10.307 6.598 1024 HH21 ARG 136 HH21 ARG 136 -2.768 -11.771 6.362 1025 HH22 ARG 136 HH22 ARG 136 -1.380 -11.523 7.384 1026 H ARG 137 HN ARG 137 1.600 -12.488 5.288 1027 HA ARG 137 HA ARG 137 1.237 -15.293 4.647 1028 HE ARG 137 HE ARG 137 5.174 -14.710 3.325 1029 HB2 ARG 137 HB2 ARG 137 3.484 -15.900 5.581 1030 HB3 ARG 137 HB1 ARG 137 3.528 -15.104 4.017 1031 HG2 ARG 137 HG2 ARG 137 3.793 -13.338 6.362 1032 HG3 ARG 137 HG1 ARG 137 5.125 -14.451 6.070 1033 HD2 ARG 137 HD2 ARG 137 3.990 -12.473 4.115 1034 HD3 ARG 137 HD1 ARG 137 5.530 -12.337 4.960 1035 HH11 ARG 137 HH11 ARG 137 6.478 -11.473 3.543 1036 HH12 ARG 137 HH12 ARG 137 7.521 -11.658 2.168 1037 HH21 ARG 137 HH21 ARG 137 6.553 -14.970 1.544 1038 HH22 ARG 137 HH22 ARG 137 7.582 -13.665 1.043 1039 H HIS 138 HN HIS 138 0.179 -16.196 6.247 1040 HA HIS 138 HA HIS 138 0.250 -14.936 8.895 1041 HD1 HIS 138 HD1 HIS 138 -1.308 -18.172 10.323 1042 HD2 HIS 138 HD2 HIS 138 -3.109 -14.426 10.127 1043 HE1 HIS 138 HE1 HIS 138 -2.490 -17.875 12.524 1044 HE2 HIS 138 HE2 HIS 138 -3.500 -15.561 12.421 1045 HB2 HIS 138 HB2 HIS 138 -1.963 -15.358 7.842 1046 HB3 HIS 138 HB1 HIS 138 -1.610 -17.082 7.839 1047 H GLU 139 HN GLU 139 1.832 -15.715 10.150 1048 HA GLU 139 HA GLU 139 2.496 -18.552 10.087 1049 HB2 GLU 139 HB2 GLU 139 3.658 -16.330 11.787 1050 HB3 GLU 139 HB1 GLU 139 4.308 -17.955 11.614 1051 HG2 GLU 139 HG2 GLU 139 4.777 -17.527 9.261 1052 HG3 GLU 139 HG1 GLU 139 4.104 -15.906 9.417 Start of MODEL 4 1 H1 GLY 1 HT1 GLY 1 -10.307 -14.319 -33.650 2 H2 GLY 1 HT2 GLY 1 -11.722 -14.123 -32.732 3 H3 GLY 1 HT3 GLY 1 -10.209 -13.803 -32.041 4 HA2 GLY 1 HA1 GLY 1 -9.870 -11.968 -33.585 5 HA3 GLY 1 HA2 GLY 1 -11.465 -12.281 -34.253 6 HA PRO 2 HA PRO 2 -11.766 -9.090 -30.838 7 HB2 PRO 2 HB2 PRO 2 -13.541 -7.773 -32.793 8 HB3 PRO 2 HB1 PRO 2 -12.183 -7.107 -31.884 9 HG2 PRO 2 HG2 PRO 2 -12.014 -7.563 -34.518 10 HG3 PRO 2 HG1 PRO 2 -10.626 -7.807 -33.443 11 HD2 PRO 2 HD2 PRO 2 -12.481 -9.838 -34.624 12 HD3 PRO 2 HD1 PRO 2 -10.717 -9.906 -34.422 13 H LEU 3 HN LEU 3 -14.046 -10.772 -32.858 14 HA LEU 3 HA LEU 3 -16.290 -10.277 -31.114 15 HG LEU 3 HG LEU 3 -17.695 -10.700 -34.535 16 HB2 LEU 3 HB2 LEU 3 -15.961 -12.176 -33.446 17 HB3 LEU 3 HB1 LEU 3 -17.456 -11.941 -32.568 18 HD11 LEU 3 HD11 LEU 3 -16.817 -8.786 -32.389 19 HD12 LEU 3 HD12 LEU 3 -18.421 -9.494 -32.578 20 HD13 LEU 3 HD13 LEU 3 -17.804 -8.377 -33.793 21 HD21 LEU 3 HD21 LEU 3 -14.958 -9.530 -34.058 22 HD22 LEU 3 HD22 LEU 3 -16.048 -9.105 -35.380 23 HD23 LEU 3 HD23 LEU 3 -15.382 -10.733 -35.274 24 H GLY 4 HN GLY 4 -17.028 -11.574 -29.518 25 HA2 GLY 4 HA2 GLY 4 -17.067 -13.352 -28.031 26 HA3 GLY 4 HA1 GLY 4 -16.065 -14.259 -29.158 27 H SER 5 HN SER 5 -15.166 -11.095 -27.991 28 HA SER 5 HA SER 5 -12.676 -12.118 -27.007 29 HG SER 5 HG SER 5 -14.271 -9.043 -28.297 30 HB2 SER 5 HB2 SER 5 -12.478 -9.602 -26.283 31 HB3 SER 5 HB1 SER 5 -12.432 -10.024 -27.997 32 H GLU 6 HN GLU 6 -11.872 -11.554 -24.828 33 HA GLU 6 HA GLU 6 -13.383 -12.743 -22.833 34 HB2 GLU 6 HB2 GLU 6 -11.141 -10.763 -22.427 35 HB3 GLU 6 HB1 GLU 6 -11.687 -11.982 -21.284 36 HG2 GLU 6 HG2 GLU 6 -11.022 -13.734 -22.887 37 HG3 GLU 6 HG1 GLU 6 -10.380 -12.482 -23.944 38 H SER 7 HN SER 7 -15.100 -12.086 -21.788 39 HA SER 7 HA SER 7 -15.603 -9.192 -21.598 40 HG SER 7 HG SER 7 -16.436 -10.747 -23.667 41 HB2 SER 7 HB2 SER 7 -17.593 -11.476 -21.664 42 HB3 SER 7 HB1 SER 7 -17.999 -9.764 -21.526 43 H LEU 8 HN LEU 8 -15.398 -8.388 -19.640 44 HA LEU 8 HA LEU 8 -15.708 -10.142 -17.311 45 HG LEU 8 HG LEU 8 -15.278 -7.884 -15.204 46 HB2 LEU 8 HB2 LEU 8 -13.595 -8.859 -17.513 47 HB3 LEU 8 HB1 LEU 8 -14.516 -7.369 -17.489 48 HD11 LEU 8 HD11 LEU 8 -15.170 -10.318 -15.311 49 HD12 LEU 8 HD12 LEU 8 -14.229 -9.698 -13.952 50 HD13 LEU 8 HD13 LEU 8 -13.409 -10.241 -15.417 51 HD21 LEU 8 HD21 LEU 8 -13.105 -7.533 -14.098 52 HD22 LEU 8 HD22 LEU 8 -13.322 -6.493 -15.504 53 HD23 LEU 8 HD23 LEU 8 -12.291 -7.922 -15.613 54 H MET 9 HN MET 9 -17.131 -9.639 -15.653 55 HA MET 9 HA MET 9 -19.488 -8.224 -16.406 56 HB2 MET 9 HB2 MET 9 -18.623 -9.491 -13.802 57 HB3 MET 9 HB1 MET 9 -20.195 -8.736 -14.026 58 HG2 MET 9 HG2 MET 9 -20.788 -10.326 -15.712 59 HG3 MET 9 HG1 MET 9 -19.163 -11.009 -15.706 60 HE1 MET 9 HE1 MET 9 -18.980 -12.815 -12.277 61 HE2 MET 9 HE2 MET 9 -18.431 -11.177 -12.632 62 HE3 MET 9 HE3 MET 9 -18.169 -12.470 -13.804 63 HA PRO 10 HA PRO 10 -18.760 -4.107 -15.097 64 HB2 PRO 10 HB2 PRO 10 -21.350 -4.204 -13.646 65 HB3 PRO 10 HB1 PRO 10 -20.810 -3.095 -14.911 66 HG2 PRO 10 HG2 PRO 10 -22.578 -5.007 -15.451 67 HG3 PRO 10 HG1 PRO 10 -21.305 -4.597 -16.616 68 HD2 PRO 10 HD2 PRO 10 -21.474 -6.915 -14.736 69 HD3 PRO 10 HD1 PRO 10 -20.891 -6.866 -16.411 70 H SER 11 HN SER 11 -18.491 -2.698 -13.260 71 HA SER 11 HA SER 11 -17.766 -4.221 -10.858 72 HG SER 11 HG SER 11 -16.631 -1.542 -9.584 73 HB2 SER 11 HB2 SER 11 -15.971 -2.920 -11.951 74 HB3 SER 11 HB1 SER 11 -16.921 -1.447 -11.755 75 H GLN 12 HN GLN 12 -19.492 -4.277 -9.527 76 HA GLN 12 HA GLN 12 -21.362 -2.128 -9.312 77 HB2 GLN 12 HB2 GLN 12 -20.986 -4.668 -7.736 78 HB3 GLN 12 HB1 GLN 12 -22.225 -3.488 -7.341 79 HG2 GLN 12 HG2 GLN 12 -23.098 -3.749 -9.670 80 HG3 GLN 12 HG1 GLN 12 -21.971 -5.091 -9.871 81 HE21 GLN 12 HE21 GLN 12 -24.796 -3.950 -8.204 82 HE22 GLN 12 HE22 GLN 12 -25.346 -5.494 -7.650 83 H VAL 13 HN VAL 13 -21.964 -1.317 -7.057 84 HA VAL 13 HA VAL 13 -19.652 0.061 -6.030 85 HB VAL 13 HB VAL 13 -22.486 0.151 -4.982 86 HG11 VAL 13 HG11 VAL 13 -20.210 2.111 -4.735 87 HG12 VAL 13 HG12 VAL 13 -20.812 1.060 -3.457 88 HG13 VAL 13 HG13 VAL 13 -21.840 2.339 -4.101 89 HG21 VAL 13 HG21 VAL 13 -22.837 2.087 -6.405 90 HG22 VAL 13 HG22 VAL 13 -22.408 0.684 -7.387 91 HG23 VAL 13 HG23 VAL 13 -21.206 1.931 -7.053 92 H VAL 14 HN VAL 14 -18.370 -0.767 -4.525 93 HA VAL 14 HA VAL 14 -19.536 -2.576 -2.517 94 HB VAL 14 HB VAL 14 -18.148 -3.873 -4.041 95 HG11 VAL 14 HG11 VAL 14 -16.722 -2.084 -4.876 96 HG12 VAL 14 HG12 VAL 14 -15.756 -3.440 -4.296 97 HG13 VAL 14 HG13 VAL 14 -15.913 -1.986 -3.311 98 HG21 VAL 14 HG21 VAL 14 -16.769 -3.454 -1.388 99 HG22 VAL 14 HG22 VAL 14 -16.600 -4.863 -2.435 100 HG23 VAL 14 HG23 VAL 14 -18.154 -4.508 -1.682 101 H LYS 15 HN LYS 15 -18.984 -2.251 -0.406 102 HA LYS 15 HA LYS 15 -16.692 -0.590 0.246 103 HB2 LYS 15 HB2 LYS 15 -18.746 0.923 0.024 104 HB3 LYS 15 HB1 LYS 15 -19.373 0.112 1.452 105 HG2 LYS 15 HG2 LYS 15 -18.324 2.174 2.101 106 HG3 LYS 15 HG1 LYS 15 -17.356 0.822 2.694 107 HD2 LYS 15 HD2 LYS 15 -15.833 1.077 0.811 108 HD3 LYS 15 HD1 LYS 15 -16.806 2.407 0.186 109 HE2 LYS 15 HE2 LYS 15 -16.346 3.667 2.258 110 HE3 LYS 15 HE1 LYS 15 -15.307 2.351 2.803 111 HZ1 LYS 15 HZ1 LYS 15 -14.042 4.155 1.781 112 HZ2 LYS 15 HZ2 LYS 15 -14.891 3.943 0.330 113 HZ3 LYS 15 HZ3 LYS 15 -13.877 2.711 0.905 114 H GLY 16 HN GLY 16 -15.707 -2.247 1.285 115 HA2 GLY 16 HA2 GLY 16 -17.228 -3.657 3.384 116 HA3 GLY 16 HA1 GLY 16 -15.837 -4.311 2.535 117 H GLY 17 HN GLY 17 -16.395 -3.919 5.439 118 HA2 GLY 17 HA2 GLY 17 -14.780 -3.745 7.136 119 HA3 GLY 17 HA1 GLY 17 -13.757 -2.831 6.041 120 H ALA 18 HN ALA 18 -16.864 -1.617 5.951 121 HA ALA 18 HA ALA 18 -16.014 0.765 7.342 122 HB1 ALA 18 HB1 ALA 18 -18.088 1.744 6.549 123 HB2 ALA 18 HB2 ALA 18 -18.647 0.161 5.999 124 HB3 ALA 18 HB3 ALA 18 -17.252 0.921 5.233 125 H PHE 19 HN PHE 19 -15.879 0.147 9.492 126 HA PHE 19 HA PHE 19 -18.487 -0.271 10.796 127 HD1 PHE 19 HD2 PHE 19 -19.056 -2.804 12.194 128 HD2 PHE 19 HD1 PHE 19 -15.495 -2.823 9.856 129 HE1 PHE 19 HE2 PHE 19 -19.692 -4.989 11.249 130 HE2 PHE 19 HE1 PHE 19 -16.128 -5.002 8.906 131 HZ PHE 19 HZ PHE 19 -18.268 -6.086 9.632 132 HB2 PHE 19 HB2 PHE 19 -15.759 -1.272 11.638 133 HB3 PHE 19 HB1 PHE 19 -17.169 -1.302 12.691 134 H ASP 20 HN ASP 20 -19.142 1.410 11.959 135 HA ASP 20 HA ASP 20 -17.101 3.149 13.163 136 HB2 ASP 20 HB2 ASP 20 -18.661 4.994 13.073 137 HB3 ASP 20 HB1 ASP 20 -18.524 4.301 11.462 138 H GLY 21 HN GLY 21 -17.334 3.738 15.305 139 HA2 GLY 21 HA2 GLY 21 -19.027 1.889 16.829 140 HA3 GLY 21 HA1 GLY 21 -17.635 2.765 17.456 141 H THR 22 HN THR 22 -20.836 3.403 16.041 142 HA THR 22 HA THR 22 -21.131 5.591 17.999 143 HB THR 22 HB THR 22 -22.698 5.423 15.430 144 HG1 THR 22 HG1 THR 22 -20.718 5.578 14.569 145 HG21 THR 22 HG21 THR 22 -22.844 7.857 15.763 146 HG22 THR 22 HG22 THR 22 -21.901 7.705 17.244 147 HG23 THR 22 HG23 THR 22 -23.504 6.971 17.136 148 H MET 23 HN MET 23 -22.321 4.744 19.632 149 HA MET 23 HA MET 23 -24.828 3.434 18.904 150 HB2 MET 23 HB2 MET 23 -24.551 1.820 20.771 151 HB3 MET 23 HB1 MET 23 -23.407 1.593 19.455 152 HG2 MET 23 HG2 MET 23 -21.678 2.707 20.757 153 HG3 MET 23 HG1 MET 23 -22.827 2.966 22.067 154 HE1 MET 23 HE1 MET 23 -20.079 1.769 22.399 155 HE2 MET 23 HE2 MET 23 -20.245 0.264 23.303 156 HE3 MET 23 HE3 MET 23 -21.114 1.706 23.827 157 H ASN 24 HN ASN 24 -26.318 4.795 19.553 158 HA ASN 24 HA ASN 24 -26.152 5.843 22.299 159 HB2 ASN 24 HB2 ASN 24 -27.195 7.190 19.802 160 HB3 ASN 24 HB1 ASN 24 -27.552 7.781 21.422 161 HD21 ASN 24 HD21 ASN 24 -25.960 8.789 22.596 162 HD22 ASN 24 HD22 ASN 24 -24.433 9.249 21.917 163 H GLY 25 HN GLY 25 -27.597 4.853 23.530 164 HA2 GLY 25 HA2 GLY 25 -30.018 4.678 23.964 165 HA3 GLY 25 HA1 GLY 25 -30.183 4.118 22.312 166 HA PRO 26 HA PRO 26 -29.114 -0.044 23.794 167 HB2 PRO 26 HB2 PRO 26 -26.284 -0.293 23.115 168 HB3 PRO 26 HB1 PRO 26 -27.675 -1.128 22.422 169 HG2 PRO 26 HG2 PRO 26 -26.258 0.726 21.054 170 HG3 PRO 26 HG1 PRO 26 -27.996 0.473 20.799 171 HD2 PRO 26 HD2 PRO 26 -26.599 2.590 22.396 172 HD3 PRO 26 HD1 PRO 26 -27.994 2.737 21.309 173 H PHE 27 HN PHE 27 -29.221 0.035 25.978 174 HA PHE 27 HA PHE 27 -26.951 0.952 27.548 175 HD1 PHE 27 HD2 PHE 27 -27.655 2.781 29.518 176 HD2 PHE 27 HD1 PHE 27 -31.047 1.525 27.283 177 HE1 PHE 27 HE2 PHE 27 -28.410 5.118 29.362 178 HE2 PHE 27 HE1 PHE 27 -31.814 3.855 27.128 179 HZ PHE 27 HZ PHE 27 -30.510 5.653 28.190 180 HB2 PHE 27 HB2 PHE 27 -29.686 -0.062 28.344 181 HB3 PHE 27 HB1 PHE 27 -28.452 0.416 29.502 182 H GLY 28 HN GLY 28 -26.124 -1.106 26.095 183 HA2 GLY 28 HA2 GLY 28 -25.041 -2.902 27.904 184 HA3 GLY 28 HA1 GLY 28 -26.480 -3.674 27.253 185 H HIS 29 HN HIS 29 -23.225 -3.381 26.869 186 HA HIS 29 HA HIS 29 -23.359 -3.806 23.965 187 HD1 HIS 29 HD1 HIS 29 -19.156 -4.568 24.423 188 HD2 HIS 29 HD2 HIS 29 -21.604 -2.305 21.931 189 HE1 HIS 29 HE1 HIS 29 -18.097 -4.675 22.145 190 HE2 HIS 29 HE2 HIS 29 -19.691 -3.463 20.623 191 HB2 HIS 29 HB2 HIS 29 -21.803 -2.041 24.802 192 HB3 HIS 29 HB1 HIS 29 -20.926 -3.281 25.691 193 H GLY 30 HN GLY 30 -23.245 -5.827 23.246 194 HA2 GLY 30 HA2 GLY 30 -21.377 -7.721 24.194 195 HA3 GLY 30 HA1 GLY 30 -22.970 -8.075 24.862 196 H TYR 31 HN TYR 31 -20.967 -8.114 22.067 197 HA TYR 31 HA TYR 31 -23.107 -9.531 20.638 198 HD1 TYR 31 HD2 TYR 31 -24.696 -8.558 18.690 199 HD2 TYR 31 HD1 TYR 31 -22.277 -5.442 20.278 200 HE1 TYR 31 HE2 TYR 31 -26.650 -7.068 18.715 201 HE2 TYR 31 HE1 TYR 31 -24.225 -3.940 20.316 202 HH TYR 31 HH TYR 31 -26.430 -3.767 19.047 203 HB2 TYR 31 HB2 TYR 31 -21.271 -7.408 19.527 204 HB3 TYR 31 HB1 TYR 31 -22.150 -8.537 18.502 205 H GLY 32 HN GLY 32 -22.526 -11.325 19.536 206 HA2 GLY 32 HA2 GLY 32 -19.902 -12.427 19.957 207 HA3 GLY 32 HA1 GLY 32 -21.200 -13.148 19.007 208 H GLU 33 HN GLU 33 -18.321 -11.308 18.950 209 HA GLU 33 HA GLU 33 -18.599 -10.227 16.342 210 HB2 GLU 33 HB2 GLU 33 -17.153 -9.137 17.914 211 HB3 GLU 33 HB1 GLU 33 -16.248 -10.616 18.195 212 HG2 GLU 33 HG2 GLU 33 -15.378 -10.542 15.957 213 HG3 GLU 33 HG1 GLU 33 -16.323 -9.097 15.606 214 H GLY 34 HN GLY 34 -18.495 -11.321 14.520 215 HA2 GLY 34 HA2 GLY 34 -17.518 -14.068 14.567 216 HA3 GLY 34 HA1 GLY 34 -18.438 -13.308 13.280 217 H ALA 35 HN ALA 35 -15.783 -14.838 13.504 218 HA ALA 35 HA ALA 35 -13.791 -13.003 12.594 219 HB1 ALA 35 HB1 ALA 35 -12.509 -15.026 12.035 220 HB2 ALA 35 HB2 ALA 35 -13.934 -16.010 12.372 221 HB3 ALA 35 HB3 ALA 35 -13.167 -15.091 13.668 222 H GLY 36 HN GLY 36 -13.169 -12.506 10.537 223 HA2 GLY 36 HA2 GLY 36 -14.994 -13.386 8.397 224 HA3 GLY 36 HA1 GLY 36 -14.170 -11.834 8.431 225 H GLU 37 HN GLU 37 -14.221 -14.397 6.672 226 HA GLU 37 HA GLU 37 -11.388 -15.025 6.605 227 HB2 GLU 37 HB2 GLU 37 -13.169 -16.775 6.305 228 HB3 GLU 37 HB1 GLU 37 -13.593 -16.009 4.784 229 HG2 GLU 37 HG2 GLU 37 -11.396 -16.490 3.893 230 HG3 GLU 37 HG1 GLU 37 -10.901 -17.181 5.435 231 H GLY 38 HN GLY 38 -10.492 -15.116 4.206 232 HA2 GLY 38 HA2 GLY 38 -10.430 -12.350 3.430 233 HA3 GLY 38 HA1 GLY 38 -9.445 -13.637 2.756 234 H ILE 39 HN ILE 39 -12.577 -12.103 2.676 235 HA ILE 39 HA ILE 39 -13.394 -13.339 0.264 236 HB ILE 39 HB ILE 39 -14.647 -10.939 0.101 237 HG12 ILE 39 HG12 ILE 39 -15.346 -10.273 2.388 238 HG13 ILE 39 HG11 ILE 39 -14.166 -11.387 3.063 239 HG21 ILE 39 HG21 ILE 39 -15.734 -13.089 0.091 240 HG22 ILE 39 HG22 ILE 39 -16.541 -12.019 1.237 241 HG23 ILE 39 HG23 ILE 39 -15.447 -13.276 1.821 242 HD11 ILE 39 HD11 ILE 39 -13.373 -9.097 3.129 243 HD12 ILE 39 HD12 ILE 39 -13.555 -8.964 1.382 244 HD13 ILE 39 HD13 ILE 39 -12.367 -10.076 2.066 245 H ASP 40 HN ASP 40 -13.284 -12.450 -1.886 246 HA ASP 40 HA ASP 40 -10.724 -11.240 -2.346 247 HB2 ASP 40 HB2 ASP 40 -12.877 -12.299 -4.139 248 HB3 ASP 40 HB1 ASP 40 -11.589 -11.299 -4.808 249 H ASP 41 HN ASP 41 -11.306 -9.342 -1.084 250 HA ASP 41 HA ASP 41 -12.252 -7.241 -2.922 251 HB2 ASP 41 HB2 ASP 41 -12.942 -7.510 0.015 252 HB3 ASP 41 HB1 ASP 41 -13.223 -6.053 -0.927 253 H VAL 42 HN VAL 42 -10.248 -6.476 -3.411 254 HA VAL 42 HA VAL 42 -8.575 -5.620 -1.140 255 HB VAL 42 HB VAL 42 -7.590 -6.574 -3.836 256 HG11 VAL 42 HG11 VAL 42 -5.356 -6.482 -2.802 257 HG12 VAL 42 HG12 VAL 42 -6.066 -5.761 -1.360 258 HG13 VAL 42 HG13 VAL 42 -6.117 -4.895 -2.895 259 HG21 VAL 42 HG21 VAL 42 -7.487 -7.936 -1.147 260 HG22 VAL 42 HG22 VAL 42 -6.715 -8.519 -2.623 261 HG23 VAL 42 HG23 VAL 42 -8.474 -8.418 -2.525 262 H GLU 43 HN GLU 43 -8.368 -3.492 -1.018 263 HA GLU 43 HA GLU 43 -8.531 -1.924 -3.504 264 HB2 GLU 43 HB2 GLU 43 -10.523 -1.556 -2.142 265 HB3 GLU 43 HB1 GLU 43 -9.525 -1.164 -0.747 266 HG2 GLU 43 HG2 GLU 43 -8.609 0.760 -2.065 267 HG3 GLU 43 HG1 GLU 43 -9.830 0.419 -3.291 268 H TRP 44 HN TRP 44 -6.290 -1.799 -3.809 269 HA TRP 44 HA TRP 44 -5.055 0.125 -1.967 270 HD1 TRP 44 HD1 TRP 44 -3.270 1.362 -1.871 271 HE1 TRP 44 HE1 TRP 44 -0.892 1.876 -1.042 272 HE3 TRP 44 HE3 TRP 44 -1.244 -3.258 -2.307 273 HZ2 TRP 44 HZ2 TRP 44 1.545 0.479 -0.697 274 HZ3 TRP 44 HZ3 TRP 44 1.124 -3.584 -1.756 275 HH2 TRP 44 HH2 TRP 44 2.492 -1.717 -0.924 276 HB2 TRP 44 HB2 TRP 44 -3.945 -2.181 -1.922 277 HB3 TRP 44 HB1 TRP 44 -3.431 -1.838 -3.579 278 H VAL 45 HN VAL 45 -4.195 1.876 -2.850 279 HA VAL 45 HA VAL 45 -4.871 2.515 -5.559 280 HB VAL 45 HB VAL 45 -3.216 4.185 -3.676 281 HG11 VAL 45 HG11 VAL 45 -4.310 6.065 -4.880 282 HG12 VAL 45 HG12 VAL 45 -5.060 4.887 -5.957 283 HG13 VAL 45 HG13 VAL 45 -3.305 5.053 -5.918 284 HG21 VAL 45 HG21 VAL 45 -5.196 3.457 -2.459 285 HG22 VAL 45 HG22 VAL 45 -6.228 3.998 -3.782 286 HG23 VAL 45 HG23 VAL 45 -5.302 5.175 -2.847 287 H VAL 46 HN VAL 46 -2.266 0.873 -4.248 288 HA VAL 46 HA VAL 46 -0.303 2.096 -6.017 289 HB VAL 46 HB VAL 46 0.013 -0.155 -3.961 290 HG11 VAL 46 HG11 VAL 46 2.020 1.130 -5.813 291 HG12 VAL 46 HG12 VAL 46 1.689 -0.590 -5.586 292 HG13 VAL 46 HG13 VAL 46 2.476 0.344 -4.301 293 HG21 VAL 46 HG21 VAL 46 -0.313 1.989 -2.956 294 HG22 VAL 46 HG22 VAL 46 0.876 2.730 -4.034 295 HG23 VAL 46 HG23 VAL 46 1.391 1.548 -2.830 296 H GLY 47 HN GLY 47 -2.443 -0.596 -6.088 297 HA2 GLY 47 HA2 GLY 47 -0.983 -2.177 -7.938 298 HA3 GLY 47 HA1 GLY 47 -2.736 -2.231 -7.692 299 H LYS 48 HN LYS 48 -2.431 0.841 -8.277 300 HA LYS 48 HA LYS 48 -2.625 0.541 -11.185 301 HB2 LYS 48 HB2 LYS 48 -3.842 2.746 -11.009 302 HB3 LYS 48 HB1 LYS 48 -4.674 1.345 -10.362 303 HG2 LYS 48 HG2 LYS 48 -4.035 2.029 -8.109 304 HG3 LYS 48 HG1 LYS 48 -3.181 3.420 -8.776 305 HD2 LYS 48 HD2 LYS 48 -6.130 2.889 -9.127 306 HD3 LYS 48 HD1 LYS 48 -5.446 3.972 -7.915 307 HE2 LYS 48 HE2 LYS 48 -4.525 5.389 -9.634 308 HE3 LYS 48 HE1 LYS 48 -5.034 4.259 -10.884 309 HZ1 LYS 48 HZ1 LYS 48 -6.885 5.741 -9.099 310 HZ2 LYS 48 HZ2 LYS 48 -7.324 4.717 -10.371 311 HZ3 LYS 48 HZ3 LYS 48 -6.523 6.175 -10.698 312 H ASP 49 HN ASP 49 -0.913 2.193 -8.654 313 HA ASP 49 HA ASP 49 0.258 4.054 -10.611 314 HB2 ASP 49 HB2 ASP 49 -1.012 4.901 -8.531 315 HB3 ASP 49 HB1 ASP 49 0.391 4.365 -7.617 316 H LYS 50 HN LYS 50 0.877 1.201 -9.463 317 HA LYS 50 HA LYS 50 3.367 1.242 -8.235 318 HB2 LYS 50 HB2 LYS 50 1.780 -0.702 -8.350 319 HB3 LYS 50 HB1 LYS 50 2.320 -0.952 -10.007 320 HG2 LYS 50 HG2 LYS 50 4.629 -1.189 -9.178 321 HG3 LYS 50 HG1 LYS 50 4.011 -1.069 -7.526 322 HD2 LYS 50 HD2 LYS 50 2.663 -3.057 -7.870 323 HD3 LYS 50 HD1 LYS 50 3.222 -3.163 -9.544 324 HE2 LYS 50 HE2 LYS 50 5.502 -3.458 -8.788 325 HE3 LYS 50 HE1 LYS 50 4.989 -3.277 -7.113 326 HZ1 LYS 50 HZ1 LYS 50 5.334 -5.605 -7.949 327 HZ2 LYS 50 HZ2 LYS 50 3.921 -5.406 -8.861 328 HZ3 LYS 50 HZ3 LYS 50 3.855 -5.303 -7.167 329 HA PRO 51 HA PRO 51 4.997 0.502 -12.930 330 HB2 PRO 51 HB2 PRO 51 3.833 2.721 -14.280 331 HB3 PRO 51 HB1 PRO 51 3.618 1.000 -14.642 332 HG2 PRO 51 HG2 PRO 51 1.887 2.844 -13.096 333 HG3 PRO 51 HG1 PRO 51 1.451 1.405 -14.037 334 HD2 PRO 51 HD2 PRO 51 1.439 1.388 -11.360 335 HD3 PRO 51 HD1 PRO 51 1.955 -0.037 -12.288 336 H THR 52 HN THR 52 4.107 3.490 -11.286 337 HA THR 52 HA THR 52 6.395 4.963 -12.196 338 HB THR 52 HB THR 52 4.475 5.481 -9.908 339 HG1 THR 52 HG1 THR 52 4.320 5.826 -12.602 340 HG21 THR 52 HG21 THR 52 5.305 7.777 -9.953 341 HG22 THR 52 HG22 THR 52 6.498 7.324 -11.173 342 HG23 THR 52 HG23 THR 52 6.591 6.640 -9.550 343 H TYR 53 HN TYR 53 5.554 3.078 -9.342 344 HA TYR 53 HA TYR 53 7.874 3.934 -7.865 345 HD1 TYR 53 HD2 TYR 53 6.272 5.261 -6.789 346 HD2 TYR 53 HD1 TYR 53 3.988 1.692 -6.529 347 HE1 TYR 53 HE2 TYR 53 4.282 6.581 -6.190 348 HE2 TYR 53 HE1 TYR 53 1.996 2.996 -5.942 349 HH TYR 53 HH TYR 53 1.667 6.152 -6.468 350 HB2 TYR 53 HB2 TYR 53 6.115 1.567 -7.321 351 HB3 TYR 53 HB1 TYR 53 7.092 2.456 -6.172 352 H ASP 54 HN ASP 54 6.930 1.276 -9.912 353 HA ASP 54 HA ASP 54 9.236 -0.330 -9.143 354 HB2 ASP 54 HB2 ASP 54 8.149 -2.047 -10.104 355 HB3 ASP 54 HB1 ASP 54 6.756 -0.986 -10.030 356 H GLU 55 HN GLU 55 8.312 1.894 -11.728 357 HA GLU 55 HA GLU 55 10.515 1.310 -13.418 358 HB2 GLU 55 HB2 GLU 55 10.098 3.393 -14.538 359 HB3 GLU 55 HB1 GLU 55 8.546 2.672 -14.155 360 HG2 GLU 55 HG2 GLU 55 8.240 4.190 -12.311 361 HG3 GLU 55 HG1 GLU 55 9.858 4.864 -12.563 362 H ILE 56 HN ILE 56 10.095 3.598 -10.723 363 HA ILE 56 HA ILE 56 12.766 4.568 -10.880 364 HB ILE 56 HB ILE 56 11.014 4.471 -8.414 365 HG12 ILE 56 HG12 ILE 56 11.297 6.720 -10.416 366 HG13 ILE 56 HG11 ILE 56 9.959 5.575 -10.424 367 HG21 ILE 56 HG21 ILE 56 12.369 6.383 -7.683 368 HG22 ILE 56 HG22 ILE 56 13.345 6.248 -9.144 369 HG23 ILE 56 HG23 ILE 56 13.365 4.952 -7.946 370 HD11 ILE 56 HD11 ILE 56 10.648 7.442 -8.164 371 HD12 ILE 56 HD12 ILE 56 9.276 6.333 -8.226 372 HD13 ILE 56 HD13 ILE 56 9.370 7.687 -9.355 373 H PHE 57 HN PHE 57 11.220 1.862 -9.309 374 HA PHE 57 HA PHE 57 13.233 0.903 -7.673 375 HD1 PHE 57 HD2 PHE 57 12.695 -1.073 -5.959 376 HD2 PHE 57 HD1 PHE 57 11.757 -2.733 -9.757 377 HE1 PHE 57 HE2 PHE 57 13.446 -3.284 -5.182 378 HE2 PHE 57 HE1 PHE 57 12.489 -4.946 -8.985 379 HZ PHE 57 HZ PHE 57 13.339 -5.223 -6.684 380 HB2 PHE 57 HB2 PHE 57 11.010 -0.030 -7.659 381 HB3 PHE 57 HB1 PHE 57 11.171 -0.567 -9.322 382 H TYR 58 HN TYR 58 12.649 0.028 -11.095 383 HA TYR 58 HA TYR 58 15.115 -1.413 -11.300 384 HD1 TYR 58 HD2 TYR 58 14.931 -3.629 -13.327 385 HD2 TYR 58 HD1 TYR 58 11.307 -1.654 -12.298 386 HE1 TYR 58 HE2 TYR 58 13.834 -5.807 -13.039 387 HE2 TYR 58 HE1 TYR 58 10.197 -3.832 -12.004 388 HH TYR 58 HH TYR 58 10.450 -6.140 -12.784 389 HB2 TYR 58 HB2 TYR 58 13.136 -0.441 -13.352 390 HB3 TYR 58 HB1 TYR 58 14.627 -1.267 -13.802 391 H THR 59 HN THR 59 14.207 1.883 -11.661 392 HA THR 59 HA THR 59 16.336 2.772 -13.294 393 HB THR 59 HB THR 59 14.581 4.197 -11.289 394 HG1 THR 59 HG1 THR 59 13.554 3.489 -13.197 395 HG21 THR 59 HG21 THR 59 16.722 5.402 -11.497 396 HG22 THR 59 HG22 THR 59 15.365 6.304 -12.168 397 HG23 THR 59 HG23 THR 59 16.487 5.473 -13.244 398 H LEU 60 HN LEU 60 15.999 2.262 -9.834 399 HA LEU 60 HA LEU 60 18.581 3.422 -9.248 400 HG LEU 60 HG LEU 60 15.861 4.279 -8.087 401 HB2 LEU 60 HB2 LEU 60 16.527 2.010 -7.562 402 HB3 LEU 60 HB1 LEU 60 18.066 2.578 -6.921 403 HD11 LEU 60 HD11 LEU 60 15.441 3.415 -5.841 404 HD12 LEU 60 HD12 LEU 60 15.715 5.155 -5.824 405 HD13 LEU 60 HD13 LEU 60 16.992 4.055 -5.303 406 HD21 LEU 60 HD21 LEU 60 18.552 5.092 -6.988 407 HD22 LEU 60 HD22 LEU 60 17.257 6.189 -7.476 408 HD23 LEU 60 HD23 LEU 60 18.060 5.177 -8.677 409 H SER 61 HN SER 61 17.588 0.554 -10.506 410 HA SER 61 HA SER 61 18.563 -1.437 -10.914 411 HG SER 61 HG SER 61 20.488 -2.551 -11.209 412 HB2 SER 61 HB2 SER 61 20.627 -0.078 -11.283 413 HB3 SER 61 HB1 SER 61 21.043 -0.314 -9.584 414 HA PRO 62 HA PRO 62 17.732 -3.098 -6.788 415 HB2 PRO 62 HB2 PRO 62 16.067 -5.061 -7.732 416 HB3 PRO 62 HB1 PRO 62 15.539 -3.443 -7.263 417 HG2 PRO 62 HG2 PRO 62 15.763 -4.629 -9.931 418 HG3 PRO 62 HG1 PRO 62 14.873 -3.188 -9.410 419 HD2 PRO 62 HD2 PRO 62 17.369 -3.312 -10.790 420 HD3 PRO 62 HD1 PRO 62 16.494 -1.876 -10.230 421 H VAL 63 HN VAL 63 18.784 -4.732 -5.817 422 HA VAL 63 HA VAL 63 20.269 -6.602 -7.496 423 HB VAL 63 HB VAL 63 21.576 -7.070 -5.406 424 HG11 VAL 63 HG11 VAL 63 22.448 -5.607 -7.117 425 HG12 VAL 63 HG12 VAL 63 22.883 -4.990 -5.522 426 HG13 VAL 63 HG13 VAL 63 21.571 -4.242 -6.430 427 HG21 VAL 63 HG21 VAL 63 20.093 -4.660 -4.358 428 HG22 VAL 63 HG22 VAL 63 21.470 -5.444 -3.578 429 HG23 VAL 63 HG23 VAL 63 19.946 -6.312 -3.758 430 H ASN 64 HN ASN 64 19.593 -8.581 -7.713 431 HA ASN 64 HA ASN 64 18.659 -10.611 -7.321 432 HB2 ASN 64 HB2 ASN 64 18.932 -9.775 -4.422 433 HB3 ASN 64 HB1 ASN 64 18.502 -11.404 -4.962 434 HD21 ASN 64 HD21 ASN 64 21.022 -9.044 -4.669 435 HD22 ASN 64 HD22 ASN 64 22.342 -10.098 -5.045 436 H GLY 65 HN GLY 65 16.997 -8.103 -7.521 437 HA2 GLY 65 HA2 GLY 65 14.687 -8.113 -7.992 438 HA3 GLY 65 HA1 GLY 65 14.488 -9.470 -6.903 439 H LYS 66 HN LYS 66 16.356 -6.977 -5.542 440 HA LYS 66 HA LYS 66 14.124 -5.356 -4.700 441 HB2 LYS 66 HB2 LYS 66 14.522 -5.595 -2.293 442 HB3 LYS 66 HB1 LYS 66 13.991 -7.112 -3.009 443 HG2 LYS 66 HG2 LYS 66 16.889 -6.507 -2.564 444 HG3 LYS 66 HG1 LYS 66 15.873 -7.205 -1.301 445 HD2 LYS 66 HD2 LYS 66 16.023 -8.379 -4.043 446 HD3 LYS 66 HD1 LYS 66 17.188 -8.814 -2.796 447 HE2 LYS 66 HE2 LYS 66 15.527 -9.754 -1.427 448 HE3 LYS 66 HE1 LYS 66 14.225 -8.968 -2.319 449 HZ1 LYS 66 HZ1 LYS 66 15.983 -11.072 -3.450 450 HZ2 LYS 66 HZ2 LYS 66 14.610 -10.405 -4.170 451 HZ3 LYS 66 HZ3 LYS 66 14.449 -11.367 -2.788 452 H ILE 67 HN ILE 67 14.795 -3.342 -3.801 453 HA ILE 67 HA ILE 67 17.500 -2.622 -4.501 454 HB ILE 67 HB ILE 67 16.884 -0.353 -3.524 455 HG12 ILE 67 HG12 ILE 67 14.236 -1.795 -3.236 456 HG13 ILE 67 HG11 ILE 67 15.156 -0.962 -1.993 457 HG21 ILE 67 HG21 ILE 67 15.127 -1.503 -5.731 458 HG22 ILE 67 HG22 ILE 67 16.752 -0.838 -5.929 459 HG23 ILE 67 HG23 ILE 67 15.422 0.213 -5.439 460 HD11 ILE 67 HD11 ILE 67 13.731 0.303 -4.323 461 HD12 ILE 67 HD12 ILE 67 14.693 1.171 -3.122 462 HD13 ILE 67 HD13 ILE 67 13.222 0.328 -2.633 463 H THR 68 HN THR 68 19.189 -2.472 -3.199 464 HA THR 68 HA THR 68 19.208 -3.166 -0.496 465 HB THR 68 HB THR 68 21.340 -1.599 -0.557 466 HG1 THR 68 HG1 THR 68 22.089 -1.310 -2.705 467 HG21 THR 68 HG21 THR 68 21.139 -4.147 -2.179 468 HG22 THR 68 HG22 THR 68 21.424 -4.036 -0.442 469 HG23 THR 68 HG23 THR 68 22.634 -3.431 -1.570 470 H GLY 69 HN GLY 69 18.686 -2.003 1.303 471 HA2 GLY 69 HA2 GLY 69 16.767 -0.065 1.070 472 HA3 GLY 69 HA1 GLY 69 17.687 -0.351 2.526 473 H ALA 70 HN ALA 70 20.218 0.436 1.234 474 HA ALA 70 HA ALA 70 20.424 3.090 1.947 475 HB1 ALA 70 HB1 ALA 70 22.050 1.665 -0.148 476 HB2 ALA 70 HB2 ALA 70 22.330 1.608 1.592 477 HB3 ALA 70 HB3 ALA 70 22.516 3.128 0.717 478 H ASN 71 HN ASN 71 19.412 1.800 -1.207 479 HA ASN 71 HA ASN 71 19.610 4.423 -2.422 480 HB2 ASN 71 HB2 ASN 71 18.930 3.404 -4.489 481 HB3 ASN 71 HB1 ASN 71 20.087 2.331 -3.724 482 HD21 ASN 71 HD21 ASN 71 19.644 0.315 -3.750 483 HD22 ASN 71 HD22 ASN 71 18.073 -0.377 -3.888 484 H ALA 72 HN ALA 72 17.138 2.342 -1.108 485 HA ALA 72 HA ALA 72 14.904 3.880 -1.972 486 HB1 ALA 72 HB1 ALA 72 15.177 2.002 0.372 487 HB2 ALA 72 HB2 ALA 72 14.657 1.566 -1.258 488 HB3 ALA 72 HB3 ALA 72 13.662 2.635 -0.272 489 H LYS 73 HN LYS 73 17.002 3.858 0.818 490 HA LYS 73 HA LYS 73 15.653 5.870 2.294 491 HB2 LYS 73 HB2 LYS 73 18.587 5.129 2.309 492 HB3 LYS 73 HB1 LYS 73 17.795 6.144 3.502 493 HG2 LYS 73 HG2 LYS 73 17.271 3.234 2.979 494 HG3 LYS 73 HG1 LYS 73 18.060 3.933 4.394 495 HD2 LYS 73 HD2 LYS 73 15.239 4.634 3.611 496 HD3 LYS 73 HD1 LYS 73 15.614 3.247 4.637 497 HE2 LYS 73 HE2 LYS 73 16.667 4.695 6.260 498 HE3 LYS 73 HE1 LYS 73 16.409 6.098 5.221 499 HZ1 LYS 73 HZ1 LYS 73 14.253 4.427 6.397 500 HZ2 LYS 73 HZ2 LYS 73 14.042 5.833 5.483 501 HZ3 LYS 73 HZ3 LYS 73 14.768 5.917 7.015 502 H LYS 74 HN LYS 74 18.128 5.889 -0.196 503 HA LYS 74 HA LYS 74 18.825 8.578 -0.242 504 HB2 LYS 74 HB2 LYS 74 19.706 6.586 -1.639 505 HB3 LYS 74 HB1 LYS 74 18.393 6.968 -2.744 506 HG2 LYS 74 HG2 LYS 74 20.388 8.015 -3.521 507 HG3 LYS 74 HG1 LYS 74 19.290 9.269 -2.929 508 HD2 LYS 74 HD2 LYS 74 21.528 9.728 -2.145 509 HD3 LYS 74 HD1 LYS 74 20.514 9.268 -0.779 510 HE2 LYS 74 HE2 LYS 74 22.605 8.135 -0.536 511 HE3 LYS 74 HE1 LYS 74 21.397 6.945 -1.002 512 HZ1 LYS 74 HZ1 LYS 74 22.208 7.206 -3.326 513 HZ2 LYS 74 HZ2 LYS 74 23.347 6.537 -2.270 514 HZ3 LYS 74 HZ3 LYS 74 23.479 8.162 -2.738 515 H GLU 75 HN GLU 75 16.214 6.883 -1.887 516 HA GLU 75 HA GLU 75 15.149 9.121 -3.201 517 HB2 GLU 75 HB2 GLU 75 13.759 6.572 -2.405 518 HB3 GLU 75 HB1 GLU 75 13.113 7.767 -3.523 519 HG2 GLU 75 HG2 GLU 75 15.305 5.800 -3.908 520 HG3 GLU 75 HG1 GLU 75 13.997 6.277 -4.987 521 H MET 76 HN MET 76 14.060 7.575 -0.181 522 HA MET 76 HA MET 76 12.012 9.498 0.231 523 HB2 MET 76 HB2 MET 76 12.033 8.589 2.616 524 HB3 MET 76 HB1 MET 76 11.665 7.457 1.323 525 HG2 MET 76 HG2 MET 76 13.906 6.578 1.406 526 HG3 MET 76 HG1 MET 76 14.353 7.763 2.625 527 HE1 MET 76 HE1 MET 76 11.004 5.529 2.365 528 HE2 MET 76 HE2 MET 76 11.578 4.129 3.269 529 HE3 MET 76 HE3 MET 76 12.358 4.578 1.751 530 H VAL 77 HN VAL 77 15.413 9.503 0.967 531 HA VAL 77 HA VAL 77 15.343 11.709 2.789 532 HB VAL 77 HB VAL 77 17.563 10.547 1.116 533 HG11 VAL 77 HG11 VAL 77 17.741 12.958 2.931 534 HG12 VAL 77 HG12 VAL 77 18.040 12.919 1.190 535 HG13 VAL 77 HG13 VAL 77 19.125 12.071 2.291 536 HG21 VAL 77 HG21 VAL 77 16.883 9.298 3.091 537 HG22 VAL 77 HG22 VAL 77 17.128 10.730 4.093 538 HG23 VAL 77 HG23 VAL 77 18.502 9.966 3.295 539 H LYS 78 HN LYS 78 15.978 11.513 -0.734 540 HA LYS 78 HA LYS 78 16.292 14.338 -1.007 541 HB2 LYS 78 HB2 LYS 78 16.499 13.989 -3.325 542 HB3 LYS 78 HB1 LYS 78 17.162 12.534 -2.597 543 HG2 LYS 78 HG2 LYS 78 14.443 12.003 -2.996 544 HG3 LYS 78 HG1 LYS 78 14.995 12.831 -4.452 545 HD2 LYS 78 HD2 LYS 78 16.382 10.456 -3.227 546 HD3 LYS 78 HD1 LYS 78 15.190 10.341 -4.524 547 HE2 LYS 78 HE2 LYS 78 16.675 11.869 -5.854 548 HE3 LYS 78 HE1 LYS 78 17.889 11.667 -4.588 549 HZ1 LYS 78 HZ1 LYS 78 18.410 10.050 -6.173 550 HZ2 LYS 78 HZ2 LYS 78 16.786 9.632 -6.425 551 HZ3 LYS 78 HZ3 LYS 78 17.554 9.180 -4.992 552 H SER 79 HN SER 79 13.617 12.394 -0.532 553 HA SER 79 HA SER 79 11.629 13.977 -1.811 554 HG SER 79 HG SER 79 9.571 12.575 -1.667 555 HB2 SER 79 HB2 SER 79 11.417 11.567 -0.988 556 HB3 SER 79 HB1 SER 79 11.198 12.254 0.624 557 H LYS 80 HN LYS 80 13.682 14.696 0.674 558 HA LYS 80 HA LYS 80 13.925 16.648 1.797 559 HB2 LYS 80 HB2 LYS 80 11.210 17.400 0.677 560 HB3 LYS 80 HB1 LYS 80 12.363 18.496 1.439 561 HG2 LYS 80 HG2 LYS 80 13.865 18.344 -0.353 562 HG3 LYS 80 HG1 LYS 80 13.086 16.895 -0.991 563 HD2 LYS 80 HD2 LYS 80 11.088 18.249 -1.524 564 HD3 LYS 80 HD1 LYS 80 11.943 19.691 -0.968 565 HE2 LYS 80 HE2 LYS 80 12.056 19.489 -3.393 566 HE3 LYS 80 HE1 LYS 80 13.659 19.329 -2.677 567 HZ1 LYS 80 HZ1 LYS 80 11.933 17.164 -3.747 568 HZ2 LYS 80 HZ2 LYS 80 13.319 16.869 -2.822 569 HZ3 LYS 80 HZ3 LYS 80 13.458 17.654 -4.316 570 H LEU 81 HN LEU 81 13.663 14.930 3.482 571 HA LEU 81 HA LEU 81 11.531 15.741 5.335 572 HG LEU 81 HG LEU 81 10.989 13.781 2.985 573 HB2 LEU 81 HB2 LEU 81 12.373 12.880 4.938 574 HB3 LEU 81 HB1 LEU 81 11.097 13.473 5.970 575 HD11 LEU 81 HD11 LEU 81 11.208 11.412 3.511 576 HD12 LEU 81 HD12 LEU 81 9.574 11.790 2.968 577 HD13 LEU 81 HD13 LEU 81 9.898 11.544 4.682 578 HD21 LEU 81 HD21 LEU 81 8.919 13.875 5.179 579 HD22 LEU 81 HD22 LEU 81 8.563 13.944 3.454 580 HD23 LEU 81 HD23 LEU 81 9.499 15.233 4.212 581 HA PRO 82 HA PRO 82 14.804 15.208 8.406 582 HB2 PRO 82 HB2 PRO 82 13.298 14.882 10.619 583 HB3 PRO 82 HB1 PRO 82 13.465 16.459 9.821 584 HG2 PRO 82 HG2 PRO 82 11.224 14.484 9.664 585 HG3 PRO 82 HG1 PRO 82 11.154 16.246 9.786 586 HD2 PRO 82 HD2 PRO 82 10.845 14.852 7.458 587 HD3 PRO 82 HD1 PRO 82 11.427 16.533 7.535 588 H ASN 83 HN ASN 83 15.422 13.582 10.086 589 HA ASN 83 HA ASN 83 15.419 11.016 8.920 590 HB2 ASN 83 HB2 ASN 83 16.285 11.919 11.667 591 HB3 ASN 83 HB1 ASN 83 16.562 10.298 11.033 592 HD21 ASN 83 HD21 ASN 83 17.037 11.222 8.325 593 HD22 ASN 83 HD22 ASN 83 18.605 11.946 8.328 594 H THR 84 HN THR 84 13.385 12.425 11.357 595 HA THR 84 HA THR 84 12.329 10.115 12.531 596 HB THR 84 HB THR 84 10.404 12.277 12.190 597 HG1 THR 84 HG1 THR 84 11.936 13.629 13.603 598 HG21 THR 84 HG21 THR 84 10.452 12.223 14.640 599 HG22 THR 84 HG22 THR 84 11.855 11.158 14.595 600 HG23 THR 84 HG23 THR 84 10.303 10.594 13.975 601 H VAL 85 HN VAL 85 11.035 12.095 9.859 602 HA VAL 85 HA VAL 85 8.892 10.389 9.187 603 HB VAL 85 HB VAL 85 10.367 12.232 7.297 604 HG11 VAL 85 HG11 VAL 85 7.538 11.195 7.327 605 HG12 VAL 85 HG12 VAL 85 8.814 10.744 6.194 606 HG13 VAL 85 HG13 VAL 85 8.176 12.389 6.196 607 HG21 VAL 85 HG21 VAL 85 8.770 13.957 7.975 608 HG22 VAL 85 HG22 VAL 85 9.766 13.436 9.333 609 HG23 VAL 85 HG23 VAL 85 8.105 12.868 9.190 610 H LEU 86 HN LEU 86 12.205 10.635 7.975 611 HA LEU 86 HA LEU 86 12.301 8.681 6.058 612 HG LEU 86 HG LEU 86 15.647 10.141 6.168 613 HB2 LEU 86 HB2 LEU 86 14.179 9.823 8.007 614 HB3 LEU 86 HB1 LEU 86 14.624 8.226 7.406 615 HD11 LEU 86 HD11 LEU 86 13.843 8.351 4.566 616 HD12 LEU 86 HD12 LEU 86 15.428 7.915 5.206 617 HD13 LEU 86 HD13 LEU 86 15.290 9.175 3.979 618 HD21 LEU 86 HD21 LEU 86 12.827 10.577 5.207 619 HD22 LEU 86 HD22 LEU 86 14.270 11.367 4.568 620 HD23 LEU 86 HD23 LEU 86 13.754 11.675 6.226 621 H GLY 87 HN GLY 87 12.640 8.251 9.570 622 HA2 GLY 87 HA2 GLY 87 13.125 5.467 9.421 623 HA3 GLY 87 HA1 GLY 87 12.675 6.355 10.867 624 H LYS 88 HN LYS 88 10.129 7.294 10.074 625 HA LYS 88 HA LYS 88 8.729 4.848 10.592 626 HB2 LYS 88 HB2 LYS 88 6.761 6.152 10.949 627 HB3 LYS 88 HB1 LYS 88 8.108 7.001 11.681 628 HG2 LYS 88 HG2 LYS 88 8.149 8.626 9.982 629 HG3 LYS 88 HG1 LYS 88 7.080 7.673 8.946 630 HD2 LYS 88 HD2 LYS 88 5.259 7.957 10.563 631 HD3 LYS 88 HD1 LYS 88 6.330 8.891 11.608 632 HE2 LYS 88 HE2 LYS 88 6.539 10.600 9.895 633 HE3 LYS 88 HE1 LYS 88 5.523 9.658 8.808 634 HZ1 LYS 88 HZ1 LYS 88 4.531 10.464 11.462 635 HZ2 LYS 88 HZ2 LYS 88 3.639 10.066 10.083 636 HZ3 LYS 88 HZ3 LYS 88 4.467 11.543 10.172 637 H ILE 89 HN ILE 89 9.121 6.931 7.796 638 HA ILE 89 HA ILE 89 7.163 5.677 6.180 639 HB ILE 89 HB ILE 89 9.720 7.104 5.441 640 HG12 ILE 89 HG12 ILE 89 6.802 7.859 5.308 641 HG13 ILE 89 HG11 ILE 89 8.031 8.548 6.365 642 HG21 ILE 89 HG21 ILE 89 7.595 6.061 3.574 643 HG22 ILE 89 HG22 ILE 89 9.257 5.484 3.700 644 HG23 ILE 89 HG23 ILE 89 8.935 7.120 3.124 645 HD11 ILE 89 HD11 ILE 89 7.966 8.772 3.369 646 HD12 ILE 89 HD12 ILE 89 9.188 9.463 4.436 647 HD13 ILE 89 HD13 ILE 89 7.521 10.031 4.522 648 H TRP 90 HN TRP 90 10.618 5.125 6.660 649 HA TRP 90 HA TRP 90 11.019 2.983 4.976 650 HD1 TRP 90 HD1 TRP 90 13.112 1.148 8.488 651 HE1 TRP 90 HE1 TRP 90 14.491 -0.739 7.388 652 HE3 TRP 90 HE3 TRP 90 13.142 2.849 3.661 653 HZ2 TRP 90 HZ2 TRP 90 15.449 -1.412 4.835 654 HZ3 TRP 90 HZ3 TRP 90 14.315 1.511 1.958 655 HH2 TRP 90 HH2 TRP 90 15.439 -0.569 2.535 656 HB2 TRP 90 HB2 TRP 90 12.833 4.038 6.219 657 HB3 TRP 90 HB1 TRP 90 12.192 3.401 7.723 658 H LYS 91 HN LYS 91 10.054 2.852 8.400 659 HA LYS 91 HA LYS 91 9.912 -0.007 8.328 660 HB2 LYS 91 HB2 LYS 91 9.191 1.980 10.427 661 HB3 LYS 91 HB1 LYS 91 9.157 0.248 10.678 662 HG2 LYS 91 HG2 LYS 91 11.574 0.274 9.994 663 HG3 LYS 91 HG1 LYS 91 11.504 2.024 10.158 664 HD2 LYS 91 HD2 LYS 91 10.749 1.777 12.471 665 HD3 LYS 91 HD1 LYS 91 10.858 0.021 12.308 666 HE2 LYS 91 HE2 LYS 91 12.852 0.619 13.345 667 HE3 LYS 91 HE1 LYS 91 13.288 0.412 11.657 668 HZ1 LYS 91 HZ1 LYS 91 13.186 2.796 11.358 669 HZ2 LYS 91 HZ2 LYS 91 14.288 2.396 12.573 670 HZ3 LYS 91 HZ3 LYS 91 12.764 3.017 12.984 671 H LEU 92 HN LEU 92 7.748 2.421 7.489 672 HA LEU 92 HA LEU 92 5.397 0.827 8.099 673 HG LEU 92 HG LEU 92 3.189 2.001 7.618 674 HB2 LEU 92 HB2 LEU 92 5.789 3.538 7.778 675 HB3 LEU 92 HB1 LEU 92 5.033 3.072 6.255 676 HD11 LEU 92 HD11 LEU 92 2.941 2.819 9.945 677 HD12 LEU 92 HD12 LEU 92 4.571 3.489 9.851 678 HD13 LEU 92 HD13 LEU 92 4.327 1.745 9.726 679 HD21 LEU 92 HD21 LEU 92 2.053 4.113 8.074 680 HD22 LEU 92 HD22 LEU 92 2.908 4.178 6.534 681 HD23 LEU 92 HD23 LEU 92 3.585 4.978 7.952 682 H ALA 93 HN ALA 93 7.620 1.372 5.497 683 HA ALA 93 HA ALA 93 5.833 -0.099 3.669 684 HB1 ALA 93 HB1 ALA 93 6.688 1.999 2.806 685 HB2 ALA 93 HB2 ALA 93 7.325 0.641 1.874 686 HB3 ALA 93 HB3 ALA 93 8.345 1.453 3.064 687 H ASP 94 HN ASP 94 9.061 -0.156 5.091 688 HA ASP 94 HA ASP 94 9.683 -2.742 3.943 689 HB2 ASP 94 HB2 ASP 94 11.442 -1.002 4.338 690 HB3 ASP 94 HB1 ASP 94 11.179 -1.176 6.064 691 H VAL 95 HN VAL 95 7.842 -3.813 4.773 692 HA VAL 95 HA VAL 95 7.118 -4.082 7.472 693 HB VAL 95 HB VAL 95 6.016 -6.222 6.676 694 HG11 VAL 95 HG11 VAL 95 5.476 -3.689 5.132 695 HG12 VAL 95 HG12 VAL 95 4.851 -4.071 6.737 696 HG13 VAL 95 HG13 VAL 95 4.352 -5.029 5.341 697 HG21 VAL 95 HG21 VAL 95 7.075 -5.277 4.018 698 HG22 VAL 95 HG22 VAL 95 5.933 -6.594 4.275 699 HG23 VAL 95 HG23 VAL 95 7.588 -6.733 4.870 700 H ASP 96 HN ASP 96 9.458 -5.664 5.520 701 HA ASP 96 HA ASP 96 9.895 -7.929 7.225 702 HB2 ASP 96 HB2 ASP 96 11.851 -8.230 5.577 703 HB3 ASP 96 HB1 ASP 96 10.214 -8.315 4.948 704 H LYS 97 HN LYS 97 11.201 -4.778 6.833 705 HA LYS 97 HA LYS 97 12.823 -3.615 7.844 706 HB2 LYS 97 HB2 LYS 97 11.921 -5.334 10.145 707 HB3 LYS 97 HB1 LYS 97 12.956 -3.916 10.315 708 HG2 LYS 97 HG2 LYS 97 11.233 -2.511 9.371 709 HG3 LYS 97 HG1 LYS 97 10.205 -3.921 9.113 710 HD2 LYS 97 HD2 LYS 97 11.197 -3.011 11.819 711 HD3 LYS 97 HD1 LYS 97 9.634 -2.562 11.135 712 HE2 LYS 97 HE2 LYS 97 10.542 -5.395 11.607 713 HE3 LYS 97 HE1 LYS 97 9.547 -4.471 12.731 714 HZ1 LYS 97 HZ1 LYS 97 8.143 -5.846 11.400 715 HZ2 LYS 97 HZ2 LYS 97 8.824 -5.268 9.960 716 HZ3 LYS 97 HZ3 LYS 97 7.890 -4.235 10.929 717 H ASP 98 HN ASP 98 14.032 -5.373 6.328 718 HA ASP 98 HA ASP 98 16.214 -6.462 7.976 719 HB2 ASP 98 HB2 ASP 98 16.742 -7.917 6.055 720 HB3 ASP 98 HB1 ASP 98 15.103 -8.174 6.642 721 H GLY 99 HN GLY 99 15.359 -3.955 5.913 722 HA2 GLY 99 HA2 GLY 99 16.906 -2.136 5.572 723 HA3 GLY 99 HA1 GLY 99 18.214 -3.304 5.568 724 H LEU 100 HN LEU 100 15.401 -4.128 3.735 725 HA LEU 100 HA LEU 100 16.298 -2.738 1.361 726 HG LEU 100 HG LEU 100 16.164 -6.160 2.642 727 HB2 LEU 100 HB2 LEU 100 16.423 -4.808 -0.003 728 HB3 LEU 100 HB1 LEU 100 17.708 -4.634 1.173 729 HD11 LEU 100 HD11 LEU 100 15.274 -6.862 -0.148 730 HD12 LEU 100 HD12 LEU 100 14.268 -6.183 1.130 731 HD13 LEU 100 HD13 LEU 100 14.939 -7.803 1.308 732 HD21 LEU 100 HD21 LEU 100 17.380 -8.082 1.812 733 HD22 LEU 100 HD22 LEU 100 18.421 -6.658 1.863 734 HD23 LEU 100 HD23 LEU 100 17.764 -7.217 0.323 735 H LEU 101 HN LEU 101 14.796 -3.543 -0.605 736 HA LEU 101 HA LEU 101 12.061 -3.622 0.367 737 HG LEU 101 HG LEU 101 13.191 -1.031 1.516 738 HB2 LEU 101 HB2 LEU 101 13.282 -1.177 -0.941 739 HB3 LEU 101 HB1 LEU 101 11.566 -1.500 -0.988 740 HD11 LEU 101 HD11 LEU 101 11.143 0.705 0.139 741 HD12 LEU 101 HD12 LEU 101 12.885 0.975 0.149 742 HD13 LEU 101 HD13 LEU 101 11.976 1.063 1.656 743 HD21 LEU 101 HD21 LEU 101 10.242 -1.473 1.098 744 HD22 LEU 101 HD22 LEU 101 10.986 -0.932 2.600 745 HD23 LEU 101 HD23 LEU 101 11.363 -2.529 1.957 746 H ASP 102 HN ASP 102 11.121 -4.937 -1.087 747 HA ASP 102 HA ASP 102 12.398 -5.370 -3.625 748 HB2 ASP 102 HB2 ASP 102 11.046 -7.238 -3.864 749 HB3 ASP 102 HB1 ASP 102 11.405 -7.179 -2.149 750 H ASP 103 HN ASP 103 10.353 -5.886 -5.347 751 HA ASP 103 HA ASP 103 10.024 -3.402 -6.606 752 HB2 ASP 103 HB2 ASP 103 10.013 -5.590 -7.708 753 HB3 ASP 103 HB1 ASP 103 8.503 -6.013 -6.887 754 H GLU 104 HN GLU 104 7.784 -5.185 -4.474 755 HA GLU 104 HA GLU 104 5.742 -3.107 -4.852 756 HB2 GLU 104 HB2 GLU 104 5.306 -5.658 -4.608 757 HB3 GLU 104 HB1 GLU 104 5.501 -5.350 -2.886 758 HG2 GLU 104 HG2 GLU 104 3.234 -5.118 -3.136 759 HG3 GLU 104 HG1 GLU 104 3.780 -3.443 -3.321 760 H GLU 105 HN GLU 105 8.242 -3.991 -2.680 761 HA GLU 105 HA GLU 105 7.247 -2.526 -0.438 762 HB2 GLU 105 HB2 GLU 105 9.535 -4.158 -1.057 763 HB3 GLU 105 HB1 GLU 105 10.038 -2.693 -0.230 764 HG2 GLU 105 HG2 GLU 105 8.675 -3.181 1.646 765 HG3 GLU 105 HG1 GLU 105 7.846 -4.477 0.783 766 H PHE 106 HN PHE 106 9.267 -1.811 -3.220 767 HA PHE 106 HA PHE 106 9.752 0.920 -2.452 768 HD1 PHE 106 HD2 PHE 106 9.392 2.742 -4.063 769 HD2 PHE 106 HD1 PHE 106 12.663 0.616 -5.735 770 HE1 PHE 106 HE2 PHE 106 10.396 4.865 -4.796 771 HE2 PHE 106 HE1 PHE 106 13.670 2.723 -6.464 772 HZ PHE 106 HZ PHE 106 12.548 4.854 -5.991 773 HB2 PHE 106 HB2 PHE 106 11.155 -0.441 -4.108 774 HB3 PHE 106 HB1 PHE 106 9.847 -0.231 -5.256 775 H ALA 107 HN ALA 107 7.377 -0.906 -4.305 776 HA ALA 107 HA ALA 107 5.875 1.149 -5.393 777 HB1 ALA 107 HB1 ALA 107 5.456 -1.230 -5.805 778 HB2 ALA 107 HB2 ALA 107 3.987 -0.375 -5.341 779 HB3 ALA 107 HB3 ALA 107 4.820 -1.399 -4.169 780 H LEU 108 HN LEU 108 5.612 -0.296 -2.169 781 HA LEU 108 HA LEU 108 3.705 1.641 -1.300 782 HG LEU 108 HG LEU 108 4.650 1.319 1.844 783 HB2 LEU 108 HB2 LEU 108 3.706 -0.562 -0.325 784 HB3 LEU 108 HB1 LEU 108 5.357 -0.349 0.240 785 HD11 LEU 108 HD11 LEU 108 2.511 2.188 2.040 786 HD12 LEU 108 HD12 LEU 108 1.785 0.879 1.118 787 HD13 LEU 108 HD13 LEU 108 2.728 2.122 0.291 788 HD21 LEU 108 HD21 LEU 108 2.829 -1.062 1.867 789 HD22 LEU 108 HD22 LEU 108 3.263 -0.065 3.257 790 HD23 LEU 108 HD23 LEU 108 4.494 -1.034 2.446 791 H ALA 109 HN ALA 109 7.215 1.254 -0.893 792 HA ALA 109 HA ALA 109 7.758 3.248 0.930 793 HB1 ALA 109 HB1 ALA 109 9.948 3.453 -0.088 794 HB2 ALA 109 HB2 ALA 109 9.369 2.643 -1.542 795 HB3 ALA 109 HB3 ALA 109 9.459 1.759 -0.020 796 H ASN 110 HN ASN 110 7.622 3.647 -2.605 797 HA ASN 110 HA ASN 110 7.919 6.483 -2.466 798 HB2 ASN 110 HB2 ASN 110 8.597 4.928 -4.411 799 HB3 ASN 110 HB1 ASN 110 6.899 4.984 -4.872 800 HD21 ASN 110 HD21 ASN 110 6.023 6.929 -5.630 801 HD22 ASN 110 HD22 ASN 110 7.024 8.237 -6.151 802 H HIS 111 HN HIS 111 5.244 4.255 -2.413 803 HA HIS 111 HA HIS 111 3.259 6.153 -3.202 804 HD1 HIS 111 HD1 HIS 111 0.864 5.334 -4.280 805 HD2 HIS 111 HD2 HIS 111 0.499 4.254 -0.279 806 HE1 HIS 111 HE1 HIS 111 -1.516 5.853 -3.651 807 HE2 HIS 111 HE2 HIS 111 -1.636 5.422 -1.163 808 HB2 HIS 111 HB2 HIS 111 2.794 3.707 -3.265 809 HB3 HIS 111 HB1 HIS 111 2.857 3.670 -1.508 810 H LEU 112 HN LEU 112 4.555 5.063 -0.128 811 HA LEU 112 HA LEU 112 2.851 6.620 1.506 812 HG LEU 112 HG LEU 112 3.813 3.675 1.740 813 HB2 LEU 112 HB2 LEU 112 5.575 5.406 1.995 814 HB3 LEU 112 HB1 LEU 112 4.624 6.201 3.243 815 HD11 LEU 112 HD11 LEU 112 4.663 4.104 4.611 816 HD12 LEU 112 HD12 LEU 112 5.627 3.327 3.353 817 HD13 LEU 112 HD13 LEU 112 4.121 2.585 3.895 818 HD21 LEU 112 HD21 LEU 112 1.956 3.623 3.339 819 HD22 LEU 112 HD22 LEU 112 1.894 5.065 2.324 820 HD23 LEU 112 HD23 LEU 112 2.465 5.183 3.986 821 H ILE 113 HN ILE 113 5.927 7.183 -0.073 822 HA ILE 113 HA ILE 113 6.531 9.732 0.936 823 HB ILE 113 HB ILE 113 7.055 8.406 -1.717 824 HG12 ILE 113 HG12 ILE 113 8.871 9.182 0.577 825 HG13 ILE 113 HG11 ILE 113 8.186 7.581 0.323 826 HG21 ILE 113 HG21 ILE 113 8.625 10.234 -2.229 827 HG22 ILE 113 HG22 ILE 113 8.012 11.121 -0.832 828 HG23 ILE 113 HG23 ILE 113 6.944 10.775 -2.193 829 HD11 ILE 113 HD11 ILE 113 10.495 7.674 -0.412 830 HD12 ILE 113 HD12 ILE 113 10.107 9.003 -1.504 831 HD13 ILE 113 HD13 ILE 113 9.420 7.403 -1.785 832 H LYS 114 HN LYS 114 4.506 8.775 -1.864 833 HA LYS 114 HA LYS 114 3.744 11.424 -2.486 834 HB2 LYS 114 HB2 LYS 114 3.235 10.074 -4.259 835 HB3 LYS 114 HB1 LYS 114 2.776 8.719 -3.235 836 HG2 LYS 114 HG2 LYS 114 0.639 9.405 -3.030 837 HG3 LYS 114 HG1 LYS 114 1.032 11.115 -3.192 838 HD2 LYS 114 HD2 LYS 114 -0.202 10.452 -5.127 839 HD3 LYS 114 HD1 LYS 114 1.471 10.699 -5.620 840 HE2 LYS 114 HE2 LYS 114 1.855 8.292 -5.554 841 HE3 LYS 114 HE1 LYS 114 0.201 8.038 -4.999 842 HZ1 LYS 114 HZ1 LYS 114 -0.660 8.806 -7.047 843 HZ2 LYS 114 HZ2 LYS 114 0.574 7.699 -7.434 844 HZ3 LYS 114 HZ3 LYS 114 0.854 9.364 -7.564 845 H VAL 115 HN VAL 115 2.367 8.996 -0.332 846 HA VAL 115 HA VAL 115 -0.028 10.259 0.327 847 HB VAL 115 HB VAL 115 1.745 8.455 1.972 848 HG11 VAL 115 HG11 VAL 115 -1.049 9.401 2.597 849 HG12 VAL 115 HG12 VAL 115 0.415 9.780 3.507 850 HG13 VAL 115 HG13 VAL 115 -0.188 8.125 3.453 851 HG21 VAL 115 HG21 VAL 115 0.003 6.789 1.458 852 HG22 VAL 115 HG22 VAL 115 0.800 7.412 0.013 853 HG23 VAL 115 HG23 VAL 115 -0.810 7.984 0.449 854 H LYS 116 HN LYS 116 3.182 10.597 1.859 855 HA LYS 116 HA LYS 116 2.330 12.478 3.808 856 HB2 LYS 116 HB2 LYS 116 4.612 12.742 4.331 857 HB3 LYS 116 HB1 LYS 116 4.501 11.088 3.739 858 HG2 LYS 116 HG2 LYS 116 5.096 12.122 1.454 859 HG3 LYS 116 HG1 LYS 116 5.653 13.493 2.407 860 HD2 LYS 116 HD2 LYS 116 7.197 12.056 3.612 861 HD3 LYS 116 HD1 LYS 116 6.582 10.653 2.735 862 HE2 LYS 116 HE2 LYS 116 8.687 11.480 1.779 863 HE3 LYS 116 HE1 LYS 116 7.349 11.566 0.641 864 HZ1 LYS 116 HZ1 LYS 116 8.554 13.569 0.454 865 HZ2 LYS 116 HZ2 LYS 116 8.588 13.806 2.127 866 HZ3 LYS 116 HZ3 LYS 116 7.128 13.961 1.290 867 H LEU 117 HN LEU 117 3.233 12.716 0.462 868 HA LEU 117 HA LEU 117 3.676 15.567 0.504 869 HG LEU 117 HG LEU 117 3.171 16.079 -2.501 870 HB2 LEU 117 HB2 LEU 117 4.864 14.039 -1.044 871 HB3 LEU 117 HB1 LEU 117 3.330 13.692 -1.843 872 HD11 LEU 117 HD11 LEU 117 4.502 17.059 -0.722 873 HD12 LEU 117 HD12 LEU 117 5.152 17.500 -2.301 874 HD13 LEU 117 HD13 LEU 117 5.944 16.252 -1.338 875 HD21 LEU 117 HD21 LEU 117 5.703 14.676 -3.338 876 HD22 LEU 117 HD22 LEU 117 4.908 15.984 -4.219 877 HD23 LEU 117 HD23 LEU 117 4.099 14.428 -4.029 878 H GLU 118 HN GLU 118 0.964 13.493 0.234 879 HA GLU 118 HA GLU 118 -0.695 15.288 -1.263 880 HB2 GLU 118 HB2 GLU 118 -1.425 12.905 0.459 881 HB3 GLU 118 HB1 GLU 118 -2.556 13.796 -0.555 882 HG2 GLU 118 HG2 GLU 118 -1.121 13.251 -2.524 883 HG3 GLU 118 HG1 GLU 118 -0.163 12.207 -1.460 884 H GLY 119 HN GLY 119 0.571 15.542 1.760 885 HA2 GLY 119 HA2 GLY 119 0.178 17.725 2.745 886 HA3 GLY 119 HA1 GLY 119 -1.527 17.518 2.381 887 H HIS 120 HN HIS 120 -0.348 14.600 3.473 888 HA HIS 120 HA HIS 120 -0.702 15.308 6.274 889 HD1 HIS 120 HD1 HIS 120 -2.441 11.638 7.242 890 HD2 HIS 120 HD2 HIS 120 -2.326 12.298 3.127 891 HE1 HIS 120 HE1 HIS 120 -2.683 9.373 6.185 892 HE2 HIS 120 HE2 HIS 120 -2.884 9.833 3.715 893 HB2 HIS 120 HB2 HIS 120 -2.553 14.035 6.684 894 HB3 HIS 120 HB1 HIS 120 -2.897 14.480 5.021 895 H GLU 121 HN GLU 121 0.546 14.204 7.614 896 HA GLU 121 HA GLU 121 2.638 12.590 6.560 897 HB2 GLU 121 HB2 GLU 