NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
12583 | 1t4y | 5141 | cing | 1-original | 7 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name 1 1H GLY 1 HT1 GLY 1 -32.690 10.554 -2.939 2 2H GLY 1 HT2 GLY 1 -33.611 9.127 -2.942 3 3H GLY 1 HT3 GLY 1 -32.068 9.143 -3.647 4 1HA GLY 1 HA2 GLY 1 -32.784 9.241 -0.777 5 2HA GLY 1 HA1 GLY 1 -31.726 8.093 -1.606 6 H SER 2 HN SER 2 -29.819 8.511 -0.406 7 HA SER 2 HA SER 2 -28.693 10.664 0.670 8 1HB SER 2 HB2 SER 2 -26.935 9.435 -1.404 9 2HB SER 2 HB1 SER 2 -26.604 9.779 0.291 10 HG SER 2 HG SER 2 -28.617 8.022 0.072 11 H SER 3 HN SER 3 -27.119 12.385 -0.221 12 HA SER 3 HA SER 3 -27.838 14.429 -1.453 13 1HB SER 3 HB2 SER 3 -25.784 14.697 -2.361 14 2HB SER 3 HB1 SER 3 -25.453 13.031 -1.887 15 HG SER 3 HG SER 3 -25.349 12.662 -3.965 16 H LEU 4 HN LEU 4 -29.482 11.979 -1.984 17 HA LEU 4 HA LEU 4 -31.355 11.727 -3.340 18 1HB LEU 4 HB2 LEU 4 -30.741 14.038 -4.352 19 2HB LEU 4 HB1 LEU 4 -29.942 13.105 -5.620 20 HG LEU 4 HG LEU 4 -32.745 13.633 -5.277 21 1HD1 LEU 4 HD11 LEU 4 -31.771 13.792 -7.411 22 2HD1 LEU 4 HD12 LEU 4 -32.788 12.353 -7.490 23 3HD1 LEU 4 HD13 LEU 4 -31.040 12.191 -7.295 24 1HD2 LEU 4 HD21 LEU 4 -33.493 11.211 -5.671 25 2HD2 LEU 4 HD22 LEU 4 -33.028 11.621 -4.020 26 3HD2 LEU 4 HD23 LEU 4 -31.911 10.726 -5.049 27 H SER 5 HN SER 5 -28.169 11.013 -3.554 28 HA SER 5 HA SER 5 -28.391 8.980 -5.660 29 1HB SER 5 HB2 SER 5 -25.925 9.409 -4.006 30 2HB SER 5 HB1 SER 5 -26.066 8.923 -5.696 31 HG SER 5 HG SER 5 -25.848 11.389 -4.606 32 HA PRO 6 HA PRO 6 -29.286 5.954 -2.546 33 1HB PRO 6 HB2 PRO 6 -28.926 3.866 -4.490 34 2HB PRO 6 HB1 PRO 6 -30.435 4.564 -3.887 35 1HG PRO 6 HG2 PRO 6 -29.470 4.848 -6.452 36 2HG PRO 6 HG1 PRO 6 -30.670 5.898 -5.684 37 1HD PRO 6 HD2 PRO 6 -27.747 6.397 -6.127 38 2HD PRO 6 HD1 PRO 6 -29.103 7.554 -6.115 39 H GLN 7 HN GLN 7 -26.487 6.691 -2.370 40 HA GLN 7 HA GLN 7 -25.391 4.648 -1.003 41 1HB GLN 7 HB2 GLN 7 -25.866 3.604 -3.486 42 2HB GLN 7 HB1 GLN 7 -24.155 4.033 -3.586 43 1HG GLN 7 HG2 GLN 7 -25.000 1.707 -2.516 44 2HG GLN 7 HG1 GLN 7 -23.535 2.527 -1.984 45 1HE2 GLN 7 HE21 GLN 7 -24.493 0.990 -0.054 46 2HE2 GLN 7 HE22 GLN 7 -25.362 1.868 1.114 47 H ALA 8 HN ALA 8 -23.598 5.256 -0.132 48 HA ALA 8 HA ALA 8 -21.973 7.354 -1.371 49 1HB ALA 8 HB1 ALA 8 -22.148 6.125 1.376 50 2HB ALA 8 HB2 ALA 8 -22.208 7.825 0.918 51 3HB ALA 8 HB3 ALA 8 -20.671 6.961 0.891 52 H LEU 9 HN LEU 9 -20.585 6.562 -2.863 53 HA LEU 9 HA LEU 9 -19.899 3.831 -2.999 54 1HB LEU 9 HB2 LEU 9 -18.125 4.642 -4.636 55 2HB LEU 9 HB1 LEU 9 -19.794 5.058 -5.029 56 HG LEU 9 HG LEU 9 -18.389 7.015 -3.313 57 1HD1 LEU 9 HD11 LEU 9 -17.539 6.472 -6.170 58 2HD1 LEU 9 HD12 LEU 9 -16.516 6.523 -4.734 59 3HD1 LEU 9 HD13 LEU 9 -17.245 8.006 -5.350 60 1HD2 LEU 9 HD21 LEU 9 -19.674 8.567 -4.547 61 2HD2 LEU 9 HD22 LEU 9 -20.717 7.147 -4.457 62 3HD2 LEU 9 HD23 LEU 9 -19.813 7.487 -5.934 63 H ALA 10 HN ALA 10 -18.105 2.718 -2.460 64 HA ALA 10 HA ALA 10 -16.749 3.447 -0.122 65 1HB ALA 10 HB1 ALA 10 -15.700 1.406 -0.300 66 2HB ALA 10 HB2 ALA 10 -15.469 1.558 -2.042 67 3HB ALA 10 HB3 ALA 10 -17.054 1.132 -1.396 68 H GLN 11 HN GLN 11 -14.707 4.268 0.246 69 HA GLN 11 HA GLN 11 -13.702 6.020 -1.811 70 1HB GLN 11 HB2 GLN 11 -12.285 5.428 0.777 71 2HB GLN 11 HB1 GLN 11 -12.341 6.937 -0.140 72 1HG GLN 11 HG2 GLN 11 -15.021 6.191 0.509 73 2HG GLN 11 HG1 GLN 11 -14.059 6.112 1.984 74 1HE2 GLN 11 HE21 GLN 11 -12.162 8.237 1.055 75 2HE2 GLN 11 HE22 GLN 11 -13.024 9.695 1.170 76 HA PRO 12 HA PRO 12 -11.142 3.143 -3.915 77 1HB PRO 12 HB2 PRO 12 -9.057 5.122 -4.184 78 2HB PRO 12 HB1 PRO 12 -10.204 4.562 -5.412 79 1HG PRO 12 HG2 PRO 12 -10.281 6.973 -3.745 80 2HG PRO 12 HG1 PRO 12 -11.099 6.628 -5.277 81 1HD PRO 12 HD2 PRO 12 -12.445 6.763 -2.915 82 2HD PRO 12 HD1 PRO 12 -12.949 5.678 -4.234 83 H LEU 13 HN LEU 13 -9.423 1.795 -3.381 84 HA LEU 13 HA LEU 13 -8.616 1.736 -0.683 85 1HB LEU 13 HB2 LEU 13 -8.690 -0.228 -2.270 86 2HB LEU 13 HB1 LEU 13 -7.202 0.388 -2.992 87 HG LEU 13 HG LEU 13 -7.569 -0.325 -0.068 88 1HD1 LEU 13 HD11 LEU 13 -5.681 -2.009 -0.919 89 2HD1 LEU 13 HD12 LEU 13 -6.517 -1.785 -2.456 90 3HD1 LEU 13 HD13 LEU 13 -7.394 -2.407 -1.057 91 1HD2 LEU 13 HD21 LEU 13 -5.935 1.358 -0.109 92 2HD2 LEU 13 HD22 LEU 13 -5.330 0.865 -1.690 93 3HD2 LEU 13 HD23 LEU 13 -4.965 -0.107 -0.264 94 H LEU 14 HN LEU 14 -7.101 2.854 0.351 95 HA LEU 14 HA LEU 14 -5.332 4.575 -1.184 96 1HB LEU 14 HB2 LEU 14 -5.770 4.319 1.801 97 2HB LEU 14 HB1 LEU 14 -4.798 5.554 1.007 98 HG LEU 14 HG LEU 14 -7.774 5.209 1.015 99 1HD1 LEU 14 HD11 LEU 14 -7.612 7.716 1.190 100 2HD1 LEU 14 HD12 LEU 14 -5.857 7.548 1.218 101 3HD1 LEU 14 HD13 LEU 14 -6.830 6.857 2.517 102 1HD2 LEU 14 HD21 LEU 14 -7.928 6.677 -0.973 103 2HD2 LEU 14 HD22 LEU 14 -7.149 5.146 -1.370 104 3HD2 LEU 14 HD23 LEU 14 -6.176 6.602 -1.158 105 H LEU 15 HN LEU 15 -3.637 3.537 -1.976 106 HA LEU 15 HA LEU 15 -2.006 1.915 -0.120 107 1HB LEU 15 HB2 LEU 15 -3.172 0.674 -2.030 108 2HB LEU 15 HB1 