121 3.381 12.413 8.885 898 HB3 GLU 121 HB1 GLU 121 2.977 14.075 8.482 899 HG2 GLU 121 HG2 GLU 121 0.916 13.940 9.670 900 HG3 GLU 121 HG1 GLU 121 1.108 12.204 9.911 901 H LEU 122 HN LEU 122 3.197 10.426 7.417 902 HA LEU 122 HA LEU 122 1.033 8.609 7.152 903 HG LEU 122 HG LEU 122 4.255 9.015 6.223 904 HB2 LEU 122 HB2 LEU 122 3.720 7.959 8.331 905 HB3 LEU 122 HB1 LEU 122 2.600 6.865 7.542 906 HD11 LEU 122 HD11 LEU 122 4.235 6.008 5.992 907 HD12 LEU 122 HD12 LEU 122 5.481 6.987 6.765 908 HD13 LEU 122 HD13 LEU 122 5.220 7.102 5.024 909 HD21 LEU 122 HD21 LEU 122 2.027 8.914 5.232 910 HD22 LEU 122 HD22 LEU 122 2.209 7.172 5.008 911 HD23 LEU 122 HD23 LEU 122 3.261 8.289 4.138 912 HA PRO 123 HA PRO 123 -0.099 8.693 11.418 913 HB2 PRO 123 HB2 PRO 123 -2.304 7.200 11.226 914 HB3 PRO 123 HB1 PRO 123 -2.192 8.781 10.450 915 HG2 PRO 123 HG2 PRO 123 -2.104 6.082 9.243 916 HG3 PRO 123 HG1 PRO 123 -2.641 7.615 8.537 917 HD2 PRO 123 HD2 PRO 123 -0.102 6.325 8.223 918 HD3 PRO 123 HD1 PRO 123 -0.610 7.896 7.566 919 H ALA 124 HN ALA 124 1.635 6.319 10.215 920 HA ALA 124 HA ALA 124 2.599 4.414 10.984 921 HB1 ALA 124 HB1 ALA 124 2.926 5.743 13.031 922 HB2 ALA 124 HB2 ALA 124 2.705 4.026 13.370 923 HB3 ALA 124 HB3 ALA 124 1.376 5.156 13.638 924 H ASP 125 HN ASP 125 -0.297 4.552 10.117 925 HA ASP 125 HA ASP 125 -1.298 2.076 11.323 926 HB2 ASP 125 HB2 ASP 125 -2.836 4.017 11.351 927 HB3 ASP 125 HB1 ASP 125 -2.740 4.105 9.597 928 H LEU 126 HN LEU 126 -0.675 0.337 10.238 929 HA LEU 126 HA LEU 126 -0.617 0.472 7.295 930 HG LEU 126 HG LEU 126 0.413 -2.411 6.870 931 HB2 LEU 126 HB2 LEU 126 1.554 -0.052 8.370 932 HB3 LEU 126 HB1 LEU 126 0.825 -1.464 9.111 933 HD11 LEU 126 HD11 LEU 126 1.459 -1.406 4.920 934 HD12 LEU 126 HD12 LEU 126 1.957 -0.021 5.896 935 HD13 LEU 126 HD13 LEU 126 0.244 -0.336 5.621 936 HD21 LEU 126 HD21 LEU 126 2.776 -2.890 6.328 937 HD22 LEU 126 HD22 LEU 126 2.415 -3.056 8.047 938 HD23 LEU 126 HD23 LEU 126 3.262 -1.625 7.457 939 HA PRO 127 HA PRO 127 -4.054 -2.356 8.067 940 HB2 PRO 127 HB2 PRO 127 -5.381 -1.369 5.765 941 HB3 PRO 127 HB1 PRO 127 -5.690 -0.907 7.442 942 HG2 PRO 127 HG2 PRO 127 -4.672 0.750 5.456 943 HG3 PRO 127 HG1 PRO 127 -4.570 1.056 7.201 944 HD2 PRO 127 HD2 PRO 127 -2.536 -0.121 5.350 945 HD3 PRO 127 HD1 PRO 127 -2.297 1.014 6.696 946 HA PRO 128 HA PRO 128 -3.037 -5.518 5.126 947 HB2 PRO 128 HB2 PRO 128 -5.421 -6.839 4.922 948 HB3 PRO 128 HB1 PRO 128 -4.324 -6.993 6.305 949 HG2 PRO 128 HG2 PRO 128 -6.794 -5.333 6.009 950 HG3 PRO 128 HG1 PRO 128 -6.238 -6.274 7.403 951 HD2 PRO 128 HD2 PRO 128 -5.959 -3.589 7.244 952 HD3 PRO 128 HD1 PRO 128 -4.792 -4.618 8.100 953 H HIS 129 HN HIS 129 -4.152 -2.872 4.071 954 HA HIS 129 HA HIS 129 -5.304 -3.843 1.539 955 HD1 HIS 129 HD1 HIS 129 -6.169 -2.685 4.567 956 HD2 HIS 129 HD2 HIS 129 -8.074 -0.376 1.701 957 HE1 HIS 129 HE1 HIS 129 -8.308 -1.940 5.626 958 HE2 HIS 129 HE2 HIS 129 -9.441 -0.507 3.886 959 HB2 HIS 129 HB2 HIS 129 -4.783 -0.958 2.293 960 HB3 HIS 129 HB1 HIS 129 -5.764 -1.551 0.971 961 H LEU 130 HN LEU 130 -2.408 -2.738 3.044 962 HA LEU 130 HA LEU 130 -1.202 -2.153 0.421 963 HG LEU 130 HG LEU 130 -2.619 -0.401 3.019 964 HB2 LEU 130 HB2 LEU 130 -0.178 -0.660 2.752 965 HB3 LEU 130 HB1 LEU 130 -0.363 -0.148 1.089 966 HD11 LEU 130 HD11 LEU 130 -1.045 2.016 2.192 967 HD12 LEU 130 HD12 LEU 130 -1.086 1.293 3.803 968 HD13 LEU 130 HD13 LEU 130 -2.535 2.057 3.141 969 HD21 LEU 130 HD21 LEU 130 -3.895 0.925 1.487 970 HD22 LEU 130 HD22 LEU 130 -3.297 -0.528 0.692 971 HD23 LEU 130 HD23 LEU 130 -2.513 1.022 0.396 972 H VAL 131 HN VAL 131 -1.093 -4.267 2.856 973 HA VAL 131 HA VAL 131 1.719 -4.266 3.359 974 HB VAL 131 HB VAL 131 -0.017 -5.308 4.888 975 HG11 VAL 131 HG11 VAL 131 0.126 -7.548 2.893 976 HG12 VAL 131 HG12 VAL 131 -1.289 -6.549 3.245 977 HG13 VAL 131 HG13 VAL 131 -0.639 -7.626 4.480 978 HG21 VAL 131 HG21 VAL 131 2.345 -5.652 5.238 979 HG22 VAL 131 HG22 VAL 131 2.352 -6.974 4.073 980 HG23 VAL 131 HG23 VAL 131 1.463 -7.138 5.585 981 HA PRO 132 HA PRO 132 2.929 -5.516 -0.677 982 HB2 PRO 132 HB2 PRO 132 5.194 -6.726 0.784 983 HB3 PRO 132 HB1 PRO 132 5.198 -5.647 -0.613 984 HG2 PRO 132 HG2 PRO 132 5.775 -4.774 1.851 985 HG3 PRO 132 HG1 PRO 132 4.920 -3.759 0.672 986 HD2 PRO 132 HD2 PRO 132 3.897 -5.136 3.093 987 HD3 PRO 132 HD1 PRO 132 3.307 -3.659 2.290 988 HA PRO 133 HA PRO 133 1.306 -9.456 -1.607 989 HB2 PRO 133 HB2 PRO 133 3.917 -10.041 -2.962 990 HB3 PRO 133 HB1 PRO 133 2.260 -10.281 -3.546 991 HG2 PRO 133 HG2 PRO 133 3.689 -8.188 -4.360 992 HG3 PRO 133 HG1 PRO 133 1.951 -8.031 -4.009 993 HD2 PRO 133 HD2 PRO 133 4.297 -7.081 -2.450 994 HD3 PRO 133 HD1 PRO 133 2.659 -6.402 -2.562 995 H SER 134 HN SER 134 4.791 -9.961 -0.992 996 HA SER 134 HA SER 134 4.437 -12.615 -0.112 997 HG SER 134 HG SER 134 7.351 -11.960 -1.653 998 HB2 SER 134 HB2 SER 134 6.783 -10.860 0.588 999 HB3 SER 134 HB1 SER 134 6.766 -12.596 0.276 1000 H LYS 135 HN LYS 135 3.479 -9.867 1.476 1001 HA LYS 135 HA LYS 135 4.170 -10.988 4.099 1002 HB2 LYS 135 HB2 LYS 135 3.792 -8.227 4.511 1003 HB3 LYS 135 HB1 LYS 135 5.298 -9.124 4.569 1004 HG2 LYS 135 HG2 LYS 135 4.278 -8.129 1.938 1005 HG3 LYS 135 HG1 LYS 135 5.098 -7.035 3.055 1006 HD2 LYS 135 HD2 LYS 135 7.074 -8.258 2.971 1007 HD3 LYS 135 HD1 LYS 135 6.286 -9.666 2.283 1008 HE2 LYS 135 HE2 LYS 135 6.248 -8.759 0.167 1009 HE3 LYS 135 HE1 LYS 135 6.356 -7.106 0.774 1010 HZ1 LYS 135 HZ1 LYS 135 8.666 -7.493 1.361 1011 HZ2 LYS 135 HZ2 LYS 135 8.427 -7.834 -0.284 1012 HZ3 LYS 135 HZ3 LYS 135 8.566 -9.105 0.836 1013 H ARG 136 HN ARG 136 1.620 -10.828 2.233 1014 HA ARG 136 HA ARG 136 -0.257 -9.638 4.113 1015 HE ARG 136 HE ARG 136 -2.867 -11.112 -0.470 1016 HB2 ARG 136 HB2 ARG 136 -1.356 -11.336 1.965 1017 HB3 ARG 136 HB1 ARG 136 -1.818 -9.716 2.461 1018 HG2 ARG 136 HG2 ARG 136 -0.078 -8.740 1.172 1019 HG3 ARG 136 HG1 ARG 136 0.646 -10.316 0.850 1020 HD2 ARG 136 HD2 ARG 136 -1.840 -9.102 -0.293 1021 HD3 ARG 136 HD1 ARG 136 -0.484 -9.863 -1.122 1022 HH11 ARG 136 HH11 ARG 136 0.556 -11.818 -0.043 1023 HH12 ARG 136 HH12 ARG 136 0.308 -13.531 0.035 1024 HH21 ARG 136 HH21 ARG 136 -3.162 -13.366 -0.411 1025 HH22 ARG 136 HH22 ARG 136 -1.783 -14.410 -0.206 1026 H ARG 137 HN ARG 137 0.453 -11.139 5.875 1027 HA ARG 137 HA ARG 137 -1.440 -13.253 6.119 1028 HE ARG 137 HE ARG 137 1.997 -16.349 7.213 1029 HB2 ARG 137 HB2 ARG 137 0.130 -15.114 6.396 1030 HB3 ARG 137 HB1 ARG 137 0.188 -14.460 4.767 1031 HG2 ARG 137 HG2 ARG 137 2.239 -13.263 5.304 1032 HG3 ARG 137 HG1 ARG 137 2.174 -13.875 6.952 1033 HD2 ARG 137 HD2 ARG 137 2.460 -15.517 4.455 1034 HD3 ARG 137 HD1 ARG 137 3.734 -15.166 5.619 1035 HH11 ARG 137 HH11 ARG 137 3.020 -17.235 3.985 1036 HH12 ARG 137 HH12 ARG 137 2.656 -18.922 4.188 1037 HH21 ARG 137 HH21 ARG 137 1.570 -18.519 7.533 1038 HH22 ARG 137 HH22 ARG 137 1.850 -19.668 6.255 1039 H HIS 138 HN HIS 138 -1.884 -13.705 8.165 1040 HA HIS 138 HA HIS 138 0.067 -12.952 10.240 1041 HD1 HIS 138 HD1 HIS 138 -0.810 -10.951 12.563 1042 HD2 HIS 138 HD2 HIS 138 -2.957 -14.498 12.876 1043 HE1 HIS 138 HE1 HIS 138 -0.909 -11.470 15.020 1044 HE2 HIS 138 HE2 HIS 138 -2.003 -13.736 15.148 1045 HB2 HIS 138 HB2 HIS 138 -2.032 -11.669 10.391 1046 HB3 HIS 138 HB1 HIS 138 -2.949 -13.169 10.435 1047 H GLU 139 HN GLU 139 1.048 -14.679 11.086 1048 HA GLU 139 HA GLU 139 1.651 -16.825 11.437 1049 HB2 GLU 139 HB2 GLU 139 -1.273 -16.928 11.997 1050 HB3 GLU 139 HB1 GLU 139 -0.432 -18.455 11.795 1051 HG2 GLU 139 HG2 GLU 139 -0.417 -18.054 14.090 1052 HG3 GLU 139 HG1 GLU 139 1.201 -17.620 13.547 Start of MODEL 5 1 H1 GLY 1 HT1 GLY 1 5.523 -40.836 -37.239 2 H2 GLY 1 HT2 GLY 1 6.239 -39.303 -37.179 3 H3 GLY 1 HT3 GLY 1 5.320 -39.851 -35.870 4 HA2 GLY 1 HA1 GLY 1 6.926 -41.591 -35.426 5 HA3 GLY 1 HA2 GLY 1 7.881 -41.035 -36.793 6 HA PRO 2 HA PRO 2 8.528 -38.378 -32.805 7 HB2 PRO 2 HB2 PRO 2 10.100 -40.428 -31.450 8 HB3 PRO 2 HB1 PRO 2 8.717 -39.513 -30.851 9 HG2 PRO 2 HG2 PRO 2 8.600 -42.168 -31.388 10 HG3 PRO 2 HG1 PRO 2 7.205 -41.086 -31.549 11 HD2 PRO 2 HD2 PRO 2 9.021 -42.167 -33.674 12 HD3 PRO 2 HD1 PRO 2 7.255 -41.962 -33.698 13 H LEU 3 HN LEU 3 10.723 -40.873 -34.035 14 HA LEU 3 HA LEU 3 13.085 -39.343 -33.596 15 HG LEU 3 HG LEU 3 14.861 -40.619 -35.740 16 HB2 LEU 3 HB2 LEU 3 13.001 -41.825 -33.688 17 HB3 LEU 3 HB1 LEU 3 12.659 -41.722 -35.405 18 HD11 LEU 3 HD11 LEU 3 15.140 -39.663 -33.513 19 HD12 LEU 3 HD12 LEU 3 16.505 -40.704 -33.922 20 HD13 LEU 3 HD13 LEU 3 15.253 -41.282 -32.822 21 HD21 LEU 3 HD21 LEU 3 16.203 -42.634 -35.389 22 HD22 LEU 3 HD22 LEU 3 14.623 -43.018 -36.070 23 HD23 LEU 3 HD23 LEU 3 14.937 -43.297 -34.356 24 H GLY 4 HN GLY 4 14.128 -37.951 -34.917 25 HA2 GLY 4 HA2 GLY 4 14.714 -36.985 -36.983 26 HA3 GLY 4 HA1 GLY 4 13.314 -37.752 -37.716 27 H SER 5 HN SER 5 12.184 -36.521 -34.938 28 HA SER 5 HA SER 5 11.208 -34.122 -36.288 29 HG SER 5 HG SER 5 9.821 -33.118 -34.034 30 HB2 SER 5 HB2 SER 5 9.510 -35.626 -35.332 31 HB3 SER 5 HB1 SER 5 10.255 -35.459 -33.742 32 H GLU 6 HN GLU 6 11.845 -32.148 -35.734 33 HA GLU 6 HA GLU 6 13.732 -31.744 -33.608 34 HB2 GLU 6 HB2 GLU 6 12.339 -29.856 -35.511 35 HB3 GLU 6 HB1 GLU 6 13.470 -29.312 -34.280 36 HG2 GLU 6 HG2 GLU 6 14.202 -31.344 -36.363 37 HG3 GLU 6 HG1 GLU 6 14.384 -29.611 -36.612 38 H SER 7 HN SER 7 13.235 -31.385 -31.564 39 HA SER 7 HA SER 7 10.497 -31.039 -30.769 40 HG SER 7 HG SER 7 11.350 -33.090 -30.009 41 HB2 SER 7 HB2 SER 7 13.004 -30.997 -29.070 42 HB3 SER 7 HB1 SER 7 11.348 -31.193 -28.493 43 H LEU 8 HN LEU 8 9.561 -29.140 -30.977 44 HA LEU 8 HA LEU 8 10.940 -26.675 -31.096 45 HG LEU 8 HG LEU 8 7.796 -26.271 -33.022 46 HB2 LEU 8 HB2 LEU 8 8.015 -27.309 -30.749 47 HB3 LEU 8 HB1 LEU 8 8.624 -25.675 -30.899 48 HD11 LEU 8 HD11 LEU 8 9.876 -25.092 -33.177 49 HD12 LEU 8 HD12 LEU 8 9.818 -26.314 -34.450 50 HD13 LEU 8 HD13 LEU 8 10.787 -26.593 -33.003 51 HD21 LEU 8 HD21 LEU 8 7.631 -28.667 -32.744 52 HD22 LEU 8 HD22 LEU 8 9.387 -28.818 -32.801 53 HD23 LEU 8 HD23 LEU 8 8.502 -28.292 -34.233 54 H MET 9 HN MET 9 11.476 -25.262 -29.561 55 HA MET 9 HA MET 9 10.614 -25.837 -26.811 56 HB2 MET 9 HB2 MET 9 13.060 -24.370 -27.810 57 HB3 MET 9 HB1 MET 9 12.628 -24.559 -26.116 58 HG2 MET 9 HG2 MET 9 12.840 -26.990 -26.354 59 HG3 MET 9 HG1 MET 9 13.316 -26.775 -28.036 60 HE1 MET 9 HE1 MET 9 15.516 -28.196 -27.607 61 HE2 MET 9 HE2 MET 9 14.991 -28.430 -25.940 62 HE3 MET 9 HE3 MET 9 16.635 -27.886 -26.278 63 HA PRO 10 HA PRO 10 8.136 -22.125 -27.126 64 HB2 PRO 10 HB2 PRO 10 7.814 -21.853 -24.380 65 HB3 PRO 10 HB1 PRO 10 6.788 -22.832 -25.435 66 HG2 PRO 10 HG2 PRO 10 9.058 -23.667 -23.685 67 HG3 PRO 10 HG1 PRO 10 7.529 -24.500 -24.020 68 HD2 PRO 10 HD2 PRO 10 9.835 -25.259 -25.164 69 HD3 PRO 10 HD1 PRO 10 8.291 -25.346 -26.037 70 H SER 11 HN SER 11 10.870 -22.421 -24.896 71 HA SER 11 HA SER 11 11.319 -19.536 -25.181 72 HG SER 11 HG SER 11 13.156 -21.957 -22.729 73 HB2 SER 11 HB2 SER 11 12.930 -19.934 -23.228 74 HB3 SER 11 HB1 SER 11 11.204 -20.064 -22.884 75 H GLN 12 HN GLN 12 12.260 -19.617 -27.215 76 HA GLN 12 HA GLN 12 14.766 -21.112 -27.434 77 HB2 GLN 12 HB2 GLN 12 14.597 -20.494 -29.878 78 HB3 GLN 12 HB1 GLN 12 13.346 -21.570 -29.277 79 HG2 GLN 12 HG2 GLN 12 11.791 -19.709 -29.142 80 HG3 GLN 12 HG1 GLN 12 13.050 -18.605 -29.692 81 HE21 GLN 12 HE21 GLN 12 10.453 -19.254 -30.859 82 HE22 GLN 12 HE22 GLN 12 10.777 -19.796 -32.469 83 H VAL 13 HN VAL 13 15.330 -19.301 -25.775 84 HA VAL 13 HA VAL 13 16.490 -17.052 -27.283 85 HB VAL 13 HB VAL 13 15.646 -17.041 -24.374 86 HG11 VAL 13 HG11 VAL 13 16.719 -14.828 -26.122 87 HG12 VAL 13 HG12 VAL 13 17.575 -15.616 -24.796 88 HG13 VAL 13 HG13 VAL 13 16.141 -14.643 -24.465 89 HG21 VAL 13 HG21 VAL 13 13.926 -15.426 -25.102 90 HG22 VAL 13 HG22 VAL 13 13.697 -17.020 -25.818 91 HG23 VAL 13 HG23 VAL 13 14.390 -15.715 -26.780 92 H VAL 14 HN VAL 14 18.545 -17.594 -27.595 93 HA VAL 14 HA VAL 14 20.001 -19.060 -25.557 94 HB VAL 14 HB VAL 14 21.878 -19.009 -27.273 95 HG11 VAL 14 HG11 VAL 14 20.445 -20.954 -26.936 96 HG12 VAL 14 HG12 VAL 14 20.852 -20.767 -28.641 97 HG13 VAL 14 HG13 VAL 14 19.258 -20.287 -28.057 98 HG21 VAL 14 HG21 VAL 14 19.664 -17.908 -29.005 99 HG22 VAL 14 HG22 VAL 14 21.183 -18.569 -29.611 100 HG23 VAL 14 HG23 VAL 14 21.191 -17.118 -28.609 101 H LYS 15 HN LYS 15 20.578 -17.810 -23.916 102 HA LYS 15 HA LYS 15 21.650 -15.161 -24.357 103 HB2 LYS 15 HB2 LYS 15 21.296 -16.761 -21.813 104 HB3 LYS 15 HB1 LYS 15 21.864 -15.098 -21.884 105 HG2 LYS 15 HG2 LYS 15 19.743 -14.373 -22.801 106 HG3 LYS 15 HG1 LYS 15 19.168 -16.045 -22.834 107 HD2 LYS 15 HD2 LYS 15 19.348 -16.166 -20.406 108 HD3 LYS 15 HD1 LYS 15 19.972 -14.516 -20.360 109 HE2 LYS 15 HE2 LYS 15 17.249 -15.314 -21.392 110 HE3 LYS 15 HE1 LYS 15 17.572 -14.667 -19.786 111 HZ1 LYS 15 HZ1 LYS 15 18.058 -13.252 -22.356 112 HZ2 LYS 15 HZ2 LYS 15 18.410 -12.635 -20.819 113 HZ3 LYS 15 HZ3 LYS 15 16.800 -12.938 -21.263 114 H GLY 16 HN GLY 16 23.502 -15.696 -25.586 115 HA2 GLY 16 HA2 GLY 16 25.467 -17.539 -24.620 116 HA3 GLY 16 HA1 GLY 16 25.648 -16.430 -25.971 117 H GLY 17 HN GLY 17 26.562 -17.118 -22.810 118 HA2 GLY 17 HA2 GLY 17 28.277 -16.121 -21.609 119 HA3 GLY 17 HA1 GLY 17 28.273 -14.792 -22.757 120 H ALA 18 HN ALA 18 25.149 -15.330 -21.757 121 HA ALA 18 HA ALA 18 25.277 -13.021 -19.978 122 HB1 ALA 18 HB1 ALA 18 22.882 -12.850 -20.278 123 HB2 ALA 18 HB2 ALA 18 22.853 -14.383 -21.147 124 HB3 ALA 18 HB3 ALA 18 23.674 -12.987 -21.847 125 H PHE 19 HN PHE 19 25.916 -13.767 -18.019 126 HA PHE 19 HA PHE 19 24.628 -16.092 -16.866 127 HD1 PHE 19 HD1 PHE 19 27.904 -13.997 -17.732 128 HD2 PHE 19 HD2 PHE 19 26.508 -13.629 -13.724 129 HE1 PHE 19 HE1 PHE 19 29.158 -11.900 -17.492 130 HE2 PHE 19 HE2 PHE 19 27.768 -11.527 -13.480 131 HZ PHE 19 HZ PHE 19 29.112 -10.678 -15.322 132 HB2 PHE 19 HB2 PHE 19 26.143 -15.624 -14.908 133 HB3 PHE 19 HB1 PHE 19 26.971 -15.949 -16.424 134 H ASP 20 HN ASP 20 22.762 -15.935 -15.851 135 HA ASP 20 HA ASP 20 22.039 -13.365 -14.627 136 HB2 ASP 20 HB2 ASP 20 19.738 -14.005 -14.791 137 HB3 ASP 20 HB1 ASP 20 20.485 -14.354 -16.344 138 H GLY 21 HN GLY 21 21.591 -13.187 -12.516 139 HA2 GLY 21 HA2 GLY 21 22.007 -15.604 -10.875 140 HA3 GLY 21 HA1 GLY 21 22.417 -13.971 -10.362 141 H THR 22 HN THR 22 19.799 -16.187 -11.042 142 HA THR 22 HA THR 22 18.150 -14.794 -9.094 143 HB THR 22 HB THR 22 17.156 -15.342 -11.907 144 HG1 THR 22 HG1 THR 22 18.423 -13.222 -10.783 145 HG21 THR 22 HG21 THR 22 15.112 -14.217 -11.202 146 HG22 THR 22 HG22 THR 22 15.767 -13.991 -9.582 147 HG23 THR 22 HG23 THR 22 15.414 -15.617 -10.172 148 H MET 23 HN MET 23 16.668 -16.130 -8.078 149 HA MET 23 HA MET 23 17.288 -18.852 -7.911 150 HB2 MET 23 HB2 MET 23 16.287 -17.635 -6.059 151 HB3 MET 23 HB1 MET 23 14.820 -17.369 -6.989 152 HG2 MET 23 HG2 MET 23 14.539 -19.128 -5.338 153 HG3 MET 23 HG1 MET 23 14.357 -19.749 -6.978 154 HE1 MET 23 HE1 MET 23 14.777 -21.651 -4.458 155 HE2 MET 23 HE2 MET 23 15.931 -22.799 -5.135 156 HE3 MET 23 HE3 MET 23 14.590 -22.210 -6.119 157 H ASN 24 HN ASN 24 16.429 -20.667 -8.752 158 HA ASN 24 HA ASN 24 14.733 -20.352 -11.097 159 HB2 ASN 24 HB2 ASN 24 16.102 -22.826 -10.018 160 HB3 ASN 24 HB1 ASN 24 15.326 -22.669 -11.591 161 HD21 ASN 24 HD21 ASN 24 16.394 -21.607 -13.239 162 HD22 ASN 24 HD22 ASN 24 18.050 -21.126 -13.123 163 H GLY 25 HN GLY 25 12.790 -21.533 -11.390 164 HA2 GLY 25 HA2 GLY 25 11.243 -23.194 -10.416 165 HA3 GLY 25 HA1 GLY 25 11.598 -22.472 -8.860 166 HA PRO 26 HA PRO 26 8.424 -19.320 -9.815 167 HB2 PRO 26 HB2 PRO 26 10.044 -17.080 -10.782 168 HB3 PRO 26 HB1 PRO 26 9.063 -17.198 -9.319 169 HG2 PRO 26 HG2 PRO 26 11.759 -17.150 -9.224 170 HG3 PRO 26 HG1 PRO 26 10.788 -18.086 -8.070 171 HD2 PRO 26 HD2 PRO 26 12.253 -19.022 -10.511 172 HD3 PRO 26 HD1 PRO 26 12.172 -19.758 -8.896 173 H PHE 27 HN PHE 27 10.385 -20.403 -12.229 174 HA PHE 27 HA PHE 27 9.219 -18.932 -14.421 175 HD1 PHE 27 HD1 PHE 27 11.450 -18.120 -16.054 176 HD2 PHE 27 HD2 PHE 27 12.696 -20.720 -12.924 177 HE1 PHE 27 HE1 PHE 27 13.408 -16.685 -15.655 178 HE2 PHE 27 HE2 PHE 27 14.659 -19.293 -12.516 179 HZ PHE 27 HZ PHE 27 14.990 -17.253 -13.833 180 HB2 PHE 27 HB2 PHE 27 10.992 -21.390 -14.435 181 HB3 PHE 27 HB1 PHE 27 10.576 -20.418 -15.843 182 H GLY 28 HN GLY 28 7.386 -19.438 -15.404 183 HA2 GLY 28 HA2 GLY 28 5.881 -21.713 -14.462 184 HA3 GLY 28 HA1 GLY 28 5.313 -20.464 -15.560 185 H HIS 29 HN HIS 29 4.557 -22.947 -16.101 186 HA HIS 29 HA HIS 29 6.127 -23.622 -18.501 187 HD1 HIS 29 HD1 HIS 29 6.265 -26.243 -14.711 188 HD2 HIS 29 HD2 HIS 29 8.557 -24.873 -17.900 189 HE1 HIS 29 HE1 HIS 29 8.650 -26.336 -13.918 190 HE2 HIS 29 HE2 HIS 29 10.012 -25.766 -15.957 191 HB2 HIS 29 HB2 HIS 29 4.866 -25.649 -16.633 192 HB3 HIS 29 HB1 HIS 29 5.682 -26.015 -18.146 193 H GLY 30 HN GLY 30 4.763 -24.920 -20.067 194 HA2 GLY 30 HA2 GLY 30 2.220 -23.579 -20.339 195 HA3 GLY 30 HA1 GLY 30 2.937 -24.716 -21.473 196 H TYR 31 HN TYR 31 0.838 -24.308 -18.761 197 HA TYR 31 HA TYR 31 0.166 -27.181 -18.844 198 HD1 TYR 31 HD1 TYR 31 1.569 -28.236 -17.174 199 HD2 TYR 31 HD2 TYR 31 1.040 -24.494 -15.215 200 HE1 TYR 31 HE1 TYR 31 3.686 -28.575 -15.964 201 HE2 TYR 31 HE2 TYR 31 3.157 -24.816 -14.014 202 HH TYR 31 HH TYR 31 4.583 -26.806 -13.284 203 HB2 TYR 31 HB2 TYR 31 -0.551 -25.178 -16.690 204 HB3 TYR 31 HB1 TYR 31 -0.846 -26.909 -16.648 205 H GLY 32 HN GLY 32 -2.199 -27.633 -18.482 206 HA2 GLY 32 HA2 GLY 32 -3.929 -26.111 -20.132 207 HA3 GLY 32 HA1 GLY 32 -4.425 -27.338 -18.970 208 H GLU 33 HN GLU 33 -5.854 -24.940 -19.424 209 HA GLU 33 HA GLU 33 -5.282 -22.728 -17.923 210 HB2 GLU 33 HB2 GLU 33 -7.931 -24.036 -18.465 211 HB3 GLU 33 HB1 GLU 33 -7.796 -22.486 -17.650 212 HG2 GLU 33 HG2 GLU 33 -6.761 -21.508 -19.583 213 HG3 GLU 33 HG1 GLU 33 -6.732 -23.073 -20.401 214 H GLY 34 HN GLY 34 -5.207 -22.156 -15.876 215 HA2 GLY 34 HA2 GLY 34 -6.085 -24.119 -13.856 216 HA3 GLY 34 HA1 GLY 34 -4.831 -22.906 -13.608 217 H ALA 35 HN ALA 35 -8.107 -23.633 -13.213 218 HA ALA 35 HA ALA 35 -9.281 -21.085 -13.383 219 HB1 ALA 35 HB1 ALA 35 -10.598 -23.146 -13.306 220 HB2 ALA 35 HB2 ALA 35 -11.100 -22.015 -12.050 221 HB3 ALA 35 HB3 ALA 35 -10.097 -23.406 -11.636 222 H GLY 36 HN GLY 36 -9.623 -19.489 -11.869 223 HA2 GLY 36 HA2 GLY 36 -7.748 -19.598 -9.605 224 HA3 GLY 36 HA1 GLY 36 -8.251 -18.130 -10.430 225 H GLU 37 HN GLU 37 -8.772 -20.151 -7.800 226 HA GLU 37 HA GLU 37 -11.466 -19.305 -7.274 227 HB2 GLU 37 HB2 GLU 37 -10.889 -20.271 -4.945 228 HB3 GLU 37 HB1 GLU 37 -11.044 -21.365 -6.311 229 HG2 GLU 37 HG2 GLU 37 -8.367 -20.304 -5.493 230 HG3 GLU 37 HG1 GLU 37 -9.096 -21.675 -4.654 231 H GLY 38 HN GLY 38 -11.536 -18.522 -4.668 232 HA2 GLY 38 HA2 GLY 38 -10.772 -15.772 -5.088 233 HA3 GLY 38 HA1 GLY 38 -11.746 -16.382 -3.766 234 H ILE 39 HN ILE 39 -8.421 -16.525 -4.979 235 HA ILE 39 HA ILE 39 -7.265 -16.682 -2.410 236 HB ILE 39 HB ILE 39 -5.246 -15.539 -3.656 237 HG12 ILE 39 HG12 ILE 39 -5.244 -16.157 -6.085 238 HG13 ILE 39 HG11 ILE 39 -6.962 -16.479 -5.970 239 HG21 ILE 39 HG21 ILE 39 -4.552 -17.749 -4.462 240 HG22 ILE 39 HG22 ILE 39 -6.204 -18.326 -4.257 241 HG23 ILE 39 HG23 ILE 39 -5.270 -17.811 -2.851 242 HD11 ILE 39 HD11 ILE 39 -7.330 -14.120 -5.365 243 HD12 ILE 39 HD12 ILE 39 -6.588 -14.323 -6.953 244 HD13 ILE 39 HD13 ILE 39 -5.602 -13.827 -5.578 245 H ASP 40 HN ASP 40 -6.119 -14.923 -1.284 246 HA ASP 40 HA ASP 40 -7.921 -12.715 -1.053 247 HB2 ASP 40 HB2 ASP 40 -5.426 -13.530 0.405 248 HB3 ASP 40 HB1 ASP 40 -6.127 -11.935 0.665 249 H ASP 41 HN ASP 41 -7.599 -11.997 -3.271 250 HA ASP 41 HA ASP 41 -5.172 -10.406 -3.692 251 HB2 ASP 41 HB2 ASP 41 -6.665 -11.849 -5.452 252 HB3 ASP 41 HB1 ASP 41 -7.387 -10.256 -5.654 253 H VAL 42 HN VAL 42 -5.457 -8.821 -2.131 254 HA VAL 42 HA VAL 42 -7.902 -7.313 -1.978 255 HB VAL 42 HB VAL 42 -6.633 -7.748 0.055 256 HG11 VAL 42 HG11 VAL 42 -4.490 -6.634 0.488 257 HG12 VAL 42 HG12 VAL 42 -4.462 -6.058 -1.181 258 HG13 VAL 42 HG13 VAL 42 -4.381 -7.787 -0.842 259 HG21 VAL 42 HG21 VAL 42 -6.621 -5.508 0.993 260 HG22 VAL 42 HG22 VAL 42 -8.022 -5.744 -0.053 261 HG23 VAL 42 HG23 VAL 42 -6.638 -4.818 -0.630 262 H GLU 43 HN GLU 43 -8.334 -5.353 -2.806 263 HA GLU 43 HA GLU 43 -6.558 -4.367 -4.845 264 HB2 GLU 43 HB2 GLU 43 -8.957 -4.440 -5.303 265 HB3 GLU 43 HB1 GLU 43 -9.265 -3.347 -3.958 266 HG2 GLU 43 HG2 GLU 43 -8.184 -1.548 -5.054 267 HG3 GLU 43 HG1 GLU 43 -7.531 -2.610 -6.297 268 H TRP 44 HN TRP 44 -4.905 -3.213 -4.254 269 HA TRP 44 HA TRP 44 -5.332 -0.970 -2.411 270 HD1 TRP 44 HD1 TRP 44 -3.414 0.935 -1.973 271 HE1 TRP 44 HE1 TRP 44 -1.109 1.879 -1.316 272 HE3 TRP 44 HE3 TRP 44 -0.878 -3.400 -1.525 273 HZ2 TRP 44 HZ2 TRP 44 1.478 0.854 -0.699 274 HZ3 TRP 44 HZ3 TRP 44 1.496 -3.371 -0.944 275 HH2 TRP 44 HH2 TRP 44 2.654 -1.276 -0.509 276 HB2 TRP 44 HB2 TRP 44 -3.840 -2.420 -1.295 277 HB3 TRP 44 HB1 TRP 44 -2.965 -2.791 -2.776 278 H VAL 45 HN VAL 45 -4.621 0.972 -3.021 279 HA VAL 45 HA VAL 45 -4.712 1.783 -5.630 280 HB VAL 45 HB VAL 45 -3.160 3.186 -3.450 281 HG11 VAL 45 HG11 VAL 45 -3.893 5.229 -4.594 282 HG12 VAL 45 HG12 VAL 45 -4.647 4.245 -5.849 283 HG13 VAL 45 HG13 VAL 45 -2.896 4.210 -5.631 284 HG21 VAL 45 HG21 VAL 45 -5.260 2.631 -2.485 285 HG22 VAL 45 HG22 VAL 45 -6.124 3.077 -3.956 286 HG23 VAL 45 HG23 VAL 45 -5.351 4.322 -2.977 287 H VAL 46 HN VAL 46 -1.983 0.295 -4.068 288 HA VAL 46 HA VAL 46 -0.062 1.474 -5.831 289 HB VAL 46 HB VAL 46 0.041 -0.462 -3.585 290 HG11 VAL 46 HG11 VAL 46 2.190 -1.429 -4.179 291 HG12 VAL 46 HG12 VAL 46 2.106 -0.691 -5.778 292 HG13 VAL 46 HG13 VAL 46 0.939 -1.933 -5.317 293 HG21 VAL 46 HG21 VAL 46 0.759 1.874 -3.437 294 HG22 VAL 46 HG22 VAL 46 1.984 1.587 -4.673 295 HG23 VAL 46 HG23 VAL 46 2.096 0.773 -3.112 296 H GLY 47 HN GLY 47 -2.322 -1.052 -6.207 297 HA2 GLY 47 HA2 GLY 47 -0.894 -2.562 -8.141 298 HA3 GLY 47 HA1 GLY 47 -2.663 -2.495 -7.979 299 H LYS 48 HN LYS 48 -2.185 0.585 -8.226 300 HA LYS 48 HA LYS 48 -2.054 0.621 -11.157 301 HB2 LYS 48 HB2 LYS 48 -3.253 2.787 -10.957 302 HB3 LYS 48 HB1 LYS 48 -4.187 1.409 -10.413 303 HG2 LYS 48 HG2 LYS 48 -4.618 2.626 -8.603 304 HG3 LYS 48 HG1 LYS 48 -2.941 2.337 -8.136 305 HD2 LYS 48 HD2 LYS 48 -3.484 4.715 -8.056 306 HD3 LYS 48 HD1 LYS 48 -2.252 4.372 -9.270 307 HE2 LYS 48 HE2 LYS 48 -3.876 4.523 -11.040 308 HE3 LYS 48 HE1 LYS 48 -5.187 4.686 -9.874 309 HZ1 LYS 48 HZ1 LYS 48 -4.470 6.806 -10.907 310 HZ2 LYS 48 HZ2 LYS 48 -2.972 6.638 -10.138 311 HZ3 LYS 48 HZ3 LYS 48 -4.377 6.810 -9.211 312 H ASP 49 HN ASP 49 -0.736 1.872 -8.234 313 HA ASP 49 HA ASP 49 0.742 4.006 -9.512 314 HB2 ASP 49 HB2 ASP 49 0.254 3.078 -6.727 315 HB3 ASP 49 HB1 ASP 49 1.744 3.946 -7.022 316 H LYS 50 HN LYS 50 1.202 0.699 -8.829 317 HA LYS 50 HA LYS 50 3.827 0.468 -8.076 318 HB2 LYS 50 HB2 LYS 50 2.125 -1.400 -8.250 319 HB3 LYS 50 HB1 LYS 50 2.495 -1.456 -9.970 320 HG2 LYS 50 HG2 LYS 50 4.856 -1.907 -9.438 321 HG3 LYS 50 HG1 LYS 50 4.446 -1.922 -7.726 322 HD2 LYS 50 HD2 LYS 50 2.913 -3.791 -8.116 323 HD3 LYS 50 HD1 LYS 50 3.357 -3.790 -9.823 324 HE2 LYS 50 HE2 LYS 50 5.304 -4.195 -7.559 325 HE3 LYS 50 HE1 LYS 50 4.530 -5.505 -8.438 326 HZ1 LYS 50 HZ1 LYS 50 6.677 -5.161 -9.370 327 HZ2 LYS 50 HZ2 LYS 50 6.431 -3.500 -9.529 328 HZ3 LYS 50 HZ3 LYS 50 5.560 -4.578 -10.503 329 HA PRO 51 HA PRO 51 4.894 0.005 -12.979 330 HB2 PRO 51 HB2 PRO 51 3.209 2.409 -13.574 331 HB3 PRO 51 HB1 PRO 51 3.683 1.071 -14.637 332 HG2 PRO 51 HG2 PRO 51 1.253 1.157 -13.533 333 HG3 PRO 51 HG1 PRO 51 2.120 -0.376 -13.735 334 HD2 PRO 51 HD2 PRO 51 1.561 1.164 -11.271 335 HD3 PRO 51 HD1 PRO 51 1.871 -0.571 -11.480 336 H THR 52 HN THR 52 4.201 3.064 -11.310 337 HA THR 52 HA THR 52 6.382 4.462 -12.518 338 HB THR 52 HB THR 52 4.618 5.151 -10.157 339 HG1 THR 52 HG1 THR 52 4.547 5.685 -12.937 340 HG21 THR 52 HG21 THR 52 6.728 6.375 -10.025 341 HG22 THR 52 HG22 THR 52 5.401 7.455 -10.458 342 HG23 THR 52 HG23 THR 52 6.538 6.908 -11.694 343 H TYR 53 HN TYR 53 5.768 2.980 -9.369 344 HA TYR 53 HA TYR 53 8.282 3.788 -8.246 345 HD1 TYR 53 HD2 TYR 53 6.749 5.205 -7.248 346 HD2 TYR 53 HD1 TYR 53 4.574 1.691 -6.272 347 HE1 TYR 53 HE2 TYR 53 4.822 6.584 -6.578 348 HE2 TYR 53 HE1 TYR 53 2.654 3.047 -5.616 349 HH TYR 53 HH TYR 53 2.197 6.127 -6.433 350 HB2 TYR 53 HB2 TYR 53 6.573 1.492 -7.351 351 HB3 TYR 53 HB1 TYR 53 7.647 2.472 -6.380 352 H ASP 54 HN ASP 54 7.097 1.208 -10.152 353 HA ASP 54 HA ASP 54 9.189 -0.685 -9.506 354 HB2 ASP 54 HB2 ASP 54 6.850 -1.295 -10.156 355 HB3 ASP 54 HB1 ASP 54 7.151 -0.660 -11.767 356 H GLU 55 HN GLU 55 8.435 1.575 -12.149 357 HA GLU 55 HA GLU 55 10.644 0.871 -13.790 358 HB2 GLU 55 HB2 GLU 55 10.237 2.951 -14.977 359 HB3 GLU 55 HB1 GLU 55 8.724 2.121 -14.669 360 HG2 GLU 55 HG2 GLU 55 8.343 3.640 -12.738 361 HG3 GLU 55 HG1 GLU 55 9.801 4.524 -13.218 362 H ILE 56 HN ILE 56 10.218 3.315 -11.245 363 HA ILE 56 HA ILE 56 12.895 4.274 -11.430 364 HB ILE 56 HB ILE 56 11.073 4.353 -9.009 365 HG12 ILE 56 HG12 ILE 56 11.454 6.497 -11.111 366 HG13 ILE 56 HG11 ILE 56 10.118 5.340 -11.139 367 HG21 ILE 56 HG21 ILE 56 12.424 6.293 -8.353 368 HG22 ILE 56 HG22 ILE 56 13.455 6.057 -9.764 369 HG23 ILE 56 HG23 ILE 56 13.410 4.838 -8.489 370 HD11 ILE 56 HD11 ILE 56 10.677 7.354 -8.976 371 HD12 ILE 56 HD12 ILE 56 9.375 6.165 -8.957 372 HD13 ILE 56 HD13 ILE 56 9.395 7.433 -10.186 373 H PHE 57 HN PHE 57 11.334 1.634 -9.803 374 HA PHE 57 HA PHE 57 13.288 0.868 -7.978 375 HD1 PHE 57 HD1 PHE 57 12.957 -1.040 -6.267 376 HD2 PHE 57 HD2 PHE 57 11.794 -2.919 -9.899 377 HE1 PHE 57 HE1 PHE 57 13.800 -3.189 -5.422 378 HE2 PHE 57 HE2 PHE 57 12.630 -5.065 -9.052 379 HZ PHE 57 HZ PHE 57 13.631 -5.217 -6.838 380 HB2 PHE 57 HB2 PHE 57 11.123 -0.126 -7.919 381 HB3 PHE 57 HB1 PHE 57 11.271 -0.709 -9.570 382 H TYR 58 HN TYR 58 12.817 -0.350 -11.315 383 HA TYR 58 HA TYR 58 15.284 -1.776 -11.292 384 HD1 TYR 58 HD2 TYR 58 14.991 -4.074 -12.184 385 HD2 TYR 58 HD1 TYR 58 11.426 -1.991 -13.197 386 HE1 TYR 58 HE2 TYR 58 13.669 -6.042 -11.539 387 HE2 TYR 58 HE1 TYR 58 10.098 -3.956 -12.554 388 HH TYR 58 HH TYR 58 11.124 -6.335 -10.668 389 HB2 TYR 58 HB2 TYR 58 13.469 -0.946 -13.564 390 HB3 TYR 58 HB1 TYR 58 14.904 -1.960 -13.773 391 H THR 59 HN THR 59 14.401 1.454 -11.922 392 HA THR 59 HA THR 59 16.723 2.259 -13.360 393 HB THR 59 HB THR 59 14.607 3.740 -11.807 394 HG1 THR 59 HG1 THR 59 13.816 2.990 -13.716 395 HG21 THR 59 HG21 THR 59 16.817 4.954 -13.461 396 HG22 THR 59 HG22 THR 59 16.653 5.076 -11.707 397 HG23 THR 59 HG23 THR 59 15.450 5.818 -12.758 398 H LEU 60 HN LEU 60 15.976 1.738 -10.002 399 HA LEU 60 HA LEU 60 18.415 3.087 -9.127 400 HG LEU 60 HG LEU 60 15.452 3.909 -8.309 401 HB2 LEU 60 HB2 LEU 60 16.189 1.747 -7.588 402 HB3 LEU 60 HB1 LEU 60 17.618 2.429 -6.830 403 HD11 LEU 60 HD11 LEU 60 16.489 4.159 -5.490 404 HD12 LEU 60 HD12 LEU 60 15.039 3.272 -5.953 405 HD13 LEU 60 HD13 LEU 60 15.121 5.018 -6.199 406 HD21 LEU 60 HD21 LEU 60 18.088 4.946 -7.268 407 HD22 LEU 60 HD22 LEU 60 16.747 5.946 -7.828 408 HD23 LEU 60 HD23 LEU 60 17.580 4.878 -8.957 409 H SER 61 HN SER 61 17.848 0.290 -10.533 410 HA SER 61 HA SER 61 19.061 -1.594 -10.816 411 HG SER 61 HG SER 61 21.521 -2.450 -9.198 412 HB2 SER 61 HB2 SER 61 21.006 -0.098 -10.697 413 HB3 SER 61 HB1 SER 61 21.038 -0.276 -8.943 414 HA PRO 62 HA PRO 62 17.508 -3.621 -7.019 415 HB2 PRO 62 HB2 PRO 62 16.408 -5.613 -8.785 416 HB3 PRO 62 HB1 PRO 62 15.558 -4.480 -7.731 417 HG2 PRO 62 HG2 PRO 62 15.536 -4.386 -10.482 418 HG3 PRO 62 HG1 PRO 62 15.179 -3.010 -9.417 419 HD2 PRO 62 HD2 PRO 62 17.656 -3.654 -10.945 420 HD3 PRO 62 HD1 PRO 62 16.939 -2.078 -10.544 421 H VAL 63 HN VAL 63 18.425 -5.290 -5.980 422 HA VAL 63 HA VAL 63 20.112 -7.157 -7.516 423 HB VAL 63 HB VAL 63 20.574 -6.208 -4.673 424 HG11 VAL 63 HG11 VAL 63 22.732 -7.366 -4.884 425 HG12 VAL 63 HG12 VAL 63 22.245 -7.959 -6.474 426 HG13 VAL 63 HG13 VAL 63 21.362 -8.466 -5.036 427 HG21 VAL 63 HG21 VAL 63 22.085 -5.486 -7.184 428 HG22 VAL 63 HG22 VAL 63 22.507 -5.003 -5.540 429 HG23 VAL 63 HG23 VAL 63 21.013 -4.421 -6.273 430 H ASN 64 HN ASN 64 19.243 -9.130 -7.477 431 HA ASN 64 HA ASN 64 18.238 -11.053 -6.780 432 HB2 ASN 64 HB2 ASN 64 18.405 -9.808 -4.020 433 HB3 ASN 64 HB1 ASN 64 17.974 -11.488 -4.361 434 HD21 ASN 64 HD21 ASN 64 20.227 -10.149 -2.899 435 HD22 ASN 64 HD22 ASN 64 21.645 -10.892 -3.558 436 H GLY 65 HN GLY 65 16.770 -8.433 -7.319 437 HA2 GLY 65 HA2 GLY 65 14.498 -8.318 -7.933 438 HA3 GLY 65 HA1 GLY 65 14.140 -9.552 -6.737 439 H LYS 66 HN LYS 66 16.132 -6.897 -5.779 440 HA LYS 66 HA LYS 66 13.997 -5.196 -4.911 441 HB2 LYS 66 HB2 LYS 66 14.599 -5.327 -2.474 442 HB3 LYS 66 HB1 LYS 66 13.791 -6.756 -3.096 443 HG2 LYS 66 HG2 LYS 66 16.760 -6.635 -2.962 444 HG3 LYS 66 HG1 LYS 66 15.810 -7.043 -1.534 445 HD2 LYS 66 HD2 LYS 66 14.942 -8.461 -3.887 446 HD3 LYS 66 HD1 LYS 66 16.636 -8.776 -3.530 447 HE2 LYS 66 HE2 LYS 66 16.121 -9.554 -1.372 448 HE3 LYS 66 HE1 LYS 66 14.459 -8.978 -1.470 449 HZ1 LYS 66 HZ1 LYS 66 14.092 -10.616 -3.257 450 HZ2 LYS 66 HZ2 LYS 66 14.523 -11.345 -1.786 451 HZ3 LYS 66 HZ3 LYS 66 15.668 -11.204 -3.024 452 H ILE 67 HN ILE 67 14.784 -3.206 -3.957 453 HA ILE 67 HA ILE 67 17.482 -2.605 -4.886 454 HB ILE 67 HB ILE 67 16.889 -0.259 -3.907 455 HG12 ILE 67 HG12 ILE 67 14.157 -1.546 -4.088 456 HG13 ILE 67 HG11 ILE 67 14.933 -0.916 -2.642 457 HG21 ILE 67 HG21 ILE 67 15.694 0.321 -6.010 458 HG22 ILE 67 HG22 ILE 67 15.525 -1.401 -6.356 459 HG23 ILE 67 HG23 ILE 67 17.128 -0.671 -6.273 460 HD11 ILE 67 HD11 ILE 67 14.081 0.704 -5.022 461 HD12 ILE 67 HD12 ILE 67 14.802 1.330 -3.536 462 HD13 ILE 67 HD13 ILE 67 13.211 0.571 -3.495 463 H THR 68 HN THR 68 19.206 -2.343 -3.619 464 HA THR 68 HA THR 68 19.218 -2.974 -0.900 465 HB THR 68 HB THR 68 21.408 -1.517 -0.979 466 HG1 THR 68 HG1 THR 68 22.154 -1.184 -3.094 467 HG21 THR 68 HG21 THR 68 22.575 -3.411 -2.096 468 HG22 THR 68 HG22 THR 68 21.003 -4.048 -2.582 469 HG23 THR 68 HG23 THR 68 21.418 -3.934 -0.871 470 H GLY 69 HN GLY 69 18.818 -1.787 0.893 471 HA2 GLY 69 HA2 GLY 69 16.752 -0.016 0.587 472 HA3 GLY 69 HA1 GLY 69 17.633 -0.249 2.086 473 H ALA 70 HN ALA 70 20.143 0.784 0.962 474 HA ALA 70 HA ALA 70 19.952 3.438 1.737 475 HB1 ALA 70 HB1 ALA 70 22.063 2.156 1.530 476 HB2 ALA 70 HB2 ALA 70 22.147 3.762 0.811 477 HB3 ALA 70 HB3 ALA 70 21.970 2.345 -0.222 478 H ASN 71 HN ASN 71 19.207 2.064 -1.391 479 HA ASN 71 HA ASN 71 19.382 4.565 -2.822 480 HB2 ASN 71 HB2 ASN 71 17.872 2.149 -3.789 481 HB3 ASN 71 HB1 ASN 71 18.732 3.357 -4.738 482 HD21 ASN 71 HD21 ASN 71 18.878 0.400 -4.587 483 HD22 ASN 71 HD22 ASN 71 20.526 0.025 -4.261 484 H ALA 72 HN ALA 72 16.837 2.505 -1.502 485 HA ALA 72 HA ALA 72 14.679 4.180 -2.312 486 HB1 ALA 72 HB1 ALA 72 14.341 1.825 -1.769 487 HB2 ALA 72 HB2 ALA 72 13.342 2.862 -0.751 488 HB3 ALA 72 HB3 ALA 72 14.811 2.136 -0.098 489 H LYS 73 HN LYS 73 16.803 3.976 0.422 490 HA LYS 73 HA LYS 73 15.527 5.897 2.067 491 HB2 LYS 73 HB2 LYS 73 18.454 5.122 1.899 492 HB3 LYS 73 HB1 LYS 73 17.761 6.136 3.159 493 HG2 LYS 73 HG2 LYS 73 17.112 3.253 2.607 494 HG3 LYS 73 HG1 LYS 73 18.018 3.900 3.976 495 HD2 LYS 73 HD2 LYS 73 15.206 4.767 3.414 496 HD3 LYS 73 HD1 LYS 73 15.551 3.293 4.325 497 HE2 LYS 73 HE2 LYS 73 16.775 4.551 5.972 498 HE3 LYS 73 HE1 LYS 73 16.581 6.041 5.041 499 HZ1 LYS 73 HZ1 LYS 73 14.177 5.851 5.371 500 HZ2 LYS 73 HZ2 LYS 73 15.003 5.943 6.852 501 HZ3 LYS 73 HZ3 LYS 73 14.410 4.457 6.304 502 H LYS 74 HN LYS 74 17.861 6.053 -0.529 503 HA LYS 74 HA LYS 74 18.517 8.762 -0.473 504 HB2 LYS 74 HB2 LYS 74 19.340 6.764 -1.967 505 HB3 LYS 74 HB1 LYS 74 18.067 7.306 -3.054 506 HG2 LYS 74 HG2 LYS 74 20.265 8.234 -3.613 507 HG3 LYS 74 HG1 LYS 74 19.079 9.481 -3.219 508 HD2 LYS 74 HD2 LYS 74 21.265 9.894 -2.186 509 HD3 LYS 74 HD1 LYS 74 19.987 9.699 -0.997 510 HE2 LYS 74 HE2 LYS 74 21.969 8.514 -0.279 511 HE3 LYS 74 HE1 LYS 74 20.680 7.373 -0.653 512 HZ1 LYS 74 HZ1 LYS 74 21.932 6.400 -2.198 513 HZ2 LYS 74 HZ2 LYS 74 23.241 7.316 -1.612 514 HZ3 LYS 74 HZ3 LYS 74 22.337 7.884 -2.920 515 H GLU 75 HN GLU 75 15.902 7.061 -2.098 516 HA GLU 75 HA GLU 75 14.626 9.203 -3.315 517 HB2 GLU 75 HB2 GLU 75 13.342 6.732 -2.134 518 HB3 GLU 75 HB1 GLU 75 12.562 7.829 -3.262 519 HG2 GLU 75 HG2 GLU 75 14.837 5.932 -3.768 520 HG3 GLU 75 HG1 GLU 75 13.247 5.975 -4.521 521 H MET 76 HN MET 76 13.947 7.817 -0.124 522 HA MET 76 HA MET 76 11.963 9.782 0.455 523 HB2 MET 76 HB2 MET 76 12.121 8.799 2.802 524 HB3 MET 76 HB1 MET 76 11.663 7.704 1.506 525 HG2 MET 76 HG2 MET 76 13.900 6.833 1.416 526 HG3 MET 76 HG1 MET 76 14.426 7.981 2.638 527 HE1 MET 76 HE1 MET 76 11.162 5.626 2.373 528 HE2 MET 76 HE2 MET 76 11.796 4.252 3.281 529 HE3 MET 76 HE3 MET 76 12.569 4.745 1.776 530 H VAL 77 HN VAL 77 15.405 9.655 0.916 531 HA VAL 77 HA VAL 77 15.639 11.743 2.831 532 HB VAL 77 HB VAL 77 17.542 10.645 0.763 533 HG11 VAL 77 HG11 VAL 77 18.149 12.868 2.719 534 HG12 VAL 77 HG12 VAL 77 18.015 13.051 0.968 535 HG13 VAL 77 HG13 VAL 77 19.306 12.067 1.657 536 HG21 VAL 77 HG21 VAL 77 18.803 9.922 2.732 537 HG22 VAL 77 HG22 VAL 77 17.156 9.290 2.756 538 HG23 VAL 77 HG23 VAL 77 17.592 10.656 3.782 539 H LYS 78 HN LYS 78 15.994 11.773 -0.722 540 HA LYS 78 HA LYS 78 16.282 14.586 -0.906 541 HB2 LYS 78 HB2 LYS 78 16.070 14.267 -3.291 542 HB3 LYS 78 HB1 LYS 78 17.105 13.018 -2.603 543 HG2 LYS 78 HG2 LYS 78 15.118 11.520 -2.550 544 HG3 LYS 78 HG1 LYS 78 14.243 12.754 -3.455 545 HD2 LYS 78 HD2 LYS 78 15.977 12.618 -5.208 546 HD3 LYS 78 HD1 LYS 78 16.713 11.275 -4.327 547 HE2 LYS 78 HE2 LYS 78 14.512 10.111 -4.435 548 HE3 LYS 78 HE1 LYS 78 13.949 11.401 -5.500 549 HZ1 LYS 78 HZ1 LYS 78 16.178 9.511 -6.029 550 HZ2 LYS 78 HZ2 LYS 78 15.746 10.802 -7.053 551 HZ3 LYS 78 HZ3 LYS 78 14.664 9.524 -6.786 552 H SER 79 HN SER 79 13.576 12.566 -0.510 553 HA SER 79 HA SER 79 11.544 14.231 -1.536 554 HG SER 79 HG SER 79 9.585 13.465 -1.137 555 HB2 SER 79 HB2 SER 79 11.361 11.806 -0.746 556 HB3 SER 79 HB1 SER 79 11.251 12.466 0.891 557 H LYS 80 HN LYS 80 13.690 14.744 0.987 558 HA LYS 80 HA LYS 80 14.051 16.559 2.280 559 HB2 LYS 80 HB2 LYS 80 11.496 17.636 1.085 560 HB3 LYS 80 HB1 LYS 80 12.635 18.560 2.061 561 HG2 LYS 80 HG2 LYS 80 14.347 18.312 0.381 562 HG3 LYS 80 HG1 LYS 80 13.311 17.245 -0.567 563 HD2 LYS 80 HD2 LYS 80 13.279 19.440 -1.544 564 HD3 LYS 80 HD1 LYS 80 11.705 19.113 -0.821 565 HE2 LYS 80 HE2 LYS 80 12.316 20.426 1.135 566 HE3 LYS 80 HE1 LYS 80 13.910 20.727 0.445 567 HZ1 LYS 80 HZ1 LYS 80 11.312 21.627 -0.668 568 HZ2 LYS 80 HZ2 LYS 80 12.814 21.847 -1.423 569 HZ3 LYS 80 HZ3 LYS 80 12.488 22.610 0.059 570 H LEU 81 HN LEU 81 13.633 14.882 3.890 571 HA LEU 81 HA LEU 81 11.350 15.620 5.596 572 HG LEU 81 HG LEU 81 11.116 13.542 3.222 573 HB2 LEU 81 HB2 LEU 81 12.438 12.829 5.244 574 HB3 LEU 81 HB1 LEU 81 11.069 13.306 6.223 575 HD11 LEU 81 HD11 LEU 81 9.717 11.523 3.239 576 HD12 LEU 81 HD12 LEU 81 9.985 11.362 4.974 577 HD13 LEU 81 HD13 LEU 81 11.338 11.207 3.853 578 HD21 LEU 81 HD21 LEU 81 9.552 15.038 4.370 579 HD22 LEU 81 HD22 LEU 81 8.874 13.663 5.242 580 HD23 LEU 81 HD23 LEU 81 8.693 13.773 3.491 581 HA PRO 82 HA PRO 82 14.449 15.296 8.900 582 HB2 PRO 82 HB2 PRO 82 12.848 14.705 10.996 583 HB3 PRO 82 HB1 PRO 82 12.908 16.333 10.287 584 HG2 PRO 82 HG2 PRO 82 10.894 14.159 9.874 585 HG3 PRO 82 HG1 PRO 82 10.637 15.897 10.090 586 HD2 PRO 82 HD2 PRO 82 10.603 14.645 7.671 587 HD3 PRO 82 HD1 PRO 82 11.054 16.348 7.890 588 H ASN 83 HN ASN 83 15.112 13.634 10.569 589 HA ASN 83 HA ASN 83 15.381 11.150 9.236 590 HB2 ASN 83 HB2 ASN 83 16.079 11.939 12.068 591 HB3 ASN 83 HB1 ASN 83 16.534 10.412 11.326 592 HD21 ASN 83 HD21 ASN 83 16.991 11.693 8.696 593 HD22 ASN 83 HD22 ASN 83 18.500 12.517 8.856 594 H THR 84 HN THR 84 13.238 12.276 11.760 595 HA THR 84 HA THR 84 12.392 9.780 12.746 596 HB THR 84 HB THR 84 10.665 12.249 12.615 597 HG1 THR 84 HG1 THR 84 12.013 13.228 13.933 598 HG21 THR 84 HG21 THR 84 9.889 11.419 14.811 599 HG22 THR 84 HG22 THR 84 10.941 10.015 14.630 600 HG23 THR 84 HG23 THR 84 9.598 10.259 13.514 601 H VAL 85 HN VAL 85 10.938 11.927 10.304 602 HA VAL 85 HA VAL 85 8.788 10.240 9.626 603 HB VAL 85 HB VAL 85 10.134 12.338 7.909 604 HG11 VAL 85 HG11 VAL 85 8.789 10.818 6.561 605 HG12 VAL 85 HG12 VAL 85 8.015 12.399 6.675 606 HG13 VAL 85 HG13 VAL 85 7.417 11.050 7.643 607 HG21 VAL 85 HG21 VAL 85 9.293 13.220 10.030 608 HG22 VAL 85 HG22 VAL 85 7.709 12.525 9.693 609 HG23 VAL 85 HG23 VAL 85 8.346 13.808 8.665 610 H LEU 86 HN LEU 86 12.052 10.548 8.310 611 HA LEU 86 HA LEU 86 11.808 8.791 6.146 612 HG LEU 86 HG LEU 86 13.386 9.239 4.839 613 HB2 LEU 86 HB2 LEU 86 13.909 10.085 7.590 614 HB3 LEU 86 HB1 LEU 86 14.367 8.414 7.261 615 HD11 LEU 86 HD11 LEU 86 14.962 11.521 6.022 616 HD12 LEU 86 HD12 LEU 86 13.237 11.552 5.661 617 HD13 LEU 86 HD13 LEU 86 14.408 11.379 4.353 618 HD21 LEU 86 HD21 LEU 86 15.374 7.906 5.333 619 HD22 LEU 86 HD22 LEU 86 16.218 9.369 5.838 620 HD23 LEU 86 HD23 LEU 86 15.706 9.182 4.161 621 H GLY 87 HN GLY 87 12.834 8.176 9.480 622 HA2 GLY 87 HA2 GLY 87 13.366 5.443 9.195 623 HA3 GLY 87 HA1 GLY 87 12.956 6.247 10.703 624 H LYS 88 HN LYS 88 10.362 7.149 9.829 625 HA LYS 88 HA LYS 88 9.039 4.644 10.458 626 HB2 LYS 88 HB2 LYS 88 7.116 5.903 11.049 627 HB3 LYS 88 HB1 LYS 88 8.504 6.785 11.667 628 HG2 LYS 88 HG2 LYS 88 8.371 8.319 9.770 629 HG3 LYS 88 HG1 LYS 88 6.978 7.432 9.160 630 HD2 LYS 88 HD2 LYS 88 7.183 9.082 11.675 631 HD3 LYS 88 HD1 LYS 88 6.112 9.332 10.294 632 HE2 LYS 88 HE2 LYS 88 5.003 7.169 10.863 633 HE3 LYS 88 HE1 LYS 88 5.972 7.122 12.338 634 HZ1 LYS 88 HZ1 LYS 88 3.888 9.091 11.589 635 HZ2 LYS 88 HZ2 LYS 88 5.006 9.386 12.827 636 HZ3 LYS 88 HZ3 LYS 88 3.935 8.078 12.954 637 H ILE 89 HN ILE 89 9.249 6.886 7.763 638 HA ILE 89 HA ILE 89 7.373 5.695 6.060 639 HB ILE 89 HB ILE 89 9.997 7.075 5.497 640 HG12 ILE 89 HG12 ILE 89 8.036 8.410 6.277 641 HG13 ILE 89 HG11 ILE 89 8.615 8.876 4.682 642 HG21 ILE 89 HG21 ILE 89 9.695 5.435 3.731 643 HG22 ILE 89 HG22 ILE 89 9.434 7.068 3.113 644 HG23 ILE 89 HG23 ILE 89 8.056 6.019 3.449 645 HD11 ILE 89 HD11 ILE 89 6.802 7.567 3.670 646 HD12 ILE 89 HD12 ILE 89 6.212 8.851 4.726 647 HD13 ILE 89 HD13 ILE 89 6.208 7.178 5.286 648 H TRP 90 HN TRP 90 10.796 4.985 6.621 649 HA TRP 90 HA TRP 90 11.088 2.854 4.848 650 HD1 TRP 90 HD1 TRP 90 13.351 0.898 8.158 651 HE1 TRP 90 HE1 TRP 90 14.661 -0.944 6.903 652 HE3 TRP 90 HE3 TRP 90 13.231 2.887 3.437 653 HZ2 TRP 90 HZ2 TRP 90 15.524 -1.468 4.264 654 HZ3 TRP 90 HZ3 TRP 90 14.318 1.645 1.614 655 HH2 TRP 90 HH2 TRP 90 15.442 -0.484 2.019 656 HB2 TRP 90 HB2 TRP 90 12.980 3.908 5.988 657 HB3 TRP 90 HB1 TRP 90 12.432 3.238 7.521 658 H LYS 91 HN LYS 91 10.260 2.769 8.308 659 HA LYS 91 HA LYS 91 10.117 -0.091 8.274 660 HB2 LYS 91 HB2 LYS 91 9.722 0.060 10.627 661 HB3 LYS 91 HB1 LYS 91 10.942 1.247 10.198 662 HG2 LYS 91 HG2 LYS 91 9.267 3.015 10.270 663 HG3 LYS 91 HG1 LYS 91 8.043 1.828 10.730 664 HD2 LYS 91 HD2 LYS 91 8.853 2.946 12.716 665 HD3 LYS 91 HD1 LYS 91 9.399 1.267 12.720 666 HE2 LYS 91 HE2 LYS 91 11.581 1.956 11.891 667 HE3 LYS 91 HE1 LYS 91 11.047 3.635 11.855 668 HZ1 LYS 91 HZ1 LYS 91 11.264 1.945 14.291 669 HZ2 LYS 91 HZ2 LYS 91 10.773 3.565 14.249 670 HZ3 LYS 91 HZ3 LYS 91 12.361 3.154 13.825 671 H LEU 92 HN LEU 92 7.918 2.314 7.433 672 HA LEU 92 HA LEU 92 5.607 0.650 8.063 673 HG LEU 92 HG LEU 92 3.464 1.927 6.567 674 HB2 LEU 92 HB2 LEU 92 5.624 3.188 8.271 675 HB3 LEU 92 HB1 LEU 92 5.617 3.230 6.504 676 HD11 LEU 92 HD11 LEU 92 3.712 0.974 8.804 677 HD12 LEU 92 HD12 LEU 92 2.209 1.889 8.657 678 HD13 LEU 92 HD13 LEU 92 3.586 2.587 9.507 679 HD21 LEU 92 HD21 LEU 92 3.484 4.331 6.209 680 HD22 LEU 92 HD22 LEU 92 3.493 4.606 7.952 681 HD23 LEU 92 HD23 LEU 92 2.093 3.858 7.184 682 H ALA 93 HN ALA 93 7.635 1.595 5.368 683 HA ALA 93 HA ALA 93 5.934 0.368 3.388 684 HB1 ALA 93 HB1 ALA 93 8.772 1.372 3.183 685 HB2 ALA 93 HB2 ALA 93 7.314 2.285 2.791 686 HB3 ALA 93 HB3 ALA 93 7.757 0.874 1.832 687 H ASP 94 HN ASP 94 8.962 -0.423 5.065 688 HA ASP 94 HA ASP 94 9.157 -2.955 3.644 689 HB2 ASP 94 HB2 ASP 94 11.171 -1.540 4.224 690 HB3 ASP 94 HB1 ASP 94 10.906 -1.982 5.901 691 H VAL 95 HN VAL 95 7.574 -4.274 4.279 692 HA VAL 95 HA VAL 95 6.694 -4.504 6.977 693 HB VAL 95 HB VAL 95 5.321 -6.384 6.207 694 HG11 VAL 95 HG11 VAL 95 3.916 -5.114 4.667 695 HG12 VAL 95 HG12 VAL 95 5.240 -3.979 4.392 696 HG13 VAL 95 HG13 VAL 95 4.497 -4.099 5.986 697 HG21 VAL 95 HG21 VAL 95 5.317 -7.020 3.875 698 HG22 VAL 95 HG22 VAL 95 6.909 -7.287 4.589 699 HG23 VAL 95 HG23 VAL 95 6.630 -5.890 3.548 700 H ASP 96 HN ASP 96 9.068 -6.087 5.081 701 HA ASP 96 HA ASP 96 9.345 -8.312 6.924 702 HB2 ASP 96 HB2 ASP 96 11.538 -7.669 5.082 703 HB3 ASP 96 HB1 ASP 96 10.771 -9.227 5.392 704 H LYS 97 HN LYS 97 10.591 -5.157 6.398 705 HA LYS 97 HA LYS 97 12.228 -3.895 7.290 706 HB2 LYS 97 HB2 LYS 97 11.887 -5.772 9.628 707 HB3 LYS 97 HB1 LYS 97 12.734 -4.226 9.670 708 HG2 LYS 97 HG2 LYS 97 10.670 -3.103 8.997 709 HG3 LYS 97 HG1 LYS 97 9.831 -4.647 9.027 710 HD2 LYS 97 HD2 LYS 97 10.326 -4.880 11.411 711 HD3 LYS 97 HD1 LYS 97 11.170 -3.328 11.383 712 HE2 LYS 97 HE2 LYS 97 8.894 -3.100 12.249 713 HE3 LYS 97 HE1 LYS 97 9.105 -2.198 10.756 714 HZ1 LYS 97 HZ1 LYS 97 8.061 -4.085 9.580 715 HZ2 LYS 97 HZ2 LYS 97 7.016 -3.352 10.698 716 HZ3 LYS 97 HZ3 LYS 97 7.761 -4.828 11.072 717 H ASP 98 HN ASP 98 13.474 -4.859 5.551 718 HA ASP 98 HA ASP 98 15.404 -6.915 6.337 719 HB2 ASP 98 HB2 ASP 98 15.185 -5.678 3.603 720 HB3 ASP 98 HB1 ASP 98 15.813 -7.267 4.040 721 H GLY 99 HN GLY 99 15.208 -3.610 5.159 722 HA2 GLY 99 HA2 GLY 99 17.035 -2.030 5.310 723 HA3 GLY 99 HA1 GLY 99 18.152 -3.397 5.326 724 H LEU 100 HN LEU 100 15.560 -3.821 3.290 725 HA LEU 100 HA LEU 100 16.584 -2.444 0.982 726 HG LEU 100 HG LEU 100 16.477 -5.896 2.293 727 HB2 LEU 100 HB2 LEU 100 16.627 -4.551 -0.393 728 HB3 LEU 100 HB1 LEU 100 17.933 -4.401 0.764 729 HD11 LEU 100 HD11 LEU 100 14.415 -5.791 1.031 730 HD12 LEU 100 HD12 LEU 100 15.017 -7.451 1.081 731 HD13 LEU 100 HD13 LEU 100 15.221 -6.481 -0.379 732 HD21 LEU 100 HD21 LEU 100 18.582 -6.596 1.278 733 HD22 LEU 100 HD22 LEU 100 17.730 -7.017 -0.207 734 HD23 LEU 100 HD23 LEU 100 17.406 -7.908 1.278 735 H LEU 101 HN LEU 101 15.014 -3.111 -0.959 736 HA LEU 101 HA LEU 101 12.306 -3.489 0.085 737 HG LEU 101 HG LEU 101 13.379 -0.741 1.100 738 HB2 LEU 101 HB2 LEU 101 13.251 -0.984 -1.320 739 HB3 LEU 101 HB1 LEU 101 11.557 -1.434 -1.211 740 HD11 LEU 101 HD11 LEU 101 12.624 1.165 -0.249 741 HD12 LEU 101 HD12 LEU 101 11.916 1.171 1.367 742 HD13 LEU 101 HD13 LEU 101 10.953 0.650 -0.017 743 HD21 LEU 101 HD21 LEU 101 11.779 -2.497 1.697 744 HD22 LEU 101 HD22 LEU 101 10.464 -1.481 1.100 745 HD23 LEU 101 HD23 LEU 101 11.411 -0.968 2.496 746 H ASP 102 HN ASP 102 11.408 -4.940 -1.290 747 HA ASP 102 HA ASP 102 12.568 -5.420 -3.867 748 HB2 ASP 102 HB2 ASP 102 10.853 -7.165 -4.099 749 HB3 ASP 102 HB1 ASP 102 11.685 -7.271 -2.554 750 H ASP 103 HN ASP 103 10.556 -5.914 -5.609 751 HA ASP 103 HA ASP 103 10.110 -3.428 -6.817 752 HB2 ASP 103 HB2 ASP 103 8.152 -5.678 -7.187 753 HB3 ASP 103 HB1 ASP 103 8.853 -4.607 -8.406 754 H GLU 104 HN GLU 104 8.204 -5.268 -4.543 755 HA GLU 104 HA GLU 104 5.851 -3.604 -4.903 756 HB2 GLU 104 HB2 GLU 104 5.897 -6.149 -4.644 757 HB3 GLU 104 HB1 GLU 104 6.255 -5.864 -2.951 758 HG2 GLU 104 HG2 GLU 104 4.154 -4.769 -2.621 759 HG3 GLU 104 HG1 GLU 104 3.799 -4.843 -4.362 760 H GLU 105 HN GLU 105 8.541 -3.999 -2.758 761 HA GLU 105 HA GLU 105 7.320 -2.482 -0.638 762 HB2 GLU 105 HB2 GLU 105 9.619 -4.160 -0.860 763 HB3 GLU 105 HB1 GLU 105 10.126 -2.582 -0.264 764 HG2 GLU 105 HG2 GLU 105 8.756 -2.653 1.590 765 HG3 GLU 105 HG1 GLU 105 7.705 -3.875 0.886 766 H PHE 106 HN PHE 106 9.571 -1.822 -3.264 767 HA PHE 106 HA PHE 106 10.028 0.892 -2.609 768 HD1 PHE 106 HD1 PHE 106 9.158 2.616 -4.439 769 HD2 PHE 106 HD2 PHE 106 12.618 0.779 -6.070 770 HE1 PHE 106 HE1 PHE 106 9.891 4.779 -5.312 771 HE2 PHE 106 HE2 PHE 106 13.352 2.954 -6.956 772 HZ PHE 106 HZ PHE 106 12.086 4.897 -6.624 773 HB2 PHE 106 HB2 PHE 106 11.235 -0.394 -4.425 774 HB3 PHE 106 HB1 PHE 106 9.772 -0.285 -5.386 775 H ALA 107 HN ALA 107 7.531 -0.825 -4.447 776 HA ALA 107 HA ALA 107 5.933 1.249 -5.260 777 HB1 ALA 107 HB1 ALA 107 5.492 -1.078 -5.816 778 HB2 ALA 107 HB2 ALA 107 4.052 -0.310 -5.148 779 HB3 ALA 107 HB3 ALA 107 5.017 -1.398 -4.149 780 H LEU 108 HN LEU 108 5.816 -0.374 -2.073 781 HA LEU 108 HA LEU 108 3.840 1.343 -1.005 782 HG LEU 108 HG LEU 108 2.818 0.008 0.791 783 HB2 LEU 108 HB2 LEU 108 4.870 -0.976 -0.184 784 HB3 LEU 108 HB1 LEU 108 5.844 0.103 0.810 785 HD11 LEU 108 HD11 LEU 108 3.012 -1.010 2.970 786 HD12 LEU 108 HD12 LEU 108 4.772 -0.998 2.840 787 HD13 LEU 108 HD13 LEU 108 3.812 -1.995 1.748 788 HD21 LEU 108 HD21 LEU 108 2.990 1.392 2.800 789 HD22 LEU 108 HD22 LEU 108 3.626 2.208 1.371 790 HD23 LEU 108 HD23 LEU 108 4.732 1.512 2.555 791 H ALA 109 HN ALA 109 7.391 1.380 -0.752 792 HA ALA 109 HA ALA 109 7.713 3.437 1.072 793 HB1 ALA 109 HB1 ALA 109 9.537 2.026 0.279 794 HB2 ALA 109 HB2 ALA 109 9.939 3.738 0.129 795 HB3 ALA 109 HB3 ALA 109 9.467 2.814 -1.296 796 H ASN 110 HN ASN 110 7.638 3.720 -2.478 797 HA ASN 110 HA ASN 110 7.989 6.543 -2.438 798 HB2 ASN 110 HB2 ASN 110 8.571 4.887 -4.315 799 HB3 ASN 110 HB1 ASN 110 6.865 4.977 -4.743 800 HD21 ASN 110 HD21 ASN 110 9.895 6.614 -4.713 801 HD22 ASN 110 HD22 ASN 110 9.417 7.992 -5.638 802 H HIS 111 HN HIS 111 5.289 4.337 -2.471 803 HA HIS 111 HA HIS 111 3.293 6.213 -3.197 804 HD1 HIS 111 HD1 HIS 111 1.184 5.098 -4.618 805 HD2 HIS 111 HD2 HIS 111 0.342 4.152 -0.655 806 HE1 HIS 111 HE1 HIS 111 -1.308 5.362 -4.376 807 HE2 HIS 111 HE2 HIS 111 -1.739 5.066 -1.902 808 HB2 HIS 111 HB2 HIS 111 3.060 3.694 -3.268 809 HB3 HIS 111 HB1 HIS 111 2.883 3.740 -1.508 810 H LEU 112 HN LEU 112 4.664 5.161 -0.126 811 HA LEU 112 HA LEU 112 2.960 6.721 1.513 812 HG LEU 112 HG LEU 112 3.723 3.976 2.197 813 HB2 LEU 112 HB2 LEU 112 5.652 5.458 1.884 814 HB3 LEU 112 HB1 LEU 112 5.014 6.558 3.106 815 HD11 LEU 112 HD11 LEU 112 4.288 3.201 4.442 816 HD12 LEU 112 HD12 LEU 112 5.098 4.731 4.773 817 HD13 LEU 112 HD13 LEU 112 5.737 3.647 3.539 818 HD21 LEU 112 HD21 LEU 112 2.908 5.956 4.327 819 HD22 LEU 112 HD22 LEU 112 2.165 4.381 4.042 820 HD23 LEU 112 HD23 LEU 112 2.056 5.641 2.813 821 H ILE 113 HN ILE 113 5.940 7.348 -0.204 822 HA ILE 113 HA ILE 113 6.563 9.856 0.895 823 HB ILE 113 HB ILE 113 7.152 8.633 -1.792 824 HG12 ILE 113 HG12 ILE 113 8.912 9.254 0.588 825 HG13 ILE 113 HG11 ILE 113 8.180 7.683 0.267 826 HG21 ILE 113 HG21 ILE 113 8.763 10.438 -2.161 827 HG22 ILE 113 HG22 ILE 113 8.198 11.241 -0.697 828 HG23 ILE 113 HG23 ILE 113 7.113 11.055 -2.075 829 HD11 ILE 113 HD11 ILE 113 9.462 7.500 -1.787 830 HD12 ILE 113 HD12 ILE 113 10.526 7.778 -0.410 831 HD13 ILE 113 HD13 ILE 113 10.148 9.101 -1.513 832 H LYS 114 HN LYS 114 4.620 8.992 -1.977 833 HA LYS 114 HA LYS 114 3.825 11.723 -2.383 834 HB2 LYS 114 HB2 LYS 114 2.251 10.893 -4.034 835 HB3 LYS 114 HB1 LYS 114 3.817 10.125 -4.239 836 HG2 LYS 114 HG2 LYS 114 3.001 8.111 -3.152 837 HG3 LYS 114 HG1 LYS 114 1.435 8.881 -2.885 838 HD2 LYS 114 HD2 LYS 114 2.640 8.517 -5.616 839 HD3 LYS 114 HD1 LYS 114 1.576 7.326 -4.866 840 HE2 LYS 114 HE2 LYS 114 -0.212 8.948 -4.743 841 HE3 LYS 114 HE1 LYS 114 0.853 10.209 -5.363 842 HZ1 LYS 114 HZ1 LYS 114 1.000 9.107 -7.452 843 HZ2 LYS 114 HZ2 LYS 114 -0.649 9.231 -7.056 844 HZ3 LYS 114 HZ3 LYS 114 0.160 7.745 -6.882 845 H VAL 115 HN VAL 115 2.596 9.108 -0.444 846 HA VAL 115 HA VAL 115 0.029 10.122 0.096 847 HB VAL 115 HB VAL 115 1.842 8.226 1.540 848 HG11 VAL 115 HG11 VAL 115 0.851 9.473 3.365 849 HG12 VAL 115 HG12 VAL 115 0.105 7.878 3.259 850 HG13 VAL 115 HG13 VAL 115 -0.753 9.292 2.650 851 HG21 VAL 115 HG21 VAL 115 0.545 7.384 -0.313 852 HG22 VAL 115 HG22 VAL 115 -0.936 8.032 0.388 853 HG23 VAL 115 HG23 VAL 115 -0.083 6.713 1.193 854 H LYS 116 HN LYS 116 3.114 10.596 1.838 855 HA LYS 116 HA LYS 116 1.978 12.474 3.670 856 HB2 LYS 116 HB2 LYS 116 4.333 13.025 4.227 857 HB3 LYS 116 HB1 LYS 116 3.977 11.303 4.313 858 HG2 LYS 116 HG2 LYS 116 5.028 10.913 2.217 859 HG3 LYS 116 HG1 LYS 116 5.225 12.643 1.938 860 HD2 LYS 116 HD2 LYS 116 6.726 12.748 3.888 861 HD3 LYS 116 HD1 LYS 116 6.576 10.992 4.070 862 HE2 LYS 116 HE2 LYS 116 8.592 11.582 2.817 863 HE3 LYS 116 HE1 LYS 116 7.447 10.680 1.825 864 HZ1 LYS 116 HZ1 LYS 116 7.672 13.638 1.792 865 HZ2 LYS 116 HZ2 LYS 116 6.770 12.670 0.740 866 HZ3 LYS 116 HZ3 LYS 116 8.463 12.622 0.692 867 H LEU 117 HN LEU 117 3.169 12.633 0.456 868 HA LEU 117 HA LEU 117 3.721 15.427 0.378 869 HG LEU 117 HG LEU 117 3.178 16.076 -2.477 870 HB2 LEU 117 HB2 LEU 117 4.553 13.678 -1.249 871 HB3 LEU 117 HB1 LEU 117 2.925 13.650 -1.931 872 HD11 LEU 117 HD11 LEU 117 5.417 17.053 -2.435 873 HD12 LEU 117 HD12 LEU 117 6.041 15.604 -1.645 874 HD13 LEU 117 HD13 LEU 117 4.877 16.633 -0.810 875 HD21 LEU 117 HD21 LEU 117 4.711 15.713 -4.365 876 HD22 LEU 117 HD22 LEU 117 3.569 14.383 -4.169 877 HD23 LEU 117 HD23 LEU 117 5.238 14.198 -3.631 878 H GLU 118 HN GLU 118 0.862 13.481 0.204 879 HA GLU 118 HA GLU 118 -0.897 15.434 -0.855 880 HB2 GLU 118 HB2 GLU 118 -1.483 13.142 1.049 881 HB3 GLU 118 HB1 GLU 118 -2.690 14.071 0.162 882 HG2 GLU 118 HG2 GLU 118 -1.652 13.300 -1.955 883 HG3 GLU 118 HG1 GLU 118 -0.577 12.276 -1.004 884 H GLY 119 HN GLY 119 0.798 15.272 2.058 885 HA2 GLY 119 HA2 GLY 119 0.885 17.178 3.488 886 HA3 GLY 119 HA1 GLY 119 -0.801 17.507 3.102 887 H HIS 120 HN HIS 120 -1.032 14.423 3.397 888 HA HIS 120 HA HIS 120 -1.673 14.566 6.233 889 HD1 HIS 120 HD1 HIS 120 -2.947 11.281 7.043 890 HD2 HIS 120 HD2 HIS 120 -2.261 11.029 2.940 891 HE1 HIS 120 HE1 HIS 120 -2.713 8.827 6.554 892 HE2 HIS 120 HE2 HIS 120 -2.490 8.687 4.043 893 HB2 HIS 120 HB2 HIS 120 -3.511 13.442 5.647 894 HB3 HIS 120 HB1 HIS 120 -2.975 13.469 3.976 895 H GLU 121 HN GLU 121 -0.533 13.574 7.707 896 HA GLU 121 HA GLU 121 1.951 12.368 6.914 897 HB2 GLU 121 HB2 GLU 121 2.495 12.411 9.320 898 HB3 GLU 121 HB1 GLU 121 1.995 13.979 8.704 899 HG2 GLU 121 HG2 GLU 121 -0.295 13.482 9.626 900 HG3 GLU 121 HG1 GLU 121 0.424 12.083 10.422 901 H LEU 122 HN LEU 122 2.647 10.373 7.190 902 HA LEU 122 HA LEU 122 0.846 8.229 7.352 903 HG LEU 122 HG LEU 122 5.010 7.885 6.640 904 HB2 LEU 122 HB2 LEU 122 3.198 6.994 7.893 905 HB3 LEU 122 HB1 LEU 122 2.616 7.376 6.280 906 HD11 LEU 122 HD11 LEU 122 3.774 9.046 4.917 907 HD12 LEU 122 HD12 LEU 122 5.005 10.090 5.628 908 HD13 LEU 122 HD13 LEU 122 3.310 10.295 6.073 909 HD21 LEU 122 HD21 LEU 122 5.637 9.873 7.952 910 HD22 LEU 122 HD22 LEU 122 5.022 8.555 8.946 911 HD23 LEU 122 HD23 LEU 122 3.994 9.944 8.591 912 HA PRO 123 HA PRO 123 0.344 8.130 11.678 913 HB2 PRO 123 HB2 PRO 123 -1.471 6.234 11.834 914 HB3 PRO 123 HB1 PRO 123 -1.800 7.643 10.809 915 HG2 PRO 123 HG2 PRO 123 -0.700 4.952 10.006 916 HG3 PRO 123 HG1 PRO 123 -2.098 5.797 9.321 917 HD2 PRO 123 HD2 PRO 123 0.389 5.938 8.226 918 HD3 PRO 123 HD1 PRO 123 -0.771 7.285 8.133 919 H ALA 124 HN ALA 124 2.237 5.891 10.180 920 HA ALA 124 HA ALA 124 3.448 4.060 10.756 921 HB1 ALA 124 HB1 ALA 124 3.905 3.603 13.136 922 HB2 ALA 124 HB2 ALA 124 2.717 4.826 13.585 923 HB3 ALA 124 HB3 ALA 124 4.178 5.291 12.713 924 H ASP 125 HN ASP 125 0.445 4.170 10.459 925 HA ASP 125 HA ASP 125 -0.218 1.516 11.528 926 HB2 ASP 125 HB2 ASP 125 -1.869 3.310 12.012 927 HB3 ASP 125 HB1 ASP 125 -2.030 3.599 10.279 928 H LEU 126 HN LEU 126 -0.744 -0.090 10.149 929 HA LEU 126 HA LEU 126 -0.299 0.420 7.289 930 HG LEU 126 HG LEU 126 2.204 -0.209 6.878 931 HB2 LEU 126 HB2 LEU 126 1.379 -1.002 8.968 932 HB3 LEU 126 HB1 LEU 126 0.432 -2.253 8.194 933 HD11 LEU 126 HD11 LEU 126 3.369 -2.180 6.030 934 HD12 LEU 126 HD12 LEU 126 2.250 -3.222 6.910 935 HD13 LEU 126 HD13 LEU 126 3.338 -2.150 7.793 936 HD21 LEU 126 HD21 LEU 126 0.329 -2.164 5.551 937 HD22 LEU 126 HD22 LEU 126 1.525 -1.157 4.734 938 HD23 LEU 126 HD23 LEU 126 0.163 -0.406 5.568 939 HA PRO 127 HA PRO 127 -4.318 -1.637 7.504 940 HB2 PRO 127 HB2 PRO 127 -5.049 -0.239 5.114 941 HB3 PRO 127 HB1 PRO 127 -5.558 0.107 6.769 942 HG2 PRO 127 HG2 PRO 127 -3.974 1.751 5.242 943 HG3 PRO 127 HG1 PRO 127 -4.015 1.760 7.016 944 HD2 PRO 127 HD2 PRO 127 -2.059 0.440 5.170 945 HD3 PRO 127 HD1 PRO 127 -1.752 1.332 6.673 946 HA PRO 128 HA PRO 128 -3.804 -4.913 4.568 947 HB2 PRO 128 HB2 PRO 128 -6.720 -4.991 4.209 948 HB3 PRO 128 HB1 PRO 128 -5.635 -6.221 4.874 949 HG2 PRO 128 HG2 PRO 128 -7.355 -4.802 6.389 950 HG3 PRO 128 HG1 PRO 128 -5.807 -5.395 7.006 951 HD2 PRO 128 HD2 PRO 128 -6.609 -2.650 6.181 952 HD3 PRO 128 HD1 PRO 128 -5.495 -3.163 7.464 953 H HIS 129 HN HIS 129 -5.596 -2.080 3.791 954 HA HIS 129 HA HIS 129 -5.717 -2.751 0.960 955 HD1 HIS 129 HD1 HIS 129 -8.393 -0.184 3.809 956 HD2 HIS 129 HD2 HIS 129 -5.086 1.411 1.858 957 HE1 HIS 129 HE1 HIS 129 -7.878 1.975 4.994 958 HE2 HIS 129 HE2 HIS 129 -6.041 3.038 3.629 959 HB2 HIS 129 HB2 HIS 129 -6.945 -0.671 0.642 960 HB3 HIS 129 HB1 HIS 129 -7.674 -1.606 1.935 961 H LEU 130 HN LEU 130 -3.315 -2.104 2.755 962 HA LEU 130 HA LEU 130 -1.866 -0.734 0.621 963 HG LEU 130 HG LEU 130 -0.861 1.262 0.707 964 HB2 LEU 130 HB2 LEU 130 -2.608 0.565 2.966 965 HB3 LEU 130 HB1 LEU 130 -0.908 0.214 3.177 966 HD11 LEU 130 HD11 LEU 130 -2.323 3.190 0.577 967 HD12 LEU 130 HD12 LEU 130 -3.095 2.730 2.094 968 HD13 LEU 130 HD13 LEU 130 -3.268 1.704 0.669 969 HD21 LEU 130 HD21 LEU 130 -0.070 3.299 1.706 970 HD22 LEU 130 HD22 LEU 130 0.488 1.915 2.644 971 HD23 LEU 130 HD23 LEU 130 -0.858 2.891 3.232 972 H VAL 131 HN VAL 131 -2.171 -3.418 2.041 973 HA VAL 131 HA VAL 131 0.530 -3.688 3.106 974 HB VAL 131 HB VAL 131 -1.415 -4.495 4.466 975 HG11 VAL 131 HG11 VAL 131 -2.394 -6.673 3.942 976 HG12 VAL 131 HG12 VAL 131 -1.566 -6.661 2.381 977 HG13 VAL 131 HG13 VAL 131 -2.804 -5.449 2.738 978 HG21 VAL 131 HG21 VAL 131 0.687 -6.498 3.709 979 HG22 VAL 131 HG22 VAL 131 -0.313 -6.563 5.163 980 HG23 VAL 131 HG23 VAL 131 0.817 -5.229 4.925 981 HA PRO 132 HA PRO 132 1.669 -5.242 -0.890 982 HB2 PRO 132 HB2 PRO 132 4.121 -6.183 0.419 983 HB3 PRO 132 HB1 PRO 132 3.919 -4.989 -0.859 984 HG2 PRO 132 HG2 PRO 132 4.601 -4.375 1.708 985 HG3 PRO 132 HG1 PRO 132 3.786 -3.261 0.597 986 HD2 PRO 132 HD2 PRO 132 2.707 -4.765 2.905 987 HD3 PRO 132 HD1 PRO 132 2.172 -3.225 2.194 988 HA PRO 133 HA PRO 133 0.252 -9.375 0.177 989 HB2 PRO 133 HB2 PRO 133 -0.359 -10.206 -2.325 990 HB3 PRO 133 HB1 PRO 133 -1.359 -9.061 -1.417 991 HG2 PRO 133 HG2 PRO 133 0.680 -8.519 -3.552 992 HG3 PRO 133 HG1 PRO 133 -0.938 -7.815 -3.337 993 HD2 PRO 133 HD2 PRO 133 1.328 -6.535 -2.572 994 HD3 PRO 133 HD1 PRO 133 -0.227 -6.335 -1.725 995 H SER 134 HN SER 134 3.022 -8.753 -1.865 996 HA SER 134 HA SER 134 3.579 -11.539 -2.360 997 HG SER 134 HG SER 134 3.820 -8.881 -4.177 998 HB2 SER 134 HB2 SER 134 5.341 -9.098 -2.662 999 HB3 SER 134 HB1 SER 134 5.736 -10.715 -3.247 1000 H LYS 135 HN LYS 135 3.885 -9.571 0.318 1001 HA LYS 135 HA LYS 135 5.913 -11.358 1.507 1002 HB2 LYS 135 HB2 LYS 135 5.702 -9.332 3.339 1003 HB3 LYS 135 HB1 LYS 135 6.899 -9.400 2.053 1004 HG2 LYS 135 HG2 LYS 135 4.240 -8.009 1.809 1005 HG3 LYS 135 HG1 LYS 135 5.746 -7.222 2.301 1006 HD2 LYS 135 HD2 LYS 135 5.992 -8.767 -0.162 1007 HD3 LYS 135 HD1 LYS 135 4.814 -7.459 -0.263 1008 HE2 LYS 135 HE2 LYS 135 7.014 -6.784 -0.969 1009 HE3 LYS 135 HE1 LYS 135 6.479 -5.864 0.428 1010 HZ1 LYS 135 HZ1 LYS 135 8.028 -8.207 1.084 1011 HZ2 LYS 135 HZ2 LYS 135 8.184 -6.623 1.650 1012 HZ3 LYS 135 HZ3 LYS 135 8.882 -7.071 0.169 1013 H ARG 136 HN ARG 136 2.725 -10.620 1.288 1014 HA ARG 136 HA ARG 136 2.067 -11.771 3.916 1015 HE ARG 136 HE ARG 136 0.180 -9.548 5.670 1016 HB2 ARG 136 HB2 ARG 136 0.083 -10.888 1.818 1017 HB3 ARG 136 HB1 ARG 136 -0.205 -11.165 3.530 1018 HG2 ARG 136 HG2 ARG 136 1.181 -8.869 2.208 1019 HG3 ARG 136 HG1 ARG 136 -0.202 -8.850 3.295 1020 HD2 ARG 136 HD2 ARG 136 2.622 -9.568 4.049 1021 HD3 ARG 136 HD1 ARG 136 1.839 -8.023 4.361 1022 HH11 ARG 136 HH11 ARG 136 3.648 -9.965 5.429 1023 HH12 ARG 136 HH12 ARG 136 3.820 -10.622 7.026 1024 HH21 ARG 136 HH21 ARG 136 0.404 -10.357 7.810 1025 HH22 ARG 136 HH22 ARG 136 1.983 -10.829 8.388 1026 H ARG 137 HN ARG 137 2.164 -13.881 4.022 1027 HA ARG 137 HA ARG 137 0.496 -15.424 2.233 1028 HE ARG 137 HE ARG 137 5.817 -15.769 0.391 1029 HB2 ARG 137 HB2 ARG 137 2.328 -17.202 2.026 1030 HB3 ARG 137 HB1 ARG 137 2.465 -15.784 0.998 1031 HG2 ARG 137 HG2 ARG 137 3.848 -15.628 3.591 1032 HG3 ARG 137 HG1 ARG 137 4.488 -16.799 2.437 1033 HD2 ARG 137 HD2 ARG 137 3.910 -13.939 1.700 1034 HD3 ARG 137 HD1 ARG 137 5.465 -14.456 2.348 1035 HH11 ARG 137 HH11 ARG 137 2.905 -13.804 0.222 1036 HH12 ARG 137 HH12 ARG 137 2.889 -13.757 -1.508 1037 HH21 ARG 137 HH21 ARG 137 5.821 -15.680 -1.884 1038 HH22 ARG 137 HH22 ARG 137 4.547 -14.846 -2.715 1039 H HIS 138 HN HIS 138 -0.261 -17.290 3.135 1040 HA HIS 138 HA HIS 138 -0.064 -17.336 6.039 1041 HD1 HIS 138 HD1 HIS 138 -1.814 -20.807 6.210 1042 HD2 HIS 138 HD2 HIS 138 -3.259 -17.085 7.375 1043 HE1 HIS 138 HE1 HIS 138 -2.944 -21.184 8.417 1044 HE2 HIS 138 HE2 HIS 138 -4.016 -18.969 8.980 1045 HB2 HIS 138 HB2 HIS 138 -2.282 -17.312 4.822 1046 HB3 HIS 138 HB1 HIS 138 -1.922 -18.951 4.289 1047 H GLU 139 HN GLU 139 1.179 -18.744 7.064 1048 HA GLU 139 HA GLU 139 2.135 -21.111 5.676 1049 HB2 GLU 139 HB2 GLU 139 3.481 -21.453 7.779 1050 HB3 GLU 139 HB1 GLU 139 3.828 -19.963 6.921 1051 HG2 GLU 139 HG2 GLU 139 2.331 -18.775 8.513 1052 HG3 GLU 139 HG1 GLU 139 2.182 -20.280 9.413 Start of MODEL 6 1 H1 GLY 1 HT1 GLY 1 21.414 15.980 -32.040 2 H2 GLY 1 HT2 GLY 1 21.858 16.666 -33.526 3 H3 GLY 1 HT3 GLY 1 20.281 16.093 -33.294 4 HA2 GLY 1 HA1 GLY 1 21.456 18.315 -31.731 5 HA3 GLY 1 HA2 GLY 1 20.496 18.551 -33.186 6 HA PRO 2 HA PRO 2 17.515 18.296 -29.629 7 HB2 PRO 2 HB2 PRO 2 16.711 20.998 -30.298 8 HB3 PRO 2 HB1 PRO 2 17.353 20.384 -28.772 9 HG2 PRO 2 HG2 PRO 2 18.723 22.099 -30.385 10 HG3 PRO 2 HG1 PRO 2 19.517 20.923 -29.323 11 HD2 PRO 2 HD2 PRO 2 18.978 20.750 -32.268 12 HD3 PRO 2 HD1 PRO 2 20.441 20.299 -31.361 13 H LEU 3 HN LEU 3 17.140 20.092 -32.670 14 HA LEU 3 HA LEU 3 14.438 19.013 -32.974 15 HG LEU 3 HG LEU 3 13.549 21.340 -32.587 16 HB2 LEU 3 HB2 LEU 3 15.897 21.194 -34.470 17 HB3 LEU 3 HB1 LEU 3 14.303 20.622 -34.903 18 HD11 LEU 3 HD11 LEU 3 16.196 22.774 -32.636 19 HD12 LEU 3 HD12 LEU 3 15.729 21.483 -31.530 20 HD13 LEU 3 HD13 LEU 3 14.899 23.037 -31.470 21 HD21 LEU 3 HD21 LEU 3 12.974 22.607 -34.560 22 HD22 LEU 3 HD22 LEU 3 14.538 23.420 -34.531 23 HD23 LEU 3 HD23 LEU 3 13.370 23.709 -33.242 24 H GLY 4 HN GLY 4 13.900 17.626 -34.613 25 HA2 GLY 4 HA2 GLY 4 14.137 16.544 -36.676 26 HA3 GLY 4 HA1 GLY 4 15.760 17.200 -36.809 27 H SER 5 HN SER 5 16.423 16.243 -34.072 28 HA SER 5 HA SER 5 17.120 13.526 -34.836 29 HG SER 5 HG SER 5 18.863 15.053 -35.029 30 HB2 SER 5 HB2 SER 5 17.963 15.124 -32.401 31 HB3 SER 5 HB1 SER 5 18.668 13.604 -32.954 32 H GLU 6 HN GLU 6 15.869 11.912 -34.280 33 HA GLU 6 HA GLU 6 13.743 12.142 -32.405 34 HB2 GLU 6 HB2 GLU 6 14.946 9.764 -33.829 35 HB3 GLU 6 HB1 GLU 6 13.523 9.666 -32.806 36 HG2 GLU 6 HG2 GLU 6 13.715 11.418 -35.241 37 HG3 GLU 6 HG1 GLU 6 13.051 9.784 -35.242 38 H SER 7 HN SER 7 13.741 11.748 -30.278 39 HA SER 7 HA SER 7 16.128 10.982 -28.917 40 HG SER 7 HG SER 7 13.984 13.430 -27.915 41 HB2 SER 7 HB2 SER 7 13.619 10.815 -27.402 42 HB3 SER 7 HB1 SER 7 15.048 11.807 -27.104 43 H LEU 8 HN LEU 8 16.773 8.927 -29.340 44 HA LEU 8 HA LEU 8 14.836 6.799 -29.590 45 HG LEU 8 HG LEU 8 16.831 4.472 -29.178 46 HB2 LEU 8 HB2 LEU 8 16.825 6.862 -31.033 47 HB3 LEU 8 HB1 LEU 8 17.853 6.702 -29.619 48 HD11 LEU 8 HD11 LEU 8 14.699 4.822 -30.289 49 HD12 LEU 8 HD12 LEU 8 15.522 3.407 -30.948 50 HD13 LEU 8 HD13 LEU 8 15.514 4.922 -31.849 51 HD21 LEU 8 HD21 LEU 8 18.068 4.788 -31.910 52 HD22 LEU 8 HD22 LEU 8 17.982 3.293 -30.978 53 HD23 LEU 8 HD23 LEU 8 18.947 4.646 -30.386 54 H MET 9 HN MET 9 14.123 5.606 -27.980 55 HA MET 9 HA MET 9 15.591 5.496 -25.463 56 HB2 MET 9 HB2 MET 9 13.561 4.310 -24.618 57 HB3 MET 9 HB1 MET 9 13.238 5.927 -25.222 58 HG2 MET 9 HG2 MET 9 12.449 4.918 -27.347 59 HG3 MET 9 HG1 MET 9 12.661 3.329 -26.619 60 HE1 MET 9 HE1 MET 9 8.753 3.785 -26.721 61 HE2 MET 9 HE2 MET 9 10.116 2.792 -27.238 62 HE3 MET 9 HE3 MET 9 9.902 4.413 -27.899 63 HA PRO 10 HA PRO 10 17.675 1.808 -26.632 64 HB2 PRO 10 HB2 PRO 10 17.553 1.188 -23.727 65 HB3 PRO 10 HB1 PRO 10 18.950 1.271 -24.806 66 HG2 PRO 10 HG2 PRO 10 18.473 3.214 -23.048 67 HG3 PRO 10 HG1 PRO 10 19.084 3.581 -24.675 68 HD2 PRO 10 HD2 PRO 10 16.319 3.871 -23.576 69 HD3 PRO 10 HD1 PRO 10 17.200 4.920 -24.704 70 H SER 11 HN SER 11 15.053 1.541 -24.253 71 HA SER 11 HA SER 11 14.533 -1.198 -25.031 72 HG SER 11 HG SER 11 14.265 1.142 -22.259 73 HB2 SER 11 HB2 SER 11 12.567 -0.794 -23.345 74 HB3 SER 11 HB1 SER 11 14.217 -0.945 -22.740 75 H GLN 12 HN GLN 12 13.862 -1.072 -27.148 76 HA GLN 12 HA GLN 12 11.211 0.131 -27.550 77 HB2 GLN 12 HB2 GLN 12 12.887 1.614 -28.593 78 HB3 GLN 12 HB1 GLN 12 13.492 0.258 -29.536 79 HG2 GLN 12 HG2 GLN 12 11.227 0.054 -30.559 80 HG3 GLN 12 HG1 GLN 12 10.775 1.537 -29.724 81 HE21 GLN 12 HE21 GLN 12 10.385 2.597 -31.661 82 HE22 GLN 12 HE22 GLN 12 11.659 3.120 -32.702 83 H VAL 13 HN VAL 13 10.060 -1.704 -27.573 84 HA VAL 13 HA VAL 13 10.587 -3.526 -29.807 85 HB VAL 13 HB VAL 13 9.597 -5.393 -28.381 86 HG11 VAL 13 HG11 VAL 13 12.259 -4.267 -27.519 87 HG12 VAL 13 HG12 VAL 13 11.977 -5.256 -28.950 88 HG13 VAL 13 HG13 VAL 13 11.729 -5.940 -27.342 89 HG21 VAL 13 HG21 VAL 13 10.258 -3.464 -26.156 90 HG22 VAL 13 HG22 VAL 13 9.843 -5.163 -25.941 91 HG23 VAL 13 HG23 VAL 13 8.651 -4.042 -26.596 92 H VAL 14 HN VAL 14 8.937 -3.573 -31.168 93 HA VAL 14 HA VAL 14 6.504 -2.198 -30.439 94 HB VAL 14 HB VAL 14 7.199 -3.524 -33.061 95 HG11 VAL 14 HG11 VAL 14 5.097 -1.467 -32.377 96 HG12 VAL 14 HG12 VAL 14 4.803 -3.157 -32.785 97 HG13 VAL 14 HG13 VAL 14 5.466 -2.059 -33.996 98 HG21 VAL 14 HG21 VAL 14 7.533 -0.656 -32.188 99 HG22 VAL 14 HG22 VAL 14 7.777 -1.263 -33.825 100 HG23 VAL 14 HG23 VAL 14 8.829 -1.809 -32.519 101 H LYS 15 HN LYS 15 5.384 -3.446 -29.030 102 HA LYS 15 HA LYS 15 4.551 -6.106 -29.917 103 HB2 LYS 15 HB2 LYS 15 3.531 -6.257 -27.609 104 HB3 LYS 15 HB1 LYS 15 5.281 -6.118 -27.645 105 HG2 LYS 15 HG2 LYS 15 5.070 -3.708 -27.144 106 HG3 LYS 15 HG1 LYS 15 3.323 -3.915 -27.021 107 HD2 LYS 15 HD2 LYS 15 3.653 -5.524 -25.196 108 HD3 LYS 15 HD1 LYS 15 5.396 -5.291 -25.313 109 HE2 LYS 15 HE2 LYS 15 5.056 -2.886 -24.813 110 HE3 LYS 15 HE1 LYS 15 3.339 -3.215 -24.580 111 HZ1 LYS 15 HZ1 LYS 15 4.460 -3.197 -22.470 112 HZ2 LYS 15 HZ2 LYS 15 5.577 -4.359 -23.003 113 HZ3 LYS 15 HZ3 LYS 15 3.947 -4.778 -22.812 114 H GLY 16 HN GLY 16 3.258 -5.285 -31.636 115 HA2 GLY 16 HA2 GLY 16 0.853 -3.808 -30.796 116 HA3 GLY 16 HA1 GLY 16 1.495 -3.849 -32.431 117 H GLY 17 HN GLY 17 -0.736 -5.163 -30.278 118 HA2 GLY 17 HA2 GLY 17 -2.436 -6.673 -30.623 119 HA3 GLY 17 HA1 GLY 17 -1.975 -6.706 -32.316 120 H ALA 18 HN ALA 18 0.371 -7.533 -29.889 121 HA ALA 18 HA ALA 18 0.099 -10.367 -30.654 122 HB1 ALA 18 HB1 ALA 18 2.648 -8.851 -30.114 123 HB2 ALA 18 HB2 ALA 18 2.055 -9.344 -31.700 124 HB3 ALA 18 HB3 ALA 18 2.522 -10.564 -30.516 125 H PHE 19 HN PHE 19 -0.830 -11.278 -28.934 126 HA PHE 19 HA PHE 19 0.324 -10.724 -26.288 127 HD1 PHE 19 HD1 PHE 19 -1.329 -9.393 -24.528 128 HD2 PHE 19 HD2 PHE 19 -3.446 -10.194 -28.133 129 HE1 PHE 19 HE1 PHE 19 -2.306 -7.132 -24.456 130 HE2 PHE 19 HE2 PHE 19 -4.425 -7.940 -28.071 131 HZ PHE 19 HZ PHE 19 -3.824 -6.391 -26.251 132 HB2 PHE 19 HB2 PHE 19 -2.355 -11.936 -27.002 133 HB3 PHE 19 HB1 PHE 19 -1.753 -11.723 -25.365 134 H ASP 20 HN ASP 20 2.095 -12.073 -26.483 135 HA ASP 20 HA ASP 20 1.476 -14.940 -26.713 136 HB2 ASP 20 HB2 ASP 20 3.889 -13.389 -27.637 137 HB3 ASP 20 HB1 ASP 20 3.942 -15.133 -27.398 138 H GLY 21 HN GLY 21 1.516 -15.837 -24.774 139 HA2 GLY 21 HA2 GLY 21 3.656 -15.033 -22.907 140 HA3 GLY 21 HA1 GLY 21 2.124 -15.753 -22.418 141 H THR 22 HN THR 22 4.907 -16.457 -24.510 142 HA THR 22 HA THR 22 4.745 -19.242 -23.591 143 HB THR 22 HB THR 22 4.097 -19.187 -25.918 144 HG1 THR 22 HG1 THR 22 5.713 -20.582 -26.739 145 HG21 THR 22 HG21 THR 22 6.709 -17.760 -26.427 146 HG22 THR 22 HG22 THR 22 5.092 -17.074 -26.593 147 HG23 THR 22 HG23 THR 22 5.622 -18.365 -27.674 148 H MET 23 HN MET 23 6.511 -20.050 -22.676 149 HA MET 23 HA MET 23 8.974 -18.458 -22.787 150 HB2 MET 23 HB2 MET 23 7.989 -20.414 -20.713 151 HB3 MET 23 HB1 MET 23 9.599 -19.707 -20.708 152 HG2 MET 23 HG2 MET 23 8.655 -17.496 -20.450 153 HG3 MET 23 HG1 MET 23 7.026 -18.161 -20.545 154 HE1 MET 23 HE1 MET 23 8.254 -16.267 -18.177 155 HE2 MET 23 HE2 MET 23 7.494 -17.016 -16.775 156 HE3 MET 23 HE3 MET 23 6.564 -16.764 -18.254 157 H ASN 24 HN ASN 24 9.941 -19.261 -24.572 158 HA ASN 24 HA ASN 24 10.582 -22.132 -24.536 159 HB2 ASN 24 HB2 ASN 24 9.285 -21.561 -26.517 160 HB3 ASN 24 HB1 ASN 24 10.397 -20.254 -26.902 161 HD21 ASN 24 HD21 ASN 24 10.055 -23.735 -26.657 162 HD22 ASN 24 HD22 ASN 24 11.353 -24.124 -27.741 163 H GLY 25 HN GLY 25 12.694 -22.745 -24.746 164 HA2 GLY 25 HA2 GLY 25 14.999 -22.097 -25.359 165 HA3 GLY 25 HA1 GLY 25 14.676 -20.568 -24.563 166 HA PRO 26 HA PRO 26 15.613 -22.850 -20.640 167 HB2 PRO 26 HB2 PRO 26 12.859 -23.379 -19.737 168 HB3 PRO 26 HB1 PRO 26 14.142 -22.460 -18.941 169 HG2 PRO 26 HG2 PRO 26 12.001 -21.240 -20.008 170 HG3 PRO 26 HG1 PRO 26 13.612 -20.503 -20.059 171 HD2 PRO 26 HD2 PRO 26 12.140 -21.975 -22.213 172 HD3 PRO 26 HD1 PRO 26 13.087 -20.474 -22.320 173 H PHE 27 HN PHE 27 16.399 -24.690 -21.627 174 HA PHE 27 HA PHE 27 14.617 -26.671 -22.706 175 HD1 PHE 27 HD2 PHE 27 14.960 -26.730 -25.043 176 HD2 PHE 27 HD1 PHE 27 18.632 -25.057 -23.698 177 HE1 PHE 27 HE2 PHE 27 15.054 -25.319 -27.059 178 HE2 PHE 27 HE1 PHE 27 18.736 -23.647 -25.712 179 HZ PHE 27 HZ PHE 27 16.943 -23.777 -27.397 180 HB2 PHE 27 HB2 PHE 27 17.629 -26.663 -22.431 181 HB3 PHE 27 HB1 PHE 27 16.701 -27.876 -23.308 182 H GLY 28 HN GLY 28 13.631 -28.099 -21.497 183 HA2 GLY 28 HA2 GLY 28 14.938 -30.056 -20.018 184 HA3 GLY 28 HA1 GLY 28 14.408 -28.827 -18.874 185 H HIS 29 HN HIS 29 13.575 -31.720 -19.890 186 HA HIS 29 HA HIS 29 10.798 -31.314 -20.483 187 HD1 HIS 29 HD1 HIS 29 14.150 -34.431 -20.533 188 HD2 HIS 29 HD2 HIS 29 11.030 -34.828 -17.807 189 HE1 HIS 29 HE1 HIS 29 14.975 -36.032 -18.779 190 HE2 HIS 29 HE2 HIS 29 13.002 -36.408 -17.258 191 HB2 HIS 29 HB2 HIS 29 10.562 -33.716 -20.441 192 HB3 HIS 29 HB1 HIS 29 12.031 -33.310 -21.310 193 H GLY 30 HN GLY 30 9.035 -31.512 -19.134 194 HA2 GLY 30 HA2 GLY 30 8.816 -32.522 -16.628 195 HA3 GLY 30 HA1 GLY 30 9.601 -30.971 -16.361 196 H TYR 31 HN TYR 31 7.370 -31.122 -15.118 197 HA TYR 31 HA TYR 31 5.538 -29.467 -16.677 198 HD1 TYR 31 HD2 TYR 31 4.122 -31.592 -13.215 199 HD2 TYR 31 HD1 TYR 31 5.567 -33.560 -16.706 200 HE1 TYR 31 HE2 TYR 31 4.578 -33.611 -11.886 201 HE2 TYR 31 HE1 TYR 31 6.019 -35.581 -15.381 202 HH TYR 31 HH TYR 31 4.778 -36.071 -12.296 203 HB2 TYR 31 HB2 TYR 31 3.613 -30.736 -15.498 204 HB3 TYR 31 HB1 TYR 31 4.374 -31.475 -16.901 205 H GLY 32 HN GLY 32 4.453 -27.907 -15.481 206 HA2 GLY 32 HA2 GLY 32 5.093 -27.841 -12.600 207 HA3 GLY 32 HA1 GLY 32 5.208 -26.403 -13.605 208 H GLU 33 HN GLU 33 3.084 -28.634 -12.006 209 HA GLU 33 HA GLU 33 0.667 -27.406 -12.925 210 HB2 GLU 33 HB2 GLU 33 0.869 -28.986 -10.375 211 HB3 GLU 33 HB1 GLU 33 -0.483 -28.864 -11.488 212 HG2 GLU 33 HG2 GLU 33 0.233 -30.938 -12.030 213 HG3 GLU 33 HG1 GLU 33 1.250 -30.010 -13.133 214 H GLY 34 HN GLY 34 -0.169 -25.545 -12.263 215 HA2 GLY 34 HA2 GLY 34 0.961 -24.212 -9.937 216 HA3 GLY 34 HA1 GLY 34 -0.149 -23.508 -11.105 217 H ALA 35 HN ALA 35 0.167 -24.639 -8.003 218 HA ALA 35 HA ALA 35 -2.537 -25.555 -7.641 219 HB1 ALA 35 HB1 ALA 35 -2.007 -25.521 -5.246 220 HB2 ALA 35 HB2 ALA 35 -0.473 -24.725 -5.601 221 HB3 ALA 35 HB3 ALA 35 -0.771 -26.365 -6.177 222 H GLY 36 HN GLY 36 -4.247 -24.274 -7.639 223 HA2 GLY 36 HA2 GLY 36 -3.852 -21.454 -6.871 224 HA3 GLY 36 HA1 GLY 36 -4.977 -21.968 -8.116 225 H GLU 37 HN GLU 37 -4.500 -21.410 -4.781 226 HA GLU 37 HA GLU 37 -7.175 -22.386 -4.165 227 HB2 GLU 37 HB2 GLU 37 -6.564 -21.853 -1.822 228 HB3 GLU 37 HB1 GLU 37 -5.483 -23.023 -2.556 229 HG2 GLU 37 HG2 GLU 37 -3.790 -21.359 -2.850 230 HG3 GLU 37 HG1 GLU 37 -4.889 -20.085 -2.326 231 H GLY 38 HN GLY 38 -8.147 -20.695 -2.350 232 HA2 GLY 38 HA2 GLY 38 -8.614 -18.276 -3.858 233 HA3 GLY 38 HA1 GLY 38 -9.318 -18.666 -2.301 234 H ILE 39 HN ILE 39 -6.237 -17.846 -3.783 235 HA ILE 39 HA ILE 39 -5.020 -16.735 -1.523 236 HB ILE 39 HB ILE 39 -3.701 -15.382 -3.203 237 HG12 ILE 39 HG12 ILE 39 -5.593 -16.796 -5.088 238 HG13 ILE 39 HG11 ILE 39 -5.243 -15.074 -4.987 239 HG21 ILE 39 HG21 ILE 39 -2.884 -17.508 -2.429 240 HG22 ILE 39 HG22 ILE 39 -2.571 -17.372 -4.159 241 HG23 ILE 39 HG23 ILE 39 -3.907 -18.367 -3.581 242 HD11 ILE 39 HD11 ILE 39 -4.229 -16.007 -6.953 243 HD12 ILE 39 HD12 ILE 39 -3.405 -17.233 -5.991 244 HD13 ILE 39 HD13 ILE 39 -2.967 -15.532 -5.814 245 H ASP 40 HN ASP 40 -4.839 -14.518 -0.884 246 HA ASP 40 HA ASP 40 -7.396 -13.237 -0.982 247 HB2 ASP 40 HB2 ASP 40 -5.789 -13.265 1.016 248 HB3 ASP 40 HB1 ASP 40 -4.884 -12.017 0.165 249 H ASP 41 HN ASP 41 -7.507 -12.942 -3.266 250 HA ASP 41 HA ASP 41 -5.735 -11.061 -4.530 251 HB2 ASP 41 HB2 ASP 41 -7.269 -11.154 -6.446 252 HB3 ASP 41 HB1 ASP 41 -6.861 -12.766 -5.877 253 H VAL 42 HN VAL 42 -5.676 -9.147 -3.554 254 HA VAL 42 HA VAL 42 -8.177 -7.592 -3.566 255 HB VAL 42 HB VAL 42 -7.463 -8.013 -1.266 256 HG11 VAL 42 HG11 VAL 42 -4.883 -6.640 -2.010 257 HG12 VAL 42 HG12 VAL 42 -5.073 -8.361 -1.668 258 HG13 VAL 42 HG13 VAL 42 -5.350 -7.173 -0.394 259 HG21 VAL 42 HG21 VAL 42 -7.317 -5.696 -0.470 260 HG22 VAL 42 HG22 VAL 42 -8.545 -5.893 -1.720 261 HG23 VAL 42 HG23 VAL 42 -6.990 -5.161 -2.118 262 H GLU 43 HN GLU 43 -8.081 -5.535 -4.469 263 HA GLU 43 HA GLU 43 -5.562 -4.891 -5.805 264 HB2 GLU 43 HB2 GLU 43 -7.616 -4.922 -7.206 265 HB3 GLU 43 HB1 GLU 43 -8.271 -3.611 -6.230 266 HG2 GLU 43 HG2 GLU 43 -6.276 -2.248 -6.865 267 HG3 GLU 43 HG1 GLU 43 -5.828 -3.531 -7.983 268 H TRP 44 HN TRP 44 -4.394 -4.048 -4.154 269 HA TRP 44 HA TRP 44 -5.321 -1.836 -2.594 270 HD1 TRP 44 HD1 TRP 44 -3.651 0.281 -1.807 271 HE1 TRP 44 HE1 TRP 44 -1.502 1.439 -0.987 272 HE3 TRP 44 HE3 TRP 44 -0.585 -3.709 -1.728 273 HZ2 TRP 44 HZ2 TRP 44 1.186 0.689 -0.390 274 HZ3 TRP 44 HZ3 TRP 44 1.751 -3.450 -1.078 275 HH2 TRP 44 HH2 TRP 44 2.621 -1.288 -0.392 276 HB2 TRP 44 HB2 TRP 44 -3.698 -3.116 -1.508 277 HB3 TRP 44 HB1 TRP 44 -2.710 -3.272 -2.960 278 H VAL 45 HN VAL 45 -4.919 0.253 -2.856 279 HA VAL 45 HA VAL 45 -4.956 1.557 -5.233 280 HB VAL 45 HB VAL 45 -3.589 2.672 -2.789 281 HG11 VAL 45 HG11 VAL 45 -3.520 4.131 -4.728 282 HG12 VAL 45 HG12 VAL 45 -4.601 4.790 -3.500 283 HG13 VAL 45 HG13 VAL 45 -5.269 3.989 -4.920 284 HG21 VAL 45 HG21 VAL 45 -6.521 2.226 -3.288 285 HG22 VAL 45 HG22 VAL 45 -5.917 3.406 -2.126 286 HG23 VAL 45 HG23 VAL 45 -5.550 1.696 -1.911 287 H VAL 46 HN VAL 46 -2.142 0.008 -3.974 288 HA VAL 46 HA VAL 46 -0.358 1.723 -5.489 289 HB VAL 46 HB VAL 46 0.047 -0.453 -3.472 290 HG11 VAL 46 HG11 VAL 46 2.148 0.196 -5.543 291 HG12 VAL 46 HG12 VAL 46 1.301 -1.342 -5.378 292 HG13 VAL 46 HG13 VAL 46 2.371 -0.783 -4.092 293 HG21 VAL 46 HG21 VAL 46 1.732 1.123 -2.684 294 HG22 VAL 46 HG22 VAL 46 0.188 1.940 -2.933 295 HG23 VAL 46 HG23 VAL 46 1.485 2.128 -4.113 296 H GLY 47 HN GLY 47 -2.006 -1.294 -5.933 297 HA2 GLY 47 HA2 GLY 47 -0.330 -2.415 -7.909 298 HA3 GLY 47 HA1 GLY 47 -2.049 -2.738 -7.725 299 H LYS 48 HN LYS 48 -2.155 0.417 -8.024 300 HA LYS 48 HA LYS 48 -2.459 0.288 -10.924 301 HB2 LYS 48 HB2 LYS 48 -3.791 2.416 -10.525 302 HB3 LYS 48 HB1 LYS 48 -4.493 0.914 -9.951 303 HG2 LYS 48 HG2 LYS 48 -3.598 1.492 -7.687 304 HG3 LYS 48 HG1 LYS 48 -3.146 3.063 -8.346 305 HD2 LYS 48 HD2 LYS 48 -5.226 3.393 -7.294 306 HD3 LYS 48 HD1 LYS 48 -5.581 3.320 -9.020 307 HE2 LYS 48 HE2 LYS 48 -5.784 0.909 -7.238 308 HE3 LYS 48 HE1 LYS 48 -7.121 2.037 -7.436 309 HZ1 LYS 48 HZ1 LYS 48 -5.823 0.516 -9.627 310 HZ2 LYS 48 HZ2 LYS 48 -7.136 1.572 -9.800 311 HZ3 LYS 48 HZ3 LYS 48 -7.312 0.130 -8.915 312 H ASP 49 HN ASP 49 -0.637 1.908 -8.430 313 HA ASP 49 HA ASP 49 0.435 3.752 -10.469 314 HB2 ASP 49 HB2 ASP 49 -0.807 4.836 -8.567 315 HB3 ASP 49 HB1 ASP 49 0.421 4.207 -7.473 316 H LYS 50 HN LYS 50 1.159 0.962 -9.089 317 HA LYS 50 HA LYS 50 3.698 1.156 -8.024 318 HB2 LYS 50 HB2 LYS 50 2.440 -0.960 -7.995 319 HB3 LYS 50 HB1 LYS 50 2.643 -1.106 -9.741 320 HG2 LYS 50 HG2 LYS 50 5.155 -0.976 -9.279 321 HG3 LYS 50 HG1 LYS 50 4.732 -1.270 -7.594 322 HD2 LYS 50 HD2 LYS 50 3.812 -3.393 -8.115 323 HD3 LYS 50 HD1 LYS 50 3.888 -3.071 -9.852 324 HE2 LYS 50 HE2 LYS 50 6.341 -2.966 -9.707 325 HE3 LYS 50 HE1 LYS 50 6.248 -3.326 -7.986 326 HZ1 LYS 50 HZ1 LYS 50 6.759 -5.252 -9.447 327 HZ2 LYS 50 HZ2 LYS 50 5.193 -5.133 -10.078 328 HZ3 LYS 50 HZ3 LYS 50 5.421 -5.471 -8.429 329 HA PRO 51 HA PRO 51 5.208 0.576 -12.779 330 HB2 PRO 51 HB2 PRO 51 3.778 2.671 -14.074 331 HB3 PRO 51 HB1 PRO 51 3.741 0.940 -14.432 332 HG2 PRO 51 HG2 PRO 51 1.860 2.574 -12.828 333 HG3 PRO 51 HG1 PRO 51 1.562 1.093 -13.753 334 HD2 PRO 51 HD2 PRO 51 1.641 1.083 -11.079 335 HD3 PRO 51 HD1 PRO 51 2.283 -0.277 -12.030 336 H THR 52 HN THR 52 4.146 3.441 -11.051 337 HA THR 52 HA THR 52 6.134 5.188 -12.129 338 HB THR 52 HB THR 52 4.537 5.466 -9.570 339 HG1 THR 52 HG1 THR 52 2.863 6.016 -10.775 340 HG21 THR 52 HG21 THR 52 4.872 7.865 -9.891 341 HG22 THR 52 HG22 THR 52 5.839 7.546 -11.331 342 HG23 THR 52 HG23 THR 52 6.418 7.025 -9.747 343 H TYR 53 HN TYR 53 5.758 3.241 -9.216 344 HA TYR 53 HA TYR 53 8.197 4.278 -8.030 345 HD1 TYR 53 HD2 TYR 53 6.406 5.546 -6.747 346 HD2 TYR 53 HD1 TYR 53 4.615 1.710 -6.390 347 HE1 TYR 53 HE2 TYR 53 4.265 6.598 -6.144 348 HE2 TYR 53 HE1 TYR 53 2.479 2.752 -5.800 349 HH TYR 53 HH TYR 53 1.745 5.872 -6.327 350 HB2 TYR 53 HB2 TYR 53 6.771 1.835 -7.097 351 HB3 TYR 53 HB1 TYR 53 7.646 3.019 -6.149 352 H ASP 54 HN ASP 54 7.127 1.632 -9.928 353 HA ASP 54 HA ASP 54 9.349 -0.138 -9.404 354 HB2 ASP 54 HB2 ASP 54 7.274 -1.131 -10.056 355 HB3 ASP 54 HB1 ASP 54 7.089 -0.043 -11.422 356 H GLU 55 HN GLU 55 8.452 2.264 -11.856 357 HA GLU 55 HA GLU 55 10.689 1.776 -13.539 358 HB2 GLU 55 HB2 GLU 55 10.147 3.853 -14.650 359 HB3 GLU 55 HB1 GLU 55 8.665 2.976 -14.324 360 HG2 GLU 55 HG2 GLU 55 7.882 4.868 -13.519 361 HG3 GLU 55 HG1 GLU 55 8.923 4.590 -12.117 362 H ILE 56 HN ILE 56 10.148 3.920 -10.770 363 HA ILE 56 HA ILE 56 12.765 5.046 -10.867 364 HB ILE 56 HB ILE 56 10.986 4.713 -8.443 365 HG12 ILE 56 HG12 ILE 56 11.212 7.127 -10.251 366 HG13 ILE 56 HG11 ILE 56 9.950 5.905 -10.439 367 HG21 ILE 56 HG21 ILE 56 13.284 6.588 -9.015 368 HG22 ILE 56 HG22 ILE 56 13.270 5.262 -7.851 369 HG23 ILE 56 HG23 ILE 56 12.239 6.668 -7.596 370 HD11 ILE 56 HD11 ILE 56 10.407 7.658 -8.037 371 HD12 ILE 56 HD12 ILE 56 9.185 6.392 -8.163 372 HD13 ILE 56 HD13 ILE 56 9.109 7.799 -9.223 373 H PHE 57 HN PHE 57 11.344 2.187 -9.470 374 HA PHE 57 HA PHE 57 13.366 1.277 -7.810 375 HD1 PHE 57 HD2 PHE 57 12.706 -0.746 -6.097 376 HD2 PHE 57 HD1 PHE 57 12.273 -2.326 -10.020 377 HE1 PHE 57 HE2 PHE 57 13.527 -2.924 -5.310 378 HE2 PHE 57 HE1 PHE 57 13.087 -4.510 -9.237 379 HZ PHE 57 HZ PHE 57 13.712 -4.811 -6.882 380 HB2 PHE 57 HB2 PHE 57 11.170 0.260 -7.879 381 HB3 PHE 57 HB1 PHE 57 11.415 -0.248 -9.543 382 H TYR 58 HN TYR 58 12.836 0.317 -11.226 383 HA TYR 58 HA TYR 58 15.341 -1.014 -11.420 384 HD1 TYR 58 HD2 TYR 58 11.723 -1.380 -12.080 385 HD2 TYR 58 HD1 TYR 58 15.148 -3.175 -13.848 386 HE1 TYR 58 HE2 TYR 58 10.694 -3.595 -11.806 387 HE2 TYR 58 HE1 TYR 58 14.133 -5.394 -13.570 388 HH TYR 58 HH TYR 58 12.471 -6.540 -12.456 389 HB2 TYR 58 HB2 TYR 58 13.343 -0.078 -13.468 390 HB3 TYR 58 HB1 TYR 58 14.872 -0.825 -13.947 391 H THR 59 HN THR 59 14.400 2.270 -11.738 392 HA THR 59 HA THR 59 16.627 3.199 -13.230 393 HB THR 59 HB THR 59 14.623 4.559 -11.430 394 HG1 THR 59 HG1 THR 59 13.739 4.039 -13.374 395 HG21 THR 59 HG21 THR 59 16.812 5.890 -13.021 396 HG22 THR 59 HG22 THR 59 16.672 5.854 -11.262 397 HG23 THR 59 HG23 THR 59 15.469 6.712 -12.225 398 H LEU 60 HN LEU 60 16.095 2.456 -9.854 399 HA LEU 60 HA LEU 60 18.548 3.767 -9.026 400 HG LEU 60 HG LEU 60 15.541 4.123 -7.960 401 HB2 LEU 60 HB2 LEU 60 16.618 2.018 -7.491 402 HB3 LEU 60 HB1 LEU 60 18.004 2.840 -6.787 403 HD11 LEU 60 HD11 LEU 60 15.194 4.912 -5.703 404 HD12 LEU 60 HD12 LEU 60 16.688 4.135 -5.177 405 HD13 LEU 60 HD13 LEU 60 15.322 3.151 -5.708 406 HD21 LEU 60 HD21 LEU 60 17.575 5.406 -8.513 407 HD22 LEU 60 HD22 LEU 60 17.978 5.453 -6.797 408 HD23 LEU 60 HD23 LEU 60 16.520 6.255 -7.382 409 H SER 61 HN SER 61 17.844 0.951 -10.558 410 HA SER 61 HA SER 61 19.004 -0.908 -11.093 411 HG SER 61 HG SER 61 21.992 -1.633 -9.759 412 HB2 SER 61 HB2 SER 61 20.993 0.503 -11.222 413 HB3 SER 61 HB1 SER 61 21.245 0.335 -9.486 414 HA PRO 62 HA PRO 62 17.866 -2.926 -7.164 415 HB2 PRO 62 HB2 PRO 62 16.234 -4.761 -8.285 416 HB3 PRO 62 HB1 PRO 62 15.698 -3.118 -7.895 417 HG2 PRO 62 HG2 PRO 62 16.493 -4.283 -10.525 418 HG3 PRO 62 HG1 PRO 62 15.192 -3.145 -10.147 419 HD2 PRO 62 HD2 PRO 62 17.620 -2.426 -11.213 420 HD3 PRO 62 HD1 PRO 62 16.586 -1.339 -10.260 421 H VAL 63 HN VAL 63 18.515 -4.864 -6.305 422 HA VAL 63 HA VAL 63 20.020 -6.662 -8.063 423 HB VAL 63 HB VAL 63 21.379 -7.221 -6.022 424 HG11 VAL 63 HG11 VAL 63 21.541 -4.379 -7.018 425 HG12 VAL 63 HG12 VAL 63 22.251 -5.793 -7.798 426 HG13 VAL 63 HG13 VAL 63 22.837 -5.267 -6.220 427 HG21 VAL 63 HG21 VAL 63 21.442 -5.593 -4.194 428 HG22 VAL 63 HG22 VAL 63 19.855 -6.351 -4.325 429 HG23 VAL 63 HG23 VAL 63 20.099 -4.717 -4.933 430 H ASN 64 HN ASN 64 19.161 -8.593 -8.256 431 HA ASN 64 HA ASN 64 18.114 -10.555 -7.822 432 HB2 ASN 64 HB2 ASN 64 19.009 -9.726 -5.099 433 HB3 ASN 64 HB1 ASN 64 17.879 -11.080 -5.226 434 HD21 ASN 64 HD21 ASN 64 21.086 -9.929 -6.044 435 HD22 ASN 64 HD22 ASN 64 21.749 -11.480 -6.419 436 H GLY 65 HN GLY 65 16.601 -7.976 -7.926 437 HA2 GLY 65 HA2 GLY 65 14.293 -7.713 -8.185 438 HA3 GLY 65 HA1 GLY 65 14.046 -9.181 -7.250 439 H LYS 66 HN LYS 66 16.028 -6.508 -6.157 440 HA LYS 66 HA LYS 66 13.943 -4.988 -5.014 441 HB2 LYS 66 HB2 LYS 66 14.380 -5.287 -2.658 442 HB3 LYS 66 HB1 LYS 66 13.939 -6.838 -3.354 443 HG2 LYS 66 HG2 LYS 66 16.817 -6.116 -3.108 444 HG3 LYS 66 HG1 LYS 66 15.927 -6.645 -1.683 445 HD2 LYS 66 HD2 LYS 66 15.882 -8.218 -4.230 446 HD3 LYS 66 HD1 LYS 66 17.174 -8.417 -3.051 447 HE2 LYS 66 HE2 LYS 66 15.647 -10.065 -2.446 448 HE3 LYS 66 HE1 LYS 66 15.268 -8.743 -1.356 449 HZ1 LYS 66 HZ1 LYS 66 13.804 -8.845 -3.881 450 HZ2 LYS 66 HZ2 LYS 66 13.285 -8.351 -2.343 451 HZ3 LYS 66 HZ3 LYS 66 13.409 -9.997 -2.705 452 H ILE 67 HN ILE 67 14.798 -3.127 -3.849 453 HA ILE 67 HA ILE 67 17.551 -2.539 -4.609 454 HB ILE 67 HB ILE 67 16.983 -0.290 -3.474 455 HG12 ILE 67 HG12 ILE 67 14.240 -1.504 -3.789 456 HG13 ILE 67 HG11 ILE 67 14.987 -0.899 -2.315 457 HG21 ILE 67 HG21 ILE 67 15.580 -1.093 -6.024 458 HG22 ILE 67 HG22 ILE 67 17.273 -0.624 -5.883 459 HG23 ILE 67 HG23 ILE 67 16.000 0.551 -5.543 460 HD11 ILE 67 HD11 ILE 67 13.350 0.665 -3.067 461 HD12 ILE 67 HD12 ILE 67 14.057 0.707 -4.681 462 HD13 ILE 67 HD13 ILE 67 14.948 1.376 -3.309 463 H THR 68 HN THR 68 19.195 -2.587 -3.213 464 HA THR 68 HA THR 68 18.978 -3.400 -0.548 465 HB THR 68 HB THR 68 21.247 -2.210 -0.300 466 HG1 THR 68 HG1 THR 68 20.478 -1.216 -2.670 467 HG21 THR 68 HG21 THR 68 21.048 -4.609 -0.698 468 HG22 THR 68 HG22 THR 68 22.407 -3.944 -1.605 469 HG23 THR 68 HG23 THR 68 20.897 -4.319 -2.437 470 H GLY 69 HN GLY 69 18.649 -2.246 1.335 471 HA2 GLY 69 HA2 GLY 69 16.793 -0.263 1.075 472 HA3 GLY 69 HA1 GLY 69 17.636 -0.607 2.569 473 H ALA 70 HN ALA 70 20.240 0.242 1.358 474 HA ALA 70 HA ALA 70 20.298 2.941 2.034 475 HB1 ALA 70 HB1 ALA 70 22.458 3.028 0.936 476 HB2 ALA 70 HB2 ALA 70 22.108 1.518 0.090 477 HB3 ALA 70 HB3 ALA 70 22.291 1.527 1.845 478 H ASN 71 HN ASN 71 19.308 1.452 -0.954 479 HA ASN 71 HA ASN 71 19.558 3.854 -2.533 480 HB2 ASN 71 HB2 ASN 71 17.789 1.612 -3.411 481 HB3 ASN 71 HB1 ASN 71 18.897 2.593 -4.361 482 HD21 ASN 71 HD21 ASN 71 21.105 2.049 -2.405 483 HD22 ASN 71 HD22 ASN 71 21.576 0.414 -2.688 484 H ALA 72 HN ALA 72 17.058 2.126 -0.833 485 HA ALA 72 HA ALA 72 14.919 3.837 -1.663 486 HB1 ALA 72 HB1 ALA 72 15.182 1.780 0.504 487 HB2 ALA 72 HB2 ALA 72 14.381 1.608 -1.056 488 HB3 ALA 72 HB3 ALA 72 13.694 2.665 0.179 489 H LYS 73 HN LYS 73 17.176 3.692 1.016 490 HA LYS 73 HA LYS 73 16.025 5.761 2.560 491 HB2 LYS 73 HB2 LYS 73 18.936 4.955 2.336 492 HB3 LYS 73 HB1 LYS 73 18.264 5.988 3.587 493 HG2 LYS 73 HG2 LYS 73 17.641 3.084 3.125 494 HG3 LYS 73 HG1 LYS 73 18.565 3.776 4.459 495 HD2 LYS 73 HD2 LYS 73 15.698 4.495 3.900 496 HD3 LYS 73 HD1 LYS 73 16.161 3.162 4.961 497 HE2 LYS 73 HE2 LYS 73 17.038 6.026 5.331 498 HE3 LYS 73 HE1 LYS 73 15.677 5.275 6.174 499 HZ1 LYS 73 HZ1 LYS 73 17.730 5.273 7.494 500 HZ2 LYS 73 HZ2 LYS 73 18.491 4.326 6.312 501 HZ3 LYS 73 HZ3 LYS 73 17.173 3.705 7.179 502 H LYS 74 HN LYS 74 18.184 5.636 -0.162 503 HA LYS 74 HA LYS 74 18.890 8.323 -0.395 504 HB2 LYS 74 HB2 LYS 74 19.587 6.197 -1.766 505 HB3 LYS 74 HB1 LYS 74 18.232 6.645 -2.796 506 HG2 LYS 74 HG2 LYS 74 20.118 7.607 -3.785 507 HG3 LYS 74 HG1 LYS 74 19.301 8.936 -2.951 508 HD2 LYS 74 HD2 LYS 74 21.632 9.082 -2.492 509 HD3 LYS 74 HD1 LYS 74 20.822 8.568 -1.019 510 HE2 LYS 74 HE2 LYS 74 22.841 7.261 -1.328 511 HE3 LYS 74 HE1 LYS 74 21.422 6.241 -1.529 512 HZ1 LYS 74 HZ1 LYS 74 21.695 6.172 -3.833 513 HZ2 LYS 74 HZ2 LYS 74 23.273 5.989 -3.226 514 HZ3 LYS 74 HZ3 LYS 74 22.770 7.482 -3.844 515 H GLU 75 HN GLU 75 16.174 6.533 -1.759 516 HA GLU 75 HA GLU 75 14.846 8.611 -3.055 517 HB2 GLU 75 HB2 GLU 75 13.885 6.059 -1.816 518 HB3 GLU 75 HB1 GLU 75 12.742 7.183 -2.537 519 HG2 GLU 75 HG2 GLU 75 15.053 5.855 -3.934 520 HG3 GLU 75 HG1 GLU 75 13.349 5.428 -4.087 521 H MET 76 HN MET 76 14.250 7.426 0.241 522 HA MET 76 HA MET 76 12.310 9.445 0.737 523 HB2 MET 76 HB2 MET 76 12.600 8.666 3.154 524 HB3 MET 76 HB1 MET 76 12.008 7.497 1.983 525 HG2 MET 76 HG2 MET 76 14.226 6.542 1.806 526 HG3 MET 76 HG1 MET 76 14.839 7.721 2.958 527 HE1 MET 76 HE1 MET 76 11.407 5.591 2.959 528 HE2 MET 76 HE2 MET 76 11.986 4.210 3.890 529 HE3 MET 76 HE3 MET 76 12.698 4.573 2.319 530 H VAL 77 HN VAL 77 15.774 9.293 1.095 531 HA VAL 77 HA VAL 77 16.062 11.617 2.699 532 HB VAL 77 HB VAL 77 17.883 10.078 0.888 533 HG11 VAL 77 HG11 VAL 77 18.559 12.795 2.020 534 HG12 VAL 77 HG12 VAL 77 18.408 12.386 0.309 535 HG13 VAL 77 HG13 VAL 77 19.703 11.678 1.276 536 HG21 VAL 77 HG21 VAL 77 18.069 10.992 3.758 537 HG22 VAL 77 HG22 VAL 77 19.222 9.944 2.931 538 HG23 VAL 77 HG23 VAL 77 17.569 9.393 3.207 539 H LYS 78 HN LYS 78 15.953 11.136 -0.834 540 HA LYS 78 HA LYS 78 16.493 13.888 -1.401 541 HB2 LYS 78 HB2 LYS 78 16.076 13.311 -3.718 542 HB3 LYS 78 HB1 LYS 78 17.067 12.066 -2.965 543 HG2 LYS 78 HG2 LYS 78 15.098 10.655 -2.695 544 HG3 LYS 78 HG1 LYS 78 14.101 11.900 -3.446 545 HD2 LYS 78 HD2 LYS 78 14.591 10.256 -5.095 546 HD3 LYS 78 HD1 LYS 78 15.524 11.703 -5.471 547 HE2 LYS 78 HE2 LYS 78 17.529 10.735 -4.702 548 HE3 LYS 78 HE1 LYS 78 16.672 9.416 -3.903 549 HZ1 LYS 78 HZ1 LYS 78 17.754 8.782 -6.023 550 HZ2 LYS 78 HZ2 LYS 78 16.708 9.833 -6.840 551 HZ3 LYS 78 HZ3 LYS 78 16.081 8.494 -6.007 552 H SER 79 HN SER 79 13.671 12.160 -0.565 553 HA SER 79 HA SER 79 11.732 13.683 -1.934 554 HG SER 79 HG SER 79 12.302 11.709 1.062 555 HB2 SER 79 HB2 SER 79 10.102 12.651 -0.473 556 HB3 SER 79 HB1 SER 79 11.300 11.451 -0.964 557 H LYS 80 HN LYS 80 13.816 14.801 0.338 558 HA LYS 80 HA LYS 80 14.023 16.909 1.192 559 HB2 LYS 80 HB2 LYS 80 11.190 17.367 0.218 560 HB3 LYS 80 HB1 LYS 80 12.308 18.608 0.788 561 HG2 LYS 80 HG2 LYS 80 13.777 18.189 -1.085 562 HG3 LYS 80 HG1 LYS 80 12.738 16.875 -1.637 563 HD2 LYS 80 HD2 LYS 80 10.911 18.465 -1.988 564 HD3 LYS 80 HD1 LYS 80 11.940 19.781 -1.417 565 HE2 LYS 80 HE2 LYS 80 12.462 18.057 -3.837 566 HE3 LYS 80 HE1 LYS 80 11.831 19.702 -3.865 567 HZ1 LYS 80 HZ1 LYS 80 14.193 19.690 -4.306 568 HZ2 LYS 80 HZ2 LYS 80 14.497 18.868 -2.853 569 HZ3 LYS 80 HZ3 LYS 80 13.895 20.451 -2.819 570 H LEU 81 HN LEU 81 13.013 14.610 2.642 571 HA LEU 81 HA LEU 81 11.315 15.905 4.660 572 HG LEU 81 HG LEU 81 10.521 13.863 2.329 573 HB2 LEU 81 HB2 LEU 81 11.818 12.966 4.241 574 HB3 LEU 81 HB1 LEU 81 10.663 13.684 5.345 575 HD11 LEU 81 HD11 LEU 81 8.859 12.249 4.251 576 HD12 LEU 81 HD12 LEU 81 10.103 11.603 3.181 577 HD13 LEU 81 HD13 LEU 81 8.652 12.344 2.503 578 HD21 LEU 81 HD21 LEU 81 8.266 14.750 2.741 579 HD22 LEU 81 HD22 LEU 81 9.532 15.801 3.380 580 HD23 LEU 81 HD23 LEU 81 8.608 14.765 4.469 581 HA PRO 82 HA PRO 82 14.576 15.318 7.651 582 HB2 PRO 82 HB2 PRO 82 13.183 15.182 9.947 583 HB3 PRO 82 HB1 PRO 82 13.273 16.691 9.001 584 HG2 PRO 82 HG2 PRO 82 11.069 14.682 9.170 585 HG3 PRO 82 HG1 PRO 82 10.976 16.447 9.084 586 HD2 PRO 82 HD2 PRO 82 10.616 14.725 6.957 587 HD3 PRO 82 HD1 PRO 82 11.046 16.440 6.812 588 H ASN 83 HN ASN 83 15.574 13.762 8.872 589 HA ASN 83 HA ASN 83 15.332 11.141 8.088 590 HB2 ASN 83 HB2 ASN 83 16.593 12.279 10.586 591 HB3 ASN 83 HB1 ASN 83 16.794 10.610 10.070 592 HD21 ASN 83 HD21 ASN 83 18.119 10.140 8.364 593 HD22 ASN 83 HD22 ASN 83 19.157 11.307 7.629 594 H THR 84 HN THR 84 13.680 12.717 10.740 595 HA THR 84 HA THR 84 12.930 10.431 12.199 596 HB THR 84 HB THR 84 11.124 12.814 11.981 597 HG1 THR 84 HG1 THR 84 13.214 13.128 13.742 598 HG21 THR 84 HG21 THR 84 12.146 11.212 14.329 599 HG22 THR 84 HG22 THR 84 10.579 11.000 13.548 600 HG23 THR 84 HG23 THR 84 10.948 12.505 14.392 601 H VAL 85 HN VAL 85 11.233 12.257 9.672 602 HA VAL 85 HA VAL 85 8.948 10.609 9.532 603 HB VAL 85 HB VAL 85 10.122 12.385 7.389 604 HG11 VAL 85 HG11 VAL 85 8.564 10.810 6.424 605 HG12 VAL 85 HG12 VAL 85 7.826 12.411 6.482 606 HG13 VAL 85 HG13 VAL 85 7.368 11.182 7.662 607 HG21 VAL 85 HG21 VAL 85 9.626 13.597 9.446 608 HG22 VAL 85 HG22 VAL 85 7.992 12.931 9.466 609 HG23 VAL 85 HG23 VAL 85 8.485 14.033 8.178 610 H LEU 86 HN LEU 86 12.025 10.587 7.763 611 HA LEU 86 HA LEU 86 11.319 8.530 5.964 612 HG LEU 86 HG LEU 86 13.892 9.729 4.222 613 HB2 LEU 86 HB2 LEU 86 14.011 9.420 6.995 614 HB3 LEU 86 HB1 LEU 86 13.813 8.154 5.778 615 HD11 LEU 86 HD11 LEU 86 11.470 9.571 4.284 616 HD12 LEU 86 HD12 LEU 86 11.991 11.203 3.861 617 HD13 LEU 86 HD13 LEU 86 11.407 10.855 5.490 618 HD21 LEU 86 HD21 LEU 86 15.140 11.111 5.753 619 HD22 LEU 86 HD22 LEU 86 13.641 11.746 6.438 620 HD23 LEU 86 HD23 LEU 86 14.072 12.110 4.767 621 H GLY 87 HN GLY 87 12.777 8.491 9.167 622 HA2 GLY 87 HA2 GLY 87 13.399 5.781 9.335 623 HA3 GLY 87 HA1 GLY 87 12.979 6.800 10.705 624 H LYS 88 HN LYS 88 10.326 7.435 10.108 625 HA LYS 88 HA LYS 88 9.158 4.891 10.799 626 HB2 LYS 88 HB2 LYS 88 7.076 6.107 11.208 627 HB3 LYS 88 HB1 LYS 88 8.430 6.778 12.095 628 HG2 LYS 88 HG2 LYS 88 8.525 8.673 10.730 629 HG3 LYS 88 HG1 LYS 88 7.498 7.930 9.500 630 HD2 LYS 88 HD2 LYS 88 5.595 7.991 10.984 631 HD3 LYS 88 HD1 LYS 88 6.602 8.575 12.310 632 HE2 LYS 88 HE2 LYS 88 6.913 10.675 11.273 633 HE3 LYS 88 HE1 LYS 88 6.269 10.097 9.735 634 HZ1 LYS 88 HZ1 LYS 88 4.095 9.898 10.748 635 HZ2 LYS 88 HZ2 LYS 88 4.672 11.482 10.931 636 HZ3 LYS 88 HZ3 LYS 88 4.697 10.407 12.250 637 H ILE 89 HN ILE 89 9.169 6.975 7.955 638 HA ILE 89 HA ILE 89 7.169 