LEU 15 -2.104 1.559 -3.119 109 HG LEU 15 HG LEU 15 -1.207 -0.687 -2.490 110 1HD1 LEU 15 HD11 LEU 15 1.023 0.079 -2.148 111 2HD1 LEU 15 HD12 LEU 15 0.474 1.521 -1.292 112 3HD1 LEU 15 HD13 LEU 15 0.212 1.374 -3.030 113 1HD2 LEU 15 HD21 LEU 15 -1.170 -1.366 -0.338 114 2HD2 LEU 15 HD22 LEU 15 -2.081 0.088 0.069 115 3HD2 LEU 15 HD23 LEU 15 -0.320 0.096 0.162 116 H GLN 16 HN GLN 16 0.163 2.356 -0.049 117 HA GLN 16 HA GLN 16 1.202 4.383 -1.921 118 1HB GLN 16 HB2 GLN 16 1.185 4.486 1.082 119 2HB GLN 16 HB1 GLN 16 2.448 5.305 0.161 120 1HG GLN 16 HG2 GLN 16 0.821 6.626 -1.033 121 2HG GLN 16 HG1 GLN 16 -0.510 5.693 -0.353 122 1HE2 GLN 16 HE21 GLN 16 2.227 6.545 1.694 123 2HE2 GLN 16 HE22 GLN 16 1.407 7.710 2.617 124 H LEU 17 HN LEU 17 3.597 4.541 -1.823 125 HA LEU 17 HA LEU 17 4.943 2.117 -0.871 126 1HB LEU 17 HB2 LEU 17 4.207 1.615 -3.175 127 2HB LEU 17 HB1 LEU 17 5.049 3.054 -3.749 128 HG LEU 17 HG LEU 17 7.152 2.052 -2.659 129 1HD1 LEU 17 HD11 LEU 17 6.275 0.342 -1.275 130 2HD1 LEU 17 HD12 LEU 17 6.971 -0.525 -2.644 131 3HD1 LEU 17 HD13 LEU 17 5.228 -0.272 -2.555 132 1HD2 LEU 17 HD21 LEU 17 6.542 0.130 -4.755 133 2HD2 LEU 17 HD22 LEU 17 7.675 1.482 -4.783 134 3HD2 LEU 17 HD23 LEU 17 5.980 1.743 -5.194 135 H PHE 18 HN PHE 18 6.801 2.656 0.070 136 HA PHE 18 HA PHE 18 7.904 5.337 -0.380 137 1HB PHE 18 HB2 PHE 18 8.317 3.227 1.734 138 2HB PHE 18 HB1 PHE 18 9.412 4.600 1.577 139 HD1 PHE 18 HD1 PHE 18 5.947 3.563 2.330 140 HD2 PHE 18 HD2 PHE 18 8.699 6.854 2.118 141 HE1 PHE 18 HE1 PHE 18 4.338 4.988 3.567 142 HE2 PHE 18 HE2 PHE 18 7.091 8.283 3.355 143 HZ PHE 18 HZ PHE 18 4.910 7.347 4.080 144 H VAL 19 HN VAL 19 9.538 5.612 -1.758 145 HA VAL 19 HA VAL 19 11.435 3.381 -2.150 146 HB VAL 19 HB VAL 19 11.451 3.736 -4.523 147 1HG1 VAL 19 HG11 VAL 19 8.695 3.756 -4.748 148 2HG1 VAL 19 HG12 VAL 19 8.943 3.219 -3.086 149 3HG1 VAL 19 HG13 VAL 19 9.677 2.328 -4.420 150 1HG2 VAL 19 HG21 VAL 19 10.309 6.298 -3.741 151 2HG2 VAL 19 HG22 VAL 19 9.376 5.549 -5.037 152 3HG2 VAL 19 HG23 VAL 19 11.101 5.847 -5.250 153 H ASP 20 HN ASP 20 13.493 4.063 -3.101 154 HA ASP 20 HA ASP 20 14.249 6.764 -2.173 155 1HB ASP 20 HB2 ASP 20 16.510 5.886 -1.917 156 2HB ASP 20 HB1 ASP 20 15.375 4.874 -1.025 157 H THR 21 HN THR 21 13.067 6.001 -4.790 158 HA THR 21 HA THR 21 13.310 6.714 -6.964 159 HB THR 21 HB THR 21 14.917 8.353 -7.496 160 HG1 THR 21 HG1 THR 21 16.414 7.317 -5.322 161 1HG2 THR 21 HG21 THR 21 15.050 9.763 -5.373 162 2HG2 THR 21 HG22 THR 21 14.260 8.420 -4.546 163 3HG2 THR 21 HG23 THR 21 13.432 9.257 -5.859 164 H ARG 22 HN ARG 22 15.018 4.374 -5.491 165 HA ARG 22 HA ARG 22 16.990 3.750 -7.480 166 1HB ARG 22 HB2 ARG 22 17.367 1.744 -6.242 167 2HB ARG 22 HB1 ARG 22 17.046 3.010 -5.057 168 1HG ARG 22 HG2 ARG 22 14.573 2.247 -5.218 169 2HG ARG 22 HG1 ARG 22 15.224 0.792 -5.974 170 1HD ARG 22 HD2 ARG 22 16.393 1.774 -3.389 171 2HD ARG 22 HD1 ARG 22 14.894 0.850 -3.374 172 HE ARG 22 HE ARG 22 16.522 -0.681 -4.915 173 1HH1 ARG 22 HH11 ARG 22 15.762 -1.059 -1.888 174 2HH1 ARG 22 HH12 ARG 22 17.324 -1.427 -1.237 175 1HH2 ARG 22 HH21 ARG 22 19.044 -0.343 -4.040 176 2HH2 ARG 22 HH22 ARG 22 19.179 -1.021 -2.452 177 HA PRO 23 HA PRO 23 14.550 2.058 -10.715 178 1HB PRO 23 HB2 PRO 23 16.358 -0.145 -11.109 179 2HB PRO 23 HB1 PRO 23 16.217 1.338 -12.064 180 1HG PRO 23 HG2 PRO 23 18.165 0.622 -10.023 181 2HG PRO 23 HG1 PRO 23 18.234 1.892 -11.253 182 1HD PRO 23 HD2 PRO 23 17.917 2.390 -8.565 183 2HD PRO 23 HD1 PRO 23 17.346 3.485 -9.843 184 H LEU 24 HN LEU 24 15.885 -0.158 -8.279 185 HA LEU 24 HA LEU 24 14.280 -2.387 -8.746 186 1HB LEU 24 HB2 LEU 24 16.195 -2.274 -7.137 187 2HB LEU 24 HB1 LEU 24 15.158 -1.372 -6.032 188 HG LEU 24 HG LEU 24 13.497 -3.359 -6.358 189 1HD1 LEU 24 HD11 LEU 24 14.303 -4.823 -7.910 190 2HD1 LEU 24 HD12 LEU 24 15.260 -5.435 -6.561 191 3HD1 LEU 24 HD13 LEU 24 15.969 -4.285 -7.695 192 1HD2 LEU 24 HD21 LEU 24 14.652 -4.599 -4.524 193 2HD2 LEU 24 HD22 LEU 24 14.615 -2.857 -4.243 194 3HD2 LEU 24 HD23 LEU 24 16.096 -3.627 -4.815 195 H SER 25 HN SER 25 13.633 0.503 -6.782 196 HA SER 25 HA SER 25 11.112 -0.321 -5.789 197 1HB SER 25 HB2 SER 25 11.039 2.474 -6.061 198 2HB SER 25 HB1 SER 25 11.484 1.563 -4.622 199 HG SER 25 HG SER 25 13.166 2.947 -5.221 200 H GLN 26 HN GLN 26 12.086 1.618 -8.604 201 HA GLN 26 HA GLN 26 9.459 2.016 -9.627 202 1HB GLN 26 HB2 GLN 26 12.004 1.849 -11.261 203 2HB GLN 26 HB1 GLN 26 10.539 2.761 -11.631 204 1HG GLN 26 HG2 GLN 26 11.563 3.498 -9.025 205 2HG GLN 26 HG1 GLN 26 12.809 3.696 -10.256 206 1HE2 GLN 26 HE21 GLN 26 10.894 5.674 -8.743 207 2HE2 GLN 26 HE22 GLN 26 10.282 6.637 -10.000 208 H HIS 27 HN HIS 27 11.782 -0.516 -9.669 209 HA HIS 27 HA HIS 27 10.746 -2.098 -11.809 210 1HB HIS 27 HB2 HIS 27 13.022 -2.144 -10.384 211 2HB HIS 27 HB1 HIS 27 12.113 -3.340 -9.466 212 HD1 HIS 27 HD1 HIS 27 10.537 -4.468 -12.018 213 HD2 HIS 27 HD2 HIS 27 14.666 -4.009 -11.667 214 HE1 HIS 27 HE1 HIS 27 11.578 -6.079 -13.675 215 H ILE 28 HN ILE 28 10.582 -2.377 -8.275 216 HA ILE 28 HA ILE 28 8.630 -4.422 -8.196 217 HB ILE 28 HB ILE 28 9.506 -2.346 -6.177 218 1HG1 ILE 28 HG12 ILE 28 9.954 -5.344 -6.290 219 2HG1 ILE 28 HG11 ILE 28 11.105 -4.160 -6.911 220 1HG2 ILE 28 HG21 ILE 28 7.271 -4.288 -6.140 221 2HG2 ILE 28 HG22 ILE 28 7.513 -2.832 -5.174 222 3HG2 ILE 28 HG23 ILE 28 8.323 -4.334 -4.725 223 1HD1 ILE 28 HD11 ILE 28 10.151 -4.455 -4.051 224 2HD1 ILE 28 HD12 ILE 28 11.108 -3.089 -4.625 225 3HD1 ILE 28 HD13 ILE 28 11.784 -4.717 -4.662 226 H VAL 29 HN VAL 29 8.475 -0.927 -8.402 227 HA VAL 29 HA VAL 29 5.808 -0.488 -7.683 228 HB VAL 29 HB VAL 29 7.589 0.907 -9.687 229 1HG1 VAL 29 HG11 VAL 29 5.828 2.774 -9.366 230 2HG1 VAL 29 HG12 VAL 29 4.759 1.486 -8.809 231 3HG1 VAL 29 HG13 VAL 29 5.413 1.443 -10.447 232 1HG2 VAL 29 HG21 VAL 29 7.628 0.853 -6.927 233 2HG2 VAL 29 HG22 VAL 29 6.653 2.284 -7.261 234 3HG2 VAL 29 HG23 VAL 29 8.284 2.154 -7.920 235 H GLN 30 HN GLN 30 7.227 -1.275 -10.840 236 HA GLN 30 HA GLN 30 4.845 -1.300 -12.335 237 1HB GLN 30 HB2 GLN 30 7.399 -2.893 -12.659 238 2HB GLN 30 HB1 GLN 30 6.095 -2.877 -13.848 239 1HG GLN 30 HG2 GLN 30 7.821 -0.572 -12.947 240 2HG GLN 30 HG1 GLN 30 7.629 -1.213 -14.578 241 1HE2 GLN 30 HE21 GLN 30 6.698 0.597 -15.634 242 2HE2 GLN 30 HE22 GLN 30 5.235 1.311 -15.154 243 H ARG 31 HN ARG 31 6.487 -3.782 -10.435 244 HA ARG 31 HA ARG 31 4.723 -5.919 -11.032 245 1HB ARG 31 HB2 ARG 31 6.475 -5.365 -8.628 246 2HB ARG 31 HB1 ARG 31 5.575 -6.866 -8.848 247 1HG ARG 31 HG2 ARG 31 6.717 -7.101 -11.098 248 2HG ARG 31 HG1 ARG 31 7.756 -5.754 -10.627 249 1HD ARG 31 HD2 ARG 31 8.150 -7.169 -8.458 250 2HD ARG 31 HD1 ARG 31 7.584 -8.511 -9.448 251 HE ARG 31 HE ARG 31 9.737 -6.851 -10.546 252 1HH1 ARG 31 HH21 ARG 31 9.616 -9.129 -8.116 253 2HH1 ARG 31 HH22 ARG 31 10.639 -10.295 -8.886 254 1HH2 ARG 31 HH11 ARG 31 10.674 -8.645 -11.933 255 2HH2 ARG 31 HH12 ARG 31 11.238 -10.021 -11.046 256 H VAL 32 HN VAL 32 4.766 -3.482 -8.464 257 HA VAL 32 HA VAL 32 2.493 -4.406 -7.055 258 HB VAL 32 HB VAL 32 3.713 -1.643 -7.294 259 1HG1 VAL 32 HG11 VAL 32 2.307 -1.905 -4.874 260 2HG1 VAL 32 HG12 VAL 32 1.216 -2.524 -6.113 261 3HG1 VAL 32 HG13 VAL 32 1.868 -0.891 -6.248 262 1HG2 VAL 32 HG21 VAL 32 5.141 -3.415 -6.287 263 2HG2 VAL 32 HG22 VAL 32 3.865 -3.754 -5.118 264 3HG2 VAL 32 HG23 VAL 32 4.679 -2.189 -5.106 265 H LYS 33 HN LYS 33 2.874 -1.840 -9.492 266 HA LYS 33 HA LYS 33 0.152 -1.161 -9.717 267 1HB LYS 33 HB2 LYS 33 2.488 -0.912 -11.613 268 2HB LYS 33 HB1 LYS 33 0.884 -0.286 -11.988 269 1HG LYS 33 HG2 LYS 33 0.983 0.968 -9.776 270 2HG LYS 33 HG1 LYS 33 2.688 0.522 -9.700 271 1HD LYS 33 HD2 LYS 33 2.919 1.539 -12.031 272 2HD LYS 33 HD1 LYS 33 1.310 2.218 -11.788 273 1HE LYS 33 HE2 LYS 33 2.785 2.768 -9.430 274 2HE LYS 33 HE1 LYS 33 3.830 3.182 -10.789 275 1HZ LYS 33 HZ1 LYS 33 2.431 4.796 -11.499 276 2HZ LYS 33 HZ2 LYS 33 2.031 4.845 -9.848 277 3HZ LYS 33 HZ3 LYS 33 1.035 4.009 -10.942 278 H ASN 34 HN ASN 34 2.156 -3.515 -11.450 279 HA ASN 34 HA ASN 34 0.244 -4.274 -13.378 280 1HB ASN 34 HB2 ASN 34 2.581 -5.776 -12.187 281 2HB ASN 34 HB1 ASN 34 1.660 -6.320 -13.584 282 1HD2 ASN 34 HD21 ASN 34 4.538 -4.999 -13.020 283 2HD2 ASN 34 HD22 ASN 34 4.668 -3.912 -14.318 284 H ILE 35 HN ILE 35 1.038 -5.628 -10.189 285 HA ILE 35 HA ILE 35 -0.816 -7.782 -10.331 286 HB ILE 35 HB ILE 35 0.393 -6.405 -7.930 287 1HG1 ILE 35 HG12 ILE 35 1.201 -8.972 -9.327 288 2HG1 ILE 35 HG11 ILE 35 1.990 -7.419 -9.602 289 1HG2 ILE 35 HG21 ILE 35 -0.861 -9.154 -8.167 290 2HG2 ILE 35 HG22 ILE 35 -1.672 -7.753 -7.466 291 3HG2 ILE 35 HG23 ILE 35 -0.223 -8.408 -6.701 292 1HD1 ILE 35 HD11 ILE 35 2.395 -7.301 -7.101 293 2HD1 ILE 35 HD12 ILE 35 3.288 -8.570 -7.939 294 3HD1 ILE 35 HD13 ILE 35 1.845 -8.974 -7.010 295 H LEU 36 HN LEU 36 -0.958 -4.622 -8.673 296 HA LEU 36 HA LEU 36 -3.540 -4.889 -7.619 297 1HB LEU 36 HB2 LEU 36 -2.062 -2.410 -8.534 298 2HB LEU 36 HB1 LEU 36 -3.555 -2.390 -7.595 299 HG LEU 36 HG LEU 36 -0.942 -3.674 -6.745 300 1HD1 LEU 36 HD11 LEU 36 -2.042 -1.629 -5.009 301 2HD1 LEU 36 HD12 LEU 36 -1.791 -0.994 -6.635 302 3HD1 LEU 36 HD13 LEU 36 -0.445 -1.713 -5.752 303 1HD2 LEU 36 HD21 LEU 36 -3.736 -3.737 -5.686 304 2HD2 LEU 36 HD22 LEU 36 -2.423 -3.624 -4.513 305 3HD2 LEU 36 HD23 LEU 36 -2.489 -4.984 -5.634 306 H ALA 37 HN ALA 37 -2.448 -3.543 -10.718 307 HA ALA 37 HA ALA 37 -5.051 -2.890 -11.665 308 1HB ALA 37 HB1 ALA 37 -3.307 -1.767 -12.768 309 2HB ALA 37 HB2 ALA 37 -3.810 -2.984 -13.940 310 3HB ALA 37 HB3 ALA 37 -2.361 -3.242 -12.969 311 H ALA 38 HN ALA 38 -3.532 -5.822 -11.091 312 HA ALA 38 HA ALA 38 -4.757 -7.258 -13.298 313 1HB ALA 38 HB1 ALA 38 -3.879 -9.222 -11.686 314 2HB ALA 38 HB2 ALA 38 -2.868 -7.900 -11.101 315 3HB ALA 38 HB3 ALA 38 -2.820 -8.361 -12.803 316 H VAL 39 HN VAL 39 -5.531 -6.383 -10.051 317 HA VAL 39 HA VAL 39 -7.613 -8.436 -9.842 318 HB VAL 39 HB VAL 39 -6.147 -7.904 -7.886 319 1HG1 VAL 39 HG11 VAL 39 -6.154 -5.814 -6.866 320 2HG1 VAL 39 HG12 VAL 39 -7.738 -5.389 -7.515 321 3HG1 VAL 