5.642 6.508 639 HB ILE 89 HB ILE 89 9.729 6.912 5.523 640 HG12 ILE 89 HG12 ILE 89 6.847 7.833 5.469 641 HG13 ILE 89 HG11 ILE 89 8.106 8.460 6.525 642 HG21 ILE 89 HG21 ILE 89 8.999 5.202 3.926 643 HG22 ILE 89 HG22 ILE 89 8.778 6.824 3.268 644 HG23 ILE 89 HG23 ILE 89 7.390 5.928 3.884 645 HD11 ILE 89 HD11 ILE 89 8.075 8.669 3.525 646 HD12 ILE 89 HD12 ILE 89 9.311 9.320 4.602 647 HD13 ILE 89 HD13 ILE 89 7.666 9.952 4.663 648 H TRP 90 HN TRP 90 10.630 4.985 6.848 649 HA TRP 90 HA TRP 90 10.808 2.761 5.202 650 HD1 TRP 90 HD1 TRP 90 12.909 0.880 8.523 651 HE1 TRP 90 HE1 TRP 90 14.197 -1.072 7.412 652 HE3 TRP 90 HE3 TRP 90 13.254 2.719 3.767 653 HZ2 TRP 90 HZ2 TRP 90 15.223 -1.739 4.860 654 HZ3 TRP 90 HZ3 TRP 90 14.397 1.366 2.069 655 HH2 TRP 90 HH2 TRP 90 15.359 -0.806 2.599 656 HB2 TRP 90 HB2 TRP 90 12.800 3.812 6.125 657 HB3 TRP 90 HB1 TRP 90 12.328 3.328 7.752 658 H LYS 91 HN LYS 91 10.300 2.820 8.733 659 HA LYS 91 HA LYS 91 10.049 -0.006 8.863 660 HB2 LYS 91 HB2 LYS 91 9.560 0.294 11.197 661 HB3 LYS 91 HB1 LYS 91 10.857 1.384 10.731 662 HG2 LYS 91 HG2 LYS 91 9.423 3.258 10.785 663 HG3 LYS 91 HG1 LYS 91 7.990 2.237 10.968 664 HD2 LYS 91 HD2 LYS 91 8.552 3.136 13.113 665 HD3 LYS 91 HD1 LYS 91 8.967 1.419 13.100 666 HE2 LYS 91 HE2 LYS 91 10.704 2.755 14.154 667 HE3 LYS 91 HE1 LYS 91 11.293 1.946 12.711 668 HZ1 LYS 91 HZ1 LYS 91 10.514 4.803 12.958 669 HZ2 LYS 91 HZ2 LYS 91 10.956 4.050 11.507 670 HZ3 LYS 91 HZ3 LYS 91 12.085 4.194 12.763 671 H LEU 92 HN LEU 92 7.887 2.363 7.873 672 HA LEU 92 HA LEU 92 5.533 0.771 8.514 673 HG LEU 92 HG LEU 92 3.413 2.008 7.091 674 HB2 LEU 92 HB2 LEU 92 5.668 3.343 8.589 675 HB3 LEU 92 HB1 LEU 92 5.578 3.265 6.832 676 HD11 LEU 92 HD11 LEU 92 2.258 2.133 9.225 677 HD12 LEU 92 HD12 LEU 92 3.651 2.925 9.956 678 HD13 LEU 92 HD13 LEU 92 3.774 1.250 9.411 679 HD21 LEU 92 HD21 LEU 92 3.498 4.764 8.308 680 HD22 LEU 92 HD22 LEU 92 2.108 3.998 7.540 681 HD23 LEU 92 HD23 LEU 92 3.528 4.417 6.581 682 H ALA 93 HN ALA 93 7.618 1.599 5.792 683 HA ALA 93 HA ALA 93 5.849 0.315 3.880 684 HB1 ALA 93 HB1 ALA 93 8.598 1.492 3.497 685 HB2 ALA 93 HB2 ALA 93 7.067 2.334 3.246 686 HB3 ALA 93 HB3 ALA 93 7.505 0.969 2.217 687 H ASP 94 HN ASP 94 9.040 -0.328 5.334 688 HA ASP 94 HA ASP 94 9.253 -2.835 3.875 689 HB2 ASP 94 HB2 ASP 94 11.286 -1.481 4.307 690 HB3 ASP 94 HB1 ASP 94 11.054 -1.712 6.030 691 H VAL 95 HN VAL 95 7.804 -4.265 4.538 692 HA VAL 95 HA VAL 95 6.848 -4.389 7.212 693 HB VAL 95 HB VAL 95 6.431 -6.404 5.002 694 HG11 VAL 95 HG11 VAL 95 4.781 -5.837 7.463 695 HG12 VAL 95 HG12 VAL 95 5.853 -7.220 7.246 696 HG13 VAL 95 HG13 VAL 95 4.426 -7.041 6.222 697 HG21 VAL 95 HG21 VAL 95 5.753 -4.185 4.266 698 HG22 VAL 95 HG22 VAL 95 4.781 -3.989 5.724 699 HG23 VAL 95 HG23 VAL 95 4.342 -5.210 4.529 700 H ASP 96 HN ASP 96 9.296 -6.079 5.429 701 HA ASP 96 HA ASP 96 9.558 -8.203 7.379 702 HB2 ASP 96 HB2 ASP 96 11.855 -7.527 5.692 703 HB3 ASP 96 HB1 ASP 96 11.108 -9.106 5.964 704 H LYS 97 HN LYS 97 10.777 -5.031 6.758 705 HA LYS 97 HA LYS 97 12.338 -3.693 7.720 706 HB2 LYS 97 HB2 LYS 97 11.953 -5.542 10.091 707 HB3 LYS 97 HB1 LYS 97 12.668 -3.931 10.138 708 HG2 LYS 97 HG2 LYS 97 10.618 -2.926 9.475 709 HG3 LYS 97 HG1 LYS 97 9.879 -4.492 9.189 710 HD2 LYS 97 HD2 LYS 97 10.153 -5.012 11.605 711 HD3 LYS 97 HD1 LYS 97 10.750 -3.367 11.849 712 HE2 LYS 97 HE2 LYS 97 8.649 -2.451 11.076 713 HE3 LYS 97 HE1 LYS 97 8.051 -4.066 10.702 714 HZ1 LYS 97 HZ1 LYS 97 8.208 -4.601 13.071 715 HZ2 LYS 97 HZ2 LYS 97 7.150 -3.309 12.785 716 HZ3 LYS 97 HZ3 LYS 97 8.702 -3.015 13.402 717 H ASP 98 HN ASP 98 13.275 -5.369 5.990 718 HA ASP 98 HA ASP 98 15.425 -6.957 7.187 719 HB2 ASP 98 HB2 ASP 98 15.379 -8.282 5.092 720 HB3 ASP 98 HB1 ASP 98 13.851 -8.317 5.975 721 H GLY 99 HN GLY 99 15.102 -4.022 5.920 722 HA2 GLY 99 HA2 GLY 99 16.864 -2.554 5.496 723 HA3 GLY 99 HA1 GLY 99 17.950 -3.932 5.423 724 H LEU 100 HN LEU 100 15.152 -4.175 3.509 725 HA LEU 100 HA LEU 100 16.248 -2.798 1.237 726 HG LEU 100 HG LEU 100 15.677 -6.281 2.295 727 HB2 LEU 100 HB2 LEU 100 16.151 -4.781 -0.244 728 HB3 LEU 100 HB1 LEU 100 17.424 -4.864 0.956 729 HD11 LEU 100 HD11 LEU 100 14.683 -6.536 -0.529 730 HD12 LEU 100 HD12 LEU 100 13.773 -5.976 0.878 731 HD13 LEU 100 HD13 LEU 100 14.294 -7.658 0.777 732 HD21 LEU 100 HD21 LEU 100 17.832 -7.042 1.488 733 HD22 LEU 100 HD22 LEU 100 17.139 -7.327 -0.111 734 HD23 LEU 100 HD23 LEU 100 16.599 -8.284 1.271 735 H LEU 101 HN LEU 101 14.684 -3.437 -0.746 736 HA LEU 101 HA LEU 101 11.941 -3.536 0.150 737 HG LEU 101 HG LEU 101 13.069 -1.004 1.481 738 HB2 LEU 101 HB2 LEU 101 13.202 -1.030 -0.971 739 HB3 LEU 101 HB1 LEU 101 11.479 -1.335 -1.077 740 HD11 LEU 101 HD11 LEU 101 12.721 1.062 0.204 741 HD12 LEU 101 HD12 LEU 101 11.808 1.056 1.712 742 HD13 LEU 101 HD13 LEU 101 10.989 0.744 0.180 743 HD21 LEU 101 HD21 LEU 101 10.120 -1.416 1.041 744 HD22 LEU 101 HD22 LEU 101 10.886 -1.032 2.581 745 HD23 LEU 101 HD23 LEU 101 11.229 -2.569 1.782 746 H ASP 102 HN ASP 102 11.168 -4.929 -1.355 747 HA ASP 102 HA ASP 102 12.433 -5.226 -3.904 748 HB2 ASP 102 HB2 ASP 102 11.092 -7.071 -4.211 749 HB3 ASP 102 HB1 ASP 102 11.318 -7.030 -2.467 750 H ASP 103 HN ASP 103 10.394 -5.609 -5.748 751 HA ASP 103 HA ASP 103 10.048 -3.021 -6.763 752 HB2 ASP 103 HB2 ASP 103 8.243 -5.389 -7.330 753 HB3 ASP 103 HB1 ASP 103 8.575 -4.018 -8.396 754 H GLU 104 HN GLU 104 7.905 -4.982 -4.725 755 HA GLU 104 HA GLU 104 5.833 -2.938 -4.888 756 HB2 GLU 104 HB2 GLU 104 5.892 -5.744 -4.103 757 HB3 GLU 104 HB1 GLU 104 4.917 -4.738 -3.041 758 HG2 GLU 104 HG2 GLU 104 3.315 -5.156 -4.540 759 HG3 GLU 104 HG1 GLU 104 4.090 -3.827 -5.424 760 H GLU 105 HN GLU 105 8.269 -4.037 -2.668 761 HA GLU 105 HA GLU 105 7.281 -2.601 -0.423 762 HB2 GLU 105 HB2 GLU 105 9.585 -4.188 -1.107 763 HB3 GLU 105 HB1 GLU 105 10.053 -2.767 -0.190 764 HG2 GLU 105 HG2 GLU 105 8.755 -3.398 1.660 765 HG3 GLU 105 HG1 GLU 105 7.837 -4.564 0.712 766 H PHE 106 HN PHE 106 9.448 -1.829 -3.094 767 HA PHE 106 HA PHE 106 9.990 0.848 -2.334 768 HD1 PHE 106 HD1 PHE 106 9.307 2.678 -3.990 769 HD2 PHE 106 HD2 PHE 106 12.620 0.743 -5.804 770 HE1 PHE 106 HE1 PHE 106 10.163 4.851 -4.740 771 HE2 PHE 106 HE2 PHE 106 13.482 2.917 -6.557 772 HZ PHE 106 HZ PHE 106 12.377 4.907 -6.063 773 HB2 PHE 106 HB2 PHE 106 11.177 -0.434 -4.189 774 HB3 PHE 106 HB1 PHE 106 9.745 -0.192 -5.175 775 H ALA 107 HN ALA 107 7.461 -0.760 -4.218 776 HA ALA 107 HA ALA 107 6.047 1.452 -5.097 777 HB1 ALA 107 HB1 ALA 107 4.152 -0.016 -5.283 778 HB2 ALA 107 HB2 ALA 107 4.869 -1.151 -4.139 779 HB3 ALA 107 HB3 ALA 107 5.609 -0.904 -5.720 780 H LEU 108 HN LEU 108 5.910 -0.197 -1.975 781 HA LEU 108 HA LEU 108 3.872 1.488 -0.909 782 HG LEU 108 HG LEU 108 2.776 -0.022 0.755 783 HB2 LEU 108 HB2 LEU 108 4.848 -0.886 -0.178 784 HB3 LEU 108 HB1 LEU 108 5.784 0.137 0.904 785 HD11 LEU 108 HD11 LEU 108 3.005 -0.962 2.993 786 HD12 LEU 108 HD12 LEU 108 4.759 -0.894 2.825 787 HD13 LEU 108 HD13 LEU 108 3.813 -1.945 1.772 788 HD21 LEU 108 HD21 LEU 108 3.501 2.250 1.332 789 HD22 LEU 108 HD22 LEU 108 4.516 1.593 2.617 790 HD23 LEU 108 HD23 LEU 108 2.762 1.433 2.711 791 H ALA 109 HN ALA 109 7.397 1.327 -0.434 792 HA ALA 109 HA ALA 109 7.721 3.350 1.414 793 HB1 ALA 109 HB1 ALA 109 9.535 2.696 -0.904 794 HB2 ALA 109 HB2 ALA 109 9.536 1.899 0.670 795 HB3 ALA 109 HB3 ALA 109 9.992 3.597 0.539 796 H ASN 110 HN ASN 110 7.766 3.664 -2.128 797 HA ASN 110 HA ASN 110 8.068 6.486 -2.098 798 HB2 ASN 110 HB2 ASN 110 8.684 4.827 -3.980 799 HB3 ASN 110 HB1 ASN 110 6.989 4.933 -4.435 800 HD21 ASN 110 HD21 ASN 110 10.023 6.553 -4.296 801 HD22 ASN 110 HD22 ASN 110 9.581 7.942 -5.223 802 H HIS 111 HN HIS 111 5.378 4.250 -1.986 803 HA HIS 111 HA HIS 111 3.402 6.123 -2.842 804 HD1 HIS 111 HD1 HIS 111 1.210 4.968 -4.176 805 HD2 HIS 111 HD2 HIS 111 0.420 4.495 -0.117 806 HE1 HIS 111 HE1 HIS 111 -1.227 5.513 -3.891 807 HE2 HIS 111 HE2 HIS 111 -1.564 5.577 -1.395 808 HB2 HIS 111 HB2 HIS 111 3.057 3.598 -2.733 809 HB3 HIS 111 HB1 HIS 111 2.906 3.791 -0.984 810 H LEU 112 HN LEU 112 4.742 5.178 0.273 811 HA LEU 112 HA LEU 112 2.980 6.761 1.837 812 HG LEU 112 HG LEU 112 3.689 3.952 2.389 813 HB2 LEU 112 HB2 LEU 112 5.648 5.476 2.348 814 HB3 LEU 112 HB1 LEU 112 4.871 6.496 3.562 815 HD11 LEU 112 HD11 LEU 112 4.109 3.044 4.631 816 HD12 LEU 112 HD12 LEU 112 4.909 4.547 5.090 817 HD13 LEU 112 HD13 LEU 112 5.607 3.526 3.835 818 HD21 LEU 112 HD21 LEU 112 1.989 5.613 3.027 819 HD22 LEU 112 HD22 LEU 112 2.719 5.744 4.626 820 HD23 LEU 112 HD23 LEU 112 1.984 4.224 4.116 821 H ILE 113 HN ILE 113 6.130 7.343 0.358 822 HA ILE 113 HA ILE 113 6.635 9.878 1.438 823 HB ILE 113 HB ILE 113 7.337 8.751 -1.285 824 HG12 ILE 113 HG12 ILE 113 9.092 9.219 1.125 825 HG13 ILE 113 HG11 ILE 113 8.263 7.690 0.824 826 HG21 ILE 113 HG21 ILE 113 7.338 11.191 -1.394 827 HG22 ILE 113 HG22 ILE 113 8.983 10.551 -1.456 828 HG23 ILE 113 HG23 ILE 113 8.367 11.256 0.038 829 HD11 ILE 113 HD11 ILE 113 10.569 7.587 0.087 830 HD12 ILE 113 HD12 ILE 113 10.322 8.990 -0.952 831 HD13 ILE 113 HD13 ILE 113 9.484 7.477 -1.299 832 H LYS 114 HN LYS 114 4.945 9.013 -1.610 833 HA LYS 114 HA LYS 114 4.143 11.732 -2.021 834 HB2 LYS 114 HB2 LYS 114 2.770 10.898 -3.864 835 HB3 LYS 114 HB1 LYS 114 4.399 10.251 -3.934 836 HG2 LYS 114 HG2 LYS 114 3.541 8.152 -2.932 837 HG3 LYS 114 HG1 LYS 114 1.911 8.822 -3.050 838 HD2 LYS 114 HD2 LYS 114 3.799 8.428 -5.371 839 HD3 LYS 114 HD1 LYS 114 2.469 7.350 -4.947 840 HE2 LYS 114 HE2 LYS 114 0.846 9.029 -5.403 841 HE3 LYS 114 HE1 LYS 114 2.086 10.276 -5.548 842 HZ1 LYS 114 HZ1 LYS 114 2.870 9.286 -7.557 843 HZ2 LYS 114 HZ2 LYS 114 1.192 9.468 -7.692 844 HZ3 LYS 114 HZ3 LYS 114 1.851 7.939 -7.371 845 H VAL 115 HN VAL 115 2.823 9.082 -0.233 846 HA VAL 115 HA VAL 115 0.203 9.998 0.153 847 HB VAL 115 HB VAL 115 2.072 8.321 1.787 848 HG11 VAL 115 HG11 VAL 115 -0.588 9.309 2.820 849 HG12 VAL 115 HG12 VAL 115 0.990 9.769 3.455 850 HG13 VAL 115 HG13 VAL 115 0.444 8.098 3.585 851 HG21 VAL 115 HG21 VAL 115 -0.729 7.908 0.753 852 HG22 VAL 115 HG22 VAL 115 0.261 6.696 1.567 853 HG23 VAL 115 HG23 VAL 115 0.753 7.326 -0.006 854 H LYS 116 HN LYS 116 3.217 10.828 1.927 855 HA LYS 116 HA LYS 116 1.746 12.838 3.396 856 HB2 LYS 116 HB2 LYS 116 3.805 13.299 4.555 857 HB3 LYS 116 HB1 LYS 116 3.446 11.578 4.565 858 HG2 LYS 116 HG2 LYS 116 5.183 11.076 3.155 859 HG3 LYS 116 HG1 LYS 116 5.252 12.715 2.490 860 HD2 LYS 116 HD2 LYS 116 5.994 11.905 5.291 861 HD3 LYS 116 HD1 LYS 116 7.119 12.296 3.996 862 HE2 LYS 116 HE2 LYS 116 5.187 14.115 5.409 863 HE3 LYS 116 HE1 LYS 116 6.936 14.254 5.298 864 HZ1 LYS 116 HZ1 LYS 116 6.510 14.515 2.794 865 HZ2 LYS 116 HZ2 LYS 116 6.170 15.831 3.806 866 HZ3 LYS 116 HZ3 LYS 116 4.908 14.849 3.241 867 H LEU 117 HN LEU 117 2.957 12.656 0.386 868 HA LEU 117 HA LEU 117 3.565 15.488 0.159 869 HG LEU 117 HG LEU 117 2.889 15.732 -2.843 870 HB2 LEU 117 HB2 LEU 117 4.686 13.844 -1.309 871 HB3 LEU 117 HB1 LEU 117 3.118 13.395 -1.982 872 HD11 LEU 117 HD11 LEU 117 4.400 16.834 -1.270 873 HD12 LEU 117 HD12 LEU 117 4.879 17.142 -2.940 874 HD13 LEU 117 HD13 LEU 117 5.767 15.966 -1.972 875 HD21 LEU 117 HD21 LEU 117 3.645 13.947 -4.300 876 HD22 LEU 117 HD22 LEU 117 5.306 14.175 -3.754 877 HD23 LEU 117 HD23 LEU 117 4.502 15.444 -4.676 878 H GLU 118 HN GLU 118 0.860 13.377 0.072 879 HA GLU 118 HA GLU 118 -0.962 14.943 -1.425 880 HB2 GLU 118 HB2 GLU 118 -1.437 12.944 0.797 881 HB3 GLU 118 HB1 GLU 118 -2.714 13.648 -0.178 882 HG2 GLU 118 HG2 GLU 118 -1.750 12.630 -2.180 883 HG3 GLU 118 HG1 GLU 118 -0.471 11.911 -1.191 884 H GLY 119 HN GLY 119 0.438 15.354 1.641 885 HA2 GLY 119 HA2 GLY 119 0.161 17.585 2.643 886 HA3 GLY 119 HA1 GLY 119 -1.557 17.425 2.305 887 H HIS 120 HN HIS 120 -1.352 14.524 3.106 888 HA HIS 120 HA HIS 120 -1.310 14.943 6.019 889 HD1 HIS 120 HD1 HIS 120 -2.404 11.248 6.956 890 HD2 HIS 120 HD2 HIS 120 -2.581 11.650 2.815 891 HE1 HIS 120 HE1 HIS 120 -2.138 8.934 6.050 892 HE2 HIS 120 HE2 HIS 120 -2.556 9.174 3.566 893 HB2 HIS 120 HB2 HIS 120 -3.103 13.568 6.200 894 HB3 HIS 120 HB1 HIS 120 -3.326 13.858 4.484 895 H GLU 121 HN GLU 121 0.163 13.727 7.241 896 HA GLU 121 HA GLU 121 2.078 12.247 5.614 897 HB2 GLU 121 HB2 GLU 121 3.607 12.385 7.451 898 HB3 GLU 121 HB1 GLU 121 2.903 13.973 7.193 899 HG2 GLU 121 HG2 GLU 121 1.471 13.720 9.086 900 HG3 GLU 121 HG1 GLU 121 1.954 12.032 9.280 901 H LEU 122 HN LEU 122 2.987 10.220 6.459 902 HA LEU 122 HA LEU 122 0.989 8.328 6.960 903 HG LEU 122 HG LEU 122 5.119 7.414 6.519 904 HB2 LEU 122 HB2 LEU 122 3.139 6.899 7.668 905 HB3 LEU 122 HB1 LEU 122 2.680 7.192 5.996 906 HD11 LEU 122 HD11 LEU 122 5.460 9.444 5.205 907 HD12 LEU 122 HD12 LEU 122 3.761 9.865 5.419 908 HD13 LEU 122 HD13 LEU 122 4.206 8.414 4.518 909 HD21 LEU 122 HD21 LEU 122 4.126 9.774 8.078 910 HD22 LEU 122 HD22 LEU 122 5.804 9.589 7.550 911 HD23 LEU 122 HD23 LEU 122 5.088 8.412 8.653 912 HA PRO 123 HA PRO 123 0.734 8.879 11.331 913 HB2 PRO 123 HB2 PRO 123 -1.551 7.574 11.665 914 HB3 PRO 123 HB1 PRO 123 -1.489 9.055 10.702 915 HG2 PRO 123 HG2 PRO 123 -1.738 6.224 9.809 916 HG3 PRO 123 HG1 PRO 123 -2.334 7.720 9.057 917 HD2 PRO 123 HD2 PRO 123 0.031 6.275 8.414 918 HD3 PRO 123 HD1 PRO 123 -0.549 7.805 7.719 919 H ALA 124 HN ALA 124 2.005 6.324 9.993 920 HA ALA 124 HA ALA 124 2.980 4.419 10.696 921 HB1 ALA 124 HB1 ALA 124 3.416 4.099 13.083 922 HB2 ALA 124 HB2 ALA 124 2.282 5.397 13.464 923 HB3 ALA 124 HB3 ALA 124 3.769 5.755 12.586 924 H ASP 125 HN ASP 125 0.204 4.451 9.963 925 HA ASP 125 HA ASP 125 -0.469 1.941 11.319 926 HB2 ASP 125 HB2 ASP 125 -2.696 2.253 11.004 927 HB3 ASP 125 HB1 ASP 125 -2.200 3.909 11.286 928 H LEU 126 HN LEU 126 -0.875 0.186 10.130 929 HA LEU 126 HA LEU 126 -0.313 0.365 7.266 930 HG LEU 126 HG LEU 126 0.517 -2.511 6.675 931 HB2 LEU 126 HB2 LEU 126 1.634 -0.496 8.632 932 HB3 LEU 126 HB1 LEU 126 0.640 -1.886 9.025 933 HD11 LEU 126 HD11 LEU 126 0.580 -0.265 5.725 934 HD12 LEU 126 HD12 LEU 126 1.790 -1.316 4.984 935 HD13 LEU 126 HD13 LEU 126 2.277 -0.114 6.181 936 HD21 LEU 126 HD21 LEU 126 2.877 -3.091 6.332 937 HD22 LEU 126 HD22 LEU 126 2.351 -3.393 7.988 938 HD23 LEU 126 HD23 LEU 126 3.329 -1.973 7.619 939 HA PRO 127 HA PRO 127 -4.315 -1.716 7.678 940 HB2 PRO 127 HB2 PRO 127 -4.774 -0.793 4.959 941 HB3 PRO 127 HB1 PRO 127 -5.616 -0.340 6.444 942 HG2 PRO 127 HG2 PRO 127 -3.999 1.336 5.041 943 HG3 PRO 127 HG1 PRO 127 -4.289 1.484 6.790 944 HD2 PRO 127 HD2 PRO 127 -1.946 0.342 5.337 945 HD3 PRO 127 HD1 PRO 127 -1.990 1.296 6.831 946 HA PRO 128 HA PRO 128 -3.308 -5.492 5.590 947 HB2 PRO 128 HB2 PRO 128 -5.849 -6.408 5.074 948 HB3 PRO 128 HB1 PRO 128 -5.028 -6.555 6.635 949 HG2 PRO 128 HG2 PRO 128 -7.047 -4.533 5.734 950 HG3 PRO 128 HG1 PRO 128 -6.914 -5.365 7.293 951 HD2 PRO 128 HD2 PRO 128 -6.089 -2.834 6.980 952 HD3 PRO 128 HD1 PRO 128 -5.221 -3.968 8.038 953 H HIS 129 HN HIS 129 -5.183 -3.013 4.132 954 HA HIS 129 HA HIS 129 -4.986 -4.265 1.497 955 HD1 HIS 129 HD1 HIS 129 -7.846 -2.021 4.088 956 HD2 HIS 129 HD2 HIS 129 -5.643 0.199 1.354 957 HE1 HIS 129 HE1 HIS 129 -7.942 0.350 4.902 958 HE2 HIS 129 HE2 HIS 129 -6.902 1.690 3.041 959 HB2 HIS 129 HB2 HIS 129 -6.454 -2.459 0.694 960 HB3 HIS 129 HB1 HIS 129 -7.185 -3.351 2.014 961 H LEU 130 HN LEU 130 -2.778 -2.968 3.148 962 HA LEU 130 HA LEU 130 -1.635 -1.540 0.842 963 HG LEU 130 HG LEU 130 -1.137 0.740 0.919 964 HB2 LEU 130 HB2 LEU 130 -2.142 -0.494 3.438 965 HB3 LEU 130 HB1 LEU 130 -0.422 -0.438 3.118 966 HD11 LEU 130 HD11 LEU 130 -3.180 2.029 1.062 967 HD12 LEU 130 HD12 LEU 130 -3.569 1.280 2.611 968 HD13 LEU 130 HD13 LEU 130 -3.539 0.305 1.144 969 HD21 LEU 130 HD21 LEU 130 -1.084 2.901 2.045 970 HD22 LEU 130 HD22 LEU 130 0.115 1.793 2.710 971 HD23 LEU 130 HD23 LEU 130 -1.383 2.105 3.589 972 H VAL 131 HN VAL 131 -1.457 -4.233 2.449 973 HA VAL 131 HA VAL 131 1.404 -4.202 2.968 974 HB VAL 131 HB VAL 131 1.115 -6.557 3.711 975 HG11 VAL 131 HG11 VAL 131 -0.070 -6.018 5.776 976 HG12 VAL 131 HG12 VAL 131 -0.720 -4.562 5.023 977 HG13 VAL 131 HG13 VAL 131 1.015 -4.711 5.298 978 HG21 VAL 131 HG21 VAL 131 -1.830 -6.032 3.319 979 HG22 VAL 131 HG22 VAL 131 -1.111 -7.467 4.049 980 HG23 VAL 131 HG23 VAL 131 -0.848 -7.123 2.339 981 HA PRO 132 HA PRO 132 2.369 -5.260 -1.196 982 HB2 PRO 132 HB2 PRO 132 4.657 -6.635 0.138 983 HB3 PRO 132 HB1 PRO 132 4.668 -5.478 -1.197 984 HG2 PRO 132 HG2 PRO 132 5.365 -4.764 1.292 985 HG3 PRO 132 HG1 PRO 132 4.502 -3.655 0.213 986 HD2 PRO 132 HD2 PRO 132 3.521 -5.158 2.572 987 HD3 PRO 132 HD1 PRO 132 2.976 -3.598 1.908 988 HA PRO 133 HA PRO 133 0.542 -9.166 -2.004 989 HB2 PRO 133 HB2 PRO 133 2.936 -9.558 -3.761 990 HB3 PRO 133 HB1 PRO 133 1.220 -9.851 -4.109 991 HG2 PRO 133 HG2 PRO 133 2.403 -7.650 -4.995 992 HG3 PRO 133 HG1 PRO 133 0.747 -7.593 -4.348 993 HD2 PRO 133 HD2 PRO 133 3.290 -6.623 -3.133 994 HD3 PRO 133 HD1 PRO 133 1.629 -6.024 -2.930 995 H SER 134 HN SER 134 3.962 -9.233 -1.082 996 HA SER 134 HA SER 134 3.895 -12.121 -0.751 997 HG SER 134 HG SER 134 6.095 -11.819 -2.407 998 HB2 SER 134 HB2 SER 134 6.141 -10.190 -0.141 999 HB3 SER 134 HB1 SER 134 6.263 -11.947 -0.277 1000 H LYS 135 HN LYS 135 3.097 -9.474 1.204 1001 HA LYS 135 HA LYS 135 3.638 -11.104 3.596 1002 HB2 LYS 135 HB2 LYS 135 3.469 -8.677 4.728 1003 HB3 LYS 135 HB1 LYS 135 4.975 -9.385 4.171 1004 HG2 LYS 135 HG2 LYS 135 3.371 -7.646 2.335 1005 HG3 LYS 135 HG1 LYS 135 4.399 -6.930 3.585 1006 HD2 LYS 135 HD2 LYS 135 5.353 -8.912 1.513 1007 HD3 LYS 135 HD1 LYS 135 5.507 -7.162 1.354 1008 HE2 LYS 135 HE2 LYS 135 6.878 -7.085 3.368 1009 HE3 LYS 135 HE1 LYS 135 6.674 -8.822 3.584 1010 HZ1 LYS 135 HZ1 LYS 135 7.843 -9.157 1.472 1011 HZ2 LYS 135 HZ2 LYS 135 8.804 -8.348 2.605 1012 HZ3 LYS 135 HZ3 LYS 135 8.096 -7.486 1.330 1013 H ARG 136 HN ARG 136 1.200 -10.379 1.714 1014 HA ARG 136 HA ARG 136 -0.781 -9.754 3.734 1015 HE ARG 136 HE ARG 136 -3.187 -12.208 -0.056 1016 HB2 ARG 136 HB2 ARG 136 -2.343 -10.442 1.722 1017 HB3 ARG 136 HB1 ARG 136 -1.510 -8.891 1.729 1018 HG2 ARG 136 HG2 ARG 136 -0.260 -9.416 -0.041 1019 HG3 ARG 136 HG1 ARG 136 0.039 -11.056 0.533 1020 HD2 ARG 136 HD2 ARG 136 -2.542 -10.150 -0.742 1021 HD3 ARG 136 HD1 ARG 136 -1.219 -10.913 -1.621 1022 HH11 ARG 136 HH11 ARG 136 0.250 -12.394 -0.786 1023 HH12 ARG 136 HH12 ARG 136 0.342 -14.104 -0.519 1024 HH21 ARG 136 HH21 ARG 136 -3.053 -14.479 0.266 1025 HH22 ARG 136 HH22 ARG 136 -1.545 -15.293 0.043 1026 H ARG 137 HN ARG 137 -0.810 -11.389 5.230 1027 HA ARG 137 HA ARG 137 -2.185 -13.775 4.543 1028 HE ARG 137 HE ARG 137 1.980 -14.927 7.108 1029 HB2 ARG 137 HB2 ARG 137 -0.241 -15.251 5.478 1030 HB3 ARG 137 HB1 ARG 137 -0.268 -14.809 3.779 1031 HG2 ARG 137 HG2 ARG 137 1.442 -13.223 4.049 1032 HG3 ARG 137 HG1 ARG 137 1.269 -13.221 5.805 1033 HD2 ARG 137 HD2 ARG 137 2.047 -15.703 4.326 1034 HD3 ARG 137 HD1 ARG 137 3.248 -14.486 4.762 1035 HH11 ARG 137 HH11 ARG 137 3.390 -17.128 4.777 1036 HH12 ARG 137 HH12 ARG 137 3.764 -18.341 5.970 1037 HH21 ARG 137 HH21 ARG 137 2.466 -16.510 8.681 1038 HH22 ARG 137 HH22 ARG 137 3.240 -17.987 8.173 1039 H HIS 138 HN HIS 138 -3.146 -14.626 6.289 1040 HA HIS 138 HA HIS 138 -2.701 -13.233 8.808 1041 HD1 HIS 138 HD1 HIS 138 -5.708 -12.227 10.032 1042 HD2 HIS 138 HD2 HIS 138 -5.360 -12.856 5.930 1043 HE1 HIS 138 HE1 HIS 138 -6.848 -10.268 8.942 1044 HE2 HIS 138 HE2 HIS 138 -6.742 -10.728 6.473 1045 HB2 HIS 138 HB2 HIS 138 -4.898 -15.020 7.775 1046 HB3 HIS 138 HB1 HIS 138 -4.815 -14.528 9.463 1047 H GLU 139 HN GLU 139 -0.947 -14.104 9.678 1048 HA GLU 139 HA GLU 139 -0.949 -16.161 11.412 1049 HB2 GLU 139 HB2 GLU 139 -0.215 -17.171 8.697 1050 HB3 GLU 139 HB1 GLU 139 0.759 -17.709 10.053 1051 HG2 GLU 139 HG2 GLU 139 -2.171 -18.162 9.582 1052 HG3 GLU 139 HG1 GLU 139 -0.883 -19.359 9.695 Start of MODEL 7 1 H1 GLY 1 HT1 GLY 1 -14.099 11.090 42.458 2 H2 GLY 1 HT2 GLY 1 -13.405 10.855 40.932 3 H3 GLY 1 HT3 GLY 1 -12.747 12.002 41.994 4 HA2 GLY 1 HA1 GLY 1 -12.160 10.217 43.546 5 HA3 GLY 1 HA2 GLY 1 -12.771 9.061 42.371 6 HA PRO 2 HA PRO 2 -8.196 10.415 41.625 7 HB2 PRO 2 HB2 PRO 2 -7.524 7.861 42.946 8 HB3 PRO 2 HB1 PRO 2 -6.768 9.447 43.118 9 HG2 PRO 2 HG2 PRO 2 -8.285 8.420 45.062 10 HG3 PRO 2 HG1 PRO 2 -8.305 10.153 44.693 11 HD2 PRO 2 HD2 PRO 2 -10.290 8.037 43.941 12 HD3 PRO 2 HD1 PRO 2 -10.571 9.700 44.501 13 H LEU 3 HN LEU 3 -7.484 9.827 39.682 14 HA LEU 3 HA LEU 3 -8.677 7.644 38.288 15 HG LEU 3 HG LEU 3 -9.340 9.511 36.823 16 HB2 LEU 3 HB2 LEU 3 -6.410 9.477 37.509 17 HB3 LEU 3 HB1 LEU 3 -7.103 8.270 36.446 18 HD11 LEU 3 HD11 LEU 3 -9.151 11.871 37.352 19 HD12 LEU 3 HD12 LEU 3 -7.419 11.692 37.628 20 HD13 LEU 3 HD13 LEU 3 -8.568 10.894 38.702 21 HD21 LEU 3 HD21 LEU 3 -8.097 9.470 34.715 22 HD22 LEU 3 HD22 LEU 3 -7.118 10.830 35.268 23 HD23 LEU 3 HD23 LEU 3 -8.847 11.041 34.999 24 H GLY 4 HN GLY 4 -7.678 5.759 37.511 25 HA2 GLY 4 HA2 GLY 4 -5.704 4.294 37.531 26 HA3 GLY 4 HA1 GLY 4 -5.315 4.976 39.105 27 H SER 5 HN SER 5 -8.444 4.838 39.403 28 HA SER 5 HA SER 5 -8.507 2.193 40.580 29 HG SER 5 HG SER 5 -8.445 4.350 41.775 30 HB2 SER 5 HB2 SER 5 -10.676 4.310 40.427 31 HB3 SER 5 HB1 SER 5 -10.707 2.861 41.435 32 H GLU 6 HN GLU 6 -10.162 0.625 40.000 33 HA GLU 6 HA GLU 6 -10.154 0.254 37.194 34 HB2 GLU 6 HB2 GLU 6 -11.659 -1.299 39.298 35 HB3 GLU 6 HB1 GLU 6 -11.398 -1.811 37.636 36 HG2 GLU 6 HG2 GLU 6 -9.426 -1.593 39.873 37 HG3 GLU 6 HG1 GLU 6 -9.800 -2.979 38.853 38 H SER 7 HN SER 7 -11.527 0.803 35.700 39 HA SER 7 HA SER 7 -13.947 2.221 36.371 40 HG SER 7 HG SER 7 -11.836 3.083 35.395 41 HB2 SER 7 HB2 SER 7 -12.972 1.400 33.629 42 HB3 SER 7 HB1 SER 7 -14.086 2.708 34.026 43 H LEU 8 HN LEU 8 -16.007 1.471 36.225 44 HA LEU 8 HA LEU 8 -16.260 -1.411 35.754 45 HG LEU 8 HG LEU 8 -16.072 0.114 38.539 46 HB2 LEU 8 HB2 LEU 8 -18.101 0.464 37.240 47 HB3 LEU 8 HB1 LEU 8 -18.320 -1.271 37.076 48 HD11 LEU 8 HD11 LEU 8 -17.039 -0.896 40.519 49 HD12 LEU 8 HD12 LEU 8 -18.331 -1.604 39.552 50 HD13 LEU 8 HD13 LEU 8 -18.215 0.149 39.722 51 HD21 LEU 8 HD21 LEU 8 -15.350 -2.114 39.193 52 HD22 LEU 8 HD22 LEU 8 -15.294 -1.928 37.439 53 HD23 LEU 8 HD23 LEU 8 -16.611 -2.833 38.186 54 H MET 9 HN MET 9 -18.308 -2.174 34.835 55 HA MET 9 HA MET 9 -19.106 -0.451 32.589 56 HB2 MET 9 HB2 MET 9 -19.309 -3.457 32.853 57 HB3 MET 9 HB1 MET 9 -19.744 -2.518 31.437 58 HG2 MET 9 HG2 MET 9 -17.428 -1.849 31.149 59 HG3 MET 9 HG1 MET 9 -16.977 -2.755 32.591 60 HE1 MET 9 HE1 MET 9 -15.510 -3.132 29.833 61 HE2 MET 9 HE2 MET 9 -15.400 -4.889 29.728 62 HE3 MET 9 HE3 MET 9 -15.114 -4.078 31.268 63 HA PRO 10 HA PRO 10 -23.195 -0.118 34.260 64 HB2 PRO 10 HB2 PRO 10 -24.630 -0.027 31.906 65 HB3 PRO 10 HB1 PRO 10 -23.791 1.354 32.620 66 HG2 PRO 10 HG2 PRO 10 -22.922 -0.462 30.418 67 HG3 PRO 10 HG1 PRO 10 -22.735 1.297 30.566 68 HD2 PRO 10 HD2 PRO 10 -20.692 -0.396 31.048 69 HD3 PRO 10 HD1 PRO 10 -20.898 1.107 31.968 70 H SER 11 HN SER 11 -22.673 -2.455 31.645 71 HA SER 11 HA SER 11 -24.854 -4.117 32.582 72 HG SER 11 HG SER 11 -24.686 -2.881 30.390 73 HB2 SER 11 HB2 SER 11 -22.796 -4.656 30.426 74 HB3 SER 11 HB1 SER 11 -24.273 -5.576 30.709 75 H GLN 12 HN GLN 12 -24.167 -4.654 34.670 76 HA GLN 12 HA GLN 12 -21.712 -6.220 34.905 77 HB2 GLN 12 HB2 GLN 12 -22.109 -4.508 36.606 78 HB3 GLN 12 HB1 GLN 12 -23.652 -5.242 37.014 79 HG2 GLN 12 HG2 GLN 12 -22.556 -7.199 37.874 80 HG3 GLN 12 HG1 GLN 12 -20.987 -6.602 37.335 81 HE21 GLN 12 HE21 GLN 12 -19.985 -4.954 38.488 82 HE22 GLN 12 HE22 GLN 12 -20.507 -4.475 40.063 83 H VAL 13 HN VAL 13 -22.178 -8.130 33.937 84 HA VAL 13 HA VAL 13 -24.459 -9.641 34.994 85 HB VAL 13 HB VAL 13 -24.262 -11.036 32.919 86 HG11 VAL 13 HG11 VAL 13 -25.969 -9.321 33.133 87 HG12 VAL 13 HG12 VAL 13 -25.386 -9.423 31.473 88 HG13 VAL 13 HG13 VAL 13 -24.851 -8.105 32.515 89 HG21 VAL 13 HG21 VAL 13 -21.959 -10.471 32.335 90 HG22 VAL 13 HG22 VAL 13 -22.444 -8.807 32.004 91 HG23 VAL 13 HG23 VAL 13 -23.062 -10.124 31.005 92 H VAL 14 HN VAL 14 -24.106 -11.432 36.100 93 HA VAL 14 HA VAL 14 -21.419 -12.638 35.984 94 HB VAL 14 HB VAL 14 -21.662 -11.617 38.155 95 HG11 VAL 14 HG11 VAL 14 -24.072 -11.411 38.272 96 HG12 VAL 14 HG12 VAL 14 -23.459 -12.222 39.713 97 HG13 VAL 14 HG13 VAL 14 -24.236 -13.158 38.435 98 HG21 VAL 14 HG21 VAL 14 -22.045 -14.605 38.324 99 HG22 VAL 14 HG22 VAL 14 -21.434 -13.581 39.622 100 HG23 VAL 14 HG23 VAL 14 -20.515 -13.747 38.125 101 H LYS 15 HN LYS 15 -21.354 -14.668 35.322 102 HA LYS 15 HA LYS 15 -23.864 -16.199 35.284 103 HB2 LYS 15 HB2 LYS 15 -21.507 -16.342 33.399 104 HB3 LYS 15 HB1 LYS 15 -22.879 -17.433 33.351 105 HG2 LYS 15 HG2 LYS 15 -23.041 -14.452 32.966 106 HG3 LYS 15 HG1 LYS 15 -22.989 -15.640 31.661 107 HD2 LYS 15 HD2 LYS 15 -25.115 -15.458 33.799 108 HD3 LYS 15 HD1 LYS 15 -25.282 -14.891 32.134 109 HE2 LYS 15 HE2 LYS 15 -24.813 -17.740 33.014 110 HE3 LYS 15 HE1 LYS 15 -26.337 -17.071 32.435 111 HZ1 LYS 15 HZ1 LYS 15 -23.834 -17.368 30.875 112 HZ2 LYS 15 HZ2 LYS 15 -25.230 -16.602 30.302 113 HZ3 LYS 15 HZ3 LYS 15 -25.259 -18.259 30.671 114 H GLY 16 HN GLY 16 -23.809 -17.514 36.990 115 HA2 GLY 16 HA2 GLY 16 -21.441 -18.604 38.108 116 HA3 GLY 16 HA1 GLY 16 -23.086 -19.107 38.473 117 H GLY 17 HN GLY 17 -20.250 -20.272 37.444 118 HA2 GLY 17 HA2 GLY 17 -19.863 -22.454 36.693 119 HA3 GLY 17 HA1 GLY 17 -21.540 -22.553 36.186 120 H ALA 18 HN ALA 18 -19.699 -19.796 35.227 121 HA ALA 18 HA ALA 18 -19.493 -20.921 32.513 122 HB1 ALA 18 HB1 ALA 18 -19.809 -18.023 33.286 123 HB2 ALA 18 HB2 ALA 18 -21.103 -19.064 32.690 124 HB3 ALA 18 HB3 ALA 18 -19.736 -18.665 31.647 125 H PHE 19 HN PHE 19 -17.541 -20.946 31.568 126 HA PHE 19 HA PHE 19 -15.253 -20.155 33.122 127 HD1 PHE 19 HD1 PHE 19 -17.313 -22.581 30.695 128 HD2 PHE 19 HD2 PHE 19 -13.921 -20.674 28.965 129 HE1 PHE 19 HE1 PHE 19 -18.215 -23.015 28.445 130 HE2 PHE 19 HE2 PHE 19 -14.815 -21.109 26.722 131 HZ PHE 19 HZ PHE 19 -16.964 -22.278 26.450 132 HB2 PHE 19 HB2 PHE 19 -13.939 -21.118 31.230 133 HB3 PHE 19 HB1 PHE 19 -15.097 -22.238 31.931 134 H ASP 20 HN ASP 20 -14.370 -18.245 33.095 135 HA ASP 20 HA ASP 20 -14.374 -16.661 30.643 136 HB2 ASP 20 HB2 ASP 20 -16.392 -15.924 31.813 137 HB3 ASP 20 HB1 ASP 20 -15.462 -15.650 33.284 138 H GLY 21 HN GLY 21 -12.528 -15.548 30.366 139 HA2 GLY 21 HA2 GLY 21 -10.802 -15.153 32.723 140 HA3 GLY 21 HA1 GLY 21 -10.148 -15.860 31.251 141 H THR 22 HN THR 22 -11.952 -13.007 32.359 142 HA THR 22 HA THR 22 -10.673 -11.456 30.219 143 HB THR 22 HB THR 22 -12.504 -9.774 30.734 144 HG1 THR 22 HG1 THR 22 -13.873 -11.960 31.927 145 HG21 THR 22 HG21 THR 22 -14.191 -10.988 29.441 146 HG22 THR 22 HG22 THR 22 -13.352 -12.504 29.768 147 HG23 THR 22 HG23 THR 22 -12.576 -11.261 28.788 148 H MET 23 HN MET 23 -9.633 -9.529 30.667 149 HA MET 23 HA MET 23 -9.492 -8.571 33.404 150 HB2 MET 23 HB2 MET 23 -7.035 -8.554 33.447 151 HB3 MET 23 HB1 MET 23 -7.655 -10.194 33.312 152 HG2 MET 23 HG2 MET 23 -7.172 -10.185 30.918 153 HG3 MET 23 HG1 MET 23 -6.553 -8.540 31.047 154 HE1 MET 23 HE1 MET 23 -6.117 -11.570 33.537 155 HE2 MET 23 HE2 MET 23 -4.581 -12.236 32.985 156 HE3 MET 23 HE3 MET 23 -5.999 -12.312 31.941 157 H ASN 24 HN ASN 24 -9.088 -6.391 33.519 158 HA ASN 24 HA ASN 24 -9.172 -5.010 30.934 159 HB2 ASN 24 HB2 ASN 24 -9.967 -4.066 33.696 160 HB3 ASN 24 HB1 ASN 24 -10.044 -3.082 32.238 161 HD21 ASN 24 HD21 ASN 24 -12.180 -3.958 34.063 162 HD22 ASN 24 HD22 ASN 24 -13.327 -4.779 33.069 163 H GLY 25 HN GLY 25 -7.832 -3.272 30.471 164 HA2 GLY 25 HA2 GLY 25 -6.250 -1.598 31.379 165 HA3 GLY 25 HA1 GLY 25 -5.563 -2.905 32.320 166 HA PRO 26 HA PRO 26 -2.968 -4.302 28.829 167 HB2 PRO 26 HB2 PRO 26 -4.428 -5.895 27.055 168 HB3 PRO 26 HB1 PRO 26 -3.476 -6.477 28.425 169 HG2 PRO 26 HG2 PRO 26 -6.407 -5.961 28.228 170 HG3 PRO 26 HG1 PRO 26 -5.550 -7.256 29.086 171 HD2 PRO 26 HD2 PRO 26 -6.577 -5.194 30.417 172 HD3 PRO 26 HD1 PRO 26 -4.998 -5.867 30.879 173 H PHE 27 HN PHE 27 -6.232 -3.644 27.616 174 HA PHE 27 HA PHE 27 -5.044 -1.801 25.661 175 HD1 PHE 27 HD2 PHE 27 -6.537 -5.652 25.708 176 HD2 PHE 27 HD1 PHE 27 -9.189 -2.434 24.870 177 HE1 PHE 27 HE2 PHE 27 -8.447 -7.063 26.356 178 HE2 PHE 27 HE1 PHE 27 -11.101 -3.834 25.521 179 HZ PHE 27 HZ PHE 27 -10.730 -6.156 26.266 180 HB2 PHE 27 HB2 PHE 27 -6.902 -2.389 24.101 181 HB3 PHE 27 HB1 PHE 27 -5.808 -3.730 24.417 182 H GLY 28 HN GLY 28 -6.554 -0.069 24.981 183 HA2 GLY 28 HA2 GLY 28 -7.891 1.063 27.263 184 HA3 GLY 28 HA1 GLY 28 -7.781 1.767 25.656 185 H HIS 29 HN HIS 29 -10.126 1.724 27.324 186 HA HIS 29 HA HIS 29 -11.807 -0.388 26.321 187 HD1 HIS 29 HD1 HIS 29 -13.183 3.452 26.614 188 HD2 HIS 29 HD2 HIS 29 -11.907 2.269 30.385 189 HE1 HIS 29 HE1 HIS 29 -13.057 5.559 27.977 190 HE2 HIS 29 HE2 HIS 29 -12.586 4.760 30.315 191 HB2 HIS 29 HB2 HIS 29 -13.635 0.710 27.600 192 HB3 HIS 29 HB1 HIS 29 -12.238 0.308 28.580 193 H GLY 30 HN GLY 30 -12.977 -0.386 24.548 194 HA2 GLY 30 HA2 GLY 30 -13.408 2.165 23.147 195 HA3 GLY 30 HA1 GLY 30 -13.463 0.573 22.404 196 H TYR 31 HN TYR 31 -15.519 1.803 21.644 197 HA TYR 31 HA TYR 31 -17.682 1.182 23.546 198 HD1 TYR 31 HD1 TYR 31 -18.861 3.019 24.759 199 HD2 TYR 31 HD2 TYR 31 -16.452 5.010 21.870 200 HE1 TYR 31 HE1 TYR 31 -18.342 4.763 26.411 201 HE2 TYR 31 HE2 TYR 31 -15.921 6.761 23.514 202 HH TYR 31 HH TYR 31 -16.508 6.447 26.809 203 HB2 TYR 31 HB2 TYR 31 -17.628 3.136 21.236 204 HB3 TYR 31 HB1 TYR 31 -19.080 2.718 22.139 205 H GLY 32 HN GLY 32 -19.767 0.508 22.419 206 HA2 GLY 32 HA2 GLY 32 -19.238 -1.767 20.772 207 HA3 GLY 32 HA1 GLY 32 -20.824 -1.175 21.249 208 H GLU 33 HN GLU 33 -18.383 -1.172 18.826 209 HA GLU 33 HA GLU 33 -20.163 0.353 17.039 210 HB2 GLU 33 HB2 GLU 33 -17.155 0.571 17.265 211 HB3 GLU 33 HB1 GLU 33 -18.093 1.267 15.954 212 HG2 GLU 33 HG2 GLU 33 -19.177 2.779 17.448 213 HG3 GLU 33 HG1 GLU 33 -18.475 1.974 18.851 214 H GLY 34 HN GLY 34 -20.068 -0.254 14.836 215 HA2 GLY 34 HA2 GLY 34 -19.211 -2.958 14.325 216 HA3 GLY 34 HA1 GLY 34 -19.965 -1.862 13.170 217 H ALA 35 HN ALA 35 -17.032 -3.153 14.367 218 HA ALA 35 HA ALA 35 -15.354 -1.148 13.124 219 HB1 ALA 35 HB1 ALA 35 -14.683 -2.132 15.250 220 HB2 ALA 35 HB2 ALA 35 -13.495 -2.464 13.991 221 HB3 ALA 35 HB3 ALA 35 -14.620 -3.727 14.498 222 H GLY 36 HN GLY 36 -13.625 -1.787 11.619 223 HA2 GLY 36 HA2 GLY 36 -14.646 -3.768 9.701 224 HA3 GLY 36 HA1 GLY 36 -13.765 -2.313 9.242 225 H GLU 37 HN GLU 37 -13.569 -5.545 10.233 226 HA GLU 37 HA GLU 37 -10.791 -5.581 10.918 227 HB2 GLU 37 HB2 GLU 37 -12.846 -7.691 10.335 228 HB3 GLU 37 HB1 GLU 37 -11.168 -8.099 10.670 229 HG2 GLU 37 HG2 GLU 37 -11.421 -6.875 12.848 230 HG3 GLU 37 HG1 GLU 37 -13.143 -6.750 12.491 231 H GLY 38 HN GLY 38 -9.632 -7.580 9.611 232 HA2 GLY 38 HA2 GLY 38 -9.190 -6.494 6.987 233 HA3 GLY 38 HA1 GLY 38 -8.349 -7.873 7.687 234 H ILE 39 HN ILE 39 -11.386 -6.813 6.414 235 HA ILE 39 HA ILE 39 -12.547 -9.332 5.954 236 HB ILE 39 HB ILE 39 -13.099 -6.923 4.226 237 HG12 ILE 39 HG12 ILE 39 -14.228 -7.385 6.987 238 HG13 ILE 39 HG11 ILE 39 -12.978 -6.209 6.632 239 HG21 ILE 39 HG21 ILE 39 -14.833 -9.099 5.378 240 HG22 ILE 39 HG22 ILE 39 -14.231 -9.023 3.723 241 HG23 ILE 39 HG23 ILE 39 -15.378 -7.812 4.297 242 HD11 ILE 39 HD11 ILE 39 -15.745 -6.193 5.471 243 HD12 ILE 39 HD12 ILE 39 -14.472 -5.005 5.177 244 HD13 ILE 39 HD13 ILE 39 -15.163 -5.175 6.790 245 H ASP 40 HN ASP 40 -12.770 -10.433 3.855 246 HA ASP 40 HA ASP 40 -10.333 -10.395 2.351 247 HB2 ASP 40 HB2 ASP 40 -12.941 -11.868 2.012 248 HB3 ASP 40 HB1 ASP 40 -11.674 -11.954 0.791 249 H ASP 41 HN ASP 41 -10.687 -8.030 2.103 250 HA ASP 41 HA ASP 41 -11.499 -7.660 -0.697 251 HB2 ASP 41 HB2 ASP 41 -13.335 -6.676 0.588 252 HB3 ASP 41 HB1 ASP 41 -12.193 -5.757 1.567 253 H VAL 42 HN VAL 42 -9.543 -7.368 -1.589 254 HA VAL 42 HA VAL 42 -7.736 -5.494 -0.219 255 HB VAL 42 HB VAL 42 -6.897 -7.783 -2.012 256 HG11 VAL 42 HG11 VAL 42 -5.270 -5.872 -0.343 257 HG12 VAL 42 HG12 VAL 42 -5.372 -5.892 -2.104 258 HG13 VAL 42 HG13 VAL 42 -4.634 -7.246 -1.249 259 HG21 VAL 42 HG21 VAL 42 -7.755 -8.640 0.092 260 HG22 VAL 42 HG22 VAL 42 -6.729 -7.518 0.988 261 HG23 VAL 42 HG23 VAL 42 -6.000 -8.807 0.034 262 H GLU 43 HN GLU 43 -8.557 -3.719 -1.301 263 HA GLU 43 HA GLU 43 -7.680 -3.578 -4.105 264 HB2 GLU 43 HB2 GLU 43 -10.092 -3.263 -3.963 265 HB3 GLU 43 HB1 GLU 43 -9.882 -2.008 -2.745 266 HG2 GLU 43 HG2 GLU 43 -8.718 -0.619 -4.394 267 HG3 GLU 43 HG1 GLU 43 -8.936 -1.888 -5.602 268 H TRP 44 HN TRP 44 -5.604 -3.034 -3.559 269 HA TRP 44 HA TRP 44 -5.201 -0.594 -2.016 270 HD1 TRP 44 HD1 TRP 44 -3.384 0.929 -1.826 271 HE1 TRP 44 HE1 TRP 44 -1.064 1.722 -1.047 272 HE3 TRP 44 HE3 TRP 44 -1.033 -3.533 -1.660 273 HZ2 TRP 44 HZ2 TRP 44 1.446 0.563 -0.438 274 HZ3 TRP 44 HZ3 TRP 44 1.317 -3.624 -1.013 275 HH2 TRP 44 HH2 TRP 44 2.537 -1.613 -0.380 276 HB2 TRP 44 HB2 TRP 44 -3.829 -2.597 -1.485 277 HB3 TRP 44 HB1 TRP 44 -3.164 -2.533 -3.122 278 H VAL 45 HN VAL 45 -4.434 1.190 -2.844 279 HA VAL 45 HA VAL 45 -4.812 1.742 -5.601 280 HB VAL 45 HB VAL 45 -3.439 3.513 -3.596 281 HG11 VAL 45 HG11 VAL 45 -4.520 5.325 -4.845 282 HG12 VAL 45 HG12 VAL 45 -5.255 4.137 -5.923 283 HG13 VAL 45 HG13 VAL 45 -3.503 4.333 -5.891 284 HG21 VAL 45 HG21 VAL 45 -5.748 4.348 -3.007 285 HG22 VAL 45 HG22 VAL 45 -5.358 2.734 -2.410 286 HG23 VAL 45 HG23 VAL 45 -6.390 2.925 -3.828 287 H VAL 46 HN VAL 46 -2.262 0.222 -4.120 288 HA VAL 46 HA VAL 46 -0.214 1.438 -5.779 289 HB VAL 46 HB VAL 46 -0.175 -0.551 -3.538 290 HG11 VAL 46 HG11 VAL 46 2.048 -0.396 -5.573 291 HG12 VAL 46 HG12 VAL 46 1.012 -1.792 -5.278 292 HG13 VAL 46 HG13 VAL 46 2.111 -1.234 -4.019 293 HG21 VAL 46 HG21 VAL 46 1.717 0.857 -2.866 294 HG22 VAL 46 HG22 VAL 46 0.258 1.802 -3.164 295 HG23 VAL 46 HG23 VAL 46 1.553 1.778 -4.360 296 H GLY 47 HN GLY 47 -2.484 -1.082 -6.033 297 HA2 GLY 47 HA2 GLY 47 -1.104 -2.827 -7.780 298 HA3 GLY 47 HA1 GLY 47 -2.857 -2.655 -7.668 299 H LYS 48 HN LYS 48 -2.266 0.344 -8.230 300 HA LYS 48 HA LYS 48 -2.401 0.058 -11.134 301 HB2 LYS 48 HB2 LYS 48 -3.213 2.463 -10.993 302 HB3 LYS 48 HB1 LYS 48 -4.281 1.232 -10.350 303 HG2 LYS 48 HG2 LYS 48 -3.600 1.802 -8.102 304 HG3 LYS 48 HG1 LYS 48 -2.448 2.981 -8.733 305 HD2 LYS 48 HD2 LYS 48 -5.423 3.095 -9.215 306 HD3 LYS 48 HD1 LYS 48 -4.606 3.953 -7.914 307 HE2 LYS 48 HE2 LYS 48 -3.912 4.293 -10.821 308 HE3 LYS 48 HE1 LYS 48 -5.077 5.307 -9.977 309 HZ1 LYS 48 HZ1 LYS 48 -3.000 6.420 -9.956 310 HZ2 LYS 48 HZ2 LYS 48 -2.168 5.054 -9.413 311 HZ3 LYS 48 HZ3 LYS 48 -3.253 5.851 -8.385 312 H ASP 49 HN ASP 49 -0.414 1.414 -8.627 313 HA ASP 49 HA ASP 49 1.061 2.990 -10.619 314 HB2 ASP 49 HB2 ASP 49 1.031 3.287 -7.607 315 HB3 ASP 49 HB1 ASP 49 1.893 4.326 -8.738 316 H LYS 50 HN LYS 50 1.206 0.090 -9.171 317 HA LYS 50 HA LYS 50 3.707 -0.270 -8.107 318 HB2 LYS 50 HB2 LYS 50 1.876 -1.958 -8.211 319 HB3 LYS 50 HB1 LYS 50 2.266 -2.218 -9.904 320 HG2 LYS 50 HG2 LYS 50 4.556 -2.910 -9.197 321 HG3 LYS 50 HG1 LYS 50 4.011 -2.804 -7.524 322 HD2 LYS 50 HD2 LYS 50 2.352 -4.498 -7.890 323 HD3 LYS 50 HD1 LYS 50 2.696 -4.524 -9.618 324 HE2 LYS 50 HE2 LYS 50 3.771 -6.420 -8.688 325 HE3 LYS 50 HE1 LYS 50 5.037 -5.248 -9.029 326 HZ1 LYS 50 HZ1 LYS 50 4.922 -4.602 -6.654 327 HZ2 LYS 50 HZ2 LYS 50 5.427 -6.195 -6.899 328 HZ3 LYS 50 HZ3 LYS 50 3.845 -5.882 -6.379 329 HA PRO 51 HA PRO 51 5.481 -1.131 -12.584 330 HB2 PRO 51 HB2 PRO 51 4.232 0.301 -14.574 331 HB3 PRO 51 HB1 PRO 51 3.914 -1.408 -14.224 332 HG2 PRO 51 HG2 PRO 51 2.374 1.020 -13.390 333 HG3 PRO 51 HG1 PRO 51 1.776 -0.552 -13.959 334 HD2 PRO 51 HD2 PRO 51 1.784 0.101 -11.349 335 HD3 PRO 51 HD1 PRO 51 2.099 -1.562 -11.898 336 H THR 52 HN THR 52 4.001 1.914 -11.659 337 HA THR 52 HA THR 52 6.017 3.570 -12.825 338 HB THR 52 HB THR 52 3.947 4.172 -10.704 339 HG1 THR 52 HG1 THR 52 3.988 4.236 -13.526 340 HG21 THR 52 HG21 THR 52 4.318 6.533 -11.269 341 HG22 THR 52 HG22 THR 52 5.624 6.063 -12.359 342 HG23 THR 52 HG23 THR 52 5.781 5.788 -10.624 343 H TYR 53 HN TYR 53 5.389 2.196 -9.658 344 HA TYR 53 HA TYR 53 7.605 3.476 -8.385 345 HD1 TYR 53 HD2 TYR 53 6.408 4.664 -7.099 346 HD2 TYR 53 HD1 TYR 53 4.000 1.196 -6.605 347 HE1 TYR 53 HE2 TYR 53 4.550 6.070 -6.318 348 HE2 TYR 53 HE1 TYR 53 2.130 2.594 -5.844 349 HH TYR 53 HH TYR 53 2.051 5.923 -6.214 350 HB2 TYR 53 HB2 TYR 53 6.074 0.989 -7.643 351 HB3 TYR 53 HB1 TYR 53 7.183 1.838 -6.576 352 H ASP 54 HN ASP 54 7.126 0.631 -10.281 353 HA ASP 54 HA ASP 54 9.631 -0.632 -9.559 354 HB2 ASP 54 HB2 ASP 54 7.747 -1.999 -10.236 355 HB3 ASP 54 HB1 ASP 54 7.625 -1.169 -11.779 356 H GLU 55 HN GLU 55 8.479 1.492 -12.156 357 HA GLU 55 HA GLU 55 10.863 1.290 -13.706 358 HB2 GLU 55 HB2 GLU 55 10.049 3.176 -14.953 359 HB3 GLU 55 HB1 GLU 55 8.712 2.091 -14.630 360 HG2 GLU 55 HG2 GLU 55 7.968 3.545 -12.811 361 HG3 GLU 55 HG1 GLU 55 9.307 4.650 -13.174 362 H ILE 56 HN ILE 56 9.755 3.589 -11.246 363 HA ILE 56 HA ILE 56 12.102 5.165 -11.235 364 HB ILE 56 HB ILE 56 10.213 4.568 -8.942 365 HG12 ILE 56 HG12 ILE 56 10.253 6.944 -10.817 366 HG13 ILE 56 HG11 ILE 56 9.195 5.543 -11.036 367 HG21 ILE 56 HG21 ILE 56 12.184 6.820 -9.309 368 HG22 ILE 56 HG22 ILE 56 12.335 5.485 -8.166 369 HG23 ILE 56 HG23 ILE 56 11.035 6.663 -7.980 370 HD11 ILE 56 HD11 ILE 56 8.153 6.011 -8.876 371 HD12 ILE 56 HD12 ILE 56 8.007 7.365 -9.997 372 HD13 ILE 56 HD13 ILE 56 9.192 7.425 -8.691 373 H PHE 57 HN PHE 57 11.228 2.131 -9.852 374 HA PHE 57 HA PHE 57 13.367 1.717 -8.082 375 HD1 PHE 57 HD2 PHE 57 14.639 -0.153 -8.074 376 HD2 PHE 57 HD1 PHE 57 10.936 -2.208 -7.883 377 HE1 PHE 57 HE2 PHE 57 15.731 -2.017 -6.922 378 HE2 PHE 57 HE1 PHE 57 12.040 -4.080 -6.745 379 HZ PHE 57 HZ PHE 57 14.283 -4.145 -6.416 380 HB2 PHE 57 HB2 PHE 57 11.266 0.459 -8.072 381 HB3 PHE 57 HB1 PHE 57 11.649 -0.218 -9.644 382 H TYR 58 HN TYR 58 12.913 0.430 -11.414 383 HA TYR 58 HA TYR 58 15.524 -0.595 -11.642 384 HD1 TYR 58 HD1 TYR 58 12.152 -1.640 -12.273 385 HD2 TYR 58 HD2 TYR 58 15.798 -2.524 -14.265 386 HE1 TYR 58 HE1 TYR 58 11.660 -4.039 -12.097 387 HE2 TYR 58 HE2 TYR 58 15.318 -4.927 -14.091 388 HH TYR 58 HH TYR 58 13.986 -6.431 -12.663 389 HB2 TYR 58 HB2 TYR 58 13.379 0.071 -13.609 390 HB3 TYR 58 HB1 TYR 58 15.003 -0.292 -14.201 391 H THR 59 HN THR 59 14.256 2.569 -12.008 392 HA THR 59 HA THR 59 16.425 3.742 -13.382 393 HB THR 59 HB THR 59 14.276 4.838 -11.572 394 HG1 THR 59 HG1 THR 59 13.995 5.714 -14.012 395 HG21 THR 59 HG21 THR 59 16.254 6.382 -13.243 396 HG22 THR 59 HG22 THR 59 16.140 6.388 -11.481 397 HG23 THR 59 HG23 THR 59 14.828 7.054 -12.457 398 H LEU 60 HN LEU 60 15.970 2.747 -10.082 399 HA LEU 60 HA LEU 60 18.447 4.079 -9.265 400 HG LEU 60 HG LEU 60 15.611 4.707 -8.090 401 HB2 LEU 60 HB2 LEU 60 16.431 2.461 -7.696 402 HB3 LEU 60 HB1 LEU 60 17.920 3.097 -7.010 403 HD11 LEU 60 HD11 LEU 60 15.368 5.438 -5.790 404 HD12 LEU 60 HD12 LEU 60 16.735 4.435 -5.305 405 HD13 LEU 60 HD13 LEU 60 15.251 3.681 -5.889 406 HD21 LEU 60 HD21 LEU 60 16.851 6.670 -7.393 407 HD22 LEU 60 HD22 LEU 60 17.775 5.767 -8.595 408 HD23 LEU 60 HD23 LEU 60 18.208 5.663 -6.887 409 H SER 61 HN SER 61 17.458 1.247 -10.662 410 HA SER 61 HA SER 61 18.528 -0.625 -11.316 411 HG SER 61 HG SER 61 22.011 -1.103 -11.024 412 HB2 SER 61 HB2 SER 61 20.525 0.896 -11.522 413 HB3 SER 61 HB1 SER 61 21.000 0.390 -9.901 414 HA PRO 62 HA PRO 62 17.514 -2.803 -7.425 415 HB2 PRO 62 HB2 PRO 62 16.714 -5.026 -8.878 416 HB3 PRO 62 HB1 PRO 62 15.657 -3.735 -8.287 417 HG2 PRO 62 HG2 PRO 62 16.760 -4.179 -11.014 418 HG3 PRO 62 HG1 PRO 62 15.221 -3.459 -10.522 419 HD2 PRO 62 HD2 PRO 62 17.336 -2.008 -11.413 420 HD3 PRO 62 HD1 PRO 62 16.136 -1.386 -10.262 421 H VAL 63 HN VAL 63 18.294 -4.735 -6.501 422 HA VAL 63 HA VAL 63 20.544 -6.038 -7.888 423 HB VAL 63 HB VAL 63 20.426 -5.294 -4.954 424 HG11 VAL 63 HG11 VAL 63 22.697 -6.168 -4.816 425 HG12 VAL 63 HG12 VAL 63 22.612 -6.669 -6.504 426 HG13 VAL 63 HG13 VAL 63 21.556 -7.423 -5.306 427 HG21 VAL 63 HG21 VAL 63 22.292 -3.802 -5.420 428 HG22 VAL 63 HG22 VAL 63 20.881 -3.361 -6.381 429 HG23 VAL 63 HG23 VAL 63 22.218 -4.230 -7.131 430 H ASN 64 HN ASN 64 19.599 -7.942 -8.390 431 HA ASN 64 HA ASN 64 18.861 -10.069 -8.138 432 HB2 ASN 64 HB2 ASN 64 19.517 -9.545 -5.235 433 HB3 ASN 64 HB1 ASN 64 18.935 -11.106 -5.825 434 HD21 ASN 64 HD21 ASN 64 21.571 -8.917 -5.663 435 HD22 ASN 64 HD22 ASN 64 22.763 -9.941 -6.385 436 H GLY 65 HN GLY 65 17.032 -7.741 -7.935 437 HA2 GLY 65 HA2 GLY 65 14.705 -7.944 -8.267 438 HA3 GLY 65 HA1 GLY 65 14.711 -9.381 -7.260 439 H LYS 66 HN LYS 66 16.396 -6.656 -6.052 440 HA LYS 66 HA LYS 66 14.223 -5.204 -4.963 441 HB2 LYS 66 HB2 LYS 66 14.410 -5.704 -2.629 442 HB3 LYS 66 HB1 LYS 66 14.167 -7.226 -3.465 443 HG2 LYS 66 HG2 LYS 66 16.797 -6.182 -2.448 444 HG3 LYS 66 HG1 LYS 66 15.803 -7.406 -1.666 445 HD2 LYS 66 HD2 LYS 66 16.696 -7.792 -4.481 446 HD3 LYS 66 HD1 LYS 66 17.818 -8.094 -3.167 447 HE2 LYS 66 HE2 LYS 66 16.708 -10.143 -3.880 448 HE3 LYS 66 HE1 LYS 66 16.323 -9.735 -2.225 449 HZ1 LYS 66 HZ1 LYS 66 14.543 -9.158 -4.526 450 HZ2 LYS 66 HZ2 LYS 66 14.171 -8.978 -2.886 451 HZ3 LYS 66 HZ3 LYS 66 14.405 -10.526 -3.534 452 H ILE 67 HN ILE 67 15.001 -3.250 -3.931 453 HA ILE 67 HA ILE 67 17.840 -2.801 -4.492 454 HB ILE 67 HB ILE 67 17.184 -0.463 -3.447 455 HG12 ILE 67 HG12 ILE 67 14.548 -1.510 -4.495 456 HG13 ILE 67 HG11 ILE 67 14.910 -1.077 -2.829 457 HG21 ILE 67 HG21 ILE 67 16.489 -1.325 -6.253 458 HG22 ILE 67 HG22 ILE 67 18.066 -0.784 -5.674 459 HG23 ILE 67 HG23 ILE 67 16.709 0.342 -5.721 460 HD11 ILE 67 HD11 ILE 67 14.843 0.792 -5.181 461 HD12 ILE 67 HD12 ILE 67 15.243 1.246 -3.522 462 HD13 ILE 67 HD13 ILE 67 13.626 0.653 -3.912 463 H THR 68 HN THR 68 19.377 -2.610 -2.984 464 HA THR 68 HA THR 68 18.957 -3.233 -0.297 465 HB THR 68 HB THR 68 21.202 -2.094 0.061 466 HG1 THR 68 HG1 THR 68 22.328 -1.489 -1.824 467 HG21 THR 68 HG21 THR 68 22.432 -3.830 -1.167 468 HG22 THR 68 HG22 THR 68 20.976 -4.188 -2.097 469 HG23 THR 68 HG23 THR 68 21.006 -4.480 -0.358 470 H GLY 69 HN GLY 69 18.716 -1.915 1.523 471 HA2 GLY 69 HA2 GLY 69 16.632 -0.185 1.088 472 HA3 GLY 69 HA1 GLY 69 17.502 -0.315 2.604 473 H ALA 70 HN ALA 70 20.012 0.687 1.499 474 HA ALA 70 HA ALA 70 19.727 3.379 2.102 475 HB1 ALA 70 HB1 ALA 70 21.878 2.099 0.433 476 HB2 ALA 70 HB2 ALA 70 21.855 2.221 2.191 477 HB3 ALA 70 HB3 ALA 70 21.976 3.681 1.204 478 H ASN 71 HN ASN 71 19.062 1.818 -0.908 479 HA ASN 71 HA ASN 71 19.352 4.186 -2.536 480 HB2 ASN 71 HB2 ASN 71 17.876 1.650 -3.257 481 HB3 ASN 71 HB1 ASN 71 18.639 2.805 -4.352 482 HD21 ASN 71 HD21 ASN 71 18.965 -0.127 -3.809 483 HD22 ASN 71 HD22 ASN 71 20.653 -0.355 -3.531 484 H ALA 72 HN ALA 72 16.741 2.310 -1.094 485 HA ALA 72 HA ALA 72 14.645 4.014 -2.046 486 HB1 ALA 72 HB1 ALA 72 13.247 2.780 -0.447 487 HB2 ALA 72 HB2 ALA 72 14.692 1.994 0.187 488 HB3 ALA 72 HB3 ALA 72 14.192 1.706 -1.480 489 H LYS 73 HN LYS 73 16.682 3.813 0.772 490 HA LYS 73 HA LYS 73 15.425 5.804 2.333 491 HB2 LYS 73 HB2 LYS 73 18.350 5.025 2.210 492 HB3 LYS 73 HB1 LYS 73 17.616 6.029 3.456 493 HG2 LYS 73 HG2 LYS 73 16.942 3.150 2.878 494 HG3 LYS 73 HG1 LYS 73 17.923 3.738 4.221 495 HD2 LYS 73 HD2 LYS 73 15.111 4.684 3.782 496 HD3 LYS 73 HD1 LYS 73 15.459 3.208 4.685 497 HE2 LYS 73 HE2 LYS 73 16.543 5.947 5.331 498 HE3 LYS 73 HE1 LYS 73 15.177 5.168 6.149 499 HZ1 LYS 73 HZ1 LYS 73 17.189 4.889 7.420 500 HZ2 LYS 73 HZ2 LYS 73 17.982 4.177 6.101 501 HZ3 LYS 73 HZ3 LYS 73 16.678 3.381 6.833 502 H LYS 74 HN LYS 74 17.744 5.840 -0.265 503 HA LYS 74 HA LYS 74 18.425 8.544 -0.306 504 HB2 LYS 74 HB2 LYS 74 19.282 6.528 -1.712 505 HB3 LYS 74 HB1 LYS 74 17.972 6.939 -2.807 506 HG2 LYS 74 HG2 LYS 74 20.036 7.938 -3.547 507 HG3 LYS 74 HG1 LYS 74 18.892 9.191 -3.057 508 HD2 LYS 74 HD2 LYS 74 21.161 9.612 -2.244 509 HD3 LYS 74 HD1 LYS 74 20.013 9.435 -0.929 510 HE2 LYS 74 HE2 LYS 74 22.134 8.255 -0.484 511 HE3 LYS 74 HE1 LYS 74 20.752 7.166 -0.538 512 HZ1 LYS 74 HZ1 LYS 74 21.370 6.516 -2.763 513 HZ2 LYS 74 HZ2 LYS 74 22.672 6.271 -1.719 514 HZ3 LYS 74 HZ3 LYS 74 22.667 7.603 -2.775 515 H GLU 75 HN GLU 75 15.777 6.803 -1.832 516 HA GLU 75 HA GLU 75 14.531 8.968 -3.114 517 HB2 GLU 75 HB2 GLU 75 13.452 6.377 -2.054 518 HB3 GLU 75 HB1 GLU 75 12.393 7.561 -2.798 519 HG2 GLU 75 HG2 GLU 75 14.686 6.107 -4.077 520 HG3 GLU 75 HG1 GLU 75 12.963 5.937 -4.409 521 H MET 76 HN MET 76 13.780 7.567 0.066 522 HA MET 76 HA MET 76 11.841 9.569 0.651 523 HB2 MET 76 HB2 MET 76 12.067 8.592 3.028 524 HB3 MET 76 HB1 MET 76 11.451 7.558 1.750 525 HG2 MET 76 HG2 MET 76 13.630 6.527 1.518 526 HG3 MET 76 HG1 MET 76 14.278 7.583 2.765 527 HE1 MET 76 HE1 MET 76 10.888 5.491 2.439 528 HE2 MET 76 HE2 MET 76 11.357 4.074 3.378 529 HE3 MET 76 HE3 MET 76 12.212 4.463 1.885 530 H VAL 77 HN VAL 77 15.260 9.426 0.937 531 HA VAL 77 HA VAL 77 15.550 11.618 2.758 532 HB VAL 77 HB VAL 77 17.396 10.152 0.923 533 HG11 VAL 77 HG11 VAL 77 18.062 12.828 2.151 534 HG12 VAL 77 HG12 VAL 77 17.930 12.475 0.426 535 HG13 VAL 77 HG13 VAL 77 19.214 11.733 1.383 536 HG21 VAL 77 HG21 VAL 77 17.559 10.974 3.822 537 HG22 VAL 77 HG22 VAL 77 18.717 9.945 2.974 538 HG23 VAL 77 HG23 VAL 77 17.058 9.395 3.219 539 H LYS 78 HN LYS 78 15.605 11.349 -0.815 540 HA LYS 78 HA LYS 78 16.081 14.134 -1.216 541 HB2 LYS 78 HB2 LYS 78 15.639 13.698 -3.566 542 HB3 LYS 78 HB1 LYS 78 16.680 12.444 -2.904 543 HG2 LYS 78 HG2 LYS 78 14.752 10.960 -2.705 544 HG3 LYS 78 HG1 LYS 78 13.720 12.220 -3.381 545 HD2 LYS 78 HD2 LYS 78 14.291 10.661 -5.111 546 HD3 LYS 78 HD1 LYS 78 15.110 12.192 -5.414 547 HE2 LYS 78 HE2 LYS 78 17.189 11.335 -4.701 548 HE3 LYS 78 HE1 LYS 78 16.436 9.916 -3.978 549 HZ1 LYS 78 HZ1 LYS 78 17.545 9.457 -6.105 550 HZ2 LYS 78 HZ2 LYS 78 16.467 10.491 -6.893 551 HZ3 LYS 78 HZ3 LYS 78 15.896 9.080 -6.136 552 H SER 79 HN SER 79 13.304 12.302 -0.460 553 HA SER 79 HA SER 79 11.312 14.106 -1.293 554 HG SER 79 HG SER 79 9.701 14.141 0.773 555 HB2 SER 79 HB2 SER 79 10.731 11.871 -0.498 556 HB3 SER 79 HB1 SER 79 11.333 12.271 1.115 557 H LYS 80 HN LYS 80 13.832 14.512 0.833 558 HA LYS 80 HA LYS 80 14.555 16.250 2.067 559 HB2 LYS 80 HB2 LYS 80 12.014 17.638 1.188 560 HB3 LYS 80 HB1 LYS 80 13.418 18.408 1.920 561 HG2 LYS 80 HG2 LYS 80 14.766 17.926 0.008 562 HG3 LYS 80 HG1 LYS 80 13.495 16.921 -0.695 563 HD2 LYS 80 HD2 LYS 80 12.038 18.919 -0.815 564 HD3 LYS 80 HD1 LYS 80 13.378 19.901 -0.218 565 HE2 LYS 80 HE2 LYS 80 14.707 19.290 -2.165 566 HE3 LYS 80 HE1 LYS 80 13.391 18.276 -2.759 567 HZ1 LYS 80 HZ1 LYS 80 11.994 20.256 -2.905 568 HZ2 LYS 80 HZ2 LYS 80 13.386 20.418 -3.861 569 HZ3 LYS 80 HZ3 LYS 80 13.280 21.220 -2.375 570 H LEU 81 HN LEU 81 14.015 14.587 3.734 571 HA LEU 81 HA LEU 81 12.027 15.642 5.629 572 HG LEU 81 HG LEU 81 11.303 13.831 3.198 573 HB2 LEU 81 HB2 LEU 81 12.518 12.718 5.125 574 HB3 LEU 81 HB1 LEU 81 11.309 13.420 6.183 575 HD11 LEU 81 HD11 LEU 81 11.098 11.440 3.688 576 HD12 LEU 81 HD12 LEU 81 9.581 12.103 3.080 577 HD13 LEU 81 HD13 LEU 81 9.778 11.782 4.804 578 HD21 LEU 81 HD21 LEU 81 8.993 14.494 3.570 579 HD22 LEU 81 HD22 LEU 81 10.084 15.483 4.541 580 HD23 LEU 81 HD23 LEU 81 9.165 14.181 5.297 581 HA PRO 82 HA PRO 82 15.197 14.754 8.680 582 HB2 PRO 82 HB2 PRO 82 13.660 14.447 10.877 583 HB3 PRO 82 HB1 PRO 82 13.956 16.035 10.150 584 HG2 PRO 82 HG2 PRO 82 11.564 14.256 9.915 585 HG3 PRO 82 HG1 PRO 82 11.639 16.015 10.086 586 HD2 PRO 82 HD2 PRO 82 11.226 14.712 7.721 587 HD3 PRO 82 HD1 PRO 82 11.941 16.337 7.851 588 H ASN 83 HN ASN 83 15.794 13.005 10.193 589 HA ASN 83 HA ASN 83 15.529 10.524 8.920 590 HB2 ASN 83 HB2 ASN 83 16.724 11.385 11.517 591 HB3 ASN 83 HB1 ASN 83 16.590 9.670 11.138 592 HD21 ASN 83 HD21 ASN 83 17.070 12.004 8.596 593 HD22 ASN 83 HD22 ASN 83 18.715 11.599 8.267 594 H THR 84 HN THR 84 13.645 11.959 11.445 595 HA THR 84 HA THR 84 12.479 9.672 12.565 596 HB THR 84 HB THR 84 11.013 12.282 12.181 597 HG1 THR 84 HG1 THR 84 12.169 12.818 14.232 598 HG21 THR 84 HG21 THR 84 9.804 10.440 13.257 599 HG22 THR 84 HG22 THR 84 10.124 11.742 14.405 600 HG23 THR 84 HG23 THR 84 11.102 10.275 14.439 601 H VAL 85 HN VAL 85 11.409 11.738 9.870 602 HA VAL 85 HA VAL 85 9.088 10.205 9.261 603 HB VAL 85 HB VAL 85 10.617 12.004 7.368 604 HG11 VAL 85 HG11 VAL 85 7.714 11.198 7.475 605 HG12 VAL 85 HG12 VAL 85 8.910 10.586 6.334 606 HG13 VAL 85 HG13 VAL 85 8.443 12.288 6.296 607 HG21 VAL 85 HG21 VAL 85 8.462 12.724 9.350 608 HG22 VAL 85 HG22 VAL 85 9.115 13.797 8.111 609 HG23 VAL 85 HG23 VAL 85 10.151 13.224 9.418 610 H LEU 86 HN LEU 86 12.354 10.355 7.909 611 HA LEU 86 HA LEU 86 12.388 8.411 6.005 612 HG LEU 86 HG LEU 86 15.758 9.895 6.327 613 HB2 LEU 86 HB2 LEU 86 14.324 9.280 8.087 614 HB3 LEU 86 HB1 LEU 86 14.685 7.798 7.204 615 HD11 LEU 86 HD11 LEU 86 13.970 8.342 4.487 616 HD12 LEU 86 HD12 LEU 86 15.582 7.865 5.022 617 HD13 LEU 86 HD13 LEU 86 15.375 9.289 4.000 618 HD21 LEU 86 HD21 LEU 86 13.870 11.422 6.578 619 HD22 LEU 86 HD22 LEU 86 12.959 10.489 5.389 620 HD23 LEU 86 HD23 LEU 86 14.420 11.348 4.904 621 H GLY 87 HN GLY 87 12.928 7.874 9.469 622 HA2 GLY 87 HA2 GLY 87 13.212 5.097 9.314 623 HA3 GLY 87 HA1 GLY 87 12.833 6.003 10.768 624 H LYS 88 HN LYS 88 10.271 7.042 9.913 625 HA LYS 88 HA LYS 88 8.847 4.582 10.452 626 HB2 LYS 88 HB2 LYS 88 6.922 5.896 10.987 627 HB3 LYS 88 HB1 LYS 88 8.332 6.519 11.822 628 HG2 LYS 88 HG2 LYS 88 8.452 8.394 10.371 629 HG3 LYS 88 HG1 LYS 88 7.221 7.703 9.301 630 HD2 LYS 88 HD2 LYS 88 5.544 7.900 10.981 631 HD3 LYS 88 HD1 LYS 88 6.739 8.321 12.202 632 HE2 LYS 88 HE2 LYS 88 7.196 10.414 10.978 633 HE3 LYS 88 HE1 LYS 88 5.917 9.991 9.837 634 HZ1 LYS 88 HZ1 LYS 88 4.313 10.050 11.597 635 HZ2 LYS 88 HZ2 LYS 88 5.172 11.513 11.616 636 HZ3 LYS 88 HZ3 LYS 88 5.521 10.304 12.760 637 H ILE 89 HN ILE 89 9.214 6.762 7.756 638 HA ILE 89 HA ILE 89 7.129 5.661 6.178 639 HB ILE 89 HB ILE 89 9.781 6.876 5.371 640 HG12 ILE 89 HG12 ILE 89 6.939 7.900 5.361 641 HG13 ILE 89 HG11 ILE 89 8.295 8.505 6.307 642 HG21 ILE 89 HG21 ILE 89 7.519 6.039 3.560 643 HG22 ILE 89 HG22 ILE 89 9.119 5.302 3.649 644 HG23 ILE 89 HG23 ILE 89 8.944 6.959 3.078 645 HD11 ILE 89 HD11 ILE 89 7.860 10.015 4.511 646 HD12 ILE 89 HD12 ILE 89 7.938 8.708 3.330 647 HD13 ILE 89 HD13 ILE 89 9.392 9.197 4.203 648 H TRP 90 HN TRP 90 10.507 4.838 6.703 649 HA TRP 90 HA TRP 90 10.695 2.644 4.989 650 HD1 TRP 90 HD1 TRP 90 12.812 0.756 8.331 651 HE1 TRP 90 HE1 TRP 90 14.162 -1.132 7.207 652 HE3 TRP 90 HE3 TRP 90 13.072 2.671 3.604 653 HZ2 TRP 90 HZ2 TRP 90 15.188 -1.725 4.647 654 HZ3 TRP 90 HZ3 TRP 90 14.255 1.374 1.882 655 HH2 TRP 90 HH2 TRP 90 15.288 -0.773 2.391 656 HB2 TRP 90 HB2 TRP 90 12.637 3.704 6.028 657 HB3 TRP 90 HB1 TRP 90 12.111 3.145 7.613 658 H LYS 91 HN LYS 91 9.927 2.714 8.472 659 HA LYS 91 HA LYS 91 9.652 -0.125 8.584 660 HB2 LYS 91 HB2 LYS 91 9.091 0.158 10.877 661 HB3 LYS 91 HB1 LYS 91 10.343 1.330 10.503 662 HG2 LYS 91 HG2 LYS 91 8.681 3.096 10.356 663 HG3 LYS 91 HG1 LYS 91 7.403 1.930 10.686 664 HD2 LYS 91 HD2 LYS 91 7.721 2.775 12.797 665 HD3 LYS 91 HD1 LYS 91 8.860 1.430 12.822 666 HE2 LYS 91 HE2 LYS 91 9.568 4.305 12.210 667 HE3 LYS 91 HE1 LYS 91 9.830 3.493 13.755 668 HZ1 LYS 91 HZ1 LYS 91 11.295 1.923 12.624 669 HZ2 LYS 91 HZ2 LYS 91 11.846 3.517 12.452 670 HZ3 LYS 91 HZ3 LYS 91 11.066 2.751 11.160 671 H LEU 92 HN LEU 92 7.561 2.332 7.542 672 HA LEU 92 HA LEU 92 5.155 0.784 8.082 673 HG LEU 92 HG LEU 92 3.106 2.110 6.578 674 HB2 LEU 92 HB2 LEU 92 5.348 3.339 8.189 675 HB3 LEU 92 HB1 LEU 92 5.346 3.290 6.423 676 HD11 LEU 92 HD11 LEU 92 1.857 2.354 8.653 677 HD12 LEU 92 HD12 LEU 92 3.281 3.029 9.445 678 HD13 LEU 92 HD13 LEU 92 3.288 1.351 8.893 679 HD21 LEU 92 HD21 LEU 92 1.867 4.168 6.982 680 HD22 LEU 92 HD22 LEU 92 3.315 4.484 6.022 681 HD23 LEU 92 HD23 LEU 92 3.287 4.889 7.739 682 H ALA 93 HN ALA 93 7.456 1.392 5.528 683 HA ALA 93 HA ALA 93 5.757 0.119 3.529 684 HB1 ALA 93 HB1 ALA 93 8.552 1.213 3.268 685 HB2 ALA 93 HB2 ALA 93 7.068 2.094 2.912 686 HB3 ALA 93 HB3 ALA 93 7.509 0.684 1.945 687 H ASP 94 HN ASP 94 8.823 -0.495 5.219 688 HA ASP 94 HA ASP 94 9.062 -3.086 3.911 689 HB2 ASP 94 HB2 ASP 94 11.079 -1.710 4.247 690 HB3 ASP 94 HB1 ASP 94 10.831 -1.769 5.975 691 H VAL 95 HN VAL 95 7.474 -4.347 4.662 692 HA VAL 95 HA VAL 95 6.477 -4.420 7.290 693 HB VAL 95 HB VAL 95 6.265 -6.534 5.154 694 HG11 VAL 95 HG11 VAL 95 5.654 -7.355 7.390 695 HG12 VAL 95 HG12 VAL 95 4.259 -7.258 6.318 696 HG13 VAL 95 HG13 VAL 95 4.508 -6.024 7.556 697 HG21 VAL 95 HG21 VAL 95 4.157 -5.475 4.560 698 HG22 VAL 95 HG22 VAL 95 5.488 -4.327 4.406 699 HG23 VAL 95 HG23 VAL 95 4.410 -4.246 5.798 700 H ASP 96 HN ASP 96 9.211 -5.853 5.846 701 HA ASP 96 HA ASP 96 9.366 -8.032 7.792 702 HB2 ASP 96 HB2 ASP 96 11.488 -7.461 5.802 703 HB3 ASP 96 HB1 ASP 96 10.869 -9.030 6.356 704 H LYS 97 HN LYS 97 10.772 -4.968 6.990 705 HA LYS 97 HA LYS 97 12.390 -3.678 7.925 706 HB2 LYS 97 HB2 LYS 97 11.984 -5.479 10.325 707 HB3 LYS 97 HB1 LYS 97 12.682 -3.858 10.332 708 HG2 LYS 97 HG2 LYS 97 10.629 -2.870 9.724 709 HG3 LYS 97 HG1 LYS 97 9.906 -4.419 9.338 710 HD2 LYS 97 HD2 LYS 97 9.064 -3.593 11.468 711 HD3 LYS 97 HD1 LYS 97 10.008 -5.065 11.698 712 HE2 LYS 97 HE2 LYS 97 11.945 -3.684 12.347 713 HE3 LYS 97 HE1 LYS 97 10.941 -2.242 12.187 714 HZ1 LYS 97 HZ1 LYS 97 11.083 -2.985 14.483 715 HZ2 LYS 97 HZ2 LYS 97 10.427 -4.493 14.057 716 HZ3 LYS 97 HZ3 LYS 97 9.489 -3.086 13.915 717 H ASP 98 HN ASP 98 13.459 -5.005 6.227 718 HA ASP 98 HA ASP 98 15.405 -6.951 7.268 719 HB2 ASP 98 HB2 ASP 98 15.490 -7.601 4.760 720 HB3 ASP 98 HB1 ASP 98 14.051 -8.045 5.685 721 H GLY 99 HN GLY 99 15.088 -3.862 5.810 722 HA2 GLY 99 HA2 GLY 99 16.897 -2.323 5.692 723 HA3 GLY 99 HA1 GLY 99 18.009 -3.681 5.642 724 H LEU 100 HN LEU 100 15.355 -4.103 3.597 725 HA LEU 100 HA LEU 100 16.490 -2.644 1.354 726 HG LEU 100 HG LEU 100 16.131 -6.110 2.539 727 HB2 LEU 100 HB2 LEU 100 16.405 -4.694 -0.096 728 HB3 LEU 100 HB1 LEU 100 17.699 -4.664 1.083 729 HD11 LEU 100 HD11 LEU 100 14.841 -6.452 -0.162 730 HD12 LEU 100 HD12 LEU 100 14.083 -5.879 1.325 731 HD13 LEU 100 HD13 LEU 100 14.619 -7.553 1.198 732 HD21 LEU 100 HD21 LEU 100 17.357 -7.206 0.014 733 HD22 LEU 100 HD22 LEU 100 16.961 -8.137 1.459 734 HD23 LEU 100 HD23 LEU 100 18.202 -6.885 1.527 735 H LEU 101 HN LEU 101 14.945 -3.401 -0.696 736 HA LEU 101 HA LEU 101 12.191 -3.544 0.155 737 HG LEU 101 HG LEU 101 13.209 -0.792 1.329 738 HB2 LEU 101 HB2 LEU 101 13.353 -1.030 -1.056 739 HB3 LEU 101 HB1 LEU 101 11.650 -1.427 -1.180 740 HD11 LEU 101 HD11 LEU 101 12.510 1.102 -0.062 741 HD12 LEU 101 HD12 LEU 101 11.689 1.078 1.495 742 HD13 LEU 101 HD13 LEU 101 10.840 0.550 0.039 743 HD21 LEU 101 HD21 LEU 101 11.127 -1.070 2.551 744 HD22 LEU 101 HD22 LEU 101 11.620 -2.590 1.805 745 HD23 LEU 101 HD23 LEU 101 10.324 -1.634 1.089 746 H ASP 102 HN ASP 102 11.487 -5.008 -1.318 747 HA ASP 102 HA ASP 102 12.772 -5.227 -3.883 748 HB2 ASP 102 HB2 ASP 102 11.519 -7.156 -4.212 749 HB3 ASP 102 HB1 ASP 102 11.869 -7.149 -2.491 750 H ASP 103 HN ASP 103 10.765 -5.723 -5.701 751 HA ASP 103 HA ASP 103 10.233 -3.109 -6.568 752 HB2 ASP 103 HB2 ASP 103 8.922 -4.119 -8.335 753 HB3 ASP 103 HB1 ASP 103 10.414 -5.028 -8.075 754 H GLU 104 HN GLU 104 8.261 -5.330 -4.716 755 HA GLU 104 HA GLU 104 5.926 -3.624 -4.921 756 HB2 GLU 104 HB2 GLU 104 5.889 -6.155 -4.825 757 HB3 GLU 104 HB1 GLU 104 6.320 -6.015 -3.124 758 HG2 GLU 104 HG2 GLU 104 4.285 -5.120 -2.537 759 HG3 GLU 104 HG1 GLU 104 3.961 -4.530 -4.182 760 H GLU 105 HN GLU 105 8.554 -4.222 -2.753 761 HA GLU 105 HA GLU 105 7.456 -2.789 -0.535 762 HB2 GLU 105 HB2 GLU 105 9.880 -4.234 -1.195 763 HB3 GLU 105 HB1 GLU 105 10.225 -2.772 -0.282 764 HG2 GLU 105 HG2 GLU 105 8.843 -3.480 1.519 765 HG3 GLU 105 HG1 GLU 105 8.176 -4.808 0.559 766 H PHE 106 HN PHE 106 9.494 -1.998 -3.284 767 HA PHE 106 HA PHE 106 9.978 0.702 -2.596 768 HD1 PHE 106 HD2 PHE 106 8.986 2.392 -4.821 769 HD2 PHE 106 HD1 PHE 106 12.758 0.608 -5.610 770 HE1 PHE 106 HE2 PHE 106 9.810 4.533 -5.697 771 HE2 PHE 106 HE1 PHE 106 13.587 2.744 -6.487 772 HZ PHE 106 HZ PHE 106 12.125 4.711 -6.526 773 HB2 PHE 106 HB2 PHE 106 11.216 -0.571 -4.371 774 HB3 PHE 106 HB1 PHE 106 9.783 -0.490 -5.379 775 H ALA 107 HN ALA 107 7.478 -1.017 -4.369 776 HA ALA 107 HA ALA 107 5.900 1.071 -5.234 777 HB1 ALA 107 HB1 ALA 107 5.484 -1.253 -5.823 778 HB2 ALA 107 HB2 ALA 107 4.030 -0.506 -5.163 779 HB3 ALA 107 HB3 ALA 107 4.990 -1.598 -4.166 780 H LEU 108 HN LEU 108 5.773 -0.588 -2.076 781 HA LEU 108 HA LEU 108 3.756 1.069 -0.983 782 HG LEU 108 HG LEU 108 2.797 -0.317 0.835 783 HB2 LEU 108 HB2 LEU 108 4.866 -1.219 -0.161 784 HB3 LEU 108 HB1 LEU 108 5.815 -0.109 0.814 785 HD11 LEU 108 HD11 LEU 108 4.826 -1.153 2.889 786 HD12 LEU 108 HD12 LEU 108 3.920 -2.242 1.841 787 HD13 LEU 108 HD13 LEU 108 3.074 -1.263 3.041 788 HD21 LEU 108 HD21 LEU 108 4.636 1.285 2.596 789 HD22 LEU 108 HD22 LEU 108 2.881 1.173 2.737 790 HD23 LEU 108 HD23 LEU 108 3.605 1.945 1.327 791 H ALA 109 HN ALA 109 7.300 1.095 -0.552 792 HA ALA 109 HA ALA 109 7.594 3.259 1.120 793 HB1 ALA 109 HB1 ALA 109 9.405 2.598 -1.189 794 HB2 ALA 109 HB2 ALA 109 9.418 1.800 0.383 795 HB3 ALA 109 HB3 ALA 109 9.832 3.512 0.260 796 H ASN 110 HN ASN 110 7.549 3.421 -2.440 797 HA ASN 110 HA ASN 110 7.911 6.242 -2.505 798 HB2 ASN 110 HB2 ASN 110 8.490 4.549 -4.340 799 HB3 ASN 110 HB1 ASN 110 6.780 4.591 -4.758 800 HD21 ASN 110 HD21 ASN 110 9.772 6.341 -4.747 801 HD22 ASN 110 HD22 ASN 110 9.251 7.657 -5.743 802 H HIS 111 HN HIS 111 5.155 4.088 -2.514 803 HA HIS 111 HA HIS 111 3.196 6.002 -3.227 804 HD1 HIS 111 HD1 HIS 111 0.914 5.055 -4.394 805 HD2 HIS 111 HD2 HIS 111 0.379 4.011 -0.401 806 HE1 HIS 111 HE1 HIS 111 -1.522 5.432 -3.923 807 HE2 HIS 111 HE2 HIS 111 -1.763 5.024 -1.448 808 HB2 HIS 111 HB2 HIS 111 2.839 3.522 -3.240 809 HB3 HIS 111 HB1 HIS 111 2.825 3.573 -1.473 810 H LEU 112 HN LEU 112 4.692 5.031 -0.211 811 HA LEU 112 HA LEU 112 3.011 6.584 1.467 812 HG LEU 112 HG LEU 112 3.836 3.768 2.054 813 HB2 LEU 112 HB2 LEU 112 5.718 5.326 1.814 814 HB3 LEU 112 HB1 LEU 112 5.042 6.369 3.057 815 HD11 LEU 112 HD11 LEU 112 4.301 3.004 4.336 816 HD12 LEU 112 HD12 LEU 112 5.095 4.542 4.685 817 HD13 LEU 112 HD13 LEU 112 5.776 3.452 3.477 818 HD21 LEU 112 HD21 LEU 112 2.180 4.107 3.837 819 HD22 LEU 112 HD22 LEU 112 2.084 5.361 2.600 820 HD23 LEU 112 HD23 LEU 112 2.851 5.708 4.150 821 H ILE 113 HN ILE 113 6.091 7.233 -0.187 822 HA ILE 113 HA ILE 113 6.519 9.826 0.768 823 HB ILE 113 HB ILE 113 7.084 8.780 -2.008 824 HG12 ILE 113 HG12 ILE 113 8.173 7.481 -0.234 825 HG13 ILE 113 HG11 ILE 113 9.340 8.391 -1.185 826 HG21 ILE 113 HG21 ILE 113 7.110 11.217 -1.968 827 HG22 ILE 113 HG22 ILE 113 8.748 10.581 -2.142 828 HG23 ILE 113 HG23 ILE 113 8.203 11.193 -0.581 829 HD11 ILE 113 HD11 ILE 113 9.533 10.039 0.567 830 HD12 ILE 113 HD12 ILE 113 9.887 8.419 1.172 831 HD13 ILE 113 HD13 ILE 113 8.333 9.174 1.529 832 H LYS 114 HN LYS 114 4.572 8.658 -1.958 833 HA LYS 114 HA LYS 114 3.487 11.077 -2.827 834 HB2 LYS 114 HB2 LYS 114 3.142 8.427 -3.454 835 HB3 LYS 114 HB1 LYS 114 1.602 8.806 -2.702 836 HG2 LYS 114 HG2 LYS 114 2.703 10.516 -4.894 837 HG3 LYS 114 HG1 LYS 114 1.845 9.025 -5.249 838 HD2 LYS 114 HD2 LYS 114 0.170 10.610 -5.379 839 HD3 LYS 114 HD1 LYS 114 -0.006 10.025 -3.727 840 HE2 LYS 114 HE2 LYS 114 1.286 11.957 -2.929 841 HE3 LYS 114 HE1 LYS 114 1.437 12.532 -4.589 842 HZ1 LYS 114 HZ1 LYS 114 -0.331 13.658 -3.368 843 HZ2 LYS 114 HZ2 LYS 114 -1.135 12.186 -3.132 844 HZ3 LYS 114 HZ3 LYS 114 -0.946 12.811 -4.694 845 H VAL 115 HN VAL 115 2.370 8.875 -0.289 846 HA VAL 115 HA VAL 115 0.017 10.252 0.406 847 HB VAL 115 HB VAL 115 1.754 8.371 2.012 848 HG11 VAL 115 HG11 VAL 115 -0.148 8.079 3.516 849 HG12 VAL 115 HG12 VAL 115 -1.031 9.338 2.652 850 HG13 VAL 115 HG13 VAL 115 0.436 9.742 3.543 851 HG21 VAL 115 HG21 VAL 115 -0.838 7.929 0.545 852 HG22 VAL 115 HG22 VAL 115 0.047 6.719 1.477 853 HG23 VAL 115 HG23 VAL 115 0.760 7.403 0.015 854 H LYS 116 HN LYS 116 3.316 10.507 1.718 855 HA LYS 116 HA LYS 116 2.544 12.472 3.654 856 HB2 LYS 116 HB2 LYS 116 5.050 12.825 3.868 857 HB3 LYS 116 HB1 LYS 116 4.470 11.196 4.197 858 HG2 LYS 116 HG2 LYS 116 5.560 10.330 2.440 859 HG3 LYS 116 HG1 LYS 116 5.267 11.746 1.425 860 HD2 LYS 116 HD2 LYS 116 7.328 11.509 3.622 861 HD3 LYS 116 HD1 LYS 116 7.620 11.514 1.891 862 HE2 LYS 116 HE2 LYS 116 6.316 13.789 3.352 863 HE3 LYS 116 HE1 LYS 116 8.044 13.707 3.006 864 HZ1 LYS 116 HZ1 LYS 116 7.582 13.701 0.669 865 HZ2 LYS 116 HZ2 LYS 116 6.765 15.016 1.371 866 HZ3 LYS 116 HZ3 LYS 116 5.914 13.615 0.937 867 H LEU 117 HN LEU 117 3.345 12.570 0.314 868 HA LEU 117 HA LEU 117 4.179 15.333 0.278 869 HG LEU 117 HG LEU 117 3.414 15.915 -2.650 870 HB2 LEU 117 HB2 LEU 117 5.000 13.678 -1.372 871 HB3 LEU 117 HB1 LEU 117 3.355 13.522 -1.997 872 HD11 LEU 117 HD11 LEU 117 5.089 16.647 -1.007 873 HD12 LEU 117 HD12 LEU 117 5.496 17.135 -2.652 874 HD13 LEU 117 HD13 LEU 117 6.329 15.771 -1.907 875 HD21 LEU 117 HD21 LEU 117 3.959 14.148 -4.261 876 HD22 LEU 117 HD22 LEU 117 5.657 14.245 -3.796 877 HD23 LEU 117 HD23 LEU 117 4.874 15.621 -4.573 878 H GLU 118 HN GLU 118 1.209 13.618 0.211 879 HA GLU 118 HA GLU 118 -0.434 15.442 -1.164 880 HB2 GLU 118 HB2 GLU 118 -1.251 13.708 1.180 881 HB3 GLU 118 HB1 GLU 118 -2.300 14.347 -0.079 882 HG2 GLU 118 HG2 GLU 118 -1.004 12.981 -1.728 883 HG3 GLU 118 HG1 GLU 118 -0.175 12.239 -0.353 884 H GLY 119 HN GLY 119 1.134 15.642 1.848 885 HA2 GLY 119 HA2 GLY 119 1.335 17.881 2.772 886 HA3 GLY 119 HA1 GLY 119 -0.377 18.102 2.435 887 H HIS 120 HN HIS 120 0.108 15.002 3.475 888 HA HIS 120 HA HIS 120 -0.322 15.769 6.268 889 HD1 HIS 120 HD1 HIS 120 -1.687 12.002 6.975 890 HD2 HIS 120 HD2 HIS 120 -2.084 12.889 2.926 891 HE1 HIS 120 HE1 HIS 120 -1.858 9.793 5.819 892 HE2 HIS 120 HE2 HIS 120 -2.253 10.356 3.384 893 HB2 HIS 120 HB2 HIS 120 -2.188 14.448 6.523 894 HB3 HIS 120 HB1 HIS 120 -2.399 14.964 4.857 895 H GLU 121 HN GLU 121 0.623 14.569 7.765 896 HA GLU 121 HA GLU 121 2.849 12.954 7.046 897 HB2 GLU 121 HB2 GLU 121 3.296 14.063 8.985 898 HB3 GLU 121 HB1 GLU 121 1.631 14.007 9.531 899 HG2 GLU 121 HG2 GLU 121 1.904 11.687 10.186 900 HG3 GLU 121 HG1 GLU 121 3.566 11.713 9.598 901 H LEU 122 HN LEU 122 3.222 10.765 7.555 902 HA LEU 122 HA LEU 122 1.068 9.000 7.032 903 HG LEU 122 HG LEU 122 4.262 9.433 6.161 904 HB2 LEU 122 HB2 LEU 122 3.753 8.304 8.225 905 HB3 LEU 122 HB1 LEU 122 2.649 7.205 7.402 906 HD11 LEU 122 HD11 LEU 122 4.298 6.438 5.829 907 HD12 LEU 122 HD12 LEU 122 5.529 7.424 6.620 908 HD13 LEU 122 HD13 LEU 122 5.253 7.581 4.884 909 HD21 LEU 122 HD21 LEU 122 2.021 9.338 5.172 910 HD22 LEU 122 HD22 LEU 122 2.241 7.617 4.861 911 HD23 LEU 122 HD23 LEU 122 3.264 8.799 4.043 912 HA PRO 123 HA PRO 123 -0.419 8.593 11.129 913 HB2 PRO 123 HB2 PRO 123 -2.259 6.698 10.706 914 HB3 PRO 123 HB1 PRO 123 -2.398 8.307 9.993 915 HG2 PRO 123 HG2 PRO 123 -1.627 5.738 8.730 916 HG3 PRO 123 HG1 PRO 123 -2.461 7.132 8.024 917 HD2 PRO 123 HD2 PRO 123 0.284 6.489 7.788 918 HD3 PRO 123 HD1 PRO 123 -0.505 7.994 7.282 919 H ALA 124 HN ALA 124 1.670 6.391 9.905 920 HA ALA 124 HA ALA 124 2.809 4.598 10.705 921 HB1 ALA 124 HB1 ALA 124 1.749 5.560 13.360 922 HB2 ALA 124 HB2 ALA 124 3.255 6.061 12.589 923 HB3 ALA 124 HB3 ALA 124 3.054 4.396 13.140 924 H ASP 125 HN ASP 125 -0.128 4.452 10.065 925 HA ASP 125 HA ASP 125 -0.739 1.920 11.426 926 HB2 ASP 125 HB2 ASP 125 -2.383 3.838 11.711 927 HB3 ASP 125 HB1 ASP 125 -2.690 3.718 9.979 928 H LEU 126 HN LEU 126 -1.063 0.138 10.167 929 HA LEU 126 HA LEU 126 -0.644 0.534 7.289 930 HG LEU 126 HG LEU 126 1.827 -0.206 6.860 931 HB2 LEU 126 HB2 LEU 126 1.017 -0.786 9.029 932 HB3 LEU 126 HB1 LEU 126 0.045 -2.100 8.384 933 HD11 LEU 126 HD11 LEU 126 2.980 -2.062 7.909 934 HD12 LEU 126 HD12 LEU 126 2.926 -2.289 6.159 935 HD13 LEU 126 HD13 LEU 126 1.833 -3.200 7.197 936 HD21 LEU 126 HD21 LEU 126 -0.039 -2.283 5.727 937 HD22 LEU 126 HD22 LEU 126 1.102 -1.290 4.817 938 HD23 LEU 126 HD23 LEU 126 -0.276 -0.538 5.629 939 HA PRO 127 HA PRO 127 -4.742 -1.322 7.543 940 HB2 PRO 127 HB2 PRO 127 -5.283 -0.263 4.940 941 HB3 PRO 127 HB1 PRO 127 -5.858 0.328 6.502 942 HG2 PRO 127 HG2 PRO 127 -4.105 1.655 4.831 943 HG3 PRO 127 HG1 PRO 127 -4.305 1.981 6.561 944 HD2 PRO 127 HD2 PRO 127 -2.190 0.418 5.153 945 HD3 PRO 127 HD1 PRO 127 -2.065 1.444 6.600 946 HA PRO 128 HA PRO 128 -4.335 -5.078 5.261 947 HB2 PRO 128 HB2 PRO 128 -7.102 -4.825 4.294 948 HB3 PRO 128 HB1 PRO 128 -6.366 -6.085 5.296 949 HG2 PRO 128 HG2 PRO 128 -8.082 -4.185 6.226 950 HG3 PRO 128 HG1 PRO 128 -6.897 -5.026 7.232 951 HD2 PRO 128 HD2 PRO 128 -6.932 -2.246 6.269 952 HD3 PRO 128 HD1 PRO 128 -6.054 -2.955 7.635 953 H HIS 129 HN HIS 129 -6.127 -2.508 3.636 954 HA HIS 129 HA HIS 129 -5.432 -3.480 1.013 955 HD1 HIS 129 HD1 HIS 129 -8.038 -1.299 3.671 956 HD2 HIS 129 HD2 HIS 129 -6.091 1.104 0.885 957 HE1 HIS 129 HE1 HIS 129 -8.129 1.041 4.596 958 HE2 HIS 129 HE2 HIS 129 -7.155 2.494 2.782 959 HB2 HIS 129 HB2 HIS 129 -6.635 -1.494 0.177 960 HB3 HIS 129 HB1 HIS 129 -7.604 -2.411 1.310 961 H LEU 130 HN LEU 130 -3.245 -2.657 2.861 962 HA LEU 130 HA LEU 130 -1.810 -1.203 0.756 963 HG LEU 130 HG LEU 130 -1.256 0.983 0.815 964 HB2 LEU 130 HB2 LEU 130 -2.402 -0.102 3.332 965 HB3 LEU 130 HB1 LEU 130 -0.671 -0.183 3.084 966 HD11 LEU 130 HD11 LEU 130 -3.653 0.887 0.998 967 HD12 LEU 130 HD12 LEU 130 -3.112 2.564 1.035 968 HD13 LEU 130 HD13 LEU 130 -3.600 1.760 2.528 969 HD21 LEU 130 HD21 LEU 130 -1.254 2.396 3.468 970 HD22 LEU 130 HD22 LEU 130 -0.949 3.157 1.906 971 HD23 LEU 130 HD23 LEU 130 0.159 1.928 2.521 972 H VAL 131 HN VAL 131 -1.921 -3.921 2.445 973 HA VAL 131 HA VAL 131 0.958 -4.022 2.924 974 HB VAL 131 HB VAL 131 -1.275 -5.791 3.849 975 HG11 VAL 131 HG11 VAL 131 1.656 -6.531 3.834 976 HG12 VAL 131 HG12 VAL 131 0.405 -7.304 2.861 977 HG13 VAL 131 HG13 VAL 131 0.361 -7.434 4.620 978 HG21 VAL 131 HG21 VAL 131 -0.195 -5.406 5.993 979 HG22 VAL 131 HG22 VAL 131 -0.495 -3.869 5.178 980 HG23 VAL 131 HG23 VAL 131 1.131 -4.561 5.186 981 HA PRO 132 HA PRO 132 1.640 -5.486 -1.190 982 HB2 PRO 132 HB2 PRO 132 4.101 -6.389 0.274 983 HB3 PRO 132 HB1 PRO 132 3.978 -5.556 -1.278 984 HG2 PRO 132 HG2 PRO 132 4.666 -4.200 0.872 985 HG3 PRO 132 HG1 PRO 132 3.519 -3.505 -0.288 986 HD2 PRO 132 HD2 PRO 132 3.005 -4.689 2.404 987 HD3 PRO 132 HD1 PRO 132 2.213 -3.314 1.592 988 HA PRO 133 HA PRO 133 0.192 -9.781 -0.696 989 HB2 PRO 133 HB2 PRO 133 1.520 -9.817 -3.379 990 HB3 PRO 133 HB1 PRO 133 -0.026 -10.518 -2.881 991 HG2 PRO 133 HG2 PRO 133 0.053 -8.229 -4.234 992 HG3 PRO 133 HG1 PRO 133 -1.121 -8.473 -2.914 993 HD2 PRO 133 HD2 PRO 133 1.351 -6.816 -2.985 994 HD3 PRO 133 HD1 PRO 133 -0.144 -6.587 -2.044 995 H SER 134 HN SER 134 3.411 -8.808 -1.721 996 HA SER 134 HA SER 134 4.660 -11.324 -1.480 997 HG SER 134 HG SER 134 5.027 -7.792 -2.187 998 HB2 SER 134 HB2 SER 134 6.761 -9.827 -1.304 999 HB3 SER 134 HB1 SER 134 5.792 -9.735 -2.778 1000 H LYS 135 HN LYS 135 3.607 -9.164 1.019 1001 HA LYS 135 HA LYS 135 5.820 -9.811 2.767 1002 HB2 LYS 135 HB2 LYS 135 3.388 -8.395 3.804 1003 HB3 LYS 135 HB1 LYS 135 5.063 -8.227 4.266 1004 HG2 LYS 135 HG2 LYS 135 3.719 -7.153 1.813 1005 HG3 LYS 135 HG1 LYS 135 4.485 -6.254 3.131 1006 HD2 LYS 135 HD2 LYS 135 5.849 -8.009 1.087 1007 HD3 LYS 135 HD1 LYS 135 5.938 -6.250 1.198 1008 HE2 LYS 135 HE2 LYS 135 7.158 -6.333 3.192 1009 HE3 LYS 135 HE1 LYS 135 6.795 -8.040 3.441 1010 HZ1 LYS 135 HZ1 LYS 135 8.115 -8.564 1.469 1011 HZ2 LYS 135 HZ2 LYS 135 9.039 -7.801 2.662 1012 HZ3 LYS 135 HZ3 LYS 135 8.540 -6.933 1.294 1013 H ARG 136 HN ARG 136 3.109 -11.438 1.924 1014 HA ARG 136 HA ARG 136 3.079 -12.884 4.484 1015 HE ARG 136 HE ARG 136 -1.854 -11.803 3.432 1016 HB2 ARG 136 HB2 ARG 136 0.917 -13.862 3.664 1017 HB3 ARG 136 HB1 ARG 136 0.860 -12.129 3.938 1018 HG2 ARG 136 HG2 ARG 136 1.203 -11.789 1.505 1019 HG3 ARG 136 HG1 ARG 136 1.097 -13.538 1.291 1020 HD2 ARG 136 HD2 ARG 136 -1.021 -12.397 0.813 1021 HD3 ARG 136 HD1 ARG 136 -1.160 -13.538 2.147 1022 HH11 ARG 136 HH11 ARG 136 0.270 -10.481 0.965 1023 HH12 ARG 136 HH12 ARG 136 0.015 -8.832 1.442 1024 HH21 ARG 136 HH21 ARG 136 -2.230 -9.630 4.033 1025 HH22 ARG 136 HH22 ARG 136 -1.419 -8.351 3.186 1026 H ARG 137 HN ARG 137 5.188 -13.683 3.628 1027 HA ARG 137 HA ARG 137 4.837 -16.176 2.208 1028 HE ARG 137 HE ARG 137 7.325 -13.969 -1.351 1029 HB2 ARG 137 HB2 ARG 137 6.112 -13.788 0.974 1030 HB3 ARG 137 HB1 ARG 137 6.874 -15.351 0.695 1031 HG2 ARG 137 HG2 ARG 137 4.944 -16.201 -0.364 1032 HG3 ARG 137 HG1 ARG 137 3.957 -14.846 0.173 1033 HD2 ARG 137 HD2 ARG 137 4.654 -14.800 -2.237 1034 HD3 ARG 137 HD1 ARG 137 5.045 -13.363 -1.297 1035 HH11 ARG 137 HH11 ARG 137 5.304 -16.222 -3.142 1036 HH12 ARG 137 HH12 ARG 137 6.625 -16.832 -4.098 1037 HH21 ARG 137 HH21 ARG 137 9.027 -14.732 -2.600 1038 HH22 ARG 137 HH22 ARG 137 8.761 -15.976 -3.789 1039 H HIS 138 HN HIS 138 5.944 -17.579 3.352 1040 HA HIS 138 HA HIS 138 8.715 -16.884 4.046 1041 HD1 HIS 138 HD1 HIS 138 8.985 -20.267 6.240 1042 HD2 HIS 138 HD2 HIS 138 9.724 -16.258 7.080 1043 HE1 HIS 138 HE1 HIS 138 11.128 -20.230 7.555 1044 HE2 HIS 138 HE2 HIS 138 11.658 -17.780 7.881 1045 HB2 HIS 138 HB2 HIS 138 7.205 -16.973 6.086 1046 HB3 HIS 138 HB1 HIS 138 6.983 -18.689 5.754 1047 H GLU 139 HN GLU 139 9.847 -17.981 2.621 1048 HA GLU 139 HA GLU 139 9.043 -20.568 1.649 1049 HB2 GLU 139 HB2 GLU 139 10.141 -19.036 0.120 1050 HB3 GLU 139 HB1 GLU 139 11.534 -18.921 1.185 1051 HG2 GLU 139 HG2 GLU 139 11.929 -21.358 0.813 1052 HG3 GLU 139 HG1 GLU 139 10.633 -21.322 -0.382 Start of MODEL 8 1 H1 GLY 1 HT1 GLY 1 -29.966 38.269 -0.604 2 H2 GLY 1 HT2 GLY 1 -29.592 36.716 -0.045 3 H3 GLY 1 HT3 GLY 1 -30.232 36.926 -1.600 4 HA2 GLY 1 HA1 GLY 1 -28.263 38.057 -2.334 5 HA3 GLY 1 HA2 GLY 1 -27.602 37.964 -0.705 6 HA PRO 2 HA PRO 2 -26.563 34.116 -3.366 7 HB2 PRO 2 HB2 PRO 2 -23.911 34.650 -3.757 8 HB3 PRO 2 HB1 PRO 2 -25.178 35.082 -4.914 9 HG2 PRO 2 HG2 PRO 2 -23.824 36.789 -2.858 10 HG3 PRO 2 HG1 PRO 2 -24.254 37.182 -4.531 11 HD2 PRO 2 HD2 PRO 2 -25.734 38.019 -2.439 12 HD3 PRO 2 HD1 PRO 2 -26.462 37.597 -4.003 13 H LEU 3 HN LEU 3 -24.992 35.920 -0.820 14 HA LEU 3 HA LEU 3 -24.135 33.389 0.420 15 HG LEU 3 HG LEU 3 -20.936 34.828 1.579 16 HB2 LEU 3 HB2 LEU 3 -22.384 35.151 -0.246 17 HB3 LEU 3 HB1 LEU 3 -23.036 36.124 1.053 18 HD11 LEU 3 HD11 LEU 3 -22.333 35.726 3.354 19 HD12 LEU 3 HD12 LEU 3 -21.660 34.160 3.813 20 HD13 LEU 3 HD13 LEU 3 -23.345 34.281 3.305 21 HD21 LEU 3 HD21 LEU 3 -21.493 32.767 0.417 22 HD22 LEU 3 HD22 LEU 3 -22.836 32.490 1.527 23 HD23 LEU 3 HD23 LEU 3 -21.176 32.458 2.124 24 H GLY 4 HN GLY 4 -25.159 32.842 2.241 25 HA2 GLY 4 HA2 GLY 4 -26.003 33.314 4.421 26 HA3 GLY 4 HA1 GLY 4 -26.360 34.956 3.900 27 H SER 5 HN SER 5 -27.631 34.153 1.429 28 HA SER 5 HA SER 5 -30.126 33.025 2.503 29 HG SER 5 HG SER 5 -29.579 35.529 2.312 30 HB2 SER 5 HB2 SER 5 -29.811 34.413 -0.161 31 HB3 SER 5 HB1 SER 5 -31.277 34.192 0.793 32 H GLU 6 HN GLU 6 -30.115 30.854 2.208 33 HA GLU 6 HA GLU 6 -28.573 29.729 0.028 34 HB2 GLU 6 HB2 GLU 6 -29.096 27.550 1.064 35 HB3 GLU 6 HB1 GLU 6 -28.345 28.674 2.180 36 HG2 GLU 6 HG2 GLU 6 -31.317 28.233 2.078 37 HG3 GLU 6 HG1 GLU 6 -30.240 27.268 3.082 38 H SER 7 HN SER 7 -29.322 28.474 -1.622 39 HA SER 7 HA SER 7 -32.194 28.676 -2.191 40 HG SER 7 HG SER 7 -31.394 28.157 -5.663 41 HB2 SER 7 HB2 SER 7 -30.630 29.613 -3.882 42 HB3 SER 7 HB1 SER 7 -29.901 28.019 -4.065 43 H LEU 8 HN LEU 8 -33.408 26.901 -2.012 44 HA LEU 8 HA LEU 8 -32.068 24.403 -1.409 45 HG LEU 8 HG LEU 8 -34.684 24.553 1.180 46 HB2 LEU 8 HB2 LEU 8 -34.930 25.286 -1.201 47 HB3 LEU 8 HB1 LEU 8 -34.464 23.610 -0.999 48 HD11 LEU 8 HD11 LEU 8 -31.755 24.414 0.486 49 HD12 LEU 8 HD12 LEU 8 -32.793 23.046 0.895 50 HD13 LEU 8 HD13 LEU 8 -32.443 24.281 2.104 51 HD21 LEU 8 HD21 LEU 8 -33.423 26.528 1.911 52 HD22 LEU 8 HD22 LEU 8 -34.550 26.905 0.609 53 HD23 LEU 8 HD23 LEU 8 -32.829 26.743 0.262 54 H MET 9 HN MET 9 -31.273 23.719 -3.341 55 HA MET 9 HA MET 9 -33.268 22.969 -5.373 56 HB2 MET 9 HB2 MET 9 -30.311 23.524 -5.600 57 HB3 MET 9 HB1 MET 9 -31.206 22.682 -6.857 58 HG2 MET 9 HG2 MET 9 -31.892 25.426 -5.843 59 HG3 MET 9 HG1 MET 9 -30.902 25.105 -7.264 60 HE1 MET 9 HE1 MET 9 -32.239 22.664 -8.640 61 HE2 MET 9 HE2 MET 9 -31.801 24.127 -9.520 62 HE3 MET 9 HE3 MET 9 -33.410 23.431 -9.713 63 HA PRO 10 HA PRO 10 -32.479 18.839 -3.746 64 HB2 PRO 10 HB2 PRO 10 -34.312 17.607 -5.350 65 HB3 PRO 10 HB1 PRO 10 -34.747 18.465 -3.866 66 HG2 PRO 10 HG2 PRO 10 -34.877 19.404 -6.706 67 HG3 PRO 10 HG1 PRO 10 -36.067 19.607 -5.405 68 HD2 PRO 10 HD2 PRO 10 -34.386 21.586 -6.120 69 HD3 PRO 10 HD1 PRO 10 -34.896 21.353 -4.437 70 H SER 11 HN SER 11 -32.013 20.140 -6.841 71 HA SER 11 HA SER 11 -30.907 17.672 -7.927 72 HG SER 11 HG SER 11 -31.081 17.661 -10.263 73 HB2 SER 11 HB2 SER 11 -32.404 19.263 -9.277 74 HB3 SER 11 HB1 SER 11 -31.012 20.346 -9.320 75 H GLN 12 HN GLN 12 -29.067 17.411 -6.714 76 HA GLN 12 HA GLN 12 -26.940 19.368 -7.257 77 HB2 GLN 12 HB2 GLN 12 -27.680 19.417 -4.869 78 HB3 GLN 12 HB1 GLN 12 -27.205 17.730 -4.730 79 HG2 GLN 12 HG2 GLN 12 -24.892 18.386 -5.330 80 HG3 GLN 12 HG1 GLN 12 -25.409 20.070 -5.319 81 HE21 GLN 12 HE21 GLN 12 -26.591 17.660 -3.086 82 HE22 GLN 12 HE22 GLN 12 -25.822 18.304 -1.675 83 H VAL 13 HN VAL 13 -25.763 18.398 -8.791 84 HA VAL 13 HA VAL 13 -25.276 15.525 -8.622 85 HB VAL 13 HB VAL 13 -25.981 16.342 -10.792 86 HG11 VAL 13 HG11 VAL 13 -23.532 18.097 -10.755 87 HG12 VAL 13 HG12 VAL 13 -25.208 18.639 -10.630 88 HG13 VAL 13 HG13 VAL 13 -24.635 17.882 -12.116 89 HG21 VAL 13 HG21 VAL 13 -24.484 14.458 -10.804 90 HG22 VAL 13 HG22 VAL 13 -23.081 15.526 -10.766 91 HG23 VAL 13 HG23 VAL 13 -24.129 15.496 -12.186 92 H VAL 14 HN VAL 14 -23.385 14.688 -7.983 93 HA VAL 14 HA VAL 14 -21.221 16.563 -7.351 94 HB VAL 14 HB VAL 14 -21.979 15.133 -5.500 95 HG11 VAL 14 HG11 VAL 14 -21.545 12.719 -5.524 96 HG12 VAL 14 HG12 VAL 14 -21.065 12.833 -7.216 97 HG13 VAL 14 HG13 VAL 14 -22.725 13.191 -6.749 98 HG21 VAL 14 HG21 VAL 14 -19.198 14.505 -6.482 99 HG22 VAL 14 HG22 VAL 14 -19.778 14.224 -4.840 100 HG23 VAL 14 HG23 VAL 14 -19.679 15.868 -5.470 101 H LYS 15 HN LYS 15 -19.258 16.452 -8.287 102 HA LYS 15 HA LYS 15 -18.894 14.377 -10.360 103 HB2 LYS 15 HB2 LYS 15 -19.389 16.519 -11.416 104 HB3 LYS 15 HB1 LYS 15 -18.130 17.305 -10.475 105 HG2 LYS 15 HG2 LYS 15 -17.341 16.943 -12.707 106 HG3 LYS 15 HG1 LYS 15 -16.451 15.888 -11.607 107 HD2 LYS 15 HD2 LYS 15 -17.967 14.034 -12.229 108 HD3 LYS 15 HD1 LYS 15 -18.757 15.105 -13.391 109 HE2 LYS 15 HE2 LYS 15 -17.163 13.757 -14.571 110 HE3 LYS 15 HE1 LYS 15 -16.557 15.411 -14.511 111 HZ1 LYS 15 HZ1 LYS 15 -15.660 13.101 -12.872 112 HZ2 LYS 15 HZ2 LYS 15 -15.197 14.698 -12.557 113 HZ3 LYS 15 HZ3 LYS 15 -14.760 13.969 -14.018 114 H GLY 16 HN GLY 16 -17.031 13.263 -10.278 115 HA2 GLY 16 HA2 GLY 16 -15.194 13.646 -8.143 116 HA3 GLY 16 HA1 GLY 16 -14.961 12.581 -9.527 117 H GLY 17 HN GLY 17 -13.433 14.875 -7.982 118 HA2 GLY 17 HA2 GLY 17 -11.500 15.972 -8.803 119 HA3 GLY 17 HA1 GLY 17 -12.186 15.926 -10.420 120 H ALA 18 HN ALA 18 -14.766 16.854 -8.883 121 HA ALA 18 HA ALA 18 -14.106 19.715 -9.016 122 HB1 ALA 18 HB1 ALA 18 -16.818 18.383 -9.045 123 HB2 ALA 18 HB2 ALA 18 -15.953 18.972 -10.464 124 HB3 ALA 18 HB3 ALA 18 -16.506 20.109 -9.232 125 H PHE 19 HN PHE 19 -13.176 19.957 -7.001 126 HA PHE 19 HA PHE 19 -14.773 19.136 -4.676 127 HD1 PHE 19 HD2 PHE 19 -13.781 17.427 -2.817 128 HD2 PHE 19 HD1 PHE 19 -11.386 20.942 -2.815 129 HE1 PHE 19 HE2 PHE 19 -13.702 17.363 -0.363 130 HE2 PHE 19 HE1 PHE 19 -11.306 20.887 -0.356 131 HZ PHE 19 HZ PHE 19 -12.464 19.099 0.877 132 HB2 PHE 19 HB2 PHE 19 -12.487 18.210 -4.832 133 HB3 PHE 19 HB1 PHE 19 -11.831 19.840 -4.826 134 H ASP 20 HN ASP 20 -16.119 20.792 -4.289 135 HA ASP 20 HA ASP 20 -14.872 23.387 -3.681 136 HB2 ASP 20 HB2 ASP 20 -17.702 22.814 -4.581 137 HB3 ASP 20 HB1 ASP 20 -17.155 24.381 -3.996 138 H GLY 21 HN GLY 21 -15.410 24.390 -1.746 139 HA2 GLY 21 HA2 GLY 21 -16.001 22.550 0.377 140 HA3 GLY 21 HA1 GLY 21 -15.614 24.257 0.554 141 H THR 22 HN THR 22 -17.939 22.057 1.130 142 HA THR 22 HA THR 22 -20.217 23.770 0.521 143 HB THR 22 HB THR 22 -21.538 21.881 1.546 144 HG1 THR 22 HG1 THR 22 -20.234 20.693 2.779 145 HG21 THR 22 HG21 THR 22 -21.240 20.368 -0.361 146 HG22 THR 22 HG22 THR 22 -19.705 21.154 -0.740 147 HG23 THR 22 HG23 THR 22 -21.211 22.056 -0.873 148 H MET 23 HN MET 23 -21.728 24.393 2.182 149 HA MET 23 HA MET 23 -20.392 25.163 4.643 150 HB2 MET 23 HB2 MET 23 -23.150 25.806 3.578 151 HB3 MET 23 HB1 MET 23 -22.487 26.447 5.075 152 HG2 MET 23 HG2 MET 23 -20.695 27.535 3.804 153 HG3 MET 23 HG1 MET 23 -21.389 26.913 2.308 154 HE1 MET 23 HE1 MET 23 -23.707 27.676 1.313 155 HE2 MET 23 HE2 MET 23 -24.797 28.811 2.111 156 HE3 MET 23 HE3 MET 23 -24.520 27.213 2.808 157 H ASN 24 HN ASN 24 -20.277 23.580 6.093 158 HA ASN 24 HA ASN 24 -22.645 21.902 6.533 159 HB2 ASN 24 HB2 ASN 24 -19.715 21.369 7.010 160 HB3 ASN 24 HB1 ASN 24 -20.980 20.366 7.713 161 HD21 ASN 24 HD21 ASN 24 -18.897 19.689 5.760 162 HD22 ASN 24 HD22 ASN 24 -19.749 19.068 4.382 163 H GLY 25 HN GLY 25 -23.580 21.778 8.484 164 HA2 GLY 25 HA2 GLY 25 -23.302 21.955 10.928 165 HA3 GLY 25 HA1 GLY 25 -22.411 23.432 10.620 166 HA PRO 26 HA PRO 26 -26.350 25.709 10.416 167 HB2 PRO 26 HB2 PRO 26 -26.924 25.604 7.526 168 HB3 PRO 26 HB1 PRO 26 -26.674 27.006 8.572 169 HG2 PRO 26 HG2 PRO 26 -24.837 26.263 6.766 170 HG3 PRO 26 HG1 PRO 26 -24.373 26.927 8.344 171 HD2 PRO 26 HD2 PRO 26 -24.411 24.077 7.424 172 HD3 PRO 26 HD1 PRO 26 -23.197 24.929 8.403 173 H PHE 27 HN PHE 27 -26.729 23.346 7.761 174 HA PHE 27 HA PHE 27 -29.390 22.677 8.703 175 HD1 PHE 27 HD1 PHE 27 -31.356 22.471 6.714 176 HD2 PHE 27 HD2 PHE 27 -28.558 19.280 6.366 177 HE1 PHE 27 HE1 PHE 27 -33.201 20.899 6.320 178 HE2 PHE 27 HE2 PHE 27 -30.405 17.701 5.977 179 HZ PHE 27 HZ PHE 27 -32.734 18.514 5.948 180 HB2 PHE 27 HB2 PHE 27 -28.920 22.854 6.269 181 HB3 PHE 27 HB1 PHE 27 -27.800 21.506 6.404 182 H GLY 28 HN GLY 28 -29.402 21.466 10.497 183 HA2 GLY 28 HA2 GLY 28 -27.364 19.653 11.235 184 HA3 GLY 28 HA1 GLY 28 -28.962 19.750 11.960 185 H HIS 29 HN HIS 29 -26.910 17.734 10.465 186 HA HIS 29 HA HIS 29 -29.095 15.976 9.634 187 HD1 HIS 29 HD1 HIS 29 -26.582 18.838 7.713 188 HD2 HIS 29 HD2 HIS 29 -25.039 14.980 7.585 189 HE1 HIS 29 HE1 HIS 29 -24.146 19.105 7.156 190 HE2 HIS 29 HE2 HIS 29 -23.190 16.770 7.312 191 HB2 HIS 29 HB2 HIS 29 -27.805 15.282 7.618 192 HB3 HIS 29 HB1 HIS 29 -28.389 16.938 7.547 193 H GLY 30 HN GLY 30 -28.862 13.962 10.400 194 HA2 GLY 30 HA2 GLY 30 -26.269 13.318 11.647 195 HA3 GLY 30 HA1 GLY 30 -27.826 12.728 12.213 196 H TYR 31 HN TYR 31 -25.104 11.745 10.828 197 HA TYR 31 HA TYR 31 -26.470 9.607 9.322 198 HD1 TYR 31 HD1 TYR 31 -25.068 13.010 7.972 199 HD2 TYR 31 HD2 TYR 31 -25.907 9.178 6.324 200 HE1 TYR 31 HE1 TYR 31 -26.224 14.079 6.084 201 HE2 TYR 31 HE2 TYR 31 -27.069 10.238 4.436 202 HH TYR 31 HH TYR 31 -28.152 12.312 3.858 203 HB2 TYR 31 HB2 TYR 31 -23.862 11.002 8.714 204 HB3 TYR 31 HB1 TYR 31 -24.260 9.424 8.048 205 H GLY 32 HN GLY 32 -26.459 7.904 10.664 206 HA2 GLY 32 HA2 GLY 32 -24.325 7.327 12.477 207 HA3 GLY 32 HA1 GLY 32 -25.638 6.242 12.038 208 H GLU 33 HN GLU 33 -22.390 6.597 11.965 209 HA GLU 33 HA GLU 33 -21.956 5.444 9.334 210 HB2 GLU 33 HB2 GLU 33 -20.573 7.327 9.982 211 HB3 GLU 33 HB1 GLU 33 -20.068 6.500 11.450 212 HG2 GLU 33 HG2 GLU 33 -18.909 4.853 10.162 213 HG3 GLU 33 HG1 GLU 33 -19.472 5.574 8.656 214 H GLY 34 HN GLY 34 -21.889 3.319 9.089 215 HA2 GLY 34 HA2 GLY 34 -21.564 1.561 11.372 216 HA3 GLY 34 HA1 GLY 34 -21.918 1.074 9.720 217 H ALA 35 HN ALA 35 -19.872 0.249 11.817 218 HA ALA 35 HA ALA 35 -17.313 1.002 10.902 219 HB1 ALA 35 HB1 ALA 35 -16.481 -0.853 12.227 220 HB2 ALA 35 HB2 ALA 35 -18.107 -1.525 12.340 221 HB3 ALA 35 HB3 ALA 35 -17.732 0.018 13.113 222 H GLY 36 HN GLY 36 -16.285 0.481 9.107 223 HA2 GLY 36 HA2 GLY 36 -17.386 -1.476 7.300 224 HA3 GLY 36 HA1 GLY 36 -16.016 -0.416 6.984 225 H GLU 37 HN GLU 37 -16.947 -3.507 7.507 226 HA GLU 37 HA GLU 37 -14.712 -4.469 9.000 227 HB2 GLU 37 HB2 GLU 37 -15.638 -6.671 8.458 228 HB3 GLU 37 HB1 GLU 37 -16.873 -5.568 9.063 229 HG2 GLU 37 HG2 GLU 37 -17.783 -5.253 6.907 230 HG3 GLU 37 HG1 GLU 37 -16.406 -6.035 6.132 231 H GLY 38 HN GLY 38 -13.048 -5.827 8.201 232 HA2 GLY 38 HA2 GLY 38 -12.075 -5.072 5.596 233 HA3 GLY 38 HA1 GLY 38 -11.277 -6.148 6.728 234 H ILE 39 HN ILE 39 -14.094 -5.986 4.630 235 HA ILE 39 HA ILE 39 -14.414 -8.728 4.219 236 HB ILE 39 HB ILE 39 -15.254 -7.831 1.849 237 HG12 ILE 39 HG12 ILE 39 -16.214 -5.568 2.077 238 HG13 ILE 39 HG11 ILE 39 -15.389 -5.364 3.613 239 HG21 ILE 39 HG21 ILE 39 -17.446 -7.487 2.868 240 HG22 ILE 39 HG22 ILE 39 -16.688 -7.376 4.457 241 HG23 ILE 39 HG23 ILE 39 -16.623 -8.890 3.553 242 HD11 ILE 39 HD11 ILE 39 -14.060 -5.709 0.934 243 HD12 ILE 39 HD12 ILE 39 -13.241 -5.459 2.478 244 HD13 ILE 39 HD13 ILE 39 -14.265 -4.190 1.806 245 H ASP 40 HN ASP 40 -13.769 -10.042 2.327 246 HA ASP 40 HA ASP 40 -10.974 -9.633 1.799 247 HB2 ASP 40 HB2 ASP 40 -12.953 -11.765 1.110 248 HB3 ASP 40 HB1 ASP 40 -11.462 -11.671 0.184 249 H ASP 41 HN ASP 41 -11.550 -7.491 0.832 250 HA ASP 41 HA ASP 41 -11.205 -7.846 -2.043 251 HB2 ASP 41 HB2 ASP 41 -13.669 -7.292 -1.555 252 HB3 ASP 41 HB1 ASP 41 -13.089 -5.701 -1.074 253 H VAL 42 HN VAL 42 -9.022 -7.349 -1.462 254 HA VAL 42 HA VAL 42 -8.566 -4.793 -0.185 255 HB VAL 42 HB VAL 42 -7.143 -6.558 0.581 256 HG11 VAL 42 HG11 VAL 42 -6.251 -6.912 -2.274 257 HG12 VAL 42 HG12 VAL 42 -7.199 -8.053 -1.317 258 HG13 VAL 42 HG13 VAL 42 -5.528 -7.705 -0.878 259 HG21 VAL 42 HG21 VAL 42 -6.145 -4.332 0.476 260 HG22 VAL 42 HG22 VAL 42 -5.549 -4.669 -1.149 261 HG23 VAL 42 HG23 VAL 42 -4.934 -5.588 0.225 262 H GLU 43 HN GLU 43 -9.259 -3.307 -1.636 263 HA GLU 43 HA GLU 43 -7.905 -3.149 -4.211 264 HB2 GLU 43 HB2 GLU 43 -10.331 -2.679 -4.143 265 HB3 GLU 43 HB1 GLU 43 -10.031 -1.350 -3.029 266 HG2 GLU 43 HG2 GLU 43 -8.680 -0.234 -4.756 267 HG3 GLU 43 HG1 GLU 43 -9.055 -1.546 -5.872 268 H TRP 44 HN TRP 44 -5.813 -2.709 -3.498 269 HA TRP 44 HA TRP 44 -5.471 -0.151 -2.131 270 HD1 TRP 44 HD1 TRP 44 -3.662 1.361 -1.896 271 HE1 TRP 44 HE1 TRP 44 -1.321 2.238 -1.321 272 HE3 TRP 44 HE3 TRP 44 -1.234 -3.058 -1.451 273 HZ2 TRP 44 HZ2 TRP 44 1.236 1.178 -0.755 274 HZ3 TRP 44 HZ3 TRP 44 1.150 -3.067 -0.919 275 HH2 TRP 44 HH2 TRP 44 2.364 -0.986 -0.556 276 HB2 TRP 44 HB2 TRP 44 -4.167 -2.000 -1.205 277 HB3 TRP 44 HB1 TRP 44 -3.436 -2.285 -2.790 278 H VAL 45 HN VAL 45 -4.582 1.506 -3.018 279 HA VAL 45 HA VAL 45 -4.851 1.927 -5.788 280 HB VAL 45 HB VAL 45 -3.434 3.690 -3.808 281 HG11 VAL 45 HG11 VAL 45 -4.405 5.523 -5.147 282 HG12 VAL 45 HG12 VAL 45 -5.080 4.325 -6.255 283 HG13 VAL 45 HG13 VAL 45 -3.332 4.491 -6.092 284 HG21 VAL 45 HG21 VAL 45 -6.397 3.256 -4.147 285 HG22 VAL 45 HG22 VAL 45 -5.715 4.677 -3.364 286 HG23 VAL 45 HG23 VAL 45 -5.440 3.077 -2.674 287 H VAL 46 HN VAL 46 -2.441 0.235 -4.360 288 HA VAL 46 HA VAL 46 -0.281 1.458 -5.894 289 HB VAL 46 HB VAL 46 -0.347 -0.081 -3.417 290 HG11 VAL 46 HG11 VAL 46 1.656 -1.409 -3.728 291 HG12 VAL 46 HG12 VAL 46 1.656 -1.041 -5.454 292 HG13 VAL 46 HG13 VAL 46 0.345 -1.991 -4.755 293 HG21 VAL 46 HG21 VAL 46 1.751 0.987 -3.058 294 HG22 VAL 46 HG22 VAL 46 0.692 2.148 -3.861 295 HG23 VAL 46 HG23 VAL 46 1.947 1.312 -4.776 296 H GLY 47 HN GLY 47 -2.428 -1.217 -6.058 297 HA2 GLY 47 HA2 GLY 47 -0.879 -2.882 -7.750 298 HA3 GLY 47 HA1 GLY 47 -2.651 -2.875 -7.644 299 H LYS 48 HN LYS 48 -2.269 0.159 -8.279 300 HA LYS 48 HA LYS 48 -2.322 -0.214 -11.181 301 HB2 LYS 48 HB2 LYS 48 -3.424 2.058 -11.121 302 HB3 LYS 48 HB1 LYS 48 -4.354 0.731 -10.445 303 HG2 LYS 48 HG2 LYS 48 -3.758 1.461 -8.203 304 HG3 LYS 48 HG1 LYS 48 -2.767 2.759 -8.877 305 HD2 LYS 48 HD2 LYS 48 -4.919 3.628 -8.174 306 HD3 LYS 48 HD1 LYS 48 -4.779 3.710 -9.931 307 HE2 LYS 48 HE2 LYS 48 -6.080 1.640 -10.113 308 HE3 LYS 48 HE1 LYS 48 -6.251 1.599 -8.357 309 HZ1 LYS 48 HZ1 LYS 48 -7.311 3.672 -10.205 310 HZ2 LYS 48 HZ2 LYS 48 -7.383 3.774 -8.515 311 HZ3 LYS 48 HZ3 LYS 48 -8.215 2.536 -9.327 312 H ASP 49 HN ASP 49 -0.602 1.404 -8.624 313 HA ASP 49 HA ASP 49 0.671 3.195 -10.583 314 HB2 ASP 49 HB2 ASP 49 -0.618 4.068 -8.509 315 HB3 ASP 49 HB1 ASP 49 0.784 3.537 -7.592 316 H LYS 50 HN LYS 50 1.159 0.340 -9.211 317 HA LYS 50 HA LYS 50 3.637 0.297 -8.006 318 HB2 LYS 50 HB2 LYS 50 2.016 -1.611 -8.099 319 HB3 LYS 50 HB1 LYS 50 2.482 -1.862 -9.780 320 HG2 LYS 50 HG2 LYS 50 4.815 -2.229 -9.026 321 HG3 LYS 50 HG1 LYS 50 4.255 -2.120 -7.358 322 HD2 LYS 50 HD2 LYS 50 2.777 -4.035 -7.743 323 HD3 LYS 50 HD1 LYS 50 3.344 -4.133 -9.410 324 HE2 LYS 50 HE2 LYS 50 5.005 -4.508 -6.925 325 HE3 LYS 50 HE1 LYS 50 4.492 -5.764 -8.047 326 HZ1 LYS 50 HZ1 LYS 50 6.798 -5.056 -8.396 327 HZ2 LYS 50 HZ2 LYS 50 6.258 -3.493 -8.765 328 HZ3 LYS 50 HZ3 LYS 50 5.833 -4.788 -9.765 329 HA PRO 51 HA PRO 51 5.527 -0.553 -12.499 330 HB2 PRO 51 HB2 PRO 51 4.227 1.039 -14.375 331 HB3 PRO 51 HB1 PRO 51 4.077 -0.715 -14.220 332 HG2 PRO 51 HG2 PRO 51 2.280 1.440 -13.206 333 HG3 PRO 51 HG1 PRO 51 1.864 -0.146 -13.884 334 HD2 PRO 51 HD2 PRO 51 1.766 0.308 -11.251 335 HD3 PRO 51 HD1 PRO 51 2.316 -1.255 -11.896 336 H THR 52 HN THR 52 4.076 2.433 -11.363 337 HA THR 52 HA THR 52 5.981 4.192 -12.540 338 HB THR 52 HB THR 52 4.392 4.709 -10.022 339 HG1 THR 52 HG1 THR 52 2.625 5.063 -11.210 340 HG21 THR 52 HG21 THR 52 4.448 7.035 -10.816 341 HG22 THR 52 HG22 THR 52 5.419 6.534 -12.200 342 HG23 THR 52 HG23 THR 52 6.069 6.390 -10.565 343 H TYR 53 HN TYR 53 5.589 2.634 -9.412 344 HA TYR 53 HA TYR 53 7.950 3.812 -8.273 345 HD1 TYR 53 HD2 TYR 53 6.420 5.053 -6.756 346 HD2 TYR 53 HD1 TYR 53 4.339 1.352 -6.731 347 HE1 TYR 53 HE2 TYR 53 4.355 6.214 -6.072 348 HE2 TYR 53 HE1 TYR 53 2.283 2.499 -6.069 349 HH TYR 53 HH TYR 53 1.729 5.610 -6.387 350 HB2 TYR 53 HB2 TYR 53 6.522 1.342 -7.340 351 HB3 TYR 53 HB1 TYR 53 7.486 2.446 -6.378 352 H ASP 54 HN ASP 54 7.122 1.016 -10.127 353 HA ASP 54 HA ASP 54 9.507 -0.490 -9.517 354 HB2 ASP 54 HB2 ASP 54 7.463 -1.630 -10.206 355 HB3 ASP 54 HB1 ASP 54 7.446 -0.756 -11.730 356 H GLU 55 HN GLU 55 8.497 1.663 -12.167 357 HA GLU 55 HA GLU 55 10.868 1.261 -13.679 358 HB2 GLU 55 HB2 GLU 55 10.228 3.282 -14.889 359 HB3 GLU 55 HB1 GLU 55 8.888 2.169 -14.711 360 HG2 GLU 55 HG2 GLU 55 8.089 3.560 -12.785 361 HG3 GLU 55 HG1 GLU 55 9.331 4.748 -13.251 362 H ILE 56 HN ILE 56 9.999 3.557 -11.140 363 HA ILE 56 HA ILE 56 12.510 4.908 -11.214 364 HB ILE 56 HB ILE 56 10.651 4.621 -8.844 365 HG12 ILE 56 HG12 ILE 56 10.712 6.833 -10.902 366 HG13 ILE 56 HG11 ILE 56 9.596 5.464 -11.001 367 HG21 ILE 56 HG21 ILE 56 11.648 6.765 -8.149 368 HG22 ILE 56 HG22 ILE 56 12.724 6.702 -9.546 369 HG23 ILE 56 HG23 ILE 56 12.858 5.489 -8.275 370 HD11 ILE 56 HD11 ILE 56 8.472 7.354 -10.048 371 HD12 ILE 56 HD12 ILE 56 9.727 7.529 -8.819 372 HD13 ILE 56 HD13 ILE 56 8.677 6.113 -8.812 373 H PHE 57 HN PHE 57 11.338 1.972 -9.804 374 HA PHE 57 HA PHE 57 13.343 1.424 -7.932 375 HD1 PHE 57 HD2 PHE 57 13.080 -0.678 -6.208 376 HD2 PHE 57 HD1 PHE 57 12.405 -2.392 -10.041 377 HE1 PHE 57 HE2 PHE 57 14.093 -2.785 -5.445 378 HE2 PHE 57 HE1 PHE 57 13.408 -4.504 -9.285 379 HZ PHE 57 HZ PHE 57 14.257 -4.702 -6.985 380 HB2 PHE 57 HB2 PHE 57 11.313 0.170 -7.909 381 HB3 PHE 57 HB1 PHE 57 11.529 -0.338 -9.576 382 H TYR 58 HN TYR 58 13.065 0.269 -11.312 383 HA TYR 58 HA TYR 58 15.677 -0.851 -11.345 384 HD1 TYR 58 HD1 TYR 58 12.239 -1.564 -12.013 385 HD2 TYR 58 HD2 TYR 58 15.733 -3.043 -13.923 386 HE1 TYR 58 HE1 TYR 58 11.411 -3.855 -11.730 387 HE2 TYR 58 HE2 TYR 58 14.920 -5.348 -13.644 388 HH TYR 58 HH TYR 58 11.702 -5.993 -12.264 389 HB2 TYR 58 HB2 TYR 58 13.728 -0.126 -13.522 390 HB3 TYR 58 HB1 TYR 58 15.341 -0.746 -13.894 391 H THR 59 HN THR 59 14.462 2.314 -11.771 392 HA THR 59 HA THR 59 16.683 3.406 -13.177 393 HB THR 59 HB THR 59 14.466 4.679 -11.569 394 HG1 THR 59 HG1 THR 59 13.582 3.980 -13.409 395 HG21 THR 59 HG21 THR 59 16.501 6.038 -13.337 396 HG22 THR 59 HG22 THR 59 16.400 6.187 -11.581 397 HG23 THR 59 HG23 THR 59 15.093 6.801 -12.595 398 H LEU 60 HN LEU 60 16.009 2.719 -9.826 399 HA LEU 60 HA LEU 60 18.258 4.294 -8.886 400 HG LEU 60 HG LEU 60 15.290 4.571 -7.849 401 HB2 LEU 60 HB2 LEU 60 16.330 2.467 -7.466 402 HB3 LEU 60 HB1 LEU 60 17.699 3.221 -6.664 403 HD11 LEU 60 HD11 LEU 60 16.453 4.554 -5.073 404 HD12 LEU 60 HD12 LEU 60 15.073 3.600 -5.610 405 HD13 LEU 60 HD13 LEU 60 14.970 5.362 -5.584 406 HD21 LEU 60 HD21 LEU 60 17.294 5.857 -8.446 407 HD22 LEU 60 HD22 LEU 60 17.781 5.876 -6.750 408 HD23 LEU 60 HD23 LEU 60 16.305 6.699 -7.252 409 H SER 61 HN SER 61 18.024 1.461 -10.455 410 HA SER 61 HA SER 61 19.437 -0.259 -10.859 411 HG SER 61 HG SER 61 22.809 -0.264 -9.811 412 HB2 SER 61 HB2 SER 61 21.197 1.532 -10.692 413 HB3 SER 61 HB1 SER 61 21.409 1.086 -9.003 414 HA PRO 62 HA PRO 62 18.245 -2.398 -7.013 415 HB2 PRO 62 HB2 PRO 62 16.804 -4.337 -8.178 416 HB3 PRO 62 HB1 PRO 62 16.145 -2.714 -7.904 417 HG2 PRO 62 HG2 PRO 62 17.191 -3.933 -10.421 418 HG3 PRO 62 HG1 PRO 62 15.806 -2.853 -10.184 419 HD2 PRO 62 HD2 PRO 62 18.307 -2.060 -11.076 420 HD3 PRO 62 HD1 PRO 62 17.100 -0.989 -10.334 421 H VAL 63 HN VAL 63 18.821 -4.482 -6.216 422 HA VAL 63 HA VAL 63 20.684 -6.014 -7.894 423 HB VAL 63 HB VAL 63 21.059 -5.351 -4.961 424 HG11 VAL 63 HG11 VAL 63 23.201 -6.535 -5.175 425 HG12 VAL 63 HG12 VAL 63 22.766 -7.006 -6.819 426 HG13 VAL 63 HG13 VAL 63 21.820 -7.596 -5.451 427 HG21 VAL 63 HG21 VAL 63 21.601 -3.456 -6.401 428 HG22 VAL 63 HG22 VAL 63 22.671 -4.477 -7.362 429 HG23 VAL 63 HG23 VAL 63 23.057 -4.135 -5.677 430 H ASN 64 HN ASN 64 19.958 -8.006 -8.126 431 HA ASN 64 HA ASN 64 19.178 -10.088 -7.668 432 HB2 ASN 64 HB2 ASN 64 19.400 -9.172 -4.795 433 HB3 ASN 64 HB1 ASN 64 19.069 -10.834 -5.299 434 HD21 ASN 64 HD21 ASN 64 21.306 -9.461 -3.853 435 HD22 ASN 64 HD22 ASN 64 22.733 -10.011 -4.668 436 H GLY 65 HN GLY 65 17.347 -7.634 -7.817 437 HA2 GLY 65 HA2 GLY 65 15.044 -7.838 -8.324 438 HA3 GLY 65 HA1 GLY 65 14.953 -9.215 -7.236 439 H LYS 66 HN LYS 66 16.635 -6.434 -6.141 440 HA LYS 66 HA LYS 66 14.401 -4.983 -5.149 441 HB2 LYS 66 HB2 LYS 66 14.638 -5.350 -2.828 442 HB3 LYS 66 HB1 LYS 66 14.465 -6.925 -3.564 443 HG2 LYS 66 HG2 LYS 66 17.190 -5.854 -3.045 444 HG3 LYS 66 HG1 LYS 66 16.243 -6.487 -1.703 445 HD2 LYS 66 HD2 LYS 66 16.541 -8.077 -4.202 446 HD3 LYS 66 HD1 LYS 66 17.834 -8.052 -3.014 447 HE2 LYS 66 HE2 LYS 66 16.555 -9.903 -2.428 448 HE3 LYS 66 HE1 LYS 66 16.060 -8.651 -1.303 449 HZ1 LYS 66 HZ1 LYS 66 14.563 -9.760 -3.592 450 HZ2 LYS 66 HZ2 LYS 66 14.195 -8.225 -2.985 451 HZ3 LYS 66 HZ3 LYS 66 14.076 -9.577 -1.974 452 H ILE 67 HN ILE 67 15.108 -3.027 -3.991 453 HA ILE 67 HA ILE 67 17.863 -2.348 -4.654 454 HB ILE 67 HB ILE 67 17.173 -0.103 -3.554 455 HG12 ILE 67 HG12 ILE 67 14.491 -1.422 -4.009 456 HG13 ILE 67 HG11 ILE 67 15.122 -0.770 -2.500 457 HG21 ILE 67 HG21 ILE 67 17.602 -0.428 -5.937 458 HG22 ILE 67 HG22 ILE 67 16.237 0.657 -5.686 459 HG23 ILE 67 HG23 ILE 67 15.954 -1.016 -6.167 460 HD11 ILE 67 HD11 ILE 67 14.336 0.795 -4.952 461 HD12 ILE 67 HD12 ILE 67 15.029 1.487 -3.483 462 HD13 ILE 67 HD13 ILE 67 13.452 0.700 -3.428 463 H THR 68 HN THR 68 19.493 -2.349 -3.263 464 HA THR 68 HA THR 68 19.269 -3.157 -0.596 465 HB THR 68 HB THR 68 21.532 -1.813 -0.416 466 HG1 THR 68 HG1 THR 68 22.237 -0.971 -2.231 467 HG21 THR 68 HG21 THR 68 21.367 -4.246 -0.461 468 HG22 THR 68 HG22 THR 68 22.717 -3.695 -1.450 469 HG23 THR 68 HG23 THR 68 21.217 -4.217 -2.218 470 H GLY 69 HN GLY 69 18.829 -2.035 1.253 471 HA2 GLY 69 HA2 GLY 69 16.971 -0.049 0.924 472 HA3 GLY 69 HA1 GLY 69 17.712 -0.451 2.465 473 H ALA 70 HN ALA 70 20.394 0.386 1.424 474 HA ALA 70 HA ALA 70 20.567 3.026 2.200 475 HB1 ALA 70 HB1 ALA 70 22.504 1.575 1.806 476 HB2 ALA 70 HB2 ALA 70 22.673 3.134 0.999 477 HB3 ALA 70 HB3 ALA 70 22.238 1.699 0.068 478 H ASN 71 HN ASN 71 19.783 1.760 -1.002 479 HA ASN 71 HA ASN 71 19.805 4.344 -2.285 480 HB2 ASN 71 HB2 ASN 71 18.363 2.034 -3.502 481 HB3 ASN 71 HB1 ASN 71 19.403 3.234 -4.263 482 HD21 ASN 71 HD21 ASN 71 19.293 0.261 -4.271 483 HD22 ASN 71 HD22 ASN 71 20.882 -0.256 -3.848 484 H ALA 72 HN ALA 72 17.477 2.249 -0.779 485 HA ALA 72 HA ALA 72 15.154 3.583 -1.805 486 HB1 ALA 72 HB1 ALA 72 13.975 2.250 -0.074 487 HB2 ALA 72 HB2 ALA 72 15.544 1.648 0.467 488 HB3 ALA 72 HB3 ALA 72 14.973 1.281 -1.162 489 H LYS 73 HN LYS 73 17.111 3.717 1.099 490 HA LYS 73 HA LYS 73 15.584 5.665 2.464 491 HB2 LYS 73 HB2 LYS 73 18.566 5.150 2.625 492 HB3 LYS 73 HB1 LYS 73 17.624 6.079 3.782 493 HG2 LYS 73 HG2 LYS 73 17.384 3.130 3.219 494 HG3 LYS 73 HG1 LYS 73 18.069 3.885 4.660 495 HD2 LYS 73 HD2 LYS 73 15.214 4.219 3.754 496 HD3 LYS 73 HD1 LYS 73 15.743 3.046 4.953 497 HE2 LYS 73 HE2 LYS 73 16.067 6.036 5.166 498 HE3 LYS 73 HE1 LYS 73 14.818 5.085 5.974 499 HZ1 LYS 73 HZ1 LYS 73 16.891 5.696 7.291 500 HZ2 LYS 73 HZ2 LYS 73 17.697 4.517 6.384 501 HZ3 LYS 73 HZ3 LYS 73 16.380 4.084 7.362 502 H LYS 74 HN LYS 74 18.185 5.772 0.128 503 HA LYS 74 HA LYS 74 18.677 8.503 -0.023 504 HB2 LYS 74 HB2 LYS 74 19.779 6.482 -1.229 505 HB3 LYS 74 HB1 LYS 74 18.550 6.745 -2.458 506 HG2 LYS 74 HG2 LYS 74 20.579 7.836 -3.099 507 HG3 LYS 74 HG1 LYS 74 19.355 9.054 -2.724 508 HD2 LYS 74 HD2 LYS 74 21.514 9.650 -1.784 509 HD3 LYS 74 HD1 LYS 74 20.338 9.362 -0.510 510 HE2 LYS 74 HE2 LYS 74 22.471 8.331 0.069 511 HE3 LYS 74 HE1 LYS 74 21.242 7.098 -0.200 512 HZ1 LYS 74 HZ1 LYS 74 22.152 6.600 -2.327 513 HZ2 LYS 74 HZ2 LYS 74 23.448 6.622 -1.228 514 HZ3 LYS 74 HZ3 LYS 74 23.202 7.937 -2.270 515 H GLU 75 HN GLU 75 16.305 6.534 -1.669 516 HA GLU 75 HA GLU 75 15.082 8.478 -3.255 517 HB2 GLU 75 HB2 GLU 75 14.918 5.830 -3.098 518 HB3 GLU 75 HB1 GLU 75 13.502 6.208 -2.133 519 HG2 GLU 75 HG2 GLU 75 13.374 5.793 -4.728 520 HG3 GLU 75 HG1 GLU 75 12.311 6.934 -3.919 521 H MET 76 HN MET 76 14.031 7.192 -0.093 522 HA MET 76 HA MET 76 11.941 9.126 0.128 523 HB2 MET 76 HB2 MET 76 11.898 8.287 2.561 524 HB3 MET 76 HB1 MET 76 11.486 7.155 1.281 525 HG2 MET 76 HG2 MET 76 13.697 6.190 1.382 526 HG3 MET 76 HG1 MET 76 14.183 7.365 2.599 527 HE1 MET 76 HE1 MET 76 10.859 5.214 2.180 528 HE2 MET 76 HE2 MET 76 11.260 3.857 3.233 529 HE3 MET 76 HE3 MET 76 12.205 4.150 1.774 530 H VAL 77 HN VAL 77 15.296 9.195 0.828 531 HA VAL 77 HA VAL 77 15.236 11.416 2.627 532 HB VAL 77 HB VAL 77 17.378 10.062 1.050 533 HG11 VAL 77 HG11 VAL 77 19.041 11.747 1.669 534 HG12 VAL 77 HG12 VAL 77 17.764 12.781 2.310 535 HG13 VAL 77 HG13 VAL 77 17.824 12.421 0.584 536 HG21 VAL 77 HG21 VAL 77 16.826 9.296 3.290 537 HG22 VAL 77 HG22 VAL 77 17.138 10.909 3.935 538 HG23 VAL 77 HG23 VAL 77 18.456 9.965 3.242 539 H LYS 78 HN LYS 78 15.824 11.128 -0.878 540 HA LYS 78 HA LYS 78 16.092 13.929 -1.299 541 HB2 LYS 78 HB2 LYS 78 15.945 13.417 -3.665 542 HB3 LYS 78 HB1 LYS 78 16.975 12.230 -2.870 543 HG2 LYS 78 HG2 LYS 78 15.103 10.660 -2.816 544 HG3 LYS 78 HG1 LYS 78 14.094 11.851 -3.637 545 HD2 LYS 78 HD2 LYS 78 14.881 10.293 -5.257 546 HD3 LYS 78 HD1 LYS 78 15.703 11.830 -5.509 547 HE2 LYS 78 HE2 LYS 78 17.730 11.030 -4.794 548 HE3 LYS 78 HE1 LYS 78 17.000 9.786 -3.782 549 HZ1 LYS 78 HZ1 LYS 78 16.501 8.474 -5.663 550 HZ2 LYS 78 HZ2 LYS 78 18.121 8.954 -5.839 551 HZ3 LYS 78 HZ3 LYS 78 16.910 9.716 -6.741 552 H SER 79 HN SER 79 13.443 11.890 -0.756 553 HA SER 79 HA SER 79 11.355 13.449 -1.838 554 HG SER 79 HG SER 79 11.917 10.729 -1.572 555 HB2 SER 79 HB2 SER 79 11.418 11.624 0.570 556 HB3 SER 79 HB1 SER 79 9.948 12.241 -0.183 557 H LYS 80 HN LYS 80 13.605 14.422 0.353 558 HA LYS 80 HA LYS 80 13.846 16.457 1.350 559 HB2 LYS 80 HB2 LYS 80 10.950 16.910 0.609 560 HB3 LYS 80 HB1 LYS 80 12.016 18.122 1.309 561 HG2 LYS 80 HG2 LYS 80 13.441 18.032 -0.653 562 HG3 LYS 80 HG1 LYS 80 12.420 16.770 -1.350 563 HD2 LYS 80 HD2 LYS 80 10.524 18.314 -1.351 564 HD3 LYS 80 HD1 LYS 80 11.551 19.575 -0.667 565 HE2 LYS 80 HE2 LYS 80 12.989 19.444 -2.671 566 HE3 LYS 80 HE1 LYS 80 11.894 18.237 -3.351 567 HZ1 LYS 80 HZ1 LYS 80 10.104 19.885 -3.244 568 HZ2 LYS 80 HZ2 LYS 80 11.384 20.412 -4.222 569 HZ3 LYS 80 HZ3 LYS 80 11.196 21.043 -2.659 570 H LEU 81 HN LEU 81 13.304 14.153 2.858 571 HA LEU 81 HA LEU 81 11.509 15.171 4.969 572 HG LEU 81 HG LEU 81 11.055 13.031 2.577 573 HB2 LEU 81 HB2 LEU 81 12.333 12.313 4.582 574 HB3 LEU 81 HB1 LEU 81 11.045 12.937 5.595 575 HD11 LEU 81 HD11 LEU 81 9.344 11.284 2.712 576 HD12 LEU 81 HD12 LEU 81 9.602 11.176 4.452 577 HD13 LEU 81 HD13 LEU 81 10.898 10.737 3.340 578 HD21 LEU 81 HD21 LEU 81 8.937 13.700 4.610 579 HD22 LEU 81 HD22 LEU 81 8.653 13.577 2.874 580 HD23 LEU 81 HD23 LEU 81 9.739 14.817 3.508 581 HA PRO 82 HA PRO 82 14.962 14.688 7.814 582 HB2 PRO 82 HB2 PRO 82 13.628 14.696 10.137 583 HB3 PRO 82 HB1 PRO 82 13.733 16.166 9.131 584 HG2 PRO 82 HG2 PRO 82 11.483 14.208 9.402 585 HG3 PRO 82 HG1 PRO 82 11.424 15.971 9.308 586 HD2 PRO 82 HD2 PRO 82 10.955 14.272 7.205 587 HD3 PRO 82 HD1 PRO 82 11.463 15.966 7.036 588 H ASN 83 HN ASN 83 15.700 13.152 9.469 589 HA ASN 83 HA ASN 83 15.459 10.513 8.658 590 HB2 ASN 83 HB2 ASN 83 16.487 11.708 11.217 591 HB3 ASN 83 HB1 ASN 83 16.476 9.969 10.955 592 HD21 ASN 83 HD21 ASN 83 17.019 10.243 8.079 593 HD22 ASN 83 HD22 ASN 83 18.692 10.663 7.961 594 H THR 84 HN THR 84 13.553 12.249 11.026 595 HA THR 84 HA THR 84 12.354 10.101 12.348 596 HB THR 84 HB THR 84 10.876 12.625 11.629 597 HG1 THR 84 HG1 THR 84 12.527 12.534 13.908 598 HG21 THR 84 HG21 THR 84 10.941 10.958 14.149 599 HG22 THR 84 HG22 THR 84 9.681 10.889 12.916 600 HG23 THR 84 HG23 THR 84 9.918 12.364 13.853 601 H VAL 85 HN VAL 85 11.182 11.935 9.525 602 HA VAL 85 HA VAL 85 8.971 10.247 8.983 603 HB VAL 85 HB VAL 85 10.408 12.046 7.029 604 HG11 VAL 85 HG11 VAL 85 7.540 11.118 7.129 605 HG12 VAL 85 HG12 VAL 85 8.784 10.454 6.071 606 HG13 VAL 85 HG13 VAL 85 8.274 12.131 5.885 607 HG21 VAL 85 HG21 VAL 85 9.831 13.278 9.060 608 HG22 VAL 85 HG22 VAL 85 8.165 12.708 8.935 609 HG23 VAL 85 HG23 VAL 85 8.826 13.782 7.702 610 H LEU 86 HN LEU 86 12.252 10.444 7.677 611 HA LEU 86 HA LEU 86 12.282 8.421 5.822 612 HG LEU 86 HG LEU 86 15.697 9.798 5.836 613 HB2 LEU 86 HB2 LEU 86 14.253 9.516 7.746 614 HB3 LEU 86 HB1 LEU 86 14.640 7.950 7.037 615 HD11 LEU 86 HD11 LEU 86 15.052 9.149 3.607 616 HD12 LEU 86 HD12 LEU 86 13.551 8.455 4.226 617 HD13 LEU 86 HD13 LEU 86 15.106 7.744 4.670 618 HD21 LEU 86 HD21 LEU 86 12.897 10.687 5.193 619 HD22 LEU 86 HD22 LEU 86 14.379 11.349 4.502 620 HD23 LEU 86 HD23 LEU 86 14.045 11.539 6.225 621 H GLY 87 HN GLY 87 12.855 8.090 9.310 622 HA2 GLY 87 HA2 GLY 87 13.267 5.315 9.278 623 HA3 GLY 87 HA1 GLY 87 12.873 6.277 10.693 624 H LYS 88 HN LYS 88 10.291 7.193 9.937 625 HA LYS 88 HA LYS 88 8.946 4.744 10.625 626 HB2 LYS 88 HB2 LYS 88 7.002 6.029 11.115 627 HB3 LYS 88 HB1 LYS 88 8.396 6.858 11.782 628 HG2 LYS 88 HG2 LYS 88 8.296 8.543 10.134 629 HG3 LYS 88 HG1 LYS 88 7.168 7.604 9.150 630 HD2 LYS 88 HD2 LYS 88 5.463 7.810 10.856 631 HD3 LYS 88 HD1 LYS 88 6.584 8.668 11.911 632 HE2 LYS 88 HE2 LYS 88 6.679 10.525 10.365 633 HE3 LYS 88 HE1 LYS 88 5.673 9.654 9.205 634 HZ1 LYS 88 HZ1 LYS 88 4.701 10.212 11.930 635 HZ2 LYS 88 HZ2 LYS 88 3.805 9.887 10.542 636 HZ3 LYS 88 HZ3 LYS 88 4.576 11.386 10.724 637 H ILE 89 HN ILE 89 9.205 6.734 7.751 638 HA ILE 89 HA ILE 89 7.093 5.417 6.362 639 HB ILE 89 HB ILE 89 9.463 7.007 5.427 640 HG12 ILE 89 HG12 ILE 89 6.474 7.428 5.386 641 HG13 ILE 89 HG11 ILE 89 7.655 8.287 6.371 642 HG21 ILE 89 HG21 ILE 89 9.134 5.295 3.740 643 HG22 ILE 89 HG22 ILE 89 8.592 6.860 3.138 644 HG23 ILE 89 HG23 ILE 89 7.411 5.663 3.669 645 HD11 ILE 89 HD11 ILE 89 8.607 9.282 4.377 646 HD12 ILE 89 HD12 ILE 89 6.884 9.633 4.500 647 HD13 ILE 89 HD13 ILE 89 7.456 8.401 3.374 648 H TRP 90 HN TRP 90 10.573 4.886 6.642 649 HA TRP 90 HA TRP 90 10.848 2.687 4.973 650 HD1 TRP 90 HD1 TRP 90 13.051 0.824 8.341 651 HE1 TRP 90 HE1 TRP 90 14.418 -1.040 7.188 652 HE3 TRP 90 HE3 TRP 90 13.153 2.708 3.602 653 HZ2 TRP 90 HZ2 TRP 90 15.396 -1.614 4.616 654 HZ3 TRP 90 HZ3 TRP 90 14.320 1.441 1.862 655 HH2 TRP 90 HH2 TRP 90 15.424 -0.676 2.358 656 HB2 TRP 90 HB2 TRP 90 12.759 3.783 6.063 657 HB3 TRP 90 HB1 TRP 90 12.215 3.185 7.627 658 H LYS 91 HN LYS 91 10.221 2.683 8.476 659 HA LYS 91 HA LYS 91 10.015 -0.142 8.584 660 HB2 LYS 91 HB2 LYS 91 9.469 0.143 10.899 661 HB3 LYS 91 HB1 LYS 91 10.684 1.346 10.485 662 HG2 LYS 91 HG2 LYS 91 8.953 3.054 10.325 663 HG3 LYS 91 HG1 LYS 91 7.727 1.853 10.723 664 HD2 LYS 91 HD2 LYS 91 8.098 2.854 12.773 665 HD3 LYS 91 HD1 LYS 91 9.172 1.458 12.844 666 HE2 LYS 91 HE2 LYS 91 10.077 4.191 11.968 667 HE3 LYS 91 HE1 LYS 91 10.140 3.646 13.641 668 HZ1 LYS 91 HZ1 LYS 91 11.615 1.863 12.983 669 HZ2 LYS 91 HZ2 LYS 91 12.257 3.358 12.502 670 HZ3 LYS 91 HZ3 LYS 91 11.532 2.344 11.359 671 H LEU 92 HN LEU 92 7.765 2.282 7.715 672 HA LEU 92 HA LEU 92 5.431 0.751 8.452 673 HG LEU 92 HG LEU 92 3.250 2.054 6.975 674 HB2 LEU 92 HB2 LEU 92 5.656 3.316 8.295 675 HB3 LEU 92 HB1 LEU 92 5.456 3.093 6.558 676 HD11 LEU 92 HD11 LEU 92 2.247 2.198 9.197 677 HD12 LEU 92 HD12 LEU 92 3.761 2.829 9.848 678 HD13 LEU 92 HD13 LEU 92 3.687 1.180 9.221 679 HD21 LEU 92 HD21 LEU 92 3.614 4.771 8.240 680 HD22 LEU 92 HD22 LEU 92 2.093 4.106 7.646 681 HD23 LEU 92 HD23 LEU 92 3.404 4.447 6.517 682 H ALA 93 HN ALA 93 7.312 1.402 5.512 683 HA ALA 93 HA ALA 93 5.484 -0.271 3.978 684 HB1 ALA 93 HB1 ALA 93 6.931 0.319 2.056 685 HB2 ALA 93 HB2 ALA 93 7.938 1.267 3.154 686 HB3 ALA 93 HB3 ALA 93 6.250 1.717 2.887 687 H ASP 94 HN ASP 94 8.739 -0.425 5.336 688 HA ASP 94 HA ASP 94 9.274 -3.001 4.114 689 HB2 ASP 94 HB2 ASP 94 11.100 -1.407 4.488 690 HB3 ASP 94 HB1 ASP 94 10.841 -1.462 6.202 691 H VAL 95 HN VAL 95 7.458 -4.091 4.902 692 HA VAL 95 HA VAL 95 6.820 -4.404 7.638 693 HB VAL 95 HB VAL 95 6.129 -6.347 5.432 694 HG11 VAL 95 HG11 VAL 95 4.704 -5.619 7.988 695 HG12 VAL 95 HG12 VAL 95 5.601 -7.109 7.690 696 HG13 VAL 95 HG13 VAL 95 4.131 -6.766 6.777 697 HG21 VAL 95 HG21 VAL 95 4.741 -3.779 6.178 698 HG22 VAL 95 HG22 VAL 95 4.109 -4.995 5.069 699 HG23 VAL 95 HG23 VAL 95 5.584 -4.116 4.665 700 H ASP 96 HN ASP 96 9.091 -5.936 5.551 701 HA ASP 96 HA ASP 96 9.450 -8.216 7.310 702 HB2 ASP 96 HB2 ASP 96 11.373 -8.580 5.511 703 HB3 ASP 96 HB1 ASP 96 9.689 -9.001 5.261 704 H LYS 97 HN LYS 97 11.031 -5.206 6.517 705 HA LYS 97 HA LYS 97 12.400 -4.027 7.817 706 HB2 LYS 97 HB2 LYS 97 12.449 -6.138 9.943 707 HB3 LYS 97 HB1 LYS 97 12.465 -4.386 10.130 708 HG2 LYS 97 HG2 LYS 97 10.124 -4.385 9.246 709 HG3 LYS 97 HG1 LYS 97 10.158 -6.135 9.348 710 HD2 LYS 97 HD2 LYS 97 9.076 -5.185 11.312 711 HD3 LYS 97 HD1 LYS 97 10.560 -6.034 11.741 712 HE2 LYS 97 HE2 LYS 97 11.746 -3.920 11.915 713 HE3 LYS 97 HE1 LYS 97 10.301 -3.045 11.409 714 HZ1 LYS 97 HZ1 LYS 97 10.528 -2.956 13.794 715 HZ2 LYS 97 HZ2 LYS 97 10.607 -4.645 13.897 716 HZ3 LYS 97 HZ3 LYS 97 9.168 -3.893 13.407 717 H ASP 98 HN ASP 98 13.526 -5.371 5.875 718 HA ASP 98 HA ASP 98 15.738 -6.945 6.959 719 HB2 ASP 98 HB2 ASP 98 15.931 -7.805 4.580 720 HB3 ASP 98 HB1 ASP 98 14.474 -8.272 5.461 721 H GLY 99 HN GLY 99 15.201 -3.875 5.942 722 HA2 GLY 99 HA2 GLY 99 16.806 -2.209 5.538 723 HA3 GLY 99 HA1 GLY 99 18.040 -3.456 5.592 724 H LEU 100 HN LEU 100 15.447 -4.087 3.480 725 HA LEU 100 HA LEU 100 16.528 -2.614 1.243 726 HG LEU 100 HG LEU 100 16.242 -6.160 2.304 727 HB2 LEU 100 HB2 LEU 100 16.717 -4.601 -0.208 728 HB3 LEU 100 HB1 LEU 100 17.899 -4.577 1.083 729 HD11 LEU 100 HD11 LEU 100 14.940 -7.578 0.807 730 HD12 LEU 100 HD12 LEU 100 15.357 -6.531 -0.551 731 HD13 LEU 100 HD13 LEU 100 14.374 -5.910 0.777 732 HD21 LEU 100 HD21 LEU 100 18.450 -6.793 1.565 733 HD22 LEU 100 HD22 LEU 100 17.854 -7.039 -0.076 734 HD23 LEU 100 HD23 LEU 100 17.299 -8.088 1.231 735 H LEU 101 HN LEU 101 15.080 -3.303 -0.786 736 HA LEU 101 HA LEU 101 12.329 -3.640 0.028 737 HG LEU 101 HG LEU 101 13.476 -0.827 1.260 738 HB2 LEU 101 HB2 LEU 101 13.369 -1.042 -1.127 739 HB3 LEU 101 HB1 LEU 101 11.668 -1.472 -1.072 740 HD11 LEU 101 HD11 LEU 101 10.955 0.458 0.234 741 HD12 LEU 101 HD12 LEU 101 12.588 1.047 -0.067 742 HD13 LEU 101 HD13 LEU 101 11.947 1.019 1.579 743 HD21 LEU 101 HD21 LEU 101 11.966 -2.670 1.889 744 HD22 LEU 101 HD22 LEU 101 10.594 -1.706 1.348 745 HD23 LEU 101 HD23 LEU 101 11.561 -1.168 2.726 746 H ASP 102 HN ASP 102 11.630 -5.003 -1.520 747 HA ASP 102 HA ASP 102 12.981 -5.101 -4.056 748 HB2 ASP 102 HB2 ASP 102 11.838 -7.043 -4.438 749 HB3 ASP 102 HB1 ASP 102 11.854 -7.022 -2.680 750 H ASP 103 HN ASP 103 11.081 -5.381 -6.001 751 HA ASP 103 HA ASP 103 10.475 -2.689 -6.556 752 HB2 ASP 103 HB2 ASP 103 9.154 -3.544 -8.477 753 HB3 ASP 103 HB1 ASP 103 10.787 -4.222 -8.387 754 H GLU 104 HN GLU 104 8.608 -5.230 -5.078 755 HA GLU 104 HA GLU 104 6.108 -3.838 -5.096 756 HB2 GLU 104 HB2 GLU 104 6.417 -6.314 -4.907 757 HB3 GLU 104 HB1 GLU 104 7.037 -6.072 -3.285 758 HG2 GLU 104 HG2 GLU 104 4.902 -5.168 -2.575 759 HG3 GLU 104 HG1 GLU 104 4.274 -5.343 -4.229 760 H GLU 105 HN GLU 105 8.751 -4.222 -2.803 761 HA GLU 105 HA GLU 105 7.607 -2.762 -0.677 762 HB2 GLU 105 HB2 GLU 105 10.210 -3.874 -1.395 763 HB3 GLU 105 HB1 GLU 105 10.306 -2.448 -0.373 764 HG2 GLU 105 HG2 GLU 105 9.061 -3.475 1.338 765 HG3 GLU 105 HG1 GLU 105 8.560 -4.794 0.278 766 H PHE 106 HN PHE 106 9.682 -1.771 -3.382 767 HA PHE 106 HA PHE 106 9.939 0.935 -2.591 768 HD1 PHE 106 HD2 PHE 106 9.071 2.740 -4.530 769 HD2 PHE 106 HD1 PHE 106 12.731 1.037 -5.825 770 HE1 PHE 106 HE2 PHE 106 9.799 4.928 -5.398 771 HE2 PHE 106 HE1 PHE 106 13.438 3.191 -6.703 772 HZ PHE 106 HZ PHE 106 11.985 5.152 -6.477 773 HB2 PHE 106 HB2 PHE 106 11.351 -0.168 -4.338 774 HB3 PHE 106 HB1 PHE 106 9.971 -0.180 -5.417 775 H ALA 107 HN ALA 107 7.571 -0.843 -4.506 776 HA ALA 107 HA ALA 107 5.939 1.198 -5.372 777 HB1 ALA 107 HB1 ALA 107 4.094 -0.418 -5.308 778 HB2 ALA 107 HB2 ALA 107 5.086 -1.497 -4.324 779 HB3 ALA 107 HB3 ALA 107 5.565 -1.125 -5.979 780 H LEU 108 HN LEU 108 5.818 -0.463 -2.212 781 HA LEU 108 HA LEU 108 3.782 1.257 -1.199 782 HG LEU 108 HG LEU 108 2.686 -0.166 0.621 783 HB2 LEU 108 HB2 LEU 108 4.673 -1.097 -0.360 784 HB3 LEU 108 HB1 LEU 108 5.700 -0.081 0.650 785 HD11 LEU 108 HD11 LEU 108 4.725 -0.903 2.686 786 HD12 LEU 108 HD12 LEU 108 3.694 -2.002 1.768 787 HD13 LEU 108 HD13 LEU 108 2.979 -0.887 2.932 788 HD21 LEU 108 HD21 LEU 108 4.455 1.579 2.312 789 HD22 LEU 108 HD22 LEU 108 2.696 1.457 2.389 790 HD23 LEU 108 HD23 LEU 108 3.472 2.133 0.956 791 H ALA 109 HN ALA 109 7.310 1.106 -0.659 792 HA ALA 109 HA ALA 109 7.684 3.162 1.091 793 HB1 ALA 109 HB1 ALA 109 9.478 1.752 0.211 794 HB2 ALA 109 HB2 ALA 109 9.898 3.464 0.144 795 HB3 ALA 109 HB3 ALA 109 9.402 2.620 -1.324 796 H ASN 110 HN ASN 110 7.601 3.592 -2.450 797 HA ASN 110 HA ASN 110 7.823 6.428 -2.297 798 HB2 ASN 110 HB2 ASN 110 8.529 4.906 -4.230 799 HB3 ASN 110 HB1 ASN 110 6.829 4.875 -4.674 800 HD21 ASN 110 HD21 ASN 110 8.521 7.641 -3.312 801 HD22 ASN 110 HD22 ASN 110 8.396 8.634 -4.718 802 H HIS 111 HN HIS 111 5.250 4.104 -2.220 803 HA HIS 111 HA HIS 111 3.155 5.852 -3.028 804 HD1 HIS 111 HD1 HIS 111 0.800 4.466 -4.111 805 HD2 HIS 111 HD2 HIS 111 0.642 4.059 0.023 806 HE1 HIS 111 HE1 HIS 111 -1.623 4.762 -3.477 807 HE2 HIS 111 HE2 HIS 111 -1.631 4.822 -0.966 808 HB2 HIS 111 HB2 HIS 111 2.927 3.364 -2.975 809 HB3 HIS 111 HB1 HIS 111 2.989 3.429 -1.212 810 H LEU 112 HN LEU 112 4.539 4.929 0.090 811 HA LEU 112 HA LEU 112 2.854 6.529 1.689 812 HG LEU 112 HG LEU 112 3.936 3.702 2.207 813 HB2 LEU 112 HB2 LEU 112 5.634 5.453 2.105 814 HB3 LEU 112 HB1 LEU 112 4.783 6.383 3.336 815 HD11 LEU 112 HD11 LEU 112 5.830 3.600 3.744 816 HD12 LEU 112 HD12 LEU 112 4.377 2.909 4.467 817 HD13 LEU 112 HD13 LEU 112 4.919 4.520 4.941 818 HD21 LEU 112 HD21 LEU 112 2.004 5.112 2.680 819 HD22 LEU 112 HD22 LEU 112 2.620 5.427 4.303 820 HD23 LEU 112 HD23 LEU 112 2.139 3.793 3.841 821 H ILE 113 HN ILE 113 5.816 7.151 -0.065 822 HA ILE 113 HA ILE 113 6.407 9.687 0.953 823 HB ILE 113 HB ILE 113 6.923 8.543 -1.786 824 HG12 ILE 113 HG12 ILE 113 7.969 7.362 0.089 825 HG13 ILE 113 HG11 ILE 113 9.181 8.168 -0.902 826 HG21 ILE 113 HG21 ILE 113 8.604 10.317 -2.049 827 HG22 ILE 113 HG22 ILE 113 8.052 11.049 -0.542 828 HG23 ILE 113 HG23 ILE 113 6.970 10.968 -1.932 829 HD11 ILE 113 HD11 ILE 113 9.316 9.965 0.741 830 HD12 ILE 113 HD12 ILE 113 9.670 8.397 1.466 831 HD13 ILE 113 HD13 ILE 113 8.098 9.155 1.724 832 H LYS 114 HN LYS 114 4.473 8.802 -1.935 833 HA LYS 114 HA LYS 114 3.693 11.534 -2.330 834 HB2 LYS 114 HB2 LYS 114 2.082 10.655 -3.989 835 HB3 LYS 114 HB1 LYS 114 3.728 10.110 -4.255 836 HG2 LYS 114 HG2 LYS 114 3.098 7.957 -3.147 837 HG3 LYS 114 HG1 LYS 114 1.429 8.532 -3.138 838 HD2 LYS 114 HD2 LYS 114 3.139 8.244 -5.604 839 HD3 LYS 114 HD1 LYS 114 1.940 7.070 -5.065 840 HE2 LYS 114 HE2 LYS 114 0.161 8.639 -5.377 841 HE3 LYS 114 HE1 LYS 114 1.299 9.948 -5.682 842 HZ1 LYS 114 HZ1 LYS 114 0.245 9.006 -7.705 843 HZ2 LYS 114 HZ2 LYS 114 1.060 7.547 -7.421 844 HZ3 LYS 114 HZ3 LYS 114 1.940 8.965 -7.732 845 H VAL 115 HN VAL 115 2.435 8.912 -0.444 846 HA VAL 115 HA VAL 115 -0.106 9.939 0.184 847 HB VAL 115 HB VAL 115 1.807 8.175 1.695 848 HG11 VAL 115 HG11 VAL 115 0.650 9.532 3.387 849 HG12 VAL 115 HG12 VAL 115 0.127 7.847 3.430 850 HG13 VAL 115 HG13 VAL 115 -0.898 9.072 2.682 851 HG21 VAL 115 HG21 VAL 115 0.563 7.213 -0.166 852 HG22 VAL 115 HG22 VAL 115 -0.951 7.759 0.554 853 HG23 VAL 115 HG23 VAL 115 0.019 6.531 1.367 854 H LYS 116 HN LYS 116 3.075 10.528 1.749 855 HA LYS 116 HA LYS 116 1.852 12.565 3.405 856 HB2 LYS 116 HB2 LYS 116 4.031 12.855 4.396 857 HB3 LYS 116 HB1 LYS 116 3.568 11.162 4.369 858 HG2 LYS 116 HG2 LYS 116 5.225 10.589 2.967 859 HG3 LYS 116 HG1 LYS 116 5.161 12.125 2.090 860 HD2 LYS 116 HD2 LYS 116 6.246 11.750 4.871 861 HD3 LYS 116 HD1 LYS 116 7.218 11.882 3.410 862 HE2 LYS 116 HE2 LYS 116 5.360 13.971 4.540 863 HE3 LYS 116 HE1 LYS 116 7.120 14.024 4.537 864 HZ1 LYS 116 HZ1 LYS 116 6.937 13.944 2.037 865 HZ2 LYS 116 HZ2 LYS 116 6.428 15.381 2.767 866 HZ3 LYS 116 HZ3 LYS 116 5.282 14.257 2.225 867 H LEU 117 HN LEU 117 2.807 12.456 0.289 868 HA LEU 117 HA LEU 117 3.768 15.166 0.082 869 HG LEU 117 HG LEU 117 2.688 15.646 -2.744 870 HB2 LEU 117 HB2 LEU 117 4.440 13.492 -1.566 871 HB3 LEU 117 HB1 LEU 117 2.750 13.229 -2.007 872 HD11 LEU 117 HD11 LEU 117 5.675 15.379 -2.416 873 HD12 LEU 117 HD12 LEU 117 4.612 16.475 -1.530 874 HD13 LEU 117 HD13 LEU 117 4.853 16.688 -3.264 875 HD21 LEU 117 HD21 LEU 117 2.842 13.839 -4.337 876 HD22 LEU 117 HD22 LEU 117 4.589 13.758 -4.123 877 HD23 LEU 117 HD23 LEU 117 3.855 15.186 -4.857 878 H GLU 118 HN GLU 118 0.735 13.464 0.054 879 HA GLU 118 HA GLU 118 -0.909 15.435 -1.087 880 HB2 GLU 118 HB2 GLU 118 -1.565 13.407 1.055 881 HB3 GLU 118 HB1 GLU 118 -2.754 14.354 0.175 882 HG2 GLU 118 HG2 GLU 118 -1.880 13.301 -1.932 883 HG3 GLU 118 HG1 GLU 118 -0.931 12.221 -0.900 884 H GLY 119 HN GLY 119 0.666 15.315 1.970 885 HA2 GLY 119 HA2 GLY 119 0.896 17.460 3.111 886 HA3 GLY 119 HA1 GLY 119 -0.798 17.750 2.754 887 H HIS 120 HN HIS 120 -0.311 14.533 3.623 888 HA HIS 120 HA HIS 120 -0.665 15.158 6.473 889 HD1 HIS 120 HD1 HIS 120 -2.241 11.427 7.327 890 HD2 HIS 120 HD2 HIS 120 -2.033 12.076 3.217 891 HE1 HIS 120 HE1 HIS 120 -2.294 9.151 6.280 892 HE2 HIS 120 HE2 HIS 120 -2.419 9.585 3.788 893 HB2 HIS 120 HB2 HIS 120 -2.500 13.836 6.726 894 HB3 HIS 120 HB1 HIS 120 -2.737 14.246 5.037 895 H GLU 121 HN GLU 121 0.622 14.041 7.847 896 HA GLU 121 HA GLU 121 2.692 12.427 6.675 897 HB2 GLU 121 HB2 GLU 121 3.659 12.327 8.898 898 HB3 GLU 121 HB1 GLU 121 3.221 13.979 8.496 899 HG2 GLU 121 HG2 GLU 121 1.704 14.110 10.148 900 HG3 GLU 121 HG1 GLU 121 1.169 12.442 9.931 901 H LEU 122 HN LEU 122 3.313 10.319 7.618 902 HA LEU 122 HA LEU 122 1.135 8.527 7.426 903 HG LEU 122 HG LEU 122 4.008 6.744 6.016 904 HB2 LEU 122 HB2 LEU 122 4.023 8.110 8.107 905 HB3 LEU 122 HB1 LEU 122 2.864 6.789 8.098 906 HD11 LEU 122 HD11 LEU 122 1.337 8.068 5.565 907 HD12 LEU 122 HD12 LEU 122 1.566 6.368 5.969 908 HD13 LEU 122 HD13 LEU 122 2.190 7.004 4.447 909 HD21 LEU 122 HD21 LEU 122 4.864 9.030 6.050 910 HD22 LEU 122 HD22 LEU 122 3.251 9.629 5.672 911 HD23 LEU 122 HD23 LEU 122 4.118 8.633 4.504 912 HA PRO 123 HA PRO 123 -0.285 8.249 11.491 913 HB2 PRO 123 HB2 PRO 123 -1.608 5.939 11.340 914 HB3 PRO 123 HB1 PRO 123 -2.075 7.306 10.316 915 HG2 PRO 123 HG2 PRO 123 -0.272 4.988 9.627 916 HG3 PRO 123 HG1 PRO 123 -1.705 5.555 8.748 917 HD2 PRO 123 HD2 PRO 123 0.771 6.285 8.041 918 HD3 PRO 123 HD1 PRO 123 -0.578 7.428 7.935 919 H ALA 124 HN ALA 124 2.202 6.263 10.448 920 HA ALA 124 HA ALA 124 3.574 4.692 11.356 921 HB1 ALA 124 HB1 ALA 124 3.833 6.296 13.195 922 HB2 ALA 124 HB2 ALA 124 3.882 4.629 13.773 923 HB3 ALA 124 HB3 ALA 124 2.425 5.596 13.996 924 H ASP 125 HN ASP 125 0.668 4.281 10.735 925 HA ASP 125 HA ASP 125 0.297 1.693 12.084 926 HB2 ASP 125 HB2 ASP 125 -1.458 3.392 12.659 927 HB3 ASP 125 HB1 ASP 125 -1.852 3.492 10.943 928 H LEU 126 HN LEU 126 -0.364 -0.002 10.759 929 HA LEU 126 HA LEU 126 0.055 0.479 7.889 930 HG LEU 126 HG LEU 126 2.399 -0.619 7.294 931 HB2 LEU 126 HB2 LEU 126 1.644 -1.026 9.485 932 HB3 LEU 126 HB1 LEU 126 0.498 -2.246 8.957 933 HD11 LEU 126 HD11 LEU 126 1.962 -3.585 7.583 934 HD12 LEU 126 HD12 LEU 126 3.257 -2.647 8.324 935 HD13 LEU 126 HD13 LEU 126 3.179 -2.805 6.570 936 HD21 LEU 126 HD21 LEU 126 1.393 -1.555 5.300 937 HD22 LEU 126 HD22 LEU 126 0.220 -0.584 6.193 938 HD23 LEU 126 HD23 LEU 126 0.151 -2.346 6.275 939 HA PRO 127 HA PRO 127 -4.140 -1.151 7.977 940 HB2 PRO 127 HB2 PRO 127 -4.760 0.321 5.648 941 HB3 PRO 127 HB1 PRO 127 -5.102 0.789 7.316 942 HG2 PRO 127 HG2 PRO 127 -3.332 2.062 5.566 943 HG3 PRO 127 HG1 PRO 127 -3.406 2.296 7.326 944 HD2 PRO 127 HD2 PRO 127 -1.559 0.603 5.700 945 HD3 PRO 127 HD1 PRO 127 -1.235 1.516 7.189 946 HA PRO 128 HA PRO 128 -3.713 -4.523 5.173 947 HB2 PRO 128 HB2 PRO 128 -6.433 -4.795 4.530 948 HB3 PRO 128 HB1 PRO 128 -5.562 -5.616 5.835 949 HG2 PRO 128 HG2 PRO 128 -7.332 -3.243 5.932 950 HG3 PRO 128 HG1 PRO 128 -7.016 -4.470 7.167 951 HD2 PRO 128 HD2 PRO 128 -6.009 -1.958 7.290 952 HD3 PRO 128 HD1 PRO 128 -5.171 -3.363 7.975 953 H HIS 129 HN HIS 129 -5.628 -1.719 4.146 954 HA HIS 129 HA HIS 129 -5.469 -2.473 1.359 955 HD1 HIS 129 HD1 HIS 129 -7.092 -0.007 4.571 956 HD2 HIS 129 HD2 HIS 129 -5.582 2.138 1.340 957 HE1 HIS 129 HE1 HIS 129 -6.642 2.311 5.435 958 HE2 HIS 129 HE2 HIS 129 -6.077 3.655 3.381 959 HB2 HIS 129 HB2 HIS 129 -6.563 -0.370 0.849 960 HB3 HIS 129 HB1 HIS 129 -7.402 -1.139 2.173 961 H LEU 130 HN LEU 130 -2.964 -1.968 3.028 962 HA LEU 130 HA LEU 130 -1.649 -0.484 0.899 963 HG LEU 130 HG LEU 130 0.048 1.161 1.310 964 HB2 LEU 130 HB2 LEU 130 -2.350 0.941 3.016 965 HB3 LEU 130 HB1 LEU 130 -0.861 0.262 3.646 966 HD11 LEU 130 HD11 LEU 130 -2.165 3.059 2.053 967 HD12 LEU 130 HD12 LEU 130 -2.090 2.063 0.598 968 HD13 LEU 130 HD13 LEU 130 -0.909 3.346 0.850 969 HD21 LEU 130 HD21 LEU 130 0.784 3.163 2.514 970 HD22 LEU 130 HD22 LEU 130 1.022 1.668 3.421 971 HD23 LEU 130 HD23 LEU 130 -0.320 2.743 3.828 972 H VAL 131 HN VAL 131 -1.733 -3.224 2.589 973 HA VAL 131 HA VAL 131 1.136 -3.341 3.084 974 HB VAL 131 HB VAL 131 -0.752 -4.360 4.633 975 HG11 VAL 131 HG11 VAL 131 -1.724 -5.830 2.971 976 HG12 VAL 131 HG12 VAL 131 -1.042 -6.752 4.313 977 HG13 VAL 131 HG13 VAL 131 -0.171 -6.653 2.780 978 HG21 VAL 131 HG21 VAL 131 1.869 -5.732 4.071 979 HG22 VAL 131 HG22 VAL 131 0.904 -5.930 5.533 980 HG23 VAL 131 HG23 VAL 131 1.609 -4.361 5.147 981 HA PRO 132 HA PRO 132 1.944 -4.810 -0.964 982 HB2 PRO 132 HB2 PRO 132 4.164 -6.352 0.230 983 HB3 PRO 132 HB1 PRO 132 4.209 -5.119 -1.031 984 HG2 PRO 132 HG2 PRO 132 5.059 -4.648 1.477 985 HG3 PRO 132 HG1 PRO 132 4.300 -3.393 0.484 986 HD2 PRO 132 HD2 PRO 132 3.205 -4.934 2.772 987 HD3 PRO 132 HD1 PRO 132 2.860 -3.266 2.246 988 HA PRO 133 HA PRO 133 -0.229 -8.574 -1.531 989 HB2 PRO 133 HB2 PRO 133 1.845 -8.974 -3.647 990 HB3 PRO 133 HB1 PRO 133 0.087 -9.174 -3.732 991 HG2 PRO 133 HG2 PRO 133 1.213 -6.982 -4.710 992 HG3 PRO 133 HG1 PRO 133 -0.309 -6.885 -3.786 993 HD2 PRO 133 HD2 PRO 133 2.459 -6.127 -2.968 994 HD3 PRO 133 HD1 PRO 133 0.892 -5.412 -2.502 995 H SER 134 HN SER 134 3.265 -8.751 -1.052 996 HA SER 134 HA SER 134 3.201 -11.626 -0.815 997 HG SER 134 HG SER 134 5.254 -8.662 -1.027 998 HB2 SER 134 HB2 SER 134 5.604 -11.284 -0.027 999 HB3 SER 134 HB1 SER 134 5.228 -10.757 -1.668 1000 H LYS 135 HN LYS 135 2.736 -8.971 1.368 1001 HA LYS 135 HA LYS 135 3.045 -10.830 3.632 1002 HB2 LYS 135 HB2 LYS 135 3.499 -8.712 5.013 1003 HB3 LYS 135 HB1 LYS 135 4.775 -9.308 3.966 1004 HG2 LYS 135 HG2 LYS 135 2.908 -7.211 2.960 1005 HG3 LYS 135 HG1 LYS 135 4.228 -6.773 4.047 1006 HD2 LYS 135 HD2 LYS 135 4.625 -8.365 1.523 1007 HD3 LYS 135 HD1 LYS 135 4.730 -6.605 1.582 1008 HE2 LYS 135 HE2 LYS 135 6.516 -6.732 3.183 1009 HE3 LYS 135 HE1 LYS 135 6.385 -8.486 3.251 1010 HZ1 LYS 135 HZ1 LYS 135 8.221 -7.742 1.830 1011 HZ2 LYS 135 HZ2 LYS 135 7.122 -6.936 0.818 1012 HZ3 LYS 135 HZ3 LYS 135 7.066 -8.621 0.956 1013 H ARG 136 HN ARG 136 0.676 -9.808 1.942 1014 HA ARG 136 HA ARG 136 -1.089 -8.705 3.915 1015 HE ARG 136 HE ARG 136 -3.897 -11.289 0.004 1016 HB2 ARG 136 HB2 ARG 136 -2.784 -9.886 2.137 1017 HB3 ARG 136 HB1 ARG 136 -2.100 -8.280 1.931 1018 HG2 ARG 136 HG2 ARG 136 -0.557 -8.984 0.382 1019 HG3 ARG 136 HG1 ARG 136 -0.627 -10.660 0.912 1020 HD2 ARG 136 HD2 ARG 136 -2.935 -9.274 -0.427 1021 HD3 ARG 136 HD1 ARG 136 -1.687 -10.141 -1.318 1022 HH11 ARG 136 HH11 ARG 136 -0.463 -11.841 -0.552 1023 HH12 ARG 136 HH12 ARG 136 -0.584 -13.567 -0.360 1024 HH21 ARG 136 HH21 ARG 136 -4.042 -13.571 0.216 1025 HH22 ARG 136 HH22 ARG 136 -2.618 -14.543 0.027 1026 H ARG 137 HN ARG 137 -0.364 -10.259 5.586 1027 HA ARG 137 HA ARG 137 -2.259 -12.410 5.822 1028 HE ARG 137 HE ARG 137 1.702 -15.409 6.373 1029 HB2 ARG 137 HB2 ARG 137 -0.458 -14.129 6.257 1030 HB3 ARG 137 HB1 ARG 137 -0.649 -13.638 4.581 1031 HG2 ARG 137 HG2 ARG 137 1.268 -12.039 4.961 1032 HG3 ARG 137 HG1 ARG 137 1.529 -12.861 6.494 1033 HD2 ARG 137 HD2 ARG 137 1.638 -14.075 3.752 1034 HD3 ARG 137 HD1 ARG 137 2.992 -13.796 4.839 1035 HH11 ARG 137 HH11 ARG 137 1.892 -15.613 2.876 1036 HH12 ARG 137 HH12 ARG 137 1.533 -17.315 2.832 1037 HH21 ARG 137 HH21 ARG 137 1.222 -17.635 6.321 1038 HH22 ARG 137 HH22 ARG 137 1.171 -18.468 4.785 1039 H HIS 138 HN HIS 138 -3.014 -12.055 7.791 1040 HA HIS 138 HA HIS 138 -1.228 -11.171 9.919 1041 HD1 HIS 138 HD1 HIS 138 -5.320 -9.014 10.054 1042 HD2 HIS 138 HD2 HIS 138 -1.161 -8.983 9.834 1043 HE1 HIS 138 HE1 HIS 138 -4.664 -6.615 9.731 1044 HE2 HIS 138 HE2 HIS 138 -2.152 -6.585 9.777 1045 HB2 HIS 138 HB2 HIS 138 -4.215 -11.365 9.685 1046 HB3 HIS 138 HB1 HIS 138 -3.440 -11.185 11.254 1047 H GLU 139 HN GLU 139 -0.180 -12.698 10.983 1048 HA GLU 139 HA GLU 139 -1.565 -15.221 11.558 1049 HB2 GLU 139 HB2 GLU 139 1.293 -14.934 10.604 1050 HB3 GLU 139 HB1 GLU 139 0.549 -16.437 11.136 1051 HG2 GLU 139 HG2 GLU 139 -0.984 -16.399 9.297 1052 HG3 GLU 139 HG1 GLU 139 -0.430 -14.798 8.808 Start of MODEL 9 1 H1 GLY 1 HT1 GLY 1 47.806 5.852 -10.043 2 H2 GLY 1 HT2 GLY 1 48.847 6.559 -8.911 3 H3 GLY 1 HT3 GLY 1 48.676 7.248 -10.450 4 HA2 GLY 1 HA1 GLY 1 46.577 7.084 -8.362 5 HA3 GLY 1 HA2 GLY 1 47.466 8.531 -8.814 6 HA PRO 2 HA PRO 2 43.852 9.345 -11.259 7 HB2 PRO 2 HB2 PRO 2 45.549 11.443 -12.451 8 HB3 PRO 2 HB1 PRO 2 44.008 11.592 -11.608 9 HG2 PRO 2 HG2 PRO 2 46.293 12.381 -10.462 10 HG3 PRO 2 HG1 PRO 2 45.007 11.609 -9.512 11 HD2 PRO 2 HD2 PRO 2 47.554 10.445 -10.561 12 HD3 PRO 2 HD1 PRO 2 46.771 10.204 -8.986 13 H LEU 3 HN LEU 3 46.921 9.842 -13.024 14 HA LEU 3 HA LEU 3 45.646 8.890 -15.450 15 HG LEU 3 HG LEU 3 49.309 8.954 -14.826 16 HB2 LEU 3 HB2 LEU 3 47.603 9.635 -16.618 17 HB3 LEU 3 HB1 LEU 3 47.102 10.892 -15.507 18 HD11 LEU 3 HD11 LEU 3 49.563 11.646 -16.159 19 HD12 LEU 3 HD12 LEU 3 49.913 10.086 -16.903 20 HD13 LEU 3 HD13 LEU 3 50.892 10.662 -15.553 21 HD21 LEU 3 HD21 LEU 3 49.999 10.755 -13.305 22 HD22 LEU 3 HD22 LEU 3 48.371 10.179 -12.948 23 HD23 LEU 3 HD23 LEU 3 48.598 11.703 -13.806 24 H GLY 4 HN GLY 4 46.285 7.092 -16.634 25 HA2 GLY 4 HA2 GLY 4 47.909 5.323 -17.026 26 HA3 GLY 4 HA1 GLY 4 48.178 5.264 -15.288 27 H SER 5 HN SER 5 45.081 5.640 -15.164 28 HA SER 5 HA SER 5 44.555 2.809 -14.973 29 HG SER 5 HG SER 5 44.691 3.870 -12.894 30 HB2 SER 5 HB2 SER 5 42.715 5.149 -14.424 31 HB3 SER 5 HB1 SER 5 42.464 3.477 -13.928 32 H GLU 6 HN GLU 6 44.288 1.873 -16.911 33 HA GLU 6 HA GLU 6 42.981 2.996 -19.138 34 HB2 GLU 6 HB2 GLU 6 43.347 0.073 -18.452 35 HB3 GLU 6 HB1 GLU 6 43.002 0.723 -20.047 36 HG2 GLU 6 HG2 GLU 6 45.489 1.329 -18.467 37 HG3 GLU 6 HG1 GLU 6 45.369 0.072 -19.694 38 H SER 7 HN SER 7 40.854 2.964 -19.783 39 HA SER 7 HA SER 7 38.959 2.304 -17.676 40 HG SER 7 HG SER 7 36.641 4.501 -19.136 41 HB2 SER 7 HB2 SER 7 38.901 4.508 -18.873 42 HB3 SER 7 HB1 SER 7 38.426 3.647 -20.336 43 H LEU 8 HN LEU 8 38.125 0.350 -17.619 44 HA LEU 8 HA LEU 8 37.248 -0.888 -20.138 45 HG LEU 8 HG LEU 8 40.190 -1.362 -19.365 46 HB2 LEU 8 HB2 LEU 8 38.536 -2.273 -17.780 47 HB3 LEU 8 HB1 LEU 8 37.741 -3.107 -19.101 48 HD11 LEU 8 HD11 LEU 8 40.649 -3.430 -18.156 49 HD12 LEU 8 HD12 LEU 8 41.379 -3.458 -19.761 50 HD13 LEU 8 HD13 LEU 8 39.898 -4.365 -19.450 51 HD21 LEU 8 HD21 LEU 8 40.304 -2.263 -21.646 52 HD22 LEU 8 HD22 LEU 8 38.827 -1.337 -21.378 53 HD23 LEU 8 HD23 LEU 8 38.771 -3.099 -21.384 54 H MET 9 HN MET 9 35.218 -1.797 -20.090 55 HA MET 9 HA MET 9 33.595 -1.154 -17.775 56 HB2 MET 9 HB2 MET 9 32.914 -2.296 -20.480 57 HB3 MET 9 HB1 MET 9 31.722 -2.060 -19.209 58 HG2 MET 9 HG2 MET 9 32.241 0.333 -19.179 59 HG3 MET 9 HG1 MET 9 33.405 0.090 -20.477 60 HE1 MET 9 HE1 MET 9 30.994 2.215 -20.513 61 HE2 MET 9 HE2 MET 9 30.439 2.041 -22.176 62 HE3 MET 9 HE3 MET 9 32.166 2.046 -21.818 63 HA PRO 10 HA PRO 10 34.213 -4.844 -15.592 64 HB2 PRO 10 HB2 PRO 10 31.334 -4.589 -14.858 65 HB3 PRO 10 HB1 PRO 10 32.752 -4.778 -13.818 66 HG2 PRO 10 HG2 PRO 10 31.575 -2.405 -14.064 67 HG3 PRO 10 HG1 PRO 10 33.340 -2.537 -13.997 68 HD2 PRO 10 HD2 PRO 10 31.569 -2.038 -16.344 69 HD3 PRO 10 HD1 PRO 10 33.174 -1.378 -15.979 70 H SER 11 HN SER 11 30.783 -5.108 -16.494 71 HA SER 11 HA SER 11 31.318 -7.802 -17.456 72 HG SER 11 HG SER 11 28.385 -5.557 -17.252 73 HB2 SER 11 HB2 SER 11 28.704 -7.759 -17.606 74 HB3 SER 11 HB1 SER 11 29.487 -7.880 -16.031 75 H GLN 12 HN GLN 12 32.313 -7.380 -19.396 76 HA GLN 12 HA GLN 12 30.697 -6.039 -21.448 77 HB2 GLN 12 HB2 GLN 12 32.960 -5.151 -21.211 78 HB3 GLN 12 HB1 GLN 12 33.636 -6.758 -21.434 79 HG2 GLN 12 HG2 GLN 12 33.833 -5.381 -23.443 80 HG3 GLN 12 HG1 GLN 12 32.842 -6.812 -23.716 81 HE21 GLN 12 HE21 GLN 12 31.812 -5.899 -25.489 82 HE22 GLN 12 HE22 GLN 12 30.633 -4.640 -25.315 83 H VAL 13 HN VAL 13 29.298 -7.638 -22.001 84 HA VAL 13 HA VAL 13 30.488 -10.057 -23.183 85 HB VAL 13 HB VAL 13 29.213 -10.648 -21.181 86 HG11 VAL 13 HG11 VAL 13 26.882 -9.306 -22.538 87 HG12 VAL 13 HG12 VAL 13 27.687 -8.785 -21.058 88 HG13 VAL 13 HG13 VAL 13 26.781 -10.296 -21.082 89 HG21 VAL 13 HG21 VAL 13 27.815 -11.437 -23.729 90 HG22 VAL 13 HG22 VAL 13 27.671 -12.270 -22.181 91 HG23 VAL 13 HG23 VAL 13 29.223 -12.221 -23.016 92 H VAL 14 HN VAL 14 29.869 -10.554 -25.256 93 HA VAL 14 HA VAL 14 27.971 -8.679 -26.487 94 HB VAL 14 HB VAL 14 30.158 -8.109 -27.260 95 HG11 VAL 14 HG11 VAL 14 31.335 -10.172 -26.753 96 HG12 VAL 14 HG12 VAL 14 31.628 -9.684 -28.422 97 HG13 VAL 14 HG13 VAL 14 30.498 -10.992 -28.072 98 HG21 VAL 14 HG21 VAL 14 28.415 -7.981 -28.922 99 HG22 VAL 14 HG22 VAL 14 28.663 -9.671 -29.356 100 HG23 VAL 14 HG23 VAL 14 29.925 -8.482 -29.685 101 H LYS 15 HN LYS 15 26.162 -9.688 -26.933 102 HA LYS 15 HA LYS 15 26.244 -12.438 -27.957 103 HB2 LYS 15 HB2 LYS 15 23.846 -10.794 -27.106 104 HB3 LYS 15 HB1 LYS 15 23.844 -12.499 -27.524 105 HG2 LYS 15 HG2 LYS 15 25.170 -13.030 -25.588 106 HG3 LYS 15 HG1 LYS 15 25.339 -11.320 -25.193 107 HD2 LYS 15 HD2 LYS 15 22.865 -11.197 -24.937 108 HD3 LYS 15 HD1 LYS 15 22.793 -12.942 -25.185 109 HE2 LYS 15 HE2 LYS 15 24.317 -11.556 -22.979 110 HE3 LYS 15 HE1 LYS 15 22.735 -12.317 -22.797 111 HZ1 LYS 15 HZ1 LYS 15 25.150 -13.778 -23.709 112 HZ2 LYS 15 HZ2 LYS 15 23.668 -14.442 -23.226 113 HZ3 LYS 15 HZ3 LYS 15 24.679 -13.692 -22.084 114 H GLY 16 HN GLY 16 27.139 -11.679 -29.978 115 HA2 GLY 16 HA2 GLY 16 25.780 -9.671 -31.501 116 HA3 GLY 16 HA1 GLY 16 27.126 -10.658 -32.042 117 H GLY 17 HN GLY 17 23.781 -10.123 -32.191 118 HA2 GLY 17 HA2 GLY 17 22.171 -10.980 -33.574 119 HA3 GLY 17 HA1 GLY 17 23.464 -11.768 -34.462 120 H ALA 18 HN ALA 18 22.979 -12.384 -31.082 121 HA ALA 18 HA ALA 18 21.799 -14.996 -31.746 122 HB1 ALA 18 HB1 ALA 18 24.188 -15.258 -31.224 123 HB2 ALA 18 HB2 ALA 18 23.160 -16.044 -30.028 124 HB3 ALA 18 HB3 ALA 18 23.917 -14.497 -29.655 125 H PHE 19 HN PHE 19 19.943 -15.351 -30.746 126 HA PHE 19 HA PHE 19 19.045 -13.522 -28.698 127 HD1 PHE 19 HD2 PHE 19 16.596 -12.477 -28.842 128 HD2 PHE 19 HD1 PHE 19 16.164 -16.683 -28.331 129 HE1 PHE 19 HE2 PHE 19 14.730 -12.091 -27.288 130 HE2 PHE 19 HE1 PHE 19 14.290 -16.301 -26.777 131 HZ PHE 19 HZ PHE 19 13.575 -13.970 -26.260 132 HB2 PHE 19 HB2 PHE 19 17.508 -14.218 -30.503 133 HB3 PHE 19 HB1 PHE 19 17.618 -15.883 -29.944 134 H ASP 20 HN ASP 20 19.852 -13.878 -26.740 135 HA ASP 20 HA ASP 20 20.120 -16.590 -25.702 136 HB2 ASP 20 HB2 ASP 20 21.825 -14.701 -25.341 137 HB3 ASP 20 HB1 ASP 20 20.659 -14.016 -24.216 138 H GLY 21 HN GLY 21 18.049 -17.328 -25.365 139 HA2 GLY 21 HA2 GLY 21 16.221 -15.574 -23.858 140 HA3 GLY 21 HA1 GLY 21 15.717 -16.850 -24.959 141 H THR 22 HN THR 22 15.685 -16.086 -21.871 142 HA THR 22 HA THR 22 15.484 -18.879 -21.099 143 HB THR 22 HB THR 22 17.157 -16.925 -19.508 144 HG1 THR 22 HG1 THR 22 17.763 -18.581 -21.568 145 HG21 THR 22 HG21 THR 22 16.539 -19.853 -19.072 146 HG22 THR 22 HG22 THR 22 15.978 -18.506 -18.080 147 HG23 THR 22 HG23 THR 22 17.695 -18.910 -18.135 148 H MET 23 HN MET 23 13.372 -18.858 -20.628 149 HA MET 23 HA MET 23 12.523 -17.379 -18.304 150 HB2 MET 23 HB2 MET 23 10.504 -16.436 -19.411 151 HB3 MET 23 HB1 MET 23 12.010 -15.716 -19.956 152 HG2 MET 23 HG2 MET 23 11.929 -17.086 -21.978 153 HG3 MET 23 HG1 MET 23 10.412 -17.794 -21.433 154 HE1 MET 23 HE1 MET 23 8.094 -14.605 -21.370 155 HE2 MET 23 HE2 MET 23 9.061 -15.275 -20.059 156 HE3 MET 23 HE3 MET 23 8.146 -16.349 -21.117 157 H ASN 24 HN ASN 24 11.546 -18.809 -17.086 158 HA ASN 24 HA ASN 24 10.028 -20.976 -18.372 159 HB2 ASN 24 HB2 ASN 24 11.333 -20.883 -15.643 160 HB3 ASN 24 HB1 ASN 24 10.324 -22.205 -16.215 161 HD21 ASN 24 HD21 ASN 24 11.424 -21.928 -18.958 162 HD22 ASN 24 HD22 ASN 24 12.995 -22.652 -18.891 163 H GLY 25 HN GLY 25 7.902 -21.192 -17.939 164 HA2 GLY 25 HA2 GLY 25 6.040 -20.934 -16.407 165 HA3 GLY 25 HA1 GLY 25 6.760 -19.428 -15.880 166 HA PRO 26 HA PRO 26 4.894 -17.519 -19.657 167 HB2 PRO 26 HB2 PRO 26 5.401 -19.107 -22.054 168 HB3 PRO 26 HB1 PRO 26 5.933 -17.468 -21.675 169 HG2 PRO 26 HG2 PRO 26 7.641 -19.559 -21.813 170 HG3 PRO 26 HG1 PRO 26 7.900 -18.183 -20.723 171 HD2 PRO 26 HD2 PRO 26 6.778 -20.896 -20.122 172 HD3 PRO 26 HD1 PRO 26 7.948 -19.935 -19.195 173 H PHE 27 HN PHE 27 4.714 -20.878 -20.836 174 HA PHE 27 HA PHE 27 1.801 -20.777 -20.439 175 HD1 PHE 27 HD2 PHE 27 0.134 -20.131 -22.616 176 HD2 PHE 27 HD1 PHE 27 4.205 -20.232 -23.864 177 HE1 PHE 27 HE2 PHE 27 -0.223 -18.083 -23.934 178 HE2 PHE 27 HE1 PHE 27 3.852 -18.184 -25.180 179 HZ PHE 27 HZ PHE 27 1.632 -17.122 -25.241 180 HB2 PHE 27 HB2 PHE 27 3.264 -22.080 -22.751 181 HB3 PHE 27 HB1 PHE 27 1.535 -22.189 -22.452 182 H GLY 28 HN GLY 28 0.894 -22.612 -19.575 183 HA2 GLY 28 HA2 GLY 28 2.806 -24.673 -18.704 184 HA3 GLY 28 HA1 GLY 28 1.325 -24.257 -17.853 185 H HIS 29 HN HIS 29 1.794 -26.877 -18.403 186 HA HIS 29 HA HIS 29 0.431 -27.603 -20.842 187 HD1 HIS 29 HD1 HIS 29 3.777 -29.841 -18.655 188 HD2 HIS 29 HD2 HIS 29 2.236 -28.647 -22.333 189 HE1 HIS 29 HE1 HIS 29 5.726 -29.836 -20.243 190 HE2 HIS 29 HE2 HIS 29 4.740 -29.299 -22.498 191 HB2 HIS 29 HB2 HIS 29 1.377 -29.265 -18.501 192 HB3 HIS 29 HB1 HIS 29 0.590 -29.939 -19.924 193 H GLY 30 HN GLY 30 -1.502 -29.089 -20.719 194 HA2 GLY 30 HA2 GLY 30 -3.640 -27.674 -19.611 195 HA3 GLY 30 HA1 GLY 30 -3.731 -29.311 -20.240 196 H TYR 31 HN TYR 31 -3.542 -27.333 -17.425 197 HA TYR 31 HA TYR 31 -3.707 -29.703 -15.709 198 HD1 TYR 31 HD1 TYR 31 -1.843 -26.197 -16.592 199 HD2 TYR 31 HD2 TYR 31 -4.559 -26.151 -13.318 200 HE1 TYR 31 HE1 TYR 31 -2.057 -23.756 -16.810 201 HE2 TYR 31 HE2 TYR 31 -4.773 -23.715 -13.524 202 HH TYR 31 HH TYR 31 -3.896 -22.011 -16.188 203 HB2 TYR 31 HB2 TYR 31 -3.372 -28.126 -13.825 204 HB3 TYR 31 HB1 TYR 31 -2.034 -28.122 -14.964 205 H GLY 32 HN GLY 32 -5.246 -29.297 -13.736 206 HA2 GLY 32 HA2 GLY 32 -7.846 -29.413 -14.804 207 HA3 GLY 32 HA1 GLY 32 -7.447 -29.297 -13.098 208 H GLU 33 HN GLU 33 -9.462 -27.998 -15.034 209 HA GLU 33 HA GLU 33 -8.984 -25.236 -15.120 210 HB2 GLU 33 HB2 GLU 33 -11.519 -25.093 -15.306 211 HB3 GLU 33 HB1 GLU 33 -10.693 -26.066 -16.516 212 HG2 GLU 33 HG2 GLU 33 -11.267 -28.090 -15.223 213 HG3 GLU 33 HG1 GLU 33 -12.177 -27.081 -14.098 214 H GLY 34 HN GLY 34 -9.256 -23.620 -13.677 215 HA2 GLY 34 HA2 GLY 34 -9.796 -24.511 -10.926 216 HA3 GLY 34 HA1 GLY 34 -8.739 -23.179 -11.364 217 H ALA 35 HN ALA 35 -11.307 -23.620 -9.705 218 HA ALA 35 HA ALA 35 -12.986 -21.529 -10.872 219 HB1 ALA 35 HB1 ALA 35 -14.558 -22.082 -9.086 220 HB2 ALA 35 HB2 ALA 35 -13.386 -23.203 -8.396 221 HB3 ALA 35 HB3 ALA 35 -14.085 -23.527 -9.981 222 H GLY 36 HN GLY 36 -13.689 -19.739 -9.451 223 HA2 GLY 36 HA2 GLY 36 -11.445 -18.482 -8.195 224 HA3 GLY 36 HA1 GLY 36 -13.073 -17.833 -8.305 225 H GLU 37 HN GLU 37 -10.761 -19.327 -6.320 226 HA GLU 37 HA GLU 37 -12.676 -19.936 -4.198 227 HB2 GLU 37 HB2 GLU 37 -10.368 -21.173 -5.002 228 HB3 GLU 37 HB1 GLU 37 -9.784 -20.188 -3.671 229 HG2 GLU 37 HG2 GLU 37 -12.197 -21.895 -3.289 230 HG3 GLU 37 HG1 GLU 37 -10.593 -22.625 -3.263 231 H GLY 38 HN GLY 38 -11.536 -19.221 -1.901 232 HA2 GLY 38 HA2 GLY 38 -11.696 -16.346 -1.992 233 HA3 GLY 38 HA1 GLY 38 -11.472 -17.321 -0.550 234 H ILE 39 HN ILE 39 -9.803 -16.366 -3.473 235 HA ILE 39 HA ILE 39 -7.186 -16.489 -2.460 236 HB ILE 39 HB ILE 39 -6.666 -14.862 -4.307 237 HG12 ILE 39 HG12 ILE 39 -9.657 -15.077 -4.708 238 HG13 ILE 39 HG11 ILE 39 -8.715 -13.618 -4.435 239 HG21 ILE 39 HG21 ILE 39 -6.557 -17.279 -4.624 240 HG22 ILE 39 HG22 ILE 39 -7.089 -16.466 -6.094 241 HG23 ILE 39 HG23 ILE 39 -8.261 -17.304 -5.077 242 HD11 ILE 39 HD11 ILE 39 -9.385 -13.755 -6.733 243 HD12 ILE 39 HD12 ILE 39 -8.653 -15.350 -6.886 244 HD13 ILE 39 HD13 ILE 39 -7.635 -13.933 -6.617 245 H ASP 40 HN ASP 40 -5.816 -14.640 -1.880 246 HA ASP 40 HA ASP 40 -7.159 -13.026 0.049 247 HB2 ASP 40 HB2 ASP 40 -4.855 -12.012 0.372 248 HB3 ASP 40 HB1 ASP 40 -4.972 -13.746 0.642 249 H ASP 41 HN ASP 41 -8.642 -12.010 -1.306 250 HA ASP 41 HA ASP 41 -8.047 -10.274 -3.415 251 HB2 ASP 41 HB2 ASP 41 -10.333 -11.120 -2.630 252 HB3 ASP 41 HB1 ASP 41 -10.283 -9.830 -1.434 