39 HG13 VAL 39 -6.316 -5.348 -8.559 322 1HG2 VAL 39 HG21 VAL 39 -8.983 -8.207 -8.014 323 2HG2 VAL 39 HG22 VAL 39 -8.624 -7.088 -6.699 324 3HG2 VAL 39 HG23 VAL 39 -7.898 -8.695 -6.712 325 H GLU 40 HN GLU 40 -7.240 -5.207 -10.857 326 HA GLU 40 HA GLU 40 -8.752 -3.445 -11.101 327 1HB GLU 40 HB2 GLU 40 -9.996 -5.885 -12.355 328 2HB GLU 40 HB1 GLU 40 -10.763 -4.300 -12.470 329 1HG GLU 40 HG2 GLU 40 -8.493 -3.440 -13.304 330 2HG GLU 40 HG1 GLU 40 -8.049 -5.135 -13.501 331 H ALA 41 HN ALA 41 -11.569 -5.337 -11.118 332 HA ALA 41 HA ALA 41 -13.240 -5.724 -9.548 333 1HB ALA 41 HB1 ALA 41 -12.803 -4.854 -7.162 334 2HB ALA 41 HB2 ALA 41 -11.159 -4.542 -7.720 335 3HB ALA 41 HB3 ALA 41 -11.801 -6.185 -7.741 336 H THR 42 HN THR 42 -14.793 -4.353 -8.215 337 HA THR 42 HA THR 42 -15.332 -1.934 -9.680 338 HB THR 42 HB THR 42 -17.333 -1.795 -8.261 339 HG1 THR 42 HG1 THR 42 -15.932 -2.882 -6.485 340 1HG2 THR 42 HG21 THR 42 -18.233 -3.313 -9.649 341 2HG2 THR 42 HG22 THR 42 -17.566 -4.621 -8.672 342 3HG2 THR 42 HG23 THR 42 -16.619 -3.936 -9.993 343 H VAL 43 HN VAL 43 -13.241 -2.577 -7.229 344 HA VAL 43 HA VAL 43 -13.420 0.176 -6.192 345 HB VAL 43 HB VAL 43 -12.341 -0.928 -4.103 346 1HG1 VAL 43 HG11 VAL 43 -14.594 0.091 -4.163 347 2HG1 VAL 43 HG12 VAL 43 -14.585 -1.370 -3.175 348 3HG1 VAL 43 HG13 VAL 43 -15.250 -1.414 -4.808 349 1HG2 VAL 43 HG21 VAL 43 -13.749 -3.296 -5.364 350 2HG2 VAL 43 HG22 VAL 43 -13.025 -3.260 -3.756 351 3HG2 VAL 43 HG23 VAL 43 -12.001 -3.132 -5.187 352 HA PRO 44 HA PRO 44 -9.321 -0.471 -8.184 353 1HB PRO 44 HB2 PRO 44 -9.289 2.357 -8.703 354 2HB PRO 44 HB1 PRO 44 -9.420 1.030 -9.864 355 1HG PRO 44 HG2 PRO 44 -11.425 2.854 -9.112 356 2HG PRO 44 HG1 PRO 44 -11.592 1.434 -10.149 357 1HD PRO 44 HD2 PRO 44 -12.528 1.810 -7.417 358 2HD PRO 44 HD1 PRO 44 -12.883 0.487 -8.545 359 H ILE 45 HN ILE 45 -7.277 0.053 -7.397 360 HA ILE 45 HA ILE 45 -7.264 1.377 -4.774 361 HB ILE 45 HB ILE 45 -5.106 -0.278 -6.104 362 1HG1 ILE 45 HG12 ILE 45 -6.052 -1.771 -4.031 363 2HG1 ILE 45 HG11 ILE 45 -7.535 -0.973 -4.554 364 1HG2 ILE 45 HG21 ILE 45 -4.466 -0.463 -3.579 365 2HG2 ILE 45 HG22 ILE 45 -5.454 0.986 -3.392 366 3HG2 ILE 45 HG23 ILE 45 -4.043 1.011 -4.451 367 1HD1 ILE 45 HD11 ILE 45 -7.334 -1.831 -6.772 368 2HD1 ILE 45 HD12 ILE 45 -6.996 -3.194 -5.704 369 3HD1 ILE 45 HD13 ILE 45 -5.669 -2.345 -6.497 370 H SER 46 HN SER 46 -5.832 3.033 -4.267 371 HA SER 46 HA SER 46 -4.791 4.510 -6.597 372 1HB SER 46 HB2 SER 46 -6.386 5.744 -5.194 373 2HB SER 46 HB1 SER 46 -5.378 5.456 -3.779 374 HG SER 46 HG SER 46 -5.197 7.426 -5.499 375 H LEU 47 HN LEU 47 -2.702 4.122 -6.972 376 HA LEU 47 HA LEU 47 -0.931 3.431 -4.742 377 1HB LEU 47 HB2 LEU 47 -1.108 2.266 -7.121 378 2HB LEU 47 HB1 LEU 47 0.020 3.546 -7.568 379 HG LEU 47 HG LEU 47 0.382 1.300 -5.612 380 1HD1 LEU 47 HD11 LEU 47 2.789 1.908 -6.795 381 2HD1 LEU 47 HD12 LEU 47 1.641 2.365 -8.054 382 3HD1 LEU 47 HD13 LEU 47 1.640 0.721 -7.414 383 1HD2 LEU 47 HD21 LEU 47 1.694 4.029 -5.502 384 2HD2 LEU 47 HD22 LEU 47 2.394 2.597 -4.746 385 3HD2 LEU 47 HD23 LEU 47 0.827 3.202 -4.208 386 H GLN 48 HN GLN 48 0.196 4.965 -3.776 387 HA GLN 48 HA GLN 48 1.122 7.271 -5.371 388 1HB GLN 48 HB2 GLN 48 -0.395 7.181 -2.829 389 2HB GLN 48 HB1 GLN 48 0.947 8.322 -2.885 390 1HG GLN 48 HG2 GLN 48 -0.011 9.070 -5.154 391 2HG GLN 48 HG1 GLN 48 -1.466 8.187 -4.693 392 1HE2 GLN 48 HE21 GLN 48 -1.108 11.154 -5.008 393 2HE2 GLN 48 HE22 GLN 48 -1.540 11.820 -3.508 394 H VAL 49 HN VAL 49 3.268 7.553 -5.309 395 HA VAL 49 HA VAL 49 4.832 5.902 -3.470 396 HB VAL 49 HB VAL 49 5.837 7.659 -5.712 397 1HG1 VAL 49 HG11 VAL 49 7.441 5.383 -5.301 398 2HG1 VAL 49 HG12 VAL 49 7.063 5.988 -3.688 399 3HG1 VAL 49 HG13 VAL 49 7.834 7.048 -4.868 400 1HG2 VAL 49 HG21 VAL 49 5.448 5.966 -7.223 401 2HG2 VAL 49 HG22 VAL 49 4.116 5.621 -6.120 402 3HG2 VAL 49 HG23 VAL 49 5.617 4.701 -6.005 403 H ILE 50 HN ILE 50 6.210 6.660 -1.963 404 HA ILE 50 HA ILE 50 6.228 9.579 -1.501 405 HB ILE 50 HB ILE 50 6.451 7.416 0.605 406 1HG1 ILE 50 HG12 ILE 50 4.089 9.001 -0.421 407 2HG1 ILE 50 HG11 ILE 50 4.227 7.253 -0.240 408 1HG2 ILE 50 HG21 ILE 50 7.395 9.313 1.555 409 2HG2 ILE 50 HG22 ILE 50 5.695 9.580 1.944 410 3HG2 ILE 50 HG23 ILE 50 6.428 10.412 0.572 411 1HD1 ILE 50 HD11 ILE 50 3.549 9.302 1.771 412 2HD1 ILE 50 HD12 ILE 50 4.721 8.104 2.319 413 3HD1 ILE 50 HD13 ILE 50 3.141 7.586 1.731 414 H ASN 51 HN ASN 51 8.190 10.449 -1.729 415 HA ASN 51 HA ASN 51 10.504 8.757 -2.031 416 1HB ASN 51 HB2 ASN 51 9.951 11.694 -2.278 417 2HB ASN 51 HB1 ASN 51 11.617 11.128 -2.172 418 1HD2 ASN 51 HD21 ASN 51 12.536 10.641 -4.163 419 2HD2 ASN 51 HD22 ASN 51 11.670 10.175 -5.547 420 H VAL 52 HN VAL 52 11.249 7.870 -0.180 421 HA VAL 52 HA VAL 52 11.072 8.912 2.399 422 HB VAL 52 HB VAL 52 12.838 7.323 2.991 423 1HG1 VAL 52 HG11 VAL 52 10.429 6.724 1.558 424 2HG1 VAL 52 HG12 VAL 52 11.222 5.768 2.811 425 3HG1 VAL 52 HG13 VAL 52 11.651 5.531 1.116 426 1HG2 VAL 52 HG21 VAL 52 14.314 7.809 1.044 427 2HG2 VAL 