253 H VAL 42 HN VAL 42 -6.480 -8.781 -3.193 254 HA VAL 42 HA VAL 42 -6.706 -6.934 -0.930 255 HB VAL 42 HB VAL 42 -4.616 -8.082 -0.788 256 HG11 VAL 42 HG11 VAL 42 -4.409 -8.873 -3.073 257 HG12 VAL 42 HG12 VAL 42 -2.934 -8.046 -2.569 258 HG13 VAL 42 HG13 VAL 42 -4.083 -7.230 -3.629 259 HG21 VAL 42 HG21 VAL 42 -4.158 -5.316 -1.899 260 HG22 VAL 42 HG22 VAL 42 -3.029 -6.226 -0.894 261 HG23 VAL 42 HG23 VAL 42 -4.579 -5.708 -0.232 262 H GLU 43 HN GLU 43 -7.900 -5.294 -1.650 263 HA GLU 43 HA GLU 43 -7.344 -4.123 -4.260 264 HB2 GLU 43 HB2 GLU 43 -9.698 -4.465 -3.594 265 HB3 GLU 43 HB1 GLU 43 -9.458 -3.389 -2.224 266 HG2 GLU 43 HG2 GLU 43 -9.124 -1.514 -3.665 267 HG3 GLU 43 HG1 GLU 43 -9.079 -2.553 -5.088 268 H TRP 44 HN TRP 44 -5.398 -3.148 -4.026 269 HA TRP 44 HA TRP 44 -5.290 -0.908 -2.128 270 HD1 TRP 44 HD1 TRP 44 -3.499 0.804 -1.850 271 HE1 TRP 44 HE1 TRP 44 -1.242 1.741 -1.037 272 HE3 TRP 44 HE3 TRP 44 -0.937 -3.539 -1.449 273 HZ2 TRP 44 HZ2 TRP 44 1.311 0.717 -0.315 274 HZ3 TRP 44 HZ3 TRP 44 1.395 -3.500 -0.730 275 HH2 TRP 44 HH2 TRP 44 2.494 -1.418 -0.149 276 HB2 TRP 44 HB2 TRP 44 -3.812 -2.692 -1.359 277 HB3 TRP 44 HB1 TRP 44 -3.038 -2.755 -2.937 278 H VAL 45 HN VAL 45 -4.547 0.964 -2.866 279 HA VAL 45 HA VAL 45 -4.768 1.614 -5.570 280 HB VAL 45 HB VAL 45 -3.303 3.228 -3.480 281 HG11 VAL 45 HG11 VAL 45 -4.126 5.155 -4.740 282 HG12 VAL 45 HG12 VAL 45 -4.918 4.076 -5.888 283 HG13 VAL 45 HG13 VAL 45 -3.158 4.093 -5.763 284 HG21 VAL 45 HG21 VAL 45 -6.278 2.986 -3.947 285 HG22 VAL 45 HG22 VAL 45 -5.519 4.245 -2.976 286 HG23 VAL 45 HG23 VAL 45 -5.391 2.559 -2.480 287 H VAL 46 HN VAL 46 -2.099 0.173 -3.970 288 HA VAL 46 HA VAL 46 -0.126 1.340 -5.722 289 HB VAL 46 HB VAL 46 -0.011 -0.584 -3.424 290 HG11 VAL 46 HG11 VAL 46 1.140 -1.836 -5.209 291 HG12 VAL 46 HG12 VAL 46 2.229 -1.313 -3.923 292 HG13 VAL 46 HG13 VAL 46 2.207 -0.455 -5.467 293 HG21 VAL 46 HG21 VAL 46 0.424 1.784 -3.115 294 HG22 VAL 46 HG22 VAL 46 1.675 1.746 -4.358 295 HG23 VAL 46 HG23 VAL 46 1.905 0.864 -2.848 296 H GLY 47 HN GLY 47 -2.334 -1.258 -5.937 297 HA2 GLY 47 HA2 GLY 47 -0.877 -2.915 -7.716 298 HA3 GLY 47 HA1 GLY 47 -2.635 -2.840 -7.586 299 H LYS 48 HN LYS 48 -2.294 0.177 -8.110 300 HA LYS 48 HA LYS 48 -2.096 -0.020 -11.025 301 HB2 LYS 48 HB2 LYS 48 -3.269 2.205 -10.927 302 HB3 LYS 48 HB1 LYS 48 -4.215 0.819 -10.418 303 HG2 LYS 48 HG2 LYS 48 -3.923 1.425 -8.112 304 HG3 LYS 48 HG1 LYS 48 -2.800 2.711 -8.557 305 HD2 LYS 48 HD2 LYS 48 -5.699 2.593 -9.374 306 HD3 LYS 48 HD1 LYS 48 -5.062 3.559 -8.039 307 HE2 LYS 48 HE2 LYS 48 -3.645 4.787 -9.600 308 HE3 LYS 48 HE1 LYS 48 -4.248 3.804 -10.935 309 HZ1 LYS 48 HZ1 LYS 48 -5.388 5.894 -10.899 310 HZ2 LYS 48 HZ2 LYS 48 -5.824 5.696 -9.272 311 HZ3 LYS 48 HZ3 LYS 48 -6.484 4.675 -10.456 312 H ASP 49 HN ASP 49 -0.755 1.568 -8.225 313 HA ASP 49 HA ASP 49 0.599 3.586 -9.822 314 HB2 ASP 49 HB2 ASP 49 0.616 3.030 -6.854 315 HB3 ASP 49 HB1 ASP 49 1.475 4.360 -7.617 316 H LYS 50 HN LYS 50 1.154 0.464 -8.865 317 HA LYS 50 HA LYS 50 3.700 0.269 -7.916 318 HB2 LYS 50 HB2 LYS 50 1.963 -1.574 -8.249 319 HB3 LYS 50 HB1 LYS 50 2.574 -1.692 -9.897 320 HG2 LYS 50 HG2 LYS 50 4.839 -2.098 -8.971 321 HG3 LYS 50 HG1 LYS 50 4.123 -2.140 -7.359 322 HD2 LYS 50 HD2 LYS 50 2.673 -3.993 -8.079 323 HD3 LYS 50 HD1 LYS 50 3.459 -3.973 -9.659 324 HE2 LYS 50 HE2 LYS 50 4.771 -4.536 -7.004 325 HE3 LYS 50 HE1 LYS 50 4.413 -5.708 -8.270 326 HZ1 LYS 50 HZ1 LYS 50 5.962 -4.592 -9.729 327 HZ2 LYS 50 HZ2 LYS 50 6.740 -5.015 -8.286 328 HZ3 LYS 50 HZ3 LYS 50 6.272 -3.409 -8.558 329 HA PRO 51 HA PRO 51 5.268 -0.244 -12.600 330 HB2 PRO 51 HB2 PRO 51 3.932 1.672 -14.162 331 HB3 PRO 51 HB1 PRO 51 3.764 -0.083 -14.263 332 HG2 PRO 51 HG2 PRO 51 2.056 1.911 -12.869 333 HG3 PRO 51 HG1 PRO 51 1.594 0.412 -13.696 334 HD2 PRO 51 HD2 PRO 51 1.649 0.554 -11.026 335 HD3 PRO 51 HD1 PRO 51 2.179 -0.917 -11.876 336 H THR 52 HN THR 52 4.074 2.828 -11.289 337 HA THR 52 HA THR 52 6.155 4.389 -12.471 338 HB THR 52 HB THR 52 4.298 5.008 -10.170 339 HG1 THR 52 HG1 THR 52 4.165 5.584 -12.964 340 HG21 THR 52 HG21 THR 52 4.812 7.351 -10.606 341 HG22 THR 52 HG22 THR 52 5.942 6.884 -11.876 342 HG23 THR 52 HG23 THR 52 6.283 6.469 -10.196 343 H TYR 53 HN TYR 53 5.601 2.884 -9.347 344 HA TYR 53 HA TYR 53 7.975 3.998 -8.157 345 HD1 TYR 53 HD2 TYR 53 6.448 5.318 -7.176 346 HD2 TYR 53 HD1 TYR 53 4.324 1.769 -6.214 347 HE1 TYR 53 HE2 TYR 53 4.486 6.667 -6.561 348 HE2 TYR 53 HE1 TYR 53 2.362 3.101 -5.606 349 HH TYR 53 HH TYR 53 1.962 6.287 -6.413 350 HB2 TYR 53 HB2 TYR 53 6.383 1.606 -7.267 351 HB3 TYR 53 HB1 TYR 53 7.408 2.620 -6.272 352 H ASP 54 HN ASP 54 7.068 1.264 -10.011 353 HA ASP 54 HA ASP 54 9.404 -0.342 -9.442 354 HB2 ASP 54 HB2 ASP 54 7.311 -1.423 -10.026 355 HB3 ASP 54 HB1 ASP 54 7.184 -0.492 -11.513 356 H GLU 55 HN GLU 55 8.418 1.965 -11.939 357 HA GLU 55 HA GLU 55 10.641 1.455 -13.652 358 HB2 GLU 55 HB2 GLU 55 10.039 3.485 -14.816 359 HB3 GLU 55 HB1 GLU 55 8.577 2.589 -14.433 360 HG2 GLU 55 HG2 GLU 55 8.172 4.078 -12.528 361 HG3 GLU 55 HG1 GLU 55 9.619 5.002 -12.972 362 H ILE 56 HN ILE 56 10.081 3.639 -10.928 363 HA ILE 56 HA ILE 56 12.666 4.851 -11.134 364 HB ILE 56 HB ILE 56 10.944 4.601 -8.654 365 HG12 ILE 56 HG12 ILE 56 10.994 6.861 -10.667 366 HG13 ILE 56 HG11 ILE 56 9.770 5.584 -10.663 367 HG21 ILE 56 HG21 ILE 56 12.116 6.656 -7.965 368 HG22 ILE 56 HG22 ILE 56 13.104 6.562 -9.422 369 HG23 ILE 56 HG23 ILE 56 13.225 5.304 -8.195 370 HD11 ILE 56 HD11 ILE 56 9.090 6.268 -8.418 371 HD12 ILE 56 HD12 ILE 56 8.939 7.580 -9.586 372 HD13 ILE 56 HD13 ILE 56 10.289 7.561 -8.453 373 H PHE 57 HN PHE 57 11.355 1.973 -9.725 374 HA PHE 57 HA PHE 57 13.427 1.200 -8.015 375 HD1 PHE 57 HD2 PHE 57 13.087 -0.808 -6.300 376 HD2 PHE 57 HD1 PHE 57 12.046 -2.511 -10.059 377 HE1 PHE 57 HE2 PHE 57 13.975 -2.976 -5.562 378 HE2 PHE 57 HE1 PHE 57 12.934 -4.684 -9.323 379 HZ PHE 57 HZ PHE 57 13.896 -4.918 -7.074 380 HB2 PHE 57 HB2 PHE 57 11.282 0.155 -7.899 381 HB3 PHE 57 HB1 PHE 57 11.376 -0.365 -9.574 382 H TYR 58 HN TYR 58 12.788 0.060 -11.356 383 HA TYR 58 HA TYR 58 15.247 -1.303 -11.617 384 HD1 TYR 58 HD2 TYR 58 11.657 -1.659 -12.226 385 HD2 TYR 58 HD1 TYR 58 15.012 -3.346 -14.228 386 HE1 TYR 58 HE2 TYR 58 10.652 -3.896 -12.017 387 HE2 TYR 58 HE1 TYR 58 14.013 -5.585 -14.026 388 HH TYR 58 HH TYR 58 10.761 -6.093 -13.001 389 HB2 TYR 58 HB2 TYR 58 13.244 -0.269 -13.611 390 HB3 TYR 58 HB1 TYR 58 14.763 -0.992 -14.147 391 H THR 59 HN THR 59 14.441 2.015 -11.829 392 HA THR 59 HA THR 59 16.614 2.877 -13.460 393 HB THR 59 HB THR 59 14.662 4.292 -11.651 394 HG1 THR 59 HG1 THR 59 13.666 3.833 -13.515 395 HG21 THR 59 HG21 THR 59 15.487 6.413 -12.529 396 HG22 THR 59 HG22 THR 59 16.803 5.569 -13.345 397 HG23 THR 59 HG23 THR 59 16.722 5.586 -11.583 398 H LEU 60 HN LEU 60 16.167 2.365 -10.010 399 HA LEU 60 HA LEU 60 18.635 3.726 -9.336 400 HG LEU 60 HG LEU 60 15.680 4.182 -8.265 401 HB2 LEU 60 HB2 LEU 60 16.733 2.102 -7.654 402 HB3 LEU 60 HB1 LEU 60 18.136 2.953 -7.024 403 HD11 LEU 60 HD11 LEU 60 16.837 4.408 -5.494 404 HD12 LEU 60 HD12 LEU 60 15.508 3.342 -5.940 405 HD13 LEU 60 HD13 LEU 60 15.319 5.092 -6.069 406 HD21 LEU 60 HD21 LEU 60 18.165 5.541 -7.230 407 HD22 LEU 60 HD22 LEU 60 16.705 6.342 -7.806 408 HD23 LEU 60 HD23 LEU 60 17.703 5.411 -8.926 409 H SER 61 HN SER 61 18.022 0.885 -10.738 410 HA SER 61 HA SER 61 19.272 -0.929 -11.235 411 HG SER 61 HG SER 61 21.714 -1.515 -11.644 412 HB2 SER 61 HB2 SER 61 21.224 0.604 -11.177 413 HB3 SER 61 HB1 SER 61 21.415 0.266 -9.457 414 HA PRO 62 HA PRO 62 18.004 -2.983 -7.368 415 HB2 PRO 62 HB2 PRO 62 16.254 -4.684 -8.499 416 HB3 PRO 62 HB1 PRO 62 15.826 -3.013 -8.112 417 HG2 PRO 62 HG2 PRO 62 16.498 -4.242 -10.743 418 HG3 PRO 62 HG1 PRO 62 15.328 -2.966 -10.359 419 HD2 PRO 62 HD2 PRO 62 17.869 -2.560 -11.411 420 HD3 PRO 62 HD1 PRO 62 16.883 -1.332 -10.595 421 H VAL 63 HN VAL 63 19.328 -4.498 -6.619 422 HA VAL 63 HA VAL 63 20.707 -6.271 -8.465 423 HB VAL 63 HB VAL 63 21.018 -5.961 -5.472 424 HG11 VAL 63 HG11 VAL 63 22.700 -7.473 -7.468 425 HG12 VAL 63 HG12 VAL 63 21.721 -8.163 -6.171 426 HG13 VAL 63 HG13 VAL 63 23.135 -7.185 -5.782 427 HG21 VAL 63 HG21 VAL 63 22.626 -4.836 -7.757 428 HG22 VAL 63 HG22 VAL 63 23.119 -4.791 -6.065 429 HG23 VAL 63 HG23 VAL 63 21.666 -3.936 -6.582 430 H ASN 64 HN ASN 64 19.621 -8.043 -9.053 431 HA ASN 64 HA ASN 64 18.559 -10.054 -8.929 432 HB2 ASN 64 HB2 ASN 64 19.479 -9.769 -6.092 433 HB3 ASN 64 HB1 ASN 64 18.368 -11.069 -6.513 434 HD21 ASN 64 HD21 ASN 64 20.722 -9.915 -8.802 435 HD22 ASN 64 HD22 ASN 64 21.751 -11.299 -8.736 436 H GLY 65 HN GLY 65 17.185 -7.389 -8.392 437 HA2 GLY 65 HA2 GLY 65 14.881 -7.146 -8.844 438 HA3 GLY 65 HA1 GLY 65 14.592 -8.707 -8.096 439 H LYS 66 HN LYS 66 16.560 -6.351 -6.454 440 HA LYS 66 HA LYS 66 14.399 -4.953 -5.243 441 HB2 LYS 66 HB2 LYS 66 14.542 -5.695 -2.993 442 HB3 LYS 66 HB1 LYS 66 14.364 -7.138 -3.969 443 HG2 LYS 66 HG2 LYS 66 16.935 -6.118 -2.789 444 HG3 LYS 66 HG1 LYS 66 15.948 -7.427 -2.141 445 HD2 LYS 66 HD2 LYS 66 16.904 -7.578 -4.952 446 HD3 LYS 66 HD1 LYS 66 18.032 -7.911 -3.651 447 HE2 LYS 66 HE2 LYS 66 17.175 -10.003 -4.284 448 HE3 LYS 66 HE1 LYS 66 16.349 -9.582 -2.797 449 HZ1 LYS 66 HZ1 LYS 66 15.230 -9.312 -5.530 450 HZ2 LYS 66 HZ2 LYS 66 14.422 -8.907 -4.099 451 HZ3 LYS 66 HZ3 LYS 66 14.831 -10.517 -4.410 452 H ILE 67 HN ILE 67 15.107 -3.135 -4.081 453 HA ILE 67 HA ILE 67 17.850 -2.414 -4.753 454 HB ILE 67 HB ILE 67 17.207 -0.157 -3.715 455 HG12 ILE 67 HG12 ILE 67 14.507 -1.555 -3.759 456 HG13 ILE 67 HG11 ILE 67 15.310 -0.789 -2.395 457 HG21 ILE 67 HG21 ILE 67 17.330 -0.573 -6.134 458 HG22 ILE 67 HG22 ILE 67 15.985 0.503 -5.759 459 HG23 ILE 67 HG23 ILE 67 15.678 -1.192 -6.137 460 HD11 ILE 67 HD11 ILE 67 13.466 0.553 -3.222 461 HD12 ILE 67 HD12 ILE 67 14.215 0.617 -4.817 462 HD13 ILE 67 HD13 ILE 67 15.003 1.390 -3.440 463 H THR 68 HN THR 68 19.464 -2.230 -3.377 464 HA THR 68 HA THR 68 19.382 -3.123 -0.730 465 HB THR 68 HB THR 68 21.556 -1.763 -0.530 466 HG1 THR 68 HG1 THR 68 22.327 -0.811 -2.374 467 HG21 THR 68 HG21 THR 68 22.796 -3.314 -1.978 468 HG22 THR 68 HG22 THR 68 21.285 -3.774 -2.764 469 HG23 THR 68 HG23 THR 68 21.540 -4.143 -1.057 470 H GLY 69 HN GLY 69 18.675 -2.116 1.080 471 HA2 GLY 69 HA2 GLY 69 16.789 -0.161 0.864 472 HA3 GLY 69 HA1 GLY 69 17.605 -0.542 2.357 473 H ALA 70 HN ALA 70 20.209 0.341 1.454 474 HA ALA 70 HA ALA 70 20.418 2.963 2.150 475 HB1 ALA 70 HB1 ALA 70 22.002 1.651 -0.052 476 HB2 ALA 70 HB2 ALA 70 22.316 1.486 1.676 477 HB3 ALA 70 HB3 ALA 70 22.484 3.058 0.895 478 H ASN 71 HN ASN 71 19.793 1.864 -1.235 479 HA ASN 71 HA ASN 71 19.895 4.554 -2.199 480 HB2 ASN 71 HB2 ASN 71 19.345 3.703 -4.366 481 HB3 ASN 71 HB1 ASN 71 20.441 2.551 -3.618 482 HD21 ASN 71 HD21 ASN 71 19.885 0.521 -3.412 483 HD22 ASN 71 HD22 ASN 71 18.345 -0.112 -3.856 484 H ALA 72 HN ALA 72 17.372 2.408 -1.106 485 HA ALA 72 HA ALA 72 15.197 4.026 -2.001 486 HB1 ALA 72 HB1 ALA 72 13.868 2.669 -0.436 487 HB2 ALA 72 HB2 ALA 72 15.360 1.945 0.170 488 HB3 ALA 72 HB3 ALA 72 14.871 1.685 -1.504 489 H LYS 73 HN LYS 73 17.226 3.856 0.812 490 HA LYS 73 HA LYS 73 15.793 5.737 2.392 491 HB2 LYS 73 HB2 LYS 73 18.721 4.970 2.464 492 HB3 LYS 73 HB1 LYS 73 17.916 5.967 3.670 493 HG2 LYS 73 HG2 LYS 73 17.340 3.082 3.034 494 HG3 LYS 73 HG1 LYS 73 18.099 3.721 4.495 495 HD2 LYS 73 HD2 LYS 73 15.348 4.548 3.627 496 HD3 LYS 73 HD1 LYS 73 15.623 3.119 4.624 497 HE2 LYS 73 HE2 LYS 73 16.683 4.484 6.327 498 HE3 LYS 73 HE1 LYS 73 16.485 5.929 5.324 499 HZ1 LYS 73 HZ1 LYS 73 14.050 5.511 5.459 500 HZ2 LYS 73 HZ2 LYS 73 14.772 5.894 6.939 501 HZ3 LYS 73 HZ3 LYS 73 14.369 4.288 6.594 502 H LYS 74 HN LYS 74 18.312 5.961 -0.031 503 HA LYS 74 HA LYS 74 18.872 8.696 0.142 504 HB2 LYS 74 HB2 LYS 74 18.707 7.149 -2.416 505 HB3 LYS 74 HB1 LYS 74 19.681 8.552 -2.101 506 HG2 LYS 74 HG2 LYS 74 20.102 5.728 -1.223 507 HG3 LYS 74 HG1 LYS 74 21.197 6.794 -2.099 508 HD2 LYS 74 HD2 LYS 74 20.373 7.404 0.719 509 HD3 LYS 74 HD1 LYS 74 21.682 6.275 0.380 510 HE2 LYS 74 HE2 LYS 74 21.537 9.162 -0.475 511 HE3 LYS 74 HE1 LYS 74 22.544 8.487 0.806 512 HZ1 LYS 74 HZ1 LYS 74 22.757 7.917 -2.108 513 HZ2 LYS 74 HZ2 LYS 74 23.649 7.117 -0.909 514 HZ3 LYS 74 HZ3 LYS 74 23.869 8.781 -1.154 515 H GLU 75 HN GLU 75 16.535 6.942 -1.797 516 HA GLU 75 HA GLU 75 15.259 9.058 -3.049 517 HB2 GLU 75 HB2 GLU 75 14.169 6.396 -2.166 518 HB3 GLU 75 HB1 GLU 75 13.201 7.545 -3.073 519 HG2 GLU 75 HG2 GLU 75 15.564 5.950 -3.963 520 HG3 GLU 75 HG1 GLU 75 13.986 6.152 -4.717 521 H MET 76 HN MET 76 14.287 7.572 0.037 522 HA MET 76 HA MET 76 12.208 9.471 0.408 523 HB2 MET 76 HB2 MET 76 12.272 8.603 2.817 524 HB3 MET 76 HB1 MET 76 11.888 7.458 1.544 525 HG2 MET 76 HG2 MET 76 14.180 6.652 1.575 526 HG3 MET 76 HG1 MET 76 14.567 7.799 2.851 527 HE1 MET 76 HE1 MET 76 11.283 5.528 2.366 528 HE2 MET 76 HE2 MET 76 11.823 4.108 3.265 529 HE3 MET 76 HE3 MET 76 12.672 4.597 1.801 530 H VAL 77 HN VAL 77 15.607 9.427 1.260 531 HA VAL 77 HA VAL 77 15.604 11.623 3.043 532 HB VAL 77 HB VAL 77 17.697 10.314 1.349 533 HG11 VAL 77 HG11 VAL 77 18.210 12.670 1.079 534 HG12 VAL 77 HG12 VAL 77 19.388 11.912 2.152 535 HG13 VAL 77 HG13 VAL 77 18.103 12.918 2.822 536 HG21 VAL 77 HG21 VAL 77 17.132 9.348 3.504 537 HG22 VAL 77 HG22 VAL 77 17.445 10.890 4.302 538 HG23 VAL 77 HG23 VAL 77 18.769 10.003 3.546 539 H LYS 78 HN LYS 78 15.992 11.447 -0.503 540 HA LYS 78 HA LYS 78 16.370 14.273 -0.792 541 HB2 LYS 78 HB2 LYS 78 16.246 13.881 -3.173 542 HB3 LYS 78 HB1 LYS 78 17.240 12.638 -2.425 543 HG2 LYS 78 HG2 LYS 78 15.269 11.133 -2.466 544 HG3 LYS 78 HG1 LYS 78 14.403 12.370 -3.383 545 HD2 LYS 78 HD2 LYS 78 15.317 10.762 -4.916 546 HD3 LYS 78 HD1 LYS 78 16.190 12.285 -5.074 547 HE2 LYS 78 HE2 LYS 78 18.040 11.454 -3.833 548 HE3 LYS 78 HE1 LYS 78 17.156 9.999 -3.378 549 HZ1 LYS 78 HZ1 LYS 78 18.807 9.715 -5.202 550 HZ2 LYS 78 HZ2 LYS 78 17.821 10.677 -6.188 551 HZ3 LYS 78 HZ3 LYS 78 17.237 9.198 -5.579 552 H SER 79 HN SER 79 13.661 12.247 -0.429 553 HA SER 79 HA SER 79 11.642 14.002 -1.333 554 HG SER 79 HG SER 79 12.099 11.230 -1.330 555 HB2 SER 79 HB2 SER 79 11.559 11.959 0.864 556 HB3 SER 79 HB1 SER 79 10.158 12.721 0.111 557 H LYS 80 HN LYS 80 13.818 14.182 1.290 558 HA LYS 80 HA LYS 80 14.458 16.031 2.418 559 HB2 LYS 80 HB2 LYS 80 12.191 17.367 0.930 560 HB3 LYS 80 HB1 LYS 80 13.338 18.213 1.967 561 HG2 LYS 80 HG2 LYS 80 15.171 17.599 0.537 562 HG3 LYS 80 HG1 LYS 80 14.113 16.589 -0.449 563 HD2 LYS 80 HD2 LYS 80 12.815 18.634 -1.023 564 HD3 LYS 80 HD1 LYS 80 14.028 19.587 -0.164 565 HE2 LYS 80 HE2 LYS 80 15.754 18.822 -1.666 566 HE3 LYS 80 HE1 LYS 80 14.622 17.740 -2.475 567 HZ1 LYS 80 HZ1 LYS 80 14.846 19.645 -3.815 568 HZ2 LYS 80 HZ2 LYS 80 14.640 20.706 -2.509 569 HZ3 LYS 80 HZ3 LYS 80 13.328 19.783 -3.068 570 H LEU 81 HN LEU 81 12.857 14.149 3.638 571 HA LEU 81 HA LEU 81 11.013 15.709 5.303 572 HG LEU 81 HG LEU 81 8.954 12.914 4.202 573 HB2 LEU 81 HB2 LEU 81 11.380 12.716 5.219 574 HB3 LEU 81 HB1 LEU 81 10.118 13.594 6.055 575 HD11 LEU 81 HD11 LEU 81 8.696 14.669 2.604 576 HD12 LEU 81 HD12 LEU 81 10.258 15.347 3.061 577 HD13 LEU 81 HD13 LEU 81 8.922 15.359 4.212 578 HD21 LEU 81 HD21 LEU 81 9.853 12.422 2.075 579 HD22 LEU 81 HD22 LEU 81 10.870 11.694 3.321 580 HD23 LEU 81 HD23 LEU 81 11.388 13.174 2.513 581 HA PRO 82 HA PRO 82 13.701 15.334 8.853 582 HB2 PRO 82 HB2 PRO 82 11.872 14.832 10.828 583 HB3 PRO 82 HB1 PRO 82 12.190 16.451 10.174 584 HG2 PRO 82 HG2 PRO 82 9.972 14.548 9.544 585 HG3 PRO 82 HG1 PRO 82 9.923 16.307 9.730 586 HD2 PRO 82 HD2 PRO 82 9.916 15.077 7.325 587 HD3 PRO 82 HD1 PRO 82 10.662 16.667 7.587 588 H ASN 83 HN ASN 83 14.582 13.743 10.178 589 HA ASN 83 HA ASN 83 14.681 11.154 9.270 590 HB2 ASN 83 HB2 ASN 83 15.391 12.416 11.879 591 HB3 ASN 83 HB1 ASN 83 15.452 10.663 11.736 592 HD21 ASN 83 HD21 ASN 83 16.165 12.711 8.994 593 HD22 ASN 83 HD22 ASN 83 17.871 12.428 8.989 594 H THR 84 HN THR 84 12.429 12.514 11.591 595 HA THR 84 HA THR 84 11.387 10.146 12.671 596 HB THR 84 HB THR 84 9.730 12.600 12.094 597 HG1 THR 84 HG1 THR 84 10.649 13.564 13.902 598 HG21 THR 84 HG21 THR 84 8.581 10.666 13.093 599 HG22 THR 84 HG22 THR 84 8.657 12.032 14.208 600 HG23 THR 84 HG23 THR 84 9.751 10.666 14.415 601 H VAL 85 HN VAL 85 10.151 12.126 9.970 602 HA VAL 85 HA VAL 85 8.112 10.362 9.175 603 HB VAL 85 HB VAL 85 9.616 12.384 7.489 604 HG11 VAL 85 HG11 VAL 85 7.714 12.336 5.992 605 HG12 VAL 85 HG12 VAL 85 6.912 11.136 7.008 606 HG13 VAL 85 HG13 VAL 85 8.391 10.714 6.146 607 HG21 VAL 85 HG21 VAL 85 7.717 13.861 7.965 608 HG22 VAL 85 HG22 VAL 85 8.568 13.399 9.437 609 HG23 VAL 85 HG23 VAL 85 7.034 12.631 9.028 610 H LEU 86 HN LEU 86 11.465 10.711 8.104 611 HA LEU 86 HA LEU 86 11.438 8.840 6.015 612 HG LEU 86 HG LEU 86 12.787 11.491 6.929 613 HB2 LEU 86 HB2 LEU 86 13.704 9.365 7.912 614 HB3 LEU 86 HB1 LEU 86 13.819 8.740 6.272 615 HD11 LEU 86 HD11 LEU 86 15.059 11.131 7.731 616 HD12 LEU 86 HD12 LEU 86 14.998 12.271 6.380 617 HD13 LEU 86 HD13 LEU 86 15.536 10.610 6.116 618 HD21 LEU 86 HD21 LEU 86 13.812 10.242 4.381 619 HD22 LEU 86 HD22 LEU 86 13.256 11.905 4.572 620 HD23 LEU 86 HD23 LEU 86 12.121 10.568 4.754 621 H GLY 87 HN GLY 87 12.364 8.415 9.428 622 HA2 GLY 87 HA2 GLY 87 13.066 5.723 9.326 623 HA3 GLY 87 HA1 GLY 87 12.445 6.544 10.754 624 H LYS 88 HN LYS 88 9.909 7.239 9.809 625 HA LYS 88 HA LYS 88 8.745 4.599 10.016 626 HB2 LYS 88 HB2 LYS 88 6.629 5.635 10.505 627 HB3 LYS 88 HB1 LYS 88 7.893 6.269 11.537 628 HG2 LYS 88 HG2 LYS 88 7.949 8.324 10.309 629 HG3 LYS 88 HG1 LYS 88 6.824 7.671 9.111 630 HD2 LYS 88 HD2 LYS 88 5.073 7.524 10.757 631 HD3 LYS 88 HD1 LYS 88 6.192 7.963 12.047 632 HE2 LYS 88 HE2 LYS 88 6.448 10.190 11.065 633 HE3 LYS 88 HE1 LYS 88 5.338 9.746 9.765 634 HZ1 LYS 88 HZ1 LYS 88 3.577 9.464 11.357 635 HZ2 LYS 88 HZ2 LYS 88 4.247 11.005 11.566 636 HZ3 LYS 88 HZ3 LYS 88 4.629 9.759 12.649 637 H ILE 89 HN ILE 89 9.385 6.828 7.479 638 HA ILE 89 HA ILE 89 7.371 5.764 5.722 639 HB ILE 89 HB ILE 89 9.981 7.177 5.135 640 HG12 ILE 89 HG12 ILE 89 7.075 7.936 4.768 641 HG13 ILE 89 HG11 ILE 89 8.199 8.615 5.942 642 HG21 ILE 89 HG21 ILE 89 9.629 5.555 3.357 643 HG22 ILE 89 HG22 ILE 89 9.338 7.189 2.763 644 HG23 ILE 89 HG23 ILE 89 7.977 6.131 3.138 645 HD11 ILE 89 HD11 ILE 89 8.405 8.871 2.953 646 HD12 ILE 89 HD12 ILE 89 9.527 9.556 4.127 647 HD13 ILE 89 HD13 ILE 89 7.857 10.123 4.067 648 H TRP 90 HN TRP 90 10.747 5.003 6.442 649 HA TRP 90 HA TRP 90 11.059 2.881 4.645 650 HD1 TRP 90 HD1 TRP 90 12.801 0.790 8.110 651 HE1 TRP 90 HE1 TRP 90 14.035 -1.211 7.015 652 HE3 TRP 90 HE3 TRP 90 13.403 2.691 3.394 653 HZ2 TRP 90 HZ2 TRP 90 15.123 -1.870 4.488 654 HZ3 TRP 90 HZ3 TRP 90 14.552 1.313 1.710 655 HH2 TRP 90 HH2 TRP 90 15.387 -0.918 2.248 656 HB2 TRP 90 HB2 TRP 90 12.972 3.775 5.823 657 HB3 TRP 90 HB1 TRP 90 12.302 3.242 7.361 658 H LYS 91 HN LYS 91 10.134 2.824 8.074 659 HA LYS 91 HA LYS 91 9.997 -0.015 8.113 660 HB2 LYS 91 HB2 LYS 91 9.005 1.960 10.114 661 HB3 LYS 91 HB1 LYS 91 9.250 0.250 10.407 662 HG2 LYS 91 HG2 LYS 91 11.643 0.583 9.905 663 HG3 LYS 91 HG1 LYS 91 11.345 2.315 9.779 664 HD2 LYS 91 HD2 LYS 91 10.398 2.201 12.114 665 HD3 LYS 91 HD1 LYS 91 11.040 0.558 12.205 666 HE2 LYS 91 HE2 LYS 91 12.627 3.077 11.724 667 HE3 LYS 91 HE1 LYS 91 12.585 2.149 13.219 668 HZ1 LYS 91 HZ1 LYS 91 13.694 1.268 10.610 669 HZ2 LYS 91 HZ2 LYS 91 13.510 0.254 11.945 670 HZ3 LYS 91 HZ3 LYS 91 14.562 1.585 12.029 671 H LEU 92 HN LEU 92 7.709 2.465 7.414 672 HA LEU 92 HA LEU 92 5.446 0.678 7.746 673 HG LEU 92 HG LEU 92 3.203 1.807 6.980 674 HB2 LEU 92 HB2 LEU 92 5.624 3.356 7.908 675 HB3 LEU 92 HB1 LEU 92 5.173 3.200 6.209 676 HD11 LEU 92 HD11 LEU 92 4.103 1.249 9.204 677 HD12 LEU 92 HD12 LEU 92 2.524 2.027 9.311 678 HD13 LEU 92 HD13 LEU 92 3.986 2.948 9.668 679 HD21 LEU 92 HD21 LEU 92 3.383 4.674 7.905 680 HD22 LEU 92 HD22 LEU 92 1.888 3.772 7.652 681 HD23 LEU 92 HD23 LEU 92 2.949 4.124 6.287 682 H ALA 93 HN ALA 93 7.759 1.507 5.340 683 HA ALA 93 HA ALA 93 6.061 0.559 3.152 684 HB1 ALA 93 HB1 ALA 93 8.904 1.554 3.079 685 HB2 ALA 93 HB2 ALA 93 7.465 2.534 2.787 686 HB3 ALA 93 HB3 ALA 93 7.876 1.215 1.688 687 H ASP 94 HN ASP 94 9.126 -0.252 4.732 688 HA ASP 94 HA ASP 94 9.126 -2.872 3.467 689 HB2 ASP 94 HB2 ASP 94 11.262 -1.587 3.916 690 HB3 ASP 94 HB1 ASP 94 10.991 -1.859 5.625 691 H VAL 95 HN VAL 95 7.008 -3.281 4.370 692 HA VAL 95 HA VAL 95 6.593 -3.599 7.165 693 HB VAL 95 HB VAL 95 5.068 -4.980 4.944 694 HG11 VAL 95 HG11 VAL 95 3.178 -4.837 6.508 695 HG12 VAL 95 HG12 VAL 95 4.244 -4.127 7.721 696 HG13 VAL 95 HG13 VAL 95 4.513 -5.781 7.167 697 HG21 VAL 95 HG21 VAL 95 3.576 -3.035 4.933 698 HG22 VAL 95 HG22 VAL 95 5.213 -2.612 4.427 699 HG23 VAL 95 HG23 VAL 95 4.659 -2.205 6.051 700 H ASP 96 HN ASP 96 8.410 -5.282 4.981 701 HA ASP 96 HA ASP 96 8.240 -7.864 6.338 702 HB2 ASP 96 HB2 ASP 96 8.366 -7.752 3.870 703 HB3 ASP 96 HB1 ASP 96 9.922 -6.918 4.011 704 H LYS 97 HN LYS 97 10.276 -5.047 5.999 705 HA LYS 97 HA LYS 97 11.880 -4.167 7.307 706 HB2 LYS 97 HB2 LYS 97 10.935 -6.194 9.336 707 HB3 LYS 97 HB1 LYS 97 11.898 -4.758 9.675 708 HG2 LYS 97 HG2 LYS 97 10.109 -3.340 8.895 709 HG3 LYS 97 HG1 LYS 97 9.137 -4.745 8.486 710 HD2 LYS 97 HD2 LYS 97 9.309 -5.409 10.925 711 HD3 LYS 97 HD1 LYS 97 9.982 -3.807 11.222 712 HE2 LYS 97 HE2 LYS 97 7.938 -2.804 10.266 713 HE3 LYS 97 HE1 LYS 97 7.276 -4.421 10.042 714 HZ1 LYS 97 HZ1 LYS 97 7.591 -4.711 12.512 715 HZ2 LYS 97 HZ2 LYS 97 6.373 -3.629 12.043 716 HZ3 LYS 97 HZ3 LYS 97 7.861 -3.038 12.593 717 H ASP 98 HN ASP 98 13.353 -5.013 5.774 718 HA ASP 98 HA ASP 98 15.007 -7.202 6.829 719 HB2 ASP 98 HB2 ASP 98 15.310 -7.882 4.383 720 HB3 ASP 98 HB1 ASP 98 13.725 -8.206 5.101 721 H GLY 99 HN GLY 99 14.866 -4.104 5.273 722 HA2 GLY 99 HA2 GLY 99 16.774 -2.609 5.497 723 HA3 GLY 99 HA1 GLY 99 17.823 -4.014 5.395 724 H LEU 100 HN LEU 100 15.393 -4.362 3.176 725 HA LEU 100 HA LEU 100 16.575 -2.651 1.124 726 HG LEU 100 HG LEU 100 16.076 -6.189 1.981 727 HB2 LEU 100 HB2 LEU 100 16.499 -4.566 -0.502 728 HB3 LEU 100 HB1 LEU 100 17.756 -4.666 0.712 729 HD11 LEU 100 HD11 LEU 100 14.982 -6.326 -0.825 730 HD12 LEU 100 HD12 LEU 100 14.122 -5.838 0.640 731 HD13 LEU 100 HD13 LEU 100 14.650 -7.509 0.442 732 HD21 LEU 100 HD21 LEU 100 17.495 -7.102 -0.514 733 HD22 LEU 100 HD22 LEU 100 16.966 -8.138 0.810 734 HD23 LEU 100 HD23 LEU 100 18.206 -6.916 1.089 735 H LEU 101 HN LEU 101 15.015 -3.367 -1.027 736 HA LEU 101 HA LEU 101 12.269 -3.487 -0.159 737 HG LEU 101 HG LEU 101 13.339 -0.847 1.064 738 HB2 LEU 101 HB2 LEU 101 13.429 -0.975 -1.379 739 HB3 LEU 101 HB1 LEU 101 11.724 -1.356 -1.445 740 HD11 LEU 101 HD11 LEU 101 12.864 1.137 -0.309 741 HD12 LEU 101 HD12 LEU 101 12.012 1.170 1.233 742 HD13 LEU 101 HD13 LEU 101 11.145 0.754 -0.246 743 HD21 LEU 101 HD21 LEU 101 10.397 -1.435 0.722 744 HD22 LEU 101 HD22 LEU 101 11.171 -0.919 2.216 745 HD23 LEU 101 HD23 LEU 101 11.584 -2.478 1.504 746 H ASP 102 HN ASP 102 11.596 -4.970 -1.609 747 HA ASP 102 HA ASP 102 12.889 -5.158 -4.165 748 HB2 ASP 102 HB2 ASP 102 11.502 -7.031 -4.570 749 HB3 ASP 102 HB1 ASP 102 12.066 -7.132 -2.912 750 H ASP 103 HN ASP 103 10.926 -5.599 -6.031 751 HA ASP 103 HA ASP 103 10.454 -2.969 -6.850 752 HB2 ASP 103 HB2 ASP 103 8.995 -3.983 -8.611 753 HB3 ASP 103 HB1 ASP 103 10.597 -4.728 -8.484 754 H GLU 104 HN GLU 104 8.425 -5.167 -5.035 755 HA GLU 104 HA GLU 104 6.103 -3.442 -5.288 756 HB2 GLU 104 HB2 GLU 104 5.968 -5.947 -5.208 757 HB3 GLU 104 HB1 GLU 104 6.475 -5.862 -3.526 758 HG2 GLU 104 HG2 GLU 104 4.493 -4.522 -3.006 759 HG3 GLU 104 HG1 GLU 104 3.978 -4.668 -4.700 760 H GLU 105 HN GLU 105 8.669 -4.105 -3.054 761 HA GLU 105 HA GLU 105 7.485 -2.725 -0.853 762 HB2 GLU 105 HB2 GLU 105 9.872 -4.256 -1.347 763 HB3 GLU 105 HB1 GLU 105 10.271 -2.782 -0.486 764 HG2 GLU 105 HG2 GLU 105 8.740 -3.301 1.273 765 HG3 GLU 105 HG1 GLU 105 8.089 -4.668 0.373 766 H PHE 106 HN PHE 106 9.699 -1.836 -3.451 767 HA PHE 106 HA PHE 106 10.129 0.839 -2.604 768 HD1 PHE 106 HD1 PHE 106 9.470 2.698 -4.268 769 HD2 PHE 106 HD2 PHE 106 12.873 0.848 -6.009 770 HE1 PHE 106 HE1 PHE 106 10.301 4.883 -4.950 771 HE2 PHE 106 HE2 PHE 106 13.707 3.049 -6.707 772 HZ PHE 106 HZ PHE 106 12.489 5.020 -6.256 773 HB2 PHE 106 HB2 PHE 106 11.433 -0.370 -4.416 774 HB3 PHE 106 HB1 PHE 106 10.038 -0.177 -5.459 775 H ALA 107 HN ALA 107 7.690 -0.794 -4.593 776 HA ALA 107 HA ALA 107 6.138 1.348 -5.369 777 HB1 ALA 107 HB1 ALA 107 4.231 -0.199 -5.375 778 HB2 ALA 107 HB2 ALA 107 5.188 -1.363 -4.457 779 HB3 ALA 107 HB3 ALA 107 5.673 -0.920 -6.093 780 H LEU 108 HN LEU 108 6.032 -0.407 -2.280 781 HA LEU 108 HA LEU 108 3.996 1.198 -1.142 782 HG LEU 108 HG LEU 108 3.015 -0.195 0.514 783 HB2 LEU 108 HB2 LEU 108 5.139 -1.121 -0.434 784 HB3 LEU 108 HB1 LEU 108 6.027 -0.035 0.632 785 HD11 LEU 108 HD11 LEU 108 4.888 -1.465 2.491 786 HD12 LEU 108 HD12 LEU 108 3.956 -2.313 1.257 787 HD13 LEU 108 HD13 LEU 108 3.126 -1.467 2.562 788 HD21 LEU 108 HD21 LEU 108 4.862 1.057 2.533 789 HD22 LEU 108 HD22 LEU 108 3.106 0.963 2.652 790 HD23 LEU 108 HD23 LEU 108 3.854 1.917 1.370 791 H ALA 109 HN ALA 109 7.531 1.239 -0.816 792 HA ALA 109 HA ALA 109 7.892 3.306 0.964 793 HB1 ALA 109 HB1 ALA 109 10.075 3.617 0.017 794 HB2 ALA 109 HB2 ALA 109 9.577 2.844 -1.489 795 HB3 ALA 109 HB3 ALA 109 9.680 1.899 -0.002 796 H ASN 110 HN ASN 110 7.754 3.683 -2.590 797 HA ASN 110 HA ASN 110 8.003 6.511 -2.464 798 HB2 ASN 110 HB2 ASN 110 8.665 4.977 -4.396 799 HB3 ASN 110 HB1 ASN 110 6.953 4.940 -4.806 800 HD21 ASN 110 HD21 ASN 110 9.851 6.818 -4.761 801 HD22 ASN 110 HD22 ASN 110 9.253 8.162 -5.665 802 H HIS 111 HN HIS 111 5.344 4.251 -2.478 803 HA HIS 111 HA HIS 111 3.316 6.120 -3.194 804 HD1 HIS 111 HD1 HIS 111 1.007 4.884 -4.524 805 HD2 HIS 111 HD2 HIS 111 0.557 4.094 -0.461 806 HE1 HIS 111 HE1 HIS 111 -1.450 5.113 -4.059 807 HE2 HIS 111 HE2 HIS 111 -1.636 4.975 -1.547 808 HB2 HIS 111 HB2 HIS 111 3.041 3.641 -3.357 809 HB3 HIS 111 HB1 HIS 111 3.003 3.569 -1.591 810 H LEU 112 HN LEU 112 4.722 5.035 -0.153 811 HA LEU 112 HA LEU 112 2.971 6.549 1.500 812 HG LEU 112 HG LEU 112 3.833 3.732 2.003 813 HB2 LEU 112 HB2 LEU 112 5.689 5.346 1.935 814 HB3 LEU 112 HB1 LEU 112 4.904 6.319 3.170 815 HD11 LEU 112 HD11 LEU 112 4.283 2.849 4.237 816 HD12 LEU 112 HD12 LEU 112 4.999 4.394 4.700 817 HD13 LEU 112 HD13 LEU 112 5.759 3.411 3.449 818 HD21 LEU 112 HD21 LEU 112 2.114 3.902 3.710 819 HD22 LEU 112 HD22 LEU 112 2.045 5.297 2.632 820 HD23 LEU 112 HD23 LEU 112 2.761 5.453 4.236 821 H ILE 113 HN ILE 113 6.091 7.212 -0.029 822 HA ILE 113 HA ILE 113 6.517 9.787 0.925 823 HB ILE 113 HB ILE 113 7.120 8.631 -1.800 824 HG12 ILE 113 HG12 ILE 113 8.859 9.044 0.649 825 HG13 ILE 113 HG11 ILE 113 8.198 7.500 0.121 826 HG21 ILE 113 HG21 ILE 113 7.104 11.064 -1.927 827 HG22 ILE 113 HG22 ILE 113 8.751 10.445 -2.047 828 HG23 ILE 113 HG23 ILE 113 8.183 11.156 -0.534 829 HD11 ILE 113 HD11 ILE 113 9.518 7.637 -1.927 830 HD12 ILE 113 HD12 ILE 113 10.539 7.723 -0.489 831 HD13 ILE 113 HD13 ILE 113 10.172 9.188 -1.398 832 H LYS 114 HN LYS 114 4.551 8.781 -1.950 833 HA LYS 114 HA LYS 114 3.762 11.448 -2.492 834 HB2 LYS 114 HB2 LYS 114 2.256 10.604 -4.064 835 HB3 LYS 114 HB1 LYS 114 3.566 9.437 -4.048 836 HG2 LYS 114 HG2 LYS 114 2.279 7.879 -2.798 837 HG3 LYS 114 HG1 LYS 114 1.019 9.080 -2.495 838 HD2 LYS 114 HD2 LYS 114 1.797 8.072 -5.220 839 HD3 LYS 114 HD1 LYS 114 0.435 7.456 -4.278 840 HE2 LYS 114 HE2 LYS 114 0.685 10.384 -4.837 841 HE3 LYS 114 HE1 LYS 114 0.056 9.299 -6.064 842 HZ1 LYS 114 HZ1 LYS 114 -1.048 9.622 -3.315 843 HZ2 LYS 114 HZ2 LYS 114 -1.666 8.599 -4.524 844 HZ3 LYS 114 HZ3 LYS 114 -1.717 10.280 -4.728 845 H VAL 115 HN VAL 115 2.466 8.982 -0.348 846 HA VAL 115 HA VAL 115 0.023 10.248 0.295 847 HB VAL 115 HB VAL 115 1.770 8.318 1.814 848 HG11 VAL 115 HG11 VAL 115 0.603 9.661 3.474 849 HG12 VAL 115 HG12 VAL 115 -0.071 8.032 3.410 850 HG13 VAL 115 HG13 VAL 115 -0.932 9.372 2.651 851 HG21 VAL 115 HG21 VAL 115 -0.917 8.036 0.470 852 HG22 VAL 115 HG22 VAL 115 -0.051 6.752 1.316 853 HG23 VAL 115 HG23 VAL 115 0.627 7.450 -0.154 854 H LYS 116 HN LYS 116 3.253 10.490 1.793 855 HA LYS 116 HA LYS 116 2.412 12.529 3.616 856 HB2 LYS 116 HB2 LYS 116 4.746 12.678 4.215 857 HB3 LYS 116 HB1 LYS 116 4.255 10.992 4.111 858 HG2 LYS 116 HG2 LYS 116 5.913 10.622 2.714 859 HG3 LYS 116 HG1 LYS 116 5.168 11.736 1.561 860 HD2 LYS 116 HD2 LYS 116 6.264 13.507 3.211 861 HD3 LYS 116 HD1 LYS 116 7.360 12.153 3.470 862 HE2 LYS 116 HE2 LYS 116 8.130 13.675 1.727 863 HE3 LYS 116 HE1 LYS 116 7.867 12.045 1.125 864 HZ1 LYS 116 HZ1 LYS 116 5.799 12.766 0.149 865 HZ2 LYS 116 HZ2 LYS 116 7.043 13.792 -0.382 866 HZ3 LYS 116 HZ3 LYS 116 5.974 14.313 0.821 867 H LEU 117 HN LEU 117 3.019 12.493 0.338 868 HA LEU 117 HA LEU 117 3.780 15.305 0.180 869 HG LEU 117 HG LEU 117 2.786 15.571 -2.817 870 HB2 LEU 117 HB2 LEU 117 4.753 13.741 -1.436 871 HB3 LEU 117 HB1 LEU 117 3.138 13.271 -1.969 872 HD11 LEU 117 HD11 LEU 117 4.678 17.092 -3.005 873 HD12 LEU 117 HD12 LEU 117 5.693 15.959 -2.115 874 HD13 LEU 117 HD13 LEU 117 4.326 16.733 -1.314 875 HD21 LEU 117 HD21 LEU 117 3.535 13.830 -4.313 876 HD22 LEU 117 HD22 LEU 117 5.213 14.120 -3.858 877 HD23 LEU 117 HD23 LEU 117 4.309 15.357 -4.737 878 H GLU 118 HN GLU 118 1.004 13.373 0.377 879 HA GLU 118 HA GLU 118 -0.763 15.155 -1.035 880 HB2 GLU 118 HB2 GLU 118 -1.240 12.683 0.632 881 HB3 GLU 118 HB1 GLU 118 -2.543 13.624 -0.087 882 HG2 GLU 118 HG2 GLU 118 -1.712 13.209 -2.300 883 HG3 GLU 118 HG1 GLU 118 -0.275 12.410 -1.659 884 H GLY 119 HN GLY 119 0.774 15.388 1.849 885 HA2 GLY 119 HA2 GLY 119 0.503 17.560 2.863 886 HA3 GLY 119 HA1 GLY 119 -1.230 17.392 2.633 887 H HIS 120 HN HIS 120 0.021 14.473 3.658 888 HA HIS 120 HA HIS 120 -0.172 15.198 6.470 889 HD1 HIS 120 HD1 HIS 120 -1.789 11.442 7.406 890 HD2 HIS 120 HD2 HIS 120 -2.009 12.317 3.343 891 HE1 HIS 120 HE1 HIS 120 -2.115 9.241 6.269 892 HE2 HIS 120 HE2 HIS 120 -2.534 9.833 3.855 893 HB2 HIS 120 HB2 HIS 120 -1.951 13.863 7.003 894 HB3 HIS 120 HB1 HIS 120 -2.430 14.398 5.404 895 H GLU 121 HN GLU 121 1.118 14.105 7.752 896 HA GLU 121 HA GLU 121 3.101 12.357 6.717 897 HB2 GLU 121 HB2 GLU 121 3.769 12.134 9.116 898 HB3 GLU 121 HB1 GLU 121 3.631 13.797 8.558 899 HG2 GLU 121 HG2 GLU 121 2.305 14.211 10.276 900 HG3 GLU 121 HG1 GLU 121 1.107 13.131 9.559 901 H LEU 122 HN LEU 122 3.585 10.207 7.685 902 HA LEU 122 HA LEU 122 1.358 8.466 7.266 903 HG LEU 122 HG LEU 122 4.496 8.865 6.233 904 HB2 LEU 122 HB2 LEU 122 4.089 7.758 8.343 905 HB3 LEU 122 HB1 LEU 122 2.927 6.663 7.585 906 HD11 LEU 122 HD11 LEU 122 5.762 6.837 6.712 907 HD12 LEU 122 HD12 LEU 122 5.484 7.029 4.981 908 HD13 LEU 122 HD13 LEU 122 4.528 5.872 5.905 909 HD21 LEU 122 HD21 LEU 122 3.427 8.094 4.162 910 HD22 LEU 122 HD22 LEU 122 2.261 8.780 5.292 911 HD23 LEU 122 HD23 LEU 122 2.385 7.030 5.105 912 HA PRO 123 HA PRO 123 -0.092 8.219 11.380 913 HB2 PRO 123 HB2 PRO 123 -1.685 6.106 11.221 914 HB3 PRO 123 HB1 PRO 123 -1.971 7.508 10.182 915 HG2 PRO 123 HG2 PRO 123 -0.528 4.956 9.532 916 HG3 PRO 123 HG1 PRO 123 -1.823 5.742 8.614 917 HD2 PRO 123 HD2 PRO 123 0.816 6.054 8.014 918 HD3 PRO 123 HD1 PRO 123 -0.385 7.334 7.733 919 H ALA 124 HN ALA 124 2.240 6.112 10.354 920 HA ALA 124 HA ALA 124 3.473 4.408 11.220 921 HB1 ALA 124 HB1 ALA 124 2.277 5.284 13.847 922 HB2 ALA 124 HB2 ALA 124 3.779 5.882 13.143 923 HB3 ALA 124 HB3 ALA 124 3.651 4.197 13.652 924 H ASP 125 HN ASP 125 0.584 4.201 10.486 925 HA ASP 125 HA ASP 125 -0.016 1.623 11.756 926 HB2 ASP 125 HB2 ASP 125 -1.698 3.362 12.275 927 HB3 ASP 125 HB1 ASP 125 -1.952 3.619 10.550 928 H LEU 126 HN LEU 126 -0.866 0.009 10.373 929 HA LEU 126 HA LEU 126 -0.255 0.436 7.533 930 HG LEU 126 HG LEU 126 2.050 -2.426 7.212 931 HB2 LEU 126 HB2 LEU 126 1.481 -0.874 8.895 932 HB3 LEU 126 HB1 LEU 126 0.283 -2.148 8.986 933 HD11 LEU 126 HD11 LEU 126 -0.799 -2.324 6.245 934 HD12 LEU 126 HD12 LEU 126 -0.048 -3.657 7.124 935 HD13 LEU 126 HD13 LEU 126 0.523 -3.232 5.512 936 HD21 LEU 126 HD21 LEU 126 2.194 -0.104 6.496 937 HD22 LEU 126 HD22 LEU 126 0.538 -0.176 5.892 938 HD23 LEU 126 HD23 LEU 126 1.795 -1.161 5.143 939 HA PRO 127 HA PRO 127 -4.522 -0.941 7.690 940 HB2 PRO 127 HB2 PRO 127 -4.774 0.169 5.031 941 HB3 PRO 127 HB1 PRO 127 -5.465 0.759 6.547 942 HG2 PRO 127 HG2 PRO 127 -3.518 2.058 5.139 943 HG3 PRO 127 HG1 PRO 127 -3.751 2.229 6.890 944 HD2 PRO 127 HD2 PRO 127 -1.761 0.575 5.389 945 HD3 PRO 127 HD1 PRO 127 -1.548 1.514 6.882 946 HA PRO 128 HA PRO 128 -4.418 -4.789 5.474 947 HB2 PRO 128 HB2 PRO 128 -7.288 -4.230 4.961 948 HB3 PRO 128 HB1 PRO 128 -6.520 -5.655 5.684 949 HG2 PRO 128 HG2 PRO 128 -7.833 -3.842 7.156 950 HG3 PRO 128 HG1 PRO 128 -6.410 -4.693 7.774 951 HD2 PRO 128 HD2 PRO 128 -6.703 -1.884 6.865 952 HD3 PRO 128 HD1 PRO 128 -5.605 -2.576 8.073 953 H HIS 129 HN HIS 129 -6.104 -2.016 4.037 954 HA HIS 129 HA HIS 129 -5.858 -3.154 1.394 955 HD1 HIS 129 HD1 HIS 129 -7.783 -0.249 4.093 956 HD2 HIS 129 HD2 HIS 129 -5.895 1.384 0.761 957 HE1 HIS 129 HE1 HIS 129 -7.486 2.193 4.607 958 HE2 HIS 129 HE2 HIS 129 -6.536 3.195 2.495 959 HB2 HIS 129 HB2 HIS 129 -6.941 -1.172 0.545 960 HB3 HIS 129 HB1 HIS 129 -7.825 -1.757 1.938 961 H LEU 130 HN LEU 130 -3.509 -2.289 3.200 962 HA LEU 130 HA LEU 130 -1.950 -1.282 0.908 963 HG LEU 130 HG LEU 130 -1.130 0.941 0.912 964 HB2 LEU 130 HB2 LEU 130 -2.257 -0.031 3.500 965 HB3 LEU 130 HB1 LEU 130 -0.579 -0.288 3.092 966 HD11 LEU 130 HD11 LEU 130 -2.975 2.515 1.021 967 HD12 LEU 130 HD12 LEU 130 -3.470 1.843 2.574 968 HD13 LEU 130 HD13 LEU 130 -3.559 0.853 1.116 969 HD21 LEU 130 HD21 LEU 130 0.244 1.830 2.727 970 HD22 LEU 130 HD22 LEU 130 -1.209 2.428 3.528 971 HD23 LEU 130 HD23 LEU 130 -0.726 3.091 1.967 972 H VAL 131 HN VAL 131 -2.422 -3.924 2.518 973 HA VAL 131 HA VAL 131 0.195 -4.410 3.613 974 HB VAL 131 HB VAL 131 -0.511 -6.722 3.975 975 HG11 VAL 131 HG11 VAL 131 -1.138 -5.035 5.616 976 HG12 VAL 131 HG12 VAL 131 -2.357 -6.304 5.513 977 HG13 VAL 131 HG13 VAL 131 -2.648 -4.744 4.748 978 HG21 VAL 131 HG21 VAL 131 -3.039 -5.957 2.522 979 HG22 VAL 131 HG22 VAL 131 -2.785 -7.455 3.419 980 HG23 VAL 131 HG23 VAL 131 -1.822 -7.116 1.980 981 HA PRO 132 HA PRO 132 1.913 -5.315 -0.410 982 HB2 PRO 132 HB2 PRO 132 4.412 -5.929 0.511 983 HB3 PRO 132 HB1 PRO 132 3.842 -4.277 0.255 984 HG2 PRO 132 HG2 PRO 132 3.998 -5.854 2.792 985 HG3 PRO 132 HG1 PRO 132 4.412 -4.153 2.502 986 HD2 PRO 132 HD2 PRO 132 2.088 -4.893 3.659 987 HD3 PRO 132 HD1 PRO 132 2.209 -3.466 2.596 988 HA PRO 133 HA PRO 133 1.048 -9.773 -0.127 989 HB2 PRO 133 HB2 PRO 133 2.000 -9.457 -2.939 990 HB3 PRO 133 HB1 PRO 133 0.586 -10.323 -2.318 991 HG2 PRO 133 HG2 PRO 133 0.301 -7.968 -3.505 992 HG3 PRO 133 HG1 PRO 133 -0.657 -8.377 -2.065 993 HD2 PRO 133 HD2 PRO 133 1.729 -6.589 -2.322 994 HD3 PRO 133 HD1 PRO 133 0.290 -6.416 -1.289 995 H SER 134 HN SER 134 3.950 -8.143 -1.238 996 HA SER 134 HA SER 134 5.687 -10.288 -1.532 997 HG SER 134 HG SER 134 8.392 -7.995 -1.360 998 HB2 SER 134 HB2 SER 134 6.176 -7.875 -2.042 999 HB3 SER 134 HB1 SER 134 6.392 -7.606 -0.314 1000 H LYS 135 HN LYS 135 4.494 -8.773 1.452 1001 HA LYS 135 HA LYS 135 6.197 -10.626 2.968 1002 HB2 LYS 135 HB2 LYS 135 5.632 -9.320 4.978 1003 HB3 LYS 135 HB1 LYS 135 6.420 -8.373 3.734 1004 HG2 LYS 135 HG2 LYS 135 4.778 -6.972 4.610 1005 HG3 LYS 135 HG1 LYS 135 4.110 -7.557 3.083 1006 HD2 LYS 135 HD2 LYS 135 2.490 -7.508 4.979 1007 HD3 LYS 135 HD1 LYS 135 2.669 -9.081 4.212 1008 HE2 LYS 135 HE2 LYS 135 2.602 -9.461 6.556 1009 HE3 LYS 135 HE1 LYS 135 4.274 -9.693 6.054 1010 HZ1 LYS 135 HZ1 LYS 135 4.822 -7.526 6.911 1011 HZ2 LYS 135 HZ2 LYS 135 4.058 -8.429 8.124 1012 HZ3 LYS 135 HZ3 LYS 135 3.199 -7.218 7.302 1013 H ARG 136 HN ARG 136 3.363 -10.753 1.545 1014 HA ARG 136 HA ARG 136 2.001 -12.133 3.733 1015 HE ARG 136 HE ARG 136 -1.370 -10.983 4.524 1016 HB2 ARG 136 HB2 ARG 136 1.017 -11.569 0.932 1017 HB3 ARG 136 HB1 ARG 136 0.079 -12.316 2.216 1018 HG2 ARG 136 HG2 ARG 136 1.050 -9.485 2.026 1019 HG3 ARG 136 HG1 ARG 136 -0.608 -10.075 2.140 1020 HD2 ARG 136 HD2 ARG 136 1.484 -10.257 4.305 1021 HD3 ARG 136 HD1 ARG 136 0.158 -9.101 4.252 1022 HH11 ARG 136 HH11 ARG 136 2.021 -11.549 5.262 1023 HH12 ARG 136 HH12 ARG 136 1.702 -12.864 6.352 1024 HH21 ARG 136 HH21 ARG 136 -1.794 -12.686 5.972 1025 HH22 ARG 136 HH22 ARG 136 -0.485 -13.502 6.770 1026 H ARG 137 HN ARG 137 3.861 -13.684 3.625 1027 HA ARG 137 HA ARG 137 3.767 -15.614 1.476 1028 HE ARG 137 HE ARG 137 7.488 -14.485 4.086 1029 HB2 ARG 137 HB2 ARG 137 5.430 -15.289 3.938 1030 HB3 ARG 137 HB1 ARG 137 5.306 -16.887 3.219 1031 HG2 ARG 137 HG2 ARG 137 7.172 -16.095 2.196 1032 HG3 ARG 137 HG1 ARG 137 5.949 -15.620 1.024 1033 HD2 ARG 137 HD2 ARG 137 7.396 -13.753 1.326 1034 HD3 ARG 137 HD1 ARG 137 5.883 -13.387 2.145 1035 HH11 ARG 137 HH11 ARG 137 7.748 -11.733 1.908 1036 HH12 ARG 137 HH12 ARG 137 8.748 -10.824 3.002 1037 HH21 ARG 137 HH21 ARG 137 8.792 -13.243 5.510 1038 HH22 ARG 137 HH22 ARG 137 9.293 -11.641 5.038 1039 H HIS 138 HN HIS 138 1.858 -16.682 1.458 1040 HA HIS 138 HA HIS 138 1.089 -18.064 3.926 1041 HD1 HIS 138 HD1 HIS 138 -2.138 -17.802 4.513 1042 HD2 HIS 138 HD2 HIS 138 -1.207 -20.646 1.619 1043 HE1 HIS 138 HE1 HIS 138 -3.613 -19.781 5.003 1044 HE2 HIS 138 HE2 HIS 138 -2.923 -21.541 3.336 1045 HB2 HIS 138 HB2 HIS 138 -0.696 -16.896 2.634 1046 HB3 HIS 138 HB1 HIS 138 -0.367 -17.948 1.264 1047 H GLU 139 HN GLU 139 2.635 -19.639 4.071 1048 HA GLU 139 HA GLU 139 2.735 -21.574 1.861 1049 HB2 GLU 139 HB2 GLU 139 4.744 -21.206 4.089 1050 HB3 GLU 139 HB1 GLU 139 4.909 -22.250 2.685 1051 HG2 GLU 139 HG2 GLU 139 4.829 -19.239 2.669 1052 HG3 GLU 139 HG1 GLU 139 6.246 -20.253 2.420 Start of MODEL 10 1 H1 GLY 1 HT1 GLY 1 -13.227 -10.207 64.564 2 H2 GLY 1 HT2 GLY 1 -14.672 -10.038 63.693 3 H3 GLY 1 HT3 GLY 1 -14.027 -8.711 64.527 4 HA2 GLY 1 HA1 GLY 1 -13.641 -8.571 62.122 5 HA3 GLY 1 HA2 GLY 1 -12.155 -8.595 63.060 6 HA PRO 2 HA PRO 2 -12.106 -12.080 59.859 7 HB2 PRO 2 HB2 PRO 2 -9.952 -10.547 58.586 8 HB3 PRO 2 HB1 PRO 2 -11.399 -11.255 57.863 9 HG2 PRO 2 HG2 PRO 2 -11.092 -8.588 58.135 10 HG3 PRO 2 HG1 PRO 2 -12.674 -9.377 58.249 11 HD2 PRO 2 HD2 PRO 2 -10.875 -8.411 60.442 12 HD3 PRO 2 HD1 PRO 2 -12.641 -8.264 60.287 13 H LEU 3 HN LEU 3 -11.084 -13.602 61.026 14 HA LEU 3 HA LEU 3 -8.333 -13.039 61.937 15 HG LEU 3 HG LEU 3 -8.934 -14.574 65.249 16 HB2 LEU 3 HB2 LEU 3 -10.294 -13.497 63.605 17 HB3 LEU 3 HB1 LEU 3 -10.086 -15.168 63.130 18 HD11 LEU 3 HD11 LEU 3 -7.086 -15.385 63.009 19 HD12 LEU 3 HD12 LEU 3 -8.131 -16.459 63.940 20 HD13 LEU 3 HD13 LEU 3 -6.795 -15.625 64.733 21 HD21 LEU 3 HD21 LEU 3 -8.340 -12.274 64.656 22 HD22 LEU 3 HD22 LEU 3 -7.175 -12.883 63.478 23 HD23 LEU 3 HD23 LEU 3 -6.941 -13.199 65.198 24 H GLY 4 HN GLY 4 -6.976 -13.933 60.516 25 HA2 GLY 4 HA2 GLY 4 -5.756 -15.834 59.821 26 HA3 GLY 4 HA1 GLY 4 -7.191 -16.818 60.069 27 H SER 5 HN SER 5 -8.064 -14.045 58.500 28 HA SER 5 HA SER 5 -8.592 -15.437 56.060 29 HG SER 5 HG SER 5 -10.612 -14.864 56.870 30 HB2 SER 5 HB2 SER 5 -8.996 -12.542 56.847 31 HB3 SER 5 HB1 SER 5 -9.586 -13.262 55.348 32 H GLU 6 HN GLU 6 -7.500 -15.455 54.249 33 HA GLU 6 HA GLU 6 -4.857 -14.445 54.134 34 HB2 GLU 6 HB2 GLU 6 -6.665 -15.790 52.136 35 HB3 GLU 6 HB1 GLU 6 -5.064 -15.211 51.687 36 HG2 GLU 6 HG2 GLU 6 -5.524 -17.098 53.972 37 HG3 GLU 6 HG1 GLU 6 -5.255 -17.645 52.315 38 H SER 7 HN SER 7 -4.330 -12.412 53.801 39 HA SER 7 HA SER 7 -6.065 -10.526 52.532 40 HG SER 7 HG SER 7 -3.842 -10.620 55.127 41 HB2 SER 7 HB2 SER 7 -3.127 -10.164 53.167 42 HB3 SER 7 HB1 SER 7 -4.351 -8.907 52.985 43 H LEU 8 HN LEU 8 -6.421 -10.689 50.427 44 HA LEU 8 HA LEU 8 -4.370 -11.719 48.659 45 HG LEU 8 HG LEU 8 -5.768 -10.758 46.032 46 HB2 LEU 8 HB2 LEU 8 -6.703 -12.414 48.383 47 HB3 LEU 8 HB1 LEU 8 -7.172 -10.753 48.090 48 HD11 LEU 8 HD11 LEU 8 -5.011 -12.922 45.149 49 HD12 LEU 8 HD12 LEU 8 -5.481 -13.692 46.667 50 HD13 LEU 8 HD13 LEU 8 -4.188 -12.493 46.650 51 HD21 LEU 8 HD21 LEU 8 -7.901 -12.883 46.204 52 HD22 LEU 8 HD22 LEU 8 -7.294 -12.164 44.713 53 HD23 LEU 8 HD23 LEU 8 -8.155 -11.167 45.884 54 H MET 9 HN MET 9 -3.175 -10.572 47.256 55 HA MET 9 HA MET 9 -3.474 -7.657 47.299 56 HB2 MET 9 HB2 MET 9 -1.154 -9.404 46.454 57 HB3 MET 9 HB1 MET 9 -1.173 -7.653 46.307 58 HG2 MET 9 HG2 MET 9 -1.337 -7.422 48.710 59 HG3 MET 9 HG1 MET 9 -1.430 -9.172 48.895 60 HE1 MET 9 HE1 MET 9 2.144 -10.307 47.760 61 HE2 MET 9 HE2 MET 9 0.710 -10.177 46.741 62 HE3 MET 9 HE3 MET 9 0.573 -10.825 48.375 63 HA PRO 10 HA PRO 10 -5.341 -7.978 43.226 64 HB2 PRO 10 HB2 PRO 10 -5.026 -5.261 42.709 65 HB3 PRO 10 HB1 PRO 10 -6.423 -5.997 43.495 66 HG2 PRO 10 HG2 PRO 10 -4.067 -4.625 44.711 67 HG3 PRO 10 HG1 PRO 10 -5.772 -4.580 45.201 68 HD2 PRO 10 HD2 PRO 10 -3.972 -6.053 46.534 69 HD3 PRO 10 HD1 PRO 10 -5.638 -6.621 46.296 70 H SER 11 HN SER 11 -4.053 -8.914 41.775 71 HA SER 11 HA SER 11 -1.353 -7.955 41.382 72 HG SER 11 HG SER 11 -2.259 -10.089 42.492 73 HB2 SER 11 HB2 SER 11 -2.805 -10.220 39.993 74 HB3 SER 11 HB1 SER 11 -1.064 -9.930 40.000 75 H GLN 12 HN GLN 12 -1.685 -5.930 40.449 76 HA GLN 12 HA GLN 12 -2.998 -5.813 37.853 77 HB2 GLN 12 HB2 GLN 12 -1.581 -3.628 39.390 78 HB3 GLN 12 HB1 GLN 12 -2.557 -3.404 37.947 79 HG2 GLN 12 HG2 GLN 12 -4.520 -4.232 39.205 80 HG3 GLN 12 HG1 GLN 12 -3.518 -4.319 40.652 81 HE21 GLN 12 HE21 GLN 12 -3.216 -1.807 38.246 82 HE22 GLN 12 HE22 GLN 12 -3.806 -0.519 39.234 83 H VAL 13 HN VAL 13 -1.759 -6.825 36.378 84 HA VAL 13 HA VAL 13 1.123 -6.462 36.439 85 HB VAL 13 HB VAL 13 1.144 -8.138 34.582 86 HG11 VAL 13 HG11 VAL 13 -0.274 -8.982 37.100 87 HG12 VAL 13 HG12 VAL 13 1.468 -8.800 36.904 88 HG13 VAL 13 HG13 VAL 13 0.607 -10.046 36.002 89 HG21 VAL 13 HG21 VAL 13 -1.811 -8.311 35.170 90 HG22 VAL 13 HG22 VAL 13 -0.903 -9.440 34.161 91 HG23 VAL 13 HG23 VAL 13 -1.077 -7.755 33.667 92 H VAL 14 HN VAL 14 2.168 -5.041 35.222 93 HA VAL 14 HA VAL 14 0.800 -3.647 33.094 94 HB VAL 14 HB VAL 14 3.714 -3.491 33.911 95 HG11 VAL 14 HG11 VAL 14 3.719 -1.363 32.692 96 HG12 VAL 14 HG12 VAL 14 2.052 -1.647 32.194 97 HG13 VAL 14 HG13 VAL 14 3.335 -2.716 31.626 98 HG21 VAL 14 HG21 VAL 14 3.085 -1.441 35.079 99 HG22 VAL 14 HG22 VAL 14 2.225 -2.838 35.729 100 HG23 VAL 14 HG23 VAL 14 1.397 -1.714 34.653 101 H LYS 15 HN LYS 15 0.362 -4.981 31.479 102 HA LYS 15 HA LYS 15 2.453 -6.808 30.511 103 HB2 LYS 15 HB2 LYS 15 0.461 -7.912 31.367 104 HB3 LYS 15 HB1 LYS 15 -0.567 -6.928 30.342 105 HG2 LYS 15 HG2 LYS 15 0.268 -8.023 28.367 106 HG3 LYS 15 HG1 LYS 15 1.446 -8.920 29.328 107 HD2 LYS 15 HD2 LYS 15 -0.460 -10.330 28.814 108 HD3 LYS 15 HD1 LYS 15 -0.384 -10.010 30.548 109 HE2 LYS 15 HE2 LYS 15 -2.659 -9.804 29.924 110 HE3 LYS 15 HE1 LYS 15 -2.061 -8.163 30.156 111 HZ1 LYS 15 HZ1 LYS 15 -1.797 -7.984 27.740 112 HZ2 LYS 15 HZ2 LYS 15 -3.404 -8.301 28.174 113 HZ3 LYS 15 HZ3 LYS 15 -2.431 -9.545 27.554 114 H GLY 16 HN GLY 16 3.011 -6.824 28.349 115 HA2 GLY 16 HA2 GLY 16 2.402 -4.563 26.737 116 HA3 GLY 16 HA1 GLY 16 3.210 -6.032 26.193 117 H GLY 17 HN GLY 17 0.769 -4.220 25.356 118 HA2 GLY 17 HA2 GLY 17 -0.990 -4.804 23.906 119 HA3 GLY 17 HA1 GLY 17 -0.839 -6.476 24.437 120 H ALA 18 HN ALA 18 -0.975 -3.798 26.656 121 HA ALA 18 HA ALA 18 -3.077 -4.894 28.171 122 HB1 ALA 18 HB1 ALA 18 -1.430 -3.345 29.101 123 HB2 ALA 18 HB2 ALA 18 -3.075 -2.777 29.379 124 HB3 ALA 18 HB3 ALA 18 -2.090 -2.043 28.112 125 H PHE 19 HN PHE 19 -5.194 -4.877 27.857 126 HA PHE 19 HA PHE 19 -6.276 -3.383 25.620 127 HD1 PHE 19 HD2 PHE 19 -7.543 -4.970 23.751 128 HD2 PHE 19 HD1 PHE 19 -9.892 -4.653 27.281 129 HE1 PHE 19 HE2 PHE 19 -9.557 -4.626 22.378 130 HE2 PHE 19 HE1 PHE 19 -11.906 -4.304 25.918 131 HZ PHE 19 HZ PHE 19 -11.741 -4.340 23.449 132 HB2 PHE 19 HB2 PHE 19 -6.772 -5.817 25.983 133 HB3 PHE 19 HB1 PHE 19 -7.673 -5.366 27.425 134 H ASP 20 HN ASP 20 -7.483 -1.604 25.799 135 HA ASP 20 HA ASP 20 -7.761 -0.337 28.337 136 HB2 ASP 20 HB2 ASP 20 -7.344 1.027 26.380 137 HB3 ASP 20 HB1 ASP 20 -8.810 0.435 25.610 138 H GLY 21 HN GLY 21 -9.275 -0.783 29.766 139 HA2 GLY 21 HA2 GLY 21 -11.883 -1.764 28.812 140 HA3 GLY 21 HA1 GLY 21 -11.234 -2.023 30.427 141 H THR 22 HN THR 22 -12.148 0.613 28.232 142 HA THR 22 HA THR 22 -12.636 2.373 30.472 143 HB THR 22 HB THR 22 -11.618 3.184 28.333 144 HG1 THR 22 HG1 THR 22 -12.361 4.992 29.102 145 HG21 THR 22 HG21 THR 22 -13.128 3.653 26.438 146 HG22 THR 22 HG22 THR 22 -14.411 2.768 27.262 147 HG23 THR 22 HG23 THR 22 -12.952 1.924 26.738 148 H MET 23 HN MET 23 -14.643 3.384 30.912 149 HA MET 23 HA MET 23 -16.970 1.787 30.089 150 HB2 MET 23 HB2 MET 23 -18.056 2.501 32.157 151 HB3 MET 23 HB1 MET 23 -16.529 1.709 32.505 152 HG2 MET 23 HG2 MET 23 -16.901 4.694 32.425 153 HG3 MET 23 HG1 MET 23 -17.003 3.719 33.887 154 HE1 MET 23 HE1 MET 23 -15.056 6.217 33.621 155 HE2 MET 23 HE2 MET 23 -13.605 5.563 34.378 156 HE3 MET 23 HE3 MET 23 -15.191 5.207 35.064 157 H ASN 24 HN ASN 24 -18.781 2.811 29.284 158 HA ASN 24 HA ASN 24 -18.242 5.561 28.380 159 HB2 ASN 24 HB2 ASN 24 -18.638 3.608 26.745 160 HB3 ASN 24 HB1 ASN 24 -20.327 3.724 27.226 161 HD21 ASN 24 HD21 ASN 24 -18.977 4.203 24.649 162 HD22 ASN 24 HD22 ASN 24 -19.422 5.818 24.191 163 H GLY 25 HN GLY 25 -19.724 7.193 28.661 164 HA2 GLY 25 HA2 GLY 25 -22.001 7.862 29.208 165 HA3 GLY 25 HA1 GLY 25 -22.043 6.540 30.354 166 HA PRO 26 HA PRO 26 -19.894 9.344 33.264 167 HB2 PRO 26 HB2 PRO 26 -17.189 9.971 32.526 168 HB3 PRO 26 HB1 PRO 26 -17.748 8.801 33.720 169 HG2 PRO 26 HG2 PRO 26 -16.475 8.139 31.377 170 HG3 PRO 26 HG1 PRO 26 -17.552 7.053 32.270 171 HD2 PRO 26 HD2 PRO 26 -18.135 8.747 29.870 172 HD3 PRO 26 HD1 PRO 26 -18.641 7.080 30.221 173 H PHE 27 HN PHE 27 -19.364 10.427 30.036 174 HA PHE 27 HA PHE 27 -19.647 13.212 30.924 175 HD1 PHE 27 HD1 PHE 27 -18.035 15.233 30.802 176 HD2 PHE 27 HD2 PHE 27 -18.103 13.669 26.846 177 HE1 PHE 27 HE1 PHE 27 -17.931 17.519 29.905 178 HE2 PHE 27 HE2 PHE 27 -17.998 15.954 25.940 179 HZ PHE 27 HZ PHE 27 -17.913 17.884 27.466 180 HB2 PHE 27 HB2 PHE 27 -17.333 12.796 30.162 181 HB3 PHE 27 HB1 PHE 27 -17.951 12.213 28.624 182 H GLY 28 HN GLY 28 -20.815 14.583 29.448 183 HA2 GLY 28 HA2 GLY 28 -23.014 13.297 28.186 184 HA3 GLY 28 HA1 GLY 28 -22.624 15.013 28.092 185 H HIS 29 HN HIS 29 -22.988 12.286 26.304 186 HA HIS 29 HA HIS 29 -21.229 13.299 24.180 187 HD1 HIS 29 HD1 HIS 29 -18.260 11.619 24.201 188 HD2 HIS 29 HD2 HIS 29 -21.329 10.254 21.739 189 HE1 HIS 29 HE1 HIS 29 -17.192 11.154 21.973 190 HE2 HIS 29 HE2 HIS 29 -19.029 10.195 20.537 191 HB2 HIS 29 HB2 HIS 29 -20.399 11.196 25.457 192 HB3 HIS 29 HB1 HIS 29 -21.691 10.353 24.613 193 H GLY 30 HN GLY 30 -21.958 12.907 22.063 194 HA2 GLY 30 HA2 GLY 30 -24.724 13.024 21.609 195 HA3 GLY 30 HA1 GLY 30 -23.496 12.737 20.387 196 H TYR 31 HN TYR 31 -25.406 11.419 19.600 197 HA TYR 31 HA TYR 31 -26.308 9.105 20.888 198 HD1 TYR 31 HD1 TYR 31 -28.877 9.829 20.310 199 HD2 TYR 31 HD2 TYR 31 -26.551 11.626 17.238 200 HE1 TYR 31 HE1 TYR 31 -30.414 11.744 20.283 201 HE2 TYR 31 HE2 TYR 31 -28.078 13.557 17.207 202 HH TYR 31 HH TYR 31 -30.408 14.079 17.812 203 HB2 TYR 31 HB2 TYR 31 -26.080 9.436 17.899 204 HB3 TYR 31 HB1 TYR 31 -27.279 8.507 18.793 205 H GLY 32 HN GLY 32 -25.974 6.853 20.001 206 HA2 GLY 32 HA2 GLY 32 -23.353 6.010 20.441 207 HA3 GLY 32 HA1 GLY 32 -24.615 5.037 19.699 208 H GLU 33 HN GLU 33 -21.688 6.607 19.231 209 HA GLU 33 HA GLU 33 -21.908 6.973 16.386 210 HB2 GLU 33 HB2 GLU 33 -19.378 7.399 16.657 211 HB3 GLU 33 HB1 GLU 33 -20.497 8.532 17.404 212 HG2 GLU 33 HG2 GLU 33 -20.177 7.416 19.563 213 HG3 GLU 33 HG1 GLU 33 -19.032 6.305 18.813 214 H GLY 34 HN GLY 34 -21.785 5.386 14.994 215 HA2 GLY 34 HA2 GLY 34 -20.723 2.807 15.790 216 HA3 GLY 34 HA1 GLY 34 -21.565 3.182 14.293 217 H ALA 35 HN ALA 35 -18.781 2.105 15.386 218 HA ALA 35 HA ALA 35 -17.041 3.587 13.576 219 HB1 ALA 35 HB1 ALA 35 -16.388 1.346 15.488 220 HB2 ALA 35 HB2 ALA 35 -16.204 3.067 15.822 221 HB3 ALA 35 HB3 ALA 35 -15.226 2.301 14.569 222 H GLY 36 HN GLY 36 -15.634 2.330 12.103 223 HA2 GLY 36 HA2 GLY 36 -17.131 0.061 10.957 224 HA3 GLY 36 HA1 GLY 36 -16.133 1.168 10.026 225 H GLU 37 HN GLU 37 -16.256 -1.833 11.367 226 HA GLU 37 HA GLU 37 -13.472 -2.092 12.033 227 HB2 GLU 37 HB2 GLU 37 -14.117 -4.569 12.135 228 HB3 GLU 37 HB1 GLU 37 -14.850 -3.486 13.309 229 HG2 GLU 37 HG2 GLU 37 -16.856 -3.376 11.823 230 HG3 GLU 37 HG1 GLU 37 -16.113 -4.630 10.830 231 H GLY 38 HN GLY 38 -12.529 -4.328 10.938 232 HA2 GLY 38 HA2 GLY 38 -11.974 -3.310 8.288 233 HA3 GLY 38 HA1 GLY 38 -11.136 -4.625 9.086 234 H ILE 39 HN ILE 39 -14.309 -3.852 7.726 235 HA ILE 39 HA ILE 39 -14.736 -6.515 6.815 236 HB ILE 39 HB ILE 39 -16.355 -5.285 5.157 237 HG12 ILE 39 HG12 ILE 39 -17.227 -3.156 6.140 238 HG13 ILE 39 HG11 ILE 39 -15.839 -3.120 7.213 239 HG21 ILE 39 HG21 ILE 39 -16.833 -5.345 8.128 240 HG22 ILE 39 HG22 ILE 39 -17.054 -6.688 7.009 241 HG23 ILE 39 HG23 ILE 39 -18.082 -5.260 6.888 242 HD11 ILE 39 HD11 ILE 39 -15.586 -1.628 5.302 243 HD12 ILE 39 HD12 ILE 39 -15.723 -3.006 4.209 244 HD13 ILE 39 HD13 ILE 39 -14.352 -2.887 5.312 245 H ASP 40 HN ASP 40 -14.707 -7.144 4.476 246 HA ASP 40 HA ASP 40 -12.120 -6.405 3.495 247 HB2 ASP 40 HB2 ASP 40 -12.609 -8.069 1.665 248 HB3 ASP 40 HB1 ASP 40 -12.645 -8.707 3.302 249 H ASP 41 HN ASP 41 -12.792 -4.151 3.281 250 HA ASP 41 HA ASP 41 -13.720 -3.621 0.517 251 HB2 ASP 41 HB2 ASP 41 -14.906 -2.401 2.376 252 HB3 ASP 41 HB1 ASP 41 -13.375 -1.658 2.812 253 H VAL 42 HN VAL 42 -11.708 -4.301 -0.372 254 HA VAL 42 HA VAL 42 -9.365 -2.743 0.506 255 HB VAL 42 HB VAL 42 -9.350 -5.594 -0.489 256 HG11 VAL 42 HG11 VAL 42 -7.311 -4.382 -1.056 257 HG12 VAL 42 HG12 VAL 42 -6.995 -5.587 0.193 258 HG13 VAL 42 HG13 VAL 42 -7.127 -3.883 0.625 259 HG21 VAL 42 HG21 VAL 42 -8.971 -4.529 2.307 260 HG22 VAL 42 HG22 VAL 42 -8.780 -6.211 1.810 261 HG23 VAL 42 HG23 VAL 42 -10.363 -5.440 1.723 262 H GLU 43 HN GLU 43 -9.038 -1.289 -1.025 263 HA GLU 43 HA GLU 43 -8.136 -2.370 -3.578 264 HB2 GLU 43 HB2 GLU 43 -10.288 -1.357 -4.146 265 HB3 GLU 43 HB1 GLU 43 -9.838 0.124 -3.306 266 HG2 GLU 43 HG2 GLU 43 -8.006 0.463 -4.918 267 HG3 GLU 43 HG1 GLU 43 -8.514 -0.991 -5.771 268 H TRP 44 HN TRP 44 -5.997 -2.104 -3.223 269 HA TRP 44 HA TRP 44 -5.106 0.312 -1.874 270 HD1 TRP 44 HD1 TRP 44 -3.258 1.550 -1.666 271 HE1 TRP 44 HE1 TRP 44 -0.881 2.108 -0.862 272 HE3 TRP 44 HE3 TRP 44 -1.303 -3.136 -1.613 273 HZ2 TRP 44 HZ2 TRP 44 1.518 0.726 -0.303 274 HZ3 TRP 44 HZ3 TRP 44 1.040 -3.438 -0.980 275 HH2 TRP 44 HH2 TRP 44 2.424 -1.551 -0.313 276 HB2 TRP 44 HB2 TRP 44 -4.050 -1.910 -1.378 277 HB3 TRP 44 HB1 TRP 44 -3.389 -1.891 -3.013 278 H VAL 45 HN VAL 45 -4.196 1.968 -2.768 279 HA VAL 45 HA VAL 45 -4.582 2.497 -5.518 280 HB VAL 45 HB VAL 45 -2.951 4.113 -3.567 281 HG11 VAL 45 HG11 VAL 45 -3.707 6.025 -4.896 282 HG12 VAL 45 HG12 VAL 45 -4.601 4.936 -5.955 283 HG13 VAL 45 HG13 VAL 45 -2.843 4.854 -5.894 284 HG21 VAL 45 HG21 VAL 45 -5.949 4.056 -3.914 285 HG22 VAL 45 HG22 VAL 45 -5.068 5.276 -2.997 286 HG23 VAL 45 HG23 VAL 45 -5.045 3.592 -2.472 287 H VAL 46 HN VAL 46 -2.098 0.834 -3.963 288 HA VAL 46 HA VAL 46 -0.027 1.700 -5.779 289 HB VAL 46 HB VAL 46 -0.101 -0.293 -3.515 290 HG11 VAL 46 HG11 VAL 46 1.046 -1.486 -5.316 291 HG12 VAL 46 HG12 VAL 46 2.160 -1.021 -4.030 292 HG13 VAL 46 HG13 VAL 46 2.129 -0.111 -5.540 293 HG21 VAL 46 HG21 VAL 46 1.779 1.956 -4.225 294 HG22 VAL 46 HG22 VAL 46 1.753 1.036 -2.721 295 HG23 VAL 46 HG23 VAL 46 0.401 2.088 -3.134 296 H GLY 47 HN GLY 47 -2.386 -0.867 -5.672 297 HA2 GLY 47 HA2 GLY 47 -1.155 -2.605 -7.507 298 HA3 GLY 47 HA1 GLY 47 -2.900 -2.458 -7.263 299 H LYS 48 HN LYS 48 -2.533 0.499 -7.970 300 HA LYS 48 HA LYS 48 -2.647 0.127 -10.861 301 HB2 LYS 48 HB2 LYS 48 -3.582 2.512 -10.718 302 HB3 LYS 48 HB1 LYS 48 -4.596 1.188 -10.179 303 HG2 LYS 48 HG2 LYS 48 -4.177 1.734 -7.887 304 HG3 LYS 48 HG1 LYS 48 -2.946 2.907 -8.355 305 HD2 LYS 48 HD2 LYS 48 -5.078 3.968 -7.734 306 HD3 LYS 48 HD1 LYS 48 -4.607 4.307 -9.397 307 HE2 LYS 48 HE2 LYS 48 -6.939 3.842 -9.420 308 HE3 LYS 48 HE1 LYS 48 -6.130 2.437 -10.110 309 HZ1 LYS 48 HZ1 LYS 48 -7.845 1.754 -8.582 310 HZ2 LYS 48 HZ2 LYS 48 -7.167 2.680 -7.335 311 HZ3 LYS 48 HZ3 LYS 48 -6.332 1.331 -7.945 312 H ASP 49 HN ASP 49 -0.769 1.705 -8.387 313 HA ASP 49 HA ASP 49 0.533 3.411 -10.400 314 HB2 ASP 49 HB2 ASP 49 -0.622 4.366 -8.284 315 HB3 ASP 49 HB1 ASP 49 0.778 3.755 -7.414 316 H LYS 50 HN LYS 50 0.939 0.523 -9.189 317 HA LYS 50 HA LYS 50 3.451 0.388 -8.006 318 HB2 LYS 50 HB2 LYS 50 1.764 -1.449 -8.021 319 HB3 LYS 50 HB1 LYS 50 2.130 -1.722 -9.722 320 HG2 LYS 50 HG2 LYS 50 4.412 -2.316 -9.164 321 HG3 LYS 50 HG1 LYS 50 4.103 -1.979 -7.459 322 HD2 LYS 50 HD2 LYS 50 2.488 -3.781 -7.374 323 HD3 LYS 50 HD1 LYS 50 2.679 -4.070 -9.107 324 HE2 LYS 50 HE2 LYS 50 4.855 -4.347 -7.034 325 HE3 LYS 50 HE1 LYS 50 3.942 -5.674 -7.743 326 HZ1 LYS 50 HZ1 LYS 50 6.178 -5.245 -8.742 327 HZ2 LYS 50 HZ2 LYS 50 5.558 -3.795 -9.362 328 HZ3 LYS 50 HZ3 LYS 50 4.889 -5.268 -9.847 329 HA PRO 51 HA PRO 51 5.208 -0.578 -12.472 330 HB2 PRO 51 HB2 PRO 51 3.986 0.909 -14.450 331 HB3 PRO 51 HB1 PRO 51 3.675 -0.803 -14.128 332 HG2 PRO 51 HG2 PRO 51 2.112 1.596 -13.279 333 HG3 PRO 51 HG1 PRO 51 1.534 0.021 -13.848 334 HD2 PRO 51 HD2 PRO 51 1.528 0.668 -11.243 335 HD3 PRO 51 HD1 PRO 51 1.870 -0.990 -11.792 336 H THR 52 HN THR 52 3.917 2.468 -11.379 337 HA THR 52 HA THR 52 5.926 4.064 -12.671 338 HB THR 52 HB THR 52 3.922 4.757 -10.507 339 HG1 THR 52 HG1 THR 52 3.994 4.953 -13.328 340 HG21 THR 52 HG21 THR 52 5.903 6.238 -10.426 341 HG22 THR 52 HG22 THR 52 4.447 7.089 -10.946 342 HG23 THR 52 HG23 THR 52 5.663 6.616 -12.132 343 H TYR 53 HN TYR 53 5.432 2.626 -9.485 344 HA TYR 53 HA TYR 53 7.811 3.888 -8.434 345 HD1 TYR 53 HD2 TYR 53 6.416 5.208 -6.977 346 HD2 TYR 53 HD1 TYR 53 4.302 1.550 -6.494 347 HE1 TYR 53 HE2 TYR 53 4.439 6.447 -6.194 348 HE2 TYR 53 HE1 TYR 53 2.331 2.784 -5.723 349 HH TYR 53 HH TYR 53 1.799 5.874 -6.236 350 HB2 TYR 53 HB2 TYR 53 6.409 1.476 -7.331 351 HB3 TYR 53 HB1 TYR 53 7.462 2.594 -6.506 352 H ASP 54 HN ASP 54 6.908 1.006 -10.078 353 HA ASP 54 HA ASP 54 9.286 -0.499 -9.490 354 HB2 ASP 54 HB2 ASP 54 7.291 -1.703 -10.040 355 HB3 ASP 54 HB1 ASP 54 7.041 -0.771 -11.506 356 H GLU 55 HN GLU 55 8.215 1.644 -12.099 357 HA GLU 55 HA GLU 55 10.458 1.261 -13.782 358 HB2 GLU 55 HB2 GLU 55 9.780 3.265 -14.910 359 HB3 GLU 55 HB1 GLU 55 8.326 2.381 -14.465 360 HG2 GLU 55 HG2 GLU 55 8.057 3.852 -12.496 361 HG3 GLU 55 HG1 GLU 55 9.476 4.763 -13.049 362 H ILE 56 HN ILE 56 9.808 3.548 -11.129 363 HA ILE 56 HA ILE 56 12.357 4.801 -11.289 364 HB ILE 56 HB ILE 56 10.614 4.510 -8.832 365 HG12 ILE 56 HG12 ILE 56 10.686 6.761 -10.855 366 HG13 ILE 56 HG11 ILE 56 9.451 5.496 -10.828 367 HG21 ILE 56 HG21 ILE 56 11.759 6.578 -8.100 368 HG22 ILE 56 HG22 ILE 56 12.787 6.492 -9.532 369 HG23 ILE 56 HG23 ILE 56 12.877 5.229 -8.306 370 HD11 ILE 56 HD11 ILE 56 8.790 6.232 -8.587 371 HD12 ILE 56 HD12 ILE 56 8.644 7.520 -9.782 372 HD13 ILE 56 HD13 ILE 56 10.002 7.510 -8.654 373 H PHE 57 HN PHE 57 11.126 1.942 -9.733 374 HA PHE 57 HA PHE 57 13.194 1.269 -8.009 375 HD1 PHE 57 HD2 PHE 57 12.895 -0.854 -6.287 376 HD2 PHE 57 HD1 PHE 57 12.110 -2.464 -10.147 377 HE1 PHE 57 HE2 PHE 57 13.892 -2.992 -5.599 378 HE2 PHE 57 HE1 PHE 57 13.099 -4.605 -9.458 379 HZ PHE 57 HZ PHE 57 13.993 -4.872 -7.188 380 HB2 PHE 57 HB2 PHE 57 11.130 0.090 -7.913 381 HB3 PHE 57 HB1 PHE 57 11.250 -0.404 -9.594 382 H TYR 58 HN TYR 58 12.767 0.124 -11.392 383 HA TYR 58 HA TYR 58 15.343 -1.091 -11.455 384 HD1 TYR 58 HD1 TYR 58 11.727 -1.554 -12.302 385 HD2 TYR 58 HD2 TYR 58 15.277 -3.410 -13.717 386 HE1 TYR 58 HE1 TYR 58 10.718 -3.753 -11.925 387 HE2 TYR 58 HE2 TYR 58 14.273 -5.625 -13.338 388 HH TYR 58 HH TYR 58 10.896 -5.975 -12.538 389 HB2 TYR 58 HB2 TYR 58 13.417 -0.316 -13.645 390 HB3 TYR 58 HB1 TYR 58 14.979 -1.074 -13.981 391 H THR 59 HN THR 59 14.205 2.096 -11.923 392 HA THR 59 HA THR 59 16.389 3.109 -13.431 393 HB THR 59 HB THR 59 14.285 4.438 -11.710 394 HG1 THR 59 HG1 THR 59 13.406 3.663 -13.580 395 HG21 THR 59 HG21 THR 59 14.926 6.558 -12.750 396 HG22 THR 59 HG22 THR 59 16.324 5.769 -13.489 397 HG23 THR 59 HG23 THR 59 16.213 5.908 -11.735 398 H LEU 60 HN LEU 60 15.949 2.330 -10.087 399 HA LEU 60 HA LEU 60 18.215 3.943 -9.232 400 HG LEU 60 HG LEU 60 15.197 3.950 -8.078 401 HB2 LEU 60 HB2 LEU 60 16.485 1.972 -7.741 402 HB3 LEU 60 HB1 LEU 60 17.801 2.884 -7.015 403 HD11 LEU 60 HD11 LEU 60 15.270 2.947 -5.814 404 HD12 LEU 60 HD12 LEU 60 14.890 4.670 -5.802 405 HD13 LEU 60 HD13 LEU 60 16.511 4.118 -5.375 406 HD21 LEU 60 HD21 LEU 60 16.032 6.177 -7.465 407 HD22 LEU 60 HD22 LEU 60 16.980 5.467 -8.772 408 HD23 LEU 60 HD23 LEU 60 17.618 5.484 -7.129 409 H SER 61 HN SER 61 17.945 1.152 -10.867 410 HA SER 61 HA SER 61 19.288 -0.612 -11.324 411 HG SER 61 HG SER 61 22.180 -1.157 -10.029 412 HB2 SER 61 HB2 SER 61 21.097 1.094 -11.331 413 HB3 SER 61 HB1 SER 61 21.351 0.804 -9.612 414 HA PRO 62 HA PRO 62 18.375 -2.634 -7.310 415 HB2 PRO 62 HB2 PRO 62 16.624 -4.447 -8.270 416 HB3 PRO 62 HB1 PRO 62 16.141 -2.799 -7.840 417 HG2 PRO 62 HG2 PRO 62 16.603 -4.001 -10.524 418 HG3 PRO 62 HG1 PRO 62 15.433 -2.768 -10.028 419 HD2 PRO 62 HD2 PRO 62 17.846 -2.279 -11.327 420 HD3 PRO 62 HD1 PRO 62 16.885 -1.080 -10.439 421 H VAL 63 HN VAL 63 18.709 -4.984 -6.729 422 HA VAL 63 HA VAL 63 20.330 -6.382 -8.692 423 HB VAL 63 HB VAL 63 21.873 -6.987 -6.720 424 HG11 VAL 63 HG11 VAL 63 22.606 -5.699 -8.654 425 HG12 VAL 63 HG12 VAL 63 23.326 -5.070 -7.172 426 HG13 VAL 63 HG13 VAL 63 21.970 -4.225 -7.918 427 HG21 VAL 63 HG21 VAL 63 20.773 -4.370 -5.701 428 HG22 VAL 63 HG22 VAL 63 22.112 -5.285 -5.004 429 HG23 VAL 63 HG23 VAL 63 20.480 -5.952 -4.976 430 H ASN 64 HN ASN 64 19.575 -8.320 -8.970 431 HA ASN 64 HA ASN 64 18.694 -10.375 -8.551 432 HB2 ASN 64 HB2 ASN 64 20.371 -10.530 -6.786 433 HB3 ASN 64 HB1 ASN 64 19.333 -9.635 -5.677 434 HD21 ASN 64 HD21 ASN 64 17.677 -10.650 -4.688 435 HD22 ASN 64 HD22 ASN 64 17.485 -12.373 -4.672 436 H GLY 65 HN GLY 65 17.186 -7.725 -8.375 437 HA2 GLY 65 HA2 GLY 65 14.879 -7.611 -8.774 438 HA3 GLY 65 HA1 GLY 65 14.654 -9.083 -7.855 439 H LYS 66 HN LYS 66 16.526 -6.472 -6.485 440 HA LYS 66 HA LYS 66 14.325 -5.063 -5.370 441 HB2 LYS 66 HB2 LYS 66 14.311 -5.716 -3.137 442 HB3 LYS 66 HB1 LYS 66 14.466 -7.241 -3.985 443 HG2 LYS 66 HG2 LYS 66 16.643 -5.722 -2.576 444 HG3 LYS 66 HG1 LYS 66 15.906 -7.245 -2.077 445 HD2 LYS 66 HD2 LYS 66 16.808 -8.304 -4.129 446 HD3 LYS 66 HD1 LYS 66 17.549 -6.773 -4.547 447 HE2 LYS 66 HE2 LYS 66 19.007 -6.851 -2.691 448 HE3 LYS 66 HE1 LYS 66 18.127 -8.198 -1.965 449 HZ1 LYS 66 HZ1 LYS 66 19.278 -8.527 -4.636 450 HZ2 LYS 66 HZ2 LYS 66 19.030 -9.687 -3.415 451 HZ3 LYS 66 HZ3 LYS 66 20.321 -8.594 -3.297 452 H ILE 67 HN ILE 67 15.012 -3.218 -4.058 453 HA ILE 67 HA ILE 67 17.755 -2.463 -4.706 454 HB ILE 67 HB ILE 67 17.032 -0.252 -3.563 455 HG12 ILE 67 HG12 ILE 67 14.374 -1.585 -4.083 456 HG13 ILE 67 HG11 ILE 67 14.992 -0.983 -2.548 457 HG21 ILE 67 HG21 ILE 67 16.061 0.551 -5.687 458 HG22 ILE 67 HG22 ILE 67 15.901 -1.120 -6.230 459 HG23 ILE 67 HG23 ILE 67 17.500 -0.436 -5.936 460 HD11 ILE 67 HD11 ILE 67 14.240 0.680 -4.939 461 HD12 ILE 67 HD12 ILE 67 14.870 1.297 -3.410 462 HD13 ILE 67 HD13 ILE 67 13.304 0.491 -3.455 463 H THR 68 HN THR 68 19.373 -2.464 -3.330 464 HA THR 68 HA THR 68 19.010 -3.523 -0.726 465 HB THR 68 HB THR 68 21.523 -2.499 -0.661 466 HG1 THR 68 HG1 THR 68 22.258 -2.966 -2.921 467 HG21 THR 68 HG21 THR 68 22.286 -4.708 -1.365 468 HG22 THR 68 HG22 THR 68 20.704 -5.052 -2.065 469 HG23 THR 68 HG23 THR 68 20.873 -4.856 -0.320 470 H GLY 69 HN GLY 69 17.483 -1.976 -0.020 471 HA2 GLY 69 HA2 GLY 69 16.840 -0.406 1.458 472 HA3 GLY 69 HA1 GLY 69 18.357 -0.788 2.253 473 H ALA 70 HN ALA 70 20.257 0.491 1.437 474 HA ALA 70 HA ALA 70 19.957 3.149 2.016 475 HB1 ALA 70 HB1 ALA 70 22.049 1.936 0.228 476 HB2 ALA 70 HB2 ALA 70 22.096 2.001 1.989 477 HB3 ALA 70 HB3 ALA 70 22.169 3.492 1.050 478 H ASN 71 HN ASN 71 19.461 1.663 -1.118 479 HA ASN 71 HA ASN 71 19.523 4.087 -2.630 480 HB2 ASN 71 HB2 ASN 71 18.036 1.576 -3.416 481 HB3 ASN 71 HB1 ASN 71 18.731 2.808 -4.476 482 HD21 ASN 71 HD21 ASN 71 19.279 -0.036 -2.659 483 HD22 ASN 71 HD22 ASN 71 20.925 -0.279 -3.097 484 H ALA 72 HN ALA 72 16.961 2.142 -1.156 485 HA ALA 72 HA ALA 72 14.836 3.855 -2.020 486 HB1 ALA 72 HB1 ALA 72 14.912 1.837 0.217 487 HB2 ALA 72 HB2 ALA 72 14.426 1.519 -1.448 488 HB3 ALA 72 HB3 ALA 72 13.463 2.599 -0.437 489 H LYS 73 HN LYS 73 16.885 3.597 0.799 490 HA LYS 73 HA LYS 73 15.636 5.566 2.376 491 HB2 LYS 73 HB2 LYS 73 18.537 4.726 2.266 492 HB3 LYS 73 HB1 LYS 73 17.825 5.728 3.529 493 HG2 LYS 73 HG2 LYS 73 17.088 2.878 2.883 494 HG3 LYS 73 HG1 LYS 73 18.031 3.431 4.267 495 HD2 LYS 73 HD2 LYS 73 15.252 4.433 3.744 496 HD3 LYS 73 HD1 LYS 73 15.550 2.947 4.647 497 HE2 LYS 73 HE2 LYS 73 16.763 4.110 6.319 498 HE3 LYS 73 HE1 LYS 73 16.788 5.599 5.367 499 HZ1 LYS 73 HZ1 LYS 73 14.521 4.345 6.795 500 HZ2 LYS 73 HZ2 LYS 73 14.271 5.507 5.587 501 HZ3 LYS 73 HZ3 LYS 73 15.150 5.906 6.976 502 H LYS 74 HN LYS 74 18.110 5.665 -0.106 503 HA LYS 74 HA LYS 74 18.822 8.341 -0.090 504 HB2 LYS 74 HB2 LYS 74 19.541 6.291 -1.579 505 HB3 LYS 74 HB1 LYS 74 18.311 6.916 -2.669 506 HG2 LYS 74 HG2 LYS 74 20.333 7.840 -3.391 507 HG3 LYS 74 HG1 LYS 74 19.514 9.138 -2.514 508 HD2 LYS 74 HD2 LYS 74 21.846 9.033 -1.887 509 HD3 LYS 74 HD1 LYS 74 20.833 8.612 -0.517 510 HE2 LYS 74 HE2 LYS 74 22.763 7.122 -0.688 511 HE3 LYS 74 HE1 LYS 74 21.252 6.246 -0.921 512 HZ1 LYS 74 HZ1 LYS 74 21.646 6.423 -3.353 513 HZ2 LYS 74 HZ2 LYS 74 22.815 5.505 -2.540 514 HZ3 LYS 74 HZ3 LYS 74 23.172 7.091 -3.022 515 H GLU 75 HN GLU 75 16.209 6.715 -1.751 516 HA GLU 75 HA GLU 75 15.092 8.939 -3.007 517 HB2 GLU 75 HB2 GLU 75 13.670 6.443 -2.118 518 HB3 GLU 75 HB1 GLU 75 13.046 7.614 -3.268 519 HG2 GLU 75 HG2 GLU 75 15.287 5.662 -3.598 520 HG3 GLU 75 HG1 GLU 75 13.867 5.923 -4.609 521 H MET 76 HN MET 76 14.185 7.489 0.103 522 HA MET 76 HA MET 76 12.202 9.475 0.613 523 HB2 MET 76 HB2 MET 76 12.314 8.572 2.986 524 HB3 MET 76 HB1 MET 76 11.887 7.425 1.727 525 HG2 MET 76 HG2 MET 76 14.139 6.558 1.724 526 HG3 MET 76 HG1 MET 76 14.615 7.741 2.932 527 HE1 MET 76 HE1 MET 76 11.341 5.476 2.606 528 HE2 MET 76 HE2 MET 76 11.824 4.130 3.637 529 HE3 MET 76 HE3 MET 76 12.707 4.459 2.146 530 H VAL 77 HN VAL 77 15.613 9.472 0.891 531 HA VAL 77 HA VAL 77 15.810 11.689 2.709 532 HB VAL 77 HB VAL 77 17.782 10.601 0.688 533 HG11 VAL 77 HG11 VAL 77 18.264 12.948 0.924 534 HG12 VAL 77 HG12 VAL 77 19.471 12.033 1.829 535 HG13 VAL 77 HG13 VAL 77 18.156 12.842 2.681 536 HG21 VAL 77 HG21 VAL 77 17.734 10.498 3.707 537 HG22 VAL 77 HG22 VAL 77 18.997 9.833 2.668 538 HG23 VAL 77 HG23 VAL 77 17.368 9.162 2.614 539 H LYS 78 HN LYS 78 15.977 11.357 -0.836 540 HA LYS 78 HA LYS 78 16.308 14.144 -1.321 541 HB2 LYS 78 HB2 LYS 78 16.121 13.624 -3.631 542 HB3 LYS 78 HB1 LYS 78 16.939 12.257 -2.895 543 HG2 LYS 78 HG2 LYS 78 14.343 11.487 -2.726 544 HG3 LYS 78 HG1 LYS 78 14.350 12.407 -4.229 545 HD2 LYS 78 HD2 LYS 78 16.299 10.211 -3.588 546 HD3 LYS 78 HD1 LYS 78 14.808 9.970 -4.496 547 HE2 LYS 78 HE2 LYS 78 15.656 11.704 -6.113 548 HE3 LYS 78 HE1 LYS 78 17.195 11.627 -5.248 549 HZ1 LYS 78 HZ1 LYS 78 17.519 9.415 -5.881 550 HZ2 LYS 78 HZ2 LYS 78 16.937 10.158 -7.292 551 HZ3 LYS 78 HZ3 LYS 78 15.901 9.198 -6.345 552 H SER 79 HN SER 79 13.628 12.262 -0.465 553 HA SER 79 HA SER 79 11.550 13.867 -1.536 554 HG SER 79 HG SER 79 9.777 13.810 0.334 555 HB2 SER 79 HB2 SER 79 11.136 11.604 -0.670 556 HB3 SER 79 HB1 SER 79 11.578 12.140 0.955 557 H LYS 80 HN LYS 80 13.919 14.513 0.728 558 HA LYS 80 HA LYS 80 14.414 16.321 1.985 559 HB2 LYS 80 HB2 LYS 80 11.919 17.537 0.782 560 HB3 LYS 80 HB1 LYS 80 13.185 18.411 1.642 561 HG2 LYS 80 HG2 LYS 80 14.770 17.965 -0.058 562 HG3 LYS 80 HG1 LYS 80 13.688 16.817 -0.850 563 HD2 LYS 80 HD2 LYS 80 12.124 18.677 -1.302 564 HD3 LYS 80 HD1 LYS 80 13.296 19.797 -0.598 565 HE2 LYS 80 HE2 LYS 80 13.372 19.690 -3.082 566 HE3 LYS 80 HE1 LYS 80 14.898 19.279 -2.307 567 HZ1 LYS 80 HZ1 LYS 80 14.117 17.798 -4.204 568 HZ2 LYS 80 HZ2 LYS 80 12.972 17.189 -3.116 569 HZ3 LYS 80 HZ3 LYS 80 14.624 17.025 -2.782 570 H LEU 81 HN LEU 81 13.836 14.706 3.643 571 HA LEU 81 HA LEU 81 11.560 15.618 5.270 572 HG LEU 81 HG LEU 81 11.374 13.523 2.881 573 HB2 LEU 81 HB2 LEU 81 12.455 12.758 5.012 574 HB3 LEU 81 HB1 LEU 81 11.054 13.350 5.877 575 HD11 LEU 81 HD11 LEU 81 9.839 11.502 4.503 576 HD12 LEU 81 HD12 LEU 81 11.321 11.190 3.602 577 HD13 LEU 81 HD13 LEU 81 9.846 11.642 2.747 578 HD21 LEU 81 HD21 LEU 81 8.952 13.920 2.919 579 HD22 LEU 81 HD22 LEU 81 9.840 15.166 3.796 580 HD23 LEU 81 HD23 LEU 81 8.982 13.904 4.682 581 HA PRO 82 HA PRO 82 14.516 15.234 8.652 582 HB2 PRO 82 HB2 PRO 82 12.814 14.842 10.717 583 HB3 PRO 82 HB1 PRO 82 13.015 16.430 9.951 584 HG2 PRO 82 HG2 PRO 82 10.863 14.385 9.544 585 HG3 PRO 82 HG1 PRO 82 10.723 16.143 9.684 586 HD2 PRO 82 HD2 PRO 82 10.675 14.817 7.317 587 HD3 PRO 82 HD1 PRO 82 11.261 16.491 7.488 588 H ASN 83 HN ASN 83 15.149 13.607 10.284 589 HA ASN 83 HA ASN 83 15.178 11.020 9.140 590 HB2 ASN 83 HB2 ASN 83 16.002 11.996 11.877 591 HB3 ASN 83 HB1 ASN 83 16.271 10.353 11.311 592 HD21 ASN 83 HD21 ASN 83 16.853 11.108 8.589 593 HD22 ASN 83 HD22 ASN 83 18.422 11.837 8.603 594 H THR 84 HN THR 84 13.117 12.509 11.492 595 HA THR 84 HA THR 84 11.980 10.249 12.684 596 HB THR 84 HB THR 84 10.197 12.542 12.111 597 HG1 THR 84 HG1 THR 84 11.981 13.264 14.031 598 HG21 THR 84 HG21 THR 84 11.095 11.139 14.634 599 HG22 THR 84 HG22 THR 84 9.584 10.871 13.764 600 HG23 THR 84 HG23 THR 84 9.878 12.415 14.561 601 H VAL 85 HN VAL 85 10.849 12.176 9.915 602 HA VAL 85 HA VAL 85 8.683 10.504 9.210 603 HB VAL 85 HB VAL 85 10.238 12.430 7.477 604 HG11 VAL 85 HG11 VAL 85 8.923 10.794 6.193 605 HG12 VAL 85 HG12 VAL 85 8.289 12.433 6.042 606 HG13 VAL 85 HG13 VAL 85 7.483 11.270 7.093 607 HG21 VAL 85 HG21 VAL 85 9.240 13.446 9.498 608 HG22 VAL 85 HG22 VAL 85 7.665 12.820 9.011 609 HG23 VAL 85 HG23 VAL 85 8.484 14.021 8.012 610 H LEU 86 HN LEU 86 11.999 10.748 7.955 611 HA LEU 86 HA LEU 86 11.922 8.783 6.012 612 HG LEU 86 HG LEU 86 13.490 9.539 4.824 613 HB2 LEU 86 HB2 LEU 86 13.959 10.054 7.645 614 HB3 LEU 86 HB1 LEU 86 14.388 8.410 7.183 615 HD11 LEU 86 HD11 LEU 86 15.184 11.545 6.305 616 HD12 LEU 86 HD12 LEU 86 13.503 11.762 5.812 617 HD13 LEU 86 HD13 LEU 86 14.767 11.606 4.592 618 HD21 LEU 86 HD21 LEU 86 16.273 9.238 5.920 619 HD22 LEU 86 HD22 LEU 86 15.857 9.405 4.211 620 HD23 LEU 86 HD23 LEU 86 15.316 7.992 5.121 621 H GLY 87 HN GLY 87 12.781 8.397 9.444 622 HA2 GLY 87 HA2 GLY 87 13.303 5.643 9.323 623 HA3 GLY 87 HA1 GLY 87 12.895 6.540 10.775 624 H LYS 88 HN LYS 88 10.276 7.394 9.752 625 HA LYS 88 HA LYS 88 8.993 4.885 10.490 626 HB2 LYS 88 HB2 LYS 88 7.052 6.057 11.106 627 HB3 LYS 88 HB1 LYS 88 8.414 6.957 11.736 628 HG2 LYS 88 HG2 LYS 88 8.144 8.669 10.129 629 HG3 LYS 88 HG1 LYS 88 6.994 7.696 9.201 630 HD2 LYS 88 HD2 LYS 88 5.388 7.770 10.988 631 HD3 LYS 88 HD1 LYS 88 6.550 8.551 12.056 632 HE2 LYS 88 HE2 LYS 88 6.525 10.535 10.620 633 HE3 LYS 88 HE1 LYS 88 5.357 9.746 9.558 634 HZ1 LYS 88 HZ1 LYS 88 3.743 9.732 11.283 635 HZ2 LYS 88 HZ2 LYS 88 4.364 11.309 11.227 636 HZ3 LYS 88 HZ3 LYS 88 4.867 10.240 12.443 637 H ILE 89 HN ILE 89 9.363 6.907 7.717 638 HA ILE 89 HA ILE 89 7.313 5.682 6.182 639 HB ILE 89 HB ILE 89 9.847 7.108 5.395 640 HG12 ILE 89 HG12 ILE 89 6.904 7.758 5.151 641 HG13 ILE 89 HG11 ILE 89 8.076 8.539 6.207 642 HG21 ILE 89 HG21 ILE 89 9.124 6.986 3.054 643 HG22 ILE 89 HG22 ILE 89 7.810 5.908 3.525 644 HG23 ILE 89 HG23 ILE 89 9.484 5.392 3.714 645 HD11 ILE 89 HD11 ILE 89 9.246 9.420 4.262 646 HD12 ILE 89 HD12 ILE 89 7.554 9.919 4.280 647 HD13 ILE 89 HD13 ILE 89 8.082 8.628 3.201 648 H TRP 90 HN TRP 90 10.767 5.005 6.680 649 HA TRP 90 HA TRP 90 10.976 2.748 5.042 650 HD1 TRP 90 HD1 TRP 90 13.125 0.868 8.406 651 HE1 TRP 90 HE1 TRP 90 14.382 -1.083 7.250 652 HE3 TRP 90 HE3 TRP 90 13.135 2.623 3.605 653 HZ2 TRP 90 HZ2 TRP 90 15.262 -1.766 4.664 654 HZ3 TRP 90 HZ3 TRP 90 14.204 1.268 1.853 655 HH2 TRP 90 HH2 TRP 90 15.239 -0.882 2.375 656 HB2 TRP 90 HB2 TRP 90 12.929 3.789 6.089 657 HB3 TRP 90 HB1 TRP 90 12.374 3.232 7.666 658 H LYS 91 HN LYS 91 10.215 2.913 8.519 659 HA LYS 91 HA LYS 91 9.960 0.089 8.745 660 HB2 LYS 91 HB2 LYS 91 9.332 0.480 11.027 661 HB3 LYS 91 HB1 LYS 91 10.646 1.569 10.613 662 HG2 LYS 91 HG2 LYS 91 9.135 3.417 10.408 663 HG3 LYS 91 HG1 LYS 91 7.745 2.356 10.645 664 HD2 LYS 91 HD2 LYS 91 7.934 3.071 12.787 665 HD3 LYS 91 HD1 LYS 91 9.130 1.778 12.859 666 HE2 LYS 91 HE2 LYS 91 9.787 4.656 12.249 667 HE3 LYS 91 HE1 LYS 91 9.899 3.934 13.848 668 HZ1 LYS 91 HZ1 LYS 91 11.493 2.327 12.929 669 HZ2 LYS 91 HZ2 LYS 91 12.045 3.932 12.823 670 HZ3 LYS 91 HZ3 LYS 91 11.445 3.149 11.446 671 H LEU 92 HN LEU 92 7.783 2.518 7.712 672 HA LEU 92 HA LEU 92 5.464 0.837 8.261 673 HG LEU 92 HG LEU 92 3.312 2.066 6.915 674 HB2 LEU 92 HB2 LEU 92 5.513 3.391 8.503 675 HB3 LEU 92 HB1 LEU 92 5.461 3.436 6.740 676 HD11 LEU 92 HD11 LEU 92 3.476 2.987 9.779 677 HD12 LEU 92 HD12 LEU 92 3.596 1.315 9.227 678 HD13 LEU 92 HD13 LEU 92 2.091 2.213 9.012 679 HD21 LEU 92 HD21 LEU 92 3.267 4.824 8.127 680 HD22 LEU 92 HD22 LEU 92 1.946 4.014 7.284 681 HD23 LEU 92 HD23 LEU 92 3.401 4.486 6.402 682 H ALA 93 HN ALA 93 7.655 1.653 5.694 683 HA ALA 93 HA ALA 93 5.937 0.760 3.566 684 HB1 ALA 93 HB1 ALA 93 7.854 1.130 2.129 685 HB2 ALA 93 HB2 ALA 93 8.900 1.315 3.539 686 HB3 ALA 93 HB3 ALA 93 7.637 2.501 3.215 687 H ASP 94 HN ASP 94 8.755 -0.489 5.312 688 HA ASP 94 HA ASP 94 8.252 -3.085 4.051 689 HB2 ASP 94 HB2 ASP 94 10.623 -2.196 4.052 690 HB3 ASP 94 HB1 ASP 94 10.622 -2.390 5.805 691 H VAL 95 HN VAL 95 6.946 -4.336 5.065 692 HA VAL 95 HA VAL 95 6.218 -4.023 7.805 693 HB VAL 95 HB VAL 95 5.553 -6.360 6.024 694 HG11 VAL 95 HG11 VAL 95 5.058 -6.672 8.398 695 HG12 VAL 95 HG12 VAL 95 3.579 -6.554 7.444 696 HG13 VAL 95 HG13 VAL 95 4.124 -5.178 8.398 697 HG21 VAL 95 HG21 VAL 95 4.952 -4.303 4.870 698 HG22 VAL 95 HG22 VAL 95 4.101 -3.732 6.304 699 HG23 VAL 95 HG23 VAL 95 3.506 -5.143 5.429 700 H ASP 96 HN ASP 96 8.636 -5.854 6.172 701 HA ASP 96 HA ASP 96 8.884 -7.687 8.467 702 HB2 ASP 96 HB2 ASP 96 9.699 -9.294 7.041 703 HB3 ASP 96 HB1 ASP 96 8.704 -8.365 5.918 704 H LYS 97 HN LYS 97 10.489 -5.241 6.597 705 HA LYS 97 HA LYS 97 12.139 -3.792 7.128 706 HB2 LYS 97 HB2 LYS 97 12.117 -4.841 9.944 707 HB3 LYS 97 HB1 LYS 97 12.439 -3.202 9.371 708 HG2 LYS 97 HG2 LYS 97 10.077 -3.067 8.627 709 HG3 LYS 97 HG1 LYS 97 9.797 -4.632 9.367 710 HD2 LYS 97 HD2 LYS 97 10.637 -3.646 11.530 711 HD3 LYS 97 HD1 LYS 97 10.585 -2.071 10.737 712 HE2 LYS 97 HE2 LYS 97 8.195 -2.302 10.370 713 HE3 LYS 97 HE1 LYS 97 8.222 -3.928 11.052 714 HZ1 LYS 97 HZ1 LYS 97 7.434 -2.399 12.706 715 HZ2 LYS 97 HZ2 LYS 97 8.773 -1.389 12.492 716 HZ3 LYS 97 HZ3 LYS 97 8.979 -2.920 13.173 717 H ASP 98 HN ASP 98 13.372 -5.184 5.773 718 HA ASP 98 HA ASP 98 15.197 -7.032 7.127 719 HB2 ASP 98 HB2 ASP 98 15.598 -7.779 4.690 720 HB3 ASP 98 HB1 ASP 98 14.021 -8.138 5.411 721 H GLY 99 HN GLY 99 15.134 -4.003 5.480 722 HA2 GLY 99 HA2 GLY 99 17.071 -2.541 5.604 723 HA3 GLY 99 HA1 GLY 99 18.091 -3.967 5.464 724 H LEU 100 HN LEU 100 15.474 -4.221 3.426 725 HA LEU 100 HA LEU 100 16.555 -2.636 1.249 726 HG LEU 100 HG LEU 100 16.159 -6.139 2.278 727 HB2 LEU 100 HB2 LEU 100 16.450 -4.615 -0.286 728 HB3 LEU 100 HB1 LEU 100 17.760 -4.647 0.874 729 HD11 LEU 100 HD11 LEU 100 14.946 -6.369 -0.469 730 HD12 LEU 100 HD12 LEU 100 14.141 -5.872 1.025 731 HD13 LEU 100 HD13 LEU 100 14.694 -7.536 0.830 732 HD21 LEU 100 HD21 LEU 100 18.243 -6.899 1.309 733 HD22 LEU 100 HD22 LEU 100 17.451 -7.139 -0.249 734 HD23 LEU 100 HD23 LEU 100 16.990 -8.127 1.138 735 H LEU 101 HN LEU 101 15.012 -3.108 -0.754 736 HA LEU 101 HA LEU 101 12.284 -3.688 0.083 737 HG LEU 101 HG LEU 101 13.180 -0.991 1.333 738 HB2 LEU 101 HB2 LEU 101 13.140 -1.054 -1.136 739 HB3 LEU 101 HB1 LEU 101 11.475 -1.603 -1.098 740 HD11 LEU 101 HD11 LEU 101 12.543 0.996 0.035 741 HD12 LEU 101 HD12 LEU 101 11.751 0.939 1.611 742 HD13 LEU 101 HD13 LEU 101 10.851 0.515 0.152 743 HD21 LEU 101 HD21 LEU 101 11.571 -2.704 1.852 744 HD22 LEU 101 HD22 LEU 101 10.285 -1.772 1.088 745 HD23 LEU 101 HD23 LEU 101 11.051 -1.173 2.560 746 H ASP 102 HN ASP 102 11.489 -5.067 -1.441 747 HA ASP 102 HA ASP 102 12.766 -5.312 -4.003 748 HB2 ASP 102 HB2 ASP 102 11.500 -7.188 -4.353 749 HB3 ASP 102 HB1 ASP 102 11.440 -7.104 -2.598 750 H ASP 103 HN ASP 103 10.810 -5.600 -5.879 751 HA ASP 103 HA ASP 103 10.445 -2.933 -6.712 752 HB2 ASP 103 HB2 ASP 103 9.270 -3.849 -8.598 753 HB3 ASP 103 HB1 ASP 103 10.614 -4.920 -8.182 754 H GLU 104 HN GLU 104 8.317 -5.142 -5.008 755 HA GLU 104 HA GLU 104 6.087 -3.297 -5.204 756 HB2 GLU 104 HB2 GLU 104 5.890 -5.842 -5.175 757 HB3 GLU 104 HB1 GLU 104 6.208 -5.733 -3.449 758 HG2 GLU 104 HG2 GLU 104 4.269 -4.199 -3.242 759 HG3 GLU 104 HG1 GLU 104 3.914 -4.509 -4.954 760 H GLU 105 HN GLU 105 8.449 -4.328 -2.806 761 HA GLU 105 HA GLU 105 7.454 -2.885 -0.613 762 HB2 GLU 105 HB2 GLU 105 9.899 -4.242 -1.353 763 HB3 GLU 105 HB1 GLU 105 10.230 -2.794 -0.419 764 HG2 GLU 105 HG2 GLU 105 9.017 -3.568 1.431 765 HG3 GLU 105 HG1 GLU 105 8.218 -4.827 0.491 766 H PHE 106 HN PHE 106 9.604 -1.923 -3.259 767 HA PHE 106 HA PHE 106 10.036 0.753 -2.480 768 HD1 PHE 106 HD2 PHE 106 9.178 2.589 -4.365 769 HD2 PHE 106 HD1 PHE 106 12.659 0.691 -5.878 770 HE1 PHE 106 HE2 PHE 106 9.973 4.747 -5.236 771 HE2 PHE 106 HE1 PHE 106 13.451 2.834 -6.753 772 HZ PHE 106 HZ PHE 106 12.122 4.867 -6.425 773 HB2 PHE 106 HB2 PHE 106 11.287 -0.435 -4.297 774 HB3 PHE 106 HB1 PHE 106 9.854 -0.356 -5.301 775 H ALA 107 HN ALA 107 7.553 -0.832 -4.434 776 HA ALA 107 HA ALA 107 6.035 1.330 -5.210 777 HB1 ALA 107 HB1 ALA 107 5.587 -0.962 -5.930 778 HB2 ALA 107 HB2 ALA 107 4.133 -0.190 -5.297 779 HB3 ALA 107 HB3 ALA 107 5.011 -1.360 -4.310 780 H LEU 108 HN LEU 108 5.819 -0.459 -2.134 781 HA LEU 108 HA LEU 108 3.781 1.169 -1.023 782 HG LEU 108 HG LEU 108 2.777 -0.111 0.770 783 HB2 LEU 108 HB2 LEU 108 4.777 -1.173 -0.295 784 HB3 LEU 108 HB1 LEU 108 5.801 -0.165 0.719 785 HD11 LEU 108 HD11 LEU 108 2.931 -1.369 2.823 786 HD12 LEU 108 HD12 LEU 108 4.685 -1.468 2.655 787 HD13 LEU 108 HD13 LEU 108 3.640 -2.274 1.485 788 HD21 LEU 108 HD21 LEU 108 4.820 1.047 2.652 789 HD22 LEU 108 HD22 LEU 108 3.073 1.043 2.898 790 HD23 LEU 108 HD23 LEU 108 3.773 1.952 1.556 791 H ALA 109 HN ALA 109 7.316 1.122 -0.559 792 HA ALA 109 HA ALA 109 7.628 3.205 1.211 793 HB1 ALA 109 HB1 ALA 109 9.444 1.778 0.405 794 HB2 ALA 109 HB2 ALA 109 9.861 3.491 0.350 795 HB3 ALA 109 HB3 ALA 109 9.428 2.643 -1.133 796 H ASN 110 HN ASN 110 7.706 3.583 -2.344 797 HA ASN 110 HA ASN 110 7.995 6.397 -2.296 798 HB2 ASN 110 HB2 ASN 110 8.541 4.727 -4.192 799 HB3 ASN 110 HB1 ASN 110 6.835 4.834 -4.594 800 HD21 ASN 110 HD21 ASN 110 6.689 7.702 -3.875 801 HD22 ASN 110 HD22 ASN 110 7.481 8.539 -5.169 802 H HIS 111 HN HIS 111 5.291 4.212 -2.236 803 HA HIS 111 HA HIS 111 3.301 6.094 -2.983 804 HD1 HIS 111 HD1 HIS 111 0.981 4.855 -4.239 805 HD2 HIS 111 HD2 HIS 111 0.517 4.331 -0.137 806 HE1 HIS 111 HE1 HIS 111 -1.465 5.229 -3.784 807 HE2 HIS 111 HE2 HIS 111 -1.615 5.299 -1.265 808 HB2 HIS 111 HB2 HIS 111 2.971 3.618 -3.023 809 HB3 HIS 111 HB1 HIS 111 2.943 3.633 -1.257 810 H LEU 112 HN LEU 112 4.586 4.976 0.110 811 HA LEU 112 HA LEU 112 2.952 6.579 1.763 812 HG LEU 112 HG LEU 112 3.863 3.706 2.220 813 HB2 LEU 112 HB2 LEU 112 5.666 5.335 2.143 814 HB3 LEU 112 HB1 LEU 112 4.894 6.293 3.401 815 HD11 LEU 112 HD11 LEU 112 4.231 2.849 4.480 816 HD12 LEU 112 HD12 LEU 112 4.906 4.407 4.962 817 HD13 LEU 112 HD13 LEU 112 5.729 3.426 3.750 818 HD21 LEU 112 HD21 LEU 112 1.988 5.139 2.706 819 HD22 LEU 112 HD22 LEU 112 2.649 5.532 4.291 820 HD23 LEU 112 HD23 LEU 112 2.099 3.892 3.947 821 H ILE 113 HN ILE 113 6.001 7.172 0.120 822 HA ILE 113 HA ILE 113 6.570 9.698 1.206 823 HB ILE 113 HB ILE 113 7.190 8.546 -1.514 824 HG12 ILE 113 HG12 ILE 113 8.945 9.018 0.898 825 HG13 ILE 113 HG11 ILE 113 8.184 7.477 0.514 826 HG21 ILE 113 HG21 ILE 113 7.176 10.990 -1.653 827 HG22 ILE 113 HG22 ILE 113 8.811 10.345 -1.794 828 HG23 ILE 113 HG23 ILE 113 8.280 11.074 -0.280 829 HD11 ILE 113 HD11 ILE 113 10.539 7.561 -0.156 830 HD12 ILE 113 HD12 ILE 113 10.179 8.923 -1.218 831 HD13 ILE 113 HD13 ILE 113 9.472 7.340 -1.542 832 H LYS 114 HN LYS 114 4.693 8.828 -1.746 833 HA LYS 114 HA LYS 114 3.937 11.567 -2.119 834 HB2 LYS 114 HB2 LYS 114 2.389 10.832 -3.842 835 HB3 LYS 114 HB1 LYS 114 3.970 10.108 -4.057 836 HG2 LYS 114 HG2 LYS 114 3.210 7.993 -3.380 837 HG3 LYS 114 HG1 LYS 114 1.702 8.649 -2.736 838 HD2 LYS 114 HD2 LYS 114 1.440 7.508 -4.934 839 HD3 LYS 114 HD1 LYS 114 0.942 9.201 -4.963 840 HE2 LYS 114 HE2 LYS 114 3.150 9.790 -5.917 841 HE3 LYS 114 HE1 LYS 114 3.559 8.077 -5.954 842 HZ1 LYS 114 HZ1 LYS 114 2.747 9.006 -8.095 843 HZ2 LYS 114 HZ2 LYS 114 1.223 9.231 -7.383 844 HZ3 LYS 114 HZ3 LYS 114 1.866 7.666 -7.550 845 H VAL 115 HN VAL 115 2.671 8.999 -0.195 846 HA VAL 115 HA VAL 115 0.127 10.036 0.384 847 HB VAL 115 HB VAL 115 2.057 8.389 2.004 848 HG11 VAL 115 HG11 VAL 115 -0.690 9.253 2.911 849 HG12 VAL 115 HG12 VAL 115 0.841 9.778 3.615 850 HG13 VAL 115 HG13 VAL 115 0.357 8.088 3.721 851 HG21 VAL 115 HG21 VAL 115 0.890 7.306 0.164 852 HG22 VAL 115 HG22 VAL 115 -0.660 7.801 0.848 853 HG23 VAL 115 HG23 VAL 115 0.368 6.664 1.723 854 H LYS 116 HN LYS 116 3.295 10.712 1.947 855 HA LYS 116 HA LYS 116 2.048 12.805 3.509 856 HB2 LYS 116 HB2 LYS 116 4.194 13.138 4.503 857 HB3 LYS 116 HB1 LYS 116 3.822 11.420 4.477 858 HG2 LYS 116 HG2 LYS 116 5.421 10.961 2.905 859 HG3 LYS 116 HG1 LYS 116 5.405 12.610 2.263 860 HD2 LYS 116 HD2 LYS 116 6.481 11.728 4.923 861 HD3 LYS 116 HD1 LYS 116 7.420 12.237 3.528 862 HE2 LYS 116 HE2 LYS 116 5.497 13.923 5.114 863 HE3 LYS 116 HE1 LYS 116 7.248 14.046 5.125 864 HZ1 LYS 116 HZ1 LYS 116 5.475 14.622 2.815 865 HZ2 LYS 116 HZ2 LYS 116 7.166 14.683 2.775 866 HZ3 LYS 116 HZ3 LYS 116 6.304 15.765 3.755 867 H LEU 117 HN LEU 117 3.056 12.520 0.415 868 HA LEU 117 HA LEU 117 3.966 15.254 0.074 869 HG LEU 117 HG LEU 117 3.307 15.562 -2.853 870 HB2 LEU 117 HB2 LEU 117 4.795 13.391 -1.371 871 HB3 LEU 117 HB1 LEU 117 3.157 13.208 -2.007 872 HD11 LEU 117 HD11 LEU 117 5.045 16.358 -1.342 873 HD12 LEU 117 HD12 LEU 117 5.519 16.573 -3.027 874 HD13 LEU 117 HD13 LEU 117 6.204 15.251 -2.081 875 HD21 LEU 117 HD21 LEU 117 3.678 13.652 -4.312 876 HD22 LEU 117 HD22 LEU 117 5.380 13.614 -3.850 877 HD23 LEU 117 HD23 LEU 117 4.742 14.988 -4.751 878 H GLU 118 HN GLU 118 1.043 13.436 0.122 879 HA GLU 118 HA GLU 118 -0.653 15.274 -1.210 880 HB2 GLU 118 HB2 GLU 118 -1.268 13.269 0.973 881 HB3 GLU 118 HB1 GLU 118 -2.482 14.133 0.038 882 HG2 GLU 118 HG2 GLU 118 -1.706 13.073 -2.004 883 HG3 GLU 118 HG1 GLU 118 -0.426 12.247 -1.111 884 H GLY 119 HN GLY 119 0.966 15.317 1.786 885 HA2 GLY 119 HA2 GLY 119 1.253 17.585 2.686 886 HA3 GLY 119 HA1 GLY 119 -0.481 17.789 2.486 887 H HIS 120 HN HIS 120 -0.743 14.896 3.416 888 HA HIS 120 HA HIS 120 -0.699 15.553 6.266 889 HD1 HIS 120 HD1 HIS 120 -2.440 11.716 6.969 890 HD2 HIS 120 HD2 HIS 120 -1.927 12.646 2.948 891 HE1 HIS 120 HE1 HIS 120 -2.407 9.511 5.771 892 HE2 HIS 120 HE2 HIS 120 -2.359 10.125 3.312 893 HB2 HIS 120 HB2 HIS 120 -2.496 14.142 6.579 894 HB3 HIS 120 HB1 HIS 120 -2.796 14.678 4.932 895 H GLU 121 HN GLU 121 0.433 14.385 7.722 896 HA GLU 121 HA GLU 121 2.633 12.839 6.766 897 HB2 GLU 121 HB2 GLU 121 3.377 12.728 9.013 898 HB3 GLU 121 HB1 GLU 121 2.656 14.319 8.817 899 HG2 GLU 121 HG2 GLU 121 0.733 13.714 10.034 900 HG3 GLU 121 HG1 GLU 121 1.131 11.998 9.951 901 H LEU 122 HN LEU 122 3.194 10.702 7.639 902 HA LEU 122 HA LEU 122 1.111 8.818 7.152 903 HG LEU 122 HG LEU 122 2.941 8.466 5.425 904 HB2 LEU 122 HB2 LEU 122 3.873 8.336 8.269 905 HB3 LEU 122 HB1 LEU 122 2.787 7.115 7.638 906 HD11 LEU 122 HD11 LEU 122 5.097 9.579 5.098 907 HD12 LEU 122 HD12 LEU 122 5.464 9.370 6.810 908 HD13 LEU 122 HD13 LEU 122 4.122 10.401 6.316 909 HD21 LEU 122 HD21 LEU 122 3.749 6.209 5.734 910 HD22 LEU 122 HD22 LEU 122 5.221 6.814 6.497 911 HD23 LEU 122 HD23 LEU 122 4.912 7.144 4.793 912 HA PRO 123 HA PRO 123 -0.294 8.513 11.281 913 HB2 PRO 123 HB2 PRO 123 -2.060 6.526 10.954 914 HB3 PRO 123 HB1 PRO 123 -2.274 8.098 10.176 915 HG2 PRO 123 HG2 PRO 123 -1.414 5.510 9.010 916 HG3 PRO 123 HG1 PRO 123 -2.300 6.840 8.253 917 HD2 PRO 123 HD2 PRO 123 0.462 6.283 8.030 918 HD3 PRO 123 HD1 PRO 123 -0.382 7.730 7.445 919 H ALA 124 HN ALA 124 1.807 6.251 10.061 920 HA ALA 124 HA ALA 124 3.012 4.531 10.933 921 HB1 ALA 124 HB1 ALA 124 3.310 4.453 13.372 922 HB2 ALA 124 HB2 ALA 124 1.996 5.616 13.560 923 HB3 ALA 124 HB3 ALA 124 3.483 6.088 12.738 924 H ASP 125 HN ASP 125 0.181 4.203 10.210 925 HA ASP 125 HA ASP 125 -0.269 1.653 11.603 926 HB2 ASP 125 HB2 ASP 125 -1.918 3.380 12.342 927 HB3 ASP 125 HB1 ASP 125 -2.442 3.551 10.668 928 H LEU 126 HN LEU 126 -0.369 -0.020 10.246 929 HA LEU 126 HA LEU 126 -0.519 0.569 7.371 930 HG LEU 126 HG LEU 126 1.996 -2.065 6.655 931 HB2 LEU 126 HB2 LEU 126 1.472 -0.669 8.527 932 HB3 LEU 126 HB1 LEU 126 0.392 -2.046 8.547 933 HD11 LEU 126 HD11 LEU 126 0.389 -2.598 4.899 934 HD12 LEU 126 HD12 LEU 126 -0.893 -1.826 5.831 935 HD13 LEU 126 HD13 LEU 126 -0.104 -3.277 6.451 936 HD21 LEU 126 HD21 LEU 126 1.615 -0.512 4.780 937 HD22 LEU 126 HD22 LEU 126 2.177 0.298 6.245 938 HD23 LEU 126 HD23 LEU 126 0.476 0.385 5.787 939 HA PRO 127 HA PRO 127 -4.527 -1.402 7.994 940 HB2 PRO 127 HB2 PRO 127 -5.606 0.037 5.829 941 HB3 PRO 127 HB1 PRO 127 -5.687 0.482 7.538 942 HG2 PRO 127 HG2 PRO 127 -4.295 1.837 5.496 943 HG3 PRO 127 HG1 PRO 127 -4.164 2.127 7.241 944 HD2 PRO 127 HD2 PRO 127 -2.378 0.586 5.434 945 HD3 PRO 127 HD1 PRO 127 -1.990 1.497 6.906 946 HA PRO 128 HA PRO 128 -4.760 -4.686 5.063 947 HB2 PRO 128 HB2 PRO 128 -7.441 -4.584 4.312 948 HB3 PRO 128 HB1 PRO 128 -6.802 -5.408 5.749 949 HG2 PRO 128 HG2 PRO 128 -8.043 -2.699 5.504 950 HG3 PRO 128 HG1 PRO 128 -8.234 -3.910 6.785 951 HD2 PRO 128 HD2 PRO 128 -6.674 -1.777 7.146 952 HD3 PRO 128 HD1 PRO 128 -6.192 -3.370 7.767 953 H HIS 129 HN HIS 129 -6.040 -1.578 4.013 954 HA HIS 129 HA HIS 129 -5.921 -2.393 1.233 955 HD1 HIS 129 HD1 HIS 129 -8.567 0.062 3.789 956 HD2 HIS 129 HD2 HIS 129 -5.086 1.908 2.440 957 HE1 HIS 129 HE1 HIS 129 -8.201 2.026 5.319 958 HE2 HIS 129 HE2 HIS 129 -6.263 3.278 4.294 959 HB2 HIS 129 HB2 HIS 129 -6.529 0.024 0.764 960 HB3 HIS 129 HB1 HIS 129 -7.725 -0.913 1.630 961 H LEU 130 HN LEU 130 -3.479 -2.193 3.021 962 HA LEU 130 HA LEU 130 -1.834 -0.984 0.938 963 HG LEU 130 HG LEU 130 -0.868 1.032 1.022 964 HB2 LEU 130 HB2 LEU 130 -2.256 0.192 3.502 965 HB3 LEU 130 HB1 LEU 130 -0.570 -0.244 3.332 966 HD11 LEU 130 HD11 LEU 130 -2.914 2.333 2.802 967 HD12 LEU 130 HD12 LEU 130 -3.225 1.500 1.278 968 HD13 LEU 130 HD13 LEU 130 -2.296 3.001 1.290 969 HD21 LEU 130 HD21 LEU 130 -0.516 2.448 3.653 970 HD22 LEU 130 HD22 LEU 130 0.035 3.010 2.077 971 HD23 LEU 130 HD23 LEU 130 0.739 1.560 2.793 972 H VAL 131 HN VAL 131 -2.474 -3.681 2.382 973 HA VAL 131 HA VAL 131 0.099 -4.342 3.506 974 HB VAL 131 HB VAL 131 -1.818 -5.315 4.595 975 HG11 VAL 131 HG11 VAL 131 -3.253 -6.980 3.526 976 HG12 VAL 131 HG12 VAL 131 -2.426 -6.704 1.992 977 HG13 VAL 131 HG13 VAL 131 -3.368 -5.410 2.730 978 HG21 VAL 131 HG21 VAL 131 -0.239 -7.429 3.140 979 HG22 VAL 131 HG22 VAL 131 -1.170 -7.672 4.619 980 HG23 VAL 131 HG23 VAL 131 0.238 -6.611 4.627 981 HA PRO 132 HA PRO 132 1.687 -5.282 -0.556 982 HB2 PRO 132 HB2 PRO 132 4.141 -6.111 0.355 983 HB3 PRO 132 HB1 PRO 132 3.706 -4.427 0.052 984 HG2 PRO 132 HG2 PRO 132 3.779 -5.939 2.628 985 HG3 PRO 132 HG1 PRO 132 4.267 -4.267 2.294 986 HD2 PRO 132 HD2 PRO 132 1.932 -4.870 3.499 987 HD3 PRO 132 HD1 PRO 132 2.098 -3.481 2.397 988 HA PRO 133 HA PRO 133 0.959 -9.771 -0.562 989 HB2 PRO 133 HB2 PRO 133 1.482 -9.248 -3.438 990 HB3 PRO 133 HB1 PRO 133 0.143 -10.117 -2.672 991 HG2 PRO 133 HG2 PRO 133 -0.228 -7.684 -3.706 992 HG3 PRO 133 HG1 PRO 133 -1.024 -8.165 -2.188 993 HD2 PRO 133 HD2 PRO 133 1.400 -6.446 -2.605 994 HD3 PRO 133 HD1 PRO 133 0.042 -6.239 -1.467 995 H SER 134 HN SER 134 3.660 -7.861 -1.101 996 HA SER 134 HA SER 134 5.440 -9.905 -2.014 997 HG SER 134 HG SER 134 8.046 -7.522 -1.851 998 HB2 SER 134 HB2 SER 134 5.849 -7.480 -2.376 999 HB3 SER 134 HB1 SER 134 6.068 -7.275 -0.640 1000 H LYS 135 HN LYS 135 4.344 -8.788 1.156 1001 HA LYS 135 HA LYS 135 6.600 -10.074 2.450 1002 HB2 LYS 135 HB2 LYS 135 5.597 -9.144 4.591 1003 HB3 LYS 135 HB1 LYS 135 6.109 -7.973 3.396 1004 HG2 LYS 135 HG2 LYS 135 4.051 -7.258 4.395 1005 HG3 LYS 135 HG1 LYS 135 3.771 -7.666 2.704 1006 HD2 LYS 135 HD2 LYS 135 1.963 -8.433 4.180 1007 HD3 LYS 135 HD1 LYS 135 2.758 -9.767 3.346 1008 HE2 LYS 135 HE2 LYS 135 2.302 -10.300 5.696 1009 HE3 LYS 135 HE1 LYS 135 4.029 -10.284 5.357 1010 HZ1 LYS 135 HZ1 LYS 135 4.126 -8.043 6.304 1011 HZ2 LYS 135 HZ2 LYS 135 3.587 -9.186 7.431 1012 HZ3 LYS 135 HZ3 LYS 135 2.478 -8.129 6.697 1013 H ARG 136 HN ARG 136 3.834 -11.311 1.306 1014 HA ARG 136 HA ARG 136 3.098 -12.925 3.576 1015 HE ARG 136 HE ARG 136 2.329 -15.450 -0.589 1016 HB2 ARG 136 HB2 ARG 136 1.821 -14.199 1.626 1017 HB3 ARG 136 HB1 ARG 136 1.228 -12.684 2.295 1018 HG2 ARG 136 HG2 ARG 136 1.417 -11.660 0.343 1019 HG3 ARG 136 HG1 ARG 136 3.082 -12.199 0.149 1020 HD2 ARG 136 HD2 ARG 136 0.671 -13.892 -0.472 1021 HD3 ARG 136 HD1 ARG 136 1.532 -12.922 -1.661 1022 HH11 ARG 136 HH11 ARG 136 3.567 -12.452 -1.945 1023 HH12 ARG 136 HH12 ARG 136 5.028 -13.189 -2.533 1024 HH21 ARG 136 HH21 ARG 136 4.223 -16.414 -1.396 1025 HH22 ARG 136 HH22 ARG 136 5.387 -15.434 -2.246 1026 H ARG 137 HN ARG 137 5.408 -13.607 3.827 1027 HA ARG 137 HA ARG 137 5.732 -16.164 2.439 1028 HE ARG 137 HE ARG 137 10.817 -14.543 2.602 1029 HB2 ARG 137 HB2 ARG 137 8.204 -15.790 2.397 1030 HB3 ARG 137 HB1 ARG 137 7.289 -14.753 1.314 1031 HG2 ARG 137 HG2 ARG 137 7.418 -12.981 3.102 1032 HG3 ARG 137 HG1 ARG 137 8.582 -14.021 3.917 1033 HD2 ARG 137 HD2 ARG 137 8.835 -12.908 1.143 1034 HD3 ARG 137 HD1 ARG 137 9.709 -12.349 2.564 1035 HH11 ARG 137 HH11 ARG 137 9.206 -13.568 -0.352 1036 HH12 ARG 137 HH12 ARG 137 10.184 -14.573 -1.380 1037 HH21 ARG 137 HH21 ARG 137 12.128 -15.846 1.268 1038 HH22 ARG 137 HH22 ARG 137 11.877 -15.848 -0.451 1039 H HIS 138 HN HIS 138 5.411 -17.607 3.951 1040 HA HIS 138 HA HIS 138 6.435 -17.075 6.652 1041 HD1 HIS 138 HD1 HIS 138 2.036 -17.829 5.730 1042 HD2 HIS 138 HD2 HIS 138 4.813 -15.746 8.014 1043 HE1 HIS 138 HE1 HIS 138 0.877 -15.724 6.463 1044 HE2 HIS 138 HE2 HIS 138 2.524 -14.534 7.952 1045 HB2 HIS 138 HB2 HIS 138 4.241 -18.914 5.724 1046 HB3 HIS 138 HB1 HIS 138 4.835 -18.855 7.379 1047 H GLU 139 HN GLU 139 7.834 -18.433 7.619 1048 HA GLU 139 HA GLU 139 8.134 -21.150 6.835 1049 HB2 GLU 139 HB2 GLU 139 9.490 -19.923 5.083 1050 HB3 GLU 139 HB1 GLU 139 10.547 -19.387 6.380 1051 HG2 GLU 139 HG2 GLU 139 11.467 -21.322 5.223 1052 HG3 GLU 139 HG1 GLU 139 11.099 -21.690 6.911
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