52 HG22 VAL 52 13.165 6.982 -0.009 428 3HG2 VAL 52 HG23 VAL 52 14.025 6.080 1.240 429 H ALA 53 HN ALA 53 13.344 9.622 -0.157 430 HA ALA 53 HA ALA 53 15.278 10.918 1.524 431 1HB ALA 53 HB1 ALA 53 15.318 11.830 -1.220 432 2HB ALA 53 HB2 ALA 53 15.163 10.075 -1.151 433 3HB ALA 53 HB3 ALA 53 16.514 10.873 -0.347 434 H ASP 54 HN ASP 54 12.214 11.754 0.351 435 HA ASP 54 HA ASP 54 12.780 14.628 0.456 436 1HB ASP 54 HB2 ASP 54 10.399 13.051 -0.515 437 2HB ASP 54 HB1 ASP 54 10.392 14.808 -0.369 438 H GLN 55 HN GLN 55 11.070 12.082 2.148 439 HA GLN 55 HA GLN 55 10.636 13.907 4.387 440 1HB GLN 55 HB2 GLN 55 8.281 13.440 4.588 441 2HB GLN 55 HB1 GLN 55 8.584 14.041 2.957 442 1HG GLN 55 HG2 GLN 55 8.960 11.227 2.888 443 2HG GLN 55 HG1 GLN 55 7.450 11.525 3.747 444 1HE2 GLN 55 HE21 GLN 55 8.963 11.540 0.624 445 2HE2 GLN 55 HE22 GLN 55 7.637 12.145 -0.245 446 HA PRO 56 HA PRO 56 11.836 9.616 5.628 447 1HB PRO 56 HB2 PRO 56 13.874 10.809 7.269 448 2HB PRO 56 HB1 PRO 56 14.085 9.780 5.843 449 1HG PRO 56 HG2 PRO 56 14.720 12.463 6.002 450 2HG PRO 56 HG1 PRO 56 14.480 11.549 4.506 451 1HD PRO 56 HD2 PRO 56 12.645 13.471 5.851 452 2HD PRO 56 HD1 PRO 56 12.798 13.069 4.125 453 H GLN 57 HN GLN 57 10.626 12.375 7.030 454 HA GLN 57 HA GLN 57 10.763 11.702 9.801 455 1HB GLN 57 HB2 GLN 57 10.447 14.006 9.143 456 2HB GLN 57 HB1 GLN 57 8.964 13.598 8.281 457 1HG GLN 57 HG2 GLN 57 7.920 12.889 10.394 458 2HG GLN 57 HG1 GLN 57 9.404 13.276 11.263 459 1HE2 GLN 57 HE21 GLN 57 6.935 14.583 11.897 460 2HE2 GLN 57 HE22 GLN 57 7.069 16.217 11.456 461 H LEU 58 HN LEU 58 8.213 11.329 7.309 462 HA LEU 58 HA LEU 58 6.390 10.112 9.161 463 1HB LEU 58 HB2 LEU 58 5.069 9.598 7.144 464 2HB LEU 58 HB1 LEU 58 5.561 11.288 7.181 465 HG LEU 58 HG LEU 58 7.424 10.797 5.667 466 1HD1 LEU 58 HD11 LEU 58 8.045 8.673 5.035 467 2HD1 LEU 58 HD12 LEU 58 6.401 8.043 5.156 468 3HD1 LEU 58 HD13 LEU 58 7.360 8.290 6.613 469 1HD2 LEU 58 HD21 LEU 58 6.111 10.311 3.661 470 2HD2 LEU 58 HD22 LEU 58 5.168 11.339 4.739 471 3HD2 LEU 58 HD23 LEU 58 4.824 9.612 4.643 472 H VAL 59 HN VAL 59 9.018 9.057 7.178 473 HA VAL 59 HA VAL 59 8.340 6.306 6.933 474 HB VAL 59 HB VAL 59 11.055 7.653 6.993 475 1HG1 VAL 59 HG11 VAL 59 10.580 4.988 7.319 476 2HG1 VAL 59 HG12 VAL 59 12.012 5.635 6.518 477 3HG1 VAL 59 HG13 VAL 59 10.633 5.097 5.559 478 1HG2 VAL 59 HG21 VAL 59 8.918 7.536 5.038 479 2HG2 VAL 59 HG22 VAL 59 10.363 6.738 4.417 480 3HG2 VAL 59 HG23 VAL 59 10.446 8.414 4.958 481 H GLU 60 HN GLU 60 10.195 8.170 9.312 482 HA GLU 60 HA GLU 60 10.859 5.926 10.952 483 1HB GLU 60 HB2 GLU 60 10.775 8.902 11.501 484 2HB GLU 60 HB1 GLU 60 11.330 7.712 12.679 485 1HG GLU 60 HG2 GLU 60 13.013 6.911 11.018 486 2HG GLU 60 HG1 GLU 60 12.506 8.200 9.928 487 H TYR 61 HN TYR 61 8.185 8.193 10.761 488 HA TYR 61 HA TYR 61 6.916 7.701 13.202 489 1HB TYR 61 HB2 TYR 61 6.199 9.451 11.605 490 2HB TYR 61 HB1 TYR 61 5.625 8.198 10.506 491 HD1 TYR 61 HD1 TYR 61 5.171 9.620 13.921 492 HD2 TYR 61 HD2 TYR 61 3.506 7.169 10.811 493 HE1 TYR 61 HE1 TYR 61 3.015 9.534 15.142 494 HE2 TYR 61 HE2 TYR 61 1.350 7.082 12.034 495 HH TYR 61 HH TYR 61 0.454 9.131 14.321 496 H TYR 62 HN TYR 62 6.672 6.012 10.098 497 HA TYR 62 HA TYR 62 4.963 3.940 11.213 498 1HB TYR 62 HB2 TYR 62 6.276 4.235 8.497 499 2HB TYR 62 HB1 TYR 62 5.119 2.986 8.935 500 HD1 TYR 62 HD1 TYR 62 5.487 6.175 7.495 501 HD2 TYR 62 HD2 TYR 62 2.854 3.896 10.010 502 HE1 TYR 62 HE1 TYR 62 3.627 7.712 6.935 503 HE2 TYR 62 HE2 TYR 62 0.991 5.434 9.451 504 HH TYR 62 HH TYR 62 1.228 7.766 6.919 505 H ARG 63 HN ARG 63 7.888 4.553 11.996 506 HA ARG 63 HA ARG 63 9.786 3.376 12.541 507 1HB ARG 63 HB2 ARG 63 7.927 0.999 12.335 508 2HB ARG 63 HB1 ARG 63 9.437 1.080 13.248 509 1HG ARG 63 HG2 ARG 63 8.176 3.224 14.290 510 2HG ARG 63 HG1 ARG 63 6.772 2.241 13.877 511 1HD ARG 63 HD2 ARG 63 8.433 0.384 15.025 512 2HD ARG 63 HD1 ARG 63 8.803 1.829 15.964 513 HE ARG 63 HE ARG 63 6.028 1.686 15.785 514 1HH1 ARG 63 HH11 ARG 63 7.086 -1.284 16.069 515 2HH1 ARG 63 HH12 ARG 63 6.856 -1.504 17.771 516 1HH2 ARG 63 HH21 ARG 63 6.400 1.872 18.414 517 2HH2 ARG 63 HH22 ARG 63 6.462 0.281 19.098 518 H LEU 64 HN LEU 64 8.351 3.347 9.692 519 HA LEU 64 HA LEU 64 9.448 1.256 8.182 520 1HB LEU 64 HB2 LEU 64 7.656 3.033 7.583 521 2HB LEU 64 HB1 LEU 64 9.027 4.035 7.113 522 HG LEU 64 HG LEU 64 8.106 2.744 5.208 523 1HD1 LEU 64 HD11 LEU 64 10.188 2.587 4.338 524 2HD1 LEU 64 HD12 LEU 64 10.691 1.399 5.541 525 3HD1 LEU 64 HD13 LEU 64 10.744 3.120 5.924 526 1HD2 LEU 64 HD21 LEU 64 8.204 0.355 5.161 527 2HD2 LEU 64 HD22 LEU 64 7.460 0.776 6.703 528 3HD2 LEU 64 HD23 LEU 64 9.157 0.297 6.644 529 H VAL 65 HN VAL 65 11.607 0.837 8.445 530 HA VAL 65 HA VAL 65 13.473 3.070 7.917 531 HB VAL 65 HB VAL 65 14.324 0.540 9.277 532 1HG1 VAL 65 HG11 VAL 65 16.161 1.772 9.847 533 2HG1 VAL 65 HG12 VAL 65 15.216 3.235 10.126 534 3HG1 VAL 65 HG13 VAL 65 15.662 2.774 8.483 535 1HG2 VAL 65 HG21 VAL 65 13.585 1.294 11.400 536 2HG2 VAL 65 HG22 VAL 65 12.191 1.539 10.347 537 3HG2 VAL 65 HG23 VAL 65 13.213 2.907 10.791 538 H VAL 66 HN VAL 66 12.222 0.199 6.628 539 HA VAL 66 HA VAL 66 14.669 -0.307 5.074 540 HB VAL 66 HB VAL 66 13.533 -2.430 4.460 541 1HG1 VAL 66 HG11 VAL 66 13.517 -2.195 7.452 542 2HG1 VAL 66 HG12 VAL 66 15.025 -1.977 6.563 543 3HG1 VAL 66 HG13 VAL 66 14.144 -3.501 6.445 544 1HG2 VAL 66 HG21 VAL 66 11.227 -1.250 5.087 545 2HG2 VAL 66 HG22 VAL 66 11.566 -1.979 6.658 546 3HG2 VAL 66 HG23 VAL 66 11.430 -2.998 5.222 547 H THR 67 HN THR 67 14.669 -0.324 2.860 548 HA THR 67 HA THR 67 12.205 0.383 1.436 549 HB THR 67 HB THR 67 13.473 2.128 0.144 550 HG1 THR 67 HG1 THR 67 15.287 1.894 2.309 551 1HG2 THR 67 HG21 THR 67 12.834 2.351 3.067 552 2HG2 THR 67 HG22 THR 67 12.003 3.067 1.685 553 3HG2 THR 67 HG23 THR 67 13.543 3.733 2.231 554 HA PRO 68 HA PRO 68 11.778 0.928 -0.663 555 1HB PRO 68 HB2 PRO 68 10.442 -1.029 -2.294 556 2HB PRO 68 HB1 PRO 68 11.189 0.492 -2.802 557 1HG PRO 68 HG2 PRO 68 12.097 -2.065 -3.397 558 2HG PRO 68 HG1 PRO 68 13.008 -0.560 -3.581 559 1HD PRO 68 HD2 PRO 68 13.249 -2.656 -1.500 560 2HD PRO 68 HD1 PRO 68 14.451 -1.470 -2.055 561 H ALA 69 HN ALA 69 9.408 0.706 -0.261 562 HA ALA 69 HA ALA 69 8.517 -1.689 1.114 563 1HB ALA 69 HB1 ALA 69 9.698 -0.567 2.922 564 2HB ALA 69 HB2 ALA 69 7.960 -0.466 3.205 565 3HB ALA 69 HB3 ALA 69 8.837 0.936 2.590 566 H LEU 70 HN LEU 70 6.254 -1.656 1.557 567 HA LEU 70 HA LEU 70 4.746 0.509 0.230 568 1HB LEU 70 HB2 LEU 70 4.922 -1.727 -1.060 569 2HB LEU 70 HB1 LEU 70 3.860 -2.373 0.192 570 HG LEU 70 HG LEU 70 3.162 0.174 -1.262 571 1HD1 LEU 70 HD11 LEU 70 3.521 -2.254 -2.566 572 2HD1 LEU 70 HD12 LEU 70 2.516 -0.920 -3.133 573 3HD1 LEU 70 HD13 LEU 70 1.795 -2.235 -2.205 574 1HD2 LEU 70 HD21 LEU 70 0.998 -0.226 -0.426 575 2HD2 LEU 70 HD22 LEU 70 2.033 -0.751 0.902 576 3HD2 LEU 70 HD23 LEU 70 1.311 -1.944 -0.178 577 H VAL 71 HN VAL 71 2.856 1.144 1.276 578 HA VAL 71 HA VAL 71 2.108 -0.339 3.704 579 HB VAL 71 HB VAL 71 2.561 2.648 3.672 580 1HG1 VAL 71 HG11 VAL 71 1.988 0.671 5.901 581 2HG1 VAL 71 HG12 VAL 71 0.855 1.864 5.265 582 3HG1 VAL 71 HG13 VAL 71 2.305 2.392 6.119 583 1HG2 VAL 71 HG21 VAL 71 4.296 0.328 4.511 584 2HG2 VAL 71 HG22 VAL 71 4.454 1.898 5.300 585 3HG2 VAL 71 HG23 VAL 71 4.738 1.750 3.565 586 H LYS 72 HN LYS 72 0.015 -0.711 3.700 587 HA LYS 72 HA LYS 72 -1.782 0.913 2.056 588 1HB LYS 72 HB2 LYS 72 -1.918 -1.577 1.994 589 2HB LYS 72 HB1 LYS 72 -2.364 -1.566 3.700 590 1HG LYS 72 HG2 LYS 72 -4.059 0.310 2.434 591 2HG LYS 72 HG1 LYS 72 -4.041 -1.117 1.397 592 1HD LYS 72 HD2 LYS 72 -4.189 -2.150 3.989 593 2HD LYS 72 HD1 LYS 72 -5.275 -0.760 4.009 594 1HE LYS 72 HE2 LYS 72 -6.169 -1.700 1.759 595 2HE LYS 72 HE1 LYS 72 -5.379 -3.201 2.244 596 1HZ LYS 72 HZ1 LYS 72 -7.733 -1.909 3.337 597 2HZ LYS 72 HZ2 LYS 72 -6.660 -2.553 4.486 598 3HZ LYS 72 HZ3 LYS 72 -7.322 -3.554 3.284 599 H ILE 73 HN ILE 73 -3.075 2.452 2.898 600 HA ILE 73 HA ILE 73 -3.081 2.754 5.824 601 HB ILE 73 HB ILE 73 -4.168 5.048 5.004 602 1HG1 ILE 73 HG12 ILE 73 -3.965 3.981 2.590 603 2HG1 ILE 73 HG11 ILE 73 -3.604 5.690 2.836 604 1HG2 ILE 73 HG21 ILE 73 -1.977 6.013 5.180 605 2HG2 ILE 73 HG22 ILE 73 -1.208 4.513 4.660 606 3HG2 ILE 73 HG23 ILE 73 -1.988 4.603 6.240 607 1HD1 ILE 73 HD11 ILE 73 -1.836 3.557 1.975 608 2HD1 ILE 73 HD12 ILE 73 -1.207 4.348 3.420 609 3HD1 ILE 73 HD13 ILE 73 -1.558 5.299 1.976 610 H GLY 74 HN GLY 74 -5.173 2.022 3.154 611 1HA GLY 74 HA2 GLY 74 -7.239 0.910 4.441 612 2HA GLY 74 HA1 GLY 74 -7.591 2.618 4.670 613 HA PRO 75 HA PRO 75 -9.699 2.429 4.511 614 1HB PRO 75 HB2 PRO 75 -11.768 0.649 3.598 615 2HB PRO 75 HB1 PRO 75 -11.852 2.399 3.840 616 1HG PRO 75 HG2 PRO 75 -11.851 1.009 1.397 617 2HG PRO 75 HG1 PRO 75 -11.762 2.756 1.642 618 1HD PRO 75 HD2 PRO 75 -9.657 0.924 0.798 619 2HD PRO 75 HD1 PRO 75 -9.653 2.699 0.810 620 H GLY 76 HN GLY 76 -10.559 0.833 6.147 621 1HA GLY 76 HA2 GLY 76 -10.590 -1.324 7.125 622 2HA GLY 76 HA1 GLY 76 -9.512 -1.892 5.853 623 H SER 77 HN SER 77 -8.346 -2.836 7.745 624 HA SER 77 HA SER 77 -7.013 -1.113 9.599 625 1HB SER 77 HB2 SER 77 -7.252 -3.289 10.392 626 2HB SER 77 HB1 SER 77 -6.772 -4.012 8.859 627 HG SER 77 HG SER 77 -4.854 -4.079 9.705 628 H ARG 78 HN ARG 78 -4.661 -0.938 9.775 629 HA ARG 78 HA ARG 78 -3.498 -0.270 7.173 630 1HB ARG 78 HB2 ARG 78 -3.455 1.243 9.271 631 2HB ARG 78 HB1 ARG 78 -2.180 0.167 9.843 632 1HG ARG 78 HG2 ARG 78 -1.117 0.560 7.496 633 2HG ARG 78 HG1 ARG 78 -2.183 1.964 7.427 634 1HD ARG 78 HD2 ARG 78 0.301 2.000 8.546 635 2HD ARG 78 HD1 ARG 78 -0.996 3.104 8.995 636 HE ARG 78 HE ARG 78 -1.366 0.873 10.578 637 1HH1 ARG 78 HH11 ARG 78 1.566 2.457 9.804 638 2HH1 ARG 78 HH12 ARG 78 2.078 2.651 11.447 639 1HH2 ARG 78 HH21 ARG 78 -0.868 1.421 12.793 640 2HH2 ARG 78 HH22 ARG 78 0.703 2.064 13.136 641 H GLN 79 HN GLN 79 -1.462 -1.034 6.493 642 HA GLN 79 HA GLN 79 -0.238 -3.235 7.978 643 1HB GLN 79 HB2 GLN 79 -1.157 -3.580 5.113 644 2HB GLN 79 HB1 GLN 79 -0.328 -4.779 6.107 645 1HG GLN 79 HG2 GLN 79 -2.275 -4.566 7.747 646 2HG GLN 79 HG1 GLN 79 -3.116 -3.669 6.484 647 1HE2 GLN 79 HE21 GLN 79 -1.378 -6.801 6.940 648 2HE2 GLN 79 HE22 GLN 79 -2.385 -7.673 5.888 649 H VAL 80 HN VAL 80 1.916 -3.685 7.302 650 HA VAL 80 HA VAL 80 3.055 -1.664 5.468 651 HB VAL 80 HB VAL 80 4.286 -2.702 8.032 652 1HG1 VAL 80 HG11 VAL 80 5.289 -1.113 5.721 653 2HG1 VAL 80 HG12 VAL 80 6.162 -2.198 6.803 654 3HG1 VAL 80 HG13 VAL 80 5.764 -0.562 7.328 655 1HG2 VAL 80 HG21 VAL 80 2.502 -1.142 8.530 656 2HG2 VAL 80 HG22 VAL 80 3.048 -0.042 7.264 657 3HG2 VAL 80 HG23 VAL 80 4.031 -0.281 8.709 658 H LEU 81 HN LEU 81 3.832 -2.628 3.732 659 HA LEU 81 HA LEU 81 5.009 -5.328 3.984 660 1HB LEU 81 HB2 LEU 81 4.048 -3.976 1.458 661 2HB LEU 81 HB1 LEU 81 4.482 -5.672 1.670 662 HG LEU 81 HG LEU 81 2.210 -4.304 3.135 663 1HD1 LEU 81 HD11 LEU 81 1.124 -6.196 1.445 664 2HD1 LEU 81 HD12 LEU 81 2.409 -5.498 0.458 665 3HD1 LEU 81 HD13 LEU 81 1.154 -4.460 1.134 666 1HD2 LEU 81 HD21 LEU 81 2.120 -7.195 2.846 667 2HD2 LEU 81 HD22 LEU 81 2.048 -6.223 4.316 668 3HD2 LEU 81 HD23 LEU 81 3.610 -6.687 3.641 669 H SER 82 HN SER 82 7.168 -5.499 3.699 670 HA SER 82 HA SER 82 8.552 -3.691 1.899 671 1HB SER 82 HB2 SER 82 8.622 -2.298 3.838 672 2HB SER 82 HB1 SER 82 9.052 -3.653 4.875 673 HG SER 82 HG SER 82 10.738 -3.331 2.749 674 H GLY 83 HN GLY 83 10.943 -4.165 1.923 675 1HA GLY 83 HA2 GLY 83 12.740 -5.673 2.087 676 2HA GLY 83 HA1 GLY 83 11.649 -6.868 2.775 677 H ILE 84 HN ILE 84 12.017 -5.061 -0.267 678 HA ILE 84 HA ILE 84 11.394 -5.717 -2.425 679 HB ILE 84 HB ILE 84 13.058 -7.169 -3.308 680 1HG1 ILE 84 HG12 ILE 84 13.516 -8.177 -0.482 681 2HG1 ILE 84 HG11 ILE 84 12.581 -9.042 -1.702 682 1HG2 ILE 84 HG21 ILE 84 14.074 -5.751 -0.829 683 2HG2 ILE 84 HG22 ILE 84 13.990 -5.095 -2.464 684 3HG2 ILE 84 HG23 ILE 84 15.121 -6.396 -2.093 685 1HD1 ILE 84 HD11 ILE 84 14.535 -9.162 -3.165 686 2HD1 ILE 84 HD12 ILE 84 14.939 -9.834 -1.586 687 3HD1 ILE 84 HD13 ILE 84 15.480 -8.212 -2.018 688 H ASP 85 HN ASP 85 10.140 -7.383 0.041 689 HA ASP 85 HA ASP 85 9.186 -9.661 -1.564 690 1HB ASP 85 HB2 ASP 85 8.404 -10.605 0.520 691 2HB ASP 85 HB1 ASP 85 10.070 -10.071 0.741 692 H LEU 86 HN LEU 86 8.361 -6.571 -1.207 693 HA LEU 86 HA LEU 86 5.782 -6.281 -0.390 694 1HB LEU 86 HB2 LEU 86 6.898 -5.107 -2.942 695 2HB LEU 86 HB1 LEU 86 5.599 -4.450 -1.950 696 HG LEU 86 HG LEU 86 7.778 -4.874 -0.203 697 1HD1 LEU 86 HD11 LEU 86 8.558 -3.867 -2.918 698 2HD1 LEU 86 HD12 LEU 86 9.461 -4.897 -1.806 699 3HD1 LEU 86 HD13 LEU 86 9.330 -3.165 -1.496 700 1HD2 LEU 86 HD21 LEU 86 7.385 -2.140 -1.226 701 2HD2 LEU 86 HD22 LEU 86 7.199 -2.764 0.414 702 3HD2 LEU 86 HD23 LEU 86 5.889 -2.945 -0.752 703 H THR 87 HN THR 87 6.808 -7.474 -3.594 704 HA THR 87 HA THR 87 4.193 -7.774 -4.623 705 HB THR 87 HB THR 87 5.233 -9.163 -6.356 706 HG1 THR 87 HG1 THR 87 7.375 -9.132 -4.515 707 1HG2 THR 87 HG21 THR 87 7.183 -7.529 -6.891 708 2HG2 THR 87 HG22 THR 87 6.658 -6.675 -5.440 709 3HG2 THR 87 HG23 THR 87 5.548 -6.877 -6.795 710 H ASP 88 HN ASP 88 6.261 -9.951 -2.767 711 HA ASP 88 HA ASP 88 4.533 -12.221 -3.092 712 1HB ASP 88 HB2 ASP 88 6.790 -11.577 -1.188 713 2HB ASP 88 HB1 ASP 88 5.893 -13.090 -1.125 714 H GLN 89 HN GLN 89 5.143 -9.850 -0.522 715 HA GLN 89 HA GLN 89 3.128 -10.833 1.237 716 1HB GLN 89 HB2 GLN 89 5.176 -8.965 1.400 717 2HB GLN 89 HB1 GLN 89 3.712 -7.986 1.497 718 1HG GLN 89 HG2 GLN 89 2.863 -9.365 3.321 719 2HG GLN 89 HG1 GLN 89 4.248 -10.447 3.184 720 1HE2 GLN 89 HE21 GLN 89 5.967 -7.919 2.608 721 2HE2 GLN 89 HE22 GLN 89 6.238 -7.273 4.154 722 H LEU 90 HN LEU 90 3.238 -8.212 -1.174 723 HA LEU 90 HA LEU 90 0.703 -7.125 -0.706 724 1HB LEU 90 HB2 LEU 90 2.322 -6.030 -2.162 725 2HB LEU 90 HB1 LEU 90 2.224 -7.364 -3.312 726 HG LEU 90 HG LEU 90 -0.185 -6.893 -3.640 727 1HD1 LEU 90 HD11 LEU 90 0.055 -5.533 -1.226 728 2HD1 LEU 90 HD12 LEU 90 -1.346 -5.493 -2.296 729 3HD1 LEU 90 HD13 LEU 90 -0.111 -4.239 -2.412 730 1HD2 LEU 90 HD21 LEU 90 1.006 -5.804 -5.300 731 2HD2 LEU 90 HD22 LEU 90 1.927 -4.836 -4.149 732 3HD2 LEU 90 HD23 LEU 90 0.255 -4.413 -4.518 733 H ALA 91 HN ALA 91 1.630 -9.573 -3.136 734 HA ALA 91 HA ALA 91 -0.906 -10.123 -4.133 735 1HB ALA 91 HB1 ALA 91 0.108 -12.486 -4.508 736 2HB ALA 91 HB2 ALA 91 1.585 -11.783 -3.849 737 3HB ALA 91 HB3 ALA 91 0.863 -11.109 -5.310 738 H ASN 92 HN ASN 92 0.683 -11.307 -1.220 739 HA ASN 92 HA ASN 92 -1.429 -13.186 -0.603 740 1HB ASN 92 HB2 ASN 92 1.078 -12.260 0.765 741 2HB ASN 92 HB1 ASN 92 -0.122 -13.205 1.640 742 1HD2 ASN 92 HD21 ASN 92 2.407 -14.345 1.211 743 2HD2 ASN 92 HD22 ASN 92 2.281 -15.593 0.067 744 H GLN 93 HN GLN 93 -0.471 -9.936 0.325 745 HA GLN 93 HA GLN 93 -2.396 -9.736 2.456 746 1HB GLN 93 HB2 GLN 93 -0.575 -7.768 1.080 747 2HB GLN 93 HB1 GLN 93 -1.738 -7.270 2.306 748 1HG GLN 93 HG2 GLN 93 0.488 -9.294 2.656 749 2HG GLN 93 HG1 GLN 93 0.411 -7.686 3.374 750 1HE2 GLN 93 HE21 GLN 93 0.023 -10.827 4.233 751 2HE2 GLN 93 HE22 GLN 93 -1.174 -10.665 5.425 752 H LEU 94 HN LEU 94 -2.239 -8.870 -0.948 753 HA LEU 94 HA LEU 94 -4.356 -7.085 -1.148 754 1HB LEU 94 HB2 LEU 94 -3.030 -7.508 -3.088 755 2HB LEU 94 HB1 LEU 94 -3.405 -9.231 -3.051 756 HG LEU 94 HG LEU 94 -5.714 -8.816 -3.611 757 1HD1 LEU 94 HD11 LEU 94 -6.669 -6.619 -3.766 758 2HD1 LEU 94 HD12 LEU 94 -5.090 -5.852 -3.596 759 3HD1 LEU 94 HD13 LEU 94 -5.818 -6.686 -2.223 760 1HD2 LEU 94 HD21 LEU 94 -4.222 -8.841 -5.530 761 2HD2 LEU 94 HD22 LEU 94 -3.815 -7.143 -5.286 762 3HD2 LEU 94 HD23 LEU 94 -5.442 -7.596 -5.794 763 HA PRO 95 HA PRO 95 -7.294 -10.972 -1.916 764 1HB PRO 95 HB2 PRO 95 -6.148 -13.036 -0.269 765 2HB PRO 95 HB1 PRO 95 -6.441 -13.069 -2.014 766 1HG PRO 95 HG2 PRO 95 -3.960 -12.621 -0.560 767 2HG PRO 95 HG1 PRO 95 -4.211 -13.041 -2.259 768 1HD PRO 95 HD2 PRO 95 -3.332 -10.574 -1.403 769 2HD PRO 95 HD1 PRO 95 -4.186 -10.844 -2.939 770 H GLN 96 HN GLN 96 -5.395 -10.701 1.072 771 HA GLN 96 HA GLN 96 -7.536 -11.195 2.867 772 1HB GLN 96 HB2 GLN 96 -4.978 -9.629 3.302 773 2HB GLN 96 HB1 GLN 96 -6.045 -10.231 4.572 774 1HG GLN 96 HG2 GLN 96 -5.683 -12.546 3.747 775 2HG GLN 96 HG1 GLN 96 -4.561 -11.922 2.540 776 1HE2 GLN 96 HE21 GLN 96 -3.698 -13.788 4.522 777 2HE2 GLN 96 HE22 GLN 96 -2.621 -12.998 5.570 778 H TRP 97 HN TRP 97 -6.358 -8.340 1.215 779 HA TRP 97 HA TRP 97 -7.812 -6.423 2.750 780 1HB TRP 97 HB2 TRP 97 -6.845 -6.225 -0.116 781 2HB TRP 97 HB1 TRP 97 -7.299 -4.881 0.932 782 HD1 TRP 97 HD1 TRP 97 -5.739 -6.976 3.288 783 HE1 TRP 97 HE1 TRP 97 -3.224 -6.487 3.580 784 HE3 TRP 97 HE3 TRP 97 -4.871 -4.262 -0.950 785 HZ2 TRP 97 HZ2 TRP 97 -1.122 -5.122 2.197 786 HZ3 TRP 97 HZ3 TRP 97 -2.607 -3.380 -1.438 787 HH2 TRP 97 HH2 TRP 97 -0.733 -3.806 0.129 788 H LEU 98 HN LEU 98 -8.388 -7.880 -0.459 789 HA LEU 98 HA LEU 98 -10.969 -6.790 -0.829 790 1HB LEU 98 HB2 LEU 98 -9.783 -9.360 -1.912 791 2HB LEU 98 HB1 LEU 98 -11.216 -8.547 -2.535 792 HG LEU 98 HG LEU 98 -8.431 -7.357 -2.433 793 1HD1 LEU 98 HD11 LEU 98 -9.957 -7.898 -4.953 794 2HD1 LEU 98 HD12 LEU 98 -9.147 -9.248 -4.158 795 3HD1 LEU 98 HD13 LEU 98 -8.214 -7.849 -4.689 796 1HD2 LEU 98 HD21 LEU 98 -9.515 -5.570 -3.833 797 2HD2 LEU 98 HD22 LEU 98 -10.126 -5.637 -2.180 798 3HD2 LEU 98 HD23 LEU 98 -11.075 -6.322 -3.499 799 H VAL 99 HN VAL 99 -9.748 -9.719 0.678 800 HA VAL 99 HA VAL 99 -12.326 -10.878 1.191 801 HB VAL 99 HB VAL 99 -9.557 -11.445 2.274 802 1HG1 VAL 99 HG11 VAL 99 -11.990 -13.200 2.627 803 2HG1 VAL 99 HG12 VAL 99 -11.526 -12.009 3.845 804 3HG1 VAL 99 HG13 VAL 99 -10.424 -13.323 3.432 805 1HG2 VAL 99 HG21 VAL 99 -11.268 -13.236 0.571 806 2HG2 VAL 99 HG22 VAL 99 -9.511 -13.194 0.721 807 3HG2 VAL 99 HG23 VAL 99 -10.351 -11.928 -0.176 808 H GLN 100 HN GLN 100 -10.948 -8.159 2.325 809 HA GLN 100 HA GLN 100 -10.770 -7.570 4.776 810 1HB GLN 100 HB2 GLN 100 -13.205 -6.718 3.202 811 2HB GLN 100 HB1 GLN 100 -12.794 -6.028 4.771 812 1HG GLN 100 HG2 GLN 100 -10.438 -5.649 3.678 813 2HG GLN 100 HG1 GLN 100 -11.326 -5.800 2.162 814 1HE2 GLN 100 HE21 GLN 100 -10.163 -3.321 2.776 815 2HE2 GLN 100 HE22 GLN 100 -11.383 -2.202 3.149 816 H GLN 101 HN GLN 101 -11.580 -10.266 4.849 817 HA GLN 101 HA GLN 101 -14.190 -10.507 6.030 818 1HB GLN 101 HB2 GLN 101 -11.838 -12.383 5.828 819 2HB GLN 101 HB1 GLN 101 -13.367 -12.825 6.591 820 1HG GLN 101 HG2 GLN 101 -14.382 -11.882 4.333 821 2HG GLN 101 HG1 GLN 101 -12.780 -12.267 3.710 822 1HE2 GLN 101 HE21 GLN 101 -15.513 -13.611 3.296 823 2HE2 GLN 101 HE22 GLN 101 -15.224 -15.243 3.664 824 H GLU 102 HN GLU 102 -14.699 -10.996 8.165 825 HA GLU 102 HA GLU 102 -13.690 -9.501 10.186 826 1HB GLU 102 HB2 GLU 102 -14.750 -12.331 10.421 827 2HB GLU 102 HB1 GLU 102 -14.631 -11.175 11.750 828 1HG GLU 102 HG2 GLU 102 -16.678 -11.409 9.720 829 2HG GLU 102 HG1 GLU 102 -16.664 -10.397 11.163 830 H GLY 103 HN GLY 103 -11.336 -9.913 9.070 831 1HA GLY 103 HA2 GLY 103 -9.477 -11.620 9.262 832 2HA GLY 103 HA1 GLY 103 -9.245 -10.235 10.329 833 H ILE 104 HN ILE 104 -11.946 -11.831 11.332 834 HA ILE 104 HA ILE 104 -10.858 -12.696 13.770 835 HB ILE 104 HB ILE 104 -13.445 -13.194 12.330 836 1HG1 ILE 104 HG12 ILE 104 -14.111 -11.409 13.535 837 2HG1 ILE 104 HG11 ILE 104 -13.503 -12.121 15.028 838 1HG2 ILE 104 HG21 ILE 104 -12.696 -15.242 13.653 839 2HG2 ILE 104 HG22 ILE 104 -14.247 -14.550 14.126 840 3HG2 ILE 104 HG23 ILE 104 -12.812 -14.237 15.103 841 1HD1 ILE 104 HD11 ILE 104 -11.245 -11.331 14.531 842 2HD1 ILE 104 HD12 ILE 104 -12.369 -9.972 14.457 843 3HD1 ILE 104 HD13 ILE 104 -11.777 -10.713 12.969 844 H PHE 105 HN PHE 105 -10.773 -14.857 14.620 845 HA PHE 105 HA PHE 105 -9.607 -16.771 12.729 846 1HB PHE 105 HB2 PHE 105 -9.452 -17.935 15.220 847 2HB PHE 105 HB1 PHE 105 -8.197 -16.921 14.513 848 HD1 PHE 105 HD1 PHE 105 -11.507 -16.441 16.251 849 HD2 PHE 105 HD2 PHE 105 -7.411 -15.210 15.848 850 HE1 PHE 105 HE1 PHE 105 -11.828 -14.769 18.059 851 HE2 PHE 105 HE2 PHE 105 -7.733 -13.543 17.650 852 HZ PHE 105 HZ PHE 105 -9.943 -13.319 18.752
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